ACM4
755
Total Contact Pairs
74
Significant Changes
8.64
Max Increase
-10.56
Max Decrease
Interactive snake plot
GPCRdb-style topology. Click the view buttons to recolor residues by different data layers. Toggle contact links to draw significant residue-residue contacts as arcs. Click loop labels (ICL/ECL) to expand or collapse loop regions.
Color convention: blue = active-favoring, red = inactive-favoring.
Top 100 conformational changes
Residue pairs with the largest RRCS changes between active and inactive states. GPCRdb numbering in parentheses. Highlighted rows exceed the significance threshold.
| Rank | Residue 1 | Residue 2 | Active RRCS | Inactive RRCS | ΔRRCS | Magnitude |
|---|---|---|---|---|---|---|
| 1 | TYR215 (5.58x58) | PHE403 (6.38x38) | 0.000 | 10.560 | -10.560 | HIGH |
| 2 | ARG264 | GLU265 | 8.641 | 0.000 | +8.641 | HIGH |
| 3 | ASN67 (2.39x39) | ARG130 (3.50x50) | 0.000 | 8.535 | -8.535 | HIGH |
| 4 | LYS290 | ASP291 | 11.807 | 3.536 | +8.270 | HIGH |
| 5 | GLN343 | GLU358 | 0.000 | 7.834 | -7.834 | HIGH |
| 6 | VAL345 | ALA356 | 0.000 | 7.666 | -7.666 | HIGH |
| 7 | LYS347 | VAL354 | 0.000 | 7.272 | -7.272 | HIGH |
| 8 | ASN294 | GLU295 | 7.130 | 0.000 | +7.130 | HIGH |
| 9 | GLN172 (4.65x65) | GLN188 | 8.371 | 1.684 | +6.686 | HIGH |
| 10 | TYR416 (6.51x51) | TYR439 (7.39x38) | 10.227 | 4.356 | +5.871 | HIGH |
| 11 | TYR439 (7.39x38) | TYR443 (7.43x42) | 0.116 | 5.733 | -5.617 | HIGH |
| 12 | ASP129 (3.49x49) | ARG130 (3.50x50) | 0.000 | 5.450 | -5.450 | HIGH |
| 13 | HIS24 | GLU28 (1.28x28) | 1.453 | 6.869 | -5.416 | HIGH |
| 14 | GLU232 (5.75x75) | LYS235 | 0.000 | 5.112 | -5.112 | HIGH |
| 15 | TYR89 (2.61x60) | TYR439 (7.39x38) | 4.845 | 9.731 | -4.886 | MED |
| 16 | THR179 | GLN188 | 3.588 | 8.461 | -4.873 | MED |
| 17 | HIS466 (8.56x56) | GLN471 (8.61x61) | 0.000 | 4.802 | -4.802 | MED |
| 18 | VAL226 (5.69x69) | ARG396 (6.31x31) | 0.000 | 4.710 | -4.710 | MED |
| 19 | THR311 | GLU312 | 0.000 | 4.463 | -4.463 | MED |
| 20 | TYR215 (5.58x58) | ILE402 (6.37x37) | 4.421 | 0.000 | +4.421 | MED |
| 21 | ILE359 | PHE377 | 0.000 | 4.331 | -4.331 | MED |
| 22 | TYR113 (3.33x33) | TRP164 (4.57x57) | 5.301 | 9.577 | -4.276 | MED |
| 23 | TYR140 (34.53x53) | ARG144 (34.57x57) | 4.449 | 0.242 | +4.208 | MED |
| 24 | GLU266 | LEU267 | 4.174 | 0.000 | +4.174 | MED |
| 25 | ARG223 (5.66x66) | GLU395 (6.30x30) | 4.133 | 0.000 | +4.133 | MED |
| 26 | PHE409 (6.44x44) | TRP413 (6.48x48) | 4.111 | 8.210 | -4.098 | MED |
| 27 | HIS466 (8.56x56) | ASN474 | 0.000 | 4.022 | -4.022 | MED |
| 28 | PHE197 (5.40x41) | PHE425 (6.60x60) | 3.869 | 0.000 | +3.869 | MED |
| 29 | THR39 (1.39x39) | TRP440 (7.40x39) | 3.798 | 7.648 | -3.850 | MED |
| 30 | THR401 (6.36x36) | CYS456 (7.56x56) | 0.929 | 4.769 | -3.840 | MED |
| 31 | VAL180 | PHE186 (45.51x51) | 2.306 | 6.125 | -3.820 | MED |
| 32 | MET86 (2.58x57) | TYR443 (7.43x42) | 3.415 | 7.065 | -3.649 | MED |
| 33 | MET250 | LYS251 | 4.098 | 0.569 | +3.529 | MED |
| 34 | SER127 (3.47x47) | TYR215 (5.58x58) | 3.506 | 0.000 | +3.506 | MED |
| 35 | ASN445 (7.45x45) | ASN449 (7.49x49) | 3.873 | 0.425 | +3.449 | MED |
| 36 | ASP112 (3.32x32) | TYR439 (7.39x38) | 0.000 | 3.363 | -3.363 | MED |
| 37 | TRP413 (6.48x48) | ASN445 (7.45x45) | 6.882 | 3.523 | +3.359 | MED |
| 38 | PHE197 (5.40x41) | ILE201 (5.44x45) | 0.076 | 3.412 | -3.335 | MED |
| 39 | TYR215 (5.58x58) | LEU406 (6.41x41) | 3.799 | 0.543 | +3.256 | MED |
| 40 | LEU190 | THR196 (5.39x40) | 3.321 | 6.488 | -3.167 | MED |
| 41 | ALA454 (7.54x54) | PHE460 (8.50x50) | 3.199 | 0.063 | +3.136 | MED |
| 42 | GLN471 (8.61x61) | ASN474 | 0.000 | 3.072 | -3.072 | MED |
| 43 | SER85 (2.57x56) | TYR443 (7.43x42) | 4.608 | 7.627 | -3.019 | MED |
| 44 | LYS462 (8.52x52) | HIS466 (8.56x56) | 0.000 | 3.011 | -3.011 | MED |
| 45 | ARG338 | ALA362 | 0.000 | 3.004 | -3.004 | MED |
| 46 | THR316 | GLU317 | 2.979 | 0.000 | +2.979 | MED |
| 47 | HIS466 (8.56x56) | ILE475 | 0.000 | 2.958 | -2.958 | MED |
| 48 | GLY49 | PRO450 | 1.055 | 4.001 | -2.945 | MED |
| 49 | PHE197 (5.40x41) | LEU421 | 4.538 | 1.596 | +2.942 | MED |
| 50 | ALA454 (7.54x54) | LYS461 | 0.129 | 3.050 | -2.920 | MED |
| 51 | LEU249 | MET250 | 0.000 | 2.908 | -2.908 | MED |
| 52 | TRP171 | PHE189 | 10.260 | 7.356 | +2.904 | MED |
| 53 | ASP129 (3.49x49) | TYR140 (34.53x53) | 4.524 | 7.395 | -2.870 | MED |
| 54 | THR346 | VAL354 | 0.000 | 2.869 | -2.869 | MED |
| 55 | TRP171 | GLN188 | 5.274 | 2.444 | +2.830 | MED |
| 56 | GLN62 | ALA478 | 0.000 | 2.830 | -2.830 | MED |
| 57 | PHE204 | ASN417 | 9.919 | 12.749 | -2.830 | MED |
| 58 | THR412 | LEU441 | 7.329 | 10.142 | -2.813 | MED |
| 59 | SER293 | ASN294 | 2.807 | 0.000 | +2.807 | MED |
| 60 | TYR113 (3.33x33) | TYR439 (7.39x38) | 3.515 | 0.719 | +2.796 | MED |
| 61 | LYS177 | GLN188 | 0.000 | 2.755 | -2.755 | MED |
| 62 | PHE189 | LEU190 | 0.000 | 2.751 | -2.751 | MED |
| 63 | LEU123 | TYR453 | 2.663 | 0.000 | +2.663 | MED |
| 64 | ASN117 | ALA203 | 2.665 | 0.110 | +2.555 | MED |
| 65 | SER314 | THR315 | 2.477 | 0.000 | +2.477 | MED |
| 66 | PHE197 (5.40x41) | THR424 | 2.781 | 0.329 | +2.452 | MED |
| 67 | ARG178 | VAL180 | 0.000 | 2.407 | -2.407 | MED |
| 68 | ARG338 | THR363 | 0.000 | 2.348 | -2.348 | MED |
| 69 | ARG130 (3.50x50) | ILE402 (6.37x37) | 0.000 | 2.312 | -2.312 | MED |
| 70 | ARG130 (3.50x50) | ARG144 (34.57x57) | 0.000 | 2.242 | -2.242 | MED |
| 71 | ARG178 | ASP182 | 2.231 | 0.000 | +2.231 | MED |
| 72 | TRP171 | ASN192 | 2.222 | 0.000 | +2.222 | MED |
| 73 | TYR113 (3.33x33) | TYR416 (6.51x51) | 3.476 | 1.261 | +2.214 | MED |
| 74 | TYR92 | PHE186 (45.51x51) | 2.185 | 0.000 | +2.185 | MED |
| 75 | HIS466 (8.56x56) | CYS470 | 2.123 | 0.000 | +2.123 | LOW |
| 76 | ASN304 | THR305 | 0.775 | 2.898 | -2.122 | LOW |
| 77 | ALA102 | ARG178 | 6.716 | 4.614 | +2.102 | LOW |
| 78 | PHE70 | ASP129 (3.49x49) | 3.390 | 1.305 | +2.085 | LOW |
| 79 | LYS341 | VAL360 | 0.000 | 2.084 | -2.084 | LOW |
| 80 | ASP78 | ASN449 (7.49x49) | 5.950 | 3.884 | +2.066 | LOW |
| 81 | THR346 | THR355 | 0.000 | 2.055 | -2.055 | LOW |
| 82 | LYS58 | PHE72 | 0.000 | 2.051 | -2.051 | LOW |
| 83 | LEU124 | PHE128 | 2.134 | 0.085 | +2.049 | LOW |
| 84 | VAL254 | LYS255 | 2.068 | 0.020 | +2.047 | LOW |
| 85 | PHE189 | THR196 (5.39x40) | 2.262 | 0.215 | +2.047 | LOW |
| 86 | SER222 | GLU395 (6.30x30) | 2.034 | 0.000 | +2.034 | LOW |
| 87 | SER297 | SER298 | 2.029 | 0.000 | +2.029 | LOW |
| 88 | ALA77 | VAL115 | 3.256 | 1.246 | +2.010 | LOW |
| 89 | VAL226 (5.69x69) | GLU395 (6.30x30) | 2.010 | 0.000 | +2.010 | LOW |
| 90 | SER247 | PRO248 | 0.720 | 2.725 | -2.004 | LOW |
| 91 | MET211 | LEU406 (6.41x41) | 0.561 | 2.523 | -1.962 | LOW |
| 92 | VAL134 | ARG225 | 3.203 | 5.145 | -1.942 | LOW |
| 93 | LEU71 | TYR453 | 2.005 | 3.928 | -1.923 | LOW |
| 94 | PHE409 (6.44x44) | ASN445 (7.45x45) | 2.016 | 3.913 | -1.897 | LOW |
| 95 | ARG308 | PRO309 | 3.600 | 1.717 | +1.883 | LOW |
| 96 | ASN423 | TRP435 | 3.835 | 1.953 | +1.882 | LOW |
| 97 | ASP106 | GLN188 | 1.878 | 0.000 | +1.878 | LOW |
| 98 | MET32 | ILE94 | 1.840 | 3.708 | -1.868 | LOW |
| 99 | PHE204 | THR414 | 4.566 | 2.701 | +1.865 | LOW |
| 100 | ASN60 | ILE475 | 0.000 | 1.857 | -1.857 | LOW |
Transmembrane domain analysis
Active-favoring residues form stronger contacts in the active state (positive ΔRRCS). Inactive-favoring residues form stronger contacts in the inactive state (negative ΔRRCS). Only residues with |ΔRRCS| ≥ 2.16 are shown (per-receptor significance threshold = max(mean(|Δ|) + σ, 0.2)).
| Segment | Range | Active-favoring residues | Count | Inactive-favoring residues | Count |
|---|---|---|---|---|---|
| TM1 | 28-39 | - | 0 | 28 (-5.4), 39 (-3.8) | 2 |
| TM2 | 67-89 | - | 0 | 67 (-8.5), 89 (-4.9), 86 (-3.6), 85 (-3.0) | 4 |
| TM3 | 112-130 | 127 (3.5) | 1 | 130 (-8.5), 129 (-5.4), 113 (-4.3), 112 (-3.4) | 4 |
| TM4 | 164-172 | 172 (6.7) | 1 | 164 (-4.3) | 1 |
| TM5 | 196-232 | 223 (4.1), 197 (3.9) | 2 | 215 (-10.6), 232 (-5.1), 226 (-4.7), 201 (-3.3), 196 (-3.2) | 5 |
| TM6 | 395-425 | 416 (5.9), 402 (4.4), 395 (4.1), 425 (3.9), 406 (3.3) | 5 | 403 (-10.6), 396 (-4.7), 409 (-4.1), 413 (-4.1), 401 (-3.8) | 5 |
| TM7 | 439-456 | 439 (5.9), 445 (3.4), 449 (3.4), 454 (3.1) | 4 | 443 (-5.6), 440 (-3.8), 456 (-3.8) | 3 |
| Intracellular / Extracellular loops & H8 | |||||
| ICL1 | - | - | 0 | - | 0 |
| ICL2 | 140-144 | 140 (4.2), 144 (4.2) | 2 | - | 0 |
| ICL3 | 235-377 | 264 (8.6), 265 (8.6), 290 (8.3), 291 (8.3), 294 (7.1), 295 (7.1), 266 (4.2), 267 (4.2), 250 (3.5), 251 (3.5) | 10 | 343 (-7.8), 358 (-7.8), 345 (-7.7), 356 (-7.7), 347 (-7.3), 354 (-7.3), 235 (-5.1), 311 (-4.5), 312 (-4.5), 359 (-4.3), 377 (-4.3), 338 (-3.0), 362 (-3.0) | 13 |
| ECL1 | - | - | 0 | - | 0 |
| ECL2 | 179-190 | 188 (6.7) | 1 | 179 (-4.9), 180 (-3.8), 186 (-3.8), 190 (-3.2) | 4 |
| ECL3 | - | - | 0 | - | 0 |
| H8 | 460-471 | 460 (3.1) | 1 | 466 (-4.8), 471 (-4.8), 462 (-3.0) | 3 |
Interactive visualizations
ΔRRCS distribution
Active vs inactive comparison
Residue-wise changes
TM domain breakdown
Variants of interest
58 variants mapped to contact positions, sorted by |ΔRRCS| impact.
| Position | Protein change | DNA change | Allele freq | Het / Hom | ΔRRCS | AM score | Pathogenicity | Conservation | dbSNP |
|---|---|---|---|---|---|---|---|---|---|
| 265 | p.Glu265Gly | c.794A>G | 1.38e-06 | 2 / 0 | 8.64 | 0.092 | BENIGN | 0.41 | rs774645111 |
| 264 | p.Arg264Pro | c.791G>C | 6.92e-07 | 1 / 0 | 8.64 | 0.090 | BENIGN | 0.37 | rs201253128 |
| 265 | p.Glu265Lys | c.793G>A | 1.71e-04 | 247 / 0 | 8.64 | - | nan | - | rs199960135 |
| 264 | p.Arg264Gln | c.791G>A | 3.11e-05 | 45 / 0 | 8.64 | - | nan | - | rs201253128 |
| 264 | p.Arg264Trp | c.790C>T | 3.46e-06 | 5 / 0 | 8.64 | - | nan | - | rs760707328 |
| 264 | p.Arg264Gly | c.790C>G | 2.42e-05 | 35 / 0 | 8.64 | - | nan | - | rs760707328 |
| 130 | p.Arg130His | c.389G>A | 1.37e-06 | 2 / 0 | 8.54 | 0.995 | PATHOGENIC | 0.99 | rs1322638523 |
| 130 | p.Arg130Cys | c.388C>T | 6.84e-07 | 1 / 0 | 8.54 | - | nan | - | rs1206223846 |
| 290 | p.Lys290Glu | c.868A>G | 7.16e-07 | 1 / 0 | 8.27 | 0.175 | BENIGN | 0.42 | |
| 291 | p.Asp291Glu | c.873C>A | 7.16e-07 | 1 / 0 | 8.27 | 0.090 | BENIGN | 0.49 | |
| 358 | p.Glu358Lys | c.1072G>A | 6.92e-07 | 1 / 0 | 7.83 | 0.797 | PATHOGENIC | 0.48 | |
| 345 | p.Val345Leu | c.1033G>C | 1.40e-06 | 2 / 0 | 7.67 | 0.542 | AMBIGUOUS | 0.49 | rs1216974790 |
| 356 | p.Ala356Ser | c.1066G>T | 4.16e-06 | 6 / 0 | 7.67 | 0.322 | BENIGN | 0.49 | rs1049106481 |
| 345 | p.Val345Leu | c.1033G>T | 6.99e-07 | 1 / 0 | 7.67 | - | nan | - | |
| 347 | p.Lys347Asn | c.1041G>T | 6.98e-07 | 1 / 0 | 7.27 | 0.979 | PATHOGENIC | 0.53 | rs1227427518 |
| 354 | p.Val354Met | c.1060G>A | 6.93e-07 | 1 / 0 | 7.27 | 0.481 | AMBIGUOUS | 0.37 | |
| 347 | p.Lys347Thr | c.1040A>C | 6.98e-07 | 1 / 0 | 7.27 | - | nan | - | |
| 295 | p.Glu295Lys | c.883G>A | 1.44e-06 | 2 / 0 | 7.13 | 0.606 | PATHOGENIC | 0.44 | |
| 294 | p.Asn294Ser | c.881A>G | 7.18e-07 | 1 / 0 | 7.13 | 0.081 | BENIGN | 0.45 | |
| 294 | p.Asn294Tyr | c.880A>T | 1.44e-06 | 2 / 0 | 7.13 | - | nan | - | |
| 28 | p.Glu28Asp | c.84G>C | 6.84e-07 | 1 / 0 | 5.42 | 0.117 | BENIGN | 0.46 | |
| 24 | p.His24Arg | c.71A>G | 2.74e-06 | 2 / 1 | 5.42 | 0.058 | BENIGN | 0.35 | rs1275501715 |
| 28 | p.Glu28Lys | c.82G>A | 1.37e-06 | 2 / 0 | 5.42 | - | nan | - | |
| 232 | p.Glu232Lys | c.694G>A | 3.64e-05 | 53 / 0 | 5.11 | 0.172 | BENIGN | 0.48 | rs200034949 |
| 232 | p.Glu232Gln | c.694G>C | 6.87e-07 | 1 / 0 | 5.11 | - | nan | - | |
| 179 | p.Thr179Met | c.536C>T | 2.19e-05 | 32 / 0 | 4.87 | 0.208 | BENIGN | 0.69 | rs759941649 |
| 179 | p.Thr179Lys | c.536C>A | 1.31e-05 | 2 / 0 | 4.87 | - | nan | - | rs759941649 |
| 466 | p.His466Asn | c.1396C>A | 1.37e-06 | 2 / 0 | 4.80 | 0.097 | BENIGN | 0.44 | |
| 226 | p.Val226Ala | c.677T>C | 1.37e-06 | 2 / 0 | 4.71 | 0.424 | AMBIGUOUS | 0.52 | rs756095049 |
| 396 | p.Arg396His | c.1187G>A | 3.43e-06 | 5 / 0 | 4.71 | 0.377 | AMBIGUOUS | 0.65 | rs1945323538 |
| 396 | p.Arg396Cys | c.1186C>T | 4.80e-06 | 7 / 0 | 4.71 | - | nan | - | rs769639848 |
| 311 | p.Thr311Ile | c.932C>T | 7.23e-07 | 1 / 0 | 4.46 | 0.129 | BENIGN | 0.43 | |
| 311 | p.Thr311Lys | c.932C>A | 7.23e-07 | 1 / 0 | 4.46 | - | nan | - | |
| 402 | p.Ile402Thr | c.1205T>C | 6.86e-07 | 1 / 0 | 4.42 | 0.993 | PATHOGENIC | 0.71 | |
| 359 | p.Ile359Thr | c.1076T>C | 1.38e-06 | 2 / 0 | 4.33 | 0.984 | PATHOGENIC | 0.42 | rs781777462 |
| 144 | p.Arg144His | c.431G>A | 6.77e-06 | 1 / 0 | 4.21 | 0.971 | PATHOGENIC | 0.95 | rs1336722245 |
| 140 | p.Tyr140Phe | c.419A>T | 4.83e-05 | 6 / 0 | 4.21 | 0.893 | PATHOGENIC | 0.99 | rs1488045482 |
| 266 | p.Glu266Lys | c.796G>A | 2.77e-06 | 4 / 0 | 4.17 | 0.150 | BENIGN | 0.42 | rs769487194 |
| 267 | p.Leu267Pro | c.800T>C | 1.97e-05 | 3 / 0 | 4.17 | 0.141 | BENIGN | 0.33 | rs1945332375 |
| 223 | p.Arg223His | c.668G>A | 6.86e-06 | 10 / 0 | 4.13 | 0.152 | BENIGN | 0.52 | rs1289982482 |
| 223 | p.Arg223Ser | c.667C>A | 4.11e-06 | 6 / 0 | 4.13 | - | nan | - | |
| 223 | p.Arg223Cys | c.667C>T | 1.37e-06 | 2 / 0 | 4.13 | - | nan | - | rs573081535 |
| 197 | p.Phe197Cys | c.590T>G | 2.05e-06 | 3 / 0 | 3.87 | 0.872 | PATHOGENIC | 0.72 | rs1434307119 |
| 401 | p.Thr401Met | c.1202C>T | 1.37e-06 | 2 / 0 | 3.84 | 0.878 | PATHOGENIC | 0.85 | |
| 401 | p.Thr401Ala | c.1201A>G | 6.86e-07 | 1 / 0 | 3.84 | - | nan | - | |
| 186 | p.Phe186Ser | c.557T>C | 6.85e-07 | 1 / 0 | 3.82 | 0.501 | AMBIGUOUS | 0.74 | |
| 186 | p.Phe186Val | c.556T>G | 3.42e-06 | 5 / 0 | 3.82 | - | nan | - | |
| 86 | p.Met86Thr | c.257T>C | 6.84e-07 | 1 / 0 | 3.65 | 0.998 | PATHOGENIC | 0.97 | |
| 250 | p.Met250Thr | c.749T>C | 6.92e-07 | 1 / 0 | 3.53 | 0.271 | BENIGN | 0.30 | |
| 127 | p.Ser127Gly | c.379A>G | 6.84e-07 | 1 / 0 | 3.51 | 0.842 | PATHOGENIC | 0.89 | |
| 449 | p.Asn449Tyr | c.1345A>T | 6.84e-07 | 1 / 0 | 3.45 | 0.996 | PATHOGENIC | 0.95 | |
| 112 | p.Asp112Asn | c.334G>A | 6.84e-07 | 1 / 0 | 3.36 | 0.999 | PATHOGENIC | 0.99 | |
| 196 | p.Thr196Ile | c.587C>T | 6.85e-07 | 1 / 0 | 3.17 | 0.960 | PATHOGENIC | 0.92 | |
| 460 | p.Phe460Leu | c.1378T>C | 6.84e-07 | 1 / 0 | 3.14 | 1.000 | PATHOGENIC | 1.00 | rs1207899036 |
| 85 | p.Ser85Ala | c.253T>G | 6.84e-07 | 1 / 0 | 3.02 | 0.815 | PATHOGENIC | 0.99 | |
| 362 | p.Ala362Val | c.1085C>T | 1.11e-05 | 16 / 0 | 3.00 | 0.134 | BENIGN | 0.45 | rs755530650 |
| 338 | p.Arg338Lys | c.1013G>A | 7.03e-07 | 1 / 0 | 3.00 | 0.070 | BENIGN | 0.47 | rs1243872011 |
| 338 | p.Arg338Gly | c.1012A>G | 7.03e-07 | 1 / 0 | 3.00 | - | nan | - | rs1007911460 |
Complete RRCS results
Top 1000 contact pairs by |ΔRRCS|. Significance threshold: |ΔRRCS| ≥ 2.16, computed as max(mean(|Δ|) + σ, 0.2). Highlighted rows indicate significant changes.
| Res1 | AA1 | Res2 | AA2 | Active RRCS | Inactive RRCS | ΔRRCS | |ΔRRCS| |
|---|---|---|---|---|---|---|---|
| 215 | TYR | 403 | PHE | 0.000 | 10.560 | -10.560 | 10.560 |
| 264 | ARG | 265 | GLU | 8.641 | 0.000 | 8.641 | 8.641 |
| 67 | ASN | 130 | ARG | 0.000 | 8.535 | -8.535 | 8.535 |
| 290 | LYS | 291 | ASP | 11.807 | 3.536 | 8.270 | 8.270 |
| 343 | GLN | 358 | GLU | 0.000 | 7.834 | -7.834 | 7.834 |
| 345 | VAL | 356 | ALA | 0.000 | 7.666 | -7.666 | 7.666 |
| 347 | LYS | 354 | VAL | 0.000 | 7.272 | -7.272 | 7.272 |
| 294 | ASN | 295 | GLU | 7.130 | 0.000 | 7.130 | 7.130 |
| 172 | GLN | 188 | GLN | 8.371 | 1.684 | 6.686 | 6.686 |
| 416 | TYR | 439 | TYR | 10.227 | 4.356 | 5.871 | 5.871 |
| 439 | TYR | 443 | TYR | 0.116 | 5.733 | -5.617 | 5.617 |
| 129 | ASP | 130 | ARG | 0.000 | 5.450 | -5.450 | 5.450 |
| 24 | HIS | 28 | GLU | 1.453 | 6.869 | -5.416 | 5.416 |
| 232 | GLU | 235 | LYS | 0.000 | 5.112 | -5.112 | 5.112 |
| 89 | TYR | 439 | TYR | 4.845 | 9.731 | -4.886 | 4.886 |
| 179 | THR | 188 | GLN | 3.588 | 8.461 | -4.873 | 4.873 |
| 466 | HIS | 471 | GLN | 0.000 | 4.802 | -4.802 | 4.802 |
| 226 | VAL | 396 | ARG | 0.000 | 4.710 | -4.710 | 4.710 |
| 311 | THR | 312 | GLU | 0.000 | 4.463 | -4.463 | 4.463 |
| 215 | TYR | 402 | ILE | 4.421 | 0.000 | 4.421 | 4.421 |
| 359 | ILE | 377 | PHE | 0.000 | 4.331 | -4.331 | 4.331 |
| 113 | TYR | 164 | TRP | 5.301 | 9.577 | -4.276 | 4.276 |
| 140 | TYR | 144 | ARG | 4.449 | 0.242 | 4.208 | 4.208 |
| 266 | GLU | 267 | LEU | 4.174 | 0.000 | 4.174 | 4.174 |
| 223 | ARG | 395 | GLU | 4.133 | 0.000 | 4.133 | 4.133 |
| 409 | PHE | 413 | TRP | 4.111 | 8.210 | -4.098 | 4.098 |
| 466 | HIS | 474 | ASN | 0.000 | 4.022 | -4.022 | 4.022 |
| 197 | PHE | 425 | PHE | 3.869 | 0.000 | 3.869 | 3.869 |
| 39 | THR | 440 | TRP | 3.798 | 7.648 | -3.850 | 3.850 |
| 401 | THR | 456 | CYS | 0.929 | 4.769 | -3.840 | 3.840 |
| 180 | VAL | 186 | PHE | 2.306 | 6.125 | -3.820 | 3.820 |
| 86 | MET | 443 | TYR | 3.415 | 7.065 | -3.649 | 3.649 |
| 250 | MET | 251 | LYS | 4.098 | 0.569 | 3.529 | 3.529 |
| 127 | SER | 215 | TYR | 3.506 | 0.000 | 3.506 | 3.506 |
| 445 | ASN | 449 | ASN | 3.873 | 0.425 | 3.449 | 3.449 |
| 112 | ASP | 439 | TYR | 0.000 | 3.363 | -3.363 | 3.363 |
| 413 | TRP | 445 | ASN | 6.882 | 3.523 | 3.359 | 3.359 |
| 197 | PHE | 201 | ILE | 0.076 | 3.412 | -3.335 | 3.335 |
| 215 | TYR | 406 | LEU | 3.799 | 0.543 | 3.256 | 3.256 |
| 190 | LEU | 196 | THR | 3.321 | 6.488 | -3.167 | 3.167 |
| 454 | ALA | 460 | PHE | 3.199 | 0.063 | 3.136 | 3.136 |
| 471 | GLN | 474 | ASN | 0.000 | 3.072 | -3.072 | 3.072 |
| 85 | SER | 443 | TYR | 4.608 | 7.627 | -3.019 | 3.019 |
| 462 | LYS | 466 | HIS | 0.000 | 3.011 | -3.011 | 3.011 |
| 338 | ARG | 362 | ALA | 0.000 | 3.004 | -3.004 | 3.004 |
| 316 | THR | 317 | GLU | 2.979 | 0.000 | 2.979 | 2.979 |
| 466 | HIS | 475 | ILE | 0.000 | 2.958 | -2.958 | 2.958 |
| 49 | GLY | 450 | PRO | 1.055 | 4.001 | -2.945 | 2.945 |
| 197 | PHE | 421 | LEU | 4.538 | 1.596 | 2.942 | 2.942 |
| 454 | ALA | 461 | LYS | 0.129 | 3.050 | -2.920 | 2.920 |
| 249 | LEU | 250 | MET | 0.000 | 2.908 | -2.908 | 2.908 |
| 171 | TRP | 189 | PHE | 10.260 | 7.356 | 2.904 | 2.904 |
| 129 | ASP | 140 | TYR | 4.524 | 7.395 | -2.870 | 2.870 |
| 346 | THR | 354 | VAL | 0.000 | 2.869 | -2.869 | 2.869 |
| 171 | TRP | 188 | GLN | 5.274 | 2.444 | 2.830 | 2.830 |
| 62 | GLN | 478 | ALA | 0.000 | 2.830 | -2.830 | 2.830 |
| 204 | PHE | 417 | ASN | 9.919 | 12.749 | -2.830 | 2.830 |
| 412 | THR | 441 | LEU | 7.329 | 10.142 | -2.813 | 2.813 |
| 293 | SER | 294 | ASN | 2.807 | 0.000 | 2.807 | 2.807 |
| 113 | TYR | 439 | TYR | 3.515 | 0.719 | 2.796 | 2.796 |
| 177 | LYS | 188 | GLN | 0.000 | 2.755 | -2.755 | 2.755 |
| 189 | PHE | 190 | LEU | 0.000 | 2.751 | -2.751 | 2.751 |
| 123 | LEU | 453 | TYR | 2.663 | 0.000 | 2.663 | 2.663 |
| 117 | ASN | 203 | ALA | 2.665 | 0.110 | 2.555 | 2.555 |
| 314 | SER | 315 | THR | 2.477 | 0.000 | 2.477 | 2.477 |
| 197 | PHE | 424 | THR | 2.781 | 0.329 | 2.452 | 2.452 |
| 178 | ARG | 180 | VAL | 0.000 | 2.407 | -2.407 | 2.407 |
| 338 | ARG | 363 | THR | 0.000 | 2.348 | -2.348 | 2.348 |
| 130 | ARG | 402 | ILE | 0.000 | 2.312 | -2.312 | 2.312 |
| 130 | ARG | 144 | ARG | 0.000 | 2.242 | -2.242 | 2.242 |
| 178 | ARG | 182 | ASP | 2.231 | 0.000 | 2.231 | 2.231 |
| 171 | TRP | 192 | ASN | 2.222 | 0.000 | 2.222 | 2.222 |
| 113 | TYR | 416 | TYR | 3.476 | 1.261 | 2.214 | 2.214 |
| 92 | TYR | 186 | PHE | 2.185 | 0.000 | 2.185 | 2.185 |
| 466 | HIS | 470 | CYS | 2.123 | 0.000 | 2.123 | 2.123 |
| 304 | ASN | 305 | THR | 0.775 | 2.898 | -2.122 | 2.122 |
| 102 | ALA | 178 | ARG | 6.716 | 4.614 | 2.102 | 2.102 |
| 70 | PHE | 129 | ASP | 3.390 | 1.305 | 2.085 | 2.085 |
| 341 | LYS | 360 | VAL | 0.000 | 2.084 | -2.084 | 2.084 |
| 78 | ASP | 449 | ASN | 5.950 | 3.884 | 2.066 | 2.066 |
| 346 | THR | 355 | THR | 0.000 | 2.055 | -2.055 | 2.055 |
| 58 | LYS | 72 | PHE | 0.000 | 2.051 | -2.051 | 2.051 |
| 124 | LEU | 128 | PHE | 2.134 | 0.085 | 2.049 | 2.049 |
| 254 | VAL | 255 | LYS | 2.068 | 0.020 | 2.047 | 2.047 |
| 189 | PHE | 196 | THR | 2.262 | 0.215 | 2.047 | 2.047 |
| 222 | SER | 395 | GLU | 2.034 | 0.000 | 2.034 | 2.034 |
| 297 | SER | 298 | SER | 2.029 | 0.000 | 2.029 | 2.029 |
| 77 | ALA | 115 | VAL | 3.256 | 1.246 | 2.010 | 2.010 |
| 226 | VAL | 395 | GLU | 2.010 | 0.000 | 2.010 | 2.010 |
| 247 | SER | 248 | PRO | 0.720 | 2.725 | -2.004 | 2.004 |
| 211 | MET | 406 | LEU | 0.561 | 2.523 | -1.962 | 1.962 |
| 134 | VAL | 225 | ARG | 3.203 | 5.145 | -1.942 | 1.942 |
| 71 | LEU | 453 | TYR | 2.005 | 3.928 | -1.923 | 1.923 |
| 409 | PHE | 445 | ASN | 2.016 | 3.913 | -1.897 | 1.897 |
| 308 | ARG | 309 | PRO | 3.600 | 1.717 | 1.883 | 1.883 |
| 423 | ASN | 435 | TRP | 3.835 | 1.953 | 1.882 | 1.882 |
| 106 | ASP | 188 | GLN | 1.878 | 0.000 | 1.878 | 1.878 |
| 32 | MET | 94 | ILE | 1.840 | 3.708 | -1.868 | 1.868 |
| 204 | PHE | 414 | THR | 4.566 | 2.701 | 1.865 | 1.865 |
| 60 | ASN | 475 | ILE | 0.000 | 1.857 | -1.857 | 1.857 |
| 168 | ILE | 187 | ILE | 0.000 | 1.853 | -1.853 | 1.853 |
| 193 | PRO | 424 | THR | 1.771 | 3.616 | -1.845 | 1.845 |
| 295 | GLU | 296 | SER | 1.838 | 0.000 | 1.838 | 1.838 |
| 89 | TYR | 93 | ILE | 2.162 | 4.000 | -1.837 | 1.837 |
| 124 | LEU | 207 | PRO | 1.163 | 3.000 | -1.836 | 1.836 |
| 303 | GLN | 304 | ASN | 1.872 | 0.055 | 1.817 | 1.817 |
| 453 | TYR | 460 | PHE | 0.000 | 1.816 | -1.816 | 1.816 |
| 130 | ARG | 133 | CYS | 0.000 | 1.792 | -1.792 | 1.792 |
| 296 | SER | 297 | SER | 1.741 | 0.000 | 1.741 | 1.741 |
| 50 | ASN | 78 | ASP | 6.139 | 4.444 | 1.695 | 1.695 |
| 457 | ASN | 460 | PHE | 2.565 | 4.252 | -1.687 | 1.687 |
| 50 | ASN | 79 | LEU | 3.190 | 1.528 | 1.662 | 1.662 |
| 367 | MET | 369 | PRO | 0.000 | 1.656 | -1.656 | 1.656 |
| 244 | PHE | 245 | LEU | 0.000 | 1.655 | -1.655 | 1.655 |
| 59 | VAL | 475 | ILE | 0.000 | 1.648 | -1.648 | 1.648 |
| 53 | VAL | 453 | TYR | 0.000 | 1.642 | -1.642 | 1.642 |
| 219 | SER | 402 | ILE | 1.637 | 0.000 | 1.637 | 1.637 |
| 3 | ASN | 4 | PHE | 0.000 | 1.629 | -1.629 | 1.629 |
| 172 | GLN | 178 | ARG | 3.399 | 5.027 | -1.627 | 1.627 |
| 212 | THR | 406 | LEU | 1.618 | 0.000 | 1.618 | 1.618 |
| 462 | LYS | 478 | ALA | 0.000 | 1.618 | -1.618 | 1.618 |
| 419 | MET | 434 | VAL | 2.279 | 3.892 | -1.612 | 1.612 |
| 108 | TRP | 112 | ASP | 0.278 | 1.851 | -1.573 | 1.573 |
| 319 | THR | 320 | THR | 1.566 | 0.000 | 1.566 | 1.566 |
| 98 | TRP | 108 | TRP | 4.753 | 6.297 | -1.544 | 1.544 |
| 186 | PHE | 191 | SER | 0.000 | 1.541 | -1.541 | 1.541 |
| 89 | TYR | 440 | TRP | 2.862 | 4.382 | -1.521 | 1.521 |
| 399 | THR | 403 | PHE | 1.519 | 0.000 | 1.519 | 1.519 |
| 412 | THR | 445 | ASN | 6.780 | 5.269 | 1.510 | 1.510 |
| 341 | LYS | 359 | ILE | 0.000 | 1.486 | -1.486 | 1.486 |
| 187 | ILE | 190 | LEU | 1.634 | 3.106 | -1.472 | 1.472 |
| 50 | ASN | 446 | SER | 0.666 | 2.128 | -1.462 | 1.462 |
| 252 | GLN | 253 | SER | 0.237 | 1.698 | -1.461 | 1.461 |
| 467 | LEU | 472 | TYR | 0.000 | 1.448 | -1.448 | 1.448 |
| 69 | TYR | 146 | THR | 0.210 | 1.644 | -1.434 | 1.434 |
| 130 | ARG | 398 | VAL | 0.000 | 1.423 | -1.423 | 1.423 |
| 92 | TYR | 185 | CYS | 0.829 | 2.249 | -1.421 | 1.421 |
| 419 | MET | 435 | TRP | 6.293 | 4.873 | 1.420 | 1.420 |
| 189 | PHE | 195 | VAL | 1.003 | 2.399 | -1.396 | 1.396 |
| 122 | ASN | 157 | TRP | 1.754 | 0.381 | 1.373 | 1.373 |
| 137 | PRO | 225 | ARG | 1.525 | 0.165 | 1.360 | 1.360 |
| 132 | PHE | 140 | TYR | 11.172 | 9.819 | 1.354 | 1.354 |
| 347 | LYS | 358 | GLU | 0.000 | 1.349 | -1.349 | 1.349 |
| 164 | TRP | 199 | THR | 1.484 | 0.136 | 1.348 | 1.348 |
| 205 | TYR | 421 | LEU | 2.525 | 1.179 | 1.346 | 1.346 |
| 108 | TRP | 109 | LEU | 2.196 | 0.852 | 1.344 | 1.344 |
| 200 | ALA | 205 | TYR | 3.214 | 4.554 | -1.340 | 1.340 |
| 175 | VAL | 188 | GLN | 0.000 | 1.329 | -1.329 | 1.329 |
| 190 | LEU | 199 | THR | 0.000 | 1.328 | -1.328 | 1.328 |
| 344 | ILE | 356 | ALA | 0.000 | 1.324 | -1.324 | 1.324 |
| 136 | LYS | 141 | PRO | 0.663 | 1.983 | -1.320 | 1.320 |
| 92 | TYR | 184 | GLN | 0.390 | 1.698 | -1.308 | 1.308 |
| 167 | ALA | 189 | PHE | 2.423 | 3.726 | -1.303 | 1.303 |
| 288 | ALA | 289 | ASP | 1.300 | 0.000 | 1.300 | 1.300 |
| 343 | GLN | 357 | ILE | 0.000 | 1.294 | -1.294 | 1.294 |
| 66 | VAL | 145 | THR | 0.386 | 1.675 | -1.289 | 1.289 |
| 86 | MET | 440 | TRP | 4.318 | 5.605 | -1.288 | 1.288 |
| 419 | MET | 430 | ILE | 3.120 | 4.396 | -1.276 | 1.276 |
| 345 | VAL | 355 | THR | 0.000 | 1.276 | -1.276 | 1.276 |
| 164 | TRP | 203 | ALA | 1.796 | 0.525 | 1.272 | 1.272 |
| 46 | THR | 86 | MET | 1.491 | 2.758 | -1.267 | 1.267 |
| 31 | GLU | 35 | ILE | 0.000 | 1.263 | -1.263 | 1.263 |
| 415 | PRO | 441 | LEU | 0.477 | 1.738 | -1.261 | 1.261 |
| 109 | LEU | 187 | ILE | 0.590 | 1.850 | -1.260 | 1.260 |
| 465 | ARG | 469 | LEU | 0.000 | 1.252 | -1.252 | 1.252 |
| 74 | LEU | 122 | ASN | 1.992 | 0.744 | 1.248 | 1.248 |
| 171 | TRP | 195 | VAL | 1.228 | 0.000 | 1.228 | 1.228 |
| 280 | LEU | 281 | PRO | 0.689 | 1.916 | -1.227 | 1.227 |
| 121 | MET | 203 | ALA | 1.215 | 0.000 | 1.215 | 1.215 |
| 43 | SER | 82 | GLY | 2.019 | 3.219 | -1.200 | 1.200 |
| 416 | TYR | 420 | VAL | 3.290 | 2.108 | 1.183 | 1.183 |
| 89 | TYR | 108 | TRP | 2.679 | 3.854 | -1.175 | 1.175 |
| 59 | VAL | 467 | LEU | 1.432 | 0.266 | 1.166 | 1.166 |
| 63 | LEU | 68 | ASN | 5.416 | 6.563 | -1.147 | 1.147 |
| 50 | ASN | 75 | ALA | 6.215 | 5.068 | 1.147 | 1.147 |
| 74 | LEU | 119 | SER | 1.790 | 2.937 | -1.147 | 1.147 |
| 56 | SER | 463 | THR | 2.559 | 3.704 | -1.146 | 1.146 |
| 131 | TYR | 214 | LEU | 3.782 | 2.643 | 1.139 | 1.139 |
| 413 | TRP | 442 | CYS | 4.303 | 3.171 | 1.132 | 1.132 |
| 66 | VAL | 144 | ARG | 4.163 | 5.290 | -1.127 | 1.127 |
| 204 | PHE | 205 | TYR | 2.068 | 3.195 | -1.127 | 1.127 |
| 256 | LYS | 257 | PRO | 0.898 | 2.023 | -1.125 | 1.125 |
| 90 | THR | 440 | TRP | 1.937 | 3.055 | -1.118 | 1.118 |
| 408 | ALA | 445 | ASN | 0.148 | 1.256 | -1.108 | 1.108 |
| 63 | LEU | 460 | PHE | 4.383 | 3.277 | 1.106 | 1.106 |
| 424 | THR | 425 | PHE | 1.995 | 3.100 | -1.105 | 1.105 |
| 218 | ILE | 399 | THR | 0.000 | 1.100 | -1.100 | 1.100 |
| 52 | LEU | 464 | PHE | 2.811 | 3.910 | -1.100 | 1.100 |
| 32 | MET | 93 | ILE | 1.087 | 0.000 | 1.087 | 1.087 |
| 113 | TYR | 190 | LEU | 0.000 | 1.066 | -1.066 | 1.066 |
| 386 | ARG | 390 | GLN | 0.000 | 1.065 | -1.065 | 1.065 |
| 204 | PHE | 208 | VAL | 3.419 | 2.354 | 1.064 | 1.064 |
| 52 | LEU | 468 | LEU | 0.000 | 1.055 | -1.055 | 1.055 |
| 343 | GLN | 345 | VAL | 0.000 | 1.054 | -1.054 | 1.054 |
| 53 | VAL | 464 | PHE | 1.821 | 2.870 | -1.049 | 1.049 |
| 133 | CYS | 140 | TYR | 2.644 | 3.687 | -1.043 | 1.043 |
| 128 | PHE | 214 | LEU | 4.135 | 5.173 | -1.037 | 1.037 |
| 52 | LEU | 467 | LEU | 0.105 | 1.137 | -1.032 | 1.032 |
| 92 | TYR | 98 | TRP | 4.386 | 5.405 | -1.019 | 1.019 |
| 82 | GLY | 87 | ASN | 2.355 | 1.357 | 0.998 | 0.998 |
| 181 | PRO | 186 | PHE | 0.000 | 0.994 | -0.994 | 0.994 |
| 116 | SER | 413 | TRP | 2.678 | 1.688 | 0.990 | 0.990 |
| 312 | GLU | 313 | LEU | 0.989 | 0.000 | 0.989 | 0.989 |
| 196 | THR | 424 | THR | 1.747 | 0.761 | 0.985 | 0.985 |
| 171 | TRP | 175 | VAL | 3.002 | 2.020 | 0.982 | 0.982 |
| 430 | ILE | 435 | TRP | 7.033 | 6.055 | 0.978 | 0.978 |
| 95 | LYS | 97 | TYR | 1.782 | 0.808 | 0.974 | 0.974 |
| 50 | ASN | 450 | PRO | 3.872 | 4.837 | -0.965 | 0.965 |
| 21 | SER | 25 | ASN | 0.000 | 0.963 | -0.963 | 0.963 |
| 73 | SER | 122 | ASN | 6.199 | 5.239 | 0.960 | 0.960 |
| 318 | ALA | 319 | THR | 1.109 | 0.158 | 0.951 | 0.951 |
| 215 | TYR | 399 | THR | 0.000 | 0.945 | -0.945 | 0.945 |
| 136 | LYS | 139 | THR | 0.945 | 0.001 | 0.944 | 0.944 |
| 334 | ASN | 335 | PRO | 2.226 | 1.288 | 0.938 | 0.938 |
| 193 | PRO | 197 | PHE | 0.937 | 0.000 | 0.937 | 0.937 |
| 421 | LEU | 425 | PHE | 0.000 | 0.926 | -0.926 | 0.926 |
| 204 | PHE | 413 | TRP | 4.880 | 3.955 | 0.926 | 0.926 |
| 469 | LEU | 471 | GLN | 0.000 | 0.921 | -0.921 | 0.921 |
| 133 | CYS | 141 | PRO | 0.000 | 0.918 | -0.918 | 0.918 |
| 123 | LEU | 449 | ASN | 0.915 | 0.000 | 0.915 | 0.915 |
| 73 | SER | 153 | ILE | 2.760 | 3.668 | -0.908 | 0.908 |
| 347 | LYS | 353 | CYS | 0.000 | 0.903 | -0.903 | 0.903 |
| 112 | ASP | 443 | TYR | 5.767 | 6.652 | -0.885 | 0.885 |
| 431 | PRO | 433 | THR | 0.883 | 0.000 | 0.883 | 0.883 |
| 110 | ALA | 169 | LEU | 1.463 | 0.584 | 0.879 | 0.879 |
| 205 | TYR | 418 | VAL | 2.500 | 1.624 | 0.876 | 0.876 |
| 74 | LEU | 123 | LEU | 1.628 | 0.769 | 0.859 | 0.859 |
| 402 | ILE | 406 | LEU | 0.153 | 1.011 | -0.858 | 0.858 |
| 345 | VAL | 358 | GLU | 0.000 | 0.856 | -0.856 | 0.856 |
| 419 | MET | 438 | GLY | 0.162 | 1.018 | -0.856 | 0.856 |
| 340 | SER | 359 | ILE | 0.000 | 0.855 | -0.855 | 0.855 |
| 372 | ASN | 375 | ARG | 2.731 | 1.880 | 0.851 | 0.851 |
| 123 | LEU | 405 | ILE | 0.000 | 0.849 | -0.849 | 0.849 |
| 54 | MET | 75 | ALA | 1.658 | 0.810 | 0.847 | 0.847 |
| 450 | PRO | 464 | PHE | 0.000 | 0.847 | -0.847 | 0.847 |
| 106 | ASP | 172 | GLN | 3.637 | 2.792 | 0.845 | 0.845 |
| 89 | TYR | 443 | TYR | 1.668 | 2.511 | -0.843 | 0.843 |
| 190 | LEU | 424 | THR | 0.840 | 0.000 | 0.840 | 0.840 |
| 383 | ASN | 386 | ARG | 0.306 | 1.142 | -0.836 | 0.836 |
| 121 | MET | 207 | PRO | 0.831 | 0.000 | 0.831 | 0.831 |
| 218 | ILE | 402 | ILE | 0.828 | 0.000 | 0.828 | 0.828 |
| 102 | ALA | 182 | ASP | 0.826 | 0.000 | 0.826 | 0.826 |
| 74 | LEU | 453 | TYR | 0.812 | 1.637 | -0.825 | 0.825 |
| 345 | VAL | 354 | VAL | 0.000 | 0.820 | -0.820 | 0.820 |
| 226 | VAL | 391 | MET | 0.815 | 0.000 | 0.815 | 0.815 |
| 97 | TYR | 99 | PRO | 0.531 | 1.345 | -0.814 | 0.814 |
| 54 | MET | 72 | PHE | 6.019 | 6.824 | -0.805 | 0.805 |
| 345 | VAL | 347 | LYS | 0.000 | 0.802 | -0.802 | 0.802 |
| 346 | THR | 353 | CYS | 0.000 | 0.797 | -0.797 | 0.797 |
| 215 | TYR | 453 | TYR | 0.793 | 0.000 | 0.793 | 0.793 |
| 73 | SER | 157 | TRP | 3.272 | 2.483 | 0.789 | 0.789 |
| 184 | GLN | 186 | PHE | 3.392 | 2.610 | 0.782 | 0.782 |
| 98 | TRP | 184 | GLN | 0.626 | 1.406 | -0.779 | 0.779 |
| 323 | MET | 324 | PRO | 0.476 | 1.252 | -0.776 | 0.776 |
| 467 | LEU | 475 | ILE | 0.000 | 0.776 | -0.776 | 0.776 |
| 80 | ILE | 111 | LEU | 0.508 | 1.281 | -0.773 | 0.773 |
| 74 | LEU | 449 | ASN | 1.772 | 0.999 | 0.773 | 0.773 |
| 168 | ILE | 189 | PHE | 1.103 | 1.875 | -0.771 | 0.771 |
| 67 | ASN | 129 | ASP | 1.496 | 0.738 | 0.758 | 0.758 |
| 416 | TYR | 438 | GLY | 2.544 | 1.790 | 0.754 | 0.754 |
| 89 | TYR | 436 | SER | 4.668 | 3.922 | 0.746 | 0.746 |
| 172 | GLN | 177 | LYS | 3.729 | 4.474 | -0.745 | 0.745 |
| 342 | ILE | 357 | ILE | 0.000 | 0.745 | -0.745 | 0.745 |
| 115 | VAL | 157 | TRP | 0.413 | 1.156 | -0.743 | 0.743 |
| 411 | LEU | 441 | LEU | 0.026 | 0.765 | -0.740 | 0.740 |
| 208 | VAL | 410 | ILE | 0.171 | 0.897 | -0.726 | 0.726 |
| 117 | ASN | 164 | TRP | 4.986 | 5.712 | -0.726 | 0.726 |
| 444 | VAL | 448 | ILE | 0.321 | 1.039 | -0.719 | 0.719 |
| 315 | THR | 316 | THR | 0.718 | 0.000 | 0.718 | 0.718 |
| 98 | TRP | 104 | VAL | 1.441 | 2.155 | -0.714 | 0.714 |
| 127 | SER | 406 | LEU | 0.000 | 0.713 | -0.713 | 0.713 |
| 70 | PHE | 153 | ILE | 2.961 | 2.253 | 0.708 | 0.708 |
| 190 | LEU | 423 | ASN | 0.703 | 0.000 | 0.703 | 0.703 |
| 337 | SER | 339 | TRP | 0.000 | 0.701 | -0.701 | 0.701 |
| 57 | ILE | 68 | ASN | 1.448 | 2.148 | -0.699 | 0.699 |
| 45 | VAL | 447 | THR | 0.221 | 0.919 | -0.698 | 0.698 |
| 404 | ALA | 452 | CYS | 0.000 | 0.696 | -0.696 | 0.696 |
| 403 | PHE | 407 | LEU | 0.000 | 0.694 | -0.694 | 0.694 |
| 133 | CYS | 144 | ARG | 0.468 | 1.162 | -0.694 | 0.694 |
| 42 | LEU | 86 | MET | 1.182 | 0.492 | 0.690 | 0.690 |
| 161 | PHE | 165 | ALA | 2.460 | 1.771 | 0.689 | 0.689 |
| 460 | PHE | 464 | PHE | 1.265 | 0.577 | 0.688 | 0.688 |
| 309 | PRO | 310 | ALA | 0.000 | 0.684 | -0.684 | 0.684 |
| 347 | LYS | 352 | GLU | 0.000 | 0.683 | -0.683 | 0.683 |
| 258 | PRO | 259 | PRO | 1.343 | 2.025 | -0.682 | 0.682 |
| 74 | LEU | 78 | ASP | 2.175 | 1.502 | 0.673 | 0.673 |
| 420 | VAL | 435 | TRP | 2.502 | 3.171 | -0.669 | 0.669 |
| 317 | GLU | 318 | ALA | 0.666 | 0.000 | 0.666 | 0.666 |
| 204 | PHE | 409 | PHE | 0.886 | 1.551 | -0.665 | 0.665 |
| 423 | ASN | 430 | ILE | 0.077 | 0.742 | -0.664 | 0.664 |
| 70 | PHE | 152 | MET | 0.387 | 1.047 | -0.661 | 0.661 |
| 215 | TYR | 218 | ILE | 0.656 | 0.000 | 0.656 | 0.656 |
| 108 | TRP | 443 | TYR | 0.602 | 1.258 | -0.656 | 0.656 |
| 263 | ALA | 264 | ARG | 0.654 | 0.000 | 0.654 | 0.654 |
| 181 | PRO | 184 | GLN | 1.950 | 1.301 | 0.649 | 0.649 |
| 63 | LEU | 463 | THR | 1.623 | 0.975 | 0.648 | 0.648 |
| 81 | ILE | 115 | VAL | 2.125 | 1.478 | 0.647 | 0.647 |
| 81 | ILE | 86 | MET | 3.130 | 3.770 | -0.640 | 0.640 |
| 81 | ILE | 116 | SER | 1.340 | 1.974 | -0.635 | 0.635 |
| 127 | SER | 211 | MET | 2.797 | 2.163 | 0.634 | 0.634 |
| 177 | LYS | 179 | THR | 0.000 | 0.632 | -0.632 | 0.632 |
| 245 | LEU | 246 | LYS | 0.000 | 0.632 | -0.632 | 0.632 |
| 368 | ARG | 369 | PRO | 0.650 | 0.024 | 0.626 | 0.626 |
| 405 | ILE | 449 | ASN | 0.000 | 0.624 | -0.624 | 0.624 |
| 39 | THR | 90 | THR | 3.880 | 4.500 | -0.619 | 0.619 |
| 451 | ALA | 455 | LEU | 0.619 | 0.000 | 0.619 | 0.619 |
| 68 | ASN | 71 | LEU | 0.479 | 1.095 | -0.615 | 0.615 |
| 62 | GLN | 479 | ARG | 0.000 | 0.614 | -0.614 | 0.614 |
| 55 | LEU | 467 | LEU | 0.062 | 0.674 | -0.612 | 0.612 |
| 385 | VAL | 389 | ARG | 0.606 | 0.000 | 0.606 | 0.606 |
| 253 | SER | 254 | VAL | 2.670 | 2.065 | 0.605 | 0.605 |
| 449 | ASN | 453 | TYR | 0.412 | 1.017 | -0.604 | 0.604 |
| 410 | ILE | 415 | PRO | 0.609 | 0.019 | 0.590 | 0.590 |
| 111 | LEU | 115 | VAL | 0.878 | 0.289 | 0.589 | 0.589 |
| 103 | VAL | 107 | LEU | 0.000 | 0.583 | -0.583 | 0.583 |
| 120 | VAL | 203 | ALA | 0.978 | 0.395 | 0.583 | 0.583 |
| 43 | SER | 87 | ASN | 4.266 | 3.685 | 0.581 | 0.581 |
| 60 | ASN | 62 | GLN | 2.109 | 2.689 | -0.580 | 0.580 |
| 81 | ILE | 446 | SER | 2.913 | 2.342 | 0.571 | 0.571 |
| 123 | LEU | 409 | PHE | 1.372 | 1.937 | -0.565 | 0.565 |
| 342 | ILE | 358 | GLU | 0.000 | 0.563 | -0.563 | 0.563 |
| 108 | TRP | 185 | CYS | 1.615 | 2.177 | -0.562 | 0.562 |
| 25 | ASN | 28 | GLU | 0.021 | 0.581 | -0.560 | 0.560 |
| 180 | VAL | 188 | GLN | 0.981 | 1.538 | -0.556 | 0.556 |
| 46 | THR | 82 | GLY | 0.711 | 1.261 | -0.550 | 0.550 |
| 113 | TYR | 168 | ILE | 1.425 | 0.882 | 0.542 | 0.542 |
| 343 | GLN | 356 | ALA | 0.000 | 0.542 | -0.542 | 0.542 |
| 200 | ALA | 421 | LEU | 0.539 | 0.000 | 0.539 | 0.539 |
| 84 | PHE | 111 | LEU | 0.262 | 0.800 | -0.537 | 0.537 |
| 410 | ILE | 414 | THR | 1.375 | 0.842 | 0.533 | 0.533 |
| 265 | GLU | 266 | GLU | 0.530 | 0.000 | 0.530 | 0.530 |
| 416 | TYR | 435 | TRP | 2.500 | 3.029 | -0.529 | 0.529 |
| 144 | ARG | 148 | MET | 0.523 | 0.000 | 0.523 | 0.523 |
| 170 | PHE | 173 | PHE | 0.490 | 1.012 | -0.522 | 0.522 |
| 92 | TYR | 97 | TYR | 6.067 | 5.547 | 0.520 | 0.520 |
| 190 | LEU | 420 | VAL | 0.516 | 0.000 | 0.516 | 0.516 |
| 125 | ILE | 152 | MET | 2.480 | 2.993 | -0.512 | 0.512 |
| 412 | THR | 442 | CYS | 2.752 | 2.243 | 0.509 | 0.509 |
| 29 | THR | 32 | MET | 0.000 | 0.506 | -0.506 | 0.506 |
| 361 | PRO | 363 | THR | 0.000 | 0.501 | -0.501 | 0.501 |
| 348 | GLN | 353 | CYS | 0.000 | 0.493 | -0.493 | 0.493 |
| 35 | ILE | 93 | ILE | 0.000 | 0.492 | -0.492 | 0.492 |
| 77 | ALA | 157 | TRP | 3.222 | 2.732 | 0.491 | 0.491 |
| 93 | ILE | 436 | SER | 0.653 | 1.135 | -0.482 | 0.482 |
| 120 | VAL | 409 | PHE | 1.086 | 1.566 | -0.480 | 0.480 |
| 405 | ILE | 452 | CYS | 0.200 | 0.672 | -0.472 | 0.472 |
| 285 | ARG | 286 | PRO | 0.815 | 0.343 | 0.472 | 0.472 |
| 42 | LEU | 447 | THR | 0.259 | 0.726 | -0.466 | 0.466 |
| 35 | ILE | 39 | THR | 0.104 | 0.568 | -0.464 | 0.464 |
| 119 | SER | 413 | TRP | 0.449 | 0.000 | 0.449 | 0.449 |
| 63 | LEU | 459 | THR | 1.994 | 2.443 | -0.449 | 0.449 |
| 276 | PRO | 277 | PRO | 0.809 | 0.363 | 0.447 | 0.447 |
| 71 | LEU | 460 | PHE | 0.159 | 0.600 | -0.442 | 0.442 |
| 189 | PHE | 199 | THR | 0.592 | 0.153 | 0.439 | 0.439 |
| 4 | PHE | 5 | THR | 0.000 | 0.438 | -0.438 | 0.438 |
| 88 | LEU | 100 | LEU | 0.239 | 0.675 | -0.436 | 0.436 |
| 180 | VAL | 184 | GLN | 0.436 | 0.003 | 0.433 | 0.433 |
| 262 | ALA | 263 | ALA | 0.433 | 0.000 | 0.433 | 0.433 |
| 46 | THR | 446 | SER | 1.389 | 1.821 | -0.432 | 0.432 |
| 36 | ALA | 94 | ILE | 1.226 | 1.655 | -0.430 | 0.430 |
| 88 | LEU | 98 | TRP | 1.207 | 0.779 | 0.429 | 0.429 |
| 60 | ASN | 463 | THR | 3.248 | 2.819 | 0.429 | 0.429 |
| 179 | THR | 180 | VAL | 0.425 | 0.000 | 0.425 | 0.425 |
| 175 | VAL | 179 | THR | 0.422 | 0.000 | 0.422 | 0.422 |
| 211 | MET | 215 | TYR | 0.416 | 0.000 | 0.416 | 0.416 |
| 437 | ILE | 441 | LEU | 0.415 | 0.000 | 0.415 | 0.415 |
| 22 | SER | 26 | ARG | 0.415 | 0.000 | 0.415 | 0.415 |
| 333 | LEU | 334 | ASN | 0.411 | 0.000 | 0.411 | 0.411 |
| 163 | LEU | 164 | TRP | 0.816 | 0.405 | 0.411 | 0.411 |
| 23 | SER | 27 | TYR | 0.000 | 0.411 | -0.411 | 0.411 |
| 341 | LYS | 358 | GLU | 0.000 | 0.410 | -0.410 | 0.410 |
| 219 | SER | 399 | THR | 0.409 | 0.000 | 0.409 | 0.409 |
| 91 | VAL | 99 | PRO | 0.935 | 0.527 | 0.409 | 0.409 |
| 412 | THR | 444 | VAL | 0.566 | 0.157 | 0.408 | 0.408 |
| 53 | VAL | 75 | ALA | 0.620 | 1.026 | -0.406 | 0.406 |
| 343 | GLN | 360 | VAL | 0.000 | 0.402 | -0.402 | 0.402 |
| 344 | ILE | 355 | THR | 0.000 | 0.398 | -0.398 | 0.398 |
| 62 | GLN | 459 | THR | 0.198 | 0.594 | -0.396 | 0.396 |
| 67 | ASN | 144 | ARG | 5.088 | 4.693 | 0.395 | 0.395 |
| 183 | ASN | 184 | GLN | 1.028 | 1.419 | -0.390 | 0.390 |
| 74 | LEU | 126 | ILE | 0.569 | 0.181 | 0.388 | 0.388 |
| 53 | VAL | 454 | ALA | 0.388 | 0.000 | 0.388 | 0.388 |
| 129 | ASP | 133 | CYS | 0.590 | 0.977 | -0.387 | 0.387 |
| 114 | VAL | 165 | ALA | 1.632 | 1.247 | 0.386 | 0.386 |
| 422 | VAL | 430 | ILE | 0.835 | 1.220 | -0.385 | 0.385 |
| 126 | ILE | 453 | TYR | 0.384 | 0.000 | 0.384 | 0.384 |
| 413 | TRP | 417 | ASN | 0.802 | 1.186 | -0.384 | 0.384 |
| 80 | ILE | 115 | VAL | 1.576 | 1.957 | -0.380 | 0.380 |
| 433 | THR | 437 | ILE | 0.000 | 0.374 | -0.374 | 0.374 |
| 122 | ASN | 153 | ILE | 0.108 | 0.481 | -0.372 | 0.372 |
| 121 | MET | 202 | ALA | 0.372 | 0.000 | 0.372 | 0.372 |
| 421 | LEU | 424 | THR | 0.000 | 0.370 | -0.370 | 0.370 |
| 99 | PRO | 100 | LEU | 0.254 | 0.619 | -0.365 | 0.365 |
| 98 | TRP | 100 | LEU | 3.091 | 2.728 | 0.363 | 0.363 |
| 192 | ASN | 193 | PRO | 1.012 | 1.375 | -0.363 | 0.363 |
| 70 | PHE | 125 | ILE | 2.765 | 3.128 | -0.363 | 0.363 |
| 131 | TYR | 135 | THR | 3.464 | 3.826 | -0.363 | 0.363 |
| 106 | ASP | 168 | ILE | 0.578 | 0.939 | -0.361 | 0.361 |
| 53 | VAL | 450 | PRO | 0.764 | 1.125 | -0.361 | 0.361 |
| 106 | ASP | 178 | ARG | 7.348 | 6.988 | 0.359 | 0.359 |
| 328 | LEU | 329 | GLN | 0.358 | 0.000 | 0.358 | 0.358 |
| 53 | VAL | 460 | PHE | 0.857 | 0.499 | 0.358 | 0.358 |
| 60 | ASN | 459 | THR | 0.482 | 0.839 | -0.357 | 0.357 |
| 100 | LEU | 104 | VAL | 1.365 | 1.718 | -0.353 | 0.353 |
| 180 | VAL | 181 | PRO | 1.190 | 0.836 | 0.353 | 0.353 |
| 172 | GLN | 173 | PHE | 2.165 | 1.816 | 0.349 | 0.349 |
| 54 | MET | 76 | CYS | 1.722 | 1.377 | 0.345 | 0.345 |
| 61 | ARG | 64 | GLN | 0.505 | 0.849 | -0.344 | 0.344 |
| 78 | ASP | 119 | SER | 0.459 | 0.802 | -0.343 | 0.343 |
| 105 | CYS | 185 | CYS | 6.501 | 6.844 | -0.342 | 0.342 |
| 212 | THR | 410 | ILE | 0.000 | 0.342 | -0.342 | 0.342 |
| 450 | PRO | 455 | LEU | 0.341 | 0.000 | 0.341 | 0.341 |
| 388 | LYS | 391 | MET | 0.000 | 0.341 | -0.341 | 0.341 |
| 159 | LEU | 163 | LEU | 1.615 | 1.953 | -0.338 | 0.338 |
| 248 | PRO | 249 | LEU | 0.338 | 0.000 | 0.338 | 0.338 |
| 65 | THR | 67 | ASN | 0.756 | 0.418 | 0.338 | 0.338 |
| 11 | SER | 13 | ASN | 0.335 | 0.000 | 0.335 | 0.335 |
| 221 | ALA | 225 | ARG | 0.000 | 0.335 | -0.335 | 0.335 |
| 123 | LEU | 445 | ASN | 0.334 | 0.000 | 0.334 | 0.334 |
| 205 | TYR | 417 | ASN | 3.543 | 3.877 | -0.334 | 0.334 |
| 119 | SER | 120 | VAL | 0.334 | 0.000 | 0.334 | 0.334 |
| 326 | PRO | 327 | PRO | 0.447 | 0.780 | -0.333 | 0.333 |
| 131 | TYR | 217 | HIS | 1.031 | 1.364 | -0.333 | 0.333 |
| 310 | ALA | 311 | THR | 0.000 | 0.327 | -0.327 | 0.327 |
| 416 | TYR | 419 | MET | 0.000 | 0.326 | -0.326 | 0.326 |
| 153 | ILE | 157 | TRP | 0.832 | 1.158 | -0.326 | 0.326 |
| 132 | PHE | 137 | PRO | 0.365 | 0.039 | 0.326 | 0.326 |
| 98 | TRP | 185 | CYS | 3.648 | 3.974 | -0.326 | 0.326 |
| 134 | VAL | 222 | SER | 0.323 | 0.000 | 0.323 | 0.323 |
| 70 | PHE | 122 | ASN | 0.260 | 0.581 | -0.320 | 0.320 |
| 78 | ASP | 450 | PRO | 0.320 | 0.000 | 0.320 | 0.320 |
| 133 | CYS | 225 | ARG | 0.319 | 0.000 | 0.319 | 0.319 |
| 24 | HIS | 25 | ASN | 0.000 | 0.318 | -0.318 | 0.318 |
| 56 | SER | 467 | LEU | 1.775 | 2.093 | -0.317 | 0.317 |
| 416 | TYR | 417 | ASN | 0.310 | 0.625 | -0.315 | 0.315 |
| 118 | ALA | 157 | TRP | 2.250 | 2.563 | -0.313 | 0.313 |
| 329 | GLN | 330 | PRO | 0.324 | 0.631 | -0.306 | 0.306 |
| 68 | ASN | 460 | PHE | 1.482 | 1.176 | 0.306 | 0.306 |
| 412 | THR | 413 | TRP | 1.805 | 1.501 | 0.304 | 0.304 |
| 47 | VAL | 79 | LEU | 2.498 | 2.797 | -0.300 | 0.300 |
| 216 | ILE | 220 | LEU | 0.471 | 0.770 | -0.299 | 0.299 |
| 98 | TRP | 183 | ASN | 3.978 | 3.680 | 0.298 | 0.298 |
| 181 | PRO | 183 | ASN | 1.418 | 1.121 | 0.297 | 0.297 |
| 404 | ALA | 456 | CYS | 0.000 | 0.297 | -0.297 | 0.297 |
| 97 | TYR | 183 | ASN | 3.065 | 3.360 | -0.295 | 0.295 |
| 215 | TYR | 219 | SER | 0.000 | 0.293 | -0.293 | 0.293 |
| 474 | ASN | 477 | THR | 0.000 | 0.293 | -0.293 | 0.293 |
| 339 | TRP | 362 | ALA | 0.000 | 0.292 | -0.292 | 0.292 |
| 215 | TYR | 405 | ILE | 0.290 | 0.000 | 0.290 | 0.290 |
| 76 | CYS | 157 | TRP | 0.429 | 0.141 | 0.288 | 0.288 |
| 433 | THR | 434 | VAL | 0.287 | 0.000 | 0.287 | 0.287 |
| 363 | THR | 364 | PRO | 0.796 | 1.071 | -0.276 | 0.276 |
| 131 | TYR | 132 | PHE | 1.995 | 2.268 | -0.274 | 0.274 |
| 105 | CYS | 106 | ASP | 0.389 | 0.662 | -0.274 | 0.274 |
| 121 | MET | 160 | SER | 1.004 | 0.732 | 0.272 | 0.272 |
| 342 | ILE | 359 | ILE | 0.000 | 0.271 | -0.271 | 0.271 |
| 408 | ALA | 448 | ILE | 0.506 | 0.776 | -0.270 | 0.270 |
| 281 | PRO | 282 | PRO | 0.611 | 0.880 | -0.269 | 0.269 |
| 202 | ALA | 207 | PRO | 1.728 | 1.996 | -0.268 | 0.268 |
| 124 | LEU | 211 | MET | 2.067 | 2.333 | -0.267 | 0.267 |
| 148 | MET | 152 | MET | 0.535 | 0.799 | -0.264 | 0.264 |
| 35 | ILE | 94 | ILE | 0.000 | 0.264 | -0.264 | 0.264 |
| 457 | ASN | 459 | THR | 1.987 | 1.723 | 0.264 | 0.264 |
| 191 | SER | 196 | THR | 0.000 | 0.260 | -0.260 | 0.260 |
| 334 | ASN | 336 | ALA | 0.000 | 0.259 | -0.259 | 0.259 |
| 463 | THR | 475 | ILE | 0.000 | 0.255 | -0.255 | 0.255 |
| 201 | ILE | 206 | LEU | 3.065 | 3.319 | -0.254 | 0.254 |
| 192 | ASN | 195 | VAL | 2.536 | 2.287 | 0.249 | 0.249 |
| 117 | ASN | 121 | MET | 2.286 | 2.038 | 0.248 | 0.248 |
| 200 | ALA | 420 | VAL | 0.000 | 0.247 | -0.247 | 0.247 |
| 426 | CYS | 428 | SER | 0.546 | 0.300 | 0.245 | 0.245 |
| 93 | ILE | 440 | TRP | 2.112 | 1.868 | 0.244 | 0.244 |
| 219 | SER | 220 | LEU | 0.000 | 0.242 | -0.242 | 0.242 |
| 117 | ASN | 163 | LEU | 0.333 | 0.094 | 0.239 | 0.239 |
| 470 | CYS | 472 | TYR | 0.000 | 0.239 | -0.239 | 0.239 |
| 77 | ALA | 119 | SER | 0.972 | 0.733 | 0.238 | 0.238 |
| 88 | LEU | 108 | TRP | 4.040 | 3.802 | 0.238 | 0.238 |
| 110 | ALA | 165 | ALA | 0.192 | 0.429 | -0.237 | 0.237 |
| 46 | THR | 78 | ASP | 0.608 | 0.845 | -0.237 | 0.237 |
| 109 | LEU | 186 | PHE | 2.416 | 2.653 | -0.236 | 0.236 |
| 70 | PHE | 149 | ALA | 3.432 | 3.666 | -0.234 | 0.234 |
| 423 | ASN | 427 | GLN | 0.337 | 0.104 | 0.234 | 0.234 |
| 414 | THR | 415 | PRO | 0.805 | 1.038 | -0.233 | 0.233 |
| 66 | VAL | 70 | PHE | 0.000 | 0.232 | -0.232 | 0.232 |
| 161 | PHE | 166 | PRO | 1.799 | 2.030 | -0.231 | 0.231 |
| 19 | VAL | 23 | SER | 0.000 | 0.230 | -0.230 | 0.230 |
| 86 | MET | 447 | THR | 0.458 | 0.686 | -0.228 | 0.228 |
| 360 | VAL | 361 | PRO | 0.405 | 0.630 | -0.225 | 0.225 |
| 84 | PHE | 108 | TRP | 0.222 | 0.000 | 0.222 | 0.222 |
| 380 | ILE | 384 | GLN | 0.120 | 0.342 | -0.221 | 0.221 |
| 48 | VAL | 52 | LEU | 0.715 | 0.494 | 0.220 | 0.220 |
| 222 | SER | 223 | ARG | 0.000 | 0.220 | -0.220 | 0.220 |
| 114 | VAL | 160 | SER | 3.406 | 3.625 | -0.219 | 0.219 |
| 291 | ASP | 292 | THR | 0.454 | 0.236 | 0.218 | 0.218 |
| 64 | GLN | 69 | TYR | 0.391 | 0.174 | 0.217 | 0.217 |
| 43 | SER | 86 | MET | 1.804 | 2.019 | -0.215 | 0.215 |
| 448 | ILE | 452 | CYS | 0.560 | 0.773 | -0.213 | 0.213 |
| 130 | ARG | 218 | ILE | 1.901 | 1.689 | 0.212 | 0.212 |
| 5 | THR | 6 | PRO | 0.830 | 0.618 | 0.212 | 0.212 |
| 277 | PRO | 278 | PRO | 0.692 | 0.900 | -0.208 | 0.208 |
| 89 | TYR | 92 | TYR | 1.191 | 0.983 | 0.208 | 0.208 |
| 320 | THR | 321 | PRO | 1.762 | 1.555 | 0.207 | 0.207 |
| 187 | ILE | 189 | PHE | 4.336 | 4.130 | 0.206 | 0.206 |
| 461 | LYS | 465 | ARG | 0.205 | 0.000 | 0.205 | 0.205 |
| 86 | MET | 444 | VAL | 0.000 | 0.204 | -0.204 | 0.204 |
| 301 | ALA | 302 | THR | 0.090 | 0.293 | -0.203 | 0.203 |
| 451 | ALA | 456 | CYS | 0.202 | 0.000 | 0.202 | 0.202 |
| 126 | ILE | 402 | ILE | 0.000 | 0.201 | -0.201 | 0.201 |
| 405 | ILE | 453 | TYR | 2.020 | 1.818 | 0.201 | 0.201 |
| 140 | TYR | 141 | PRO | 1.217 | 1.418 | -0.201 | 0.201 |
| 106 | ASP | 169 | LEU | 1.824 | 1.623 | 0.200 | 0.200 |
| 178 | ARG | 188 | GLN | 2.766 | 2.965 | -0.200 | 0.200 |
| 81 | ILE | 443 | TYR | 1.385 | 1.584 | -0.199 | 0.199 |
| 134 | VAL | 218 | ILE | 0.964 | 0.766 | 0.199 | 0.199 |
| 127 | SER | 214 | LEU | 1.329 | 1.526 | -0.197 | 0.197 |
| 139 | THR | 143 | ARG | 0.000 | 0.195 | -0.195 | 0.195 |
| 333 | LEU | 339 | TRP | 0.000 | 0.194 | -0.194 | 0.194 |
| 169 | LEU | 170 | PHE | 0.072 | 0.266 | -0.194 | 0.194 |
| 401 | THR | 452 | CYS | 0.000 | 0.192 | -0.192 | 0.192 |
| 118 | ALA | 156 | ALA | 0.000 | 0.191 | -0.191 | 0.191 |
| 418 | VAL | 422 | VAL | 0.005 | 0.196 | -0.190 | 0.190 |
| 57 | ILE | 63 | LEU | 1.562 | 1.372 | 0.190 | 0.190 |
| 92 | TYR | 183 | ASN | 0.167 | 0.356 | -0.189 | 0.189 |
| 379 | SER | 380 | ILE | 0.107 | 0.295 | -0.188 | 0.188 |
| 47 | VAL | 83 | ALA | 1.319 | 1.506 | -0.187 | 0.187 |
| 56 | SER | 63 | LEU | 2.715 | 2.533 | 0.182 | 0.182 |
| 349 | THR | 354 | VAL | 0.000 | 0.181 | -0.181 | 0.181 |
| 218 | ILE | 222 | SER | 0.181 | 0.000 | 0.181 | 0.181 |
| 32 | MET | 35 | ILE | 0.179 | 0.000 | 0.179 | 0.179 |
| 432 | ASP | 435 | TRP | 0.344 | 0.170 | 0.174 | 0.174 |
| 305 | THR | 306 | LYS | 1.765 | 1.594 | 0.171 | 0.171 |
| 409 | PHE | 410 | ILE | 0.000 | 0.171 | -0.171 | 0.171 |
| 36 | ALA | 90 | THR | 0.311 | 0.141 | 0.170 | 0.170 |
| 282 | PRO | 283 | PRO | 0.798 | 0.629 | 0.169 | 0.169 |
| 123 | LEU | 211 | MET | 1.961 | 1.795 | 0.166 | 0.166 |
| 235 | LYS | 236 | GLU | 0.162 | 0.000 | 0.162 | 0.162 |
| 43 | SER | 47 | VAL | 0.000 | 0.162 | -0.162 | 0.162 |
| 201 | ILE | 207 | PRO | 0.160 | 0.322 | -0.162 | 0.162 |
| 53 | VAL | 57 | ILE | 0.338 | 0.500 | -0.162 | 0.162 |
| 105 | CYS | 109 | LEU | 0.984 | 0.823 | 0.161 | 0.161 |
| 51 | ILE | 79 | LEU | 1.195 | 1.034 | 0.161 | 0.161 |
| 80 | ILE | 84 | PHE | 0.425 | 0.585 | -0.161 | 0.161 |
| 42 | LEU | 444 | VAL | 0.000 | 0.160 | -0.160 | 0.160 |
| 472 | TYR | 475 | ILE | 0.000 | 0.160 | -0.160 | 0.160 |
| 186 | PHE | 432 | ASP | 0.160 | 0.000 | 0.160 | 0.160 |
| 401 | THR | 453 | TYR | 0.000 | 0.157 | -0.157 | 0.157 |
| 207 | PRO | 211 | MET | 0.000 | 0.155 | -0.155 | 0.155 |
| 435 | TRP | 439 | TYR | 0.154 | 0.000 | 0.154 | 0.154 |
| 398 | VAL | 402 | ILE | 0.738 | 0.585 | 0.153 | 0.153 |
| 46 | THR | 447 | THR | 6.246 | 6.094 | 0.152 | 0.152 |
| 83 | ALA | 84 | PHE | 0.884 | 1.033 | -0.149 | 0.149 |
| 292 | THR | 293 | SER | 1.565 | 1.713 | -0.147 | 0.147 |
| 115 | VAL | 116 | SER | 0.000 | 0.146 | -0.146 | 0.146 |
| 416 | TYR | 442 | CYS | 1.904 | 1.758 | 0.146 | 0.146 |
| 91 | VAL | 95 | LYS | 0.000 | 0.146 | -0.146 | 0.146 |
| 108 | TRP | 439 | TYR | 0.000 | 0.144 | -0.144 | 0.144 |
| 191 | SER | 427 | GLN | 0.143 | 0.000 | 0.143 | 0.143 |
| 112 | ASP | 116 | SER | 0.936 | 0.793 | 0.143 | 0.143 |
| 113 | TYR | 187 | ILE | 5.428 | 5.286 | 0.142 | 0.142 |
| 124 | LEU | 210 | ILE | 1.119 | 0.976 | 0.142 | 0.142 |
| 121 | MET | 124 | LEU | 0.357 | 0.498 | -0.140 | 0.140 |
| 192 | ASN | 194 | ALA | 0.794 | 0.933 | -0.138 | 0.138 |
| 85 | SER | 115 | VAL | 0.000 | 0.138 | -0.138 | 0.138 |
| 56 | SER | 464 | PHE | 3.024 | 3.160 | -0.135 | 0.135 |
| 240 | LYS | 241 | THR | 0.000 | 0.135 | -0.135 | 0.135 |
| 209 | VAL | 213 | VAL | 0.024 | 0.158 | -0.134 | 0.134 |
| 166 | PRO | 170 | PHE | 0.656 | 0.524 | 0.132 | 0.132 |
| 59 | VAL | 463 | THR | 0.241 | 0.373 | -0.132 | 0.132 |
| 98 | TRP | 99 | PRO | 0.737 | 0.868 | -0.132 | 0.132 |
| 166 | PRO | 171 | TRP | 0.248 | 0.380 | -0.132 | 0.132 |
| 89 | TYR | 435 | TRP | 0.564 | 0.694 | -0.130 | 0.130 |
| 49 | GLY | 464 | PHE | 0.000 | 0.130 | -0.130 | 0.130 |
| 67 | ASN | 68 | ASN | 0.268 | 0.397 | -0.129 | 0.129 |
| 148 | MET | 151 | LEU | 0.000 | 0.129 | -0.129 | 0.129 |
| 261 | GLU | 262 | ALA | 0.514 | 0.385 | 0.129 | 0.129 |
| 78 | ASP | 446 | SER | 11.009 | 10.881 | 0.128 | 0.128 |
| 210 | ILE | 214 | LEU | 0.995 | 0.868 | 0.127 | 0.127 |
| 171 | TRP | 191 | SER | 0.126 | 0.000 | 0.126 | 0.126 |
| 283 | PRO | 284 | PRO | 0.725 | 0.851 | -0.126 | 0.126 |
| 85 | SER | 108 | TRP | 2.703 | 2.577 | 0.126 | 0.126 |
| 109 | LEU | 113 | TYR | 0.207 | 0.082 | 0.126 | 0.126 |
| 146 | THR | 147 | LYS | 0.145 | 0.020 | 0.125 | 0.125 |
| 180 | VAL | 185 | CYS | 0.129 | 0.254 | -0.125 | 0.125 |
| 357 | ILE | 359 | ILE | 0.443 | 0.320 | 0.123 | 0.123 |
| 208 | VAL | 212 | THR | 0.280 | 0.402 | -0.122 | 0.122 |
| 199 | THR | 204 | PHE | 0.008 | 0.129 | -0.121 | 0.121 |
| 412 | THR | 438 | GLY | 0.000 | 0.121 | -0.121 | 0.121 |
| 98 | TRP | 182 | ASP | 0.543 | 0.663 | -0.120 | 0.120 |
| 60 | ASN | 63 | LEU | 2.677 | 2.797 | -0.120 | 0.120 |
| 127 | SER | 218 | ILE | 0.399 | 0.517 | -0.118 | 0.118 |
| 208 | VAL | 409 | PHE | 0.981 | 0.863 | 0.118 | 0.118 |
| 34 | PHE | 38 | VAL | 1.485 | 1.604 | -0.118 | 0.118 |
| 455 | LEU | 456 | CYS | 0.000 | 0.117 | -0.117 | 0.117 |
| 120 | VAL | 124 | LEU | 0.000 | 0.116 | -0.116 | 0.116 |
| 107 | LEU | 169 | LEU | 0.750 | 0.634 | 0.116 | 0.116 |
| 109 | LEU | 168 | ILE | 1.641 | 1.755 | -0.114 | 0.114 |
| 129 | ASP | 144 | ARG | 4.921 | 4.810 | 0.111 | 0.111 |
| 267 | LEU | 268 | ARG | 0.806 | 0.695 | 0.111 | 0.111 |
| 452 | CYS | 453 | TYR | 0.110 | 0.000 | 0.110 | 0.110 |
| 232 | GLU | 352 | GLU | 0.000 | 0.108 | -0.108 | 0.108 |
| 131 | TYR | 218 | ILE | 3.365 | 3.257 | 0.108 | 0.108 |
| 361 | PRO | 370 | ALA | 0.000 | 0.108 | -0.108 | 0.108 |
| 211 | MET | 409 | PHE | 1.566 | 1.459 | 0.108 | 0.108 |
| 91 | VAL | 97 | TYR | 0.120 | 0.013 | 0.107 | 0.107 |
| 275 | ALA | 276 | PRO | 0.441 | 0.548 | -0.107 | 0.107 |
| 46 | THR | 50 | ASN | 0.656 | 0.762 | -0.106 | 0.106 |
| 81 | ILE | 85 | SER | 1.053 | 0.947 | 0.106 | 0.106 |
| 371 | ALA | 375 | ARG | 0.000 | 0.104 | -0.104 | 0.104 |
| 57 | ILE | 71 | LEU | 0.229 | 0.333 | -0.104 | 0.104 |
| 132 | PHE | 135 | THR | 0.155 | 0.259 | -0.104 | 0.104 |
| 65 | THR | 68 | ASN | 3.388 | 3.285 | 0.103 | 0.103 |
| 466 | HIS | 472 | TYR | 0.000 | 0.103 | -0.103 | 0.103 |
| 109 | LEU | 185 | CYS | 1.772 | 1.669 | 0.102 | 0.102 |
| 212 | THR | 216 | ILE | 0.465 | 0.364 | 0.101 | 0.101 |
| 105 | CYS | 178 | ARG | 0.720 | 0.821 | -0.101 | 0.101 |
| 136 | LYS | 140 | TYR | 0.367 | 0.466 | -0.099 | 0.099 |
| 57 | ILE | 72 | PHE | 2.287 | 2.188 | 0.099 | 0.099 |
| 300 | SER | 301 | ALA | 0.098 | 0.000 | 0.098 | 0.098 |
| 220 | LEU | 223 | ARG | 0.098 | 0.000 | 0.098 | 0.098 |
| 340 | SER | 360 | VAL | 0.000 | 0.098 | -0.098 | 0.098 |
| 196 | THR | 420 | VAL | 1.107 | 1.205 | -0.098 | 0.098 |
| 53 | VAL | 71 | LEU | 0.193 | 0.290 | -0.097 | 0.097 |
| 35 | ILE | 40 | GLY | 0.000 | 0.097 | -0.097 | 0.097 |
| 80 | ILE | 157 | TRP | 0.375 | 0.472 | -0.097 | 0.097 |
| 80 | ILE | 85 | SER | 0.766 | 0.862 | -0.096 | 0.096 |
| 125 | ILE | 153 | ILE | 0.122 | 0.026 | 0.096 | 0.096 |
| 105 | CYS | 186 | PHE | 0.234 | 0.327 | -0.093 | 0.093 |
| 180 | VAL | 187 | ILE | 0.093 | 0.000 | 0.093 | 0.093 |
| 134 | VAL | 221 | ALA | 0.641 | 0.733 | -0.092 | 0.092 |
| 28 | GLU | 32 | MET | 0.000 | 0.089 | -0.089 | 0.089 |
| 125 | ILE | 156 | ALA | 0.713 | 0.625 | 0.089 | 0.089 |
| 449 | ASN | 450 | PRO | 1.046 | 0.958 | 0.088 | 0.088 |
| 195 | VAL | 199 | THR | 0.212 | 0.301 | -0.088 | 0.088 |
| 230 | ARG | 231 | PRO | 0.541 | 0.629 | -0.088 | 0.088 |
| 72 | PHE | 76 | CYS | 1.469 | 1.557 | -0.088 | 0.088 |
| 222 | SER | 398 | VAL | 0.088 | 0.000 | 0.088 | 0.088 |
| 117 | ASN | 160 | SER | 7.102 | 7.189 | -0.087 | 0.087 |
| 440 | TRP | 443 | TYR | 1.393 | 1.477 | -0.084 | 0.084 |
| 379 | SER | 382 | ARG | 0.168 | 0.253 | -0.084 | 0.084 |
| 463 | THR | 467 | LEU | 0.490 | 0.406 | 0.084 | 0.084 |
| 164 | TRP | 168 | ILE | 0.478 | 0.561 | -0.083 | 0.083 |
| 135 | THR | 136 | LYS | 0.726 | 0.644 | 0.082 | 0.082 |
| 123 | LEU | 126 | ILE | 0.000 | 0.082 | -0.082 | 0.082 |
| 110 | ALA | 168 | ILE | 2.800 | 2.719 | 0.081 | 0.081 |
| 66 | VAL | 149 | ALA | 0.869 | 0.949 | -0.080 | 0.080 |
| 206 | LEU | 210 | ILE | 1.372 | 1.293 | 0.079 | 0.079 |
| 69 | TYR | 153 | ILE | 1.804 | 1.726 | 0.077 | 0.077 |
| 412 | THR | 448 | ILE | 0.442 | 0.519 | -0.077 | 0.077 |
| 122 | ASN | 156 | ALA | 0.042 | 0.119 | -0.077 | 0.077 |
| 117 | ASN | 120 | VAL | 0.076 | 0.000 | 0.076 | 0.076 |
| 208 | VAL | 211 | MET | 0.000 | 0.076 | -0.076 | 0.076 |
| 54 | MET | 79 | LEU | 0.658 | 0.583 | 0.075 | 0.075 |
| 112 | ASP | 115 | VAL | 0.000 | 0.074 | -0.074 | 0.074 |
| 145 | THR | 148 | MET | 0.700 | 0.774 | -0.073 | 0.073 |
| 179 | THR | 186 | PHE | 0.000 | 0.072 | -0.072 | 0.072 |
| 71 | LEU | 126 | ILE | 0.639 | 0.567 | 0.072 | 0.072 |
| 67 | ASN | 133 | CYS | 0.072 | 0.000 | 0.072 | 0.072 |
| 459 | THR | 463 | THR | 0.226 | 0.155 | 0.071 | 0.071 |
| 114 | VAL | 161 | PHE | 3.149 | 3.080 | 0.069 | 0.069 |
| 376 | LYS | 380 | ILE | 0.235 | 0.165 | 0.069 | 0.069 |
| 56 | SER | 460 | PHE | 0.999 | 1.067 | -0.069 | 0.069 |
| 454 | ALA | 464 | PHE | 1.263 | 1.197 | 0.066 | 0.066 |
| 33 | VAL | 37 | THR | 0.231 | 0.295 | -0.064 | 0.064 |
| 143 | ARG | 148 | MET | 0.062 | 0.000 | 0.062 | 0.062 |
| 98 | TRP | 105 | CYS | 6.826 | 6.888 | -0.062 | 0.062 |
| 22 | SER | 23 | SER | 0.057 | 0.118 | -0.061 | 0.061 |
| 63 | LEU | 457 | ASN | 0.155 | 0.094 | 0.061 | 0.061 |
| 325 | ALA | 326 | PRO | 0.662 | 0.601 | 0.061 | 0.061 |
| 206 | LEU | 207 | PRO | 1.314 | 1.373 | -0.060 | 0.060 |
| 81 | ILE | 112 | ASP | 0.207 | 0.149 | 0.058 | 0.058 |
| 118 | ALA | 122 | ASN | 0.132 | 0.076 | 0.056 | 0.056 |
| 41 | SER | 42 | LEU | 0.155 | 0.099 | 0.056 | 0.056 |
| 78 | ASP | 81 | ILE | 0.189 | 0.133 | 0.056 | 0.056 |
| 414 | THR | 418 | VAL | 0.596 | 0.652 | -0.055 | 0.055 |
| 105 | CYS | 184 | GLN | 0.209 | 0.154 | 0.055 | 0.055 |
| 90 | THR | 94 | ILE | 1.038 | 1.093 | -0.055 | 0.055 |
| 193 | PRO | 427 | GLN | 0.000 | 0.054 | -0.054 | 0.054 |
| 338 | ARG | 364 | PRO | 0.000 | 0.054 | -0.054 | 0.054 |
| 251 | LYS | 252 | GLN | 1.214 | 1.161 | 0.053 | 0.053 |
| 126 | ILE | 130 | ARG | 0.268 | 0.215 | 0.052 | 0.052 |
| 86 | MET | 446 | SER | 0.000 | 0.051 | -0.051 | 0.051 |
| 120 | VAL | 413 | TRP | 0.331 | 0.280 | 0.050 | 0.050 |
| 145 | THR | 147 | LYS | 0.554 | 0.504 | 0.050 | 0.050 |
| 352 | GLU | 354 | VAL | 0.000 | 0.048 | -0.048 | 0.048 |
| 213 | VAL | 217 | HIS | 1.345 | 1.297 | 0.047 | 0.047 |
| 86 | MET | 87 | ASN | 0.046 | 0.000 | 0.046 | 0.046 |
| 387 | LYS | 391 | MET | 0.288 | 0.242 | 0.046 | 0.046 |
| 120 | VAL | 207 | PRO | 0.992 | 1.037 | -0.045 | 0.045 |
| 128 | PHE | 132 | PHE | 1.267 | 1.223 | 0.044 | 0.044 |
| 57 | ILE | 460 | PHE | 1.934 | 1.890 | 0.044 | 0.044 |
| 373 | VAL | 377 | PHE | 1.510 | 1.467 | 0.043 | 0.043 |
| 160 | SER | 165 | ALA | 0.042 | 0.086 | -0.043 | 0.043 |
| 38 | VAL | 42 | LEU | 0.345 | 0.303 | 0.043 | 0.043 |
| 26 | ARG | 29 | THR | 0.042 | 0.000 | 0.042 | 0.042 |
| 128 | PHE | 210 | ILE | 1.260 | 1.301 | -0.042 | 0.042 |
| 175 | VAL | 177 | LYS | 0.312 | 0.354 | -0.042 | 0.042 |
| 257 | PRO | 258 | PRO | 0.014 | 0.055 | -0.041 | 0.041 |
| 136 | LYS | 137 | PRO | 0.083 | 0.123 | -0.041 | 0.041 |
| 44 | LEU | 48 | VAL | 0.618 | 0.579 | 0.039 | 0.039 |
| 430 | ILE | 431 | PRO | 0.669 | 0.631 | 0.038 | 0.038 |
| 121 | MET | 156 | ALA | 1.395 | 1.433 | -0.038 | 0.038 |
| 118 | ALA | 160 | SER | 4.097 | 4.134 | -0.037 | 0.037 |
| 409 | PHE | 414 | THR | 0.091 | 0.054 | 0.037 | 0.037 |
| 306 | LYS | 307 | GLU | 0.036 | 0.000 | 0.036 | 0.036 |
| 47 | VAL | 82 | GLY | 1.513 | 1.476 | 0.036 | 0.036 |
| 196 | THR | 421 | LEU | 0.036 | 0.000 | 0.036 | 0.036 |
| 394 | ARG | 398 | VAL | 0.035 | 0.000 | 0.035 | 0.035 |
| 358 | GLU | 360 | VAL | 0.033 | 0.000 | 0.033 | 0.033 |
| 161 | PHE | 162 | VAL | 0.118 | 0.151 | -0.033 | 0.033 |
| 95 | LYS | 99 | PRO | 0.183 | 0.151 | 0.032 | 0.032 |
| 47 | VAL | 51 | ILE | 0.716 | 0.685 | 0.031 | 0.031 |
| 387 | LYS | 390 | GLN | 0.031 | 0.000 | 0.031 | 0.031 |
| 430 | ILE | 434 | VAL | 0.527 | 0.558 | -0.031 | 0.031 |
| 29 | THR | 33 | VAL | 0.000 | 0.031 | -0.031 | 0.031 |
| 114 | VAL | 164 | TRP | 1.117 | 1.147 | -0.030 | 0.030 |
| 452 | CYS | 457 | ASN | 0.000 | 0.029 | -0.029 | 0.029 |
| 66 | VAL | 69 | TYR | 0.027 | 0.000 | 0.027 | 0.027 |
| 85 | SER | 112 | ASP | 5.860 | 5.886 | -0.026 | 0.026 |
| 36 | ALA | 41 | SER | 0.000 | 0.024 | -0.024 | 0.024 |
| 17 | ARG | 20 | THR | 0.000 | 0.023 | -0.023 | 0.023 |
| 431 | PRO | 434 | VAL | 1.364 | 1.342 | 0.022 | 0.022 |
| 81 | ILE | 119 | SER | 0.022 | 0.000 | 0.022 | 0.022 |
| 165 | ALA | 169 | LEU | 0.000 | 0.022 | -0.022 | 0.022 |
| 66 | VAL | 146 | THR | 0.996 | 1.017 | -0.021 | 0.021 |
| 109 | LEU | 439 | TYR | 0.000 | 0.021 | -0.021 | 0.021 |
| 70 | PHE | 126 | ILE | 1.896 | 1.875 | 0.021 | 0.021 |
| 164 | TRP | 189 | PHE | 1.161 | 1.180 | -0.019 | 0.019 |
| 69 | TYR | 149 | ALA | 0.000 | 0.017 | -0.017 | 0.017 |
| 59 | VAL | 60 | ASN | 0.104 | 0.120 | -0.017 | 0.017 |
| 426 | CYS | 429 | CYS | 3.660 | 3.676 | -0.016 | 0.016 |
| 429 | CYS | 430 | ILE | 0.146 | 0.162 | -0.016 | 0.016 |
| 71 | LEU | 74 | LEU | 0.016 | 0.000 | 0.016 | 0.016 |
| 112 | ASP | 113 | TYR | 0.054 | 0.069 | -0.015 | 0.015 |
| 51 | ILE | 55 | LEU | 0.999 | 0.984 | 0.015 | 0.015 |
| 120 | VAL | 121 | MET | 0.015 | 0.000 | 0.015 | 0.015 |
| 66 | VAL | 67 | ASN | 0.000 | 0.015 | -0.015 | 0.015 |
| 135 | THR | 221 | ALA | 0.014 | 0.000 | 0.014 | 0.014 |
| 446 | SER | 449 | ASN | 0.013 | 0.000 | 0.013 | 0.013 |
| 384 | GLN | 387 | LYS | 0.013 | 0.000 | 0.013 | 0.013 |
| 158 | VAL | 162 | VAL | 0.245 | 0.233 | 0.013 | 0.013 |
| 401 | THR | 405 | ILE | 0.511 | 0.523 | -0.012 | 0.012 |
| 375 | ARG | 382 | ARG | 0.000 | 0.011 | -0.011 | 0.011 |
| 58 | LYS | 64 | GLN | 2.368 | 2.358 | 0.010 | 0.010 |
| 201 | ILE | 205 | TYR | 0.112 | 0.104 | 0.008 | 0.008 |
| 302 | THR | 303 | GLN | 0.007 | 0.000 | 0.007 | 0.007 |
| 407 | LEU | 411 | LEU | 1.726 | 1.720 | 0.006 | 0.006 |
| 344 | ILE | 346 | THR | 0.004 | 0.000 | 0.004 | 0.004 |
| 119 | SER | 445 | ASN | 0.000 | 0.003 | -0.003 | 0.003 |
| 164 | TRP | 187 | ILE | 0.099 | 0.096 | 0.003 | 0.003 |
| 57 | ILE | 64 | GLN | 3.071 | 3.068 | 0.003 | 0.003 |
| 165 | ALA | 166 | PRO | 0.845 | 0.842 | 0.003 | 0.003 |
| 132 | PHE | 136 | LYS | 0.000 | 0.003 | -0.003 | 0.003 |
| 165 | ALA | 170 | PHE | 0.000 | 0.002 | -0.002 | 0.002 |
| 445 | ASN | 448 | ILE | 0.002 | 0.000 | 0.002 | 0.002 |
| 19 | VAL | 22 | SER | 0.000 | 0.001 | -0.001 | 0.001 |
RRCS change distribution
-0.17
Mean ΔRRCS
1.54
Std Dev
-0.08
Median
Magnitude classification
14
High (|Δ| ≥ 5.0)
60
Medium (2.2 ≤ |Δ| < 5.0)
681
Low (|Δ| < 2.2)
Methods
RRCS analysis. Residue-Residue Contact Scores (RRCS) were calculated for each conformational state based on inter-atomic distances. Changes (ΔRRCS) were computed by comparing active and inactive structures predicted by AlphaFold multistate (del Alamo et al., 2022).
Significance threshold. |ΔRRCS| ≥ 2.16, computed as max(mean(|Δ|) + σ, 0.2). The 0.2 floor ensures receptors with very small overall change still surface their largest contacts.
Variant data. Population frequencies from gnomAD v4; pathogenicity predictions from AlphaMissense; conservation from ProtVar / UniProt.
Structural annotation. TM domain boundaries and generic numbering from GPCRdb.
What is RRCS?
Residue-Residue Contact Score (RRCS) measures how strongly two amino acids interact in a protein structure. When a protein changes shape (from inactive to active), these contact strengths change.
ΔRRCS (Delta RRCS) shows the difference in contact strength between states:
- Positive ΔRRCS. Contact is stronger in the active state.
- Negative ΔRRCS. Contact is stronger in the inactive state.
- Large |ΔRRCS|. Significant structural rearrangement.
Residues with large RRCS changes are critical for protein function. Mutations at these positions may disrupt the protein's ability to change shape properly.
Pathogenicity predictions
AlphaMissense predicts whether a mutation harms protein function:
- Pathogenic (score ≥ 0.564): mutation likely damages function.
- Ambiguous (0.34–0.563): effect uncertain.
- Benign (< 0.34): mutation likely tolerated.
Conservation & population data
Conservation score. How well-preserved a position is across species (0 = variable, 1 = conserved). High conservation suggests the position is critical for function.
Allele frequency. How often a variant appears in the population. Rare variants (low frequency) may be more likely to be harmful.
Sources: AlphaFold multistate · RRCS · gnomAD v4 · AlphaMissense · GPCRdb · UniProt / ProtVar