A0A3Q0KQ71_SCHMA Loading...

Putative rhodopsin-like orphan GPCR AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KQ71, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 459 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M31.3Very low36.7Very low242 Ų242132.7 Ų132.7100%1.19272%0.718SS**  0100.50-90170.6166.900108.6
2N35.9Very low37.4Very low156 Ų156123.3 Ų123.383%0.83467%0.667SS**  trans-153.298.6138.9-112.9-1.2000106.9N4N2-N4 VanDerWaalsContact C-N 3.3Å; N2-N4 PolarHBondContact O-N 3.48Å
3N34.6Very low38Very low151 Ų151119 Ų11981%0.80764%0.64SS**  trans-57.694.2163.3-84.8-13.8000107.7N5N3-N5 PolarHBondContact O-N 3.37Å
4N38.3Very low38.9Very low147 Ų147111.2 Ų111.279%0.78660%0.597SS**  trans-88.697.4153.7-88-2000106.7N2 N6N2-N4 VanDerWaalsContact C-N 3.3Å; N2-N4 PolarHBondContact O-N 3.48Å; N4-N6 PolarHBondContact O-N 3.41Å
5N35.7Very low39.5Very low132 Ų132105.6 Ų105.671%0.70657%0.57SS**  trans-33.6125.3172.2-75.4-33.9000111.8N3 N7N3-N5 PolarHBondContact O-N 3.37Å; N5-N7 PolarHBondContact O-N 3.29Å
6N35.4Very low40.4Very low140 Ų14099.8 Ų99.875%0.74954%0.538SS*.  trans-5863.6163.9-75.5-23.5000111.9N4 N8N4-N6 PolarHBondContact O-N 3.41Å; N6-N8 PolarHBondContact O-N 3.19Å; N6-N8 VanDerWaalsContact O-N 3.11Å
7N35.8Very low41.6Very low131 Ų13195.1 Ų95.170%0.70151%0.514SS*.  trans-80.775.4152-75.8-4.7000106N5 T9N5-N7 PolarHBondContact O-N 3.29Å; N7-T9 HydrophobicContact CB-CG2 4.4Å; N7-T9 PolarHBondContact O-N 3.3Å; N7-T9 PolarHBondContact O-OG1 3.24Å
8N37.9Very low43.3Very low111 Ų11193.7 Ų93.759%0.59450%0.502SS*.  trans-65.957163.2-80.2-8.2000109.1N6 T10N6-N8 PolarHBondContact O-N 3.19Å; N6-N8 VanDerWaalsContact O-N 3.11Å; N8-T10 PolarHBondContact O-N 3Å
9T36.6Very low45.4Very low113 Ų11389.3 Ų89.369%0.69348%0.478SS*.  trans-74.179.1163.852.30000105.8N7 T11N7-T9 HydrophobicContact CB-CG2 4.4Å; N7-T9 PolarHBondContact O-N 3.3Å; N7-T9 PolarHBondContact O-OG1 3.24Å; T9-T11 PolarHBondContact O-N 3.2Å
10T39.6Very low47.5Very low22 Ų2290.3 Ų90.314%0.13548%0.475CS..  trans-54.5113.6169.152.40000107.3N8 L12 Q13N8-T10 PolarHBondContact O-N 3Å; T10-L12 PolarHBondContact O-N 2.88Å; T10-Q13 PolarHBondContact O-N 2.99Å
11T43Very low49.6Very low115 Ų11589.9 Ų89.971%0.70647%0.468SS*.SBendtrans-66.1-21.3173.947.20000111T9 Q13 Q154T9-T11 PolarHBondContact O-N 3.2Å; T11-Q13 PolarHBondContact O-N 3.22Å; T11-Q154 PolarHBondContact OG1-OE1 3.03Å
12L45.1Very low52.3Low19 Ų1979.1 Ų79.110%0.09942%0.416CS..  trans-71.963.1159.1-73.5177.6000111.7T10 F14 Q154 Y259T10-L12 PolarHBondContact O-N 2.88Å; L12-F14 HydrophobicContact CB-CD2 4.03Å; L12-F14 HydrophobicContact CB-CE1 4.34Å; L12-F14 HydrophobicContact CB-CE2 3.86Å; L12-F14 HydrophobicContact CB-CG 4.39Å; L12-F14 HydrophobicContact CB-CZ 4.07Å; L12-F14 HydrophobicContact CD1-CE1 3.67Å; L12-F14 HydrophobicContact CD1-CE2 3.89Å; L12-F14 HydrophobicContact CD1-CZ 3.32Å; L12-F14 HydrophobicContact CD2-CD1 3.82Å; L12-F14 HydrophobicContact CD2-CE1 3.55Å; L12-F14 HydrophobicContact CD2-CG 4.44Å; L12-F14 HydrophobicContact CD2-CZ 4.03Å; L12-F14 HydrophobicContact CG-CE1 4.07Å; L12-F14 HydrophobicContact CG-CE2 4.32Å; L12-F14 HydrophobicContact CG-CZ 4.02Å; L12-F14 PolarHBondContact O-N 3.23Å; L12-Q154 HydrophobicContact CB-CB 4.14Å; L12-Q154 HydrophobicContact CD1-CB 3.41Å; L12-Q154 VanDerWaalsContact CD1-CB 3.41Å; L12-Q154 HydrophobicContact CD1-CG 3.16Å; L12-Q154 HydrophobicContact CG-CB 4.07Å; L12-Q154 HydrophobicContact CG-CG 3.92Å; L12-Y259 WeakPolarHBondContact CD1-O 3.42Å
13Q45.2Very low54.9Low68 Ų6877.2 Ų77.232%0.31840%0.4SS..  trans-68.279.6140.8-130-175.7-10.700104.5T10 T11 S15 L43T10-Q13 PolarHBondContact O-N 2.99Å; T11-Q13 PolarHBondContact O-N 3.22Å; Q13-S15 PolarHBondContact O-N 2.84Å; Q13-L43 HydrophobicContact CB-CD2 4.2Å; Q13-L43 HydrophobicContact CG-CD2 3.75Å
14F49.8Very low57.5Low10 Ų1073 Ų734%0.04437%0.373CS..  trans-45.3121.6172-70.9-75.8000105.1L12 F16 I152 L169 M261L12-F14 HydrophobicContact CB-CD2 4.03Å; L12-F14 HydrophobicContact CB-CE1 4.34Å; L12-F14 HydrophobicContact CB-CE2 3.86Å; L12-F14 HydrophobicContact CB-CG 4.39Å; L12-F14 HydrophobicContact CB-CZ 4.07Å; L12-F14 HydrophobicContact CD1-CE1 3.67Å; L12-F14 HydrophobicContact CD1-CE2 3.89Å; L12-F14 HydrophobicContact CD1-CZ 3.32Å; L12-F14 HydrophobicContact CD2-CD1 3.82Å; L12-F14 HydrophobicContact CD2-CE1 3.55Å; L12-F14 HydrophobicContact CD2-CG 4.44Å; L12-F14 HydrophobicContact CD2-CZ 4.03Å; L12-F14 HydrophobicContact CG-CE1 4.07Å; L12-F14 HydrophobicContact CG-CE2 4.32Å; L12-F14 HydrophobicContact CG-CZ 4.02Å; L12-F14 PolarHBondContact O-N 3.23Å; F14-F16 HydrophobicContact CB-CD2 4.37Å; F14-F16 HydrophobicContact CB-CE1 4.26Å; F14-F16 HydrophobicContact CB-CE2 4Å; F14-F16 HydrophobicContact CB-CZ 3.87Å; F14-F16 HydrophobicContact CD2-CZ 4.19Å; F14-F16 HydrophobicContact CG-CZ 4.43Å; F14-F16 WeakPolarHBondContact O-CD2 3.09Å; F14-F16 PolarHBondContact O-N 2.93Å; F14-I152 HydrophobicContact CD2-CG2 3.83Å; F14-I152 HydrophobicContact CE2-CG2 3.62Å; F14-L169 HydrophobicContact CD2-CD2 4.21Å; F14-L169 HydrophobicContact CE2-CD2 3.32Å; F14-L169 HydrophobicContact CZ-CD2 3.56Å; F14-M261 HydrophobicContact CD1-CB 3.76Å; F14-M261 HydrophobicContact CD1-CG 4.16Å; F14-M261 HydrophobicContact CD1-SD 3.39Å; F14-M261 WeakPolarHBondContact CD1-SD 3.45Å; F14-M261 HydrophobicContact CE1-CB 3.29Å; F14-M261 HydrophobicContact CE1-CG 4.04Å; F14-M261 HydrophobicContact CE1-SD 3.54Å; F14-M261 VanDerWaalsContact CE1-SD 3.54Å; F14-M261 HydrophobicContact CG-SD 4.07Å; F14-M261 HydrophobicContact CZ-CB 4.32Å; F14-M261 HydrophobicContact CZ-SD 4.27Å
15S48.4Very low59.9Low27 Ų2769.4 Ų69.419%0.18935%0.353CS..  trans-60.493155.5-169.40000103.4Q13 T17 M41Q13-S15 PolarHBondContact O-N 2.84Å; S15-T17 PolarHBondContact O-N 2.94Å; S15-T17 PolarHBondContact O-OG1 3.13Å; S15-T17 VanDerWaalsContact O-OG1 3.08Å; S15-M41 PolarHBondContact OG-SD 2.98Å; S15-M41 VanDerWaalsContact OG-SD 3.33Å
16F54.1Low62.4Low13 Ų1363.9 Ų63.96%0.05733%0.328CS..  trans-60.969.8156.8-63-76.7000105.2F14 S148 I152 P173F14-F16 HydrophobicContact CB-CD2 4.37Å; F14-F16 HydrophobicContact CB-CE1 4.26Å; F14-F16 HydrophobicContact CB-CE2 4Å; F14-F16 HydrophobicContact CB-CZ 3.87Å; F14-F16 HydrophobicContact CD2-CZ 4.19Å; F14-F16 HydrophobicContact CG-CZ 4.43Å; F14-F16 WeakPolarHBondContact O-CD2 3.09Å; F14-F16 PolarHBondContact O-N 2.93Å; F16-S148 VanDerWaalsContact CE2-CB 3.49Å; F16-S148 WeakPolarHBondContact CE2-OG 3.4Å; F16-I152 HydrophobicContact CE1-CD1 3.71Å; F16-I152 HydrophobicContact CE2-CD1 4.02Å; F16-I152 HydrophobicContact CZ-CD1 3.13Å; F16-I152 HydrophobicContact CZ-CG1 4.48Å; F16-P173 HydrophobicContact CD1-CB 3.77Å; F16-P173 HydrophobicContact CD1-CG 3.66Å; F16-P173 HydrophobicContact CE1-CB 4.35Å; F16-P173 HydrophobicContact CE1-CG 3.72Å
17T59.9Low64.9Low20 Ų2060.4 Ų60.412%0.12331%0.309CS..  trans-57.2140.7153.824.40000104.4S15 Y19 M41S15-T17 PolarHBondContact O-N 2.94Å; S15-T17 PolarHBondContact O-OG1 3.13Å; S15-T17 VanDerWaalsContact O-OG1 3.08Å; T17-Y19 WeakPolarHBondContact O-CD2 3.22Å; T17-Y19 VanDerWaalsContact O-CG 3.28Å; T17-Y19 PolarHBondContact O-N 2.88Å; T17-Y19 WeakPolarHBondContact OG1-CE1 3.27Å; T17-Y19 WeakPolarHBondContact OG1-CE2 3.49Å; T17-Y19 PolarHBondContact OG1-OH 3.03Å; T17-M41 HydrophobicContact CG2-CE 3.64Å; T17-M41 HydrophobicContact CG2-SD 3.74Å
18F72.7Confident67.2Low70 Ų7054.5 Ų54.531%0.30728%0.277SS..  trans-7075.5-167.5-53.6-85.7000109.6Y20 F141 N177 M180F18-Y20 PolarHBondContact O-N 2.82Å; F18-F141 AromaticContact CD1-CE2 3.84Å; F18-F141 HydrophobicContact CD1-CE2 3.84Å; F18-F141 HydrophobicContact CD1-CZ 4.31Å; F18-F141 HydrophobicContact CE1-CD2 4.28Å; F18-F141 HydrophobicContact CE1-CE1 4.4Å; F18-F141 AromaticContact CE1-CE2 3.22Å; F18-F141 HydrophobicContact CE1-CE2 3.22Å; F18-F141 AromaticContact CE1-CZ 3.32Å; F18-F141 HydrophobicContact CE1-CZ 3.32Å; F18-F141 HydrophobicContact CZ-CE2 4.21Å; F18-F141 AromaticContact CZ-CZ 3.86Å; F18-F141 HydrophobicContact CZ-CZ 3.86Å; F18-N177 VanDerWaalsContact C-CG 3.5Å; F18-N177 HydrophobicContact CB-CB 4.14Å; F18-N177 VanDerWaalsContact CB-OD1 3.3Å; F18-N177 WeakPolarHBondContact CB-OD1 3.42Å; F18-N177 VanDerWaalsContact O-CG 3.31Å; F18-N177 PolarHBondContact O-ND2 3.46Å; F18-N177 PolarHBondContact O-OD1 3.37Å; F18-M180 HydrophobicContact CD1-CB 3.79Å; F18-M180 HydrophobicContact CD1-CG 3.98Å; F18-M180 HydrophobicContact CE1-CB 3.66Å; F18-M180 HydrophobicContact CE1-CE 3.61Å; F18-M180 HydrophobicContact CE1-CG 3.51Å; F18-M180 HydrophobicContact CE1-SD 4.4Å; F18-M180 HydrophobicContact CZ-CE 3.93Å; F18-M180 HydrophobicContact CZ-CG 4.15Å
19Y83.3Confident69.2Low10 Ų1053.1 Ų53.14%0.03927%0.27CS..  trans-73.7131.9-170.6-62.5-60.9000110.9T17 P173 N177 Y246 I247 M261T17-Y19 WeakPolarHBondContact O-CD2 3.22Å; T17-Y19 VanDerWaalsContact O-CG 3.28Å; T17-Y19 PolarHBondContact O-N 2.88Å; T17-Y19 WeakPolarHBondContact OG1-CE1 3.27Å; T17-Y19 WeakPolarHBondContact OG1-CE2 3.49Å; T17-Y19 PolarHBondContact OG1-OH 3.03Å; Y19-P173 HydrophobicContact CD2-CB 3.81Å; Y19-N177 VanDerWaalsContact C-ND2 3.31Å; Y19-N177 VanDerWaalsContact O-CB 3.3Å; Y19-N177 WeakPolarHBondContact O-CB 3.41Å; Y19-N177 PolarHBondContact O-ND2 2.88Å; Y19-Y246 WeakPolarHBondContact CA-O 3.32Å; Y19-I247 VanDerWaalsContact CD1-C 3.46Å; Y19-M261 HydrophobicContact CD2-CE 3.87Å; Y19-M261 HydrophobicContact CE2-CE 3.62Å
20Y88.4Confident71.2Confident109 Ų10956.1 Ų56.143%0.42728%0.276SS..SBendtrans-65.2-43.1175.5-179.7-120.7000111.7F18 N177 T244 Y246 Y266F18-Y20 PolarHBondContact O-N 2.82Å; Y20-N177 WeakPolarHBondContact CA-ND2 3.25Å; Y20-N177 PolarHBondContact N-ND2 2.79Å; Y20-T244 HydrophobicContact CD2-CG2 3.84Å; Y20-T244 HydrophobicContact CE2-CG2 3.94Å; Y20-T244 HydrophobicContact CG-CG2 4.32Å; Y20-Y246 PolarHBondContact N-O 2.63Å; Y20-Y266 AromaticContact CD1-CD1 3.9Å; Y20-Y266 HydrophobicContact CD1-CD1 3.9Å; Y20-Y266 AromaticContact CD1-CE1 3.61Å; Y20-Y266 HydrophobicContact CD1-CE1 3.61Å; Y20-Y266 AromaticContact CE1-CE1 3.8Å; Y20-Y266 HydrophobicContact CE1-CE1 3.8Å
21Y90.6Very high73Confident82 Ų8257.8 Ų57.832%0.32228%0.284SS..  trans-152.3165.8166.970.8-89.4000110.9K23 I247 S248 Y266Y21-K23 HydrophobicContact CD2-CB 4.45Å; Y21-K23 HydrophobicContact CE2-CB 3.99Å; Y21-I247 HydrophobicContact CD1-CB 4.4Å; Y21-I247 HydrophobicContact CD1-CG2 3.49Å; Y21-I247 VanDerWaalsContact CD1-CG2 3.49Å; Y21-I247 HydrophobicContact CE1-CB 4.06Å; Y21-I247 HydrophobicContact CE1-CD1 4.47Å; Y21-I247 HydrophobicContact CE1-CG2 3.14Å; Y21-I247 HydrophobicContact CE2-CG2 4.4Å; Y21-I247 HydrophobicContact CG-CG2 4.24Å; Y21-I247 WeakPolarHBondContact OH-CD1 3.48Å; Y21-S248 PolarHBondContact O-N 2.72Å; Y21-Y266 HydrophobicContact CE1-CD2 4.35Å; Y21-Y266 HydrophobicContact CE1-CE1 4.48Å; Y21-Y266 HydrophobicContact CE1-CE2 4.07Å
22V89Confident74.5Confident15 Ų1560.4 Ų60.49%0.09129%0.294CS..EExtended strand (participates in β ladder)trans-114124.4176-1760000109.2I170 P173 V174 S248 L250 M261V22-I170 HydrophobicContact CB-CB 4.46Å; V22-I170 HydrophobicContact CB-CG2 4.2Å; V22-I170 HydrophobicContact CG1-CG1 4.21Å; V22-I170 WeakPolarHBondContact CG2-O 3.24Å; V22-P173 HydrophobicContact CG2-CB 4.24Å; V22-P173 HydrophobicContact CG2-CG 4.05Å; V22-V174 HydrophobicContact CG2-CG2 4.14Å; V22-S248 CarbonylContact C-O 3.44Å; V22-S248 WeakPolarHBondContact CA-O 3.35Å; V22-L250 HydrophobicContact CG1-CB 3.88Å; V22-L250 HydrophobicContact CG1-CD2 4.41Å; V22-M261 HydrophobicContact CG1-CE 4.26Å; V22-M261 HydrophobicContact CG2-CE 4.1Å
23K90.4Very high75.8Confident116 Ų11662.2 Ų62.250%0.50430%0.303SS..EExtended strand (participates in β ladder)trans-102.7116.9177.5-169.9177.6178.1-178.90110.1Y21 S248 L249 L250Y21-K23 HydrophobicContact CD2-CB 4.45Å; Y21-K23 HydrophobicContact CE2-CB 3.99Å; K23-S248 PolarHBondContact N-O 2.65Å; K23-L249 HydrophobicContact CB-CD2 3.97Å; K23-L249 HydrophobicContact CD-CD2 4.25Å; K23-L250 PolarHBondContact O-N 3.11Å
24Y88.8Confident77Confident63 Ų6364.6 Ų64.625%0.24733%0.328CS..EExtended strand (participates in β ladder)trans-79.2121.9169.3-175.1-113.9000110.4P165 L250Y24-P165 HydrophobicContact CD1-CG 4.06Å; Y24-P165 HydrophobicContact CD2-CB 3.89Å; Y24-P165 HydrophobicContact CD2-CG 4Å; Y24-P165 HydrophobicContact CE1-CG 4.29Å; Y24-P165 HydrophobicContact CE2-CB 3.83Å; Y24-P165 HydrophobicContact CE2-CG 4.24Å; Y24-P165 HydrophobicContact CG-CB 4.31Å; Y24-P165 HydrophobicContact CG-CG 3.89Å; Y24-L250 CarbonylContact C-O 3.56Å; Y24-L250 WeakPolarHBondContact CA-O 3.36Å; Y24-L250 HydrophobicContact CD2-CB 4.34Å; Y24-L250 HydrophobicContact CD2-CD2 3.99Å; Y24-L250 HydrophobicContact CD2-CG 3.97Å; Y24-L250 WeakPolarHBondContact CD2-O 3.41Å
25I88.5Confident78Confident71 Ų7167.9 Ų67.936%0.36435%0.345SS..EExtended strand (participates in β ladder)trans-94.4-23-177.7-59.4168.8000111.6L31 L249 L250 W262I25-L31 HydrophobicContact CD1-CD1 4.34Å; I25-L31 HydrophobicContact CG2-CD1 4.25Å; I25-L249 HydrophobicContact CD1-CB 3.69Å; I25-L249 HydrophobicContact CD1-CD1 3.95Å; I25-L249 HydrophobicContact CD1-CD2 4.03Å; I25-L249 HydrophobicContact CD1-CG 4.08Å; I25-L250 PolarHBondContact N-O 2.66Å; I25-W262 HydrophobicContact CD1-CH2 3.67Å; I25-W262 HydrophobicContact CD1-CZ2 4.08Å
26G87.7Confident79Confident17 Ų1767.2 Ų67.218%0.17534%0.339CS..EExtended strand (participates in β ladder)trans104.8-133-171.400000111.7C251 Y252G26-C251 CarbonylContact O-C 3.53Å; G26-C251 VanDerWaalsContact O-CA 3.28Å; G26-C251 WeakPolarHBondContact O-CA 3.34Å; G26-C251 WeakPolarHBondContact O-CB 3.01Å; G26-Y252 PolarHBondContact O-N 2.93Å
27L87.2Confident79.7Confident66 Ų6670.9 Ų70.935%0.34635%0.354SS..EExtended strand (participates in β ladder)trans-77.2140.3-177.2-65.4172.8000112.4N29 Y252L27-N29 PolarHBondContact O-N 3.46Å; L27-Y252 CarbonylContact C-O 3.35Å; L27-Y252 WeakPolarHBondContact CA-O 3.24Å; L27-Y252 HydrophobicContact CD2-CD1 4.07Å
28C85.2Confident79.7Confident7 Ų771.7 Ų71.75%0.04737%0.366CS..G310 helixtrans-71.8-14.9177.1-57.30000113.4H30 L31 C251 Y252 D253C28-H30 PolarHBondContact O-N 2.91Å; C28-L31 WeakPolarHBondContact O-CB 3.42Å; C28-L31 PolarHBondContact O-N 3.32Å; C28-C251 HydrophobicContact CB-CB 4.08Å; C28-C251 WeakPolarHBondContact CB-SG 3.44Å; C28-C251 WeakPolarHBondContact SG-CB 3.38Å; C28-C251 CovalentContact SG-SG 2.04Å; C28-C251 PolarHBondContact SG-SG 3.08Å; C28-Y252 PolarHBondContact N-O 3.48Å; C28-Y252 PolarHBondContact SG-N 3.42Å; C28-Y252 VanDerWaalsContact SG-N 3.45Å; C28-D253 HydrophobicContact CB-CB 4.17Å; C28-D253 PolarHBondContact SG-N 3.41Å
29N80.5Confident78.7Confident82 Ų8277.4 Ų77.444%0.43939%0.391SS..G310 helixtrans-58.6-24.9-169.1-58.1-5000114.8L27 S254L27-N29 PolarHBondContact O-N 3.46Å; N29-S254 PolarHBondContact ND2-OG 2.63Å; N29-S254 VanDerWaalsContact ND2-OG 3.11Å; N29-S254 PolarHBondContact OD1-OG 3.42Å
30H76.9Confident77.1Confident177 Ų17781.4 Ų81.482%0.81942%0.42SS*.G310 helixtrans-93.1-2.2179.3-59.6-63.4000113.7C28C28-H30 PolarHBondContact O-N 2.91Å
31L78.7Confident75.4Confident57 Ų5780.1 Ų80.130%0.29842%0.419SS..  trans-104.1124.9-173.2-67159.6000109.9I25 C28 I36 C251 W262I25-L31 HydrophobicContact CD1-CD1 4.34Å; I25-L31 HydrophobicContact CG2-CD1 4.25Å; C28-L31 WeakPolarHBondContact O-CB 3.42Å; C28-L31 PolarHBondContact O-N 3.32Å; L31-I36 HydrophobicContact CB-CD1 3.66Å; L31-I36 WeakPolarHBondContact O-CD1 3.39Å; L31-C251 HydrophobicContact CD1-CB 4.05Å; L31-W262 HydrophobicContact CD1-CH2 3.63Å; L31-W262 HydrophobicContact CD1-CZ2 4.43Å; L31-W262 HydrophobicContact CD1-CZ3 4.45Å; L31-W262 HydrophobicContact CD2-CH2 4.5Å
32N74.3Confident73.6Confident170 Ų17080 Ų8091%0.90942%0.423SS*.  trans-104.528.6178.3-15719.9000112.3
33D71.6Confident72.3Confident57 Ų5780.5 Ų80.531%0.30543%0.425SS..  trans-84.1118.4-180-170.6-14.4000110.1N35 I36 W262D33-N35 PolarHBondContact O-N 2.9Å; D33-N35 WeakPolarHBondContact OD1-CB 2.96Å; D33-N35 PolarHBondContact OD1-N 3.26Å; D33-N35 PolarHBondContact OD1-ND2 2.77Å; D33-N35 VanDerWaalsContact OD1-ND2 3.07Å; D33-I36 HydrophobicContact CB-CD1 4.28Å; D33-I36 HydrophobicContact CB-CG1 3.98Å; D33-I36 WeakPolarHBondContact O-CD1 3.41Å; D33-I36 WeakPolarHBondContact O-CG1 3.09Å; D33-I36 PolarHBondContact O-N 3.28Å; D33-I36 VanDerWaalsContact O-N 3.14Å; D33-W262 PolarHBondContact OD2-NE1 3.02Å
34S70.4Confident70.8Confident118 Ų11876.1 Ų76.183%0.82541%0.408SS*.THydrogen-bonded Turntrans-61.7-13.7177.356.30000113.5
35N71.9Confident69.9Low78 Ų7878 Ų7842%0.41742%0.419SS..THydrogen-bonded Turntrans-94.94.6178.2-56.1-63.8000114.3D33 Y37 G38 W262D33-N35 PolarHBondContact O-N 2.9Å; D33-N35 WeakPolarHBondContact OD1-CB 2.96Å; D33-N35 PolarHBondContact OD1-N 3.26Å; D33-N35 PolarHBondContact OD1-ND2 2.77Å; D33-N35 VanDerWaalsContact OD1-ND2 3.07Å; N35-Y37 PolarHBondContact O-N 3.09Å; N35-Y37 VanDerWaalsContact O-N 3.16Å; N35-G38 VanDerWaalsContact O-CA 3.29Å; N35-G38 WeakPolarHBondContact O-CA 3.28Å; N35-G38 PolarHBondContact O-N 2.85Å; N35-W262 WeakPolarHBondContact O-CB 3.34Å
36I69.7Low69.1Low13 Ų1377.6 Ų77.67%0.06742%0.421CS..THydrogen-bonded Turntrans-53.6-38.7-177.7-71.9161.3000112.5L31 D33 G260 M261 W262L31-I36 HydrophobicContact CB-CD1 3.66Å; L31-I36 WeakPolarHBondContact O-CD1 3.39Å; D33-I36 HydrophobicContact CB-CD1 4.28Å; D33-I36 HydrophobicContact CB-CG1 3.98Å; D33-I36 WeakPolarHBondContact O-CD1 3.41Å; D33-I36 WeakPolarHBondContact O-CG1 3.09Å; D33-I36 PolarHBondContact O-N 3.28Å; D33-I36 VanDerWaalsContact O-N 3.14Å; I36-G260 CarbonylContact O-C 3.49Å; I36-G260 WeakPolarHBondContact O-CA 3.47Å; I36-M261 PolarHBondContact O-N 3.48Å; I36-W262 HydrophobicContact CB-CE3 4.44Å; I36-W262 HydrophobicContact CG1-CE3 4.25Å; I36-W262 HydrophobicContact CG1-CH2 4.38Å; I36-W262 HydrophobicContact CG1-CZ3 4.14Å; I36-W262 HydrophobicContact CG2-CZ3 4.43Å
37Y69.2Low68.7Low91 Ų9184.6 Ų84.636%0.35745%0.446SS..THydrogen-bonded Turntrans-92.3-1.2175.8-63-60.6000114.1N35 D253 Q258N35-Y37 PolarHBondContact O-N 3.09Å; N35-Y37 VanDerWaalsContact O-N 3.16Å; Y37-D253 WeakPolarHBondContact OH-CB 3.26Å; Y37-D253 PolarHBondContact OH-OD2 3.15Å; Y37-Q258 HydrophobicContact CE1-CG 3.88Å; Y37-Q258 PolarHBondContact OH-NE2 2.91Å
38G58.9Low68.6Low37 Ų3784.8 Ų84.838%0.38145%0.445SS..  trans61.6142.9178.900000114N35 S40N35-G38 VanDerWaalsContact O-CA 3.29Å; N35-G38 WeakPolarHBondContact O-CA 3.28Å; N35-G38 PolarHBondContact O-N 2.85Å; G38-S40 PolarHBondContact O-N 2.7Å
39K51.2Low68.6Low190 Ų19084.7 Ų84.783%0.82644%0.444SS*.  trans-72.6122.4150.8-73.4178.6-179.8174.50106.1M41K39-M41 PolarHBondContact O-N 3.32Å
40S50.3Low69.1Low93 Ų9385.3 Ų85.365%0.6545%0.446SS*.  trans-51.1110.9170.854.80000108.2G38 I42G38-S40 PolarHBondContact O-N 2.7Å; S40-I42 PolarHBondContact O-N 3.47Å
41M52.3Low69.9Low83 Ų8379.9 Ų79.941%0.40943%0.427SS..  trans-55.9138.2162.2-72.2-172.9-16800106.1S15 T17 K39 L43S15-M41 PolarHBondContact OG-SD 2.98Å; S15-M41 VanDerWaalsContact OG-SD 3.33Å; T17-M41 HydrophobicContact CG2-CE 3.64Å; T17-M41 HydrophobicContact CG2-SD 3.74Å; K39-M41 PolarHBondContact O-N 3.32Å; M41-L43 VanDerWaalsContact C-N 3.28Å; M41-L43 WeakPolarHBondContact O-CD1 3.37Å; M41-L43 PolarHBondContact O-N 3.31Å
42I53.1Low70.6Confident78 Ų7877.7 Ų77.740%0.442%0.415SS..  trans-64.795.9179.5-60.4149.9000106.7S40 N380S40-I42 PolarHBondContact O-N 3.47Å; I42-N380 HydrophobicContact CD1-CB 3.42Å; I42-N380 VanDerWaalsContact CD1-CB 3.42Å
43L60.9Low71.6Confident26 Ų2670.7 Ų70.714%0.13638%0.377CS..PPolyproline II helixtrans-66.5141.5170.4-92.268.9000107.3Q13 M41 Q45Q13-L43 HydrophobicContact CB-CD2 4.2Å; Q13-L43 HydrophobicContact CG-CD2 3.75Å; M41-L43 VanDerWaalsContact C-N 3.28Å; M41-L43 WeakPolarHBondContact O-CD1 3.37Å; M41-L43 PolarHBondContact O-N 3.31Å; L43-Q45 PolarHBondContact O-N 3.36Å
44P59.4Low72.7Confident24 Ų2471.2 Ų71.216%0.15638%0.384CS..PPolyproline II helixtrans-59.4139.1170.227.3-33.2000108.7T46 Q49P44-T46 PolarHBondContact O-N 2.74Å; P44-Q49 HydrophobicContact CB-CG 4.41Å; P44-Q49 HydrophobicContact CG-CG 4.13Å; P44-Q49 VanDerWaalsContact CG-NE2 3.31Å
45Q69.8Low74Confident102 Ų10269 Ų6948%0.47736%0.36SS..PPolyproline II helixtrans-54.8136.7179-57-176.4-4.900109.7L43 K47 H48L43-Q45 PolarHBondContact O-N 3.36Å; Q45-K47 PolarHBondContact O-N 2.7Å; Q45-K47 VanDerWaalsContact O-N 3.08Å; Q45-H48 PolarHBondContact O-N 2.84Å; Q45-H48 PolarHBondContact OE1-NE2 2.92Å
46T72Confident75.3Confident64 Ų6465.3 Ų65.339%0.39334%0.34SS..Hα-helixtrans-50.8-38.6-178.949.90000111.9P44 H48 Q49P44-T46 PolarHBondContact O-N 2.74Å; T46-H48 VanDerWaalsContact C-N 3.32Å; T46-H48 PolarHBondContact O-N 2.84Å; T46-Q49 PolarHBondContact O-N 2.7Å; T46-Q49 VanDerWaalsContact O-N 3.13Å
47K79.8Confident76.6Confident163 Ų16369.4 Ų69.471%0.70936%0.358SS*.Hα-helixtrans-58.1-37.8176.5-64.1-175.2-179.7-179.90113.7Q45 Q49Q45-K47 PolarHBondContact O-N 2.7Å; Q45-K47 VanDerWaalsContact O-N 3.08Å; K47-Q49 VanDerWaalsContact C-N 3.28Å; K47-Q49 PolarHBondContact O-N 2.75Å
48H84.2Confident78Confident71 Ų7168.6 Ų68.633%0.32936%0.359SS..Hα-helixtrans-74.6-18.3-179.8-64.8-48.7000113.2Q45 T46 T388Q45-H48 PolarHBondContact O-N 2.84Å; Q45-H48 PolarHBondContact OE1-NE2 2.92Å; T46-H48 VanDerWaalsContact C-N 3.32Å; T46-H48 PolarHBondContact O-N 2.84Å; H48-T388 WeakPolarHBondContact O-CG2 3.19Å
49Q86Confident79.9Confident5 Ų566.9 Ų66.92%0.02334%0.341CS..Hα-helixtrans-85-20179.8-60-59.6-67.100113.2P44 T46 K47 F52 I53 K142 V146 T388P44-Q49 HydrophobicContact CB-CG 4.41Å; P44-Q49 HydrophobicContact CG-CG 4.13Å; P44-Q49 VanDerWaalsContact CG-NE2 3.31Å; T46-Q49 PolarHBondContact O-N 2.7Å; T46-Q49 VanDerWaalsContact O-N 3.13Å; K47-Q49 VanDerWaalsContact C-N 3.28Å; K47-Q49 PolarHBondContact O-N 2.75Å; Q49-F52 PolarHBondContact O-N 3.37Å; Q49-I53 WeakPolarHBondContact O-CG1 3.34Å; Q49-I53 PolarHBondContact O-N 3.47Å; Q49-K142 VanDerWaalsContact OE1-CE 3.3Å; Q49-V146 HydrophobicContact CB-CG2 4.22Å; Q49-T388 VanDerWaalsContact NE2-CG2 3.28Å; Q49-T388 PolarHBondContact NE2-OG1 3.48Å
50I91Very high82.1Confident95 Ų9559.4 Ų59.449%0.48731%0.308SS..Hα-helixtrans-55.7-48-176.9-60.3171.1000112.3F52 I53 C54I50-F52 VanDerWaalsContact C-N 3.32Å; I50-F52 PolarHBondContact O-N 2.98Å; I50-I53 PolarHBondContact O-N 2.88Å; I50-C54 PolarHBondContact O-N 3.38Å; I50-C54 PolarHBondContact O-SG 3.34Å; I50-C54 VanDerWaalsContact O-SG 3.36Å
51P92.7Very high84.4Confident62 Ų6258.2 Ų58.240%0.40329%0.294SS..Hα-helixtrans-59-42.9178.8-24.335.4000112.6I53 C54 F55P51-I53 PolarHBondContact O-N 3.31Å; P51-C54 PolarHBondContact O-N 3.18Å; P51-F55 HydrophobicContact CB-CD2 4.43Å; P51-F55 HydrophobicContact CB-CE2 4.43Å; P51-F55 WeakPolarHBondContact O-CD2 3.43Å; P51-F55 PolarHBondContact O-N 3.02Å
52F93.8Very high86.6Confident12 Ų1255.5 Ų55.55%0.05328%0.281CS..Hα-helixtrans-61.8-42.6178.4178.8-88.9000111.9Q49 I50 F55 T56 A138 K142 N391 T395Q49-F52 PolarHBondContact O-N 3.37Å; I50-F52 VanDerWaalsContact C-N 3.32Å; I50-F52 PolarHBondContact O-N 2.98Å; F52-F55 PolarHBondContact O-N 3.27Å; F52-T56 HydrophobicContact CD1-CG2 4.07Å; F52-T56 HydrophobicContact CD2-CG2 4.41Å; F52-T56 HydrophobicContact CE1-CG2 3.57Å; F52-T56 HydrophobicContact CE2-CG2 3.93Å; F52-T56 HydrophobicContact CG-CG2 4.49Å; F52-T56 HydrophobicContact CZ-CG2 3.51Å; F52-T56 WeakPolarHBondContact O-CB 3.15Å; F52-T56 WeakPolarHBondContact O-CG2 3.47Å; F52-T56 PolarHBondContact O-N 3.29Å; F52-T56 PolarHBondContact O-OG1 3.33Å; F52-A138 HydrophobicContact CE1-CB 4.25Å; F52-A138 HydrophobicContact CZ-CB 4.05Å; F52-K142 HydrophobicContact CD1-CB 4.34Å; F52-K142 HydrophobicContact CD1-CD 4.37Å; F52-K142 HydrophobicContact CD1-CG 3.55Å; F52-K142 HydrophobicContact CE1-CB 4.36Å; F52-K142 HydrophobicContact CE1-CD 4.33Å; F52-K142 HydrophobicContact CE1-CG 3.38Å; F52-N391 HydrophobicContact CD2-CB 3.93Å; F52-N391 HydrophobicContact CE2-CB 3.59Å; F52-N391 WeakPolarHBondContact CE2-O 3.44Å; F52-N391 HydrophobicContact CZ-CB 4.44Å; F52-T395 WeakPolarHBondContact CE2-OG1 3.39Å
53I94.8Very high88.7Confident23 Ų2351.8 Ų51.812%0.11826%0.262CS..Hα-helixtrans-61.2-46.1175.9-66.1168000110.6Q49 I50 P51 T56 F57 F139 K142 V146Q49-I53 WeakPolarHBondContact O-CG1 3.34Å; Q49-I53 PolarHBondContact O-N 3.47Å; I50-I53 PolarHBondContact O-N 2.88Å; P51-I53 PolarHBondContact O-N 3.31Å; I53-T56 WeakPolarHBondContact CA-OG1 3.34Å; I53-T56 PolarHBondContact O-N 3.46Å; I53-T56 PolarHBondContact O-OG1 3.08Å; I53-F57 PolarHBondContact O-N 3.49Å; I53-F57 VanDerWaalsContact O-N 3.1Å; I53-F139 HydrophobicContact CG2-CD2 3.94Å; I53-F139 HydrophobicContact CG2-CE2 3.71Å; I53-K142 HydrophobicContact CD1-CB 4.19Å; I53-K142 HydrophobicContact CG1-CB 3.67Å; I53-V146 HydrophobicContact CD1-CB 4.38Å; I53-V146 HydrophobicContact CD1-CG2 3.77Å
54C96.6Very high90.5Very high67 Ų6754 Ų5445%0.45327%0.273SS..Hα-helixtrans-61.6-47.4177.7-66.50000111.9I50 P51 F57 I58I50-C54 PolarHBondContact O-N 3.38Å; I50-C54 PolarHBondContact O-SG 3.34Å; I50-C54 VanDerWaalsContact O-SG 3.36Å; P51-C54 PolarHBondContact O-N 3.18Å; C54-F57 PolarHBondContact O-N 3.01Å; C54-I58 VanDerWaalsContact O-CG1 3.28Å; C54-I58 WeakPolarHBondContact O-CG1 3.31Å; C54-I58 PolarHBondContact O-N 3.29Å
55F97.5Very high92.2Very high72 Ų7254.6 Ų54.632%0.31628%0.275SS..Hα-helixtrans-66.5-37.9-179.8-77.1-62000112.3P51 F52 F57 I58 G59 T392 T395 I396 I399P51-F55 HydrophobicContact CB-CD2 4.43Å; P51-F55 HydrophobicContact CB-CE2 4.43Å; P51-F55 WeakPolarHBondContact O-CD2 3.43Å; P51-F55 PolarHBondContact O-N 3.02Å; F52-F55 PolarHBondContact O-N 3.27Å; F55-F57 VanDerWaalsContact C-N 3.33Å; F55-F57 PolarHBondContact O-N 3.15Å; F55-I58 PolarHBondContact O-N 3.25Å; F55-G59 PolarHBondContact O-N 3.08Å; F55-T392 HydrophobicContact CD2-CG2 3.62Å; F55-T392 HydrophobicContact CE2-CG2 4.02Å; F55-T395 HydrophobicContact CB-CG2 3.63Å; F55-T395 VanDerWaalsContact O-CG2 3.31Å; F55-T395 WeakPolarHBondContact O-CG2 3.37Å; F55-I396 HydrophobicContact CD1-CG1 4.13Å; F55-I396 HydrophobicContact CD2-CG1 4.49Å; F55-I396 HydrophobicContact CE1-CG1 4.17Å; F55-I396 HydrophobicContact CE2-CD1 4.33Å; F55-I396 HydrophobicContact CG-CG1 4.3Å; F55-I396 HydrophobicContact CZ-CD1 4.3Å; F55-I396 HydrophobicContact CZ-CG1 4.38Å; F55-I399 HydrophobicContact CB-CD1 4.24Å; F55-I399 HydrophobicContact CD1-CD1 3.61Å; F55-I399 HydrophobicContact CE1-CD1 4.48Å; F55-I399 HydrophobicContact CG-CD1 4.39Å
56T97.4Very high93.5Very high0 Ų049.7 Ų49.70%025%0.252CS..Hα-helixtrans-67.9-37.4179.245.10000110.9F52 I53 G59 F60 A138 T395F52-T56 HydrophobicContact CD1-CG2 4.07Å; F52-T56 HydrophobicContact CD2-CG2 4.41Å; F52-T56 HydrophobicContact CE1-CG2 3.57Å; F52-T56 HydrophobicContact CE2-CG2 3.93Å; F52-T56 HydrophobicContact CG-CG2 4.49Å; F52-T56 HydrophobicContact CZ-CG2 3.51Å; F52-T56 WeakPolarHBondContact O-CB 3.15Å; F52-T56 WeakPolarHBondContact O-CG2 3.47Å; F52-T56 PolarHBondContact O-N 3.29Å; F52-T56 PolarHBondContact O-OG1 3.33Å; I53-T56 WeakPolarHBondContact CA-OG1 3.34Å; I53-T56 PolarHBondContact O-N 3.46Å; I53-T56 PolarHBondContact O-OG1 3.08Å; T56-G59 PolarHBondContact O-N 3.38Å; T56-F60 WeakPolarHBondContact O-CB 3.32Å; T56-F60 PolarHBondContact O-N 3.29Å; T56-A138 HydrophobicContact CG2-CB 3.94Å; T56-T395 VanDerWaalsContact CA-CG2 3.45Å; T56-T395 HydrophobicContact CG2-CG2 3.58Å; T56-T395 VanDerWaalsContact N-CG2 3.31Å
57F98Very high94.7Very high99 Ų9948.4 Ų48.443%0.43424%0.242SC..Hα-helixtrans-62.9-47172-172.7-111.2000112.4I53 C54 F55 G59 F60 I61 F139I53-F57 PolarHBondContact O-N 3.49Å; I53-F57 VanDerWaalsContact O-N 3.1Å; C54-F57 PolarHBondContact O-N 3.01Å; F55-F57 VanDerWaalsContact C-N 3.33Å; F55-F57 PolarHBondContact O-N 3.15Å; F57-G59 PolarHBondContact O-N 3.33Å; F57-F60 WeakPolarHBondContact O-CB 3.3Å; F57-F60 PolarHBondContact O-N 3.49Å; F57-I61 HydrophobicContact CE1-CG1 4.29Å; F57-I61 HydrophobicContact CE2-CD1 4.47Å; F57-I61 HydrophobicContact CE2-CG1 4.48Å; F57-I61 HydrophobicContact CZ-CD1 4.28Å; F57-I61 HydrophobicContact CZ-CG1 4.21Å; F57-I61 WeakPolarHBondContact O-CG1 3.22Å; F57-I61 PolarHBondContact O-N 2.93Å; F57-F139 HydrophobicContact CB-CD2 3.78Å; F57-F139 HydrophobicContact CB-CE2 3.77Å; F57-F139 HydrophobicContact CB-CG 4.49Å; F57-F139 HydrophobicContact CB-CZ 4.47Å; F57-F139 HydrophobicContact CD2-CD1 4.35Å; F57-F139 HydrophobicContact CD2-CD2 4.28Å; F57-F139 AromaticContact CD2-CE1 3.98Å; F57-F139 HydrophobicContact CD2-CE1 3.98Å; F57-F139 AromaticContact CD2-CE2 3.91Å; F57-F139 HydrophobicContact CD2-CE2 3.91Å; F57-F139 HydrophobicContact CD2-CG 4.49Å; F57-F139 AromaticContact CD2-CZ 3.75Å; F57-F139 HydrophobicContact CD2-CZ 3.75Å; F57-F139 HydrophobicContact CE2-CZ 4.4Å; F57-F139 HydrophobicContact CG-CD2 4.47Å; F57-F139 HydrophobicContact CG-CE2 4.12Å; F57-F139 HydrophobicContact CG-CZ 4.36Å
58I98.3Very high95.5Very high75 Ų7544.8 Ų44.839%0.38523%0.227SC..Hα-helixtrans-60.9-46.1176.1-66.6164.5000110.6C54 F55 F60 I61 L62 I399C54-I58 VanDerWaalsContact O-CG1 3.28Å; C54-I58 WeakPolarHBondContact O-CG1 3.31Å; C54-I58 PolarHBondContact O-N 3.29Å; F55-I58 PolarHBondContact O-N 3.25Å; I58-F60 VanDerWaalsContact C-N 3.32Å; I58-F60 PolarHBondContact O-N 3.2Å; I58-I61 PolarHBondContact O-N 3.47Å; I58-L62 HydrophobicContact CG2-CD1 3.74Å; I58-L62 HydrophobicContact CG2-CG 4.21Å; I58-L62 WeakPolarHBondContact O-CG 3.39Å; I58-L62 PolarHBondContact O-N 3.39Å; I58-I399 HydrophobicContact CB-CD1 4.11Å; I58-I399 HydrophobicContact CG2-CD1 3.83Å; I58-I399 HydrophobicContact CG2-CG1 4.16Å
59G98.1Very high96Very high0 Ų041.4 Ų41.40%021%0.211CC..Hα-helixtrans-58.1-43177.100000112.1F55 T56 F57 N63F55-G59 PolarHBondContact O-N 3.08Å; T56-G59 PolarHBondContact O-N 3.38Å; F57-G59 PolarHBondContact O-N 3.33Å; G59-N63 VanDerWaalsContact O-CB 3.29Å; G59-N63 WeakPolarHBondContact O-CB 3.15Å; G59-N63 PolarHBondContact O-N 3.45Å; G59-N63 PolarHBondContact O-ND2 3.29Å
60F98.2Very high96.4Very high34 Ų3441.3 Ų41.315%0.14921%0.21CC..Hα-helixtrans-59-51.9174.4168.8-109.5000112.2T56 F57 I58 L62 N63 I64 V132 N135 L136T56-F60 WeakPolarHBondContact O-CB 3.32Å; T56-F60 PolarHBondContact O-N 3.29Å; F57-F60 WeakPolarHBondContact O-CB 3.3Å; F57-F60 PolarHBondContact O-N 3.49Å; I58-F60 VanDerWaalsContact C-N 3.32Å; I58-F60 PolarHBondContact O-N 3.2Å; F60-L62 PolarHBondContact O-N 3.41Å; F60-N63 PolarHBondContact O-N 3.41Å; F60-I64 HydrophobicContact CD1-CD1 4.43Å; F60-I64 HydrophobicContact CD2-CD1 4Å; F60-I64 HydrophobicContact CD2-CG1 4.29Å; F60-I64 HydrophobicContact CE1-CD1 3.77Å; F60-I64 HydrophobicContact CE2-CD1 3.27Å; F60-I64 HydrophobicContact CE2-CG1 3.96Å; F60-I64 HydrophobicContact CZ-CD1 3.14Å; F60-I64 HydrophobicContact CZ-CG1 4.25Å; F60-I64 PolarHBondContact O-N 3.49Å; F60-V132 HydrophobicContact CD2-CG1 4.09Å; F60-V132 HydrophobicContact CE2-CG1 3.9Å; F60-N135 HydrophobicContact CB-CB 3.88Å; F60-L136 HydrophobicContact CD2-CB 3.71Å; F60-L136 HydrophobicContact CD2-CD1 4.15Å; F60-L136 HydrophobicContact CD2-CG 4.4Å; F60-L136 HydrophobicContact CE1-CD1 4.4Å; F60-L136 HydrophobicContact CE2-CB 3.77Å; F60-L136 HydrophobicContact CE2-CD1 3.73Å; F60-L136 HydrophobicContact CE2-CD2 3.98Å; F60-L136 HydrophobicContact CE2-CG 4.03Å; F60-L136 HydrophobicContact CZ-CD1 3.86Å; F60-L136 HydrophobicContact CZ-CD2 4.5Å
61I98.3Very high96.5Very high68 Ų6840.4 Ų40.435%0.34921%0.206SC..Hα-helixtrans-61.3-48.7-178.8-64-62.3000111.3F57 I58 N63 I64 I65F57-I61 HydrophobicContact CE1-CG1 4.29Å; F57-I61 HydrophobicContact CE2-CD1 4.47Å; F57-I61 HydrophobicContact CE2-CG1 4.48Å; F57-I61 HydrophobicContact CZ-CD1 4.28Å; F57-I61 HydrophobicContact CZ-CG1 4.21Å; F57-I61 WeakPolarHBondContact O-CG1 3.22Å; F57-I61 PolarHBondContact O-N 2.93Å; I58-I61 PolarHBondContact O-N 3.47Å; I61-N63 VanDerWaalsContact C-N 3.31Å; I61-N63 PolarHBondContact O-N 3.18Å; I61-I64 PolarHBondContact O-N 3.36Å; I61-I65 HydrophobicContact CG2-CD1 3.87Å; I61-I65 VanDerWaalsContact O-CG1 3.29Å; I61-I65 WeakPolarHBondContact O-CG1 3.33Å; I61-I65 PolarHBondContact O-N 2.95Å
62L98.2Very high96.3Very high26 Ų2641.6 Ų41.614%0.13621%0.205CC..Hα-helixtrans-64.9-34.8-178.6-67.5179.2000112.6I58 F60 S66 I399 F402 F403I58-L62 HydrophobicContact CG2-CD1 3.74Å; I58-L62 HydrophobicContact CG2-CG 4.21Å; I58-L62 WeakPolarHBondContact O-CG 3.39Å; I58-L62 PolarHBondContact O-N 3.39Å; F60-L62 PolarHBondContact O-N 3.41Å; L62-S66 WeakPolarHBondContact O-CB 3.47Å; L62-S66 PolarHBondContact O-N 2.96Å; L62-S66 PolarHBondContact O-OG 3.31Å; L62-I399 HydrophobicContact CD1-CB 4.45Å; L62-I399 HydrophobicContact CD1-CG1 4.39Å; L62-I399 HydrophobicContact CD1-CG2 3.79Å; L62-F402 HydrophobicContact CB-CB 3.98Å; L62-F402 HydrophobicContact CB-CD2 4.19Å; L62-F402 HydrophobicContact CB-CG 4.03Å; L62-F402 HydrophobicContact CD1-CB 4.38Å; L62-F402 HydrophobicContact CD1-CD1 4.36Å; L62-F402 HydrophobicContact CD1-CG 4.43Å; L62-F402 HydrophobicContact CD2-CD1 3.9Å; L62-F402 HydrophobicContact CD2-CD2 4.21Å; L62-F402 HydrophobicContact CD2-CE1 3.99Å; L62-F402 HydrophobicContact CD2-CE2 4.32Å; L62-F402 HydrophobicContact CD2-CG 4.03Å; L62-F402 HydrophobicContact CD2-CZ 4.21Å; L62-F402 HydrophobicContact CG-CG 4.39Å; L62-F403 HydrophobicContact CD1-CE2 4.36Å
63N97.9Very high95.9Very high0 Ų041 Ų410%020%0.203CC..Hα-helixtrans-76.7-33.1176.9-77.9-66.2000113G59 F60 I61 S66 L67 E131 V132 S398G59-N63 VanDerWaalsContact O-CB 3.29Å; G59-N63 WeakPolarHBondContact O-CB 3.15Å; G59-N63 PolarHBondContact O-N 3.45Å; G59-N63 PolarHBondContact O-ND2 3.29Å; F60-N63 PolarHBondContact O-N 3.41Å; I61-N63 VanDerWaalsContact C-N 3.31Å; I61-N63 PolarHBondContact O-N 3.18Å; N63-S66 PolarHBondContact O-N 2.92Å; N63-L67 VanDerWaalsContact O-CB 3.23Å; N63-L67 WeakPolarHBondContact O-CB 3.38Å; N63-L67 PolarHBondContact O-N 3.33Å; N63-E131 HydrophobicContact CB-CB 3.99Å; N63-E131 PolarHBondContact OD1-OE2 3.09Å; N63-V132 HydrophobicContact CB-CG2 3.81Å; N63-S398 PolarHBondContact ND2-O 3.49Å; N63-S398 PolarHBondContact ND2-OG 3.45Å
64I97.7Very high95.1Very high72 Ų7242.2 Ų42.237%0.36921%0.21SC..Hα-helixtrans-61.7-46.4168.6-79.4-171.6000110.7F60 I61 S66 L67 F68 V132F60-I64 HydrophobicContact CD1-CD1 4.43Å; F60-I64 HydrophobicContact CD2-CD1 4Å; F60-I64 HydrophobicContact CD2-CG1 4.29Å; F60-I64 HydrophobicContact CE1-CD1 3.77Å; F60-I64 HydrophobicContact CE2-CD1 3.27Å; F60-I64 HydrophobicContact CE2-CG1 3.96Å; F60-I64 HydrophobicContact CZ-CD1 3.14Å; F60-I64 HydrophobicContact CZ-CG1 4.25Å; F60-I64 PolarHBondContact O-N 3.49Å; I61-I64 PolarHBondContact O-N 3.36Å; I64-S66 VanDerWaalsContact C-N 3.3Å; I64-S66 PolarHBondContact O-N 3.06Å; I64-L67 PolarHBondContact O-N 2.82Å; I64-F68 WeakPolarHBondContact O-CB 3.39Å; I64-F68 PolarHBondContact O-N 3.24Å; I64-V132 HydrophobicContact CD1-CG1 4.42Å; I64-V132 HydrophobicContact CG1-CG1 3.98Å; I64-V132 HydrophobicContact CG1-CG2 3.71Å
65I96.9Very high94.2Very high36 Ų3644.1 Ų44.119%0.18522%0.215CC..Hα-helixtrans-59.3-45.8176.9-69.3167.9000109.8I61 L67 F68 V69 F402 F416 F420I61-I65 HydrophobicContact CG2-CD1 3.87Å; I61-I65 VanDerWaalsContact O-CG1 3.29Å; I61-I65 WeakPolarHBondContact O-CG1 3.33Å; I61-I65 PolarHBondContact O-N 2.95Å; I65-L67 PolarHBondContact O-N 3.14Å; I65-F68 PolarHBondContact O-N 3.02Å; I65-V69 HydrophobicContact CG2-CG2 4.5Å; I65-V69 VanDerWaalsContact O-CG2 3.29Å; I65-V69 WeakPolarHBondContact O-CG2 3.36Å; I65-V69 PolarHBondContact O-N 3.38Å; I65-F402 HydrophobicContact CB-CE2 4.49Å; I65-F402 HydrophobicContact CG2-CE2 3.87Å; I65-F416 HydrophobicContact CG2-CD2 4.02Å; I65-F416 HydrophobicContact CG2-CE2 3.77Å; I65-F420 HydrophobicContact CG1-CZ 4.38Å; I65-F420 HydrophobicContact CG2-CE2 3.83Å; I65-F420 HydrophobicContact CG2-CZ 4.05Å
66S97.2Very high92.8Very high0 Ų042.9 Ų42.90%021%0.213CC..Hα-helixtrans-59.6-48.1177.5-61.50000112.1L62 N63 I64 F68 V69 F70 C128 F402L62-S66 WeakPolarHBondContact O-CB 3.47Å; L62-S66 PolarHBondContact O-N 2.96Å; L62-S66 PolarHBondContact O-OG 3.31Å; N63-S66 PolarHBondContact O-N 2.92Å; I64-S66 VanDerWaalsContact C-N 3.3Å; I64-S66 PolarHBondContact O-N 3.06Å; S66-F68 VanDerWaalsContact C-N 3.34Å; S66-F68 PolarHBondContact O-N 2.91Å; S66-V69 PolarHBondContact O-N 3.45Å; S66-F70 WeakPolarHBondContact O-CD2 3.4Å; S66-F70 PolarHBondContact O-N 2.93Å; S66-C128 VanDerWaalsContact CB-SG 3.55Å; S66-F402 WeakPolarHBondContact OG-CD2 3.49Å
67L96.7Very high91.2Very high37 Ų3747.9 Ų47.919%0.19424%0.235CC..Hα-helixtrans-59.9-45.6178.6-175.663.8000110.8N63 I64 I65 F70 L71 I125 C128 V132N63-L67 VanDerWaalsContact O-CB 3.23Å; N63-L67 WeakPolarHBondContact O-CB 3.38Å; N63-L67 PolarHBondContact O-N 3.33Å; I64-L67 PolarHBondContact O-N 2.82Å; I65-L67 PolarHBondContact O-N 3.14Å; L67-F70 PolarHBondContact O-N 3.17Å; L67-L71 HydrophobicContact CD1-CD1 4.01Å; L67-L71 HydrophobicContact CD1-CG 4.2Å; L67-L71 HydrophobicContact CG-CD1 3.84Å; L67-L71 HydrophobicContact CG-CG 4.38Å; L67-L71 VanDerWaalsContact O-CB 3.32Å; L67-L71 WeakPolarHBondContact O-CB 3.49Å; L67-L71 VanDerWaalsContact O-CG 3.27Å; L67-L71 WeakPolarHBondContact O-CG 3.45Å; L67-L71 PolarHBondContact O-N 3.5Å; L67-I125 HydrophobicContact CD1-CG2 3.89Å; L67-C128 HydrophobicContact CB-CB 4.04Å; L67-C128 HydrophobicContact CD1-CB 4.19Å; L67-V132 HydrophobicContact CD2-CG2 4.41Å
68F95.6Very high89.2Confident86 Ų8648.7 Ų48.738%0.37724%0.239SC..Hα-helixtrans-59.3-48.5176.3-175-95.3000111.6I64 I65 S66 F70 L71 F72 I419 F420I64-F68 WeakPolarHBondContact O-CB 3.39Å; I64-F68 PolarHBondContact O-N 3.24Å; I65-F68 PolarHBondContact O-N 3.02Å; S66-F68 VanDerWaalsContact C-N 3.34Å; S66-F68 PolarHBondContact O-N 2.91Å; F68-F70 VanDerWaalsContact C-N 3.34Å; F68-F70 PolarHBondContact O-N 2.95Å; F68-L71 PolarHBondContact O-N 3.01Å; F68-F72 HydrophobicContact CB-CD2 4.49Å; F68-F72 HydrophobicContact CD1-CD2 4.36Å; F68-F72 AromaticContact CD2-CD2 3.19Å; F68-F72 HydrophobicContact CD2-CD2 3.19Å; F68-F72 AromaticContact CD2-CE2 3.37Å; F68-F72 HydrophobicContact CD2-CE2 3.37Å; F68-F72 HydrophobicContact CD2-CG 4.2Å; F68-F72 HydrophobicContact CD2-CZ 4.47Å; F68-F72 HydrophobicContact CE1-CB 4.45Å; F68-F72 HydrophobicContact CE1-CD2 4.4Å; F68-F72 AromaticContact CE2-CD2 3.24Å; F68-F72 HydrophobicContact CE2-CD2 3.24Å; F68-F72 AromaticContact CE2-CE2 3.43Å; F68-F72 HydrophobicContact CE2-CE2 3.43Å; F68-F72 VanDerWaalsContact CE2-CE2 3.43Å; F68-F72 AromaticContact CE2-CG 3.87Å; F68-F72 HydrophobicContact CE2-CG 3.87Å; F68-F72 HydrophobicContact CE2-CZ 4.18Å; F68-F72 AromaticContact CG-CD2 3.78Å; F68-F72 HydrophobicContact CG-CD2 3.78Å; F68-F72 HydrophobicContact CG-CE2 4.32Å; F68-F72 HydrophobicContact CZ-CB 4.31Å; F68-F72 AromaticContact CZ-CD2 3.88Å; F68-F72 HydrophobicContact CZ-CD2 3.88Å; F68-F72 HydrophobicContact CZ-CE2 4.43Å; F68-F72 HydrophobicContact CZ-CG 4.1Å; F68-F72 WeakPolarHBondContact O-CB 3.22Å; F68-F72 WeakPolarHBondContact O-CD2 3.35Å; F68-F72 PolarHBondContact O-N 3.49Å; F68-I419 HydrophobicContact CD1-CD1 4.24Å; F68-I419 HydrophobicContact CD1-CG2 4.42Å; F68-I419 HydrophobicContact CE1-CD1 3.99Å; F68-I419 HydrophobicContact CE1-CG2 3.84Å; F68-F420 HydrophobicContact CD1-CZ 4.49Å
69V94.8Very high87Confident0 Ų054.3 Ų54.30%026%0.261CS..Hα-helixtrans-58.7-43.7177.4168.70000111.5I65 S66 G73 F412 I415 F416 I419 F420I65-V69 HydrophobicContact CG2-CG2 4.5Å; I65-V69 VanDerWaalsContact O-CG2 3.29Å; I65-V69 WeakPolarHBondContact O-CG2 3.36Å; I65-V69 PolarHBondContact O-N 3.38Å; S66-V69 PolarHBondContact O-N 3.45Å; V69-G73 WeakPolarHBondContact O-CA 3.38Å; V69-G73 PolarHBondContact O-N 3.36Å; V69-F412 HydrophobicContact CB-CD2 4.21Å; V69-F412 HydrophobicContact CB-CE2 3.83Å; V69-F412 HydrophobicContact CB-CZ 4.36Å; V69-F412 HydrophobicContact CG1-CD2 3.52Å; V69-F412 HydrophobicContact CG1-CE2 3.67Å; V69-F412 HydrophobicContact CG1-CG 4.1Å; V69-F412 HydrophobicContact CG1-CZ 4.33Å; V69-F412 HydrophobicContact CG2-CE2 4.44Å; V69-F412 HydrophobicContact CG2-CZ 4.49Å; V69-I415 HydrophobicContact CG1-CB 4.09Å; V69-I415 HydrophobicContact CG1-CG2 3.85Å; V69-F416 HydrophobicContact CG2-CB 4.37Å; V69-F416 HydrophobicContact CG2-CD2 4.27Å; V69-I419 HydrophobicContact CG2-CD1 4.43Å; V69-F420 HydrophobicContact CG2-CE2 4.18Å
70F94.4Very high84.7Confident3 Ų360 Ų601%0.01329%0.286CS..Hα-helixtrans-73.3-31178.8-70.7-55.7000113.8S66 L67 F68 K117 M121 L124 I125 F405 M409 Y411 F412S66-F70 WeakPolarHBondContact O-CD2 3.4Å; S66-F70 PolarHBondContact O-N 2.93Å; L67-F70 PolarHBondContact O-N 3.17Å; F68-F70 VanDerWaalsContact C-N 3.34Å; F68-F70 PolarHBondContact O-N 2.95Å; F70-K117 PolarHBondContact O-NZ 3.02Å; F70-M121 HydrophobicContact CD1-SD 4.15Å; F70-M121 HydrophobicContact CE1-SD 4.02Å; F70-L124 HydrophobicContact CE1-CD1 4.14Å; F70-L124 HydrophobicContact CE2-CB 4.13Å; F70-L124 HydrophobicContact CZ-CB 4.17Å; F70-L124 HydrophobicContact CZ-CD1 3.86Å; F70-I125 HydrophobicContact CB-CD1 4.2Å; F70-I125 HydrophobicContact CB-CG1 3.54Å; F70-I125 HydrophobicContact CG-CG1 4.36Å; F70-F405 AromaticContact CE2-CD2 3.88Å; F70-F405 HydrophobicContact CE2-CD2 3.88Å; F70-F405 HydrophobicContact CE2-CE2 4.04Å; F70-F405 HydrophobicContact CE2-CG 4.39Å; F70-F405 HydrophobicContact CZ-CD2 4.12Å; F70-F405 HydrophobicContact CZ-CG 4.16Å; F70-M409 HydrophobicContact CE1-CE 3.78Å; F70-M409 HydrophobicContact CE1-SD 4.39Å; F70-M409 HydrophobicContact CZ-CE 4.12Å; F70-M409 HydrophobicContact CZ-SD 4.13Å; F70-Y411 HydrophobicContact CD1-CE1 4.4Å; F70-F412 HydrophobicContact CD1-CD2 4.34Å; F70-F412 HydrophobicContact CD2-CD2 4.5Å; F70-F412 HydrophobicContact CD2-CE2 4.33Å; F70-F412 AromaticContact CE1-CD2 3.74Å; F70-F412 HydrophobicContact CE1-CD2 3.74Å; F70-F412 HydrophobicContact CE1-CE2 4.46Å; F70-F412 AromaticContact CE2-CD2 3.92Å; F70-F412 HydrophobicContact CE2-CD2 3.92Å; F70-F412 AromaticContact CE2-CE2 3.86Å; F70-F412 HydrophobicContact CE2-CE2 3.86Å; F70-F412 AromaticContact CZ-CD2 3.49Å; F70-F412 HydrophobicContact CZ-CD2 3.49Å; F70-F412 VanDerWaalsContact CZ-CD2 3.49Å; F70-F412 AromaticContact CZ-CE2 3.93Å; F70-F412 HydrophobicContact CZ-CE2 3.93Å
71L93Very high82.2Confident77 Ų7763 Ų6340%0.40331%0.311SS..Hα-helixtrans-76.1-51.6178.6-74.2177.7000111.9L67 F68 K117 I125L67-L71 HydrophobicContact CD1-CD1 4.01Å; L67-L71 HydrophobicContact CD1-CG 4.2Å; L67-L71 HydrophobicContact CG-CD1 3.84Å; L67-L71 HydrophobicContact CG-CG 4.38Å; L67-L71 VanDerWaalsContact O-CB 3.32Å; L67-L71 WeakPolarHBondContact O-CB 3.49Å; L67-L71 VanDerWaalsContact O-CG 3.27Å; L67-L71 WeakPolarHBondContact O-CG 3.45Å; L67-L71 PolarHBondContact O-N 3.5Å; F68-L71 PolarHBondContact O-N 3.01Å; L71-K117 PolarHBondContact O-NZ 3.09Å; L71-I125 HydrophobicContact CD2-CD1 4.24Å; L71-I125 HydrophobicContact CD2-CG2 3.96Å
72F88.8Confident79.3Confident87 Ų8766.7 Ų66.738%0.38233%0.332SS..Hα-helixtrans-94.4-6-170.8-65.5-81.3000114.4F68 D74 L75 T76F68-F72 HydrophobicContact CB-CD2 4.49Å; F68-F72 HydrophobicContact CD1-CD2 4.36Å; F68-F72 AromaticContact CD2-CD2 3.19Å; F68-F72 HydrophobicContact CD2-CD2 3.19Å; F68-F72 AromaticContact CD2-CE2 3.37Å; F68-F72 HydrophobicContact CD2-CE2 3.37Å; F68-F72 HydrophobicContact CD2-CG 4.2Å; F68-F72 HydrophobicContact CD2-CZ 4.47Å; F68-F72 HydrophobicContact CE1-CB 4.45Å; F68-F72 HydrophobicContact CE1-CD2 4.4Å; F68-F72 AromaticContact CE2-CD2 3.24Å; F68-F72 HydrophobicContact CE2-CD2 3.24Å; F68-F72 AromaticContact CE2-CE2 3.43Å; F68-F72 HydrophobicContact CE2-CE2 3.43Å; F68-F72 VanDerWaalsContact CE2-CE2 3.43Å; F68-F72 AromaticContact CE2-CG 3.87Å; F68-F72 HydrophobicContact CE2-CG 3.87Å; F68-F72 HydrophobicContact CE2-CZ 4.18Å; F68-F72 AromaticContact CG-CD2 3.78Å; F68-F72 HydrophobicContact CG-CD2 3.78Å; F68-F72 HydrophobicContact CG-CE2 4.32Å; F68-F72 HydrophobicContact CZ-CB 4.31Å; F68-F72 AromaticContact CZ-CD2 3.88Å; F68-F72 HydrophobicContact CZ-CD2 3.88Å; F68-F72 HydrophobicContact CZ-CE2 4.43Å; F68-F72 HydrophobicContact CZ-CG 4.1Å; F68-F72 WeakPolarHBondContact O-CB 3.22Å; F68-F72 WeakPolarHBondContact O-CD2 3.35Å; F68-F72 PolarHBondContact O-N 3.49Å; F72-D74 PolarHBondContact O-N 3.48Å; F72-D74 VanDerWaalsContact O-N 3.15Å; F72-L75 HydrophobicContact CD1-CD1 3.82Å; F72-L75 HydrophobicContact CE1-CD1 4.43Å; F72-L75 WeakPolarHBondContact O-CB 3.28Å; F72-L75 PolarHBondContact O-N 3.28Å; F72-T76 PolarHBondContact O-N 2.97Å
73G84.8Confident76.4Confident0 Ų070.1 Ų70.10%036%0.355CS..Hα-helixtrans-59.6-25.7-179.300000115.6V69 T76 I415V69-G73 WeakPolarHBondContact O-CA 3.38Å; V69-G73 PolarHBondContact O-N 3.36Å; G73-T76 PolarHBondContact O-OG1 2.97Å; G73-I415 VanDerWaalsContact CA-CD1 3.4Å; G73-I415 WeakPolarHBondContact O-CD1 3.49Å
74D78.7Confident73.7Confident48 Ų4873.7 Ų73.726%0.25738%0.38SS..Hα-helixtrans-73.7-35.5175-65.5-37.5000111.5F72 K77 H78 K117F72-D74 PolarHBondContact O-N 3.48Å; F72-D74 VanDerWaalsContact O-N 3.15Å; D74-K77 PolarHBondContact O-N 3.49Å; D74-H78 PolarHBondContact O-CD2 2.98Å; D74-H78 PolarHBondContact O-N 3.12Å; D74-K117 WeakPolarHBondContact OD2-CE 3.25Å
75L76.8Confident70.9Confident107 Ų10779.7 Ų79.756%0.5640%0.404SS*.Hα-helixtrans-67.5-37.9179.6-61-175.8000111.7F72 K77 H78 K79F72-L75 HydrophobicContact CD1-CD1 3.82Å; F72-L75 HydrophobicContact CE1-CD1 4.43Å; F72-L75 WeakPolarHBondContact O-CB 3.28Å; F72-L75 PolarHBondContact O-N 3.28Å; L75-K77 VanDerWaalsContact C-N 3.34Å; L75-K77 PolarHBondContact O-N 3.41Å; L75-H78 PolarHBondContact O-N 2.95Å; L75-K79 PolarHBondContact O-N 3.15Å
76T68.3Low68.1Low45 Ų4586.9 Ų86.928%0.27643%0.43SS..Hα-helixtrans-67.4-3418053.70000112.5F72 G73 I419F72-T76 PolarHBondContact O-N 2.97Å; G73-T76 PolarHBondContact O-OG1 2.97Å; T76-I419 HydrophobicContact CG2-CD1 4.22Å; T76-I419 HydrophobicContact CG2-CG1 3.93Å
77K64.1Low65.3Low106 Ų10693.7 Ų93.746%0.46147%0.466SS..Hα-helixtrans-67-43.1174.4-77.3-174.6176.9-177.40112.9D74 L75 K79 K80 S81D74-K77 PolarHBondContact O-N 3.49Å; L75-K77 VanDerWaalsContact C-N 3.34Å; L75-K77 PolarHBondContact O-N 3.41Å; K77-K79 PolarHBondContact O-N 3.49Å; K77-K80 PolarHBondContact O-N 3.21Å; K77-S81 PolarHBondContact O-N 3.34Å
78H56.2Low62.4Low115 Ų115101.5 Ų101.553%0.53250%0.498SS..Hα-helixtrans-68.7-34.2-176.2-78.4-65.4000113D74 L75 K80D74-H78 PolarHBondContact O-CD2 2.98Å; D74-H78 PolarHBondContact O-N 3.12Å; L75-H78 PolarHBondContact O-N 2.95Å; H78-K80 PolarHBondContact O-N 3.47Å
79K53Low59.9Low194 Ų194103.4 Ų103.484%0.84351%0.511SS*.Hα-helixtrans-62.8-24.9179.1-167173179.6-179.30113.3L75 K77L75-K79 PolarHBondContact O-N 3.15Å; K77-K79 PolarHBondContact O-N 3.49Å
80K49.7Very low56.9Low119 Ų119114.8 Ų114.852%0.51755%0.554SS.*Hα-helixtrans-104.8-13.5-176-162159.8-176148.80115.1K77 H78 N82 P83 T424K77-K80 PolarHBondContact O-N 3.21Å; H78-K80 PolarHBondContact O-N 3.47Å; K80-N82 PolarHBondContact O-N 3.47Å; K80-P83 VanDerWaalsContact O-CD 3.27Å; K80-P83 WeakPolarHBondContact O-CD 3.37Å; K80-T424 HydrophobicContact CD-CG2 4.46Å; K80-T424 PolarHBondContact NZ-OG1 3.35Å
81S45.6Very low54.2Low96 Ų96122.3 Ų122.367%0.67159%0.594SS**SBendtrans-79.10.6174.8-167.60000113.9K77 P83K77-S81 PolarHBondContact O-N 3.34Å; S81-P83 WeakPolarHBondContact O-CD 3.46Å
82N37.7Very low51.6Low147 Ų147126.5 Ų126.579%0.78662%0.617SS**  trans-116.762.8167.3-113.918.2000110.3K80 S84K80-N82 PolarHBondContact O-N 3.47Å; N82-S84 PolarHBondContact O-N 2.97Å
83P37.7Very low49.1Very low98 Ų98128.1 Ų128.164%0.63664%0.639SS**  trans-65.5122.4153.59.67.2000106.4K80 S81 K85K80-P83 VanDerWaalsContact O-CD 3.27Å; K80-P83 WeakPolarHBondContact O-CD 3.37Å; S81-P83 WeakPolarHBondContact O-CD 3.46Å; P83-K85 PolarHBondContact O-N 3.47Å
84S39.6Very low46.9Very low74 Ų74131.4 Ų131.452%0.51767%0.672SS.*  trans-24.9101.4171.549.30000113.8N82 Y86 D87N82-S84 PolarHBondContact O-N 2.97Å; S84-Y86 PolarHBondContact O-N 3.01Å; S84-D87 PolarHBondContact OG-OD2 2.82Å
85K38.9Very low44.9Very low199 Ų199134.4 Ų134.487%0.86570%0.697SS**THydrogen-bonded Turntrans-70.920.9152.9-150.7-178.1-176.6-176.90111.4P83P83-K85 PolarHBondContact O-N 3.47Å
86Y39.3Very low43.1Very low186 Ų186133.8 Ų133.873%0.72970%0.702SS**THydrogen-bonded Turntrans-117.23.5-174.9-93.6-76000114.6S84 I89S84-Y86 PolarHBondContact O-N 3.01Å; Y86-I89 HydrophobicContact CD1-CD1 4.27Å; Y86-I89 HydrophobicContact CE1-CD1 4.26Å
87D36.8Very low41.8Very low143 Ų143138.8 Ų138.877%0.76573%0.727SS**SBendtrans-9920.8167.9-75.8-39.9000113.5S84S84-D87 PolarHBondContact OG-OD2 2.82Å
88K36.9Very low40.4Very low201 Ų201141.4 Ų141.487%0.87475%0.745SS**SBendtrans-107.821.6166.2-139.1-177.5-175.7-175.10113.7
89I42.6Very low39.6Very low126 Ų126140.3 Ų140.365%0.64675%0.75SS**SBendtrans-118.278.9168-52.3174.8000107.7Y86Y86-I89 HydrophobicContact CD1-CD1 4.27Å; Y86-I89 HydrophobicContact CE1-CD1 4.26Å
90R32.7Very low38.9Very low240 Ų240136.4 Ų136.491%0.90675%0.747SS**SBendtrans174.681.9152.8-99.3169.1-170.4-156.23.8107.7
91L36.2Very low38Very low160 Ų160141.4 Ų141.484%0.83876%0.763SS**SBendtrans171.768.7148.3-91.7159.5000105.5
92D39.1Very low37.4Very low166 Ų166142.8 Ų142.889%0.88877%0.771SS**  trans-151.675.3152.2-88.2-27.7000105.9G94D92-G94 PolarHBondContact O-N 2.85Å
93S36.6Very low37.3Very low121 Ų121141.5 Ų141.585%0.84676%0.763SS**  trans-60104.1153.639.40000107.9
94G37.6Very low37.3Very low68 Ų68141.7 Ų141.770%0.70177%0.767SS**  trans175.284.917900000115D92D92-G94 PolarHBondContact O-N 2.85Å
95S38.2Very low37.2Very low112 Ų112145.7 Ų145.778%0.78378%0.781SS**  trans73.5105.5146.7-149.20000119.7
96S38.7Very low37.2Very low93 Ų93143.7 Ų143.765%0.6578%0.776SS**  68.9131.8127.768.90000121.8
97N39.9Very low36.9Very low150 Ų150139.5 Ų139.580%0.80277%0.774SS**  trans9678.4153.7-56.6-18.3000118.8
98L36.1Very low36.8Very low162 Ų162139.3 Ų139.385%0.84878%0.779SS**  62.5116.5111.5-14869.8000119.3
99S38.8Very low36.7Very low91 Ų91140.5 Ų140.564%0.63678%0.777SS**  trans66.1107.1140.462.40000119.8
100S38.1Very low36.5Very low113 Ų113138.8 Ų138.879%0.7978%0.777SS**  16593.9102.4-73.10000111.3C102S100-C102 PolarHBondContact O-N 3.17Å
101R31.3Very low36.8Very low224 Ų224138.4 Ų138.485%0.84578%0.775SS**  15.4101.6128.2-100.9168.7140.9170.8-6.5116I103R101-I103 HydrophobicContact CG-CD1 4.49Å
102C33Very low37Very low124 Ų124138.2 Ų138.284%0.83877%0.77SS**  trans-132.389.9137.7-128.80000108.7S100 S104S100-C102 PolarHBondContact O-N 3.17Å; C102-S104 PolarHBondContact O-N 3.48Å
103I35.6Very low37.2Very low120 Ų120134.1 Ų134.162%0.61575%0.754SS**  trans-70.482.4164.9-63.7170.9000105.6R101 I105R101-I103 HydrophobicContact CG-CD1 4.49Å; I103-I105 HydrophobicContact CG2-CB 4.43Å; I103-I105 HydrophobicContact CG2-CD1 3.43Å; I103-I105 VanDerWaalsContact CG2-CD1 3.43Å; I103-I105 HydrophobicContact CG2-CG1 3.56Å; I103-I105 PolarHBondContact O-N 2.97Å
104S36.4Very low37.7Very low103 Ų103137.4 Ų137.472%0.7275%0.753SS**  trans-86.476.5161.255.60000108.1C102 M106C102-S104 PolarHBondContact O-N 3.48Å; S104-M106 PolarHBondContact O-N 3.47Å
105I38.5Very low38.4Very low158 Ų158140.4 Ų140.481%0.8175%0.749SS**  trans-66.481.4152.7-64.4161.9000105.2I103I103-I105 HydrophobicContact CG2-CB 4.43Å; I103-I105 HydrophobicContact CG2-CD1 3.43Å; I103-I105 VanDerWaalsContact CG2-CD1 3.43Å; I103-I105 HydrophobicContact CG2-CG1 3.56Å; I103-I105 PolarHBondContact O-N 2.97Å
106M38.1Very low39.6Very low156 Ų156139.5 Ų139.577%0.76874%0.743SS**  trans-13583171.5-132.7163.678.100108.8S104 T108S104-M106 PolarHBondContact O-N 3.47Å; M106-T108 PolarHBondContact O-N 3.01Å
107S33.6Very low41.4Very low99 Ų99137.5 Ų137.569%0.69272%0.722SS**  trans38.973.3145.370.60000115.1R109S107-R109 PolarHBondContact O-N 3.34Å
108T33.9Very low43.6Very low139 Ų139134 Ų13485%0.85371%0.709SS**  trans-71.372.5141.155.50000106.6M106 S110M106-T108 PolarHBondContact O-N 3.01Å; T108-S110 PolarHBondContact O-N 3.15Å
109R35.8Very low46Very low225 Ų225127.2 Ų127.285%0.84968%0.676SS**  trans-46.3102.5150.1-179.9175.3175.7158.9-1102.6S107 R111S107-R109 PolarHBondContact O-N 3.34Å; R109-R111 PolarHBondContact O-N 3.07Å
110S38.5Very low48.5Very low91 Ų91123.8 Ų123.864%0.63665%0.649SS**  trans-57.594.9175.159.70000104T108 H112T108-S110 PolarHBondContact O-N 3.15Å; S110-H112 PolarHBondContact O-N 3.17Å
111R38.1Very low51Low231 Ų231120.2 Ų120.287%0.87262%0.621SS**  trans-53.995.6149-79.9178.3167.7145.1-3.5100.6R109 S113R109-R111 PolarHBondContact O-N 3.07Å; R111-S113 PolarHBondContact O-N 2.79Å
112H40.5Very low54Low156 Ų156110.8 Ų110.872%0.72259%0.587SS**  trans-46.893.8148.3-87.2-53.1000102.5S110 K114S110-H112 PolarHBondContact O-N 3.17Å; H112-K114 PolarHBondContact O-N 2.97Å
113S44.4Very low57Low80 Ų80105.1 Ų105.156%0.55955%0.548SS*.  trans-51.494.6155.7166.90000101.4R111 H115R111-S113 PolarHBondContact O-N 2.79Å; S113-H115 PolarHBondContact O-N 3.37Å
114K47.1Very low59.8Low191 Ų19199.4 Ų99.483%0.8352%0.519SS*.  trans-60.586.8166.8-87.2-178.5175.81770101.7H112 S116H112-K114 PolarHBondContact O-N 2.97Å; K114-S116 PolarHBondContact O-N 3.18Å
115H50.6Low62.7Low130 Ų13095.9 Ų95.960%0.60249%0.492SS*.  trans-56.1101.1164.4-105.3-67.2000103.4S113 K117S113-H115 PolarHBondContact O-N 3.37Å; H115-K117 PolarHBondContact O-N 3.09Å
116S64.1Low65.5Low94 Ų9491.1 Ų91.166%0.65747%0.465SS*.  trans-60.4113-179.3179.90000105.2K114 S118K114-S116 PolarHBondContact O-N 3.18Å; S116-S118 PolarHBondContact O-N 3.38Å
117K77.4Confident68.3Low50 Ų5083.7 Ų83.722%0.21743%0.429CS..  trans-48.7137.3173.2-69.8-173.7-179.4-174.30107.8F70 L71 D74 H115 S119 M121 I122 I125F70-K117 PolarHBondContact O-NZ 3.02Å; L71-K117 PolarHBondContact O-NZ 3.09Å; D74-K117 WeakPolarHBondContact OD2-CE 3.25Å; H115-K117 PolarHBondContact O-N 3.09Å; K117-S119 PolarHBondContact O-N 3.1Å; K117-M121 HydrophobicContact CB-CB 4.31Å; K117-I122 HydrophobicContact CB-CD1 4.18Å; K117-I122 HydrophobicContact CB-CG1 3.69Å; K117-I122 WeakPolarHBondContact O-CD1 3.47Å; K117-I125 HydrophobicContact CD-CD1 3.63Å
118S84.7Confident71.4Confident76 Ų7679 Ų7953%0.53140%0.396SS..  trans-54.2143.9173.81760000108.9S116 F120 M121 I122S116-S118 PolarHBondContact O-N 3.38Å; S118-F120 PolarHBondContact O-N 3.37Å; S118-M121 PolarHBondContact O-N 3.05Å; S118-I122 PolarHBondContact O-N 2.78Å
119S86.9Confident74.5Confident20 Ų2073.3 Ų73.314%0.1437%0.365CS..Hα-helixtrans-49.5-32.2177.9-160.30000112.1K117 S123 L218 R219K117-S119 PolarHBondContact O-N 3.1Å; S119-S123 PolarHBondContact O-N 3.07Å; S119-S123 PolarHBondContact O-OG 3.31Å; S119-L218 PolarHBondContact OG-O 3.24Å; S119-R219 WeakPolarHBondContact CB-O 3.35Å
120F90.9Very high77.4Confident20 Ų2062.8 Ų62.89%0.08833%0.326CS..Hα-helixtrans-67.4-42.6174.3-174.2-129.9000115.3S118 I122 S123 L124 I197 A347 V350 V351 M409S118-F120 PolarHBondContact O-N 3.37Å; F120-I122 VanDerWaalsContact C-N 3.28Å; F120-S123 WeakPolarHBondContact CA-OG 3.49Å; F120-S123 PolarHBondContact O-N 3.18Å; F120-S123 PolarHBondContact O-OG 3.32Å; F120-L124 HydrophobicContact CD1-CD1 4.19Å; F120-L124 HydrophobicContact CD2-CG 4.46Å; F120-L124 HydrophobicContact CE1-CD1 3.74Å; F120-L124 HydrophobicContact CE2-CD1 4.15Å; F120-L124 HydrophobicContact CE2-CD2 4.3Å; F120-L124 HydrophobicContact CE2-CG 4.18Å; F120-L124 HydrophobicContact CZ-CD1 3.73Å; F120-L124 HydrophobicContact CZ-CD2 4.44Å; F120-L124 HydrophobicContact CZ-CG 4.26Å; F120-L124 WeakPolarHBondContact O-CG 3.41Å; F120-L124 PolarHBondContact O-N 3.19Å; F120-I197 HydrophobicContact CE2-CG2 4.49Å; F120-A347 HydrophobicContact CD1-CB 4.17Å; F120-A347 HydrophobicContact CE1-CB 3.86Å; F120-A347 HydrophobicContact CZ-CB 4.14Å; F120-V350 HydrophobicContact CZ-CB 4.25Å; F120-V350 HydrophobicContact CZ-CG1 4.07Å; F120-V351 HydrophobicContact CE2-CG2 3.51Å; F120-V351 HydrophobicContact CZ-CG2 4.08Å; F120-M409 HydrophobicContact CE1-CE 4.05Å
121M92.5Very high80.3Confident38 Ų3858.5 Ų58.519%0.18730%0.296CS..Hα-helixtrans-67.9-37.6178.1-68.3-60-168.800109.7F70 K117 S118 L124 I125 M409 Y411F70-M121 HydrophobicContact CD1-SD 4.15Å; F70-M121 HydrophobicContact CE1-SD 4.02Å; K117-M121 HydrophobicContact CB-CB 4.31Å; S118-M121 PolarHBondContact O-N 3.05Å; M121-L124 PolarHBondContact O-N 3.29Å; M121-I125 WeakPolarHBondContact O-CD1 3.32Å; M121-I125 VanDerWaalsContact O-CG1 3.28Å; M121-I125 WeakPolarHBondContact O-CG1 3.22Å; M121-I125 PolarHBondContact O-N 3.44Å; M121-M409 HydrophobicContact CE-CE 3.87Å; M121-M409 HydrophobicContact SD-CE 3.88Å; M121-Y411 HydrophobicContact CE-CD1 3.38Å; M121-Y411 HydrophobicContact CE-CD2 4.32Å; M121-Y411 HydrophobicContact CE-CE1 3.81Å; M121-Y411 HydrophobicContact CE-CG 3.67Å; M121-Y411 HydrophobicContact SD-CD1 4.28Å; M121-Y411 HydrophobicContact SD-CE1 4.33Å
122I93.8Very high83.1Confident26 Ų2648.5 Ų48.513%0.13326%0.26CS..Hα-helixtrans-59.9-47.8173.4-65.3172.3000110.4K117 S118 F120 L124 I125 F126 P221 I225K117-I122 HydrophobicContact CB-CD1 4.18Å; K117-I122 HydrophobicContact CB-CG1 3.69Å; K117-I122 WeakPolarHBondContact O-CD1 3.47Å; S118-I122 PolarHBondContact O-N 2.78Å; F120-I122 VanDerWaalsContact C-N 3.28Å; I122-L124 VanDerWaalsContact C-N 3.32Å; I122-L124 PolarHBondContact O-N 3.41Å; I122-I125 WeakPolarHBondContact O-CB 3.35Å; I122-I125 PolarHBondContact O-N 3.38Å; I122-F126 HydrophobicContact CG2-CD2 3.82Å; I122-F126 HydrophobicContact CG2-CE2 3.48Å; I122-F126 VanDerWaalsContact CG2-CE2 3.48Å; I122-F126 VanDerWaalsContact O-CD2 3.22Å; I122-F126 WeakPolarHBondContact O-CD2 3.21Å; I122-F126 PolarHBondContact O-N 2.87Å; I122-F126 VanDerWaalsContact O-N 3.09Å; I122-P221 HydrophobicContact CD1-CB 3.69Å; I122-I225 HydrophobicContact CG2-CD1 4.22Å; I122-I225 HydrophobicContact CG2-CG1 4.19Å
123S95.1Very high85.9Confident4 Ų444.1 Ų44.13%0.02824%0.242CC..Hα-helixtrans-63.5-35.8179.864.40000113.2S119 F120 F126 L127S119-S123 PolarHBondContact O-N 3.07Å; S119-S123 PolarHBondContact O-OG 3.31Å; F120-S123 WeakPolarHBondContact CA-OG 3.49Å; F120-S123 PolarHBondContact O-N 3.18Å; F120-S123 PolarHBondContact O-OG 3.32Å; S123-F126 PolarHBondContact O-N 3.01Å; S123-L127 PolarHBondContact O-N 3.38Å
124L95.8Very high88.4Confident1 Ų141 Ų411%0.00522%0.218CC..Hα-helixtrans-69.7-34.3174.6-67.2177000112.7F70 F120 M121 I122 L127 C128 I197 F405 M409F70-L124 HydrophobicContact CE1-CD1 4.14Å; F70-L124 HydrophobicContact CE2-CB 4.13Å; F70-L124 HydrophobicContact CZ-CB 4.17Å; F70-L124 HydrophobicContact CZ-CD1 3.86Å; F120-L124 HydrophobicContact CD1-CD1 4.19Å; F120-L124 HydrophobicContact CD2-CG 4.46Å; F120-L124 HydrophobicContact CE1-CD1 3.74Å; F120-L124 HydrophobicContact CE2-CD1 4.15Å; F120-L124 HydrophobicContact CE2-CD2 4.3Å; F120-L124 HydrophobicContact CE2-CG 4.18Å; F120-L124 HydrophobicContact CZ-CD1 3.73Å; F120-L124 HydrophobicContact CZ-CD2 4.44Å; F120-L124 HydrophobicContact CZ-CG 4.26Å; F120-L124 WeakPolarHBondContact O-CG 3.41Å; F120-L124 PolarHBondContact O-N 3.19Å; M121-L124 PolarHBondContact O-N 3.29Å; I122-L124 VanDerWaalsContact C-N 3.32Å; I122-L124 PolarHBondContact O-N 3.41Å; L124-L127 HydrophobicContact CD2-CD2 4.43Å; L124-L127 PolarHBondContact O-N 3.33Å; L124-C128 PolarHBondContact O-N 2.99Å; L124-C128 PolarHBondContact O-SG 3.43Å; L124-C128 VanDerWaalsContact O-SG 3.38Å; L124-I197 HydrophobicContact CD2-CD1 4.46Å; L124-F405 HydrophobicContact CD2-CE1 3.75Å; L124-F405 HydrophobicContact CD2-CZ 3.95Å; L124-M409 HydrophobicContact CD1-CE 3.56Å; L124-M409 HydrophobicContact CD1-SD 3.68Å
125I96.6Very high90.8Very high28 Ų2831.9 Ų31.914%0.14418%0.179CC..Hα-helixtrans-61.9-44.9173-70.7162.3000110.5L67 F70 L71 K117 M121 I122 L127 C128 G129L67-I125 HydrophobicContact CD1-CG2 3.89Å; F70-I125 HydrophobicContact CB-CD1 4.2Å; F70-I125 HydrophobicContact CB-CG1 3.54Å; F70-I125 HydrophobicContact CG-CG1 4.36Å; L71-I125 HydrophobicContact CD2-CD1 4.24Å; L71-I125 HydrophobicContact CD2-CG2 3.96Å; K117-I125 HydrophobicContact CD-CD1 3.63Å; M121-I125 WeakPolarHBondContact O-CD1 3.32Å; M121-I125 VanDerWaalsContact O-CG1 3.28Å; M121-I125 WeakPolarHBondContact O-CG1 3.22Å; M121-I125 PolarHBondContact O-N 3.44Å; I122-I125 WeakPolarHBondContact O-CB 3.35Å; I122-I125 PolarHBondContact O-N 3.38Å; I125-L127 VanDerWaalsContact C-N 3.35Å; I125-C128 PolarHBondContact O-N 3.43Å; I125-G129 PolarHBondContact O-N 2.85Å
126F97.3Very high93.1Very high58 Ų5828.8 Ų28.825%0.25417%0.166SC..Hα-helixtrans-61.8-43.1175.3-78.3-67.8000111.9I122 S123 G129 C130 F224 I225 F228I122-F126 HydrophobicContact CG2-CD2 3.82Å; I122-F126 HydrophobicContact CG2-CE2 3.48Å; I122-F126 VanDerWaalsContact CG2-CE2 3.48Å; I122-F126 VanDerWaalsContact O-CD2 3.22Å; I122-F126 WeakPolarHBondContact O-CD2 3.21Å; I122-F126 PolarHBondContact O-N 2.87Å; I122-F126 VanDerWaalsContact O-N 3.09Å; S123-F126 PolarHBondContact O-N 3.01Å; F126-G129 PolarHBondContact O-N 3.18Å; F126-C130 PolarHBondContact O-N 3.16Å; F126-C130 PolarHBondContact O-SG 3.48Å; F126-F224 HydrophobicContact CD2-CE1 4.18Å; F126-I225 HydrophobicContact CE2-CG1 3.75Å; F126-I225 HydrophobicContact CZ-CG1 4.06Å; F126-I225 HydrophobicContact CZ-CG2 4.45Å; F126-F228 HydrophobicContact CB-CE1 4.27Å; F126-F228 HydrophobicContact CB-CE2 4.48Å; F126-F228 HydrophobicContact CB-CZ 4.23Å; F126-F228 AromaticContact CD1-CD1 3.59Å; F126-F228 HydrophobicContact CD1-CD1 3.59Å; F126-F228 AromaticContact CD1-CE1 3.31Å; F126-F228 HydrophobicContact CD1-CE1 3.31Å; F126-F228 HydrophobicContact CD1-CZ 4.04Å; F126-F228 AromaticContact CE1-CD1 3.81Å; F126-F228 HydrophobicContact CE1-CD1 3.81Å; F126-F228 AromaticContact CE1-CE1 3.81Å; F126-F228 HydrophobicContact CE1-CE1 3.81Å; F126-F228 HydrophobicContact CG-CD1 4.02Å; F126-F228 AromaticContact CG-CE1 3.96Å; F126-F228 HydrophobicContact CG-CE1 3.96Å; F126-F228 HydrophobicContact CG-CZ 4.41Å; F126-F228 HydrophobicContact CZ-CD1 4.41Å
127L97.7Very high94.6Very high0 Ų024.5 Ų24.50%014%0.137CC..Hα-helixtrans-56.7-54.9176.5-176.964.3000111.1S123 L124 I125 G129 C130 E131 R190 C193 V194 I197 V354 F405S123-L127 PolarHBondContact O-N 3.38Å; L124-L127 HydrophobicContact CD2-CD2 4.43Å; L124-L127 PolarHBondContact O-N 3.33Å; I125-L127 VanDerWaalsContact C-N 3.35Å; L127-G129 VanDerWaalsContact C-N 3.28Å; L127-G129 PolarHBondContact O-N 3.03Å; L127-C130 PolarHBondContact O-N 3.42Å; L127-E131 WeakPolarHBondContact O-CG 3.24Å; L127-E131 PolarHBondContact O-N 2.9Å; L127-R190 HydrophobicContact CD1-CG 3.59Å; L127-C193 HydrophobicContact CD1-CB 4.23Å; L127-V194 HydrophobicContact CD1-CG2 3.59Å; L127-I197 HydrophobicContact CB-CD1 4.11Å; L127-I197 HydrophobicContact CD2-CD1 4.06Å; L127-V354 HydrophobicContact CD2-CG1 4.46Å; L127-F405 HydrophobicContact CD2-CZ 4.28Å
128C98Very high95.4Very high0 Ų022.4 Ų22.40%013%0.129CC..Hα-helixtrans-60.8-36.8178.2-64.20000112.3S66 L67 L124 I125 E131 V132S66-C128 VanDerWaalsContact CB-SG 3.55Å; L67-C128 HydrophobicContact CB-CB 4.04Å; L67-C128 HydrophobicContact CD1-CB 4.19Å; L124-C128 PolarHBondContact O-N 2.99Å; L124-C128 PolarHBondContact O-SG 3.43Å; L124-C128 VanDerWaalsContact O-SG 3.38Å; I125-C128 PolarHBondContact O-N 3.43Å; C128-E131 PolarHBondContact O-N 3.48Å; C128-V132 VanDerWaalsContact O-CG2 3.32Å; C128-V132 WeakPolarHBondContact O-CG2 3.37Å; C128-V132 PolarHBondContact O-N 2.86Å
129G97.8Very high96Very high20 Ų2020.6 Ų20.621%0.20611%0.111CC..Hα-helixtrans-60.7-48.1175.400000112.6I125 F126 L127 E131 V132 I133I125-G129 PolarHBondContact O-N 2.85Å; F126-G129 PolarHBondContact O-N 3.18Å; L127-G129 VanDerWaalsContact C-N 3.28Å; L127-G129 PolarHBondContact O-N 3.03Å; G129-E131 VanDerWaalsContact C-N 3.3Å; G129-E131 PolarHBondContact O-N 3.27Å; G129-V132 PolarHBondContact O-N 3.5Å; G129-I133 WeakPolarHBondContact O-CG1 3.37Å; G129-I133 PolarHBondContact O-N 2.88Å; G129-I133 VanDerWaalsContact O-N 3.14Å
130C98.3Very high96.3Very high5 Ų522.5 Ų22.53%0.03412%0.119CC..Hα-helixtrans-61.4-39.4174.9-65.20000112F126 L127 I133 F134 S189 R190 F228F126-C130 PolarHBondContact O-N 3.16Å; F126-C130 PolarHBondContact O-SG 3.48Å; L127-C130 PolarHBondContact O-N 3.42Å; C130-I133 PolarHBondContact O-N 3.03Å; C130-F134 WeakPolarHBondContact O-CB 3.41Å; C130-F134 PolarHBondContact O-N 3.09Å; C130-S189 VanDerWaalsContact SG-CB 3.58Å; C130-R190 HydrophobicContact CB-CB 3.79Å; C130-R190 HydrophobicContact CB-CG 4.46Å; C130-F228 VanDerWaalsContact SG-CZ 3.56Å
131E97.8Very high96.4Very high0 Ų021.6 Ų21.60%012%0.115CC..Hα-helixtrans-66.2-39.2178-71.6-176.3117.400112.8N63 L127 C128 G129 F134 N135 R190 S398 N401N63-E131 HydrophobicContact CB-CB 3.99Å; N63-E131 PolarHBondContact OD1-OE2 3.09Å; L127-E131 WeakPolarHBondContact O-CG 3.24Å; L127-E131 PolarHBondContact O-N 2.9Å; C128-E131 PolarHBondContact O-N 3.48Å; G129-E131 VanDerWaalsContact C-N 3.3Å; G129-E131 PolarHBondContact O-N 3.27Å; E131-F134 PolarHBondContact O-N 3.38Å; E131-N135 VanDerWaalsContact O-CB 3.31Å; E131-N135 WeakPolarHBondContact O-CB 3.49Å; E131-N135 PolarHBondContact O-N 3.44Å; E131-N135 PolarHBondContact O-ND2 3.22Å; E131-R190 VanDerWaalsContact CG-CD 3.43Å; E131-R190 HydrophobicContact CG-CG 3.75Å; E131-S398 VanDerWaalsContact CD-OG 3.25Å; E131-S398 WeakPolarHBondContact CG-OG 3.46Å; E131-S398 WeakPolarHBondContact OE1-CA 3.39Å; E131-S398 WeakPolarHBondContact OE1-CB 3.26Å; E131-S398 PolarHBondContact OE1-OG 2.95Å; E131-N401 PolarHBondContact OE1-ND2 3.31Å
132V98.4Very high96.3Very high21 Ų2120.8 Ų20.813%0.12711%0.111CC..Hα-helixtrans-61.8-46.3173.7169.70000110.5F60 N63 I64 L67 C128 G129 L136F60-V132 HydrophobicContact CD2-CG1 4.09Å; F60-V132 HydrophobicContact CE2-CG1 3.9Å; N63-V132 HydrophobicContact CB-CG2 3.81Å; I64-V132 HydrophobicContact CD1-CG1 4.42Å; I64-V132 HydrophobicContact CG1-CG1 3.98Å; I64-V132 HydrophobicContact CG1-CG2 3.71Å; L67-V132 HydrophobicContact CD2-CG2 4.41Å; C128-V132 VanDerWaalsContact O-CG2 3.32Å; C128-V132 WeakPolarHBondContact O-CG2 3.37Å; C128-V132 PolarHBondContact O-N 2.86Å; G129-V132 PolarHBondContact O-N 3.5Å; V132-L136 WeakPolarHBondContact O-CB 3.5Å; V132-L136 PolarHBondContact O-N 2.95Å
133I97.9Very high96.2Very high64 Ų6422.7 Ų22.733%0.32812%0.121SC..Hα-helixtrans-60.4-49.3178.7-65.9166.8000110.6G129 C130 G137 I182G129-I133 WeakPolarHBondContact O-CG1 3.37Å; G129-I133 PolarHBondContact O-N 2.88Å; G129-I133 VanDerWaalsContact O-N 3.14Å; C130-I133 PolarHBondContact O-N 3.03Å; I133-G137 PolarHBondContact O-N 3.32Å; I133-I182 HydrophobicContact CG2-CG2 3.67Å; I133-I182 WeakPolarHBondContact CG2-O 3.33Å
134F97.9Very high95.9Very high15 Ų1524.3 Ų24.37%0.06613%0.129CC..Hα-helixtrans-60.1-55.5179167.4-113.5000112.1C130 E131 L136 G137 A138 A183 L187 I394C130-F134 WeakPolarHBondContact O-CB 3.41Å; C130-F134 PolarHBondContact O-N 3.09Å; E131-F134 PolarHBondContact O-N 3.38Å; F134-L136 PolarHBondContact O-N 3.41Å; F134-G137 PolarHBondContact O-N 3.34Å; F134-A138 HydrophobicContact CE2-CB 4.35Å; F134-A138 VanDerWaalsContact O-CB 3.22Å; F134-A138 WeakPolarHBondContact O-CB 3.23Å; F134-A138 PolarHBondContact O-N 2.91Å; F134-A183 HydrophobicContact CD2-CB 4.46Å; F134-A183 WeakPolarHBondContact CD2-O 3.38Å; F134-L187 HydrophobicContact CD2-CB 3.75Å; F134-L187 HydrophobicContact CD2-CD1 4.35Å; F134-L187 HydrophobicContact CD2-CG 4.48Å; F134-L187 HydrophobicContact CE2-CB 4.1Å; F134-L187 HydrophobicContact CE2-CD1 4.16Å; F134-L187 HydrophobicContact CE2-CD2 4.24Å; F134-L187 HydrophobicContact CE2-CG 4.39Å; F134-L187 HydrophobicContact CG-CB 4.39Å; F134-L187 HydrophobicContact CZ-CD1 4.32Å; F134-I394 HydrophobicContact CE1-CG2 3.74Å; F134-I394 HydrophobicContact CZ-CG2 3.62Å
135N98.2Very high95.4Very high0 Ų025.6 Ų25.60%014%0.135CC..Hα-helixtrans-66.6-38.5-174.6-75.5-73.3000112F60 E131 F139 S398F60-N135 HydrophobicContact CB-CB 3.88Å; E131-N135 VanDerWaalsContact O-CB 3.31Å; E131-N135 WeakPolarHBondContact O-CB 3.49Å; E131-N135 PolarHBondContact O-N 3.44Å; E131-N135 PolarHBondContact O-ND2 3.22Å; N135-F139 WeakPolarHBondContact O-CB 3.21Å; N135-F139 PolarHBondContact O-N 3.3Å; N135-S398 PolarHBondContact ND2-OG 2.9Å
136L97.7Very high94.8Very high64 Ų6426 Ų2634%0.33514%0.139SC..Hα-helixtrans-65-49.6176.1-177.760.2000111.3F60 V132 F134 A138 F139 I140F60-L136 HydrophobicContact CD2-CB 3.71Å; F60-L136 HydrophobicContact CD2-CD1 4.15Å; F60-L136 HydrophobicContact CD2-CG 4.4Å; F60-L136 HydrophobicContact CE1-CD1 4.4Å; F60-L136 HydrophobicContact CE2-CB 3.77Å; F60-L136 HydrophobicContact CE2-CD1 3.73Å; F60-L136 HydrophobicContact CE2-CD2 3.98Å; F60-L136 HydrophobicContact CE2-CG 4.03Å; F60-L136 HydrophobicContact CZ-CD1 3.86Å; F60-L136 HydrophobicContact CZ-CD2 4.5Å; V132-L136 WeakPolarHBondContact O-CB 3.5Å; V132-L136 PolarHBondContact O-N 2.95Å; F134-L136 PolarHBondContact O-N 3.41Å; L136-A138 PolarHBondContact O-N 3.34Å; L136-F139 PolarHBondContact O-N 3.24Å; L136-I140 HydrophobicContact CD1-CD1 3.75Å; L136-I140 HydrophobicContact CD1-CG1 4.11Å; L136-I140 HydrophobicContact CG-CD1 3.99Å; L136-I140 WeakPolarHBondContact O-CG1 3.46Å; L136-I140 PolarHBondContact O-N 3.39Å
137G95.6Very high94.3Very high5 Ų526.9 Ų26.95%0.05215%0.146CC..Hα-helixtrans-60.3-46.3179.100000111.7I133 F134 F141I133-G137 PolarHBondContact O-N 3.32Å; F134-G137 PolarHBondContact O-N 3.34Å; G137-F141 WeakPolarHBondContact O-CB 3.23Å; G137-F141 PolarHBondContact O-N 3.42Å
138A94.8Very high93.5Very high5 Ų527.2 Ų27.24%0.04115%0.148CC..Hα-helixtrans-64.5-40.3178.100000112.9F52 T56 F134 L136 K142 A183F52-A138 HydrophobicContact CE1-CB 4.25Å; F52-A138 HydrophobicContact CZ-CB 4.05Å; T56-A138 HydrophobicContact CG2-CB 3.94Å; F134-A138 HydrophobicContact CE2-CB 4.35Å; F134-A138 VanDerWaalsContact O-CB 3.22Å; F134-A138 WeakPolarHBondContact O-CB 3.23Å; F134-A138 PolarHBondContact O-N 2.91Å; L136-A138 PolarHBondContact O-N 3.34Å; A138-K142 WeakPolarHBondContact O-CB 3.41Å; A138-K142 WeakPolarHBondContact O-CG 3.47Å; A138-K142 PolarHBondContact O-N 3.3Å; A138-A183 HydrophobicContact CB-CB 4.5Å
139F96.3Very high92.4Very high39 Ų3929.6 Ų29.617%0.17117%0.165CC..Hα-helixtrans-62.8-54.5176.8172-107.2000111.5I53 F57 N135 L136 F141 K142 L143I53-F139 HydrophobicContact CG2-CD2 3.94Å; I53-F139 HydrophobicContact CG2-CE2 3.71Å; F57-F139 HydrophobicContact CB-CD2 3.78Å; F57-F139 HydrophobicContact CB-CE2 3.77Å; F57-F139 HydrophobicContact CB-CG 4.49Å; F57-F139 HydrophobicContact CB-CZ 4.47Å; F57-F139 HydrophobicContact CD2-CD1 4.35Å; F57-F139 HydrophobicContact CD2-CD2 4.28Å; F57-F139 AromaticContact CD2-CE1 3.98Å; F57-F139 HydrophobicContact CD2-CE1 3.98Å; F57-F139 AromaticContact CD2-CE2 3.91Å; F57-F139 HydrophobicContact CD2-CE2 3.91Å; F57-F139 HydrophobicContact CD2-CG 4.49Å; F57-F139 AromaticContact CD2-CZ 3.75Å; F57-F139 HydrophobicContact CD2-CZ 3.75Å; F57-F139 HydrophobicContact CE2-CZ 4.4Å; F57-F139 HydrophobicContact CG-CD2 4.47Å; F57-F139 HydrophobicContact CG-CE2 4.12Å; F57-F139 HydrophobicContact CG-CZ 4.36Å; N135-F139 WeakPolarHBondContact O-CB 3.21Å; N135-F139 PolarHBondContact O-N 3.3Å; L136-F139 PolarHBondContact O-N 3.24Å; F139-F141 VanDerWaalsContact C-N 3.34Å; F139-F141 PolarHBondContact O-N 3.47Å; F139-K142 PolarHBondContact O-N 3.21Å; F139-L143 HydrophobicContact CE1-CD2 4.26Å; F139-L143 HydrophobicContact CZ-CD2 4.13Å; F139-L143 VanDerWaalsContact O-CB 3.31Å; F139-L143 WeakPolarHBondContact O-CB 3.41Å; F139-L143 PolarHBondContact O-N 3.23Å
140I94.9Very high91.5Very high59 Ų5936.8 Ų36.830%0.30319%0.186SC..Hα-helixtrans-62.5-44.5-179-60.9174.9000109.9L136 K142 L143 I144 L179L136-I140 HydrophobicContact CD1-CD1 3.75Å; L136-I140 HydrophobicContact CD1-CG1 4.11Å; L136-I140 HydrophobicContact CG-CD1 3.99Å; L136-I140 WeakPolarHBondContact O-CG1 3.46Å; L136-I140 PolarHBondContact O-N 3.39Å; I140-K142 PolarHBondContact O-N 3.43Å; I140-L143 PolarHBondContact O-N 2.96Å; I140-I144 HydrophobicContact CG2-CD1 3.85Å; I140-I144 HydrophobicContact CG2-CG1 4.39Å; I140-I144 WeakPolarHBondContact O-CG1 3.29Å; I140-I144 PolarHBondContact O-N 2.82Å; I140-L179 HydrophobicContact CB-CD1 4.23Å; I140-L179 HydrophobicContact CB-CD2 4.41Å; I140-L179 HydrophobicContact CG2-CD1 3.52Å; I140-L179 HydrophobicContact CG2-CD2 4.2Å
141F91.9Very high90.4Very high2 Ų241.9 Ų41.91%0.00921%0.208CC..Hα-helixtrans-53.6-51.6176.4168.2-91.9000111.9F18 G137 F139 I144 Q145 Q176 L179 M180F18-F141 AromaticContact CD1-CE2 3.84Å; F18-F141 HydrophobicContact CD1-CE2 3.84Å; F18-F141 HydrophobicContact CD1-CZ 4.31Å; F18-F141 HydrophobicContact CE1-CD2 4.28Å; F18-F141 HydrophobicContact CE1-CE1 4.4Å; F18-F141 AromaticContact CE1-CE2 3.22Å; F18-F141 HydrophobicContact CE1-CE2 3.22Å; F18-F141 AromaticContact CE1-CZ 3.32Å; F18-F141 HydrophobicContact CE1-CZ 3.32Å; F18-F141 HydrophobicContact CZ-CE2 4.21Å; F18-F141 AromaticContact CZ-CZ 3.86Å; F18-F141 HydrophobicContact CZ-CZ 3.86Å; G137-F141 WeakPolarHBondContact O-CB 3.23Å; G137-F141 PolarHBondContact O-N 3.42Å; F139-F141 VanDerWaalsContact C-N 3.34Å; F139-F141 PolarHBondContact O-N 3.47Å; F141-I144 PolarHBondContact O-N 3.25Å; F141-Q145 WeakPolarHBondContact O-CB 3.22Å; F141-Q145 PolarHBondContact O-N 3.31Å; F141-Q176 HydrophobicContact CD2-CB 4.5Å; F141-Q176 HydrophobicContact CD2-CG 3.34Å; F141-Q176 WeakPolarHBondContact CD2-O 3.48Å; F141-Q176 HydrophobicContact CE2-CG 3.14Å; F141-Q176 HydrophobicContact CZ-CG 4.21Å; F141-Q176 VanDerWaalsContact CZ-NE2 3.3Å; F141-L179 HydrophobicContact CB-CB 4.32Å; F141-M180 HydrophobicContact CD1-CE 3.23Å; F141-M180 HydrophobicContact CD2-CB 3.97Å; F141-M180 HydrophobicContact CD2-CE 3.72Å; F141-M180 HydrophobicContact CE1-CE 3.11Å; F141-M180 HydrophobicContact CE2-CB 4.14Å; F141-M180 HydrophobicContact CE2-CE 3.58Å; F141-M180 HydrophobicContact CG-CE 3.57Å; F141-M180 HydrophobicContact CZ-CE 3.32Å
142K90.1Very high89.3Confident21 Ų2142.1 Ų42.19%0.09121%0.209CC..Hα-helixtrans-71.5-32.7-178-74.7-58.7-175.4172.30113.1Q49 F52 I53 A138 F139 I140 Q145 V146Q49-K142 VanDerWaalsContact OE1-CE 3.3Å; F52-K142 HydrophobicContact CD1-CB 4.34Å; F52-K142 HydrophobicContact CD1-CD 4.37Å; F52-K142 HydrophobicContact CD1-CG 3.55Å; F52-K142 HydrophobicContact CE1-CB 4.36Å; F52-K142 HydrophobicContact CE1-CD 4.33Å; F52-K142 HydrophobicContact CE1-CG 3.38Å; I53-K142 HydrophobicContact CD1-CB 4.19Å; I53-K142 HydrophobicContact CG1-CB 3.67Å; A138-K142 WeakPolarHBondContact O-CB 3.41Å; A138-K142 WeakPolarHBondContact O-CG 3.47Å; A138-K142 PolarHBondContact O-N 3.3Å; F139-K142 PolarHBondContact O-N 3.21Å; I140-K142 PolarHBondContact O-N 3.43Å; K142-Q145 PolarHBondContact O-N 2.93Å; K142-V146 WeakPolarHBondContact O-CG2 3.27Å; K142-V146 PolarHBondContact O-N 3.45Å
143L91.3Very high88.1Confident65 Ų6543.6 Ų43.634%0.3422%0.215SC..Hα-helixtrans-62.5-47.3174.4-172.565000110.6F139 I140 Q145 V146 L147F139-L143 HydrophobicContact CE1-CD2 4.26Å; F139-L143 HydrophobicContact CZ-CD2 4.13Å; F139-L143 VanDerWaalsContact O-CB 3.31Å; F139-L143 WeakPolarHBondContact O-CB 3.41Å; F139-L143 PolarHBondContact O-N 3.23Å; I140-L143 PolarHBondContact O-N 2.96Å; L143-Q145 VanDerWaalsContact C-N 3.35Å; L143-Q145 PolarHBondContact O-N 3.29Å; L143-V146 PolarHBondContact O-N 3Å; L143-L147 HydrophobicContact CD1-CD1 3.82Å; L143-L147 HydrophobicContact CD1-CG 4.22Å; L143-L147 HydrophobicContact CG-CD1 3.8Å; L143-L147 HydrophobicContact CG-CG 4.45Å; L143-L147 WeakPolarHBondContact O-CB 3.43Å; L143-L147 VanDerWaalsContact O-CG 3.27Å; L143-L147 WeakPolarHBondContact O-CG 3.2Å; L143-L147 PolarHBondContact O-N 2.88Å
144I88.8Confident87.1Confident38 Ų3841 Ų4120%0.19520%0.201CC..Hα-helixtrans-59.9-45.9174.2-67.3170.4000110.3I140 F141 V146 L147 S148 I175 L179I140-I144 HydrophobicContact CG2-CD1 3.85Å; I140-I144 HydrophobicContact CG2-CG1 4.39Å; I140-I144 WeakPolarHBondContact O-CG1 3.29Å; I140-I144 PolarHBondContact O-N 2.82Å; F141-I144 PolarHBondContact O-N 3.25Å; I144-V146 VanDerWaalsContact C-N 3.29Å; I144-V146 PolarHBondContact O-N 2.85Å; I144-L147 PolarHBondContact O-N 3.39Å; I144-S148 WeakPolarHBondContact O-CA 3.39Å; I144-S148 VanDerWaalsContact O-CB 3.25Å; I144-S148 WeakPolarHBondContact O-CB 3.32Å; I144-S148 PolarHBondContact O-N 2.96Å; I144-I175 HydrophobicContact CD1-CG2 4.34Å; I144-L179 HydrophobicContact CD1-CD1 3.56Å
145Q85.3Confident86.1Confident28 Ų2846.3 Ų46.313%0.13122%0.222CC..Hα-helixtrans-59.7-36-180-175.1174.830.300113.5F141 K142 L143 S148F141-Q145 WeakPolarHBondContact O-CB 3.22Å; F141-Q145 PolarHBondContact O-N 3.31Å; K142-Q145 PolarHBondContact O-N 2.93Å; L143-Q145 VanDerWaalsContact C-N 3.35Å; L143-Q145 PolarHBondContact O-N 3.29Å; Q145-S148 PolarHBondContact O-OG 3.48Å; Q145-S148 VanDerWaalsContact O-OG 3.05Å
146V85.8Confident84.9Confident38 Ų3847.2 Ų47.223%0.2323%0.228CC..Hα-helixtrans-81.9-37.2178.9171.50000111.6Q49 I53 K142 L143 I144Q49-V146 HydrophobicContact CB-CG2 4.22Å; I53-V146 HydrophobicContact CD1-CB 4.38Å; I53-V146 HydrophobicContact CD1-CG2 3.77Å; K142-V146 WeakPolarHBondContact O-CG2 3.27Å; K142-V146 PolarHBondContact O-N 3.45Å; L143-V146 PolarHBondContact O-N 3Å; I144-V146 VanDerWaalsContact C-N 3.29Å; I144-V146 PolarHBondContact O-N 2.85Å
147L85.6Confident83.6Confident76 Ų7650.7 Ų50.740%0.39825%0.245SC..Hα-helixtrans-81.7-13.9-179.7-64.4178.9000113.4L143 I144 S149 Y150 F151L143-L147 HydrophobicContact CD1-CD1 3.82Å; L143-L147 HydrophobicContact CD1-CG 4.22Å; L143-L147 HydrophobicContact CG-CD1 3.8Å; L143-L147 HydrophobicContact CG-CG 4.45Å; L143-L147 WeakPolarHBondContact O-CB 3.43Å; L143-L147 VanDerWaalsContact O-CG 3.27Å; L143-L147 WeakPolarHBondContact O-CG 3.2Å; L143-L147 PolarHBondContact O-N 2.88Å; I144-L147 PolarHBondContact O-N 3.39Å; L147-S149 PolarHBondContact O-N 3.08Å; L147-S149 VanDerWaalsContact O-N 3.16Å; L147-Y150 WeakPolarHBondContact O-CB 3.27Å; L147-Y150 PolarHBondContact O-N 3.44Å; L147-F151 HydrophobicContact CB-CD2 4.25Å; L147-F151 HydrophobicContact CB-CE2 3.92Å; L147-F151 HydrophobicContact CD1-CE2 4.48Å; L147-F151 WeakPolarHBondContact O-CD2 3.28Å
148S82.1Confident82.4Confident7 Ų755.1 Ų55.15%0.04927%0.268CS..Hα-helixtrans-56.5-34.8-175.963.90000112.8F16 I144 Q145 Y150 F151 I152F16-S148 VanDerWaalsContact CE2-CB 3.49Å; F16-S148 WeakPolarHBondContact CE2-OG 3.4Å; I144-S148 WeakPolarHBondContact O-CA 3.39Å; I144-S148 VanDerWaalsContact O-CB 3.25Å; I144-S148 WeakPolarHBondContact O-CB 3.32Å; I144-S148 PolarHBondContact O-N 2.96Å; Q145-S148 PolarHBondContact O-OG 3.48Å; Q145-S148 VanDerWaalsContact O-OG 3.05Å; S148-Y150 PolarHBondContact O-N 3.45Å; S148-F151 PolarHBondContact O-N 3.02Å; S148-I152 VanDerWaalsContact O-CB 3.28Å; S148-I152 WeakPolarHBondContact O-CB 3.1Å; S148-I152 PolarHBondContact O-N 3.03Å
149S74.8Confident80.9Confident50 Ų5057.4 Ų57.435%0.3529%0.292SS..Hα-helixtrans-64.7-19177.660.40000113.8L147L147-S149 PolarHBondContact O-N 3.08Å; L147-S149 VanDerWaalsContact O-N 3.16Å
150Y77.7Confident79.3Confident170 Ų17060.6 Ų60.667%0.66732%0.319SS*.Hα-helixtrans-86.3-33.6177.9-174-97.2000112.3L147 S148 H153L147-Y150 WeakPolarHBondContact O-CB 3.27Å; L147-Y150 PolarHBondContact O-N 3.44Å; S148-Y150 PolarHBondContact O-N 3.45Å; Y150-H153 PolarHBondContact O-CE1 2.94Å; Y150-H153 VanDerWaalsContact O-CE1 3.31Å
151F75.3Confident77.9Confident112 Ų11264.4 Ų64.449%0.49133%0.333SS..Hα-helixtrans-100.1-19.9-174.3-60.4-68.6000114.1L147 S148L147-F151 HydrophobicContact CB-CD2 4.25Å; L147-F151 HydrophobicContact CB-CE2 3.92Å; L147-F151 HydrophobicContact CD1-CE2 4.48Å; L147-F151 WeakPolarHBondContact O-CD2 3.28Å; S148-F151 PolarHBondContact O-N 3.02Å
152I74.7Confident76.7Confident5 Ų566.7 Ų66.73%0.02634%0.344CS..  trans-110.9119.9-174.2-61.2171.9000108.5F14 F16 S148 L169 L172F14-I152 HydrophobicContact CD2-CG2 3.83Å; F14-I152 HydrophobicContact CE2-CG2 3.62Å; F16-I152 HydrophobicContact CE1-CD1 3.71Å; F16-I152 HydrophobicContact CE2-CD1 4.02Å; F16-I152 HydrophobicContact CZ-CD1 3.13Å; F16-I152 HydrophobicContact CZ-CG1 4.48Å; S148-I152 VanDerWaalsContact O-CB 3.28Å; S148-I152 WeakPolarHBondContact O-CB 3.1Å; S148-I152 PolarHBondContact O-N 3.03Å; I152-L169 HydrophobicContact CG2-CD2 3.39Å; I152-L169 HydrophobicContact CG2-CG 4.39Å; I152-L172 HydrophobicContact CD1-CB 4.25Å; I152-L172 HydrophobicContact CD1-CD1 3.51Å; I152-L172 HydrophobicContact CG1-CD1 3.72Å
153H74Confident75.6Confident53 Ų5370.8 Ų70.825%0.24537%0.365CS..  trans-114.4136.5179.6-58.8-43.7000109.9Y150 Y155Y150-H153 PolarHBondContact O-CE1 2.94Å; Y150-H153 VanDerWaalsContact O-CE1 3.31Å; H153-Y155 WeakPolarHBondContact CB-O 3.49Å; H153-Y155 PolarHBondContact O-N 3.15Å
154Q75.6Confident74.5Confident9 Ų972.1 Ų72.14%0.04238%0.378CS..SBendtrans-61.2-30.3172.2176.8151.112.400112.5T11 L12 Q258 Y259T11-Q154 PolarHBondContact OG1-OE1 3.03Å; L12-Q154 HydrophobicContact CB-CB 4.14Å; L12-Q154 HydrophobicContact CD1-CB 3.41Å; L12-Q154 VanDerWaalsContact CD1-CB 3.41Å; L12-Q154 HydrophobicContact CD1-CG 3.16Å; L12-Q154 HydrophobicContact CG-CB 4.07Å; L12-Q154 HydrophobicContact CG-CG 3.92Å; Q154-Q258 HydrophobicContact CG-CB 3.74Å; Q154-Q258 WeakPolarHBondContact O-CA 3.47Å; Q154-Y259 WeakPolarHBondContact O-CD2 3.23Å; Q154-Y259 PolarHBondContact O-N 3.29Å
155Y78.2Confident73.7Confident127 Ų12771 Ų7150%0.49837%0.373SS..SBendtrans-100.7135.1-178.1-53.7-82.2000108.4H153 H257 Q258H153-Y155 WeakPolarHBondContact CB-O 3.49Å; H153-Y155 PolarHBondContact O-N 3.15Å; Y155-H257 WeakPolarHBondContact CD1-O 3.35Å; Y155-Q258 HydrophobicContact CD1-CB 4.21Å; Y155-Q258 HydrophobicContact CE1-CB 4.06Å
156P73.3Confident73.4Confident18 Ų1871.3 Ų71.312%0.11738%0.376CS..  trans-60.7140.6173.527.7-33.3000109.6D158 Y252 H257 Y259P156-D158 PolarHBondContact O-N 3.32Å; P156-Y252 HydrophobicContact CG-CE2 3.86Å; P156-H257 VanDerWaalsContact CD-O 3.23Å; P156-H257 WeakPolarHBondContact CD-O 3.21Å; P156-Y259 HydrophobicContact CB-CE2 4.1Å
157I70.5Confident73.3Confident138 Ų13874 Ų7471%0.70839%0.387SS*.SBendtrans-59.6-39.4177.9-58.8171.2000110
158D69.4Low73.2Confident98 Ų9873.7 Ų73.752%0.52439%0.386SS..SBendtrans-103.4106.3172.3-73.8-16.7000110.2P156 S160 K161P156-D158 PolarHBondContact O-N 3.32Å; D158-S160 PolarHBondContact O-N 3.43Å; D158-K161 HydrophobicContact CB-CB 4.45Å; D158-K161 PolarHBondContact O-N 2.91Å
159G64.5Low73.3Confident53 Ų5373.4 Ų73.455%0.54638%0.384SS..THydrogen-bonded Turntrans-59.4-16.9-177.200000115.7
160S62.6Low73.8Confident105 Ų10572.9 Ų72.973%0.73438%0.377SS*.THydrogen-bonded Turntrans-97.2-13.8-178.859.50000114.7D158D158-S160 PolarHBondContact O-N 3.43Å
161K64.4Low74.4Confident139 Ų13968.7 Ų68.760%0.60437%0.365SS*.  trans-124.588.1-175.5-66.9179.9-175.9172.50110.7D158 I163D158-K161 HydrophobicContact CB-CB 4.45Å; D158-K161 PolarHBondContact O-N 2.91Å; K161-I163 VanDerWaalsContact C-N 3.3Å
162H67.5Low75Confident51 Ų5165.1 Ų65.124%0.23635%0.351CS..  trans-82.5-11170.866.5-77.5000113.1P164 Y252H162-P164 CarbonylContact O-C 3.56Å; H162-Y252 HydrophobicContact CB-CD1 3.39Å; H162-Y252 HydrophobicContact CB-CD2 3.87Å; H162-Y252 HydrophobicContact CB-CE1 3.41Å; H162-Y252 VanDerWaalsContact CB-CE1 3.41Å; H162-Y252 HydrophobicContact CB-CE2 3.91Å; H162-Y252 HydrophobicContact CB-CG 3.61Å; H162-Y252 AromaticContact CD2-CD1 3.58Å; H162-Y252 AromaticContact CG-CD1 3.47Å; H162-Y252 VanDerWaalsContact CG-CD1 3.47Å; H162-Y252 AromaticContact CG-CE1 3.62Å
163I67.2Low75.6Confident106 Ų10664.9 Ų64.954%0.54435%0.35SS..SBendtrans-122.2127.8177.2-65.1159000108.3K161K161-I163 VanDerWaalsContact C-N 3.3Å
164P67.3Low76.4Confident93 Ų9364 Ų6460%0.60435%0.348SS*.SBendcis-67.4153.8-5.229.5-34.3000112.3H162 M167H162-P164 CarbonylContact O-C 3.56Å; P164-M167 HydrophobicContact CB-CE 3.96Å
165P73.1Confident77.2Confident14 Ų1467 Ų679%0.09136%0.363CS..  trans-60.4157.1175.327.9-35.9000110.5Y24 M167 I170 L250 Y259Y24-P165 HydrophobicContact CD1-CG 4.06Å; Y24-P165 HydrophobicContact CD2-CB 3.89Å; Y24-P165 HydrophobicContact CD2-CG 4Å; Y24-P165 HydrophobicContact CE1-CG 4.29Å; Y24-P165 HydrophobicContact CE2-CB 3.83Å; Y24-P165 HydrophobicContact CE2-CG 4.24Å; Y24-P165 HydrophobicContact CG-CB 4.31Å; Y24-P165 HydrophobicContact CG-CG 3.89Å; P165-M167 PolarHBondContact O-N 3.47Å; P165-I170 HydrophobicContact CB-CD1 4.39Å; P165-I170 HydrophobicContact CG-CD1 3.73Å; P165-L250 HydrophobicContact CB-CD2 4.38Å; P165-Y259 HydrophobicContact CB-CE1 4.35Å
166D78.2Confident77.8Confident35 Ų3561 Ų6119%0.18734%0.34CS..  trans-58.1112.2172.5-175.7-2.5000109.5N168 L169 Y259D166-N168 PolarHBondContact O-N 3.47Å; D166-N168 VanDerWaalsContact O-N 3.14Å; D166-N168 VanDerWaalsContact OD1-CB 3.29Å; D166-N168 WeakPolarHBondContact OD1-CB 3.48Å; D166-N168 PolarHBondContact OD1-N 2.91Å; D166-N168 PolarHBondContact OD1-ND2 3.32Å; D166-L169 HydrophobicContact CB-CD1 3.99Å; D166-L169 HydrophobicContact CB-CG 4.24Å; D166-L169 WeakPolarHBondContact O-CB 3.42Å; D166-L169 PolarHBondContact O-N 2.97Å; D166-Y259 HydrophobicContact CB-CE2 4.46Å; D166-Y259 PolarHBondContact N-OH 3.38Å
167M83.6Confident78.7Confident95 Ų9560.4 Ų60.447%0.46834%0.336SS..Hα-helixtrans-61.2-24.2-177.9-68.1-67.8165.700111.7P164 P165 L169 I170 I171P164-M167 HydrophobicContact CB-CE 3.96Å; P165-M167 PolarHBondContact O-N 3.47Å; M167-L169 VanDerWaalsContact C-N 3.29Å; M167-L169 PolarHBondContact O-N 3.38Å; M167-I170 PolarHBondContact O-N 3.27Å; M167-I170 VanDerWaalsContact O-N 3.14Å; M167-I170 HydrophobicContact SD-CD1 4.41Å; M167-I171 HydrophobicContact CB-CD1 4.11Å; M167-I171 WeakPolarHBondContact O-CB 3.32Å; M167-I171 WeakPolarHBondContact O-CG1 3.47Å; M167-I171 PolarHBondContact O-N 3.2Å
168N84.4Confident79.8Confident70 Ų7058 Ų5837%0.37432%0.323SS..Hα-helixtrans-62.8-36.1175.2-66.9-28.4000112D166 I170 L172D166-N168 PolarHBondContact O-N 3.47Å; D166-N168 VanDerWaalsContact O-N 3.14Å; D166-N168 VanDerWaalsContact OD1-CB 3.29Å; D166-N168 WeakPolarHBondContact OD1-CB 3.48Å; D166-N168 PolarHBondContact OD1-N 2.91Å; D166-N168 PolarHBondContact OD1-ND2 3.32Å; N168-I170 PolarHBondContact O-N 3.45Å; N168-L172 HydrophobicContact CB-CD1 3.89Å; N168-L172 VanDerWaalsContact O-CB 3.27Å; N168-L172 WeakPolarHBondContact O-CB 3.19Å; N168-L172 WeakPolarHBondContact O-CG 3.42Å; N168-L172 PolarHBondContact O-N 3.44Å; N168-L172 VanDerWaalsContact O-N 3.11Å
169L82.9Confident80.9Confident1 Ų154.6 Ų54.61%0.00531%0.305CS..Hα-helixtrans-66.5-25.8176.5-69168.4000112.6F14 I152 D166 M167 P173 L250 Y259F14-L169 HydrophobicContact CD2-CD2 4.21Å; F14-L169 HydrophobicContact CE2-CD2 3.32Å; F14-L169 HydrophobicContact CZ-CD2 3.56Å; I152-L169 HydrophobicContact CG2-CD2 3.39Å; I152-L169 HydrophobicContact CG2-CG 4.39Å; D166-L169 HydrophobicContact CB-CD1 3.99Å; D166-L169 HydrophobicContact CB-CG 4.24Å; D166-L169 WeakPolarHBondContact O-CB 3.42Å; D166-L169 PolarHBondContact O-N 2.97Å; M167-L169 VanDerWaalsContact C-N 3.29Å; M167-L169 PolarHBondContact O-N 3.38Å; L169-P173 WeakPolarHBondContact O-CD 3.29Å; L169-P173 VanDerWaalsContact O-CG 3.3Å; L169-P173 WeakPolarHBondContact O-CG 3.32Å; L169-L250 HydrophobicContact CB-CD1 4.46Å; L169-L250 HydrophobicContact CB-CD2 4.03Å; L169-L250 HydrophobicContact CD1-CD1 4.31Å; L169-Y259 HydrophobicContact CD1-CD1 4.03Å; L169-Y259 HydrophobicContact CD1-CD2 3.36Å; L169-Y259 HydrophobicContact CD1-CE1 4.31Å; L169-Y259 HydrophobicContact CD1-CE2 3.69Å; L169-Y259 HydrophobicContact CD1-CG 3.54Å
170I86.4Confident82.3Confident39 Ų3953.4 Ų53.420%0.229%0.286CS..Hα-helixtrans-89.6-46.9-179.7-63.9173.5000110.5V22 P165 M167 N168 V174 L250V22-I170 HydrophobicContact CB-CB 4.46Å; V22-I170 HydrophobicContact CB-CG2 4.2Å; V22-I170 HydrophobicContact CG1-CG1 4.21Å; V22-I170 WeakPolarHBondContact CG2-O 3.24Å; P165-I170 HydrophobicContact CB-CD1 4.39Å; P165-I170 HydrophobicContact CG-CD1 3.73Å; M167-I170 PolarHBondContact O-N 3.27Å; M167-I170 VanDerWaalsContact O-N 3.14Å; M167-I170 HydrophobicContact SD-CD1 4.41Å; N168-I170 PolarHBondContact O-N 3.45Å; I170-V174 WeakPolarHBondContact O-CG2 3.33Å; I170-L250 HydrophobicContact CD1-CD2 4.4Å; I170-L250 HydrophobicContact CG1-CD2 3.86Å
171I89.2Confident83.8Confident81 Ų8150.9 Ų50.942%0.41526%0.262SS..Hα-helixtrans-81.1-43.7-168.8-65.5170.8000112M167 V174 I175M167-I171 HydrophobicContact CB-CD1 4.11Å; M167-I171 WeakPolarHBondContact O-CB 3.32Å; M167-I171 WeakPolarHBondContact O-CG1 3.47Å; M167-I171 PolarHBondContact O-N 3.2Å; I171-V174 PolarHBondContact O-N 3.14Å; I171-I175 HydrophobicContact CG2-CD1 3.4Å; I171-I175 HydrophobicContact CG2-CG1 3.89Å; I171-I175 WeakPolarHBondContact O-CG1 3.35Å; I171-I175 PolarHBondContact O-N 3.31Å
172L88.2Confident85.4Confident37 Ų3747.6 Ų47.619%0.19425%0.25CS..Hα-helixtrans-62.8-44.6-172.1-69.6170.5000113.9I152 N168 V174 I175 Q176I152-L172 HydrophobicContact CD1-CB 4.25Å; I152-L172 HydrophobicContact CD1-CD1 3.51Å; I152-L172 HydrophobicContact CG1-CD1 3.72Å; N168-L172 HydrophobicContact CB-CD1 3.89Å; N168-L172 VanDerWaalsContact O-CB 3.27Å; N168-L172 WeakPolarHBondContact O-CB 3.19Å; N168-L172 WeakPolarHBondContact O-CG 3.42Å; N168-L172 PolarHBondContact O-N 3.44Å; N168-L172 VanDerWaalsContact O-N 3.11Å; L172-V174 VanDerWaalsContact C-N 3.27Å; L172-V174 PolarHBondContact O-N 3.47Å; L172-I175 PolarHBondContact O-N 3.48Å; L172-Q176 WeakPolarHBondContact O-CB 3.37Å; L172-Q176 PolarHBondContact O-N 3.27Å
173P87Confident86.7Confident1 Ų145.3 Ų45.31%0.00624%0.24CC..Hα-helixtrans-59.7-37.5175.6-14.621.4000113.4F16 Y19 V22 L169 Q176 N177 M261F16-P173 HydrophobicContact CD1-CB 3.77Å; F16-P173 HydrophobicContact CD1-CG 3.66Å; F16-P173 HydrophobicContact CE1-CB 4.35Å; F16-P173 HydrophobicContact CE1-CG 3.72Å; Y19-P173 HydrophobicContact CD2-CB 3.81Å; V22-P173 HydrophobicContact CG2-CB 4.24Å; V22-P173 HydrophobicContact CG2-CG 4.05Å; L169-P173 WeakPolarHBondContact O-CD 3.29Å; L169-P173 VanDerWaalsContact O-CG 3.3Å; L169-P173 WeakPolarHBondContact O-CG 3.32Å; P173-Q176 PolarHBondContact O-N 2.9Å; P173-N177 WeakPolarHBondContact O-CB 3.49Å; P173-N177 PolarHBondContact O-N 2.81Å; P173-M261 HydrophobicContact CB-CE 4.46Å; P173-M261 HydrophobicContact CG-CE 3.82Å
174V91Very high88.1Confident35 Ų3541.3 Ų41.321%0.21222%0.219CC..Hα-helixtrans-70.3-46.1179.8179.90000110.7V22 I170 I171 L172 Q176 N177 I178V22-V174 HydrophobicContact CG2-CG2 4.14Å; I170-V174 WeakPolarHBondContact O-CG2 3.33Å; I171-V174 PolarHBondContact O-N 3.14Å; L172-V174 VanDerWaalsContact C-N 3.27Å; L172-V174 PolarHBondContact O-N 3.47Å; V174-Q176 VanDerWaalsContact C-N 3.26Å; V174-Q176 PolarHBondContact O-N 3.25Å; V174-N177 WeakPolarHBondContact O-CB 3.44Å; V174-N177 PolarHBondContact O-N 3.44Å; V174-I178 HydrophobicContact CG1-CD1 4.02Å; V174-I178 WeakPolarHBondContact O-CG1 3.49Å; V174-I178 PolarHBondContact O-N 3.28Å
175I91.4Very high89.6Confident70 Ų7037.6 Ų37.636%0.35919%0.193SC..Hα-helixtrans-57.9-43.7173.5-70.3-179.9000110.2I144 I171 L172 N177 I178 L179I144-I175 HydrophobicContact CD1-CG2 4.34Å; I171-I175 HydrophobicContact CG2-CD1 3.4Å; I171-I175 HydrophobicContact CG2-CG1 3.89Å; I171-I175 WeakPolarHBondContact O-CG1 3.35Å; I171-I175 PolarHBondContact O-N 3.31Å; L172-I175 PolarHBondContact O-N 3.48Å; I175-N177 PolarHBondContact O-N 3.5Å; I175-I178 PolarHBondContact O-N 2.88Å; I175-L179 HydrophobicContact CG2-CD1 3.82Å; I175-L179 HydrophobicContact CG2-CG 4.26Å; I175-L179 WeakPolarHBondContact O-CB 3.31Å; I175-L179 VanDerWaalsContact O-CG 3.3Å; I175-L179 WeakPolarHBondContact O-CG 3.41Å; I175-L179 PolarHBondContact O-N 3.24Å
176Q90.8Very high90.7Very high1 Ų136.9 Ų36.91%0.00519%0.189CC..Hα-helixtrans-62.9-41.4179.2-178.7172.5-4.100111.8F141 L172 P173 V174 L179 M180F141-Q176 HydrophobicContact CD2-CB 4.5Å; F141-Q176 HydrophobicContact CD2-CG 3.34Å; F141-Q176 WeakPolarHBondContact CD2-O 3.48Å; F141-Q176 HydrophobicContact CE2-CG 3.14Å; F141-Q176 HydrophobicContact CZ-CG 4.21Å; F141-Q176 VanDerWaalsContact CZ-NE2 3.3Å; L172-Q176 WeakPolarHBondContact O-CB 3.37Å; L172-Q176 PolarHBondContact O-N 3.27Å; P173-Q176 PolarHBondContact O-N 2.9Å; V174-Q176 VanDerWaalsContact C-N 3.26Å; V174-Q176 PolarHBondContact O-N 3.25Å; Q176-L179 PolarHBondContact O-N 3.45Å; Q176-M180 PolarHBondContact O-N 2.76Å; Q176-M180 VanDerWaalsContact O-N 3.07Å
177N92.1Very high91.6Very high7 Ų735.7 Ų35.74%0.03718%0.182CC..Hα-helixtrans-60.9-48172.6-174.325.2000111.8F18 Y19 Y20 P173 V174 I175 L179 M180 F181 H243F18-N177 VanDerWaalsContact C-CG 3.5Å; F18-N177 HydrophobicContact CB-CB 4.14Å; F18-N177 VanDerWaalsContact CB-OD1 3.3Å; F18-N177 WeakPolarHBondContact CB-OD1 3.42Å; F18-N177 VanDerWaalsContact O-CG 3.31Å; F18-N177 PolarHBondContact O-ND2 3.46Å; F18-N177 PolarHBondContact O-OD1 3.37Å; Y19-N177 VanDerWaalsContact C-ND2 3.31Å; Y19-N177 VanDerWaalsContact O-CB 3.3Å; Y19-N177 WeakPolarHBondContact O-CB 3.41Å; Y19-N177 PolarHBondContact O-ND2 2.88Å; Y20-N177 WeakPolarHBondContact CA-ND2 3.25Å; Y20-N177 PolarHBondContact N-ND2 2.79Å; P173-N177 WeakPolarHBondContact O-CB 3.49Å; P173-N177 PolarHBondContact O-N 2.81Å; V174-N177 WeakPolarHBondContact O-CB 3.44Å; V174-N177 PolarHBondContact O-N 3.44Å; I175-N177 PolarHBondContact O-N 3.5Å; N177-L179 VanDerWaalsContact C-N 3.34Å; N177-L179 PolarHBondContact O-N 3.32Å; N177-M180 PolarHBondContact O-N 2.95Å; N177-F181 WeakPolarHBondContact O-CB 3.44Å; N177-F181 PolarHBondContact O-N 3.26Å; N177-H243 PolarHBondContact ND2-O 2.86Å; N177-H243 WeakPolarHBondContact OD1-CB 3.36Å; N177-H243 PolarHBondContact OD1-ND1 3.38Å
178I94.1Very high92.3Very high86 Ų8631.2 Ų31.244%0.44116%0.16SC..Hα-helixtrans-60-42.9178.4-67.9167.1000111.5V174 I175 F181 I182V174-I178 HydrophobicContact CG1-CD1 4.02Å; V174-I178 WeakPolarHBondContact O-CG1 3.49Å; V174-I178 PolarHBondContact O-N 3.28Å; I175-I178 PolarHBondContact O-N 2.88Å; I178-F181 WeakPolarHBondContact O-CB 3.48Å; I178-F181 PolarHBondContact O-N 2.86Å; I178-I182 HydrophobicContact CG2-CD1 3.94Å; I178-I182 VanDerWaalsContact O-CG1 3.32Å; I178-I182 WeakPolarHBondContact O-CG1 3.31Å; I178-I182 PolarHBondContact O-N 2.9Å
179L94Very high92.9Very high27 Ų2727.9 Ų27.914%0.14114%0.143CC..Hα-helixtrans-64.5-41.4178.1-73.6169.6000112.2I140 F141 I144 I175 Q176 N177 I182 A183I140-L179 HydrophobicContact CB-CD1 4.23Å; I140-L179 HydrophobicContact CB-CD2 4.41Å; I140-L179 HydrophobicContact CG2-CD1 3.52Å; I140-L179 HydrophobicContact CG2-CD2 4.2Å; F141-L179 HydrophobicContact CB-CB 4.32Å; I144-L179 HydrophobicContact CD1-CD1 3.56Å; I175-L179 HydrophobicContact CG2-CD1 3.82Å; I175-L179 HydrophobicContact CG2-CG 4.26Å; I175-L179 WeakPolarHBondContact O-CB 3.31Å; I175-L179 VanDerWaalsContact O-CG 3.3Å; I175-L179 WeakPolarHBondContact O-CG 3.41Å; I175-L179 PolarHBondContact O-N 3.24Å; Q176-L179 PolarHBondContact O-N 3.45Å; N177-L179 VanDerWaalsContact C-N 3.34Å; N177-L179 PolarHBondContact O-N 3.32Å; L179-I182 PolarHBondContact O-N 3.47Å; L179-A183 WeakPolarHBondContact O-CB 3Å; L179-A183 PolarHBondContact O-N 3.37Å
180M92.5Very high93.6Very high29 Ų2927.9 Ų27.914%0.14314%0.143CC..Hα-helixtrans-65.3-43.4175-173.959.973.600111.1F18 F141 Q176 N177 I182 A183 E184F18-M180 HydrophobicContact CD1-CB 3.79Å; F18-M180 HydrophobicContact CD1-CG 3.98Å; F18-M180 HydrophobicContact CE1-CB 3.66Å; F18-M180 HydrophobicContact CE1-CE 3.61Å; F18-M180 HydrophobicContact CE1-CG 3.51Å; F18-M180 HydrophobicContact CE1-SD 4.4Å; F18-M180 HydrophobicContact CZ-CE 3.93Å; F18-M180 HydrophobicContact CZ-CG 4.15Å; F141-M180 HydrophobicContact CD1-CE 3.23Å; F141-M180 HydrophobicContact CD2-CB 3.97Å; F141-M180 HydrophobicContact CD2-CE 3.72Å; F141-M180 HydrophobicContact CE1-CE 3.11Å; F141-M180 HydrophobicContact CE2-CB 4.14Å; F141-M180 HydrophobicContact CE2-CE 3.58Å; F141-M180 HydrophobicContact CG-CE 3.57Å; F141-M180 HydrophobicContact CZ-CE 3.32Å; Q176-M180 PolarHBondContact O-N 2.76Å; Q176-M180 VanDerWaalsContact O-N 3.07Å; N177-M180 PolarHBondContact O-N 2.95Å; M180-I182 VanDerWaalsContact C-N 3.33Å; M180-I182 PolarHBondContact O-N 3.34Å; M180-A183 WeakPolarHBondContact O-CB 3.24Å; M180-A183 PolarHBondContact O-N 3.2Å; M180-A183 VanDerWaalsContact O-N 3.11Å; M180-E184 HydrophobicContact CG-CG 4.33Å; M180-E184 WeakPolarHBondContact O-CG 3.49Å; M180-E184 PolarHBondContact O-N 3.46Å; M180-E184 HydrophobicContact SD-CG 4.29Å
181F95.2Very high94.1Very high52 Ų5226 Ų2623%0.22813%0.133CC..Hα-helixtrans-54.7-47.4174.4164.2-111.5000112N177 I178 A183 E184 I185 I236 A239 G240 H243N177-F181 WeakPolarHBondContact O-CB 3.44Å; N177-F181 PolarHBondContact O-N 3.26Å; I178-F181 WeakPolarHBondContact O-CB 3.48Å; I178-F181 PolarHBondContact O-N 2.86Å; F181-A183 PolarHBondContact O-N 2.88Å; F181-E184 PolarHBondContact O-N 2.96Å; F181-I185 HydrophobicContact CD1-CD1 4.1Å; F181-I185 HydrophobicContact CD2-CD1 4.01Å; F181-I185 HydrophobicContact CD2-CG1 4.38Å; F181-I185 HydrophobicContact CE1-CD1 3.62Å; F181-I185 HydrophobicContact CE2-CD1 3.49Å; F181-I185 VanDerWaalsContact CE2-CD1 3.49Å; F181-I185 HydrophobicContact CE2-CG1 4.03Å; F181-I185 HydrophobicContact CG-CD1 4.31Å; F181-I185 HydrophobicContact CZ-CD1 3.31Å; F181-I185 HydrophobicContact CZ-CG1 4.33Å; F181-I185 WeakPolarHBondContact O-CG1 3.26Å; F181-I185 PolarHBondContact O-N 2.94Å; F181-I236 HydrophobicContact CZ-CG2 4.28Å; F181-A239 HydrophobicContact CD2-CB 3.78Å; F181-A239 HydrophobicContact CE2-CB 3.85Å; F181-G240 VanDerWaalsContact CE2-CA 3.46Å; F181-G240 VanDerWaalsContact CE2-N 3.35Å; F181-H243 HydrophobicContact CB-CB 4.3Å; F181-H243 AromaticContact CD2-CD2 3.98Å
182I96.4Very high94.5Very high70 Ų7023.5 Ų23.536%0.35912%0.119SC..Hα-helixtrans-61.6-44.3175.8-68.3166.1000111.1I133 I178 L179 M180 E184 I185 G186I133-I182 HydrophobicContact CG2-CG2 3.67Å; I133-I182 WeakPolarHBondContact CG2-O 3.33Å; I178-I182 HydrophobicContact CG2-CD1 3.94Å; I178-I182 VanDerWaalsContact O-CG1 3.32Å; I178-I182 WeakPolarHBondContact O-CG1 3.31Å; I178-I182 PolarHBondContact O-N 2.9Å; L179-I182 PolarHBondContact O-N 3.47Å; M180-I182 VanDerWaalsContact C-N 3.33Å; M180-I182 PolarHBondContact O-N 3.34Å; I182-E184 VanDerWaalsContact C-N 3.33Å; I182-E184 PolarHBondContact O-N 2.91Å; I182-I185 PolarHBondContact O-N 2.82Å; I182-G186 PolarHBondContact O-N 3.42Å; I182-G186 VanDerWaalsContact O-N 3.12Å
183A96.5Very high95Very high2 Ų221.8 Ų21.82%0.01711%0.109CC..Hα-helixtrans-60.9-42.7178.100000111.5F134 A138 L179 M180 F181 G186 L187F134-A183 HydrophobicContact CD2-CB 4.46Å; F134-A183 WeakPolarHBondContact CD2-O 3.38Å; A138-A183 HydrophobicContact CB-CB 4.5Å; L179-A183 WeakPolarHBondContact O-CB 3Å; L179-A183 PolarHBondContact O-N 3.37Å; M180-A183 WeakPolarHBondContact O-CB 3.24Å; M180-A183 PolarHBondContact O-N 3.2Å; M180-A183 VanDerWaalsContact O-N 3.11Å; F181-A183 PolarHBondContact O-N 2.88Å; A183-G186 WeakPolarHBondContact O-CA 3.5Å; A183-G186 PolarHBondContact O-N 2.9Å; A183-L187 PolarHBondContact O-N 3.39Å
184E96.1Very high95.5Very high23 Ų2321.8 Ų21.811%0.10711%0.109CC..Hα-helixtrans-67.3-38.5179.4-73.8-166.4-172.700113.1M180 F181 I182 G186 L187 F188 A239 K242 H243M180-E184 HydrophobicContact CG-CG 4.33Å; M180-E184 WeakPolarHBondContact O-CG 3.49Å; M180-E184 PolarHBondContact O-N 3.46Å; M180-E184 HydrophobicContact SD-CG 4.29Å; F181-E184 PolarHBondContact O-N 2.96Å; I182-E184 VanDerWaalsContact C-N 3.33Å; I182-E184 PolarHBondContact O-N 2.91Å; E184-G186 VanDerWaalsContact C-N 3.27Å; E184-G186 PolarHBondContact O-N 3.2Å; E184-L187 PolarHBondContact O-N 3.25Å; E184-F188 HydrophobicContact CB-CE1 4.37Å; E184-F188 HydrophobicContact CB-CZ 4.36Å; E184-F188 VanDerWaalsContact O-CD1 3.32Å; E184-F188 WeakPolarHBondContact O-CD1 3.29Å; E184-F188 VanDerWaalsContact O-CG 3.31Å; E184-F188 WeakPolarHBondContact O-CG 3.29Å; E184-F188 PolarHBondContact O-N 3.44Å; E184-A239 HydrophobicContact CB-CB 4.4Å; E184-K242 IonicContact OE1-NZ 3.85Å; E184-K242 PolarHBondContact OE1-NZ 2.98Å; E184-K242 VanDerWaalsContact OE2-CD 3.3Å; E184-K242 WeakPolarHBondContact OE2-CD 3.3Å; E184-K242 IonicContact OE2-NZ 3.59Å; E184-K242 PolarHBondContact OE2-NZ 2.85Å; E184-H243 VanDerWaalsContact CD-NE2 3.32Å; E184-H243 IonicContact OE1-NE2 3.44Å; E184-H243 IonicContact OE2-NE2 2.63Å; E184-H243 PolarHBondContact OE2-NE2 2.88Å
185I97.8Very high95.8Very high14 Ų1420.3 Ų20.37%0.07210%0.101CC..Hα-helixtrans-57.1-46.7170.5-67.9162.6000109.9F181 I182 L187 S189 F232 I236 A239F181-I185 HydrophobicContact CD1-CD1 4.1Å; F181-I185 HydrophobicContact CD2-CD1 4.01Å; F181-I185 HydrophobicContact CD2-CG1 4.38Å; F181-I185 HydrophobicContact CE1-CD1 3.62Å; F181-I185 HydrophobicContact CE2-CD1 3.49Å; F181-I185 VanDerWaalsContact CE2-CD1 3.49Å; F181-I185 HydrophobicContact CE2-CG1 4.03Å; F181-I185 HydrophobicContact CG-CD1 4.31Å; F181-I185 HydrophobicContact CZ-CD1 3.31Å; F181-I185 HydrophobicContact CZ-CG1 4.33Å; F181-I185 WeakPolarHBondContact O-CG1 3.26Å; F181-I185 PolarHBondContact O-N 2.94Å; I182-I185 PolarHBondContact O-N 2.82Å; I185-L187 VanDerWaalsContact C-N 3.34Å; I185-L187 PolarHBondContact O-N 2.97Å; I185-S189 WeakPolarHBondContact O-CB 3.33Å; I185-S189 PolarHBondContact O-N 3.42Å; I185-S189 PolarHBondContact O-OG 3.42Å; I185-F232 HydrophobicContact CG2-CD2 4.28Å; I185-F232 HydrophobicContact CG2-CE2 3.6Å; I185-F232 HydrophobicContact CG2-CZ 3.84Å; I185-I236 HydrophobicContact CD1-CB 4.45Å; I185-I236 HydrophobicContact CD1-CG1 3.82Å; I185-I236 HydrophobicContact CG1-CG1 4.08Å; I185-I236 HydrophobicContact CG2-CG1 3.95Å; I185-A239 HydrophobicContact CG1-CB 4.01Å
186G97.5Very high96.1Very high0 Ų017.6 Ų17.60%09%0.087CC..Hα-helixtrans-57.5-46.4175.600000112I182 A183 E184 R190I182-G186 PolarHBondContact O-N 3.42Å; I182-G186 VanDerWaalsContact O-N 3.12Å; A183-G186 WeakPolarHBondContact O-CA 3.5Å; A183-G186 PolarHBondContact O-N 2.9Å; E184-G186 VanDerWaalsContact C-N 3.27Å; E184-G186 PolarHBondContact O-N 3.2Å; G186-R190 WeakPolarHBondContact O-CB 3.29Å; G186-R190 PolarHBondContact O-N 2.96Å
187L96.9Very high96.4Very high9 Ų917.8 Ų17.85%0.0479%0.088CC..Hα-helixtrans-62.6-51.2179.8-178.158.8000112.3F134 A183 E184 I185 S189 R190 N191 I394F134-L187 HydrophobicContact CD2-CB 3.75Å; F134-L187 HydrophobicContact CD2-CD1 4.35Å; F134-L187 HydrophobicContact CD2-CG 4.48Å; F134-L187 HydrophobicContact CE2-CB 4.1Å; F134-L187 HydrophobicContact CE2-CD1 4.16Å; F134-L187 HydrophobicContact CE2-CD2 4.24Å; F134-L187 HydrophobicContact CE2-CG 4.39Å; F134-L187 HydrophobicContact CG-CB 4.39Å; F134-L187 HydrophobicContact CZ-CD1 4.32Å; A183-L187 PolarHBondContact O-N 3.39Å; E184-L187 PolarHBondContact O-N 3.25Å; I185-L187 VanDerWaalsContact C-N 3.34Å; I185-L187 PolarHBondContact O-N 2.97Å; L187-S189 VanDerWaalsContact C-N 3.33Å; L187-S189 PolarHBondContact O-N 2.98Å; L187-R190 PolarHBondContact O-N 2.87Å; L187-N191 PolarHBondContact O-N 3.34Å; L187-N191 VanDerWaalsContact O-N 3.08Å; L187-N191 PolarHBondContact O-OD1 3.19Å; L187-I394 HydrophobicContact CD1-CD1 4.45Å; L187-I394 HydrophobicContact CD1-CG2 3.68Å; L187-I394 HydrophobicContact CD2-CD1 4.44Å
188F97.6Very high96.6Very high1 Ų117.5 Ų17.50%0.0049%0.086CC..Hα-helixtrans-61.9-45.9-179.1-663.1000110.2E184 R190 N191 W192 I238 A239 V281 Y284 R285E184-F188 HydrophobicContact CB-CE1 4.37Å; E184-F188 HydrophobicContact CB-CZ 4.36Å; E184-F188 VanDerWaalsContact O-CD1 3.32Å; E184-F188 WeakPolarHBondContact O-CD1 3.29Å; E184-F188 VanDerWaalsContact O-CG 3.31Å; E184-F188 WeakPolarHBondContact O-CG 3.29Å; E184-F188 PolarHBondContact O-N 3.44Å; F188-R190 VanDerWaalsContact C-N 3.33Å; F188-R190 PolarHBondContact O-N 2.9Å; F188-N191 PolarHBondContact O-N 3.3Å; F188-W192 VanDerWaalsContact O-CD1 3.29Å; F188-W192 PolarHBondContact O-N 3.49Å; F188-I238 HydrophobicContact CE2-CG2 3.99Å; F188-A239 HydrophobicContact CD2-CB 4.47Å; F188-A239 HydrophobicContact CE2-CB 4.01Å; F188-V281 HydrophobicContact CZ-CG1 4.01Å; F188-Y284 HydrophobicContact CB-CE1 4.21Å; F188-Y284 HydrophobicContact CD2-CD1 4.22Å; F188-Y284 HydrophobicContact CD2-CE1 4.06Å; F188-Y284 HydrophobicContact CG-CE1 4.38Å; F188-R285 HydrophobicContact CD1-CB 4.05Å; F188-R285 HydrophobicContact CD1-CG 3.73Å; F188-R285 HydrophobicContact CE1-CB 3.89Å; F188-R285 HydrophobicContact CE1-CG 3.6Å; F188-R285 HydrophobicContact CZ-CB 4.48Å
189S97.8Very high96.7Very high1 Ų113.9 Ų13.91%0.0077%0.069CC..Hα-helixtrans-65.6-36.7-179-560000112.1C130 I185 L187 C193 F232C130-S189 VanDerWaalsContact SG-CB 3.58Å; I185-S189 WeakPolarHBondContact O-CB 3.33Å; I185-S189 PolarHBondContact O-N 3.42Å; I185-S189 PolarHBondContact O-OG 3.42Å; L187-S189 VanDerWaalsContact C-N 3.33Å; L187-S189 PolarHBondContact O-N 2.98Å; S189-C193 VanDerWaalsContact O-CB 3.24Å; S189-C193 WeakPolarHBondContact O-CB 3.49Å; S189-C193 PolarHBondContact O-N 2.87Å; S189-F232 WeakPolarHBondContact OG-CD2 3.31Å
190R97.3Very high96.8Very high0 Ų013.2 Ų13.20%07%0.068CC..Hα-helixtrans-63-47.4174.3-173.3-161.370.1105.63.3111.3L127 C130 E131 G186 L187 F188 W192 C193 V194 E362 D397L127-R190 HydrophobicContact CD1-CG 3.59Å; C130-R190 HydrophobicContact CB-CB 3.79Å; C130-R190 HydrophobicContact CB-CG 4.46Å; E131-R190 VanDerWaalsContact CG-CD 3.43Å; E131-R190 HydrophobicContact CG-CG 3.75Å; G186-R190 WeakPolarHBondContact O-CB 3.29Å; G186-R190 PolarHBondContact O-N 2.96Å; L187-R190 PolarHBondContact O-N 2.87Å; F188-R190 VanDerWaalsContact C-N 3.33Å; F188-R190 PolarHBondContact O-N 2.9Å; R190-W192 VanDerWaalsContact C-N 3.35Å; R190-W192 PolarHBondContact O-N 2.84Å; R190-C193 WeakPolarHBondContact O-CA 3.33Å; R190-C193 VanDerWaalsContact O-CB 3.32Å; R190-C193 WeakPolarHBondContact O-CB 3.18Å; R190-C193 PolarHBondContact O-N 2.95Å; R190-C193 VanDerWaalsContact O-N 3.09Å; R190-V194 WeakPolarHBondContact O-CG2 3.1Å; R190-V194 PolarHBondContact O-N 2.93Å; R190-E362 IonicContact CZ-OE1 3.7Å; R190-E362 IonicContact NH2-OE1 3.72Å; R190-E362 PolarHBondContact NH2-OE1 3.46Å; R190-D397 IonicContact CZ-OD2 3.62Å; R190-D397 IonicContact NH1-OD2 2.66Å; R190-D397 PolarHBondContact NH1-OD2 2.83Å; R190-D397 IonicContact NH2-OD2 3.82Å
191N97.3Very high96.9Very high1 Ų112.8 Ų12.81%0.0057%0.065CC..Hα-helixtrans-59.6-46.7179.3-67.79.5000111.1L187 F188 C193 V194 C195 R285 T289 F358L187-N191 PolarHBondContact O-N 3.34Å; L187-N191 VanDerWaalsContact O-N 3.08Å; L187-N191 PolarHBondContact O-OD1 3.19Å; F188-N191 PolarHBondContact O-N 3.3Å; N191-C193 VanDerWaalsContact C-N 3.33Å; N191-C193 PolarHBondContact O-N 3.41Å; N191-V194 PolarHBondContact O-N 3.17Å; N191-C195 PolarHBondContact O-N 2.91Å; N191-R285 PolarHBondContact ND2-O 3.43Å; N191-T289 HydrophobicContact CB-CG2 4.17Å; N191-F358 HydrophobicContact CB-CE2 4.1Å; N191-F358 HydrophobicContact CB-CZ 4.16Å; N191-F358 WeakPolarHBondContact OD1-CE2 3.27Å
192W98Very high96.9Very high28 Ų2810.4 Ų10.411%0.1065%0.054CC..Hα-helixtrans-65.3-34.5174.4-81.2106.3000112.9F188 R190 C195 L196 L231 Y284 I288 T289 L292F188-W192 VanDerWaalsContact O-CD1 3.29Å; F188-W192 PolarHBondContact O-N 3.49Å; R190-W192 VanDerWaalsContact C-N 3.35Å; R190-W192 PolarHBondContact O-N 2.84Å; W192-C195 HydrophobicContact CE3-CB 4.44Å; W192-C195 WeakPolarHBondContact O-CB 3.23Å; W192-C195 PolarHBondContact O-N 3.34Å; W192-L196 WeakPolarHBondContact O-CG 3.32Å; W192-L196 PolarHBondContact O-N 3.22Å; W192-L231 HydrophobicContact CB-CB 4.34Å; W192-L231 HydrophobicContact CB-CD1 4.1Å; W192-L231 HydrophobicContact CD2-CD1 4.06Å; W192-L231 HydrophobicContact CD2-CD2 3.91Å; W192-L231 HydrophobicContact CD2-CG 4.47Å; W192-L231 HydrophobicContact CE3-CD1 3.68Å; W192-L231 HydrophobicContact CE3-CD2 3.9Å; W192-L231 HydrophobicContact CE3-CG 4.41Å; W192-L231 HydrophobicContact CG-CB 4.42Å; W192-L231 HydrophobicContact CG-CD1 4.26Å; W192-L231 HydrophobicContact CG-CD2 4.4Å; W192-L231 HydrophobicContact CH2-CD2 4.47Å; W192-L231 HydrophobicContact CZ3-CD1 4.42Å; W192-L231 HydrophobicContact CZ3-CD2 4.18Å; W192-Y284 AromaticContact CD1-CE1 3.93Å; W192-Y284 AromaticContact CD1-CZ 3.65Å; W192-Y284 AromaticContact CE2-CE2 3.61Å; W192-Y284 AromaticContact CE2-CZ 3.93Å; W192-Y284 AromaticContact CZ2-CD2 3.81Å; W192-Y284 HydrophobicContact CZ2-CD2 3.81Å; W192-Y284 AromaticContact CZ2-CE2 3.7Å; W192-Y284 HydrophobicContact CZ2-CE2 3.7Å; W192-Y284 AromaticContact NE1-CD1 3.9Å; W192-Y284 AromaticContact NE1-CD2 3.68Å; W192-Y284 AromaticContact NE1-CE1 3.48Å; W192-Y284 AromaticContact NE1-CE2 3.24Å; W192-Y284 AromaticContact NE1-CG 3.99Å; W192-Y284 AromaticContact NE1-CZ 3.12Å; W192-Y284 PolarHBondContact NE1-O 3.46Å; W192-Y284 PolarHBondContact NE1-OH 2.91Å; W192-I288 HydrophobicContact CH2-CG2 3.66Å; W192-I288 HydrophobicContact CZ2-CG2 4.12Å; W192-T289 HydrophobicContact CD2-CG2 3.64Å; W192-T289 HydrophobicContact CE3-CG2 4.1Å; W192-T289 HydrophobicContact CG-CG2 3.95Å; W192-T289 HydrophobicContact CZ2-CG2 4.06Å; W192-L292 HydrophobicContact CH2-CD1 4.41Å; W192-L292 HydrophobicContact CZ3-CD1 4.13Å
193C97.5Very high96.8Very high0 Ų07.8 Ų7.80%04%0.041CC..Hα-helixtrans-62.4-45.7173.6-1660000111.6L127 S189 R190 N191 C195 L196 I197 F228L127-C193 HydrophobicContact CD1-CB 4.23Å; S189-C193 VanDerWaalsContact O-CB 3.24Å; S189-C193 WeakPolarHBondContact O-CB 3.49Å; S189-C193 PolarHBondContact O-N 2.87Å; R190-C193 WeakPolarHBondContact O-CA 3.33Å; R190-C193 VanDerWaalsContact O-CB 3.32Å; R190-C193 WeakPolarHBondContact O-CB 3.18Å; R190-C193 PolarHBondContact O-N 2.95Å; R190-C193 VanDerWaalsContact O-N 3.09Å; N191-C193 VanDerWaalsContact C-N 3.33Å; N191-C193 PolarHBondContact O-N 3.41Å; C193-C195 VanDerWaalsContact C-N 3.31Å; C193-C195 PolarHBondContact O-N 3.12Å; C193-L196 PolarHBondContact O-N 3.14Å; C193-I197 WeakPolarHBondContact O-CB 3.41Å; C193-I197 WeakPolarHBondContact O-CD1 3.12Å; C193-I197 WeakPolarHBondContact O-CG1 3.36Å; C193-I197 PolarHBondContact O-N 3.2Å; C193-F228 HydrophobicContact CB-CD2 4.31Å; C193-F228 HydrophobicContact CB-CE2 3.86Å
194V97.4Very high96.5Very high1 Ų18.9 Ų8.91%0.0065%0.047CC..Hα-helixtrans-60.8-42.4175.4177.30000110.7L127 R190 N191 I197 T198 I293 V354 F358L127-V194 HydrophobicContact CD1-CG2 3.59Å; R190-V194 WeakPolarHBondContact O-CG2 3.1Å; R190-V194 PolarHBondContact O-N 2.93Å; N191-V194 PolarHBondContact O-N 3.17Å; V194-I197 PolarHBondContact O-N 2.95Å; V194-T198 WeakPolarHBondContact O-CB 3.42Å; V194-T198 PolarHBondContact O-N 3.23Å; V194-T198 PolarHBondContact O-OG1 3.31Å; V194-I293 HydrophobicContact CB-CD1 4.14Å; V194-I293 HydrophobicContact CG1-CD1 3.75Å; V194-I293 HydrophobicContact CG1-CG1 4.33Å; V194-V354 HydrophobicContact CG1-CG1 4.17Å; V194-V354 HydrophobicContact CG2-CG1 4.27Å; V194-F358 HydrophobicContact CB-CD2 4.49Å; V194-F358 HydrophobicContact CG1-CB 4.4Å; V194-F358 HydrophobicContact CG1-CD2 4.36Å; V194-F358 HydrophobicContact CG1-CG 4.28Å; V194-F358 HydrophobicContact CG2-CD2 4.38Å
195C97.5Very high96.3Very high4 Ų48 Ų83%0.0274%0.044CC..Hα-helixtrans-58-50.4174.2-178.70000111.8N191 W192 C193 I197 T198 A199 L292 I293N191-C195 PolarHBondContact O-N 2.91Å; W192-C195 HydrophobicContact CE3-CB 4.44Å; W192-C195 WeakPolarHBondContact O-CB 3.23Å; W192-C195 PolarHBondContact O-N 3.34Å; C193-C195 VanDerWaalsContact C-N 3.31Å; C193-C195 PolarHBondContact O-N 3.12Å; C195-I197 PolarHBondContact O-N 3.31Å; C195-T198 PolarHBondContact O-N 3Å; C195-A199 WeakPolarHBondContact O-CB 3.24Å; C195-A199 PolarHBondContact O-N 2.67Å; C195-L292 VanDerWaalsContact SG-CB 3.53Å; C195-I293 HydrophobicContact CB-CD1 4.22Å; C195-I293 HydrophobicContact CB-CG1 3.94Å
196L97.4Very high96Very high14 Ų149.1 Ų9.17%0.0735%0.049CC..Hα-helixtrans-63.7-39.5178.4-71.8175.6000112.8W192 C193 T198 A199 A200 L218 F224 I227 F228 L231W192-L196 WeakPolarHBondContact O-CG 3.32Å; W192-L196 PolarHBondContact O-N 3.22Å; C193-L196 PolarHBondContact O-N 3.14Å; L196-T198 VanDerWaalsContact C-N 3.32Å; L196-A199 PolarHBondContact O-N 3.34Å; L196-A200 WeakPolarHBondContact O-CB 3.37Å; L196-A200 PolarHBondContact O-N 3.43Å; L196-L218 HydrophobicContact CD2-CD2 4.03Å; L196-F224 HydrophobicContact CB-CD2 4.49Å; L196-F224 HydrophobicContact CB-CE2 3.64Å; L196-F224 HydrophobicContact CB-CZ 4.04Å; L196-F224 HydrophobicContact CD1-CE2 4.48Å; L196-F224 HydrophobicContact CD1-CZ 4.45Å; L196-I227 HydrophobicContact CD1-CG2 4.24Å; L196-I227 HydrophobicContact CD2-CG2 3.72Å; L196-F228 HydrophobicContact CD1-CB 4Å; L196-F228 HydrophobicContact CD1-CD2 4.2Å; L196-L231 HydrophobicContact CD1-CD1 3.79Å; L196-L231 HydrophobicContact CD2-CD1 4.23Å; L196-L231 HydrophobicContact CG-CD1 4.07Å
197I96.7Very high95.7Very high4 Ų414.3 Ų14.32%0.0217%0.069CC..Hα-helixtrans-60.3-45.3175-72.4164.2000110.1F120 L124 L127 C193 V194 C195 A200 R201 V351F120-I197 HydrophobicContact CE2-CG2 4.49Å; L124-I197 HydrophobicContact CD2-CD1 4.46Å; L127-I197 HydrophobicContact CB-CD1 4.11Å; L127-I197 HydrophobicContact CD2-CD1 4.06Å; C193-I197 WeakPolarHBondContact O-CB 3.41Å; C193-I197 WeakPolarHBondContact O-CD1 3.12Å; C193-I197 WeakPolarHBondContact O-CG1 3.36Å; C193-I197 PolarHBondContact O-N 3.2Å; V194-I197 PolarHBondContact O-N 2.95Å; C195-I197 PolarHBondContact O-N 3.31Å; I197-A200 PolarHBondContact O-N 3.3Å; I197-R201 VanDerWaalsContact O-CG 3.28Å; I197-R201 WeakPolarHBondContact O-CG 3.48Å; I197-R201 PolarHBondContact O-N 2.91Å; I197-V351 HydrophobicContact CG2-CB 4.28Å; I197-V351 HydrophobicContact CG2-CG1 3.87Å; I197-V351 HydrophobicContact CG2-CG2 3.43Å; I197-V351 VanDerWaalsContact CG2-CG2 3.43Å
198T97.3Very high95.1Very high1 Ų116.4 Ų16.41%0.0068%0.083CC..Hα-helixtrans-68.1-43.7-179.2-50.40000111.2V194 C195 L196 R201 A202 F296 I300 V351V194-T198 WeakPolarHBondContact O-CB 3.42Å; V194-T198 PolarHBondContact O-N 3.23Å; V194-T198 PolarHBondContact O-OG1 3.31Å; C195-T198 PolarHBondContact O-N 3Å; L196-T198 VanDerWaalsContact C-N 3.32Å; T198-R201 WeakPolarHBondContact O-CB 3.24Å; T198-R201 PolarHBondContact O-N 3.22Å; T198-A202 PolarHBondContact O-N 2.9Å; T198-F296 HydrophobicContact CG2-CB 3.65Å; T198-I300 HydrophobicContact CG2-CD1 4.21Å; T198-V351 HydrophobicContact CG2-CG1 4.38Å
199A96.5Very high94.2Very high10 Ų1023.9 Ų23.98%0.08312%0.122CC..Hα-helixtrans-60.8-46.7174.400000112.1C195 L196 R201 A202 E203 L218 F296C195-A199 WeakPolarHBondContact O-CB 3.24Å; C195-A199 PolarHBondContact O-N 2.67Å; L196-A199 PolarHBondContact O-N 3.34Å; A199-R201 PolarHBondContact O-N 3.41Å; A199-A202 WeakPolarHBondContact O-CB 3.43Å; A199-A202 PolarHBondContact O-N 3.47Å; A199-A202 VanDerWaalsContact O-N 3.16Å; A199-E203 PolarHBondContact O-N 2.98Å; A199-L218 HydrophobicContact CB-CD1 3.49Å; A199-L218 VanDerWaalsContact CB-CD1 3.49Å; A199-F296 HydrophobicContact CB-CD1 4.45Å; A199-F296 HydrophobicContact CB-CD2 3.69Å; A199-F296 HydrophobicContact CB-CE1 4.28Å; A199-F296 HydrophobicContact CB-CE2 3.49Å; A199-F296 VanDerWaalsContact CB-CE2 3.49Å; A199-F296 HydrophobicContact CB-CG 4.19Å; A199-F296 HydrophobicContact CB-CZ 3.81Å
200A95.2Very high93.1Very high14 Ų1424.3 Ų24.312%0.11613%0.126CC..Hα-helixtrans-60.4-33.5176.400000111.9L196 I197 V204 L218L196-A200 WeakPolarHBondContact O-CB 3.37Å; L196-A200 PolarHBondContact O-N 3.43Å; I197-A200 PolarHBondContact O-N 3.3Å; A200-V204 WeakPolarHBondContact O-CG2 3.33Å; A200-V204 PolarHBondContact O-N 3.04Å; A200-L218 HydrophobicContact CB-CB 3.7Å; A200-L218 HydrophobicContact CB-CD1 4.38Å
201R94.8Very high92Very high19 Ų1928.9 Ų28.97%0.07216%0.159CC..Hα-helixtrans-73.6-41.9174.4-73.6-69.3153.3-156.19.6113I197 T198 A199 E203 V204 V205 I300 V351I197-R201 VanDerWaalsContact O-CG 3.28Å; I197-R201 WeakPolarHBondContact O-CG 3.48Å; I197-R201 PolarHBondContact O-N 2.91Å; T198-R201 WeakPolarHBondContact O-CB 3.24Å; T198-R201 PolarHBondContact O-N 3.22Å; A199-R201 PolarHBondContact O-N 3.41Å; R201-E203 VanDerWaalsContact C-N 3.26Å; R201-E203 PolarHBondContact O-N 2.95Å; R201-V204 PolarHBondContact O-N 2.85Å; R201-V205 WeakPolarHBondContact O-CG2 3.47Å; R201-V205 PolarHBondContact O-N 3.47Å; R201-I300 HydrophobicContact CB-CD1 3.91Å; R201-V351 HydrophobicContact CB-CG1 4.18Å; R201-V351 HydrophobicContact CG-CB 3.8Å; R201-V351 HydrophobicContact CG-CG1 3.81Å; R201-V351 HydrophobicContact CG-CG2 3.57Å
202A95.1Very high91.4Very high2 Ų236.8 Ų36.82%0.01719%0.188CC..Hα-helixtrans-57.2-44.9174.800000110.2T198 A199 V204 V205 I206 F296 I300T198-A202 PolarHBondContact O-N 2.9Å; A199-A202 WeakPolarHBondContact O-CB 3.43Å; A199-A202 PolarHBondContact O-N 3.47Å; A199-A202 VanDerWaalsContact O-N 3.16Å; A202-V204 PolarHBondContact O-N 2.98Å; A202-V205 PolarHBondContact O-N 3.23Å; A202-V205 VanDerWaalsContact O-N 3.15Å; A202-I206 HydrophobicContact CB-CD1 4.07Å; A202-I206 WeakPolarHBondContact O-CB 3.39Å; A202-I206 WeakPolarHBondContact O-CD1 3.47Å; A202-I206 WeakPolarHBondContact O-CG1 3.16Å; A202-I206 PolarHBondContact O-N 2.85Å; A202-F296 HydrophobicContact CB-CB 4.12Å; A202-F296 HydrophobicContact CB-CD1 3.94Å; A202-F296 HydrophobicContact CB-CG 4.36Å; A202-I300 HydrophobicContact CB-CD1 4.21Å; A202-I300 HydrophobicContact CB-CG1 3.93Å
203E93.9Very high90.5Very high15 Ų1539.4 Ų39.47%0.0721%0.211CC..Hα-helixtrans-53.7-48.1175.4-171.4-171.2104.400112.3A199 R201 V205 W207 Q215 R216 I217 L218 R219A199-E203 PolarHBondContact O-N 2.98Å; R201-E203 VanDerWaalsContact C-N 3.26Å; R201-E203 PolarHBondContact O-N 2.95Å; E203-V205 PolarHBondContact O-N 3.17Å; E203-W207 HydrophobicContact CB-CE3 4.47Å; E203-W207 HydrophobicContact CG-CE3 4.02Å; E203-W207 HydrophobicContact CG-CZ3 4.27Å; E203-W207 PolarHBondContact O-N 2.68Å; E203-Q215 WeakPolarHBondContact CG-O 3.4Å; E203-R216 WeakPolarHBondContact OE1-CA 3.45Å; E203-I217 PolarHBondContact OE1-N 3.16Å; E203-I217 PolarHBondContact OE2-N 3.03Å; E203-L218 PolarHBondContact OE2-N 3.32Å; E203-R219 VanDerWaalsContact OE1-CB 3.22Å; E203-R219 WeakPolarHBondContact OE1-CB 3.15Å; E203-R219 PolarHBondContact OE1-N 2.93Å; E203-R219 VanDerWaalsContact OE1-N 3.12Å
204V92Very high89.8Confident26 Ų2647.2 Ų47.216%0.15824%0.241CC..Hα-helixtrans-67.4-35.5179.31730000112.8A200 R201 A202 P208 Q344A200-V204 WeakPolarHBondContact O-CG2 3.33Å; A200-V204 PolarHBondContact O-N 3.04Å; R201-V204 PolarHBondContact O-N 2.85Å; A202-V204 PolarHBondContact O-N 2.98Å; V204-P208 WeakPolarHBondContact O-CA 3.49Å; V204-Q344 HydrophobicContact CG1-CG 4.49Å
205V91.9Very high89Confident5 Ų548.8 Ų48.83%0.0325%0.248CC..Hα-helixtrans-78.8-40.5-178172.40000111.5R201 A202 E203 I300 R303 L304 T348R201-V205 WeakPolarHBondContact O-CG2 3.47Å; R201-V205 PolarHBondContact O-N 3.47Å; A202-V205 PolarHBondContact O-N 3.23Å; A202-V205 VanDerWaalsContact O-N 3.15Å; E203-V205 PolarHBondContact O-N 3.17Å; V205-I300 HydrophobicContact CG2-CG2 4.42Å; V205-R303 HydrophobicContact CG1-CB 3.85Å; V205-R303 HydrophobicContact CG1-CG 3.77Å; V205-L304 HydrophobicContact CG1-CD2 4.35Å; V205-L304 HydrophobicContact CG1-CG 4.34Å; V205-T348 HydrophobicContact CG2-CG2 4.05Å
206I91.3Very high88.3Confident36 Ų3652.5 Ų52.519%0.18526%0.261CS..Hα-helixtrans-73.1-45.8-179.1-62.5162.3000110.2A202 P208 M299A202-I206 HydrophobicContact CB-CD1 4.07Å; A202-I206 WeakPolarHBondContact O-CB 3.39Å; A202-I206 WeakPolarHBondContact O-CD1 3.47Å; A202-I206 WeakPolarHBondContact O-CG1 3.16Å; A202-I206 PolarHBondContact O-N 2.85Å; I206-P208 VanDerWaalsContact C-CD 3.44Å; I206-P208 VanDerWaalsContact O-CD 3.24Å; I206-P208 WeakPolarHBondContact O-CD 3.31Å; I206-M299 HydrophobicContact CD1-CB 4.27Å; I206-M299 HydrophobicContact CD1-CE 3.38Å; I206-M299 HydrophobicContact CD1-SD 4.33Å
207W89.7Confident87.9Confident110 Ų11054.8 Ų54.842%0.41727%0.273SS..  trans-119.469.6-176.8-54.6-66.5000112E203 L209 G210 Q215E203-W207 HydrophobicContact CB-CE3 4.47Å; E203-W207 HydrophobicContact CG-CE3 4.02Å; E203-W207 HydrophobicContact CG-CZ3 4.27Å; E203-W207 PolarHBondContact O-N 2.68Å; W207-L209 PolarHBondContact O-N 2.67Å; W207-L209 VanDerWaalsContact O-N 3.15Å; W207-G210 PolarHBondContact O-N 2.84Å; W207-Q215 HydrophobicContact CB-CB 4.36Å; W207-Q215 HydrophobicContact CD2-CB 4.26Å; W207-Q215 HydrophobicContact CD2-CG 4Å; W207-Q215 HydrophobicContact CE3-CB 4.26Å; W207-Q215 HydrophobicContact CE3-CG 4.34Å; W207-Q215 HydrophobicContact CG-CB 4.31Å; W207-Q215 HydrophobicContact CG-CG 4.12Å
208P84.4Confident87.5Confident52 Ų5255.6 Ų55.634%0.33828%0.277SS..THydrogen-bonded Turntrans-60-31.2-178.124.6-34.6000113.1V204 I206V204-P208 WeakPolarHBondContact O-CA 3.49Å; I206-P208 VanDerWaalsContact C-CD 3.44Å; I206-P208 VanDerWaalsContact O-CD 3.24Å; I206-P208 WeakPolarHBondContact O-CD 3.31Å
209L79.3Confident87Confident159 Ų15960.3 Ų60.383%0.83230%0.295SS*.THydrogen-bonded Turntrans-112.723.4176.9-62.3172.6000112.1W207 S211W207-L209 PolarHBondContact O-N 2.67Å; W207-L209 VanDerWaalsContact O-N 3.15Å; L209-S211 PolarHBondContact O-N 2.97Å
210G75.5Confident86.7Confident9 Ų963.8 Ų63.89%0.09331%0.309CS..  trans-51105-17900000111.5W207 Q215 R216W207-G210 PolarHBondContact O-N 2.84Å; G210-Q215 VanDerWaalsContact CA-OE1 3.27Å; G210-R216 VanDerWaalsContact O-CD 3.22Å; G210-R216 WeakPolarHBondContact O-CD 3.14Å; G210-R216 PolarHBondContact O-NE 3.32Å; G210-R216 VanDerWaalsContact O-NE 3.09Å
211S72.7Confident86.5Confident97 Ų9764.9 Ų64.968%0.67832%0.315SS*.  trans-78.6-34.5-176.4177.70000110.5L209 R216L209-S211 PolarHBondContact O-N 2.97Å; S211-R216 PolarHBondContact O-NH2 3.45Å
212R84.8Confident86.4Confident167 Ų16773.8 Ų73.863%0.6335%0.349SS*.SBendtrans-76.2149-175.5-58.1-176.4178.1179.61.3111.2W214 Q215R212-W214 VanDerWaalsContact CB-NE1 3.26Å; R212-Q215 HydrophobicContact CB-CG 4.5Å; R212-Q215 PolarHBondContact O-N 3.47Å
213S79.8Confident86.3Confident83 Ų8377.7 Ų77.758%0.5837%0.365SS*.G310 helixtrans-66.5-37.8-174.356.60000113.7Q215 R216S213-Q215 VanDerWaalsContact C-N 3.28Å; S213-Q215 PolarHBondContact O-N 3.09Å; S213-R216 PolarHBondContact O-N 3.06Å; S213-R216 VanDerWaalsContact O-N 3.08Å
214W81.7Confident86.3Confident164 Ų16477 Ų7762%0.62136%0.362SS*.G310 helixtrans-63-27.9175.670.7-39.4000114.2R212 R216 I217R212-W214 VanDerWaalsContact CB-NE1 3.26Å; W214-R216 PolarHBondContact O-N 3.44Å; W214-I217 HydrophobicContact CB-CD1 4.25Å; W214-I217 WeakPolarHBondContact O-CD1 3.33Å; W214-I217 WeakPolarHBondContact O-CG1 3.37Å
215Q81.8Confident86.5Confident34 Ų3478.2 Ų78.216%0.15937%0.367CS..G310 helixtrans-78.10.4174.6-67.7169-28.500112.7E203 W207 G210 R212 S213E203-Q215 WeakPolarHBondContact CG-O 3.4Å; W207-Q215 HydrophobicContact CB-CB 4.36Å; W207-Q215 HydrophobicContact CD2-CB 4.26Å; W207-Q215 HydrophobicContact CD2-CG 4Å; W207-Q215 HydrophobicContact CE3-CB 4.26Å; W207-Q215 HydrophobicContact CE3-CG 4.34Å; W207-Q215 HydrophobicContact CG-CB 4.31Å; W207-Q215 HydrophobicContact CG-CG 4.12Å; G210-Q215 VanDerWaalsContact CA-OE1 3.27Å; R212-Q215 HydrophobicContact CB-CG 4.5Å; R212-Q215 PolarHBondContact O-N 3.47Å; S213-Q215 VanDerWaalsContact C-N 3.28Å; S213-Q215 PolarHBondContact O-N 3.09Å
216R83.3Confident86.8Confident81 Ų8184.2 Ų84.231%0.30640%0.395SS..G310 helixtrans-128.513.9-174.9-69.1-172.9-73.1160.2-5.9112.8E203 G210 S211 S213 W214 L218 R219 H220E203-R216 WeakPolarHBondContact OE1-CA 3.45Å; G210-R216 VanDerWaalsContact O-CD 3.22Å; G210-R216 WeakPolarHBondContact O-CD 3.14Å; G210-R216 PolarHBondContact O-NE 3.32Å; G210-R216 VanDerWaalsContact O-NE 3.09Å; S211-R216 PolarHBondContact O-NH2 3.45Å; S213-R216 PolarHBondContact O-N 3.06Å; S213-R216 VanDerWaalsContact O-N 3.08Å; W214-R216 PolarHBondContact O-N 3.44Å; R216-L218 PolarHBondContact O-N 3.28Å; R216-R219 HydrophobicContact CB-CB 4.46Å; R216-R219 PolarHBondContact O-N 3.08Å; R216-H220 PolarHBondContact O-CD2 3.24Å; R216-H220 PolarHBondContact O-N 3.43Å
217I88.4Confident87Confident62 Ų6285 Ų8532%0.31840%0.399SS..THydrogen-bonded Turntrans-59.8-52.6-170-70.7168.8000110.3E203 W214 R219 H220 K223 I227E203-I217 PolarHBondContact OE1-N 3.16Å; E203-I217 PolarHBondContact OE2-N 3.03Å; W214-I217 HydrophobicContact CB-CD1 4.25Å; W214-I217 WeakPolarHBondContact O-CD1 3.33Å; W214-I217 WeakPolarHBondContact O-CG1 3.37Å; I217-R219 VanDerWaalsContact C-N 3.32Å; I217-H220 PolarHBondContact O-N 2.89Å; I217-K223 HydrophobicContact CG2-CB 4.47Å; I217-K223 HydrophobicContact CG2-CD 4.1Å; I217-K223 VanDerWaalsContact O-CB 3.3Å; I217-K223 WeakPolarHBondContact O-CB 3.16Å; I217-I227 HydrophobicContact CG2-CD1 4.05Å
218L89.1Confident87.4Confident22 Ų2280.2 Ų80.212%0.11538%0.381CS..THydrogen-bonded Turntrans-80.8-16.9-176.4-65.3174.3000112.5S119 L196 A199 A200 E203 R216 H220 F224 I227S119-L218 PolarHBondContact OG-O 3.24Å; L196-L218 HydrophobicContact CD2-CD2 4.03Å; A199-L218 HydrophobicContact CB-CD1 3.49Å; A199-L218 VanDerWaalsContact CB-CD1 3.49Å; A200-L218 HydrophobicContact CB-CB 3.7Å; A200-L218 HydrophobicContact CB-CD1 4.38Å; E203-L218 PolarHBondContact OE2-N 3.32Å; R216-L218 PolarHBondContact O-N 3.28Å; L218-H220 VanDerWaalsContact C-N 3.29Å; L218-F224 HydrophobicContact CD2-CD2 4.45Å; L218-I227 HydrophobicContact CD2-CD1 3.74Å
219R86Confident88Confident100 Ų10081.9 Ų81.938%0.37739%0.386SS..THydrogen-bonded Turntrans-69-26.1171.3-176.3174178.7-177.6-2.3113.2S119 E203 R216 I217S119-R219 WeakPolarHBondContact CB-O 3.35Å; E203-R219 VanDerWaalsContact OE1-CB 3.22Å; E203-R219 WeakPolarHBondContact OE1-CB 3.15Å; E203-R219 PolarHBondContact OE1-N 2.93Å; E203-R219 VanDerWaalsContact OE1-N 3.12Å; R216-R219 HydrophobicContact CB-CB 4.46Å; R216-R219 PolarHBondContact O-N 3.08Å; I217-R219 VanDerWaalsContact C-N 3.32Å
220H89.9Confident88.9Confident82 Ų8279.5 Ų79.538%0.3837%0.374SS..SBendtrans-80.2118.2176.5-75-65.9000110.5R216 I217 L218 R222 K223 F224R216-H220 PolarHBondContact O-CD2 3.24Å; R216-H220 PolarHBondContact O-N 3.43Å; I217-H220 PolarHBondContact O-N 2.89Å; L218-H220 VanDerWaalsContact C-N 3.29Å; H220-R222 VanDerWaalsContact C-N 3.27Å; H220-R222 PolarHBondContact O-N 2.95Å; H220-K223 HydrophobicContact CB-CB 4.29Å; H220-K223 HydrophobicContact CB-CD 4.48Å; H220-K223 HydrophobicContact CB-CG 4.28Å; H220-K223 PolarHBondContact O-N 3.45Å; H220-K223 VanDerWaalsContact O-N 3.09Å; H220-F224 PolarHBondContact O-N 2.93Å
221P90.8Very high90Very high37 Ų3780.1 Ų80.124%0.2438%0.375CS..Hα-helixtrans-61.1-34.9-172.723.5-34.2000112.8I122 F224 I225I122-P221 HydrophobicContact CD1-CB 3.69Å; P221-F224 PolarHBondContact O-N 3.05Å; P221-I225 WeakPolarHBondContact O-CB 3.42Å; P221-I225 WeakPolarHBondContact O-CD1 3.14Å; P221-I225 WeakPolarHBondContact O-CG1 3.44Å; P221-I225 PolarHBondContact O-N 2.81Å
222R93.1Very high91.2Very high207 Ų20778.3 Ų78.378%0.78136%0.355SS*.Hα-helixtrans-63.8-43.8177.1-65.7-176.4-175.2164.80.6112.5H220 I225 Q226H220-R222 VanDerWaalsContact C-N 3.27Å; H220-R222 PolarHBondContact O-N 2.95Å; R222-I225 PolarHBondContact O-N 3.43Å; R222-Q226 VanDerWaalsContact O-CG 3.31Å; R222-Q226 WeakPolarHBondContact O-CG 3.33Å; R222-Q226 PolarHBondContact O-N 3.41Å
223K93.4Very high91.8Very high83 Ų8375.4 Ų75.436%0.36135%0.35SS..Hα-helixtrans-70-41.2179-69.5-168.2178.4-171.80111.1I217 H220 I225 Q226 I227I217-K223 HydrophobicContact CG2-CB 4.47Å; I217-K223 HydrophobicContact CG2-CD 4.1Å; I217-K223 VanDerWaalsContact O-CB 3.3Å; I217-K223 WeakPolarHBondContact O-CB 3.16Å; H220-K223 HydrophobicContact CB-CB 4.29Å; H220-K223 HydrophobicContact CB-CD 4.48Å; H220-K223 HydrophobicContact CB-CG 4.28Å; H220-K223 PolarHBondContact O-N 3.45Å; H220-K223 VanDerWaalsContact O-N 3.09Å; K223-I225 VanDerWaalsContact C-N 3.32Å; K223-I225 PolarHBondContact O-N 3.5Å; K223-Q226 PolarHBondContact O-N 2.88Å; K223-I227 VanDerWaalsContact O-CG1 3.32Å; K223-I227 WeakPolarHBondContact O-CG1 3.27Å; K223-I227 PolarHBondContact O-N 3.41Å
224F94.5Very high92.7Very high1 Ų174.2 Ų74.20%0.00434%0.336CS..Hα-helixtrans-55.1-49.2172.1-178.5-83.2000111.2F126 L196 L218 H220 P221 Q226 I227 F228F126-F224 HydrophobicContact CD2-CE1 4.18Å; L196-F224 HydrophobicContact CB-CD2 4.49Å; L196-F224 HydrophobicContact CB-CE2 3.64Å; L196-F224 HydrophobicContact CB-CZ 4.04Å; L196-F224 HydrophobicContact CD1-CE2 4.48Å; L196-F224 HydrophobicContact CD1-CZ 4.45Å; L218-F224 HydrophobicContact CD2-CD2 4.45Å; H220-F224 PolarHBondContact O-N 2.93Å; P221-F224 PolarHBondContact O-N 3.05Å; F224-Q226 PolarHBondContact O-N 3.4Å; F224-I227 PolarHBondContact O-N 2.92Å; F224-F228 HydrophobicContact CE1-CB 4.44Å; F224-F228 WeakPolarHBondContact O-CB 3.49Å; F224-F228 PolarHBondContact O-N 3.37Å
225I95.9Very high93.5Very high52 Ų5266.4 Ų66.427%0.26731%0.307SS..Hα-helixtrans-60.7-45.7178.1-70.1163.2000111.2I122 F126 P221 R222 K223 I227 F228 I229I122-I225 HydrophobicContact CG2-CD1 4.22Å; I122-I225 HydrophobicContact CG2-CG1 4.19Å; F126-I225 HydrophobicContact CE2-CG1 3.75Å; F126-I225 HydrophobicContact CZ-CG1 4.06Å; F126-I225 HydrophobicContact CZ-CG2 4.45Å; P221-I225 WeakPolarHBondContact O-CB 3.42Å; P221-I225 WeakPolarHBondContact O-CD1 3.14Å; P221-I225 WeakPolarHBondContact O-CG1 3.44Å; P221-I225 PolarHBondContact O-N 2.81Å; R222-I225 PolarHBondContact O-N 3.43Å; K223-I225 VanDerWaalsContact C-N 3.32Å; K223-I225 PolarHBondContact O-N 3.5Å; I225-I227 PolarHBondContact O-N 2.99Å; I225-F228 PolarHBondContact O-N 3.26Å; I225-I229 HydrophobicContact CG2-CD1 3.59Å; I225-I229 HydrophobicContact CG2-CG1 4.25Å; I225-I229 WeakPolarHBondContact O-CB 3.29Å; I225-I229 VanDerWaalsContact O-CG1 3.25Å; I225-I229 WeakPolarHBondContact O-CG1 3.32Å; I225-I229 PolarHBondContact O-N 2.67Å
226Q96.7Very high94.3Very high130 Ų13067.4 Ų67.461%0.60731%0.313SS*.Hα-helixtrans-59.9-45.8178.5-75.8170.7-21.100112.3R222 K223 F224 I229 L230R222-Q226 VanDerWaalsContact O-CG 3.31Å; R222-Q226 WeakPolarHBondContact O-CG 3.33Å; R222-Q226 PolarHBondContact O-N 3.41Å; K223-Q226 PolarHBondContact O-N 2.88Å; F224-Q226 PolarHBondContact O-N 3.4Å; Q226-I229 PolarHBondContact O-N 3.5Å; Q226-L230 PolarHBondContact O-N 3.47Å
227I96.9Very high94.9Very high54 Ų5468.7 Ų68.728%0.27732%0.324SS..Hα-helixtrans-66.5-41.7178.5-64164.4000110.5L196 I217 L218 K223 F224 I225 L230 L231L196-I227 HydrophobicContact CD1-CG2 4.24Å; L196-I227 HydrophobicContact CD2-CG2 3.72Å; I217-I227 HydrophobicContact CG2-CD1 4.05Å; L218-I227 HydrophobicContact CD2-CD1 3.74Å; K223-I227 VanDerWaalsContact O-CG1 3.32Å; K223-I227 WeakPolarHBondContact O-CG1 3.27Å; K223-I227 PolarHBondContact O-N 3.41Å; F224-I227 PolarHBondContact O-N 2.92Å; I225-I227 PolarHBondContact O-N 2.99Å; I227-L230 WeakPolarHBondContact O-CB 3.4Å; I227-L230 PolarHBondContact O-N 3.43Å; I227-L231 HydrophobicContact CG2-CD1 4.09Å; I227-L231 WeakPolarHBondContact O-CG 3.28Å; I227-L231 PolarHBondContact O-N 3.4Å
228F97.4Very high95.4Very high9 Ų966.6 Ų66.64%0.03931%0.313CS..Hα-helixtrans-62.5-45176.3178-97.6000111.8F126 C130 C193 L196 F224 I225 L230 L231 F232F126-F228 HydrophobicContact CB-CE1 4.27Å; F126-F228 HydrophobicContact CB-CE2 4.48Å; F126-F228 HydrophobicContact CB-CZ 4.23Å; F126-F228 AromaticContact CD1-CD1 3.59Å; F126-F228 HydrophobicContact CD1-CD1 3.59Å; F126-F228 AromaticContact CD1-CE1 3.31Å; F126-F228 HydrophobicContact CD1-CE1 3.31Å; F126-F228 HydrophobicContact CD1-CZ 4.04Å; F126-F228 AromaticContact CE1-CD1 3.81Å; F126-F228 HydrophobicContact CE1-CD1 3.81Å; F126-F228 AromaticContact CE1-CE1 3.81Å; F126-F228 HydrophobicContact CE1-CE1 3.81Å; F126-F228 HydrophobicContact CG-CD1 4.02Å; F126-F228 AromaticContact CG-CE1 3.96Å; F126-F228 HydrophobicContact CG-CE1 3.96Å; F126-F228 HydrophobicContact CG-CZ 4.41Å; F126-F228 HydrophobicContact CZ-CD1 4.41Å; C130-F228 VanDerWaalsContact SG-CZ 3.56Å; C193-F228 HydrophobicContact CB-CD2 4.31Å; C193-F228 HydrophobicContact CB-CE2 3.86Å; L196-F228 HydrophobicContact CD1-CB 4Å; L196-F228 HydrophobicContact CD1-CD2 4.2Å; F224-F228 HydrophobicContact CE1-CB 4.44Å; F224-F228 WeakPolarHBondContact O-CB 3.49Å; F224-F228 PolarHBondContact O-N 3.37Å; I225-F228 PolarHBondContact O-N 3.26Å; F228-L230 VanDerWaalsContact C-N 3.31Å; F228-L230 PolarHBondContact O-N 2.89Å; F228-L231 PolarHBondContact O-N 3.45Å; F228-F232 HydrophobicContact CE1-CB 4.49Å; F228-F232 HydrophobicContact CZ-CD2 4.46Å; F228-F232 WeakPolarHBondContact O-CB 3.29Å; F228-F232 PolarHBondContact O-N 2.98Å
229I97.7Very high95.7Very high87 Ų8765.5 Ų65.545%0.44631%0.308SS..Hα-helixtrans-60.6-42.1176-70.1169000110.5I225 Q226 L231 F232 M233I225-I229 HydrophobicContact CG2-CD1 3.59Å; I225-I229 HydrophobicContact CG2-CG1 4.25Å; I225-I229 WeakPolarHBondContact O-CB 3.29Å; I225-I229 VanDerWaalsContact O-CG1 3.25Å; I225-I229 WeakPolarHBondContact O-CG1 3.32Å; I225-I229 PolarHBondContact O-N 2.67Å; Q226-I229 PolarHBondContact O-N 3.5Å; I229-L231 PolarHBondContact O-N 2.99Å; I229-F232 WeakPolarHBondContact O-CB 3.38Å; I229-F232 PolarHBondContact O-N 3.39Å; I229-M233 HydrophobicContact CG2-CG 4.37Å; I229-M233 VanDerWaalsContact O-CG 3.29Å; I229-M233 WeakPolarHBondContact O-CG 3.42Å; I229-M233 PolarHBondContact O-N 3.37Å
230L98Very high96.1Very high108 Ų10861.8 Ų61.857%0.56530%0.3SS*.Hα-helixtrans-58.7-49.2175.9178.365.5000111.5Q226 I227 F228 F232 M233 I234Q226-L230 PolarHBondContact O-N 3.47Å; I227-L230 WeakPolarHBondContact O-CB 3.4Å; I227-L230 PolarHBondContact O-N 3.43Å; F228-L230 VanDerWaalsContact C-N 3.31Å; F228-L230 PolarHBondContact O-N 2.89Å; L230-F232 VanDerWaalsContact C-N 3.31Å; L230-F232 PolarHBondContact O-N 3.31Å; L230-M233 PolarHBondContact O-N 3.5Å; L230-I234 HydrophobicContact CD1-CD1 4.33Å; L230-I234 HydrophobicContact CG-CD1 4.08Å; L230-I234 VanDerWaalsContact O-CG1 3.31Å; L230-I234 WeakPolarHBondContact O-CG1 3.43Å; L230-I234 PolarHBondContact O-N 2.96Å
231L98Very high96.4Very high22 Ų2261.6 Ų61.612%0.11530%0.302CS..Hα-helixtrans-65.2-34.7177.5-67.5169.3000112W192 L196 I227 F228 I229 I234 S235 Y284W192-L231 HydrophobicContact CB-CB 4.34Å; W192-L231 HydrophobicContact CB-CD1 4.1Å; W192-L231 HydrophobicContact CD2-CD1 4.06Å; W192-L231 HydrophobicContact CD2-CD2 3.91Å; W192-L231 HydrophobicContact CD2-CG 4.47Å; W192-L231 HydrophobicContact CE3-CD1 3.68Å; W192-L231 HydrophobicContact CE3-CD2 3.9Å; W192-L231 HydrophobicContact CE3-CG 4.41Å; W192-L231 HydrophobicContact CG-CB 4.42Å; W192-L231 HydrophobicContact CG-CD1 4.26Å; W192-L231 HydrophobicContact CG-CD2 4.4Å; W192-L231 HydrophobicContact CH2-CD2 4.47Å; W192-L231 HydrophobicContact CZ3-CD1 4.42Å; W192-L231 HydrophobicContact CZ3-CD2 4.18Å; L196-L231 HydrophobicContact CD1-CD1 3.79Å; L196-L231 HydrophobicContact CD2-CD1 4.23Å; L196-L231 HydrophobicContact CG-CD1 4.07Å; I227-L231 HydrophobicContact CG2-CD1 4.09Å; I227-L231 WeakPolarHBondContact O-CG 3.28Å; I227-L231 PolarHBondContact O-N 3.4Å; F228-L231 PolarHBondContact O-N 3.45Å; I229-L231 PolarHBondContact O-N 2.99Å; L231-I234 HydrophobicContact CD2-CD1 4.48Å; L231-I234 PolarHBondContact O-N 2.81Å; L231-S235 WeakPolarHBondContact O-CB 3.19Å; L231-S235 PolarHBondContact O-N 2.89Å; L231-S235 PolarHBondContact O-OG 3.41Å; L231-Y284 PolarHBondContact O-OH 3Å
232F98Very high96.5Very high59 Ų5961.4 Ų61.426%0.25930%0.297SS..Hα-helixtrans-62.8-45.5174-175.5-98.6000111.1I185 S189 F228 I229 L230 S235 I236I185-F232 HydrophobicContact CG2-CD2 4.28Å; I185-F232 HydrophobicContact CG2-CE2 3.6Å; I185-F232 HydrophobicContact CG2-CZ 3.84Å; S189-F232 WeakPolarHBondContact OG-CD2 3.31Å; F228-F232 HydrophobicContact CE1-CB 4.49Å; F228-F232 HydrophobicContact CZ-CD2 4.46Å; F228-F232 WeakPolarHBondContact O-CB 3.29Å; F228-F232 PolarHBondContact O-N 2.98Å; I229-F232 WeakPolarHBondContact O-CB 3.38Å; I229-F232 PolarHBondContact O-N 3.39Å; L230-F232 VanDerWaalsContact C-N 3.31Å; L230-F232 PolarHBondContact O-N 3.31Å; F232-S235 WeakPolarHBondContact O-CB 3.14Å; F232-S235 PolarHBondContact O-N 2.93Å; F232-I236 HydrophobicContact CD1-CD1 3.77Å; F232-I236 HydrophobicContact CE1-CD1 3.45Å; F232-I236 VanDerWaalsContact CE1-CD1 3.45Å; F232-I236 HydrophobicContact CE1-CG1 4.29Å; F232-I236 HydrophobicContact CZ-CD1 4.16Å; F232-I236 WeakPolarHBondContact O-CG1 3.32Å; F232-I236 PolarHBondContact O-N 2.92Å
233M98.2Very high96.5Very high107 Ų10752 Ų5253%0.52726%0.262SS..Hα-helixtrans-65.6-40.4176.6-64.1-61.1-98.400112.4I229 L230 S235 I236 I237I229-M233 HydrophobicContact CG2-CG 4.37Å; I229-M233 VanDerWaalsContact O-CG 3.29Å; I229-M233 WeakPolarHBondContact O-CG 3.42Å; I229-M233 PolarHBondContact O-N 3.37Å; L230-M233 PolarHBondContact O-N 3.5Å; M233-S235 VanDerWaalsContact C-N 3.26Å; M233-S235 PolarHBondContact O-N 3.03Å; M233-I236 WeakPolarHBondContact O-CB 3.33Å; M233-I236 PolarHBondContact O-N 3.49Å; M233-I236 HydrophobicContact SD-CD1 4.03Å; M233-I237 WeakPolarHBondContact O-CG1 3.44Å; M233-I237 PolarHBondContact O-N 2.95Å
234I98.2Very high96.4Very high58 Ų5849 Ų4930%0.29725%0.251SS..Hα-helixtrans-60.7-40.4173-66.1165.7000110.3L230 L231 I236 I237 I238 Y284L230-I234 HydrophobicContact CD1-CD1 4.33Å; L230-I234 HydrophobicContact CG-CD1 4.08Å; L230-I234 VanDerWaalsContact O-CG1 3.31Å; L230-I234 WeakPolarHBondContact O-CG1 3.43Å; L230-I234 PolarHBondContact O-N 2.96Å; L231-I234 HydrophobicContact CD2-CD1 4.48Å; L231-I234 PolarHBondContact O-N 2.81Å; I234-I236 VanDerWaalsContact C-N 3.35Å; I234-I236 PolarHBondContact O-N 3.02Å; I234-I237 PolarHBondContact O-N 2.79Å; I234-I238 HydrophobicContact CG2-CD1 3.64Å; I234-I238 HydrophobicContact CG2-CG1 4.23Å; I234-I238 WeakPolarHBondContact O-CG1 3.38Å; I234-I238 PolarHBondContact O-N 2.9Å; I234-Y284 HydrophobicContact CB-CE2 4.46Å; I234-Y284 HydrophobicContact CG2-CD2 4.38Å; I234-Y284 HydrophobicContact CG2-CE1 4.47Å; I234-Y284 HydrophobicContact CG2-CE2 3.55Å
235S98.1Very high96Very high0 Ų049.5 Ų49.50%025%0.254CS..Hα-helixtrans-62.8-40.2176.9-55.40000112.1L231 F232 M233 A239 Y284L231-S235 WeakPolarHBondContact O-CB 3.19Å; L231-S235 PolarHBondContact O-N 2.89Å; L231-S235 PolarHBondContact O-OG 3.41Å; F232-S235 WeakPolarHBondContact O-CB 3.14Å; F232-S235 PolarHBondContact O-N 2.93Å; M233-S235 VanDerWaalsContact C-N 3.26Å; M233-S235 PolarHBondContact O-N 3.03Å; S235-A239 WeakPolarHBondContact O-CB 3.42Å; S235-A239 PolarHBondContact O-N 3.09Å; S235-Y284 PolarHBondContact N-OH 3.14Å; S235-Y284 PolarHBondContact OG-OH 3.44Å
236I97.9Very high95.7Very high55 Ų5549.1 Ų49.128%0.28225%0.249SC..Hα-helixtrans-60.4-46.8173.4-69.3167.6000111.1F181 I185 F232 M233 I234 G240F181-I236 HydrophobicContact CZ-CG2 4.28Å; I185-I236 HydrophobicContact CD1-CB 4.45Å; I185-I236 HydrophobicContact CD1-CG1 3.82Å; I185-I236 HydrophobicContact CG1-CG1 4.08Å; I185-I236 HydrophobicContact CG2-CG1 3.95Å; F232-I236 HydrophobicContact CD1-CD1 3.77Å; F232-I236 HydrophobicContact CE1-CD1 3.45Å; F232-I236 VanDerWaalsContact CE1-CD1 3.45Å; F232-I236 HydrophobicContact CE1-CG1 4.29Å; F232-I236 HydrophobicContact CZ-CD1 4.16Å; F232-I236 WeakPolarHBondContact O-CG1 3.32Å; F232-I236 PolarHBondContact O-N 2.92Å; M233-I236 WeakPolarHBondContact O-CB 3.33Å; M233-I236 PolarHBondContact O-N 3.49Å; M233-I236 HydrophobicContact SD-CD1 4.03Å; I234-I236 VanDerWaalsContact C-N 3.35Å; I234-I236 PolarHBondContact O-N 3.02Å; I236-G240 WeakPolarHBondContact O-CA 3.38Å; I236-G240 PolarHBondContact O-N 3.36Å
237I97.9Very high95.4Very high107 Ų10743.3 Ų43.355%0.54922%0.222SC..Hα-helixtrans-64.6-48.1-178.4-65.7164.9000110.5M233 I234 G240 L241M233-I237 WeakPolarHBondContact O-CG1 3.44Å; M233-I237 PolarHBondContact O-N 2.95Å; I234-I237 PolarHBondContact O-N 2.79Å; I237-G240 PolarHBondContact O-N 2.72Å; I237-L241 HydrophobicContact CG2-CD1 4.3Å; I237-L241 WeakPolarHBondContact O-CG 3.48Å; I237-L241 PolarHBondContact O-N 3.21Å
238I97.3Very high95Very high18 Ų1840.7 Ų40.79%0.09221%0.209CC..Hα-helixtrans-64.7-45.5-178-68.2175.6000111F188 I234 G240 K242 Y276 I280 V281 Y284F188-I238 HydrophobicContact CE2-CG2 3.99Å; I234-I238 HydrophobicContact CG2-CD1 3.64Å; I234-I238 HydrophobicContact CG2-CG1 4.23Å; I234-I238 WeakPolarHBondContact O-CG1 3.38Å; I234-I238 PolarHBondContact O-N 2.9Å; I238-G240 VanDerWaalsContact C-N 3.34Å; I238-K242 PolarHBondContact O-N 2.72Å; I238-Y276 VanDerWaalsContact CA-OH 3.26Å; I238-Y276 WeakPolarHBondContact CA-OH 3.44Å; I238-Y276 WeakPolarHBondContact CG2-OH 3.22Å; I238-Y276 PolarHBondContact O-OH 2.99Å; I238-I280 HydrophobicContact CD1-CG2 4.31Å; I238-I280 HydrophobicContact CG1-CG2 4.39Å; I238-I280 HydrophobicContact CG2-CG2 4.47Å; I238-V281 HydrophobicContact CG2-CG2 4.01Å; I238-Y284 HydrophobicContact CD1-CD1 3.54Å; I238-Y284 HydrophobicContact CD1-CD2 3.75Å; I238-Y284 HydrophobicContact CD1-CE1 3.84Å; I238-Y284 HydrophobicContact CD1-CE2 4.04Å; I238-Y284 HydrophobicContact CD1-CG 3.48Å; I238-Y284 VanDerWaalsContact CD1-CG 3.48Å; I238-Y284 HydrophobicContact CG2-CD1 4.46Å
239A95.9Very high94.6Very high0 Ų041 Ų410%021%0.211CC..Hα-helixtrans-65.5-39.2175.700000111.2F181 E184 I185 F188 S235 L241 K242 H243F181-A239 HydrophobicContact CD2-CB 3.78Å; F181-A239 HydrophobicContact CE2-CB 3.85Å; E184-A239 HydrophobicContact CB-CB 4.4Å; I185-A239 HydrophobicContact CG1-CB 4.01Å; F188-A239 HydrophobicContact CD2-CB 4.47Å; F188-A239 HydrophobicContact CE2-CB 4.01Å; S235-A239 WeakPolarHBondContact O-CB 3.42Å; S235-A239 PolarHBondContact O-N 3.09Å; A239-L241 PolarHBondContact O-N 3.33Å; A239-K242 WeakPolarHBondContact O-CB 3.43Å; A239-K242 PolarHBondContact O-N 3Å; A239-H243 PolarHBondContact O-CD2 2.96Å; A239-H243 PolarHBondContact O-N 3.31Å; A239-H243 VanDerWaalsContact O-N 3.07Å
240G95Very high94.2Very high21 Ų2136.9 Ų36.922%0.21619%0.189CC..Hα-helixtrans-62-47.8-178.100000111.7F181 I236 I237 I238 K242 H243 T244F181-G240 VanDerWaalsContact CE2-CA 3.46Å; F181-G240 VanDerWaalsContact CE2-N 3.35Å; I236-G240 WeakPolarHBondContact O-CA 3.38Å; I236-G240 PolarHBondContact O-N 3.36Å; I237-G240 PolarHBondContact O-N 2.72Å; I238-G240 VanDerWaalsContact C-N 3.34Å; G240-K242 VanDerWaalsContact C-N 3.32Å; G240-K242 PolarHBondContact O-N 3.36Å; G240-H243 PolarHBondContact O-N 3.2Å; G240-T244 WeakPolarHBondContact O-CG2 3.4Å
241L95Very high93.8Very high78 Ų7831.7 Ų31.741%0.40816%0.163SC..Hα-helixtrans-61.3-40.8175.7-69.9173.8000112I237 A239 H243 T244 F268 Y276I237-L241 HydrophobicContact CG2-CD1 4.3Å; I237-L241 WeakPolarHBondContact O-CG 3.48Å; I237-L241 PolarHBondContact O-N 3.21Å; A239-L241 PolarHBondContact O-N 3.33Å; L241-H243 VanDerWaalsContact C-N 3.29Å; L241-H243 PolarHBondContact O-N 3.42Å; L241-T244 PolarHBondContact O-N 3.18Å; L241-T244 PolarHBondContact O-OG1 3.18Å; L241-F268 HydrophobicContact CB-CE2 4.38Å; L241-Y276 HydrophobicContact CB-CE1 4.38Å
242K92.9Very high93.3Very high33 Ų3331 Ų3114%0.14316%0.158CC..Hα-helixtrans-58.3-41.9177.2-175.8-172164.8-170.70112E184 I238 A239 G240 T244 D245 F273 Y276 M277 V281E184-K242 IonicContact OE1-NZ 3.85Å; E184-K242 PolarHBondContact OE1-NZ 2.98Å; E184-K242 VanDerWaalsContact OE2-CD 3.3Å; E184-K242 WeakPolarHBondContact OE2-CD 3.3Å; E184-K242 IonicContact OE2-NZ 3.59Å; E184-K242 PolarHBondContact OE2-NZ 2.85Å; I238-K242 PolarHBondContact O-N 2.72Å; A239-K242 WeakPolarHBondContact O-CB 3.43Å; A239-K242 PolarHBondContact O-N 3Å; G240-K242 VanDerWaalsContact C-N 3.32Å; G240-K242 PolarHBondContact O-N 3.36Å; K242-T244 VanDerWaalsContact C-N 3.25Å; K242-T244 PolarHBondContact O-N 3.47Å; K242-D245 VanDerWaalsContact O-CG 3.32Å; K242-F273 HydrophobicContact CG-CE2 4.14Å; K242-F273 HydrophobicContact CG-CZ 4.31Å; K242-Y276 HydrophobicContact CB-CE1 4.03Å; K242-M277 HydrophobicContact CD-CE 4.3Å; K242-M277 HydrophobicContact CD-SD 3.8Å; K242-M277 HydrophobicContact CG-SD 3.8Å; K242-V281 HydrophobicContact CD-CG1 4.43Å
243H92.8Very high92.7Very high9 Ų928.7 Ų28.74%0.04215%0.149CC..THydrogen-bonded Turntrans-85.513.2-175.2-76.6-75.7000114.6N177 F181 E184 A239 G240 L241N177-H243 PolarHBondContact ND2-O 2.86Å; N177-H243 WeakPolarHBondContact OD1-CB 3.36Å; N177-H243 PolarHBondContact OD1-ND1 3.38Å; F181-H243 HydrophobicContact CB-CB 4.3Å; F181-H243 AromaticContact CD2-CD2 3.98Å; E184-H243 VanDerWaalsContact CD-NE2 3.32Å; E184-H243 IonicContact OE1-NE2 3.44Å; E184-H243 IonicContact OE2-NE2 2.63Å; E184-H243 PolarHBondContact OE2-NE2 2.88Å; A239-H243 PolarHBondContact O-CD2 2.96Å; A239-H243 PolarHBondContact O-N 3.31Å; A239-H243 VanDerWaalsContact O-N 3.07Å; G240-H243 PolarHBondContact O-N 3.2Å; L241-H243 VanDerWaalsContact C-N 3.29Å; L241-H243 PolarHBondContact O-N 3.42Å
244T91.6Very high92.1Very high21 Ų2125.5 Ų25.513%0.12914%0.137CC..THydrogen-bonded Turntrans-112.114.1175.359.20000112.9Y20 G240 L241 K242 M267Y20-T244 HydrophobicContact CD2-CG2 3.84Å; Y20-T244 HydrophobicContact CE2-CG2 3.94Å; Y20-T244 HydrophobicContact CG-CG2 4.32Å; G240-T244 WeakPolarHBondContact O-CG2 3.4Å; L241-T244 PolarHBondContact O-N 3.18Å; L241-T244 PolarHBondContact O-OG1 3.18Å; K242-T244 VanDerWaalsContact C-N 3.25Å; K242-T244 PolarHBondContact O-N 3.47Å; T244-M267 WeakPolarHBondContact O-CB 3.43Å; T244-M267 WeakPolarHBondContact O-CG 3.3Å; T244-M267 PolarHBondContact O-N 3.42Å
245D87.4Confident91.4Very high12 Ų1228.9 Ų28.96%0.06415%0.154CC..SBendtrans-72.6-47.2-172.158.9-15.6000113.5K242 Y266 F273K242-D245 VanDerWaalsContact O-CG 3.32Å; D245-Y266 PolarHBondContact O-N 3.24Å; D245-F273 HydrophobicContact CB-CD2 3.58Å; D245-F273 HydrophobicContact CB-CE2 3.55Å; D245-F273 HydrophobicContact CB-CG 4.32Å; D245-F273 HydrophobicContact CB-CZ 4.26Å; D245-F273 VanDerWaalsContact OD2-CE2 3.29Å; D245-F273 WeakPolarHBondContact OD2-CE2 3.21Å; D245-F273 WeakPolarHBondContact OD2-CZ 3.36Å
246Y88.7Confident90.8Very high43 Ų4333 Ų3317%0.16918%0.176CC..EExtended strand (participates in β ladder)trans-119.7145.4-176.2-63.3-78.7000113.2Y19 Y20 Q264 E265Y19-Y246 WeakPolarHBondContact CA-O 3.32Å; Y20-Y246 PolarHBondContact N-O 2.63Å; Y246-Q264 WeakPolarHBondContact CA-O 3.32Å; Y246-E265 HydrophobicContact CE1-CG 4.06Å
247I90.9Very high90.1Very high8 Ų835.2 Ų35.24%0.04119%0.185CC..EExtended strand (participates in β ladder)trans-113.4155.516560.6169.8000108.8Y19 Y21 L249 S263 Q264 Y266Y19-I247 VanDerWaalsContact CD1-C 3.46Å; Y21-I247 HydrophobicContact CD1-CB 4.4Å; Y21-I247 HydrophobicContact CD1-CG2 3.49Å; Y21-I247 VanDerWaalsContact CD1-CG2 3.49Å; Y21-I247 HydrophobicContact CE1-CB 4.06Å; Y21-I247 HydrophobicContact CE1-CD1 4.47Å; Y21-I247 HydrophobicContact CE1-CG2 3.14Å; Y21-I247 HydrophobicContact CE2-CG2 4.4Å; Y21-I247 HydrophobicContact CG-CG2 4.24Å; Y21-I247 WeakPolarHBondContact OH-CD1 3.48Å; I247-L249 HydrophobicContact CD1-CD2 4.5Å; I247-S263 WeakPolarHBondContact O-CA 3.35Å; I247-Q264 HydrophobicContact CD1-CB 4.39Å; I247-Q264 HydrophobicContact CG1-CB 3.94Å; I247-Q264 WeakPolarHBondContact CG1-O 3.31Å; I247-Q264 PolarHBondContact N-O 3.12Å; I247-Q264 PolarHBondContact O-N 3.41Å; I247-Y266 HydrophobicContact CD1-CD2 4.29Å; I247-Y266 HydrophobicContact CG2-CD1 4Å; I247-Y266 HydrophobicContact CG2-CD2 3.86Å; I247-Y266 HydrophobicContact CG2-CG 3.53Å
248S88.7Confident89.5Confident0 Ų031.3 Ų31.30%017%0.165CC..EExtended strand (participates in β ladder)trans-104.5139.2172.9-171.30000111.7Y21 V22 K23 M261 W262Y21-S248 PolarHBondContact O-N 2.72Å; V22-S248 CarbonylContact C-O 3.44Å; V22-S248 WeakPolarHBondContact CA-O 3.35Å; K23-S248 PolarHBondContact N-O 2.65Å; S248-M261 WeakPolarHBondContact OG-CE 3.33Å; S248-M261 WeakPolarHBondContact OG-CG 3.27Å; S248-W262 WeakPolarHBondContact CA-O 3.11Å; S248-W262 PolarHBondContact OG-O 3.45Å
249L89Confident88.9Confident15 Ų1530.7 Ų30.78%0.07916%0.161CC..EExtended strand (participates in β ladder)trans-102.4127.1168.5-62-173.6000108.6K23 I25 I247 M261 W262 Q264K23-L249 HydrophobicContact CB-CD2 3.97Å; K23-L249 HydrophobicContact CD-CD2 4.25Å; I25-L249 HydrophobicContact CD1-CB 3.69Å; I25-L249 HydrophobicContact CD1-CD1 3.95Å; I25-L249 HydrophobicContact CD1-CD2 4.03Å; I25-L249 HydrophobicContact CD1-CG 4.08Å; I247-L249 HydrophobicContact CD1-CD2 4.5Å; L249-M261 VanDerWaalsContact O-CA 3.26Å; L249-M261 WeakPolarHBondContact O-CA 3.4Å; L249-W262 HydrophobicContact CB-CD2 3.89Å; L249-W262 HydrophobicContact CB-CE3 4.07Å; L249-W262 HydrophobicContact CB-CH2 3.74Å; L249-W262 HydrophobicContact CB-CZ2 3.62Å; L249-W262 HydrophobicContact CB-CZ3 3.99Å; L249-W262 HydrophobicContact CD1-CH2 4.23Å; L249-W262 HydrophobicContact CD1-CZ2 3.38Å; L249-W262 HydrophobicContact CG-CZ2 4.16Å; L249-W262 PolarHBondContact N-O 3.4Å; L249-W262 PolarHBondContact O-N 2.89Å; L249-W262 VanDerWaalsContact O-N 3.13Å; L249-Q264 HydrophobicContact CD1-CB 4.33Å; L249-Q264 HydrophobicContact CG-CB 4.38Å
250L89.2Confident88.4Confident0 Ų030.7 Ų30.70%016%0.161CC..EExtended strand (participates in β ladder)trans-116.7126.5179.6-179.768.6000109.2V22 K23 Y24 I25 P165 L169 I170 Y259 G260 M261V22-L250 HydrophobicContact CG1-CB 3.88Å; V22-L250 HydrophobicContact CG1-CD2 4.41Å; K23-L250 PolarHBondContact O-N 3.11Å; Y24-L250 CarbonylContact C-O 3.56Å; Y24-L250 WeakPolarHBondContact CA-O 3.36Å; Y24-L250 HydrophobicContact CD2-CB 4.34Å; Y24-L250 HydrophobicContact CD2-CD2 3.99Å; Y24-L250 HydrophobicContact CD2-CG 3.97Å; Y24-L250 WeakPolarHBondContact CD2-O 3.41Å; I25-L250 PolarHBondContact N-O 2.66Å; P165-L250 HydrophobicContact CB-CD2 4.38Å; L169-L250 HydrophobicContact CB-CD1 4.46Å; L169-L250 HydrophobicContact CB-CD2 4.03Å; L169-L250 HydrophobicContact CD1-CD1 4.31Å; I170-L250 HydrophobicContact CD1-CD2 4.4Å; I170-L250 HydrophobicContact CG1-CD2 3.86Å; L250-Y259 HydrophobicContact CD1-CD1 4.24Å; L250-Y259 HydrophobicContact CD1-CG 4.47Å; L250-G260 WeakPolarHBondContact CA-O 3.29Å; L250-M261 HydrophobicContact CD1-CB 4.27Å; L250-M261 HydrophobicContact CD1-CG 4.42Å
251C88.8Confident87.9Confident0 Ų030.1 Ų30.10%015%0.153CC..EExtended strand (participates in β ladder)trans-131.9162.7171.972.20000110.9G26 C28 L31 Y259 G260 W262G26-C251 CarbonylContact O-C 3.53Å; G26-C251 VanDerWaalsContact O-CA 3.28Å; G26-C251 WeakPolarHBondContact O-CA 3.34Å; G26-C251 WeakPolarHBondContact O-CB 3.01Å; C28-C251 HydrophobicContact CB-CB 4.08Å; C28-C251 WeakPolarHBondContact CB-SG 3.44Å; C28-C251 WeakPolarHBondContact SG-CB 3.38Å; C28-C251 CovalentContact SG-SG 2.04Å; C28-C251 PolarHBondContact SG-SG 3.08Å; L31-C251 HydrophobicContact CD1-CB 4.05Å; C251-Y259 CarbonylContact O-C 3.57Å; C251-Y259 WeakPolarHBondContact O-CA 3.45Å; C251-G260 PolarHBondContact N-O 3.08Å; C251-G260 PolarHBondContact O-N 2.94Å; C251-W262 HydrophobicContact CB-CZ3 4.35Å
252Y87.8Confident87.4Confident6 Ų627.2 Ų27.22%0.02414%0.137CC..EExtended strand (participates in β ladder)trans-112.1123.1173.8178.2-104.6000110.3G26 L27 C28 P156 H162 H257 Y259G26-Y252 PolarHBondContact O-N 2.93Å; L27-Y252 CarbonylContact C-O 3.35Å; L27-Y252 WeakPolarHBondContact CA-O 3.24Å; L27-Y252 HydrophobicContact CD2-CD1 4.07Å; C28-Y252 PolarHBondContact N-O 3.48Å; C28-Y252 PolarHBondContact SG-N 3.42Å; C28-Y252 VanDerWaalsContact SG-N 3.45Å; P156-Y252 HydrophobicContact CG-CE2 3.86Å; H162-Y252 HydrophobicContact CB-CD1 3.39Å; H162-Y252 HydrophobicContact CB-CD2 3.87Å; H162-Y252 HydrophobicContact CB-CE1 3.41Å; H162-Y252 VanDerWaalsContact CB-CE1 3.41Å; H162-Y252 HydrophobicContact CB-CE2 3.91Å; H162-Y252 HydrophobicContact CB-CG 3.61Å; H162-Y252 AromaticContact CD2-CD1 3.58Å; H162-Y252 AromaticContact CG-CD1 3.47Å; H162-Y252 VanDerWaalsContact CG-CD1 3.47Å; H162-Y252 AromaticContact CG-CE1 3.62Å; Y252-H257 WeakPolarHBondContact OH-CA 3.09Å; Y252-H257 PolarHBondContact OH-ND1 2.91Å; Y252-Y259 AromaticContact CD2-CD1 3.96Å; Y252-Y259 HydrophobicContact CD2-CD1 3.96Å; Y252-Y259 AromaticContact CD2-CE1 3.87Å; Y252-Y259 HydrophobicContact CD2-CE1 3.87Å; Y252-Y259 HydrophobicContact CD2-CG 4.43Å; Y252-Y259 HydrophobicContact CG-CE1 4.45Å
253D86.2Confident87.1Confident11 Ų1127.9 Ų27.96%0.05915%0.146CC..EExtended strand (participates in β ladder)trans-86.1111.1171.5-178.13.3000109.4C28 Y37 I255 N256 H257 Q258C28-D253 HydrophobicContact CB-CB 4.17Å; C28-D253 PolarHBondContact SG-N 3.41Å; Y37-D253 WeakPolarHBondContact OH-CB 3.26Å; Y37-D253 PolarHBondContact OH-OD2 3.15Å; D253-I255 VanDerWaalsContact C-N 3.26Å; D253-I255 PolarHBondContact O-N 3.03Å; D253-I255 WeakPolarHBondContact OD1-CB 3.47Å; D253-I255 PolarHBondContact OD1-N 2.85Å; D253-N256 WeakPolarHBondContact OD2-CB 3.48Å; D253-N256 PolarHBondContact OD2-ND2 2.88Å; D253-H257 VanDerWaalsContact O-CA 3.24Å; D253-H257 WeakPolarHBondContact O-CA 3.1Å; D253-H257 PolarHBondContact O-N 3.34Å; D253-Q258 HydrophobicContact CB-CG 4.3Å; D253-Q258 PolarHBondContact N-O 3.32Å; D253-Q258 PolarHBondContact O-N 3.49Å
254S84.2Confident86.8Confident41 Ų4132 Ų3229%0.28717%0.165SC..THydrogen-bonded Turntrans-68-23.4177.652.20000113.8N29 H257N29-S254 PolarHBondContact ND2-OG 2.63Å; N29-S254 VanDerWaalsContact ND2-OG 3.11Å; N29-S254 PolarHBondContact OD1-OG 3.42Å; S254-H257 PolarHBondContact O-CE1 2.91Å; S254-H257 VanDerWaalsContact O-CE1 3.32Å; S254-H257 PolarHBondContact O-ND1 2.87Å
255I85.1Confident86.7Confident128 Ų12835.2 Ų35.266%0.65618%0.178SC*.THydrogen-bonded Turntrans-80.7-48.6-175.9-58.9172.4000109.9D253D253-I255 VanDerWaalsContact C-N 3.26Å; D253-I255 PolarHBondContact O-N 3.03Å; D253-I255 WeakPolarHBondContact OD1-CB 3.47Å; D253-I255 PolarHBondContact OD1-N 2.85Å
256N83.8Confident86.7Confident87 Ų8739.5 Ų39.547%0.46519%0.194SC..THydrogen-bonded Turntrans-92.30.8179.8-66.3-55.5000113.3D253 Q258D253-N256 WeakPolarHBondContact OD2-CB 3.48Å; D253-N256 PolarHBondContact OD2-ND2 2.88Å; N256-Q258 VanDerWaalsContact C-N 3.27Å; N256-Q258 HydrophobicContact CB-CG 3.7Å; N256-Q258 VanDerWaalsContact CB-NE2 3.33Å; N256-Q258 PolarHBondContact O-N 3.33Å
257H83.7Confident86.8Confident102 Ų10242.9 Ų42.947%0.47221%0.213SC..THydrogen-bonded Turntrans51.640.9-177.4-62.4-66000114.2Y155 P156 Y252 D253 S254Y155-H257 WeakPolarHBondContact CD1-O 3.35Å; P156-H257 VanDerWaalsContact CD-O 3.23Å; P156-H257 WeakPolarHBondContact CD-O 3.21Å; Y252-H257 WeakPolarHBondContact OH-CA 3.09Å; Y252-H257 PolarHBondContact OH-ND1 2.91Å; D253-H257 VanDerWaalsContact O-CA 3.24Å; D253-H257 WeakPolarHBondContact O-CA 3.1Å; D253-H257 PolarHBondContact O-N 3.34Å; S254-H257 PolarHBondContact O-CE1 2.91Å; S254-H257 VanDerWaalsContact O-CE1 3.32Å; S254-H257 PolarHBondContact O-ND1 2.87Å
258Q84.8Confident86.8Confident25 Ų2544.9 Ų44.912%0.11722%0.221CC..EExtended strand (participates in β ladder)trans-135.2152.1-173.862.3-177.6-900112.3Y37 Q154 Y155 D253 N256Y37-Q258 HydrophobicContact CE1-CG 3.88Å; Y37-Q258 PolarHBondContact OH-NE2 2.91Å; Q154-Q258 HydrophobicContact CG-CB 3.74Å; Q154-Q258 WeakPolarHBondContact O-CA 3.47Å; Y155-Q258 HydrophobicContact CD1-CB 4.21Å; Y155-Q258 HydrophobicContact CE1-CB 4.06Å; D253-Q258 HydrophobicContact CB-CG 4.3Å; D253-Q258 PolarHBondContact N-O 3.32Å; D253-Q258 PolarHBondContact O-N 3.49Å; N256-Q258 VanDerWaalsContact C-N 3.27Å; N256-Q258 HydrophobicContact CB-CG 3.7Å; N256-Q258 VanDerWaalsContact CB-NE2 3.33Å; N256-Q258 PolarHBondContact O-N 3.33Å
259Y85.2Confident86.9Confident4 Ų448.3 Ų48.32%0.01624%0.242CC..EExtended strand (participates in β ladder)trans-78.7133.7171.5-65.9-74.7000111.3L12 Q154 P156 P165 D166 L169 L250 C251 Y252L12-Y259 WeakPolarHBondContact CD1-O 3.42Å; Q154-Y259 WeakPolarHBondContact O-CD2 3.23Å; Q154-Y259 PolarHBondContact O-N 3.29Å; P156-Y259 HydrophobicContact CB-CE2 4.1Å; P165-Y259 HydrophobicContact CB-CE1 4.35Å; D166-Y259 HydrophobicContact CB-CE2 4.46Å; D166-Y259 PolarHBondContact N-OH 3.38Å; L169-Y259 HydrophobicContact CD1-CD1 4.03Å; L169-Y259 HydrophobicContact CD1-CD2 3.36Å; L169-Y259 HydrophobicContact CD1-CE1 4.31Å; L169-Y259 HydrophobicContact CD1-CE2 3.69Å; L169-Y259 HydrophobicContact CD1-CG 3.54Å; L250-Y259 HydrophobicContact CD1-CD1 4.24Å; L250-Y259 HydrophobicContact CD1-CG 4.47Å; C251-Y259 CarbonylContact O-C 3.57Å; C251-Y259 WeakPolarHBondContact O-CA 3.45Å; Y252-Y259 AromaticContact CD2-CD1 3.96Å; Y252-Y259 HydrophobicContact CD2-CD1 3.96Å; Y252-Y259 AromaticContact CD2-CE1 3.87Å; Y252-Y259 HydrophobicContact CD2-CE1 3.87Å; Y252-Y259 HydrophobicContact CD2-CG 4.43Å; Y252-Y259 HydrophobicContact CG-CE1 4.45Å
260G85Confident86.8Confident0 Ų053.2 Ų53.20%027%0.265CS..EExtended strand (participates in β ladder)trans-100.5136.7166.600000110I36 L250 C251I36-G260 CarbonylContact O-C 3.49Å; I36-G260 WeakPolarHBondContact O-CA 3.47Å; L250-G260 WeakPolarHBondContact CA-O 3.29Å; C251-G260 PolarHBondContact N-O 3.08Å; C251-G260 PolarHBondContact O-N 2.94Å
261M84.7Confident87Confident9 Ų960.8 Ų60.84%0.04430%0.298CS..EExtended strand (participates in β ladder)trans-145.2130.9179.9-166.4-176-172.900110.7F14 Y19 V22 I36 P173 S248 L249 L250F14-M261 HydrophobicContact CD1-CB 3.76Å; F14-M261 HydrophobicContact CD1-CG 4.16Å; F14-M261 HydrophobicContact CD1-SD 3.39Å; F14-M261 WeakPolarHBondContact CD1-SD 3.45Å; F14-M261 HydrophobicContact CE1-CB 3.29Å; F14-M261 HydrophobicContact CE1-CG 4.04Å; F14-M261 HydrophobicContact CE1-SD 3.54Å; F14-M261 VanDerWaalsContact CE1-SD 3.54Å; F14-M261 HydrophobicContact CG-SD 4.07Å; F14-M261 HydrophobicContact CZ-CB 4.32Å; F14-M261 HydrophobicContact CZ-SD 4.27Å; Y19-M261 HydrophobicContact CD2-CE 3.87Å; Y19-M261 HydrophobicContact CE2-CE 3.62Å; V22-M261 HydrophobicContact CG1-CE 4.26Å; V22-M261 HydrophobicContact CG2-CE 4.1Å; I36-M261 PolarHBondContact O-N 3.48Å; P173-M261 HydrophobicContact CB-CE 4.46Å; P173-M261 HydrophobicContact CG-CE 3.82Å; S248-M261 WeakPolarHBondContact OG-CE 3.33Å; S248-M261 WeakPolarHBondContact OG-CG 3.27Å; L249-M261 VanDerWaalsContact O-CA 3.26Å; L249-M261 WeakPolarHBondContact O-CA 3.4Å; L250-M261 HydrophobicContact CD1-CB 4.27Å; L250-M261 HydrophobicContact CD1-CG 4.42Å
262W85.3Confident87.2Confident18 Ų1863.4 Ų63.47%0.06832%0.316CS..EExtended strand (participates in β ladder)trans-144.3164.1176.970.3108000111.9I25 L31 D33 N35 I36 S248 L249 C251I25-W262 HydrophobicContact CD1-CH2 3.67Å; I25-W262 HydrophobicContact CD1-CZ2 4.08Å; L31-W262 HydrophobicContact CD1-CH2 3.63Å; L31-W262 HydrophobicContact CD1-CZ2 4.43Å; L31-W262 HydrophobicContact CD1-CZ3 4.45Å; L31-W262 HydrophobicContact CD2-CH2 4.5Å; D33-W262 PolarHBondContact OD2-NE1 3.02Å; N35-W262 WeakPolarHBondContact O-CB 3.34Å; I36-W262 HydrophobicContact CB-CE3 4.44Å; I36-W262 HydrophobicContact CG1-CE3 4.25Å; I36-W262 HydrophobicContact CG1-CH2 4.38Å; I36-W262 HydrophobicContact CG1-CZ3 4.14Å; I36-W262 HydrophobicContact CG2-CZ3 4.43Å; S248-W262 WeakPolarHBondContact CA-O 3.11Å; S248-W262 PolarHBondContact OG-O 3.45Å; L249-W262 HydrophobicContact CB-CD2 3.89Å; L249-W262 HydrophobicContact CB-CE3 4.07Å; L249-W262 HydrophobicContact CB-CH2 3.74Å; L249-W262 HydrophobicContact CB-CZ2 3.62Å; L249-W262 HydrophobicContact CB-CZ3 3.99Å; L249-W262 HydrophobicContact CD1-CH2 4.23Å; L249-W262 HydrophobicContact CD1-CZ2 3.38Å; L249-W262 HydrophobicContact CG-CZ2 4.16Å; L249-W262 PolarHBondContact N-O 3.4Å; L249-W262 PolarHBondContact O-N 2.89Å; L249-W262 VanDerWaalsContact O-N 3.13Å; C251-W262 HydrophobicContact CB-CZ3 4.35Å
263S86.3Confident87.3Confident47 Ų4764.7 Ų64.733%0.32932%0.322SS..EExtended strand (participates in β ladder)trans-92135.8-179.359.90000111I247I247-S263 WeakPolarHBondContact O-CA 3.35Å
264Q86.7Confident87.6Confident95 Ų9566.7 Ų66.744%0.44434%0.337SS..EExtended strand (participates in β ladder)trans-120.1140.3168.1-173.7-175.5-9.100109.4Y246 I247 L249Y246-Q264 WeakPolarHBondContact CA-O 3.32Å; I247-Q264 HydrophobicContact CD1-CB 4.39Å; I247-Q264 HydrophobicContact CG1-CB 3.94Å; I247-Q264 WeakPolarHBondContact CG1-O 3.31Å; I247-Q264 PolarHBondContact N-O 3.12Å; I247-Q264 PolarHBondContact O-N 3.41Å; L249-Q264 HydrophobicContact CD1-CB 4.33Å; L249-Q264 HydrophobicContact CG-CB 4.38Å
265E88.7Confident88Confident88 Ų8868.7 Ų68.741%0.41134%0.344SS..EExtended strand (participates in β ladder)trans-60.8135.5171.1-61.4-179.2166.500110.3Y246 T269 H270Y246-E265 HydrophobicContact CE1-CG 4.06Å; E265-T269 VanDerWaalsContact OE2-CA 3.27Å; E265-T269 WeakPolarHBondContact OE2-CA 3.11Å; E265-H270 WeakPolarHBondContact OE1-CB 3.45Å; E265-H270 PolarHBondContact OE1-N 3.24Å
266Y88.8Confident88.5Confident103 Ų10363.8 Ų63.840%0.40432%0.317SS..  trans-116.4-77.5-178.2-177.6-121000112.7Y20 Y21 D245 I247Y20-Y266 AromaticContact CD1-CD1 3.9Å; Y20-Y266 HydrophobicContact CD1-CD1 3.9Å; Y20-Y266 AromaticContact CD1-CE1 3.61Å; Y20-Y266 HydrophobicContact CD1-CE1 3.61Å; Y20-Y266 AromaticContact CE1-CE1 3.8Å; Y20-Y266 HydrophobicContact CE1-CE1 3.8Å; Y21-Y266 HydrophobicContact CE1-CD2 4.35Å; Y21-Y266 HydrophobicContact CE1-CE1 4.48Å; Y21-Y266 HydrophobicContact CE1-CE2 4.07Å; D245-Y266 PolarHBondContact O-N 3.24Å; I247-Y266 HydrophobicContact CD1-CD2 4.29Å; I247-Y266 HydrophobicContact CG2-CD1 4Å; I247-Y266 HydrophobicContact CG2-CD2 3.86Å; I247-Y266 HydrophobicContact CG2-CG 3.53Å
267M90.7Very high88.9Confident113 Ų11362 Ų6256%0.55731%0.307SS*.SBendtrans-83.4-35.3-179.4-75-67.3-169.900113.2T244T244-M267 WeakPolarHBondContact O-CB 3.43Å; T244-M267 WeakPolarHBondContact O-CG 3.3Å; T244-M267 PolarHBondContact O-N 3.42Å
268F89.7Confident89.3Confident50 Ų5058.4 Ų58.422%0.21929%0.293CS..SBendtrans-124137.4-174.4-65.4-75000110.5L241 F273L241-F268 HydrophobicContact CB-CE2 4.38Å; F268-F273 HydrophobicContact CB-CB 3.87Å; F268-F273 HydrophobicContact CD2-CD2 4.47Å
269T91.4Very high89.8Confident72 Ų7264.2 Ų64.244%0.44232%0.318SS..  trans-66.5155162.964.90000109.9E265 K271 S272 F273E265-T269 VanDerWaalsContact OE2-CA 3.27Å; E265-T269 WeakPolarHBondContact OE2-CA 3.11Å; T269-K271 PolarHBondContact O-N 3.27Å; T269-K271 VanDerWaalsContact O-N 3.11Å; T269-S272 PolarHBondContact O-N 3.21Å; T269-S272 WeakPolarHBondContact OG1-CB 3.33Å; T269-S272 PolarHBondContact OG1-N 2.69Å; T269-S272 PolarHBondContact OG1-OG 3.01Å; T269-S272 VanDerWaalsContact OG1-OG 3.11Å; T269-F273 WeakPolarHBondContact O-CB 3.15Å; T269-F273 PolarHBondContact O-N 3.07Å
270H88Confident90.4Very high118 Ų11867.8 Ų67.855%0.54634%0.336SS..Hα-helixtrans-51.1-40.1178178-88000112.6E265 S274E265-H270 WeakPolarHBondContact OE1-CB 3.45Å; E265-H270 PolarHBondContact OE1-N 3.24Å; H270-S274 WeakPolarHBondContact O-CB 3.45Å; H270-S274 PolarHBondContact O-N 2.99Å
271K91.5Very high90.8Very high160 Ų16067.9 Ų67.970%0.69634%0.337SS*.Hα-helixtrans-66-47.9176.4-173.2178.6179.3-179.50111.8T269 F273 S274 L275T269-K271 PolarHBondContact O-N 3.27Å; T269-K271 VanDerWaalsContact O-N 3.11Å; K271-F273 VanDerWaalsContact C-N 3.34Å; K271-F273 PolarHBondContact O-N 3.22Å; K271-S274 PolarHBondContact O-N 3.09Å; K271-L275 WeakPolarHBondContact O-CG 3.44Å; K271-L275 PolarHBondContact O-N 3.09Å
272S93.5Very high91.2Very high55 Ų5568.2 Ų68.239%0.38534%0.339SS..Hα-helixtrans-64.5-38.7178.3-65.10000112.1T269 L275 Y276T269-S272 PolarHBondContact O-N 3.21Å; T269-S272 WeakPolarHBondContact OG1-CB 3.33Å; T269-S272 PolarHBondContact OG1-N 2.69Å; T269-S272 PolarHBondContact OG1-OG 3.01Å; T269-S272 VanDerWaalsContact OG1-OG 3.11Å; S272-L275 PolarHBondContact O-N 3.49Å; S272-Y276 WeakPolarHBondContact O-CB 3.44Å; S272-Y276 PolarHBondContact O-N 3.29Å
273F91.2Very high91.7Very high32 Ų3268.8 Ų68.814%0.1435%0.345CS..Hα-helixtrans-64.7-44.9175.8-177.8-104.5000111.7K242 D245 F268 T269 K271 L275 Y276 M277K242-F273 HydrophobicContact CG-CE2 4.14Å; K242-F273 HydrophobicContact CG-CZ 4.31Å; D245-F273 HydrophobicContact CB-CD2 3.58Å; D245-F273 HydrophobicContact CB-CE2 3.55Å; D245-F273 HydrophobicContact CB-CG 4.32Å; D245-F273 HydrophobicContact CB-CZ 4.26Å; D245-F273 VanDerWaalsContact OD2-CE2 3.29Å; D245-F273 WeakPolarHBondContact OD2-CE2 3.21Å; D245-F273 WeakPolarHBondContact OD2-CZ 3.36Å; F268-F273 HydrophobicContact CB-CB 3.87Å; F268-F273 HydrophobicContact CD2-CD2 4.47Å; T269-F273 WeakPolarHBondContact O-CB 3.15Å; T269-F273 PolarHBondContact O-N 3.07Å; K271-F273 VanDerWaalsContact C-N 3.34Å; K271-F273 PolarHBondContact O-N 3.22Å; F273-L275 VanDerWaalsContact C-N 3.34Å; F273-L275 PolarHBondContact O-N 3.41Å; F273-Y276 WeakPolarHBondContact O-CB 3.22Å; F273-Y276 PolarHBondContact O-N 3.35Å; F273-M277 HydrophobicContact CD1-CG 4.13Å; F273-M277 HydrophobicContact CE1-CG 3.71Å; F273-M277 HydrophobicContact CE1-SD 4.45Å; F273-M277 HydrophobicContact CE2-CG 4.15Å; F273-M277 HydrophobicContact CE2-SD 4.3Å; F273-M277 HydrophobicContact CZ-CG 3.73Å; F273-M277 HydrophobicContact CZ-SD 3.92Å; F273-M277 WeakPolarHBondContact O-CG 3.41Å; F273-M277 PolarHBondContact O-N 2.84Å
274S90.8Very high92.2Very high53 Ų5367.5 Ų67.537%0.37133%0.333SS..Hα-helixtrans-59.3-43.8175.1178.50000111.8H270 K271 M277 S278H270-S274 WeakPolarHBondContact O-CB 3.45Å; H270-S274 PolarHBondContact O-N 2.99Å; K271-S274 PolarHBondContact O-N 3.09Å; S274-M277 PolarHBondContact O-N 2.96Å; S274-S278 WeakPolarHBondContact O-CB 3.45Å; S274-S278 PolarHBondContact O-N 3.3Å; S274-S278 PolarHBondContact O-OG 3.48Å
275L93.8Very high92.6Very high83 Ų8365 Ų6544%0.43532%0.319SS..Hα-helixtrans-62.7-43.9174.3-69.7173.4000111.8K271 S272 F273 M277 S278 F279K271-L275 WeakPolarHBondContact O-CG 3.44Å; K271-L275 PolarHBondContact O-N 3.09Å; S272-L275 PolarHBondContact O-N 3.49Å; F273-L275 VanDerWaalsContact C-N 3.34Å; F273-L275 PolarHBondContact O-N 3.41Å; L275-M277 PolarHBondContact O-N 3.07Å; L275-S278 PolarHBondContact O-N 2.87Å; L275-F279 HydrophobicContact CB-CD2 4.4Å; L275-F279 HydrophobicContact CD2-CD2 3.97Å; L275-F279 HydrophobicContact CD2-CE2 3.63Å; L275-F279 WeakPolarHBondContact O-CB 3.42Å; L275-F279 WeakPolarHBondContact O-CD2 3.49Å; L275-F279 PolarHBondContact O-N 2.78Å
276Y95Very high92.7Very high25 Ų2561.3 Ų61.310%0.09831%0.305CS..Hα-helixtrans-59.9-46.1177177.2-107.3000112.2I238 L241 K242 S272 F273 S278 I280 V281I238-Y276 VanDerWaalsContact CA-OH 3.26Å; I238-Y276 WeakPolarHBondContact CA-OH 3.44Å; I238-Y276 WeakPolarHBondContact CG2-OH 3.22Å; I238-Y276 PolarHBondContact O-OH 2.99Å; L241-Y276 HydrophobicContact CB-CE1 4.38Å; K242-Y276 HydrophobicContact CB-CE1 4.03Å; S272-Y276 WeakPolarHBondContact O-CB 3.44Å; S272-Y276 PolarHBondContact O-N 3.29Å; F273-Y276 WeakPolarHBondContact O-CB 3.22Å; F273-Y276 PolarHBondContact O-N 3.35Å; Y276-S278 VanDerWaalsContact C-N 3.33Å; Y276-S278 PolarHBondContact O-N 3.42Å; Y276-I280 HydrophobicContact CD2-CB 3.86Å; Y276-I280 HydrophobicContact CD2-CG1 3.87Å; Y276-I280 HydrophobicContact CD2-CG2 4.29Å; Y276-I280 HydrophobicContact CE2-CB 3.8Å; Y276-I280 HydrophobicContact CE2-CG1 4.12Å; Y276-I280 HydrophobicContact CE2-CG2 3.72Å; Y276-I280 WeakPolarHBondContact O-CA 3.46Å; Y276-I280 WeakPolarHBondContact O-CB 3.45Å; Y276-I280 PolarHBondContact O-N 3.44Å; Y276-V281 HydrophobicContact CD1-CG2 3.75Å; Y276-V281 HydrophobicContact CE1-CG2 3.32Å; Y276-V281 PolarHBondContact O-N 2.89Å; Y276-V281 VanDerWaalsContact O-N 3.09Å
277M92.8Very high92.9Very high51 Ų5158.3 Ų58.325%0.25130%0.297SS..Iπ-helixtrans-60.8-42.8175.9-72.6-62-66.800111.8K242 F273 S274 L275 V281 L282K242-M277 HydrophobicContact CD-CE 4.3Å; K242-M277 HydrophobicContact CD-SD 3.8Å; K242-M277 HydrophobicContact CG-SD 3.8Å; F273-M277 HydrophobicContact CD1-CG 4.13Å; F273-M277 HydrophobicContact CE1-CG 3.71Å; F273-M277 HydrophobicContact CE1-SD 4.45Å; F273-M277 HydrophobicContact CE2-CG 4.15Å; F273-M277 HydrophobicContact CE2-SD 4.3Å; F273-M277 HydrophobicContact CZ-CG 3.73Å; F273-M277 HydrophobicContact CZ-SD 3.92Å; F273-M277 WeakPolarHBondContact O-CG 3.41Å; F273-M277 PolarHBondContact O-N 2.84Å; S274-M277 PolarHBondContact O-N 2.96Å; L275-M277 PolarHBondContact O-N 3.07Å; M277-V281 HydrophobicContact CE-CB 4.47Å; M277-V281 HydrophobicContact CE-CG1 4.2Å; M277-V281 HydrophobicContact SD-CB 3.97Å; M277-V281 HydrophobicContact SD-CG1 4.12Å; M277-V281 HydrophobicContact SD-CG2 3.78Å; M277-L282 VanDerWaalsContact O-CB 3.28Å; M277-L282 WeakPolarHBondContact O-CB 3.39Å; M277-L282 PolarHBondContact O-N 3.27Å
278S92.3Very high93.1Very high25 Ų2556.4 Ų56.418%0.17529%0.288CS..Iπ-helixtrans-72.1-43.3-176.5-53.20000113.4S274 L275 Y276 P283 T373S274-S278 WeakPolarHBondContact O-CB 3.45Å; S274-S278 PolarHBondContact O-N 3.3Å; S274-S278 PolarHBondContact O-OG 3.48Å; L275-S278 PolarHBondContact O-N 2.87Å; Y276-S278 VanDerWaalsContact C-N 3.33Å; Y276-S278 PolarHBondContact O-N 3.42Å; S278-P283 VanDerWaalsContact O-CD 3.23Å; S278-P283 WeakPolarHBondContact O-CD 3.3Å; S278-P283 WeakPolarHBondContact O-CG 3.46Å; S278-T373 WeakPolarHBondContact OG-CG2 3.43Å
279F95.1Very high93.4Very high147 Ų14754 Ų5465%0.64528%0.277SS*.Iπ-helixtrans-103.2-20-168.4-71.1-74.7000114L275 P283L275-F279 HydrophobicContact CB-CD2 4.4Å; L275-F279 HydrophobicContact CD2-CD2 3.97Å; L275-F279 HydrophobicContact CD2-CE2 3.63Å; L275-F279 WeakPolarHBondContact O-CB 3.42Å; L275-F279 WeakPolarHBondContact O-CD2 3.49Å; L275-F279 PolarHBondContact O-N 2.78Å; F279-P283 WeakPolarHBondContact O-CG 3.18Å
280I96.4Very high93.5Very high79 Ų7953.8 Ų53.841%0.40527%0.268SS..Iπ-helixtrans-114.4-59.8-179.7-53.8-61.2000110.8I238 Y276 Y284I238-I280 HydrophobicContact CD1-CG2 4.31Å; I238-I280 HydrophobicContact CG1-CG2 4.39Å; I238-I280 HydrophobicContact CG2-CG2 4.47Å; Y276-I280 HydrophobicContact CD2-CB 3.86Å; Y276-I280 HydrophobicContact CD2-CG1 3.87Å; Y276-I280 HydrophobicContact CD2-CG2 4.29Å; Y276-I280 HydrophobicContact CE2-CB 3.8Å; Y276-I280 HydrophobicContact CE2-CG1 4.12Å; Y276-I280 HydrophobicContact CE2-CG2 3.72Å; Y276-I280 WeakPolarHBondContact O-CA 3.46Å; Y276-I280 WeakPolarHBondContact O-CB 3.45Å; Y276-I280 PolarHBondContact O-N 3.44Å; I280-Y284 WeakPolarHBondContact O-CB 3.41Å; I280-Y284 PolarHBondContact O-N 3.49Å; I280-Y284 VanDerWaalsContact O-N 3.09Å
281V95Very high93.8Very high3 Ų352.5 Ų52.52%0.01827%0.265CS..Iπ-helixtrans-67.4-53.4-171.6-178.60000111.5F188 I238 K242 Y276 M277 Y284 R285F188-V281 HydrophobicContact CZ-CG1 4.01Å; I238-V281 HydrophobicContact CG2-CG2 4.01Å; K242-V281 HydrophobicContact CD-CG1 4.43Å; Y276-V281 HydrophobicContact CD1-CG2 3.75Å; Y276-V281 HydrophobicContact CE1-CG2 3.32Å; Y276-V281 PolarHBondContact O-N 2.89Å; Y276-V281 VanDerWaalsContact O-N 3.09Å; M277-V281 HydrophobicContact CE-CB 4.47Å; M277-V281 HydrophobicContact CE-CG1 4.2Å; M277-V281 HydrophobicContact SD-CB 3.97Å; M277-V281 HydrophobicContact SD-CG1 4.12Å; M277-V281 HydrophobicContact SD-CG2 3.78Å; V281-Y284 PolarHBondContact O-N 3.01Å; V281-R285 WeakPolarHBondContact O-CB 3.29Å; V281-R285 PolarHBondContact O-N 3.39Å
282L93.4Very high94.1Very high15 Ų1547.3 Ų47.38%0.07924%0.244CC..Hα-helixtrans-61.6-46.4-178.1174.365.4000112.4M277 Y284 A286 V287 F366 I370M277-L282 VanDerWaalsContact O-CB 3.28Å; M277-L282 WeakPolarHBondContact O-CB 3.39Å; M277-L282 PolarHBondContact O-N 3.27Å; L282-Y284 PolarHBondContact O-N 3.36Å; L282-A286 HydrophobicContact CD1-CB 4.26Å; L282-A286 PolarHBondContact O-N 3.47Å; L282-V287 HydrophobicContact CG-CG2 4.47Å; L282-V287 PolarHBondContact O-N 2.93Å; L282-F366 HydrophobicContact CD1-CD2 4.4Å; L282-I370 HydrophobicContact CD2-CG1 4.17Å
283P95.3Very high94.3Very high30 Ų3044.8 Ų44.820%0.19523%0.226CC..Iπ-helixtrans-63.6-42.3177.7-27.539.1000113.4S278 F279 V287 I288S278-P283 VanDerWaalsContact O-CD 3.23Å; S278-P283 WeakPolarHBondContact O-CD 3.3Å; S278-P283 WeakPolarHBondContact O-CG 3.46Å; F279-P283 WeakPolarHBondContact O-CG 3.18Å; P283-V287 HydrophobicContact CB-CB 4.37Å; P283-V287 HydrophobicContact CB-CG2 4.38Å; P283-V287 PolarHBondContact O-N 3.41Å; P283-I288 HydrophobicContact CB-CD1 4.38Å; P283-I288 WeakPolarHBondContact O-CB 3.11Å; P283-I288 WeakPolarHBondContact O-CG1 3.39Å; P283-I288 PolarHBondContact O-N 2.91Å
284Y96.7Very high94.5Very high20 Ų2046.4 Ų46.48%0.07824%0.236CC..Iπ-helixtrans-68.8-43.7179.4-179.6-99.1000112.9F188 W192 L231 I234 S235 I238 I280 V281 L282F188-Y284 HydrophobicContact CB-CE1 4.21Å; F188-Y284 HydrophobicContact CD2-CD1 4.22Å; F188-Y284 HydrophobicContact CD2-CE1 4.06Å; F188-Y284 HydrophobicContact CG-CE1 4.38Å; W192-Y284 AromaticContact CD1-CE1 3.93Å; W192-Y284 AromaticContact CD1-CZ 3.65Å; W192-Y284 AromaticContact CE2-CE2 3.61Å; W192-Y284 AromaticContact CE2-CZ 3.93Å; W192-Y284 AromaticContact CZ2-CD2 3.81Å; W192-Y284 HydrophobicContact CZ2-CD2 3.81Å; W192-Y284 AromaticContact CZ2-CE2 3.7Å; W192-Y284 HydrophobicContact CZ2-CE2 3.7Å; W192-Y284 AromaticContact NE1-CD1 3.9Å; W192-Y284 AromaticContact NE1-CD2 3.68Å; W192-Y284 AromaticContact NE1-CE1 3.48Å; W192-Y284 AromaticContact NE1-CE2 3.24Å; W192-Y284 AromaticContact NE1-CG 3.99Å; W192-Y284 AromaticContact NE1-CZ 3.12Å; W192-Y284 PolarHBondContact NE1-O 3.46Å; W192-Y284 PolarHBondContact NE1-OH 2.91Å; L231-Y284 PolarHBondContact O-OH 3Å; I234-Y284 HydrophobicContact CB-CE2 4.46Å; I234-Y284 HydrophobicContact CG2-CD2 4.38Å; I234-Y284 HydrophobicContact CG2-CE1 4.47Å; I234-Y284 HydrophobicContact CG2-CE2 3.55Å; S235-Y284 PolarHBondContact N-OH 3.14Å; S235-Y284 PolarHBondContact OG-OH 3.44Å; I238-Y284 HydrophobicContact CD1-CD1 3.54Å; I238-Y284 HydrophobicContact CD1-CD2 3.75Å; I238-Y284 HydrophobicContact CD1-CE1 3.84Å; I238-Y284 HydrophobicContact CD1-CE2 4.04Å; I238-Y284 HydrophobicContact CD1-CG 3.48Å; I238-Y284 VanDerWaalsContact CD1-CG 3.48Å; I238-Y284 HydrophobicContact CG2-CD1 4.46Å; I280-Y284 WeakPolarHBondContact O-CB 3.41Å; I280-Y284 PolarHBondContact O-N 3.49Å; I280-Y284 VanDerWaalsContact O-N 3.09Å; V281-Y284 PolarHBondContact O-N 3.01Å; L282-Y284 PolarHBondContact O-N 3.36Å
285R94Very high94.8Very high42 Ų4247.9 Ų47.916%0.15824%0.239CC..Iπ-helixtrans-69.3-41.4-178.2176.5-172.4174.4-140.2-11.5112.3F188 N191 V281 T289 N365F188-R285 HydrophobicContact CD1-CB 4.05Å; F188-R285 HydrophobicContact CD1-CG 3.73Å; F188-R285 HydrophobicContact CE1-CB 3.89Å; F188-R285 HydrophobicContact CE1-CG 3.6Å; F188-R285 HydrophobicContact CZ-CB 4.48Å; N191-R285 PolarHBondContact ND2-O 3.43Å; V281-R285 WeakPolarHBondContact O-CB 3.29Å; V281-R285 PolarHBondContact O-N 3.39Å; R285-T289 PolarHBondContact O-OG1 3.13Å; R285-N365 PolarHBondContact NH2-OD1 3.2Å
286A91.7Very high95Very high12 Ų1246.1 Ų46.110%0.09923%0.228CC..Iπ-helixtrans-128.6-59-165.700000113.6L282 I288 T289 W290 F366L282-A286 HydrophobicContact CD1-CB 4.26Å; L282-A286 PolarHBondContact O-N 3.47Å; A286-I288 PolarHBondContact O-N 3.19Å; A286-T289 PolarHBondContact O-N 2.88Å; A286-T289 PolarHBondContact O-OG1 3.47Å; A286-W290 WeakPolarHBondContact O-CB 3.44Å; A286-W290 PolarHBondContact O-N 3.27Å; A286-F366 HydrophobicContact CB-CD2 3.77Å; A286-F366 HydrophobicContact CB-CE2 4.5Å
287V92.4Very high95Very high39 Ų3945.6 Ų45.624%0.23623%0.227CC..Iπ-helixtrans-58.2-55-168.8-177.40000111.5L282 P283 W290 I291 F366L282-V287 HydrophobicContact CG-CG2 4.47Å; L282-V287 PolarHBondContact O-N 2.93Å; P283-V287 HydrophobicContact CB-CB 4.37Å; P283-V287 HydrophobicContact CB-CG2 4.38Å; P283-V287 PolarHBondContact O-N 3.41Å; V287-W290 PolarHBondContact O-N 2.95Å; V287-I291 HydrophobicContact CG1-CD1 3.7Å; V287-I291 WeakPolarHBondContact O-CB 3.38Å; V287-I291 VanDerWaalsContact O-CG1 3.28Å; V287-I291 WeakPolarHBondContact O-CG1 2.98Å; V287-I291 PolarHBondContact O-N 3.49Å; V287-F366 HydrophobicContact CB-CE2 4.29Å; V287-F366 HydrophobicContact CG2-CD2 4.45Å; V287-F366 HydrophobicContact CG2-CE2 3.43Å; V287-F366 VanDerWaalsContact CG2-CE2 3.43Å; V287-F366 HydrophobicContact CG2-CZ 3.97Å
288I95.7Very high95.2Very high73 Ų7346.5 Ų46.537%0.37424%0.236SC..Hα-helixtrans-66.4-47.9-173.5-65169.5000109.8W192 P283 A286 W290 I291 L292W192-I288 HydrophobicContact CH2-CG2 3.66Å; W192-I288 HydrophobicContact CZ2-CG2 4.12Å; P283-I288 HydrophobicContact CB-CD1 4.38Å; P283-I288 WeakPolarHBondContact O-CB 3.11Å; P283-I288 WeakPolarHBondContact O-CG1 3.39Å; P283-I288 PolarHBondContact O-N 2.91Å; A286-I288 PolarHBondContact O-N 3.19Å; I288-W290 VanDerWaalsContact C-N 3.32Å; I288-W290 PolarHBondContact O-N 2.96Å; I288-I291 PolarHBondContact O-N 3.38Å; I288-L292 HydrophobicContact CG2-CD1 3.79Å; I288-L292 HydrophobicContact CG2-CG 4.34Å; I288-L292 WeakPolarHBondContact O-CB 3.37Å; I288-L292 VanDerWaalsContact O-CG 3.24Å; I288-L292 WeakPolarHBondContact O-CG 3.37Å; I288-L292 PolarHBondContact O-N 3.27Å
289T95.5Very high95.4Very high0 Ų048.8 Ų48.80%024%0.244CC..Hα-helixtrans-60.9-41.5179.248.20000111.9N191 W192 R285 A286 I293N191-T289 HydrophobicContact CB-CG2 4.17Å; W192-T289 HydrophobicContact CD2-CG2 3.64Å; W192-T289 HydrophobicContact CE3-CG2 4.1Å; W192-T289 HydrophobicContact CG-CG2 3.95Å; W192-T289 HydrophobicContact CZ2-CG2 4.06Å; R285-T289 PolarHBondContact O-OG1 3.13Å; A286-T289 PolarHBondContact O-N 2.88Å; A286-T289 PolarHBondContact O-OG1 3.47Å; T289-I293 WeakPolarHBondContact O-CB 3.33Å; T289-I293 WeakPolarHBondContact O-CD1 3.28Å; T289-I293 WeakPolarHBondContact O-CG1 3.37Å; T289-I293 PolarHBondContact O-N 3.4Å
290W93.6Very high95.4Very high67 Ų6741.8 Ų41.825%0.25421%0.214SC..Hα-helixtrans-68.6-46.2-178.4-170.289.7000111.7A286 V287 I288 L292 I293 I294A286-W290 WeakPolarHBondContact O-CB 3.44Å; A286-W290 PolarHBondContact O-N 3.27Å; V287-W290 PolarHBondContact O-N 2.95Å; I288-W290 VanDerWaalsContact C-N 3.32Å; I288-W290 PolarHBondContact O-N 2.96Å; W290-L292 PolarHBondContact O-N 3.11Å; W290-I293 PolarHBondContact O-N 2.96Å; W290-I294 HydrophobicContact CD2-CD1 3.59Å; W290-I294 HydrophobicContact CD2-CG1 4.47Å; W290-I294 VanDerWaalsContact CE2-CD1 3.41Å; W290-I294 HydrophobicContact CE3-CD1 3.58Å; W290-I294 HydrophobicContact CG-CD1 4.5Å; W290-I294 HydrophobicContact CH2-CD1 3.25Å; W290-I294 HydrophobicContact CZ2-CD1 3.27Å; W290-I294 HydrophobicContact CZ3-CD1 3.41Å; W290-I294 VanDerWaalsContact CZ3-CD1 3.41Å; W290-I294 WeakPolarHBondContact O-CG1 3.46Å; W290-I294 PolarHBondContact O-N 3.18Å
291I95.2Very high95.3Very high91 Ų9141.2 Ų41.247%0.46721%0.211SC..Hα-helixtrans-58.9-47.3175.3-68.9171.3000110.7V287 I288 I294 L295V287-I291 HydrophobicContact CG1-CD1 3.7Å; V287-I291 WeakPolarHBondContact O-CB 3.38Å; V287-I291 VanDerWaalsContact O-CG1 3.28Å; V287-I291 WeakPolarHBondContact O-CG1 2.98Å; V287-I291 PolarHBondContact O-N 3.49Å; I288-I291 PolarHBondContact O-N 3.38Å; I291-I294 PolarHBondContact O-N 3.16Å; I291-L295 VanDerWaalsContact O-CB 3.29Å; I291-L295 WeakPolarHBondContact O-CB 3.28Å; I291-L295 PolarHBondContact O-N 3.07Å
292L97.2Very high95.2Very high51 Ų5146.2 Ų46.227%0.26724%0.236SC..Hα-helixtrans-64.3-44-179.8-71.2176.8000112W192 C195 I288 W290 I294 L295 F296W192-L292 HydrophobicContact CH2-CD1 4.41Å; W192-L292 HydrophobicContact CZ3-CD1 4.13Å; C195-L292 VanDerWaalsContact SG-CB 3.53Å; I288-L292 HydrophobicContact CG2-CD1 3.79Å; I288-L292 HydrophobicContact CG2-CG 4.34Å; I288-L292 WeakPolarHBondContact O-CB 3.37Å; I288-L292 VanDerWaalsContact O-CG 3.24Å; I288-L292 WeakPolarHBondContact O-CG 3.37Å; I288-L292 PolarHBondContact O-N 3.27Å; W290-L292 PolarHBondContact O-N 3.11Å; L292-I294 VanDerWaalsContact C-N 3.34Å; L292-I294 PolarHBondContact O-N 3.24Å; L292-L295 PolarHBondContact O-N 3.35Å; L292-F296 HydrophobicContact CB-CD2 4.33Å; L292-F296 HydrophobicContact CB-CE2 4.07Å; L292-F296 HydrophobicContact CD2-CE2 4.23Å; L292-F296 WeakPolarHBondContact O-CB 3.34Å; L292-F296 WeakPolarHBondContact O-CD2 3.4Å; L292-F296 WeakPolarHBondContact O-CG 3.45Å; L292-F296 PolarHBondContact O-N 3.2Å
293I96.6Very high95.1Very high2 Ų250 Ų501%0.0125%0.25CC..Hα-helixtrans-60.7-45.1177.7-72.5163.6000110.5V194 C195 T289 W290 T297 A355 F358V194-I293 HydrophobicContact CB-CD1 4.14Å; V194-I293 HydrophobicContact CG1-CD1 3.75Å; V194-I293 HydrophobicContact CG1-CG1 4.33Å; C195-I293 HydrophobicContact CB-CD1 4.22Å; C195-I293 HydrophobicContact CB-CG1 3.94Å; T289-I293 WeakPolarHBondContact O-CB 3.33Å; T289-I293 WeakPolarHBondContact O-CD1 3.28Å; T289-I293 WeakPolarHBondContact O-CG1 3.37Å; T289-I293 PolarHBondContact O-N 3.4Å; W290-I293 PolarHBondContact O-N 2.96Å; I293-T297 WeakPolarHBondContact O-CB 3.37Å; I293-T297 PolarHBondContact O-N 3.4Å; I293-T297 PolarHBondContact O-OG1 2.89Å; I293-A355 HydrophobicContact CG2-CB 3.83Å; I293-F358 HydrophobicContact CD1-CD1 3.56Å; I293-F358 HydrophobicContact CD1-CE1 3.32Å; I293-F358 HydrophobicContact CD1-CE2 4.38Å; I293-F358 HydrophobicContact CD1-CG 4.21Å; I293-F358 HydrophobicContact CD1-CZ 3.78Å; I293-F358 HydrophobicContact CG2-CD1 4.41Å
294I95.7Very high94.7Very high66 Ų6650 Ų5034%0.33825%0.248SC..Hα-helixtrans-63.1-48.4177-72.7178.5000110.9W290 I291 L292 F296 T297 V298W290-I294 HydrophobicContact CD2-CD1 3.59Å; W290-I294 HydrophobicContact CD2-CG1 4.47Å; W290-I294 VanDerWaalsContact CE2-CD1 3.41Å; W290-I294 HydrophobicContact CE3-CD1 3.58Å; W290-I294 HydrophobicContact CG-CD1 4.5Å; W290-I294 HydrophobicContact CH2-CD1 3.25Å; W290-I294 HydrophobicContact CZ2-CD1 3.27Å; W290-I294 HydrophobicContact CZ3-CD1 3.41Å; W290-I294 VanDerWaalsContact CZ3-CD1 3.41Å; W290-I294 WeakPolarHBondContact O-CG1 3.46Å; W290-I294 PolarHBondContact O-N 3.18Å; I291-I294 PolarHBondContact O-N 3.16Å; L292-I294 VanDerWaalsContact C-N 3.34Å; L292-I294 PolarHBondContact O-N 3.24Å; I294-F296 PolarHBondContact O-N 3.21Å; I294-T297 PolarHBondContact O-N 3.19Å; I294-V298 HydrophobicContact CG2-CG2 4.14Å; I294-V298 WeakPolarHBondContact O-CB 3.37Å; I294-V298 VanDerWaalsContact O-CG2 3.27Å; I294-V298 WeakPolarHBondContact O-CG2 3.37Å; I294-V298 PolarHBondContact O-N 3.44Å
295L97Very high94Very high84 Ų8458.1 Ų58.144%0.4428%0.278SS..Hα-helixtrans-56.2-51.3179.6-177.6145.9000110.9I291 L292 T297 V298 M299I291-L295 VanDerWaalsContact O-CB 3.29Å; I291-L295 WeakPolarHBondContact O-CB 3.28Å; I291-L295 PolarHBondContact O-N 3.07Å; L292-L295 PolarHBondContact O-N 3.35Å; L295-T297 PolarHBondContact O-N 2.89Å; L295-V298 PolarHBondContact O-N 2.73Å; L295-M299 HydrophobicContact CD2-CG 4.44Å; L295-M299 HydrophobicContact CD2-SD 3.51Å; L295-M299 VanDerWaalsContact CD2-SD 3.51Å; L295-M299 HydrophobicContact CG-SD 4.45Å; L295-M299 VanDerWaalsContact O-CG 3.23Å; L295-M299 WeakPolarHBondContact O-CG 3.45Å; L295-M299 PolarHBondContact O-N 3.2Å
296F97.6Very high92.8Very high47 Ų4759.2 Ų59.221%0.20629%0.291CS..Hα-helixtrans-66.1-36.5178.8-66.8-50.5000112.7T198 A199 A202 L292 I294 M299 I300T198-F296 HydrophobicContact CG2-CB 3.65Å; A199-F296 HydrophobicContact CB-CD1 4.45Å; A199-F296 HydrophobicContact CB-CD2 3.69Å; A199-F296 HydrophobicContact CB-CE1 4.28Å; A199-F296 HydrophobicContact CB-CE2 3.49Å; A199-F296 VanDerWaalsContact CB-CE2 3.49Å; A199-F296 HydrophobicContact CB-CG 4.19Å; A199-F296 HydrophobicContact CB-CZ 3.81Å; A202-F296 HydrophobicContact CB-CB 4.12Å; A202-F296 HydrophobicContact CB-CD1 3.94Å; A202-F296 HydrophobicContact CB-CG 4.36Å; L292-F296 HydrophobicContact CB-CD2 4.33Å; L292-F296 HydrophobicContact CB-CE2 4.07Å; L292-F296 HydrophobicContact CD2-CE2 4.23Å; L292-F296 WeakPolarHBondContact O-CB 3.34Å; L292-F296 WeakPolarHBondContact O-CD2 3.4Å; L292-F296 WeakPolarHBondContact O-CG 3.45Å; L292-F296 PolarHBondContact O-N 3.2Å; I294-F296 PolarHBondContact O-N 3.21Å; F296-M299 HydrophobicContact CD1-SD 4Å; F296-M299 PolarHBondContact O-N 3.3Å; F296-I300 WeakPolarHBondContact O-CD1 3.47Å; F296-I300 VanDerWaalsContact O-CG1 3.22Å; F296-I300 WeakPolarHBondContact O-CG1 3.4Å; F296-I300 PolarHBondContact O-N 3.33Å
297T96.6Very high91.4Very high13 Ų1363.3 Ų63.38%0.0830%0.304CS..Hα-helixtrans-64.4-45.6176.2-62.60000111.3I293 I294 L295 I300 I301 L352 A355I293-T297 WeakPolarHBondContact O-CB 3.37Å; I293-T297 PolarHBondContact O-N 3.4Å; I293-T297 PolarHBondContact O-OG1 2.89Å; I294-T297 PolarHBondContact O-N 3.19Å; L295-T297 PolarHBondContact O-N 2.89Å; T297-I300 WeakPolarHBondContact O-CB 3.48Å; T297-I300 PolarHBondContact O-N 2.56Å; T297-I301 HydrophobicContact CG2-CD1 3.94Å; T297-I301 WeakPolarHBondContact O-CG1 3.31Å; T297-I301 PolarHBondContact O-N 3.36Å; T297-L352 HydrophobicContact CG2-CD2 3.79Å; T297-A355 WeakPolarHBondContact OG1-CB 3.47Å
298V96.3Very high89.8Confident70 Ų7071.9 Ų71.942%0.42433%0.332SS..Hα-helixtrans-61.6-45175.9170.40000110.6I294 L295 I300 I301 I302I294-V298 HydrophobicContact CG2-CG2 4.14Å; I294-V298 WeakPolarHBondContact O-CB 3.37Å; I294-V298 VanDerWaalsContact O-CG2 3.27Å; I294-V298 WeakPolarHBondContact O-CG2 3.37Å; I294-V298 PolarHBondContact O-N 3.44Å; L295-V298 PolarHBondContact O-N 2.73Å; V298-I300 VanDerWaalsContact C-N 3.33Å; V298-I300 PolarHBondContact O-N 2.79Å; V298-I301 PolarHBondContact O-N 2.74Å; V298-I302 HydrophobicContact CG1-CD1 3.61Å; V298-I302 HydrophobicContact CG1-CG1 4.24Å; V298-I302 VanDerWaalsContact O-CG1 3.31Å; V298-I302 WeakPolarHBondContact O-CG1 3.45Å; V298-I302 PolarHBondContact O-N 2.97Å
299M95.5Very high88Confident73 Ų7376.5 Ų76.536%0.3635%0.35SS..Hα-helixtrans-57.8-43.6175.1-69.6173.388.300112.3I206 L295 F296 R303I206-M299 HydrophobicContact CD1-CB 4.27Å; I206-M299 HydrophobicContact CD1-CE 3.38Å; I206-M299 HydrophobicContact CD1-SD 4.33Å; L295-M299 HydrophobicContact CD2-CG 4.44Å; L295-M299 HydrophobicContact CD2-SD 3.51Å; L295-M299 VanDerWaalsContact CD2-SD 3.51Å; L295-M299 HydrophobicContact CG-SD 4.45Å; L295-M299 VanDerWaalsContact O-CG 3.23Å; L295-M299 WeakPolarHBondContact O-CG 3.45Å; L295-M299 PolarHBondContact O-N 3.2Å; F296-M299 HydrophobicContact CD1-SD 4Å; F296-M299 PolarHBondContact O-N 3.3Å; M299-R303 WeakPolarHBondContact O-CB 3.08Å; M299-R303 PolarHBondContact O-N 2.83Å; M299-R303 VanDerWaalsContact O-N 3.09Å
300I95.2Very high86.1Confident0 Ų081.7 Ų81.70%037%0.374CS..Hα-helixtrans-60.6-49175.9-70163.9000110.2T198 R201 A202 V205 F296 T297 V298 R303 L304 T348 L352T198-I300 HydrophobicContact CG2-CD1 4.21Å; R201-I300 HydrophobicContact CB-CD1 3.91Å; A202-I300 HydrophobicContact CB-CD1 4.21Å; A202-I300 HydrophobicContact CB-CG1 3.93Å; V205-I300 HydrophobicContact CG2-CG2 4.42Å; F296-I300 WeakPolarHBondContact O-CD1 3.47Å; F296-I300 VanDerWaalsContact O-CG1 3.22Å; F296-I300 WeakPolarHBondContact O-CG1 3.4Å; F296-I300 PolarHBondContact O-N 3.33Å; T297-I300 WeakPolarHBondContact O-CB 3.48Å; T297-I300 PolarHBondContact O-N 2.56Å; V298-I300 VanDerWaalsContact C-N 3.33Å; V298-I300 PolarHBondContact O-N 2.79Å; I300-R303 PolarHBondContact O-N 3.33Å; I300-L304 HydrophobicContact CG2-CD1 3.73Å; I300-L304 HydrophobicContact CG2-CG 4.33Å; I300-L304 WeakPolarHBondContact O-CB 3.42Å; I300-L304 VanDerWaalsContact O-CG 3.24Å; I300-L304 WeakPolarHBondContact O-CG 3.21Å; I300-L304 PolarHBondContact O-N 3.3Å; I300-T348 HydrophobicContact CG2-CG2 3.49Å; I300-T348 VanDerWaalsContact CG2-CG2 3.49Å; I300-L352 HydrophobicContact CB-CD2 4.28Å; I300-L352 HydrophobicContact CG2-CD1 4.18Å; I300-L352 HydrophobicContact CG2-CD2 3.83Å; I300-L352 HydrophobicContact CG2-CG 4.19Å
301I94.4Very high84.3Confident67 Ų6781.9 Ų81.934%0.34439%0.385SS..Hα-helixtrans-63-46.9-177.4-68.4167.7000111.2T297 V298 R303 L304 R305 L352T297-I301 HydrophobicContact CG2-CD1 3.94Å; T297-I301 WeakPolarHBondContact O-CG1 3.31Å; T297-I301 PolarHBondContact O-N 3.36Å; V298-I301 PolarHBondContact O-N 2.74Å; I301-R303 VanDerWaalsContact C-N 3.29Å; I301-R303 PolarHBondContact O-N 3.42Å; I301-L304 PolarHBondContact O-N 3.33Å; I301-R305 PolarHBondContact O-N 3.45Å; I301-L352 HydrophobicContact CD1-CD2 4.48Å; I301-L352 HydrophobicContact CG1-CD2 4.09Å
302I94Very high82.4Confident108 Ų10880.2 Ų80.255%0.55438%0.382SS*.Hα-helixtrans-57.9-45.4178.3-69.4170.7000110V298 L304 R305 P306V298-I302 HydrophobicContact CG1-CD1 3.61Å; V298-I302 HydrophobicContact CG1-CG1 4.24Å; V298-I302 VanDerWaalsContact O-CG1 3.31Å; V298-I302 WeakPolarHBondContact O-CG1 3.45Å; V298-I302 PolarHBondContact O-N 2.97Å; I302-L304 VanDerWaalsContact C-N 3.33Å; I302-L304 PolarHBondContact O-N 2.92Å; I302-R305 PolarHBondContact O-N 3.2Å; I302-P306 WeakPolarHBondContact O-CD 3.5Å
303R90Very high80.4Confident94 Ų9482.5 Ų82.536%0.35539%0.393SS..Hα-helixtrans-71.6-24.9-177.5-171.760.9178.5125.3-9.4113.8V205 M299 I300 I301 P306V205-R303 HydrophobicContact CG1-CB 3.85Å; V205-R303 HydrophobicContact CG1-CG 3.77Å; M299-R303 WeakPolarHBondContact O-CB 3.08Å; M299-R303 PolarHBondContact O-N 2.83Å; M299-R303 VanDerWaalsContact O-N 3.09Å; I300-R303 PolarHBondContact O-N 3.33Å; I301-R303 VanDerWaalsContact C-N 3.29Å; I301-R303 PolarHBondContact O-N 3.42Å; R303-P306 WeakPolarHBondContact O-CD 3.5Å
304L88.3Confident78.5Confident31 Ų3187.8 Ų87.816%0.16242%0.421CS..Hα-helixtrans-78.5-23.8176.7-73.7174.6000113.7V205 I300 I301 I302 W307 M345 T348 L352V205-L304 HydrophobicContact CG1-CD2 4.35Å; V205-L304 HydrophobicContact CG1-CG 4.34Å; I300-L304 HydrophobicContact CG2-CD1 3.73Å; I300-L304 HydrophobicContact CG2-CG 4.33Å; I300-L304 WeakPolarHBondContact O-CB 3.42Å; I300-L304 VanDerWaalsContact O-CG 3.24Å; I300-L304 WeakPolarHBondContact O-CG 3.21Å; I300-L304 PolarHBondContact O-N 3.3Å; I301-L304 PolarHBondContact O-N 3.33Å; I302-L304 VanDerWaalsContact C-N 3.33Å; I302-L304 PolarHBondContact O-N 2.92Å; L304-W307 HydrophobicContact CD2-CE3 3.76Å; L304-W307 HydrophobicContact CD2-CZ3 3.84Å; L304-W307 PolarHBondContact O-N 2.94Å; L304-M345 HydrophobicContact CD2-CE 3.82Å; L304-M345 HydrophobicContact CD2-SD 3.59Å; L304-M345 VanDerWaalsContact CD2-SD 3.59Å; L304-T348 HydrophobicContact CD1-CG2 3.92Å; L304-L352 HydrophobicContact CD1-CD1 4.16Å
305R82.2Confident76.4Confident190 Ų19091.7 Ų91.772%0.71744%0.438SS*.THydrogen-bonded Turntrans-60.1-45.5-179.6-74.8-179.7177.2-167.6-0.5113.9I301 I302 W307I301-R305 PolarHBondContact O-N 3.45Å; I302-R305 PolarHBondContact O-N 3.2Å; R305-W307 VanDerWaalsContact C-N 3.3Å; R305-W307 PolarHBondContact O-N 3.08Å
306P69Low74.4Confident65 Ų6592 Ų9242%0.42244%0.439SS..THydrogen-bonded Turntrans-62.7-30-179.9-24.732.9000114.8I302 R303 R308 K309 Q310I302-P306 WeakPolarHBondContact O-CD 3.5Å; R303-P306 WeakPolarHBondContact O-CD 3.5Å; P306-R308 PolarHBondContact O-N 2.91Å; P306-K309 PolarHBondContact O-N 3.19Å; P306-K309 VanDerWaalsContact O-N 3.09Å; P306-Q310 PolarHBondContact O-N 2.88Å
307W60.8Low72.2Confident98 Ų9893.7 Ų93.737%0.37146%0.457SS..Hα-helixtrans-65.8-24-174.8-81.6-10.2000114.1L304 R305 K309 S311 M345L304-W307 HydrophobicContact CD2-CE3 3.76Å; L304-W307 HydrophobicContact CD2-CZ3 3.84Å; L304-W307 PolarHBondContact O-N 2.94Å; R305-W307 VanDerWaalsContact C-N 3.3Å; R305-W307 PolarHBondContact O-N 3.08Å; W307-K309 VanDerWaalsContact C-N 3.3Å; W307-K309 PolarHBondContact O-N 3.42Å; W307-S311 PolarHBondContact O-OG 3.4Å; W307-M345 HydrophobicContact CE3-SD 4.03Å; W307-M345 HydrophobicContact CZ3-SD 3.85Å
308R58.4Low70.1Confident220 Ų220101.3 Ų101.383%0.8349%0.492SS*.Hα-helixtrans-70.3-24.7174.9-74.5-173.7176.3-175.2-0.8113.3P306P306-R308 PolarHBondContact O-N 2.91Å
309K58.7Low67.9Low170 Ų170102.3 Ų102.374%0.73950%0.502SS*.Hα-helixtrans-88-33.3-179.5-71.2-170.8177.2-173.90113.3P306 W307 S312P306-K309 PolarHBondContact O-N 3.19Å; P306-K309 VanDerWaalsContact O-N 3.09Å; W307-K309 VanDerWaalsContact C-N 3.3Å; W307-K309 PolarHBondContact O-N 3.42Å; K309-S312 PolarHBondContact O-OG 2.86Å
310Q56.4Low65.6Low108 Ų108106.8 Ų106.851%0.50552%0.519SS..Hα-helixtrans-80.8-28.5-177.1-163.564.81700113.4P306 S312 L313 L314P306-Q310 PolarHBondContact O-N 2.88Å; Q310-S312 VanDerWaalsContact C-N 3.27Å; Q310-S312 PolarHBondContact O-N 3.03Å; Q310-L313 PolarHBondContact O-N 3.43Å; Q310-L314 PolarHBondContact O-N 2.87Å
311S55.5Low63.5Low72 Ų72111.8 Ų111.850%0.50355%0.554SS.*Hα-helixtrans-67.9-26.1-17963.40000113.4W307W307-S311 PolarHBondContact O-OG 3.4Å
312S55.2Low61.4Low55 Ų55116.1 Ų116.139%0.38558%0.577SS.*Hα-helixtrans-74.9-37.1174.2520000112.1K309 Q310 Q315 I316K309-S312 PolarHBondContact O-OG 2.86Å; Q310-S312 VanDerWaalsContact C-N 3.27Å; Q310-S312 PolarHBondContact O-N 3.03Å; S312-Q315 PolarHBondContact O-N 2.67Å; S312-I316 WeakPolarHBondContact O-CG1 3.41Å; S312-I316 PolarHBondContact O-N 3.26Å
313L55Low59.3Low99 Ų99118.2 Ų118.252%0.51859%0.589SS.*Hα-helixtrans-68.7-37.4-179.1-80.5166.3000113.3Q310 Q315 I316 S317Q310-L313 PolarHBondContact O-N 3.43Å; L313-Q315 VanDerWaalsContact C-N 3.3Å; L313-Q315 PolarHBondContact O-N 3.45Å; L313-I316 PolarHBondContact O-N 2.98Å; L313-S317 PolarHBondContact O-N 3.42Å; L313-S317 VanDerWaalsContact O-N 3.08Å; L313-S317 PolarHBondContact O-OG 3.11Å
314L55.6Low57.5Low114 Ų114121 Ų12160%0.59761%0.612SS**Hα-helixtrans-70.8-23175.4-78.8163.8000113.3Q310Q310-L314 PolarHBondContact O-N 2.87Å
315Q53.1Low55.9Low148 Ų148127.4 Ų127.469%0.69264%0.644SS**Hα-helixtrans-78.8-31.9171.8-93-175.9-64.300112.7S312 L313S312-Q315 PolarHBondContact O-N 2.67Å; L313-Q315 VanDerWaalsContact C-N 3.3Å; L313-Q315 PolarHBondContact O-N 3.45Å
316I53.6Low54.2Low90 Ų90123.7 Ų123.746%0.46264%0.644SS.*Hα-helixtrans-82.5-32.1-177.2-65.1165.8000111.9S312 L313 Q318 S319S312-I316 WeakPolarHBondContact O-CG1 3.41Å; S312-I316 PolarHBondContact O-N 3.26Å; L313-I316 PolarHBondContact O-N 2.98Å; I316-Q318 PolarHBondContact O-N 3.1Å; I316-S319 PolarHBondContact O-N 3.49Å; I316-S319 PolarHBondContact O-OG 3.49Å
317S51.9Low53.3Low83 Ų83129.5 Ų129.558%0.5867%0.668SS**THydrogen-bonded Turntrans-73-7.6-178.639.40000114.7L313L313-S317 PolarHBondContact O-N 3.42Å; L313-S317 VanDerWaalsContact O-N 3.08Å; L313-S317 PolarHBondContact O-OG 3.11Å
318Q53.8Low53.1Low173 Ų173128.2 Ų128.281%0.80869%0.685SS**THydrogen-bonded Turntrans-107.4-6.1171.8-71.6-174-20.700114I316I316-Q318 PolarHBondContact O-N 3.1Å
319S49.8Very low53Low90 Ų90126.2 Ų126.263%0.62969%0.685SS**SBendtrans-100.16.6176750000113.5I316I316-S319 PolarHBondContact O-N 3.49Å; I316-S319 PolarHBondContact O-OG 3.49Å
320K46.8Very low53.2Low168 Ų168125.6 Ų125.673%0.7369%0.685SS**SBendtrans-132.969.7-178.8-75.3-169.6174.9-172.90111.6
321S50Low54.1Low105 Ų105124.8 Ų124.873%0.73468%0.684SS**SBendtrans178.4117.313656.60000111.2
322L50.1Low55.3Low158 Ų158126.3 Ų126.383%0.82769%0.692SS**  trans67.9105.4153.9-8771.8000118.7
323D50.9Low56.7Low151 Ų151130.8 Ų130.881%0.80771%0.707SS**SBendtrans11134.7130.2-56.6-39.4000117.5
324D51.6Low57.9Low154 Ų154133.8 Ų133.882%0.82471%0.712SS**  trans79.458.7166-61.4-21.6000119.8
325I55.2Low59.3Low164 Ų164132 Ų13284%0.84170%0.703SS**  trans-142.1112.7135.2-53.4-178.3000110.2
326P46.3Very low60.8Low112 Ų112127.9 Ų127.973%0.72769%0.694SS**  trans-76.4134.2179.630-32.2000112.4
327M50.5Low62.3Low188 Ų188127.1 Ų127.193%0.92669%0.694SS**SBendtrans54.6120.2148.6-62.5-155.2-60.400120
328G55.8Low63.8Low70 Ų70129.7 Ų129.772%0.72269%0.691SS**  121.2-2.5123.200000119E330G328-E330 VanDerWaalsContact C-N 3.3Å; G328-E330 PolarHBondContact O-N 3.41Å; G328-E330 VanDerWaalsContact O-N 3.13Å
329H56.1Low65.3Low179 Ų179129.4 Ų129.483%0.82969%0.687SS**  trans-88.472.4169.2-94.3-74.8000111.1N331H329-N331 VanDerWaalsContact C-N 3.35Å; H329-N331 PolarHBondContact O-N 2.99Å
330E62.8Low66.9Low157 Ų157131.5 Ų131.573%0.73468%0.681SS**  trans-56.2101.5156.9-68.3-173.3159.300107.4G328 P332G328-E330 VanDerWaalsContact C-N 3.3Å; G328-E330 PolarHBondContact O-N 3.41Å; G328-E330 VanDerWaalsContact O-N 3.13Å; E330-P332 WeakPolarHBondContact O-CD 3.32Å
331N75.3Confident68.8Low90 Ų90128.7 Ų128.748%0.48167%0.671SS.*  trans-64.6110.3178.7-84.8-32.6000108.5H329 Q333 Y334H329-N331 VanDerWaalsContact C-N 3.35Å; H329-N331 PolarHBondContact O-N 2.99Å; N331-Q333 PolarHBondContact O-N 3.01Å; N331-Y334 HydrophobicContact CB-CD2 3.48Å; N331-Y334 VanDerWaalsContact CB-CD2 3.48Å; N331-Y334 HydrophobicContact CB-CE2 4.09Å; N331-Y334 HydrophobicContact CB-CG 4.48Å; N331-Y334 PolarHBondContact O-N 3.45Å
332P81.9Confident70.5Confident104 Ų104129.3 Ų129.368%0.67566%0.66SS**Hα-helixtrans-60.3-21.4-173.323.8-34.3000112.5E330 A336E330-P332 WeakPolarHBondContact O-CD 3.32Å; P332-A336 WeakPolarHBondContact O-CB 3.37Å; P332-A336 PolarHBondContact O-N 3.41Å; P332-A336 VanDerWaalsContact O-N 3.11Å
333Q83.4Confident72.2Confident149 Ų149123.6 Ų123.670%0.69664%0.639SS**Hα-helixtrans-66.5-40.7174.5-169174.42.200113N331 A336 V337N331-Q333 PolarHBondContact O-N 3.01Å; Q333-A336 PolarHBondContact O-N 3.3Å; Q333-V337 VanDerWaalsContact O-CG2 3.32Å; Q333-V337 WeakPolarHBondContact O-CG2 3.46Å; Q333-V337 PolarHBondContact O-N 3.01Å; Q333-V337 VanDerWaalsContact O-N 3.08Å
334Y81.9Confident74Confident163 Ų163119.7 Ų119.764%0.63962%0.616SS**Hα-helixtrans-68.7-40.4-179.9-78.1-94.2000111.1N331 V337 R338N331-Y334 HydrophobicContact CB-CD2 3.48Å; N331-Y334 VanDerWaalsContact CB-CD2 3.48Å; N331-Y334 HydrophobicContact CB-CE2 4.09Å; N331-Y334 HydrophobicContact CB-CG 4.48Å; N331-Y334 PolarHBondContact O-N 3.45Å; Y334-V337 PolarHBondContact O-N 2.9Å; Y334-R338 WeakPolarHBondContact O-CB 3.34Å; Y334-R338 PolarHBondContact O-N 3.31Å
335D85.3Confident75.8Confident76 Ų76115.6 Ų115.641%0.40659%0.593SS.*Hα-helixtrans-66.9-38.8176.4-75.2-39.2000112.9V337 R338 K339D335-V337 PolarHBondContact O-N 3.44Å; D335-R338 PolarHBondContact O-N 2.95Å; D335-K339 VanDerWaalsContact O-CB 3.25Å; D335-K339 WeakPolarHBondContact O-CB 3.3Å; D335-K339 PolarHBondContact O-N 3.29Å
336A84.5Confident77.5Confident61 Ų61112.3 Ų112.350%0.50457%0.573SS.*Hα-helixtrans-61-43.6173.800000111.8P332 Q333 R340P332-A336 WeakPolarHBondContact O-CB 3.37Å; P332-A336 PolarHBondContact O-N 3.41Å; P332-A336 VanDerWaalsContact O-N 3.11Å; Q333-A336 PolarHBondContact O-N 3.3Å; A336-R340 WeakPolarHBondContact O-CB 3.3Å; A336-R340 PolarHBondContact O-N 2.89Å
337V83.3Confident79.7Confident74 Ų74107.5 Ų107.545%0.44854%0.542SS..Hα-helixtrans-64.2-46.8176.4172.40000110.8Q333 Y334 D335 K339 R340 Q341Q333-V337 VanDerWaalsContact O-CG2 3.32Å; Q333-V337 WeakPolarHBondContact O-CG2 3.46Å; Q333-V337 PolarHBondContact O-N 3.01Å; Q333-V337 VanDerWaalsContact O-N 3.08Å; Y334-V337 PolarHBondContact O-N 2.9Å; D335-V337 PolarHBondContact O-N 3.44Å; V337-K339 PolarHBondContact O-N 2.9Å; V337-R340 PolarHBondContact O-N 2.94Å; V337-Q341 HydrophobicContact CG1-CG 4.44Å; V337-Q341 WeakPolarHBondContact O-CG 3.39Å; V337-Q341 PolarHBondContact O-N 2.84Å
338R84.7Confident81.8Confident138 Ų13898.7 Ų98.752%0.52150%0.499SS..Hα-helixtrans-62.4-42.3178.9-170.8-179.7-177.1-161.94.1111.9Y334 D335 Q341 K342Y334-R338 WeakPolarHBondContact O-CB 3.34Å; Y334-R338 PolarHBondContact O-N 3.31Å; D335-R338 PolarHBondContact O-N 2.95Å; R338-Q341 PolarHBondContact O-N 3.36Å; R338-K342 WeakPolarHBondContact O-CG 3.5Å; R338-K342 PolarHBondContact O-N 3.33Å
339K84.8Confident83.7Confident167 Ų167101.6 Ų101.673%0.72649%0.488SS*.Hα-helixtrans-64.1-42.6176.2-171.4174.3-177.3174.90111.3D335 V337 K342 G343D335-K339 VanDerWaalsContact O-CB 3.25Å; D335-K339 WeakPolarHBondContact O-CB 3.3Å; D335-K339 PolarHBondContact O-N 3.29Å; V337-K339 PolarHBondContact O-N 2.9Å; K339-K342 PolarHBondContact O-N 3.41Å; K339-G343 PolarHBondContact O-N 3.48Å
340R84.3Confident85.6Confident134 Ų13493.1 Ų93.151%0.50645%0.449SS..Hα-helixtrans-61.9-45.6174.6-179.3174.9169.5-170.1-10.2111.6A336 V337 G343 Q344A336-R340 WeakPolarHBondContact O-CB 3.3Å; A336-R340 PolarHBondContact O-N 2.89Å; V337-R340 PolarHBondContact O-N 2.94Å; R340-G343 PolarHBondContact O-N 3.23Å; R340-Q344 WeakPolarHBondContact O-CG 3.47Å; R340-Q344 PolarHBondContact O-N 3.38Å
341Q85.5Confident87.2Confident109 Ų10985.7 Ų85.751%0.50942%0.415SS..Hα-helixtrans-60.7-47.6176.8-75175.6-12.200111.8V337 R338 G343 Q344 M345V337-Q341 HydrophobicContact CG1-CG 4.44Å; V337-Q341 WeakPolarHBondContact O-CG 3.39Å; V337-Q341 PolarHBondContact O-N 2.84Å; R338-Q341 PolarHBondContact O-N 3.36Å; Q341-G343 VanDerWaalsContact C-N 3.26Å; Q341-G343 PolarHBondContact O-N 2.92Å; Q341-Q344 PolarHBondContact O-N 3.42Å; Q341-Q344 VanDerWaalsContact O-N 3.14Å; Q341-M345 WeakPolarHBondContact O-CG 3.39Å; Q341-M345 PolarHBondContact O-N 3.22Å
342K86.5Confident88.2Confident118 Ų11882.6 Ų82.651%0.51340%0.398SS..Hα-helixtrans-56.6-40.8174.9-75.5179.81791800111.9R338 K339 K346R338-K342 WeakPolarHBondContact O-CG 3.5Å; R338-K342 PolarHBondContact O-N 3.33Å; K339-K342 PolarHBondContact O-N 3.41Å; K342-K346 WeakPolarHBondContact O-CG 3.49Å; K342-K346 PolarHBondContact O-N 2.96Å
343G86Confident88.9Confident38 Ų3882.1 Ų82.139%0.39239%0.388SS..Hα-helixtrans-63.2-45174.800000113.2K339 R340 Q341 K346 A347K339-G343 PolarHBondContact O-N 3.48Å; R340-G343 PolarHBondContact O-N 3.23Å; Q341-G343 VanDerWaalsContact C-N 3.26Å; Q341-G343 PolarHBondContact O-N 2.92Å; G343-K346 PolarHBondContact O-N 3.3Å; G343-A347 PolarHBondContact O-N 2.87Å
344Q88Confident89.5Confident68 Ų6875.3 Ų75.332%0.31836%0.356SS..Hα-helixtrans-64-42.3176.6-65.6-54.8-32.900111.8V204 R340 Q341 K346 A347 T348V204-Q344 HydrophobicContact CG1-CG 4.49Å; R340-Q344 WeakPolarHBondContact O-CG 3.47Å; R340-Q344 PolarHBondContact O-N 3.38Å; Q341-Q344 PolarHBondContact O-N 3.42Å; Q341-Q344 VanDerWaalsContact O-N 3.14Å; Q344-K346 VanDerWaalsContact C-N 3.27Å; Q344-K346 PolarHBondContact O-N 2.95Å; Q344-A347 PolarHBondContact O-N 3.47Å; Q344-A347 VanDerWaalsContact O-N 3.1Å; Q344-T348 PolarHBondContact O-N 3.02Å; Q344-T348 PolarHBondContact O-OG1 3.44Å; Q344-T348 VanDerWaalsContact O-OG1 3.07Å
345M90.1Very high90.2Very high68 Ų6867.7 Ų67.734%0.33533%0.327SS..Hα-helixtrans-61.7-32.3177.4-71.7-60.2-70.100113.3L304 W307 Q341 R349L304-M345 HydrophobicContact CD2-CE 3.82Å; L304-M345 HydrophobicContact CD2-SD 3.59Å; L304-M345 VanDerWaalsContact CD2-SD 3.59Å; W307-M345 HydrophobicContact CE3-SD 4.03Å; W307-M345 HydrophobicContact CZ3-SD 3.85Å; Q341-M345 WeakPolarHBondContact O-CG 3.39Å; Q341-M345 PolarHBondContact O-N 3.22Å; M345-R349 WeakPolarHBondContact O-CG 3.35Å; M345-R349 PolarHBondContact O-N 2.87Å; M345-R349 PolarHBondContact O-NE 3.32Å
346K91.2Very high90.7Very high96 Ų9668 Ų6842%0.41733%0.328SS..Hα-helixtrans-66.5-47.6172-73.6178.3178.2-173.10111.3K342 G343 Q344 T348 R349 V350K342-K346 WeakPolarHBondContact O-CG 3.49Å; K342-K346 PolarHBondContact O-N 2.96Å; G343-K346 PolarHBondContact O-N 3.3Å; Q344-K346 VanDerWaalsContact C-N 3.27Å; Q344-K346 PolarHBondContact O-N 2.95Å; K346-T348 PolarHBondContact O-N 2.98Å; K346-R349 PolarHBondContact O-N 3.12Å; K346-V350 WeakPolarHBondContact O-CG2 3.29Å; K346-V350 PolarHBondContact O-N 2.96Å
347A92.3Very high91.2Very high11 Ų1166 Ų669%0.09131%0.311CS..Hα-helixtrans-64.2-39.517900000112.5F120 G343 Q344 R349 V350 V351F120-A347 HydrophobicContact CD1-CB 4.17Å; F120-A347 HydrophobicContact CE1-CB 3.86Å; F120-A347 HydrophobicContact CZ-CB 4.14Å; G343-A347 PolarHBondContact O-N 2.87Å; Q344-A347 PolarHBondContact O-N 3.47Å; Q344-A347 VanDerWaalsContact O-N 3.1Å; A347-R349 VanDerWaalsContact C-N 3.34Å; A347-R349 PolarHBondContact O-N 3.5Å; A347-V350 PolarHBondContact O-N 3.05Å; A347-V351 PolarHBondContact O-N 3.09Å; A347-V351 VanDerWaalsContact O-N 3.14Å
348T94.5Very high91.7Very high3 Ų362.6 Ų62.62%0.01829%0.291CS..Hα-helixtrans-63-39.8175.6-55.60000111.8V205 I300 L304 Q344 K346 V350 V351 L352V205-T348 HydrophobicContact CG2-CG2 4.05Å; I300-T348 HydrophobicContact CG2-CG2 3.49Å; I300-T348 VanDerWaalsContact CG2-CG2 3.49Å; L304-T348 HydrophobicContact CD1-CG2 3.92Å; Q344-T348 PolarHBondContact O-N 3.02Å; Q344-T348 PolarHBondContact O-OG1 3.44Å; Q344-T348 VanDerWaalsContact O-OG1 3.07Å; K346-T348 PolarHBondContact O-N 2.98Å; T348-V350 PolarHBondContact O-N 2.7Å; T348-V351 PolarHBondContact O-N 3.29Å; T348-L352 HydrophobicContact CG2-CD1 4.18Å; T348-L352 HydrophobicContact CG2-CG 4.35Å; T348-L352 WeakPolarHBondContact O-CB 3.42Å; T348-L352 VanDerWaalsContact O-CG 3.32Å; T348-L352 WeakPolarHBondContact O-CG 3.15Å; T348-L352 PolarHBondContact O-N 3.44Å
349R95.4Very high92.1Very high130 Ų13056.8 Ų56.849%0.49127%0.274SS..Hα-helixtrans-61.1-42.4174.9-79.4-175.5-73.7170.1-6.7112.9M345 K346 A347 L352 M353M345-R349 WeakPolarHBondContact O-CG 3.35Å; M345-R349 PolarHBondContact O-N 2.87Å; M345-R349 PolarHBondContact O-NE 3.32Å; K346-R349 PolarHBondContact O-N 3.12Å; A347-R349 VanDerWaalsContact C-N 3.34Å; A347-R349 PolarHBondContact O-N 3.5Å; R349-L352 PolarHBondContact O-N 3.49Å; R349-M353 WeakPolarHBondContact O-CG 3.19Å; R349-M353 PolarHBondContact O-N 3.2Å
350V95.8Very high92.5Very high1 Ų155.3 Ų55.31%0.00627%0.273CS..Hα-helixtrans-57.8-50.9175.6173.40000110.2F120 K346 A347 T348 L352 M353 V354 V404 F405 L408 M409F120-V350 HydrophobicContact CZ-CB 4.25Å; F120-V350 HydrophobicContact CZ-CG1 4.07Å; K346-V350 WeakPolarHBondContact O-CG2 3.29Å; K346-V350 PolarHBondContact O-N 2.96Å; A347-V350 PolarHBondContact O-N 3.05Å; T348-V350 PolarHBondContact O-N 2.7Å; V350-L352 PolarHBondContact O-N 2.88Å; V350-M353 PolarHBondContact O-N 2.91Å; V350-M353 VanDerWaalsContact O-N 3.16Å; V350-V354 HydrophobicContact CG1-CG2 4.46Å; V350-V354 WeakPolarHBondContact O-CG2 3.33Å; V350-V354 PolarHBondContact O-N 3.45Å; V350-V404 HydrophobicContact CG1-CG1 4.1Å; V350-F405 HydrophobicContact CG1-CD1 4.23Å; V350-F405 HydrophobicContact CG1-CE1 4.3Å; V350-L408 HydrophobicContact CG2-CB 3.68Å; V350-L408 HydrophobicContact CG2-CD1 4.42Å; V350-M409 HydrophobicContact CG1-CG 4.34Å; V350-M409 HydrophobicContact CG1-SD 4.12Å; V350-M409 HydrophobicContact CG2-CG 3.52Å; V350-M409 HydrophobicContact CG2-SD 4.31Å
351V95.7Very high93Very high2 Ų250.4 Ų50.41%0.01226%0.257CS..Hα-helixtrans-66.9-37-177.5174.10000112.6F120 I197 T198 R201 A347 T348 M353 V354 A355F120-V351 HydrophobicContact CE2-CG2 3.51Å; F120-V351 HydrophobicContact CZ-CG2 4.08Å; I197-V351 HydrophobicContact CG2-CB 4.28Å; I197-V351 HydrophobicContact CG2-CG1 3.87Å; I197-V351 HydrophobicContact CG2-CG2 3.43Å; I197-V351 VanDerWaalsContact CG2-CG2 3.43Å; T198-V351 HydrophobicContact CG2-CG1 4.38Å; R201-V351 HydrophobicContact CB-CG1 4.18Å; R201-V351 HydrophobicContact CG-CB 3.8Å; R201-V351 HydrophobicContact CG-CG1 3.81Å; R201-V351 HydrophobicContact CG-CG2 3.57Å; A347-V351 PolarHBondContact O-N 3.09Å; A347-V351 VanDerWaalsContact O-N 3.14Å; T348-V351 PolarHBondContact O-N 3.29Å; V351-M353 VanDerWaalsContact C-N 3.32Å; V351-M353 PolarHBondContact O-N 3.45Å; V351-V354 PolarHBondContact O-N 2.93Å; V351-A355 VanDerWaalsContact O-CB 3.24Å; V351-A355 WeakPolarHBondContact O-CB 3.49Å; V351-A355 PolarHBondContact O-N 3.42Å
352L96.5Very high93.4Very high25 Ų2545.8 Ų45.813%0.13124%0.235CC..Hα-helixtrans-60.7-42.4172.5-73174.6000111.4T297 I300 I301 L304 T348 R349 V350 A355 L356T297-L352 HydrophobicContact CG2-CD2 3.79Å; I300-L352 HydrophobicContact CB-CD2 4.28Å; I300-L352 HydrophobicContact CG2-CD1 4.18Å; I300-L352 HydrophobicContact CG2-CD2 3.83Å; I300-L352 HydrophobicContact CG2-CG 4.19Å; I301-L352 HydrophobicContact CD1-CD2 4.48Å; I301-L352 HydrophobicContact CG1-CD2 4.09Å; L304-L352 HydrophobicContact CD1-CD1 4.16Å; T348-L352 HydrophobicContact CG2-CD1 4.18Å; T348-L352 HydrophobicContact CG2-CG 4.35Å; T348-L352 WeakPolarHBondContact O-CB 3.42Å; T348-L352 VanDerWaalsContact O-CG 3.32Å; T348-L352 WeakPolarHBondContact O-CG 3.15Å; T348-L352 PolarHBondContact O-N 3.44Å; R349-L352 PolarHBondContact O-N 3.49Å; V350-L352 PolarHBondContact O-N 2.88Å; L352-A355 PolarHBondContact O-N 2.94Å; L352-L356 VanDerWaalsContact O-CB 3.31Å; L352-L356 WeakPolarHBondContact O-CB 3.37Å; L352-L356 WeakPolarHBondContact O-CG 3.34Å; L352-L356 PolarHBondContact O-N 3.19Å
353M97.1Very high93.6Very high94 Ų9442 Ų4246%0.46322%0.224SC..Hα-helixtrans-68.7-40.6178.1-67.5-54.5170.400112.8R349 V350 V351 L356 A357 V404 L408R349-M353 WeakPolarHBondContact O-CG 3.19Å; R349-M353 PolarHBondContact O-N 3.2Å; V350-M353 PolarHBondContact O-N 2.91Å; V350-M353 VanDerWaalsContact O-N 3.16Å; V351-M353 VanDerWaalsContact C-N 3.32Å; V351-M353 PolarHBondContact O-N 3.45Å; M353-L356 PolarHBondContact O-N 2.8Å; M353-L356 HydrophobicContact SD-CD1 4.23Å; M353-A357 WeakPolarHBondContact O-CB 3.32Å; M353-A357 PolarHBondContact O-N 2.9Å; M353-V404 HydrophobicContact CB-CG1 3.96Å; M353-V404 HydrophobicContact CB-CG2 4.08Å; M353-L408 HydrophobicContact CB-CD1 4.1Å; M353-L408 HydrophobicContact CG-CD1 3.64Å
354V96Very high93.9Very high5 Ų543.2 Ų43.23%0.0322%0.22CC..Hα-helixtrans-60.9-46.2173.3173.10000110.7L127 V194 V350 V351 L356 A357 F358 V404 F405L127-V354 HydrophobicContact CD2-CG1 4.46Å; V194-V354 HydrophobicContact CG1-CG1 4.17Å; V194-V354 HydrophobicContact CG2-CG1 4.27Å; V350-V354 HydrophobicContact CG1-CG2 4.46Å; V350-V354 WeakPolarHBondContact O-CG2 3.33Å; V350-V354 PolarHBondContact O-N 3.45Å; V351-V354 PolarHBondContact O-N 2.93Å; V354-L356 PolarHBondContact O-N 3.3Å; V354-A357 PolarHBondContact O-N 2.88Å; V354-F358 VanDerWaalsContact O-CB 3.3Å; V354-F358 WeakPolarHBondContact O-CB 3.28Å; V354-F358 PolarHBondContact O-N 2.65Å; V354-V404 HydrophobicContact CG2-CG1 3.99Å; V354-F405 HydrophobicContact CG2-CE1 4.29Å
355A96Very high94Very high4 Ų440.3 Ų40.33%0.03321%0.206CC..Hα-helixtrans-66.5-35.9179.600000112.9I293 T297 V351 L352 G359I293-A355 HydrophobicContact CG2-CB 3.83Å; T297-A355 WeakPolarHBondContact OG1-CB 3.47Å; V351-A355 VanDerWaalsContact O-CB 3.24Å; V351-A355 WeakPolarHBondContact O-CB 3.49Å; V351-A355 PolarHBondContact O-N 3.42Å; L352-A355 PolarHBondContact O-N 2.94Å; A355-G359 PolarHBondContact O-N 2.87Å
356L95.8Very high93.9Very high82 Ų8238.5 Ų38.543%0.42920%0.196SC..Hα-helixtrans-70-43.6175.3-73.4170.6000111.8L352 M353 V354 G359 L360L352-L356 VanDerWaalsContact O-CB 3.31Å; L352-L356 WeakPolarHBondContact O-CB 3.37Å; L352-L356 WeakPolarHBondContact O-CG 3.34Å; L352-L356 PolarHBondContact O-N 3.19Å; M353-L356 PolarHBondContact O-N 2.8Å; M353-L356 HydrophobicContact SD-CD1 4.23Å; V354-L356 PolarHBondContact O-N 3.3Å; L356-G359 PolarHBondContact O-N 3.48Å; L356-L360 WeakPolarHBondContact O-CB 3.46Å; L356-L360 VanDerWaalsContact O-CG 3.29Å; L356-L360 WeakPolarHBondContact O-CG 3.27Å; L356-L360 PolarHBondContact O-N 2.96Å
357A95.4Very high93.9Very high18 Ų1839 Ų3915%0.14920%0.202CC..Hα-helixtrans-59.3-49.9174.900000110.5M353 V354 G359 L360 L361 D397 C400M353-A357 WeakPolarHBondContact O-CB 3.32Å; M353-A357 PolarHBondContact O-N 2.9Å; V354-A357 PolarHBondContact O-N 2.88Å; A357-G359 PolarHBondContact O-N 3.3Å; A357-L360 PolarHBondContact O-N 3.4Å; A357-L361 WeakPolarHBondContact O-CB 3.26Å; A357-L361 WeakPolarHBondContact O-CG 3.25Å; A357-L361 PolarHBondContact O-N 3.31Å; A357-D397 WeakPolarHBondContact CB-OD1 3.47Å; A357-C400 HydrophobicContact CB-CB 4.39Å
358F94.2Very high93.8Very high3 Ų339.1 Ų39.11%0.01320%0.201CC..Hα-helixtrans-54.5-53174.2-179.7-85.5000110.9N191 V194 I293 V354 L360 L361 E362 D397N191-F358 HydrophobicContact CB-CE2 4.1Å; N191-F358 HydrophobicContact CB-CZ 4.16Å; N191-F358 WeakPolarHBondContact OD1-CE2 3.27Å; V194-F358 HydrophobicContact CB-CD2 4.49Å; V194-F358 HydrophobicContact CG1-CB 4.4Å; V194-F358 HydrophobicContact CG1-CD2 4.36Å; V194-F358 HydrophobicContact CG1-CG 4.28Å; V194-F358 HydrophobicContact CG2-CD2 4.38Å; I293-F358 HydrophobicContact CD1-CD1 3.56Å; I293-F358 HydrophobicContact CD1-CE1 3.32Å; I293-F358 HydrophobicContact CD1-CE2 4.38Å; I293-F358 HydrophobicContact CD1-CG 4.21Å; I293-F358 HydrophobicContact CD1-CZ 3.78Å; I293-F358 HydrophobicContact CG2-CD1 4.41Å; V354-F358 VanDerWaalsContact O-CB 3.3Å; V354-F358 WeakPolarHBondContact O-CB 3.28Å; V354-F358 PolarHBondContact O-N 2.65Å; F358-L360 VanDerWaalsContact C-N 3.33Å; F358-L360 PolarHBondContact O-N 3.04Å; F358-L361 PolarHBondContact O-N 3.47Å; F358-E362 HydrophobicContact CD1-CG 4.32Å; F358-E362 HydrophobicContact CD2-CG 3.76Å; F358-E362 HydrophobicContact CE1-CB 4.41Å; F358-E362 HydrophobicContact CE1-CG 4.27Å; F358-E362 HydrophobicContact CE2-CG 3.73Å; F358-E362 HydrophobicContact CG-CG 4.07Å; F358-E362 HydrophobicContact CZ-CB 4.46Å; F358-E362 HydrophobicContact CZ-CG 3.99Å; F358-E362 WeakPolarHBondContact O-CB 3.31Å; F358-E362 VanDerWaalsContact O-CG 3.27Å; F358-E362 WeakPolarHBondContact O-CG 3.4Å; F358-E362 PolarHBondContact O-N 3.25Å; F358-D397 WeakPolarHBondContact CA-OD1 3.49Å; F358-D397 PolarHBondContact N-OD1 3.04Å; F358-D397 VanDerWaalsContact N-OD1 3.08Å
359G92.4Very high93.5Very high16 Ų1639.7 Ų39.717%0.16521%0.205CC..Hα-helixtrans-59.7-40.1-177.600000113.4A355 L356 A357 C363A355-G359 PolarHBondContact O-N 2.87Å; L356-G359 PolarHBondContact O-N 3.48Å; A357-G359 PolarHBondContact O-N 3.3Å; G359-C363 WeakPolarHBondContact O-CB 3.46Å; G359-C363 PolarHBondContact O-N 2.8Å
360L94.5Very high93.3Very high136 Ų13635.7 Ų35.771%0.71219%0.193SC*.Hα-helixtrans-76.4-45.3-179.1-70.6170.4000112.5L356 A357 F358L356-L360 WeakPolarHBondContact O-CB 3.46Å; L356-L360 VanDerWaalsContact O-CG 3.29Å; L356-L360 WeakPolarHBondContact O-CG 3.27Å; L356-L360 PolarHBondContact O-N 2.96Å; A357-L360 PolarHBondContact O-N 3.4Å; F358-L360 VanDerWaalsContact C-N 3.33Å; F358-L360 PolarHBondContact O-N 3.04Å
361L94.8Very high93Very high32 Ų3237.7 Ų37.717%0.16821%0.206CC..Hα-helixtrans-81.6-34.4-172.8-65.1169.6000112.3A357 F358 L393 I396 D397A357-L361 WeakPolarHBondContact O-CB 3.26Å; A357-L361 WeakPolarHBondContact O-CG 3.25Å; A357-L361 PolarHBondContact O-N 3.31Å; F358-L361 PolarHBondContact O-N 3.47Å; L361-L393 HydrophobicContact CD2-CD2 3.97Å; L361-I396 HydrophobicContact CD1-CG2 4.2Å; L361-I396 HydrophobicContact CD2-CG2 4.43Å; L361-D397 HydrophobicContact CB-CB 3.92Å; L361-D397 VanDerWaalsContact CD1-CA 3.41Å; L361-D397 HydrophobicContact CD1-CB 3.64Å; L361-D397 HydrophobicContact CG-CB 4.42Å
362E93.2Very high92.6Very high11 Ų1139.9 Ų39.95%0.05122%0.216CC..Hα-helixtrans-80.6-25.1178-64.7-76.8162.700113R190 F358 M364 N365 F366 I394R190-E362 IonicContact CZ-OE1 3.7Å; R190-E362 IonicContact NH2-OE1 3.72Å; R190-E362 PolarHBondContact NH2-OE1 3.46Å; F358-E362 HydrophobicContact CD1-CG 4.32Å; F358-E362 HydrophobicContact CD2-CG 3.76Å; F358-E362 HydrophobicContact CE1-CB 4.41Å; F358-E362 HydrophobicContact CE1-CG 4.27Å; F358-E362 HydrophobicContact CE2-CG 3.73Å; F358-E362 HydrophobicContact CG-CG 4.07Å; F358-E362 HydrophobicContact CZ-CB 4.46Å; F358-E362 HydrophobicContact CZ-CG 3.99Å; F358-E362 WeakPolarHBondContact O-CB 3.31Å; F358-E362 VanDerWaalsContact O-CG 3.27Å; F358-E362 WeakPolarHBondContact O-CG 3.4Å; F358-E362 PolarHBondContact O-N 3.25Å; E362-M364 PolarHBondContact O-N 2.82Å; E362-N365 PolarHBondContact O-N 2.99Å; E362-N365 VanDerWaalsContact O-N 3.08Å; E362-F366 PolarHBondContact O-N 2.99Å; E362-I394 WeakPolarHBondContact OE1-CG1 3.34Å; E362-I394 WeakPolarHBondContact OE2-CG1 3.29Å
363C91.7Very high92.1Very high40 Ų4040.6 Ų40.627%0.2722%0.221SC..Hα-helixtrans-54.9-40.2-179.3178.10000111.5G359 F366 M367G359-C363 WeakPolarHBondContact O-CB 3.46Å; G359-C363 PolarHBondContact O-N 2.8Å; C363-F366 WeakPolarHBondContact O-CB 3.3Å; C363-F366 PolarHBondContact O-N 3.5Å; C363-M367 VanDerWaalsContact O-CG 3.29Å; C363-M367 WeakPolarHBondContact O-CG 3.48Å; C363-M367 PolarHBondContact O-N 3.11Å
364M90.7Very high91.6Very high63 Ų6342.8 Ų42.831%0.3123%0.229SC..Hα-helixtrans-66.1-43.4178.9-153.7-171.180.200112E362 F366 M367 I368 I389 L393E362-M364 PolarHBondContact O-N 2.82Å; M364-F366 VanDerWaalsContact C-N 3.28Å; M364-F366 PolarHBondContact O-N 3.12Å; M364-M367 PolarHBondContact O-N 2.94Å; M364-I368 HydrophobicContact CE-CD1 3.57Å; M364-I368 HydrophobicContact CG-CD1 4.1Å; M364-I368 WeakPolarHBondContact O-CB 3.42Å; M364-I368 WeakPolarHBondContact O-CD1 3.46Å; M364-I368 WeakPolarHBondContact O-CG1 3.47Å; M364-I368 PolarHBondContact O-N 3.39Å; M364-I389 HydrophobicContact CE-CB 3.89Å; M364-I389 HydrophobicContact CE-CG2 3.39Å; M364-I389 HydrophobicContact SD-CG2 4.42Å; M364-L393 HydrophobicContact CB-CD1 3.76Å; M364-L393 HydrophobicContact CE-CD1 3.41Å; M364-L393 VanDerWaalsContact CE-CD1 3.41Å; M364-L393 HydrophobicContact CE-CG 4.31Å; M364-L393 HydrophobicContact CG-CD1 4.27Å; M364-L393 HydrophobicContact SD-CD1 3.53Å; M364-L393 VanDerWaalsContact SD-CD1 3.53Å
365N90Very high91Very high7 Ų749.3 Ų49.34%0.03726%0.263CS..Hα-helixtrans-62.8-39.3176.8-163.1-69.6000111.3R285 E362 I368 S369 G390 N391 I394R285-N365 PolarHBondContact NH2-OD1 3.2Å; E362-N365 PolarHBondContact O-N 2.99Å; E362-N365 VanDerWaalsContact O-N 3.08Å; N365-I368 PolarHBondContact O-N 3.5Å; N365-S369 WeakPolarHBondContact O-CB 3.42Å; N365-S369 PolarHBondContact O-N 3.39Å; N365-S369 PolarHBondContact O-OG 2.88Å; N365-S369 PolarHBondContact OD1-OG 3.11Å; N365-G390 PolarHBondContact ND2-O 3.26Å; N365-N391 PolarHBondContact ND2-N 2.96Å; N365-N391 PolarHBondContact ND2-OD1 3.16Å; N365-N391 VanDerWaalsContact ND2-OD1 3.09Å; N365-I394 HydrophobicContact CB-CD1 4.05Å; N365-I394 HydrophobicContact CB-CG1 4.21Å; N365-I394 WeakPolarHBondContact ND2-CD1 3.28Å
366F88.4Confident90.7Very high29 Ų2955 Ų5513%0.12729%0.293CS..Hα-helixtrans-59.5-50.3174.3172.5-119.7000112.1L282 A286 V287 E362 C363 M364 I368 S369 I370L282-F366 HydrophobicContact CD1-CD2 4.4Å; A286-F366 HydrophobicContact CB-CD2 3.77Å; A286-F366 HydrophobicContact CB-CE2 4.5Å; V287-F366 HydrophobicContact CB-CE2 4.29Å; V287-F366 HydrophobicContact CG2-CD2 4.45Å; V287-F366 HydrophobicContact CG2-CE2 3.43Å; V287-F366 VanDerWaalsContact CG2-CE2 3.43Å; V287-F366 HydrophobicContact CG2-CZ 3.97Å; E362-F366 PolarHBondContact O-N 2.99Å; C363-F366 WeakPolarHBondContact O-CB 3.3Å; C363-F366 PolarHBondContact O-N 3.5Å; M364-F366 VanDerWaalsContact C-N 3.28Å; M364-F366 PolarHBondContact O-N 3.12Å; F366-I368 PolarHBondContact O-N 3.36Å; F366-S369 PolarHBondContact O-N 3.14Å; F366-I370 HydrophobicContact CD1-CD1 4.32Å; F366-I370 HydrophobicContact CD2-CD1 4.16Å; F366-I370 HydrophobicContact CD2-CG1 4.48Å; F366-I370 HydrophobicContact CE1-CD1 3.71Å; F366-I370 HydrophobicContact CE2-CD1 3.48Å; F366-I370 VanDerWaalsContact CE2-CD1 3.48Å; F366-I370 HydrophobicContact CE2-CG1 4.02Å; F366-I370 HydrophobicContact CZ-CD1 3.27Å; F366-I370 HydrophobicContact CZ-CG1 4.3Å; F366-I370 PolarHBondContact O-N 3.35Å
367M91.7Very high90.2Very high108 Ų10852.6 Ų52.653%0.53228%0.28SS..Hα-helixtrans-63.1-41.8178.2-66.1-60.1-119.100112.2C363 M364 S369 I370 C371C363-M367 VanDerWaalsContact O-CG 3.29Å; C363-M367 WeakPolarHBondContact O-CG 3.48Å; C363-M367 PolarHBondContact O-N 3.11Å; M364-M367 PolarHBondContact O-N 2.94Å; M367-S369 VanDerWaalsContact C-N 3.33Å; M367-S369 PolarHBondContact O-N 3.14Å; M367-I370 PolarHBondContact O-N 3.48Å; M367-C371 PolarHBondContact O-N 3.34Å; M367-C371 PolarHBondContact O-SG 3.24Å
368I91.2Very high89.5Confident13 Ų1355.5 Ų55.57%0.06731%0.312CS..Hα-helixtrans-60.9-45.1175.8-67.9160.3000110.5M364 N365 F366 I370 C371 Q372 L386M364-I368 HydrophobicContact CE-CD1 3.57Å; M364-I368 HydrophobicContact CG-CD1 4.1Å; M364-I368 WeakPolarHBondContact O-CB 3.42Å; M364-I368 WeakPolarHBondContact O-CD1 3.46Å; M364-I368 WeakPolarHBondContact O-CG1 3.47Å; M364-I368 PolarHBondContact O-N 3.39Å; N365-I368 PolarHBondContact O-N 3.5Å; F366-I368 PolarHBondContact O-N 3.36Å; I368-I370 VanDerWaalsContact C-N 3.32Å; I368-I370 PolarHBondContact O-N 2.97Å; I368-C371 PolarHBondContact O-N 2.81Å; I368-Q372 HydrophobicContact CG2-CG 4.25Å; I368-Q372 WeakPolarHBondContact O-CB 3.35Å; I368-Q372 WeakPolarHBondContact O-CG 3.44Å; I368-Q372 PolarHBondContact O-N 2.95Å; I368-L386 HydrophobicContact CD1-CB 3.97Å; I368-L386 VanDerWaalsContact CD1-O 3.27Å; I368-L386 WeakPolarHBondContact CD1-O 3.41Å; I368-L386 HydrophobicContact CG1-CB 4.05Å; I368-L386 HydrophobicContact CG2-CB 4.09Å
369S88.3Confident89.1Confident14 Ų1459.7 Ų59.710%0.09833%0.334CS..Hα-helixtrans-61.8-39.9179.6-59.30000111.6N365 F366 M367 T373N365-S369 WeakPolarHBondContact O-CB 3.42Å; N365-S369 PolarHBondContact O-N 3.39Å; N365-S369 PolarHBondContact O-OG 2.88Å; N365-S369 PolarHBondContact OD1-OG 3.11Å; F366-S369 PolarHBondContact O-N 3.14Å; M367-S369 VanDerWaalsContact C-N 3.33Å; M367-S369 PolarHBondContact O-N 3.14Å; S369-T373 VanDerWaalsContact O-CB 3.28Å; S369-T373 WeakPolarHBondContact O-CB 3.38Å; S369-T373 PolarHBondContact O-N 3.41Å; S369-T373 PolarHBondContact O-OG1 3.32Å
370I89.2Confident88.7Confident47 Ų4763.9 Ų63.924%0.24135%0.353CS..Hα-helixtrans-61.3-52.5172.6-72.7173.7000110.3L282 F366 M367 I368 Q372 T373 F374L282-I370 HydrophobicContact CD2-CG1 4.17Å; F366-I370 HydrophobicContact CD1-CD1 4.32Å; F366-I370 HydrophobicContact CD2-CD1 4.16Å; F366-I370 HydrophobicContact CD2-CG1 4.48Å; F366-I370 HydrophobicContact CE1-CD1 3.71Å; F366-I370 HydrophobicContact CE2-CD1 3.48Å; F366-I370 VanDerWaalsContact CE2-CD1 3.48Å; F366-I370 HydrophobicContact CE2-CG1 4.02Å; F366-I370 HydrophobicContact CZ-CD1 3.27Å; F366-I370 HydrophobicContact CZ-CG1 4.3Å; F366-I370 PolarHBondContact O-N 3.35Å; M367-I370 PolarHBondContact O-N 3.48Å; I368-I370 VanDerWaalsContact C-N 3.32Å; I368-I370 PolarHBondContact O-N 2.97Å; I370-Q372 VanDerWaalsContact C-N 3.26Å; I370-Q372 PolarHBondContact O-N 3.3Å; I370-T373 PolarHBondContact O-N 3.43Å; I370-T373 VanDerWaalsContact O-N 3.12Å; I370-F374 HydrophobicContact CG2-CD2 3.71Å; I370-F374 HydrophobicContact CG2-CE2 3.92Å; I370-F374 VanDerWaalsContact O-CD2 3.26Å; I370-F374 WeakPolarHBondContact O-CD2 3.41Å; I370-F374 PolarHBondContact O-N 3Å
371C91.1Very high88.3Confident42 Ų4261.2 Ų61.228%0.28434%0.337SS..Hα-helixtrans-59.4-37-178.7-69.10000112.8M367 I368 N375 L376 L377M367-C371 PolarHBondContact O-N 3.34Å; M367-C371 PolarHBondContact O-SG 3.24Å; I368-C371 PolarHBondContact O-N 2.81Å; C371-N375 PolarHBondContact O-N 3.28Å; C371-L376 HydrophobicContact CB-CB 4.4Å; C371-L376 PolarHBondContact O-N 3.35Å; C371-L377 HydrophobicContact CB-CD1 3.64Å; C371-L377 HydrophobicContact CB-CG 4.01Å
372Q87.1Confident87.9Confident49 Ų4963.3 Ų63.323%0.22935%0.348CS..Hα-helixtrans-69.3-44.4175-73.3-178.4-32.500111.6I368 I370 F374 N375 L377 S383I368-Q372 HydrophobicContact CG2-CG 4.25Å; I368-Q372 WeakPolarHBondContact O-CB 3.35Å; I368-Q372 WeakPolarHBondContact O-CG 3.44Å; I368-Q372 PolarHBondContact O-N 2.95Å; I370-Q372 VanDerWaalsContact C-N 3.26Å; I370-Q372 PolarHBondContact O-N 3.3Å; Q372-F374 VanDerWaalsContact C-N 3.31Å; Q372-F374 PolarHBondContact O-N 3.01Å; Q372-N375 PolarHBondContact O-N 3.21Å; Q372-N375 VanDerWaalsContact O-N 3.12Å; Q372-N375 PolarHBondContact O-OD1 3.46Å; Q372-L377 HydrophobicContact CB-CD1 4.49Å; Q372-L377 HydrophobicContact CG-CD1 3.58Å; Q372-S383 WeakPolarHBondContact CG-OG 3.39Å; Q372-S383 PolarHBondContact NE2-O 3.37Å; Q372-S383 PolarHBondContact NE2-OG 3.3Å
373T84.9Confident87.7Confident39 Ų3963.8 Ų63.824%0.23935%0.352CS..Hα-helixtrans-62.1-39.1-178.9-59.70000111.9S278 S369 I370 N375S278-T373 WeakPolarHBondContact OG-CG2 3.43Å; S369-T373 VanDerWaalsContact O-CB 3.28Å; S369-T373 WeakPolarHBondContact O-CB 3.38Å; S369-T373 PolarHBondContact O-N 3.41Å; S369-T373 PolarHBondContact O-OG1 3.32Å; I370-T373 PolarHBondContact O-N 3.43Å; I370-T373 VanDerWaalsContact O-N 3.12Å; T373-N375 VanDerWaalsContact C-N 3.31Å; T373-N375 PolarHBondContact O-N 2.94Å
374F86.3Confident87.4Confident140 Ų14066.1 Ų66.161%0.61436%0.355SS*.THydrogen-bonded Turntrans-89.311.1178.1-68.4-71.8000113.8I370 Q372 L376I370-F374 HydrophobicContact CG2-CD2 3.71Å; I370-F374 HydrophobicContact CG2-CE2 3.92Å; I370-F374 VanDerWaalsContact O-CD2 3.26Å; I370-F374 WeakPolarHBondContact O-CD2 3.41Å; I370-F374 PolarHBondContact O-N 3Å; Q372-F374 VanDerWaalsContact C-N 3.31Å; Q372-F374 PolarHBondContact O-N 3.01Å; F374-L376 HydrophobicContact CB-CD1 4.24Å; F374-L376 HydrophobicContact CB-CD2 4.47Å; F374-L376 HydrophobicContact CB-CG 3.9Å; F374-L376 PolarHBondContact O-N 3.18Å; F374-L376 VanDerWaalsContact O-N 3.09Å
375N84.7Confident87.3Confident142 Ų14265.7 Ų65.776%0.75935%0.354SS*.THydrogen-bonded Turntrans50.931.8-177.9-69.4-29.3000114.1C371 Q372 T373 L377C371-N375 PolarHBondContact O-N 3.28Å; Q372-N375 PolarHBondContact O-N 3.21Å; Q372-N375 VanDerWaalsContact O-N 3.12Å; Q372-N375 PolarHBondContact O-OD1 3.46Å; T373-N375 VanDerWaalsContact C-N 3.31Å; T373-N375 PolarHBondContact O-N 2.94Å; N375-L377 PolarHBondContact O-N 3.07Å
376L89.4Confident87.4Confident124 Ų12467.5 Ų67.565%0.64936%0.364SS*.  trans-73.8-18.5178.3-60.8178000112.1C371 F374 G378C371-L376 HydrophobicContact CB-CB 4.4Å; C371-L376 PolarHBondContact O-N 3.35Å; F374-L376 HydrophobicContact CB-CD1 4.24Å; F374-L376 HydrophobicContact CB-CD2 4.47Å; F374-L376 HydrophobicContact CB-CG 3.9Å; F374-L376 PolarHBondContact O-N 3.18Å; F374-L376 VanDerWaalsContact O-N 3.09Å; L376-G378 PolarHBondContact O-N 2.85Å
377L85.6Confident87.5Confident31 Ų3168.8 Ų68.816%0.16237%0.37CS..  trans-9283.8177.2-69.8152.7000109.7C371 Q372 N375 N379 L382 L386C371-L377 HydrophobicContact CB-CD1 3.64Å; C371-L377 HydrophobicContact CB-CG 4.01Å; Q372-L377 HydrophobicContact CB-CD1 4.49Å; Q372-L377 HydrophobicContact CG-CD1 3.58Å; N375-L377 PolarHBondContact O-N 3.07Å; L377-N379 PolarHBondContact O-N 2.74Å; L377-N379 VanDerWaalsContact O-N 3.13Å; L377-L382 HydrophobicContact CD2-CD2 4.15Å; L377-L382 HydrophobicContact CD2-CG 4.26Å; L377-L386 HydrophobicContact CD1-CD1 4.46Å; L377-L386 HydrophobicContact CD2-CD1 3.54Å
378G80.3Confident87.4Confident80 Ų8064.2 Ų64.283%0.82535%0.348SS*.  trans-63.2-16.8-179.700000114.9L376L376-G378 PolarHBondContact O-N 2.85Å
379N85.9Confident87.5Confident90 Ų9067 Ų6748%0.48136%0.362SS..  trans-101.9111.4176.2-176.6-14.3000111.2L377 H381 L382 S383L377-N379 PolarHBondContact O-N 2.74Å; L377-N379 VanDerWaalsContact O-N 3.13Å; N379-H381 VanDerWaalsContact C-N 3.28Å; N379-H381 PolarHBondContact O-N 2.79Å; N379-H381 WeakPolarHBondContact OD1-CB 2.96Å; N379-H381 PolarHBondContact OD1-N 3.27Å; N379-L382 HydrophobicContact CB-CB 3.98Å; N379-L382 PolarHBondContact O-N 2.65Å; N379-L382 PolarHBondContact OD1-N 2.87Å; N379-S383 PolarHBondContact O-N 3.04Å
380N83.4Confident87.7Confident105 Ų10566.3 Ų66.356%0.56136%0.358SS*.Hα-helixtrans-57.2-37.1177.4-70-16.3000113.2I42 S383 R384I42-N380 HydrophobicContact CD1-CB 3.42Å; I42-N380 VanDerWaalsContact CD1-CB 3.42Å; N380-S383 PolarHBondContact O-N 3.15Å; N380-R384 WeakPolarHBondContact O-CG 3.02Å; N380-R384 PolarHBondContact O-N 2.99Å
381H85.6Confident87.9Confident79 Ų7966 Ų6637%0.36636%0.356SS..Hα-helixtrans-66.8-45.1177.9-178-84.7000111.5N379 S383 R384 L385N379-H381 VanDerWaalsContact C-N 3.28Å; N379-H381 PolarHBondContact O-N 2.79Å; N379-H381 WeakPolarHBondContact OD1-CB 2.96Å; N379-H381 PolarHBondContact OD1-N 3.27Å; H381-S383 VanDerWaalsContact C-N 3.33Å; H381-S383 PolarHBondContact O-N 3.31Å; H381-R384 PolarHBondContact O-N 2.94Å; H381-L385 WeakPolarHBondContact O-CB 3.05Å; H381-L385 PolarHBondContact O-N 2.87Å
382L88.3Confident88.1Confident77 Ų7764.9 Ų64.940%0.40335%0.348SS..Hα-helixtrans-62-43.5175.917962.5000111L377 N379 R384 L385 L386L377-L382 HydrophobicContact CD2-CD2 4.15Å; L377-L382 HydrophobicContact CD2-CG 4.26Å; N379-L382 HydrophobicContact CB-CB 3.98Å; N379-L382 PolarHBondContact O-N 2.65Å; N379-L382 PolarHBondContact OD1-N 2.87Å; L382-R384 VanDerWaalsContact C-N 3.34Å; L382-R384 PolarHBondContact O-N 2.86Å; L382-L385 PolarHBondContact O-N 3.27Å; L382-L386 HydrophobicContact CD1-CD1 4.24Å; L382-L386 HydrophobicContact CD1-CG 4.16Å; L382-L386 HydrophobicContact CG-CD1 4.07Å; L382-L386 HydrophobicContact CG-CG 4.41Å; L382-L386 WeakPolarHBondContact O-CB 3.42Å; L382-L386 WeakPolarHBondContact O-CG 3.33Å; L382-L386 PolarHBondContact O-N 2.95Å
383S87.9Confident88.5Confident20 Ų2064.3 Ų64.314%0.1435%0.347CS..Hα-helixtrans-55.7-47.5176.2-177.70000111.8Q372 N379 N380 H381 L386 E387Q372-S383 WeakPolarHBondContact CG-OG 3.39Å; Q372-S383 PolarHBondContact NE2-O 3.37Å; Q372-S383 PolarHBondContact NE2-OG 3.3Å; N379-S383 PolarHBondContact O-N 3.04Å; N380-S383 PolarHBondContact O-N 3.15Å; H381-S383 VanDerWaalsContact C-N 3.33Å; H381-S383 PolarHBondContact O-N 3.31Å; S383-L386 PolarHBondContact O-N 2.79Å; S383-E387 WeakPolarHBondContact O-CB 3.27Å; S383-E387 PolarHBondContact O-N 3.15Å
384R85.2Confident89Confident89 Ų8962.5 Ų62.534%0.33634%0.336SS..Hα-helixtrans-67.7-37.2177.7-69.6-59.9-169.3-1751113.8N380 H381 L382 E387 T388N380-R384 WeakPolarHBondContact O-CG 3.02Å; N380-R384 PolarHBondContact O-N 2.99Å; H381-R384 PolarHBondContact O-N 2.94Å; L382-R384 VanDerWaalsContact C-N 3.34Å; L382-R384 PolarHBondContact O-N 2.86Å; R384-E387 WeakPolarHBondContact CD-OE2 3.48Å; R384-E387 IonicContact CZ-OE2 2.56Å; R384-E387 IonicContact NH1-OE1 2.87Å; R384-E387 IonicContact NH1-OE2 2.74Å; R384-E387 PolarHBondContact NH1-OE2 2.89Å; R384-T388 PolarHBondContact O-N 3.28Å; R384-T388 PolarHBondContact O-OG1 3.36Å
385L89.2Confident89.5Confident54 Ų5455.9 Ų55.928%0.28331%0.306SS..Hα-helixtrans-63.3-49.4175.3179.562.6000110.3H381 L382 E387 T388 I389H381-L385 WeakPolarHBondContact O-CB 3.05Å; H381-L385 PolarHBondContact O-N 2.87Å; L382-L385 PolarHBondContact O-N 3.27Å; L385-E387 PolarHBondContact O-N 3.45Å; L385-T388 WeakPolarHBondContact O-CB 3.38Å; L385-T388 PolarHBondContact O-N 3.4Å; L385-T388 VanDerWaalsContact O-N 3.15Å; L385-I389 HydrophobicContact CD1-CD1 4.38Å; L385-I389 HydrophobicContact CG-CD1 4.09Å; L385-I389 WeakPolarHBondContact O-CG1 3.42Å; L385-I389 PolarHBondContact O-N 2.89Å
386L91.4Very high90.1Very high46 Ų4651.3 Ų51.324%0.24128%0.282CS..Hα-helixtrans-59.9-45.5177.3-72.7175.2000111.6I368 L377 L382 S383 T388 I389 G390I368-L386 HydrophobicContact CD1-CB 3.97Å; I368-L386 VanDerWaalsContact CD1-O 3.27Å; I368-L386 WeakPolarHBondContact CD1-O 3.41Å; I368-L386 HydrophobicContact CG1-CB 4.05Å; I368-L386 HydrophobicContact CG2-CB 4.09Å; L377-L386 HydrophobicContact CD1-CD1 4.46Å; L377-L386 HydrophobicContact CD2-CD1 3.54Å; L382-L386 HydrophobicContact CD1-CD1 4.24Å; L382-L386 HydrophobicContact CD1-CG 4.16Å; L382-L386 HydrophobicContact CG-CD1 4.07Å; L382-L386 HydrophobicContact CG-CG 4.41Å; L382-L386 WeakPolarHBondContact O-CB 3.42Å; L382-L386 WeakPolarHBondContact O-CG 3.33Å; L382-L386 PolarHBondContact O-N 2.95Å; S383-L386 PolarHBondContact O-N 2.79Å; L386-T388 VanDerWaalsContact C-N 3.26Å; L386-T388 PolarHBondContact O-N 3.12Å; L386-I389 PolarHBondContact O-N 3.09Å; L386-I389 VanDerWaalsContact O-N 3.15Å; L386-G390 PolarHBondContact O-N 3.43Å
387E90.1Very high90.4Very high55 Ų5545.5 Ų45.526%0.25725%0.251SS..Hα-helixtrans-53.8-44.6174.4-170.6-170.7160.300111.6S383 R384 L385 G390 N391S383-E387 WeakPolarHBondContact O-CB 3.27Å; S383-E387 PolarHBondContact O-N 3.15Å; R384-E387 WeakPolarHBondContact CD-OE2 3.48Å; R384-E387 IonicContact CZ-OE2 2.56Å; R384-E387 IonicContact NH1-OE1 2.87Å; R384-E387 IonicContact NH1-OE2 2.74Å; R384-E387 PolarHBondContact NH1-OE2 2.89Å; L385-E387 PolarHBondContact O-N 3.45Å; E387-G390 PolarHBondContact O-N 2.93Å; E387-N391 WeakPolarHBondContact O-CB 3.46Å; E387-N391 PolarHBondContact O-N 3.02Å; E387-N391 PolarHBondContact O-ND2 3.19Å
388T90.6Very high90.9Very high12 Ų1244 Ų447%0.07424%0.243CC..Hα-helixtrans-64-43.9178.2-580000111.8H48 Q49 R384 L385 L386 N391 T392H48-T388 WeakPolarHBondContact O-CG2 3.19Å; Q49-T388 VanDerWaalsContact NE2-CG2 3.28Å; Q49-T388 PolarHBondContact NE2-OG1 3.48Å; R384-T388 PolarHBondContact O-N 3.28Å; R384-T388 PolarHBondContact O-OG1 3.36Å; L385-T388 WeakPolarHBondContact O-CB 3.38Å; L385-T388 PolarHBondContact O-N 3.4Å; L385-T388 VanDerWaalsContact O-N 3.15Å; L386-T388 VanDerWaalsContact C-N 3.26Å; L386-T388 PolarHBondContact O-N 3.12Å; T388-N391 PolarHBondContact O-N 3.29Å; T388-T392 WeakPolarHBondContact O-CB 3.45Å; T388-T392 PolarHBondContact O-N 2.93Å; T388-T392 PolarHBondContact O-OG1 3.13Å
389I92.7Very high91.8Very high72 Ų7240.9 Ų40.937%0.36921%0.208SC..Hα-helixtrans-64.7-45.9176.8-58.6166.4000109.7M364 L385 L386 N391 T392 L393M364-I389 HydrophobicContact CE-CB 3.89Å; M364-I389 HydrophobicContact CE-CG2 3.39Å; M364-I389 HydrophobicContact SD-CG2 4.42Å; L385-I389 HydrophobicContact CD1-CD1 4.38Å; L385-I389 HydrophobicContact CG-CD1 4.09Å; L385-I389 WeakPolarHBondContact O-CG1 3.42Å; L385-I389 PolarHBondContact O-N 2.89Å; L386-I389 PolarHBondContact O-N 3.09Å; L386-I389 VanDerWaalsContact O-N 3.15Å; I389-N391 PolarHBondContact O-N 2.92Å; I389-T392 WeakPolarHBondContact O-CB 3.15Å; I389-T392 PolarHBondContact O-N 3.43Å; I389-T392 VanDerWaalsContact O-N 3.12Å; I389-L393 WeakPolarHBondContact O-CG 3.46Å; I389-L393 PolarHBondContact O-N 3.34Å
390G93.8Very high92.3Very high0 Ų038.4 Ų38.40%020%0.197CC..Hα-helixtrans-59-44.1177.900000112.5N365 L386 E387 T392 L393 I394N365-G390 PolarHBondContact ND2-O 3.26Å; L386-G390 PolarHBondContact O-N 3.43Å; E387-G390 PolarHBondContact O-N 2.93Å; G390-T392 VanDerWaalsContact C-N 3.32Å; G390-L393 PolarHBondContact O-N 3.05Å; G390-I394 WeakPolarHBondContact O-CG1 3.38Å; G390-I394 PolarHBondContact O-N 3.34Å
391N93.2Very high93Very high39 Ų3933.4 Ų33.421%0.20917%0.17CC..Hα-helixtrans-67.6-34.4176.5-69.5-20.7000111.7F52 N365 E387 T388 I389 L393 I394 T395F52-N391 HydrophobicContact CD2-CB 3.93Å; F52-N391 HydrophobicContact CE2-CB 3.59Å; F52-N391 WeakPolarHBondContact CE2-O 3.44Å; F52-N391 HydrophobicContact CZ-CB 4.44Å; N365-N391 PolarHBondContact ND2-N 2.96Å; N365-N391 PolarHBondContact ND2-OD1 3.16Å; N365-N391 VanDerWaalsContact ND2-OD1 3.09Å; E387-N391 WeakPolarHBondContact O-CB 3.46Å; E387-N391 PolarHBondContact O-N 3.02Å; E387-N391 PolarHBondContact O-ND2 3.19Å; T388-N391 PolarHBondContact O-N 3.29Å; I389-N391 PolarHBondContact O-N 2.92Å; N391-L393 VanDerWaalsContact C-N 3.34Å; N391-I394 PolarHBondContact O-N 2.97Å; N391-T395 PolarHBondContact O-N 2.84Å; N391-T395 PolarHBondContact O-OG1 3.46Å
392T95Very high93.5Very high19 Ų1930.4 Ų30.412%0.11716%0.156CC..Hα-helixtrans-63.5-40.7173.9-55.50000111.2F55 T388 I389 G390 T395 I396F55-T392 HydrophobicContact CD2-CG2 3.62Å; F55-T392 HydrophobicContact CE2-CG2 4.02Å; T388-T392 WeakPolarHBondContact O-CB 3.45Å; T388-T392 PolarHBondContact O-N 2.93Å; T388-T392 PolarHBondContact O-OG1 3.13Å; I389-T392 WeakPolarHBondContact O-CB 3.15Å; I389-T392 PolarHBondContact O-N 3.43Å; I389-T392 VanDerWaalsContact O-N 3.12Å; G390-T392 VanDerWaalsContact C-N 3.32Å; T392-T395 WeakPolarHBondContact O-CB 3.41Å; T392-T395 PolarHBondContact O-N 2.89Å; T392-T395 VanDerWaalsContact O-N 3.16Å; T392-I396 HydrophobicContact CG2-CD1 4.13Å; T392-I396 WeakPolarHBondContact O-CG1 3.32Å; T392-I396 PolarHBondContact O-N 3.13Å
393L96.1Very high93.9Very high38 Ų3832.3 Ų32.320%0.19916%0.162CC..Hα-helixtrans-64.5-39.9176.2-68.4179.6000113.3L361 M364 I389 G390 N391 T395 I396 D397L361-L393 HydrophobicContact CD2-CD2 3.97Å; M364-L393 HydrophobicContact CB-CD1 3.76Å; M364-L393 HydrophobicContact CE-CD1 3.41Å; M364-L393 VanDerWaalsContact CE-CD1 3.41Å; M364-L393 HydrophobicContact CE-CG 4.31Å; M364-L393 HydrophobicContact CG-CD1 4.27Å; M364-L393 HydrophobicContact SD-CD1 3.53Å; M364-L393 VanDerWaalsContact SD-CD1 3.53Å; I389-L393 WeakPolarHBondContact O-CG 3.46Å; I389-L393 PolarHBondContact O-N 3.34Å; G390-L393 PolarHBondContact O-N 3.05Å; N391-L393 VanDerWaalsContact C-N 3.34Å; L393-T395 PolarHBondContact O-N 2.71Å; L393-I396 HydrophobicContact CD2-CD1 4.3Å; L393-I396 PolarHBondContact O-N 3.33Å; L393-D397 PolarHBondContact O-N 3.34Å
394I95.4Very high94.4Very high1 Ų132.1 Ų32.11%0.00516%0.159CC..Hα-helixtrans-56.1-41.1172.7-65.6-173.6000110.5F134 L187 E362 N365 G390 N391 D397 S398F134-I394 HydrophobicContact CE1-CG2 3.74Å; F134-I394 HydrophobicContact CZ-CG2 3.62Å; L187-I394 HydrophobicContact CD1-CD1 4.45Å; L187-I394 HydrophobicContact CD1-CG2 3.68Å; L187-I394 HydrophobicContact CD2-CD1 4.44Å; E362-I394 WeakPolarHBondContact OE1-CG1 3.34Å; E362-I394 WeakPolarHBondContact OE2-CG1 3.29Å; N365-I394 HydrophobicContact CB-CD1 4.05Å; N365-I394 HydrophobicContact CB-CG1 4.21Å; N365-I394 WeakPolarHBondContact ND2-CD1 3.28Å; G390-I394 WeakPolarHBondContact O-CG1 3.38Å; G390-I394 PolarHBondContact O-N 3.34Å; N391-I394 PolarHBondContact O-N 2.97Å; I394-D397 WeakPolarHBondContact O-CB 3.27Å; I394-D397 PolarHBondContact O-N 2.89Å; I394-S398 PolarHBondContact O-N 3.42Å
395T96Very high94.9Very high0 Ų027.9 Ų27.90%014%0.143CC..Hα-helixtrans-70-39.6-179.5-51.40000111.6F52 F55 T56 N391 T392 L393 D397 S398 I399F52-T395 WeakPolarHBondContact CE2-OG1 3.39Å; F55-T395 HydrophobicContact CB-CG2 3.63Å; F55-T395 VanDerWaalsContact O-CG2 3.31Å; F55-T395 WeakPolarHBondContact O-CG2 3.37Å; T56-T395 VanDerWaalsContact CA-CG2 3.45Å; T56-T395 HydrophobicContact CG2-CG2 3.58Å; T56-T395 VanDerWaalsContact N-CG2 3.31Å; N391-T395 PolarHBondContact O-N 2.84Å; N391-T395 PolarHBondContact O-OG1 3.46Å; T392-T395 WeakPolarHBondContact O-CB 3.41Å; T392-T395 PolarHBondContact O-N 2.89Å; T392-T395 VanDerWaalsContact O-N 3.16Å; L393-T395 PolarHBondContact O-N 2.71Å; T395-D397 VanDerWaalsContact C-N 3.3Å; T395-D397 PolarHBondContact O-N 3.08Å; T395-S398 WeakPolarHBondContact O-CB 3.19Å; T395-S398 PolarHBondContact O-N 2.96Å; T395-I399 PolarHBondContact O-N 3.04Å; T395-I399 VanDerWaalsContact O-N 3.14Å
396I96.8Very high95.2Very high47 Ų4727.1 Ų27.124%0.24114%0.139CC..Hα-helixtrans-62.4-38.2173.2-68.5166000110.9F55 L361 T392 L393 S398 I399 C400F55-I396 HydrophobicContact CD1-CG1 4.13Å; F55-I396 HydrophobicContact CD2-CG1 4.49Å; F55-I396 HydrophobicContact CE1-CG1 4.17Å; F55-I396 HydrophobicContact CE2-CD1 4.33Å; F55-I396 HydrophobicContact CG-CG1 4.3Å; F55-I396 HydrophobicContact CZ-CD1 4.3Å; F55-I396 HydrophobicContact CZ-CG1 4.38Å; L361-I396 HydrophobicContact CD1-CG2 4.2Å; L361-I396 HydrophobicContact CD2-CG2 4.43Å; T392-I396 HydrophobicContact CG2-CD1 4.13Å; T392-I396 WeakPolarHBondContact O-CG1 3.32Å; T392-I396 PolarHBondContact O-N 3.13Å; L393-I396 HydrophobicContact CD2-CD1 4.3Å; L393-I396 PolarHBondContact O-N 3.33Å; I396-S398 VanDerWaalsContact C-N 3.27Å; I396-S398 PolarHBondContact O-N 2.95Å; I396-I399 WeakPolarHBondContact O-CB 3.34Å; I396-I399 PolarHBondContact O-N 3.13Å; I396-I399 VanDerWaalsContact O-N 3.13Å; I396-C400 PolarHBondContact O-N 3.38Å; I396-C400 PolarHBondContact O-SG 3.27Å
397D96.7Very high95.4Very high1 Ų128.4 Ų28.41%0.00515%0.152CC..Hα-helixtrans-58.5-42.3174.5-175.249.4000111.4R190 A357 F358 L361 L393 I394 T395 I399 C400 N401R190-D397 IonicContact CZ-OD2 3.62Å; R190-D397 IonicContact NH1-OD2 2.66Å; R190-D397 PolarHBondContact NH1-OD2 2.83Å; R190-D397 IonicContact NH2-OD2 3.82Å; A357-D397 WeakPolarHBondContact CB-OD1 3.47Å; F358-D397 WeakPolarHBondContact CA-OD1 3.49Å; F358-D397 PolarHBondContact N-OD1 3.04Å; F358-D397 VanDerWaalsContact N-OD1 3.08Å; L361-D397 HydrophobicContact CB-CB 3.92Å; L361-D397 VanDerWaalsContact CD1-CA 3.41Å; L361-D397 HydrophobicContact CD1-CB 3.64Å; L361-D397 HydrophobicContact CG-CB 4.42Å; L393-D397 PolarHBondContact O-N 3.34Å; I394-D397 WeakPolarHBondContact O-CB 3.27Å; I394-D397 PolarHBondContact O-N 2.89Å; T395-D397 VanDerWaalsContact C-N 3.3Å; T395-D397 PolarHBondContact O-N 3.08Å; D397-I399 VanDerWaalsContact C-N 3.31Å; D397-I399 PolarHBondContact O-N 3.41Å; D397-C400 WeakPolarHBondContact O-CB 3.33Å; D397-C400 PolarHBondContact O-N 3.31Å; D397-N401 PolarHBondContact O-N 3.08Å
398S96.3Very high95.6Very high0 Ų028.3 Ų28.30%015%0.153CC..Hα-helixtrans-64.7-34.6176.4-1650000113.5N63 E131 N135 I394 T395 I396N63-S398 PolarHBondContact ND2-O 3.49Å; N63-S398 PolarHBondContact ND2-OG 3.45Å; E131-S398 VanDerWaalsContact CD-OG 3.25Å; E131-S398 WeakPolarHBondContact CG-OG 3.46Å; E131-S398 WeakPolarHBondContact OE1-CA 3.39Å; E131-S398 WeakPolarHBondContact OE1-CB 3.26Å; E131-S398 PolarHBondContact OE1-OG 2.95Å; N135-S398 PolarHBondContact ND2-OG 2.9Å; I394-S398 PolarHBondContact O-N 3.42Å; T395-S398 WeakPolarHBondContact O-CB 3.19Å; T395-S398 PolarHBondContact O-N 2.96Å; I396-S398 VanDerWaalsContact C-N 3.27Å; I396-S398 PolarHBondContact O-N 2.95Å
399I97.9Very high95.8Very high15 Ų1528.4 Ų28.48%0.07715%0.153CC..Hα-helixtrans-68.7-40.9173.6-69.5168.3000111F55 I58 L62 T395 I396 D397 N401 F402 F403F55-I399 HydrophobicContact CB-CD1 4.24Å; F55-I399 HydrophobicContact CD1-CD1 3.61Å; F55-I399 HydrophobicContact CE1-CD1 4.48Å; F55-I399 HydrophobicContact CG-CD1 4.39Å; I58-I399 HydrophobicContact CB-CD1 4.11Å; I58-I399 HydrophobicContact CG2-CD1 3.83Å; I58-I399 HydrophobicContact CG2-CG1 4.16Å; L62-I399 HydrophobicContact CD1-CB 4.45Å; L62-I399 HydrophobicContact CD1-CG1 4.39Å; L62-I399 HydrophobicContact CD1-CG2 3.79Å; T395-I399 PolarHBondContact O-N 3.04Å; T395-I399 VanDerWaalsContact O-N 3.14Å; I396-I399 WeakPolarHBondContact O-CB 3.34Å; I396-I399 PolarHBondContact O-N 3.13Å; I396-I399 VanDerWaalsContact O-N 3.13Å; D397-I399 VanDerWaalsContact C-N 3.31Å; D397-I399 PolarHBondContact O-N 3.41Å; I399-N401 PolarHBondContact O-N 2.9Å; I399-F402 PolarHBondContact O-N 2.92Å; I399-F403 HydrophobicContact CG2-CD2 3.92Å; I399-F403 HydrophobicContact CG2-CE2 3.55Å; I399-F403 WeakPolarHBondContact O-CD2 3.35Å
400C97.6Very high95.7Very high38 Ų3827.3 Ų27.326%0.25715%0.152SC..Hα-helixtrans-56.6-34.7179.3-74.10000112.2A357 I396 D397 F402 F403 V404A357-C400 HydrophobicContact CB-CB 4.39Å; I396-C400 PolarHBondContact O-N 3.38Å; I396-C400 PolarHBondContact O-SG 3.27Å; D397-C400 WeakPolarHBondContact O-CB 3.33Å; D397-C400 PolarHBondContact O-N 3.31Å; C400-F402 VanDerWaalsContact C-N 3.35Å; C400-F402 PolarHBondContact O-N 2.87Å; C400-F403 PolarHBondContact O-N 2.87Å; C400-F403 VanDerWaalsContact O-N 3.09Å; C400-V404 WeakPolarHBondContact O-CG2 3.37Å; C400-V404 PolarHBondContact O-N 3.36Å
401N96.5Very high95.5Very high0 Ų029.5 Ų29.50%016%0.16CC..Hα-helixtrans-56.3-44.9178.3-74.6-28.5000112.8E131 D397 I399 F403 V404 F405E131-N401 PolarHBondContact OE1-ND2 3.31Å; D397-N401 PolarHBondContact O-N 3.08Å; I399-N401 PolarHBondContact O-N 2.9Å; N401-F403 VanDerWaalsContact C-N 3.34Å; N401-F403 PolarHBondContact O-N 2.85Å; N401-V404 PolarHBondContact O-N 3.42Å; N401-F405 HydrophobicContact CB-CE2 4.01Å; N401-F405 HydrophobicContact CB-CZ 3.94Å; N401-F405 WeakPolarHBondContact O-CD1 3.33Å; N401-F405 WeakPolarHBondContact O-CD2 3.28Å; N401-F405 WeakPolarHBondContact O-CG 3.36Å; N401-F405 PolarHBondContact O-N 3.45Å
402F97Very high95.5Very high16 Ų1627.6 Ų27.67%0.0715%0.15CC..Hα-helixtrans-57.7-46.7174.8175.6-91.5000111.7L62 I65 S66 I399 C400 V404 F405 I406 F412 F416L62-F402 HydrophobicContact CB-CB 3.98Å; L62-F402 HydrophobicContact CB-CD2 4.19Å; L62-F402 HydrophobicContact CB-CG 4.03Å; L62-F402 HydrophobicContact CD1-CB 4.38Å; L62-F402 HydrophobicContact CD1-CD1 4.36Å; L62-F402 HydrophobicContact CD1-CG 4.43Å; L62-F402 HydrophobicContact CD2-CD1 3.9Å; L62-F402 HydrophobicContact CD2-CD2 4.21Å; L62-F402 HydrophobicContact CD2-CE1 3.99Å; L62-F402 HydrophobicContact CD2-CE2 4.32Å; L62-F402 HydrophobicContact CD2-CG 4.03Å; L62-F402 HydrophobicContact CD2-CZ 4.21Å; L62-F402 HydrophobicContact CG-CG 4.39Å; I65-F402 HydrophobicContact CB-CE2 4.49Å; I65-F402 HydrophobicContact CG2-CE2 3.87Å; S66-F402 WeakPolarHBondContact OG-CD2 3.49Å; I399-F402 PolarHBondContact O-N 2.92Å; C400-F402 VanDerWaalsContact C-N 3.35Å; C400-F402 PolarHBondContact O-N 2.87Å; F402-V404 VanDerWaalsContact C-N 3.32Å; F402-V404 PolarHBondContact O-N 3.47Å; F402-F405 PolarHBondContact O-N 2.84Å; F402-F405 VanDerWaalsContact O-N 3.17Å; F402-I406 PolarHBondContact O-N 3.01Å; F402-F412 HydrophobicContact CD2-CE1 4.33Å; F402-F412 HydrophobicContact CD2-CZ 4.06Å; F402-F412 AromaticContact CE2-CE1 3.99Å; F402-F412 HydrophobicContact CE2-CE1 3.99Å; F402-F412 AromaticContact CE2-CZ 3.94Å; F402-F412 HydrophobicContact CE2-CZ 3.94Å; F402-F416 HydrophobicContact CE2-CE2 4.26Å; F402-F416 HydrophobicContact CZ-CD2 4.49Å; F402-F416 AromaticContact CZ-CE2 3.98Å; F402-F416 HydrophobicContact CZ-CE2 3.98Å; F402-F416 HydrophobicContact CZ-CZ 4.28Å
403F97.4Very high95.4Very high117 Ų11732.6 Ų32.651%0.51317%0.167SC..Hα-helixtrans-66.7-33.7179.5-70.3-67.1000112.7L62 I399 C400 N401 I406 S407L62-F403 HydrophobicContact CD1-CE2 4.36Å; I399-F403 HydrophobicContact CG2-CD2 3.92Å; I399-F403 HydrophobicContact CG2-CE2 3.55Å; I399-F403 WeakPolarHBondContact O-CD2 3.35Å; C400-F403 PolarHBondContact O-N 2.87Å; C400-F403 VanDerWaalsContact O-N 3.09Å; N401-F403 VanDerWaalsContact C-N 3.34Å; N401-F403 PolarHBondContact O-N 2.85Å; F403-I406 HydrophobicContact CD1-CG2 4.47Å; F403-I406 WeakPolarHBondContact O-CG2 3.48Å; F403-S407 VanDerWaalsContact O-CB 3.24Å; F403-S407 WeakPolarHBondContact O-CB 3.38Å; F403-S407 PolarHBondContact O-N 3.4Å; F403-S407 VanDerWaalsContact O-N 3.12Å; F403-S407 PolarHBondContact O-OG 2.04Å
404V97.1Very high95.2Very high16 Ų1633.2 Ų33.210%0.09717%0.17CC..Hα-helixtrans-65.4-42.6171.7172.40000110.6V350 M353 V354 C400 N401 F402 S407 L408V350-V404 HydrophobicContact CG1-CG1 4.1Å; M353-V404 HydrophobicContact CB-CG1 3.96Å; M353-V404 HydrophobicContact CB-CG2 4.08Å; V354-V404 HydrophobicContact CG2-CG1 3.99Å; C400-V404 WeakPolarHBondContact O-CG2 3.37Å; C400-V404 PolarHBondContact O-N 3.36Å; N401-V404 PolarHBondContact O-N 3.42Å; F402-V404 VanDerWaalsContact C-N 3.32Å; F402-V404 PolarHBondContact O-N 3.47Å; V404-S407 PolarHBondContact O-OG 2.93Å; V404-L408 HydrophobicContact CG1-CD1 4.08Å; V404-L408 WeakPolarHBondContact O-CB 3.45Å; V404-L408 PolarHBondContact O-N 3.03Å
405F96.6Very high95Very high0 Ų033.1 Ų33.10%017%0.169CC..Hα-helixtrans-66-47.5178.8-55.5-28.2000111.9F70 L124 L127 V350 V354 N401 F402 S407 M409 F412F70-F405 AromaticContact CE2-CD2 3.88Å; F70-F405 HydrophobicContact CE2-CD2 3.88Å; F70-F405 HydrophobicContact CE2-CE2 4.04Å; F70-F405 HydrophobicContact CE2-CG 4.39Å; F70-F405 HydrophobicContact CZ-CD2 4.12Å; F70-F405 HydrophobicContact CZ-CG 4.16Å; L124-F405 HydrophobicContact CD2-CE1 3.75Å; L124-F405 HydrophobicContact CD2-CZ 3.95Å; L127-F405 HydrophobicContact CD2-CZ 4.28Å; V350-F405 HydrophobicContact CG1-CD1 4.23Å; V350-F405 HydrophobicContact CG1-CE1 4.3Å; V354-F405 HydrophobicContact CG2-CE1 4.29Å; N401-F405 HydrophobicContact CB-CE2 4.01Å; N401-F405 HydrophobicContact CB-CZ 3.94Å; N401-F405 WeakPolarHBondContact O-CD1 3.33Å; N401-F405 WeakPolarHBondContact O-CD2 3.28Å; N401-F405 WeakPolarHBondContact O-CG 3.36Å; N401-F405 PolarHBondContact O-N 3.45Å; F402-F405 PolarHBondContact O-N 2.84Å; F402-F405 VanDerWaalsContact O-N 3.17Å; F405-S407 VanDerWaalsContact C-N 3.33Å; F405-S407 PolarHBondContact O-N 2.76Å; F405-M409 HydrophobicContact CB-SD 4.26Å; F405-M409 HydrophobicContact CD1-SD 3.77Å; F405-M409 HydrophobicContact CG-SD 4.26Å; F405-M409 WeakPolarHBondContact O-CA 3.46Å; F405-M409 WeakPolarHBondContact O-CB 3.37Å; F405-M409 PolarHBondContact O-N 3.35Å; F405-F412 HydrophobicContact CB-CB 4.44Å; F405-F412 HydrophobicContact CB-CD1 3.94Å; F405-F412 HydrophobicContact CB-CD2 4Å; F405-F412 HydrophobicContact CB-CE1 4.11Å; F405-F412 HydrophobicContact CB-CE2 4.16Å; F405-F412 HydrophobicContact CB-CG 3.88Å; F405-F412 HydrophobicContact CB-CZ 4.21Å; F405-F412 HydrophobicContact CD2-CE2 4.4Å
406I95.4Very high94.8Very high37 Ų3735.2 Ų35.219%0.1918%0.178CC..Hα-helixtrans-65.4-35.8-179-162.170.2000112.6F402 F403 F412 R413 F416F402-I406 PolarHBondContact O-N 3.01Å; F403-I406 HydrophobicContact CD1-CG2 4.47Å; F403-I406 WeakPolarHBondContact O-CG2 3.48Å; I406-F412 HydrophobicContact CB-CD1 4.26Å; I406-F412 HydrophobicContact CB-CE1 4.26Å; I406-F412 HydrophobicContact CD1-CD1 3.86Å; I406-F412 HydrophobicContact CD1-CE1 3.99Å; I406-R413 HydrophobicContact CD1-CB 4.21Å; I406-R413 HydrophobicContact CD1-CG 4.21Å; I406-F416 HydrophobicContact CD1-CB 4.04Å; I406-F416 HydrophobicContact CD1-CD1 3.65Å; I406-F416 HydrophobicContact CD1-CE1 4.3Å; I406-F416 HydrophobicContact CD1-CG 3.85Å
407S95.1Very high94.5Very high73 Ų7334.9 Ų34.951%0.5118%0.177SC..Hα-helixtrans-80.3-42-177.260.30000112.9F403 V404 F405F403-S407 VanDerWaalsContact O-CB 3.24Å; F403-S407 WeakPolarHBondContact O-CB 3.38Å; F403-S407 PolarHBondContact O-N 3.4Å; F403-S407 VanDerWaalsContact O-N 3.12Å; F403-S407 PolarHBondContact O-OG 2.04Å; V404-S407 PolarHBondContact O-OG 2.93Å; F405-S407 VanDerWaalsContact C-N 3.33Å; F405-S407 PolarHBondContact O-N 2.76Å
408L94.6Very high94Very high54 Ų5437.4 Ų37.428%0.28319%0.189SC..Hα-helixtrans-103.2-23-170.8-59.2-175.2000114.2V350 M353 V404V350-L408 HydrophobicContact CG2-CB 3.68Å; V350-L408 HydrophobicContact CG2-CD1 4.42Å; M353-L408 HydrophobicContact CB-CD1 4.1Å; M353-L408 HydrophobicContact CG-CD1 3.64Å; V404-L408 HydrophobicContact CG1-CD1 4.08Å; V404-L408 WeakPolarHBondContact O-CB 3.45Å; V404-L408 PolarHBondContact O-N 3.03Å
409M93.9Very high93.6Very high13 Ų1339.6 Ų39.66%0.06420%0.2CC..  trans-99.998.9-179.4-59.3-178.765.400111.1F70 F120 M121 L124 V350 F405 Y411 F412 R413F70-M409 HydrophobicContact CE1-CE 3.78Å; F70-M409 HydrophobicContact CE1-SD 4.39Å; F70-M409 HydrophobicContact CZ-CE 4.12Å; F70-M409 HydrophobicContact CZ-SD 4.13Å; F120-M409 HydrophobicContact CE1-CE 4.05Å; M121-M409 HydrophobicContact CE-CE 3.87Å; M121-M409 HydrophobicContact SD-CE 3.88Å; L124-M409 HydrophobicContact CD1-CE 3.56Å; L124-M409 HydrophobicContact CD1-SD 3.68Å; V350-M409 HydrophobicContact CG1-CG 4.34Å; V350-M409 HydrophobicContact CG1-SD 4.12Å; V350-M409 HydrophobicContact CG2-CG 3.52Å; V350-M409 HydrophobicContact CG2-SD 4.31Å; F405-M409 HydrophobicContact CB-SD 4.26Å; F405-M409 HydrophobicContact CD1-SD 3.77Å; F405-M409 HydrophobicContact CG-SD 4.26Å; F405-M409 WeakPolarHBondContact O-CA 3.46Å; F405-M409 WeakPolarHBondContact O-CB 3.37Å; F405-M409 PolarHBondContact O-N 3.35Å; M409-Y411 PolarHBondContact O-N 2.78Å; M409-Y411 VanDerWaalsContact O-N 3.15Å; M409-F412 HydrophobicContact CB-CB 3.72Å; M409-F412 WeakPolarHBondContact O-CB 3.07Å; M409-F412 PolarHBondContact O-N 3.44Å; M409-R413 PolarHBondContact O-N 2.87Å
410S91.1Very high93.2Very high50 Ų5043.5 Ų43.535%0.3522%0.217SC..Hα-helixtrans-56-33.9174.160.10000112.8I414S410-I414 WeakPolarHBondContact O-CD1 3.33Å; S410-I414 WeakPolarHBondContact O-CG1 3.29Å; S410-I414 PolarHBondContact O-N 3.43Å; S410-I414 VanDerWaalsContact O-N 3.08Å
411Y89.8Confident92.6Very high45 Ų4544.7 Ų44.718%0.17623%0.225CC..Hα-helixtrans-60-51.6173.8173.1-93.2000111.7F70 M121 M409 R413 I414 I415F70-Y411 HydrophobicContact CD1-CE1 4.4Å; M121-Y411 HydrophobicContact CE-CD1 3.38Å; M121-Y411 HydrophobicContact CE-CD2 4.32Å; M121-Y411 HydrophobicContact CE-CE1 3.81Å; M121-Y411 HydrophobicContact CE-CG 3.67Å; M121-Y411 HydrophobicContact SD-CD1 4.28Å; M121-Y411 HydrophobicContact SD-CE1 4.33Å; M409-Y411 PolarHBondContact O-N 2.78Å; M409-Y411 VanDerWaalsContact O-N 3.15Å; Y411-R413 PolarHBondContact O-N 3.16Å; Y411-I414 PolarHBondContact O-N 2.91Å; Y411-I415 HydrophobicContact CD1-CD1 4.48Å; Y411-I415 HydrophobicContact CD2-CD1 4.17Å; Y411-I415 HydrophobicContact CE1-CD1 3.85Å; Y411-I415 HydrophobicContact CE2-CD1 3.5Å; Y411-I415 VanDerWaalsContact CE2-CD1 3.5Å; Y411-I415 HydrophobicContact CE2-CG1 4.48Å; Y411-I415 WeakPolarHBondContact O-CG1 3.21Å; Y411-I415 PolarHBondContact O-N 3.14Å; Y411-I415 WeakPolarHBondContact OH-CD1 3.38Å
412F93.3Very high91.7Very high0 Ų050 Ų500%026%0.261CS..Hα-helixtrans-61-47.2-179.3-173.3-90000110.7V69 F70 F402 F405 I406 M409 I414 I415 F416V69-F412 HydrophobicContact CB-CD2 4.21Å; V69-F412 HydrophobicContact CB-CE2 3.83Å; V69-F412 HydrophobicContact CB-CZ 4.36Å; V69-F412 HydrophobicContact CG1-CD2 3.52Å; V69-F412 HydrophobicContact CG1-CE2 3.67Å; V69-F412 HydrophobicContact CG1-CG 4.1Å; V69-F412 HydrophobicContact CG1-CZ 4.33Å; V69-F412 HydrophobicContact CG2-CE2 4.44Å; V69-F412 HydrophobicContact CG2-CZ 4.49Å; F70-F412 HydrophobicContact CD1-CD2 4.34Å; F70-F412 HydrophobicContact CD2-CD2 4.5Å; F70-F412 HydrophobicContact CD2-CE2 4.33Å; F70-F412 AromaticContact CE1-CD2 3.74Å; F70-F412 HydrophobicContact CE1-CD2 3.74Å; F70-F412 HydrophobicContact CE1-CE2 4.46Å; F70-F412 AromaticContact CE2-CD2 3.92Å; F70-F412 HydrophobicContact CE2-CD2 3.92Å; F70-F412 AromaticContact CE2-CE2 3.86Å; F70-F412 HydrophobicContact CE2-CE2 3.86Å; F70-F412 AromaticContact CZ-CD2 3.49Å; F70-F412 HydrophobicContact CZ-CD2 3.49Å; F70-F412 VanDerWaalsContact CZ-CD2 3.49Å; F70-F412 AromaticContact CZ-CE2 3.93Å; F70-F412 HydrophobicContact CZ-CE2 3.93Å; F402-F412 HydrophobicContact CD2-CE1 4.33Å; F402-F412 HydrophobicContact CD2-CZ 4.06Å; F402-F412 AromaticContact CE2-CE1 3.99Å; F402-F412 HydrophobicContact CE2-CE1 3.99Å; F402-F412 AromaticContact CE2-CZ 3.94Å; F402-F412 HydrophobicContact CE2-CZ 3.94Å; F405-F412 HydrophobicContact CB-CB 4.44Å; F405-F412 HydrophobicContact CB-CD1 3.94Å; F405-F412 HydrophobicContact CB-CD2 4Å; F405-F412 HydrophobicContact CB-CE1 4.11Å; F405-F412 HydrophobicContact CB-CE2 4.16Å; F405-F412 HydrophobicContact CB-CG 3.88Å; F405-F412 HydrophobicContact CB-CZ 4.21Å; F405-F412 HydrophobicContact CD2-CE2 4.4Å; I406-F412 HydrophobicContact CB-CD1 4.26Å; I406-F412 HydrophobicContact CB-CE1 4.26Å; I406-F412 HydrophobicContact CD1-CD1 3.86Å; I406-F412 HydrophobicContact CD1-CE1 3.99Å; M409-F412 HydrophobicContact CB-CB 3.72Å; M409-F412 WeakPolarHBondContact O-CB 3.07Å; M409-F412 PolarHBondContact O-N 3.44Å; F412-I414 PolarHBondContact O-N 3.33Å; F412-I415 PolarHBondContact O-N 3.05Å; F412-F416 HydrophobicContact CD1-CB 4.49Å; F412-F416 HydrophobicContact CE1-CB 4.47Å; F412-F416 WeakPolarHBondContact O-CB 3.46Å; F412-F416 PolarHBondContact O-N 2.9Å
413R94Very high90.5Very high124 Ų12455.7 Ų55.747%0.46829%0.285SS..Hα-helixtrans-59.8-44.9179.7-172.4174.667.2-167.24.5113.7I406 M409 Y411 L417I406-R413 HydrophobicContact CD1-CB 4.21Å; I406-R413 HydrophobicContact CD1-CG 4.21Å; M409-R413 PolarHBondContact O-N 2.87Å; Y411-R413 PolarHBondContact O-N 3.16Å; R413-L417 HydrophobicContact CG-CD1 4.04Å; R413-L417 WeakPolarHBondContact O-CB 3.15Å; R413-L417 VanDerWaalsContact O-CG 3.27Å; R413-L417 WeakPolarHBondContact O-CG 3.12Å; R413-L417 PolarHBondContact O-N 3.29Å
414I91Very high88.7Confident50 Ų5053.6 Ų53.626%0.25628%0.282SS..Hα-helixtrans-62.1-47.1179.1-70.1165.2000110S410 Y411 F412 L417 Q418S410-I414 WeakPolarHBondContact O-CD1 3.33Å; S410-I414 WeakPolarHBondContact O-CG1 3.29Å; S410-I414 PolarHBondContact O-N 3.43Å; S410-I414 VanDerWaalsContact O-N 3.08Å; Y411-I414 PolarHBondContact O-N 2.91Å; F412-I414 PolarHBondContact O-N 3.33Å; I414-L417 PolarHBondContact O-N 3.19Å; I414-Q418 HydrophobicContact CG2-CG 4.44Å; I414-Q418 WeakPolarHBondContact O-CB 3.45Å; I414-Q418 VanDerWaalsContact O-CG 3.23Å; I414-Q418 WeakPolarHBondContact O-CG 3.24Å; I414-Q418 PolarHBondContact O-N 3.18Å
415I90.6Very high86.9Confident0 Ų058.4 Ų58.40%030%0.302CS..Hα-helixtrans-70.1-41.3-177.2-63.4-165.1000111.3V69 G73 Y411 F412 L417 Q418 I419V69-I415 HydrophobicContact CG1-CB 4.09Å; V69-I415 HydrophobicContact CG1-CG2 3.85Å; G73-I415 VanDerWaalsContact CA-CD1 3.4Å; G73-I415 WeakPolarHBondContact O-CD1 3.49Å; Y411-I415 HydrophobicContact CD1-CD1 4.48Å; Y411-I415 HydrophobicContact CD2-CD1 4.17Å; Y411-I415 HydrophobicContact CE1-CD1 3.85Å; Y411-I415 HydrophobicContact CE2-CD1 3.5Å; Y411-I415 VanDerWaalsContact CE2-CD1 3.5Å; Y411-I415 HydrophobicContact CE2-CG1 4.48Å; Y411-I415 WeakPolarHBondContact O-CG1 3.21Å; Y411-I415 PolarHBondContact O-N 3.14Å; Y411-I415 WeakPolarHBondContact OH-CD1 3.38Å; F412-I415 PolarHBondContact O-N 3.05Å; I415-L417 PolarHBondContact O-N 3.07Å; I415-Q418 PolarHBondContact O-N 3Å; I415-I419 HydrophobicContact CG2-CD1 3.53Å; I415-I419 HydrophobicContact CG2-CG1 4.21Å; I415-I419 WeakPolarHBondContact O-CB 3.4Å; I415-I419 VanDerWaalsContact O-CG1 3.29Å; I415-I419 WeakPolarHBondContact O-CG1 3.4Å; I415-I419 PolarHBondContact O-N 2.95Å
416F92.2Very high84.6Confident43 Ų4363.7 Ų63.719%0.18933%0.33CS..Hα-helixtrans-56.1-50173.9177.8-93.9000111.5I65 V69 F402 I406 F412 Q418 I419 F420I65-F416 HydrophobicContact CG2-CD2 4.02Å; I65-F416 HydrophobicContact CG2-CE2 3.77Å; V69-F416 HydrophobicContact CG2-CB 4.37Å; V69-F416 HydrophobicContact CG2-CD2 4.27Å; F402-F416 HydrophobicContact CE2-CE2 4.26Å; F402-F416 HydrophobicContact CZ-CD2 4.49Å; F402-F416 AromaticContact CZ-CE2 3.98Å; F402-F416 HydrophobicContact CZ-CE2 3.98Å; F402-F416 HydrophobicContact CZ-CZ 4.28Å; I406-F416 HydrophobicContact CD1-CB 4.04Å; I406-F416 HydrophobicContact CD1-CD1 3.65Å; I406-F416 HydrophobicContact CD1-CE1 4.3Å; I406-F416 HydrophobicContact CD1-CG 3.85Å; F412-F416 HydrophobicContact CD1-CB 4.49Å; F412-F416 HydrophobicContact CE1-CB 4.47Å; F412-F416 WeakPolarHBondContact O-CB 3.46Å; F412-F416 PolarHBondContact O-N 2.9Å; F416-Q418 VanDerWaalsContact C-N 3.33Å; F416-Q418 PolarHBondContact O-N 2.74Å; F416-I419 PolarHBondContact O-N 3.19Å; F416-F420 AromaticContact CD2-CD2 3.61Å; F416-F420 HydrophobicContact CD2-CD2 3.61Å; F416-F420 HydrophobicContact CD2-CE2 4Å; F416-F420 AromaticContact CE2-CD2 3.65Å; F416-F420 HydrophobicContact CE2-CD2 3.65Å; F416-F420 HydrophobicContact CE2-CE2 4.1Å; F416-F420 HydrophobicContact CE2-CG 4.28Å; F416-F420 HydrophobicContact CG-CD2 4.29Å; F416-F420 HydrophobicContact CZ-CD2 4.38Å; F416-F420 WeakPolarHBondContact O-CD2 3.46Å; F416-F420 PolarHBondContact O-N 3.28Å
417L90.5Very high82.3Confident40 Ų4068.7 Ų68.721%0.20936%0.358CS..Hα-helixtrans-65.6-34177.8-70.7172.5000113R413 I414 I415 C421 C422 K423 F425R413-L417 HydrophobicContact CG-CD1 4.04Å; R413-L417 WeakPolarHBondContact O-CB 3.15Å; R413-L417 VanDerWaalsContact O-CG 3.27Å; R413-L417 WeakPolarHBondContact O-CG 3.12Å; R413-L417 PolarHBondContact O-N 3.29Å; I414-L417 PolarHBondContact O-N 3.19Å; I415-L417 PolarHBondContact O-N 3.07Å; L417-C421 HydrophobicContact CD2-CB 4.18Å; L417-C421 CarbonylContact O-C 3.58Å; L417-C421 VanDerWaalsContact O-CA 3.29Å; L417-C421 WeakPolarHBondContact O-CA 3.39Å; L417-C421 VanDerWaalsContact O-CB 3.26Å; L417-C421 WeakPolarHBondContact O-CB 3.23Å; L417-C421 PolarHBondContact O-N 3.23Å; L417-C422 PolarHBondContact O-N 3.26Å; L417-K423 PolarHBondContact O-N 3.36Å; L417-F425 HydrophobicContact CD1-CE2 4.11Å
418Q87.2Confident79.5Confident55 Ų5572.5 Ų72.526%0.25737%0.367SS..Hα-helixtrans-68.3-41.1176.3-78.2174.6-12.900112I414 I415 F416I414-Q418 HydrophobicContact CG2-CG 4.44Å; I414-Q418 WeakPolarHBondContact O-CB 3.45Å; I414-Q418 VanDerWaalsContact O-CG 3.23Å; I414-Q418 WeakPolarHBondContact O-CG 3.24Å; I414-Q418 PolarHBondContact O-N 3.18Å; I415-Q418 PolarHBondContact O-N 3Å; F416-Q418 VanDerWaalsContact C-N 3.33Å; F416-Q418 PolarHBondContact O-N 2.74Å
419I87.4Confident76.6Confident45 Ų4578.7 Ų78.723%0.23140%0.395CS..Hα-helixtrans-74.8-50.8-178.9-68171.7000110.9F68 V69 T76 I415 F416F68-I419 HydrophobicContact CD1-CD1 4.24Å; F68-I419 HydrophobicContact CD1-CG2 4.42Å; F68-I419 HydrophobicContact CE1-CD1 3.99Å; F68-I419 HydrophobicContact CE1-CG2 3.84Å; V69-I419 HydrophobicContact CG2-CD1 4.43Å; T76-I419 HydrophobicContact CG2-CD1 4.22Å; T76-I419 HydrophobicContact CG2-CG1 3.93Å; I415-I419 HydrophobicContact CG2-CD1 3.53Å; I415-I419 HydrophobicContact CG2-CG1 4.21Å; I415-I419 WeakPolarHBondContact O-CB 3.4Å; I415-I419 VanDerWaalsContact O-CG1 3.29Å; I415-I419 WeakPolarHBondContact O-CG1 3.4Å; I415-I419 PolarHBondContact O-N 2.95Å; F416-I419 PolarHBondContact O-N 3.19Å
420F87.9Confident73.7Confident98 Ų9883.7 Ų83.743%0.4343%0.428SS..Hα-helixtrans-99-19.3-168.5-66.6-78.2000114.3I65 F68 V69 F416I65-F420 HydrophobicContact CG1-CZ 4.38Å; I65-F420 HydrophobicContact CG2-CE2 3.83Å; I65-F420 HydrophobicContact CG2-CZ 4.05Å; F68-F420 HydrophobicContact CD1-CZ 4.49Å; V69-F420 HydrophobicContact CG2-CE2 4.18Å; F416-F420 AromaticContact CD2-CD2 3.61Å; F416-F420 HydrophobicContact CD2-CD2 3.61Å; F416-F420 HydrophobicContact CD2-CE2 4Å; F416-F420 AromaticContact CE2-CD2 3.65Å; F416-F420 HydrophobicContact CE2-CD2 3.65Å; F416-F420 HydrophobicContact CE2-CE2 4.1Å; F416-F420 HydrophobicContact CE2-CG 4.28Å; F416-F420 HydrophobicContact CG-CD2 4.29Å; F416-F420 HydrophobicContact CZ-CD2 4.38Å; F416-F420 WeakPolarHBondContact O-CD2 3.46Å; F416-F420 PolarHBondContact O-N 3.28Å
421C85.7Confident71Confident63 Ų6389.7 Ų89.743%0.42645%0.453SS..SBendtrans-117.21.2-179.2-55.90000113.9L417 K423L417-C421 HydrophobicContact CD2-CB 4.18Å; L417-C421 CarbonylContact O-C 3.58Å; L417-C421 VanDerWaalsContact O-CA 3.29Å; L417-C421 WeakPolarHBondContact O-CA 3.39Å; L417-C421 VanDerWaalsContact O-CB 3.26Å; L417-C421 WeakPolarHBondContact O-CB 3.23Å; L417-C421 PolarHBondContact O-N 3.23Å; C421-K423 HydrophobicContact CB-CG 4.29Å; C421-K423 PolarHBondContact O-N 3.03Å
422C77.1Confident68.3Low112 Ų11291.9 Ų91.976%0.75748%0.48SS*.  trans50.118.5-176.3-63.40000114.9L417 T424L417-C422 PolarHBondContact O-N 3.26Å; C422-T424 PolarHBondContact O-N 3.34Å
423K72.3Confident65.5Low135 Ų13597.7 Ų97.759%0.58752%0.516SS*.  trans-79.4116.2-178.6-75.6-172.4178.6-177.70109.5L417 C421 F425L417-K423 PolarHBondContact O-N 3.36Å; C421-K423 HydrophobicContact CB-CG 4.29Å; C421-K423 PolarHBondContact O-N 3.03Å; K423-F425 PolarHBondContact O-N 3.11Å
424T61Low62.6Low73 Ų73100.8 Ų100.845%0.44853%0.532SS..  trans-78.6114.7171.2-57.80000109.1K80 C422 N426K80-T424 HydrophobicContact CD-CG2 4.46Å; K80-T424 PolarHBondContact NZ-OG1 3.35Å; C422-T424 PolarHBondContact O-N 3.34Å; T424-N426 WeakPolarHBondContact CG2-OD1 3.09Å; T424-N426 PolarHBondContact O-N 2.82Å
425F57.4Low59.7Low116 Ų116103.6 Ų103.651%0.50956%0.557SS.*  trans-83.5106.4160.7-94.6-86.7000108.4L417 K423 N427L417-F425 HydrophobicContact CD1-CE2 4.11Å; K423-F425 PolarHBondContact O-N 3.11Å; F425-N427 PolarHBondContact O-N 3.31Å; F425-N427 VanDerWaalsContact O-N 3.17Å
426N50Low57Low111 Ų111109 Ų10959%0.59459%0.59SS**  trans-69.8103.7159.6-761.4000106.5T424 E428T424-N426 WeakPolarHBondContact CG2-OD1 3.09Å; T424-N426 PolarHBondContact O-N 2.82Å; N426-E428 PolarHBondContact O-N 3.35Å
427N45.6Very low54Low143 Ų143112 Ų11277%0.76562%0.616SS**  trans-75.157.9162.7-93.6-7.2000108.6F425 Q429F425-N427 PolarHBondContact O-N 3.31Å; F425-N427 VanDerWaalsContact O-N 3.17Å; N427-Q429 PolarHBondContact O-N 3.41Å
428E36.8Very low51Low152 Ų152115.7 Ų115.771%0.7164%0.644SS**  trans-89.792.8159.6-72.5179.1-175.400105N426 P430N426-E428 PolarHBondContact O-N 3.35Å; E428-P430 VanDerWaalsContact O-CD 3.28Å; E428-P430 WeakPolarHBondContact O-CD 3.39Å
429Q34.6Very low48.4Very low185 Ų185119 Ų11986%0.86467%0.668SS**  trans-62.5120.8149.2-73.4-170.3-75.800104.6N427 M431N427-Q429 PolarHBondContact O-N 3.41Å; Q429-M431 VanDerWaalsContact C-N 3.34Å; Q429-M431 PolarHBondContact O-N 2.82Å
430P33.2Very low45.6Very low118 Ų118122.3 Ų122.377%0.76670%0.695SS**  trans-60106.317023.1-29.6000106.3E428 A432E428-P430 VanDerWaalsContact O-CD 3.28Å; E428-P430 WeakPolarHBondContact O-CD 3.39Å; P430-A432 PolarHBondContact O-N 3.45Å
431M33.5Very low42.8Very low176 Ų176123.3 Ų123.387%0.86771%0.709SS**  trans-56.1103.7148.4-92.8-176.7167.100103.5Q429 T433Q429-M431 VanDerWaalsContact C-N 3.34Å; Q429-M431 PolarHBondContact O-N 2.82Å; M431-T433 PolarHBondContact O-N 2.72Å
432A34Very low39.9Very low90 Ų90125.5 Ų125.574%0.74473%0.725SS**  trans-5989.5160.700000105.5P430 K434P430-A432 PolarHBondContact O-N 3.45Å; A432-K434 PolarHBondContact O-N 2.6Å
433T33Very low37.6Very low123 Ų123127.6 Ų127.676%0.75572%0.724SS**  trans-60.189.7158.639.60000105M431 S435M431-T433 PolarHBondContact O-N 2.72Å; T433-S435 PolarHBondContact O-N 2.73Å
434K32.8Very low35.2Very low188 Ų188126.4 Ų126.482%0.81773%0.732SS**  trans-59.296153.5-83.5-175.6174.5-177.70104.9A432 T436A432-K434 PolarHBondContact O-N 2.6Å; K434-T436 PolarHBondContact O-N 3.34Å
435S31.3Very low33.8Very low110 Ų110130.4 Ų130.477%0.76975%0.749SS**  trans-64.680.1161.351.60000107.2T433 S437T433-S435 PolarHBondContact O-N 2.73Å; S435-S437 VanDerWaalsContact C-N 3.3Å; S435-S437 PolarHBondContact O-N 3.47Å
436T34.2Very low32.2Very low113 Ų113132.9 Ų132.969%0.69377%0.766SS**  trans-77.894.8155.824.90000106.3K434 C438K434-T436 PolarHBondContact O-N 3.34Å; T436-C438 VanDerWaalsContact C-N 3.27Å; T436-C438 PolarHBondContact O-N 3.11Å
437S28.3Very low31Very low107 Ų107130.5 Ų130.575%0.74877%0.768SS**  trans-58.693157.549.90000108.1S435 T439S435-S437 VanDerWaalsContact C-N 3.3Å; S435-S437 PolarHBondContact O-N 3.47Å; S437-T439 VanDerWaalsContact C-N 3.35Å; S437-T439 PolarHBondContact O-N 3.32Å
438C29.1Very low30.2Very low116 Ų116131 Ų13178%0.78477%0.77SS**  trans-81.589.9166.4-65.10000107.2T436 S440T436-C438 VanDerWaalsContact C-N 3.27Å; T436-C438 PolarHBondContact O-N 3.11Å; C438-S440 PolarHBondContact O-N 3.46Å
439T32.3Very low29.6Very low124 Ų124128.3 Ų128.376%0.76177%0.769SS**  trans-59.1119.4160.613.60000108.2S437 V441S437-T439 VanDerWaalsContact C-N 3.35Å; S437-T439 PolarHBondContact O-N 3.32Å; T439-V441 PolarHBondContact O-N 2.96Å
440S28.3Very low29.4Very low115 Ų115129.6 Ų129.680%0.80477%0.767SS**  trans-57.2111168.349.90000109.8C438C438-S440 PolarHBondContact O-N 3.46Å
441V29.3Very low29Very low119 Ų119132.3 Ų132.372%0.72177%0.769SS**  trans-114.398.5158.6179.60000106.9T439 H443T439-V441 PolarHBondContact O-N 2.96Å; V441-H443 PolarHBondContact O-N 3.41Å
442S24.1Very low28.9Very low109 Ų109132.7 Ų132.776%0.76277%0.771SS**  trans-63.6112.1160.348.20000108.9
443H28.6Very low28.8Very low157 Ų157136.3 Ų136.373%0.72777%0.772SS**  trans-134.2101.4153.6-98.2-75.7000109.4V441 I445V441-H443 PolarHBondContact O-N 3.41Å; H443-I445 PolarHBondContact O-N 2.98Å
444S23Very low28.5Very low110 Ų110139.4 Ų139.477%0.76978%0.775SS**  trans-63.7111.8153.348.40000109.2
445I29.7Very low28.5Very low157 Ų157138 Ų13881%0.80578%0.776SS**  trans-137.2123.6149.5-61.5-174.8000108.4H443H443-I445 PolarHBondContact O-N 2.98Å
446I25.7Very low28.4Very low167 Ų167139.8 Ų139.886%0.85678%0.777SS**  trans-72142.1177-70.5157.8000109.7
447G24.9Very low28.3Very low61 Ų61140.2 Ų140.263%0.62978%0.779SS**  trans99.1100.2150.900000116.4
448N27Very low28.1Very low153 Ų153144.8 Ų144.882%0.81879%0.786SS**  -166131.4104.6-102.4-15.4000112.3
449S25.4Very low28.5Very low97 Ų97149.5 Ų149.568%0.67881%0.81SS**  trans-59.1121.9168.9153.60000110.8
450Y30.6Very low28.3Very low211 Ų211150.8 Ų150.883%0.82781%0.813SS**  trans-134.2103.9147.5-79-76.8000110
451H24.5Very low28.3Very low176 Ų176152.6 Ų152.682%0.81581%0.813SS**  trans-55.4120.5157.3-125.8-87.6000109
452M32Very low28.3Very low184 Ų184154.5 Ų154.591%0.90682%0.819SS**  trans-143.387.8159.4-104.4-85.8173.400108.2
453E30Very low28.5Very low166 Ų166157.2 Ų157.278%0.77682%0.822SS**  trans11.8131.1147.7-133.5162.4-175.400120.8
454K27.1Very low28.5Very low188 Ų188157.2 Ų157.282%0.81783%0.828SS**  trans-43.9129.4160.4-73.2165170.1170.80112.2
455L34.3Very low28.9Very low157 Ų157160.3 Ų160.382%0.82283%0.832SS**  trans-122.989.2149.2-103.1132.2000109.2
456N27.6Very low28.8Very low149 Ų149160.6 Ų160.680%0.79783%0.834SS**  trans-82.7115.2154.8-92-27.4000107.3
457T33.2Very low29.1Very low121 Ų121160.1 Ų160.174%0.74283%0.832SS**  trans-143.810515340.30000109.8
458K24.2Very low29.4Very low203 Ų203168.3 Ų168.388%0.88385%0.849SS**  trans-55.1136.2145.7-72.1170.9169.3177.10108.8
459V37.1Very low29.6Very low215 Ų215169.7 Ų169.7100%1.30385%0.852SS**  -157.20105.3159.90000106.5

Retrieved 459 of 459 residues in 805.6 ms (Link to these results)

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