A0A077ZL17_TRITR Loading...

Cleft lip and palate transmembrane protein 1-like protein

AlphaFold DB , UniProt , Accession A0A077ZL17, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 328 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
1M41.2Very low40Very low223 Ų223118.5 Ų118.5100%1.09960%0.598SS**  0-3.90-110.3158.5168.700113.4
2T46.6Very low39.6Very low115 Ų115120.3 Ų120.371%0.70660%0.599SS**  trans-99.1-10.1-178.1410000114.8T6T2-T6 PolarHBondContact O-N 2.93Å; T2-T6 PolarHBondContact O-OG1 3.21Å; T2-T6 VanDerWaalsContact O-OG1 3.11Å
3D44Very low39.4Very low109 Ų109115.2 Ų115.258%0.58358%0.579SS**Hα-helixtrans-87.3-28.9-166.3-149.724.1000113.9T6 R7D3-T6 WeakPolarHBondContact CA-OG1 3.3Å; D3-T6 PolarHBondContact O-OG1 2.84Å; D3-R7 PolarHBondContact O-N 3.22Å
4S43.8Very low39.4Very low76 Ų76113 Ų11353%0.53157%0.569SS.*Hα-helixtrans-72.3-32.6170.244.60000112T8S4-T8 PolarHBondContact O-N 3.02Å; S4-T8 VanDerWaalsContact O-N 3.14Å; S4-T8 PolarHBondContact O-OG1 3.45Å
5D37.4Very low39.4Very low103 Ų103113 Ų11355%0.55156%0.564SS**Hα-helixtrans-74.4-35.5179.5-73-22.4000111.7T8 Y9D5-T8 PolarHBondContact O-N 3.27Å; D5-Y9 WeakPolarHBondContact O-CB 3.47Å; D5-Y9 PolarHBondContact O-N 3.43Å
6T42.2Very low39.2Very low73 Ų73110 Ų11045%0.44855%0.549SS..Hα-helixtrans-68.1-42.7173.837.80000112.4T2 D3 T8 Y9 E10T2-T6 PolarHBondContact O-N 2.93Å; T2-T6 PolarHBondContact O-OG1 3.21Å; T2-T6 VanDerWaalsContact O-OG1 3.11Å; D3-T6 WeakPolarHBondContact CA-OG1 3.3Å; D3-T6 PolarHBondContact O-OG1 2.84Å; T6-T8 VanDerWaalsContact C-N 3.27Å; T6-T8 PolarHBondContact O-N 2.89Å; T6-Y9 PolarHBondContact O-N 2.99Å; T6-E10 PolarHBondContact O-N 3.1Å
7R36.3Very low39.4Very low141 Ų141105.4 Ų105.453%0.53253%0.528SS..Hα-helixtrans-58.5-40.1171.3-78.4-173.5175.2163.28112D3 Q11 E201D3-R7 PolarHBondContact O-N 3.22Å; R7-Q11 WeakPolarHBondContact O-CB 3.4Å; R7-Q11 PolarHBondContact O-N 3.1Å; R7-E201 IonicContact CZ-OE1 3.22Å; R7-E201 IonicContact CZ-OE2 3.13Å; R7-E201 IonicContact NE-OE1 3.37Å; R7-E201 IonicContact NE-OE2 3.39Å; R7-E201 PolarHBondContact NE-OE2 2.94Å; R7-E201 VanDerWaalsContact NH2-CD 3.34Å; R7-E201 IonicContact NH2-OE1 2.93Å; R7-E201 PolarHBondContact NH2-OE1 3.4Å; R7-E201 IonicContact NH2-OE2 3.76Å; R7-E201 PolarHBondContact NH2-OE2 3.46Å
8T38.5Very low39.2Very low68 Ų68100.7 Ų100.742%0.41751%0.505SS..Hα-helixtrans-70.8-35.2177.8-47.40000112S4 D5 T6 K12S4-T8 PolarHBondContact O-N 3.02Å; S4-T8 VanDerWaalsContact O-N 3.14Å; S4-T8 PolarHBondContact O-OG1 3.45Å; D5-T8 PolarHBondContact O-N 3.27Å; T6-T8 VanDerWaalsContact C-N 3.27Å; T6-T8 PolarHBondContact O-N 2.89Å; T8-K12 HydrophobicContact CG2-CD 4.44Å; T8-K12 WeakPolarHBondContact O-CB 3.32Å; T8-K12 VanDerWaalsContact O-CG 3.27Å; T8-K12 WeakPolarHBondContact O-CG 3.35Å; T8-K12 PolarHBondContact O-N 2.95Å
9Y34Very low39.1Very low175 Ų17597.5 Ų97.569%0.68649%0.491SS*.Hα-helixtrans-70-47.9176.5-113.9-89.7000111.8D5 T6 K12 T13D5-Y9 WeakPolarHBondContact O-CB 3.47Å; D5-Y9 PolarHBondContact O-N 3.43Å; T6-Y9 PolarHBondContact O-N 2.99Å; Y9-K12 CarbonylContact O-C 3.59Å; Y9-K12 PolarHBondContact O-N 2.71Å; Y9-T13 WeakPolarHBondContact O-CG2 3.24Å; Y9-T13 PolarHBondContact O-N 2.84Å; Y9-T13 PolarHBondContact O-OG1 3.11Å
10E38.3Very low38.8Very low107 Ų10794.2 Ų94.250%0.548%0.475SS..Hα-helixtrans-68.5-40.6178.4-72.4-149.715400111.3T6 K12 T13 L14T6-E10 PolarHBondContact O-N 3.1Å; E10-K12 PolarHBondContact O-N 3.31Å; E10-T13 VanDerWaalsContact CA-OG1 3.28Å; E10-T13 WeakPolarHBondContact CA-OG1 3.35Å; E10-T13 CarbonylContact O-C 3.54Å; E10-T13 PolarHBondContact O-N 3.49Å; E10-T13 VanDerWaalsContact O-N 3.13Å; E10-T13 PolarHBondContact O-OG1 2.94Å; E10-L14 WeakPolarHBondContact O-CB 3.4Å; E10-L14 PolarHBondContact O-N 3.3Å
11Q37.5Very low38.8Very low113 Ų11393.5 Ų93.553%0.52847%0.469SS..Hα-helixtrans-68.3-24.8175-150.8175.66.500112.4R7 K15R7-Q11 WeakPolarHBondContact O-CB 3.4Å; R7-Q11 PolarHBondContact O-N 3.1Å; Q11-K15 VanDerWaalsContact O-CG 3.3Å; Q11-K15 WeakPolarHBondContact O-CG 3.39Å; Q11-K15 PolarHBondContact O-N 3.02Å
12K35.3Very low38.7Very low141 Ų14184.4 Ų84.461%0.61342%0.423SS*.Hα-helixtrans-75.2-36.3168.3-84.2177.6176.6177.60112.7T8 Y9 E10 M16T8-K12 HydrophobicContact CG2-CD 4.44Å; T8-K12 WeakPolarHBondContact O-CB 3.32Å; T8-K12 VanDerWaalsContact O-CG 3.27Å; T8-K12 WeakPolarHBondContact O-CG 3.35Å; T8-K12 PolarHBondContact O-N 2.95Å; Y9-K12 CarbonylContact O-C 3.59Å; Y9-K12 PolarHBondContact O-N 2.71Å; E10-K12 PolarHBondContact O-N 3.31Å; K12-M16 WeakPolarHBondContact O-CG 3.23Å; K12-M16 PolarHBondContact O-N 2.94Å
13T37.4Very low38.1Very low54 Ų5482.1 Ų82.133%0.33141%0.411SS..Hα-helixtrans-74.3-34.5174.256.40000112Y9 E10 K15 M16 P17 P266Y9-T13 WeakPolarHBondContact O-CG2 3.24Å; Y9-T13 PolarHBondContact O-N 2.84Å; Y9-T13 PolarHBondContact O-OG1 3.11Å; E10-T13 VanDerWaalsContact CA-OG1 3.28Å; E10-T13 WeakPolarHBondContact CA-OG1 3.35Å; E10-T13 CarbonylContact O-C 3.54Å; E10-T13 PolarHBondContact O-N 3.49Å; E10-T13 VanDerWaalsContact O-N 3.13Å; E10-T13 PolarHBondContact O-OG1 2.94Å; T13-K15 PolarHBondContact O-N 3.3Å; T13-M16 PolarHBondContact O-N 3.42Å; T13-P17 WeakPolarHBondContact O-CD 3.48Å; T13-P266 HydrophobicContact CG2-CB 4.43Å
14L39.8Very low37.9Very low84 Ų8477.4 Ų77.444%0.4439%0.386SS..Hα-helixtrans-59.9-33174.2-159.486.4000111.9E10 Y111E10-L14 WeakPolarHBondContact O-CB 3.4Å; E10-L14 PolarHBondContact O-N 3.3Å; L14-Y111 VanDerWaalsContact CD1-OH 3.26Å; L14-Y111 WeakPolarHBondContact CD1-OH 2.89Å
15K38.7Very low37.8Very low113 Ų11375 Ų7549%0.49137%0.373SS..Hα-helixtrans-84.3-28.7178.3-72178.4-177.9-175.70112.1Q11 T13 L18 V19Q11-K15 VanDerWaalsContact O-CG 3.3Å; Q11-K15 WeakPolarHBondContact O-CG 3.39Å; Q11-K15 PolarHBondContact O-N 3.02Å; T13-K15 PolarHBondContact O-N 3.3Å; K15-L18 CarbonylContact O-C 3.17Å; K15-L18 PolarHBondContact O-N 3.02Å; K15-V19 HydrophobicContact CB-CG2 3.89Å; K15-V19 WeakPolarHBondContact O-CA 3.32Å; K15-V19 VanDerWaalsContact O-CB 3.23Å; K15-V19 WeakPolarHBondContact O-CB 3.33Å; K15-V19 WeakPolarHBondContact O-CG2 3.33Å; K15-V19 PolarHBondContact O-N 2.87Å
16M35.7Very low37.9Very low65 Ų6573 Ų7332%0.3236%0.362SS..Hα-helixtrans-70.2-45.2-163.7-85.3-92.3-165.200119.7K12 T13 L18 V19 L20 P266K12-M16 WeakPolarHBondContact O-CG 3.23Å; K12-M16 PolarHBondContact O-N 2.94Å; T13-M16 PolarHBondContact O-N 3.42Å; M16-L18 PolarHBondContact O-N 3.42Å; M16-V19 VanDerWaalsContact C-N 3.33Å; M16-V19 CarbonylContact O-C 3.36Å; M16-V19 WeakPolarHBondContact O-CA 3.39Å; M16-V19 PolarHBondContact O-N 2.82Å; M16-L20 PolarHBondContact O-N 2.83Å; M16-P266 HydrophobicContact CB-CG 3.56Å; M16-P266 HydrophobicContact CE-CG 4.31Å; M16-P266 HydrophobicContact CG-CG 3.49Å; M16-P266 VanDerWaalsContact CG-CG 3.49Å; M16-P266 VanDerWaalsContact SD-CD 3.54Å; M16-P266 HydrophobicContact SD-CG 3.84Å
17P44Very low37.8Very low32 Ų3272 Ų7221%0.20835%0.351CS..Hα-helixtrans-67.6-29.8177.426.3-31.6000110.8T13 L218 Y269T13-P17 WeakPolarHBondContact O-CD 3.48Å; P17-L218 HydrophobicContact CG-CD2 4.37Å; P17-Y269 HydrophobicContact CB-CD2 4.03Å
18L35.8Very low38Very low21 Ų2166.3 Ų66.311%0.1133%0.332CS..Hα-helixtrans-74.1-33.5164.4-96.4156.9000111.4K15 M16 L20 F21 K22 I121K15-L18 CarbonylContact O-C 3.17Å; K15-L18 PolarHBondContact O-N 3.02Å; M16-L18 PolarHBondContact O-N 3.42Å; L18-L20 PolarHBondContact O-N 2.94Å; L18-F21 CarbonylContact O-C 3.59Å; L18-F21 PolarHBondContact O-N 3.37Å; L18-K22 HydrophobicContact CB-CD 3.95Å; L18-K22 HydrophobicContact CB-CG 4.12Å; L18-K22 HydrophobicContact CD2-CD 4.23Å; L18-K22 HydrophobicContact CD2-CG 3.93Å; L18-K22 WeakPolarHBondContact O-CA 3.4Å; L18-K22 WeakPolarHBondContact O-CB 3.3Å; L18-K22 WeakPolarHBondContact O-CG 3.46Å; L18-K22 PolarHBondContact O-N 3.36Å; L18-I121 HydrophobicContact CD2-CG2 3.98Å
19V36Very low38.2Very low40 Ų4064.3 Ų64.324%0.24232%0.32CS..Hα-helixtrans-76.9-13.3-177.71670000114.2K15 M16 C23K15-V19 HydrophobicContact CB-CG2 3.89Å; K15-V19 WeakPolarHBondContact O-CA 3.32Å; K15-V19 VanDerWaalsContact O-CB 3.23Å; K15-V19 WeakPolarHBondContact O-CB 3.33Å; K15-V19 WeakPolarHBondContact O-CG2 3.33Å; K15-V19 PolarHBondContact O-N 2.87Å; M16-V19 VanDerWaalsContact C-N 3.33Å; M16-V19 CarbonylContact O-C 3.36Å; M16-V19 WeakPolarHBondContact O-CA 3.39Å; M16-V19 PolarHBondContact O-N 2.82Å; V19-C23 HydrophobicContact CG1-CB 4.49Å; V19-C23 WeakPolarHBondContact CG1-SG 3.28Å; V19-C23 VanDerWaalsContact O-CA 3.23Å; V19-C23 WeakPolarHBondContact O-CA 3.07Å; V19-C23 WeakPolarHBondContact O-CB 3.37Å; V19-C23 PolarHBondContact O-N 3.09Å; V19-C23 PolarHBondContact O-SG 2.99Å
20L33.9Very low38.3Very low30 Ų3058 Ų5816%0.15730%0.297CS..Hα-helixtrans-80.3-47.9162.1-132.482.3000111.2M16 L18 K22 C23 L24 D256 M265 Y269M16-L20 PolarHBondContact O-N 2.83Å; L18-L20 PolarHBondContact O-N 2.94Å; L20-K22 PolarHBondContact O-N 3.26Å; L20-C23 PolarHBondContact O-N 3.08Å; L20-L24 WeakPolarHBondContact O-CB 3.08Å; L20-L24 PolarHBondContact O-N 3.31Å; L20-D256 HydrophobicContact CD2-CB 4.46Å; L20-M265 HydrophobicContact CD1-CE 3.16Å; L20-M265 HydrophobicContact CD1-SD 3.53Å; L20-M265 VanDerWaalsContact CD1-SD 3.53Å; L20-M265 HydrophobicContact CD2-CE 3.57Å; L20-M265 HydrophobicContact CD2-SD 3.98Å; L20-M265 HydrophobicContact CG-CE 3.97Å; L20-M265 HydrophobicContact CG-SD 4.28Å; L20-Y269 HydrophobicContact CB-CE2 4.38Å; L20-Y269 HydrophobicContact CD2-CE1 4.26Å; L20-Y269 VanDerWaalsContact CD2-OH 3.27Å; L20-Y269 WeakPolarHBondContact CD2-OH 3.19Å
21F39Very low38.3Very low81 Ų8158.5 Ų58.536%0.35530%0.302SS..Hα-helixtrans-65.2-24.5173.6-162.4-94.2000113.2L18 G25 E73L18-F21 CarbonylContact O-C 3.59Å; L18-F21 PolarHBondContact O-N 3.37Å; F21-G25 WeakPolarHBondContact O-CA 3.42Å; F21-G25 PolarHBondContact O-N 3.35Å; F21-E73 VanDerWaalsContact CE2-CD 3.5Å; F21-E73 WeakPolarHBondContact CE2-OE1 3.5Å; F21-E73 VanDerWaalsContact CE2-OE2 3.23Å; F21-E73 WeakPolarHBondContact CE2-OE2 3.5Å; F21-E73 WeakPolarHBondContact CZ-OE1 3.42Å; F21-E73 WeakPolarHBondContact CZ-OE2 3.43Å
22K38Very low38.5Very low32 Ų3256.7 Ų56.714%0.13930%0.302CS..Hα-helixtrans-95.7-30.1174.2-66.3178.4-173.8-175.30109.4L18 L20 L24 G25 I26 I121L18-K22 HydrophobicContact CB-CD 3.95Å; L18-K22 HydrophobicContact CB-CG 4.12Å; L18-K22 HydrophobicContact CD2-CD 4.23Å; L18-K22 HydrophobicContact CD2-CG 3.93Å; L18-K22 WeakPolarHBondContact O-CA 3.4Å; L18-K22 WeakPolarHBondContact O-CB 3.3Å; L18-K22 WeakPolarHBondContact O-CG 3.46Å; L18-K22 PolarHBondContact O-N 3.36Å; L20-K22 PolarHBondContact O-N 3.26Å; K22-L24 PolarHBondContact O-N 2.95Å; K22-G25 PolarHBondContact O-N 3.01Å; K22-I26 HydrophobicContact CB-CD1 3.64Å; K22-I26 HydrophobicContact CB-CG1 3.92Å; K22-I26 HydrophobicContact CD-CD1 4.35Å; K22-I26 HydrophobicContact CG-CD1 4.44Å; K22-I26 WeakPolarHBondContact O-CA 3.47Å; K22-I26 WeakPolarHBondContact O-CB 2.81Å; K22-I26 WeakPolarHBondContact O-CD1 3.45Å; K22-I26 WeakPolarHBondContact O-CG1 3.34Å; K22-I26 PolarHBondContact O-N 2.75Å; K22-I121 HydrophobicContact CD-CD1 3.41Å; K22-I121 VanDerWaalsContact CD-CD1 3.41Å; K22-I121 HydrophobicContact CG-CD1 3.51Å; K22-I121 HydrophobicContact CG-CG1 4.33Å
23C34.9Very low38.6Very low67 Ų6753.1 Ų53.145%0.45329%0.292SS..Hα-helixtrans-69.4-33169.7-87.60000108.2V19 L20 F27V19-C23 HydrophobicContact CG1-CB 4.49Å; V19-C23 WeakPolarHBondContact CG1-SG 3.28Å; V19-C23 VanDerWaalsContact O-CA 3.23Å; V19-C23 WeakPolarHBondContact O-CA 3.07Å; V19-C23 WeakPolarHBondContact O-CB 3.37Å; V19-C23 PolarHBondContact O-N 3.09Å; V19-C23 PolarHBondContact O-SG 2.99Å; L20-C23 PolarHBondContact O-N 3.08Å; C23-F27 WeakPolarHBondContact O-CA 3.29Å; C23-F27 WeakPolarHBondContact O-CB 3.44Å; C23-F27 PolarHBondContact O-N 2.94Å
24L40.1Very low38.6Very low10 Ų1052.6 Ų52.65%0.05229%0.287CS..Hα-helixtrans-74.4-48171.6-153.4124.1000110.5L20 K22 F27 V28 S66 H69 M70L20-L24 WeakPolarHBondContact O-CB 3.08Å; L20-L24 PolarHBondContact O-N 3.31Å; K22-L24 PolarHBondContact O-N 2.95Å; L24-F27 PolarHBondContact O-N 3.07Å; L24-V28 WeakPolarHBondContact O-CB 2.91Å; L24-V28 WeakPolarHBondContact O-CG2 3.27Å; L24-V28 PolarHBondContact O-N 3.36Å; L24-S66 VanDerWaalsContact CD1-CA 3.49Å; L24-H69 HydrophobicContact CD1-CB 3.43Å; L24-H69 VanDerWaalsContact CD1-CB 3.43Å; L24-H69 VanDerWaalsContact CD1-CG 3.47Å; L24-H69 HydrophobicContact CD2-CB 3.68Å; L24-H69 WeakPolarHBondContact CD2-CD2 3.01Å; L24-H69 HydrophobicContact CG-CB 4.06Å; L24-M70 HydrophobicContact CD2-CG 4.28Å
25G40.5Very low38.5Very low25 Ų2552 Ų5226%0.25830%0.3SS..Hα-helixtrans-64.1-47.3177.100000113.2F21 K22 V28 T29F21-G25 WeakPolarHBondContact O-CA 3.42Å; F21-G25 PolarHBondContact O-N 3.35Å; K22-G25 PolarHBondContact O-N 3.01Å; G25-V28 CarbonylContact O-C 3.44Å; G25-V28 PolarHBondContact O-N 3.1Å; G25-T29 VanDerWaalsContact C-OG1 3.3Å; G25-T29 WeakPolarHBondContact O-CA 3.41Å; G25-T29 WeakPolarHBondContact O-CB 3.45Å; G25-T29 VanDerWaalsContact O-CG2 3.3Å; G25-T29 WeakPolarHBondContact O-CG2 3.36Å; G25-T29 PolarHBondContact O-N 3.15Å; G25-T29 PolarHBondContact O-OG1 3.29Å
26I39.7Very low38.2Very low61 Ų6154.9 Ų54.931%0.31331%0.313SS..Hα-helixtrans-66.7-41.6171.6-62167000109.7K22 V28 T29 H30K22-I26 HydrophobicContact CB-CD1 3.64Å; K22-I26 HydrophobicContact CB-CG1 3.92Å; K22-I26 HydrophobicContact CD-CD1 4.35Å; K22-I26 HydrophobicContact CG-CD1 4.44Å; K22-I26 WeakPolarHBondContact O-CA 3.47Å; K22-I26 WeakPolarHBondContact O-CB 2.81Å; K22-I26 WeakPolarHBondContact O-CD1 3.45Å; K22-I26 WeakPolarHBondContact O-CG1 3.34Å; K22-I26 PolarHBondContact O-N 2.75Å; I26-V28 VanDerWaalsContact C-N 3.28Å; I26-V28 PolarHBondContact O-N 3.15Å; I26-T29 VanDerWaalsContact CA-OG1 3.29Å; I26-T29 WeakPolarHBondContact CA-OG1 3.42Å; I26-T29 PolarHBondContact O-N 3.3Å; I26-H30 WeakPolarHBondContact CG2-CD2 3.32Å; I26-H30 VanDerWaalsContact CG2-NE2 3.28Å; I26-H30 WeakPolarHBondContact CG2-NE2 3.21Å; I26-H30 WeakPolarHBondContact O-CA 3.34Å; I26-H30 WeakPolarHBondContact O-CB 3Å; I26-H30 PolarHBondContact O-CD2 3.33Å; I26-H30 VanDerWaalsContact O-CG 3.31Å; I26-H30 PolarHBondContact O-N 2.88Å
27F40.9Very low38.1Very low52 Ų5258.4 Ų58.423%0.22833%0.333CS..Hα-helixtrans-67-37174.9-172.3-97000110.6C23 L24 L31 V63C23-F27 WeakPolarHBondContact O-CA 3.29Å; C23-F27 WeakPolarHBondContact O-CB 3.44Å; C23-F27 PolarHBondContact O-N 2.94Å; L24-F27 PolarHBondContact O-N 3.07Å; F27-L31 HydrophobicContact CD1-CD1 4.38Å; F27-L31 HydrophobicContact CE1-CD1 3.51Å; F27-L31 HydrophobicContact CE2-CD1 4.32Å; F27-L31 HydrophobicContact CZ-CD1 3.46Å; F27-L31 VanDerWaalsContact CZ-CD1 3.46Å; F27-L31 WeakPolarHBondContact O-CB 3.45Å; F27-L31 PolarHBondContact O-N 3.04Å; F27-V63 HydrophobicContact CE1-CB 4.01Å; F27-V63 HydrophobicContact CE1-CG1 3.83Å; F27-V63 HydrophobicContact CE1-CG2 3.64Å; F27-V63 HydrophobicContact CE2-CG2 4.02Å; F27-V63 HydrophobicContact CZ-CB 4.1Å; F27-V63 HydrophobicContact CZ-CG1 4.11Å; F27-V63 HydrophobicContact CZ-CG2 3.23Å
28V40.8Very low37.7Very low21 Ų2159 Ų5913%0.12735%0.345CS..Hα-helixtrans-77.3-32.4179.2168.90000112.4L24 G25 I26 S32 M70L24-V28 WeakPolarHBondContact O-CB 2.91Å; L24-V28 WeakPolarHBondContact O-CG2 3.27Å; L24-V28 PolarHBondContact O-N 3.36Å; G25-V28 CarbonylContact O-C 3.44Å; G25-V28 PolarHBondContact O-N 3.1Å; I26-V28 VanDerWaalsContact C-N 3.28Å; I26-V28 PolarHBondContact O-N 3.15Å; V28-S32 WeakPolarHBondContact O-CA 3.17Å; V28-S32 WeakPolarHBondContact O-CB 3.29Å; V28-S32 PolarHBondContact O-N 3.4Å; V28-S32 PolarHBondContact O-OG 3.14Å; V28-M70 HydrophobicContact CB-CE 4.44Å; V28-M70 HydrophobicContact CB-CG 4.22Å; V28-M70 HydrophobicContact CB-SD 3.8Å; V28-M70 HydrophobicContact CG1-CE 3.33Å; V28-M70 HydrophobicContact CG1-CG 3.9Å; V28-M70 HydrophobicContact CG1-SD 3.32Å; V28-M70 WeakPolarHBondContact CG1-SD 3.28Å; V28-M70 HydrophobicContact CG2-CE 4.31Å; V28-M70 HydrophobicContact CG2-CG 3.46Å; V28-M70 VanDerWaalsContact CG2-CG 3.46Å; V28-M70 HydrophobicContact CG2-SD 3.08Å; V28-M70 WeakPolarHBondContact CG2-SD 3.41Å
29T41.1Very low38.2Very low26 Ų2662.4 Ų62.416%0.1637%0.37CS..Hα-helixtrans-81.8-37.3174.246.30000110.8G25 I26 L31 S32 V33 D34 I120G25-T29 VanDerWaalsContact C-OG1 3.3Å; G25-T29 WeakPolarHBondContact O-CA 3.41Å; G25-T29 WeakPolarHBondContact O-CB 3.45Å; G25-T29 VanDerWaalsContact O-CG2 3.3Å; G25-T29 WeakPolarHBondContact O-CG2 3.36Å; G25-T29 PolarHBondContact O-N 3.15Å; G25-T29 PolarHBondContact O-OG1 3.29Å; I26-T29 VanDerWaalsContact CA-OG1 3.29Å; I26-T29 WeakPolarHBondContact CA-OG1 3.42Å; I26-T29 PolarHBondContact O-N 3.3Å; T29-L31 VanDerWaalsContact C-N 3.26Å; T29-L31 PolarHBondContact O-N 3.02Å; T29-S32 PolarHBondContact O-N 3.34Å; T29-V33 CarbonylContact O-C 3.57Å; T29-V33 WeakPolarHBondContact O-CA 3.31Å; T29-V33 PolarHBondContact O-N 3.31Å; T29-D34 PolarHBondContact O-N 2.76Å; T29-I120 HydrophobicContact CG2-CD1 4.49Å; T29-I120 HydrophobicContact CG2-CG2 3.58Å
30H36.8Very low39.2Very low44 Ų4465.2 Ų65.220%0.20438%0.384CS..Iπ-helixtrans-58.9-38.5166.5-84.7-111.8000111.9I26 G35 L47I26-H30 WeakPolarHBondContact CG2-CD2 3.32Å; I26-H30 VanDerWaalsContact CG2-NE2 3.28Å; I26-H30 WeakPolarHBondContact CG2-NE2 3.21Å; I26-H30 WeakPolarHBondContact O-CA 3.34Å; I26-H30 WeakPolarHBondContact O-CB 3Å; I26-H30 PolarHBondContact O-CD2 3.33Å; I26-H30 VanDerWaalsContact O-CG 3.31Å; I26-H30 PolarHBondContact O-N 2.88Å; H30-G35 PolarHBondContact O-N 2.97Å; H30-G35 VanDerWaalsContact O-N 3.15Å; H30-L47 HydrophobicContact CB-CD1 4.1Å; H30-L47 WeakPolarHBondContact ND1-CD1 3.15Å
31L37.6Very low40.4Very low116 Ų11668.9 Ų68.961%0.60740%0.403SS*.Iπ-helixtrans-86.9-28.4-178.2-147.1147.5000112.9F27 T29F27-L31 HydrophobicContact CD1-CD1 4.38Å; F27-L31 HydrophobicContact CE1-CD1 3.51Å; F27-L31 HydrophobicContact CE2-CD1 4.32Å; F27-L31 HydrophobicContact CZ-CD1 3.46Å; F27-L31 VanDerWaalsContact CZ-CD1 3.46Å; F27-L31 WeakPolarHBondContact O-CB 3.45Å; F27-L31 PolarHBondContact O-N 3.04Å; T29-L31 VanDerWaalsContact C-N 3.26Å; T29-L31 PolarHBondContact O-N 3.02Å
32S41.7Very low41.5Very low75 Ų7572.5 Ų72.552%0.52442%0.422SS..Iπ-helixtrans-110.8-16.9-174.3-48.20000115.8V28 T29V28-S32 WeakPolarHBondContact O-CA 3.17Å; V28-S32 WeakPolarHBondContact O-CB 3.29Å; V28-S32 PolarHBondContact O-N 3.4Å; V28-S32 PolarHBondContact O-OG 3.14Å; T29-S32 PolarHBondContact O-N 3.34Å
33V38.9Very low42.5Very low67 Ų6774.8 Ų74.841%0.40644%0.435SS..Iπ-helixtrans-137.3-49.6-173.4-174.30000113.7T29 F36 L37T29-V33 CarbonylContact O-C 3.57Å; T29-V33 WeakPolarHBondContact O-CA 3.31Å; T29-V33 PolarHBondContact O-N 3.31Å; V33-F36 CarbonylContact O-C 3.51Å; V33-F36 PolarHBondContact O-N 2.71Å; V33-F36 VanDerWaalsContact O-N 3.1Å; V33-L37 PolarHBondContact O-N 3.23Å
34D35.9Very low43.5Very low43 Ų4376.6 Ų76.623%0.2344%0.435CS..Iπ-helixtrans-78.5-30-176.9-67.7-30.4000112.6T29 F36 L37 G38 I120T29-D34 PolarHBondContact O-N 2.76Å; D34-F36 PolarHBondContact O-N 2.86Å; D34-F36 VanDerWaalsContact O-N 3.15Å; D34-L37 PolarHBondContact O-N 2.72Å; D34-G38 PolarHBondContact O-N 3.3Å; D34-I120 WeakPolarHBondContact OD1-CD1 3.49Å; D34-I120 WeakPolarHBondContact OD2-CD1 3.08Å
35G38.9Very low44.7Very low70 Ų7080.3 Ų80.372%0.72246%0.456SS*.Hα-helixtrans-60.2-20165.500000113.4H30H30-G35 PolarHBondContact O-N 2.97Å; H30-G35 VanDerWaalsContact O-N 3.15Å
36F32.6Very low45.7Very low175 Ų17582.1 Ų82.177%0.76846%0.464SS*.Hα-helixtrans-105.2-25.7179.8-163.4-110.9000113.8V33 D34V33-F36 CarbonylContact O-C 3.51Å; V33-F36 PolarHBondContact O-N 2.71Å; V33-F36 VanDerWaalsContact O-N 3.1Å; D34-F36 PolarHBondContact O-N 2.86Å; D34-F36 VanDerWaalsContact O-N 3.15Å
37L33Very low46.6Very low139 Ų13982.2 Ų82.273%0.72847%0.465SS*.Hα-helixtrans-133.617.9-170.2-70.6178000118.3V33 D34V33-L37 PolarHBondContact O-N 3.23Å; D34-L37 PolarHBondContact O-N 2.72Å
38G36.4Very low47.5Very low44 Ų4485 Ų8545%0.45448%0.477SS..  trans130.7174.5152.100000115.7D34D34-G38 PolarHBondContact O-N 3.3Å
39S46.4Very low48.6Very low92 Ų9289.7 Ų89.764%0.64350%0.497SS*.  cis-152.27.2-27.953.60000110.7
40D55.8Low49.4Very low99 Ų9992.5 Ų92.553%0.52951%0.514SS..  trans-106.8121.6-165.8-66.6-6.5000110.4E42 D43D40-E42 PolarHBondContact O-N 2.94Å; D40-D43 PolarHBondContact O-N 3.41Å
41D60Low50.5Low107 Ų10794.3 Ų94.357%0.57253%0.525SS*.Hα-helixtrans-66.3-23.6-175.5-70.1-35.3000112.5D43 K44 D45D41-D43 PolarHBondContact O-N 3.33Å; D41-K44 PolarHBondContact O-N 2.85Å; D41-K44 IonicContact OD1-NZ 2.84Å; D41-K44 PolarHBondContact OD1-NZ 3.23Å; D41-D45 PolarHBondContact O-N 2.77Å
42E61.6Low51.9Low158 Ų15895.6 Ų95.674%0.73853%0.532SS*.Hα-helixtrans-65.9-36.3177-163.7167.5-163.300112.5D40 S46D40-E42 PolarHBondContact O-N 2.94Å; E42-S46 WeakPolarHBondContact O-CB 3.32Å; E42-S46 PolarHBondContact O-N 2.7Å; E42-S46 PolarHBondContact O-OG 3.25Å
43D59.3Low53.2Low79 Ų7997.8 Ų97.842%0.42254%0.538SS..Hα-helixtrans-70.5-38.5175.5-80-22.5000111.3D40 D41 L47D40-D43 PolarHBondContact O-N 3.41Å; D41-D43 PolarHBondContact O-N 3.33Å; D43-L47 WeakPolarHBondContact O-CB 3.05Å; D43-L47 PolarHBondContact O-N 3.02Å
44K54.9Low54.6Low105 Ų10596.6 Ų96.646%0.45753%0.531SS..Hα-helixtrans-65.8-42175.3-62.1178.1-162.3147.70111.2D41 L47 K48D41-K44 PolarHBondContact O-N 2.85Å; D41-K44 IonicContact OD1-NZ 2.84Å; D41-K44 PolarHBondContact OD1-NZ 3.23Å; K44-L47 PolarHBondContact O-N 3.41Å; K44-K48 VanDerWaalsContact O-CG 3.32Å; K44-K48 WeakPolarHBondContact O-CG 3.34Å; K44-K48 PolarHBondContact O-N 3.47Å
45D66Low56.6Low89 Ų8999 Ų9948%0.47654%0.544SS..Hα-helixtrans-72.8-37.9-179.1-78-8.8000111.9D41 L47 K48 Q49D41-D45 PolarHBondContact O-N 2.77Å; D45-L47 VanDerWaalsContact C-N 3.31Å; D45-L47 PolarHBondContact O-N 3.28Å; D45-K48 PolarHBondContact O-N 2.91Å; D45-K48 IonicContact OD1-NZ 2.84Å; D45-K48 PolarHBondContact OD1-NZ 2.79Å; D45-Q49 WeakPolarHBondContact O-CB 2.92Å; D45-Q49 PolarHBondContact O-N 3.22Å
46S61.8Low58.4Low62 Ų62100.1 Ų100.143%0.43454%0.538SS..Hα-helixtrans-61.2-39.1171.2-61.60000112.2E42 T50E42-S46 WeakPolarHBondContact O-CB 3.32Å; E42-S46 PolarHBondContact O-N 2.7Å; E42-S46 PolarHBondContact O-OG 3.25Å; S46-T50 WeakPolarHBondContact O-CB 3.11Å; S46-T50 PolarHBondContact O-N 2.67Å; S46-T50 PolarHBondContact O-OG1 3.49Å
47L57.4Low60.7Low63 Ų63101 Ų10133%0.3354%0.538SS..Hα-helixtrans-67.2-46175.5-173.9149.6000111.4H30 D43 K44 D45 Q49 T50 L51H30-L47 HydrophobicContact CB-CD1 4.1Å; H30-L47 WeakPolarHBondContact ND1-CD1 3.15Å; D43-L47 WeakPolarHBondContact O-CB 3.05Å; D43-L47 PolarHBondContact O-N 3.02Å; K44-L47 PolarHBondContact O-N 3.41Å; D45-L47 VanDerWaalsContact C-N 3.31Å; D45-L47 PolarHBondContact O-N 3.28Å; L47-Q49 VanDerWaalsContact C-N 3.33Å; L47-Q49 PolarHBondContact O-N 2.9Å; L47-T50 PolarHBondContact O-N 2.66Å; L47-L51 HydrophobicContact CD2-CD1 3.52Å; L47-L51 HydrophobicContact CD2-CG 4.03Å; L47-L51 WeakPolarHBondContact O-CG 3.13Å; L47-L51 PolarHBondContact O-N 2.53Å
48K60.5Low62.5Low110 Ų11097.7 Ų97.748%0.47852%0.521SS..Hα-helixtrans-59.2-44.9175.3-73.5174.2-158.9154.80111.5K44 D45 T50 L51 L52K44-K48 VanDerWaalsContact O-CG 3.32Å; K44-K48 WeakPolarHBondContact O-CG 3.34Å; K44-K48 PolarHBondContact O-N 3.47Å; D45-K48 PolarHBondContact O-N 2.91Å; D45-K48 IonicContact OD1-NZ 2.84Å; D45-K48 PolarHBondContact OD1-NZ 2.79Å; K48-T50 VanDerWaalsContact C-N 3.32Å; K48-T50 PolarHBondContact O-N 2.72Å; K48-L51 PolarHBondContact O-N 3.06Å; K48-L52 WeakPolarHBondContact O-CB 3.36Å; K48-L52 VanDerWaalsContact O-CG 3.3Å; K48-L52 WeakPolarHBondContact O-CG 3.47Å; K48-L52 PolarHBondContact O-N 3.16Å
49Q64.6Low64.1Low120 Ų12097.7 Ų97.756%0.56151%0.51SS*.Hα-helixtrans-60.9-44.5178.4-175.3169.8400110.9D45 L47 L51 L52 D53D45-Q49 WeakPolarHBondContact O-CB 2.92Å; D45-Q49 PolarHBondContact O-N 3.22Å; L47-Q49 VanDerWaalsContact C-N 3.33Å; L47-Q49 PolarHBondContact O-N 2.9Å; Q49-L51 VanDerWaalsContact C-N 3.33Å; Q49-L51 PolarHBondContact O-N 3.34Å; Q49-L52 PolarHBondContact O-N 3.41Å; Q49-D53 VanDerWaalsContact CG-OD2 3.24Å; Q49-D53 WeakPolarHBondContact CG-OD2 2.75Å; Q49-D53 PolarHBondContact NE2-OD2 2.75Å; Q49-D53 WeakPolarHBondContact O-CB 2.9Å; Q49-D53 PolarHBondContact O-N 3.44Å
50T58Low65.6Low85 Ų8595.9 Ų95.952%0.52150%0.501SS..Hα-helixtrans-61.6-40.4176.1-55.10000112.1S46 L47 K48 T54S46-T50 WeakPolarHBondContact O-CB 3.11Å; S46-T50 PolarHBondContact O-N 2.67Å; S46-T50 PolarHBondContact O-OG1 3.49Å; L47-T50 PolarHBondContact O-N 2.66Å; K48-T50 VanDerWaalsContact C-N 3.32Å; K48-T50 PolarHBondContact O-N 2.72Å; T50-T54 VanDerWaalsContact O-CB 3.23Å; T50-T54 WeakPolarHBondContact O-CB 3.36Å; T50-T54 PolarHBondContact O-N 3.42Å; T50-T54 PolarHBondContact O-OG1 2.79Å
51L59.4Low66.6Low82 Ų8294.9 Ų94.943%0.42950%0.495SS..Hα-helixtrans-64.9-37.6176.1-71.9178.6000112.7L47 K48 Q49 L59L47-L51 HydrophobicContact CD2-CD1 3.52Å; L47-L51 HydrophobicContact CD2-CG 4.03Å; L47-L51 WeakPolarHBondContact O-CG 3.13Å; L47-L51 PolarHBondContact O-N 2.53Å; K48-L51 PolarHBondContact O-N 3.06Å; Q49-L51 VanDerWaalsContact C-N 3.33Å; Q49-L51 PolarHBondContact O-N 3.34Å; L51-L59 HydrophobicContact CD2-CD1 3.64Å; L51-L59 HydrophobicContact CD2-CD2 3.4Å; L51-L59 VanDerWaalsContact CD2-CD2 3.4Å; L51-L59 HydrophobicContact CD2-CG 4.1Å
52L66.9Low67.2Low143 Ų14391.9 Ų91.975%0.74948%0.481SS*.Hα-helixtrans-78.8-39.4-177.9-71.6171.3000112.6K48 Q49K48-L52 WeakPolarHBondContact O-CB 3.36Å; K48-L52 VanDerWaalsContact O-CG 3.3Å; K48-L52 WeakPolarHBondContact O-CG 3.47Å; K48-L52 PolarHBondContact O-N 3.16Å; Q49-L52 PolarHBondContact O-N 3.41Å
53D69.7Low67.9Low121 Ų12186.1 Ų86.165%0.64746%0.456SS*.Hα-helixtrans-81.2-15.9-175-69.2-17000112.9Q49Q49-D53 VanDerWaalsContact CG-OD2 3.24Å; Q49-D53 WeakPolarHBondContact CG-OD2 2.75Å; Q49-D53 PolarHBondContact NE2-OD2 2.75Å; Q49-D53 WeakPolarHBondContact O-CB 2.9Å; Q49-D53 PolarHBondContact O-N 3.44Å
54T68.5Low68.8Low42 Ų4286.1 Ų86.126%0.25846%0.459SS..SBendtrans-96.4141.1-175.1-54.50000112.5T50 L58 L59T50-T54 VanDerWaalsContact O-CB 3.23Å; T50-T54 WeakPolarHBondContact O-CB 3.36Å; T50-T54 PolarHBondContact O-N 3.42Å; T50-T54 PolarHBondContact O-OG1 2.79Å; T54-L58 HydrophobicContact CG2-CB 4.36Å; T54-L58 HydrophobicContact CG2-CD2 3.79Å; T54-L59 HydrophobicContact CG2-CB 4.26Å; T54-L59 HydrophobicContact CG2-CD1 4.29Å
55N77.2Confident69.9Low94 Ų9481.9 Ų81.950%0.50344%0.442SS..  trans-56.8125.2172.1-178.3-26.1000110.3Y57 L58 L59N55-Y57 PolarHBondContact O-N 3.4Å; N55-Y57 VanDerWaalsContact O-N 3.1Å; N55-Y57 WeakPolarHBondContact OD1-CD2 3.06Å; N55-Y57 PolarHBondContact OD1-N 2.7Å; N55-Y57 VanDerWaalsContact OD1-N 3.1Å; N55-L58 HydrophobicContact CB-CB 4.32Å; N55-L58 PolarHBondContact O-N 3.42Å; N55-L59 PolarHBondContact O-N 3.43Å
56P77.7Confident70.2Confident93 Ų9377.9 Ų77.960%0.60442%0.42SS*.Hα-helixtrans-56.2-32.9-174.721.1-34.4000113.7A60P56-A60 WeakPolarHBondContact O-CB 2.87Å; P56-A60 PolarHBondContact O-N 2.87Å
57Y79.5Confident71.1Confident195 Ų19579.2 Ų79.277%0.76542%0.422SS*.Hα-helixtrans-67.9-40.5176.6-66.9-76.4000112.4N55 L61N55-Y57 PolarHBondContact O-N 3.4Å; N55-Y57 VanDerWaalsContact O-N 3.1Å; N55-Y57 WeakPolarHBondContact OD1-CD2 3.06Å; N55-Y57 PolarHBondContact OD1-N 2.7Å; N55-Y57 VanDerWaalsContact OD1-N 3.1Å; Y57-L61 WeakPolarHBondContact O-CB 3.21Å; Y57-L61 PolarHBondContact O-N 3.47Å; Y57-L61 VanDerWaalsContact O-N 3.11Å
58L72Confident72.3Confident69 Ų6979.7 Ų79.736%0.36143%0.425SS..Hα-helixtrans-68.3-41.1177.8-170.4147.5000110.1T54 N55 L61 T62T54-L58 HydrophobicContact CG2-CB 4.36Å; T54-L58 HydrophobicContact CG2-CD2 3.79Å; N55-L58 HydrophobicContact CB-CB 4.32Å; N55-L58 PolarHBondContact O-N 3.42Å; L58-L61 PolarHBondContact O-N 2.9Å; L58-T62 PolarHBondContact O-N 2.81Å; L58-T62 PolarHBondContact O-OG1 2.58Å
59L70.1Confident73.2Confident43 Ų4374.6 Ų74.623%0.22540%0.403CS..Hα-helixtrans-61.1-51.4177.2-166109.8000111.9L51 T54 N55 L61 T62 V63L51-L59 HydrophobicContact CD2-CD1 3.64Å; L51-L59 HydrophobicContact CD2-CD2 3.4Å; L51-L59 VanDerWaalsContact CD2-CD2 3.4Å; L51-L59 HydrophobicContact CD2-CG 4.1Å; T54-L59 HydrophobicContact CG2-CB 4.26Å; T54-L59 HydrophobicContact CG2-CD1 4.29Å; N55-L59 PolarHBondContact O-N 3.43Å; L59-L61 VanDerWaalsContact C-N 3.26Å; L59-L61 PolarHBondContact O-N 3.2Å; L59-T62 WeakPolarHBondContact O-CB 3.23Å; L59-T62 PolarHBondContact O-N 3.41Å; L59-T62 VanDerWaalsContact O-N 3.09Å; L59-V63 WeakPolarHBondContact O-CG2 3.44Å; L59-V63 PolarHBondContact O-N 3.22Å
60A76.5Confident73.7Confident55 Ų5571.8 Ų71.846%0.45539%0.39SS..Hα-helixtrans-57.7-40.7178.400000111.9P56 V63 V64P56-A60 WeakPolarHBondContact O-CB 2.87Å; P56-A60 PolarHBondContact O-N 2.87Å; A60-V63 PolarHBondContact O-N 3.25Å; A60-V64 WeakPolarHBondContact O-CG2 3.02Å; A60-V64 PolarHBondContact O-N 2.64Å; A60-V64 VanDerWaalsContact O-N 3.08Å
61L76.8Confident75Confident77 Ų7771.3 Ų71.340%0.40339%0.387SS..Hα-helixtrans-62-47.1174.6179.364.1000111.6Y57 L58 L59 V63 V64 V65 F259Y57-L61 WeakPolarHBondContact O-CB 3.21Å; Y57-L61 PolarHBondContact O-N 3.47Å; Y57-L61 VanDerWaalsContact O-N 3.11Å; L58-L61 PolarHBondContact O-N 2.9Å; L59-L61 VanDerWaalsContact C-N 3.26Å; L59-L61 PolarHBondContact O-N 3.2Å; L61-V63 VanDerWaalsContact C-N 3.29Å; L61-V63 PolarHBondContact O-N 2.58Å; L61-V64 PolarHBondContact O-N 3.13Å; L61-V65 HydrophobicContact CD1-CG2 4.21Å; L61-V65 WeakPolarHBondContact O-CB 3.14Å; L61-V65 VanDerWaalsContact O-CG2 3.3Å; L61-V65 WeakPolarHBondContact O-CG2 3.23Å; L61-V65 PolarHBondContact O-N 3.07Å; L61-F259 HydrophobicContact CD1-CZ 3.98Å; L61-F259 HydrophobicContact CD2-CE1 3.93Å; L61-F259 HydrophobicContact CD2-CZ 3.89Å; L61-F259 HydrophobicContact CG-CE1 3.87Å; L61-F259 HydrophobicContact CG-CZ 3.66Å
62T72.4Confident76.3Confident45 Ų4569.3 Ų69.328%0.27638%0.375SS..Hα-helixtrans-59-39.2176.8-580000112L58 L59 S66L58-T62 PolarHBondContact O-N 2.81Å; L58-T62 PolarHBondContact O-OG1 2.58Å; L59-T62 WeakPolarHBondContact O-CB 3.23Å; L59-T62 PolarHBondContact O-N 3.41Å; L59-T62 VanDerWaalsContact O-N 3.09Å; T62-S66 VanDerWaalsContact O-CB 3.29Å; T62-S66 WeakPolarHBondContact O-CB 3.3Å; T62-S66 PolarHBondContact O-N 3.22Å; T62-S66 PolarHBondContact O-OG 2.9Å
63V75.9Confident76.9Confident36 Ų3666 Ų6622%0.21836%0.356CS..Hα-helixtrans-61.2-52.9174.71730000111.3F27 L59 A60 L61 V65 S66 L67F27-V63 HydrophobicContact CE1-CB 4.01Å; F27-V63 HydrophobicContact CE1-CG1 3.83Å; F27-V63 HydrophobicContact CE1-CG2 3.64Å; F27-V63 HydrophobicContact CE2-CG2 4.02Å; F27-V63 HydrophobicContact CZ-CB 4.1Å; F27-V63 HydrophobicContact CZ-CG1 4.11Å; F27-V63 HydrophobicContact CZ-CG2 3.23Å; L59-V63 WeakPolarHBondContact O-CG2 3.44Å; L59-V63 PolarHBondContact O-N 3.22Å; A60-V63 PolarHBondContact O-N 3.25Å; L61-V63 VanDerWaalsContact C-N 3.29Å; L61-V63 PolarHBondContact O-N 2.58Å; V63-V65 VanDerWaalsContact C-N 3.25Å; V63-V65 PolarHBondContact O-N 2.52Å; V63-S66 WeakPolarHBondContact O-CB 3.43Å; V63-S66 PolarHBondContact O-N 2.87Å; V63-S66 VanDerWaalsContact O-N 3.14Å; V63-L67 HydrophobicContact CG1-CD1 4.32Å; V63-L67 WeakPolarHBondContact O-CG 3.2Å; V63-L67 PolarHBondContact O-N 3.19Å
64V79.4Confident77.5Confident80 Ų8066.4 Ų66.449%0.48535%0.352SS..Hα-helixtrans-58.7-42.5-177.9169.30000110.8A60 L61 L67 L68A60-V64 WeakPolarHBondContact O-CG2 3.02Å; A60-V64 PolarHBondContact O-N 2.64Å; A60-V64 VanDerWaalsContact O-N 3.08Å; L61-V64 PolarHBondContact O-N 3.13Å; V64-L67 PolarHBondContact O-N 3.02Å; V64-L68 HydrophobicContact CG1-CD1 4.24Å; V64-L68 WeakPolarHBondContact O-CG 3.28Å; V64-L68 PolarHBondContact O-N 3.13Å
65V77.9Confident78.4Confident16 Ų1666.6 Ų66.610%0.09735%0.351CS..Hα-helixtrans-69.6-37.7179.1165.10000112.1L61 V63 L67 L68 H69 I255 F259L61-V65 HydrophobicContact CD1-CG2 4.21Å; L61-V65 WeakPolarHBondContact O-CB 3.14Å; L61-V65 VanDerWaalsContact O-CG2 3.3Å; L61-V65 WeakPolarHBondContact O-CG2 3.23Å; L61-V65 PolarHBondContact O-N 3.07Å; V63-V65 VanDerWaalsContact C-N 3.25Å; V63-V65 PolarHBondContact O-N 2.52Å; V65-L67 VanDerWaalsContact C-N 3.27Å; V65-L67 PolarHBondContact O-N 3.34Å; V65-L68 PolarHBondContact O-N 3.21Å; V65-H69 WeakPolarHBondContact O-CB 3.22Å; V65-H69 PolarHBondContact O-N 3.3Å; V65-I255 HydrophobicContact CG1-CG2 3.5Å; V65-F259 HydrophobicContact CB-CD2 4.47Å; V65-F259 HydrophobicContact CB-CE1 4.35Å; V65-F259 HydrophobicContact CB-CE2 3.83Å; V65-F259 HydrophobicContact CB-CZ 3.77Å; V65-F259 HydrophobicContact CG1-CD2 3.68Å; V65-F259 HydrophobicContact CG1-CE1 4.33Å; V65-F259 HydrophobicContact CG1-CE2 3.51Å; V65-F259 HydrophobicContact CG1-CG 4.24Å; V65-F259 HydrophobicContact CG1-CZ 3.87Å; V65-F259 HydrophobicContact CG2-CD2 4.23Å; V65-F259 HydrophobicContact CG2-CE1 4.08Å; V65-F259 HydrophobicContact CG2-CE2 3.2Å; V65-F259 HydrophobicContact CG2-CZ 3.1Å
66S72.4Confident78.7Confident4 Ų462.7 Ų62.73%0.02833%0.332CS..Hα-helixtrans-58.2-44.1173.4-60.90000111.7L24 T62 V63 M70L24-S66 VanDerWaalsContact CD1-CA 3.49Å; T62-S66 VanDerWaalsContact O-CB 3.29Å; T62-S66 WeakPolarHBondContact O-CB 3.3Å; T62-S66 PolarHBondContact O-N 3.22Å; T62-S66 PolarHBondContact O-OG 2.9Å; V63-S66 WeakPolarHBondContact O-CB 3.43Å; V63-S66 PolarHBondContact O-N 2.87Å; V63-S66 VanDerWaalsContact O-N 3.14Å; S66-M70 WeakPolarHBondContact O-CG 3.16Å; S66-M70 PolarHBondContact O-N 3.22Å
67L79.7Confident78.9Confident90 Ų9062.2 Ų62.247%0.47132%0.321SS..Hα-helixtrans-64.5-43.7175.3-65.1172.7000112.4V63 V64 V65 M70 V71V63-L67 HydrophobicContact CG1-CD1 4.32Å; V63-L67 WeakPolarHBondContact O-CG 3.2Å; V63-L67 PolarHBondContact O-N 3.19Å; V64-L67 PolarHBondContact O-N 3.02Å; V65-L67 VanDerWaalsContact C-N 3.27Å; V65-L67 PolarHBondContact O-N 3.34Å; L67-M70 HydrophobicContact CD2-SD 4.08Å; L67-M70 WeakPolarHBondContact O-CB 3.39Å; L67-M70 PolarHBondContact O-N 3.39Å; L67-V71 VanDerWaalsContact O-CG2 3.31Å; L67-V71 WeakPolarHBondContact O-CG2 3.35Å; L67-V71 PolarHBondContact O-N 2.93Å
68L82.6Confident79.1Confident74 Ų7458 Ų5839%0.38731%0.306SS..Hα-helixtrans-62.8-44.5178.2-75.4173.9000112V64 V65 V71 F72 I255V64-L68 HydrophobicContact CG1-CD1 4.24Å; V64-L68 WeakPolarHBondContact O-CG 3.28Å; V64-L68 PolarHBondContact O-N 3.13Å; V65-L68 PolarHBondContact O-N 3.21Å; L68-V71 PolarHBondContact O-N 3.16Å; L68-V71 VanDerWaalsContact O-N 3.16Å; L68-F72 HydrophobicContact CB-CD2 4.48Å; L68-F72 HydrophobicContact CB-CE2 4.15Å; L68-F72 HydrophobicContact CD2-CE2 4.43Å; L68-F72 WeakPolarHBondContact O-CD2 3.48Å; L68-F72 WeakPolarHBondContact O-CG 3.27Å; L68-F72 PolarHBondContact O-N 3.01Å; L68-I255 HydrophobicContact CB-CD1 4.41Å
69H79.2Confident79.8Confident3 Ų355.6 Ų55.61%0.01429%0.294CS..Hα-helixtrans-61.4-44.4177.7-171.2114.9000111L24 V65 V71 F72 E73 N252 D256L24-H69 HydrophobicContact CD1-CB 3.43Å; L24-H69 VanDerWaalsContact CD1-CB 3.43Å; L24-H69 VanDerWaalsContact CD1-CG 3.47Å; L24-H69 HydrophobicContact CD2-CB 3.68Å; L24-H69 WeakPolarHBondContact CD2-CD2 3.01Å; L24-H69 HydrophobicContact CG-CB 4.06Å; V65-H69 WeakPolarHBondContact O-CB 3.22Å; V65-H69 PolarHBondContact O-N 3.3Å; H69-V71 VanDerWaalsContact C-N 3.29Å; H69-V71 PolarHBondContact O-N 2.83Å; H69-F72 PolarHBondContact O-N 2.83Å; H69-E73 WeakPolarHBondContact O-CB 3.15Å; H69-E73 PolarHBondContact O-N 3.19Å; H69-N252 WeakPolarHBondContact CA-OD1 3.15Å; H69-N252 PolarHBondContact CD2-ND2 3.36Å; H69-N252 PolarHBondContact CD2-OD1 2.92Å; H69-N252 PolarHBondContact CE1-ND2 2.75Å; H69-N252 VanDerWaalsContact CE1-ND2 3.26Å; H69-N252 PolarHBondContact CE1-OD1 3.04Å; H69-N252 PolarHBondContact ND1-OD1 3.48Å; H69-N252 PolarHBondContact NE2-ND2 3.01Å; H69-N252 PolarHBondContact NE2-OD1 3.34Å; H69-N252 PolarHBondContact O-OD1 3.24Å; H69-D256 IonicContact CE1-OD1 2.86Å; H69-D256 PolarHBondContact CE1-OD1 3.46Å; H69-D256 VanDerWaalsContact CE1-OD1 3.22Å; H69-D256 IonicContact CE1-OD2 3.84Å; H69-D256 PolarHBondContact CE1-OD2 3.05Å; H69-D256 IonicContact ND1-OD1 2.71Å; H69-D256 PolarHBondContact ND1-OD1 2.84Å; H69-D256 VanDerWaalsContact ND1-OD1 3.13Å
70M77.1Confident80.6Confident60 Ų6054.1 Ų54.130%0.29629%0.286SS..Hα-helixtrans-56.3-45172.7-69.4169.967.300112.3L24 V28 S66 L67 E73 F74L24-M70 HydrophobicContact CD2-CG 4.28Å; V28-M70 HydrophobicContact CB-CE 4.44Å; V28-M70 HydrophobicContact CB-CG 4.22Å; V28-M70 HydrophobicContact CB-SD 3.8Å; V28-M70 HydrophobicContact CG1-CE 3.33Å; V28-M70 HydrophobicContact CG1-CG 3.9Å; V28-M70 HydrophobicContact CG1-SD 3.32Å; V28-M70 WeakPolarHBondContact CG1-SD 3.28Å; V28-M70 HydrophobicContact CG2-CE 4.31Å; V28-M70 HydrophobicContact CG2-CG 3.46Å; V28-M70 VanDerWaalsContact CG2-CG 3.46Å; V28-M70 HydrophobicContact CG2-SD 3.08Å; V28-M70 WeakPolarHBondContact CG2-SD 3.41Å; S66-M70 WeakPolarHBondContact O-CG 3.16Å; S66-M70 PolarHBondContact O-N 3.22Å; L67-M70 HydrophobicContact CD2-SD 4.08Å; L67-M70 WeakPolarHBondContact O-CB 3.39Å; L67-M70 PolarHBondContact O-N 3.39Å; M70-E73 PolarHBondContact O-N 3.31Å; M70-F74 VanDerWaalsContact O-CB 3.27Å; M70-F74 WeakPolarHBondContact O-CB 3.4Å; M70-F74 PolarHBondContact O-N 2.84Å
71V83.9Confident81Confident76 Ų7653.1 Ų53.146%0.46127%0.273SS..Hα-helixtrans-63.8-46.2-178.3168.70000109.6L67 L68 H69 F74 L75L67-V71 VanDerWaalsContact O-CG2 3.31Å; L67-V71 WeakPolarHBondContact O-CG2 3.35Å; L67-V71 PolarHBondContact O-N 2.93Å; L68-V71 PolarHBondContact O-N 3.16Å; L68-V71 VanDerWaalsContact O-N 3.16Å; H69-V71 VanDerWaalsContact C-N 3.29Å; H69-V71 PolarHBondContact O-N 2.83Å; V71-F74 PolarHBondContact O-N 3.36Å; V71-L75 HydrophobicContact CG1-CD1 3.85Å; V71-L75 HydrophobicContact CG1-CG 4.38Å; V71-L75 WeakPolarHBondContact O-CB 3.31Å; V71-L75 WeakPolarHBondContact O-CG 3.25Å; V71-L75 PolarHBondContact O-N 3.13Å
72F86.7Confident81.5Confident39 Ų3952.5 Ų52.517%0.17127%0.269CS..Hα-helixtrans-66.7-39.9178.4-67-46.6000112.6L68 H69 L75 A76 Y248 L251 N252 I255L68-F72 HydrophobicContact CB-CD2 4.48Å; L68-F72 HydrophobicContact CB-CE2 4.15Å; L68-F72 HydrophobicContact CD2-CE2 4.43Å; L68-F72 WeakPolarHBondContact O-CD2 3.48Å; L68-F72 WeakPolarHBondContact O-CG 3.27Å; L68-F72 PolarHBondContact O-N 3.01Å; H69-F72 PolarHBondContact O-N 2.83Å; F72-L75 PolarHBondContact O-N 3.14Å; F72-A76 VanDerWaalsContact O-CB 3.3Å; F72-A76 WeakPolarHBondContact O-CB 3.28Å; F72-A76 PolarHBondContact O-N 3.31Å; F72-Y248 HydrophobicContact CD1-CD1 4.06Å; F72-L251 HydrophobicContact CD1-CB 4.4Å; F72-L251 HydrophobicContact CD1-CD1 4.23Å; F72-L251 HydrophobicContact CD2-CB 4.26Å; F72-L251 HydrophobicContact CE1-CD1 3.89Å; F72-L251 HydrophobicContact CE2-CB 4.42Å; F72-L251 HydrophobicContact CG-CB 4.27Å; F72-L251 HydrophobicContact CZ-CD1 4.26Å; F72-N252 HydrophobicContact CB-CB 4.41Å; F72-I255 HydrophobicContact CD2-CD1 3.64Å; F72-I255 HydrophobicContact CE2-CD1 3.47Å; F72-I255 VanDerWaalsContact CE2-CD1 3.47Å
73E80.5Confident82.2Confident75 Ų7552.1 Ų52.135%0.3526%0.263SS..Hα-helixtrans-63-47.4174.8-176.2170.7-159.500111.6F21 H69 M70 L75 A76 F77F21-E73 VanDerWaalsContact CE2-CD 3.5Å; F21-E73 WeakPolarHBondContact CE2-OE1 3.5Å; F21-E73 VanDerWaalsContact CE2-OE2 3.23Å; F21-E73 WeakPolarHBondContact CE2-OE2 3.5Å; F21-E73 WeakPolarHBondContact CZ-OE1 3.42Å; F21-E73 WeakPolarHBondContact CZ-OE2 3.43Å; H69-E73 WeakPolarHBondContact O-CB 3.15Å; H69-E73 PolarHBondContact O-N 3.19Å; M70-E73 PolarHBondContact O-N 3.31Å; E73-L75 VanDerWaalsContact C-N 3.31Å; E73-L75 PolarHBondContact O-N 3.33Å; E73-A76 PolarHBondContact O-N 3.29Å; E73-F77 VanDerWaalsContact O-CB 3.23Å; E73-F77 WeakPolarHBondContact O-CB 3.3Å; E73-F77 PolarHBondContact O-N 3Å
74F82.6Confident82.8Confident129 Ų12951.6 Ų51.657%0.56626%0.257SS*.Hα-helixtrans-60.1-42.3175.9176.3-103.3000111.8M70 V71 F77 K78M70-F74 VanDerWaalsContact O-CB 3.27Å; M70-F74 WeakPolarHBondContact O-CB 3.4Å; M70-F74 PolarHBondContact O-N 2.84Å; V71-F74 PolarHBondContact O-N 3.36Å; F74-F77 PolarHBondContact O-N 3.35Å; F74-K78 HydrophobicContact CE1-CD 4.23Å; F74-K78 HydrophobicContact CZ-CD 4.45Å; F74-K78 WeakPolarHBondContact O-CB 3.18Å; F74-K78 PolarHBondContact O-N 3.18Å
75L85.8Confident83Confident45 Ų4556 Ų5624%0.23627%0.265CS..Hα-helixtrans-65.5-43.1175.9-72.9173.6000111.6V71 F72 E73 F77 K78 N79 Y248V71-L75 HydrophobicContact CG1-CD1 3.85Å; V71-L75 HydrophobicContact CG1-CG 4.38Å; V71-L75 WeakPolarHBondContact O-CB 3.31Å; V71-L75 WeakPolarHBondContact O-CG 3.25Å; V71-L75 PolarHBondContact O-N 3.13Å; F72-L75 PolarHBondContact O-N 3.14Å; E73-L75 VanDerWaalsContact C-N 3.31Å; E73-L75 PolarHBondContact O-N 3.33Å; L75-F77 VanDerWaalsContact C-N 3.35Å; L75-K78 PolarHBondContact O-N 3.25Å; L75-N79 WeakPolarHBondContact O-CB 3.35Å; L75-N79 PolarHBondContact O-N 3.25Å; L75-N79 PolarHBondContact O-ND2 3.41Å; L75-Y248 HydrophobicContact CB-CD1 4.06Å; L75-Y248 HydrophobicContact CB-CD2 3.73Å; L75-Y248 HydrophobicContact CB-CE1 4.24Å; L75-Y248 HydrophobicContact CB-CE2 3.95Å; L75-Y248 HydrophobicContact CB-CG 3.82Å; L75-Y248 HydrophobicContact CD1-CD1 4.18Å; L75-Y248 HydrophobicContact CD1-CE1 3.86Å
76A83.3Confident83.3Confident13 Ų1362.6 Ų62.611%0.10729%0.293CS..Hα-helixtrans-59-49.5175.800000110.3F72 E73 N79 D80 M245F72-A76 VanDerWaalsContact O-CB 3.3Å; F72-A76 WeakPolarHBondContact O-CB 3.28Å; F72-A76 PolarHBondContact O-N 3.31Å; E73-A76 PolarHBondContact O-N 3.29Å; A76-N79 PolarHBondContact O-N 3.11Å; A76-D80 WeakPolarHBondContact O-CB 3.33Å; A76-D80 PolarHBondContact O-N 3.45Å; A76-M245 WeakPolarHBondContact O-CG 3.49Å
77F83.2Confident83.8Confident82 Ų8265.3 Ų65.336%0.3630%0.302SS..Hα-helixtrans-59.7-49.9178.5178.7-109000112.8E73 F74 L75 N79 D80 I81 I131E73-F77 VanDerWaalsContact O-CB 3.23Å; E73-F77 WeakPolarHBondContact O-CB 3.3Å; E73-F77 PolarHBondContact O-N 3Å; F74-F77 PolarHBondContact O-N 3.35Å; L75-F77 VanDerWaalsContact C-N 3.35Å; F77-N79 VanDerWaalsContact C-N 3.33Å; F77-N79 PolarHBondContact O-N 3.23Å; F77-D80 WeakPolarHBondContact O-CB 3.41Å; F77-D80 PolarHBondContact O-N 3.38Å; F77-I81 HydrophobicContact CD1-CD1 4.17Å; F77-I81 HydrophobicContact CD2-CD1 4.42Å; F77-I81 HydrophobicContact CE1-CD1 3.44Å; F77-I81 VanDerWaalsContact CE1-CD1 3.44Å; F77-I81 HydrophobicContact CE2-CD1 3.7Å; F77-I81 HydrophobicContact CE2-CG1 4.28Å; F77-I81 HydrophobicContact CZ-CD1 3.16Å; F77-I81 HydrophobicContact CZ-CG1 4.2Å; F77-I81 PolarHBondContact O-N 2.88Å; F77-I81 VanDerWaalsContact O-N 3.07Å; F77-I131 HydrophobicContact CD2-CD1 4.48Å; F77-I131 HydrophobicContact CE2-CB 4.26Å; F77-I131 HydrophobicContact CE2-CD1 3.22Å; F77-I131 HydrophobicContact CE2-CG1 3.7Å; F77-I131 HydrophobicContact CE2-CG2 4.01Å; F77-I131 HydrophobicContact CZ-CD1 3.27Å; F77-I131 HydrophobicContact CZ-CG1 3.78Å
78K84.2Confident83.9Confident106 Ų10667.8 Ų67.846%0.46131%0.312SS..Hα-helixtrans-60.1-42.6177.3179.2-178.1176.6-178.50111.8F74 L75 M82F74-K78 HydrophobicContact CE1-CD 4.23Å; F74-K78 HydrophobicContact CZ-CD 4.45Å; F74-K78 WeakPolarHBondContact O-CB 3.18Å; F74-K78 PolarHBondContact O-N 3.18Å; L75-K78 PolarHBondContact O-N 3.25Å; K78-M82 WeakPolarHBondContact O-CB 3.3Å; K78-M82 PolarHBondContact O-N 3.26Å
79N85.3Confident83.9Confident20 Ų2064.5 Ų64.511%0.10730%0.295CS..Hα-helixtrans-71.4-33.3179.7-78.9-88.8000112L75 A76 F77 M82 F83 R244 M245 Y248L75-N79 WeakPolarHBondContact O-CB 3.35Å; L75-N79 PolarHBondContact O-N 3.25Å; L75-N79 PolarHBondContact O-ND2 3.41Å; A76-N79 PolarHBondContact O-N 3.11Å; F77-N79 VanDerWaalsContact C-N 3.33Å; F77-N79 PolarHBondContact O-N 3.23Å; N79-M82 PolarHBondContact O-N 3.28Å; N79-F83 WeakPolarHBondContact O-CB 3.27Å; N79-F83 PolarHBondContact O-N 2.87Å; N79-R244 HydrophobicContact CB-CB 4.3Å; N79-M245 HydrophobicContact CB-CB 4.09Å; N79-Y248 VanDerWaalsContact ND2-CE2 3.25Å; N79-Y248 WeakPolarHBondContact ND2-CE2 3.21Å
80D87.7Confident84Confident12 Ų1264.6 Ų64.66%0.06430%0.295CS..Hα-helixtrans-61.4-52.5173.1-16951.9000111.2A76 F77 M82 F83 W84 K135 M245A76-D80 WeakPolarHBondContact O-CB 3.33Å; A76-D80 PolarHBondContact O-N 3.45Å; F77-D80 WeakPolarHBondContact O-CB 3.41Å; F77-D80 PolarHBondContact O-N 3.38Å; D80-M82 VanDerWaalsContact C-N 3.29Å; D80-M82 PolarHBondContact O-N 3.41Å; D80-F83 WeakPolarHBondContact O-CB 3.33Å; D80-F83 PolarHBondContact O-N 2.95Å; D80-F83 VanDerWaalsContact O-N 3.15Å; D80-W84 PolarHBondContact O-N 3.43Å; D80-W84 PolarHBondContact OD1-NE1 3.49Å; D80-K135 WeakPolarHBondContact OD2-CE 3.42Å; D80-K135 IonicContact OD2-NZ 2.94Å; D80-K135 PolarHBondContact OD2-NZ 2.86Å; D80-M245 HydrophobicContact CB-CE 4.21Å; D80-M245 HydrophobicContact CB-CG 3.81Å
81I84.9Confident84.3Confident33 Ų3365 Ų6517%0.16930%0.297CS..Hα-helixtrans-59.5-43.1177.4-68.9170.2000111F77 F83 W84 R85 I131F77-I81 HydrophobicContact CD1-CD1 4.17Å; F77-I81 HydrophobicContact CD2-CD1 4.42Å; F77-I81 HydrophobicContact CE1-CD1 3.44Å; F77-I81 VanDerWaalsContact CE1-CD1 3.44Å; F77-I81 HydrophobicContact CE2-CD1 3.7Å; F77-I81 HydrophobicContact CE2-CG1 4.28Å; F77-I81 HydrophobicContact CZ-CD1 3.16Å; F77-I81 HydrophobicContact CZ-CG1 4.2Å; F77-I81 PolarHBondContact O-N 2.88Å; F77-I81 VanDerWaalsContact O-N 3.07Å; I81-F83 VanDerWaalsContact C-N 3.3Å; I81-F83 PolarHBondContact O-N 3.46Å; I81-W84 PolarHBondContact O-N 2.83Å; I81-R85 WeakPolarHBondContact O-CB 3.07Å; I81-R85 PolarHBondContact O-N 2.78Å; I81-I131 HydrophobicContact CG1-CG2 4.43Å
82M86.1Confident84.3Confident65 Ų6561.5 Ų61.532%0.3228%0.276SS..Hα-helixtrans-61.6-41.3179.2-172.9-174.9-54.800111.6K78 N79 D80 K86K78-M82 WeakPolarHBondContact O-CB 3.3Å; K78-M82 PolarHBondContact O-N 3.26Å; N79-M82 PolarHBondContact O-N 3.28Å; D80-M82 VanDerWaalsContact C-N 3.29Å; D80-M82 PolarHBondContact O-N 3.41Å; M82-K86 HydrophobicContact CG-CD 4.14Å; M82-K86 WeakPolarHBondContact O-CG 3.22Å; M82-K86 PolarHBondContact O-N 3.26Å
83F87.9Confident84.3Confident36 Ų3660.2 Ų60.216%0.15827%0.27CS..Hα-helixtrans-61.2-55.7176.7172.5-100.7000111N79 D80 I81 R85 K86 R87 L93 H240 P242N79-F83 WeakPolarHBondContact O-CB 3.27Å; N79-F83 PolarHBondContact O-N 2.87Å; D80-F83 WeakPolarHBondContact O-CB 3.33Å; D80-F83 PolarHBondContact O-N 2.95Å; D80-F83 VanDerWaalsContact O-N 3.15Å; I81-F83 VanDerWaalsContact C-N 3.3Å; I81-F83 PolarHBondContact O-N 3.46Å; F83-R85 VanDerWaalsContact C-N 3.25Å; F83-R85 PolarHBondContact O-N 3.32Å; F83-K86 PolarHBondContact O-N 3.48Å; F83-R87 WeakPolarHBondContact O-CB 3.34Å; F83-R87 PolarHBondContact O-N 3.07Å; F83-L93 HydrophobicContact CE1-CD1 3.87Å; F83-L93 HydrophobicContact CE1-CD2 4.46Å; F83-L93 HydrophobicContact CZ-CD1 3.81Å; F83-L93 HydrophobicContact CZ-CD2 4.2Å; F83-H240 WeakPolarHBondContact CE2-O 3.45Å; F83-H240 WeakPolarHBondContact CZ-O 3.18Å; F83-P242 HydrophobicContact CB-CB 3.99Å; F83-P242 HydrophobicContact CD1-CB 3.95Å; F83-P242 HydrophobicContact CD1-CG 4.13Å; F83-P242 HydrophobicContact CD2-CB 3.63Å; F83-P242 HydrophobicContact CD2-CG 4.49Å; F83-P242 HydrophobicContact CE1-CB 4.3Å; F83-P242 HydrophobicContact CE1-CG 4.18Å; F83-P242 HydrophobicContact CE2-CB 3.99Å; F83-P242 HydrophobicContact CG-CB 3.59Å; F83-P242 HydrophobicContact CG-CG 4.29Å; F83-P242 HydrophobicContact CZ-CB 4.31Å; F83-P242 HydrophobicContact CZ-CG 4.36Å
84W87.5Confident84.7Confident25 Ų2556.9 Ų56.910%0.09526%0.255CS..Hα-helixtrans-65.1-27.1-178.9-74.4105.9000113.8D80 I81 L90 L93 L98 W134 K135 C139D80-W84 PolarHBondContact O-N 3.43Å; D80-W84 PolarHBondContact OD1-NE1 3.49Å; I81-W84 PolarHBondContact O-N 2.83Å; W84-L90 HydrophobicContact CZ3-CD2 4.12Å; W84-L93 HydrophobicContact CH2-CD1 4.05Å; W84-L93 HydrophobicContact CZ3-CD1 4.3Å; W84-L98 HydrophobicContact CH2-CD1 4.39Å; W84-L98 HydrophobicContact CH2-CD2 3.89Å; W84-L98 HydrophobicContact CZ2-CD1 4.09Å; W84-L98 HydrophobicContact CZ2-CD2 4.39Å; W84-L98 HydrophobicContact CZ3-CD2 4.33Å; W84-W134 HydrophobicContact CB-CH2 4.18Å; W84-W134 HydrophobicContact CB-CZ3 3.8Å; W84-K135 HydrophobicContact CD2-CD 4.37Å; W84-K135 HydrophobicContact CD2-CG 4.15Å; W84-K135 HydrophobicContact CG-CD 4.36Å; W84-K135 HydrophobicContact CG-CG 4.07Å; W84-C139 WeakPolarHBondContact CZ3-SG 3.23Å
85R84.5Confident85Confident172 Ų17250.9 Ų50.965%0.64923%0.229SC*.Hα-helixtrans-71.9-38175.7-171-175.8-55.2-175.30.9112.6I81 F83 W134I81-R85 WeakPolarHBondContact O-CB 3.07Å; I81-R85 PolarHBondContact O-N 2.78Å; F83-R85 VanDerWaalsContact C-N 3.25Å; F83-R85 PolarHBondContact O-N 3.32Å; R85-W134 HydrophobicContact CB-CH2 4.34Å
86K85.1Confident85.1Confident156 Ų15651.7 Ų51.768%0.67823%0.229SC*.Hα-helixtrans-90.1-13.2-176.1-69.7-178.5176.4-176.50113.6M82 F83M82-K86 HydrophobicContact CG-CD 4.14Å; M82-K86 WeakPolarHBondContact O-CG 3.22Å; M82-K86 PolarHBondContact O-N 3.26Å; F83-K86 PolarHBondContact O-N 3.48Å
87R82.2Confident85.4Confident60 Ų6051.5 Ų51.523%0.22623%0.227CC..  trans-79.3124-173.3-163.976.1-167.3156.218.2111.3F83 S89 H240 E299F83-R87 WeakPolarHBondContact O-CB 3.34Å; F83-R87 PolarHBondContact O-N 3.07Å; R87-S89 WeakPolarHBondContact CG-O 2.95Å; R87-S89 PolarHBondContact NE-O 2.87Å; R87-S89 PolarHBondContact NH2-O 3.27Å; R87-H240 PolarHBondContact NH2-ND1 3.05Å; R87-H240 VanDerWaalsContact NH2-ND1 3.16Å; R87-E299 IonicContact CZ-OE1 2.83Å; R87-E299 IonicContact NH2-OE1 3.89Å; R87-E299 PolarHBondContact NH2-OE1 3.22Å
88E81.1Confident85.7Confident143 Ų14348.3 Ų48.367%0.66821%0.214SC*.  trans-99.5-44.2177.5-61.7-173.9160.900111.8
89S82.6Confident86Confident5 Ų546 Ų464%0.03521%0.206CC..  trans-96.9141.4176.2163.90000113.4R87 E91 S164 E299R87-S89 WeakPolarHBondContact CG-O 2.95Å; R87-S89 PolarHBondContact NE-O 2.87Å; R87-S89 PolarHBondContact NH2-O 3.27Å; S89-E91 WeakPolarHBondContact OG-CB 3.12Å; S89-E91 PolarHBondContact OG-N 3.41Å; S89-E91 VanDerWaalsContact OG-N 3.13Å; S89-S164 WeakPolarHBondContact CA-OG 3.32Å; S89-S164 WeakPolarHBondContact CB-OG 3.22Å; S89-S164 PolarHBondContact OG-OG 3.46Å; S89-E299 VanDerWaalsContact CB-CD 3.42Å; S89-E299 WeakPolarHBondContact CB-OE1 3.25Å; S89-E299 WeakPolarHBondContact CB-OE2 3.34Å
90L82.7Confident86.2Confident4 Ų447.6 Ų47.62%0.02121%0.212CC..  trans-98.68.5175.9-59.6176.4000112.9W84 G92 L93 V95 C139 K162 S164 Y165W84-L90 HydrophobicContact CZ3-CD2 4.12Å; L90-G92 PolarHBondContact O-N 3.39Å; L90-L93 PolarHBondContact O-N 3.2Å; L90-L93 VanDerWaalsContact O-N 3.13Å; L90-V95 HydrophobicContact CD1-CG2 4.05Å; L90-C139 HydrophobicContact CD1-CB 3.96Å; L90-K162 HydrophobicContact CD1-CB 3.94Å; L90-K162 HydrophobicContact CD1-CD 4.03Å; L90-K162 HydrophobicContact CD1-CG 4.28Å; L90-K162 HydrophobicContact CG-CD 4.46Å; L90-S164 PolarHBondContact N-OG 3.1Å; L90-S164 VanDerWaalsContact N-OG 3.1Å; L90-Y165 HydrophobicContact CB-CD2 4.39Å
91E83.2Confident86.3Confident70 Ų7049.7 Ų49.733%0.32722%0.223SC..THydrogen-bonded Turntrans-56136175.7-171.3177.4-178.700110.7S89 L93 H240S89-E91 WeakPolarHBondContact OG-CB 3.12Å; S89-E91 PolarHBondContact OG-N 3.41Å; S89-E91 VanDerWaalsContact OG-N 3.13Å; E91-L93 PolarHBondContact O-N 3.26Å; E91-H240 WeakPolarHBondContact O-CB 3.44Å; E91-H240 PolarHBondContact O-ND1 2.85Å
92G83.3Confident86.5Confident2 Ų250.7 Ų50.72%0.02123%0.228CC..THydrogen-bonded Turntrans77.5-6.5-177.900000116.1L90 T170 Q228L90-G92 PolarHBondContact O-N 3.39Å; G92-T170 PolarHBondContact N-OG1 3.39Å; G92-Q228 PolarHBondContact O-NE2 3.13Å
93L86.9Confident86.7Confident11 Ų1151 Ų516%0.05823%0.234CC..SBendtrans-103.2136.3176.8-63174.9000111.2F83 W84 L90 E91 V95 Y165 L241F83-L93 HydrophobicContact CE1-CD1 3.87Å; F83-L93 HydrophobicContact CE1-CD2 4.46Å; F83-L93 HydrophobicContact CZ-CD1 3.81Å; F83-L93 HydrophobicContact CZ-CD2 4.2Å; W84-L93 HydrophobicContact CH2-CD1 4.05Å; W84-L93 HydrophobicContact CZ3-CD1 4.3Å; L90-L93 PolarHBondContact O-N 3.2Å; L90-L93 VanDerWaalsContact O-N 3.13Å; E91-L93 PolarHBondContact O-N 3.26Å; L93-V95 PolarHBondContact O-N 3.39Å; L93-Y165 WeakPolarHBondContact O-CE2 3.41Å; L93-L241 HydrophobicContact CD2-CD2 4.09Å
94S89.1Confident86.9Confident5 Ų550.8 Ų50.84%0.03524%0.236CC..  trans-79.6107.3173.3177.10000111.5R96 S97 L98 D174S94-R96 VanDerWaalsContact C-N 3.29Å; S94-S97 VanDerWaalsContact OG-CB 3.27Å; S94-S97 WeakPolarHBondContact OG-CB 3.28Å; S94-S97 PolarHBondContact OG-N 3.47Å; S94-S97 PolarHBondContact OG-OG 2.93Å; S94-S97 VanDerWaalsContact OG-OG 3.13Å; S94-L98 PolarHBondContact O-N 3.01Å; S94-L98 VanDerWaalsContact O-N 3.11Å; S94-D174 WeakPolarHBondContact CB-OD1 3.11Å; S94-D174 PolarHBondContact OG-OD1 3.21Å
95V88.1Confident86.9Confident4 Ų451 Ų512%0.02424%0.24CC..Hα-helixtrans-64.9-36.4171178.30000110.5L90 L93 L98 L99 C139 L140 Y165L90-V95 HydrophobicContact CD1-CG2 4.05Å; L93-V95 PolarHBondContact O-N 3.39Å; V95-L98 WeakPolarHBondContact O-CB 3.43Å; V95-L98 PolarHBondContact O-N 2.83Å; V95-L99 HydrophobicContact CG1-CD1 4.25Å; V95-L99 WeakPolarHBondContact O-CG 3.47Å; V95-L99 PolarHBondContact O-N 2.92Å; V95-C139 HydrophobicContact CG1-CB 4.08Å; V95-C139 HydrophobicContact CG2-CB 4.26Å; V95-L140 HydrophobicContact CG1-CD2 3.82Å; V95-L140 HydrophobicContact CG1-CG 4.39Å; V95-Y165 HydrophobicContact CB-CE1 4.17Å; V95-Y165 HydrophobicContact CB-CE2 4.22Å; V95-Y165 HydrophobicContact CG2-CD1 4.09Å; V95-Y165 HydrophobicContact CG2-CD2 3.65Å; V95-Y165 HydrophobicContact CG2-CE1 4.1Å; V95-Y165 HydrophobicContact CG2-CE2 3.71Å; V95-Y165 HydrophobicContact CG2-CG 3.83Å
96R88.9Confident87.4Confident61 Ų6145.2 Ų45.223%0.2322%0.224CC..Hα-helixtrans-67.3-41.6177.9-70.6176.9-178.173.115.6112.4S94 L98 L99 F100 E161 Y165 D174 F178S94-R96 VanDerWaalsContact C-N 3.29Å; R96-L98 VanDerWaalsContact C-N 3.29Å; R96-L98 PolarHBondContact O-N 2.8Å; R96-L99 PolarHBondContact O-N 2.99Å; R96-F100 WeakPolarHBondContact O-CB 3.14Å; R96-F100 PolarHBondContact O-N 3.39Å; R96-E161 IonicContact CZ-OE1 3.95Å; R96-E161 IonicContact NH2-OE1 3.23Å; R96-E161 PolarHBondContact NH2-OE1 2.91Å; R96-Y165 PolarHBondContact NH1-OH 2.88Å; R96-Y165 VanDerWaalsContact NH1-OH 3.16Å; R96-D174 WeakPolarHBondContact CB-OD2 3.41Å; R96-D174 WeakPolarHBondContact CD-OD2 3.48Å; R96-D174 WeakPolarHBondContact CG-OD2 3.24Å; R96-D174 IonicContact CZ-OD2 3.68Å; R96-D174 PolarHBondContact N-OD2 3.5Å; R96-D174 IonicContact NE-OD2 3.84Å; R96-D174 IonicContact NH1-OD2 2.77Å; R96-D174 PolarHBondContact NH1-OD2 3.4Å; R96-F178 VanDerWaalsContact C-CZ 3.46Å; R96-F178 HydrophobicContact CB-CD1 4.28Å; R96-F178 HydrophobicContact CB-CD2 3.48Å; R96-F178 VanDerWaalsContact CB-CD2 3.48Å; R96-F178 HydrophobicContact CB-CE1 4.13Å; R96-F178 HydrophobicContact CB-CE2 3.3Å; R96-F178 HydrophobicContact CB-CG 3.98Å; R96-F178 HydrophobicContact CB-CZ 3.66Å; R96-F178 HydrophobicContact CG-CD2 4.31Å
97S89.4Confident87.7Confident10 Ų1039 Ų397%0.0720%0.198CC..Hα-helixtrans-63.7-35.6173.3-70.10000111.9S94 F100 N101 F178S94-S97 VanDerWaalsContact OG-CB 3.27Å; S94-S97 WeakPolarHBondContact OG-CB 3.28Å; S94-S97 PolarHBondContact OG-N 3.47Å; S94-S97 PolarHBondContact OG-OG 2.93Å; S94-S97 VanDerWaalsContact OG-OG 3.13Å; S97-F100 PolarHBondContact O-N 3.35Å; S97-N101 WeakPolarHBondContact O-CB 3.39Å; S97-N101 PolarHBondContact O-N 2.72Å; S97-N101 PolarHBondContact O-ND2 2.96Å; S97-N101 VanDerWaalsContact O-ND2 3.16Å; S97-F178 VanDerWaalsContact N-CZ 3.33Å; S97-F178 WeakPolarHBondContact OG-CE2 3.33Å; S97-F178 WeakPolarHBondContact OG-CZ 2.84Å
98L88.9Confident88Confident15 Ų1537.8 Ų37.88%0.07920%0.198CC..Hα-helixtrans-62.2-47.5174178.968.6000111.9W84 S94 V95 R96 F100 N101 M102 K135 C139W84-L98 HydrophobicContact CH2-CD1 4.39Å; W84-L98 HydrophobicContact CH2-CD2 3.89Å; W84-L98 HydrophobicContact CZ2-CD1 4.09Å; W84-L98 HydrophobicContact CZ2-CD2 4.39Å; W84-L98 HydrophobicContact CZ3-CD2 4.33Å; S94-L98 PolarHBondContact O-N 3.01Å; S94-L98 VanDerWaalsContact O-N 3.11Å; V95-L98 WeakPolarHBondContact O-CB 3.43Å; V95-L98 PolarHBondContact O-N 2.83Å; R96-L98 VanDerWaalsContact C-N 3.29Å; R96-L98 PolarHBondContact O-N 2.8Å; L98-F100 VanDerWaalsContact C-N 3.33Å; L98-N101 PolarHBondContact O-N 3.03Å; L98-M102 PolarHBondContact O-N 2.61Å; L98-K135 HydrophobicContact CD1-CB 3.91Å; L98-K135 HydrophobicContact CD1-CD 3.72Å; L98-K135 HydrophobicContact CD1-CG 4.46Å; L98-K135 HydrophobicContact CD2-CB 3.99Å; L98-K135 HydrophobicContact CG-CB 4.43Å; L98-C139 HydrophobicContact CD2-CB 3.95Å; L98-C139 WeakPolarHBondContact CD2-SG 3.28Å
99L89.9Confident88.3Confident56 Ų5632.5 Ų32.529%0.29317%0.172SC..Hα-helixtrans-67.1-36.7178.6-63.3170.5000112.2V95 R96 M102 T103 V136 L140V95-L99 HydrophobicContact CG1-CD1 4.25Å; V95-L99 WeakPolarHBondContact O-CG 3.47Å; V95-L99 PolarHBondContact O-N 2.92Å; R96-L99 PolarHBondContact O-N 2.99Å; L99-M102 WeakPolarHBondContact O-CB 3.43Å; L99-M102 PolarHBondContact O-N 3.47Å; L99-T103 PolarHBondContact O-N 2.99Å; L99-T103 PolarHBondContact O-OG1 3.32Å; L99-V136 HydrophobicContact CD2-CB 4.49Å; L99-V136 HydrophobicContact CD2-CG1 3.93Å; L99-V136 HydrophobicContact CD2-CG2 3.9Å; L99-L140 HydrophobicContact CD1-CD1 3.86Å; L99-L140 HydrophobicContact CD2-CD1 3.7Å; L99-L140 HydrophobicContact CG-CD1 4.34Å
100F90.3Very high88.8Confident54 Ų5435 Ų3524%0.23719%0.185CC..Hα-helixtrans-63.7-44.8173.5-165.2-87.1000111R96 S97 L98 M102 T103 V104 F178 L217 M224R96-F100 WeakPolarHBondContact O-CB 3.14Å; R96-F100 PolarHBondContact O-N 3.39Å; S97-F100 PolarHBondContact O-N 3.35Å; L98-F100 VanDerWaalsContact C-N 3.33Å; F100-M102 VanDerWaalsContact C-N 3.32Å; F100-M102 PolarHBondContact O-N 3.13Å; F100-T103 WeakPolarHBondContact O-CA 3.27Å; F100-T103 WeakPolarHBondContact O-CB 3.12Å; F100-T103 PolarHBondContact O-N 2.98Å; F100-V104 HydrophobicContact CD1-CG2 3.83Å; F100-V104 HydrophobicContact CE1-CG2 3.46Å; F100-V104 VanDerWaalsContact CE1-CG2 3.46Å; F100-V104 HydrophobicContact CZ-CG2 4.32Å; F100-V104 WeakPolarHBondContact O-CG2 3.43Å; F100-V104 PolarHBondContact O-N 3.43Å; F100-F178 HydrophobicContact CB-CE1 4.34Å; F100-F178 HydrophobicContact CB-CZ 4.44Å; F100-L217 HydrophobicContact CE1-CD2 4.25Å; F100-L217 HydrophobicContact CZ-CD2 4.45Å; F100-M224 HydrophobicContact CD1-CB 4.35Å; F100-M224 HydrophobicContact CD1-CG 4.18Å; F100-M224 HydrophobicContact CD1-SD 3.82Å; F100-M224 HydrophobicContact CE1-CB 4.25Å; F100-M224 HydrophobicContact CE1-CE 3.34Å; F100-M224 HydrophobicContact CE1-CG 3.6Å; F100-M224 HydrophobicContact CE1-SD 3.15Å; F100-M224 WeakPolarHBondContact CE1-SD 3.04Å; F100-M224 HydrophobicContact CE2-CE 4.3Å; F100-M224 HydrophobicContact CE2-SD 4.36Å; F100-M224 HydrophobicContact CZ-CE 3.21Å; F100-M224 HydrophobicContact CZ-CG 4.42Å; F100-M224 HydrophobicContact CZ-SD 3.48Å; F100-M224 WeakPolarHBondContact CZ-SD 3.27Å
101N89.5Confident89Confident56 Ų5635.4 Ų35.430%0.29919%0.186SC..Hα-helixtrans-59.5-41.3174.5-75.8-29.8000111.8S97 L98 T103 V104 S105S97-N101 WeakPolarHBondContact O-CB 3.39Å; S97-N101 PolarHBondContact O-N 2.72Å; S97-N101 PolarHBondContact O-ND2 2.96Å; S97-N101 VanDerWaalsContact O-ND2 3.16Å; L98-N101 PolarHBondContact O-N 3.03Å; N101-T103 VanDerWaalsContact C-N 3.31Å; N101-T103 PolarHBondContact O-N 3.09Å; N101-V104 WeakPolarHBondContact O-CB 3.46Å; N101-V104 PolarHBondContact O-N 2.91Å; N101-S105 PolarHBondContact O-N 2.94Å; N101-S105 PolarHBondContact O-OG 3.06Å
102M89.4Confident89Confident55 Ų5532.1 Ų32.127%0.27117%0.171SC..Hα-helixtrans-59-43.1172.6-175.3-155.7178.700111.5L98 L99 F100 V104 S105 V106 A133 V136L98-M102 PolarHBondContact O-N 2.61Å; L99-M102 WeakPolarHBondContact O-CB 3.43Å; L99-M102 PolarHBondContact O-N 3.47Å; F100-M102 VanDerWaalsContact C-N 3.32Å; F100-M102 PolarHBondContact O-N 3.13Å; M102-V104 VanDerWaalsContact C-N 3.33Å; M102-V104 PolarHBondContact O-N 2.98Å; M102-S105 PolarHBondContact O-N 3.14Å; M102-V106 WeakPolarHBondContact O-CG2 3.21Å; M102-V106 PolarHBondContact O-N 3Å; M102-A133 HydrophobicContact CE-CB 3.92Å; M102-V136 HydrophobicContact CE-CG2 4.43Å; M102-V136 HydrophobicContact CG-CG2 4.34Å; M102-V136 HydrophobicContact SD-CG2 3.44Å; M102-V136 WeakPolarHBondContact SD-CG2 3.34Å
103T91.2Very high89.2Confident72 Ų7235.2 Ų35.244%0.44219%0.187SC..Hα-helixtrans-63-40.9177.7-53.50000111.3L99 F100 N101 V106 I107L99-T103 PolarHBondContact O-N 2.99Å; L99-T103 PolarHBondContact O-OG1 3.32Å; F100-T103 WeakPolarHBondContact O-CA 3.27Å; F100-T103 WeakPolarHBondContact O-CB 3.12Å; F100-T103 PolarHBondContact O-N 2.98Å; N101-T103 VanDerWaalsContact C-N 3.31Å; N101-T103 PolarHBondContact O-N 3.09Å; T103-V106 PolarHBondContact O-N 3.45Å; T103-I107 HydrophobicContact CG2-CD1 4.19Å; T103-I107 WeakPolarHBondContact O-CG1 3.23Å; T103-I107 PolarHBondContact O-N 3.19Å
104V91.1Very high89.3Confident31 Ų3136.2 Ų36.219%0.18819%0.192CC..Hα-helixtrans-60-48.1172.9167.90000110.8F100 N101 M102 V106 I107 V108 L217F100-V104 HydrophobicContact CD1-CG2 3.83Å; F100-V104 HydrophobicContact CE1-CG2 3.46Å; F100-V104 VanDerWaalsContact CE1-CG2 3.46Å; F100-V104 HydrophobicContact CZ-CG2 4.32Å; F100-V104 WeakPolarHBondContact O-CG2 3.43Å; F100-V104 PolarHBondContact O-N 3.43Å; N101-V104 WeakPolarHBondContact O-CB 3.46Å; N101-V104 PolarHBondContact O-N 2.91Å; M102-V104 VanDerWaalsContact C-N 3.33Å; M102-V104 PolarHBondContact O-N 2.98Å; V104-V106 VanDerWaalsContact C-N 3.26Å; V104-V106 PolarHBondContact O-N 3.11Å; V104-I107 PolarHBondContact O-N 3.16Å; V104-I107 VanDerWaalsContact O-N 3.11Å; V104-V108 HydrophobicContact CG1-CG2 4.24Å; V104-V108 VanDerWaalsContact O-CG2 3.31Å; V104-V108 WeakPolarHBondContact O-CG2 3.36Å; V104-V108 PolarHBondContact O-N 3.45Å; V104-L217 HydrophobicContact CB-CD1 4.35Å; V104-L217 HydrophobicContact CG1-CD1 4.1Å; V104-L217 HydrophobicContact CG2-CD1 3.96Å; V104-L217 HydrophobicContact CG2-CD2 3.64Å; V104-L217 HydrophobicContact CG2-CG 4.42Å
105S88.4Confident88.9Confident28 Ų2838.1 Ų38.120%0.19620%0.202CC..Hα-helixtrans-59.5-36.9177.6-62.40000112N101 M102 F109 D132N101-S105 PolarHBondContact O-N 2.94Å; N101-S105 PolarHBondContact O-OG 3.06Å; M102-S105 PolarHBondContact O-N 3.14Å; S105-F109 WeakPolarHBondContact O-CB 3.01Å; S105-F109 PolarHBondContact O-N 2.84Å; S105-D132 PolarHBondContact OG-OD2 3.3Å
106V94.2Very high88.4Confident52 Ų5243.9 Ų43.932%0.31523%0.232SC..Hα-helixtrans-64.9-47.1173.1173.20000111.5M102 T103 V104 V108 F109 L110 L129M102-V106 WeakPolarHBondContact O-CG2 3.21Å; M102-V106 PolarHBondContact O-N 3Å; T103-V106 PolarHBondContact O-N 3.45Å; V104-V106 VanDerWaalsContact C-N 3.26Å; V104-V106 PolarHBondContact O-N 3.11Å; V106-V108 VanDerWaalsContact C-N 3.35Å; V106-V108 PolarHBondContact O-N 3.4Å; V106-F109 PolarHBondContact O-N 3.48Å; V106-L110 HydrophobicContact CG1-CD1 3.94Å; V106-L110 HydrophobicContact CG1-CG 4.32Å; V106-L110 WeakPolarHBondContact O-CG 3.25Å; V106-L110 PolarHBondContact O-N 2.77Å; V106-L129 HydrophobicContact CB-CD1 4.43Å; V106-L129 HydrophobicContact CG2-CD1 3.47Å; V106-L129 VanDerWaalsContact CG2-CD1 3.47Å; V106-L129 HydrophobicContact CG2-CD2 4.29Å
107I91Very high87.7Confident25 Ų2541.7 Ų41.713%0.12823%0.226CC..Hα-helixtrans-60.9-46179.4-68.5164.1000110.5T103 V104 F109 L110 Y111 L213 L217T103-I107 HydrophobicContact CG2-CD1 4.19Å; T103-I107 WeakPolarHBondContact O-CG1 3.23Å; T103-I107 PolarHBondContact O-N 3.19Å; V104-I107 PolarHBondContact O-N 3.16Å; V104-I107 VanDerWaalsContact O-N 3.11Å; I107-F109 VanDerWaalsContact C-N 3.34Å; I107-F109 PolarHBondContact O-N 3.29Å; I107-L110 PolarHBondContact O-N 2.94Å; I107-Y111 VanDerWaalsContact O-CB 3.31Å; I107-Y111 WeakPolarHBondContact O-CB 3.47Å; I107-Y111 PolarHBondContact O-N 3.09Å; I107-L213 HydrophobicContact CD1-CB 4.43Å; I107-L213 HydrophobicContact CD1-CD1 4.16Å; I107-L213 HydrophobicContact CG1-CD1 4.37Å; I107-L213 HydrophobicContact CG2-CB 3.79Å; I107-L217 HydrophobicContact CB-CD1 4.23Å; I107-L217 HydrophobicContact CD1-CD1 4.02Å; I107-L217 HydrophobicContact CG2-CD1 3.95Å
108V88.2Confident87Confident35 Ų3545 Ų4521%0.21224%0.243CC..Hα-helixtrans-60.6-45.2177.51740000110.5V104 V106 Y111 V112 I125 Y214V104-V108 HydrophobicContact CG1-CG2 4.24Å; V104-V108 VanDerWaalsContact O-CG2 3.31Å; V104-V108 WeakPolarHBondContact O-CG2 3.36Å; V104-V108 PolarHBondContact O-N 3.45Å; V106-V108 VanDerWaalsContact C-N 3.35Å; V106-V108 PolarHBondContact O-N 3.4Å; V108-Y111 PolarHBondContact O-N 2.84Å; V108-V112 HydrophobicContact CG1-CG2 4.45Å; V108-V112 WeakPolarHBondContact O-CB 3.34Å; V108-V112 WeakPolarHBondContact O-CG2 3.21Å; V108-V112 PolarHBondContact O-N 2.85Å; V108-I125 HydrophobicContact CG1-CD1 4.36Å; V108-I125 HydrophobicContact CG1-CG2 4.14Å; V108-Y214 HydrophobicContact CG1-CE2 4.35Å; V108-Y214 HydrophobicContact CG2-CD2 4.04Å; V108-Y214 HydrophobicContact CG2-CE2 4.08Å
109F89Confident86.6Confident31 Ų3151.4 Ų51.414%0.13627%0.27CS..Hα-helixtrans-62-47.8177.6-179.8-120.2000112.4S105 V106 I107 Y111 V112 L113 I125 F126 L129S105-F109 WeakPolarHBondContact O-CB 3.01Å; S105-F109 PolarHBondContact O-N 2.84Å; V106-F109 PolarHBondContact O-N 3.48Å; I107-F109 VanDerWaalsContact C-N 3.34Å; I107-F109 PolarHBondContact O-N 3.29Å; F109-Y111 VanDerWaalsContact C-N 3.34Å; F109-Y111 PolarHBondContact O-N 3.01Å; F109-V112 PolarHBondContact O-N 3.24Å; F109-L113 HydrophobicContact CD1-CD1 4.05Å; F109-L113 HydrophobicContact CD2-CG 4.44Å; F109-L113 HydrophobicContact CE1-CD1 3.54Å; F109-L113 HydrophobicContact CE1-CG 4.27Å; F109-L113 HydrophobicContact CE2-CD1 4.18Å; F109-L113 HydrophobicContact CE2-CD2 4.12Å; F109-L113 HydrophobicContact CE2-CG 4.03Å; F109-L113 HydrophobicContact CZ-CD1 3.61Å; F109-L113 HydrophobicContact CZ-CD2 4.06Å; F109-L113 HydrophobicContact CZ-CG 3.96Å; F109-L113 WeakPolarHBondContact O-CG 3.4Å; F109-L113 PolarHBondContact O-N 3.39Å; F109-I125 HydrophobicContact CB-CG2 3.98Å; F109-I125 HydrophobicContact CD2-CG2 4.1Å; F109-F126 HydrophobicContact CD2-CB 4.17Å; F109-F126 AromaticContact CE1-CD2 3.9Å; F109-F126 HydrophobicContact CE1-CD2 3.9Å; F109-F126 HydrophobicContact CE2-CB 3.6Å; F109-F126 HydrophobicContact CE2-CD2 4.03Å; F109-F126 HydrophobicContact CE2-CG 4.25Å; F109-F126 HydrophobicContact CZ-CB 4.01Å; F109-F126 AromaticContact CZ-CD2 3.55Å; F109-F126 HydrophobicContact CZ-CD2 3.55Å; F109-F126 HydrophobicContact CZ-CE2 4.46Å; F109-F126 HydrophobicContact CZ-CG 4.15Å; F109-L129 HydrophobicContact CB-CD2 4.15Å; F109-L129 HydrophobicContact CD1-CD2 3.8Å; F109-L129 HydrophobicContact CG-CD2 4.12Å
110L92.2Very high86Confident58 Ų5850.9 Ų50.930%0.30427%0.267SS..Hα-helixtrans-61.6-41.5177.5-71175.6000112.1V106 I107 V112 L113 D114 L210V106-L110 HydrophobicContact CG1-CD1 3.94Å; V106-L110 HydrophobicContact CG1-CG 4.32Å; V106-L110 WeakPolarHBondContact O-CG 3.25Å; V106-L110 PolarHBondContact O-N 2.77Å; I107-L110 PolarHBondContact O-N 2.94Å; L110-V112 VanDerWaalsContact C-N 3.33Å; L110-V112 PolarHBondContact O-N 3.49Å; L110-L113 PolarHBondContact O-N 3.35Å; L110-D114 PolarHBondContact O-N 3Å; L110-L210 HydrophobicContact CB-CD1 4.12Å; L110-L210 HydrophobicContact CB-CD2 3.66Å; L110-L210 HydrophobicContact CD1-CD2 4.3Å
111Y87.9Confident85.3Confident13 Ų1349.1 Ų49.15%0.05126%0.26CS..Hα-helixtrans-61.4-41.7175.3176.5-97.3000112L14 I107 V108 F109 L113 D114 N115 L210 Y214L14-Y111 VanDerWaalsContact CD1-OH 3.26Å; L14-Y111 WeakPolarHBondContact CD1-OH 2.89Å; I107-Y111 VanDerWaalsContact O-CB 3.31Å; I107-Y111 WeakPolarHBondContact O-CB 3.47Å; I107-Y111 PolarHBondContact O-N 3.09Å; V108-Y111 PolarHBondContact O-N 2.84Å; F109-Y111 VanDerWaalsContact C-N 3.34Å; F109-Y111 PolarHBondContact O-N 3.01Å; Y111-L113 VanDerWaalsContact C-N 3.33Å; Y111-D114 PolarHBondContact O-N 3.19Å; Y111-N115 WeakPolarHBondContact CD2-ND2 3.18Å; Y111-N115 WeakPolarHBondContact CE2-ND2 3.46Å; Y111-N115 PolarHBondContact O-N 3.05Å; Y111-N115 VanDerWaalsContact O-N 3.14Å; Y111-N115 PolarHBondContact O-ND2 2.74Å; Y111-L210 HydrophobicContact CD2-CB 4.27Å; Y111-Y214 AromaticContact CD1-CD1 3.79Å; Y111-Y214 HydrophobicContact CD1-CD1 3.79Å; Y111-Y214 AromaticContact CD1-CD2 3.89Å; Y111-Y214 HydrophobicContact CD1-CD2 3.89Å; Y111-Y214 HydrophobicContact CD1-CE1 4.05Å; Y111-Y214 HydrophobicContact CD1-CE2 4.14Å; Y111-Y214 AromaticContact CD1-CG 3.7Å; Y111-Y214 HydrophobicContact CD1-CG 3.7Å; Y111-Y214 HydrophobicContact CD2-CD1 4.29Å; Y111-Y214 HydrophobicContact CD2-CG 4.1Å; Y111-Y214 AromaticContact CE1-CD1 3.51Å; Y111-Y214 HydrophobicContact CE1-CD1 3.51Å; Y111-Y214 HydrophobicContact CE1-CD2 4.4Å; Y111-Y214 AromaticContact CE1-CE1 3.58Å; Y111-Y214 HydrophobicContact CE1-CE1 3.58Å; Y111-Y214 HydrophobicContact CE1-CE2 4.46Å; Y111-Y214 AromaticContact CE1-CG 3.94Å; Y111-Y214 HydrophobicContact CE1-CG 3.94Å; Y111-Y214 HydrophobicContact CE2-CD1 4.05Å; Y111-Y214 HydrophobicContact CE2-CG 4.32Å; Y111-Y214 HydrophobicContact CG-CD1 4.17Å; Y111-Y214 HydrophobicContact CG-CD2 4.15Å; Y111-Y214 AromaticContact CG-CG 3.79Å; Y111-Y214 HydrophobicContact CG-CG 3.79Å; Y111-Y214 AromaticContact CZ-CD1 3.64Å
112V82.8Confident84.7Confident1 Ų150.1 Ų50.11%0.00626%0.26CS..Hα-helixtrans-69.8-31178.9168.30000112.2V108 F109 L110 T117 R122 I125V108-V112 HydrophobicContact CG1-CG2 4.45Å; V108-V112 WeakPolarHBondContact O-CB 3.34Å; V108-V112 WeakPolarHBondContact O-CG2 3.21Å; V108-V112 PolarHBondContact O-N 2.85Å; F109-V112 PolarHBondContact O-N 3.24Å; L110-V112 VanDerWaalsContact C-N 3.33Å; L110-V112 PolarHBondContact O-N 3.49Å; V112-T117 HydrophobicContact CG1-CG2 4.08Å; V112-T117 WeakPolarHBondContact CG1-OG1 3.45Å; V112-T117 PolarHBondContact O-OG1 2.82Å; V112-T117 VanDerWaalsContact O-OG1 3.11Å; V112-R122 HydrophobicContact CG1-CG 3.88Å; V112-I125 HydrophobicContact CB-CD1 4.32Å; V112-I125 HydrophobicContact CG1-CD1 4.05Å; V112-I125 HydrophobicContact CG2-CD1 3.71Å
113L87.3Confident84.2Confident67 Ų6748.7 Ų48.735%0.35126%0.257SS..Hα-helixtrans-67.9-40.9169.6-71.3178.2000112.1F109 L110 Y111 N115 R122F109-L113 HydrophobicContact CD1-CD1 4.05Å; F109-L113 HydrophobicContact CD2-CG 4.44Å; F109-L113 HydrophobicContact CE1-CD1 3.54Å; F109-L113 HydrophobicContact CE1-CG 4.27Å; F109-L113 HydrophobicContact CE2-CD1 4.18Å; F109-L113 HydrophobicContact CE2-CD2 4.12Å; F109-L113 HydrophobicContact CE2-CG 4.03Å; F109-L113 HydrophobicContact CZ-CD1 3.61Å; F109-L113 HydrophobicContact CZ-CD2 4.06Å; F109-L113 HydrophobicContact CZ-CG 3.96Å; F109-L113 WeakPolarHBondContact O-CG 3.4Å; F109-L113 PolarHBondContact O-N 3.39Å; L110-L113 PolarHBondContact O-N 3.35Å; Y111-L113 VanDerWaalsContact C-N 3.33Å; L113-N115 VanDerWaalsContact C-N 3.29Å; L113-N115 PolarHBondContact O-N 3.48Å; L113-R122 HydrophobicContact CD2-CG 4.27Å
114D88.2Confident83.6Confident32 Ų3247.9 Ų47.917%0.17125%0.254CS..Hα-helixtrans-69-24.1179.2-171.369000113.5L110 Y111 R203 Y206 S207 L210L110-D114 PolarHBondContact O-N 3Å; Y111-D114 PolarHBondContact O-N 3.19Å; D114-R203 PolarHBondContact O-NH2 3.11Å; D114-R203 IonicContact OD2-NH2 3.83Å; D114-Y206 HydrophobicContact CB-CE1 4.34Å; D114-S207 VanDerWaalsContact OD2-CB 3.22Å; D114-S207 WeakPolarHBondContact OD2-CB 3.4Å; D114-S207 PolarHBondContact OD2-OG 2.99Å; D114-L210 HydrophobicContact CB-CD1 3.88Å
115N81.5Confident83.1Confident44 Ų4448.1 Ų48.124%0.23525%0.254CS..THydrogen-bonded Turntrans-97.916.4-178.2-74-80.1000114.5Y111 L113 T117Y111-N115 WeakPolarHBondContact CD2-ND2 3.18Å; Y111-N115 WeakPolarHBondContact CE2-ND2 3.46Å; Y111-N115 PolarHBondContact O-N 3.05Å; Y111-N115 VanDerWaalsContact O-N 3.14Å; Y111-N115 PolarHBondContact O-ND2 2.74Å; L113-N115 VanDerWaalsContact C-N 3.29Å; L113-N115 PolarHBondContact O-N 3.48Å; N115-T117 HydrophobicContact CB-CG2 4.29Å; N115-T117 PolarHBondContact O-N 2.83Å
116D76.5Confident83Confident125 Ų12550.8 Ų50.867%0.66826%0.262SS*.THydrogen-bonded Turntrans44.344.7175.2-72.4-44.9000114.1
117T74.6Confident82.5Confident16 Ų1654.4 Ų54.410%0.09827%0.274CS..  trans-71.1166.3-178.6600000112.5V112 N115 F119 R122V112-T117 HydrophobicContact CG1-CG2 4.08Å; V112-T117 WeakPolarHBondContact CG1-OG1 3.45Å; V112-T117 PolarHBondContact O-OG1 2.82Å; V112-T117 VanDerWaalsContact O-OG1 3.11Å; N115-T117 HydrophobicContact CB-CG2 4.29Å; N115-T117 PolarHBondContact O-N 2.83Å; T117-F119 PolarHBondContact O-N 2.91Å; T117-R122 PolarHBondContact O-NE 3.36Å; T117-R122 PolarHBondContact O-NH2 3.22Å; T117-R122 WeakPolarHBondContact OG1-CG 3.41Å
118N74.5Confident82.1Confident78 Ų7854.6 Ų54.642%0.41728%0.282SS..  trans-53.7138.1177.1-177.4-47.2000110.8I120 I121 R122N118-I120 PolarHBondContact O-N 3.31Å; N118-I120 WeakPolarHBondContact OD1-CB 3.49Å; N118-I120 PolarHBondContact OD1-N 3.42Å; N118-I121 HydrophobicContact CB-CD1 3.79Å; N118-I121 HydrophobicContact CB-CG1 4.14Å; N118-I121 WeakPolarHBondContact O-CB 3.43Å; N118-I121 PolarHBondContact O-N 2.88Å; N118-R122 PolarHBondContact O-N 3.14Å; N118-R122 VanDerWaalsContact O-N 3.09Å
119F80.4Confident82.1Confident150 Ų15054 Ų5466%0.65828%0.278SS*.Hα-helixtrans-51.6-40.1-179.6175.5-102.3000113T117 I121 R122 A123T117-F119 PolarHBondContact O-N 2.91Å; F119-I121 PolarHBondContact O-N 3.46Å; F119-R122 WeakPolarHBondContact O-CB 3.26Å; F119-R122 PolarHBondContact O-N 3.04Å; F119-A123 WeakPolarHBondContact O-CB 3.29Å; F119-A123 PolarHBondContact O-N 3.5Å
120I78.3Confident82.1Confident45 Ų4556.5 Ų56.523%0.23129%0.292CS..Hα-helixtrans-59.2-38.9179.1-65.1173.4000111.2T29 D34 N118 A123 S124T29-I120 HydrophobicContact CG2-CD1 4.49Å; T29-I120 HydrophobicContact CG2-CG2 3.58Å; D34-I120 WeakPolarHBondContact OD1-CD1 3.49Å; D34-I120 WeakPolarHBondContact OD2-CD1 3.08Å; N118-I120 PolarHBondContact O-N 3.31Å; N118-I120 WeakPolarHBondContact OD1-CB 3.49Å; N118-I120 PolarHBondContact OD1-N 3.42Å; I120-A123 PolarHBondContact O-N 3Å; I120-S124 PolarHBondContact O-N 3.37Å
121I74.3Confident81.9Confident17 Ų1755.3 Ų55.39%0.08729%0.286CS..Hα-helixtrans-76.1-39.4-177.9-54.7171.1000110.3L18 K22 N118 F119 A123 S124 I125L18-I121 HydrophobicContact CD2-CG2 3.98Å; K22-I121 HydrophobicContact CD-CD1 3.41Å; K22-I121 VanDerWaalsContact CD-CD1 3.41Å; K22-I121 HydrophobicContact CG-CD1 3.51Å; K22-I121 HydrophobicContact CG-CG1 4.33Å; N118-I121 HydrophobicContact CB-CD1 3.79Å; N118-I121 HydrophobicContact CB-CG1 4.14Å; N118-I121 WeakPolarHBondContact O-CB 3.43Å; N118-I121 PolarHBondContact O-N 2.88Å; F119-I121 PolarHBondContact O-N 3.46Å; I121-A123 VanDerWaalsContact C-N 3.29Å; I121-A123 PolarHBondContact O-N 2.89Å; I121-S124 PolarHBondContact O-N 3.03Å; I121-S124 PolarHBondContact O-OG 3.27Å; I121-I125 HydrophobicContact CG2-CD1 4.17Å; I121-I125 WeakPolarHBondContact O-CG1 3.36Å; I121-I125 PolarHBondContact O-N 3.1Å
122R77.9Confident81.9Confident78 Ų7856 Ų5629%0.29429%0.291SS..Hα-helixtrans-58.5-45.4170.4-74.7-177.9-88.7172.3-10110.7V112 L113 T117 N118 F119 F126V112-R122 HydrophobicContact CG1-CG 3.88Å; L113-R122 HydrophobicContact CD2-CG 4.27Å; T117-R122 PolarHBondContact O-NE 3.36Å; T117-R122 PolarHBondContact O-NH2 3.22Å; T117-R122 WeakPolarHBondContact OG1-CG 3.41Å; N118-R122 PolarHBondContact O-N 3.14Å; N118-R122 VanDerWaalsContact O-N 3.09Å; F119-R122 WeakPolarHBondContact O-CB 3.26Å; F119-R122 PolarHBondContact O-N 3.04Å; R122-F126 WeakPolarHBondContact O-CB 3.39Å; R122-F126 PolarHBondContact O-N 3.37Å
123A79.7Confident82.2Confident25 Ų2557.6 Ų57.621%0.20730%0.304CS..Hα-helixtrans-63.8-45.6179.500000111.9F119 I120 I121 I125 F126 F127F119-A123 WeakPolarHBondContact O-CB 3.29Å; F119-A123 PolarHBondContact O-N 3.5Å; I120-A123 PolarHBondContact O-N 3Å; I121-A123 VanDerWaalsContact C-N 3.29Å; I121-A123 PolarHBondContact O-N 2.89Å; A123-I125 PolarHBondContact O-N 2.91Å; A123-F126 WeakPolarHBondContact O-CB 3.29Å; A123-F126 PolarHBondContact O-N 3.37Å; A123-F127 HydrophobicContact CB-CE2 4.48Å; A123-F127 WeakPolarHBondContact O-CD2 3.45Å; A123-F127 PolarHBondContact O-N 2.85Å
124S78.3Confident82.3Confident55 Ų5559 Ų5939%0.38530%0.304SS..Hα-helixtrans-62.1-44.4-179.567.10000112.6I120 I121 F127 G128I120-S124 PolarHBondContact O-N 3.37Å; I121-S124 PolarHBondContact O-N 3.03Å; I121-S124 PolarHBondContact O-OG 3.27Å; S124-F127 PolarHBondContact O-N 3.44Å; S124-G128 PolarHBondContact O-N 2.93Å
125I79.5Confident82.2Confident35 Ų3558.2 Ų58.218%0.17930%0.299CS..Hα-helixtrans-68.4-38.5177.2-64.6174.4000110.9V108 F109 V112 I121 A123 G128 L129V108-I125 HydrophobicContact CG1-CD1 4.36Å; V108-I125 HydrophobicContact CG1-CG2 4.14Å; F109-I125 HydrophobicContact CB-CG2 3.98Å; F109-I125 HydrophobicContact CD2-CG2 4.1Å; V112-I125 HydrophobicContact CB-CD1 4.32Å; V112-I125 HydrophobicContact CG1-CD1 4.05Å; V112-I125 HydrophobicContact CG2-CD1 3.71Å; I121-I125 HydrophobicContact CG2-CD1 4.17Å; I121-I125 WeakPolarHBondContact O-CG1 3.36Å; I121-I125 PolarHBondContact O-N 3.1Å; A123-I125 PolarHBondContact O-N 2.91Å; I125-G128 PolarHBondContact O-N 3.23Å; I125-L129 PolarHBondContact O-N 3.36Å
126F86Confident82.5Confident85 Ų8556.9 Ų56.937%0.37329%0.293SS..Hα-helixtrans-59.5-46.4173.9177.2-110.8000112F109 R122 A123 L129 L130F109-F126 HydrophobicContact CD2-CB 4.17Å; F109-F126 AromaticContact CE1-CD2 3.9Å; F109-F126 HydrophobicContact CE1-CD2 3.9Å; F109-F126 HydrophobicContact CE2-CB 3.6Å; F109-F126 HydrophobicContact CE2-CD2 4.03Å; F109-F126 HydrophobicContact CE2-CG 4.25Å; F109-F126 HydrophobicContact CZ-CB 4.01Å; F109-F126 AromaticContact CZ-CD2 3.55Å; F109-F126 HydrophobicContact CZ-CD2 3.55Å; F109-F126 HydrophobicContact CZ-CE2 4.46Å; F109-F126 HydrophobicContact CZ-CG 4.15Å; R122-F126 WeakPolarHBondContact O-CB 3.39Å; R122-F126 PolarHBondContact O-N 3.37Å; A123-F126 WeakPolarHBondContact O-CB 3.29Å; A123-F126 PolarHBondContact O-N 3.37Å; F126-L129 WeakPolarHBondContact O-CB 3.35Å; F126-L129 PolarHBondContact O-N 3.1Å; F126-L130 HydrophobicContact CD1-CD1 4.19Å; F126-L130 HydrophobicContact CE1-CD1 3.64Å; F126-L130 HydrophobicContact CE1-CG 4.17Å; F126-L130 HydrophobicContact CE2-CD2 4.38Å; F126-L130 HydrophobicContact CE2-CG 4.47Å; F126-L130 HydrophobicContact CZ-CD1 3.96Å; F126-L130 HydrophobicContact CZ-CD2 4.08Å; F126-L130 HydrophobicContact CZ-CG 4.12Å; F126-L130 WeakPolarHBondContact O-CG 3.46Å; F126-L130 PolarHBondContact O-N 2.96Å
127F85.1Confident82.9Confident127 Ų12754.4 Ų54.456%0.55728%0.283SS*.Hα-helixtrans-60.5-48.7174.5-76.9-65.4000110.7A123 S124 L129 L130 I131A123-F127 HydrophobicContact CB-CE2 4.48Å; A123-F127 WeakPolarHBondContact O-CD2 3.45Å; A123-F127 PolarHBondContact O-N 2.85Å; S124-F127 PolarHBondContact O-N 3.44Å; F127-L129 PolarHBondContact O-N 3.28Å; F127-L130 HydrophobicContact CD1-CD1 4.16Å; F127-L130 WeakPolarHBondContact O-CA 3.48Å; F127-L130 WeakPolarHBondContact O-CB 3.49Å; F127-L130 PolarHBondContact O-N 3.08Å; F127-I131 VanDerWaalsContact O-CD1 3.23Å; F127-I131 WeakPolarHBondContact O-CD1 3.44Å; F127-I131 PolarHBondContact O-N 3.38Å
128G82.1Confident83.2Confident30 Ų3057.4 Ų57.431%0.30930%0.295SS..Hα-helixtrans-50.4-44.6174.900000113S124 I125 L130 I131 D132S124-G128 PolarHBondContact O-N 2.93Å; I125-G128 PolarHBondContact O-N 3.23Å; G128-L130 PolarHBondContact O-N 3.38Å; G128-I131 PolarHBondContact O-N 3.38Å; G128-D132 PolarHBondContact O-N 3.48Å
129L88Confident83.5Confident22 Ų2253.7 Ų53.712%0.11528%0.275CS..Hα-helixtrans-60.6-42.1173.6172.662000112.7V106 F109 I125 F126 F127 I131 D132 A133V106-L129 HydrophobicContact CB-CD1 4.43Å; V106-L129 HydrophobicContact CG2-CD1 3.47Å; V106-L129 VanDerWaalsContact CG2-CD1 3.47Å; V106-L129 HydrophobicContact CG2-CD2 4.29Å; F109-L129 HydrophobicContact CB-CD2 4.15Å; F109-L129 HydrophobicContact CD1-CD2 3.8Å; F109-L129 HydrophobicContact CG-CD2 4.12Å; I125-L129 PolarHBondContact O-N 3.36Å; F126-L129 WeakPolarHBondContact O-CB 3.35Å; F126-L129 PolarHBondContact O-N 3.1Å; F127-L129 PolarHBondContact O-N 3.28Å; L129-I131 VanDerWaalsContact C-N 3.31Å; L129-I131 PolarHBondContact O-N 3.39Å; L129-D132 PolarHBondContact O-N 3.1Å; L129-A133 VanDerWaalsContact O-CB 3.28Å; L129-A133 WeakPolarHBondContact O-CB 3.42Å; L129-A133 PolarHBondContact O-N 3.42Å
130L89.7Confident83.5Confident83 Ų8347.2 Ų47.244%0.43525%0.247SC..Hα-helixtrans-62-38.2175.7-67.6179000112.3F126 F127 G128 A133 W134F126-L130 HydrophobicContact CD1-CD1 4.19Å; F126-L130 HydrophobicContact CE1-CD1 3.64Å; F126-L130 HydrophobicContact CE1-CG 4.17Å; F126-L130 HydrophobicContact CE2-CD2 4.38Å; F126-L130 HydrophobicContact CE2-CG 4.47Å; F126-L130 HydrophobicContact CZ-CD1 3.96Å; F126-L130 HydrophobicContact CZ-CD2 4.08Å; F126-L130 HydrophobicContact CZ-CG 4.12Å; F126-L130 WeakPolarHBondContact O-CG 3.46Å; F126-L130 PolarHBondContact O-N 2.96Å; F127-L130 HydrophobicContact CD1-CD1 4.16Å; F127-L130 WeakPolarHBondContact O-CA 3.48Å; F127-L130 WeakPolarHBondContact O-CB 3.49Å; F127-L130 PolarHBondContact O-N 3.08Å; G128-L130 PolarHBondContact O-N 3.38Å; L130-A133 PolarHBondContact O-N 3.32Å; L130-W134 WeakPolarHBondContact O-CB 3.33Å; L130-W134 PolarHBondContact O-N 3.07Å
131I87.3Confident83.1Confident34 Ų3448.4 Ų48.417%0.17425%0.254CS..Hα-helixtrans-66.8-42.8176.5-69.6125.8000110.8F77 I81 F127 G128 L129 W134 K135F77-I131 HydrophobicContact CD2-CD1 4.48Å; F77-I131 HydrophobicContact CE2-CB 4.26Å; F77-I131 HydrophobicContact CE2-CD1 3.22Å; F77-I131 HydrophobicContact CE2-CG1 3.7Å; F77-I131 HydrophobicContact CE2-CG2 4.01Å; F77-I131 HydrophobicContact CZ-CD1 3.27Å; F77-I131 HydrophobicContact CZ-CG1 3.78Å; I81-I131 HydrophobicContact CG1-CG2 4.43Å; F127-I131 VanDerWaalsContact O-CD1 3.23Å; F127-I131 WeakPolarHBondContact O-CD1 3.44Å; F127-I131 PolarHBondContact O-N 3.38Å; G128-I131 PolarHBondContact O-N 3.38Å; L129-I131 VanDerWaalsContact C-N 3.31Å; L129-I131 PolarHBondContact O-N 3.39Å; I131-W134 WeakPolarHBondContact O-CB 3.38Å; I131-W134 PolarHBondContact O-N 3.25Å; I131-K135 WeakPolarHBondContact O-CG 3.05Å; I131-K135 PolarHBondContact O-N 3.17Å
132D87.9Confident82.6Confident28 Ų2851.4 Ų51.415%0.1527%0.27CS..Hα-helixtrans-66.1-40.1176-72.8-23.4000111.8S105 G128 L129 W134 K135S105-D132 PolarHBondContact OG-OD2 3.3Å; G128-D132 PolarHBondContact O-N 3.48Å; L129-D132 PolarHBondContact O-N 3.1Å; D132-W134 VanDerWaalsContact C-N 3.28Å; D132-W134 PolarHBondContact O-N 3.48Å; D132-K135 WeakPolarHBondContact O-CB 3.23Å; D132-K135 PolarHBondContact O-N 3.42Å; D132-K135 VanDerWaalsContact O-N 3.14Å; D132-K135 IonicContact OD1-NZ 3.01Å; D132-K135 PolarHBondContact OD1-NZ 3.14Å
133A89.7Confident81.4Confident34 Ų3449.8 Ų49.828%0.28127%0.27SS..Hα-helixtrans-61.7-36.1173.100000112M102 L129 L130 K135 V136 P137M102-A133 HydrophobicContact CE-CB 3.92Å; L129-A133 VanDerWaalsContact O-CB 3.28Å; L129-A133 WeakPolarHBondContact O-CB 3.42Å; L129-A133 PolarHBondContact O-N 3.42Å; L130-A133 PolarHBondContact O-N 3.32Å; A133-K135 VanDerWaalsContact C-N 3.27Å; A133-K135 PolarHBondContact O-N 3.05Å; A133-V136 PolarHBondContact O-N 2.94Å; A133-P137 WeakPolarHBondContact O-CD 3.2Å
134W88.5Confident80.1Confident95 Ų9553.6 Ų53.636%0.3629%0.287SS..Hα-helixtrans-65.8-26.1175.8173.179.3000113.3W84 R85 L130 I131 D132 P137W84-W134 HydrophobicContact CB-CH2 4.18Å; W84-W134 HydrophobicContact CB-CZ3 3.8Å; R85-W134 HydrophobicContact CB-CH2 4.34Å; L130-W134 WeakPolarHBondContact O-CB 3.33Å; L130-W134 PolarHBondContact O-N 3.07Å; I131-W134 WeakPolarHBondContact O-CB 3.38Å; I131-W134 PolarHBondContact O-N 3.25Å; D132-W134 VanDerWaalsContact C-N 3.28Å; D132-W134 PolarHBondContact O-N 3.48Å; W134-P137 WeakPolarHBondContact O-CD 3.48Å; W134-P137 WeakPolarHBondContact O-CG 3.37Å
135K87.3Confident78.8Confident16 Ų1653 Ų537%0.0728%0.279CS..Hα-helixtrans-74.1-27.9176.1-63.2166.9-170164.70112.7D80 W84 L98 I131 D132 A133 K138 C139D80-K135 WeakPolarHBondContact OD2-CE 3.42Å; D80-K135 IonicContact OD2-NZ 2.94Å; D80-K135 PolarHBondContact OD2-NZ 2.86Å; W84-K135 HydrophobicContact CD2-CD 4.37Å; W84-K135 HydrophobicContact CD2-CG 4.15Å; W84-K135 HydrophobicContact CG-CD 4.36Å; W84-K135 HydrophobicContact CG-CG 4.07Å; L98-K135 HydrophobicContact CD1-CB 3.91Å; L98-K135 HydrophobicContact CD1-CD 3.72Å; L98-K135 HydrophobicContact CD1-CG 4.46Å; L98-K135 HydrophobicContact CD2-CB 3.99Å; L98-K135 HydrophobicContact CG-CB 4.43Å; I131-K135 WeakPolarHBondContact O-CG 3.05Å; I131-K135 PolarHBondContact O-N 3.17Å; D132-K135 WeakPolarHBondContact O-CB 3.23Å; D132-K135 PolarHBondContact O-N 3.42Å; D132-K135 VanDerWaalsContact O-N 3.14Å; D132-K135 IonicContact OD1-NZ 3.01Å; D132-K135 PolarHBondContact OD1-NZ 3.14Å; A133-K135 VanDerWaalsContact C-N 3.27Å; A133-K135 PolarHBondContact O-N 3.05Å; K135-K138 VanDerWaalsContact O-CB 3.3Å; K135-K138 WeakPolarHBondContact O-CB 3.41Å; K135-K138 PolarHBondContact O-N 2.9Å; K135-K138 VanDerWaalsContact O-N 3.09Å; K135-C139 PolarHBondContact O-N 3.39Å
136V87.5Confident77.4Confident17 Ų1761.3 Ų61.310%0.10331%0.308CS..Hα-helixtrans-57.1-53.4-178.9177.30000113.6L99 M102 A133 K138 C139 L140 I142L99-V136 HydrophobicContact CD2-CB 4.49Å; L99-V136 HydrophobicContact CD2-CG1 3.93Å; L99-V136 HydrophobicContact CD2-CG2 3.9Å; M102-V136 HydrophobicContact CE-CG2 4.43Å; M102-V136 HydrophobicContact CG-CG2 4.34Å; M102-V136 HydrophobicContact SD-CG2 3.44Å; M102-V136 WeakPolarHBondContact SD-CG2 3.34Å; A133-V136 PolarHBondContact O-N 2.94Å; V136-K138 PolarHBondContact O-N 3.13Å; V136-K138 VanDerWaalsContact O-N 3.13Å; V136-C139 PolarHBondContact O-N 2.72Å; V136-L140 HydrophobicContact CG1-CD1 3.98Å; V136-L140 PolarHBondContact O-N 2.86Å; V136-I142 HydrophobicContact CG1-CD1 4.49Å
137P84.4Confident75.7Confident72 Ų7265.8 Ų65.847%0.46833%0.33SS..Hα-helixtrans-67.1-12.8178.328.1-36.7000113.2A133 W134 C139A133-P137 WeakPolarHBondContact O-CD 3.2Å; W134-P137 WeakPolarHBondContact O-CD 3.48Å; W134-P137 WeakPolarHBondContact O-CG 3.37Å; P137-C139 VanDerWaalsContact C-N 3.34Å
138K81.6Confident74Confident79 Ų7964.6 Ų64.634%0.34333%0.33SS..Hα-helixtrans-76.4-25.3170.7-64.8-69.4-173.2175.50112.3K135 V136 K162K135-K138 VanDerWaalsContact O-CB 3.3Å; K135-K138 WeakPolarHBondContact O-CB 3.41Å; K135-K138 PolarHBondContact O-N 2.9Å; K135-K138 VanDerWaalsContact O-N 3.09Å; V136-K138 PolarHBondContact O-N 3.13Å; V136-K138 VanDerWaalsContact O-N 3.13Å; K138-K162 WeakPolarHBondContact O-CE 3.32Å; K138-K162 PolarHBondContact O-NZ 3.3Å
139C80Confident72.4Confident1 Ų170.7 Ų70.71%0.00734%0.343CS..Hα-helixtrans-103.8-31.9-175.6-60.40000114W84 L90 V95 L98 K135 V136 P137 K162W84-C139 WeakPolarHBondContact CZ3-SG 3.23Å; L90-C139 HydrophobicContact CD1-CB 3.96Å; V95-C139 HydrophobicContact CG1-CB 4.08Å; V95-C139 HydrophobicContact CG2-CB 4.26Å; L98-C139 HydrophobicContact CD2-CB 3.95Å; L98-C139 WeakPolarHBondContact CD2-SG 3.28Å; K135-C139 PolarHBondContact O-N 3.39Å; V136-C139 PolarHBondContact O-N 2.72Å; P137-C139 VanDerWaalsContact C-N 3.34Å; C139-K162 PolarHBondContact O-N 2.96Å
140L79.5Confident70.6Confident13 Ų1378.8 Ų78.87%0.06837%0.373CS..EExtended strand (participates in β ladder)trans-115.8122.4179.7-58.5176.9000108.9V95 L99 V136 I142 V159 R160 E161V95-L140 HydrophobicContact CG1-CD2 3.82Å; V95-L140 HydrophobicContact CG1-CG 4.39Å; L99-L140 HydrophobicContact CD1-CD1 3.86Å; L99-L140 HydrophobicContact CD2-CD1 3.7Å; L99-L140 HydrophobicContact CG-CD1 4.34Å; V136-L140 HydrophobicContact CG1-CD1 3.98Å; V136-L140 PolarHBondContact O-N 2.86Å; L140-I142 VanDerWaalsContact C-N 3.35Å; L140-I142 HydrophobicContact CB-CG1 4.41Å; L140-I142 PolarHBondContact O-N 3.04Å; L140-V159 HydrophobicContact CB-CG1 3.85Å; L140-V159 HydrophobicContact CD1-CG1 3.53Å; L140-V159 HydrophobicContact CD2-CG1 4.07Å; L140-V159 HydrophobicContact CG-CG1 4.03Å; L140-R160 CarbonylContact C-O 3.58Å; L140-R160 WeakPolarHBondContact CA-O 3.31Å; L140-E161 HydrophobicContact CD2-CB 4.46Å; L140-E161 HydrophobicContact CD2-CG 3.89Å
141D71.5Confident68.8Low70 Ų7082.4 Ų82.437%0.37439%0.385SS..EExtended strand (participates in β ladder)trans-7495.5167.5-66.1-32.3000107.4S143 R160D141-S143 PolarHBondContact O-N 3.48Å; D141-R160 PolarHBondContact N-O 3.29Å; D141-R160 PolarHBondContact O-N 3.22Å
142I62.5Low67.1Low81 Ų8183 Ų8342%0.41540%0.4SS..EExtended strand (participates in β ladder)trans-77.783.9173.8-56.7172.8000106.9V136 L140 L157V136-I142 HydrophobicContact CG1-CD1 4.49Å; L140-I142 VanDerWaalsContact C-N 3.35Å; L140-I142 HydrophobicContact CB-CG1 4.41Å; L140-I142 PolarHBondContact O-N 3.04Å; I142-L157 HydrophobicContact CG2-CD2 3.83Å
143S53.7Low65.6Low44 Ų4492.7 Ų92.731%0.30843%0.434SS..EExtended strand (participates in β ladder)trans-83.3120.4172.960.90000109.4D141 D145 C158D141-S143 PolarHBondContact O-N 3.48Å; S143-D145 PolarHBondContact O-N 3.43Å; S143-D145 VanDerWaalsContact O-N 3.1Å; S143-C158 PolarHBondContact N-O 3.06Å; S143-C158 CarbonylContact O-C 3.47Å; S143-C158 WeakPolarHBondContact O-CA 3.46Å; S143-C158 WeakPolarHBondContact O-CB 3.41Å; S143-C158 PolarHBondContact O-N 3.49Å; S143-C158 PolarHBondContact OG-O 3.19Å
144L51.3Low63.7Low105 Ų10596 Ų9655%0.5545%0.446SS..EExtended strand (participates in β ladder)trans-75.995.5169.4-84.3145.8000107.7R146 P155 L157L144-R146 VanDerWaalsContact C-N 3.31Å; L144-R146 PolarHBondContact O-N 2.9Å; L144-P155 HydrophobicContact CD2-CB 3.72Å; L144-P155 HydrophobicContact CD2-CG 3.43Å; L144-P155 VanDerWaalsContact CD2-CG 3.43Å; L144-L157 HydrophobicContact CD2-CD2 3.65Å; L144-L157 HydrophobicContact CG-CD2 3.92Å
145D50.7Low61.8Low41 Ų4193.7 Ų93.722%0.21944%0.443CS..EExtended strand (participates in β ladder)trans-72.193.5173.5-170.3-2.9000108.1S143 Q147 K156 C158S143-D145 PolarHBondContact O-N 3.43Å; S143-D145 VanDerWaalsContact O-N 3.1Å; D145-Q147 PolarHBondContact O-N 3.38Å; D145-Q147 VanDerWaalsContact OD1-CB 3.23Å; D145-Q147 WeakPolarHBondContact OD1-CB 3.31Å; D145-Q147 PolarHBondContact OD1-N 3.46Å; D145-Q147 VanDerWaalsContact OD1-N 3.12Å; D145-K156 PolarHBondContact N-O 3.26Å; D145-K156 PolarHBondContact O-N 3.28Å; D145-C158 HydrophobicContact CB-CB 3.99Å
146R50.1Low59.9Low211 Ų21197.6 Ų97.680%0.79646%0.46SS*.EExtended strand (participates in β ladder)trans-69.7-10.9-179.6-145.8174.7177.1-168.4-1.5111.6L144L144-R146 VanDerWaalsContact C-N 3.31Å; L144-R146 PolarHBondContact O-N 2.9Å
147Q52Low58.3Low178 Ų178102 Ų10283%0.83248%0.483SS*.EExtended strand (participates in β ladder)trans-86.9-32.5-172.3-136.9171.63.700112.6D145D145-Q147 PolarHBondContact O-N 3.38Å; D145-Q147 VanDerWaalsContact OD1-CB 3.23Å; D145-Q147 WeakPolarHBondContact OD1-CB 3.31Å; D145-Q147 PolarHBondContact OD1-N 3.46Å; D145-Q147 VanDerWaalsContact OD1-N 3.12Å
148N49.6Very low56.6Low102 Ų102100 Ų10055%0.54547%0.47SS..EExtended strand (participates in β ladder)trans-113.991.7176.1-92.7-38.7000111.4W150 K156N148-W150 PolarHBondContact O-N 3.31Å; N148-K156 HydrophobicContact CB-CD 4.28Å; N148-K156 WeakPolarHBondContact O-CB 3.46Å
149R47.1Very low55.6Low159 Ų159100 Ų10060%0.648%0.476SS*.EExtended strand (participates in β ladder)trans-76.4120.7179.6-59-172.7-168.6161.44.9110.5F151 G152R149-F151 PolarHBondContact O-N 3.4Å; R149-F151 VanDerWaalsContact O-N 3.09Å; R149-G152 WeakPolarHBondContact CD-O 3.22Å; R149-G152 PolarHBondContact NH1-O 2.94Å; R149-G152 VanDerWaalsContact NH1-O 3.09Å
150W51.1Low54.7Low192 Ų192107.3 Ų107.373%0.72750%0.504SS*.THydrogen-bonded Turntrans-64.8-16.8-176.2-175.157.4000113.6N148 I154N148-W150 PolarHBondContact O-N 3.31Å; W150-I154 PolarHBondContact N-O 3.07Å
151F50.6Low54.2Low158 Ų158108.9 Ų108.969%0.69351%0.511SS*.THydrogen-bonded Turntrans-154.535.9176.4-101.9-83.3000112.2R149 R153R149-F151 PolarHBondContact O-N 3.4Å; R149-F151 VanDerWaalsContact O-N 3.09Å; F151-R153 PolarHBondContact O-N 3.04Å
152G53.7Low54.1Low47 Ų47107.8 Ų107.849%0.48550%0.503SS..SBendtrans67.3-17.1-177.100000116.2R149R149-G152 WeakPolarHBondContact CD-O 3.22Å; R149-G152 PolarHBondContact NH1-O 2.94Å; R149-G152 VanDerWaalsContact NH1-O 3.09Å
153R54.8Low54.1Low231 Ų231108.2 Ų108.287%0.87251%0.509SS*.SBendtrans-119.7-30.3-176.3-118.4-177.3-90.8162.9-7.3115.1F151F151-R153 PolarHBondContact O-N 3.04Å
154I50.9Low54.8Low103 Ų103108 Ų10853%0.52851%0.507SS..SBendtrans-108.8121.5-174.6-49.2175.5000109.8W150W150-I154 PolarHBondContact N-O 3.07Å
155P47.8Very low55.8Low47 Ų47103 Ų10331%0.30548%0.481SS..EExtended strand (participates in β ladder)trans-62.5136.5176.526-33.6000110.6L144 L157L144-P155 HydrophobicContact CD2-CB 3.72Å; L144-P155 HydrophobicContact CD2-CG 3.43Å; L144-P155 VanDerWaalsContact CD2-CG 3.43Å; P155-L157 PolarHBondContact O-N 3Å
156K47Very low56.5Low99 Ų99104.1 Ų104.143%0.4349%0.49SS..EExtended strand (participates in β ladder)trans-70.3118.4-178.6177.1-179.6-177-176.40108.8D145 N148 C158D145-K156 PolarHBondContact N-O 3.26Å; D145-K156 PolarHBondContact O-N 3.28Å; N148-K156 HydrophobicContact CB-CD 4.28Å; N148-K156 WeakPolarHBondContact O-CB 3.46Å; K156-C158 PolarHBondContact O-N 3.28Å
157L53.6Low57.3Low110 Ų110101.6 Ų101.658%0.57649%0.487SS*.EExtended strand (participates in β ladder)trans-68.498.6169.1-66.6168.5000107.4I142 L144 P155 V159I142-L157 HydrophobicContact CG2-CD2 3.83Å; L144-L157 HydrophobicContact CD2-CD2 3.65Å; L144-L157 HydrophobicContact CG-CD2 3.92Å; P155-L157 PolarHBondContact O-N 3Å; L157-V159 PolarHBondContact O-N 2.89Å
158C49.5Very low58.5Low28 Ų2893.9 Ų93.919%0.18945%0.452CS..EExtended strand (participates in β ladder)trans-89.892.5173.9-159.70000107S143 D145 K156 R160S143-C158 PolarHBondContact N-O 3.06Å; S143-C158 CarbonylContact O-C 3.47Å; S143-C158 WeakPolarHBondContact O-CA 3.46Å; S143-C158 WeakPolarHBondContact O-CB 3.41Å; S143-C158 PolarHBondContact O-N 3.49Å; S143-C158 PolarHBondContact OG-O 3.19Å; D145-C158 HydrophobicContact CB-CB 3.99Å; K156-C158 PolarHBondContact O-N 3.28Å; C158-R160 PolarHBondContact O-N 3.01Å
159V60.3Low60Low80 Ų8091.4 Ų91.449%0.48544%0.443SS..EExtended strand (participates in β ladder)trans-76.8102.4175.6-176.90000107.3L140 L157L140-V159 HydrophobicContact CB-CG1 3.85Å; L140-V159 HydrophobicContact CD1-CG1 3.53Å; L140-V159 HydrophobicContact CD2-CG1 4.07Å; L140-V159 HydrophobicContact CG-CG1 4.03Å; L157-V159 PolarHBondContact O-N 2.89Å
160R61.9Low61.8Low155 Ų15583.8 Ų83.859%0.58541%0.414SS*.EExtended strand (participates in β ladder)trans-99.7133.4170.8-69-173.4-155.3-1514.3109L140 D141 C158L140-R160 CarbonylContact C-O 3.58Å; L140-R160 WeakPolarHBondContact CA-O 3.31Å; D141-R160 PolarHBondContact N-O 3.29Å; D141-R160 PolarHBondContact O-N 3.22Å; C158-R160 PolarHBondContact O-N 3.01Å
161E68Low63.5Low45 Ų4577.4 Ų77.421%0.2139%0.392CS..EExtended strand (participates in β ladder)trans-66.5141166.1-64.7169166.600108.2R96 L140 Y165 V166 K171R96-E161 IonicContact CZ-OE1 3.95Å; R96-E161 IonicContact NH2-OE1 3.23Å; R96-E161 PolarHBondContact NH2-OE1 2.91Å; L140-E161 HydrophobicContact CD2-CB 4.46Å; L140-E161 HydrophobicContact CD2-CG 3.89Å; E161-Y165 HydrophobicContact CB-CD1 3.91Å; E161-Y165 HydrophobicContact CG-CD1 4.19Å; E161-Y165 HydrophobicContact CG-CE1 4.38Å; E161-V166 HydrophobicContact CB-CG2 3.65Å; E161-K171 WeakPolarHBondContact OE2-CD 3.48Å; E161-K171 WeakPolarHBondContact OE2-CE 3.2Å; E161-K171 IonicContact OE2-NZ 2.72Å; E161-K171 PolarHBondContact OE2-NZ 2.92Å
162K69.6Low65.2Low48 Ų4876.5 Ų76.521%0.20939%0.389CS..PPolyproline II helixtrans-55.1144.8178.9-83.6-167.71711730111.8L90 K138 C139 S164 Y165 V166L90-K162 HydrophobicContact CD1-CB 3.94Å; L90-K162 HydrophobicContact CD1-CD 4.03Å; L90-K162 HydrophobicContact CD1-CG 4.28Å; L90-K162 HydrophobicContact CG-CD 4.46Å; K138-K162 WeakPolarHBondContact O-CE 3.32Å; K138-K162 PolarHBondContact O-NZ 3.3Å; C139-K162 PolarHBondContact O-N 2.96Å; K162-S164 VanDerWaalsContact C-N 3.31Å; K162-S164 PolarHBondContact O-N 3.26Å; K162-Y165 WeakPolarHBondContact O-CA 3.22Å; K162-Y165 VanDerWaalsContact O-CB 3.3Å; K162-Y165 WeakPolarHBondContact O-CB 3.09Å; K162-Y165 PolarHBondContact O-N 2.97Å; K162-V166 PolarHBondContact O-N 2.96Å
163V64Low66.9Low89 Ų8977.3 Ų77.354%0.53938%0.378SS..Hα-helixtrans-53.9-46.1-179.2179.80000111.9Y165 V166 E167V163-Y165 PolarHBondContact O-N 3.41Å; V163-Y165 VanDerWaalsContact O-N 3.08Å; V163-V166 PolarHBondContact O-N 3.21Å; V163-E167 HydrophobicContact CG1-CG 3.91Å; V163-E167 VanDerWaalsContact CG1-OE1 3.24Å; V163-E167 WeakPolarHBondContact CG1-OE1 3.18Å; V163-E167 PolarHBondContact O-N 3.44Å
164S67.5Low68.6Low39 Ų3966.3 Ų66.327%0.27334%0.337SS..Hα-helixtrans-52.9-32.5175156.60000113.4S89 L90 K162 S168S89-S164 WeakPolarHBondContact CA-OG 3.32Å; S89-S164 WeakPolarHBondContact CB-OG 3.22Å; S89-S164 PolarHBondContact OG-OG 3.46Å; L90-S164 PolarHBondContact N-OG 3.1Å; L90-S164 VanDerWaalsContact N-OG 3.1Å; K162-S164 VanDerWaalsContact C-N 3.31Å; K162-S164 PolarHBondContact O-N 3.26Å; S164-S168 WeakPolarHBondContact O-CB 3.23Å; S164-S168 PolarHBondContact O-OG 3.48Å
165Y71.6Confident70.5Confident0 Ų064.6 Ų64.60%033%0.331CS..Hα-helixtrans-79.6-45175.4-178.1-107000112L90 L93 V95 R96 E161 K162 V163 S168 T170 K171 D174L90-Y165 HydrophobicContact CB-CD2 4.39Å; L93-Y165 WeakPolarHBondContact O-CE2 3.41Å; V95-Y165 HydrophobicContact CB-CE1 4.17Å; V95-Y165 HydrophobicContact CB-CE2 4.22Å; V95-Y165 HydrophobicContact CG2-CD1 4.09Å; V95-Y165 HydrophobicContact CG2-CD2 3.65Å; V95-Y165 HydrophobicContact CG2-CE1 4.1Å; V95-Y165 HydrophobicContact CG2-CE2 3.71Å; V95-Y165 HydrophobicContact CG2-CG 3.83Å; R96-Y165 PolarHBondContact NH1-OH 2.88Å; R96-Y165 VanDerWaalsContact NH1-OH 3.16Å; E161-Y165 HydrophobicContact CB-CD1 3.91Å; E161-Y165 HydrophobicContact CG-CD1 4.19Å; E161-Y165 HydrophobicContact CG-CE1 4.38Å; K162-Y165 WeakPolarHBondContact O-CA 3.22Å; K162-Y165 VanDerWaalsContact O-CB 3.3Å; K162-Y165 WeakPolarHBondContact O-CB 3.09Å; K162-Y165 PolarHBondContact O-N 2.97Å; V163-Y165 PolarHBondContact O-N 3.41Å; V163-Y165 VanDerWaalsContact O-N 3.08Å; Y165-S168 PolarHBondContact O-N 2.97Å; Y165-S168 PolarHBondContact O-OG 2.88Å; Y165-T170 HydrophobicContact CD2-CG2 4.48Å; Y165-T170 HydrophobicContact CE2-CG2 4Å; Y165-K171 HydrophobicContact CD1-CB 4.17Å; Y165-K171 HydrophobicContact CD1-CD 4.35Å; Y165-K171 HydrophobicContact CD1-CG 4.42Å; Y165-K171 HydrophobicContact CE1-CB 3.81Å; Y165-K171 HydrophobicContact CE1-CD 4.18Å; Y165-K171 HydrophobicContact CE1-CG 3.87Å; Y165-K171 HydrophobicContact CE2-CB 4.49Å; Y165-K171 WeakPolarHBondContact O-CB 3.45Å; Y165-D174 WeakPolarHBondContact OH-CB 3.34Å; Y165-D174 PolarHBondContact OH-OD2 2.91Å
166V65.7Low72.5Confident66 Ų6665.8 Ų65.840%0.433%0.333SS..Hα-helixtrans-67-38.6-175.1178.20000112.6E161 K162 V163 S168 K171E161-V166 HydrophobicContact CB-CG2 3.65Å; K162-V166 PolarHBondContact O-N 2.96Å; V163-V166 PolarHBondContact O-N 3.21Å; V166-S168 VanDerWaalsContact C-N 3.33Å; V166-K171 HydrophobicContact CB-CD 4.42Å; V166-K171 HydrophobicContact CG1-CD 4.37Å; V166-K171 HydrophobicContact CG2-CD 4.36Å
167E67.5Low74.7Confident158 Ų15861.4 Ų61.474%0.73832%0.316SS*.SBendtrans-78-21.5179-68.317916900112.4V163V163-E167 HydrophobicContact CG1-CG 3.91Å; V163-E167 VanDerWaalsContact CG1-OE1 3.24Å; V163-E167 WeakPolarHBondContact CG1-OE1 3.18Å; V163-E167 PolarHBondContact O-N 3.44Å
168S76Confident76.5Confident15 Ų1557.5 Ų57.511%0.10529%0.294CS..SBendtrans-78.2147.117977.60000112.2S164 Y165 V166 T170 K171S164-S168 WeakPolarHBondContact O-CB 3.23Å; S164-S168 PolarHBondContact O-OG 3.48Å; Y165-S168 PolarHBondContact O-N 2.97Å; Y165-S168 PolarHBondContact O-OG 2.88Å; V166-S168 VanDerWaalsContact C-N 3.33Å; S168-T170 PolarHBondContact O-N 3.4Å; S168-T170 WeakPolarHBondContact OG-CB 3.47Å; S168-T170 PolarHBondContact OG-N 3.48Å; S168-T170 PolarHBondContact OG-OG1 2.6Å; S168-K171 PolarHBondContact O-N 3.28Å
169S81.1Confident78.5Confident50 Ų5061.9 Ų61.935%0.3531%0.31SS..Hα-helixtrans-59.9-15.7169.656.30000113.1K171 E172 Y173 L235S169-K171 VanDerWaalsContact C-N 3.25Å; S169-K171 PolarHBondContact O-N 2.98Å; S169-E172 PolarHBondContact O-N 3.46Å; S169-Y173 VanDerWaalsContact O-CD2 3.25Å; S169-Y173 WeakPolarHBondContact O-CD2 3.22Å; S169-Y173 PolarHBondContact O-N 3.02Å; S169-L235 WeakPolarHBondContact OG-CD2 3.13Å
170T86.3Confident80Confident0 Ų064 Ų640%031%0.31CS..Hα-helixtrans-52.6-42.6173.4-42.80000111.7G92 Y165 S168 E172 Y173 D174 I231 L235G92-T170 PolarHBondContact N-OG1 3.39Å; Y165-T170 HydrophobicContact CD2-CG2 4.48Å; Y165-T170 HydrophobicContact CE2-CG2 4Å; S168-T170 PolarHBondContact O-N 3.4Å; S168-T170 WeakPolarHBondContact OG-CB 3.47Å; S168-T170 PolarHBondContact OG-N 3.48Å; S168-T170 PolarHBondContact OG-OG1 2.6Å; T170-E172 PolarHBondContact O-N 2.89Å; T170-Y173 PolarHBondContact O-N 3.06Å; T170-D174 VanDerWaalsContact O-CB 3.27Å; T170-D174 WeakPolarHBondContact O-CB 3.49Å; T170-D174 PolarHBondContact O-N 2.74Å; T170-I231 HydrophobicContact CG2-CG2 3.99Å; T170-L235 HydrophobicContact CG2-CD1 4.36Å
171K85.5Confident81.5Confident58 Ų5857.4 Ų57.425%0.25229%0.286SS..Hα-helixtrans-63.8-43-177.4174.3173.6174.4161.60112.1E161 Y165 V166 S168 S169 D174 V175E161-K171 WeakPolarHBondContact OE2-CD 3.48Å; E161-K171 WeakPolarHBondContact OE2-CE 3.2Å; E161-K171 IonicContact OE2-NZ 2.72Å; E161-K171 PolarHBondContact OE2-NZ 2.92Å; Y165-K171 HydrophobicContact CD1-CB 4.17Å; Y165-K171 HydrophobicContact CD1-CD 4.35Å; Y165-K171 HydrophobicContact CD1-CG 4.42Å; Y165-K171 HydrophobicContact CE1-CB 3.81Å; Y165-K171 HydrophobicContact CE1-CD 4.18Å; Y165-K171 HydrophobicContact CE1-CG 3.87Å; Y165-K171 HydrophobicContact CE2-CB 4.49Å; Y165-K171 WeakPolarHBondContact O-CB 3.45Å; V166-K171 HydrophobicContact CB-CD 4.42Å; V166-K171 HydrophobicContact CG1-CD 4.37Å; V166-K171 HydrophobicContact CG2-CD 4.36Å; S168-K171 PolarHBondContact O-N 3.28Å; S169-K171 VanDerWaalsContact C-N 3.25Å; S169-K171 PolarHBondContact O-N 2.98Å; K171-D174 PolarHBondContact O-N 3.29Å; K171-V175 HydrophobicContact CG-CG2 4.49Å; K171-V175 VanDerWaalsContact O-CG2 3.3Å; K171-V175 WeakPolarHBondContact O-CG2 3.46Å; K171-V175 PolarHBondContact O-N 3.45Å
172E87.7Confident82.6Confident138 Ų13856.8 Ų56.865%0.64529%0.287SS*.Hα-helixtrans-63.2-44.8179.5-62.5-174.7170.400111S169 T170 D174 V175 M176S169-E172 PolarHBondContact O-N 3.46Å; T170-E172 PolarHBondContact O-N 2.89Å; E172-D174 VanDerWaalsContact C-N 3.35Å; E172-V175 PolarHBondContact O-N 2.85Å; E172-M176 WeakPolarHBondContact O-CB 3.45Å; E172-M176 PolarHBondContact O-N 3.16Å
173Y89Confident83.7Confident65 Ų6562.6 Ų62.626%0.25531%0.308SS..Hα-helixtrans-67.9-34.9177.1-61.4-40.2000112.7S169 T170 M176 A177 K234 L235S169-Y173 VanDerWaalsContact O-CD2 3.25Å; S169-Y173 WeakPolarHBondContact O-CD2 3.22Å; S169-Y173 PolarHBondContact O-N 3.02Å; T170-Y173 PolarHBondContact O-N 3.06Å; Y173-M176 PolarHBondContact O-N 2.88Å; Y173-A177 VanDerWaalsContact O-CB 3.26Å; Y173-A177 WeakPolarHBondContact O-CB 3.37Å; Y173-A177 PolarHBondContact O-N 2.87Å; Y173-K234 HydrophobicContact CD1-CB 3.8Å; Y173-K234 HydrophobicContact CD1-CD 4.32Å; Y173-K234 HydrophobicContact CD1-CG 3.95Å; Y173-K234 HydrophobicContact CD2-CB 3.71Å; Y173-K234 HydrophobicContact CE1-CB 4.06Å; Y173-K234 HydrophobicContact CE1-CD 4.31Å; Y173-K234 HydrophobicContact CE1-CG 4.34Å; Y173-K234 HydrophobicContact CE2-CB 3.94Å; Y173-K234 HydrophobicContact CG-CB 3.64Å; Y173-K234 HydrophobicContact CG-CG 4.15Å; Y173-L235 HydrophobicContact CD2-CD2 3.8Å; Y173-L235 HydrophobicContact CD2-CG 4.04Å; Y173-L235 HydrophobicContact CE2-CD2 3.78Å; Y173-L235 HydrophobicContact CE2-CG 4.35Å
174D90.6Very high85Confident0 Ų062.3 Ų62.30%031%0.306CS..Hα-helixtrans-68.1-43.8175.7-174.149.5000112.1S94 R96 Y165 T170 K171 E172 M176 A177 F178 I231S94-D174 WeakPolarHBondContact CB-OD1 3.11Å; S94-D174 PolarHBondContact OG-OD1 3.21Å; R96-D174 WeakPolarHBondContact CB-OD2 3.41Å; R96-D174 WeakPolarHBondContact CD-OD2 3.48Å; R96-D174 WeakPolarHBondContact CG-OD2 3.24Å; R96-D174 IonicContact CZ-OD2 3.68Å; R96-D174 PolarHBondContact N-OD2 3.5Å; R96-D174 IonicContact NE-OD2 3.84Å; R96-D174 IonicContact NH1-OD2 2.77Å; R96-D174 PolarHBondContact NH1-OD2 3.4Å; Y165-D174 WeakPolarHBondContact OH-CB 3.34Å; Y165-D174 PolarHBondContact OH-OD2 2.91Å; T170-D174 VanDerWaalsContact O-CB 3.27Å; T170-D174 WeakPolarHBondContact O-CB 3.49Å; T170-D174 PolarHBondContact O-N 2.74Å; K171-D174 PolarHBondContact O-N 3.29Å; E172-D174 VanDerWaalsContact C-N 3.35Å; D174-M176 VanDerWaalsContact C-N 3.31Å; D174-M176 PolarHBondContact O-N 2.91Å; D174-A177 PolarHBondContact O-N 3.44Å; D174-F178 WeakPolarHBondContact O-CD2 3.38Å; D174-F178 PolarHBondContact O-N 3.41Å; D174-F178 WeakPolarHBondContact OD1-CD2 3.27Å; D174-F178 WeakPolarHBondContact OD1-CE2 3.1Å; D174-I231 HydrophobicContact CB-CD1 3.79Å; D174-I231 HydrophobicContact CB-CG1 4.44Å; D174-I231 WeakPolarHBondContact OD1-CD1 3.26Å
175V90.3Very high86.1Confident66 Ų6661 Ų6140%0.430%0.296SS..Hα-helixtrans-58.9-46.1172.7172.10000110.5K171 E172 F178 K179K171-V175 HydrophobicContact CG-CG2 4.49Å; K171-V175 VanDerWaalsContact O-CG2 3.3Å; K171-V175 WeakPolarHBondContact O-CG2 3.46Å; K171-V175 PolarHBondContact O-N 3.45Å; E172-V175 PolarHBondContact O-N 2.85Å; V175-F178 PolarHBondContact O-N 3.45Å; V175-K179 VanDerWaalsContact O-CB 3.32Å; V175-K179 WeakPolarHBondContact O-CB 3.47Å; V175-K179 PolarHBondContact O-N 3.36Å
176M90.3Very high87.1Confident73 Ų7367.2 Ų67.236%0.3632%0.323SS..Hα-helixtrans-62.5-45.5179-176.2179.3-68.100111.6E172 Y173 D174 K179 Y180 F230E172-M176 WeakPolarHBondContact O-CB 3.45Å; E172-M176 PolarHBondContact O-N 3.16Å; Y173-M176 PolarHBondContact O-N 2.88Å; D174-M176 VanDerWaalsContact C-N 3.31Å; D174-M176 PolarHBondContact O-N 2.91Å; M176-K179 PolarHBondContact O-N 2.85Å; M176-Y180 HydrophobicContact CG-CD2 3.74Å; M176-Y180 HydrophobicContact CG-CE2 3.33Å; M176-Y180 WeakPolarHBondContact O-CD2 3.23Å; M176-Y180 PolarHBondContact O-N 3.46Å; M176-Y180 VanDerWaalsContact O-N 3.09Å; M176-Y180 HydrophobicContact SD-CE2 3.97Å; M176-F230 HydrophobicContact CG-CE1 4.3Å; M176-F230 HydrophobicContact CG-CZ 4.35Å; M176-F230 HydrophobicContact SD-CE1 4.32Å; M176-F230 HydrophobicContact SD-CZ 4.12Å
177A92.1Very high88.5Confident7 Ų768.3 Ų68.36%0.05833%0.332CS..Hα-helixtrans-58.5-51.6177.900000111.1Y173 D174 K179 Y180 L181 P227 F230Y173-A177 VanDerWaalsContact O-CB 3.26Å; Y173-A177 WeakPolarHBondContact O-CB 3.37Å; Y173-A177 PolarHBondContact O-N 2.87Å; D174-A177 PolarHBondContact O-N 3.44Å; A177-K179 VanDerWaalsContact C-N 3.33Å; A177-K179 PolarHBondContact O-N 2.85Å; A177-Y180 PolarHBondContact O-N 2.83Å; A177-L181 VanDerWaalsContact O-CB 3.24Å; A177-L181 WeakPolarHBondContact O-CB 3.16Å; A177-L181 PolarHBondContact O-N 3.02Å; A177-P227 HydrophobicContact CB-CB 4.01Å; A177-F230 HydrophobicContact CB-CB 4.28Å; A177-F230 HydrophobicContact CB-CD1 3.61Å; A177-F230 HydrophobicContact CB-CE1 4.22Å; A177-F230 HydrophobicContact CB-CG 4.18Å
178F91.6Very high89.7Confident28 Ų2863.6 Ų63.612%0.12331%0.311CS..Hα-helixtrans-65.8-34.4179.7-90.8-91.6000112.8R96 S97 F100 D174 V175 L181 S182 P227R96-F178 VanDerWaalsContact C-CZ 3.46Å; R96-F178 HydrophobicContact CB-CD1 4.28Å; R96-F178 HydrophobicContact CB-CD2 3.48Å; R96-F178 VanDerWaalsContact CB-CD2 3.48Å; R96-F178 HydrophobicContact CB-CE1 4.13Å; R96-F178 HydrophobicContact CB-CE2 3.3Å; R96-F178 HydrophobicContact CB-CG 3.98Å; R96-F178 HydrophobicContact CB-CZ 3.66Å; R96-F178 HydrophobicContact CG-CD2 4.31Å; S97-F178 VanDerWaalsContact N-CZ 3.33Å; S97-F178 WeakPolarHBondContact OG-CE2 3.33Å; S97-F178 WeakPolarHBondContact OG-CZ 2.84Å; F100-F178 HydrophobicContact CB-CE1 4.34Å; F100-F178 HydrophobicContact CB-CZ 4.44Å; D174-F178 WeakPolarHBondContact O-CD2 3.38Å; D174-F178 PolarHBondContact O-N 3.41Å; D174-F178 WeakPolarHBondContact OD1-CD2 3.27Å; D174-F178 WeakPolarHBondContact OD1-CE2 3.1Å; V175-F178 PolarHBondContact O-N 3.45Å; F178-L181 HydrophobicContact CD1-CD2 4.35Å; F178-L181 HydrophobicContact CE1-CD2 4.27Å; F178-L181 PolarHBondContact O-N 2.93Å; F178-S182 VanDerWaalsContact O-CB 3.26Å; F178-S182 WeakPolarHBondContact O-CB 3.46Å; F178-S182 PolarHBondContact O-N 2.91Å; F178-S182 PolarHBondContact O-OG 3.22Å; F178-P227 HydrophobicContact CD2-CB 4.08Å; F178-P227 HydrophobicContact CD2-CG 4.31Å; F178-P227 HydrophobicContact CE2-CB 3.62Å; F178-P227 HydrophobicContact CE2-CG 3.83Å; F178-P227 HydrophobicContact CZ-CB 4.26Å; F178-P227 HydrophobicContact CZ-CG 4.01Å
179K92.2Very high90.5Very high120 Ų12064.8 Ų64.852%0.52232%0.316SS..Hα-helixtrans-61.9-50.4175.1-177.5179.7178.3-179.40111.6V175 M176 A177 L181 S182 W183V175-K179 VanDerWaalsContact O-CB 3.32Å; V175-K179 WeakPolarHBondContact O-CB 3.47Å; V175-K179 PolarHBondContact O-N 3.36Å; M176-K179 PolarHBondContact O-N 2.85Å; A177-K179 VanDerWaalsContact C-N 3.33Å; A177-K179 PolarHBondContact O-N 2.85Å; K179-L181 VanDerWaalsContact C-N 3.33Å; K179-S182 PolarHBondContact O-N 2.87Å; K179-W183 PolarHBondContact O-N 2.94Å
180Y92.2Very high91.2Very high123 Ų12364.2 Ų64.248%0.48232%0.318SS..Hα-helixtrans-65.8-39176.9-69.8-54.9000111.8M176 A177 S182 W183M176-Y180 HydrophobicContact CG-CD2 3.74Å; M176-Y180 HydrophobicContact CG-CE2 3.33Å; M176-Y180 WeakPolarHBondContact O-CD2 3.23Å; M176-Y180 PolarHBondContact O-N 3.46Å; M176-Y180 VanDerWaalsContact O-N 3.09Å; M176-Y180 HydrophobicContact SD-CE2 3.97Å; A177-Y180 PolarHBondContact O-N 2.83Å; Y180-S182 PolarHBondContact O-N 2.78Å; Y180-W183 HydrophobicContact CD1-CE3 4.01Å; Y180-W183 HydrophobicContact CD1-CZ3 4.07Å; Y180-W183 HydrophobicContact CE1-CE3 4.42Å; Y180-W183 HydrophobicContact CE1-CZ3 4.01Å; Y180-W183 PolarHBondContact O-N 3.42Å
181L91.9Very high91.6Very high17 Ų1766.3 Ų66.39%0.08934%0.34CS..Hα-helixtrans-57.9-49.8175-166.176.8000111.1A177 F178 K179 W183 V184 L185 I223 M224 P227A177-L181 VanDerWaalsContact O-CB 3.24Å; A177-L181 WeakPolarHBondContact O-CB 3.16Å; A177-L181 PolarHBondContact O-N 3.02Å; F178-L181 HydrophobicContact CD1-CD2 4.35Å; F178-L181 HydrophobicContact CE1-CD2 4.27Å; F178-L181 PolarHBondContact O-N 2.93Å; K179-L181 VanDerWaalsContact C-N 3.33Å; L181-W183 VanDerWaalsContact C-N 3.28Å; L181-W183 PolarHBondContact O-N 3.39Å; L181-V184 PolarHBondContact O-N 3.46Å; L181-L185 WeakPolarHBondContact O-CB 3.47Å; L181-L185 PolarHBondContact O-N 3.33Å; L181-I223 HydrophobicContact CD1-CG2 3.32Å; L181-I223 WeakPolarHBondContact CD1-O 3.15Å; L181-I223 HydrophobicContact CG-CG2 3.98Å; L181-M224 HydrophobicContact CD2-SD 4.48Å; L181-P227 HydrophobicContact CD1-CG 4.32Å; L181-P227 HydrophobicContact CD2-CG 3.69Å; L181-P227 HydrophobicContact CG-CG 4.46Å
182S90.8Very high91.9Very high33 Ų3365.5 Ų65.523%0.23134%0.336CS..Hα-helixtrans-58.8-37.8-178.7-750000112.7F178 K179 Y180 V184 L185 F186F178-S182 VanDerWaalsContact O-CB 3.26Å; F178-S182 WeakPolarHBondContact O-CB 3.46Å; F178-S182 PolarHBondContact O-N 2.91Å; F178-S182 PolarHBondContact O-OG 3.22Å; K179-S182 PolarHBondContact O-N 2.87Å; Y180-S182 PolarHBondContact O-N 2.78Å; S182-V184 PolarHBondContact O-N 2.84Å; S182-L185 PolarHBondContact O-N 3.09Å; S182-F186 WeakPolarHBondContact O-CD2 3.49Å; S182-F186 PolarHBondContact O-N 3.01Å
183W92.6Very high92.2Very high169 Ų16959.9 Ų59.964%0.6431%0.312SS*.Hα-helixtrans-61.6-30.2175.3-76.6-8.7000113.7K179 Y180 L181 P187K179-W183 PolarHBondContact O-N 2.94Å; Y180-W183 HydrophobicContact CD1-CE3 4.01Å; Y180-W183 HydrophobicContact CD1-CZ3 4.07Å; Y180-W183 HydrophobicContact CE1-CE3 4.42Å; Y180-W183 HydrophobicContact CE1-CZ3 4.01Å; Y180-W183 PolarHBondContact O-N 3.42Å; L181-W183 VanDerWaalsContact C-N 3.28Å; L181-W183 PolarHBondContact O-N 3.39Å; W183-P187 WeakPolarHBondContact O-CD 3.32Å; W183-P187 WeakPolarHBondContact O-CG 3.48Å
184V91.7Very high92.5Very high83 Ų8360.9 Ų60.950%0.50333%0.325SS..Hα-helixtrans-88.8-41.6175.8179.20000110.7L181 S182 P187 L188L181-V184 PolarHBondContact O-N 3.46Å; S182-V184 PolarHBondContact O-N 2.84Å; V184-P187 WeakPolarHBondContact O-CD 3.5Å; V184-L188 HydrophobicContact CG1-CD1 3.76Å; V184-L188 VanDerWaalsContact O-CG 3.29Å; V184-L188 WeakPolarHBondContact O-CG 3.34Å; V184-L188 PolarHBondContact O-N 3.42Å
185L91.6Very high92.6Very high13 Ų1366.4 Ų66.47%0.06835%0.347CS..Hα-helixtrans-66.8-45.8-172.7-169.976.5000112.6L181 S182 L188 L189 F216 I223 M224L181-L185 WeakPolarHBondContact O-CB 3.47Å; L181-L185 PolarHBondContact O-N 3.33Å; S182-L185 PolarHBondContact O-N 3.09Å; L185-L188 PolarHBondContact O-N 2.91Å; L185-L189 VanDerWaalsContact O-CB 3.3Å; L185-L189 WeakPolarHBondContact O-CB 3.42Å; L185-L189 PolarHBondContact O-N 3.27Å; L185-F216 HydrophobicContact CD1-CE1 3.75Å; L185-F216 HydrophobicContact CD1-CZ 3.61Å; L185-F216 HydrophobicContact CG-CE1 4.3Å; L185-F216 HydrophobicContact CG-CZ 4.16Å; L185-I223 HydrophobicContact CD1-CB 4.5Å; L185-I223 HydrophobicContact CD1-CG2 3.82Å; L185-M224 HydrophobicContact CD1-CE 3.3Å; L185-M224 HydrophobicContact CD1-SD 3.96Å; L185-M224 HydrophobicContact CD2-CE 3.8Å; L185-M224 HydrophobicContact CD2-SD 4.25Å; L185-M224 HydrophobicContact CG-CE 4.12Å
186F92.2Very high92.6Very high130 Ų13063.3 Ų63.357%0.5733%0.328SS*.Hα-helixtrans-68-43.6-175.7-71.5-57.3000113.3S182 L188 L189 G190S182-F186 WeakPolarHBondContact O-CD2 3.49Å; S182-F186 PolarHBondContact O-N 3.01Å; F186-L188 VanDerWaalsContact C-N 3.35Å; F186-L188 PolarHBondContact O-N 3.38Å; F186-L189 PolarHBondContact O-N 2.98Å; F186-G190 PolarHBondContact O-N 3.38Å
187P94.5Very high92.7Very high88 Ų8863.2 Ų63.257%0.57133%0.329SS*.Hα-helixtrans-61-41.3172.6-27.137.1000113.1W183 V184 G190 G191W183-P187 WeakPolarHBondContact O-CD 3.32Å; W183-P187 WeakPolarHBondContact O-CG 3.48Å; V184-P187 WeakPolarHBondContact O-CD 3.5Å; P187-G190 PolarHBondContact O-N 2.95Å; P187-G191 PolarHBondContact O-N 2.94Å
188L93.3Very high92.7Very high60 Ų6068.3 Ų68.331%0.31435%0.354SS..Hα-helixtrans-64.4-42.1176.4-72.5174.5000111.8V184 L185 F186 G190 G191 Y192 F216 F220 I223V184-L188 HydrophobicContact CG1-CD1 3.76Å; V184-L188 VanDerWaalsContact O-CG 3.29Å; V184-L188 WeakPolarHBondContact O-CG 3.34Å; V184-L188 PolarHBondContact O-N 3.42Å; L185-L188 PolarHBondContact O-N 2.91Å; F186-L188 VanDerWaalsContact C-N 3.35Å; F186-L188 PolarHBondContact O-N 3.38Å; L188-G190 VanDerWaalsContact C-N 3.35Å; L188-G191 PolarHBondContact O-N 3.24Å; L188-Y192 WeakPolarHBondContact O-CB 3.43Å; L188-Y192 PolarHBondContact O-N 2.88Å; L188-F216 HydrophobicContact CB-CE2 4Å; L188-F216 HydrophobicContact CB-CZ 4.44Å; L188-F220 HydrophobicContact CD1-CD1 4.06Å; L188-F220 HydrophobicContact CD1-CE1 4.01Å; L188-F220 HydrophobicContact CD2-CE1 4.06Å; L188-F220 HydrophobicContact CD2-CZ 4.17Å; L188-F220 HydrophobicContact CG-CE1 4.47Å; L188-I223 HydrophobicContact CD1-CD1 3.56Å
189L93.8Very high92.5Very high40 Ų4074.9 Ų74.921%0.20938%0.379CS..Hα-helixtrans-62.1-44175.6179.363.1000110.9L185 F186 Y192 A193 M212 L213 F216L185-L189 VanDerWaalsContact O-CB 3.3Å; L185-L189 WeakPolarHBondContact O-CB 3.42Å; L185-L189 PolarHBondContact O-N 3.27Å; F186-L189 PolarHBondContact O-N 2.98Å; L189-Y192 PolarHBondContact O-N 3.21Å; L189-A193 VanDerWaalsContact O-CB 3.25Å; L189-A193 WeakPolarHBondContact O-CB 3.34Å; L189-A193 PolarHBondContact O-N 3.06Å; L189-M212 HydrophobicContact CD1-CE 4.49Å; L189-M212 HydrophobicContact CD1-SD 3.74Å; L189-L213 HydrophobicContact CD1-CD2 4.23Å; L189-F216 VanDerWaalsContact CA-CE2 3.44Å; L189-F216 HydrophobicContact CB-CD2 4.36Å; L189-F216 HydrophobicContact CB-CE1 4.25Å; L189-F216 HydrophobicContact CB-CE2 3.9Å; L189-F216 HydrophobicContact CB-CZ 3.83Å; L189-F216 HydrophobicContact CD1-CB 4.14Å; L189-F216 HydrophobicContact CD1-CD1 3.71Å; L189-F216 HydrophobicContact CD1-CD2 3.91Å; L189-F216 HydrophobicContact CD1-CE1 4.03Å; L189-F216 HydrophobicContact CD1-CE2 4.25Å; L189-F216 HydrophobicContact CD1-CG 3.63Å; L189-F216 HydrophobicContact CD1-CZ 4.31Å
190G94.3Very high92.2Very high37 Ų3771 Ų7138%0.38136%0.364SS..Hα-helixtrans-60.8-46.7175.600000112.3F186 P187 L188 A193 V194F186-G190 PolarHBondContact O-N 3.38Å; P187-G190 PolarHBondContact O-N 2.95Å; L188-G190 VanDerWaalsContact C-N 3.35Å; G190-A193 PolarHBondContact O-N 3.01Å; G190-V194 WeakPolarHBondContact O-CG2 3.18Å; G190-V194 PolarHBondContact O-N 3.04Å
191G94.7Very high91.7Very high45 Ų4571.6 Ų71.646%0.46437%0.371SS..Hα-helixtrans-61.6-44.2176.400000112.8P187 L188 V194 Y195P187-G191 PolarHBondContact O-N 2.94Å; L188-G191 PolarHBondContact O-N 3.24Å; G191-V194 PolarHBondContact O-N 3.16Å; G191-Y195 WeakPolarHBondContact O-CB 3.42Å; G191-Y195 PolarHBondContact O-N 3.39Å
192Y92.6Very high91.2Very high41 Ų4174.4 Ų74.416%0.16138%0.383CS..Hα-helixtrans-66.5-36.8176.3-170.8-95.8000112.2L188 L189 Y195 S196 M212 G215 F216 F220L188-Y192 WeakPolarHBondContact O-CB 3.43Å; L188-Y192 PolarHBondContact O-N 2.88Å; L189-Y192 PolarHBondContact O-N 3.21Å; Y192-Y195 HydrophobicContact CE2-CD1 4.42Å; Y192-Y195 PolarHBondContact O-N 3.23Å; Y192-S196 VanDerWaalsContact O-CB 3.23Å; Y192-S196 WeakPolarHBondContact O-CB 3.49Å; Y192-S196 PolarHBondContact O-N 3.3Å; Y192-M212 HydrophobicContact CD1-CG 4.1Å; Y192-M212 HydrophobicContact CD1-SD 4.34Å; Y192-M212 HydrophobicContact CE1-CG 4.36Å; Y192-M212 VanDerWaalsContact CE1-O 3.22Å; Y192-M212 WeakPolarHBondContact CE1-O 3.33Å; Y192-G215 WeakPolarHBondContact OH-CA 3.37Å; Y192-F216 HydrophobicContact CD1-CB 3.66Å; Y192-F216 HydrophobicContact CD1-CD2 4.26Å; Y192-F216 HydrophobicContact CD1-CG 4.46Å; Y192-F216 HydrophobicContact CE1-CB 3.96Å; Y192-F216 VanDerWaalsContact CE1-N 3.3Å; Y192-F216 HydrophobicContact CG-CB 4.27Å; Y192-F216 HydrophobicContact CG-CD2 4.08Å; Y192-F220 HydrophobicContact CD2-CE2 4.25Å
193A94.4Very high90.8Very high19 Ų1981 Ų8116%0.15740%0.403CS..Hα-helixtrans-64-43.617600000111.8L189 G190 S196 L197 M212L189-A193 VanDerWaalsContact O-CB 3.25Å; L189-A193 WeakPolarHBondContact O-CB 3.34Å; L189-A193 PolarHBondContact O-N 3.06Å; G190-A193 PolarHBondContact O-N 3.01Å; A193-S196 PolarHBondContact O-N 3.28Å; A193-L197 WeakPolarHBondContact O-CB 3.41Å; A193-L197 PolarHBondContact O-N 3.42Å; A193-M212 HydrophobicContact CB-CE 4.28Å; A193-M212 HydrophobicContact CB-CG 4.09Å; A193-M212 HydrophobicContact CB-SD 3.97Å
194V94.5Very high90.6Very high87 Ų8774.4 Ų74.453%0.52739%0.387SS..Hα-helixtrans-63.5-45.8175173.70000110.9G190 G191 S196 L197 I198G190-V194 WeakPolarHBondContact O-CG2 3.18Å; G190-V194 PolarHBondContact O-N 3.04Å; G191-V194 PolarHBondContact O-N 3.16Å; V194-S196 PolarHBondContact O-N 2.94Å; V194-L197 PolarHBondContact O-N 2.99Å; V194-I198 HydrophobicContact CG1-CD1 3.74Å; V194-I198 WeakPolarHBondContact O-CG1 3.28Å; V194-I198 PolarHBondContact O-N 2.82Å; V194-I198 VanDerWaalsContact O-N 3.14Å
195Y92.7Very high90.6Very high115 Ų11579 Ų7945%0.45140%0.396SS..Hα-helixtrans-57.6-49.3175.5172-98.3000111.7G191 Y192 L197 I198 Y199G191-Y195 WeakPolarHBondContact O-CB 3.42Å; G191-Y195 PolarHBondContact O-N 3.39Å; Y192-Y195 HydrophobicContact CE2-CD1 4.42Å; Y192-Y195 PolarHBondContact O-N 3.23Å; Y195-L197 VanDerWaalsContact C-N 3.3Å; Y195-L197 PolarHBondContact O-N 3.33Å; Y195-I198 PolarHBondContact O-N 2.81Å; Y195-Y199 AromaticContact CD2-CD2 3.48Å; Y195-Y199 HydrophobicContact CD2-CD2 3.48Å; Y195-Y199 VanDerWaalsContact CD2-CD2 3.48Å; Y195-Y199 HydrophobicContact CD2-CE2 4.02Å; Y195-Y199 HydrophobicContact CD2-CG 4.33Å; Y195-Y199 AromaticContact CE2-CD2 3.67Å; Y195-Y199 HydrophobicContact CE2-CD2 3.67Å; Y195-Y199 HydrophobicContact CE2-CE2 4.31Å; Y195-Y199 HydrophobicContact CE2-CG 4.1Å; Y195-Y199 HydrophobicContact CG-CD2 4.3Å; Y195-Y199 WeakPolarHBondContact O-CD2 3.36Å; Y195-Y199 PolarHBondContact O-N 3.37Å
196S90.8Very high90.6Very high1 Ų184.7 Ų84.71%0.00742%0.417CS..Hα-helixtrans-62.2-35.8179.2171.80000112.4Y192 A193 V194 L200 W208Y192-S196 VanDerWaalsContact O-CB 3.23Å; Y192-S196 WeakPolarHBondContact O-CB 3.49Å; Y192-S196 PolarHBondContact O-N 3.3Å; A193-S196 PolarHBondContact O-N 3.28Å; V194-S196 PolarHBondContact O-N 2.94Å; S196-L200 VanDerWaalsContact O-CB 3.29Å; S196-L200 WeakPolarHBondContact O-CB 2.97Å; S196-L200 PolarHBondContact O-N 3.14Å; S196-W208 PolarHBondContact OG-NE1 3.48Å
197L91.6Very high90.6Very high72 Ų7279 Ų7938%0.37739%0.393SS..Hα-helixtrans-72-35.4179.9-170.464.9000112.9A193 V194 Y195 W205 W208A193-L197 WeakPolarHBondContact O-CB 3.41Å; A193-L197 PolarHBondContact O-N 3.42Å; V194-L197 PolarHBondContact O-N 2.99Å; Y195-L197 VanDerWaalsContact C-N 3.3Å; Y195-L197 PolarHBondContact O-N 3.33Å; L197-W205 HydrophobicContact CD1-CH2 4.25Å; L197-W205 HydrophobicContact CD1-CZ3 4.07Å; L197-W208 HydrophobicContact CB-CZ2 3.84Å; L197-W208 HydrophobicContact CD1-CD2 4.14Å; L197-W208 HydrophobicContact CD1-CH2 4.5Å; L197-W208 HydrophobicContact CD1-CZ2 3.89Å; L197-W208 HydrophobicContact CG-CZ2 4.3Å
198I92.2Very high90.5Very high114 Ų11476.4 Ų76.459%0.58537%0.372SS*.Hα-helixtrans-83.8-40.3-176.3-63.9170.7000111.5V194 Y195V194-I198 HydrophobicContact CG1-CD1 3.74Å; V194-I198 WeakPolarHBondContact O-CG1 3.28Å; V194-I198 PolarHBondContact O-N 2.82Å; V194-I198 VanDerWaalsContact O-N 3.14Å; Y195-I198 PolarHBondContact O-N 2.81Å
199Y88.9Confident90.6Very high166 Ų16676.3 Ų76.365%0.65137%0.374SS*.Hα-helixtrans-107-19.2-168.3-65.6-76.1000114.8Y195Y195-Y199 AromaticContact CD2-CD2 3.48Å; Y195-Y199 HydrophobicContact CD2-CD2 3.48Å; Y195-Y199 VanDerWaalsContact CD2-CD2 3.48Å; Y195-Y199 HydrophobicContact CD2-CE2 4.02Å; Y195-Y199 HydrophobicContact CD2-CG 4.33Å; Y195-Y199 AromaticContact CE2-CD2 3.67Å; Y195-Y199 HydrophobicContact CE2-CD2 3.67Å; Y195-Y199 HydrophobicContact CE2-CE2 4.31Å; Y195-Y199 HydrophobicContact CE2-CG 4.1Å; Y195-Y199 HydrophobicContact CG-CD2 4.3Å; Y195-Y199 WeakPolarHBondContact O-CD2 3.36Å; Y195-Y199 PolarHBondContact O-N 3.37Å
200L85Confident90.5Very high38 Ų3874.9 Ų74.920%0.19937%0.367CS..SBendtrans-104.2128.8-176.8-55.3177.4000111.7S196 H202S196-L200 VanDerWaalsContact O-CB 3.29Å; S196-L200 WeakPolarHBondContact O-CB 2.97Å; S196-L200 PolarHBondContact O-N 3.14Å; L200-H202 PolarHBondContact O-ND1 2.85Å; L200-H202 VanDerWaalsContact O-ND1 3.09Å
201E82.5Confident90.2Very high135 Ų13574.9 Ų74.963%0.63136%0.361SS*.  trans-66.5135.8173.2-64.2-171143.100110.1R7R7-E201 IonicContact CZ-OE1 3.22Å; R7-E201 IonicContact CZ-OE2 3.13Å; R7-E201 IonicContact NE-OE1 3.37Å; R7-E201 IonicContact NE-OE2 3.39Å; R7-E201 PolarHBondContact NE-OE2 2.94Å; R7-E201 VanDerWaalsContact NH2-CD 3.34Å; R7-E201 IonicContact NH2-OE1 2.93Å; R7-E201 PolarHBondContact NH2-OE1 3.4Å; R7-E201 IonicContact NH2-OE2 3.76Å; R7-E201 PolarHBondContact NH2-OE2 3.46Å
202H81.5Confident90.1Very high76 Ų7673.5 Ų73.535%0.35234%0.342SS..  trans-137.5137.1-179.650-84.7000111L200 G204 W208L200-H202 PolarHBondContact O-ND1 2.85Å; L200-H202 VanDerWaalsContact O-ND1 3.09Å; H202-G204 PolarHBondContact O-N 3.19Å; H202-W208 HydrophobicContact CB-CB 3.69Å; H202-W208 HydrophobicContact CB-CG 4.28Å; H202-W208 AromaticContact CG-CD1 3.87Å; H202-W208 AromaticContact ND1-CD1 3.81Å
203R80.7Confident90.1Very high173 Ų17373.6 Ų73.665%0.65335%0.346SS*.SBendtrans-67.3-26.2-179.5-70.1-174.5-86.1172.21112.8D114D114-R203 PolarHBondContact O-NH2 3.11Å; D114-R203 IonicContact OD2-NH2 3.83Å
204G89.5Confident89.7Confident29 Ų2974.4 Ų74.430%0.29935%0.345SS..SBendtrans176.9177.2178.500000111.1H202 Y206 S207 W208H202-G204 PolarHBondContact O-N 3.19Å; G204-Y206 PolarHBondContact O-N 2.83Å; G204-S207 PolarHBondContact O-N 2.84Å; G204-W208 WeakPolarHBondContact O-CB 3.37Å; G204-W208 PolarHBondContact O-N 3.18Å
205W91.4Very high89.3Confident179 Ų17970.8 Ų70.868%0.67833%0.325SS*.Hα-helixtrans-60-40-175-72.1104.1000113.9L197 W208 V209L197-W205 HydrophobicContact CD1-CH2 4.25Å; L197-W205 HydrophobicContact CD1-CZ3 4.07Å; W205-W208 HydrophobicContact CE3-CD2 4.49Å; W205-W208 AromaticContact CE3-CE3 3.73Å; W205-W208 HydrophobicContact CE3-CE3 3.73Å; W205-W208 HydrophobicContact CE3-CZ3 4.07Å; W205-W208 AromaticContact CZ3-CE3 3.96Å; W205-W208 HydrophobicContact CZ3-CE3 3.96Å; W205-W208 AromaticContact CZ3-CZ3 3.98Å; W205-W208 HydrophobicContact CZ3-CZ3 3.98Å; W205-W208 PolarHBondContact O-N 3.33Å; W205-V209 WeakPolarHBondContact O-CG2 3.33Å; W205-V209 PolarHBondContact O-N 3.46Å
206Y92Very high89.1Confident134 Ų13465.6 Ų65.653%0.52531%0.305SS..Hα-helixtrans-62.4-52.3177.4174.9-101.7000111.9D114 G204 W208 V209 L210D114-Y206 HydrophobicContact CB-CE1 4.34Å; G204-Y206 PolarHBondContact O-N 2.83Å; Y206-W208 VanDerWaalsContact C-N 3.29Å; Y206-W208 PolarHBondContact O-N 3.44Å; Y206-V209 PolarHBondContact O-N 3.44Å; Y206-L210 HydrophobicContact CD1-CD1 4.06Å; Y206-L210 HydrophobicContact CE1-CD1 3.4Å; Y206-L210 HydrophobicContact CE1-CG 4.44Å; Y206-L210 HydrophobicContact CE2-CD1 4.05Å; Y206-L210 HydrophobicContact CE2-CG 4.46Å; Y206-L210 VanDerWaalsContact CZ-CD1 3.4Å; Y206-L210 PolarHBondContact O-N 3.27Å; Y206-L210 VanDerWaalsContact O-N 3.09Å
207S91Very high88.9Confident10 Ų1066.5 Ų66.57%0.0731%0.31CS..Hα-helixtrans-64.5-34.5179-170.30000111.7D114 G204 S211D114-S207 VanDerWaalsContact OD2-CB 3.22Å; D114-S207 WeakPolarHBondContact OD2-CB 3.4Å; D114-S207 PolarHBondContact OD2-OG 2.99Å; G204-S207 PolarHBondContact O-N 2.84Å; S207-S211 WeakPolarHBondContact O-CB 3.45Å; S207-S211 PolarHBondContact O-N 2.87Å; S207-S211 PolarHBondContact O-OG 3.48Å
208W93.4Very high88.3Confident33 Ų3366.4 Ų66.413%0.12531%0.309CS..Hα-helixtrans-61.5-51.7172.8174.670.8000111.8S196 L197 H202 G204 W205 Y206 L210 S211 M212S196-W208 PolarHBondContact OG-NE1 3.48Å; L197-W208 HydrophobicContact CB-CZ2 3.84Å; L197-W208 HydrophobicContact CD1-CD2 4.14Å; L197-W208 HydrophobicContact CD1-CH2 4.5Å; L197-W208 HydrophobicContact CD1-CZ2 3.89Å; L197-W208 HydrophobicContact CG-CZ2 4.3Å; H202-W208 HydrophobicContact CB-CB 3.69Å; H202-W208 HydrophobicContact CB-CG 4.28Å; H202-W208 AromaticContact CG-CD1 3.87Å; H202-W208 AromaticContact ND1-CD1 3.81Å; G204-W208 WeakPolarHBondContact O-CB 3.37Å; G204-W208 PolarHBondContact O-N 3.18Å; W205-W208 HydrophobicContact CE3-CD2 4.49Å; W205-W208 AromaticContact CE3-CE3 3.73Å; W205-W208 HydrophobicContact CE3-CE3 3.73Å; W205-W208 HydrophobicContact CE3-CZ3 4.07Å; W205-W208 AromaticContact CZ3-CE3 3.96Å; W205-W208 HydrophobicContact CZ3-CE3 3.96Å; W205-W208 AromaticContact CZ3-CZ3 3.98Å; W205-W208 HydrophobicContact CZ3-CZ3 3.98Å; W205-W208 PolarHBondContact O-N 3.33Å; Y206-W208 VanDerWaalsContact C-N 3.29Å; Y206-W208 PolarHBondContact O-N 3.44Å; W208-L210 VanDerWaalsContact C-N 3.33Å; W208-L210 PolarHBondContact O-N 3.24Å; W208-S211 PolarHBondContact O-N 3.46Å; W208-M212 WeakPolarHBondContact O-CB 3.16Å; W208-M212 PolarHBondContact O-N 2.9Å
209V94.2Very high87.7Confident59 Ų5963.9 Ų63.936%0.35830%0.299SS..Hα-helixtrans-59.5-45.3-180172.40000110.8W205 Y206 M212 L213W205-V209 WeakPolarHBondContact O-CG2 3.33Å; W205-V209 PolarHBondContact O-N 3.46Å; Y206-V209 PolarHBondContact O-N 3.44Å; V209-M212 PolarHBondContact O-N 3.31Å; V209-L213 HydrophobicContact CG1-CD1 3.81Å; V209-L213 HydrophobicContact CG1-CG 4.28Å; V209-L213 WeakPolarHBondContact O-CB 3.37Å; V209-L213 VanDerWaalsContact O-CG 3.27Å; V209-L213 WeakPolarHBondContact O-CG 3.44Å; V209-L213 PolarHBondContact O-N 3.03Å
210L92Very high87.5Confident9 Ų957.9 Ų57.95%0.04728%0.276CS..Hα-helixtrans-63.4-46178.3-72.4179.7000112.3L110 Y111 D114 Y206 W208 M212 L213 Y214L110-L210 HydrophobicContact CB-CD1 4.12Å; L110-L210 HydrophobicContact CB-CD2 3.66Å; L110-L210 HydrophobicContact CD1-CD2 4.3Å; Y111-L210 HydrophobicContact CD2-CB 4.27Å; D114-L210 HydrophobicContact CB-CD1 3.88Å; Y206-L210 HydrophobicContact CD1-CD1 4.06Å; Y206-L210 HydrophobicContact CE1-CD1 3.4Å; Y206-L210 HydrophobicContact CE1-CG 4.44Å; Y206-L210 HydrophobicContact CE2-CD1 4.05Å; Y206-L210 HydrophobicContact CE2-CG 4.46Å; Y206-L210 VanDerWaalsContact CZ-CD1 3.4Å; Y206-L210 PolarHBondContact O-N 3.27Å; Y206-L210 VanDerWaalsContact O-N 3.09Å; W208-L210 VanDerWaalsContact C-N 3.33Å; W208-L210 PolarHBondContact O-N 3.24Å; L210-M212 VanDerWaalsContact C-N 3.34Å; L210-M212 PolarHBondContact O-N 3.44Å; L210-L213 PolarHBondContact O-N 3.22Å; L210-Y214 WeakPolarHBondContact O-CB 3.16Å; L210-Y214 PolarHBondContact O-N 3.01Å
211S88.6Confident87.3Confident38 Ų3856.5 Ų56.527%0.26627%0.271SS..Hα-helixtrans-64.9-39.9179.3-590000111.8S207 W208 G215S207-S211 WeakPolarHBondContact O-CB 3.45Å; S207-S211 PolarHBondContact O-N 2.87Å; S207-S211 PolarHBondContact O-OG 3.48Å; W208-S211 PolarHBondContact O-N 3.46Å; S211-G215 PolarHBondContact O-N 2.83Å
212M92.6Very high87.2Confident15 Ų1554 Ų547%0.07426%0.259CS..Hα-helixtrans-64.4-50175.9-179-78.3-66.500111.1L189 Y192 A193 W208 V209 L210 G215 F216L189-M212 HydrophobicContact CD1-CE 4.49Å; L189-M212 HydrophobicContact CD1-SD 3.74Å; Y192-M212 HydrophobicContact CD1-CG 4.1Å; Y192-M212 HydrophobicContact CD1-SD 4.34Å; Y192-M212 HydrophobicContact CE1-CG 4.36Å; Y192-M212 VanDerWaalsContact CE1-O 3.22Å; Y192-M212 WeakPolarHBondContact CE1-O 3.33Å; A193-M212 HydrophobicContact CB-CE 4.28Å; A193-M212 HydrophobicContact CB-CG 4.09Å; A193-M212 HydrophobicContact CB-SD 3.97Å; W208-M212 WeakPolarHBondContact O-CB 3.16Å; W208-M212 PolarHBondContact O-N 2.9Å; V209-M212 PolarHBondContact O-N 3.31Å; L210-M212 VanDerWaalsContact C-N 3.34Å; L210-M212 PolarHBondContact O-N 3.44Å; M212-G215 PolarHBondContact O-N 3.27Å; M212-F216 VanDerWaalsContact O-CB 3.23Å; M212-F216 WeakPolarHBondContact O-CB 3.27Å; M212-F216 PolarHBondContact O-N 3.15Å
213L91.8Very high87.4Confident43 Ų4351 Ų5123%0.22525%0.245CC..Hα-helixtrans-63.5-45.4178.7-71.3174.2000111.5I107 L189 V209 L210 F216 L217I107-L213 HydrophobicContact CD1-CB 4.43Å; I107-L213 HydrophobicContact CD1-CD1 4.16Å; I107-L213 HydrophobicContact CG1-CD1 4.37Å; I107-L213 HydrophobicContact CG2-CB 3.79Å; L189-L213 HydrophobicContact CD1-CD2 4.23Å; V209-L213 HydrophobicContact CG1-CD1 3.81Å; V209-L213 HydrophobicContact CG1-CG 4.28Å; V209-L213 WeakPolarHBondContact O-CB 3.37Å; V209-L213 VanDerWaalsContact O-CG 3.27Å; V209-L213 WeakPolarHBondContact O-CG 3.44Å; V209-L213 PolarHBondContact O-N 3.03Å; L210-L213 PolarHBondContact O-N 3.22Å; L213-F216 PolarHBondContact O-N 3.18Å; L213-L217 WeakPolarHBondContact O-CB 3.3Å; L213-L217 WeakPolarHBondContact O-CG 3.4Å; L213-L217 PolarHBondContact O-N 2.86Å
214Y87.9Confident87.4Confident37 Ų3743.3 Ų43.315%0.14522%0.217CC..Hα-helixtrans-62.1-48177.9178.7-100.8000111.7V108 Y111 L210 F216 L217 L218V108-Y214 HydrophobicContact CG1-CE2 4.35Å; V108-Y214 HydrophobicContact CG2-CD2 4.04Å; V108-Y214 HydrophobicContact CG2-CE2 4.08Å; Y111-Y214 AromaticContact CD1-CD1 3.79Å; Y111-Y214 HydrophobicContact CD1-CD1 3.79Å; Y111-Y214 AromaticContact CD1-CD2 3.89Å; Y111-Y214 HydrophobicContact CD1-CD2 3.89Å; Y111-Y214 HydrophobicContact CD1-CE1 4.05Å; Y111-Y214 HydrophobicContact CD1-CE2 4.14Å; Y111-Y214 AromaticContact CD1-CG 3.7Å; Y111-Y214 HydrophobicContact CD1-CG 3.7Å; Y111-Y214 HydrophobicContact CD2-CD1 4.29Å; Y111-Y214 HydrophobicContact CD2-CG 4.1Å; Y111-Y214 AromaticContact CE1-CD1 3.51Å; Y111-Y214 HydrophobicContact CE1-CD1 3.51Å; Y111-Y214 HydrophobicContact CE1-CD2 4.4Å; Y111-Y214 AromaticContact CE1-CE1 3.58Å; Y111-Y214 HydrophobicContact CE1-CE1 3.58Å; Y111-Y214 HydrophobicContact CE1-CE2 4.46Å; Y111-Y214 AromaticContact CE1-CG 3.94Å; Y111-Y214 HydrophobicContact CE1-CG 3.94Å; Y111-Y214 HydrophobicContact CE2-CD1 4.05Å; Y111-Y214 HydrophobicContact CE2-CG 4.32Å; Y111-Y214 HydrophobicContact CG-CD1 4.17Å; Y111-Y214 HydrophobicContact CG-CD2 4.15Å; Y111-Y214 AromaticContact CG-CG 3.79Å; Y111-Y214 HydrophobicContact CG-CG 3.79Å; Y111-Y214 AromaticContact CZ-CD1 3.64Å; L210-Y214 WeakPolarHBondContact O-CB 3.16Å; L210-Y214 PolarHBondContact O-N 3.01Å; Y214-F216 VanDerWaalsContact C-N 3.32Å; Y214-F216 PolarHBondContact O-N 2.71Å; Y214-L217 PolarHBondContact O-N 2.69Å; Y214-L218 PolarHBondContact O-N 3.47Å
215G84.4Confident87.2Confident11 Ų1144.2 Ų44.211%0.11321%0.213CC..Hα-helixtrans-61.9-38.4177.300000112.9Y192 S211 M212 L218 T219Y192-G215 WeakPolarHBondContact OH-CA 3.37Å; S211-G215 PolarHBondContact O-N 2.83Å; M212-G215 PolarHBondContact O-N 3.27Å; G215-L218 PolarHBondContact O-N 2.97Å; G215-T219 WeakPolarHBondContact O-CB 3.35Å; G215-T219 PolarHBondContact O-N 2.99Å; G215-T219 PolarHBondContact O-OG1 3.04Å
216F88.6Confident87Confident6 Ų638.4 Ų38.43%0.02620%0.198CC..Hα-helixtrans-62.9-47.5173.3177.1-100000111.6L185 L188 L189 Y192 M212 L213 Y214 L218 T219 F220 M224L185-F216 HydrophobicContact CD1-CE1 3.75Å; L185-F216 HydrophobicContact CD1-CZ 3.61Å; L185-F216 HydrophobicContact CG-CE1 4.3Å; L185-F216 HydrophobicContact CG-CZ 4.16Å; L188-F216 HydrophobicContact CB-CE2 4Å; L188-F216 HydrophobicContact CB-CZ 4.44Å; L189-F216 VanDerWaalsContact CA-CE2 3.44Å; L189-F216 HydrophobicContact CB-CD2 4.36Å; L189-F216 HydrophobicContact CB-CE1 4.25Å; L189-F216 HydrophobicContact CB-CE2 3.9Å; L189-F216 HydrophobicContact CB-CZ 3.83Å; L189-F216 HydrophobicContact CD1-CB 4.14Å; L189-F216 HydrophobicContact CD1-CD1 3.71Å; L189-F216 HydrophobicContact CD1-CD2 3.91Å; L189-F216 HydrophobicContact CD1-CE1 4.03Å; L189-F216 HydrophobicContact CD1-CE2 4.25Å; L189-F216 HydrophobicContact CD1-CG 3.63Å; L189-F216 HydrophobicContact CD1-CZ 4.31Å; Y192-F216 HydrophobicContact CD1-CB 3.66Å; Y192-F216 HydrophobicContact CD1-CD2 4.26Å; Y192-F216 HydrophobicContact CD1-CG 4.46Å; Y192-F216 HydrophobicContact CE1-CB 3.96Å; Y192-F216 VanDerWaalsContact CE1-N 3.3Å; Y192-F216 HydrophobicContact CG-CB 4.27Å; Y192-F216 HydrophobicContact CG-CD2 4.08Å; M212-F216 VanDerWaalsContact O-CB 3.23Å; M212-F216 WeakPolarHBondContact O-CB 3.27Å; M212-F216 PolarHBondContact O-N 3.15Å; L213-F216 PolarHBondContact O-N 3.18Å; Y214-F216 VanDerWaalsContact C-N 3.32Å; Y214-F216 PolarHBondContact O-N 2.71Å; F216-L218 VanDerWaalsContact C-N 3.3Å; F216-L218 PolarHBondContact O-N 3.24Å; F216-T219 PolarHBondContact O-N 3.11Å; F216-F220 AromaticContact CD2-CD2 3.26Å; F216-F220 HydrophobicContact CD2-CD2 3.26Å; F216-F220 AromaticContact CD2-CE2 3.72Å; F216-F220 HydrophobicContact CD2-CE2 3.72Å; F216-F220 HydrophobicContact CD2-CG 4.25Å; F216-F220 HydrophobicContact CE2-CB 4.17Å; F216-F220 AromaticContact CE2-CD2 3.23Å; F216-F220 HydrophobicContact CE2-CD2 3.23Å; F216-F220 AromaticContact CE2-CE2 3.74Å; F216-F220 HydrophobicContact CE2-CE2 3.74Å; F216-F220 AromaticContact CE2-CG 3.87Å; F216-F220 HydrophobicContact CE2-CG 3.87Å; F216-F220 HydrophobicContact CG-CD2 4.1Å; F216-F220 HydrophobicContact CZ-CB 4.17Å; F216-F220 HydrophobicContact CZ-CD2 4.08Å; F216-F220 HydrophobicContact CZ-CG 4.33Å; F216-F220 WeakPolarHBondContact O-CB 3.45Å; F216-F220 PolarHBondContact O-N 2.98Å; F216-M224 HydrophobicContact CE1-CE 4.04Å
217L86.6Confident86.9Confident20 Ų2032.1 Ų32.111%0.10517%0.173CC..Hα-helixtrans-63.4-36.2179-70.7169.5000112.4F100 V104 I107 L213 Y214 G221 M224F100-L217 HydrophobicContact CE1-CD2 4.25Å; F100-L217 HydrophobicContact CZ-CD2 4.45Å; V104-L217 HydrophobicContact CB-CD1 4.35Å; V104-L217 HydrophobicContact CG1-CD1 4.1Å; V104-L217 HydrophobicContact CG2-CD1 3.96Å; V104-L217 HydrophobicContact CG2-CD2 3.64Å; V104-L217 HydrophobicContact CG2-CG 4.42Å; I107-L217 HydrophobicContact CB-CD1 4.23Å; I107-L217 HydrophobicContact CD1-CD1 4.02Å; I107-L217 HydrophobicContact CG2-CD1 3.95Å; L213-L217 WeakPolarHBondContact O-CB 3.3Å; L213-L217 WeakPolarHBondContact O-CG 3.4Å; L213-L217 PolarHBondContact O-N 2.86Å; Y214-L217 PolarHBondContact O-N 2.69Å; L217-G221 WeakPolarHBondContact O-CA 3.46Å; L217-G221 PolarHBondContact O-N 3.18Å; L217-M224 HydrophobicContact CD2-CE 3.85Å
218L79.6Confident86.8Confident70 Ų7032.7 Ų32.737%0.36618%0.175SC..Hα-helixtrans-65.8-47.3174.6-174.863.2000111P17 Y214 G215 F216P17-L218 HydrophobicContact CG-CD2 4.37Å; Y214-L218 PolarHBondContact O-N 3.47Å; G215-L218 PolarHBondContact O-N 2.97Å; F216-L218 VanDerWaalsContact C-N 3.3Å; F216-L218 PolarHBondContact O-N 3.24Å
219T80Confident86.6Confident61 Ų6131.7 Ų31.737%0.37417%0.172SC..Hα-helixtrans-69.5-42.8-176.7-53.70000112.3G215 F216G215-T219 WeakPolarHBondContact O-CB 3.35Å; G215-T219 PolarHBondContact O-N 2.99Å; G215-T219 PolarHBondContact O-OG1 3.04Å; F216-T219 PolarHBondContact O-N 3.11Å
220F85.4Confident86.4Confident39 Ų3931.6 Ų31.617%0.17117%0.167CC..Hα-helixtrans-111.414.4-171.8-63-74.7000113.9L188 Y192 F216 F222 I223L188-F220 HydrophobicContact CD1-CD1 4.06Å; L188-F220 HydrophobicContact CD1-CE1 4.01Å; L188-F220 HydrophobicContact CD2-CE1 4.06Å; L188-F220 HydrophobicContact CD2-CZ 4.17Å; L188-F220 HydrophobicContact CG-CE1 4.47Å; Y192-F220 HydrophobicContact CD2-CE2 4.25Å; F216-F220 AromaticContact CD2-CD2 3.26Å; F216-F220 HydrophobicContact CD2-CD2 3.26Å; F216-F220 AromaticContact CD2-CE2 3.72Å; F216-F220 HydrophobicContact CD2-CE2 3.72Å; F216-F220 HydrophobicContact CD2-CG 4.25Å; F216-F220 HydrophobicContact CE2-CB 4.17Å; F216-F220 AromaticContact CE2-CD2 3.23Å; F216-F220 HydrophobicContact CE2-CD2 3.23Å; F216-F220 AromaticContact CE2-CE2 3.74Å; F216-F220 HydrophobicContact CE2-CE2 3.74Å; F216-F220 AromaticContact CE2-CG 3.87Å; F216-F220 HydrophobicContact CE2-CG 3.87Å; F216-F220 HydrophobicContact CG-CD2 4.1Å; F216-F220 HydrophobicContact CZ-CB 4.17Å; F216-F220 HydrophobicContact CZ-CD2 4.08Å; F216-F220 HydrophobicContact CZ-CG 4.33Å; F216-F220 WeakPolarHBondContact O-CB 3.45Å; F216-F220 PolarHBondContact O-N 2.98Å; F220-F222 HydrophobicContact CD1-CE1 4.3Å; F220-F222 PolarHBondContact O-N 3.29Å; F220-I223 HydrophobicContact CB-CD1 4.04Å; F220-I223 HydrophobicContact CB-CG1 4.41Å; F220-I223 HydrophobicContact CD1-CD1 3.88Å; F220-I223 HydrophobicContact CG-CD1 4.34Å; F220-I223 VanDerWaalsContact O-CB 3.24Å; F220-I223 WeakPolarHBondContact O-CB 3.43Å; F220-I223 WeakPolarHBondContact O-CG1 3.43Å; F220-I223 PolarHBondContact O-N 3.16Å
221G79.7Confident86.3Confident9 Ų931.1 Ų31.19%0.09317%0.165CC..Hα-helixtrans-60.3-20.3-174.200000115.6L217 I223 M224L217-G221 WeakPolarHBondContact O-CA 3.46Å; L217-G221 PolarHBondContact O-N 3.18Å; G221-I223 VanDerWaalsContact C-N 3.25Å; G221-I223 PolarHBondContact O-N 3.41Å; G221-M224 WeakPolarHBondContact O-CB 3.46Å; G221-M224 PolarHBondContact O-N 3.31Å; G221-M224 VanDerWaalsContact O-N 3.16Å
222F81Confident86.2Confident84 Ų8429.5 Ų29.537%0.36815%0.153SC..Hα-helixtrans-62.1-35.3171.760.9-80.5000112.9F220 M224 M225 T226 R275F220-F222 HydrophobicContact CD1-CE1 4.3Å; F220-F222 PolarHBondContact O-N 3.29Å; F222-M224 PolarHBondContact O-N 2.9Å; F222-M225 PolarHBondContact O-N 2.91Å; F222-T226 PolarHBondContact O-N 3.33Å; F222-T226 PolarHBondContact O-OG1 2.96Å; F222-R275 HydrophobicContact CB-CG 3.51Å; F222-R275 HydrophobicContact CD1-CG 4.43Å; F222-R275 HydrophobicContact CG-CG 4.31Å
223I85Confident86Confident11 Ų1134.4 Ų34.46%0.05617%0.171CC..Hα-helixtrans-57.6-38.8179.3-61.3-173.2000107.8L181 L185 L188 F220 G221 M225 T226 P227L181-I223 HydrophobicContact CD1-CG2 3.32Å; L181-I223 WeakPolarHBondContact CD1-O 3.15Å; L181-I223 HydrophobicContact CG-CG2 3.98Å; L185-I223 HydrophobicContact CD1-CB 4.5Å; L185-I223 HydrophobicContact CD1-CG2 3.82Å; L188-I223 HydrophobicContact CD1-CD1 3.56Å; F220-I223 HydrophobicContact CB-CD1 4.04Å; F220-I223 HydrophobicContact CB-CG1 4.41Å; F220-I223 HydrophobicContact CD1-CD1 3.88Å; F220-I223 HydrophobicContact CG-CD1 4.34Å; F220-I223 VanDerWaalsContact O-CB 3.24Å; F220-I223 WeakPolarHBondContact O-CB 3.43Å; F220-I223 WeakPolarHBondContact O-CG1 3.43Å; F220-I223 PolarHBondContact O-N 3.16Å; G221-I223 VanDerWaalsContact C-N 3.25Å; G221-I223 PolarHBondContact O-N 3.41Å; I223-M225 VanDerWaalsContact C-N 3.34Å; I223-M225 PolarHBondContact O-N 2.88Å; I223-T226 WeakPolarHBondContact O-CB 3.11Å; I223-T226 PolarHBondContact O-N 3.39Å; I223-T226 VanDerWaalsContact O-N 3.12Å; I223-T226 PolarHBondContact O-OG1 3.23Å; I223-P227 WeakPolarHBondContact O-CD 3.22Å
224M81.6Confident85.9Confident13 Ų1336.4 Ų36.46%0.06418%0.178CC..Hα-helixtrans-70.8-24.1-179.6-51.8-52.8-173.400114.7F100 L181 L185 F216 L217 G221 F222 T226 P227F100-M224 HydrophobicContact CD1-CB 4.35Å; F100-M224 HydrophobicContact CD1-CG 4.18Å; F100-M224 HydrophobicContact CD1-SD 3.82Å; F100-M224 HydrophobicContact CE1-CB 4.25Å; F100-M224 HydrophobicContact CE1-CE 3.34Å; F100-M224 HydrophobicContact CE1-CG 3.6Å; F100-M224 HydrophobicContact CE1-SD 3.15Å; F100-M224 WeakPolarHBondContact CE1-SD 3.04Å; F100-M224 HydrophobicContact CE2-CE 4.3Å; F100-M224 HydrophobicContact CE2-SD 4.36Å; F100-M224 HydrophobicContact CZ-CE 3.21Å; F100-M224 HydrophobicContact CZ-CG 4.42Å; F100-M224 HydrophobicContact CZ-SD 3.48Å; F100-M224 WeakPolarHBondContact CZ-SD 3.27Å; L181-M224 HydrophobicContact CD2-SD 4.48Å; L185-M224 HydrophobicContact CD1-CE 3.3Å; L185-M224 HydrophobicContact CD1-SD 3.96Å; L185-M224 HydrophobicContact CD2-CE 3.8Å; L185-M224 HydrophobicContact CD2-SD 4.25Å; L185-M224 HydrophobicContact CG-CE 4.12Å; F216-M224 HydrophobicContact CE1-CE 4.04Å; L217-M224 HydrophobicContact CD2-CE 3.85Å; G221-M224 WeakPolarHBondContact O-CB 3.46Å; G221-M224 PolarHBondContact O-N 3.31Å; G221-M224 VanDerWaalsContact O-N 3.16Å; F222-M224 PolarHBondContact O-N 2.9Å; M224-T226 VanDerWaalsContact C-N 3.34Å; M224-P227 WeakPolarHBondContact O-CD 3.42Å
225M84Confident85.7Confident47 Ų4735.8 Ų35.823%0.23218%0.177CC..Hα-helixtrans-79-21.6173.7-65.1-96.2102.900112F222 I223 L229 I279F222-M225 PolarHBondContact O-N 2.91Å; I223-M225 VanDerWaalsContact C-N 3.34Å; I223-M225 PolarHBondContact O-N 2.88Å; M225-L229 WeakPolarHBondContact O-CD1 3.02Å; M225-I279 HydrophobicContact CB-CG2 4.26Å
226T88.3Confident85.8Confident57 Ų5740 Ų4035%0.3519%0.193SC..Hα-helixtrans-62-38.5-171.3-56.10000114.9F222 I223 M224 Q228 L229 F230F222-T226 PolarHBondContact O-N 3.33Å; F222-T226 PolarHBondContact O-OG1 2.96Å; I223-T226 WeakPolarHBondContact O-CB 3.11Å; I223-T226 PolarHBondContact O-N 3.39Å; I223-T226 VanDerWaalsContact O-N 3.12Å; I223-T226 PolarHBondContact O-OG1 3.23Å; M224-T226 VanDerWaalsContact C-N 3.34Å; T226-Q228 VanDerWaalsContact C-N 3.32Å; T226-Q228 PolarHBondContact O-N 3.46Å; T226-L229 WeakPolarHBondContact O-CB 3.37Å; T226-L229 PolarHBondContact O-N 3.35Å; T226-L229 VanDerWaalsContact O-N 3.14Å; T226-F230 PolarHBondContact O-N 3.09Å
227P89.3Confident85.4Confident2 Ų240.5 Ų40.51%0.01320%0.197CC..Hα-helixtrans-58.3-40-178.6-27.635.7000114A177 F178 L181 I223 M224 L229 F230 I231A177-P227 HydrophobicContact CB-CB 4.01Å; F178-P227 HydrophobicContact CD2-CB 4.08Å; F178-P227 HydrophobicContact CD2-CG 4.31Å; F178-P227 HydrophobicContact CE2-CB 3.62Å; F178-P227 HydrophobicContact CE2-CG 3.83Å; F178-P227 HydrophobicContact CZ-CB 4.26Å; F178-P227 HydrophobicContact CZ-CG 4.01Å; L181-P227 HydrophobicContact CD1-CG 4.32Å; L181-P227 HydrophobicContact CD2-CG 3.69Å; L181-P227 HydrophobicContact CG-CG 4.46Å; I223-P227 WeakPolarHBondContact O-CD 3.22Å; M224-P227 WeakPolarHBondContact O-CD 3.42Å; P227-L229 PolarHBondContact O-N 3.49Å; P227-F230 WeakPolarHBondContact O-CB 3.34Å; P227-F230 PolarHBondContact O-N 2.89Å; P227-I231 WeakPolarHBondContact O-CG1 3.44Å; P227-I231 PolarHBondContact O-N 3.38Å
228Q89.4Confident85.3Confident22 Ų2239.6 Ų39.610%0.10319%0.192CC..Hα-helixtrans-66.1-39.1178.4-17463.549.500111.5G92 T226 F230 I231 N232 L241 Y283G92-Q228 PolarHBondContact O-NE2 3.13Å; T226-Q228 VanDerWaalsContact C-N 3.32Å; T226-Q228 PolarHBondContact O-N 3.46Å; Q228-F230 VanDerWaalsContact C-N 3.31Å; Q228-F230 PolarHBondContact O-N 2.81Å; Q228-I231 PolarHBondContact O-N 3.28Å; Q228-N232 PolarHBondContact NE2-OD1 3.35Å; Q228-N232 PolarHBondContact O-N 2.99Å; Q228-N232 PolarHBondContact O-ND2 3.19Å; Q228-N232 PolarHBondContact O-OD1 3.5Å; Q228-L241 HydrophobicContact CG-CD2 4.07Å; Q228-Y283 WeakPolarHBondContact CB-OH 3.3Å; Q228-Y283 HydrophobicContact CG-CE1 4.37Å; Q228-Y283 WeakPolarHBondContact CG-OH 3.25Å
229L89.3Confident85.3Confident13 Ų1338.7 Ų38.77%0.06820%0.195CC..Hα-helixtrans-63.1-39.1173.4-69.2133.2000111.8M225 T226 P227 Y233 I279 I282 Y283 Q286M225-L229 WeakPolarHBondContact O-CD1 3.02Å; T226-L229 WeakPolarHBondContact O-CB 3.37Å; T226-L229 PolarHBondContact O-N 3.35Å; T226-L229 VanDerWaalsContact O-N 3.14Å; P227-L229 PolarHBondContact O-N 3.49Å; L229-Y233 WeakPolarHBondContact O-CB 3.39Å; L229-Y233 PolarHBondContact O-N 3.34Å; L229-I279 HydrophobicContact CD1-CD1 3.88Å; L229-I279 HydrophobicContact CD1-CG2 3.9Å; L229-I282 HydrophobicContact CD2-CB 3.76Å; L229-I282 HydrophobicContact CD2-CG2 3.39Å; L229-Y283 HydrophobicContact CD1-CE2 4.48Å; L229-Y283 HydrophobicContact CD2-CD1 4.11Å; L229-Y283 HydrophobicContact CD2-CD2 4.27Å; L229-Y283 HydrophobicContact CD2-CE1 4.03Å; L229-Y283 HydrophobicContact CD2-CE2 4.2Å; L229-Y283 HydrophobicContact CD2-CG 4.22Å; L229-Y283 HydrophobicContact CG-CE1 3.94Å; L229-Y283 HydrophobicContact CG-CE2 4.2Å; L229-Q286 PolarHBondContact O-NE2 2.82Å
230F90.4Very high85.3Confident56 Ų5637.3 Ų37.325%0.24618%0.184CC..Hα-helixtrans-65.3-43.8177.8-177.4-92.6000111.8M176 A177 T226 P227 Q228 Y233 K234M176-F230 HydrophobicContact CG-CE1 4.3Å; M176-F230 HydrophobicContact CG-CZ 4.35Å; M176-F230 HydrophobicContact SD-CE1 4.32Å; M176-F230 HydrophobicContact SD-CZ 4.12Å; A177-F230 HydrophobicContact CB-CB 4.28Å; A177-F230 HydrophobicContact CB-CD1 3.61Å; A177-F230 HydrophobicContact CB-CE1 4.22Å; A177-F230 HydrophobicContact CB-CG 4.18Å; T226-F230 PolarHBondContact O-N 3.09Å; P227-F230 WeakPolarHBondContact O-CB 3.34Å; P227-F230 PolarHBondContact O-N 2.89Å; Q228-F230 VanDerWaalsContact C-N 3.31Å; Q228-F230 PolarHBondContact O-N 2.81Å; F230-Y233 WeakPolarHBondContact O-CB 3.29Å; F230-Y233 PolarHBondContact O-N 3.48Å; F230-K234 HydrophobicContact CD1-CG 4.06Å; F230-K234 HydrophobicContact CE1-CD 4.46Å; F230-K234 HydrophobicContact CE1-CG 3.7Å; F230-K234 HydrophobicContact CZ-CD 4.31Å; F230-K234 HydrophobicContact CZ-CG 3.98Å; F230-K234 WeakPolarHBondContact O-CG 3.34Å; F230-K234 PolarHBondContact O-N 3.14Å
231I88.2Confident85.4Confident0 Ų036.1 Ų36.10%018%0.179CC..Hα-helixtrans-61.5-48.5176.7-70.1160.5000110.5T170 D174 P227 Q228 Y233 K234 L235T170-I231 HydrophobicContact CG2-CG2 3.99Å; D174-I231 HydrophobicContact CB-CD1 3.79Å; D174-I231 HydrophobicContact CB-CG1 4.44Å; D174-I231 WeakPolarHBondContact OD1-CD1 3.26Å; P227-I231 WeakPolarHBondContact O-CG1 3.44Å; P227-I231 PolarHBondContact O-N 3.38Å; Q228-I231 PolarHBondContact O-N 3.28Å; I231-Y233 PolarHBondContact O-N 2.93Å; I231-K234 PolarHBondContact O-N 3.19Å; I231-K234 VanDerWaalsContact O-N 3.1Å; I231-L235 HydrophobicContact CG2-CD1 3.56Å; I231-L235 HydrophobicContact CG2-CG 4.19Å; I231-L235 WeakPolarHBondContact O-CB 3.4Å; I231-L235 WeakPolarHBondContact O-CG 3.45Å; I231-L235 PolarHBondContact O-N 3.03Å
232N87.9Confident85.8Confident3 Ų336.7 Ų36.72%0.01618%0.182CC..Hα-helixtrans-57.3-39.8175.9-65.1-7.7000112.1Q228 K236 S237 V238 L241 Y283 Q286 Y290Q228-N232 PolarHBondContact NE2-OD1 3.35Å; Q228-N232 PolarHBondContact O-N 2.99Å; Q228-N232 PolarHBondContact O-ND2 3.19Å; Q228-N232 PolarHBondContact O-OD1 3.5Å; N232-K236 WeakPolarHBondContact O-CA 3.14Å; N232-K236 PolarHBondContact O-N 3.4Å; N232-S237 PolarHBondContact O-N 3.02Å; N232-V238 HydrophobicContact CB-CG1 3.98Å; N232-L241 VanDerWaalsContact ND2-CD1 3.3Å; N232-L241 WeakPolarHBondContact ND2-CD1 3.5Å; N232-Y283 VanDerWaalsContact ND2-CE1 3.27Å; N232-Y283 WeakPolarHBondContact ND2-CE1 3.27Å; N232-Q286 PolarHBondContact ND2-OE1 3.44Å; N232-Y290 WeakPolarHBondContact O-CE2 3.34Å
233Y88.7Confident86.1Confident118 Ų11834.8 Ų34.846%0.46317%0.172SC..Hα-helixtrans-64.7-40.7177.2174.6-91000112.2L229 F230 I231 K236 Y290L229-Y233 WeakPolarHBondContact O-CB 3.39Å; L229-Y233 PolarHBondContact O-N 3.34Å; F230-Y233 WeakPolarHBondContact O-CB 3.29Å; F230-Y233 PolarHBondContact O-N 3.48Å; I231-Y233 PolarHBondContact O-N 2.93Å; Y233-K236 VanDerWaalsContact O-CD 3.29Å; Y233-K236 WeakPolarHBondContact O-CD 3.36Å; Y233-K236 WeakPolarHBondContact O-CE 3.41Å; Y233-Y290 WeakPolarHBondContact CD2-OH 3.48Å
234K88.3Confident86.4Confident85 Ų8542.4 Ų42.437%0.3720%0.2SC..Hα-helixtrans-74.4-41.6179.4-72.5-67-173.7175.20112.8Y173 F230 I231 K236Y173-K234 HydrophobicContact CD1-CB 3.8Å; Y173-K234 HydrophobicContact CD1-CD 4.32Å; Y173-K234 HydrophobicContact CD1-CG 3.95Å; Y173-K234 HydrophobicContact CD2-CB 3.71Å; Y173-K234 HydrophobicContact CE1-CB 4.06Å; Y173-K234 HydrophobicContact CE1-CD 4.31Å; Y173-K234 HydrophobicContact CE1-CG 4.34Å; Y173-K234 HydrophobicContact CE2-CB 3.94Å; Y173-K234 HydrophobicContact CG-CB 3.64Å; Y173-K234 HydrophobicContact CG-CG 4.15Å; F230-K234 HydrophobicContact CD1-CG 4.06Å; F230-K234 HydrophobicContact CE1-CD 4.46Å; F230-K234 HydrophobicContact CE1-CG 3.7Å; F230-K234 HydrophobicContact CZ-CD 4.31Å; F230-K234 HydrophobicContact CZ-CG 3.98Å; F230-K234 WeakPolarHBondContact O-CG 3.34Å; F230-K234 PolarHBondContact O-N 3.14Å; I231-K234 PolarHBondContact O-N 3.19Å; I231-K234 VanDerWaalsContact O-N 3.1Å; K234-K236 PolarHBondContact O-N 3.47Å
235L85.3Confident86.7Confident24 Ų2443.4 Ų43.413%0.12621%0.205CC..Hα-helixtrans-74.1-15.7176.5-68.8175.4000113.2S169 T170 Y173 I231 S237S169-L235 WeakPolarHBondContact OG-CD2 3.13Å; T170-L235 HydrophobicContact CG2-CD1 4.36Å; Y173-L235 HydrophobicContact CD2-CD2 3.8Å; Y173-L235 HydrophobicContact CD2-CG 4.04Å; Y173-L235 HydrophobicContact CE2-CD2 3.78Å; Y173-L235 HydrophobicContact CE2-CG 4.35Å; I231-L235 HydrophobicContact CG2-CD1 3.56Å; I231-L235 HydrophobicContact CG2-CG 4.19Å; I231-L235 WeakPolarHBondContact O-CB 3.4Å; I231-L235 WeakPolarHBondContact O-CG 3.45Å; I231-L235 PolarHBondContact O-N 3.03Å; L235-S237 PolarHBondContact O-N 3.29Å
236K84.9Confident87Confident101 Ų10142.6 Ų42.644%0.43920%0.201SC..THydrogen-bonded Turntrans5040.1-172.1-60.9-67.4178.4-173.60111.5N232 Y233 K234 Y290N232-K236 WeakPolarHBondContact O-CA 3.14Å; N232-K236 PolarHBondContact O-N 3.4Å; Y233-K236 VanDerWaalsContact O-CD 3.29Å; Y233-K236 WeakPolarHBondContact O-CD 3.36Å; Y233-K236 WeakPolarHBondContact O-CE 3.41Å; K234-K236 PolarHBondContact O-N 3.47Å; K236-Y290 HydrophobicContact CB-CD1 4.23Å; K236-Y290 HydrophobicContact CD-CD1 3.75Å; K236-Y290 HydrophobicContact CD-CE1 3.26Å; K236-Y290 HydrophobicContact CG-CE1 4.5Å; K236-Y290 PolarHBondContact NZ-OH 2.93Å
237S81.7Confident87.1Confident15 Ų1542.3 Ų42.311%0.10520%0.199CC..  trans-150.6144.5-178.5-179.70000110.2N232 L235 A239N232-S237 PolarHBondContact O-N 3.02Å; L235-S237 PolarHBondContact O-N 3.29Å; S237-A239 PolarHBondContact OG-N 3.12Å
238V82.6Confident87.1Confident1 Ų145.1 Ų45.11%0.00621%0.21CC..  trans-129.816.4172.6-65.80000111.6N232 H240 L241 W243 Q286 R287 Y290N232-V238 HydrophobicContact CB-CG1 3.98Å; V238-H240 VanDerWaalsContact C-N 3.25Å; V238-H240 PolarHBondContact O-N 3.28Å; V238-L241 HydrophobicContact CB-CD1 4.37Å; V238-L241 HydrophobicContact CG1-CD1 4.46Å; V238-L241 PolarHBondContact O-N 2.97Å; V238-W243 HydrophobicContact CB-CZ2 3.87Å; V238-W243 HydrophobicContact CG1-CZ2 4.5Å; V238-W243 HydrophobicContact CG2-CZ2 3.74Å; V238-W243 PolarHBondContact O-NE1 3.34Å; V238-Q286 HydrophobicContact CG1-CB 4Å; V238-R287 HydrophobicContact CG2-CB 3.97Å; V238-R287 HydrophobicContact CG2-CG 4.1Å; V238-Y290 HydrophobicContact CG1-CD2 4.3Å
239A80.1Confident87Confident52 Ų5248.4 Ų48.443%0.4322%0.224SC..THydrogen-bonded Turntrans-66.7-28.3-175.200000112.8S237 L241 V292S237-A239 PolarHBondContact OG-N 3.12Å; A239-L241 VanDerWaalsContact C-N 3.33Å; A239-L241 PolarHBondContact O-N 3.36Å; A239-V292 HydrophobicContact CB-CG1 4.48Å; A239-V292 HydrophobicContact CB-CG2 4.43Å
240H81Confident86.9Confident31 Ų3149.2 Ų49.214%0.14423%0.227CC..THydrogen-bonded Turntrans-83.5-7.2-176.3-48.6-79.6000113.3F83 R87 E91 V238F83-H240 WeakPolarHBondContact CE2-O 3.45Å; F83-H240 WeakPolarHBondContact CZ-O 3.18Å; R87-H240 PolarHBondContact NH2-ND1 3.05Å; R87-H240 VanDerWaalsContact NH2-ND1 3.16Å; E91-H240 WeakPolarHBondContact O-CB 3.44Å; E91-H240 PolarHBondContact O-ND1 2.85Å; V238-H240 VanDerWaalsContact C-N 3.25Å; V238-H240 PolarHBondContact O-N 3.28Å
241L87.2Confident86.9Confident15 Ų1549.3 Ų49.38%0.07923%0.23CC..SBendtrans-81.7143.8-177.8-73.7180000113.1L93 Q228 N232 V238 A239 W243 L246 Y283L93-L241 HydrophobicContact CD2-CD2 4.09Å; Q228-L241 HydrophobicContact CG-CD2 4.07Å; N232-L241 VanDerWaalsContact ND2-CD1 3.3Å; N232-L241 WeakPolarHBondContact ND2-CD1 3.5Å; V238-L241 HydrophobicContact CB-CD1 4.37Å; V238-L241 HydrophobicContact CG1-CD1 4.46Å; V238-L241 PolarHBondContact O-N 2.97Å; A239-L241 VanDerWaalsContact C-N 3.33Å; A239-L241 PolarHBondContact O-N 3.36Å; L241-W243 VanDerWaalsContact C-N 3.31Å; L241-W243 VanDerWaalsContact O-CD1 3.31Å; L241-W243 PolarHBondContact O-N 3.34Å; L241-L246 HydrophobicContact CB-CD1 4.11Å; L241-L246 HydrophobicContact CD1-CD1 4.25Å; L241-Y283 HydrophobicContact CD1-CD1 3.91Å; L241-Y283 HydrophobicContact CD1-CE1 3.8Å
242P88.1Confident86.6Confident21 Ų2150.2 Ų50.214%0.13624%0.235CC..  trans-76.276.4177.332.1-35.7000112.1F83 R244 M245 L246F83-P242 HydrophobicContact CB-CB 3.99Å; F83-P242 HydrophobicContact CD1-CB 3.95Å; F83-P242 HydrophobicContact CD1-CG 4.13Å; F83-P242 HydrophobicContact CD2-CB 3.63Å; F83-P242 HydrophobicContact CD2-CG 4.49Å; F83-P242 HydrophobicContact CE1-CB 4.3Å; F83-P242 HydrophobicContact CE1-CG 4.18Å; F83-P242 HydrophobicContact CE2-CB 3.99Å; F83-P242 HydrophobicContact CG-CB 3.59Å; F83-P242 HydrophobicContact CG-CG 4.29Å; F83-P242 HydrophobicContact CZ-CB 4.31Å; F83-P242 HydrophobicContact CZ-CG 4.36Å; P242-R244 VanDerWaalsContact C-N 3.29Å; P242-R244 PolarHBondContact O-N 3.41Å; P242-R244 VanDerWaalsContact O-N 3.16Å; P242-M245 HydrophobicContact CB-CB 4.06Å; P242-M245 HydrophobicContact CG-CB 4.41Å; P242-M245 HydrophobicContact CG-SD 4.46Å; P242-M245 WeakPolarHBondContact O-CB 3.44Å; P242-M245 PolarHBondContact O-N 3.41Å; P242-L246 PolarHBondContact O-N 3.01Å
243W87.8Confident86.2Confident43 Ų4350.9 Ų50.916%0.16324%0.239CC..Hα-helixtrans-53.8-39.1-174.8-80.498.5000115.1V238 L241 M245 L246 T247 Y283 R287V238-W243 HydrophobicContact CB-CZ2 3.87Å; V238-W243 HydrophobicContact CG1-CZ2 4.5Å; V238-W243 HydrophobicContact CG2-CZ2 3.74Å; V238-W243 PolarHBondContact O-NE1 3.34Å; L241-W243 VanDerWaalsContact C-N 3.31Å; L241-W243 VanDerWaalsContact O-CD1 3.31Å; L241-W243 PolarHBondContact O-N 3.34Å; W243-M245 PolarHBondContact O-N 2.83Å; W243-L246 PolarHBondContact O-N 3.29Å; W243-T247 WeakPolarHBondContact O-CB 3.34Å; W243-T247 PolarHBondContact O-N 3.39Å; W243-T247 PolarHBondContact O-OG1 2.89Å; W243-Y283 WeakPolarHBondContact CH2-O 3.37Å; W243-R287 HydrophobicContact CH2-CB 3.59Å; W243-R287 HydrophobicContact CH2-CG 4.08Å; W243-R287 HydrophobicContact CZ2-CB 3.61Å; W243-R287 HydrophobicContact CZ2-CG 3.82Å; W243-R287 HydrophobicContact CZ3-CB 4.49Å
244R89.9Confident85.9Confident172 Ų17249.1 Ų49.165%0.64923%0.234SC*.Hα-helixtrans-61.1-47.7177.9-66.4-177.2-177.9178.20111.3N79 P242 T247 Y248N79-R244 HydrophobicContact CB-CB 4.3Å; P242-R244 VanDerWaalsContact C-N 3.29Å; P242-R244 PolarHBondContact O-N 3.41Å; P242-R244 VanDerWaalsContact O-N 3.16Å; R244-T247 PolarHBondContact O-N 3.33Å; R244-Y248 HydrophobicContact CB-CE2 4.1Å; R244-Y248 WeakPolarHBondContact O-CD2 3.47Å; R244-Y248 WeakPolarHBondContact O-CE2 3.41Å; R244-Y248 PolarHBondContact O-N 3.48Å
245M89.4Confident85.6Confident34 Ų3446.1 Ų46.117%0.16722%0.222CC..Hα-helixtrans-61.8-46.1177.5174.9-84.7-161.200111.2A76 N79 D80 P242 W243 T247 Y248 K249A76-M245 WeakPolarHBondContact O-CG 3.49Å; N79-M245 HydrophobicContact CB-CB 4.09Å; D80-M245 HydrophobicContact CB-CE 4.21Å; D80-M245 HydrophobicContact CB-CG 3.81Å; P242-M245 HydrophobicContact CB-CB 4.06Å; P242-M245 HydrophobicContact CG-CB 4.41Å; P242-M245 HydrophobicContact CG-SD 4.46Å; P242-M245 WeakPolarHBondContact O-CB 3.44Å; P242-M245 PolarHBondContact O-N 3.41Å; W243-M245 PolarHBondContact O-N 2.83Å; M245-T247 PolarHBondContact O-N 2.86Å; M245-Y248 PolarHBondContact O-N 3.31Å; M245-K249 WeakPolarHBondContact O-CB 3.41Å; M245-K249 PolarHBondContact O-N 2.91Å
246L89Confident85.2Confident30 Ų3045.8 Ų45.816%0.15722%0.22CC..Hα-helixtrans-61.9-42.5178.6-67.5175.7000112.2L241 P242 W243 K249 F250 F280L241-L246 HydrophobicContact CB-CD1 4.11Å; L241-L246 HydrophobicContact CD1-CD1 4.25Å; P242-L246 PolarHBondContact O-N 3.01Å; W243-L246 PolarHBondContact O-N 3.29Å; L246-K249 PolarHBondContact O-N 3.18Å; L246-F250 WeakPolarHBondContact O-CB 3.47Å; L246-F250 PolarHBondContact O-N 3.14Å; L246-F280 HydrophobicContact CB-CE2 4.3Å
247T90.8Very high84.8Confident50 Ų5042.5 Ų42.531%0.30721%0.207SC..Hα-helixtrans-64.8-43.5176.8-59.70000111.7W243 R244 M245 K249 F250 L251W243-T247 WeakPolarHBondContact O-CB 3.34Å; W243-T247 PolarHBondContact O-N 3.39Å; W243-T247 PolarHBondContact O-OG1 2.89Å; R244-T247 PolarHBondContact O-N 3.33Å; M245-T247 PolarHBondContact O-N 2.86Å; T247-K249 VanDerWaalsContact C-N 3.33Å; T247-K249 PolarHBondContact O-N 2.98Å; T247-F250 PolarHBondContact O-N 2.87Å; T247-L251 HydrophobicContact CG2-CD1 4.26Å; T247-L251 HydrophobicContact CG2-CG 4.44Å; T247-L251 VanDerWaalsContact O-CG 3.32Å; T247-L251 WeakPolarHBondContact O-CG 3.27Å; T247-L251 PolarHBondContact O-N 3.37Å
248Y89.9Confident84.7Confident62 Ų6246 Ų4624%0.24322%0.224CC..Hα-helixtrans-64.3-39.5176.1-64.6-49000112F72 L75 N79 R244 M245 L251 N252F72-Y248 HydrophobicContact CD1-CD1 4.06Å; L75-Y248 HydrophobicContact CB-CD1 4.06Å; L75-Y248 HydrophobicContact CB-CD2 3.73Å; L75-Y248 HydrophobicContact CB-CE1 4.24Å; L75-Y248 HydrophobicContact CB-CE2 3.95Å; L75-Y248 HydrophobicContact CB-CG 3.82Å; L75-Y248 HydrophobicContact CD1-CD1 4.18Å; L75-Y248 HydrophobicContact CD1-CE1 3.86Å; N79-Y248 VanDerWaalsContact ND2-CE2 3.25Å; N79-Y248 WeakPolarHBondContact ND2-CE2 3.21Å; R244-Y248 HydrophobicContact CB-CE2 4.1Å; R244-Y248 WeakPolarHBondContact O-CD2 3.47Å; R244-Y248 WeakPolarHBondContact O-CE2 3.41Å; R244-Y248 PolarHBondContact O-N 3.48Å; M245-Y248 PolarHBondContact O-N 3.31Å; Y248-L251 PolarHBondContact O-N 3.29Å; Y248-N252 PolarHBondContact O-N 2.98Å
249K85.7Confident84.1Confident91 Ų9147 Ų4740%0.39623%0.229SC..Hα-helixtrans-62.8-42.2175.1-171.2174.8-178.6-179.60111.9M245 L246 T247 N252 T253M245-K249 WeakPolarHBondContact O-CB 3.41Å; M245-K249 PolarHBondContact O-N 2.91Å; L246-K249 PolarHBondContact O-N 3.18Å; T247-K249 VanDerWaalsContact C-N 3.33Å; T247-K249 PolarHBondContact O-N 2.98Å; K249-N252 WeakPolarHBondContact O-CB 3.34Å; K249-N252 PolarHBondContact O-N 3.37Å; K249-T253 PolarHBondContact O-N 3.26Å; K249-T253 VanDerWaalsContact O-N 3.1Å; K249-T253 PolarHBondContact O-OG1 3.38Å
250F88.5Confident83.5Confident30 Ų3044.8 Ų44.813%0.13221%0.21CC..Hα-helixtrans-65.8-43.8175.4167.5-105000112.9L246 T247 N252 T253 F254 D277 F280 F281L246-F250 WeakPolarHBondContact O-CB 3.47Å; L246-F250 PolarHBondContact O-N 3.14Å; T247-F250 PolarHBondContact O-N 2.87Å; F250-N252 PolarHBondContact O-N 2.94Å; F250-T253 WeakPolarHBondContact CA-OG1 3.45Å; F250-T253 PolarHBondContact O-N 3.3Å; F250-T253 PolarHBondContact O-OG1 3.39Å; F250-F254 HydrophobicContact CE1-CB 4.45Å; F250-F254 HydrophobicContact CE2-CB 4.31Å; F250-F254 HydrophobicContact CZ-CB 4.2Å; F250-F254 HydrophobicContact CZ-CD2 4.12Å; F250-F254 HydrophobicContact CZ-CG 4.32Å; F250-F254 WeakPolarHBondContact O-CB 3.45Å; F250-F254 PolarHBondContact O-N 2.96Å; F250-D277 HydrophobicContact CE2-CB 4.16Å; F250-F280 HydrophobicContact CB-CB 4.18Å; F250-F280 HydrophobicContact CB-CD1 3.78Å; F250-F280 HydrophobicContact CB-CD2 3.43Å; F250-F280 VanDerWaalsContact CB-CD2 3.43Å; F250-F280 HydrophobicContact CB-CE1 3.92Å; F250-F280 HydrophobicContact CB-CE2 3.58Å; F250-F280 HydrophobicContact CB-CG 3.51Å; F250-F280 HydrophobicContact CB-CZ 3.82Å; F250-F280 AromaticContact CD1-CD1 3.55Å; F250-F280 HydrophobicContact CD1-CD1 3.55Å; F250-F280 AromaticContact CD1-CE1 3.31Å; F250-F280 HydrophobicContact CD1-CE1 3.31Å; F250-F280 HydrophobicContact CD1-CE2 4.45Å; F250-F280 HydrophobicContact CD1-CG 4.21Å; F250-F280 AromaticContact CD1-CZ 3.81Å; F250-F280 HydrophobicContact CD1-CZ 3.81Å; F250-F280 HydrophobicContact CD2-CB 3.49Å; F250-F280 VanDerWaalsContact CD2-CB 3.49Å; F250-F280 AromaticContact CD2-CD1 3.21Å; F250-F280 HydrophobicContact CD2-CD1 3.21Å; F250-F280 HydrophobicContact CD2-CD2 4.22Å; F250-F280 AromaticContact CD2-CE1 3.92Å; F250-F280 HydrophobicContact CD2-CE1 3.92Å; F250-F280 AromaticContact CD2-CG 3.36Å; F250-F280 HydrophobicContact CD2-CG 3.36Å; F250-F280 AromaticContact CE1-CD1 3.88Å; F250-F280 HydrophobicContact CE1-CD1 3.88Å; F250-F280 AromaticContact CE1-CE1 3.72Å; F250-F280 HydrophobicContact CE1-CE1 3.72Å; F250-F280 HydrophobicContact CE2-CB 4.16Å; F250-F280 AromaticContact CE2-CD1 3.55Å; F250-F280 HydrophobicContact CE2-CD1 3.55Å; F250-F280 HydrophobicContact CE2-CE1 4.26Å; F250-F280 HydrophobicContact CE2-CG 4.1Å; F250-F280 HydrophobicContact CG-CB 4.04Å; F250-F280 AromaticContact CG-CD1 3.18Å; F250-F280 HydrophobicContact CG-CD1 3.18Å; F250-F280 AromaticContact CG-CD2 3.86Å; F250-F280 HydrophobicContact CG-CD2 3.86Å; F250-F280 AromaticContact CG-CE1 3.41Å; F250-F280 HydrophobicContact CG-CE1 3.41Å; F250-F280 VanDerWaalsContact CG-CE1 3.41Å; F250-F280 HydrophobicContact CG-CE2 4.05Å; F250-F280 AromaticContact CG-CG 3.4Å; F250-F280 HydrophobicContact CG-CG 3.4Å; F250-F280 VanDerWaalsContact CG-CG 3.4Å; F250-F280 AromaticContact CG-CZ 3.84Å; F250-F280 HydrophobicContact CG-CZ 3.84Å; F250-F280 AromaticContact CZ-CD1 3.87Å; F250-F280 HydrophobicContact CZ-CD1 3.87Å; F250-F280 HydrophobicContact CZ-CE1 4.17Å; F250-F281 HydrophobicContact CE2-CE2 4.29Å; F250-F281 HydrophobicContact CZ-CE2 4.39Å; F250-F281 HydrophobicContact CZ-CZ 4.24Å
251L89.4Confident82.8Confident57 Ų5752.2 Ų52.230%0.29824%0.242SC..Hα-helixtrans-58.5-34.7175-71.4173.3000110.9F72 T247 Y248 I255F72-L251 HydrophobicContact CD1-CB 4.4Å; F72-L251 HydrophobicContact CD1-CD1 4.23Å; F72-L251 HydrophobicContact CD2-CB 4.26Å; F72-L251 HydrophobicContact CE1-CD1 3.89Å; F72-L251 HydrophobicContact CE2-CB 4.42Å; F72-L251 HydrophobicContact CG-CB 4.27Å; F72-L251 HydrophobicContact CZ-CD1 4.26Å; T247-L251 HydrophobicContact CG2-CD1 4.26Å; T247-L251 HydrophobicContact CG2-CG 4.44Å; T247-L251 VanDerWaalsContact O-CG 3.32Å; T247-L251 WeakPolarHBondContact O-CG 3.27Å; T247-L251 PolarHBondContact O-N 3.37Å; Y248-L251 PolarHBondContact O-N 3.29Å; L251-I255 WeakPolarHBondContact O-CD1 3.48Å; L251-I255 WeakPolarHBondContact O-CG1 3.43Å; L251-I255 PolarHBondContact O-N 3.34Å; L251-I255 VanDerWaalsContact O-N 3.13Å
252N82.8Confident81.8Confident19 Ų1955.4 Ų55.410%0.10226%0.262CS..Hα-helixtrans-63.2-52175.3-150.533.5000112.4H69 F72 Y248 K249 F250 I255 D256H69-N252 WeakPolarHBondContact CA-OD1 3.15Å; H69-N252 PolarHBondContact CD2-ND2 3.36Å; H69-N252 PolarHBondContact CD2-OD1 2.92Å; H69-N252 PolarHBondContact CE1-ND2 2.75Å; H69-N252 VanDerWaalsContact CE1-ND2 3.26Å; H69-N252 PolarHBondContact CE1-OD1 3.04Å; H69-N252 PolarHBondContact ND1-OD1 3.48Å; H69-N252 PolarHBondContact NE2-ND2 3.01Å; H69-N252 PolarHBondContact NE2-OD1 3.34Å; H69-N252 PolarHBondContact O-OD1 3.24Å; F72-N252 HydrophobicContact CB-CB 4.41Å; Y248-N252 PolarHBondContact O-N 2.98Å; K249-N252 WeakPolarHBondContact O-CB 3.34Å; K249-N252 PolarHBondContact O-N 3.37Å; F250-N252 PolarHBondContact O-N 2.94Å; N252-I255 PolarHBondContact O-N 3.16Å; N252-D256 PolarHBondContact O-N 3.48Å
253T79.4Confident80.6Confident17 Ų1757.1 Ų57.110%0.10427%0.269CS..Hα-helixtrans-69.3-34.3-179.654.70000112.7K249 F250 I255 D256 D257 D276 D277K249-T253 PolarHBondContact O-N 3.26Å; K249-T253 VanDerWaalsContact O-N 3.1Å; K249-T253 PolarHBondContact O-OG1 3.38Å; F250-T253 WeakPolarHBondContact CA-OG1 3.45Å; F250-T253 PolarHBondContact O-N 3.3Å; F250-T253 PolarHBondContact O-OG1 3.39Å; T253-I255 VanDerWaalsContact C-N 3.34Å; T253-I255 PolarHBondContact O-N 3.11Å; T253-D256 WeakPolarHBondContact O-CB 3.35Å; T253-D256 PolarHBondContact O-N 3.44Å; T253-D256 VanDerWaalsContact O-N 3.16Å; T253-D257 PolarHBondContact O-N 3Å; T253-D276 HydrophobicContact CG2-CB 4.19Å; T253-D277 VanDerWaalsContact CB-OD1 3.28Å; T253-D277 WeakPolarHBondContact CB-OD1 3.13Å; T253-D277 PolarHBondContact OG1-OD1 3.13Å
254F83.1Confident79.2Confident81 Ų8164.4 Ų64.436%0.35530%0.302SS..Hα-helixtrans-64.4-40.2176.5-179.6-103.3000111.8F250 D256 D257 L258 D277F250-F254 HydrophobicContact CE1-CB 4.45Å; F250-F254 HydrophobicContact CE2-CB 4.31Å; F250-F254 HydrophobicContact CZ-CB 4.2Å; F250-F254 HydrophobicContact CZ-CD2 4.12Å; F250-F254 HydrophobicContact CZ-CG 4.32Å; F250-F254 WeakPolarHBondContact O-CB 3.45Å; F250-F254 PolarHBondContact O-N 2.96Å; F254-D256 VanDerWaalsContact C-N 3.33Å; F254-D257 PolarHBondContact O-N 3.29Å; F254-L258 HydrophobicContact CD1-CD1 3.94Å; F254-L258 HydrophobicContact CD1-CG 4.37Å; F254-L258 HydrophobicContact CE1-CD1 3.4Å; F254-L258 HydrophobicContact CE1-CD2 4.49Å; F254-L258 HydrophobicContact CE1-CG 3.96Å; F254-L258 HydrophobicContact CZ-CD1 3.9Å; F254-L258 HydrophobicContact CZ-CD2 4.16Å; F254-L258 HydrophobicContact CZ-CG 4.05Å; F254-L258 WeakPolarHBondContact O-CG 3.21Å; F254-L258 PolarHBondContact O-N 3.29Å; F254-D277 WeakPolarHBondContact CA-OD2 3.48Å
255I81.8Confident77.6Confident23 Ų2356.8 Ų56.812%0.11827%0.274CS..Hα-helixtrans-61.2-46.7172.6-73.4168000109.5V65 L68 F72 L251 N252 T253 D257 L258 F259V65-I255 HydrophobicContact CG1-CG2 3.5Å; L68-I255 HydrophobicContact CB-CD1 4.41Å; F72-I255 HydrophobicContact CD2-CD1 3.64Å; F72-I255 HydrophobicContact CE2-CD1 3.47Å; F72-I255 VanDerWaalsContact CE2-CD1 3.47Å; L251-I255 WeakPolarHBondContact O-CD1 3.48Å; L251-I255 WeakPolarHBondContact O-CG1 3.43Å; L251-I255 PolarHBondContact O-N 3.34Å; L251-I255 VanDerWaalsContact O-N 3.13Å; N252-I255 PolarHBondContact O-N 3.16Å; T253-I255 VanDerWaalsContact C-N 3.34Å; T253-I255 PolarHBondContact O-N 3.11Å; I255-D257 VanDerWaalsContact C-N 3.29Å; I255-D257 PolarHBondContact O-N 3.41Å; I255-L258 PolarHBondContact O-N 3.27Å; I255-F259 HydrophobicContact CG2-CD2 3.97Å; I255-F259 HydrophobicContact CG2-CE2 4.3Å; I255-F259 VanDerWaalsContact O-CD2 3.28Å; I255-F259 WeakPolarHBondContact O-CD2 3.29Å; I255-F259 PolarHBondContact O-N 3.38Å
256D76.1Confident76Confident17 Ų1756.6 Ų56.69%0.09128%0.276CS..Hα-helixtrans-57.3-40.6177.3-68.9-16.4000112.7L20 H69 N252 T253 F254 F259 A260 Y269L20-D256 HydrophobicContact CD2-CB 4.46Å; H69-D256 IonicContact CE1-OD1 2.86Å; H69-D256 PolarHBondContact CE1-OD1 3.46Å; H69-D256 VanDerWaalsContact CE1-OD1 3.22Å; H69-D256 IonicContact CE1-OD2 3.84Å; H69-D256 PolarHBondContact CE1-OD2 3.05Å; H69-D256 IonicContact ND1-OD1 2.71Å; H69-D256 PolarHBondContact ND1-OD1 2.84Å; H69-D256 VanDerWaalsContact ND1-OD1 3.13Å; N252-D256 PolarHBondContact O-N 3.48Å; T253-D256 WeakPolarHBondContact O-CB 3.35Å; T253-D256 PolarHBondContact O-N 3.44Å; T253-D256 VanDerWaalsContact O-N 3.16Å; F254-D256 VanDerWaalsContact C-N 3.33Å; D256-F259 CarbonylContact O-C 3.54Å; D256-F259 PolarHBondContact O-N 3.28Å; D256-A260 VanDerWaalsContact O-CB 3.31Å; D256-A260 WeakPolarHBondContact O-CB 3.45Å; D256-A260 PolarHBondContact O-N 3.13Å; D256-Y269 VanDerWaalsContact CB-OH 3.28Å; D256-Y269 WeakPolarHBondContact CB-OH 3.3Å; D256-Y269 PolarHBondContact OD2-OH 3.43Å
257D77.3Confident74.8Confident31 Ų3160 Ų6017%0.16630%0.297CS..Hα-helixtrans-65.2-43.8176.4-92-1.3000112.9T253 F254 I255 F259 A260 F261 C273 F274T253-D257 PolarHBondContact O-N 3Å; F254-D257 PolarHBondContact O-N 3.29Å; I255-D257 VanDerWaalsContact C-N 3.29Å; I255-D257 PolarHBondContact O-N 3.41Å; D257-F259 VanDerWaalsContact C-N 3.28Å; D257-F259 PolarHBondContact O-N 2.87Å; D257-A260 WeakPolarHBondContact O-CB 3.42Å; D257-A260 PolarHBondContact O-N 2.88Å; D257-F261 PolarHBondContact O-N 3.36Å; D257-C273 WeakPolarHBondContact OD1-CB 3.38Å; D257-F274 PolarHBondContact OD1-N 2.86Å; D257-F274 VanDerWaalsContact OD2-CA 3.25Å; D257-F274 WeakPolarHBondContact OD2-CA 3.26Å; D257-F274 PolarHBondContact OD2-N 2.93Å
258L78.4Confident73.5Confident89 Ų8962.3 Ų62.347%0.46631%0.308SS..Hα-helixtrans-60.4-40.4173.7-72179.4000111.2F254 I255 F261 V262F254-L258 HydrophobicContact CD1-CD1 3.94Å; F254-L258 HydrophobicContact CD1-CG 4.37Å; F254-L258 HydrophobicContact CE1-CD1 3.4Å; F254-L258 HydrophobicContact CE1-CD2 4.49Å; F254-L258 HydrophobicContact CE1-CG 3.96Å; F254-L258 HydrophobicContact CZ-CD1 3.9Å; F254-L258 HydrophobicContact CZ-CD2 4.16Å; F254-L258 HydrophobicContact CZ-CG 4.05Å; F254-L258 WeakPolarHBondContact O-CG 3.21Å; F254-L258 PolarHBondContact O-N 3.29Å; I255-L258 PolarHBondContact O-N 3.27Å; L258-F261 WeakPolarHBondContact O-CB 3.24Å; L258-F261 PolarHBondContact O-N 3.13Å; L258-V262 PolarHBondContact O-N 3.12Å
259F69.9Low72Confident23 Ų2360.7 Ų60.710%0.10130%0.301CS..Hα-helixtrans-73.1-33.1176.8-87.9-88.7000113L61 V65 I255 D256 D257 F261 V262 I263 M265L61-F259 HydrophobicContact CD1-CZ 3.98Å; L61-F259 HydrophobicContact CD2-CE1 3.93Å; L61-F259 HydrophobicContact CD2-CZ 3.89Å; L61-F259 HydrophobicContact CG-CE1 3.87Å; L61-F259 HydrophobicContact CG-CZ 3.66Å; V65-F259 HydrophobicContact CB-CD2 4.47Å; V65-F259 HydrophobicContact CB-CE1 4.35Å; V65-F259 HydrophobicContact CB-CE2 3.83Å; V65-F259 HydrophobicContact CB-CZ 3.77Å; V65-F259 HydrophobicContact CG1-CD2 3.68Å; V65-F259 HydrophobicContact CG1-CE1 4.33Å; V65-F259 HydrophobicContact CG1-CE2 3.51Å; V65-F259 HydrophobicContact CG1-CG 4.24Å; V65-F259 HydrophobicContact CG1-CZ 3.87Å; V65-F259 HydrophobicContact CG2-CD2 4.23Å; V65-F259 HydrophobicContact CG2-CE1 4.08Å; V65-F259 HydrophobicContact CG2-CE2 3.2Å; V65-F259 HydrophobicContact CG2-CZ 3.1Å; I255-F259 HydrophobicContact CG2-CD2 3.97Å; I255-F259 HydrophobicContact CG2-CE2 4.3Å; I255-F259 VanDerWaalsContact O-CD2 3.28Å; I255-F259 WeakPolarHBondContact O-CD2 3.29Å; I255-F259 PolarHBondContact O-N 3.38Å; D256-F259 CarbonylContact O-C 3.54Å; D256-F259 PolarHBondContact O-N 3.28Å; D257-F259 VanDerWaalsContact C-N 3.28Å; D257-F259 PolarHBondContact O-N 2.87Å; F259-F261 PolarHBondContact O-N 3.06Å; F259-V262 PolarHBondContact O-N 3.21Å; F259-V262 VanDerWaalsContact O-N 3.07Å; F259-I263 HydrophobicContact CD1-CD1 3.99Å; F259-I263 HydrophobicContact CD1-CG1 4.5Å; F259-I263 PolarHBondContact O-N 3.39Å; F259-M265 HydrophobicContact CB-CE 4.05Å
260A67.5Low71.1Confident4 Ų460.7 Ų60.73%0.03330%0.299CS..Hα-helixtrans-62.6-23173.600000112.5D256 D257 I263 M265 R270D256-A260 VanDerWaalsContact O-CB 3.31Å; D256-A260 WeakPolarHBondContact O-CB 3.45Å; D256-A260 PolarHBondContact O-N 3.13Å; D257-A260 WeakPolarHBondContact O-CB 3.42Å; D257-A260 PolarHBondContact O-N 2.88Å; A260-I263 CarbonylContact C-O 3.45Å; A260-M265 HydrophobicContact CB-CB 4.47Å; A260-M265 HydrophobicContact CB-CG 4.43Å; A260-M265 HydrophobicContact CB-SD 4.06Å; A260-R270 HydrophobicContact CB-CG 4.03Å; A260-R270 PolarHBondContact O-NE 2.54Å; A260-R270 PolarHBondContact O-NH2 3.02Å
261F67.9Low70.3Confident187 Ų18764.4 Ų64.482%0.8232%0.319SS*.Hα-helixtrans-77.3-41.8169.8-175.3-100.7000112.4D257 L258 F259D257-F261 PolarHBondContact O-N 3.36Å; L258-F261 WeakPolarHBondContact O-CB 3.24Å; L258-F261 PolarHBondContact O-N 3.13Å; F259-F261 PolarHBondContact O-N 3.06Å
262V65.7Low69.3Low83 Ų8362.5 Ų62.550%0.50331%0.313SS..Hα-helixtrans-74.1-43.4-178.5177.10000112.4L258 F259L258-V262 PolarHBondContact O-N 3.12Å; F259-V262 PolarHBondContact O-N 3.21Å; F259-V262 VanDerWaalsContact O-N 3.07Å
263I62.5Low68.8Low56 Ų5662.1 Ų62.129%0.28731%0.311SS..THydrogen-bonded Turntrans-106.7130.7-178.7-56.5176.4000107.6F259 A260 M265F259-I263 HydrophobicContact CD1-CD1 3.99Å; F259-I263 HydrophobicContact CD1-CG1 4.5Å; F259-I263 PolarHBondContact O-N 3.39Å; A260-I263 CarbonylContact C-O 3.45Å; I263-M265 HydrophobicContact CB-CE 4.1Å; I263-M265 HydrophobicContact CG2-CE 4.46Å; I263-M265 PolarHBondContact O-N 2.83Å
264K57.3Low68.6Low196 Ų19667.6 Ų67.685%0.85233%0.334SS*.THydrogen-bonded Turntrans-67.894.3178.2-76.4-175.8179.51750110.7
265M56.9Low68.5Low13 Ų1366.1 Ų66.16%0.06433%0.326CS..  trans-93.3156174.1-60.2-166.1-164.100111.8L20 F259 A260 I263 Y269 R270L20-M265 HydrophobicContact CD1-CE 3.16Å; L20-M265 HydrophobicContact CD1-SD 3.53Å; L20-M265 VanDerWaalsContact CD1-SD 3.53Å; L20-M265 HydrophobicContact CD2-CE 3.57Å; L20-M265 HydrophobicContact CD2-SD 3.98Å; L20-M265 HydrophobicContact CG-CE 3.97Å; L20-M265 HydrophobicContact CG-SD 4.28Å; F259-M265 HydrophobicContact CB-CE 4.05Å; A260-M265 HydrophobicContact CB-CB 4.47Å; A260-M265 HydrophobicContact CB-CG 4.43Å; A260-M265 HydrophobicContact CB-SD 4.06Å; I263-M265 HydrophobicContact CB-CE 4.1Å; I263-M265 HydrophobicContact CG2-CE 4.46Å; I263-M265 PolarHBondContact O-N 2.83Å; M265-Y269 HydrophobicContact CB-CD1 4.06Å; M265-Y269 HydrophobicContact CG-CD1 4.44Å; M265-Y269 HydrophobicContact SD-CD1 3.5Å; M265-Y269 VanDerWaalsContact SD-CD1 3.5Å; M265-Y269 HydrophobicContact SD-CE1 3.28Å; M265-Y269 WeakPolarHBondContact SD-CE1 3.08Å; M265-R270 HydrophobicContact CB-CG 4.38Å; M265-R270 PolarHBondContact O-NE 3.21Å
266P55.6Low68.4Low30 Ų3066.9 Ų66.920%0.19533%0.33CS..  trans-60.4144.2176.6-20.532.1000111.7T13 M16 L268 Y269 R270T13-P266 HydrophobicContact CG2-CB 4.43Å; M16-P266 HydrophobicContact CB-CG 3.56Å; M16-P266 HydrophobicContact CE-CG 4.31Å; M16-P266 HydrophobicContact CG-CG 3.49Å; M16-P266 VanDerWaalsContact CG-CG 3.49Å; M16-P266 VanDerWaalsContact SD-CD 3.54Å; M16-P266 HydrophobicContact SD-CG 3.84Å; P266-L268 VanDerWaalsContact C-N 3.3Å; P266-L268 PolarHBondContact O-N 3.1Å; P266-Y269 WeakPolarHBondContact O-CB 3.45Å; P266-Y269 PolarHBondContact O-N 3.28Å; P266-Y269 VanDerWaalsContact O-N 3.09Å; P266-R270 PolarHBondContact O-N 2.97Å
267T65Low68.8Low100 Ų10066.4 Ų66.461%0.61333%0.328SS*.Hα-helixtrans-56.1-39.8-176.348.30000113.3Y269 R270 I271T267-Y269 VanDerWaalsContact C-N 3.32Å; T267-Y269 PolarHBondContact O-N 2.95Å; T267-R270 WeakPolarHBondContact O-CB 3.13Å; T267-R270 PolarHBondContact O-N 2.94Å; T267-I271 VanDerWaalsContact O-CG1 3.27Å; T267-I271 WeakPolarHBondContact O-CG1 3.21Å; T267-I271 PolarHBondContact O-N 3.38Å
268L63.2Low69.3Low100 Ų10067.7 Ų67.752%0.52434%0.337SS..Hα-helixtrans-60.3-39.3177.8-74.4170.5000113P266 I271 G272P266-L268 VanDerWaalsContact C-N 3.3Å; P266-L268 PolarHBondContact O-N 3.1Å; L268-I271 PolarHBondContact O-N 3.43Å; L268-G272 PolarHBondContact O-N 2.84Å
269Y59.1Low69.7Low28 Ų2864.3 Ų64.311%0.1132%0.319CS..Hα-helixtrans-67.1-45.6177.1176.9-99.7000110.9P17 L20 D256 M265 P266 T267 I271 G272 C273P17-Y269 HydrophobicContact CB-CD2 4.03Å; L20-Y269 HydrophobicContact CB-CE2 4.38Å; L20-Y269 HydrophobicContact CD2-CE1 4.26Å; L20-Y269 VanDerWaalsContact CD2-OH 3.27Å; L20-Y269 WeakPolarHBondContact CD2-OH 3.19Å; D256-Y269 VanDerWaalsContact CB-OH 3.28Å; D256-Y269 WeakPolarHBondContact CB-OH 3.3Å; D256-Y269 PolarHBondContact OD2-OH 3.43Å; M265-Y269 HydrophobicContact CB-CD1 4.06Å; M265-Y269 HydrophobicContact CG-CD1 4.44Å; M265-Y269 HydrophobicContact SD-CD1 3.5Å; M265-Y269 VanDerWaalsContact SD-CD1 3.5Å; M265-Y269 HydrophobicContact SD-CE1 3.28Å; M265-Y269 WeakPolarHBondContact SD-CE1 3.08Å; P266-Y269 WeakPolarHBondContact O-CB 3.45Å; P266-Y269 PolarHBondContact O-N 3.28Å; P266-Y269 VanDerWaalsContact O-N 3.09Å; T267-Y269 VanDerWaalsContact C-N 3.32Å; T267-Y269 PolarHBondContact O-N 2.95Å; Y269-I271 VanDerWaalsContact C-N 3.26Å; Y269-I271 PolarHBondContact O-N 3.2Å; Y269-G272 WeakPolarHBondContact O-CA 3.48Å; Y269-G272 PolarHBondContact O-N 3.4Å; Y269-C273 VanDerWaalsContact CE1-SG 3.59Å; Y269-C273 VanDerWaalsContact CE2-SG 3.56Å; Y269-C273 PolarHBondContact O-N 3.49Å
270R66.8Low70.4Confident90 Ų9064.2 Ų64.234%0.3432%0.319SS..Hα-helixtrans-56.8-42.7175.6-59.1-167.9168.5162.1-7.2111.9A260 M265 P266 T267 G272 F274A260-R270 HydrophobicContact CB-CG 4.03Å; A260-R270 PolarHBondContact O-NE 2.54Å; A260-R270 PolarHBondContact O-NH2 3.02Å; M265-R270 HydrophobicContact CB-CG 4.38Å; M265-R270 PolarHBondContact O-NE 3.21Å; P266-R270 PolarHBondContact O-N 2.97Å; T267-R270 WeakPolarHBondContact O-CB 3.13Å; T267-R270 PolarHBondContact O-N 2.94Å; R270-G272 VanDerWaalsContact C-N 3.32Å; R270-F274 WeakPolarHBondContact O-CB 3.37Å; R270-F274 PolarHBondContact O-N 2.77Å
271I70Confident71.5Confident109 Ų10969.4 Ų69.456%0.55934%0.341SS*.Hα-helixtrans-64.2-40.5176.2-67164.3000110.3T267 L268 Y269 R275T267-I271 VanDerWaalsContact O-CG1 3.27Å; T267-I271 WeakPolarHBondContact O-CG1 3.21Å; T267-I271 PolarHBondContact O-N 3.38Å; L268-I271 PolarHBondContact O-N 3.43Å; Y269-I271 VanDerWaalsContact C-N 3.26Å; Y269-I271 PolarHBondContact O-N 3.2Å; I271-R275 WeakPolarHBondContact O-CB 2.83Å; I271-R275 PolarHBondContact O-N 3.01Å
272G69.6Low72.6Confident16 Ų1663.8 Ų63.817%0.16532%0.318CS..Hα-helixtrans-64.3-44.6178.500000114.2L268 Y269 R270 R275 D276L268-G272 PolarHBondContact O-N 2.84Å; Y269-G272 WeakPolarHBondContact O-CA 3.48Å; Y269-G272 PolarHBondContact O-N 3.4Å; R270-G272 VanDerWaalsContact C-N 3.32Å; G272-R275 WeakPolarHBondContact O-CB 3.33Å; G272-D276 PolarHBondContact O-N 3.31Å
273C71.7Confident73.7Confident11 Ų1160.6 Ų60.67%0.07430%0.297CS..Hα-helixtrans-71.2-48.4177.8-66.70000111.4D257 Y269 R275 D276 D277D257-C273 WeakPolarHBondContact OD1-CB 3.38Å; Y269-C273 VanDerWaalsContact CE1-SG 3.59Å; Y269-C273 VanDerWaalsContact CE2-SG 3.56Å; Y269-C273 PolarHBondContact O-N 3.49Å; C273-R275 PolarHBondContact O-N 3.41Å; C273-R275 VanDerWaalsContact O-N 3.14Å; C273-D276 PolarHBondContact O-N 3.36Å; C273-D277 PolarHBondContact O-N 3.39Å; C273-D277 VanDerWaalsContact O-N 3.13Å
274F74.8Confident74.9Confident132 Ų13261.6 Ų61.658%0.57930%0.303SS*.Hα-helixtrans-54.8-37.9175.6-178.9-106.8000112.7D257 R270 D277 V278D257-F274 PolarHBondContact OD1-N 2.86Å; D257-F274 VanDerWaalsContact OD2-CA 3.25Å; D257-F274 WeakPolarHBondContact OD2-CA 3.26Å; D257-F274 PolarHBondContact OD2-N 2.93Å; R270-F274 WeakPolarHBondContact O-CB 3.37Å; R270-F274 PolarHBondContact O-N 2.77Å; F274-D277 PolarHBondContact O-N 3.32Å; F274-V278 HydrophobicContact CD1-CG2 4.17Å; F274-V278 HydrophobicContact CE1-CG2 3.77Å; F274-V278 HydrophobicContact CE2-CG2 4.31Å; F274-V278 HydrophobicContact CZ-CG2 3.85Å; F274-V278 VanDerWaalsContact O-CG2 3.27Å; F274-V278 WeakPolarHBondContact O-CG2 3.4Å; F274-V278 PolarHBondContact O-N 3.02Å
275R80.8Confident76.5Confident51 Ų5159 Ų5919%0.19229%0.289CS..Hα-helixtrans-60.4-46.9175.5173.4-152.197.4179.1-2.7112.5F222 I271 G272 C273 D277 V278 I279F222-R275 HydrophobicContact CB-CG 3.51Å; F222-R275 HydrophobicContact CD1-CG 4.43Å; F222-R275 HydrophobicContact CG-CG 4.31Å; I271-R275 WeakPolarHBondContact O-CB 2.83Å; I271-R275 PolarHBondContact O-N 3.01Å; G272-R275 WeakPolarHBondContact O-CB 3.33Å; C273-R275 PolarHBondContact O-N 3.41Å; C273-R275 VanDerWaalsContact O-N 3.14Å; R275-D277 VanDerWaalsContact C-N 3.32Å; R275-V278 PolarHBondContact O-N 2.92Å; R275-I279 WeakPolarHBondContact O-CG1 3.36Å; R275-I279 PolarHBondContact O-N 2.89Å
276D81.5Confident78Confident38 Ų3858.9 Ų58.920%0.20329%0.288CS..Hα-helixtrans-67.8-36.3-178.9-75.1-6.7000111.3T253 G272 C273 I279 F280T253-D276 HydrophobicContact CG2-CB 4.19Å; G272-D276 PolarHBondContact O-N 3.31Å; C273-D276 PolarHBondContact O-N 3.36Å; D276-I279 PolarHBondContact O-N 2.95Å; D276-F280 PolarHBondContact O-N 2.64Å
277D84.6Confident79.4Confident8 Ų863.5 Ų63.54%0.04330%0.302CS..Hα-helixtrans-63.4-45.3173.1-83.420.4000111.8F250 T253 F254 C273 F274 R275 I279 F280 F281F250-D277 HydrophobicContact CE2-CB 4.16Å; T253-D277 VanDerWaalsContact CB-OD1 3.28Å; T253-D277 WeakPolarHBondContact CB-OD1 3.13Å; T253-D277 PolarHBondContact OG1-OD1 3.13Å; F254-D277 WeakPolarHBondContact CA-OD2 3.48Å; C273-D277 PolarHBondContact O-N 3.39Å; C273-D277 VanDerWaalsContact O-N 3.13Å; F274-D277 PolarHBondContact O-N 3.32Å; R275-D277 VanDerWaalsContact C-N 3.32Å; D277-I279 VanDerWaalsContact C-N 3.31Å; D277-I279 PolarHBondContact O-N 3.09Å; D277-F280 WeakPolarHBondContact O-CB 3.44Å; D277-F280 PolarHBondContact O-N 2.83Å; D277-F280 VanDerWaalsContact O-N 3.1Å; D277-F281 WeakPolarHBondContact O-CD2 3.18Å; D277-F281 PolarHBondContact O-N 3.13Å
278V86.4Confident80.4Confident58 Ų5867 Ų6735%0.35230%0.304SS..Hα-helixtrans-56.9-45.6173.9168.20000111.1F274 R275 F280 F281 I282F274-V278 HydrophobicContact CD1-CG2 4.17Å; F274-V278 HydrophobicContact CE1-CG2 3.77Å; F274-V278 HydrophobicContact CE2-CG2 4.31Å; F274-V278 HydrophobicContact CZ-CG2 3.85Å; F274-V278 VanDerWaalsContact O-CG2 3.27Å; F274-V278 WeakPolarHBondContact O-CG2 3.4Å; F274-V278 PolarHBondContact O-N 3.02Å; R275-V278 PolarHBondContact O-N 2.92Å; V278-F280 VanDerWaalsContact C-N 3.3Å; V278-F280 PolarHBondContact O-N 2.99Å; V278-F281 PolarHBondContact O-N 3.1Å; V278-I282 HydrophobicContact CG1-CD1 4.29Å; V278-I282 WeakPolarHBondContact O-CG1 3.15Å; V278-I282 PolarHBondContact O-N 3.1Å
279I86.4Confident81.4Confident17 Ų1764.3 Ų64.39%0.08730%0.296CS..Hα-helixtrans-61-41177.1-68.2-58.1000111.2M225 L229 R275 D276 D277 I282 Y283M225-I279 HydrophobicContact CB-CG2 4.26Å; L229-I279 HydrophobicContact CD1-CD1 3.88Å; L229-I279 HydrophobicContact CD1-CG2 3.9Å; R275-I279 WeakPolarHBondContact O-CG1 3.36Å; R275-I279 PolarHBondContact O-N 2.89Å; D276-I279 PolarHBondContact O-N 2.95Å; D277-I279 VanDerWaalsContact C-N 3.31Å; D277-I279 PolarHBondContact O-N 3.09Å; I279-I282 HydrophobicContact CD1-CD1 4.25Å; I279-I282 PolarHBondContact O-N 3.18Å; I279-Y283 HydrophobicContact CG2-CD2 3.84Å; I279-Y283 HydrophobicContact CG2-CE2 3.5Å; I279-Y283 VanDerWaalsContact CG2-CE2 3.5Å; I279-Y283 VanDerWaalsContact O-CD2 3.26Å; I279-Y283 WeakPolarHBondContact O-CD2 3.37Å; I279-Y283 PolarHBondContact O-N 2.99Å
280F86.4Confident82.4Confident22 Ų2264 Ų6410%0.09630%0.295CS..Hα-helixtrans-63.3-41175.4-175.5-96.9000112.8L246 F250 D276 D277 V278 I282 Y283 L284L246-F280 HydrophobicContact CB-CE2 4.3Å; F250-F280 HydrophobicContact CB-CB 4.18Å; F250-F280 HydrophobicContact CB-CD1 3.78Å; F250-F280 HydrophobicContact CB-CD2 3.43Å; F250-F280 VanDerWaalsContact CB-CD2 3.43Å; F250-F280 HydrophobicContact CB-CE1 3.92Å; F250-F280 HydrophobicContact CB-CE2 3.58Å; F250-F280 HydrophobicContact CB-CG 3.51Å; F250-F280 HydrophobicContact CB-CZ 3.82Å; F250-F280 AromaticContact CD1-CD1 3.55Å; F250-F280 HydrophobicContact CD1-CD1 3.55Å; F250-F280 AromaticContact CD1-CE1 3.31Å; F250-F280 HydrophobicContact CD1-CE1 3.31Å; F250-F280 HydrophobicContact CD1-CE2 4.45Å; F250-F280 HydrophobicContact CD1-CG 4.21Å; F250-F280 AromaticContact CD1-CZ 3.81Å; F250-F280 HydrophobicContact CD1-CZ 3.81Å; F250-F280 HydrophobicContact CD2-CB 3.49Å; F250-F280 VanDerWaalsContact CD2-CB 3.49Å; F250-F280 AromaticContact CD2-CD1 3.21Å; F250-F280 HydrophobicContact CD2-CD1 3.21Å; F250-F280 HydrophobicContact CD2-CD2 4.22Å; F250-F280 AromaticContact CD2-CE1 3.92Å; F250-F280 HydrophobicContact CD2-CE1 3.92Å; F250-F280 AromaticContact CD2-CG 3.36Å; F250-F280 HydrophobicContact CD2-CG 3.36Å; F250-F280 AromaticContact CE1-CD1 3.88Å; F250-F280 HydrophobicContact CE1-CD1 3.88Å; F250-F280 AromaticContact CE1-CE1 3.72Å; F250-F280 HydrophobicContact CE1-CE1 3.72Å; F250-F280 HydrophobicContact CE2-CB 4.16Å; F250-F280 AromaticContact CE2-CD1 3.55Å; F250-F280 HydrophobicContact CE2-CD1 3.55Å; F250-F280 HydrophobicContact CE2-CE1 4.26Å; F250-F280 HydrophobicContact CE2-CG 4.1Å; F250-F280 HydrophobicContact CG-CB 4.04Å; F250-F280 AromaticContact CG-CD1 3.18Å; F250-F280 HydrophobicContact CG-CD1 3.18Å; F250-F280 AromaticContact CG-CD2 3.86Å; F250-F280 HydrophobicContact CG-CD2 3.86Å; F250-F280 AromaticContact CG-CE1 3.41Å; F250-F280 HydrophobicContact CG-CE1 3.41Å; F250-F280 VanDerWaalsContact CG-CE1 3.41Å; F250-F280 HydrophobicContact CG-CE2 4.05Å; F250-F280 AromaticContact CG-CG 3.4Å; F250-F280 HydrophobicContact CG-CG 3.4Å; F250-F280 VanDerWaalsContact CG-CG 3.4Å; F250-F280 AromaticContact CG-CZ 3.84Å; F250-F280 HydrophobicContact CG-CZ 3.84Å; F250-F280 AromaticContact CZ-CD1 3.87Å; F250-F280 HydrophobicContact CZ-CD1 3.87Å; F250-F280 HydrophobicContact CZ-CE1 4.17Å; D276-F280 PolarHBondContact O-N 2.64Å; D277-F280 WeakPolarHBondContact O-CB 3.44Å; D277-F280 PolarHBondContact O-N 2.83Å; D277-F280 VanDerWaalsContact O-N 3.1Å; V278-F280 VanDerWaalsContact C-N 3.3Å; V278-F280 PolarHBondContact O-N 2.99Å; F280-I282 VanDerWaalsContact C-N 3.27Å; F280-I282 PolarHBondContact O-N 3.13Å; F280-Y283 CarbonylContact O-C 3.59Å; F280-Y283 WeakPolarHBondContact O-CA 3.14Å; F280-Y283 WeakPolarHBondContact O-CB 3.03Å; F280-Y283 PolarHBondContact O-N 3.41Å; F280-Y283 VanDerWaalsContact O-N 3.08Å; F280-L284 PolarHBondContact O-N 3.16Å
281F90.1Very high82.1Confident113 Ų11369.3 Ų69.350%0.49631%0.314SS..Hα-helixtrans-61.2-36.5173.5-78.6-68.5000112.2F250 D277 V278 L284 Y285F250-F281 HydrophobicContact CE2-CE2 4.29Å; F250-F281 HydrophobicContact CZ-CE2 4.39Å; F250-F281 HydrophobicContact CZ-CZ 4.24Å; D277-F281 WeakPolarHBondContact O-CD2 3.18Å; D277-F281 PolarHBondContact O-N 3.13Å; V278-F281 PolarHBondContact O-N 3.1Å; F281-L284 PolarHBondContact O-N 2.64Å; F281-Y285 WeakPolarHBondContact O-CB 3.47Å; F281-Y285 PolarHBondContact O-N 2.77Å
282I89.9Confident81.4Confident69 Ų6968.5 Ų68.535%0.35431%0.314SS..Hα-helixtrans-65.2-42.1173-59.1165.9000110.3L229 V278 I279 F280 L284 Y285 Q286L229-I282 HydrophobicContact CD2-CB 3.76Å; L229-I282 HydrophobicContact CD2-CG2 3.39Å; V278-I282 HydrophobicContact CG1-CD1 4.29Å; V278-I282 WeakPolarHBondContact O-CG1 3.15Å; V278-I282 PolarHBondContact O-N 3.1Å; I279-I282 HydrophobicContact CD1-CD1 4.25Å; I279-I282 PolarHBondContact O-N 3.18Å; F280-I282 VanDerWaalsContact C-N 3.27Å; F280-I282 PolarHBondContact O-N 3.13Å; I282-L284 VanDerWaalsContact C-N 3.32Å; I282-L284 PolarHBondContact O-N 3.3Å; I282-Y285 PolarHBondContact O-N 3.05Å; I282-Q286 HydrophobicContact CG2-CG 4.43Å; I282-Q286 WeakPolarHBondContact O-CB 3.32Å; I282-Q286 WeakPolarHBondContact O-CG 3.48Å; I282-Q286 PolarHBondContact O-N 2.85Å
283Y88.6Confident80.3Confident15 Ų1573 Ų736%0.05934%0.335CS..Hα-helixtrans-59.5-42.6173-78.4-63.9000112Q228 L229 N232 L241 W243 I279 F280 Q286 R287Q228-Y283 WeakPolarHBondContact CB-OH 3.3Å; Q228-Y283 HydrophobicContact CG-CE1 4.37Å; Q228-Y283 WeakPolarHBondContact CG-OH 3.25Å; L229-Y283 HydrophobicContact CD1-CE2 4.48Å; L229-Y283 HydrophobicContact CD2-CD1 4.11Å; L229-Y283 HydrophobicContact CD2-CD2 4.27Å; L229-Y283 HydrophobicContact CD2-CE1 4.03Å; L229-Y283 HydrophobicContact CD2-CE2 4.2Å; L229-Y283 HydrophobicContact CD2-CG 4.22Å; L229-Y283 HydrophobicContact CG-CE1 3.94Å; L229-Y283 HydrophobicContact CG-CE2 4.2Å; N232-Y283 VanDerWaalsContact ND2-CE1 3.27Å; N232-Y283 WeakPolarHBondContact ND2-CE1 3.27Å; L241-Y283 HydrophobicContact CD1-CD1 3.91Å; L241-Y283 HydrophobicContact CD1-CE1 3.8Å; W243-Y283 WeakPolarHBondContact CH2-O 3.37Å; I279-Y283 HydrophobicContact CG2-CD2 3.84Å; I279-Y283 HydrophobicContact CG2-CE2 3.5Å; I279-Y283 VanDerWaalsContact CG2-CE2 3.5Å; I279-Y283 VanDerWaalsContact O-CD2 3.26Å; I279-Y283 WeakPolarHBondContact O-CD2 3.37Å; I279-Y283 PolarHBondContact O-N 2.99Å; F280-Y283 CarbonylContact O-C 3.59Å; F280-Y283 WeakPolarHBondContact O-CA 3.14Å; F280-Y283 WeakPolarHBondContact O-CB 3.03Å; F280-Y283 PolarHBondContact O-N 3.41Å; F280-Y283 VanDerWaalsContact O-N 3.08Å; Y283-Q286 WeakPolarHBondContact O-CB 3.47Å; Y283-Q286 PolarHBondContact O-N 2.96Å; Y283-R287 PolarHBondContact O-N 3.38Å
284L89.5Confident79.1Confident77 Ų7776.9 Ų76.940%0.40336%0.36SS..Hα-helixtrans-63.5-42.3177.3-17362.8000111.6F280 F281 I282 R287 W288F280-L284 PolarHBondContact O-N 3.16Å; F281-L284 PolarHBondContact O-N 2.64Å; I282-L284 VanDerWaalsContact C-N 3.32Å; I282-L284 PolarHBondContact O-N 3.3Å; L284-R287 WeakPolarHBondContact O-CB 3.44Å; L284-R287 PolarHBondContact O-N 3.24Å; L284-W288 PolarHBondContact O-N 3.45Å
285Y90.3Very high77.3Confident142 Ų14276.2 Ų76.256%0.55737%0.37SS*.Hα-helixtrans-60.6-45.9173174.5-100.8000111.5F281 I282 R287 W288 A289F281-Y285 WeakPolarHBondContact O-CB 3.47Å; F281-Y285 PolarHBondContact O-N 2.77Å; I282-Y285 PolarHBondContact O-N 3.05Å; Y285-R287 VanDerWaalsContact C-N 3.29Å; Y285-R287 PolarHBondContact O-N 3.47Å; Y285-W288 HydrophobicContact CD2-CE3 4.19Å; Y285-W288 HydrophobicContact CE2-CE3 4.1Å; Y285-W288 HydrophobicContact CE2-CZ3 4.04Å; Y285-W288 PolarHBondContact O-N 3.5Å; Y285-A289 HydrophobicContact CE1-CB 4.44Å; Y285-A289 WeakPolarHBondContact O-CB 3.3Å; Y285-A289 PolarHBondContact O-N 2.96Å
286Q88.2Confident75.6Confident10 Ų1081 Ų815%0.04739%0.388CS..Hα-helixtrans-59.5-40.3175.4-73.7-174.3-19.100111.6L229 N232 V238 I282 Y283 Y290L229-Q286 PolarHBondContact O-NE2 2.82Å; N232-Q286 PolarHBondContact ND2-OE1 3.44Å; V238-Q286 HydrophobicContact CG1-CB 4Å; I282-Q286 HydrophobicContact CG2-CG 4.43Å; I282-Q286 WeakPolarHBondContact O-CB 3.32Å; I282-Q286 WeakPolarHBondContact O-CG 3.48Å; I282-Q286 PolarHBondContact O-N 2.85Å; Y283-Q286 WeakPolarHBondContact O-CB 3.47Å; Y283-Q286 PolarHBondContact O-N 2.96Å; Q286-Y290 HydrophobicContact CB-CD2 3.89Å; Q286-Y290 HydrophobicContact CB-CE2 3.72Å; Q286-Y290 HydrophobicContact CG-CD2 4.43Å; Q286-Y290 HydrophobicContact CG-CE2 3.75Å; Q286-Y290 WeakPolarHBondContact O-CA 3.26Å; Q286-Y290 WeakPolarHBondContact O-CB 3.15Å; Q286-Y290 WeakPolarHBondContact O-CD2 3.16Å; Q286-Y290 PolarHBondContact O-N 3.34Å
287R85.5Confident73.5Confident127 Ų12783.4 Ų83.448%0.47940%0.404SS..Hα-helixtrans-65.4-38.6176.1-173.7-178173.8-167-4.1113.2V238 W243 Y283 L284 Y285V238-R287 HydrophobicContact CG2-CB 3.97Å; V238-R287 HydrophobicContact CG2-CG 4.1Å; W243-R287 HydrophobicContact CH2-CB 3.59Å; W243-R287 HydrophobicContact CH2-CG 4.08Å; W243-R287 HydrophobicContact CZ2-CB 3.61Å; W243-R287 HydrophobicContact CZ2-CG 3.82Å; W243-R287 HydrophobicContact CZ3-CB 4.49Å; Y283-R287 PolarHBondContact O-N 3.38Å; L284-R287 WeakPolarHBondContact O-CB 3.44Å; L284-R287 PolarHBondContact O-N 3.24Å; Y285-R287 VanDerWaalsContact C-N 3.29Å; Y285-R287 PolarHBondContact O-N 3.47Å
288W85.4Confident71.5Confident174 Ų17487.7 Ų87.766%0.65943%0.427SS*.Hα-helixtrans-71.1-44.5177.7174.878.2000111.8L284 Y285L284-W288 PolarHBondContact O-N 3.45Å; Y285-W288 HydrophobicContact CD2-CE3 4.19Å; Y285-W288 HydrophobicContact CE2-CE3 4.1Å; Y285-W288 HydrophobicContact CE2-CZ3 4.04Å; Y285-W288 PolarHBondContact O-N 3.5Å
289A84Confident70Confident43 Ų4389.7 Ų89.736%0.35543%0.433SS..Hα-helixtrans-70.4-38.3-18000000112.3Y285 R291Y285-A289 HydrophobicContact CE1-CB 4.44Å; Y285-A289 WeakPolarHBondContact O-CB 3.3Å; Y285-A289 PolarHBondContact O-N 2.96Å; A289-R291 PolarHBondContact O-N 3.46Å
290Y80.8Confident67.9Low23 Ų2395.7 Ų95.79%0.0946%0.459CS..SBendtrans-98.373.2178.2-47.2-32.9000108.7N232 Y233 K236 V238 Q286 V292N232-Y290 WeakPolarHBondContact O-CE2 3.34Å; Y233-Y290 WeakPolarHBondContact CD2-OH 3.48Å; K236-Y290 HydrophobicContact CB-CD1 4.23Å; K236-Y290 HydrophobicContact CD-CD1 3.75Å; K236-Y290 HydrophobicContact CD-CE1 3.26Å; K236-Y290 HydrophobicContact CG-CE1 4.5Å; K236-Y290 PolarHBondContact NZ-OH 2.93Å; V238-Y290 HydrophobicContact CG1-CD2 4.3Å; Q286-Y290 HydrophobicContact CB-CD2 3.89Å; Q286-Y290 HydrophobicContact CB-CE2 3.72Å; Q286-Y290 HydrophobicContact CG-CD2 4.43Å; Q286-Y290 HydrophobicContact CG-CE2 3.75Å; Q286-Y290 WeakPolarHBondContact O-CA 3.26Å; Q286-Y290 WeakPolarHBondContact O-CB 3.15Å; Q286-Y290 WeakPolarHBondContact O-CD2 3.16Å; Q286-Y290 PolarHBondContact O-N 3.34Å; Y290-V292 PolarHBondContact O-N 2.92Å
291R60.2Low65.7Low200 Ų200103.2 Ų103.276%0.75549%0.494SS*.  trans-55.6125.9172.5-70.5-173.6174.5-175.3-2.2108A289 D293A289-R291 PolarHBondContact O-N 3.46Å; R291-D293 PolarHBondContact O-N 3.33Å
292V55.7Low63.2Low92 Ų92104 Ų10456%0.55850%0.503SS*.  trans-64.6100.4174.9179.70000106.2A239 Y290 P294A239-V292 HydrophobicContact CB-CG1 4.48Å; A239-V292 HydrophobicContact CB-CG2 4.43Å; Y290-V292 PolarHBondContact O-N 2.92Å; V292-P294 WeakPolarHBondContact O-CD 3.36Å
293D45.2Very low60.6Low112 Ų112105.5 Ų105.560%0.59952%0.517SS*.  trans-56.5112.7174-83-37.2000108.2R291 C295 R296R291-D293 PolarHBondContact O-N 3.33Å; D293-C295 PolarHBondContact O-N 3.44Å; D293-C295 VanDerWaalsContact O-N 3.12Å; D293-R296 HydrophobicContact CB-CB 4.36Å; D293-R296 WeakPolarHBondContact O-CB 3.14Å; D293-R296 PolarHBondContact O-N 2.81Å
294P47.2Very low58.4Low91 Ų91107.1 Ų107.159%0.59153%0.53SS*.THydrogen-bonded Turntrans-61.7-22.1178.9-18.731.4000112.1V292 R296 S304V292-P294 WeakPolarHBondContact O-CD 3.36Å; P294-R296 VanDerWaalsContact C-N 3.33Å; P294-S304 PolarHBondContact O-OG 2.77Å
295C37.4Very low55.9Low118 Ų118112 Ų11280%0.79755%0.551SS**THydrogen-bonded Turntrans-79.9-6.1177.4-63.20000114.1D293 T297D293-C295 PolarHBondContact O-N 3.44Å; D293-C295 VanDerWaalsContact O-N 3.12Å; C295-T297 PolarHBondContact O-N 3.01Å; C295-T297 VanDerWaalsContact O-N 3.1Å
296R45.4Very low53.6Low153 Ų153109.7 Ų109.758%0.57755%0.553SS**SBendtrans-75.2105.2176-158.7178.6-154163.34.6107.7D293 P294 N298D293-R296 HydrophobicContact CB-CB 4.36Å; D293-R296 WeakPolarHBondContact O-CB 3.14Å; D293-R296 PolarHBondContact O-N 2.81Å; P294-R296 VanDerWaalsContact C-N 3.33Å; R296-N298 PolarHBondContact O-N 3.4Å; R296-N298 VanDerWaalsContact O-N 3.13Å
297T35.3Very low51.4Low88 Ų88115.4 Ų115.454%0.5458%0.584SS.*  trans-48.6119.8177-5.20000108.8C295C295-T297 PolarHBondContact O-N 3.01Å; C295-T297 VanDerWaalsContact O-N 3.1Å
298N44.4Very low49.4Very low98 Ų98120.3 Ų120.352%0.52460%0.603SS.*  trans-67.8171.3171.6-65.4-45.5000109R296 F300 S304R296-N298 PolarHBondContact O-N 3.4Å; R296-N298 VanDerWaalsContact O-N 3.13Å; N298-F300 CarbonylContact O-C 3.59Å; N298-F300 PolarHBondContact O-N 3.33Å; N298-S304 PolarHBondContact ND2-OG 3.09Å
299E53.8Low47.4Very low100 Ų100114.4 Ų114.447%0.46760%0.596SS.*SBendtrans-54.1-10.8-178.5-37.6-179.1-155.600114.2R87 S89R87-E299 IonicContact CZ-OE1 2.83Å; R87-E299 IonicContact NH2-OE1 3.89Å; R87-E299 PolarHBondContact NH2-OE1 3.22Å; S89-E299 VanDerWaalsContact CB-CD 3.42Å; S89-E299 WeakPolarHBondContact CB-OE1 3.25Å; S89-E299 WeakPolarHBondContact CB-OE2 3.34Å
300F42.1Very low45.5Very low143 Ų143115.3 Ų115.363%0.62760%0.603SS**SBendtrans-112.5117.3164.1-58.4-83.6000106.3N298 L302N298-F300 CarbonylContact O-C 3.59Å; N298-F300 PolarHBondContact O-N 3.33Å; F300-L302 PolarHBondContact O-N 3.28Å
301E41.1Very low43.9Very low179 Ų179116.9 Ų116.984%0.83662%0.615SS**SBendtrans-59.957.1-175.8-62.2176.614900114.3
302L38Very low43.4Very low130 Ų130110 Ų11068%0.68160%0.602SS**SBendtrans-129.8121.4174.8-71170.4000106.9F300 S304F300-L302 PolarHBondContact O-N 3.28Å; L302-S304 PolarHBondContact O-N 3.01Å
303P35.1Very low43Very low101 Ų101108.3 Ų108.366%0.65660%0.597SS**  trans-52.5126170.5-21.931.4000108.8E305P303-E305 PolarHBondContact O-N 3.46Å
304S41.6Very low43.2Very low48 Ų48106.3 Ų106.334%0.33659%0.591SS.*  trans-49.6113.9170.3-31.70000107.1P294 N298 L302 P306P294-S304 PolarHBondContact O-OG 2.77Å; N298-S304 PolarHBondContact ND2-OG 3.09Å; L302-S304 PolarHBondContact O-N 3.01Å; S304-P306 VanDerWaalsContact O-N 3.14Å
305E36.7Very low43.4Very low181 Ų181107.8 Ų107.885%0.84659%0.59SS**  trans-47.8128.1-179.5-79.1-173.414600108.7P303 N307P303-E305 PolarHBondContact O-N 3.46Å; E305-N307 PolarHBondContact O-N 3.08Å
306P41.5Very low43.9Very low92 Ų92104.6 Ų104.660%0.59757%0.573SS**  trans-56.9118.4-17620.3-30.1000107.8S304 R308 V311S304-P306 VanDerWaalsContact O-N 3.14Å; P306-R308 PolarHBondContact O-N 2.89Å; P306-V311 HydrophobicContact CB-CG2 3.89Å
307N42.7Very low44.1Very low130 Ų130101.5 Ų101.570%0.69557%0.571SS**  trans-48.8106.8175.4-175.26.8000107.5E305 G309 A310E305-N307 PolarHBondContact O-N 3.08Å; N307-G309 PolarHBondContact O-N 2.9Å; N307-A310 PolarHBondContact O-N 3.07Å
308R44.1Very low44.8Very low230 Ų230100.4 Ų100.487%0.86857%0.567SS**Hα-helixtrans-53.9-18.5-171.1-81.4-179175.3178.8-1.4113.4P306 A312P306-R308 PolarHBondContact O-N 2.89Å; R308-A312 WeakPolarHBondContact O-CB 3.3Å; R308-A312 PolarHBondContact O-N 3.28Å
309G43.3Very low45.1Very low50 Ų5098.3 Ų98.352%0.51556%0.563SS.*Hα-helixtrans-73.7-28.8173.100000115.4N307 A313N307-G309 PolarHBondContact O-N 2.9Å; G309-A313 PolarHBondContact O-N 3Å
310A44.5Very low44.8Very low62 Ų6299.2 Ų99.251%0.51257%0.571SS.*Hα-helixtrans-81.8-36.4-178.400000112.4N307 A313 S314N307-A310 PolarHBondContact O-N 3.07Å; A310-A313 PolarHBondContact O-N 2.84Å; A310-S314 PolarHBondContact O-N 3.43Å; A310-S314 VanDerWaalsContact O-N 3.1Å; A310-S314 PolarHBondContact O-OG 3.23Å
311V47Very low45.1Very low56 Ų5699.2 Ų99.234%0.33957%0.573SS.*Hα-helixtrans-68.4-40.1175.6-176.50000110.6P306 A313 S314 E315P306-V311 HydrophobicContact CB-CG2 3.89Å; V311-A313 VanDerWaalsContact C-N 3.29Å; V311-A313 PolarHBondContact O-N 3.43Å; V311-S314 PolarHBondContact O-N 3.33Å; V311-S314 PolarHBondContact O-OG 3.26Å; V311-E315 HydrophobicContact CG1-CG 4.35Å; V311-E315 WeakPolarHBondContact O-CB 3.41Å; V311-E315 WeakPolarHBondContact O-CG 3.24Å; V311-E315 PolarHBondContact O-N 3.29Å
312A48.6Very low45.4Very low57 Ų5796.8 Ų96.847%0.47156%0.562SS.*Hα-helixtrans-62.6-35.3175.500000112.6R308 A316R308-A312 WeakPolarHBondContact O-CB 3.3Å; R308-A312 PolarHBondContact O-N 3.28Å; A312-A316 VanDerWaalsContact O-CB 3.29Å; A312-A316 WeakPolarHBondContact O-CB 3.02Å; A312-A316 PolarHBondContact O-N 2.98Å
313A48.3Very low45.8Very low55 Ų5597.5 Ų97.546%0.45556%0.559SS.*Hα-helixtrans-71.8-38.9176.600000112.4G309 A310 V311 T317G309-A313 PolarHBondContact O-N 3Å; A310-A313 PolarHBondContact O-N 2.84Å; V311-A313 VanDerWaalsContact C-N 3.29Å; V311-A313 PolarHBondContact O-N 3.43Å; A313-T317 PolarHBondContact O-N 2.84Å; A313-T317 VanDerWaalsContact O-N 3.14Å; A313-T317 PolarHBondContact O-OG1 2.8Å
314S48.7Very low46.4Very low70 Ų7098.6 Ų98.649%0.4956%0.56SS.*Hα-helixtrans-69.1-39.5175.857.20000112.3A310 V311 T317 S318A310-S314 PolarHBondContact O-N 3.43Å; A310-S314 VanDerWaalsContact O-N 3.1Å; A310-S314 PolarHBondContact O-OG 3.23Å; V311-S314 PolarHBondContact O-N 3.33Å; V311-S314 PolarHBondContact O-OG 3.26Å; S314-T317 PolarHBondContact O-N 3.1Å; S314-S318 PolarHBondContact O-N 3.02Å; S314-S318 PolarHBondContact O-OG 2.72Å; S314-S318 VanDerWaalsContact O-OG 3.13Å
315E50.8Low46.6Very low122 Ų122104.7 Ų104.757%0.5758%0.58SS**Hα-helixtrans-68.7-38.2178.1-75.4178.6172.600112V311 S318 A319V311-E315 HydrophobicContact CG1-CG 4.35Å; V311-E315 WeakPolarHBondContact O-CB 3.41Å; V311-E315 WeakPolarHBondContact O-CG 3.24Å; V311-E315 PolarHBondContact O-N 3.29Å; E315-S318 WeakPolarHBondContact CA-OG 3.42Å; E315-S318 PolarHBondContact O-N 2.96Å; E315-S318 PolarHBondContact O-OG 3.23Å; E315-A319 WeakPolarHBondContact O-CB 3.08Å; E315-A319 PolarHBondContact O-N 2.96Å
316A48.1Very low47.1Very low52 Ų52104 Ų10443%0.4357%0.574SS.*Hα-helixtrans-62.9-43174.200000111.7A312 S318 A319 D320A312-A316 VanDerWaalsContact O-CB 3.29Å; A312-A316 WeakPolarHBondContact O-CB 3.02Å; A312-A316 PolarHBondContact O-N 2.98Å; A316-S318 PolarHBondContact O-N 3.25Å; A316-A319 PolarHBondContact O-N 3.33Å; A316-D320 PolarHBondContact O-N 2.9Å
317T50.2Low47.4Very low87 Ų87106.1 Ų106.153%0.53458%0.581SS.*Hα-helixtrans-65.4-40.7179.1-44.40000111.4A313 S314 E321A313-T317 PolarHBondContact O-N 2.84Å; A313-T317 VanDerWaalsContact O-N 3.14Å; A313-T317 PolarHBondContact O-OG1 2.8Å; S314-T317 PolarHBondContact O-N 3.1Å; T317-E321 PolarHBondContact O-N 2.99Å
318S50.7Low47.4Very low65 Ų65106.5 Ų106.546%0.45560%0.602SS.*Hα-helixtrans-69.2-33.8176.152.80000113.4S314 E315 A316 E321 E322S314-S318 PolarHBondContact O-N 3.02Å; S314-S318 PolarHBondContact O-OG 2.72Å; S314-S318 VanDerWaalsContact O-OG 3.13Å; E315-S318 WeakPolarHBondContact CA-OG 3.42Å; E315-S318 PolarHBondContact O-N 2.96Å; E315-S318 PolarHBondContact O-OG 3.23Å; A316-S318 PolarHBondContact O-N 3.25Å; S318-E321 PolarHBondContact O-N 3.25Å; S318-E322 PolarHBondContact O-N 3.27Å
319A49.5Very low47.5Very low54 Ų54100.3 Ų100.345%0.44659%0.589SS.*Hα-helixtrans-70.8-36.6178.700000112E315 A316 E322 K323E315-A319 WeakPolarHBondContact O-CB 3.08Å; E315-A319 PolarHBondContact O-N 2.96Å; A316-A319 PolarHBondContact O-N 3.33Å; A319-E322 PolarHBondContact O-N 2.91Å; A319-K323 WeakPolarHBondContact O-CB 3.23Å; A319-K323 PolarHBondContact O-N 2.79Å; A319-K323 VanDerWaalsContact O-N 3.1Å
320D48.1Very low47.7Very low119 Ų119102.9 Ų102.964%0.63659%0.592SS**Hα-helixtrans-69.2-37.5175-77.3-24000111.9A316 N324A316-D320 PolarHBondContact O-N 2.9Å; D320-N324 PolarHBondContact O-N 3.12Å; D320-N324 VanDerWaalsContact O-N 3.16Å
321E49.2Very low47.9Very low143 Ų143105.2 Ų105.267%0.66860%0.597SS**Hα-helixtrans-67-36.9174.2-78.2-172168.300113T317 S318 K325T317-E321 PolarHBondContact O-N 2.99Å; S318-E321 PolarHBondContact O-N 3.25Å; E321-K325 PolarHBondContact O-N 3.25Å
322E47Very low48Very low129 Ų129108.1 Ų108.160%0.60361%0.612SS**Hα-helixtrans-74.3-31.2179.5-156178.6-17600112.3S318 A319 K325S318-E322 PolarHBondContact O-N 3.27Å; A319-E322 PolarHBondContact O-N 2.91Å; E322-K325 PolarHBondContact O-N 3.19Å
323K46.2Very low47.9Very low144 Ų144111.3 Ų111.363%0.62662%0.621SS**Hα-helixtrans-71.6-40.3176.3-148.9176.5-175.2-175.90111.9A319 K325 K326 D327A319-K323 WeakPolarHBondContact O-CB 3.23Å; A319-K323 PolarHBondContact O-N 2.79Å; A319-K323 VanDerWaalsContact O-N 3.1Å; K323-K325 PolarHBondContact O-N 3.44Å; K323-K326 PolarHBondContact O-N 3.09Å; K323-K326 VanDerWaalsContact O-N 3.11Å; K323-D327 PolarHBondContact O-N 3.09Å
324N47.8Very low47.9Very low124 Ų124115.1 Ų115.166%0.66363%0.632SS**Hα-helixtrans-69.5-15.2178.9-146.413.3000113.4D320D320-N324 PolarHBondContact O-N 3.12Å; D320-N324 VanDerWaalsContact O-N 3.16Å
325K46.5Very low47.9Very low176 Ų176118.3 Ų118.377%0.76564%0.642SS**THydrogen-bonded Turntrans-88.5-11173.5-111.8179.4-177.9173.70114.7E321 E322 K323E321-K325 PolarHBondContact O-N 3.25Å; E322-K325 PolarHBondContact O-N 3.19Å; K323-K325 PolarHBondContact O-N 3.44Å
326K47.2Very low47.6Very low166 Ų166118 Ų11872%0.72265%0.648SS**THydrogen-bonded Turntrans-98.8-18.8176.1-85178.7178.1165.20113.5K323K323-K326 PolarHBondContact O-N 3.09Å; K323-K326 VanDerWaalsContact O-N 3.11Å
327D47.8Very low47.6Very low138 Ų138123.5 Ų123.574%0.73867%0.666SS**  trans-99.17.4178.6-64.3-28000113.4K323K323-D327 PolarHBondContact O-N 3.09Å
328A41Very low47.4Very low137 Ų137126.8 Ų126.8100%1.13268%0.678SS**  trans-115.80168.500000109.6

Retrieved 328 of 328 residues in 457.2 ms (Link to these results)

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