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Cytochrome b

Component of the ubiquinol-cytochrome c reductase complex (complex III or cytochrome b-c1 complex) that is part of the mitochondrial respiratory chain. The b-c1 complex mediates electron transfer from ubiquinol to cytochrome c. Contributes to the generation of a proton gradient across the mitochondrial membrane that is then used for ATP synthesis.

AlphaFold DB , UniProt , Accession A0A059R6D6, Species HUMAN (Homo sapiens, Human), Gene CYTB, Length 380 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
1M79.6Confident92.1Very high243 Ų243106.5 Ų106.5100%1.19756%0.56SS**  0134.90-71.6175.6173.300108.6
2T87.4Confident92.2Very high107 Ų107105.8 Ų105.866%0.65655%0.549SS*.  trans-67.8133.9172.738.30000109.3T7T2-T7 WeakPolarHBondContact OG1-CG2 3.39Å
3P93.1Very high92.3Very high62 Ų62106.8 Ų106.840%0.40356%0.555SS.*  trans-68.4148.8-175.828.8-35.3000110.8R5 K6P3-R5 HydrophobicContact CB-CG 4.17Å; P3-R5 HydrophobicContact CG-CG 4.1Å; P3-R5 PolarHBondContact O-N 2.97Å; P3-R5 VanDerWaalsContact O-N 3.08Å; P3-K6 HydrophobicContact CG-CB 4.41Å; P3-K6 HydrophobicContact CG-CD 4.07Å; P3-K6 HydrophobicContact CG-CG 4.05Å; P3-K6 PolarHBondContact O-N 3.5Å
4M94.1Very high92.3Very high119 Ų119106.1 Ų106.159%0.58655%0.551SS**Hα-helixtrans-54-33.2-179-172.7179.1165.400112.9K6 T7 N8 M11M4-K6 PolarHBondContact O-N 3.12Å; M4-K6 VanDerWaalsContact O-N 3.09Å; M4-T7 WeakPolarHBondContact CA-OG1 3.44Å; M4-T7 PolarHBondContact O-N 3.26Å; M4-T7 VanDerWaalsContact O-N 3.1Å; M4-T7 PolarHBondContact O-OG1 2.89Å; M4-N8 HydrophobicContact CE-CB 4.23Å; M4-N8 HydrophobicContact CG-CB 3.98Å; M4-N8 WeakPolarHBondContact O-CB 3.18Å; M4-N8 PolarHBondContact O-N 3.33Å; M4-M11 HydrophobicContact CB-SD 4.47Å; M4-M11 HydrophobicContact CE-SD 3.73Å; M4-M11 HydrophobicContact CG-SD 3.79Å; M4-M11 HydrophobicContact SD-SD 4.04Å
5R94.9Very high92.6Very high91 Ų9199.1 Ų99.134%0.34352%0.515SS..Hα-helixtrans-59-20.617678-176.5-163.6179.810.4114.4P3 M11 K12 N15 D20P3-R5 HydrophobicContact CB-CG 4.17Å; P3-R5 HydrophobicContact CG-CG 4.1Å; P3-R5 PolarHBondContact O-N 2.97Å; P3-R5 VanDerWaalsContact O-N 3.08Å; R5-M11 HydrophobicContact CB-CE 4.34Å; R5-M11 CarbonylContact O-C 3.55Å; R5-K12 WeakPolarHBondContact O-CA 3.35Å; R5-K12 PolarHBondContact O-N 3.41Å; R5-N15 HydrophobicContact CB-CB 4.42Å; R5-N15 WeakPolarHBondContact CD-OD1 3.48Å; R5-N15 WeakPolarHBondContact CG-OD1 3.38Å; R5-N15 PolarHBondContact NE-OD1 3.13Å; R5-N15 VanDerWaalsContact NE-OD1 3.17Å; R5-N15 WeakPolarHBondContact O-CB 3.18Å; R5-D20 IonicContact CZ-OD1 3.65Å; R5-D20 IonicContact NE-OD2 3.99Å; R5-D20 IonicContact NH2-OD1 2.83Å; R5-D20 PolarHBondContact NH2-OD1 2.79Å; R5-D20 IonicContact NH2-OD2 3.34Å; R5-D20 PolarHBondContact NH2-OD2 2.68Å
6K93.9Very high92.6Very high98 Ų9899.3 Ų99.343%0.42651%0.512SS..Hα-helixtrans-102-15.6178.5-66.9-171.6176.1-169.30113.3P3 M4 D20P3-K6 HydrophobicContact CG-CB 4.41Å; P3-K6 HydrophobicContact CG-CD 4.07Å; P3-K6 HydrophobicContact CG-CG 4.05Å; P3-K6 PolarHBondContact O-N 3.5Å; M4-K6 PolarHBondContact O-N 3.12Å; M4-K6 VanDerWaalsContact O-N 3.09Å; K6-D20 WeakPolarHBondContact CE-OD2 3.38Å; K6-D20 IonicContact NZ-OD2 3.34Å; K6-D20 PolarHBondContact NZ-OD2 2.77Å
7T94.4Very high92.6Very high80 Ų8094.6 Ų94.649%0.49149%0.49SS..Hα-helixtrans-110.8-37.9-172.8560000113.1T2 M4T2-T7 WeakPolarHBondContact OG1-CG2 3.39Å; M4-T7 WeakPolarHBondContact CA-OG1 3.44Å; M4-T7 PolarHBondContact O-N 3.26Å; M4-T7 VanDerWaalsContact O-N 3.1Å; M4-T7 PolarHBondContact O-OG1 2.89Å
8N96Very high92.6Very high50 Ų5095.9 Ų95.927%0.26749%0.492SS..SBendtrans-67.1129177.6176.3-80.2000110.1M4 L10 M11 K12M4-N8 HydrophobicContact CE-CB 4.23Å; M4-N8 HydrophobicContact CG-CB 3.98Å; M4-N8 WeakPolarHBondContact O-CB 3.18Å; M4-N8 PolarHBondContact O-N 3.33Å; N8-L10 VanDerWaalsContact C-N 3.31Å; N8-L10 PolarHBondContact O-N 3.28Å; N8-L10 PolarHBondContact OD1-N 2.93Å; N8-M11 HydrophobicContact CB-CB 4.07Å; N8-M11 HydrophobicContact CB-CG 4.07Å; N8-M11 HydrophobicContact CB-SD 4.25Å; N8-M11 PolarHBondContact O-N 3.23Å; N8-M11 PolarHBondContact OD1-N 3.06Å; N8-K12 WeakPolarHBondContact O-CB 3.47Å; N8-K12 PolarHBondContact O-N 3.09Å
9P93.6Very high92.8Very high108 Ų10893.3 Ų93.370%0.70148%0.478SS*.Hα-helixtrans-55.2-39.2-173.9-2935.4000114.9
10L92.1Very high93Very high136 Ų13690.4 Ų90.471%0.71246%0.463SS*.Hα-helixtrans-78-48.1179.3-65.8176.8000111.5N8 K12 L13 I14N8-L10 VanDerWaalsContact C-N 3.31Å; N8-L10 PolarHBondContact O-N 3.28Å; N8-L10 PolarHBondContact OD1-N 2.93Å; L10-K12 PolarHBondContact O-N 2.86Å; L10-L13 WeakPolarHBondContact O-CB 3.37Å; L10-L13 PolarHBondContact O-N 3.42Å; L10-L13 VanDerWaalsContact O-N 3.16Å; L10-I14 PolarHBondContact O-N 3.11Å
11M93.7Very high93.2Very high77 Ų7787.4 Ų87.438%0.37945%0.448SS..Hα-helixtrans-64.8-29.4179.8-59.2-17677.400112M4 R5 N8 L13 I14 N15M4-M11 HydrophobicContact CB-SD 4.47Å; M4-M11 HydrophobicContact CE-SD 3.73Å; M4-M11 HydrophobicContact CG-SD 3.79Å; M4-M11 HydrophobicContact SD-SD 4.04Å; R5-M11 HydrophobicContact CB-CE 4.34Å; R5-M11 CarbonylContact O-C 3.55Å; N8-M11 HydrophobicContact CB-CB 4.07Å; N8-M11 HydrophobicContact CB-CG 4.07Å; N8-M11 HydrophobicContact CB-SD 4.25Å; N8-M11 PolarHBondContact O-N 3.23Å; N8-M11 PolarHBondContact OD1-N 3.06Å; M11-L13 VanDerWaalsContact C-N 3.35Å; M11-I14 PolarHBondContact O-N 3.2Å; M11-N15 VanDerWaalsContact O-CB 3.26Å; M11-N15 WeakPolarHBondContact O-CB 3.36Å; M11-N15 PolarHBondContact O-N 2.95Å
12K93.7Very high94Very high99 Ų9979.2 Ų79.243%0.4341%0.414SS..Hα-helixtrans-61.1-43.2175.2-179.6176.1179.9-172.10111.3R5 N8 L10 N15 H16R5-K12 WeakPolarHBondContact O-CA 3.35Å; R5-K12 PolarHBondContact O-N 3.41Å; N8-K12 WeakPolarHBondContact O-CB 3.47Å; N8-K12 PolarHBondContact O-N 3.09Å; L10-K12 PolarHBondContact O-N 2.86Å; K12-N15 PolarHBondContact O-N 2.72Å; K12-H16 WeakPolarHBondContact CE-NE2 3.34Å; K12-H16 VanDerWaalsContact CG-CD2 3.48Å; K12-H16 WeakPolarHBondContact CG-CD2 3.19Å; K12-H16 PolarHBondContact O-CD2 3.14Å; K12-H16 PolarHBondContact O-N 3.32Å
13L92.8Very high94.5Very high119 Ų11974.3 Ų74.362%0.62338%0.383SS*.Hα-helixtrans-60.9-46.8175.8-17767.7000111.2L10 M11 N15 H16 S17L10-L13 WeakPolarHBondContact O-CB 3.37Å; L10-L13 PolarHBondContact O-N 3.42Å; L10-L13 VanDerWaalsContact O-N 3.16Å; M11-L13 VanDerWaalsContact C-N 3.35Å; L13-N15 VanDerWaalsContact C-N 3.35Å; L13-N15 PolarHBondContact O-N 3.44Å; L13-H16 PolarHBondContact O-N 3.12Å; L13-S17 VanDerWaalsContact O-CB 3.25Å; L13-S17 WeakPolarHBondContact O-CB 3.48Å; L13-S17 PolarHBondContact O-N 3.01Å; L13-S17 PolarHBondContact O-OG 3.42Å
14I93.4Very high94.8Very high97 Ų9771.4 Ų71.450%0.49736%0.364SS..Hα-helixtrans-61.9-44.3176.7-61.9171.8000110.3L10 M11 H16 S17 F18L10-I14 PolarHBondContact O-N 3.11Å; M11-I14 PolarHBondContact O-N 3.2Å; I14-H16 PolarHBondContact O-N 2.9Å; I14-S17 PolarHBondContact O-N 3.37Å; I14-F18 WeakPolarHBondContact O-CB 3.31Å; I14-F18 PolarHBondContact O-N 3.49Å
15N95.7Very high95Very high1 Ų167.7 Ų67.71%0.00535%0.35CS..Iπ-helixtrans-62.4-46.1-178.7-174.881000111.8R5 M11 K12 L13 S17 I19 D20R5-N15 HydrophobicContact CB-CB 4.42Å; R5-N15 WeakPolarHBondContact CD-OD1 3.48Å; R5-N15 WeakPolarHBondContact CG-OD1 3.38Å; R5-N15 PolarHBondContact NE-OD1 3.13Å; R5-N15 VanDerWaalsContact NE-OD1 3.17Å; R5-N15 WeakPolarHBondContact O-CB 3.18Å; M11-N15 VanDerWaalsContact O-CB 3.26Å; M11-N15 WeakPolarHBondContact O-CB 3.36Å; M11-N15 PolarHBondContact O-N 2.95Å; K12-N15 PolarHBondContact O-N 2.72Å; L13-N15 VanDerWaalsContact C-N 3.35Å; L13-N15 PolarHBondContact O-N 3.44Å; N15-S17 VanDerWaalsContact C-N 3.31Å; N15-S17 PolarHBondContact O-N 3.21Å; N15-I19 PolarHBondContact O-N 3.06Å; N15-D20 PolarHBondContact ND2-OD2 3.37Å; N15-D20 PolarHBondContact O-N 2.99Å; N15-D20 PolarHBondContact OD1-OD2 2.61Å
16H93.9Very high95.1Very high102 Ų10266 Ų6647%0.47235%0.348SS..Iπ-helixtrans-70.6-26.1178.4-74.5-66.3000113.5K12 L13 I14 L21K12-H16 WeakPolarHBondContact CE-NE2 3.34Å; K12-H16 VanDerWaalsContact CG-CD2 3.48Å; K12-H16 WeakPolarHBondContact CG-CD2 3.19Å; K12-H16 PolarHBondContact O-CD2 3.14Å; K12-H16 PolarHBondContact O-N 3.32Å; L13-H16 PolarHBondContact O-N 3.12Å; I14-H16 PolarHBondContact O-N 2.9Å; H16-L21 WeakPolarHBondContact O-CB 3.37Å
17S92.3Very high95.4Very high20 Ų2062.2 Ų62.214%0.1433%0.332CS..Iπ-helixtrans-93.1-26.2-176.7-56.60000113.9L13 I14 N15 L21L13-S17 VanDerWaalsContact O-CB 3.25Å; L13-S17 WeakPolarHBondContact O-CB 3.48Å; L13-S17 PolarHBondContact O-N 3.01Å; L13-S17 PolarHBondContact O-OG 3.42Å; I14-S17 PolarHBondContact O-N 3.37Å; N15-S17 VanDerWaalsContact C-N 3.31Å; N15-S17 PolarHBondContact O-N 3.21Å; S17-L21 WeakPolarHBondContact O-CD2 3.38Å
18F91.8Very high95.5Very high118 Ų11860.1 Ų60.152%0.51832%0.321SS..Iπ-helixtrans-134.6-18.7-170.7-72.4-81.1000115.5I14 F220I14-F18 WeakPolarHBondContact O-CB 3.31Å; I14-F18 PolarHBondContact O-N 3.49Å; F18-F220 WeakPolarHBondContact O-CD1 3.03Å
19I96.3Very high95.7Very high45 Ų4561 Ų6123%0.23134%0.335CS..Iπ-helixtrans-109-69.3-174.1-54.7178.3000110.4N15 L21 F220 H221N15-I19 PolarHBondContact O-N 3.06Å; I19-L21 VanDerWaalsContact C-N 3.27Å; I19-L21 PolarHBondContact O-N 3.45Å; I19-F220 PolarHBondContact O-N 2.92Å; I19-H221 HydrophobicContact CG2-CB 4.05Å; I19-H221 PolarHBondContact O-N 3.43Å
20D97.2Very high95.9Very high35 Ų3560.7 Ų60.719%0.18732%0.32CS..SBendtrans-91.314-176.6-66.3-14.5000111.7R5 K6 N15 P22R5-D20 IonicContact CZ-OD1 3.65Å; R5-D20 IonicContact NE-OD2 3.99Å; R5-D20 IonicContact NH2-OD1 2.83Å; R5-D20 PolarHBondContact NH2-OD1 2.79Å; R5-D20 IonicContact NH2-OD2 3.34Å; R5-D20 PolarHBondContact NH2-OD2 2.68Å; K6-D20 WeakPolarHBondContact CE-OD2 3.38Å; K6-D20 IonicContact NZ-OD2 3.34Å; K6-D20 PolarHBondContact NZ-OD2 2.77Å; N15-D20 PolarHBondContact ND2-OD2 3.37Å; N15-D20 PolarHBondContact O-N 2.99Å; N15-D20 PolarHBondContact OD1-OD2 2.61Å; D20-P22 WeakPolarHBondContact O-CD 3.31Å
21L97.2Very high96.2Very high28 Ų2855.3 Ų55.315%0.14729%0.29CS..  trans-61.2117.8178.3175.967.2000110.3H16 S17 I19 T23 F220H16-L21 WeakPolarHBondContact O-CB 3.37Å; S17-L21 WeakPolarHBondContact O-CD2 3.38Å; I19-L21 VanDerWaalsContact C-N 3.27Å; I19-L21 PolarHBondContact O-N 3.45Å; L21-T23 PolarHBondContact O-N 3.48Å; L21-T23 PolarHBondContact O-OG1 3.29Å; L21-F220 HydrophobicContact CB-CB 3.93Å; L21-F220 HydrophobicContact CD2-CD2 4.24Å; L21-F220 PolarHBondContact O-N 3.44Å
22P97.3Very high96.4Very high72 Ų7252.1 Ų52.147%0.46828%0.275SS..EExtended strand (participates in β ladder)trans-72.3113.9178-17.632.9000111D20 K217D20-P22 WeakPolarHBondContact O-CD 3.31Å; P22-K217 HydrophobicContact CB-CB 4.14Å; P22-K217 HydrophobicContact CB-CD 3.63Å
23T98Very high96.7Very high4 Ų449 Ų493%0.02526%0.261CS..EExtended strand (participates in β ladder)trans-119.2139.7-174.5-51.40000109.4L21 S25 I27 K217 I218 Y224L21-T23 PolarHBondContact O-N 3.48Å; L21-T23 PolarHBondContact O-OG1 3.29Å; T23-S25 PolarHBondContact O-N 3.04Å; T23-I27 HydrophobicContact CG2-CD1 3.61Å; T23-I27 HydrophobicContact CG2-CG1 4.26Å; T23-K217 WeakPolarHBondContact O-CA 3.43Å; T23-I218 PolarHBondContact N-O 3.15Å; T23-I218 PolarHBondContact O-N 2.99Å; T23-Y224 HydrophobicContact CG2-CD2 3.48Å; T23-Y224 VanDerWaalsContact CG2-CD2 3.48Å; T23-Y224 HydrophobicContact CG2-CE2 3.28Å; T23-Y224 HydrophobicContact CG2-CG 4.33Å
24P98.3Very high96.9Very high0 Ų044.8 Ų44.80%025%0.247CC..EExtended strand (participates in β ladder)trans-52.5139175.5-18.726.1000110.7N26 I27 S205 N207 S213 Y224P24-N26 PolarHBondContact O-N 3.49Å; P24-I27 HydrophobicContact CB-CG2 4.1Å; P24-I27 HydrophobicContact CG-CG2 4.14Å; P24-S205 VanDerWaalsContact CG-O 3.23Å; P24-S205 WeakPolarHBondContact CG-O 3.46Å; P24-N207 HydrophobicContact CB-CB 3.86Å; P24-N207 HydrophobicContact CG-CB 4.17Å; P24-S213 WeakPolarHBondContact CB-OG 3.39Å; P24-S213 WeakPolarHBondContact CG-OG 3.46Å; P24-Y224 PolarHBondContact O-OH 2.87Å
25S98.1Very high97.2Very high41 Ų4142.3 Ų42.329%0.28724%0.238SC..THydrogen-bonded Turntrans-66.6-20.9-177.2630000114.4T23 D216 Y224T23-S25 PolarHBondContact O-N 3.04Å; S25-D216 VanDerWaalsContact CB-OD2 3.29Å; S25-D216 WeakPolarHBondContact CB-OD2 3.46Å; S25-D216 PolarHBondContact N-O 3.06Å; S25-D216 PolarHBondContact OG-OD2 3.49Å; S25-Y224 VanDerWaalsContact C-OH 3.28Å; S25-Y224 PolarHBondContact O-OH 2.87Å
26N98.3Very high97.3Very high57 Ų5742.9 Ų42.931%0.30524%0.241SC..THydrogen-bonded Turntrans-110.715.4-166.969.9-29.8000114.8P24 S28 N207 P208 L209P24-N26 PolarHBondContact O-N 3.49Å; N26-S28 PolarHBondContact O-N 2.95Å; N26-N207 PolarHBondContact ND2-OD1 3.46Å; N26-N207 WeakPolarHBondContact OD1-CB 3.37Å; N26-P208 VanDerWaalsContact O-CD 3.28Å; N26-P208 WeakPolarHBondContact O-CD 3.42Å; N26-P208 WeakPolarHBondContact O-CG 3.4Å; N26-L209 WeakPolarHBondContact ND2-CD1 3.41Å
27I98.4Very high97.6Very high18 Ų1839.2 Ų39.29%0.09223%0.225CC..  trans-67.3129.5177.254.3162.4000110.9T23 P24 W31 N206 N207 Y224 K227T23-I27 HydrophobicContact CG2-CD1 3.61Å; T23-I27 HydrophobicContact CG2-CG1 4.26Å; P24-I27 HydrophobicContact CB-CG2 4.1Å; P24-I27 HydrophobicContact CG-CG2 4.14Å; I27-W31 HydrophobicContact CB-CB 4.03Å; I27-W31 HydrophobicContact CB-CD2 3.75Å; I27-W31 HydrophobicContact CB-CE3 4.21Å; I27-W31 HydrophobicContact CB-CG 3.64Å; I27-W31 HydrophobicContact CD1-CB 3.79Å; I27-W31 HydrophobicContact CD1-CG 3.92Å; I27-W31 HydrophobicContact CG1-CB 4.37Å; I27-W31 HydrophobicContact CG1-CG 4.34Å; I27-W31 HydrophobicContact CG2-CD2 3.77Å; I27-W31 HydrophobicContact CG2-CE3 4.47Å; I27-W31 HydrophobicContact CG2-CG 3.83Å; I27-W31 HydrophobicContact CG2-CZ2 4.29Å; I27-N206 VanDerWaalsContact CG2-O 3.32Å; I27-N206 WeakPolarHBondContact CG2-O 3.13Å; I27-N207 HydrophobicContact CG2-CB 4.13Å; I27-Y224 HydrophobicContact CD1-CD1 3.78Å; I27-Y224 HydrophobicContact CD1-CD2 4.46Å; I27-Y224 HydrophobicContact CD1-CE1 3.48Å; I27-Y224 VanDerWaalsContact CD1-CE1 3.48Å; I27-Y224 HydrophobicContact CD1-CE2 4.14Å; I27-Y224 HydrophobicContact CD1-CG 4.3Å; I27-Y224 HydrophobicContact CG1-CD1 4.08Å; I27-Y224 HydrophobicContact CG1-CE1 3.25Å; I27-Y224 HydrophobicContact CG1-CE2 4.12Å; I27-Y224 WeakPolarHBondContact CG1-OH 3.43Å; I27-K227 PolarHBondContact O-NZ 3Å
28S98.4Very high97.9Very high36 Ų3639.9 Ų39.925%0.25224%0.235SC..  trans-83.3-177.6-175.564.30000112.5N26 W30 W31 K227N26-S28 PolarHBondContact O-N 2.95Å; S28-W30 PolarHBondContact O-N 3.01Å; S28-W30 VanDerWaalsContact O-N 3.13Å; S28-W31 PolarHBondContact O-N 2.89Å; S28-W31 VanDerWaalsContact O-N 3.12Å; S28-K227 PolarHBondContact O-NZ 2.89Å
29A98.4Very high98.2Very high69 Ų6935.5 Ų35.557%0.5722%0.221SC*.G310 helixtrans-57-24.6177.600000113.3W31 N32A29-W31 PolarHBondContact O-N 2.77Å; A29-W31 VanDerWaalsContact O-N 3.12Å; A29-N32 WeakPolarHBondContact CA-OD1 3.46Å; A29-N32 VanDerWaalsContact O-CB 3.25Å; A29-N32 WeakPolarHBondContact O-CB 3.3Å; A29-N32 PolarHBondContact O-N 3.38Å; A29-N32 PolarHBondContact O-OD1 2.71Å; A29-N32 VanDerWaalsContact O-OD1 3.12Å
30W98.6Very high98.3Very high100 Ų10033.4 Ų33.438%0.37921%0.21SC..G310 helixtrans-61.4-21177.2-59.6115.6000113.7S28 N32 F33 L96 R100 Y104S28-W30 PolarHBondContact O-N 3.01Å; S28-W30 VanDerWaalsContact O-N 3.13Å; W30-N32 VanDerWaalsContact C-N 3.34Å; W30-F33 HydrophobicContact CE3-CD2 4.16Å; W30-F33 AromaticContact CE3-CE2 3.57Å; W30-F33 HydrophobicContact CE3-CE2 3.57Å; W30-F33 AromaticContact CZ3-CE2 3.9Å; W30-F33 HydrophobicContact CZ3-CE2 3.9Å; W30-F33 WeakPolarHBondContact O-CD2 3.38Å; W30-L96 HydrophobicContact CZ3-CD2 4.13Å; W30-R100 HydrophobicContact CB-CB 4.09Å; W30-R100 HydrophobicContact CB-CG 3.53Å; W30-Y104 HydrophobicContact CB-CE2 4.23Å; W30-Y104 AromaticContact CD1-CE2 3.83Å; W30-Y104 HydrophobicContact CG-CE2 4.17Å
31W98.7Very high98.4Very high23 Ų2332.6 Ų32.69%0.08721%0.206CC..G310 helixtrans-77.6-17.9175.3-86.6-113.6000113.8I27 S28 A29 F33 G34 R100 Y104 N206 P208I27-W31 HydrophobicContact CB-CB 4.03Å; I27-W31 HydrophobicContact CB-CD2 3.75Å; I27-W31 HydrophobicContact CB-CE3 4.21Å; I27-W31 HydrophobicContact CB-CG 3.64Å; I27-W31 HydrophobicContact CD1-CB 3.79Å; I27-W31 HydrophobicContact CD1-CG 3.92Å; I27-W31 HydrophobicContact CG1-CB 4.37Å; I27-W31 HydrophobicContact CG1-CG 4.34Å; I27-W31 HydrophobicContact CG2-CD2 3.77Å; I27-W31 HydrophobicContact CG2-CE3 4.47Å; I27-W31 HydrophobicContact CG2-CG 3.83Å; I27-W31 HydrophobicContact CG2-CZ2 4.29Å; S28-W31 PolarHBondContact O-N 2.89Å; S28-W31 VanDerWaalsContact O-N 3.12Å; A29-W31 PolarHBondContact O-N 2.77Å; A29-W31 VanDerWaalsContact O-N 3.12Å; W31-F33 PolarHBondContact O-N 3.47Å; W31-G34 PolarHBondContact O-N 3.41Å; W31-R100 VanDerWaalsContact CE2-NH1 3.3Å; W31-R100 HydrophobicContact CE3-CG 4.32Å; W31-R100 HydrophobicContact CZ3-CG 4.24Å; W31-Y104 HydrophobicContact CH2-CD1 4.14Å; W31-Y104 AromaticContact CH2-CD2 3.55Å; W31-Y104 HydrophobicContact CH2-CD2 3.55Å; W31-Y104 AromaticContact CH2-CE2 3.99Å; W31-Y104 HydrophobicContact CH2-CE2 3.99Å; W31-Y104 AromaticContact CH2-CG 3.61Å; W31-Y104 HydrophobicContact CH2-CG 3.61Å; W31-Y104 AromaticContact CZ3-CD2 3.62Å; W31-Y104 HydrophobicContact CZ3-CD2 3.62Å; W31-Y104 AromaticContact CZ3-CE2 3.59Å; W31-Y104 HydrophobicContact CZ3-CE2 3.59Å; W31-Y104 HydrophobicContact CZ3-CG 4.1Å; W31-N206 VanDerWaalsContact CE2-O 3.3Å; W31-N206 HydrophobicContact CZ2-CB 4.32Å; W31-N206 VanDerWaalsContact CZ2-O 3.3Å; W31-N206 WeakPolarHBondContact CZ2-O 3.45Å; W31-N206 PolarHBondContact NE1-O 3.45Å; W31-P208 HydrophobicContact CH2-CG 4.07Å; W31-P208 HydrophobicContact CZ3-CG 3.83Å
32N98.7Very high98.5Very high11 Ų1136.7 Ų36.76%0.05923%0.227CC..G310 helixtrans-66.6-23.3178.6-67.170.4000112.7A29 W30 G34 S35 L36 K227 D228A29-N32 WeakPolarHBondContact CA-OD1 3.46Å; A29-N32 VanDerWaalsContact O-CB 3.25Å; A29-N32 WeakPolarHBondContact O-CB 3.3Å; A29-N32 PolarHBondContact O-N 3.38Å; A29-N32 PolarHBondContact O-OD1 2.71Å; A29-N32 VanDerWaalsContact O-OD1 3.12Å; W30-N32 VanDerWaalsContact C-N 3.34Å; N32-G34 PolarHBondContact O-N 3.24Å; N32-G34 VanDerWaalsContact O-N 3.09Å; N32-S35 PolarHBondContact O-N 3.49Å; N32-S35 VanDerWaalsContact O-N 3.12Å; N32-S35 PolarHBondContact O-OG 3.22Å; N32-L36 WeakPolarHBondContact O-CG 3.39Å; N32-L36 PolarHBondContact O-N 2.71Å; N32-K227 PolarHBondContact ND2-O 2.99Å; N32-K227 VanDerWaalsContact ND2-O 3.16Å; N32-K227 WeakPolarHBondContact OD1-CE 3.41Å; N32-K227 PolarHBondContact OD1-NZ 3.42Å; N32-D228 PolarHBondContact ND2-OD1 3.16Å
33F98.8Very high98.5Very high32 Ų3235 Ų3514%0.1421%0.213CC..Hα-helixtrans-62.5-20.6-179.3-69.5-68.3000113.5W30 W31 L36 L37 C93 L96 H97W30-F33 HydrophobicContact CE3-CD2 4.16Å; W30-F33 AromaticContact CE3-CE2 3.57Å; W30-F33 HydrophobicContact CE3-CE2 3.57Å; W30-F33 AromaticContact CZ3-CE2 3.9Å; W30-F33 HydrophobicContact CZ3-CE2 3.9Å; W30-F33 WeakPolarHBondContact O-CD2 3.38Å; W31-F33 PolarHBondContact O-N 3.47Å; F33-L36 HydrophobicContact CD1-CD1 3.97Å; F33-L36 HydrophobicContact CE1-CD1 4.11Å; F33-L37 WeakPolarHBondContact O-CB 3.46Å; F33-L37 WeakPolarHBondContact O-CD1 3.42Å; F33-L37 WeakPolarHBondContact O-CG 3.42Å; F33-L37 PolarHBondContact O-N 3.31Å; F33-C93 HydrophobicContact CD1-CB 4.11Å; F33-L96 HydrophobicContact CD1-CB 4.07Å; F33-L96 HydrophobicContact CD1-CD1 4.4Å; F33-L96 HydrophobicContact CD2-CB 3.93Å; F33-L96 HydrophobicContact CE1-CB 3.92Å; F33-L96 HydrophobicContact CE1-CD1 3.49Å; F33-L96 VanDerWaalsContact CE1-CD1 3.49Å; F33-L96 HydrophobicContact CE1-CG 4.34Å; F33-L96 HydrophobicContact CE2-CB 3.79Å; F33-L96 HydrophobicContact CE2-CD1 4.09Å; F33-L96 HydrophobicContact CG-CB 4.1Å; F33-L96 HydrophobicContact CZ-CB 3.79Å; F33-L96 HydrophobicContact CZ-CD1 3.31Å; F33-L96 HydrophobicContact CZ-CG 4.17Å; F33-H97 HydrophobicContact CB-CB 3.92Å
34G98.1Very high98.6Very high32 Ų3236 Ų3633%0.3322%0.217SC..Hα-helixtrans-65.1-50.5171.400000112.6W31 N32 L37 G38 H97W31-G34 PolarHBondContact O-N 3.41Å; N32-G34 PolarHBondContact O-N 3.24Å; N32-G34 VanDerWaalsContact O-N 3.09Å; G34-L37 PolarHBondContact O-N 3.02Å; G34-G38 PolarHBondContact O-N 3.33Å; G34-H97 PolarHBondContact N-ND1 2.89Å
35S98.2Very high98.6Very high45 Ų4537.9 Ų37.932%0.31523%0.227SC..Hα-helixtrans-70.4-34.9177.646.20000112.4N32 L37 G38 A39 D228N32-S35 PolarHBondContact O-N 3.49Å; N32-S35 VanDerWaalsContact O-N 3.12Å; N32-S35 PolarHBondContact O-OG 3.22Å; S35-L37 PolarHBondContact O-N 2.67Å; S35-G38 PolarHBondContact O-N 2.96Å; S35-A39 PolarHBondContact O-N 3.22Å; S35-D228 WeakPolarHBondContact CB-OD2 3.48Å; S35-D228 PolarHBondContact OG-OD2 2.89Å
36L98.8Very high98.7Very high13 Ų1339.1 Ų39.17%0.06823%0.233CC..Hα-helixtrans-62.5-39.9173.1-66.2-179000112.5N32 F33 G38 A39 C40 L232 F235N32-L36 WeakPolarHBondContact O-CG 3.39Å; N32-L36 PolarHBondContact O-N 2.71Å; F33-L36 HydrophobicContact CD1-CD1 3.97Å; F33-L36 HydrophobicContact CE1-CD1 4.11Å; L36-G38 VanDerWaalsContact C-N 3.32Å; L36-G38 PolarHBondContact O-N 3.4Å; L36-A39 WeakPolarHBondContact O-CB 3.34Å; L36-A39 PolarHBondContact O-N 3.45Å; L36-C40 PolarHBondContact O-N 2.99Å; L36-C40 PolarHBondContact O-SG 3.47Å; L36-L232 HydrophobicContact CD2-CB 4.49Å; L36-F235 HydrophobicContact CD1-CB 4.48Å; L36-F235 HydrophobicContact CD2-CB 3.67Å; L36-F235 HydrophobicContact CD2-CD2 4.44Å; L36-F235 HydrophobicContact CD2-CG 4.06Å
37L98.9Very high98.7Very high24 Ų2437 Ų3713%0.12622%0.222CC..Hα-helixtrans-62.5-39.5174.1-77169.2000112.2F33 G34 S35 C40 L41 F90 C93 L94 H97F33-L37 WeakPolarHBondContact O-CB 3.46Å; F33-L37 WeakPolarHBondContact O-CD1 3.42Å; F33-L37 WeakPolarHBondContact O-CG 3.42Å; F33-L37 PolarHBondContact O-N 3.31Å; G34-L37 PolarHBondContact O-N 3.02Å; S35-L37 PolarHBondContact O-N 2.67Å; L37-C40 PolarHBondContact O-N 3.39Å; L37-L41 PolarHBondContact O-N 3.13Å; L37-F90 HydrophobicContact CD2-CD2 4.12Å; L37-F90 HydrophobicContact CD2-CE2 3.95Å; L37-F90 HydrophobicContact CD2-CZ 4.24Å; L37-C93 HydrophobicContact CD2-CB 3.68Å; L37-C93 HydrophobicContact CG-CB 3.97Å; L37-L94 HydrophobicContact CD1-CD2 3.94Å; L37-L94 HydrophobicContact CD2-CB 4.32Å; L37-L94 HydrophobicContact CD2-CD2 3.75Å; L37-L94 HydrophobicContact CD2-CG 3.62Å; L37-H97 HydrophobicContact CD1-CB 3.82Å
38G98.7Very high98.7Very high34 Ų3436.9 Ų36.935%0.35123%0.226SC..Hα-helixtrans-60.1-44.7171.500000112.3G34 S35 L36 L41 I42G34-G38 PolarHBondContact O-N 3.33Å; S35-G38 PolarHBondContact O-N 2.96Å; L36-G38 VanDerWaalsContact C-N 3.32Å; L36-G38 PolarHBondContact O-N 3.4Å; G38-L41 PolarHBondContact O-N 2.88Å; G38-I42 WeakPolarHBondContact O-CG1 3.23Å; G38-I42 PolarHBondContact O-N 3.49Å; G38-I42 VanDerWaalsContact O-N 3.08Å
39A98.8Very high98.7Very high27 Ų2738.9 Ų38.922%0.22323%0.233CC..Hα-helixtrans-63.5-41.4175.700000112.4S35 L36 L41 I42 L43 L232S35-A39 PolarHBondContact O-N 3.22Å; L36-A39 WeakPolarHBondContact O-CB 3.34Å; L36-A39 PolarHBondContact O-N 3.45Å; A39-L41 VanDerWaalsContact C-N 3.32Å; A39-L41 PolarHBondContact O-N 3.31Å; A39-I42 PolarHBondContact O-N 3.3Å; A39-L43 WeakPolarHBondContact O-CB 3.44Å; A39-L43 PolarHBondContact O-N 2.86Å; A39-L232 HydrophobicContact CB-CD1 3.73Å
40C98.9Very high98.7Very high0 Ų040.4 Ų40.40%023%0.227CC..Hα-helixtrans-62.4-40.7175.1-60.10000110.8L36 L37 L43 Q44 F90 F235L36-C40 PolarHBondContact O-N 2.99Å; L36-C40 PolarHBondContact O-SG 3.47Å; L37-C40 PolarHBondContact O-N 3.39Å; C40-L43 WeakPolarHBondContact O-CB 3.39Å; C40-L43 PolarHBondContact O-N 3.1Å; C40-Q44 VanDerWaalsContact O-CG 3.31Å; C40-Q44 WeakPolarHBondContact O-CG 3.35Å; C40-Q44 PolarHBondContact O-N 2.7Å; C40-F90 HydrophobicContact CB-CB 4.17Å; C40-F90 HydrophobicContact CB-CD1 3.15Å; C40-F90 HydrophobicContact CB-CE1 3.7Å; C40-F90 HydrophobicContact CB-CG 3.93Å; C40-F235 WeakPolarHBondContact SG-CE2 3.35Å; C40-F235 WeakPolarHBondContact SG-CZ 3.34Å
41L98.9Very high98.8Very high19 Ų1936.8 Ų36.810%0.09922%0.215CC..Hα-helixtrans-63.6-45179.3-177.360.6000111.5L37 G38 A39 Q44 I45 F90 I189 A190L37-L41 PolarHBondContact O-N 3.13Å; G38-L41 PolarHBondContact O-N 2.88Å; A39-L41 VanDerWaalsContact C-N 3.32Å; A39-L41 PolarHBondContact O-N 3.31Å; L41-Q44 PolarHBondContact O-N 3.15Å; L41-I45 HydrophobicContact CD1-CD1 3.99Å; L41-I45 HydrophobicContact CD1-CG1 4.31Å; L41-I45 HydrophobicContact CG-CD1 3.92Å; L41-I45 VanDerWaalsContact O-CG1 3.32Å; L41-I45 WeakPolarHBondContact O-CG1 3.33Å; L41-I45 PolarHBondContact O-N 3.25Å; L41-F90 HydrophobicContact CB-CE1 3.93Å; L41-F90 HydrophobicContact CD1-CE1 4.48Å; L41-I189 HydrophobicContact CD1-CB 4.38Å; L41-I189 HydrophobicContact CD1-CG2 3.88Å; L41-I189 HydrophobicContact CD2-CG2 3.99Å; L41-A190 HydrophobicContact CD2-CB 3.95Å
42I98.8Very high98.8Very high114 Ų11436.8 Ų36.859%0.58522%0.22SC*.Hα-helixtrans-60.9-47.6175.4-66.4167.4000110G38 A39 Q44 I45 T46G38-I42 WeakPolarHBondContact O-CG1 3.23Å; G38-I42 PolarHBondContact O-N 3.49Å; G38-I42 VanDerWaalsContact O-N 3.08Å; A39-I42 PolarHBondContact O-N 3.3Å; I42-Q44 PolarHBondContact O-N 2.91Å; I42-I45 PolarHBondContact O-N 2.9Å; I42-T46 WeakPolarHBondContact O-CB 3.49Å; I42-T46 PolarHBondContact O-N 3.3Å; I42-T46 PolarHBondContact O-OG1 3.47Å; I42-T46 VanDerWaalsContact O-OG1 3.05Å
43L98.9Very high98.8Very high35 Ų3541.9 Ų41.918%0.18325%0.245CC..Hα-helixtrans-55.2-49.1176.7178.875000111.5A39 C40 T46 T47 L239A39-L43 WeakPolarHBondContact O-CB 3.44Å; A39-L43 PolarHBondContact O-N 2.86Å; C40-L43 WeakPolarHBondContact O-CB 3.39Å; C40-L43 PolarHBondContact O-N 3.1Å; L43-T46 PolarHBondContact O-N 3.43Å; L43-T47 HydrophobicContact CD1-CG2 4.08Å; L43-T47 HydrophobicContact CG-CG2 4.47Å; L43-T47 WeakPolarHBondContact O-CB 3.36Å; L43-T47 WeakPolarHBondContact O-CG2 3.44Å; L43-T47 PolarHBondContact O-N 2.82Å; L43-T47 PolarHBondContact O-OG1 3.13Å; L43-L239 HydrophobicContact CD2-CD2 3.43Å; L43-L239 VanDerWaalsContact CD2-CD2 3.43Å
44Q98.9Very high98.7Very high25 Ų2544.2 Ų44.212%0.11726%0.256CS..Hα-helixtrans-65.1-42.7-179.1-68-49.5104.300112.1C40 L41 I42 T47 G48 H83 G86 F90C40-Q44 VanDerWaalsContact O-CG 3.31Å; C40-Q44 WeakPolarHBondContact O-CG 3.35Å; C40-Q44 PolarHBondContact O-N 2.7Å; L41-Q44 PolarHBondContact O-N 3.15Å; I42-Q44 PolarHBondContact O-N 2.91Å; Q44-T47 PolarHBondContact O-OG1 3.03Å; Q44-G48 WeakPolarHBondContact O-CA 3.26Å; Q44-G48 PolarHBondContact O-N 3.48Å; Q44-H83 PolarHBondContact NE2-O 2.74Å; Q44-H83 PolarHBondContact O-CE1 3.12Å; Q44-H83 VanDerWaalsContact O-CE1 3.29Å; Q44-H83 PolarHBondContact O-ND1 3.48Å; Q44-H83 PolarHBondContact OE1-O 3.01Å; Q44-G86 VanDerWaalsContact OE1-C 3.23Å; Q44-F90 HydrophobicContact CG-CD1 4.31Å
45I98.9Very high98.8Very high40 Ų4043.9 Ų43.921%0.20525%0.245CC..Hα-helixtrans-63.8-47.6177.5-69.5169.6000110.3L41 I42 L49 P186 F187L41-I45 HydrophobicContact CD1-CD1 3.99Å; L41-I45 HydrophobicContact CD1-CG1 4.31Å; L41-I45 HydrophobicContact CG-CD1 3.92Å; L41-I45 VanDerWaalsContact O-CG1 3.32Å; L41-I45 WeakPolarHBondContact O-CG1 3.33Å; L41-I45 PolarHBondContact O-N 3.25Å; I42-I45 PolarHBondContact O-N 2.9Å; I45-L49 VanDerWaalsContact O-CB 3.26Å; I45-L49 WeakPolarHBondContact O-CB 3.28Å; I45-L49 PolarHBondContact O-N 2.95Å; I45-P186 HydrophobicContact CD1-CB 4.22Å; I45-P186 HydrophobicContact CG1-CB 3.7Å; I45-F187 HydrophobicContact CG2-CE1 4.02Å; I45-F187 HydrophobicContact CG2-CZ 4.21Å
46T98.9Very high98.8Very high68 Ų6844 Ų4442%0.41725%0.246SC..Hα-helixtrans-64.6-54.6-178.7-57.90000111.1I42 L43 G48 L49 F50I42-T46 WeakPolarHBondContact O-CB 3.49Å; I42-T46 PolarHBondContact O-N 3.3Å; I42-T46 PolarHBondContact O-OG1 3.47Å; I42-T46 VanDerWaalsContact O-OG1 3.05Å; L43-T46 PolarHBondContact O-N 3.43Å; T46-G48 VanDerWaalsContact C-N 3.33Å; T46-G48 PolarHBondContact O-N 3.45Å; T46-L49 PolarHBondContact O-N 2.94Å; T46-F50 HydrophobicContact CG2-CD2 4.21Å; T46-F50 HydrophobicContact CG2-CE2 4.11Å; T46-F50 VanDerWaalsContact O-CD2 3.31Å; T46-F50 WeakPolarHBondContact O-CD2 3.28Å; T46-F50 PolarHBondContact O-N 2.9Å
47T98.9Very high98.7Very high11 Ų1144.9 Ų44.97%0.06725%0.253CS..Hα-helixtrans-62.4-41.1179.853.70000111.9L43 Q44 L49 F50 L51 I79 L82 H83L43-T47 HydrophobicContact CD1-CG2 4.08Å; L43-T47 HydrophobicContact CG-CG2 4.47Å; L43-T47 WeakPolarHBondContact O-CB 3.36Å; L43-T47 WeakPolarHBondContact O-CG2 3.44Å; L43-T47 PolarHBondContact O-N 2.82Å; L43-T47 PolarHBondContact O-OG1 3.13Å; Q44-T47 PolarHBondContact O-OG1 3.03Å; T47-L49 PolarHBondContact O-N 3.08Å; T47-F50 PolarHBondContact O-N 3.44Å; T47-L51 VanDerWaalsContact O-CG 3.28Å; T47-L51 WeakPolarHBondContact O-CG 3.45Å; T47-L51 PolarHBondContact O-N 3.3Å; T47-I79 HydrophobicContact CG2-CG2 4.26Å; T47-L82 HydrophobicContact CG2-CB 4.09Å; T47-H83 PolarHBondContact OG1-ND1 3.03Å
48G98.8Very high98.6Very high17 Ų1746.4 Ų46.418%0.17526%0.261CS..Hα-helixtrans-62.6-40.117800000112.8Q44 T46 L51 A52 H83Q44-G48 WeakPolarHBondContact O-CA 3.26Å; Q44-G48 PolarHBondContact O-N 3.48Å; T46-G48 VanDerWaalsContact C-N 3.33Å; T46-G48 PolarHBondContact O-N 3.45Å; G48-L51 PolarHBondContact O-N 2.91Å; G48-A52 VanDerWaalsContact O-CB 3.32Å; G48-A52 WeakPolarHBondContact O-CB 3.32Å; G48-A52 PolarHBondContact O-N 2.81Å; G48-H83 VanDerWaalsContact CA-CE1 3.45Å; G48-H83 WeakPolarHBondContact CA-CE1 3.45Å; G48-H83 PolarHBondContact N-ND1 3.39Å
49L98.8Very high98.5Very high77 Ų7745.7 Ų45.740%0.40325%0.252SS..Hα-helixtrans-61.8-45.1175.3-179.364.9000111.8I45 T46 T47 A52 M53 F183I45-L49 VanDerWaalsContact O-CB 3.26Å; I45-L49 WeakPolarHBondContact O-CB 3.28Å; I45-L49 PolarHBondContact O-N 2.95Å; T46-L49 PolarHBondContact O-N 2.94Å; T47-L49 PolarHBondContact O-N 3.08Å; L49-A52 PolarHBondContact O-N 3.03Å; L49-M53 HydrophobicContact CG-CE 4.1Å; L49-M53 WeakPolarHBondContact O-CG 3.28Å; L49-M53 PolarHBondContact O-N 3.43Å; L49-F183 HydrophobicContact CD1-CE2 4.24Å; L49-F183 HydrophobicContact CD1-CZ 4.06Å
50F98.8Very high98.4Very high102 Ų10249 Ų4945%0.44727%0.273SS..Hα-helixtrans-65.8-37.5176.6-82.8-82000112.5T46 T47 M53 H54 I79T46-F50 HydrophobicContact CG2-CD2 4.21Å; T46-F50 HydrophobicContact CG2-CE2 4.11Å; T46-F50 VanDerWaalsContact O-CD2 3.31Å; T46-F50 WeakPolarHBondContact O-CD2 3.28Å; T46-F50 PolarHBondContact O-N 2.9Å; T47-F50 PolarHBondContact O-N 3.44Å; F50-M53 HydrophobicContact CD1-SD 4.27Å; F50-M53 PolarHBondContact O-N 3.47Å; F50-H54 PolarHBondContact O-CD2 3.4Å; F50-I79 HydrophobicContact CB-CD1 4.29Å; F50-I79 HydrophobicContact CB-CG2 4.21Å
51L98.9Very high98.4Very high24 Ų2451.2 Ų51.213%0.12629%0.287CS..Hα-helixtrans-65.2-41.9174.2-68169.2000111.6T47 G48 M53 H54 Y55 I69 I79 R80 H83T47-L51 VanDerWaalsContact O-CG 3.28Å; T47-L51 WeakPolarHBondContact O-CG 3.45Å; T47-L51 PolarHBondContact O-N 3.3Å; G48-L51 PolarHBondContact O-N 2.91Å; L51-M53 PolarHBondContact O-N 3.4Å; L51-H54 PolarHBondContact O-N 3.28Å; L51-Y55 PolarHBondContact O-N 3.45Å; L51-Y55 VanDerWaalsContact O-N 3.13Å; L51-I69 HydrophobicContact CD2-CD1 4.32Å; L51-I69 HydrophobicContact CD2-CG2 3.55Å; L51-I79 HydrophobicContact CD1-CG2 4.47Å; L51-I79 HydrophobicContact CD2-CG2 4.02Å; L51-I79 HydrophobicContact CG-CG2 3.88Å; L51-R80 HydrophobicContact CD2-CB 4.09Å; L51-H83 HydrophobicContact CD1-CB 3.49Å; L51-H83 VanDerWaalsContact CD1-CB 3.49Å
52A98.7Very high98.4Very high23 Ų2350.3 Ų50.319%0.1928%0.282CS..Hα-helixtrans-61.7-28.1-179.800000113.1G48 L49 H54 F179 F183G48-A52 VanDerWaalsContact O-CB 3.32Å; G48-A52 WeakPolarHBondContact O-CB 3.32Å; G48-A52 PolarHBondContact O-N 2.81Å; L49-A52 PolarHBondContact O-N 3.03Å; A52-H54 PolarHBondContact O-N 3.44Å; A52-F179 HydrophobicContact CB-CE2 4.24Å; A52-F179 HydrophobicContact CB-CZ 4.13Å; A52-F183 HydrophobicContact CB-CD2 4.28Å; A52-F183 HydrophobicContact CB-CE2 3.99Å
53M98.7Very high98.4Very high117 Ų11747.6 Ų47.658%0.57627%0.266SS*.THydrogen-bonded Turntrans-63.5-18.2174.9-66.3175.4-173.500113.5L49 F50 L51L49-M53 HydrophobicContact CG-CE 4.1Å; L49-M53 WeakPolarHBondContact O-CG 3.28Å; L49-M53 PolarHBondContact O-N 3.43Å; F50-M53 HydrophobicContact CD1-SD 4.27Å; F50-M53 PolarHBondContact O-N 3.47Å; L51-M53 PolarHBondContact O-N 3.4Å
54H98.6Very high98.4Very high81 Ų8149 Ų4938%0.37528%0.279SS..THydrogen-bonded Turntrans-123.2-2.8-175-61.2-68000113.6F50 L51 A52 I69 V73F50-H54 PolarHBondContact O-CD2 3.4Å; L51-H54 PolarHBondContact O-N 3.28Å; A52-H54 PolarHBondContact O-N 3.44Å; H54-I69 HydrophobicContact CB-CD1 3.88Å; H54-I69 HydrophobicContact CB-CG1 3.49Å; H54-I69 VanDerWaalsContact CB-CG1 3.49Å; H54-V73 HydrophobicContact CB-CG2 4.37Å
55Y98.8Very high98.4Very high25 Ų2548.3 Ų48.310%0.09828%0.277CS..  trans-92.1145.1-177177.1-108.3000111.9L51 P57 A62 S65 I66 L133 F179L51-Y55 PolarHBondContact O-N 3.45Å; L51-Y55 VanDerWaalsContact O-N 3.13Å; Y55-P57 HydrophobicContact CD1-CB 4.38Å; Y55-P57 HydrophobicContact CE1-CB 3.7Å; Y55-A62 HydrophobicContact CE2-CB 4.03Å; Y55-S65 WeakPolarHBondContact CD2-OG 3.49Å; Y55-I66 HydrophobicContact CD2-CD1 3.7Å; Y55-I66 HydrophobicContact CD2-CG1 4.2Å; Y55-I66 HydrophobicContact CE2-CD1 4.08Å; Y55-I66 HydrophobicContact CE2-CG1 4.21Å; Y55-L133 HydrophobicContact CE1-CB 4.42Å; Y55-L133 HydrophobicContact CE2-CB 4.41Å; Y55-L133 WeakPolarHBondContact CE2-O 3.36Å; Y55-L133 WeakPolarHBondContact OH-CA 3.28Å; Y55-L133 PolarHBondContact OH-O 3.37Å; Y55-F179 AromaticContact CD1-CD2 3.62Å; Y55-F179 HydrophobicContact CD1-CD2 3.62Å; Y55-F179 AromaticContact CD1-CE2 3.63Å; Y55-F179 HydrophobicContact CD1-CE2 3.63Å; Y55-F179 HydrophobicContact CD1-CG 4.34Å; Y55-F179 HydrophobicContact CD1-CZ 4.35Å; Y55-F179 HydrophobicContact CE1-CB 4.36Å; Y55-F179 AromaticContact CE1-CD2 3.59Å; Y55-F179 HydrophobicContact CE1-CD2 3.59Å; Y55-F179 HydrophobicContact CE1-CE2 4.11Å; Y55-F179 HydrophobicContact CE1-CG 4.06Å
56S98.3Very high98.4Very high47 Ų4747.5 Ų47.533%0.32927%0.273SS..  trans-121.1114176.3-172.50000110.4D58 T61 A62 S65S56-D58 PolarHBondContact O-N 2.92Å; S56-T61 WeakPolarHBondContact CB-OG1 3.27Å; S56-T61 PolarHBondContact OG-OG1 3.04Å; S56-A62 VanDerWaalsContact O-CA 3.26Å; S56-A62 WeakPolarHBondContact O-CA 3.39Å; S56-A62 WeakPolarHBondContact O-CB 3.38Å; S56-S65 PolarHBondContact N-OG 2.85Å
57P97Very high98.3Very high33 Ų3345.9 Ų45.921%0.21427%0.266CS..  trans-85.553.4-173.536.4-38.4000113Y55 T176 F179Y55-P57 HydrophobicContact CD1-CB 4.38Å; Y55-P57 HydrophobicContact CE1-CB 3.7Å; P57-T176 PolarHBondContact O-OG1 2.91Å; P57-F179 HydrophobicContact CB-CB 3.77Å; P57-F179 HydrophobicContact CB-CD1 3.98Å; P57-F179 HydrophobicContact CB-CG 3.89Å; P57-F179 HydrophobicContact CG-CD1 3.94Å; P57-F179 HydrophobicContact CG-CE1 4.44Å; P57-F179 HydrophobicContact CG-CG 4.35Å
58D97.3Very high98.3Very high56 Ų5649 Ų4930%0.29928%0.28SS..SBendtrans-125.9140.4173.5178.7-96.5000110.6S56 S60 T61 A62 S172S56-D58 PolarHBondContact O-N 2.92Å; D58-S60 PolarHBondContact O-N 3.49Å; D58-S60 VanDerWaalsContact O-N 3.12Å; D58-S60 VanDerWaalsContact OD1-CB 3.27Å; D58-S60 WeakPolarHBondContact OD1-CB 3.14Å; D58-S60 PolarHBondContact OD1-N 3.39Å; D58-S60 PolarHBondContact OD1-OG 3.3Å; D58-T61 PolarHBondContact O-N 2.84Å; D58-A62 WeakPolarHBondContact O-CB 3.49Å; D58-A62 PolarHBondContact O-N 3.07Å; D58-S172 PolarHBondContact OD2-OG 3.47Å
59A96.2Very high98.3Very high19 Ų1948.3 Ų48.316%0.15727%0.272CS..THydrogen-bonded Turntrans-59.3-27.3-174.500000113.4W135 S172A59-W135 HydrophobicContact CB-CZ2 3.71Å; A59-W135 PolarHBondContact O-NE1 3.41Å; A59-S172 VanDerWaalsContact CB-OG 3.23Å; A59-S172 WeakPolarHBondContact CB-OG 3.34Å; A59-S172 PolarHBondContact N-OG 3.19Å
60S97.6Very high98.3Very high97 Ų9746.1 Ų46.168%0.67826%0.262SS*.THydrogen-bonded Turntrans-78.7-27178.372.80000113.6D58D58-S60 PolarHBondContact O-N 3.49Å; D58-S60 VanDerWaalsContact O-N 3.12Å; D58-S60 VanDerWaalsContact OD1-CB 3.27Å; D58-S60 WeakPolarHBondContact OD1-CB 3.14Å; D58-S60 PolarHBondContact OD1-N 3.39Å; D58-S60 PolarHBondContact OD1-OG 3.3Å
61T98.3Very high98.3Very high46 Ų4651.1 Ų51.128%0.28228%0.278SS..THydrogen-bonded Turntrans-115.4-20.5-173.257.40000114.2S56 D58 F63 S64 S65S56-T61 WeakPolarHBondContact CB-OG1 3.27Å; S56-T61 PolarHBondContact OG-OG1 3.04Å; D58-T61 PolarHBondContact O-N 2.84Å; T61-F63 PolarHBondContact O-N 3.35Å; T61-S64 CarbonylContact O-C 3.57Å; T61-S64 PolarHBondContact O-N 3.41Å; T61-S64 VanDerWaalsContact O-N 3.13Å; T61-S64 PolarHBondContact O-OG 3.08Å; T61-S65 WeakPolarHBondContact O-CB 3.37Å; T61-S65 PolarHBondContact O-N 3.42Å
62A98.6Very high98.3Very high0 Ų055.2 Ų55.20%030%0.299CS..Hα-helixtrans-55.1-53.5-171.400000113.1Y55 S56 D58 S64 S65 I66 W135 L175Y55-A62 HydrophobicContact CE2-CB 4.03Å; S56-A62 VanDerWaalsContact O-CA 3.26Å; S56-A62 WeakPolarHBondContact O-CA 3.39Å; S56-A62 WeakPolarHBondContact O-CB 3.38Å; D58-A62 WeakPolarHBondContact O-CB 3.49Å; D58-A62 PolarHBondContact O-N 3.07Å; A62-S64 VanDerWaalsContact C-N 3.35Å; A62-S64 PolarHBondContact O-N 3.3Å; A62-S65 PolarHBondContact O-N 3.17Å; A62-S65 VanDerWaalsContact O-N 3.16Å; A62-S65 PolarHBondContact O-OG 3.3Å; A62-I66 PolarHBondContact O-N 3.32Å; A62-I66 VanDerWaalsContact O-N 3.14Å; A62-W135 HydrophobicContact CB-CB 3.88Å; A62-W135 HydrophobicContact CB-CG 4.41Å; A62-L175 HydrophobicContact CB-CD2 3.55Å
63F98.6Very high98.3Very high56 Ų5655.4 Ų55.425%0.24630%0.298CS..Hα-helixtrans-58.7-45.5177.9-173.5-91.8000111.9T61 S65 I66 A67 P134 W135 Y256 L258T61-F63 PolarHBondContact O-N 3.35Å; F63-S65 VanDerWaalsContact C-N 3.34Å; F63-S65 PolarHBondContact O-N 3.04Å; F63-I66 PolarHBondContact O-N 2.89Å; F63-A67 PolarHBondContact O-N 3.43Å; F63-A67 VanDerWaalsContact O-N 3.1Å; F63-P134 WeakPolarHBondContact CA-O 3.31Å; F63-P134 WeakPolarHBondContact CD2-O 3.32Å; F63-W135 HydrophobicContact CB-CB 4.45Å; F63-Y256 WeakPolarHBondContact CZ-O 3.39Å; F63-L258 HydrophobicContact CB-CD1 3.45Å; F63-L258 VanDerWaalsContact CB-CD1 3.45Å; F63-L258 HydrophobicContact CD1-CB 4.19Å; F63-L258 HydrophobicContact CD1-CD1 4.13Å; F63-L258 HydrophobicContact CD2-CB 4.47Å; F63-L258 HydrophobicContact CD2-CD1 4.24Å; F63-L258 HydrophobicContact CE1-CB 4.33Å; F63-L258 HydrophobicContact CG-CB 4.28Å; F63-L258 HydrophobicContact CG-CD1 3.69Å
64S98.6Very high98.3Very high64 Ų6456.7 Ų56.745%0.44831%0.307SS..Hα-helixtrans-66.5-32.5177.666.60000113.2T61 A62 A67 H68T61-S64 CarbonylContact O-C 3.57Å; T61-S64 PolarHBondContact O-N 3.41Å; T61-S64 VanDerWaalsContact O-N 3.13Å; T61-S64 PolarHBondContact O-OG 3.08Å; A62-S64 VanDerWaalsContact C-N 3.35Å; A62-S64 PolarHBondContact O-N 3.3Å; S64-A67 WeakPolarHBondContact O-CB 3.3Å; S64-A67 PolarHBondContact O-N 3.36Å; S64-H68 WeakPolarHBondContact O-CB 3.33Å; S64-H68 PolarHBondContact O-N 3.47Å
65S98.7Very high98.3Very high11 Ų1160.6 Ų60.68%0.07732%0.32CS..Hα-helixtrans-68.5-35.7177.275.40000111.8Y55 S56 T61 A62 F63 H68 I69Y55-S65 WeakPolarHBondContact CD2-OG 3.49Å; S56-S65 PolarHBondContact N-OG 2.85Å; T61-S65 WeakPolarHBondContact O-CB 3.37Å; T61-S65 PolarHBondContact O-N 3.42Å; A62-S65 PolarHBondContact O-N 3.17Å; A62-S65 VanDerWaalsContact O-N 3.16Å; A62-S65 PolarHBondContact O-OG 3.3Å; F63-S65 VanDerWaalsContact C-N 3.34Å; F63-S65 PolarHBondContact O-N 3.04Å; S65-H68 PolarHBondContact O-N 2.89Å; S65-I69 VanDerWaalsContact O-CG1 3.31Å; S65-I69 WeakPolarHBondContact O-CG1 3.28Å; S65-I69 PolarHBondContact O-N 3.3Å
66I98.6Very high98.3Very high24 Ų2459.4 Ų59.412%0.12332%0.316CS..Hα-helixtrans-66.8-40.1170.8-64.6-57.1000111.3Y55 A62 F63 I69 T70 P134Y55-I66 HydrophobicContact CD2-CD1 3.7Å; Y55-I66 HydrophobicContact CD2-CG1 4.2Å; Y55-I66 HydrophobicContact CE2-CD1 4.08Å; Y55-I66 HydrophobicContact CE2-CG1 4.21Å; A62-I66 PolarHBondContact O-N 3.32Å; A62-I66 VanDerWaalsContact O-N 3.14Å; F63-I66 PolarHBondContact O-N 2.89Å; I66-I69 HydrophobicContact CD1-CD1 4.16Å; I66-I69 PolarHBondContact O-N 3.36Å; I66-T70 PolarHBondContact O-N 2.91Å; I66-T70 PolarHBondContact O-OG1 3.35Å; I66-P134 HydrophobicContact CG1-CB 4.4Å
67A98.4Very high98.3Very high33 Ų3362.2 Ų62.227%0.27332%0.319SS..Hα-helixtrans-62.4-43.9174.300000111.5F63 S64 T70 R71F63-A67 PolarHBondContact O-N 3.43Å; F63-A67 VanDerWaalsContact O-N 3.1Å; S64-A67 WeakPolarHBondContact O-CB 3.3Å; S64-A67 PolarHBondContact O-N 3.36Å; A67-T70 PolarHBondContact O-N 3.41Å; A67-T70 VanDerWaalsContact O-N 3.16Å; A67-R71 WeakPolarHBondContact O-CB 3.33Å; A67-R71 WeakPolarHBondContact O-CG 3.48Å; A67-R71 PolarHBondContact O-N 3.47Å
68H98.8Very high98.4Very high78 Ų7863.2 Ų63.236%0.36132%0.322SS..Hα-helixtrans-60-46.8174.2166.1-92.2000112S64 S65 T70 R71 D72 V73S64-H68 WeakPolarHBondContact O-CB 3.33Å; S64-H68 PolarHBondContact O-N 3.47Å; S65-H68 PolarHBondContact O-N 2.89Å; H68-T70 PolarHBondContact O-N 3.39Å; H68-R71 PolarHBondContact O-N 2.98Å; H68-D72 IonicContact CD2-OD2 3.33Å; H68-D72 PolarHBondContact CD2-OD2 3.05Å; H68-D72 IonicContact CG-OD2 3.93Å; H68-D72 WeakPolarHBondContact O-CB 3.37Å; H68-D72 PolarHBondContact O-N 2.79Å; H68-V73 PolarHBondContact O-N 2.86Å
69I98.8Very high98.4Very high2 Ų262.2 Ų62.21%0.0132%0.316CS..Hα-helixtrans-53.8-44.3173-75.8164.2000110.9L51 H54 S65 I66 G76 R80L51-I69 HydrophobicContact CD2-CD1 4.32Å; L51-I69 HydrophobicContact CD2-CG2 3.55Å; H54-I69 HydrophobicContact CB-CD1 3.88Å; H54-I69 HydrophobicContact CB-CG1 3.49Å; H54-I69 VanDerWaalsContact CB-CG1 3.49Å; S65-I69 VanDerWaalsContact O-CG1 3.31Å; S65-I69 WeakPolarHBondContact O-CG1 3.28Å; S65-I69 PolarHBondContact O-N 3.3Å; I66-I69 HydrophobicContact CD1-CD1 4.16Å; I66-I69 PolarHBondContact O-N 3.36Å; I69-G76 CarbonylContact O-C 3.33Å; I69-G76 WeakPolarHBondContact O-CA 3.33Å; I69-R80 HydrophobicContact CG2-CB 4.39Å
70T98.4Very high98.6Very high30 Ų3063.3 Ų63.318%0.18432%0.316CS..Hα-helixtrans-72.6-34.9-175-51.50000112I66 A67 H68 W77 R80I66-T70 PolarHBondContact O-N 2.91Å; I66-T70 PolarHBondContact O-OG1 3.35Å; A67-T70 PolarHBondContact O-N 3.41Å; A67-T70 VanDerWaalsContact O-N 3.16Å; H68-T70 PolarHBondContact O-N 3.39Å; T70-W77 HydrophobicContact CG2-CB 3.92Å; T70-W77 WeakPolarHBondContact O-CB 3.35Å; T70-R80 WeakPolarHBondContact OG1-CD 3.49Å
71R98.6Very high98.6Very high208 Ų20860.1 Ų60.179%0.78529%0.29SS*.Hα-helixtrans-102.6-35.2-168.3-65.6178.2178.7-161.3-0.4114.2A67 H68A67-R71 WeakPolarHBondContact O-CB 3.33Å; A67-R71 WeakPolarHBondContact O-CG 3.48Å; A67-R71 PolarHBondContact O-N 3.47Å; H68-R71 PolarHBondContact O-N 2.98Å
72D98.7Very high98.7Very high109 Ų10959 Ų5958%0.58328%0.282SS*.THydrogen-bonded Turntrans-115.3-25.5-165-52.3-41.1000112.8H68H68-D72 IonicContact CD2-OD2 3.33Å; H68-D72 PolarHBondContact CD2-OD2 3.05Å; H68-D72 IonicContact CG-OD2 3.93Å; H68-D72 WeakPolarHBondContact O-CB 3.37Å; H68-D72 PolarHBondContact O-N 2.79Å
73V98.8Very high98.7Very high28 Ų2860.6 Ų60.617%0.1729%0.289CS..SBendtrans-80.8130176.6179.60000110.2H54 H68 Y75 G76H54-V73 HydrophobicContact CB-CG2 4.37Å; H68-V73 PolarHBondContact O-N 2.86Å; V73-Y75 PolarHBondContact O-N 3.39Å; V73-Y75 VanDerWaalsContact O-N 3.17Å; V73-G76 PolarHBondContact O-N 2.67Å
74N98.6Very high98.7Very high143 Ų14360.4 Ų60.477%0.76530%0.298SS*.THydrogen-bonded Turntrans-54.5120.9176.3-69.6-40.8000111.2G76N74-G76 PolarHBondContact O-N 2.88Å; N74-G76 VanDerWaalsContact O-N 3.09Å
75Y98.5Very high98.7Very high163 Ų16357.6 Ų57.664%0.63928%0.278SS*.THydrogen-bonded Turntrans57.212.7-173.6-56.9-80.4000115.3V73 W77 M78 I79V73-Y75 PolarHBondContact O-N 3.39Å; V73-Y75 VanDerWaalsContact O-N 3.17Å; Y75-W77 VanDerWaalsContact C-N 3.31Å; Y75-W77 PolarHBondContact O-N 2.95Å; Y75-M78 HydrophobicContact CD1-CE 4.32Å; Y75-M78 WeakPolarHBondContact O-CB 3.49Å; Y75-M78 PolarHBondContact O-N 3.28Å; Y75-I79 WeakPolarHBondContact O-CG1 3.48Å; Y75-I79 PolarHBondContact O-N 3.48Å; Y75-I79 VanDerWaalsContact O-N 3.08Å
76G98.8Very high98.7Very high1 Ų157.1 Ų57.11%0.0127%0.274CS..Hα-helixtrans-64.4-33.9-176.900000113.1I69 V73 N74 M78 I79 R80I69-G76 CarbonylContact O-C 3.33Å; I69-G76 WeakPolarHBondContact O-CA 3.33Å; V73-G76 PolarHBondContact O-N 2.67Å; N74-G76 PolarHBondContact O-N 2.88Å; N74-G76 VanDerWaalsContact O-N 3.09Å; G76-M78 VanDerWaalsContact C-N 3.33Å; G76-M78 PolarHBondContact O-N 2.8Å; G76-I79 PolarHBondContact O-N 3.39Å; G76-R80 WeakPolarHBondContact O-CB 3.27Å; G76-R80 PolarHBondContact O-N 2.93Å
77W98.6Very high98.7Very high105 Ų10556.9 Ų56.940%0.39828%0.276SS..Hα-helixtrans-56.8-45.4170.169.3-90.1000112.2T70 Y75 R80 Y81 L244T70-W77 HydrophobicContact CG2-CB 3.92Å; T70-W77 WeakPolarHBondContact O-CB 3.35Å; Y75-W77 VanDerWaalsContact C-N 3.31Å; Y75-W77 PolarHBondContact O-N 2.95Å; W77-R80 PolarHBondContact O-N 2.82Å; W77-Y81 HydrophobicContact CB-CE2 4.47Å; W77-Y81 HydrophobicContact CE3-CD2 4.05Å; W77-Y81 HydrophobicContact CE3-CE2 4.49Å; W77-Y81 WeakPolarHBondContact O-CD2 3.42Å; W77-Y81 PolarHBondContact O-N 2.95Å; W77-L244 HydrophobicContact CH2-CD2 3.88Å; W77-L244 HydrophobicContact CZ3-CD2 4.22Å
78M98.6Very high98.7Very high54 Ų5455.5 Ų55.527%0.26627%0.265SS..Hα-helixtrans-68.1-44-177.8-174.1179.671.700110.3Y75 G76 R80 Y81 L82Y75-M78 HydrophobicContact CD1-CE 4.32Å; Y75-M78 WeakPolarHBondContact O-CB 3.49Å; Y75-M78 PolarHBondContact O-N 3.28Å; G76-M78 VanDerWaalsContact C-N 3.33Å; G76-M78 PolarHBondContact O-N 2.8Å; M78-R80 VanDerWaalsContact C-N 3.34Å; M78-R80 PolarHBondContact O-N 3.48Å; M78-Y81 PolarHBondContact O-N 3.48Å; M78-L82 HydrophobicContact CG-CD1 4.08Å; M78-L82 HydrophobicContact CG-CG 4.4Å; M78-L82 VanDerWaalsContact O-CB 3.32Å; M78-L82 WeakPolarHBondContact O-CB 3.47Å; M78-L82 VanDerWaalsContact O-CG 3.24Å; M78-L82 WeakPolarHBondContact O-CG 3.39Å; M78-L82 PolarHBondContact O-N 2.84Å
79I98.8Very high98.7Very high36 Ų3652.7 Ų52.719%0.18525%0.252CS..Hα-helixtrans-61.9-43.6176.8-60.7171.7000110.4T47 F50 L51 Y75 G76 L82 H83T47-I79 HydrophobicContact CG2-CG2 4.26Å; F50-I79 HydrophobicContact CB-CD1 4.29Å; F50-I79 HydrophobicContact CB-CG2 4.21Å; L51-I79 HydrophobicContact CD1-CG2 4.47Å; L51-I79 HydrophobicContact CD2-CG2 4.02Å; L51-I79 HydrophobicContact CG-CG2 3.88Å; Y75-I79 WeakPolarHBondContact O-CG1 3.48Å; Y75-I79 PolarHBondContact O-N 3.48Å; Y75-I79 VanDerWaalsContact O-N 3.08Å; G76-I79 PolarHBondContact O-N 3.39Å; I79-L82 PolarHBondContact O-N 3.4Å; I79-H83 WeakPolarHBondContact O-CB 3.4Å; I79-H83 PolarHBondContact O-N 2.87Å
80R98.8Very high98.7Very high42 Ų4253.3 Ų53.316%0.15825%0.254CS..Hα-helixtrans-59.1-50.4176.7179.3-176.6174.9-104.61.1111.4L51 I69 T70 G76 W77 M78 H83 A84 Y256L51-R80 HydrophobicContact CD2-CB 4.09Å; I69-R80 HydrophobicContact CG2-CB 4.39Å; T70-R80 WeakPolarHBondContact OG1-CD 3.49Å; G76-R80 WeakPolarHBondContact O-CB 3.27Å; G76-R80 PolarHBondContact O-N 2.93Å; W77-R80 PolarHBondContact O-N 2.82Å; M78-R80 VanDerWaalsContact C-N 3.34Å; M78-R80 PolarHBondContact O-N 3.48Å; R80-H83 WeakPolarHBondContact O-CB 3.47Å; R80-H83 PolarHBondContact O-N 3.39Å; R80-A84 WeakPolarHBondContact O-CB 3.38Å; R80-A84 PolarHBondContact O-N 3.11Å; R80-Y256 PolarHBondContact NH1-OH 3.22Å
81Y98.8Very high98.8Very high30 Ų3052 Ų5212%0.11825%0.246CC..Hα-helixtrans-72.5-31.7-178.4-69.6-59.3000113W77 M78 H83 A84 N85 P247 Y256W77-Y81 HydrophobicContact CB-CE2 4.47Å; W77-Y81 HydrophobicContact CE3-CD2 4.05Å; W77-Y81 HydrophobicContact CE3-CE2 4.49Å; W77-Y81 WeakPolarHBondContact O-CD2 3.42Å; W77-Y81 PolarHBondContact O-N 2.95Å; M78-Y81 PolarHBondContact O-N 3.48Å; Y81-H83 VanDerWaalsContact C-N 3.3Å; Y81-H83 PolarHBondContact O-N 3.49Å; Y81-A84 PolarHBondContact O-N 3.36Å; Y81-N85 VanDerWaalsContact O-CB 3.24Å; Y81-N85 WeakPolarHBondContact O-CB 3.41Å; Y81-N85 PolarHBondContact O-N 3.47Å; Y81-N85 PolarHBondContact O-ND2 3.05Å; Y81-P247 HydrophobicContact CD1-CB 3.59Å; Y81-P247 HydrophobicContact CD2-CB 4.03Å; Y81-P247 HydrophobicContact CE1-CB 3.82Å; Y81-P247 HydrophobicContact CE2-CB 4.23Å; Y81-P247 HydrophobicContact CG-CB 3.72Å; Y81-Y256 PolarHBondContact OH-OH 3.01Å
82L98.9Very high98.8Very high23 Ų2344.9 Ų44.912%0.1222%0.223CC..Hα-helixtrans-60.8-41.4168.8-77.5172.4000111.2T47 M78 I79 G86 L239 M240 T243T47-L82 HydrophobicContact CG2-CB 4.09Å; M78-L82 HydrophobicContact CG-CD1 4.08Å; M78-L82 HydrophobicContact CG-CG 4.4Å; M78-L82 VanDerWaalsContact O-CB 3.32Å; M78-L82 WeakPolarHBondContact O-CB 3.47Å; M78-L82 VanDerWaalsContact O-CG 3.24Å; M78-L82 WeakPolarHBondContact O-CG 3.39Å; M78-L82 PolarHBondContact O-N 2.84Å; I79-L82 PolarHBondContact O-N 3.4Å; L82-G86 WeakPolarHBondContact O-CA 3.39Å; L82-G86 PolarHBondContact O-N 3.47Å; L82-L239 HydrophobicContact CD2-CD2 3.97Å; L82-L239 HydrophobicContact CD2-CG 4.09Å; L82-M240 HydrophobicContact CD2-SD 3.8Å; L82-T243 HydrophobicContact CD2-CG2 4.17Å; L82-T243 HydrophobicContact CG-CG2 4.16Å
83H98.9Very high98.8Very high33 Ų3339.9 Ų39.915%0.15320%0.196CC..Hα-helixtrans-68.5-43.9177.9-165.781.7000112.3Q44 T47 G48 L51 I79 R80 Y81 A87 H182Q44-H83 PolarHBondContact NE2-O 2.74Å; Q44-H83 PolarHBondContact O-CE1 3.12Å; Q44-H83 VanDerWaalsContact O-CE1 3.29Å; Q44-H83 PolarHBondContact O-ND1 3.48Å; Q44-H83 PolarHBondContact OE1-O 3.01Å; T47-H83 PolarHBondContact OG1-ND1 3.03Å; G48-H83 VanDerWaalsContact CA-CE1 3.45Å; G48-H83 WeakPolarHBondContact CA-CE1 3.45Å; G48-H83 PolarHBondContact N-ND1 3.39Å; L51-H83 HydrophobicContact CD1-CB 3.49Å; L51-H83 VanDerWaalsContact CD1-CB 3.49Å; I79-H83 WeakPolarHBondContact O-CB 3.4Å; I79-H83 PolarHBondContact O-N 2.87Å; R80-H83 WeakPolarHBondContact O-CB 3.47Å; R80-H83 PolarHBondContact O-N 3.39Å; Y81-H83 VanDerWaalsContact C-N 3.3Å; Y81-H83 PolarHBondContact O-N 3.49Å; H83-A87 PolarHBondContact O-N 3.04Å; H83-A87 VanDerWaalsContact O-N 3.12Å; H83-H182 AromaticContact NE2-NE2 3.95Å
84A98.8Very high98.8Very high52 Ų5239.2 Ų39.243%0.4319%0.192SC..Hα-helixtrans-68.9-51.5-179.700000112.2R80 Y81 G86 A87 S88R80-A84 WeakPolarHBondContact O-CB 3.38Å; R80-A84 PolarHBondContact O-N 3.11Å; Y81-A84 PolarHBondContact O-N 3.36Å; A84-G86 VanDerWaalsContact C-N 3.34Å; A84-A87 WeakPolarHBondContact O-CB 3.06Å; A84-A87 PolarHBondContact O-N 3.4Å; A84-S88 PolarHBondContact O-N 2.91Å
85N98.9Very high98.8Very high5 Ų535.5 Ų35.53%0.02717%0.169CC..Hα-helixtrans-71.8-31.3177.9-71.1-51.4000111.9Y81 A87 S88 M89 L239 L242 P247Y81-N85 VanDerWaalsContact O-CB 3.24Å; Y81-N85 WeakPolarHBondContact O-CB 3.41Å; Y81-N85 PolarHBondContact O-N 3.47Å; Y81-N85 PolarHBondContact O-ND2 3.05Å; N85-A87 VanDerWaalsContact C-N 3.29Å; N85-A87 PolarHBondContact O-N 3.21Å; N85-S88 WeakPolarHBondContact O-CB 3.49Å; N85-S88 PolarHBondContact O-N 3.27Å; N85-S88 VanDerWaalsContact O-N 3.15Å; N85-M89 WeakPolarHBondContact O-CG 3.21Å; N85-M89 PolarHBondContact O-N 3.43Å; N85-L239 HydrophobicContact CB-CD1 3.89Å; N85-L242 HydrophobicContact CB-CD2 3.75Å; N85-L242 HydrophobicContact CB-CG 4.13Å; N85-L242 WeakPolarHBondContact OD1-CD2 3.39Å; N85-P247 PolarHBondContact ND2-O 2.86Å; N85-P247 PolarHBondContact OD1-O 2.68Å
86G98.9Very high98.8Very high0 Ų030.9 Ų30.90%016%0.155CC..Hα-helixtrans-60.2-36.4171.900000112.7Q44 L82 A84 M89 F90Q44-G86 VanDerWaalsContact OE1-C 3.23Å; L82-G86 WeakPolarHBondContact O-CA 3.39Å; L82-G86 PolarHBondContact O-N 3.47Å; A84-G86 VanDerWaalsContact C-N 3.34Å; G86-M89 PolarHBondContact O-N 2.87Å; G86-F90 WeakPolarHBondContact O-CB 3.49Å; G86-F90 PolarHBondContact O-N 2.82Å
87A98.8Very high98.8Very high20 Ų2032.6 Ų32.617%0.16516%0.163CC..Hα-helixtrans-62.7-43.7172.200000111.9H83 A84 N85 F90 F91H83-A87 PolarHBondContact O-N 3.04Å; H83-A87 VanDerWaalsContact O-N 3.12Å; A84-A87 WeakPolarHBondContact O-CB 3.06Å; A84-A87 PolarHBondContact O-N 3.4Å; N85-A87 VanDerWaalsContact C-N 3.29Å; N85-A87 PolarHBondContact O-N 3.21Å; A87-F90 VanDerWaalsContact O-CB 3.24Å; A87-F90 WeakPolarHBondContact O-CB 3.36Å; A87-F90 PolarHBondContact O-N 3.48Å; A87-F91 WeakPolarHBondContact O-CD2 3.3Å; A87-F91 PolarHBondContact O-N 3.45Å; A87-F91 VanDerWaalsContact O-N 3.17Å
88S98.8Very high98.8Very high4 Ų429 Ų293%0.02815%0.151CC..Hα-helixtrans-61.7-45.2173.8-73.90000111.9A84 N85 F90 F91 I92 W272A84-S88 PolarHBondContact O-N 2.91Å; N85-S88 WeakPolarHBondContact O-CB 3.49Å; N85-S88 PolarHBondContact O-N 3.27Å; N85-S88 VanDerWaalsContact O-N 3.15Å; S88-F90 PolarHBondContact O-N 3.4Å; S88-F91 PolarHBondContact O-N 2.85Å; S88-F91 VanDerWaalsContact O-N 3.15Å; S88-I92 WeakPolarHBondContact O-CG1 3.19Å; S88-I92 PolarHBondContact O-N 3.47Å; S88-W272 PolarHBondContact OG-NE1 3.08Å
89M98.8Very high98.8Very high19 Ų1926.8 Ų26.89%0.09414%0.142CC..Hα-helixtrans-62.7-32.4176.4-67.2-58.5-63.900112.4N85 G86 I92 C93 F235 S238 L239N85-M89 WeakPolarHBondContact O-CG 3.21Å; N85-M89 PolarHBondContact O-N 3.43Å; G86-M89 PolarHBondContact O-N 2.87Å; M89-I92 PolarHBondContact O-N 2.88Å; M89-I92 HydrophobicContact SD-CD1 3.92Å; M89-C93 WeakPolarHBondContact O-CB 3.43Å; M89-C93 PolarHBondContact O-N 3.19Å; M89-C93 PolarHBondContact O-SG 3.21Å; M89-F235 HydrophobicContact CB-CE2 3.69Å; M89-F235 HydrophobicContact CB-CZ 4.11Å; M89-F235 HydrophobicContact CE-CD2 3.87Å; M89-F235 HydrophobicContact CE-CE2 3.96Å; M89-F235 HydrophobicContact CG-CE2 4.39Å; M89-S238 WeakPolarHBondContact CE-OG 3.43Å; M89-L239 HydrophobicContact CG-CB 4.37Å; M89-L239 HydrophobicContact CG-CD1 3.93Å
90F98.9Very high98.8Very high15 Ų1526.3 Ų26.37%0.06614%0.138CC..Hα-helixtrans-59.9-48.1172.5-158.1106.2000110.9L37 C40 L41 Q44 G86 A87 S88 C93 L94 T123L37-F90 HydrophobicContact CD2-CD2 4.12Å; L37-F90 HydrophobicContact CD2-CE2 3.95Å; L37-F90 HydrophobicContact CD2-CZ 4.24Å; C40-F90 HydrophobicContact CB-CB 4.17Å; C40-F90 HydrophobicContact CB-CD1 3.15Å; C40-F90 HydrophobicContact CB-CE1 3.7Å; C40-F90 HydrophobicContact CB-CG 3.93Å; L41-F90 HydrophobicContact CB-CE1 3.93Å; L41-F90 HydrophobicContact CD1-CE1 4.48Å; Q44-F90 HydrophobicContact CG-CD1 4.31Å; G86-F90 WeakPolarHBondContact O-CB 3.49Å; G86-F90 PolarHBondContact O-N 2.82Å; A87-F90 VanDerWaalsContact O-CB 3.24Å; A87-F90 WeakPolarHBondContact O-CB 3.36Å; A87-F90 PolarHBondContact O-N 3.48Å; S88-F90 PolarHBondContact O-N 3.4Å; F90-C93 PolarHBondContact O-N 3.38Å; F90-L94 HydrophobicContact CD2-CD1 3.67Å; F90-L94 HydrophobicContact CD2-CG 3.89Å; F90-L94 HydrophobicContact CE2-CD1 3.73Å; F90-L94 HydrophobicContact CE2-CD2 4.28Å; F90-L94 HydrophobicContact CE2-CG 3.89Å; F90-L94 WeakPolarHBondContact O-CG 3.43Å; F90-L94 PolarHBondContact O-N 2.87Å; F90-T123 HydrophobicContact CD2-CG2 3.5Å; F90-T123 VanDerWaalsContact CD2-CG2 3.5Å; F90-T123 HydrophobicContact CE2-CG2 3.39Å; F90-T123 HydrophobicContact CG-CG2 4.49Å; F90-T123 HydrophobicContact CZ-CG2 4.34Å
91F98.9Very high98.9Very high2 Ų224.4 Ų24.41%0.00913%0.132CC..Hα-helixtrans-69.4-36.9178.1-82.1-80.9000113.6A87 S88 C93 L94 F95 T123 M124 A127 W272 Y273A87-F91 WeakPolarHBondContact O-CD2 3.3Å; A87-F91 PolarHBondContact O-N 3.45Å; A87-F91 VanDerWaalsContact O-N 3.17Å; S88-F91 PolarHBondContact O-N 2.85Å; S88-F91 VanDerWaalsContact O-N 3.15Å; F91-C93 VanDerWaalsContact C-N 3.32Å; F91-C93 PolarHBondContact O-N 3.45Å; F91-L94 HydrophobicContact CD1-CD1 4.09Å; F91-L94 HydrophobicContact CE1-CD1 4.17Å; F91-L94 PolarHBondContact O-N 3.31Å; F91-F95 HydrophobicContact CB-CD2 4.49Å; F91-F95 HydrophobicContact CB-CE2 4.03Å; F91-F95 HydrophobicContact CB-CZ 4.44Å; F91-F95 HydrophobicContact CD1-CE1 4.31Å; F91-F95 HydrophobicContact CD1-CE2 4.27Å; F91-F95 AromaticContact CD1-CZ 3.82Å; F91-F95 HydrophobicContact CD1-CZ 3.82Å; F91-F95 WeakPolarHBondContact O-CD2 3.5Å; F91-F95 VanDerWaalsContact O-CG 3.29Å; F91-F95 WeakPolarHBondContact O-CG 3.41Å; F91-F95 PolarHBondContact O-N 3.44Å; F91-T123 HydrophobicContact CE1-CG2 4.5Å; F91-T123 HydrophobicContact CE2-CG2 4.18Å; F91-T123 HydrophobicContact CZ-CG2 3.91Å; F91-M124 HydrophobicContact CE1-CG 3.82Å; F91-M124 HydrophobicContact CZ-CG 4.17Å; F91-A127 HydrophobicContact CE2-CB 3.48Å; F91-A127 VanDerWaalsContact CE2-CB 3.48Å; F91-A127 HydrophobicContact CZ-CB 3.84Å; F91-W272 HydrophobicContact CB-CH2 4.14Å; F91-W272 HydrophobicContact CB-CZ2 4.18Å; F91-Y273 HydrophobicContact CB-CD1 4.23Å; F91-Y273 HydrophobicContact CB-CG 3.96Å; F91-Y273 AromaticContact CD1-CD2 3.96Å; F91-Y273 HydrophobicContact CD1-CD2 3.96Å; F91-Y273 HydrophobicContact CD1-CG 4.01Å; F91-Y273 AromaticContact CD2-CD1 3.78Å; F91-Y273 HydrophobicContact CD2-CD1 3.78Å; F91-Y273 AromaticContact CD2-CD2 3.52Å; F91-Y273 HydrophobicContact CD2-CD2 3.52Å; F91-Y273 HydrophobicContact CD2-CE1 4.08Å; F91-Y273 AromaticContact CD2-CE2 3.78Å; F91-Y273 HydrophobicContact CD2-CE2 3.78Å; F91-Y273 AromaticContact CD2-CG 3.52Å; F91-Y273 HydrophobicContact CD2-CG 3.52Å; F91-Y273 AromaticContact CE1-CD2 3.91Å; F91-Y273 HydrophobicContact CE1-CD2 3.91Å; F91-Y273 HydrophobicContact CE1-CG 4.43Å; F91-Y273 HydrophobicContact CE2-CD1 4.43Å; F91-Y273 AromaticContact CE2-CD2 3.48Å; F91-Y273 HydrophobicContact CE2-CD2 3.48Å; F91-Y273 VanDerWaalsContact CE2-CD2 3.48Å; F91-Y273 HydrophobicContact CE2-CE1 4.45Å; F91-Y273 AromaticContact CE2-CE2 3.44Å; F91-Y273 HydrophobicContact CE2-CE2 3.44Å; F91-Y273 VanDerWaalsContact CE2-CE2 3.44Å; F91-Y273 AromaticContact CE2-CG 4Å; F91-Y273 HydrophobicContact CE2-CG 4Å; F91-Y273 AromaticContact CE2-CZ 3.99Å; F91-Y273 HydrophobicContact CG-CD1 4.07Å; F91-Y273 AromaticContact CG-CD2 3.78Å; F91-Y273 HydrophobicContact CG-CD2 3.78Å; F91-Y273 HydrophobicContact CG-CE2 4.48Å; F91-Y273 AromaticContact CG-CG 3.53Å; F91-Y273 HydrophobicContact CG-CG 3.53Å; F91-Y273 AromaticContact CZ-CD2 3.68Å; F91-Y273 HydrophobicContact CZ-CD2 3.68Å; F91-Y273 AromaticContact CZ-CE2 3.87Å; F91-Y273 HydrophobicContact CZ-CE2 3.87Å; F91-Y273 HydrophobicContact CZ-CG 4.43Å
92I98.9Very high98.9Very high59 Ų5924.3 Ų24.330%0.30313%0.133SC..Hα-helixtrans-57.4-49.7171.4-66.8169.2000109.5S88 M89 L94 F95 L96 W272S88-I92 WeakPolarHBondContact O-CG1 3.19Å; S88-I92 PolarHBondContact O-N 3.47Å; M89-I92 PolarHBondContact O-N 2.88Å; M89-I92 HydrophobicContact SD-CD1 3.92Å; I92-L94 VanDerWaalsContact C-N 3.34Å; I92-L94 PolarHBondContact O-N 3.15Å; I92-F95 PolarHBondContact O-N 3.19Å; I92-L96 HydrophobicContact CG2-CD1 3.93Å; I92-L96 VanDerWaalsContact O-CG 3.28Å; I92-L96 WeakPolarHBondContact O-CG 3.44Å; I92-L96 PolarHBondContact O-N 3.22Å; I92-L96 VanDerWaalsContact O-N 3.08Å; I92-W272 HydrophobicContact CD1-CH2 4.48Å; I92-W272 HydrophobicContact CD1-CZ2 4.28Å; I92-W272 HydrophobicContact CG1-CH2 3.54Å; I92-W272 HydrophobicContact CG1-CZ2 3.71Å
93C98.9Very high98.9Very high3 Ų324.9 Ų24.92%0.0213%0.134CC..Hα-helixtrans-62.4-39.9177.7-66.80000112.2F33 L37 M89 F90 F91 H97F33-C93 HydrophobicContact CD1-CB 4.11Å; L37-C93 HydrophobicContact CD2-CB 3.68Å; L37-C93 HydrophobicContact CG-CB 3.97Å; M89-C93 WeakPolarHBondContact O-CB 3.43Å; M89-C93 PolarHBondContact O-N 3.19Å; M89-C93 PolarHBondContact O-SG 3.21Å; F90-C93 PolarHBondContact O-N 3.38Å; F91-C93 VanDerWaalsContact C-N 3.32Å; F91-C93 PolarHBondContact O-N 3.45Å; C93-H97 WeakPolarHBondContact O-CB 3.46Å; C93-H97 PolarHBondContact O-N 3.22Å
94L98.8Very high98.9Very high15 Ų1524.4 Ų24.48%0.07913%0.131CC..Hα-helixtrans-61.7-51177.6-84.5176.3000111.3L37 F90 F91 I92 L96 H97 I98 L120 T123L37-L94 HydrophobicContact CD1-CD2 3.94Å; L37-L94 HydrophobicContact CD2-CB 4.32Å; L37-L94 HydrophobicContact CD2-CD2 3.75Å; L37-L94 HydrophobicContact CD2-CG 3.62Å; F90-L94 HydrophobicContact CD2-CD1 3.67Å; F90-L94 HydrophobicContact CD2-CG 3.89Å; F90-L94 HydrophobicContact CE2-CD1 3.73Å; F90-L94 HydrophobicContact CE2-CD2 4.28Å; F90-L94 HydrophobicContact CE2-CG 3.89Å; F90-L94 WeakPolarHBondContact O-CG 3.43Å; F90-L94 PolarHBondContact O-N 2.87Å; F91-L94 HydrophobicContact CD1-CD1 4.09Å; F91-L94 HydrophobicContact CE1-CD1 4.17Å; F91-L94 PolarHBondContact O-N 3.31Å; I92-L94 VanDerWaalsContact C-N 3.34Å; I92-L94 PolarHBondContact O-N 3.15Å; L94-L96 VanDerWaalsContact C-N 3.34Å; L94-L96 PolarHBondContact O-N 2.96Å; L94-H97 WeakPolarHBondContact O-CB 3.37Å; L94-H97 PolarHBondContact O-N 2.88Å; L94-I98 VanDerWaalsContact O-CG1 3.28Å; L94-I98 WeakPolarHBondContact O-CG1 3.34Å; L94-I98 PolarHBondContact O-N 2.84Å; L94-L120 HydrophobicContact CD1-CD1 4.15Å; L94-T123 HydrophobicContact CD1-CG2 3.79Å
95F98.9Very high98.8Very high65 Ų6522 Ų2229%0.28511%0.111SC..Hα-helixtrans-64.3-39.3-178-62.6-37.4000111.9F91 I92 I98 G99 W272 Y273 F276F91-F95 HydrophobicContact CB-CD2 4.49Å; F91-F95 HydrophobicContact CB-CE2 4.03Å; F91-F95 HydrophobicContact CB-CZ 4.44Å; F91-F95 HydrophobicContact CD1-CE1 4.31Å; F91-F95 HydrophobicContact CD1-CE2 4.27Å; F91-F95 AromaticContact CD1-CZ 3.82Å; F91-F95 HydrophobicContact CD1-CZ 3.82Å; F91-F95 WeakPolarHBondContact O-CD2 3.5Å; F91-F95 VanDerWaalsContact O-CG 3.29Å; F91-F95 WeakPolarHBondContact O-CG 3.41Å; F91-F95 PolarHBondContact O-N 3.44Å; I92-F95 PolarHBondContact O-N 3.19Å; F95-I98 PolarHBondContact O-N 3.12Å; F95-G99 PolarHBondContact O-N 3.44Å; F95-W272 HydrophobicContact CD2-CH2 4.22Å; F95-W272 HydrophobicContact CD2-CZ3 4.17Å; F95-W272 HydrophobicContact CE2-CH2 4.06Å; F95-W272 AromaticContact CE2-CZ3 3.86Å; F95-W272 HydrophobicContact CE2-CZ3 3.86Å; F95-Y273 WeakPolarHBondContact CZ-O 3.46Å; F95-F276 HydrophobicContact CE1-CE1 4.45Å; F95-F276 HydrophobicContact CZ-CE1 4.32Å
96L98.9Very high98.8Very high66 Ų6622.6 Ų22.635%0.34612%0.116SC..Hα-helixtrans-68.8-36.2174.7-62.8176.9000112W30 F33 I92 L94 G99 R100W30-L96 HydrophobicContact CZ3-CD2 4.13Å; F33-L96 HydrophobicContact CD1-CB 4.07Å; F33-L96 HydrophobicContact CD1-CD1 4.4Å; F33-L96 HydrophobicContact CD2-CB 3.93Å; F33-L96 HydrophobicContact CE1-CB 3.92Å; F33-L96 HydrophobicContact CE1-CD1 3.49Å; F33-L96 VanDerWaalsContact CE1-CD1 3.49Å; F33-L96 HydrophobicContact CE1-CG 4.34Å; F33-L96 HydrophobicContact CE2-CB 3.79Å; F33-L96 HydrophobicContact CE2-CD1 4.09Å; F33-L96 HydrophobicContact CG-CB 4.1Å; F33-L96 HydrophobicContact CZ-CB 3.79Å; F33-L96 HydrophobicContact CZ-CD1 3.31Å; F33-L96 HydrophobicContact CZ-CG 4.17Å; I92-L96 HydrophobicContact CG2-CD1 3.93Å; I92-L96 VanDerWaalsContact O-CG 3.28Å; I92-L96 WeakPolarHBondContact O-CG 3.44Å; I92-L96 PolarHBondContact O-N 3.22Å; I92-L96 VanDerWaalsContact O-N 3.08Å; L94-L96 VanDerWaalsContact C-N 3.34Å; L94-L96 PolarHBondContact O-N 2.96Å; L96-G99 PolarHBondContact O-N 3.41Å; L96-R100 WeakPolarHBondContact O-CB 3.42Å; L96-R100 PolarHBondContact O-N 2.76Å
97H98.9Very high98.8Very high36 Ų3623.1 Ų23.117%0.16712%0.118CC..Hα-helixtrans-64.6-43.6174.8-168.3102.7000112.2F33 G34 L37 C93 L94 R100 G101F33-H97 HydrophobicContact CB-CB 3.92Å; G34-H97 PolarHBondContact N-ND1 2.89Å; L37-H97 HydrophobicContact CD1-CB 3.82Å; C93-H97 WeakPolarHBondContact O-CB 3.46Å; C93-H97 PolarHBondContact O-N 3.22Å; L94-H97 WeakPolarHBondContact O-CB 3.37Å; L94-H97 PolarHBondContact O-N 2.88Å; H97-R100 PolarHBondContact CE1-NH2 3.37Å; H97-R100 PolarHBondContact ND1-NH2 3.2Å; H97-R100 PolarHBondContact NE2-NH2 2.96Å; H97-G101 PolarHBondContact O-N 2.96Å; H97-G101 VanDerWaalsContact O-N 3.08Å
98I98.9Very high98.8Very high29 Ų2925.5 Ų25.515%0.14913%0.128CC..Hα-helixtrans-65.5-47.4175.2-67163.7000109.9L94 F95 R100 G101 L102 W113 L120 L301L94-I98 VanDerWaalsContact O-CG1 3.28Å; L94-I98 WeakPolarHBondContact O-CG1 3.34Å; L94-I98 PolarHBondContact O-N 2.84Å; F95-I98 PolarHBondContact O-N 3.12Å; I98-R100 VanDerWaalsContact C-N 3.33Å; I98-R100 PolarHBondContact O-N 2.92Å; I98-G101 CarbonylContact O-C 3.57Å; I98-G101 WeakPolarHBondContact O-CA 3.27Å; I98-G101 PolarHBondContact O-N 3.27Å; I98-L102 HydrophobicContact CG2-CD1 4.18Å; I98-L102 HydrophobicContact CG2-CG 4.38Å; I98-L102 WeakPolarHBondContact O-CG 3.36Å; I98-L102 PolarHBondContact O-N 3.31Å; I98-W113 HydrophobicContact CG2-CH2 4.16Å; I98-L120 HydrophobicContact CD1-CD1 4.11Å; I98-L120 HydrophobicContact CD1-CD2 3.85Å; I98-L120 HydrophobicContact CD1-CG 4.44Å; I98-L301 HydrophobicContact CG2-CD1 4.39Å; I98-L301 HydrophobicContact CG2-CD2 4.13Å
99G98.9Very high98.7Very high9 Ų927.7 Ų27.79%0.09314%0.136CC..Hα-helixtrans-56.7-44.4177.400000112.4F95 L96 G101 L102 Y103 Y325F95-G99 PolarHBondContact O-N 3.44Å; L96-G99 PolarHBondContact O-N 3.41Å; G99-G101 VanDerWaalsContact C-N 3.31Å; G99-G101 PolarHBondContact O-N 3.39Å; G99-L102 PolarHBondContact O-N 3.36Å; G99-Y103 WeakPolarHBondContact O-CB 3.31Å; G99-Y103 PolarHBondContact O-N 3.11Å; G99-Y325 WeakPolarHBondContact CA-OH 3.43Å; G99-Y325 WeakPolarHBondContact O-CE2 3.45Å; G99-Y325 PolarHBondContact O-OH 3.03Å
100R98.9Very high98.6Very high25 Ų2529.2 Ų29.29%0.09415%0.148CC..Hα-helixtrans-54.9-47.5169.6178.8-76.7-65.7-96.3-5.9111.1W30 W31 L96 H97 I98 L102 Y103 Y104W30-R100 HydrophobicContact CB-CB 4.09Å; W30-R100 HydrophobicContact CB-CG 3.53Å; W31-R100 VanDerWaalsContact CE2-NH1 3.3Å; W31-R100 HydrophobicContact CE3-CG 4.32Å; W31-R100 HydrophobicContact CZ3-CG 4.24Å; L96-R100 WeakPolarHBondContact O-CB 3.42Å; L96-R100 PolarHBondContact O-N 2.76Å; H97-R100 PolarHBondContact CE1-NH2 3.37Å; H97-R100 PolarHBondContact ND1-NH2 3.2Å; H97-R100 PolarHBondContact NE2-NH2 2.96Å; I98-R100 VanDerWaalsContact C-N 3.33Å; I98-R100 PolarHBondContact O-N 2.92Å; R100-L102 VanDerWaalsContact C-N 3.33Å; R100-L102 PolarHBondContact O-N 2.99Å; R100-Y103 PolarHBondContact O-N 3.07Å; R100-Y104 HydrophobicContact CG-CD2 3.76Å; R100-Y104 HydrophobicContact CG-CE2 4.12Å; R100-Y104 WeakPolarHBondContact O-CD2 3.34Å; R100-Y104 PolarHBondContact O-N 3.35Å
101G98.8Very high98.6Very high3 Ų333.2 Ų33.23%0.03117%0.167CC..Hα-helixtrans-60.6-40.6-18000000113.1H97 I98 G99 G105 S106 F107H97-G101 PolarHBondContact O-N 2.96Å; H97-G101 VanDerWaalsContact O-N 3.08Å; I98-G101 CarbonylContact O-C 3.57Å; I98-G101 WeakPolarHBondContact O-CA 3.27Å; I98-G101 PolarHBondContact O-N 3.27Å; G99-G101 VanDerWaalsContact C-N 3.31Å; G99-G101 PolarHBondContact O-N 3.39Å; G101-G105 CarbonylContact O-C 3.52Å; G101-G105 PolarHBondContact O-N 2.84Å; G101-S106 PolarHBondContact O-N 3.17Å; G101-F107 WeakPolarHBondContact O-CD1 3.46Å
102L98.8Very high98.6Very high28 Ų2833.8 Ų33.815%0.14717%0.171CC..Hα-helixtrans-66.8-49.3174.7-65.4174.8000111.9I98 G99 R100 G105 F107 W113 L301 I304 Y325I98-L102 HydrophobicContact CG2-CD1 4.18Å; I98-L102 HydrophobicContact CG2-CG 4.38Å; I98-L102 WeakPolarHBondContact O-CG 3.36Å; I98-L102 PolarHBondContact O-N 3.31Å; G99-L102 PolarHBondContact O-N 3.36Å; R100-L102 VanDerWaalsContact C-N 3.33Å; R100-L102 PolarHBondContact O-N 2.99Å; L102-G105 PolarHBondContact O-N 3.14Å; L102-F107 HydrophobicContact CD2-CD1 4.29Å; L102-W113 HydrophobicContact CD2-CH2 3.79Å; L102-W113 HydrophobicContact CD2-CZ2 3.99Å; L102-W113 HydrophobicContact CG-CH2 4.12Å; L102-L301 HydrophobicContact CD2-CD2 4.41Å; L102-I304 HydrophobicContact CD2-CB 4.48Å; L102-I304 HydrophobicContact CD2-CD1 4.24Å; L102-I304 HydrophobicContact CD2-CG1 4.02Å; L102-I304 HydrophobicContact CD2-CG2 3.88Å; L102-Y325 HydrophobicContact CB-CE2 4.2Å
103Y98.9Very high98.6Very high35 Ų3532.1 Ų32.114%0.13716%0.161CC..Hα-helixtrans-66.4-42-175-170.7-89.8000112.9G99 R100 M315 Q322 Y325G99-Y103 WeakPolarHBondContact O-CB 3.31Å; G99-Y103 PolarHBondContact O-N 3.11Å; R100-Y103 PolarHBondContact O-N 3.07Å; Y103-M315 HydrophobicContact CD2-CB 4.3Å; Y103-M315 HydrophobicContact CD2-SD 4.31Å; Y103-M315 HydrophobicContact CE1-CB 4.45Å; Y103-M315 HydrophobicContact CE2-CB 4.22Å; Y103-M315 HydrophobicContact CG-CB 4.48Å; Y103-M315 VanDerWaalsContact O-CB 3.28Å; Y103-M315 WeakPolarHBondContact O-CB 3.27Å; Y103-M315 VanDerWaalsContact O-CG 3.32Å; Y103-M315 WeakPolarHBondContact O-CG 3.44Å; Y103-M315 PolarHBondContact O-N 3.24Å; Y103-Q322 HydrophobicContact CE2-CB 4.49Å; Y103-Q322 HydrophobicContact CE2-CG 3.95Å; Y103-Q322 VanDerWaalsContact OH-CD 3.23Å; Y103-Q322 WeakPolarHBondContact OH-CG 3.5Å; Y103-Q322 PolarHBondContact OH-OE1 3.12Å; Y103-Y325 AromaticContact CD2-CD1 3.51Å; Y103-Y325 HydrophobicContact CD2-CD1 3.51Å; Y103-Y325 HydrophobicContact CD2-CD2 4.05Å; Y103-Y325 AromaticContact CD2-CE1 3.74Å; Y103-Y325 HydrophobicContact CD2-CE1 3.74Å; Y103-Y325 HydrophobicContact CD2-CE2 4.26Å; Y103-Y325 AromaticContact CD2-CG 3.67Å; Y103-Y325 HydrophobicContact CD2-CG 3.67Å; Y103-Y325 HydrophobicContact CE2-CD1 4.04Å; Y103-Y325 HydrophobicContact CE2-CE1 4.46Å; Y103-Y325 HydrophobicContact CE2-CG 4.4Å
104Y98.8Very high98.6Very high22 Ų2235.3 Ų35.39%0.08618%0.178CC..THydrogen-bonded Turntrans-94.53.9-177-63.6-69000113.8W30 W31 R100 S106 N206 P208 S314W30-Y104 HydrophobicContact CB-CE2 4.23Å; W30-Y104 AromaticContact CD1-CE2 3.83Å; W30-Y104 HydrophobicContact CG-CE2 4.17Å; W31-Y104 HydrophobicContact CH2-CD1 4.14Å; W31-Y104 AromaticContact CH2-CD2 3.55Å; W31-Y104 HydrophobicContact CH2-CD2 3.55Å; W31-Y104 AromaticContact CH2-CE2 3.99Å; W31-Y104 HydrophobicContact CH2-CE2 3.99Å; W31-Y104 AromaticContact CH2-CG 3.61Å; W31-Y104 HydrophobicContact CH2-CG 3.61Å; W31-Y104 AromaticContact CZ3-CD2 3.62Å; W31-Y104 HydrophobicContact CZ3-CD2 3.62Å; W31-Y104 AromaticContact CZ3-CE2 3.59Å; W31-Y104 HydrophobicContact CZ3-CE2 3.59Å; W31-Y104 HydrophobicContact CZ3-CG 4.1Å; R100-Y104 HydrophobicContact CG-CD2 3.76Å; R100-Y104 HydrophobicContact CG-CE2 4.12Å; R100-Y104 WeakPolarHBondContact O-CD2 3.34Å; R100-Y104 PolarHBondContact O-N 3.35Å; Y104-S106 VanDerWaalsContact C-N 3.32Å; Y104-S106 PolarHBondContact O-N 2.99Å; Y104-N206 PolarHBondContact O-ND2 2.97Å; Y104-P208 VanDerWaalsContact CD1-CA 3.49Å; Y104-P208 HydrophobicContact CD1-CB 4.21Å; Y104-P208 WeakPolarHBondContact CD1-O 3.28Å; Y104-P208 VanDerWaalsContact CE1-CA 3.49Å; Y104-P208 HydrophobicContact CE1-CB 3.66Å; Y104-P208 HydrophobicContact CE1-CG 4.39Å; Y104-S314 WeakPolarHBondContact CD1-OG 3.19Å
105G98.5Very high98.6Very high1 Ų135.3 Ų35.31%0.0118%0.178CC..THydrogen-bonded Turntrans67.529.8179.100000113.7G101 L102 F107 L108 Q313G101-G105 CarbonylContact O-C 3.52Å; G101-G105 PolarHBondContact O-N 2.84Å; L102-G105 PolarHBondContact O-N 3.14Å; G105-F107 PolarHBondContact O-N 3.19Å; G105-L108 WeakPolarHBondContact O-CG 3.48Å; G105-L108 PolarHBondContact O-N 3.06Å; G105-Q313 PolarHBondContact O-NE2 3.02Å
106S98.6Very high98.6Very high19 Ų1933.4 Ų33.413%0.13318%0.176CC..G310 helixtrans-73.6-13.8178.3-54.50000112.8G101 Y104 L108 Y109 N206G101-S106 PolarHBondContact O-N 3.17Å; Y104-S106 VanDerWaalsContact C-N 3.32Å; Y104-S106 PolarHBondContact O-N 2.99Å; S106-L108 PolarHBondContact O-N 2.85Å; S106-Y109 PolarHBondContact O-N 3.1Å; S106-Y109 VanDerWaalsContact O-N 3.14Å; S106-N206 PolarHBondContact OG-ND2 2.87Å
107F98.5Very high98.6Very high11 Ų1130.9 Ų30.95%0.04816%0.163CC..G310 helixtrans-62.7-14.5172.456.9-106.8000113.5G101 L102 G105 Y109 W113 I304 P305 H308G101-F107 WeakPolarHBondContact O-CD1 3.46Å; L102-F107 HydrophobicContact CD2-CD1 4.29Å; G105-F107 PolarHBondContact O-N 3.19Å; F107-Y109 PolarHBondContact O-N 3.28Å; F107-W113 HydrophobicContact CB-CB 4.43Å; F107-W113 HydrophobicContact CB-CD2 3.33Å; F107-W113 HydrophobicContact CB-CE3 3.62Å; F107-W113 HydrophobicContact CB-CG 3.71Å; F107-W113 HydrophobicContact CB-CH2 4.18Å; F107-W113 HydrophobicContact CB-CZ2 3.93Å; F107-W113 HydrophobicContact CB-CZ3 4.04Å; F107-I304 HydrophobicContact CB-CG2 4.31Å; F107-I304 HydrophobicContact CD1-CG2 3.47Å; F107-I304 VanDerWaalsContact CD1-CG2 3.47Å; F107-I304 HydrophobicContact CD2-CG2 3.8Å; F107-I304 HydrophobicContact CE1-CG2 3.57Å; F107-I304 HydrophobicContact CE2-CG2 3.93Å; F107-I304 HydrophobicContact CG-CG2 3.58Å; F107-I304 HydrophobicContact CZ-CG2 3.81Å; F107-P305 HydrophobicContact CB-CG 4.32Å; F107-P305 HydrophobicContact CD2-CB 4.32Å; F107-P305 HydrophobicContact CD2-CG 4.22Å; F107-P305 WeakPolarHBondContact O-CG 3.45Å; F107-H308 HydrophobicContact CE2-CB 3.83Å; F107-H308 AromaticContact CE2-CG 3.93Å; F107-H308 AromaticContact CE2-ND1 3.81Å; F107-H308 HydrophobicContact CZ-CB 4.32Å; F107-H308 AromaticContact CZ-ND1 3.6Å
108L98.3Very high98.6Very high69 Ų6933.3 Ų33.336%0.36118%0.176SC..G310 helixtrans-66.6-17.4173.2-65.6-177.9000112.8G105 S106 S110 H308 Q313G105-L108 WeakPolarHBondContact O-CG 3.48Å; G105-L108 PolarHBondContact O-N 3.06Å; S106-L108 PolarHBondContact O-N 2.85Å; L108-S110 VanDerWaalsContact C-N 3.29Å; L108-S110 PolarHBondContact O-N 3.29Å; L108-S110 VanDerWaalsContact O-N 3.11Å; L108-H308 HydrophobicContact CD2-CB 4.29Å; L108-Q313 HydrophobicContact CD1-CB 4.15Å; L108-Q313 HydrophobicContact CD1-CG 3.72Å
109Y98Very high98.6Very high51 Ų5132.9 Ų32.920%0.217%0.174CC..SBendtrans-81.481165.4-54.6-41.4000109S106 F107 E111 T112 W113 T203 N206S106-Y109 PolarHBondContact O-N 3.1Å; S106-Y109 VanDerWaalsContact O-N 3.14Å; F107-Y109 PolarHBondContact O-N 3.28Å; Y109-E111 PolarHBondContact O-N 2.98Å; Y109-T112 PolarHBondContact O-N 2.84Å; Y109-W113 WeakPolarHBondContact O-CB 3.48Å; Y109-W113 PolarHBondContact O-N 2.85Å; Y109-T203 HydrophobicContact CD1-CG2 4.18Å; Y109-T203 HydrophobicContact CE1-CG2 4.43Å; Y109-N206 HydrophobicContact CE2-CB 3.64Å
110S96.8Very high98.6Very high50 Ų5032.9 Ų32.935%0.3517%0.172SC..Hα-helixtrans-52.7-46.1-16734.60000114.5L108 W113 N114L108-S110 VanDerWaalsContact C-N 3.29Å; L108-S110 PolarHBondContact O-N 3.29Å; L108-S110 VanDerWaalsContact O-N 3.11Å; S110-W113 PolarHBondContact O-N 3.17Å; S110-N114 VanDerWaalsContact O-CB 3.28Å; S110-N114 WeakPolarHBondContact O-CB 3.49Å; S110-N114 PolarHBondContact O-N 2.96Å; S110-N114 PolarHBondContact O-ND2 3.36Å; S110-N114 VanDerWaalsContact O-ND2 3.1Å
111E98.1Very high98.6Very high99 Ų9935 Ų3546%0.46318%0.184SC..Hα-helixtrans-67-50.4-176.4-65.982.5167.500110Y109 W113 N114 I115 F199Y109-E111 PolarHBondContact O-N 2.98Å; E111-W113 VanDerWaalsContact C-N 3.33Å; E111-W113 PolarHBondContact O-N 3.33Å; E111-N114 PolarHBondContact O-N 2.91Å; E111-I115 WeakPolarHBondContact O-CG1 3.47Å; E111-I115 PolarHBondContact O-N 3.18Å; E111-F199 HydrophobicContact CB-CB 4.06Å; E111-F199 HydrophobicContact CB-CD1 3.49Å; E111-F199 VanDerWaalsContact CB-CD1 3.49Å; E111-F199 HydrophobicContact CB-CD2 4.21Å; E111-F199 HydrophobicContact CB-CE1 3.88Å; E111-F199 HydrophobicContact CB-CG 3.66Å; E111-F199 HydrophobicContact CB-CZ 4.38Å; E111-F199 HydrophobicContact CG-CD1 3.89Å; E111-F199 HydrophobicContact CG-CE1 3.88Å; E111-F199 HydrophobicContact CG-CZ 4.5Å
112T98.6Very high98.6Very high14 Ų1435.5 Ų35.59%0.08619%0.189CC..Hα-helixtrans-57.3-46.7174.7-53.90000110.7Y109 G116 H196 F199 L200Y109-T112 PolarHBondContact O-N 2.84Å; T112-G116 PolarHBondContact O-N 3.22Å; T112-H196 WeakPolarHBondContact CG2-CE1 3.29Å; T112-H196 PolarHBondContact O-CE1 3.34Å; T112-H196 PolarHBondContact O-ND1 2.96Å; T112-F199 WeakPolarHBondContact OG1-CB 3.42Å; T112-L200 HydrophobicContact CG2-CB 4.18Å; T112-L200 HydrophobicContact CG2-CD1 4.49Å; T112-L200 PolarHBondContact OG1-N 3.26Å
113W98.8Very high98.6Very high25 Ų2534.7 Ų34.710%0.09519%0.185CC..Hα-helixtrans-62.9-48.5179.5-176.6-107.7000112.8I98 L102 F107 Y109 S110 E111 I115 G116 I117 L301I98-W113 HydrophobicContact CG2-CH2 4.16Å; L102-W113 HydrophobicContact CD2-CH2 3.79Å; L102-W113 HydrophobicContact CD2-CZ2 3.99Å; L102-W113 HydrophobicContact CG-CH2 4.12Å; F107-W113 HydrophobicContact CB-CB 4.43Å; F107-W113 HydrophobicContact CB-CD2 3.33Å; F107-W113 HydrophobicContact CB-CE3 3.62Å; F107-W113 HydrophobicContact CB-CG 3.71Å; F107-W113 HydrophobicContact CB-CH2 4.18Å; F107-W113 HydrophobicContact CB-CZ2 3.93Å; F107-W113 HydrophobicContact CB-CZ3 4.04Å; Y109-W113 WeakPolarHBondContact O-CB 3.48Å; Y109-W113 PolarHBondContact O-N 2.85Å; S110-W113 PolarHBondContact O-N 3.17Å; E111-W113 VanDerWaalsContact C-N 3.33Å; E111-W113 PolarHBondContact O-N 3.33Å; W113-I115 PolarHBondContact O-N 3.14Å; W113-G116 CarbonylContact O-C 3.59Å; W113-G116 VanDerWaalsContact O-CA 3.28Å; W113-G116 WeakPolarHBondContact O-CA 3.42Å; W113-G116 PolarHBondContact O-N 2.95Å; W113-I117 PolarHBondContact O-N 3.2Å; W113-L301 HydrophobicContact CH2-CD2 4.4Å; W113-L301 HydrophobicContact CZ2-CB 4.16Å; W113-L301 HydrophobicContact CZ2-CD2 3.99Å; W113-L301 PolarHBondContact NE1-O 3.17Å
114N98.6Very high98.6Very high70 Ų7034 Ų3437%0.37418%0.183SC..Hα-helixtrans-65.4-39.1-179.1-72.1-30.3000111.9S110 E111 G116 I117 I118S110-N114 VanDerWaalsContact O-CB 3.28Å; S110-N114 WeakPolarHBondContact O-CB 3.49Å; S110-N114 PolarHBondContact O-N 2.96Å; S110-N114 PolarHBondContact O-ND2 3.36Å; S110-N114 VanDerWaalsContact O-ND2 3.1Å; E111-N114 PolarHBondContact O-N 2.91Å; N114-G116 VanDerWaalsContact C-N 3.27Å; N114-G116 PolarHBondContact O-N 2.97Å; N114-I117 WeakPolarHBondContact O-CB 3.47Å; N114-I117 PolarHBondContact O-N 2.66Å; N114-I118 WeakPolarHBondContact O-CG1 3.43Å; N114-I118 PolarHBondContact O-N 3.31Å; N114-I118 VanDerWaalsContact O-N 3.07Å
115I98.8Very high98.6Very high15 Ų1534.8 Ų34.88%0.07720%0.195CC..Hα-helixtrans-65.3-35.3170.8-66.8162.3000110.8E111 W113 I117 I118 L119 L195 H196 F199E111-I115 WeakPolarHBondContact O-CG1 3.47Å; E111-I115 PolarHBondContact O-N 3.18Å; W113-I115 PolarHBondContact O-N 3.14Å; I115-I117 VanDerWaalsContact C-N 3.29Å; I115-I117 PolarHBondContact O-N 3.2Å; I115-I118 PolarHBondContact O-N 3.48Å; I115-L119 HydrophobicContact CG2-CD1 4.15Å; I115-L119 HydrophobicContact CG2-CG 4.37Å; I115-L119 WeakPolarHBondContact O-CB 3.46Å; I115-L119 WeakPolarHBondContact O-CG 2.98Å; I115-L119 PolarHBondContact O-N 2.94Å; I115-L195 HydrophobicContact CD1-CD2 3.84Å; I115-L195 HydrophobicContact CD1-CG 3.75Å; I115-L195 HydrophobicContact CG1-CD2 4.45Å; I115-H196 HydrophobicContact CB-CB 4.49Å; I115-H196 HydrophobicContact CG2-CB 3.69Å; I115-F199 HydrophobicContact CD1-CD2 3.16Å; I115-F199 HydrophobicContact CD1-CE2 3.38Å; I115-F199 HydrophobicContact CD1-CG 4.26Å
116G98.8Very high98.6Very high24 Ų2435.4 Ų35.425%0.24720%0.198CC..Hα-helixtrans-57.7-39.7171.600000113T112 W113 N114 L119 L120T112-G116 PolarHBondContact O-N 3.22Å; W113-G116 CarbonylContact O-C 3.59Å; W113-G116 VanDerWaalsContact O-CA 3.28Å; W113-G116 WeakPolarHBondContact O-CA 3.42Å; W113-G116 PolarHBondContact O-N 2.95Å; N114-G116 VanDerWaalsContact C-N 3.27Å; N114-G116 PolarHBondContact O-N 2.97Å; G116-L119 WeakPolarHBondContact O-CB 3.4Å; G116-L119 PolarHBondContact O-N 2.85Å; G116-L120 PolarHBondContact O-N 2.76Å
117I98.8Very high98.6Very high13 Ų1335 Ų357%0.06720%0.196CC..Hα-helixtrans-66.7-42.6174.4-61.8168.4000110.8W113 N114 I115 L119 L120 L121 L301 A302W113-I117 PolarHBondContact O-N 3.2Å; N114-I117 WeakPolarHBondContact O-CB 3.47Å; N114-I117 PolarHBondContact O-N 2.66Å; I115-I117 VanDerWaalsContact C-N 3.29Å; I115-I117 PolarHBondContact O-N 3.2Å; I117-L119 VanDerWaalsContact C-N 3.33Å; I117-L119 PolarHBondContact O-N 2.9Å; I117-L120 WeakPolarHBondContact O-CB 3.41Å; I117-L120 PolarHBondContact O-N 3.17Å; I117-L121 HydrophobicContact CG2-CD1 4.25Å; I117-L121 WeakPolarHBondContact O-CG 3.42Å; I117-L121 PolarHBondContact O-N 3.08Å; I117-L301 HydrophobicContact CD1-CB 3.82Å; I117-L301 HydrophobicContact CG1-CB 3.96Å; I117-A302 HydrophobicContact CD1-CB 3.9Å
118I98.8Very high98.6Very high87 Ų8736.6 Ų36.645%0.44620%0.203SC..Hα-helixtrans-62.6-42.2176.1-62.6169.1000110.6N114 I115 L121 A122 L192N114-I118 WeakPolarHBondContact O-CG1 3.43Å; N114-I118 PolarHBondContact O-N 3.31Å; N114-I118 VanDerWaalsContact O-N 3.07Å; I115-I118 PolarHBondContact O-N 3.48Å; I118-L121 PolarHBondContact O-N 3.18Å; I118-A122 WeakPolarHBondContact O-CB 3.45Å; I118-A122 PolarHBondContact O-N 3.24Å; I118-L192 HydrophobicContact CG2-CD1 3.88Å; I118-L192 HydrophobicContact CG2-CD2 4.32Å
119L98.9Very high98.6Very high21 Ų2134.2 Ų34.211%0.1119%0.19CC..Hα-helixtrans-59.4-46.8174.2-80167.2000111.5I115 G116 I117 L121 A122 T123 I189 L192 A193 H196I115-L119 HydrophobicContact CG2-CD1 4.15Å; I115-L119 HydrophobicContact CG2-CG 4.37Å; I115-L119 WeakPolarHBondContact O-CB 3.46Å; I115-L119 WeakPolarHBondContact O-CG 2.98Å; I115-L119 PolarHBondContact O-N 2.94Å; G116-L119 WeakPolarHBondContact O-CB 3.4Å; G116-L119 PolarHBondContact O-N 2.85Å; I117-L119 VanDerWaalsContact C-N 3.33Å; I117-L119 PolarHBondContact O-N 2.9Å; L119-L121 PolarHBondContact O-N 3.33Å; L119-A122 PolarHBondContact O-N 3.47Å; L119-T123 PolarHBondContact O-N 3.23Å; L119-T123 PolarHBondContact O-OG1 3.48Å; L119-T123 VanDerWaalsContact O-OG1 3.06Å; L119-I189 HydrophobicContact CD2-CG2 3.82Å; L119-L192 HydrophobicContact CD2-CB 3.55Å; L119-L192 HydrophobicContact CG-CB 4.08Å; L119-A193 HydrophobicContact CD2-CB 4.38Å; L119-H196 HydrophobicContact CD1-CB 3.82Å
120L98.9Very high98.6Very high8 Ų832.6 Ų32.64%0.04219%0.189CC..Hα-helixtrans-55.9-51.3175.5173.464.3000111.1L94 I98 G116 I117 A122 T123 M124 I298 L301L94-L120 HydrophobicContact CD1-CD1 4.15Å; I98-L120 HydrophobicContact CD1-CD1 4.11Å; I98-L120 HydrophobicContact CD1-CD2 3.85Å; I98-L120 HydrophobicContact CD1-CG 4.44Å; G116-L120 PolarHBondContact O-N 2.76Å; I117-L120 WeakPolarHBondContact O-CB 3.41Å; I117-L120 PolarHBondContact O-N 3.17Å; L120-A122 PolarHBondContact O-N 3.36Å; L120-T123 PolarHBondContact O-N 3.44Å; L120-M124 HydrophobicContact CD1-CG 4.15Å; L120-M124 HydrophobicContact CD1-SD 3.95Å; L120-M124 HydrophobicContact CG-CG 4.48Å; L120-M124 HydrophobicContact CG-SD 3.89Å; L120-M124 WeakPolarHBondContact O-CB 3.33Å; L120-M124 WeakPolarHBondContact O-CG 3.35Å; L120-M124 PolarHBondContact O-N 3.37Å; L120-I298 HydrophobicContact CD2-CG2 3.91Å; L120-L301 HydrophobicContact CD2-CD1 3.77Å
121L98.8Very high98.7Very high69 Ų6932.1 Ų32.136%0.36118%0.18SC..Hα-helixtrans-62-41.8179.8-70.6170.1000112.2I117 I118 L119 M124 A125 I298 L299I117-L121 HydrophobicContact CG2-CD1 4.25Å; I117-L121 WeakPolarHBondContact O-CG 3.42Å; I117-L121 PolarHBondContact O-N 3.08Å; I118-L121 PolarHBondContact O-N 3.18Å; L119-L121 PolarHBondContact O-N 3.33Å; L121-M124 PolarHBondContact O-N 2.92Å; L121-A125 WeakPolarHBondContact O-CB 3.48Å; L121-A125 PolarHBondContact O-N 3.23Å; L121-I298 HydrophobicContact CD2-CG2 3.77Å; L121-I298 HydrophobicContact CG-CG2 4.45Å; L121-L299 HydrophobicContact CD1-CD2 4.18Å
122A98.9Very high98.7Very high15 Ų1527.5 Ų27.512%0.12416%0.158CC..Hα-helixtrans-64.7-42.417700000111.8I118 L119 L120 A125 T126 I189I118-A122 WeakPolarHBondContact O-CB 3.45Å; I118-A122 PolarHBondContact O-N 3.24Å; L119-A122 PolarHBondContact O-N 3.47Å; L120-A122 PolarHBondContact O-N 3.36Å; A122-A125 PolarHBondContact O-N 2.9Å; A122-T126 WeakPolarHBondContact O-CB 3.46Å; A122-T126 PolarHBondContact O-N 3.25Å; A122-T126 PolarHBondContact O-OG1 2.98Å; A122-I189 HydrophobicContact CB-CD1 4.14Å; A122-I189 HydrophobicContact CB-CG1 3.72Å
123T98.9Very high98.8Very high11 Ų1127.6 Ų27.67%0.06716%0.158CC..Hα-helixtrans-64.9-42.3174.7-58.10000111.5F90 F91 L94 L119 L120 T126 A127F90-T123 HydrophobicContact CD2-CG2 3.5Å; F90-T123 VanDerWaalsContact CD2-CG2 3.5Å; F90-T123 HydrophobicContact CE2-CG2 3.39Å; F90-T123 HydrophobicContact CG-CG2 4.49Å; F90-T123 HydrophobicContact CZ-CG2 4.34Å; F91-T123 HydrophobicContact CE1-CG2 4.5Å; F91-T123 HydrophobicContact CE2-CG2 4.18Å; F91-T123 HydrophobicContact CZ-CG2 3.91Å; L94-T123 HydrophobicContact CD1-CG2 3.79Å; L119-T123 PolarHBondContact O-N 3.23Å; L119-T123 PolarHBondContact O-OG1 3.48Å; L119-T123 VanDerWaalsContact O-OG1 3.06Å; L120-T123 PolarHBondContact O-N 3.44Å; T123-T126 PolarHBondContact O-N 3.28Å; T123-A127 WeakPolarHBondContact O-CB 3.19Å; T123-A127 PolarHBondContact O-N 2.84Å
124M98.8Very high98.7Very high19 Ų1927.6 Ų27.69%0.09416%0.162CC..Hα-helixtrans-57.9-48.6174.7-73.1177.185.300111.4F91 L120 L121 T126 A127 F128 F274 I298F91-M124 HydrophobicContact CE1-CG 3.82Å; F91-M124 HydrophobicContact CZ-CG 4.17Å; L120-M124 HydrophobicContact CD1-CG 4.15Å; L120-M124 HydrophobicContact CD1-SD 3.95Å; L120-M124 HydrophobicContact CG-CG 4.48Å; L120-M124 HydrophobicContact CG-SD 3.89Å; L120-M124 WeakPolarHBondContact O-CB 3.33Å; L120-M124 WeakPolarHBondContact O-CG 3.35Å; L120-M124 PolarHBondContact O-N 3.37Å; L121-M124 PolarHBondContact O-N 2.92Å; M124-T126 PolarHBondContact O-N 3.37Å; M124-A127 PolarHBondContact O-N 3.46Å; M124-F128 WeakPolarHBondContact O-CB 3.28Å; M124-F128 PolarHBondContact O-N 2.97Å; M124-F274 HydrophobicContact CB-CE1 3.84Å; M124-F274 HydrophobicContact CB-CZ 4.28Å; M124-F274 HydrophobicContact CE-CD1 3.66Å; M124-F274 HydrophobicContact CE-CE1 3.52Å; M124-F274 HydrophobicContact CG-CE1 3.85Å; M124-F274 WeakPolarHBondContact O-CZ 3.23Å; M124-I298 HydrophobicContact CE-CD1 3.42Å; M124-I298 VanDerWaalsContact CE-CD1 3.42Å; M124-I298 HydrophobicContact CE-CG1 4.16Å; M124-I298 HydrophobicContact SD-CD1 3.9Å; M124-I298 HydrophobicContact SD-CG1 4.46Å; M124-I298 HydrophobicContact SD-CG2 4.36Å
125A98.7Very high98.7Very high40 Ų4024.9 Ų24.933%0.33115%0.146SC..Hα-helixtrans-60-45.9175.700000111.8L121 A122 A127 F128 M129 L185L121-A125 WeakPolarHBondContact O-CB 3.48Å; L121-A125 PolarHBondContact O-N 3.23Å; A122-A125 PolarHBondContact O-N 2.9Å; A125-A127 PolarHBondContact O-N 3.38Å; A125-F128 PolarHBondContact O-N 2.57Å; A125-M129 HydrophobicContact CB-CE 4.07Å; A125-M129 WeakPolarHBondContact O-CE 3.28Å; A125-M129 PolarHBondContact O-N 3.4Å; A125-L185 HydrophobicContact CB-CD1 4.33Å
126T98.9Very high98.7Very high13 Ų1324.2 Ų24.28%0.0814%0.143CC..Hα-helixtrans-59.1-49.2179.1-56.30000111.4A122 T123 M124 M129 G130 H182 L185 P186 I189A122-T126 WeakPolarHBondContact O-CB 3.46Å; A122-T126 PolarHBondContact O-N 3.25Å; A122-T126 PolarHBondContact O-OG1 2.98Å; T123-T126 PolarHBondContact O-N 3.28Å; M124-T126 PolarHBondContact O-N 3.37Å; T126-M129 PolarHBondContact O-N 3.45Å; T126-G130 PolarHBondContact O-N 3.01Å; T126-H182 PolarHBondContact O-CE1 2.65Å; T126-H182 PolarHBondContact O-ND1 3.06Å; T126-L185 HydrophobicContact CG2-CB 4.47Å; T126-L185 VanDerWaalsContact OG1-CB 3.23Å; T126-L185 WeakPolarHBondContact OG1-CB 3.35Å; T126-P186 HydrophobicContact CG2-CG 3.88Å; T126-I189 WeakPolarHBondContact OG1-CD1 3.09Å
127A98.8Very high98.7Very high12 Ų1223.6 Ų23.610%0.09913%0.133CC..Hα-helixtrans-67.6-41-178.200000112.4F91 T123 M124 A125 M129 G130 Y131 Y273F91-A127 HydrophobicContact CE2-CB 3.48Å; F91-A127 VanDerWaalsContact CE2-CB 3.48Å; F91-A127 HydrophobicContact CZ-CB 3.84Å; T123-A127 WeakPolarHBondContact O-CB 3.19Å; T123-A127 PolarHBondContact O-N 2.84Å; M124-A127 PolarHBondContact O-N 3.46Å; A125-A127 PolarHBondContact O-N 3.38Å; A127-M129 PolarHBondContact O-N 2.91Å; A127-G130 PolarHBondContact O-N 3.08Å; A127-Y131 WeakPolarHBondContact O-CB 3.23Å; A127-Y131 PolarHBondContact O-N 3.18Å; A127-Y273 HydrophobicContact CB-CE2 4.01Å
128F98.6Very high98.6Very high43 Ų4323 Ų2319%0.18913%0.13CC..Hα-helixtrans-56.6-51.5174.1169.7-103.8000111.2M124 A125 G130 Y131 V132 I146 T147 F178 F274M124-F128 WeakPolarHBondContact O-CB 3.28Å; M124-F128 PolarHBondContact O-N 2.97Å; A125-F128 PolarHBondContact O-N 2.57Å; F128-G130 VanDerWaalsContact C-N 3.35Å; F128-G130 PolarHBondContact O-N 3.27Å; F128-Y131 PolarHBondContact O-N 2.94Å; F128-V132 WeakPolarHBondContact O-CG2 3.49Å; F128-V132 PolarHBondContact O-N 3.1Å; F128-I146 HydrophobicContact CD2-CG2 4.4Å; F128-I146 HydrophobicContact CE2-CB 3.75Å; F128-I146 HydrophobicContact CE2-CG1 4.09Å; F128-I146 HydrophobicContact CE2-CG2 3.73Å; F128-I146 HydrophobicContact CZ-CB 3.98Å; F128-I146 HydrophobicContact CZ-CG2 3.89Å; F128-T147 HydrophobicContact CE1-CG2 4.26Å; F128-T147 HydrophobicContact CZ-CG2 4.14Å; F128-F178 AromaticContact CE1-CE2 3.92Å; F128-F178 HydrophobicContact CE1-CE2 3.92Å; F128-F178 HydrophobicContact CE1-CZ 4.2Å; F128-F178 HydrophobicContact CZ-CE2 4.49Å; F128-F274 HydrophobicContact CB-CE2 4.28Å; F128-F274 HydrophobicContact CB-CZ 4.2Å
129M98.6Very high98.5Very high19 Ų1918.9 Ų18.99%0.09411%0.109CC..Hα-helixtrans-65.7-38.1179.3-72.4179.5-79.400112.4A125 T126 A127 Y131 V132 L133 F178 F181 H182 L185A125-M129 HydrophobicContact CB-CE 4.07Å; A125-M129 WeakPolarHBondContact O-CE 3.28Å; A125-M129 PolarHBondContact O-N 3.4Å; T126-M129 PolarHBondContact O-N 3.45Å; A127-M129 PolarHBondContact O-N 2.91Å; M129-Y131 VanDerWaalsContact C-N 3.28Å; M129-Y131 PolarHBondContact O-N 2.7Å; M129-V132 WeakPolarHBondContact O-CB 3.19Å; M129-V132 PolarHBondContact O-N 3.13Å; M129-V132 VanDerWaalsContact O-N 3.09Å; M129-L133 WeakPolarHBondContact O-CG 3.33Å; M129-F178 HydrophobicContact CB-CB 4.25Å; M129-F178 HydrophobicContact CB-CD2 4.42Å; M129-F178 HydrophobicContact CB-CG 4.35Å; M129-F178 HydrophobicContact CG-CB 4.25Å; M129-F178 HydrophobicContact CG-CD1 4.13Å; M129-F178 HydrophobicContact CG-CD2 4Å; M129-F178 HydrophobicContact CG-CE2 4.38Å; M129-F178 HydrophobicContact CG-CG 3.88Å; M129-F178 HydrophobicContact SD-CD1 4.14Å; M129-F178 HydrophobicContact SD-CG 4.36Å; M129-F181 HydrophobicContact CE-CB 3.96Å; M129-F181 HydrophobicContact SD-CB 3.45Å; M129-F181 WeakPolarHBondContact SD-CB 3.46Å; M129-F181 HydrophobicContact SD-CD2 4.48Å; M129-F181 HydrophobicContact SD-CG 4.31Å; M129-H182 HydrophobicContact CB-CB 4.1Å; M129-L185 HydrophobicContact CE-CD1 3.24Å
130G98.6Very high98.5Very high17 Ų1718.4 Ų18.418%0.17511%0.106CC..Hα-helixtrans-59.7-38.9175.200000112.6T126 A127 F128 V132 L133 P134 H182T126-G130 PolarHBondContact O-N 3.01Å; A127-G130 PolarHBondContact O-N 3.08Å; F128-G130 VanDerWaalsContact C-N 3.35Å; F128-G130 PolarHBondContact O-N 3.27Å; G130-V132 PolarHBondContact O-N 3.23Å; G130-L133 WeakPolarHBondContact O-CB 3.35Å; G130-L133 PolarHBondContact O-N 3.3Å; G130-P134 WeakPolarHBondContact O-CD 3.28Å; G130-H182 WeakPolarHBondContact CA-CE1 3.32Å; G130-H182 VanDerWaalsContact CA-ND1 3.26Å; G130-H182 WeakPolarHBondContact CA-ND1 3.3Å; G130-H182 PolarHBondContact N-ND1 2.72Å
131Y98.6Very high98.5Very high41 Ų4119.7 Ų19.716%0.16111%0.11CC..Hα-helixtrans-68.1-19.4177.2-169.4-105.5000113.5A127 F128 M129 P134 M138 S139 E271A127-Y131 WeakPolarHBondContact O-CB 3.23Å; A127-Y131 PolarHBondContact O-N 3.18Å; F128-Y131 PolarHBondContact O-N 2.94Å; M129-Y131 VanDerWaalsContact C-N 3.28Å; M129-Y131 PolarHBondContact O-N 2.7Å; Y131-P134 WeakPolarHBondContact O-CD 3.41Å; Y131-M138 HydrophobicContact CE1-CB 4.17Å; Y131-S139 VanDerWaalsContact O-CB 3.28Å; Y131-S139 WeakPolarHBondContact O-CB 3.29Å; Y131-S139 PolarHBondContact O-OG 3.41Å; Y131-E271 HydrophobicContact CD1-CG 4.23Å; Y131-E271 HydrophobicContact CD2-CG 3.46Å; Y131-E271 VanDerWaalsContact CD2-CG 3.46Å; Y131-E271 HydrophobicContact CE1-CG 4.16Å; Y131-E271 HydrophobicContact CE2-CG 3.37Å; Y131-E271 WeakPolarHBondContact CE2-OE1 3.26Å; Y131-E271 HydrophobicContact CG-CG 3.87Å; Y131-E271 PolarHBondContact OH-OE1 3.46Å
132V98.6Very high98.3Very high1 Ų116.8 Ų16.81%0.00610%0.098CC..Hα-helixtrans-78.8-27.9175.4-177.50000111.8F128 M129 G130 P134 W135 A143 L175 F178F128-V132 WeakPolarHBondContact O-CG2 3.49Å; F128-V132 PolarHBondContact O-N 3.1Å; M129-V132 WeakPolarHBondContact O-CB 3.19Å; M129-V132 PolarHBondContact O-N 3.13Å; M129-V132 VanDerWaalsContact O-N 3.09Å; G130-V132 PolarHBondContact O-N 3.23Å; V132-P134 VanDerWaalsContact C-CD 3.48Å; V132-W135 HydrophobicContact CG1-CE3 4.18Å; V132-W135 HydrophobicContact CG1-CZ3 3.99Å; V132-W135 PolarHBondContact O-N 3.11Å; V132-A143 HydrophobicContact CG1-CB 4.05Å; V132-A143 HydrophobicContact CG2-CB 3.76Å; V132-L175 HydrophobicContact CG1-CD1 4.36Å; V132-F178 HydrophobicContact CB-CD2 3.93Å; V132-F178 HydrophobicContact CG1-CD2 3.97Å; V132-F178 HydrophobicContact CG1-CE2 4.5Å; V132-F178 HydrophobicContact CG2-CD2 3.88Å; V132-F178 HydrophobicContact CG2-CE2 4.04Å
133L98.8Very high98.2Very high17 Ų1716.1 Ų16.19%0.0899%0.092CC..THydrogen-bonded Turntrans-59.4-35.3-171.6-55-174.6000115.3Y55 M129 G130 W135 L175 F178 F179 H182Y55-L133 HydrophobicContact CE1-CB 4.42Å; Y55-L133 HydrophobicContact CE2-CB 4.41Å; Y55-L133 WeakPolarHBondContact CE2-O 3.36Å; Y55-L133 WeakPolarHBondContact OH-CA 3.28Å; Y55-L133 PolarHBondContact OH-O 3.37Å; M129-L133 WeakPolarHBondContact O-CG 3.33Å; G130-L133 WeakPolarHBondContact O-CB 3.35Å; G130-L133 PolarHBondContact O-N 3.3Å; L133-W135 PolarHBondContact O-N 2.96Å; L133-L175 HydrophobicContact CD2-CD1 4.01Å; L133-F178 HydrophobicContact CD2-CB 4.48Å; L133-F179 HydrophobicContact CD1-CD2 4.04Å; L133-F179 HydrophobicContact CD2-CB 3.91Å; L133-H182 HydrophobicContact CD1-CB 4.29Å
134P98.5Very high98.1Very high25 Ų2517 Ų1716%0.16210%0.098CC..THydrogen-bonded Turntrans-64-17.8175.8-24.635.7000115.1F63 I66 G130 Y131 V132 G136F63-P134 WeakPolarHBondContact CA-O 3.31Å; F63-P134 WeakPolarHBondContact CD2-O 3.32Å; I66-P134 HydrophobicContact CG1-CB 4.4Å; G130-P134 WeakPolarHBondContact O-CD 3.28Å; Y131-P134 WeakPolarHBondContact O-CD 3.41Å; V132-P134 VanDerWaalsContact C-CD 3.48Å; P134-G136 VanDerWaalsContact C-N 3.25Å; P134-G136 PolarHBondContact O-N 3.19Å
135W98.5Very high98Very high13 Ų1318.8 Ų18.85%0.04911%0.109CC..  trans56.735.6176.7-151.4-111.6000114.4A59 A62 F63 V132 L133 F140 V170 L175 A259A59-W135 HydrophobicContact CB-CZ2 3.71Å; A59-W135 PolarHBondContact O-NE1 3.41Å; A62-W135 HydrophobicContact CB-CB 3.88Å; A62-W135 HydrophobicContact CB-CG 4.41Å; F63-W135 HydrophobicContact CB-CB 4.45Å; V132-W135 HydrophobicContact CG1-CE3 4.18Å; V132-W135 HydrophobicContact CG1-CZ3 3.99Å; V132-W135 PolarHBondContact O-N 3.11Å; L133-W135 PolarHBondContact O-N 2.96Å; W135-F140 HydrophobicContact CH2-CD2 4.06Å; W135-F140 AromaticContact CZ2-CD2 3.92Å; W135-F140 HydrophobicContact CZ2-CD2 3.92Å; W135-F140 HydrophobicContact CZ2-CE2 4.33Å; W135-V170 HydrophobicContact CH2-CG1 3.7Å; W135-V170 HydrophobicContact CZ3-CG1 4.02Å; W135-L175 HydrophobicContact CD2-CD2 3.88Å; W135-L175 HydrophobicContact CE3-CB 4.31Å; W135-L175 HydrophobicContact CE3-CD1 3.66Å; W135-L175 HydrophobicContact CE3-CD2 3.71Å; W135-L175 HydrophobicContact CE3-CG 4.11Å; W135-L175 HydrophobicContact CG-CD2 4.29Å; W135-L175 HydrophobicContact CH2-CB 4.23Å; W135-L175 HydrophobicContact CZ3-CB 3.86Å; W135-L175 HydrophobicContact CZ3-CD1 3.88Å; W135-L175 HydrophobicContact CZ3-CD2 4.09Å; W135-L175 HydrophobicContact CZ3-CG 4.17Å; W135-A259 HydrophobicContact CG-CB 4.42Å; W135-A259 WeakPolarHBondContact O-CB 3.19Å; W135-A259 PolarHBondContact O-N 2.98Å; W135-A259 VanDerWaalsContact O-N 3.12Å
136G98.3Very high97.9Very high0 Ų019 Ų190%011%0.105CC..BIsolated β-bridgetrans-85.5-179.1168.900000112.7P134 M138 S139 F140 N255 T257P134-G136 VanDerWaalsContact C-N 3.25Å; P134-G136 PolarHBondContact O-N 3.19Å; G136-M138 PolarHBondContact O-N 3.42Å; G136-S139 WeakPolarHBondContact O-CB 3.28Å; G136-S139 PolarHBondContact O-N 2.82Å; G136-F140 PolarHBondContact O-N 2.99Å; G136-N255 VanDerWaalsContact C-OD1 3.28Å; G136-N255 VanDerWaalsContact CA-OD1 3.24Å; G136-N255 WeakPolarHBondContact CA-OD1 3.41Å; G136-T257 CarbonylContact C-O 3.25Å; G136-T257 WeakPolarHBondContact CA-O 3.16Å
137Q98Very high97.8Very high11 Ų1118.9 Ų18.95%0.05110%0.104CC..Hα-helixtrans-59.1-49-178.6-73.5-78.860.800112.8F140 W141 D254 T257 N263 P265Q137-F140 PolarHBondContact O-N 3.47Å; Q137-W141 WeakPolarHBondContact O-CB 3.45Å; Q137-W141 PolarHBondContact O-N 3.42Å; Q137-D254 HydrophobicContact CB-CB 4.44Å; Q137-D254 WeakPolarHBondContact CB-O 3.28Å; Q137-T257 HydrophobicContact CG-CG2 4.05Å; Q137-T257 PolarHBondContact N-O 3.38Å; Q137-N263 PolarHBondContact NE2-O 3.42Å; Q137-P265 HydrophobicContact CB-CG 3.87Å
138M97.2Very high97.7Very high2 Ų221.4 Ų21.41%0.0112%0.115CC..Hα-helixtrans-68.1-36.6179.6-70.3-6316500112.1Y131 G136 G142 D252 D254 N255 P265Y131-M138 HydrophobicContact CE1-CB 4.17Å; G136-M138 PolarHBondContact O-N 3.42Å; M138-G142 WeakPolarHBondContact O-CA 3.44Å; M138-G142 PolarHBondContact O-N 3.42Å; M138-D252 HydrophobicContact CG-CB 4.09Å; M138-D254 HydrophobicContact CE-CB 3.53Å; M138-D254 WeakPolarHBondContact CE-OD2 3.46Å; M138-D254 HydrophobicContact CG-CB 3.81Å; M138-N255 HydrophobicContact CB-CB 4.18Å; M138-N255 PolarHBondContact N-OD1 2.84Å; M138-P265 HydrophobicContact CE-CB 3.53Å; M138-P265 HydrophobicContact CE-CG 4.05Å
139S97.4Very high97.5Very high0 Ų020.6 Ų20.60%011%0.113CC..Hα-helixtrans-55.6-54.1172.2-66.10000112Y131 G136 A143 N255Y131-S139 VanDerWaalsContact O-CB 3.28Å; Y131-S139 WeakPolarHBondContact O-CB 3.29Å; Y131-S139 PolarHBondContact O-OG 3.41Å; G136-S139 WeakPolarHBondContact O-CB 3.28Å; G136-S139 PolarHBondContact O-N 2.82Å; S139-A143 VanDerWaalsContact O-CB 3.31Å; S139-A143 WeakPolarHBondContact O-CB 3.42Å; S139-A143 PolarHBondContact O-N 2.98Å; S139-N255 PolarHBondContact N-OD1 3.18Å; S139-N255 PolarHBondContact OG-ND2 2.84Å; S139-N255 PolarHBondContact OG-OD1 2.84Å
140F98.1Very high97.3Very high11 Ų1122.6 Ų22.65%0.04812%0.124CC..Hα-helixtrans-68.8-49.7-175.7175-91000112.6W135 G136 Q137 A143 T144 V170 A259 P261W135-F140 HydrophobicContact CH2-CD2 4.06Å; W135-F140 AromaticContact CZ2-CD2 3.92Å; W135-F140 HydrophobicContact CZ2-CD2 3.92Å; W135-F140 HydrophobicContact CZ2-CE2 4.33Å; G136-F140 PolarHBondContact O-N 2.99Å; Q137-F140 PolarHBondContact O-N 3.47Å; F140-A143 PolarHBondContact O-N 3.4Å; F140-T144 WeakPolarHBondContact O-CB 3.28Å; F140-T144 PolarHBondContact O-N 3.49Å; F140-T144 PolarHBondContact O-OG1 3.47Å; F140-V170 HydrophobicContact CD2-CG1 4.1Å; F140-V170 HydrophobicContact CE2-CB 4.12Å; F140-V170 HydrophobicContact CE2-CG1 4.14Å; F140-V170 VanDerWaalsContact CE2-O 3.3Å; F140-V170 WeakPolarHBondContact CE2-O 3.39Å; F140-A259 HydrophobicContact CB-CB 3.52Å; F140-A259 HydrophobicContact CD2-CB 4.29Å; F140-A259 HydrophobicContact CG-CB 3.94Å; F140-P261 HydrophobicContact CE1-CB 4.13Å; F140-P261 HydrophobicContact CE1-CG 4.3Å; F140-P261 HydrophobicContact CE2-CG 4.23Å; F140-P261 HydrophobicContact CZ-CB 3.86Å; F140-P261 HydrophobicContact CZ-CG 3.82Å
141W98.3Very high97.2Very high34 Ų3423.2 Ų23.213%0.12913%0.125CC..Hα-helixtrans-72.1-35.4-177.6-73.6106.4000111.9Q137 T144 V145 N260 P261 N263 T264 P265 I268Q137-W141 WeakPolarHBondContact O-CB 3.45Å; Q137-W141 PolarHBondContact O-N 3.42Å; W141-T144 PolarHBondContact O-N 3.47Å; W141-V145 WeakPolarHBondContact O-CB 3.46Å; W141-V145 WeakPolarHBondContact O-CG2 3.16Å; W141-V145 PolarHBondContact O-N 3.42Å; W141-N260 PolarHBondContact NE1-O 3.07Å; W141-P261 WeakPolarHBondContact CH2-O 3.34Å; W141-P261 WeakPolarHBondContact CZ2-O 3.47Å; W141-N263 PolarHBondContact NE1-O 3.3Å; W141-N263 VanDerWaalsContact NE1-O 3.1Å; W141-T264 HydrophobicContact CD2-CG2 4.16Å; W141-T264 HydrophobicContact CE3-CG2 4.17Å; W141-T264 HydrophobicContact CH2-CG2 4.48Å; W141-T264 VanDerWaalsContact CH2-OG1 3.28Å; W141-T264 WeakPolarHBondContact CH2-OG1 3.35Å; W141-T264 HydrophobicContact CZ2-CG2 4.46Å; W141-T264 WeakPolarHBondContact CZ2-OG1 3.47Å; W141-T264 HydrophobicContact CZ3-CG2 4.34Å; W141-P265 HydrophobicContact CG-CG 4.38Å; W141-I268 HydrophobicContact CB-CD1 3.76Å; W141-I268 HydrophobicContact CB-CG1 3.92Å; W141-I268 HydrophobicContact CB-CG2 4.13Å; W141-I268 HydrophobicContact CD2-CD1 4.35Å; W141-I268 HydrophobicContact CE3-CD1 4.24Å; W141-I268 HydrophobicContact CG-CD1 4.19Å
142G95.8Very high97.1Very high9 Ų922.1 Ų22.19%0.09313%0.125CC..Hα-helixtrans-59.6-48.1170.100000111.7M138 T144 V145 I146M138-G142 WeakPolarHBondContact O-CA 3.44Å; M138-G142 PolarHBondContact O-N 3.42Å; G142-T144 VanDerWaalsContact C-N 3.35Å; G142-T144 PolarHBondContact O-N 3.31Å; G142-V145 PolarHBondContact O-N 3.23Å; G142-I146 WeakPolarHBondContact O-CB 3.29Å; G142-I146 VanDerWaalsContact O-CG1 3.25Å; G142-I146 WeakPolarHBondContact O-CG1 3.48Å; G142-I146 PolarHBondContact O-N 3.21Å
143A96.8Very high97Very high1 Ų124.4 Ų24.41%0.00814%0.139CC..Hα-helixtrans-57.3-48.8175.100000111.6V132 S139 F140 T147 V170V132-A143 HydrophobicContact CG1-CB 4.05Å; V132-A143 HydrophobicContact CG2-CB 3.76Å; S139-A143 VanDerWaalsContact O-CB 3.31Å; S139-A143 WeakPolarHBondContact O-CB 3.42Å; S139-A143 PolarHBondContact O-N 2.98Å; F140-A143 PolarHBondContact O-N 3.4Å; A143-T147 WeakPolarHBondContact O-CB 3.4Å; A143-T147 WeakPolarHBondContact O-CG2 3.41Å; A143-T147 PolarHBondContact O-N 2.9Å; A143-T147 PolarHBondContact O-OG1 3.39Å; A143-V170 HydrophobicContact CB-CG1 4.2Å; A143-V170 HydrophobicContact CB-CG2 4.29Å
144T97.3Very high96.8Very high30 Ų3027.1 Ų27.118%0.18416%0.158CC..Hα-helixtrans-59.4-49.5-178.9-60.40000111.8F140 W141 G142 N148F140-T144 WeakPolarHBondContact O-CB 3.28Å; F140-T144 PolarHBondContact O-N 3.49Å; F140-T144 PolarHBondContact O-OG1 3.47Å; W141-T144 PolarHBondContact O-N 3.47Å; G142-T144 VanDerWaalsContact C-N 3.35Å; G142-T144 PolarHBondContact O-N 3.31Å; T144-N148 WeakPolarHBondContact O-CB 3.49Å; T144-N148 PolarHBondContact O-N 2.79Å
145V96.5Very high96.7Very high55 Ų5537 Ų3733%0.33319%0.193SC..Hα-helixtrans-67.1-50.1-178.2171.40000111.2W141 G142 N148 L149 I268W141-V145 WeakPolarHBondContact O-CB 3.46Å; W141-V145 WeakPolarHBondContact O-CG2 3.16Å; W141-V145 PolarHBondContact O-N 3.42Å; G142-V145 PolarHBondContact O-N 3.23Å; V145-N148 PolarHBondContact O-N 2.96Å; V145-L149 PolarHBondContact O-N 3.38Å; V145-I268 HydrophobicContact CG2-CD1 4.15Å; V145-I268 HydrophobicContact CG2-CG2 4.33Å
146I95.6Very high96.7Very high46 Ų4641.3 Ų41.324%0.23622%0.216CC..Hα-helixtrans-68.8-44.5-173-63.5-61.5000111.6F128 G142 N148 L149F128-I146 HydrophobicContact CD2-CG2 4.4Å; F128-I146 HydrophobicContact CE2-CB 3.75Å; F128-I146 HydrophobicContact CE2-CG1 4.09Å; F128-I146 HydrophobicContact CE2-CG2 3.73Å; F128-I146 HydrophobicContact CZ-CB 3.98Å; F128-I146 HydrophobicContact CZ-CG2 3.89Å; G142-I146 WeakPolarHBondContact O-CB 3.29Å; G142-I146 VanDerWaalsContact O-CG1 3.25Å; G142-I146 WeakPolarHBondContact O-CG1 3.48Å; G142-I146 PolarHBondContact O-N 3.21Å; I146-N148 VanDerWaalsContact C-N 3.33Å; I146-N148 PolarHBondContact O-N 3.19Å; I146-L149 HydrophobicContact CD1-CD1 4.19Å; I146-L149 WeakPolarHBondContact O-CB 3.48Å; I146-L149 WeakPolarHBondContact O-CG 3.36Å; I146-L149 PolarHBondContact O-N 3.36Å
147T96.8Very high96.6Very high10 Ų1041.4 Ų41.46%0.06122%0.217CC..Hα-helixtrans-67.9-35.3178.455.30000111.9F128 A143 L149 L150 I164 W165 F178F128-T147 HydrophobicContact CE1-CG2 4.26Å; F128-T147 HydrophobicContact CZ-CG2 4.14Å; A143-T147 WeakPolarHBondContact O-CB 3.4Å; A143-T147 WeakPolarHBondContact O-CG2 3.41Å; A143-T147 PolarHBondContact O-N 2.9Å; A143-T147 PolarHBondContact O-OG1 3.39Å; T147-L149 PolarHBondContact O-N 3.32Å; T147-L149 VanDerWaalsContact O-N 3.13Å; T147-L150 WeakPolarHBondContact O-CB 3.4Å; T147-L150 PolarHBondContact O-N 3.24Å; T147-L150 VanDerWaalsContact O-N 3.11Å; T147-I164 HydrophobicContact CG2-CG2 4.36Å; T147-W165 PolarHBondContact OG1-NE1 3.19Å; T147-F178 HydrophobicContact CG2-CZ 4.02Å
148N97Very high96.6Very high64 Ų6445 Ų4534%0.34224%0.24SC..G310 helixtrans-68.7-7.8176.1-169.334.8000113.6T144 V145 I146 L150 S151 W165 K287T144-N148 WeakPolarHBondContact O-CB 3.49Å; T144-N148 PolarHBondContact O-N 2.79Å; V145-N148 PolarHBondContact O-N 2.96Å; I146-N148 VanDerWaalsContact C-N 3.33Å; I146-N148 PolarHBondContact O-N 3.19Å; N148-L150 PolarHBondContact O-N 3.1Å; N148-S151 PolarHBondContact O-N 3.31Å; N148-S151 PolarHBondContact O-OG 3.19Å; N148-S151 PolarHBondContact OD1-OG 3.11Å; N148-W165 HydrophobicContact CB-CH2 4.33Å; N148-W165 HydrophobicContact CB-CZ2 4.12Å; N148-K287 PolarHBondContact O-NZ 2.81Å
149L94.8Very high96.6Very high26 Ų2650 Ų5014%0.13627%0.267CS..G310 helixtrans-61.1-31.4168.6-66.8179.5000111.6V145 I146 T147 S151 A152 L281 V291V145-L149 PolarHBondContact O-N 3.38Å; I146-L149 HydrophobicContact CD1-CD1 4.19Å; I146-L149 WeakPolarHBondContact O-CB 3.48Å; I146-L149 WeakPolarHBondContact O-CG 3.36Å; I146-L149 PolarHBondContact O-N 3.36Å; T147-L149 PolarHBondContact O-N 3.32Å; T147-L149 VanDerWaalsContact O-N 3.13Å; L149-S151 PolarHBondContact O-N 3.48Å; L149-A152 VanDerWaalsContact O-CB 3.27Å; L149-A152 WeakPolarHBondContact O-CB 3.25Å; L149-A152 PolarHBondContact O-N 3.26Å; L149-A152 VanDerWaalsContact O-N 3.1Å; L149-L281 HydrophobicContact CD1-CD1 4.37Å; L149-L281 HydrophobicContact CD1-CD2 3.68Å; L149-L281 HydrophobicContact CD2-CD1 4.23Å; L149-L281 HydrophobicContact CD2-CD2 4.15Å; L149-V291 HydrophobicContact CB-CG2 4Å; L149-V291 HydrophobicContact CD2-CG2 4.3Å
150L94.3Very high96.6Very high61 Ų6152.6 Ų52.632%0.31928%0.28SS..G310 helixtrans-66.2-20.6179.5-66.6173.5000113.6T147 N148 A152 T153 G157 L160 V161 I164T147-L150 WeakPolarHBondContact O-CB 3.4Å; T147-L150 PolarHBondContact O-N 3.24Å; T147-L150 VanDerWaalsContact O-N 3.11Å; N148-L150 PolarHBondContact O-N 3.1Å; L150-A152 PolarHBondContact O-N 2.91Å; L150-A152 VanDerWaalsContact O-N 3.13Å; L150-T153 VanDerWaalsContact O-CB 3.28Å; L150-T153 WeakPolarHBondContact O-CB 3.22Å; L150-T153 PolarHBondContact O-N 3.08Å; L150-T153 PolarHBondContact O-OG1 3.47Å; L150-G157 WeakPolarHBondContact O-CA 3.14Å; L150-L160 HydrophobicContact CB-CD2 4.12Å; L150-L160 HydrophobicContact CD1-CD2 4.2Å; L150-L160 HydrophobicContact CD1-CG 4.43Å; L150-L160 HydrophobicContact CD2-CD2 4.34Å; L150-L160 HydrophobicContact CG-CD2 4.46Å; L150-V161 HydrophobicContact CB-CG2 3.85Å; L150-I164 HydrophobicContact CD1-CD1 3.24Å
151S96.3Very high96.6Very high30 Ų3052.2 Ų52.221%0.2128%0.279CS..G310 helixtrans-66.2-11.6173.863.60000113.4N148 L149 T153 K287N148-S151 PolarHBondContact O-N 3.31Å; N148-S151 PolarHBondContact O-OG 3.19Å; N148-S151 PolarHBondContact OD1-OG 3.11Å; L149-S151 PolarHBondContact O-N 3.48Å; S151-T153 PolarHBondContact O-N 3.43Å; S151-K287 PolarHBondContact OG-NZ 3.32Å
152A96Very high96.6Very high18 Ų1854 Ų5415%0.14929%0.289CS..G310 helixtrans-70.8-15170.400000113.2L149 L150 P154 K287 L288 V291L149-A152 VanDerWaalsContact O-CB 3.27Å; L149-A152 WeakPolarHBondContact O-CB 3.25Å; L149-A152 PolarHBondContact O-N 3.26Å; L149-A152 VanDerWaalsContact O-N 3.1Å; L150-A152 PolarHBondContact O-N 2.91Å; L150-A152 VanDerWaalsContact O-N 3.13Å; A152-P154 WeakPolarHBondContact O-CD 3.34Å; A152-K287 HydrophobicContact CB-CD 4.03Å; A152-K287 HydrophobicContact CB-CG 3.95Å; A152-L288 HydrophobicContact CB-CB 4.27Å; A152-L288 HydrophobicContact CB-CD1 4.37Å; A152-V291 HydrophobicContact CB-CG2 4.01Å
153T96.1Very high96.7Very high49 Ų4962.6 Ų62.630%0.30132%0.318SS..SBendtrans-65.1122.8178.5-51.20000109.9L150 S151 I156 G157L150-T153 VanDerWaalsContact O-CB 3.28Å; L150-T153 WeakPolarHBondContact O-CB 3.22Å; L150-T153 PolarHBondContact O-N 3.08Å; L150-T153 PolarHBondContact O-OG1 3.47Å; S151-T153 PolarHBondContact O-N 3.43Å; T153-I156 HydrophobicContact CG2-CD1 4.21Å; T153-I156 HydrophobicContact CG2-CG1 3.78Å; T153-G157 VanDerWaalsContact O-CA 3.31Å; T153-G157 WeakPolarHBondContact O-CA 3.46Å; T153-G157 PolarHBondContact O-N 3.43Å
154P96.1Very high96.7Very high75 Ų7564.1 Ų64.149%0.48733%0.326SS..THydrogen-bonded Turntrans-57.3142.2179.8-25.634.9000112.3A152 I156 L288A152-P154 WeakPolarHBondContact O-CD 3.34Å; P154-I156 PolarHBondContact O-N 3.43Å; P154-L288 HydrophobicContact CG-CD2 4.42Å
155Y96.3Very high96.8Very high233 Ų23363.9 Ų63.991%0.91432%0.322SS*.THydrogen-bonded Turntrans68-50.4177-46.4-70.1000116
156I97.6Very high96.8Very high102 Ų10263 Ų6352%0.52332%0.324SS..THydrogen-bonded Turntrans-105.4-2.4-170.762.8169.2000114.3T153 P154 T158 D159 L160T153-I156 HydrophobicContact CG2-CD1 4.21Å; T153-I156 HydrophobicContact CG2-CG1 3.78Å; P154-I156 PolarHBondContact O-N 3.43Å; I156-T158 PolarHBondContact O-N 3.12Å; I156-D159 PolarHBondContact O-N 2.9Å; I156-L160 WeakPolarHBondContact O-CB 3.44Å; I156-L160 PolarHBondContact O-N 2.87Å
157G97.1Very high96.9Very high3 Ų362.2 Ų62.23%0.03133%0.327CS..Hα-helixtrans-60.1-46.2-168.200000114.4L150 T153 L160 V161L150-G157 WeakPolarHBondContact O-CA 3.14Å; T153-G157 VanDerWaalsContact O-CA 3.31Å; T153-G157 WeakPolarHBondContact O-CA 3.46Å; T153-G157 PolarHBondContact O-N 3.43Å; G157-L160 PolarHBondContact O-N 3.19Å; G157-V161 WeakPolarHBondContact O-CG2 3.44Å; G157-V161 PolarHBondContact O-N 2.98Å; G157-V161 VanDerWaalsContact O-N 3.11Å
158T96.6Very high96.9Very high85 Ų8571.2 Ų71.252%0.52136%0.361SS..Hα-helixtrans-64.6-45.2-179.5-54.70000111.5I156 L160 V161 Q162I156-T158 PolarHBondContact O-N 3.12Å; T158-L160 VanDerWaalsContact C-N 3.31Å; T158-L160 PolarHBondContact O-N 3.12Å; T158-V161 PolarHBondContact O-N 3.13Å; T158-Q162 PolarHBondContact O-N 2.77Å
159D98.1Very high96.8Very high108 Ų10871.2 Ų71.258%0.57837%0.366SS*.Hα-helixtrans-63.3-39.8178.8-62-19.1000111I156 V161 Q162 W163I156-D159 PolarHBondContact O-N 2.9Å; D159-V161 PolarHBondContact O-N 3.36Å; D159-Q162 PolarHBondContact O-N 2.87Å; D159-W163 WeakPolarHBondContact O-CB 3.33Å; D159-W163 PolarHBondContact O-N 2.73Å
160L97.5Very high97Very high54 Ų5470.1 Ų70.128%0.28336%0.361SS..Hα-helixtrans-62-43.4176.7-176.463.7000111.9L150 I156 G157 T158 W163 I164L150-L160 HydrophobicContact CB-CD2 4.12Å; L150-L160 HydrophobicContact CD1-CD2 4.2Å; L150-L160 HydrophobicContact CD1-CG 4.43Å; L150-L160 HydrophobicContact CD2-CD2 4.34Å; L150-L160 HydrophobicContact CG-CD2 4.46Å; I156-L160 WeakPolarHBondContact O-CB 3.44Å; I156-L160 PolarHBondContact O-N 2.87Å; G157-L160 PolarHBondContact O-N 3.19Å; T158-L160 VanDerWaalsContact C-N 3.31Å; T158-L160 PolarHBondContact O-N 3.12Å; L160-W163 HydrophobicContact CD1-CE3 4.39Å; L160-W163 PolarHBondContact O-N 3.27Å; L160-I164 HydrophobicContact CD1-CD1 4.37Å; L160-I164 HydrophobicContact CG-CD1 4.2Å; L160-I164 VanDerWaalsContact O-CG1 3.29Å; L160-I164 WeakPolarHBondContact O-CG1 3.43Å; L160-I164 PolarHBondContact O-N 3.16Å
161V98Very high97.1Very high4 Ų471.1 Ų71.12%0.02437%0.366CS..Hα-helixtrans-65.1-49.5178171.80000111L150 G157 T158 D159 W163 I164 W165L150-V161 HydrophobicContact CB-CG2 3.85Å; G157-V161 WeakPolarHBondContact O-CG2 3.44Å; G157-V161 PolarHBondContact O-N 2.98Å; G157-V161 VanDerWaalsContact O-N 3.11Å; T158-V161 PolarHBondContact O-N 3.13Å; D159-V161 PolarHBondContact O-N 3.36Å; V161-W163 VanDerWaalsContact C-N 3.27Å; V161-W163 PolarHBondContact O-N 3.44Å; V161-I164 PolarHBondContact O-N 2.58Å; V161-I164 VanDerWaalsContact O-N 3.16Å; V161-W165 HydrophobicContact CG1-CD2 3.63Å; V161-W165 VanDerWaalsContact CG1-CE2 3.44Å; V161-W165 HydrophobicContact CG1-CE3 3.68Å; V161-W165 HydrophobicContact CG1-CG 4.46Å; V161-W165 HydrophobicContact CG1-CH2 3.47Å; V161-W165 VanDerWaalsContact CG1-CH2 3.47Å; V161-W165 HydrophobicContact CG1-CZ2 3.39Å; V161-W165 HydrophobicContact CG1-CZ3 3.61Å; V161-W165 PolarHBondContact O-N 3.13Å
162Q98Very high97.1Very high70 Ų7070.8 Ų70.833%0.32736%0.364SS..Hα-helixtrans-63.9-35.1178.7-69.6-178.5-2.700112T158 D159 W165 G166 G167T158-Q162 PolarHBondContact O-N 2.77Å; D159-Q162 PolarHBondContact O-N 2.87Å; Q162-W165 PolarHBondContact O-N 3.23Å; Q162-G166 WeakPolarHBondContact O-CA 3.48Å; Q162-G166 PolarHBondContact O-N 2.94Å; Q162-G167 WeakPolarHBondContact CA-O 3.45Å; Q162-G167 PolarHBondContact O-N 3.32Å
163W98.2Very high97.2Very high190 Ų19072.7 Ų72.772%0.7238%0.375SS*.Hα-helixtrans-64-44.5173.3-17979.3000111.6D159 L160 V161 W165 G166 R177D159-W163 WeakPolarHBondContact O-CB 3.33Å; D159-W163 PolarHBondContact O-N 2.73Å; L160-W163 HydrophobicContact CD1-CE3 4.39Å; L160-W163 PolarHBondContact O-N 3.27Å; V161-W163 VanDerWaalsContact C-N 3.27Å; V161-W163 PolarHBondContact O-N 3.44Å; W163-W165 VanDerWaalsContact C-N 3.34Å; W163-G166 PolarHBondContact O-N 3.47Å; W163-R177 PolarHBondContact O-NH1 3.35Å
164I97.3Very high97.3Very high33 Ų3370.4 Ų70.417%0.16936%0.361CS..Hα-helixtrans-64.3-38175.3-71.8167.9000111.4T147 L150 L160 V161 R177 F178T147-I164 HydrophobicContact CG2-CG2 4.36Å; L150-I164 HydrophobicContact CD1-CD1 3.24Å; L160-I164 HydrophobicContact CD1-CD1 4.37Å; L160-I164 HydrophobicContact CG-CD1 4.2Å; L160-I164 VanDerWaalsContact O-CG1 3.29Å; L160-I164 WeakPolarHBondContact O-CG1 3.43Å; L160-I164 PolarHBondContact O-N 3.16Å; V161-I164 PolarHBondContact O-N 2.58Å; V161-I164 VanDerWaalsContact O-N 3.16Å; I164-R177 WeakPolarHBondContact O-CD 3.46Å; I164-R177 PolarHBondContact O-NE 3.42Å; I164-R177 PolarHBondContact O-NH1 2.92Å; I164-F178 HydrophobicContact CG2-CE1 4.23Å; I164-F178 HydrophobicContact CG2-CZ 4.4Å
165W98.3Very high97.4Very high25 Ų2566.8 Ų66.810%0.09534%0.338CS..Hα-helixtrans-74.2-33.6177.4-66.7-16.3000112.7T147 N148 V161 Q162 W163 G167 Y168 S169 V170 T174T147-W165 PolarHBondContact OG1-NE1 3.19Å; N148-W165 HydrophobicContact CB-CH2 4.33Å; N148-W165 HydrophobicContact CB-CZ2 4.12Å; V161-W165 HydrophobicContact CG1-CD2 3.63Å; V161-W165 VanDerWaalsContact CG1-CE2 3.44Å; V161-W165 HydrophobicContact CG1-CE3 3.68Å; V161-W165 HydrophobicContact CG1-CG 4.46Å; V161-W165 HydrophobicContact CG1-CH2 3.47Å; V161-W165 VanDerWaalsContact CG1-CH2 3.47Å; V161-W165 HydrophobicContact CG1-CZ2 3.39Å; V161-W165 HydrophobicContact CG1-CZ3 3.61Å; V161-W165 PolarHBondContact O-N 3.13Å; Q162-W165 PolarHBondContact O-N 3.23Å; W163-W165 VanDerWaalsContact C-N 3.34Å; W165-G167 VanDerWaalsContact C-N 3.32Å; W165-Y168 VanDerWaalsContact CZ3-O 3.25Å; W165-Y168 WeakPolarHBondContact CZ3-O 3.41Å; W165-S169 VanDerWaalsContact CE3-CA 3.48Å; W165-V170 HydrophobicContact CD2-CG2 4.38Å; W165-V170 HydrophobicContact CG-CG2 4.35Å; W165-V170 HydrophobicContact CZ2-CG2 4.32Å; W165-T174 WeakPolarHBondContact CA-OG1 3.49Å; W165-T174 PolarHBondContact O-N 3.3Å; W165-T174 PolarHBondContact O-OG1 3.28Å
166G97.4Very high97.5Very high37 Ų3758.7 Ų58.738%0.38131%0.312SS..THydrogen-bonded Turntrans74.427-168.800000113.1Q162 W163Q162-G166 WeakPolarHBondContact O-CA 3.48Å; Q162-G166 PolarHBondContact O-N 2.94Å; W163-G166 PolarHBondContact O-N 3.47Å
167G96.4Very high97.6Very high29 Ų2957.2 Ų57.230%0.29930%0.3SS..SBendtrans171.6-165.6-171.700000110.8Q162 W165Q162-G167 WeakPolarHBondContact CA-O 3.45Å; Q162-G167 PolarHBondContact O-N 3.32Å; W165-G167 VanDerWaalsContact C-N 3.32Å
168Y97Very high97.6Very high199 Ų19957.6 Ų57.678%0.7830%0.301SS*.SBendtrans-90-11.1-176.2-59-71.6000114.2W165W165-Y168 VanDerWaalsContact CZ3-O 3.25Å; W165-Y168 WeakPolarHBondContact CZ3-O 3.41Å
169S96.4Very high97.7Very high64 Ų6455.6 Ų55.645%0.44829%0.285SS..SBendtrans-150.3167.9177.657.30000109.8W165 D171W165-S169 VanDerWaalsContact CE3-CA 3.48Å; S169-D171 PolarHBondContact O-N 2.93Å
170V97.8Very high97.8Very high3 Ų354.3 Ų54.32%0.01828%0.282CS..SBendtrans-61.5123.4166.8175.60000108.7W135 F140 A143 W165 T174W135-V170 HydrophobicContact CH2-CG1 3.7Å; W135-V170 HydrophobicContact CZ3-CG1 4.02Å; F140-V170 HydrophobicContact CD2-CG1 4.1Å; F140-V170 HydrophobicContact CE2-CB 4.12Å; F140-V170 HydrophobicContact CE2-CG1 4.14Å; F140-V170 VanDerWaalsContact CE2-O 3.3Å; F140-V170 WeakPolarHBondContact CE2-O 3.39Å; A143-V170 HydrophobicContact CB-CG1 4.2Å; A143-V170 HydrophobicContact CB-CG2 4.29Å; W165-V170 HydrophobicContact CD2-CG2 4.38Å; W165-V170 HydrophobicContact CG-CG2 4.35Å; W165-V170 HydrophobicContact CZ2-CG2 4.32Å; V170-T174 HydrophobicContact CG1-CG2 4.2Å
171D96.9Very high97.8Very high82 Ų8257 Ų5744%0.43929%0.291SS..SBendtrans-158.3-170.1-178.5-1634.5000110.7S169 P173 T174 L175S169-D171 PolarHBondContact O-N 2.93Å; D171-P173 VanDerWaalsContact C-CD 3.45Å; D171-P173 VanDerWaalsContact C-N 3.33Å; D171-T174 PolarHBondContact N-OG1 3.37Å; D171-T174 WeakPolarHBondContact O-CA 3.29Å; D171-T174 VanDerWaalsContact O-CB 3.25Å; D171-T174 WeakPolarHBondContact O-CB 3.38Å; D171-T174 PolarHBondContact O-N 3.45Å; D171-L175 PolarHBondContact O-N 3.31Å
172S97.1Very high97.9Very high24 Ų2458.1 Ų58.117%0.16830%0.296CS..Hα-helixtrans-43.8-47.2178.6-81.70000114D58 A59 T174 L175 T176D58-S172 PolarHBondContact OD2-OG 3.47Å; A59-S172 VanDerWaalsContact CB-OG 3.23Å; A59-S172 WeakPolarHBondContact CB-OG 3.34Å; A59-S172 PolarHBondContact N-OG 3.19Å; S172-T174 PolarHBondContact O-N 2.87Å; S172-L175 PolarHBondContact O-N 2.93Å; S172-L175 VanDerWaalsContact O-N 3.08Å; S172-T176 PolarHBondContact O-N 2.89Å; S172-T176 PolarHBondContact O-OG1 2.99Å; S172-T176 VanDerWaalsContact O-OG1 3.09Å
173P98.1Very high97.9Very high57 Ų5758.6 Ų58.637%0.3730%0.297SS..Hα-helixtrans-58.6-34.7177-2535.2000113.6D171 R177D171-P173 VanDerWaalsContact C-CD 3.45Å; D171-P173 VanDerWaalsContact C-N 3.33Å; P173-R177 WeakPolarHBondContact O-CG 3.35Å; P173-R177 PolarHBondContact O-N 3.35Å; P173-R177 PolarHBondContact O-NE 2.85Å
174T98.1Very high97.9Very high1 Ų153.4 Ų53.41%0.00628%0.283CS..Hα-helixtrans-71.7-40.2175.6-44.30000111.3W165 V170 D171 S172 R177 F178W165-T174 WeakPolarHBondContact CA-OG1 3.49Å; W165-T174 PolarHBondContact O-N 3.3Å; W165-T174 PolarHBondContact O-OG1 3.28Å; V170-T174 HydrophobicContact CG1-CG2 4.2Å; D171-T174 PolarHBondContact N-OG1 3.37Å; D171-T174 WeakPolarHBondContact O-CA 3.29Å; D171-T174 VanDerWaalsContact O-CB 3.25Å; D171-T174 WeakPolarHBondContact O-CB 3.38Å; D171-T174 PolarHBondContact O-N 3.45Å; S172-T174 PolarHBondContact O-N 2.87Å; T174-R177 WeakPolarHBondContact O-CG 3.42Å; T174-F178 HydrophobicContact CG2-CD1 4.34Å; T174-F178 HydrophobicContact CG2-CD2 4.43Å; T174-F178 HydrophobicContact CG2-CE1 4.05Å; T174-F178 HydrophobicContact CG2-CE2 4.17Å; T174-F178 HydrophobicContact CG2-CZ 3.96Å; T174-F178 WeakPolarHBondContact O-CB 3.5Å; T174-F178 WeakPolarHBondContact O-CG 3.44Å; T174-F178 PolarHBondContact O-N 3.02Å
175L98.1Very high98Very high0 Ų053.3 Ų53.30%028%0.282CS..Hα-helixtrans-66.6-45.8-179.8-173.656.2000111.8A62 V132 L133 W135 D171 S172 R177 F178 F179A62-L175 HydrophobicContact CB-CD2 3.55Å; V132-L175 HydrophobicContact CG1-CD1 4.36Å; L133-L175 HydrophobicContact CD2-CD1 4.01Å; W135-L175 HydrophobicContact CD2-CD2 3.88Å; W135-L175 HydrophobicContact CE3-CB 4.31Å; W135-L175 HydrophobicContact CE3-CD1 3.66Å; W135-L175 HydrophobicContact CE3-CD2 3.71Å; W135-L175 HydrophobicContact CE3-CG 4.11Å; W135-L175 HydrophobicContact CG-CD2 4.29Å; W135-L175 HydrophobicContact CH2-CB 4.23Å; W135-L175 HydrophobicContact CZ3-CB 3.86Å; W135-L175 HydrophobicContact CZ3-CD1 3.88Å; W135-L175 HydrophobicContact CZ3-CD2 4.09Å; W135-L175 HydrophobicContact CZ3-CG 4.17Å; D171-L175 PolarHBondContact O-N 3.31Å; S172-L175 PolarHBondContact O-N 2.93Å; S172-L175 VanDerWaalsContact O-N 3.08Å; L175-R177 PolarHBondContact O-N 2.95Å; L175-F178 PolarHBondContact O-N 3.44Å; L175-F179 PolarHBondContact O-N 3.48Å
176T98.4Very high98Very high62 Ų6253 Ų5338%0.3828%0.283SS..Hα-helixtrans-61.9-42.4179.8-50.60000112.4P57 S172 T180P57-T176 PolarHBondContact O-OG1 2.91Å; S172-T176 PolarHBondContact O-N 2.89Å; S172-T176 PolarHBondContact O-OG1 2.99Å; S172-T176 VanDerWaalsContact O-OG1 3.09Å; T176-T180 PolarHBondContact O-N 3.42Å; T176-T180 VanDerWaalsContact O-N 3.11Å; T176-T180 PolarHBondContact O-OG1 3.46Å; T176-T180 VanDerWaalsContact O-OG1 3.09Å
177R98.2Very high98.1Very high72 Ų7255.8 Ų55.827%0.27229%0.285SS..Hα-helixtrans-69-39175.866.3-174.368.5-156-11.9112.1W163 I164 P173 T174 L175 F179 T180 F181W163-R177 PolarHBondContact O-NH1 3.35Å; I164-R177 WeakPolarHBondContact O-CD 3.46Å; I164-R177 PolarHBondContact O-NE 3.42Å; I164-R177 PolarHBondContact O-NH1 2.92Å; P173-R177 WeakPolarHBondContact O-CG 3.35Å; P173-R177 PolarHBondContact O-N 3.35Å; P173-R177 PolarHBondContact O-NE 2.85Å; T174-R177 WeakPolarHBondContact O-CG 3.42Å; L175-R177 PolarHBondContact O-N 2.95Å; R177-F179 VanDerWaalsContact C-N 3.3Å; R177-F179 PolarHBondContact O-N 3.21Å; R177-T180 PolarHBondContact O-N 3.24Å; R177-F181 HydrophobicContact CB-CD2 4.36Å; R177-F181 HydrophobicContact CB-CE2 4.29Å; R177-F181 WeakPolarHBondContact O-CD2 3.17Å; R177-F181 PolarHBondContact O-N 2.96Å
178F98.6Very high98.2Very high11 Ų1158.2 Ų58.25%0.04829%0.291CS..Hα-helixtrans-65.9-37.4178.8-82.314.8000110.6F128 M129 V132 L133 T147 I164 T174 L175 F181 H182F128-F178 AromaticContact CE1-CE2 3.92Å; F128-F178 HydrophobicContact CE1-CE2 3.92Å; F128-F178 HydrophobicContact CE1-CZ 4.2Å; F128-F178 HydrophobicContact CZ-CE2 4.49Å; M129-F178 HydrophobicContact CB-CB 4.25Å; M129-F178 HydrophobicContact CB-CD2 4.42Å; M129-F178 HydrophobicContact CB-CG 4.35Å; M129-F178 HydrophobicContact CG-CB 4.25Å; M129-F178 HydrophobicContact CG-CD1 4.13Å; M129-F178 HydrophobicContact CG-CD2 4Å; M129-F178 HydrophobicContact CG-CE2 4.38Å; M129-F178 HydrophobicContact CG-CG 3.88Å; M129-F178 HydrophobicContact SD-CD1 4.14Å; M129-F178 HydrophobicContact SD-CG 4.36Å; V132-F178 HydrophobicContact CB-CD2 3.93Å; V132-F178 HydrophobicContact CG1-CD2 3.97Å; V132-F178 HydrophobicContact CG1-CE2 4.5Å; V132-F178 HydrophobicContact CG2-CD2 3.88Å; V132-F178 HydrophobicContact CG2-CE2 4.04Å; L133-F178 HydrophobicContact CD2-CB 4.48Å; T147-F178 HydrophobicContact CG2-CZ 4.02Å; I164-F178 HydrophobicContact CG2-CE1 4.23Å; I164-F178 HydrophobicContact CG2-CZ 4.4Å; T174-F178 HydrophobicContact CG2-CD1 4.34Å; T174-F178 HydrophobicContact CG2-CD2 4.43Å; T174-F178 HydrophobicContact CG2-CE1 4.05Å; T174-F178 HydrophobicContact CG2-CE2 4.17Å; T174-F178 HydrophobicContact CG2-CZ 3.96Å; T174-F178 WeakPolarHBondContact O-CB 3.5Å; T174-F178 WeakPolarHBondContact O-CG 3.44Å; T174-F178 PolarHBondContact O-N 3.02Å; L175-F178 PolarHBondContact O-N 3.44Å; F178-F181 PolarHBondContact O-N 3.48Å; F178-H182 WeakPolarHBondContact O-CB 3.41Å; F178-H182 PolarHBondContact O-N 3.38Å
179F98.8Very high98.3Very high42 Ų4249.1 Ų49.118%0.18426%0.255CS..Hα-helixtrans-59.1-50.1169.6175.5-108.4000111.7A52 Y55 P57 L133 L175 R177 F181 H182 F183A52-F179 HydrophobicContact CB-CE2 4.24Å; A52-F179 HydrophobicContact CB-CZ 4.13Å; Y55-F179 AromaticContact CD1-CD2 3.62Å; Y55-F179 HydrophobicContact CD1-CD2 3.62Å; Y55-F179 AromaticContact CD1-CE2 3.63Å; Y55-F179 HydrophobicContact CD1-CE2 3.63Å; Y55-F179 HydrophobicContact CD1-CG 4.34Å; Y55-F179 HydrophobicContact CD1-CZ 4.35Å; Y55-F179 HydrophobicContact CE1-CB 4.36Å; Y55-F179 AromaticContact CE1-CD2 3.59Å; Y55-F179 HydrophobicContact CE1-CD2 3.59Å; Y55-F179 HydrophobicContact CE1-CE2 4.11Å; Y55-F179 HydrophobicContact CE1-CG 4.06Å; P57-F179 HydrophobicContact CB-CB 3.77Å; P57-F179 HydrophobicContact CB-CD1 3.98Å; P57-F179 HydrophobicContact CB-CG 3.89Å; P57-F179 HydrophobicContact CG-CD1 3.94Å; P57-F179 HydrophobicContact CG-CE1 4.44Å; P57-F179 HydrophobicContact CG-CG 4.35Å; L133-F179 HydrophobicContact CD1-CD2 4.04Å; L133-F179 HydrophobicContact CD2-CB 3.91Å; L175-F179 PolarHBondContact O-N 3.48Å; R177-F179 VanDerWaalsContact C-N 3.3Å; R177-F179 PolarHBondContact O-N 3.21Å; F179-F181 PolarHBondContact O-N 3.41Å; F179-H182 PolarHBondContact O-N 3.47Å; F179-F183 HydrophobicContact CZ-CD2 4.37Å; F179-F183 WeakPolarHBondContact O-CB 3.36Å; F179-F183 PolarHBondContact O-N 3.27Å
180T98.6Very high98.4Very high82 Ų8248 Ų4850%0.50325%0.249SC..Hα-helixtrans-58.4-46.4178.6-600000112.3T176 R177 F183 I184T176-T180 PolarHBondContact O-N 3.42Å; T176-T180 VanDerWaalsContact O-N 3.11Å; T176-T180 PolarHBondContact O-OG1 3.46Å; T176-T180 VanDerWaalsContact O-OG1 3.09Å; R177-T180 PolarHBondContact O-N 3.24Å; T180-F183 PolarHBondContact O-N 3.11Å; T180-I184 WeakPolarHBondContact O-CG2 3.48Å; T180-I184 PolarHBondContact O-N 3.49Å; T180-I184 VanDerWaalsContact O-N 3.11Å
181F98.7Very high98.4Very high110 Ų11050.9 Ų50.948%0.48227%0.274SS..Hα-helixtrans-68.2-41.9178-74.9-58.4000112.6M129 R177 F178 F179 F183 I184 L185M129-F181 HydrophobicContact CE-CB 3.96Å; M129-F181 HydrophobicContact SD-CB 3.45Å; M129-F181 WeakPolarHBondContact SD-CB 3.46Å; M129-F181 HydrophobicContact SD-CD2 4.48Å; M129-F181 HydrophobicContact SD-CG 4.31Å; R177-F181 HydrophobicContact CB-CD2 4.36Å; R177-F181 HydrophobicContact CB-CE2 4.29Å; R177-F181 WeakPolarHBondContact O-CD2 3.17Å; R177-F181 PolarHBondContact O-N 2.96Å; F178-F181 PolarHBondContact O-N 3.48Å; F179-F181 PolarHBondContact O-N 3.41Å; F181-F183 PolarHBondContact O-N 2.81Å; F181-I184 WeakPolarHBondContact O-CG2 3.21Å; F181-I184 PolarHBondContact O-N 2.99Å; F181-L185 WeakPolarHBondContact O-CB 3.38Å; F181-L185 VanDerWaalsContact O-CG 3.28Å; F181-L185 WeakPolarHBondContact O-CG 3.18Å; F181-L185 PolarHBondContact O-N 3.34Å
182H98.8Very high98.5Very high27 Ų2748.7 Ų48.713%0.12526%0.262CS..Hα-helixtrans-61.3-34174.7-179.772.2000111.9H83 T126 M129 G130 L133 F178 F179 P186H83-H182 AromaticContact NE2-NE2 3.95Å; T126-H182 PolarHBondContact O-CE1 2.65Å; T126-H182 PolarHBondContact O-ND1 3.06Å; M129-H182 HydrophobicContact CB-CB 4.1Å; G130-H182 WeakPolarHBondContact CA-CE1 3.32Å; G130-H182 VanDerWaalsContact CA-ND1 3.26Å; G130-H182 WeakPolarHBondContact CA-ND1 3.3Å; G130-H182 PolarHBondContact N-ND1 2.72Å; L133-H182 HydrophobicContact CD1-CB 4.29Å; F178-H182 WeakPolarHBondContact O-CB 3.41Å; F178-H182 PolarHBondContact O-N 3.38Å; F179-H182 PolarHBondContact O-N 3.47Å; H182-P186 WeakPolarHBondContact O-CD 3.25Å; H182-P186 WeakPolarHBondContact O-CG 3.48Å
183F98.7Very high98.6Very high81 Ų8149 Ų4936%0.35527%0.266SS..Hα-helixtrans-72.5-43.8177.4-167.2-84.2000112.6L49 A52 F179 T180 F181 F187L49-F183 HydrophobicContact CD1-CE2 4.24Å; L49-F183 HydrophobicContact CD1-CZ 4.06Å; A52-F183 HydrophobicContact CB-CD2 4.28Å; A52-F183 HydrophobicContact CB-CE2 3.99Å; F179-F183 HydrophobicContact CZ-CD2 4.37Å; F179-F183 WeakPolarHBondContact O-CB 3.36Å; F179-F183 PolarHBondContact O-N 3.27Å; T180-F183 PolarHBondContact O-N 3.11Å; F181-F183 PolarHBondContact O-N 2.81Å; F183-F187 HydrophobicContact CD1-CE2 4.08Å; F183-F187 AromaticContact CE1-CE2 3.83Å; F183-F187 HydrophobicContact CE1-CE2 3.83Å; F183-F187 HydrophobicContact CE1-CZ 4.45Å; F183-F187 HydrophobicContact CZ-CE2 4.48Å; F183-F187 VanDerWaalsContact O-CD2 3.25Å; F183-F187 WeakPolarHBondContact O-CD2 2.86Å; F183-F187 VanDerWaalsContact O-CE2 3.24Å; F183-F187 WeakPolarHBondContact O-CE2 3.43Å
184I98.8Very high98.6Very high81 Ų8149.1 Ų49.142%0.41527%0.272SS..Hα-helixtrans-78.8-35-175.5-169.260.5000113.5T180 F181 F187 I188T180-I184 WeakPolarHBondContact O-CG2 3.48Å; T180-I184 PolarHBondContact O-N 3.49Å; T180-I184 VanDerWaalsContact O-N 3.11Å; F181-I184 WeakPolarHBondContact O-CG2 3.21Å; F181-I184 PolarHBondContact O-N 2.99Å; I184-F187 PolarHBondContact O-N 2.88Å; I184-F187 VanDerWaalsContact O-N 3.12Å; I184-I188 HydrophobicContact CG1-CD1 4.24Å; I184-I188 PolarHBondContact O-N 3.3Å
185L98.7Very high98.6Very high30 Ų3052.6 Ų52.616%0.15729%0.29CS..Hα-helixtrans-60.4-39.3-174-80.8169.6000114.9A125 T126 M129 F181 F187 I188 I189A125-L185 HydrophobicContact CB-CD1 4.33Å; T126-L185 HydrophobicContact CG2-CB 4.47Å; T126-L185 VanDerWaalsContact OG1-CB 3.23Å; T126-L185 WeakPolarHBondContact OG1-CB 3.35Å; M129-L185 HydrophobicContact CE-CD1 3.24Å; F181-L185 WeakPolarHBondContact O-CB 3.38Å; F181-L185 VanDerWaalsContact O-CG 3.28Å; F181-L185 WeakPolarHBondContact O-CG 3.18Å; F181-L185 PolarHBondContact O-N 3.34Å; L185-F187 PolarHBondContact O-N 3.08Å; L185-I188 HydrophobicContact CD2-CD1 4.2Å; L185-I188 CarbonylContact O-C 3.39Å; L185-I188 WeakPolarHBondContact O-CA 3.28Å; L185-I188 WeakPolarHBondContact O-CB 3.34Å; L185-I188 PolarHBondContact O-N 3.38Å; L185-I189 WeakPolarHBondContact O-CG1 3.37Å; L185-I189 PolarHBondContact O-N 3.2Å
186P98.8Very high98.6Very high18 Ų1853.9 Ų53.912%0.11730%0.296CS..Hα-helixtrans-54-34.7173.9-29.234.9000114I45 T126 H182 I189 A190I45-P186 HydrophobicContact CD1-CB 4.22Å; I45-P186 HydrophobicContact CG1-CB 3.7Å; T126-P186 HydrophobicContact CG2-CG 3.88Å; H182-P186 WeakPolarHBondContact O-CD 3.25Å; H182-P186 WeakPolarHBondContact O-CG 3.48Å; P186-I189 PolarHBondContact O-N 3.36Å; P186-A190 PolarHBondContact O-N 2.8Å
187F98.7Very high98.6Very high97 Ų9754.5 Ų54.543%0.42530%0.297SS..Hα-helixtrans-74.5-35.9176.4-58.4-76.2000112.1I45 F183 I184 L185 I189 A190 A191I45-F187 HydrophobicContact CG2-CE1 4.02Å; I45-F187 HydrophobicContact CG2-CZ 4.21Å; F183-F187 HydrophobicContact CD1-CE2 4.08Å; F183-F187 AromaticContact CE1-CE2 3.83Å; F183-F187 HydrophobicContact CE1-CE2 3.83Å; F183-F187 HydrophobicContact CE1-CZ 4.45Å; F183-F187 HydrophobicContact CZ-CE2 4.48Å; F183-F187 VanDerWaalsContact O-CD2 3.25Å; F183-F187 WeakPolarHBondContact O-CD2 2.86Å; F183-F187 VanDerWaalsContact O-CE2 3.24Å; F183-F187 WeakPolarHBondContact O-CE2 3.43Å; I184-F187 PolarHBondContact O-N 2.88Å; I184-F187 VanDerWaalsContact O-N 3.12Å; L185-F187 PolarHBondContact O-N 3.08Å; F187-I189 VanDerWaalsContact C-N 3.34Å; F187-A190 WeakPolarHBondContact O-CB 3.48Å; F187-A190 PolarHBondContact O-N 3.23Å; F187-A191 PolarHBondContact O-N 3.13Å; F187-A191 VanDerWaalsContact O-N 3.09Å
188I98.8Very high98.6Very high80 Ų8055.4 Ų55.441%0.4131%0.306SS..Hα-helixtrans-64.1-42.4171.3-63.1171.4000110I184 L185 A190 A191 L192I184-I188 HydrophobicContact CG1-CD1 4.24Å; I184-I188 PolarHBondContact O-N 3.3Å; L185-I188 HydrophobicContact CD2-CD1 4.2Å; L185-I188 CarbonylContact O-C 3.39Å; L185-I188 WeakPolarHBondContact O-CA 3.28Å; L185-I188 WeakPolarHBondContact O-CB 3.34Å; L185-I188 PolarHBondContact O-N 3.38Å; I188-A190 VanDerWaalsContact C-N 3.31Å; I188-A190 PolarHBondContact O-N 3.14Å; I188-A191 PolarHBondContact O-N 2.97Å; I188-L192 HydrophobicContact CG2-CD1 4.05Å; I188-L192 HydrophobicContact CG2-CG 4.42Å; I188-L192 WeakPolarHBondContact O-CG 3.36Å; I188-L192 PolarHBondContact O-N 2.95Å
189I98.9Very high98.6Very high8 Ų858 Ų584%0.04132%0.318CS..Hα-helixtrans-59.9-41.6174.3-68.6167000110.5L41 L119 A122 T126 L185 P186 F187 A191 L192 A193L41-I189 HydrophobicContact CD1-CB 4.38Å; L41-I189 HydrophobicContact CD1-CG2 3.88Å; L41-I189 HydrophobicContact CD2-CG2 3.99Å; L119-I189 HydrophobicContact CD2-CG2 3.82Å; A122-I189 HydrophobicContact CB-CD1 4.14Å; A122-I189 HydrophobicContact CB-CG1 3.72Å; T126-I189 WeakPolarHBondContact OG1-CD1 3.09Å; L185-I189 WeakPolarHBondContact O-CG1 3.37Å; L185-I189 PolarHBondContact O-N 3.2Å; P186-I189 PolarHBondContact O-N 3.36Å; F187-I189 VanDerWaalsContact C-N 3.34Å; I189-A191 PolarHBondContact O-N 2.83Å; I189-L192 PolarHBondContact O-N 2.96Å; I189-A193 VanDerWaalsContact O-CB 3.3Å; I189-A193 WeakPolarHBondContact O-CB 3.17Å; I189-A193 PolarHBondContact O-N 2.97Å
190A98.8Very high98.5Very high39 Ų3957.8 Ų57.832%0.32232%0.318SS..Hα-helixtrans-61.3-42.4175.800000112.3L41 P186 F187 I188 A193 A194L41-A190 HydrophobicContact CD2-CB 3.95Å; P186-A190 PolarHBondContact O-N 2.8Å; F187-A190 WeakPolarHBondContact O-CB 3.48Å; F187-A190 PolarHBondContact O-N 3.23Å; I188-A190 VanDerWaalsContact C-N 3.31Å; I188-A190 PolarHBondContact O-N 3.14Å; A190-A193 PolarHBondContact O-N 3.47Å; A190-A194 PolarHBondContact O-N 3.47Å
191A98.8Very high98.4Very high65 Ų6557 Ų5754%0.53731%0.309SS..Hα-helixtrans-65.2-43.4175.100000112.1F187 I188 I189 A193 A194 L195F187-A191 PolarHBondContact O-N 3.13Å; F187-A191 VanDerWaalsContact O-N 3.09Å; I188-A191 PolarHBondContact O-N 2.97Å; I189-A191 PolarHBondContact O-N 2.83Å; A191-A193 VanDerWaalsContact C-N 3.32Å; A191-A193 PolarHBondContact O-N 3.24Å; A191-A194 PolarHBondContact O-N 3.15Å; A191-L195 PolarHBondContact O-N 3.43Å
192L98.8Very high98.2Very high36 Ų3658.8 Ų58.819%0.18832%0.319CS..Hα-helixtrans-64-35.5174.9-72.1170.4000112.2I118 L119 I188 I189 L195 H196I118-L192 HydrophobicContact CG2-CD1 3.88Å; I118-L192 HydrophobicContact CG2-CD2 4.32Å; L119-L192 HydrophobicContact CD2-CB 3.55Å; L119-L192 HydrophobicContact CG-CB 4.08Å; I188-L192 HydrophobicContact CG2-CD1 4.05Å; I188-L192 HydrophobicContact CG2-CG 4.42Å; I188-L192 WeakPolarHBondContact O-CG 3.36Å; I188-L192 PolarHBondContact O-N 2.95Å; I189-L192 PolarHBondContact O-N 2.96Å; L192-L195 PolarHBondContact O-N 3.05Å; L192-H196 WeakPolarHBondContact O-CB 3.44Å; L192-H196 PolarHBondContact O-N 3.17Å
193A98.7Very high98Very high30 Ų3060.9 Ų60.925%0.24833%0.334CS..Hα-helixtrans-67.9-38.1176.200000111.6L119 I189 A190 A191 L195 H196 L197L119-A193 HydrophobicContact CD2-CB 4.38Å; I189-A193 VanDerWaalsContact O-CB 3.3Å; I189-A193 WeakPolarHBondContact O-CB 3.17Å; I189-A193 PolarHBondContact O-N 2.97Å; A190-A193 PolarHBondContact O-N 3.47Å; A191-A193 VanDerWaalsContact C-N 3.32Å; A191-A193 PolarHBondContact O-N 3.24Å; A193-L195 VanDerWaalsContact C-N 3.35Å; A193-H196 WeakPolarHBondContact O-CB 3.48Å; A193-H196 PolarHBondContact O-N 3.22Å; A193-L197 WeakPolarHBondContact O-CG 3.37Å; A193-L197 PolarHBondContact O-N 3.43Å
194A98.2Very high97.8Very high60 Ų6057.5 Ų57.550%0.49632%0.322SS..Hα-helixtrans-62.9-42.2171.400000111.5A190 A191 L197 L198A190-A194 PolarHBondContact O-N 3.47Å; A191-A194 PolarHBondContact O-N 3.15Å; A194-L197 PolarHBondContact O-N 3.29Å; A194-L198 PolarHBondContact O-N 3.41Å
195L98.4Very high97.7Very high73 Ų7355 Ų5538%0.38231%0.311SS..Hα-helixtrans-64.4-40.8174.7-173.165.6000112I115 A191 L192 A193 L197 L198 F199I115-L195 HydrophobicContact CD1-CD2 3.84Å; I115-L195 HydrophobicContact CD1-CG 3.75Å; I115-L195 HydrophobicContact CG1-CD2 4.45Å; A191-L195 PolarHBondContact O-N 3.43Å; L192-L195 PolarHBondContact O-N 3.05Å; A193-L195 VanDerWaalsContact C-N 3.35Å; L195-L197 VanDerWaalsContact C-N 3.35Å; L195-L197 PolarHBondContact O-N 3.01Å; L195-L198 WeakPolarHBondContact O-CB 3.38Å; L195-L198 PolarHBondContact O-N 3.16Å; L195-F199 HydrophobicContact CD1-CD2 4.19Å; L195-F199 HydrophobicContact CD1-CE2 3.71Å; L195-F199 HydrophobicContact CD2-CE2 4.36Å; L195-F199 HydrophobicContact CG-CD2 4.1Å; L195-F199 HydrophobicContact CG-CE2 3.84Å; L195-F199 WeakPolarHBondContact O-CD2 3.49Å; L195-F199 PolarHBondContact O-N 3.04Å; L195-F199 VanDerWaalsContact O-N 3.14Å
196H98.6Very high97.7Very high28 Ų2853.8 Ų53.813%0.1331%0.305CS..Hα-helixtrans-58.8-45.2175.3-174.881.8000111.7T112 I115 L119 L192 A193 L200T112-H196 WeakPolarHBondContact CG2-CE1 3.29Å; T112-H196 PolarHBondContact O-CE1 3.34Å; T112-H196 PolarHBondContact O-ND1 2.96Å; I115-H196 HydrophobicContact CB-CB 4.49Å; I115-H196 HydrophobicContact CG2-CB 3.69Å; L119-H196 HydrophobicContact CD1-CB 3.82Å; L192-H196 WeakPolarHBondContact O-CB 3.44Å; L192-H196 PolarHBondContact O-N 3.17Å; A193-H196 WeakPolarHBondContact O-CB 3.48Å; A193-H196 PolarHBondContact O-N 3.22Å; H196-L200 WeakPolarHBondContact O-CB 3.45Å; H196-L200 PolarHBondContact O-N 2.98Å
197L98Very high97.7Very high74 Ų7453.1 Ų53.139%0.38730%0.3SS..Hα-helixtrans-67.8-34176.1-70.5174.6000112.5A193 A194 L195 L200 H201A193-L197 WeakPolarHBondContact O-CG 3.37Å; A193-L197 PolarHBondContact O-N 3.43Å; A194-L197 PolarHBondContact O-N 3.29Å; L195-L197 VanDerWaalsContact C-N 3.35Å; L195-L197 PolarHBondContact O-N 3.01Å; L197-L200 HydrophobicContact CD2-CD2 4.12Å; L197-L200 WeakPolarHBondContact O-CB 3.49Å; L197-L200 PolarHBondContact O-N 2.9Å; L197-H201 WeakPolarHBondContact O-CB 3.18Å; L197-H201 PolarHBondContact O-CD2 3.12Å; L197-H201 PolarHBondContact O-N 3.36Å
198L97.3Very high97.7Very high91 Ų9149.2 Ų49.248%0.47628%0.284SS..Hα-helixtrans-59.6-52.2175.3-176.5150.1000110.9A194 L195 L200 H201 E202A194-L198 PolarHBondContact O-N 3.41Å; L195-L198 WeakPolarHBondContact O-CB 3.38Å; L195-L198 PolarHBondContact O-N 3.16Å; L198-L200 VanDerWaalsContact C-N 3.29Å; L198-L200 PolarHBondContact O-N 3.2Å; L198-H201 PolarHBondContact O-N 2.95Å; L198-H201 VanDerWaalsContact O-N 3.08Å; L198-E202 PolarHBondContact O-N 3.44Å
199F98.1Very high97.6Very high67 Ų6748 Ų4829%0.29428%0.279SS..Hα-helixtrans-64.9-32.5176.4-75.2-70.1000113.1E111 T112 I115 L195 H201 E202E111-F199 HydrophobicContact CB-CB 4.06Å; E111-F199 HydrophobicContact CB-CD1 3.49Å; E111-F199 VanDerWaalsContact CB-CD1 3.49Å; E111-F199 HydrophobicContact CB-CD2 4.21Å; E111-F199 HydrophobicContact CB-CE1 3.88Å; E111-F199 HydrophobicContact CB-CG 3.66Å; E111-F199 HydrophobicContact CB-CZ 4.38Å; E111-F199 HydrophobicContact CG-CD1 3.89Å; E111-F199 HydrophobicContact CG-CE1 3.88Å; E111-F199 HydrophobicContact CG-CZ 4.5Å; T112-F199 WeakPolarHBondContact OG1-CB 3.42Å; I115-F199 HydrophobicContact CD1-CD2 3.16Å; I115-F199 HydrophobicContact CD1-CE2 3.38Å; I115-F199 HydrophobicContact CD1-CG 4.26Å; L195-F199 HydrophobicContact CD1-CD2 4.19Å; L195-F199 HydrophobicContact CD1-CE2 3.71Å; L195-F199 HydrophobicContact CD2-CE2 4.36Å; L195-F199 HydrophobicContact CG-CD2 4.1Å; L195-F199 HydrophobicContact CG-CE2 3.84Å; L195-F199 WeakPolarHBondContact O-CD2 3.49Å; L195-F199 PolarHBondContact O-N 3.04Å; L195-F199 VanDerWaalsContact O-N 3.14Å; F199-H201 VanDerWaalsContact C-N 3.32Å; F199-H201 PolarHBondContact O-N 2.92Å; F199-E202 PolarHBondContact O-N 3.46Å
200L97.5Very high97.5Very high36 Ų3648.2 Ų48.219%0.18828%0.282CS..Hα-helixtrans-63.4-38.6171.7179.864.4000111.8T112 H196 L197 L198 E202 T203 G204T112-L200 HydrophobicContact CG2-CB 4.18Å; T112-L200 HydrophobicContact CG2-CD1 4.49Å; T112-L200 PolarHBondContact OG1-N 3.26Å; H196-L200 WeakPolarHBondContact O-CB 3.45Å; H196-L200 PolarHBondContact O-N 2.98Å; L197-L200 HydrophobicContact CD2-CD2 4.12Å; L197-L200 WeakPolarHBondContact O-CB 3.49Å; L197-L200 PolarHBondContact O-N 2.9Å; L198-L200 VanDerWaalsContact C-N 3.29Å; L198-L200 PolarHBondContact O-N 3.2Å; L200-E202 VanDerWaalsContact C-N 3.34Å; L200-T203 PolarHBondContact O-N 2.6Å; L200-T203 PolarHBondContact O-OG1 3.01Å; L200-G204 VanDerWaalsContact O-CA 3.31Å; L200-G204 WeakPolarHBondContact O-CA 3.25Å; L200-G204 PolarHBondContact O-N 3.35Å
201H96.2Very high97.4Very high65 Ų6551.3 Ų51.330%0.30129%0.293SS..Hα-helixtrans-73.7-23.3-178.3-70.6178.4000113.5L197 L198 F199 T203L197-H201 WeakPolarHBondContact O-CB 3.18Å; L197-H201 PolarHBondContact O-CD2 3.12Å; L197-H201 PolarHBondContact O-N 3.36Å; L198-H201 PolarHBondContact O-N 2.95Å; L198-H201 VanDerWaalsContact O-N 3.08Å; F199-H201 VanDerWaalsContact C-N 3.32Å; F199-H201 PolarHBondContact O-N 2.92Å; H201-T203 VanDerWaalsContact C-N 3.31Å; H201-T203 PolarHBondContact O-N 3.01Å
202E95.4Very high97.3Very high149 Ų14953 Ų5370%0.69630%0.297SS*.Hα-helixtrans-61.4-38.8172.1-68-61.5137.800112.2L198 F199 L200L198-E202 PolarHBondContact O-N 3.44Å; F199-E202 PolarHBondContact O-N 3.46Å; L200-E202 VanDerWaalsContact C-N 3.34Å
203T93.9Very high97.2Very high71 Ų7152.1 Ų52.144%0.43629%0.293SS..Hα-helixtrans-100.8-28.3-177.852.90000113.2Y109 L200 H201Y109-T203 HydrophobicContact CD1-CG2 4.18Å; Y109-T203 HydrophobicContact CE1-CG2 4.43Å; L200-T203 PolarHBondContact O-N 2.6Å; L200-T203 PolarHBondContact O-OG1 3.01Å; H201-T203 VanDerWaalsContact C-N 3.31Å; H201-T203 PolarHBondContact O-N 3.01Å
204G94.9Very high97Very high10 Ų1057.6 Ų57.610%0.10331%0.313CS..  trans79.3170.8-166.100000112.6L200L200-G204 VanDerWaalsContact O-CA 3.31Å; L200-G204 WeakPolarHBondContact O-CA 3.25Å; L200-G204 PolarHBondContact O-N 3.35Å
205S96.8Very high96.9Very high29 Ų2960.4 Ų60.420%0.20333%0.329CS..  trans-67.8139.6178.4-73.10000112.5P24P24-S205 VanDerWaalsContact CG-O 3.23Å; P24-S205 WeakPolarHBondContact CG-O 3.46Å
206N97.8Very high96.9Very high4 Ų461 Ų612%0.02133%0.332CS..  trans-64.3174.4159.1-173.922.4000110.2I27 W31 Y104 S106 Y109 Q313I27-N206 VanDerWaalsContact CG2-O 3.32Å; I27-N206 WeakPolarHBondContact CG2-O 3.13Å; W31-N206 VanDerWaalsContact CE2-O 3.3Å; W31-N206 HydrophobicContact CZ2-CB 4.32Å; W31-N206 VanDerWaalsContact CZ2-O 3.3Å; W31-N206 WeakPolarHBondContact CZ2-O 3.45Å; W31-N206 PolarHBondContact NE1-O 3.45Å; Y104-N206 PolarHBondContact O-ND2 2.97Å; S106-N206 PolarHBondContact OG-ND2 2.87Å; Y109-N206 HydrophobicContact CE2-CB 3.64Å; N206-Q313 PolarHBondContact ND2-NE2 3.14Å
207N98.6Very high96.8Very high4 Ų462.8 Ų62.82%0.02134%0.34CS..  trans-141.2167.2175.870.285.4000112.8P24 N26 I27 L209 G210 I211P24-N207 HydrophobicContact CB-CB 3.86Å; P24-N207 HydrophobicContact CG-CB 4.17Å; N26-N207 PolarHBondContact ND2-OD1 3.46Å; N26-N207 WeakPolarHBondContact OD1-CB 3.37Å; I27-N207 HydrophobicContact CG2-CB 4.13Å; N207-L209 PolarHBondContact O-N 3.41Å; N207-L209 VanDerWaalsContact O-N 3.12Å; N207-L209 WeakPolarHBondContact OD1-CB 3.49Å; N207-L209 PolarHBondContact OD1-N 3.27Å; N207-L209 VanDerWaalsContact OD1-N 3.11Å; N207-G210 PolarHBondContact O-N 3.42Å; N207-I211 PolarHBondContact ND2-O 3.12Å
208P98.6Very high96.9Very high14 Ų1461.2 Ų61.29%0.09133%0.332CS..THydrogen-bonded Turntrans-56.5-31.8-173.8-30.337.5000115.7N26 W31 Y104 G210 S314 M316N26-P208 VanDerWaalsContact O-CD 3.28Å; N26-P208 WeakPolarHBondContact O-CD 3.42Å; N26-P208 WeakPolarHBondContact O-CG 3.4Å; W31-P208 HydrophobicContact CH2-CG 4.07Å; W31-P208 HydrophobicContact CZ3-CG 3.83Å; Y104-P208 VanDerWaalsContact CD1-CA 3.49Å; Y104-P208 HydrophobicContact CD1-CB 4.21Å; Y104-P208 WeakPolarHBondContact CD1-O 3.28Å; Y104-P208 VanDerWaalsContact CE1-CA 3.49Å; Y104-P208 HydrophobicContact CE1-CB 3.66Å; Y104-P208 HydrophobicContact CE1-CG 4.39Å; P208-G210 VanDerWaalsContact C-N 3.3Å; P208-G210 PolarHBondContact O-N 3.05Å; P208-S314 WeakPolarHBondContact O-CB 3.38Å; P208-S314 PolarHBondContact O-OG 3.11Å; P208-M316 HydrophobicContact CB-SD 4.3Å
209L98.1Very high96.9Very high56 Ų5659.9 Ų59.929%0.29333%0.327SS..THydrogen-bonded Turntrans-75.6-19.7-178.4-59.7171.3000112.5N26 N207 I211 M316 F317N26-L209 WeakPolarHBondContact ND2-CD1 3.41Å; N207-L209 PolarHBondContact O-N 3.41Å; N207-L209 VanDerWaalsContact O-N 3.12Å; N207-L209 WeakPolarHBondContact OD1-CB 3.49Å; N207-L209 PolarHBondContact OD1-N 3.27Å; N207-L209 VanDerWaalsContact OD1-N 3.11Å; L209-I211 HydrophobicContact CB-CD1 4.23Å; L209-I211 HydrophobicContact CB-CG1 3.85Å; L209-I211 HydrophobicContact CD1-CD1 4.1Å; L209-I211 HydrophobicContact CD1-CG1 4.39Å; L209-I211 PolarHBondContact O-N 3.09Å; L209-M316 HydrophobicContact CD2-CE 3.82Å; L209-M316 HydrophobicContact CD2-SD 3.69Å; L209-F317 HydrophobicContact CD2-CE2 3.99Å; L209-F317 HydrophobicContact CD2-CZ 3.64Å
210G97.2Very high96.9Very high11 Ų1158.3 Ų58.311%0.11332%0.32CS..  trans63.928.1-176.400000113.8N207 P208N207-G210 PolarHBondContact O-N 3.42Å; P208-G210 VanDerWaalsContact C-N 3.3Å; P208-G210 PolarHBondContact O-N 3.05Å
211I96.8Very high96.9Very high105 Ų10561 Ų6154%0.53833%0.332SS..SBendtrans-118.5163.2173.964.3177.6000109.8N207 L209 S213N207-I211 PolarHBondContact ND2-O 3.12Å; L209-I211 HydrophobicContact CB-CD1 4.23Å; L209-I211 HydrophobicContact CB-CG1 3.85Å; L209-I211 HydrophobicContact CD1-CD1 4.1Å; L209-I211 HydrophobicContact CD1-CG1 4.39Å; L209-I211 PolarHBondContact O-N 3.09Å; I211-S213 PolarHBondContact O-N 2.98Å
212T96.4Very high97Very high101 Ų10161 Ų6162%0.6234%0.338SS*.  trans-56.3132.5174.6173.30000111.7H214T212-H214 PolarHBondContact OG1-CD2 3.45Å; T212-H214 PolarHBondContact OG1-N 2.98Å
213S96.3Very high97.1Very high16 Ų1660.2 Ų60.211%0.11233%0.329CS..  trans-104.812.5176.879.80000112.7P24 I211 S215 D216 K217P24-S213 WeakPolarHBondContact CB-OG 3.39Å; P24-S213 WeakPolarHBondContact CG-OG 3.46Å; I211-S213 PolarHBondContact O-N 2.98Å; S213-S215 PolarHBondContact O-N 2.78Å; S213-D216 CarbonylContact O-C 3.51Å; S213-D216 VanDerWaalsContact O-C 3.25Å; S213-D216 PolarHBondContact O-N 3.46Å; S213-K217 VanDerWaalsContact O-CG 3.28Å; S213-K217 WeakPolarHBondContact O-CG 3.48Å
214H95Very high97.3Very high146 Ų14657.3 Ų57.368%0.67631%0.31SS*.THydrogen-bonded Turntrans-59.1-30.2-175.4-75.2-64.5000113.3T212 D216T212-H214 PolarHBondContact OG1-CD2 3.45Å; T212-H214 PolarHBondContact OG1-N 2.98Å; H214-D216 VanDerWaalsContact C-N 3.27Å; H214-D216 PolarHBondContact O-N 2.77Å
215S96.2Very high97.5Very high119 Ų11959.5 Ų59.583%0.83232%0.322SS*.THydrogen-bonded Turntrans-70.7-20.217755.10000113.8S213S213-S215 PolarHBondContact O-N 2.78Å
216D97.2Very high97.6Very high84 Ų8463.8 Ų63.845%0.44934%0.341SS..SBendtrans-145.381.2-176.9-172.819000111.2S25 S213 H214S25-D216 VanDerWaalsContact CB-OD2 3.29Å; S25-D216 WeakPolarHBondContact CB-OD2 3.46Å; S25-D216 PolarHBondContact N-O 3.06Å; S25-D216 PolarHBondContact OG-OD2 3.49Å; S213-D216 CarbonylContact O-C 3.51Å; S213-D216 VanDerWaalsContact O-C 3.25Å; S213-D216 PolarHBondContact O-N 3.46Å; H214-D216 VanDerWaalsContact C-N 3.27Å; H214-D216 PolarHBondContact O-N 2.77Å
217K97.8Very high97.6Very high66 Ų6666 Ų6629%0.28735%0.351SS..EExtended strand (participates in β ladder)trans-111.8139.7170.1-64.3-165176.7-171.40109.9P22 T23 S213P22-K217 HydrophobicContact CB-CB 4.14Å; P22-K217 HydrophobicContact CB-CD 3.63Å; T23-K217 WeakPolarHBondContact O-CA 3.43Å; S213-K217 VanDerWaalsContact O-CG 3.28Å; S213-K217 WeakPolarHBondContact O-CG 3.48Å
218I98.1Very high97.6Very high42 Ų4267.2 Ų67.222%0.21536%0.357CS..EExtended strand (participates in β ladder)trans-110.5158.2170.862.6-178.5000109.5T23 Y223 Y224T23-I218 PolarHBondContact N-O 3.15Å; T23-I218 PolarHBondContact O-N 2.99Å; I218-Y223 HydrophobicContact CB-CD2 4.05Å; I218-Y223 HydrophobicContact CB-CE2 4.2Å; I218-Y223 HydrophobicContact CD1-CD1 4.33Å; I218-Y223 HydrophobicContact CD1-CD2 3.82Å; I218-Y223 HydrophobicContact CD1-CE2 4.49Å; I218-Y223 HydrophobicContact CD1-CG 3.72Å; I218-Y223 HydrophobicContact CG1-CD2 4.18Å; I218-Y224 HydrophobicContact CD1-CD2 4.49Å; I218-Y224 HydrophobicContact CD1-CE2 3.7Å; I218-Y224 HydrophobicContact CG1-CD2 4.49Å; I218-Y224 HydrophobicContact CG1-CE2 3.75Å
219T97.4Very high97.6Very high62 Ų6268.9 Ų68.938%0.3837%0.372SS..EExtended strand (participates in β ladder)trans-67.9145.5172.150.40000110.3H221 Y223T219-H221 WeakPolarHBondContact CB-O 3.35Å; T219-H221 PolarHBondContact O-N 3.46Å; T219-H221 PolarHBondContact OG1-O 3.26Å; T219-Y223 WeakPolarHBondContact O-CD2 3.33Å
220F98.3Very high97.6Very high34 Ų3471 Ų7115%0.14938%0.383CS..SBendtrans-60-46.2178.2-171.5-82.4000111.9F18 I19 L21 P222 Y223 Y224 T225F18-F220 WeakPolarHBondContact O-CD1 3.03Å; I19-F220 PolarHBondContact O-N 2.92Å; L21-F220 HydrophobicContact CB-CB 3.93Å; L21-F220 HydrophobicContact CD2-CD2 4.24Å; L21-F220 PolarHBondContact O-N 3.44Å; F220-P222 CarbonylContact O-C 2.91Å; F220-Y223 PolarHBondContact O-N 2.86Å; F220-Y224 HydrophobicContact CD2-CD2 4.23Å; F220-Y224 HydrophobicContact CD2-CG 4.19Å; F220-Y224 HydrophobicContact CE2-CG 4.27Å; F220-Y224 WeakPolarHBondContact O-CA 3.39Å; F220-Y224 PolarHBondContact O-N 2.71Å; F220-T225 PolarHBondContact O-N 2.92Å
221H98Very high97.7Very high92 Ų9271 Ų7143%0.42638%0.384SS..THydrogen-bonded Turntrans-88.9134170.7-172.774.4000110.7I19 T219 T225I19-H221 HydrophobicContact CG2-CB 4.05Å; I19-H221 PolarHBondContact O-N 3.43Å; T219-H221 WeakPolarHBondContact CB-O 3.35Å; T219-H221 PolarHBondContact O-N 3.46Å; T219-H221 PolarHBondContact OG1-O 3.26Å; H221-T225 PolarHBondContact ND1-OG1 2.76Å; H221-T225 VanDerWaalsContact ND1-OG1 3.13Å
222P97.9Very high97.8Very high66 Ų6669.1 Ų69.143%0.42937%0.374SS..THydrogen-bonded Turncis-89.5-14.51.735.4-35.4000114.7F220 Y224 T225 I226F220-P222 CarbonylContact O-C 2.91Å; P222-Y224 PolarHBondContact O-N 3.06Å; P222-T225 PolarHBondContact O-N 3.44Å; P222-I226 WeakPolarHBondContact O-CG2 3.3Å; P222-I226 PolarHBondContact O-N 3.3Å
223Y98.4Very high97.9Very high133 Ų13369.7 Ų69.752%0.52237%0.373SS..Hα-helixtrans-58.2-52.7-164.2-61.7-76.2000114.2I218 T219 F220 I226 K227I218-Y223 HydrophobicContact CB-CD2 4.05Å; I218-Y223 HydrophobicContact CB-CE2 4.2Å; I218-Y223 HydrophobicContact CD1-CD1 4.33Å; I218-Y223 HydrophobicContact CD1-CD2 3.82Å; I218-Y223 HydrophobicContact CD1-CE2 4.49Å; I218-Y223 HydrophobicContact CD1-CG 3.72Å; I218-Y223 HydrophobicContact CG1-CD2 4.18Å; T219-Y223 WeakPolarHBondContact O-CD2 3.33Å; F220-Y223 PolarHBondContact O-N 2.86Å; Y223-I226 VanDerWaalsContact O-CG2 3.3Å; Y223-I226 WeakPolarHBondContact O-CG2 3.41Å; Y223-K227 WeakPolarHBondContact O-CB 3.25Å; Y223-K227 PolarHBondContact O-N 3.38Å
224Y98.2Very high98Very high9 Ų973.8 Ų73.84%0.03539%0.393CS..Hα-helixtrans-84-25.2-179.9-67.1-60000112.3T23 P24 S25 I27 I218 F220 P222 K227 D228T23-Y224 HydrophobicContact CG2-CD2 3.48Å; T23-Y224 VanDerWaalsContact CG2-CD2 3.48Å; T23-Y224 HydrophobicContact CG2-CE2 3.28Å; T23-Y224 HydrophobicContact CG2-CG 4.33Å; P24-Y224 PolarHBondContact O-OH 2.87Å; S25-Y224 VanDerWaalsContact C-OH 3.28Å; S25-Y224 PolarHBondContact O-OH 2.87Å; I27-Y224 HydrophobicContact CD1-CD1 3.78Å; I27-Y224 HydrophobicContact CD1-CD2 4.46Å; I27-Y224 HydrophobicContact CD1-CE1 3.48Å; I27-Y224 VanDerWaalsContact CD1-CE1 3.48Å; I27-Y224 HydrophobicContact CD1-CE2 4.14Å; I27-Y224 HydrophobicContact CD1-CG 4.3Å; I27-Y224 HydrophobicContact CG1-CD1 4.08Å; I27-Y224 HydrophobicContact CG1-CE1 3.25Å; I27-Y224 HydrophobicContact CG1-CE2 4.12Å; I27-Y224 WeakPolarHBondContact CG1-OH 3.43Å; I218-Y224 HydrophobicContact CD1-CD2 4.49Å; I218-Y224 HydrophobicContact CD1-CE2 3.7Å; I218-Y224 HydrophobicContact CG1-CD2 4.49Å; I218-Y224 HydrophobicContact CG1-CE2 3.75Å; F220-Y224 HydrophobicContact CD2-CD2 4.23Å; F220-Y224 HydrophobicContact CD2-CG 4.19Å; F220-Y224 HydrophobicContact CE2-CG 4.27Å; F220-Y224 WeakPolarHBondContact O-CA 3.39Å; F220-Y224 PolarHBondContact O-N 2.71Å; P222-Y224 PolarHBondContact O-N 3.06Å; Y224-K227 HydrophobicContact CD1-CD 3.87Å; Y224-K227 HydrophobicContact CE1-CD 3.99Å; Y224-K227 PolarHBondContact O-N 3.47Å; Y224-D228 WeakPolarHBondContact O-CB 3.44Å; Y224-D228 VanDerWaalsContact O-CG 3.28Å; Y224-D228 PolarHBondContact O-N 2.71Å
225T98.3Very high98.2Very high57 Ų5767.4 Ų67.435%0.3536%0.363SS..Hα-helixtrans-59.7-48.6169.7-45.60000111.8F220 H221 P222 A229F220-T225 PolarHBondContact O-N 2.92Å; H221-T225 PolarHBondContact ND1-OG1 2.76Å; H221-T225 VanDerWaalsContact ND1-OG1 3.13Å; P222-T225 PolarHBondContact O-N 3.44Å; T225-A229 WeakPolarHBondContact O-CB 3.02Å; T225-A229 PolarHBondContact O-N 3.38Å
226I98.4Very high98.3Very high119 Ų11965.2 Ų65.261%0.6134%0.342SS*.Hα-helixtrans-71.1-36.6-179.8-168.460.9000111.8P222 Y223 A229 L230P222-I226 WeakPolarHBondContact O-CG2 3.3Å; P222-I226 PolarHBondContact O-N 3.3Å; Y223-I226 VanDerWaalsContact O-CG2 3.3Å; Y223-I226 WeakPolarHBondContact O-CG2 3.41Å; I226-A229 PolarHBondContact O-N 2.79Å; I226-L230 PolarHBondContact O-N 2.8Å
227K98.6Very high98.4Very high50 Ų5066.4 Ų66.422%0.21735%0.348CS..Hα-helixtrans-64.8-41.6175.9-171.2-173168.1-154.20111.6I27 S28 N32 Y223 Y224 L230 G231I27-K227 PolarHBondContact O-NZ 3Å; S28-K227 PolarHBondContact O-NZ 2.89Å; N32-K227 PolarHBondContact ND2-O 2.99Å; N32-K227 VanDerWaalsContact ND2-O 3.16Å; N32-K227 WeakPolarHBondContact OD1-CE 3.41Å; N32-K227 PolarHBondContact OD1-NZ 3.42Å; Y223-K227 WeakPolarHBondContact O-CB 3.25Å; Y223-K227 PolarHBondContact O-N 3.38Å; Y224-K227 HydrophobicContact CD1-CD 3.87Å; Y224-K227 HydrophobicContact CE1-CD 3.99Å; Y224-K227 PolarHBondContact O-N 3.47Å; K227-L230 PolarHBondContact O-N 2.88Å; K227-G231 PolarHBondContact O-N 3.31Å
228D98.6Very high98.4Very high30 Ų3065.7 Ų65.716%0.1635%0.351CS..Hα-helixtrans-69.2-36.6176.7-78.110.2000111.8N32 S35 Y224 L230 G231 L232N32-D228 PolarHBondContact ND2-OD1 3.16Å; S35-D228 WeakPolarHBondContact CB-OD2 3.48Å; S35-D228 PolarHBondContact OG-OD2 2.89Å; Y224-D228 WeakPolarHBondContact O-CB 3.44Å; Y224-D228 VanDerWaalsContact O-CG 3.28Å; Y224-D228 PolarHBondContact O-N 2.71Å; D228-L230 VanDerWaalsContact C-N 3.33Å; D228-L230 PolarHBondContact O-N 3.16Å; D228-G231 PolarHBondContact O-N 2.89Å; D228-L232 WeakPolarHBondContact O-CB 3.48Å; D228-L232 PolarHBondContact O-N 3.47Å
229A98.6Very high98.4Very high49 Ų4963.7 Ų63.741%0.40534%0.341SS..Hα-helixtrans-60.9-40.8171.900000112.2T225 I226 L232 L233T225-A229 WeakPolarHBondContact O-CB 3.02Å; T225-A229 PolarHBondContact O-N 3.38Å; I226-A229 PolarHBondContact O-N 2.79Å; A229-L232 PolarHBondContact O-N 3.21Å; A229-L233 PolarHBondContact O-N 3.44Å
230L98.7Very high98.5Very high100 Ų10063.8 Ų63.852%0.52434%0.338SS..Hα-helixtrans-63.1-45.3172.9176.262.6000111.6I226 K227 D228 L232 L233 L234I226-L230 PolarHBondContact O-N 2.8Å; K227-L230 PolarHBondContact O-N 2.88Å; D228-L230 VanDerWaalsContact C-N 3.33Å; D228-L230 PolarHBondContact O-N 3.16Å; L230-L232 VanDerWaalsContact C-N 3.31Å; L230-L232 PolarHBondContact O-N 3.36Å; L230-L233 PolarHBondContact O-N 3.46Å; L230-L234 WeakPolarHBondContact O-CG 3.4Å; L230-L234 PolarHBondContact O-N 3.3Å; L230-L234 VanDerWaalsContact O-N 3.09Å
231G98.6Very high98.5Very high12 Ų1265.2 Ų65.212%0.12435%0.349CS..Hα-helixtrans-57.5-44.7175.400000112.1K227 D228 L234 F235K227-G231 PolarHBondContact O-N 3.31Å; D228-G231 PolarHBondContact O-N 2.89Å; G231-L234 PolarHBondContact O-N 3.3Å; G231-F235 WeakPolarHBondContact O-CB 3.16Å; G231-F235 PolarHBondContact O-N 2.81Å
232L98.8Very high98.5Very high65 Ų6561.8 Ų61.834%0.3433%0.334SS..Hα-helixtrans-63.3-40.4176.8-178.862.2000112.1L36 A39 D228 A229 L230 F235 L236L36-L232 HydrophobicContact CD2-CB 4.49Å; A39-L232 HydrophobicContact CB-CD1 3.73Å; D228-L232 WeakPolarHBondContact O-CB 3.48Å; D228-L232 PolarHBondContact O-N 3.47Å; A229-L232 PolarHBondContact O-N 3.21Å; L230-L232 VanDerWaalsContact C-N 3.31Å; L230-L232 PolarHBondContact O-N 3.36Å; L232-F235 HydrophobicContact CD1-CD1 4.14Å; L232-F235 WeakPolarHBondContact O-CB 3.49Å; L232-F235 PolarHBondContact O-N 3.27Å; L232-L236 HydrophobicContact CD1-CD1 4.31Å; L232-L236 HydrophobicContact CD1-CG 4.18Å; L232-L236 HydrophobicContact CG-CD1 4.09Å; L232-L236 HydrophobicContact CG-CG 4.38Å; L232-L236 WeakPolarHBondContact O-CB 3.42Å; L232-L236 VanDerWaalsContact O-CG 3.32Å; L232-L236 WeakPolarHBondContact O-CG 3.44Å; L232-L236 PolarHBondContact O-N 3.05Å
233L98.8Very high98.5Very high112 Ų11258.7 Ų58.759%0.58631%0.314SS*.Hα-helixtrans-60.7-46.2176.417964.9000111.6A229 L230 L236 L237A229-L233 PolarHBondContact O-N 3.44Å; L230-L233 PolarHBondContact O-N 3.46Å; L233-L236 PolarHBondContact O-N 3.06Å; L233-L237 WeakPolarHBondContact O-CB 3.24Å; L233-L237 PolarHBondContact O-N 2.67Å
234L98.6Very high98.5Very high103 Ų10356.3 Ų56.354%0.53931%0.31SS..Hα-helixtrans-65.3-40.6177.5-65.9176.1000111.8L230 G231 L237 S238L230-L234 WeakPolarHBondContact O-CG 3.4Å; L230-L234 PolarHBondContact O-N 3.3Å; L230-L234 VanDerWaalsContact O-N 3.09Å; G231-L234 PolarHBondContact O-N 3.3Å; L234-L237 PolarHBondContact O-N 3.05Å; L234-S238 PolarHBondContact O-N 2.69Å; L234-S238 PolarHBondContact O-OG 3.09Å
235F98.6Very high98.5Very high11 Ų1163.9 Ų63.95%0.04834%0.343CS..Hα-helixtrans-57.6-52.6172.9168.2-90.4000111.3L36 C40 M89 G231 L232 L237 S238 L239L36-F235 HydrophobicContact CD1-CB 4.48Å; L36-F235 HydrophobicContact CD2-CB 3.67Å; L36-F235 HydrophobicContact CD2-CD2 4.44Å; L36-F235 HydrophobicContact CD2-CG 4.06Å; C40-F235 WeakPolarHBondContact SG-CE2 3.35Å; C40-F235 WeakPolarHBondContact SG-CZ 3.34Å; M89-F235 HydrophobicContact CB-CE2 3.69Å; M89-F235 HydrophobicContact CB-CZ 4.11Å; M89-F235 HydrophobicContact CE-CD2 3.87Å; M89-F235 HydrophobicContact CE-CE2 3.96Å; M89-F235 HydrophobicContact CG-CE2 4.39Å; G231-F235 WeakPolarHBondContact O-CB 3.16Å; G231-F235 PolarHBondContact O-N 2.81Å; L232-F235 HydrophobicContact CD1-CD1 4.14Å; L232-F235 WeakPolarHBondContact O-CB 3.49Å; L232-F235 PolarHBondContact O-N 3.27Å; F235-L237 VanDerWaalsContact C-N 3.31Å; F235-L237 PolarHBondContact O-N 3.12Å; F235-S238 PolarHBondContact O-N 3.42Å; F235-S238 PolarHBondContact O-OG 3.23Å; F235-L239 HydrophobicContact CE1-CD2 4.09Å; F235-L239 HydrophobicContact CZ-CD2 4.29Å; F235-L239 PolarHBondContact O-N 3.43Å
236L98.6Very high98.5Very high74 Ų7463.2 Ų63.239%0.38734%0.341SS..Hα-helixtrans-62.3-39.9179.9-71.4173.9000111.3L232 L233 S238 L239 M240L232-L236 HydrophobicContact CD1-CD1 4.31Å; L232-L236 HydrophobicContact CD1-CG 4.18Å; L232-L236 HydrophobicContact CG-CD1 4.09Å; L232-L236 HydrophobicContact CG-CG 4.38Å; L232-L236 WeakPolarHBondContact O-CB 3.42Å; L232-L236 VanDerWaalsContact O-CG 3.32Å; L232-L236 WeakPolarHBondContact O-CG 3.44Å; L232-L236 PolarHBondContact O-N 3.05Å; L233-L236 PolarHBondContact O-N 3.06Å; L236-S238 VanDerWaalsContact C-N 3.35Å; L236-S238 PolarHBondContact O-N 3.35Å; L236-L239 PolarHBondContact O-N 3.1Å; L236-M240 VanDerWaalsContact O-CB 3.27Å; L236-M240 WeakPolarHBondContact O-CB 3.33Å; L236-M240 WeakPolarHBondContact O-CG 2.93Å; L236-M240 PolarHBondContact O-N 3.48Å
237L98.6Very high98.5Very high109 Ų10959.1 Ų59.157%0.57132%0.322SS*.Hα-helixtrans-58.1-47.6174.7-179.764.1000111.3L233 L234 F235 T241L233-L237 WeakPolarHBondContact O-CB 3.24Å; L233-L237 PolarHBondContact O-N 2.67Å; L234-L237 PolarHBondContact O-N 3.05Å; F235-L237 VanDerWaalsContact C-N 3.31Å; F235-L237 PolarHBondContact O-N 3.12Å; L237-T241 WeakPolarHBondContact O-CB 3.29Å; L237-T241 PolarHBondContact O-N 3.01Å; L237-T241 PolarHBondContact O-OG1 3.1Å
238S98.4Very high98.5Very high50 Ų5060.2 Ų60.235%0.3533%0.33SS..Hα-helixtrans-64.1-45.6178.267.60000112.8M89 L234 F235 L236 T241 L242M89-S238 WeakPolarHBondContact CE-OG 3.43Å; L234-S238 PolarHBondContact O-N 2.69Å; L234-S238 PolarHBondContact O-OG 3.09Å; F235-S238 PolarHBondContact O-N 3.42Å; F235-S238 PolarHBondContact O-OG 3.23Å; L236-S238 VanDerWaalsContact C-N 3.35Å; L236-S238 PolarHBondContact O-N 3.35Å; S238-T241 PolarHBondContact O-N 2.95Å; S238-L242 PolarHBondContact O-N 2.91Å
239L98.8Very high98.5Very high0 Ų064.7 Ų64.70%035%0.354CS..Hα-helixtrans-63-44.8178.2174.264.2000111.6L43 L82 N85 M89 F235 L236 T241 L242 T243L43-L239 HydrophobicContact CD2-CD2 3.43Å; L43-L239 VanDerWaalsContact CD2-CD2 3.43Å; L82-L239 HydrophobicContact CD2-CD2 3.97Å; L82-L239 HydrophobicContact CD2-CG 4.09Å; N85-L239 HydrophobicContact CB-CD1 3.89Å; M89-L239 HydrophobicContact CG-CB 4.37Å; M89-L239 HydrophobicContact CG-CD1 3.93Å; F235-L239 HydrophobicContact CE1-CD2 4.09Å; F235-L239 HydrophobicContact CZ-CD2 4.29Å; F235-L239 PolarHBondContact O-N 3.43Å; L236-L239 PolarHBondContact O-N 3.1Å; L239-T241 VanDerWaalsContact C-N 3.35Å; L239-L242 PolarHBondContact O-N 3.38Å; L239-T243 VanDerWaalsContact O-CB 3.23Å; L239-T243 WeakPolarHBondContact O-CB 3.37Å; L239-T243 PolarHBondContact O-N 2.91Å; L239-T243 PolarHBondContact O-OG1 3.03Å
240M98.6Very high98.5Very high64 Ų6465 Ų6532%0.31535%0.348SS..Hα-helixtrans-68.2-36.6178.8-68.8-54.4-60.800111.3L82 L236 T243 L244L82-M240 HydrophobicContact CD2-SD 3.8Å; L236-M240 VanDerWaalsContact O-CB 3.27Å; L236-M240 WeakPolarHBondContact O-CB 3.33Å; L236-M240 WeakPolarHBondContact O-CG 2.93Å; L236-M240 PolarHBondContact O-N 3.48Å; M240-T243 PolarHBondContact O-N 3.49Å; M240-L244 HydrophobicContact CE-CD1 3.7Å; M240-L244 HydrophobicContact CE-CD2 4.18Å; M240-L244 HydrophobicContact CE-CG 3.92Å; M240-L244 VanDerWaalsContact O-CB 3.24Å; M240-L244 WeakPolarHBondContact O-CB 3.47Å; M240-L244 VanDerWaalsContact O-CG 3.24Å; M240-L244 WeakPolarHBondContact O-CG 3.42Å; M240-L244 PolarHBondContact O-N 3.33Å
241T98.6Very high98.3Very high65 Ų6562.2 Ų62.240%0.39934%0.344SS..Hα-helixtrans-62.1-48.6175.3-57.90000110.4L237 S238 L239 F245L237-T241 WeakPolarHBondContact O-CB 3.29Å; L237-T241 PolarHBondContact O-N 3.01Å; L237-T241 PolarHBondContact O-OG1 3.1Å; S238-T241 PolarHBondContact O-N 2.95Å; L239-T241 VanDerWaalsContact C-N 3.35Å; T241-F245 HydrophobicContact CG2-CD2 4.04Å; T241-F245 WeakPolarHBondContact O-CB 3.42Å; T241-F245 PolarHBondContact O-N 3.43Å
242L98.2Very high98.2Very high19 Ų1962.7 Ų62.710%0.09934%0.343CS..Hα-helixtrans-59.9-48.5175.9179.761.9000111.2N85 S238 L239 L244 S246 P247 L249 L250N85-L242 HydrophobicContact CB-CD2 3.75Å; N85-L242 HydrophobicContact CB-CG 4.13Å; N85-L242 WeakPolarHBondContact OD1-CD2 3.39Å; S238-L242 PolarHBondContact O-N 2.91Å; L239-L242 PolarHBondContact O-N 3.38Å; L242-L244 PolarHBondContact O-N 3Å; L242-S246 WeakPolarHBondContact CD1-O 3.43Å; L242-S246 CarbonylContact O-C 3.46Å; L242-S246 WeakPolarHBondContact O-CA 3.42Å; L242-S246 PolarHBondContact O-N 2.94Å; L242-P247 WeakPolarHBondContact O-CA 3.3Å; L242-L249 HydrophobicContact CD1-CB 4Å; L242-L249 HydrophobicContact CD1-CD2 4.12Å; L242-L250 HydrophobicContact CD1-CG 4.39Å; L242-L250 HydrophobicContact CD2-CD1 3.69Å; L242-L250 HydrophobicContact CD2-CG 4.37Å
243T98.1Very high98.2Very high1 Ų164 Ų641%0.00636%0.356CS..Hα-helixtrans-67-37-175.9-61.10000113.4L82 L239 M240 P247L82-T243 HydrophobicContact CD2-CG2 4.17Å; L82-T243 HydrophobicContact CG-CG2 4.16Å; L239-T243 VanDerWaalsContact O-CB 3.23Å; L239-T243 WeakPolarHBondContact O-CB 3.37Å; L239-T243 PolarHBondContact O-N 2.91Å; L239-T243 PolarHBondContact O-OG1 3.03Å; M240-T243 PolarHBondContact O-N 3.49Å; T243-P247 WeakPolarHBondContact O-CB 3.4Å
244L98.4Very high98.1Very high83 Ų8361.3 Ų61.344%0.43534%0.342SS..Hα-helixtrans-91.8-33.9-174.4-63.5177.8000113.3W77 M240 L242W77-L244 HydrophobicContact CH2-CD2 3.88Å; W77-L244 HydrophobicContact CZ3-CD2 4.22Å; M240-L244 HydrophobicContact CE-CD1 3.7Å; M240-L244 HydrophobicContact CE-CD2 4.18Å; M240-L244 HydrophobicContact CE-CG 3.92Å; M240-L244 VanDerWaalsContact O-CB 3.24Å; M240-L244 WeakPolarHBondContact O-CB 3.47Å; M240-L244 VanDerWaalsContact O-CG 3.24Å; M240-L244 WeakPolarHBondContact O-CG 3.42Å; M240-L244 PolarHBondContact O-N 3.33Å; L242-L244 PolarHBondContact O-N 3Å
245F98.4Very high98Very high168 Ų16857.4 Ų57.474%0.73732%0.322SS*.Hα-helixtrans-105-29.2-174.3-64.4-74.5000113.8T241T241-F245 HydrophobicContact CG2-CD2 4.04Å; T241-F245 WeakPolarHBondContact O-CB 3.42Å; T241-F245 PolarHBondContact O-N 3.43Å
246S98.3Very high98Very high43 Ų4361.6 Ų61.630%0.30134%0.338SS..  trans-145.255.8-176.464.60000112.3L242 D248 L249L242-S246 WeakPolarHBondContact CD1-O 3.43Å; L242-S246 CarbonylContact O-C 3.46Å; L242-S246 WeakPolarHBondContact O-CA 3.42Å; L242-S246 PolarHBondContact O-N 2.94Å; S246-D248 PolarHBondContact O-N 3.35Å; S246-D248 VanDerWaalsContact O-N 3.1Å; S246-L249 VanDerWaalsContact O-CB 3.29Å; S246-L249 WeakPolarHBondContact O-CB 3.3Å; S246-L249 PolarHBondContact O-N 3.33Å; S246-L249 VanDerWaalsContact O-N 3.1Å
247P98.1Very high97.9Very high34 Ų3461.9 Ų61.922%0.22134%0.343CS..THydrogen-bonded Turntrans-60.7-26.5-167.821-33.1000114.6Y81 N85 L242 T243Y81-P247 HydrophobicContact CD1-CB 3.59Å; Y81-P247 HydrophobicContact CD2-CB 4.03Å; Y81-P247 HydrophobicContact CE1-CB 3.82Å; Y81-P247 HydrophobicContact CE2-CB 4.23Å; Y81-P247 HydrophobicContact CG-CB 3.72Å; N85-P247 PolarHBondContact ND2-O 2.86Å; N85-P247 PolarHBondContact OD1-O 2.68Å; L242-P247 WeakPolarHBondContact O-CA 3.3Å; T243-P247 WeakPolarHBondContact O-CB 3.4Å
248D98.2Very high97.9Very high73 Ų7361 Ų6139%0.3934%0.338SS..THydrogen-bonded Turntrans-99.82.3-176.9-63.4-53.3000113.7S246 L250 G251 Y256S246-D248 PolarHBondContact O-N 3.35Å; S246-D248 VanDerWaalsContact O-N 3.1Å; D248-L250 PolarHBondContact O-N 3.33Å; D248-L250 VanDerWaalsContact O-N 3.11Å; D248-G251 PolarHBondContact O-N 2.91Å; D248-G251 VanDerWaalsContact O-N 3.14Å; D248-Y256 WeakPolarHBondContact OD1-CE2 3.48Å; D248-Y256 PolarHBondContact OD1-OH 3.46Å
249L98.4Very high97.8Very high124 Ų12459.3 Ų59.365%0.64933%0.327SS*.THydrogen-bonded Turntrans-56.3-33.9-173.117963.5000113.6L242 S246L242-L249 HydrophobicContact CD1-CB 4Å; L242-L249 HydrophobicContact CD1-CD2 4.12Å; S246-L249 VanDerWaalsContact O-CB 3.29Å; S246-L249 WeakPolarHBondContact O-CB 3.3Å; S246-L249 PolarHBondContact O-N 3.33Å; S246-L249 VanDerWaalsContact O-N 3.1Å
250L97.9Very high97.7Very high55 Ų5562.4 Ų62.429%0.28834%0.344SS..THydrogen-bonded Turntrans-100.1-5.8-175.9-58.6-177.4000113.9L242 D248L242-L250 HydrophobicContact CD1-CG 4.39Å; L242-L250 HydrophobicContact CD2-CD1 3.69Å; L242-L250 HydrophobicContact CD2-CG 4.37Å; D248-L250 PolarHBondContact O-N 3.33Å; D248-L250 VanDerWaalsContact O-N 3.11Å
251G95.6Very high97.6Very high42 Ų4263.2 Ų63.243%0.43335%0.353SS..SBendtrans-97.5169.9-178.700000113D248D248-G251 PolarHBondContact O-N 2.91Å; D248-G251 VanDerWaalsContact O-N 3.14Å
252D96.9Very high97.5Very high21 Ų2168 Ų6811%0.11238%0.376CS..  trans-100.4129.2175.9-161.4-71.8000111.6M138 D254 N255 K269M138-D252 HydrophobicContact CG-CB 4.09Å; D252-D254 PolarHBondContact O-N 3.47Å; D252-D254 WeakPolarHBondContact OD1-CB 3.43Å; D252-D254 PolarHBondContact OD1-N 3.15Å; D252-N255 WeakPolarHBondContact O-CB 3.31Å; D252-N255 PolarHBondContact O-N 3.12Å; D252-N255 VanDerWaalsContact O-N 3.11Å; D252-K269 WeakPolarHBondContact OD2-CE 3.35Å; D252-K269 IonicContact OD2-NZ 2.87Å; D252-K269 PolarHBondContact OD2-NZ 2.92Å
253P97Very high97.4Very high94 Ų9471.5 Ų71.561%0.6140%0.395SS*.G310 helixtrans-61.9-27-177.925.6-35.7000113.5N255 Y256P253-N255 PolarHBondContact O-N 3.31Å; P253-N255 VanDerWaalsContact O-N 3.14Å; P253-Y256 WeakPolarHBondContact O-CB 3.48Å; P253-Y256 PolarHBondContact O-N 3.4Å
254D96.9Very high97.2Very high55 Ų5574.9 Ų74.929%0.29442%0.415SS..G310 helixtrans-63.8-22.5179.1-77.1-10.6000111.4Q137 M138 D252 Y256 T257Q137-D254 HydrophobicContact CB-CB 4.44Å; Q137-D254 WeakPolarHBondContact CB-O 3.28Å; M138-D254 HydrophobicContact CE-CB 3.53Å; M138-D254 WeakPolarHBondContact CE-OD2 3.46Å; M138-D254 HydrophobicContact CG-CB 3.81Å; D252-D254 PolarHBondContact O-N 3.47Å; D252-D254 WeakPolarHBondContact OD1-CB 3.43Å; D252-D254 PolarHBondContact OD1-N 3.15Å; D254-Y256 PolarHBondContact O-N 3.22Å; D254-T257 PolarHBondContact O-N 3.42Å
255N97.5Very high97Very high20 Ų2071.4 Ų71.411%0.10740%0.398CS..G310 helixtrans-73.8-4.8176.7-139.732.3000114.2G136 M138 S139 D252 P253 T257G136-N255 VanDerWaalsContact C-OD1 3.28Å; G136-N255 VanDerWaalsContact CA-OD1 3.24Å; G136-N255 WeakPolarHBondContact CA-OD1 3.41Å; M138-N255 HydrophobicContact CB-CB 4.18Å; M138-N255 PolarHBondContact N-OD1 2.84Å; S139-N255 PolarHBondContact N-OD1 3.18Å; S139-N255 PolarHBondContact OG-ND2 2.84Å; S139-N255 PolarHBondContact OG-OD1 2.84Å; D252-N255 WeakPolarHBondContact O-CB 3.31Å; D252-N255 PolarHBondContact O-N 3.12Å; D252-N255 VanDerWaalsContact O-N 3.11Å; P253-N255 PolarHBondContact O-N 3.31Å; P253-N255 VanDerWaalsContact O-N 3.14Å; N255-T257 VanDerWaalsContact C-N 3.32Å
256Y97.6Very high96.6Very high100 Ų10069.8 Ų69.839%0.39240%0.404SS..G310 helixtrans-87.51.7167.4-74.5-71.9000113.6F63 R80 Y81 D248 P253 D254F63-Y256 WeakPolarHBondContact CZ-O 3.39Å; R80-Y256 PolarHBondContact NH1-OH 3.22Å; Y81-Y256 PolarHBondContact OH-OH 3.01Å; D248-Y256 WeakPolarHBondContact OD1-CE2 3.48Å; D248-Y256 PolarHBondContact OD1-OH 3.46Å; P253-Y256 WeakPolarHBondContact O-CB 3.48Å; P253-Y256 PolarHBondContact O-N 3.4Å; D254-Y256 PolarHBondContact O-N 3.22Å
257T97.9Very high96.4Very high79 Ų7970 Ų7049%0.48540%0.401SS..SBendtrans-104.5133.2170.4-55.40000109.4G136 Q137 D254 N255 A259G136-T257 CarbonylContact C-O 3.25Å; G136-T257 WeakPolarHBondContact CA-O 3.16Å; Q137-T257 HydrophobicContact CG-CG2 4.05Å; Q137-T257 PolarHBondContact N-O 3.38Å; D254-T257 PolarHBondContact O-N 3.42Å; N255-T257 VanDerWaalsContact C-N 3.32Å; T257-A259 PolarHBondContact O-N 2.82Å
258L97.7Very high96.2Very high91 Ų9169.9 Ų69.948%0.47640%0.397SS..BIsolated β-bridgetrans-54.2137.9175.7175.365000110.6F63 N260F63-L258 HydrophobicContact CB-CD1 3.45Å; F63-L258 VanDerWaalsContact CB-CD1 3.45Å; F63-L258 HydrophobicContact CD1-CB 4.19Å; F63-L258 HydrophobicContact CD1-CD1 4.13Å; F63-L258 HydrophobicContact CD2-CB 4.47Å; F63-L258 HydrophobicContact CD2-CD1 4.24Å; F63-L258 HydrophobicContact CE1-CB 4.33Å; F63-L258 HydrophobicContact CG-CB 4.28Å; F63-L258 HydrophobicContact CG-CD1 3.69Å; L258-N260 PolarHBondContact O-N 3.35Å
259A97.2Very high96Very high14 Ų1469.2 Ų69.212%0.11639%0.391CS..  trans-53.1128.8176.200000112.1W135 F140 T257W135-A259 HydrophobicContact CG-CB 4.42Å; W135-A259 WeakPolarHBondContact O-CB 3.19Å; W135-A259 PolarHBondContact O-N 2.98Å; W135-A259 VanDerWaalsContact O-N 3.12Å; F140-A259 HydrophobicContact CB-CB 3.52Å; F140-A259 HydrophobicContact CD2-CB 4.29Å; F140-A259 HydrophobicContact CG-CB 3.94Å; T257-A259 PolarHBondContact O-N 2.82Å
260N97Very high95.9Very high66 Ų6664.3 Ų64.335%0.35337%0.367SS..  trans-125.8108.6173-177.2-13.6000109.3W141 L258 L262 N263W141-N260 PolarHBondContact NE1-O 3.07Å; L258-N260 PolarHBondContact O-N 3.35Å; N260-L262 PolarHBondContact O-N 3.45Å; N260-L262 WeakPolarHBondContact OD1-CB 3.38Å; N260-L262 PolarHBondContact OD1-N 3.25Å; N260-N263 HydrophobicContact CB-CB 4.16Å; N260-N263 PolarHBondContact O-N 3.02Å; N260-N263 VanDerWaalsContact O-N 3.1Å
261P95.8Very high95.9Very high80 Ų8062.8 Ų62.852%0.51936%0.358SS..THydrogen-bonded Turntrans-60.2-15.7179.3-24.434.2000114.9F140 W141F140-P261 HydrophobicContact CE1-CB 4.13Å; F140-P261 HydrophobicContact CE1-CG 4.3Å; F140-P261 HydrophobicContact CE2-CG 4.23Å; F140-P261 HydrophobicContact CZ-CB 3.86Å; F140-P261 HydrophobicContact CZ-CG 3.82Å; W141-P261 WeakPolarHBondContact CH2-O 3.34Å; W141-P261 WeakPolarHBondContact CZ2-O 3.47Å
262L96.4Very high96Very high165 Ų16563.7 Ų63.786%0.86435%0.349SS*.THydrogen-bonded Turntrans-101.4-5.3-178.8-54.8-179.8000113.5N260N260-L262 PolarHBondContact O-N 3.45Å; N260-L262 WeakPolarHBondContact OD1-CB 3.38Å; N260-L262 PolarHBondContact OD1-N 3.25Å
263N95.8Very high96.1Very high93 Ų9363.1 Ų63.150%0.49735%0.345SS..  trans-128.6100.1-179.5-174.515.5000110.9Q137 W141 N260Q137-N263 PolarHBondContact NE2-O 3.42Å; W141-N263 PolarHBondContact NE1-O 3.3Å; W141-N263 VanDerWaalsContact NE1-O 3.1Å; N260-N263 HydrophobicContact CB-CB 4.16Å; N260-N263 PolarHBondContact O-N 3.02Å; N260-N263 VanDerWaalsContact O-N 3.1Å
264T94.1Very high96.2Very high72 Ų7260 Ų6044%0.44232%0.322SS..  trans-78.8128.2179.8-47.90000111W141 I268W141-T264 HydrophobicContact CD2-CG2 4.16Å; W141-T264 HydrophobicContact CE3-CG2 4.17Å; W141-T264 HydrophobicContact CH2-CG2 4.48Å; W141-T264 VanDerWaalsContact CH2-OG1 3.28Å; W141-T264 WeakPolarHBondContact CH2-OG1 3.35Å; W141-T264 HydrophobicContact CZ2-CG2 4.46Å; W141-T264 WeakPolarHBondContact CZ2-OG1 3.47Å; W141-T264 HydrophobicContact CZ3-CG2 4.34Å; T264-I268 HydrophobicContact CG2-CD1 3.48Å; T264-I268 VanDerWaalsContact CG2-CD1 3.48Å; T264-I268 HydrophobicContact CG2-CG1 4.25Å
265P94Very high96.3Very high11 Ų1158.2 Ų58.27%0.07131%0.312CS..  trans-57.1150.2172.8-28.335.8000112.6Q137 M138 W141 H267 I268Q137-P265 HydrophobicContact CB-CG 3.87Å; M138-P265 HydrophobicContact CE-CB 3.53Å; M138-P265 HydrophobicContact CE-CG 4.05Å; W141-P265 HydrophobicContact CG-CG 4.38Å; P265-H267 VanDerWaalsContact C-N 3.26Å; P265-H267 PolarHBondContact O-N 3.09Å; P265-I268 HydrophobicContact CB-CG1 4.41Å
266P90.9Very high96.3Very high134 Ų13458.3 Ų58.387%0.8731%0.312SS*.SBendtrans-58.4-35-178.5-2533.8000114.1
267H92.5Very high96.4Very high48 Ų4853.8 Ų53.822%0.22230%0.295CS..SBendtrans-141.192.1-179.7-173.3-132.9000111.7P265 K269 R282 G340 Q341P265-H267 VanDerWaalsContact C-N 3.26Å; P265-H267 PolarHBondContact O-N 3.09Å; H267-K269 PolarHBondContact O-N 2.58Å; H267-R282 PolarHBondContact NE2-NH1 3.44Å; H267-G340 PolarHBondContact CE1-O 3.04Å; H267-G340 VanDerWaalsContact CE1-O 3.24Å; H267-Q341 PolarHBondContact CE1-O 3.29Å; H267-Q341 PolarHBondContact NE2-O 3.08Å
268I93.9Very high96.4Very high30 Ų3051.3 Ų51.315%0.15428%0.277CS..  trans-73.6122.2175-55.7162.1000109.6W141 V145 T264 P265 Y278W141-I268 HydrophobicContact CB-CD1 3.76Å; W141-I268 HydrophobicContact CB-CG1 3.92Å; W141-I268 HydrophobicContact CB-CG2 4.13Å; W141-I268 HydrophobicContact CD2-CD1 4.35Å; W141-I268 HydrophobicContact CE3-CD1 4.24Å; W141-I268 HydrophobicContact CG-CD1 4.19Å; V145-I268 HydrophobicContact CG2-CD1 4.15Å; V145-I268 HydrophobicContact CG2-CG2 4.33Å; T264-I268 HydrophobicContact CG2-CD1 3.48Å; T264-I268 VanDerWaalsContact CG2-CD1 3.48Å; T264-I268 HydrophobicContact CG2-CG1 4.25Å; P265-I268 HydrophobicContact CB-CG1 4.41Å; I268-Y278 PolarHBondContact O-OH 3.26Å; I268-Y278 VanDerWaalsContact O-OH 3.13Å
269K94.7Very high96.5Very high59 Ų5947.1 Ų47.126%0.25726%0.255SS..  trans-143.5152.7176.562-174.8175.3-176.10109.5D252 H267 L275 Y278D252-K269 WeakPolarHBondContact OD2-CE 3.35Å; D252-K269 IonicContact OD2-NZ 2.87Å; D252-K269 PolarHBondContact OD2-NZ 2.92Å; H267-K269 PolarHBondContact O-N 2.58Å; K269-L275 HydrophobicContact CB-CD2 4.15Å; K269-Y278 HydrophobicContact CB-CE1 4.32Å
270P96.6Very high96.5Very high21 Ų2146.5 Ų46.514%0.13625%0.25CC..  trans-77.5174.1171.235.8-36.8000110.9F274 L275 Y278P270-F274 HydrophobicContact CB-CB 3.81Å; P270-F274 HydrophobicContact CB-CD2 4.15Å; P270-F274 HydrophobicContact CB-CG 4.42Å; P270-F274 HydrophobicContact CG-CB 3.73Å; P270-L275 HydrophobicContact CG-CD2 4.11Å; P270-L275 WeakPolarHBondContact O-CD2 3.15Å; P270-Y278 HydrophobicContact CG-CD1 4.48Å; P270-Y278 HydrophobicContact CG-CD2 4.46Å; P270-Y278 HydrophobicContact CG-CG 4.07Å
271E97.7Very high96.6Very high23 Ų2344.2 Ų44.211%0.10724%0.237CC..  trans-57.7156.5171.9-69.5-67.9111.600112.8Y131 Y273 F274Y131-E271 HydrophobicContact CD1-CG 4.23Å; Y131-E271 HydrophobicContact CD2-CG 3.46Å; Y131-E271 VanDerWaalsContact CD2-CG 3.46Å; Y131-E271 HydrophobicContact CE1-CG 4.16Å; Y131-E271 HydrophobicContact CE2-CG 3.37Å; Y131-E271 WeakPolarHBondContact CE2-OE1 3.26Å; Y131-E271 HydrophobicContact CG-CG 3.87Å; Y131-E271 PolarHBondContact OH-OE1 3.46Å; E271-Y273 HydrophobicContact CB-CD1 4.22Å; E271-Y273 HydrophobicContact CB-CE1 3.59Å; E271-Y273 HydrophobicContact CB-CE2 4.08Å; E271-Y273 HydrophobicContact CG-CE1 4.33Å; E271-Y273 PolarHBondContact O-N 3.39Å; E271-F274 PolarHBondContact O-N 3.34Å
272W98.6Very high96.7Very high62 Ų6243.2 Ų43.224%0.23522%0.223CC..G310 helixtrans-53.9-36.8-166.271.2-93.4000114.1S88 F91 I92 F95 F274 L275S88-W272 PolarHBondContact OG-NE1 3.08Å; F91-W272 HydrophobicContact CB-CH2 4.14Å; F91-W272 HydrophobicContact CB-CZ2 4.18Å; I92-W272 HydrophobicContact CD1-CH2 4.48Å; I92-W272 HydrophobicContact CD1-CZ2 4.28Å; I92-W272 HydrophobicContact CG1-CH2 3.54Å; I92-W272 HydrophobicContact CG1-CZ2 3.71Å; F95-W272 HydrophobicContact CD2-CH2 4.22Å; F95-W272 HydrophobicContact CD2-CZ3 4.17Å; F95-W272 HydrophobicContact CE2-CH2 4.06Å; F95-W272 AromaticContact CE2-CZ3 3.86Å; F95-W272 HydrophobicContact CE2-CZ3 3.86Å; W272-F274 PolarHBondContact O-N 3.31Å; W272-L275 HydrophobicContact CB-CD1 4.27Å; W272-L275 WeakPolarHBondContact O-CB 3.42Å; W272-L275 PolarHBondContact O-N 3.49Å; W272-L275 VanDerWaalsContact O-N 3.11Å
273Y98.5Very high96.7Very high9 Ų936 Ų364%0.03519%0.186CC..G310 helixtrans-70.6-8.2-178.945.6-96.2000114F91 F95 A127 E271F91-Y273 HydrophobicContact CB-CD1 4.23Å; F91-Y273 HydrophobicContact CB-CG 3.96Å; F91-Y273 AromaticContact CD1-CD2 3.96Å; F91-Y273 HydrophobicContact CD1-CD2 3.96Å; F91-Y273 HydrophobicContact CD1-CG 4.01Å; F91-Y273 AromaticContact CD2-CD1 3.78Å; F91-Y273 HydrophobicContact CD2-CD1 3.78Å; F91-Y273 AromaticContact CD2-CD2 3.52Å; F91-Y273 HydrophobicContact CD2-CD2 3.52Å; F91-Y273 HydrophobicContact CD2-CE1 4.08Å; F91-Y273 AromaticContact CD2-CE2 3.78Å; F91-Y273 HydrophobicContact CD2-CE2 3.78Å; F91-Y273 AromaticContact CD2-CG 3.52Å; F91-Y273 HydrophobicContact CD2-CG 3.52Å; F91-Y273 AromaticContact CE1-CD2 3.91Å; F91-Y273 HydrophobicContact CE1-CD2 3.91Å; F91-Y273 HydrophobicContact CE1-CG 4.43Å; F91-Y273 HydrophobicContact CE2-CD1 4.43Å; F91-Y273 AromaticContact CE2-CD2 3.48Å; F91-Y273 HydrophobicContact CE2-CD2 3.48Å; F91-Y273 VanDerWaalsContact CE2-CD2 3.48Å; F91-Y273 HydrophobicContact CE2-CE1 4.45Å; F91-Y273 AromaticContact CE2-CE2 3.44Å; F91-Y273 HydrophobicContact CE2-CE2 3.44Å; F91-Y273 VanDerWaalsContact CE2-CE2 3.44Å; F91-Y273 AromaticContact CE2-CG 4Å; F91-Y273 HydrophobicContact CE2-CG 4Å; F91-Y273 AromaticContact CE2-CZ 3.99Å; F91-Y273 HydrophobicContact CG-CD1 4.07Å; F91-Y273 AromaticContact CG-CD2 3.78Å; F91-Y273 HydrophobicContact CG-CD2 3.78Å; F91-Y273 HydrophobicContact CG-CE2 4.48Å; F91-Y273 AromaticContact CG-CG 3.53Å; F91-Y273 HydrophobicContact CG-CG 3.53Å; F91-Y273 AromaticContact CZ-CD2 3.68Å; F91-Y273 HydrophobicContact CZ-CD2 3.68Å; F91-Y273 AromaticContact CZ-CE2 3.87Å; F91-Y273 HydrophobicContact CZ-CE2 3.87Å; F91-Y273 HydrophobicContact CZ-CG 4.43Å; F95-Y273 WeakPolarHBondContact CZ-O 3.46Å; A127-Y273 HydrophobicContact CB-CE2 4.01Å; E271-Y273 HydrophobicContact CB-CD1 4.22Å; E271-Y273 HydrophobicContact CB-CE1 3.59Å; E271-Y273 HydrophobicContact CB-CE2 4.08Å; E271-Y273 HydrophobicContact CG-CE1 4.33Å; E271-Y273 PolarHBondContact O-N 3.39Å
274F98.6Very high96.8Very high29 Ų2934.1 Ų34.113%0.12718%0.178CC..G310 helixtrans-104-9.2171.6-65.7-57.2000113.8M124 F128 P270 E271 W272 F276 A277 Y278M124-F274 HydrophobicContact CB-CE1 3.84Å; M124-F274 HydrophobicContact CB-CZ 4.28Å; M124-F274 HydrophobicContact CE-CD1 3.66Å; M124-F274 HydrophobicContact CE-CE1 3.52Å; M124-F274 HydrophobicContact CG-CE1 3.85Å; M124-F274 WeakPolarHBondContact O-CZ 3.23Å; F128-F274 HydrophobicContact CB-CE2 4.28Å; F128-F274 HydrophobicContact CB-CZ 4.2Å; P270-F274 HydrophobicContact CB-CB 3.81Å; P270-F274 HydrophobicContact CB-CD2 4.15Å; P270-F274 HydrophobicContact CB-CG 4.42Å; P270-F274 HydrophobicContact CG-CB 3.73Å; E271-F274 PolarHBondContact O-N 3.34Å; W272-F274 PolarHBondContact O-N 3.31Å; F274-F276 VanDerWaalsContact C-N 3.3Å; F274-F276 PolarHBondContact O-N 2.82Å; F274-A277 PolarHBondContact O-N 3.49Å; F274-Y278 WeakPolarHBondContact O-CB 3.05Å; F274-Y278 PolarHBondContact O-N 3.46Å
275L98.7Very high96.9Very high17 Ų1736.7 Ų36.79%0.08920%0.196CC..Hα-helixtrans-62.8-34-170.3-68.9179.4000113.3K269 P270 W272 A277 Y278 T279 T336K269-L275 HydrophobicContact CB-CD2 4.15Å; P270-L275 HydrophobicContact CG-CD2 4.11Å; P270-L275 WeakPolarHBondContact O-CD2 3.15Å; W272-L275 HydrophobicContact CB-CD1 4.27Å; W272-L275 WeakPolarHBondContact O-CB 3.42Å; W272-L275 PolarHBondContact O-N 3.49Å; W272-L275 VanDerWaalsContact O-N 3.11Å; L275-A277 PolarHBondContact O-N 2.93Å; L275-Y278 HydrophobicContact CD2-CD1 4.34Å; L275-Y278 PolarHBondContact O-N 3.19Å; L275-T279 PolarHBondContact O-N 2.94Å; L275-T279 PolarHBondContact O-OG1 2.95Å; L275-T336 HydrophobicContact CB-CG2 4.06Å; L275-T336 WeakPolarHBondContact CB-O 3.36Å; L275-T336 HydrophobicContact CD1-CG2 4.33Å
276F98.8Very high97.1Very high22 Ų2240.6 Ų40.610%0.09622%0.216CC..Hα-helixtrans-61.2-46.3178.280.8-83.7000111.8F95 F274 T279 I280 L332 L335F95-F276 HydrophobicContact CE1-CE1 4.45Å; F95-F276 HydrophobicContact CZ-CE1 4.32Å; F274-F276 VanDerWaalsContact C-N 3.3Å; F274-F276 PolarHBondContact O-N 2.82Å; F276-T279 PolarHBondContact O-N 3.22Å; F276-I280 PolarHBondContact O-N 3.13Å; F276-L332 HydrophobicContact CB-CD2 4.22Å; F276-L332 HydrophobicContact CD2-CD2 3.66Å; F276-L332 HydrophobicContact CE2-CD2 4.33Å; F276-L332 HydrophobicContact CG-CD2 4.06Å; F276-L335 HydrophobicContact CB-CB 3.92Å
277A98.6Very high97.2Very high4 Ų439.1 Ų39.13%0.03320%0.196CC..Hα-helixtrans-71.9-34.5178.600000111.3F274 L275 T279 I280 L281 L294F274-A277 PolarHBondContact O-N 3.49Å; L275-A277 PolarHBondContact O-N 2.93Å; A277-T279 VanDerWaalsContact C-N 3.32Å; A277-T279 PolarHBondContact O-N 2.74Å; A277-I280 PolarHBondContact O-N 3.3Å; A277-L281 PolarHBondContact O-N 3.22Å; A277-L294 HydrophobicContact CB-CD1 4.29Å; A277-L294 HydrophobicContact CB-CG 4.28Å
278Y98.5Very high97.4Very high28 Ų2839.9 Ų39.911%0.1120%0.202CC..Hα-helixtrans-62.9-36.1173.3179.3-116.3000112.5I268 K269 P270 F274 L275 L281 R282I268-Y278 PolarHBondContact O-OH 3.26Å; I268-Y278 VanDerWaalsContact O-OH 3.13Å; K269-Y278 HydrophobicContact CB-CE1 4.32Å; P270-Y278 HydrophobicContact CG-CD1 4.48Å; P270-Y278 HydrophobicContact CG-CD2 4.46Å; P270-Y278 HydrophobicContact CG-CG 4.07Å; F274-Y278 WeakPolarHBondContact O-CB 3.05Å; F274-Y278 PolarHBondContact O-N 3.46Å; L275-Y278 HydrophobicContact CD2-CD1 4.34Å; L275-Y278 PolarHBondContact O-N 3.19Å; Y278-L281 HydrophobicContact CD2-CD2 4.11Å; Y278-L281 HydrophobicContact CE2-CD2 4.47Å; Y278-L281 WeakPolarHBondContact O-CB 3.14Å; Y278-R282 HydrophobicContact CE2-CG 4.16Å; Y278-R282 VanDerWaalsContact CZ-CD 3.43Å; Y278-R282 WeakPolarHBondContact O-CG 3.28Å; Y278-R282 PolarHBondContact O-N 3.3Å; Y278-R282 WeakPolarHBondContact OH-CD 3.35Å
279T98.8Very high97.6Very high2 Ų239.6 Ų39.61%0.01221%0.206CC..Hα-helixtrans-63.2-48.3170.7-64.80000111.3L275 F276 A277 L281 R282 S283 L335 I338 G339L275-T279 PolarHBondContact O-N 2.94Å; L275-T279 PolarHBondContact O-OG1 2.95Å; F276-T279 PolarHBondContact O-N 3.22Å; A277-T279 VanDerWaalsContact C-N 3.32Å; A277-T279 PolarHBondContact O-N 2.74Å; T279-L281 VanDerWaalsContact C-N 3.29Å; T279-L281 PolarHBondContact O-N 3.32Å; T279-R282 PolarHBondContact O-N 3.27Å; T279-R282 VanDerWaalsContact O-N 3.08Å; T279-S283 PolarHBondContact O-N 3.45Å; T279-S283 PolarHBondContact O-OG 3.02Å; T279-L335 WeakPolarHBondContact CB-O 3.44Å; T279-L335 HydrophobicContact CG2-CD2 3.53Å; T279-L335 PolarHBondContact OG1-O 3.08Å; T279-I338 HydrophobicContact CG2-CB 4.04Å; T279-I338 HydrophobicContact CG2-CG2 3.64Å; T279-G339 WeakPolarHBondContact OG1-CA 3.35Å; T279-G339 PolarHBondContact OG1-N 2.91Å
280I98.8Very high97.8Very high2 Ų236.8 Ų36.81%0.0119%0.193CC..Hα-helixtrans-58.3-41.6178.8-67171.1000111.5F276 A277 R282 S283 A293 S297 L335 Y358 F359F276-I280 PolarHBondContact O-N 3.13Å; A277-I280 PolarHBondContact O-N 3.3Å; I280-R282 PolarHBondContact O-N 3.32Å; I280-S283 PolarHBondContact O-N 3.26Å; I280-A293 HydrophobicContact CG2-CB 3.79Å; I280-S297 VanDerWaalsContact CD1-CB 3.49Å; I280-L335 HydrophobicContact CD1-CD1 4.05Å; I280-L335 HydrophobicContact CG1-CD1 4.21Å; I280-L335 HydrophobicContact CG1-CD2 4.13Å; I280-Y358 HydrophobicContact CD1-CD1 3.95Å; I280-Y358 HydrophobicContact CD1-CE1 4.28Å; I280-Y358 HydrophobicContact CD1-CG 4.28Å; I280-F359 HydrophobicContact CG2-CE2 3.86Å; I280-F359 HydrophobicContact CG2-CZ 4.33Å
281L98.4Very high97.9Very high18 Ų1836.5 Ų36.59%0.09419%0.192CC..Hα-helixtrans-54.3-51.4172.817065.7000111.8L149 A277 Y278 T279 S283 G290 L294L149-L281 HydrophobicContact CD1-CD1 4.37Å; L149-L281 HydrophobicContact CD1-CD2 3.68Å; L149-L281 HydrophobicContact CD2-CD1 4.23Å; L149-L281 HydrophobicContact CD2-CD2 4.15Å; A277-L281 PolarHBondContact O-N 3.22Å; Y278-L281 HydrophobicContact CD2-CD2 4.11Å; Y278-L281 HydrophobicContact CE2-CD2 4.47Å; Y278-L281 WeakPolarHBondContact O-CB 3.14Å; T279-L281 VanDerWaalsContact C-N 3.29Å; T279-L281 PolarHBondContact O-N 3.32Å; L281-S283 VanDerWaalsContact C-N 3.32Å; L281-S283 PolarHBondContact O-N 3.08Å; L281-G290 WeakPolarHBondContact CD1-O 3.48Å; L281-G290 WeakPolarHBondContact O-CA 3.45Å; L281-L294 HydrophobicContact CB-CB 4.13Å; L281-L294 HydrophobicContact CB-CD1 3.91Å; L281-L294 HydrophobicContact CD2-CD1 4.16Å; L281-L294 HydrophobicContact CG-CD1 4.5Å
282R97.2Very high97.9Very high59 Ų5939.7 Ų39.722%0.22321%0.209CC..Hα-helixtrans-74.7-20.3-175-67.7-171.2-62172.312.8113.6H267 Y278 T279 I280 V284 I338 G339 Q341H267-R282 PolarHBondContact NE2-NH1 3.44Å; Y278-R282 HydrophobicContact CE2-CG 4.16Å; Y278-R282 VanDerWaalsContact CZ-CD 3.43Å; Y278-R282 WeakPolarHBondContact O-CG 3.28Å; Y278-R282 PolarHBondContact O-N 3.3Å; Y278-R282 WeakPolarHBondContact OH-CD 3.35Å; T279-R282 PolarHBondContact O-N 3.27Å; T279-R282 VanDerWaalsContact O-N 3.08Å; I280-R282 PolarHBondContact O-N 3.32Å; R282-V284 VanDerWaalsContact C-N 3.25Å; R282-V284 PolarHBondContact O-N 2.92Å; R282-I338 PolarHBondContact NH2-O 2.89Å; R282-G339 PolarHBondContact NH2-O 2.78Å; R282-Q341 PolarHBondContact NH1-O 3.4Å; R282-Q341 PolarHBondContact NH2-O 3.1Å
283S98Very high97.9Very high13 Ų1337.4 Ų37.49%0.09120%0.203CC..Hα-helixtrans-66.6-26.4178.5-67.80000113.2T279 I280 L281 G351 Q352 S355T279-S283 PolarHBondContact O-N 3.45Å; T279-S283 PolarHBondContact O-OG 3.02Å; I280-S283 PolarHBondContact O-N 3.26Å; L281-S283 VanDerWaalsContact C-N 3.32Å; L281-S283 PolarHBondContact O-N 3.08Å; S283-G351 PolarHBondContact OG-O 3.44Å; S283-G351 VanDerWaalsContact OG-O 3.05Å; S283-Q352 WeakPolarHBondContact O-CG 3.05Å; S283-Q352 PolarHBondContact O-NE2 3.45Å; S283-Q352 PolarHBondContact OG-N 2.96Å; S283-S355 WeakPolarHBondContact CB-OG 3.48Å; S283-S355 PolarHBondContact OG-OG 2.8Å
284V98Very high97.8Very high53 Ų5338.7 Ų38.732%0.32121%0.21SC..SBendtrans-93117.6-179.3-175.30000109.9R282 N286 A293R282-V284 VanDerWaalsContact C-N 3.25Å; R282-V284 PolarHBondContact O-N 2.92Å; V284-N286 HydrophobicContact CG1-CB 4.27Å; V284-N286 PolarHBondContact O-N 2.72Å; V284-A293 HydrophobicContact CG2-CB 3.87Å
285P96.1Very high97.8Very high126 Ų12641.3 Ų41.382%0.81823%0.225SC*.SBendtrans-78.443.7-178.734.7-37.3000112.4
286N97.3Very high97.8Very high94 Ų9445 Ų4550%0.50325%0.245SC..SBendtrans-151.2130.1176.1-180-81000108.9V284 L288 G289 G290V284-N286 HydrophobicContact CG1-CB 4.27Å; V284-N286 PolarHBondContact O-N 2.72Å; N286-L288 PolarHBondContact O-N 3.5Å; N286-L288 PolarHBondContact OD1-N 3.23Å; N286-L288 VanDerWaalsContact OD1-N 3.07Å; N286-G289 PolarHBondContact O-N 2.86Å; N286-G289 PolarHBondContact OD1-N 3.36Å; N286-G290 PolarHBondContact O-N 3.31Å
287K94.2Very high97.8Very high103 Ų10344 Ų4445%0.44824%0.241SC..Hα-helixtrans-58.2-52.4-175.6-167.3-175.8-178.6176.80112.4N148 S151 A152 G290 V291N148-K287 PolarHBondContact O-NZ 2.81Å; S151-K287 PolarHBondContact OG-NZ 3.32Å; A152-K287 HydrophobicContact CB-CD 4.03Å; A152-K287 HydrophobicContact CB-CG 3.95Å; K287-G290 PolarHBondContact O-N 3.02Å; K287-V291 WeakPolarHBondContact O-CG2 2.93Å; K287-V291 PolarHBondContact O-N 3.24Å
288L96.6Very high97.7Very high64 Ų6444.6 Ų44.634%0.33524%0.243SC..Hα-helixtrans-65.7-44.7179.5176.660.3000111.2A152 P154 N286 G290 V291 L292A152-L288 HydrophobicContact CB-CB 4.27Å; A152-L288 HydrophobicContact CB-CD1 4.37Å; P154-L288 HydrophobicContact CG-CD2 4.42Å; N286-L288 PolarHBondContact O-N 3.5Å; N286-L288 PolarHBondContact OD1-N 3.23Å; N286-L288 VanDerWaalsContact OD1-N 3.07Å; L288-G290 VanDerWaalsContact C-N 3.32Å; L288-G290 PolarHBondContact O-N 3.48Å; L288-V291 PolarHBondContact O-N 3.46Å; L288-L292 HydrophobicContact CD1-CD1 4.23Å; L288-L292 HydrophobicContact CD1-CG 4.17Å; L288-L292 HydrophobicContact CG-CD1 4.12Å; L288-L292 HydrophobicContact CG-CG 4.47Å; L288-L292 WeakPolarHBondContact O-CG 2.91Å; L288-L292 PolarHBondContact O-N 3.32Å
289G98.2Very high97.7Very high23 Ų2347 Ų4724%0.23726%0.257CS..Hα-helixtrans-58.6-42.6177.500000112.6N286 L292 A293N286-G289 PolarHBondContact O-N 2.86Å; N286-G289 PolarHBondContact OD1-N 3.36Å; G289-L292 PolarHBondContact O-N 3.42Å; G289-A293 WeakPolarHBondContact O-CB 3.34Å; G289-A293 PolarHBondContact O-N 3.19Å
290G98Very high97.7Very high0 Ų047.3 Ų47.30%026%0.259CS..Hα-helixtrans-65.8-41.9175.300000112.7L281 N286 K287 L288 L292 A293 L294L281-G290 WeakPolarHBondContact CD1-O 3.48Å; L281-G290 WeakPolarHBondContact O-CA 3.45Å; N286-G290 PolarHBondContact O-N 3.31Å; K287-G290 PolarHBondContact O-N 3.02Å; L288-G290 VanDerWaalsContact C-N 3.32Å; L288-G290 PolarHBondContact O-N 3.48Å; G290-L292 VanDerWaalsContact C-N 3.33Å; G290-L292 PolarHBondContact O-N 3.03Å; G290-A293 PolarHBondContact O-N 3.39Å; G290-L294 WeakPolarHBondContact O-CB 3.45Å; G290-L294 PolarHBondContact O-N 3.37Å
291V97.7Very high97.7Very high16 Ų1648 Ų4810%0.09726%0.263CS..Hα-helixtrans-59.2-46.8174.8175.60000110.5L149 A152 K287 L288 L294 L295L149-V291 HydrophobicContact CB-CG2 4Å; L149-V291 HydrophobicContact CD2-CG2 4.3Å; A152-V291 HydrophobicContact CB-CG2 4.01Å; K287-V291 WeakPolarHBondContact O-CG2 2.93Å; K287-V291 PolarHBondContact O-N 3.24Å; L288-V291 PolarHBondContact O-N 3.46Å; V291-L294 PolarHBondContact O-N 2.81Å; V291-L295 HydrophobicContact CG1-CD1 4.27Å; V291-L295 WeakPolarHBondContact O-CG 3.48Å; V291-L295 PolarHBondContact O-N 3.03Å
292L98.2Very high97.7Very high89 Ų8949.1 Ų49.147%0.46627%0.274SS..Hα-helixtrans-63.4-42.8177-68.1174.5000111.5L288 G289 G290 L294 L295 L296L288-L292 HydrophobicContact CD1-CD1 4.23Å; L288-L292 HydrophobicContact CD1-CG 4.17Å; L288-L292 HydrophobicContact CG-CD1 4.12Å; L288-L292 HydrophobicContact CG-CG 4.47Å; L288-L292 WeakPolarHBondContact O-CG 2.91Å; L288-L292 PolarHBondContact O-N 3.32Å; G289-L292 PolarHBondContact O-N 3.42Å; G290-L292 VanDerWaalsContact C-N 3.33Å; G290-L292 PolarHBondContact O-N 3.03Å; L292-L294 PolarHBondContact O-N 3.12Å; L292-L295 PolarHBondContact O-N 3.09Å; L292-L296 VanDerWaalsContact O-CB 3.3Å; L292-L296 WeakPolarHBondContact O-CB 3.41Å; L292-L296 WeakPolarHBondContact O-CG 3.48Å; L292-L296 PolarHBondContact O-N 3.3Å
293A98.4Very high97.7Very high14 Ų1450.4 Ų50.412%0.11628%0.283CS..Hα-helixtrans-62.4-41177.700000112.3I280 V284 G289 G290 L296 S297I280-A293 HydrophobicContact CG2-CB 3.79Å; V284-A293 HydrophobicContact CG2-CB 3.87Å; G289-A293 WeakPolarHBondContact O-CB 3.34Å; G289-A293 PolarHBondContact O-N 3.19Å; G290-A293 PolarHBondContact O-N 3.39Å; A293-L296 PolarHBondContact O-N 2.85Å; A293-S297 WeakPolarHBondContact O-CB 3.22Å; A293-S297 PolarHBondContact O-N 3.19Å
294L97.9Very high97.7Very high36 Ų3650.5 Ų50.519%0.18828%0.283CS..Hα-helixtrans-61.7-48.6174174142.8000111.5A277 L281 G290 V291 L292 L296 S297A277-L294 HydrophobicContact CB-CD1 4.29Å; A277-L294 HydrophobicContact CB-CG 4.28Å; L281-L294 HydrophobicContact CB-CB 4.13Å; L281-L294 HydrophobicContact CB-CD1 3.91Å; L281-L294 HydrophobicContact CD2-CD1 4.16Å; L281-L294 HydrophobicContact CG-CD1 4.5Å; G290-L294 WeakPolarHBondContact O-CB 3.45Å; G290-L294 PolarHBondContact O-N 3.37Å; V291-L294 PolarHBondContact O-N 2.81Å; L292-L294 PolarHBondContact O-N 3.12Å; L294-L296 VanDerWaalsContact C-N 3.34Å; L294-L296 PolarHBondContact O-N 3.49Å; L294-S297 PolarHBondContact O-N 2.96Å; L294-S297 PolarHBondContact O-OG 2.96Å
295L97.3Very high97.7Very high84 Ų8449.6 Ų49.644%0.4428%0.278SS..Hα-helixtrans-60.9-45.3177.9-70.8173000111.1V291 L292 S297 I298 L299V291-L295 HydrophobicContact CG1-CD1 4.27Å; V291-L295 WeakPolarHBondContact O-CG 3.48Å; V291-L295 PolarHBondContact O-N 3.03Å; L292-L295 PolarHBondContact O-N 3.09Å; L295-S297 VanDerWaalsContact C-N 3.29Å; L295-S297 PolarHBondContact O-N 3.48Å; L295-I298 PolarHBondContact O-N 3.3Å; L295-L299 WeakPolarHBondContact O-CG 3.2Å; L295-L299 PolarHBondContact O-N 3.37Å
296L98.3Very high97.8Very high95 Ų9549.2 Ų49.250%0.49727%0.268SS..Hα-helixtrans-65.6-29.6178.4-70.9172.4000112.6L292 A293 L294 I298 L299 I300 F359L292-L296 VanDerWaalsContact O-CB 3.3Å; L292-L296 WeakPolarHBondContact O-CB 3.41Å; L292-L296 WeakPolarHBondContact O-CG 3.48Å; L292-L296 PolarHBondContact O-N 3.3Å; A293-L296 PolarHBondContact O-N 2.85Å; L294-L296 VanDerWaalsContact C-N 3.34Å; L294-L296 PolarHBondContact O-N 3.49Å; L296-I298 PolarHBondContact O-N 2.78Å; L296-I298 VanDerWaalsContact O-N 3.15Å; L296-L299 PolarHBondContact O-N 2.82Å; L296-I300 WeakPolarHBondContact O-CB 3.47Å; L296-I300 WeakPolarHBondContact O-CG2 3.26Å; L296-I300 PolarHBondContact O-N 3.07Å; L296-F359 HydrophobicContact CB-CE1 4.18Å; L296-F359 HydrophobicContact CB-CZ 4.31Å
297S98.4Very high97.8Very high2 Ų246.4 Ų46.41%0.01425%0.253CS..Hα-helixtrans-63.7-18.7175.975.50000114.1I280 A293 L294 L295 Y358I280-S297 VanDerWaalsContact CD1-CB 3.49Å; A293-S297 WeakPolarHBondContact O-CB 3.22Å; A293-S297 PolarHBondContact O-N 3.19Å; L294-S297 PolarHBondContact O-N 2.96Å; L294-S297 PolarHBondContact O-OG 2.96Å; L295-S297 VanDerWaalsContact C-N 3.29Å; L295-S297 PolarHBondContact O-N 3.48Å; S297-Y358 PolarHBondContact O-OH 3.02Å
298I98.4Very high98Very high16 Ų1643.5 Ų43.58%0.08224%0.241CC..Hα-helixtrans-101.5-47175-54.1161.4000109.4L120 L121 M124 L295 L296 I300 L301L120-I298 HydrophobicContact CD2-CG2 3.91Å; L121-I298 HydrophobicContact CD2-CG2 3.77Å; L121-I298 HydrophobicContact CG-CG2 4.45Å; M124-I298 HydrophobicContact CE-CD1 3.42Å; M124-I298 VanDerWaalsContact CE-CD1 3.42Å; M124-I298 HydrophobicContact CE-CG1 4.16Å; M124-I298 HydrophobicContact SD-CD1 3.9Å; M124-I298 HydrophobicContact SD-CG1 4.46Å; M124-I298 HydrophobicContact SD-CG2 4.36Å; L295-I298 PolarHBondContact O-N 3.3Å; L296-I298 PolarHBondContact O-N 2.78Å; L296-I298 VanDerWaalsContact O-N 3.15Å; I298-I300 PolarHBondContact O-N 3.49Å; I298-L301 WeakPolarHBondContact O-CB 3.14Å; I298-L301 WeakPolarHBondContact O-CG 3.42Å; I298-L301 PolarHBondContact O-N 3.34Å
299L98.3Very high98Very high79 Ų7944.6 Ų44.641%0.41425%0.245SC..Hα-helixtrans-68.1-16.9-177.5-65.7179.9000113.7L121 L295 L296 L301 A302L121-L299 HydrophobicContact CD1-CD2 4.18Å; L295-L299 WeakPolarHBondContact O-CG 3.2Å; L295-L299 PolarHBondContact O-N 3.37Å; L296-L299 PolarHBondContact O-N 2.82Å; L299-L301 PolarHBondContact O-N 2.83Å; L299-L301 VanDerWaalsContact O-N 3.12Å; L299-A302 WeakPolarHBondContact O-CB 3.29Å; L299-A302 PolarHBondContact O-N 3.32Å
300I98.5Very high98Very high7 Ų744 Ų444%0.03624%0.237CC..G310 helixtrans-57.4-24.6172.2-166.1167.5000112.6L296 I298 A302 M303 Y358 F359 I362 L363L296-I300 WeakPolarHBondContact O-CB 3.47Å; L296-I300 WeakPolarHBondContact O-CG2 3.26Å; L296-I300 PolarHBondContact O-N 3.07Å; I298-I300 PolarHBondContact O-N 3.49Å; I300-A302 PolarHBondContact O-N 2.88Å; I300-M303 WeakPolarHBondContact O-CB 3.32Å; I300-M303 PolarHBondContact O-N 3.34Å; I300-Y358 HydrophobicContact CG2-CE1 4.15Å; I300-Y358 VanDerWaalsContact CG2-OH 3.27Å; I300-Y358 WeakPolarHBondContact CG2-OH 3.38Å; I300-F359 HydrophobicContact CD1-CD1 3.72Å; I300-F359 HydrophobicContact CD1-CE1 4.09Å; I300-I362 HydrophobicContact CD1-CB 3.82Å; I300-I362 HydrophobicContact CD1-CD1 3.97Å; I300-I362 HydrophobicContact CD1-CG2 3.55Å; I300-I362 HydrophobicContact CG1-CG2 3.77Å; I300-I362 HydrophobicContact CG2-CD1 4.28Å; I300-L363 HydrophobicContact CD1-CD1 4.45Å; I300-L363 HydrophobicContact CD1-CD2 3.77Å; I300-L363 HydrophobicContact CD1-CG 3.9Å; I300-L363 HydrophobicContact CG1-CD2 4.11Å
301L98.6Very high98Very high18 Ų1850.4 Ų50.49%0.09427%0.265CS..G310 helixtrans-57.2-32.1172.9-67.7175.7000112.4I98 L102 W113 I117 L120 I298 L299 M303 I304I98-L301 HydrophobicContact CG2-CD1 4.39Å; I98-L301 HydrophobicContact CG2-CD2 4.13Å; L102-L301 HydrophobicContact CD2-CD2 4.41Å; W113-L301 HydrophobicContact CH2-CD2 4.4Å; W113-L301 HydrophobicContact CZ2-CB 4.16Å; W113-L301 HydrophobicContact CZ2-CD2 3.99Å; W113-L301 PolarHBondContact NE1-O 3.17Å; I117-L301 HydrophobicContact CD1-CB 3.82Å; I117-L301 HydrophobicContact CG1-CB 3.96Å; L120-L301 HydrophobicContact CD2-CD1 3.77Å; I298-L301 WeakPolarHBondContact O-CB 3.14Å; I298-L301 WeakPolarHBondContact O-CG 3.42Å; I298-L301 PolarHBondContact O-N 3.34Å; L299-L301 PolarHBondContact O-N 2.83Å; L299-L301 VanDerWaalsContact O-N 3.12Å; L301-M303 PolarHBondContact O-N 3.32Å; L301-I304 WeakPolarHBondContact O-CB 3.4Å; L301-I304 WeakPolarHBondContact O-CG1 3.33Å; L301-I304 PolarHBondContact O-N 3.16Å
302A98.2Very high98Very high40 Ų4051.6 Ų51.633%0.33127%0.27SS..G310 helixtrans-70.4-21.8177.100000112.7I117 L299 I300I117-A302 HydrophobicContact CD1-CB 3.9Å; L299-A302 WeakPolarHBondContact O-CB 3.29Å; L299-A302 PolarHBondContact O-N 3.32Å; I300-A302 PolarHBondContact O-N 2.88Å
303M97.6Very high98Very high86 Ų8649.4 Ų49.442%0.42426%0.257SS..G310 helixtrans-81.3-20.5176.6-60.7-59.6-65.400112.4I300 L301 I306 L307I300-M303 WeakPolarHBondContact O-CB 3.32Å; I300-M303 PolarHBondContact O-N 3.34Å; L301-M303 PolarHBondContact O-N 3.32Å; M303-I306 HydrophobicContact CE-CD1 4.46Å; M303-I306 WeakPolarHBondContact O-CB 3.43Å; M303-I306 PolarHBondContact O-N 3.27Å; M303-I306 HydrophobicContact SD-CD1 4.45Å; M303-L307 HydrophobicContact CB-CD1 3.91Å; M303-L307 HydrophobicContact CB-CG 4.39Å; M303-L307 VanDerWaalsContact O-CG 3.3Å; M303-L307 WeakPolarHBondContact O-CG 3.46Å; M303-L307 PolarHBondContact O-N 3.09Å
304I98.3Very high98Very high16 Ų1648.8 Ų48.88%0.08225%0.252CS..THydrogen-bonded Turntrans-54.9-45.9-173.7-60-68.3000113.5L102 F107 L301 I306 L307 H308 I362L102-I304 HydrophobicContact CD2-CB 4.48Å; L102-I304 HydrophobicContact CD2-CD1 4.24Å; L102-I304 HydrophobicContact CD2-CG1 4.02Å; L102-I304 HydrophobicContact CD2-CG2 3.88Å; F107-I304 HydrophobicContact CB-CG2 4.31Å; F107-I304 HydrophobicContact CD1-CG2 3.47Å; F107-I304 VanDerWaalsContact CD1-CG2 3.47Å; F107-I304 HydrophobicContact CD2-CG2 3.8Å; F107-I304 HydrophobicContact CE1-CG2 3.57Å; F107-I304 HydrophobicContact CE2-CG2 3.93Å; F107-I304 HydrophobicContact CG-CG2 3.58Å; F107-I304 HydrophobicContact CZ-CG2 3.81Å; L301-I304 WeakPolarHBondContact O-CB 3.4Å; L301-I304 WeakPolarHBondContact O-CG1 3.33Å; L301-I304 PolarHBondContact O-N 3.16Å; I304-I306 VanDerWaalsContact C-N 3.25Å; I304-I306 PolarHBondContact O-N 3.38Å; I304-L307 PolarHBondContact O-N 2.81Å; I304-H308 PolarHBondContact O-N 3.1Å; I304-I362 HydrophobicContact CD1-CG2 3.45Å; I304-I362 VanDerWaalsContact CD1-CG2 3.45Å
305P97.7Very high98Very high34 Ų3447.8 Ų47.822%0.22125%0.246CC..THydrogen-bonded Turntrans-60.2-35.7178-23.234.6000113.1F107 H308F107-P305 HydrophobicContact CB-CG 4.32Å; F107-P305 HydrophobicContact CD2-CB 4.32Å; F107-P305 HydrophobicContact CD2-CG 4.22Å; F107-P305 WeakPolarHBondContact O-CG 3.45Å; P305-H308 WeakPolarHBondContact O-CB 3.42Å; P305-H308 PolarHBondContact O-N 3.14Å
306I97.1Very high98Very high118 Ų11847.5 Ų47.561%0.60524%0.244SC*.THydrogen-bonded Turntrans-74.5-31.9-179.4-54.1170.7000110.9M303 I304 H308M303-I306 HydrophobicContact CE-CD1 4.46Å; M303-I306 WeakPolarHBondContact O-CB 3.43Å; M303-I306 PolarHBondContact O-N 3.27Å; M303-I306 HydrophobicContact SD-CD1 4.45Å; I304-I306 VanDerWaalsContact C-N 3.25Å; I304-I306 PolarHBondContact O-N 3.38Å; I306-H308 PolarHBondContact O-N 3.11Å
307L97.7Very high98Very high35 Ų3548.2 Ų48.218%0.18324%0.243CC..THydrogen-bonded Turntrans-79.2-4.5179.2-67.5172.1000113.2M303 I304 M309 I362 L363 P367M303-L307 HydrophobicContact CB-CD1 3.91Å; M303-L307 HydrophobicContact CB-CG 4.39Å; M303-L307 VanDerWaalsContact O-CG 3.3Å; M303-L307 WeakPolarHBondContact O-CG 3.46Å; M303-L307 PolarHBondContact O-N 3.09Å; I304-L307 PolarHBondContact O-N 2.81Å; L307-M309 PolarHBondContact O-N 2.89Å; L307-M309 VanDerWaalsContact O-N 3.16Å; L307-I362 HydrophobicContact CD1-CG2 4.16Å; L307-L363 HydrophobicContact CD1-CD2 3.85Å; L307-P367 HydrophobicContact CB-CG 4.04Å; L307-P367 HydrophobicContact CD2-CG 4.09Å
308H97.9Very high98Very high42 Ų4248.4 Ų48.419%0.19424%0.243CC..  trans-76.2102.6-179-172.777.8000112.2F107 L108 I304 P305 I306 S310 Q312F107-H308 HydrophobicContact CE2-CB 3.83Å; F107-H308 AromaticContact CE2-CG 3.93Å; F107-H308 AromaticContact CE2-ND1 3.81Å; F107-H308 HydrophobicContact CZ-CB 4.32Å; F107-H308 AromaticContact CZ-ND1 3.6Å; L108-H308 HydrophobicContact CD2-CB 4.29Å; I304-H308 PolarHBondContact O-N 3.1Å; P305-H308 WeakPolarHBondContact O-CB 3.42Å; P305-H308 PolarHBondContact O-N 3.14Å; I306-H308 PolarHBondContact O-N 3.11Å; H308-S310 PolarHBondContact NE2-O 3.44Å; H308-Q312 PolarHBondContact CE1-O 3.22Å
309M97.7Very high98Very high87 Ų8752 Ų5243%0.42927%0.268SS..  trans-103.3-3.1-179.3-59.5-59.5172.500114.1L307 P367 L371 N374L307-M309 PolarHBondContact O-N 2.89Å; L307-M309 VanDerWaalsContact O-N 3.16Å; M309-P367 HydrophobicContact CG-CB 4.05Å; M309-L371 HydrophobicContact CB-CD2 3.82Å; M309-L371 HydrophobicContact CB-CG 3.89Å; M309-L371 HydrophobicContact CG-CD2 4.47Å; M309-L371 HydrophobicContact CG-CG 4.39Å; M309-N374 PolarHBondContact O-ND2 3.1Å
310S98Very high98Very high10 Ų1051.3 Ų51.37%0.0726%0.264CS..  trans-77.2146.6-178172.80000111.4H308 Q312 R318H308-S310 PolarHBondContact NE2-O 3.44Å; S310-Q312 VanDerWaalsContact C-N 3.32Å; S310-Q312 WeakPolarHBondContact CB-O 3.23Å; S310-Q312 PolarHBondContact OG-N 3Å; S310-Q312 PolarHBondContact OG-O 2.69Å; S310-R318 WeakPolarHBondContact OG-CD 3.4Å; S310-R318 VanDerWaalsContact OG-CZ 3.31Å; S310-R318 PolarHBondContact OG-NE 2.86Å; S310-R318 PolarHBondContact OG-NH1 3.05Å
311K97.7Very high98Very high134 Ų13451 Ų5158%0.58326%0.263SS*.SBendtrans-81.9-13.8169.1-54.8-71.2-173.4170.50112.6N374 W379 A380K311-N374 PolarHBondContact N-OD1 3.46Å; K311-W379 HydrophobicContact CB-CD2 4.06Å; K311-W379 HydrophobicContact CB-CE3 3.5Å; K311-W379 VanDerWaalsContact CB-CE3 3.5Å; K311-W379 HydrophobicContact CB-CZ3 3.79Å; K311-W379 HydrophobicContact CG-CB 4.19Å; K311-W379 HydrophobicContact CG-CD2 4.25Å; K311-W379 HydrophobicContact CG-CE3 3.9Å; K311-W379 HydrophobicContact CG-CG 4.43Å; K311-A380 WeakPolarHBondContact CE-O 3.47Å; K311-A380 PolarHBondContact NZ-O 3.33Å
312Q98Very high98Very high42 Ų4252.6 Ų52.620%0.19627%0.27CS..SBendtrans-99.1130.3170.6-78.6161.5-32.300110.5H308 S310 R318 W379H308-Q312 PolarHBondContact CE1-O 3.22Å; S310-Q312 VanDerWaalsContact C-N 3.32Å; S310-Q312 WeakPolarHBondContact CB-O 3.23Å; S310-Q312 PolarHBondContact OG-N 3Å; S310-Q312 PolarHBondContact OG-O 2.69Å; Q312-R318 HydrophobicContact CB-CG 4.45Å; Q312-R318 PolarHBondContact O-NH1 3.39Å; Q312-R318 VanDerWaalsContact OE1-CG 3.25Å; Q312-W379 HydrophobicContact CB-CZ3 4.44Å; Q312-W379 VanDerWaalsContact CD-CH2 3.46Å; Q312-W379 HydrophobicContact CG-CH2 3.4Å; Q312-W379 VanDerWaalsContact CG-CH2 3.4Å; Q312-W379 HydrophobicContact CG-CZ3 3.56Å
313Q97.8Very high98.1Very high42 Ų4254 Ų5420%0.19628%0.277CS..SBendtrans-65.8-55.5177.9175.3169.13.100112.3G105 L108 N206G105-Q313 PolarHBondContact O-NE2 3.02Å; L108-Q313 HydrophobicContact CD1-CB 4.15Å; L108-Q313 HydrophobicContact CD1-CG 3.72Å; N206-Q313 PolarHBondContact ND2-NE2 3.14Å
314S98.3Very high98.1Very high2 Ų250.7 Ų50.71%0.01426%0.261CS..SBendtrans-83.2147.9-177174.60000112.5Y104 P208 M316 R318Y104-S314 WeakPolarHBondContact CD1-OG 3.19Å; P208-S314 WeakPolarHBondContact O-CB 3.38Å; P208-S314 PolarHBondContact O-OG 3.11Å; S314-M316 PolarHBondContact O-N 3.07Å; S314-M316 WeakPolarHBondContact OG-CB 3.18Å; S314-M316 PolarHBondContact OG-N 3.25Å; S314-M316 VanDerWaalsContact OG-N 3.08Å; S314-R318 WeakPolarHBondContact O-CD 3.24Å
315M98.6Very high98.1Very high14 Ų1451.4 Ų51.47%0.06926%0.263CS..G310 helixtrans-75.3-5.8170.4-64.6-175.1-175.400113.5Y103 F317 R318 Q322 Y325Y103-M315 HydrophobicContact CD2-CB 4.3Å; Y103-M315 HydrophobicContact CD2-SD 4.31Å; Y103-M315 HydrophobicContact CE1-CB 4.45Å; Y103-M315 HydrophobicContact CE2-CB 4.22Å; Y103-M315 HydrophobicContact CG-CB 4.48Å; Y103-M315 VanDerWaalsContact O-CB 3.28Å; Y103-M315 WeakPolarHBondContact O-CB 3.27Å; Y103-M315 VanDerWaalsContact O-CG 3.32Å; Y103-M315 WeakPolarHBondContact O-CG 3.44Å; Y103-M315 PolarHBondContact O-N 3.24Å; M315-F317 PolarHBondContact O-N 3.4Å; M315-R318 PolarHBondContact O-N 2.76Å; M315-Q322 HydrophobicContact CB-CG 4.17Å; M315-Q322 VanDerWaalsContact O-CG 3.26Å; M315-Q322 WeakPolarHBondContact O-CG 3.16Å; M315-Q322 PolarHBondContact O-NE2 3.33Å; M315-Y325 HydrophobicContact SD-CG 4.42Å
316M98Very high98.2Very high79 Ų7956.7 Ų56.739%0.38928%0.278SS..G310 helixtrans-52.2-32.9-176-178.7166.1177.500114.3P208 L209 S314 Q322P208-M316 HydrophobicContact CB-SD 4.3Å; L209-M316 HydrophobicContact CD2-CE 3.82Å; L209-M316 HydrophobicContact CD2-SD 3.69Å; S314-M316 PolarHBondContact O-N 3.07Å; S314-M316 WeakPolarHBondContact OG-CB 3.18Å; S314-M316 PolarHBondContact OG-N 3.25Å; S314-M316 VanDerWaalsContact OG-N 3.08Å; M316-Q322 PolarHBondContact O-NE2 3.49Å
317F98.1Very high98.3Very high109 Ų10954.4 Ų54.448%0.47827%0.267SS..G310 helixtrans-11020.7179.5-55.8-62.7000113.7L209 M315L209-F317 HydrophobicContact CD2-CE2 3.99Å; L209-F317 HydrophobicContact CD2-CZ 3.64Å; M315-F317 PolarHBondContact O-N 3.4Å
318R98.4Very high98.3Very high6 Ų653.1 Ų53.12%0.02326%0.261CS..  trans-127.877.3-171.5-70.3174.955.7-164.4-0.1110.9S310 Q312 S314 M315 L320 S321 Q322 S370 E373S310-R318 WeakPolarHBondContact OG-CD 3.4Å; S310-R318 VanDerWaalsContact OG-CZ 3.31Å; S310-R318 PolarHBondContact OG-NE 2.86Å; S310-R318 PolarHBondContact OG-NH1 3.05Å; Q312-R318 HydrophobicContact CB-CG 4.45Å; Q312-R318 PolarHBondContact O-NH1 3.39Å; Q312-R318 VanDerWaalsContact OE1-CG 3.25Å; S314-R318 WeakPolarHBondContact O-CD 3.24Å; M315-R318 PolarHBondContact O-N 2.76Å; R318-L320 VanDerWaalsContact C-N 3.3Å; R318-L320 PolarHBondContact O-N 3.33Å; R318-S321 PolarHBondContact NE-OG 2.92Å; R318-S321 PolarHBondContact NH2-OG 3.4Å; R318-S321 PolarHBondContact O-N 3.17Å; R318-S321 VanDerWaalsContact O-N 3.15Å; R318-Q322 WeakPolarHBondContact O-CG 3.24Å; R318-Q322 PolarHBondContact O-N 2.83Å; R318-S370 PolarHBondContact NH2-OG 3.44Å; R318-E373 VanDerWaalsContact CA-OE1 3.31Å; R318-E373 WeakPolarHBondContact CA-OE1 3.36Å; R318-E373 WeakPolarHBondContact CB-OE1 3.46Å; R318-E373 WeakPolarHBondContact CB-OE2 3.35Å; R318-E373 IonicContact CZ-OE2 3.49Å; R318-E373 IonicContact NE-OE2 3.64Å; R318-E373 PolarHBondContact NE-OE2 3.18Å; R318-E373 IonicContact NH2-OE2 2.95Å; R318-E373 PolarHBondContact NH2-OE2 3.25Å
319P98.3Very high98.3Very high92 Ų9252.4 Ų52.460%0.59726%0.262SS*.Hα-helixtrans-62.7-33.6-167.624-34.2000113.5Q322 S323P319-Q322 PolarHBondContact O-N 2.92Å; P319-S323 PolarHBondContact O-N 2.93Å; P319-S323 VanDerWaalsContact O-N 3.13Å
320L98.4Very high98.4Very high65 Ų6550.4 Ų50.434%0.3426%0.259SS..Hα-helixtrans-70.1-42.5177.4-59.9178.2000109.9R318 Q322 S323 L324 I369 I372 E373 M376R318-L320 VanDerWaalsContact C-N 3.3Å; R318-L320 PolarHBondContact O-N 3.33Å; L320-Q322 VanDerWaalsContact C-N 3.34Å; L320-Q322 PolarHBondContact O-N 3.37Å; L320-S323 PolarHBondContact O-N 2.98Å; L320-S323 PolarHBondContact O-OG 2.93Å; L320-L324 PolarHBondContact O-N 3.46Å; L320-L324 VanDerWaalsContact O-N 3.13Å; L320-I369 HydrophobicContact CB-CD1 4.43Å; L320-I369 HydrophobicContact CB-CG2 3.42Å; L320-I369 VanDerWaalsContact CB-CG2 3.42Å; L320-I369 HydrophobicContact CD1-CD1 4.33Å; L320-I369 HydrophobicContact CD1-CG2 4.46Å; L320-I372 HydrophobicContact CD1-CG2 4.38Å; L320-E373 HydrophobicContact CB-CG 4.25Å; L320-E373 WeakPolarHBondContact CB-OE1 3.44Å; L320-E373 HydrophobicContact CD1-CG 4.22Å; L320-E373 PolarHBondContact N-OE1 3.45Å; L320-M376 HydrophobicContact CD1-SD 4.09Å
321S98.6Very high98.4Very high1 Ų150.1 Ų50.11%0.00726%0.257CS..Hα-helixtrans-64.2-36.1174.8-63.70000113R318 S323 L324 Y325 E373R318-S321 PolarHBondContact NE-OG 2.92Å; R318-S321 PolarHBondContact NH2-OG 3.4Å; R318-S321 PolarHBondContact O-N 3.17Å; R318-S321 VanDerWaalsContact O-N 3.15Å; S321-S323 VanDerWaalsContact C-N 3.34Å; S321-S323 PolarHBondContact O-N 2.98Å; S321-L324 PolarHBondContact O-N 2.8Å; S321-Y325 PolarHBondContact O-N 2.94Å; S321-E373 PolarHBondContact N-OE1 3Å; S321-E373 PolarHBondContact OG-OE1 3.4Å; S321-E373 PolarHBondContact OG-OE2 2.9Å
322Q98.8Very high98.5Very high51 Ų5146.3 Ų46.324%0.23824%0.242CC..Hα-helixtrans-60.5-43.7172.8-69.3177.83800111.7Y103 M315 M316 R318 P319 L320 L324 Y325 W326Y103-Q322 HydrophobicContact CE2-CB 4.49Å; Y103-Q322 HydrophobicContact CE2-CG 3.95Å; Y103-Q322 VanDerWaalsContact OH-CD 3.23Å; Y103-Q322 WeakPolarHBondContact OH-CG 3.5Å; Y103-Q322 PolarHBondContact OH-OE1 3.12Å; M315-Q322 HydrophobicContact CB-CG 4.17Å; M315-Q322 VanDerWaalsContact O-CG 3.26Å; M315-Q322 WeakPolarHBondContact O-CG 3.16Å; M315-Q322 PolarHBondContact O-NE2 3.33Å; M316-Q322 PolarHBondContact O-NE2 3.49Å; R318-Q322 WeakPolarHBondContact O-CG 3.24Å; R318-Q322 PolarHBondContact O-N 2.83Å; P319-Q322 PolarHBondContact O-N 2.92Å; L320-Q322 VanDerWaalsContact C-N 3.34Å; L320-Q322 PolarHBondContact O-N 3.37Å; Q322-L324 VanDerWaalsContact C-N 3.32Å; Q322-L324 PolarHBondContact O-N 2.86Å; Q322-Y325 PolarHBondContact O-N 3.48Å; Q322-W326 PolarHBondContact O-N 3.39Å
323S98.5Very high98.5Very high68 Ų6850.3 Ų50.348%0.47627%0.265SS..Hα-helixtrans-61.6-40.9177.575.80000112P319 L320 S321 W326 L327P319-S323 PolarHBondContact O-N 2.93Å; P319-S323 VanDerWaalsContact O-N 3.13Å; L320-S323 PolarHBondContact O-N 2.98Å; L320-S323 PolarHBondContact O-OG 2.93Å; S321-S323 VanDerWaalsContact C-N 3.34Å; S321-S323 PolarHBondContact O-N 2.98Å; S323-W326 PolarHBondContact O-N 2.99Å; S323-L327 WeakPolarHBondContact O-CB 3.34Å; S323-L327 PolarHBondContact O-N 3.27Å
324L98.5Very high98.6Very high17 Ų1751.5 Ų51.59%0.08927%0.272CS..Hα-helixtrans-68.5-36.1175.4-73.4-173.1000113.1L320 S321 Q322 L327 L328 L365 M366 I369L320-L324 PolarHBondContact O-N 3.46Å; L320-L324 VanDerWaalsContact O-N 3.13Å; S321-L324 PolarHBondContact O-N 2.8Å; Q322-L324 VanDerWaalsContact C-N 3.32Å; Q322-L324 PolarHBondContact O-N 2.86Å; L324-L327 HydrophobicContact CD2-CD2 4.07Å; L324-L327 PolarHBondContact O-N 3.22Å; L324-L328 WeakPolarHBondContact O-CB 3.35Å; L324-L328 PolarHBondContact O-N 2.85Å; L324-L365 HydrophobicContact CD1-CB 3.72Å; L324-L365 WeakPolarHBondContact CD1-O 3.32Å; L324-L365 HydrophobicContact CD2-CB 4.17Å; L324-L365 HydrophobicContact CD2-CD1 4.19Å; L324-M366 HydrophobicContact CB-CG 4.37Å; L324-M366 HydrophobicContact CD1-CG 4.19Å; L324-I369 HydrophobicContact CD1-CB 3.88Å; L324-I369 HydrophobicContact CD1-CG1 3.57Å; L324-I369 HydrophobicContact CD1-CG2 4.33Å; L324-I369 HydrophobicContact CG-CG1 4.45Å
325Y98.8Very high98.6Very high31 Ų3151.4 Ų51.412%0.12227%0.271CS..Hα-helixtrans-61.2-46.1173.7171-91000111.2G99 L102 Y103 M315 S321 Q322 L328 A329G99-Y325 WeakPolarHBondContact CA-OH 3.43Å; G99-Y325 WeakPolarHBondContact O-CE2 3.45Å; G99-Y325 PolarHBondContact O-OH 3.03Å; L102-Y325 HydrophobicContact CB-CE2 4.2Å; Y103-Y325 AromaticContact CD2-CD1 3.51Å; Y103-Y325 HydrophobicContact CD2-CD1 3.51Å; Y103-Y325 HydrophobicContact CD2-CD2 4.05Å; Y103-Y325 AromaticContact CD2-CE1 3.74Å; Y103-Y325 HydrophobicContact CD2-CE1 3.74Å; Y103-Y325 HydrophobicContact CD2-CE2 4.26Å; Y103-Y325 AromaticContact CD2-CG 3.67Å; Y103-Y325 HydrophobicContact CD2-CG 3.67Å; Y103-Y325 HydrophobicContact CE2-CD1 4.04Å; Y103-Y325 HydrophobicContact CE2-CE1 4.46Å; Y103-Y325 HydrophobicContact CE2-CG 4.4Å; M315-Y325 HydrophobicContact SD-CG 4.42Å; S321-Y325 PolarHBondContact O-N 2.94Å; Q322-Y325 PolarHBondContact O-N 3.48Å; Y325-L328 WeakPolarHBondContact O-CB 3.48Å; Y325-L328 PolarHBondContact O-N 2.86Å; Y325-A329 PolarHBondContact O-N 3.39Å
326W98.8Very high98.6Very high145 Ų14552.5 Ų52.555%0.54928%0.278SS..Hα-helixtrans-71.5-31.6178.5-71.4116.7000112.7Q322 S323 A329 A330Q322-W326 PolarHBondContact O-N 3.39Å; S323-W326 PolarHBondContact O-N 2.99Å; W326-A329 HydrophobicContact CE3-CB 4.12Å; W326-A329 PolarHBondContact O-N 3.19Å; W326-A330 WeakPolarHBondContact O-CB 3.44Å; W326-A330 PolarHBondContact O-N 3.41Å
327L98.7Very high98.7Very high70 Ų7054.8 Ų54.837%0.36628%0.283SS..Hα-helixtrans-59.9-47.2168.6-179.764.9000111S323 L324 A329 A330 D331 L357S323-L327 WeakPolarHBondContact O-CB 3.34Å; S323-L327 PolarHBondContact O-N 3.27Å; L324-L327 HydrophobicContact CD2-CD2 4.07Å; L324-L327 PolarHBondContact O-N 3.22Å; L327-A329 VanDerWaalsContact C-N 3.35Å; L327-A329 PolarHBondContact O-N 3.29Å; L327-A330 PolarHBondContact O-N 2.89Å; L327-D331 WeakPolarHBondContact O-CB 3.45Å; L327-D331 PolarHBondContact O-N 3.4Å; L327-L357 HydrophobicContact CD1-CD2 4.28Å; L327-L357 HydrophobicContact CD2-CD1 4.34Å
328L98.8Very high98.7Very high9 Ų949.9 Ų49.95%0.04726%0.261CS..Hα-helixtrans-61.6-42.1176.5179.163.6000111.9L324 Y325 D331 L332 Y358 T361 I362 M366L324-L328 WeakPolarHBondContact O-CB 3.35Å; L324-L328 PolarHBondContact O-N 2.85Å; Y325-L328 WeakPolarHBondContact O-CB 3.48Å; Y325-L328 PolarHBondContact O-N 2.86Å; L328-D331 PolarHBondContact O-N 3.36Å; L328-L332 WeakPolarHBondContact O-CG 3.42Å; L328-L332 PolarHBondContact O-N 3.27Å; L328-Y358 HydrophobicContact CD1-CD2 3.63Å; L328-Y358 HydrophobicContact CD1-CE2 3.93Å; L328-T361 HydrophobicContact CB-CG2 4.11Å; L328-I362 HydrophobicContact CD1-CD1 4.08Å; L328-I362 HydrophobicContact CD1-CG1 4.1Å; L328-I362 HydrophobicContact CD2-CD1 4.2Å; L328-I362 HydrophobicContact CD2-CG1 3.93Å; L328-M366 HydrophobicContact CB-CE 4.3Å; L328-M366 HydrophobicContact CD2-CE 3.78Å
329A98.8Very high98.7Very high27 Ų2749.6 Ų49.622%0.22326%0.26CS..Hα-helixtrans-63-43.6176.600000111.8Y325 W326 L327 L332 L333Y325-A329 PolarHBondContact O-N 3.39Å; W326-A329 HydrophobicContact CE3-CB 4.12Å; W326-A329 PolarHBondContact O-N 3.19Å; L327-A329 VanDerWaalsContact C-N 3.35Å; L327-A329 PolarHBondContact O-N 3.29Å; A329-L332 PolarHBondContact O-N 3.41Å; A329-L333 WeakPolarHBondContact O-CG 3.07Å; A329-L333 PolarHBondContact O-N 3.03Å
330A98.9Very high98.6Very high45 Ų4546.2 Ų46.237%0.37224%0.242SC..Hα-helixtrans-64.8-40.4175.600000112W326 L327 L333 I334W326-A330 WeakPolarHBondContact O-CB 3.44Å; W326-A330 PolarHBondContact O-N 3.41Å; L327-A330 PolarHBondContact O-N 2.89Å; A330-L333 WeakPolarHBondContact O-CB 3.25Å; A330-L333 PolarHBondContact O-N 2.88Å; A330-I334 WeakPolarHBondContact O-CG1 3.32Å; A330-I334 PolarHBondContact O-N 2.96Å
331D98.9Very high98.6Very high3 Ų345.6 Ų45.62%0.01624%0.237CC..Hα-helixtrans-63.2-41.2176.6-172.955.5000112L327 L328 L333 I334 L335 A354 L357 Y358L327-D331 WeakPolarHBondContact O-CB 3.45Å; L327-D331 PolarHBondContact O-N 3.4Å; L328-D331 PolarHBondContact O-N 3.36Å; D331-L333 VanDerWaalsContact C-N 3.31Å; D331-L333 PolarHBondContact O-N 3.31Å; D331-I334 WeakPolarHBondContact O-CB 3.38Å; D331-I334 PolarHBondContact O-N 2.85Å; D331-I334 VanDerWaalsContact O-N 3.14Å; D331-L335 WeakPolarHBondContact O-CG 3.45Å; D331-L335 PolarHBondContact O-N 2.92Å; D331-A354 VanDerWaalsContact OD1-CA 3.3Å; D331-A354 WeakPolarHBondContact OD1-CA 3.38Å; D331-A354 WeakPolarHBondContact OD1-CB 3.08Å; D331-A354 VanDerWaalsContact OD2-O 3.07Å; D331-L357 HydrophobicContact CB-CD2 4.25Å; D331-Y358 VanDerWaalsContact OD2-CA 3.28Å; D331-Y358 WeakPolarHBondContact OD2-CA 3.31Å; D331-Y358 WeakPolarHBondContact OD2-CB 3.47Å; D331-Y358 PolarHBondContact OD2-N 2.55Å; D331-Y358 VanDerWaalsContact OD2-N 3.1Å
332L98.9Very high98.5Very high54 Ų5448.4 Ų48.428%0.28326%0.256SS..Hα-helixtrans-61.1-37.3172.1-78.5168.9000113F276 L328 A329 L335 T336 Y358F276-L332 HydrophobicContact CB-CD2 4.22Å; F276-L332 HydrophobicContact CD2-CD2 3.66Å; F276-L332 HydrophobicContact CE2-CD2 4.33Å; F276-L332 HydrophobicContact CG-CD2 4.06Å; L328-L332 WeakPolarHBondContact O-CG 3.42Å; L328-L332 PolarHBondContact O-N 3.27Å; A329-L332 PolarHBondContact O-N 3.41Å; L332-L335 HydrophobicContact CD2-CD1 4.41Å; L332-T336 WeakPolarHBondContact O-CB 3.38Å; L332-T336 PolarHBondContact O-N 3.44Å; L332-T336 PolarHBondContact O-OG1 3.47Å; L332-Y358 HydrophobicContact CD2-CD2 4.01Å; L332-Y358 HydrophobicContact CD2-CE2 3.76Å; L332-Y358 HydrophobicContact CG-CD2 4.38Å; L332-Y358 HydrophobicContact CG-CE2 4.29Å
333L98.8Very high98.3Very high126 Ų12650.8 Ų50.866%0.6627%0.274SS*.Hα-helixtrans-66.8-39.8173.6-67.5173.8000111.4A329 A330 D331 T336 W337A329-L333 WeakPolarHBondContact O-CG 3.07Å; A329-L333 PolarHBondContact O-N 3.03Å; A330-L333 WeakPolarHBondContact O-CB 3.25Å; A330-L333 PolarHBondContact O-N 2.88Å; D331-L333 VanDerWaalsContact C-N 3.31Å; D331-L333 PolarHBondContact O-N 3.31Å; L333-T336 PolarHBondContact O-N 2.84Å; L333-W337 WeakPolarHBondContact O-CB 3.38Å; L333-W337 PolarHBondContact O-N 3.33Å
334I98.9Very high98.2Very high68 Ų6850 Ų5035%0.34927%0.268SS..Hα-helixtrans-63.3-48.3174.1-68.3167.9000110.3A330 D331 T336 W337 I338 I350 A354A330-I334 WeakPolarHBondContact O-CG1 3.32Å; A330-I334 PolarHBondContact O-N 2.96Å; D331-I334 WeakPolarHBondContact O-CB 3.38Å; D331-I334 PolarHBondContact O-N 2.85Å; D331-I334 VanDerWaalsContact O-N 3.14Å; I334-T336 VanDerWaalsContact C-N 3.27Å; I334-T336 PolarHBondContact O-N 3.05Å; I334-W337 HydrophobicContact CG2-CE3 4.43Å; I334-W337 PolarHBondContact O-N 2.9Å; I334-I338 HydrophobicContact CG2-CG1 4.15Å; I334-I338 WeakPolarHBondContact O-CB 3.24Å; I334-I338 VanDerWaalsContact O-CG1 3.29Å; I334-I338 WeakPolarHBondContact O-CG1 3.41Å; I334-I338 PolarHBondContact O-N 3.43Å; I334-I350 HydrophobicContact CG2-CG2 4Å; I334-A354 HydrophobicContact CG2-CB 4.08Å
335L98.9Very high98.1Very high0 Ų058.9 Ų58.90%030%0.302CS..Hα-helixtrans-57.6-41176.4-73.5170.8000111.6F276 T279 I280 D331 L332 G339 A354 Y358F276-L335 HydrophobicContact CB-CB 3.92Å; T279-L335 WeakPolarHBondContact CB-O 3.44Å; T279-L335 HydrophobicContact CG2-CD2 3.53Å; T279-L335 PolarHBondContact OG1-O 3.08Å; I280-L335 HydrophobicContact CD1-CD1 4.05Å; I280-L335 HydrophobicContact CG1-CD1 4.21Å; I280-L335 HydrophobicContact CG1-CD2 4.13Å; D331-L335 WeakPolarHBondContact O-CG 3.45Å; D331-L335 PolarHBondContact O-N 2.92Å; L332-L335 HydrophobicContact CD2-CD1 4.41Å; L335-G339 PolarHBondContact O-N 3.11Å; L335-A354 HydrophobicContact CD2-CB 3.6Å; L335-A354 HydrophobicContact CG-CB 3.96Å; L335-Y358 HydrophobicContact CD1-CD2 4.26Å; L335-Y358 HydrophobicContact CD1-CG 4.31Å
336T98.8Very high98Very high36 Ų3659.8 Ų59.822%0.22131%0.312CS..Hα-helixtrans-63.6-48175.7-57.90000111.1L275 L332 L333 I334 G339 G340L275-T336 HydrophobicContact CB-CG2 4.06Å; L275-T336 WeakPolarHBondContact CB-O 3.36Å; L275-T336 HydrophobicContact CD1-CG2 4.33Å; L332-T336 WeakPolarHBondContact O-CB 3.38Å; L332-T336 PolarHBondContact O-N 3.44Å; L332-T336 PolarHBondContact O-OG1 3.47Å; L333-T336 PolarHBondContact O-N 2.84Å; I334-T336 VanDerWaalsContact C-N 3.27Å; I334-T336 PolarHBondContact O-N 3.05Å; T336-G339 PolarHBondContact O-N 3.36Å; T336-G340 PolarHBondContact O-N 2.87Å
337W98.7Very high98Very high128 Ų12855 Ų5549%0.48530%0.295SS..Hα-helixtrans-59.3-49.4177.4165.957.9000112L333 I334 G339 G340 Q341 F347 I350L333-W337 WeakPolarHBondContact O-CB 3.38Å; L333-W337 PolarHBondContact O-N 3.33Å; I334-W337 HydrophobicContact CG2-CE3 4.43Å; I334-W337 PolarHBondContact O-N 2.9Å; W337-G339 PolarHBondContact O-N 3.09Å; W337-G340 PolarHBondContact O-N 2.96Å; W337-G340 VanDerWaalsContact O-N 3.1Å; W337-Q341 WeakPolarHBondContact O-CG 3.44Å; W337-F347 HydrophobicContact CH2-CD1 4.38Å; W337-F347 HydrophobicContact CH2-CE1 4.04Å; W337-F347 HydrophobicContact CZ2-CD1 4.41Å; W337-F347 AromaticContact CZ2-CE1 3.77Å; W337-F347 HydrophobicContact CZ2-CE1 3.77Å; W337-I350 HydrophobicContact CZ3-CG2 4.5Å
338I98.7Very high97.9Very high5 Ų554.3 Ų54.33%0.02629%0.293CS..Hα-helixtrans-62.1-31.8178.1-65.2-61.9000111.5T279 R282 I334 G340 Q341 F347 I350T279-I338 HydrophobicContact CG2-CB 4.04Å; T279-I338 HydrophobicContact CG2-CG2 3.64Å; R282-I338 PolarHBondContact NH2-O 2.89Å; I334-I338 HydrophobicContact CG2-CG1 4.15Å; I334-I338 WeakPolarHBondContact O-CB 3.24Å; I334-I338 VanDerWaalsContact O-CG1 3.29Å; I334-I338 WeakPolarHBondContact O-CG1 3.41Å; I334-I338 PolarHBondContact O-N 3.43Å; I338-G340 PolarHBondContact O-N 3.09Å; I338-Q341 WeakPolarHBondContact O-CB 3.25Å; I338-Q341 PolarHBondContact O-N 3.11Å; I338-F347 HydrophobicContact CD1-CB 4.26Å; I338-F347 HydrophobicContact CD1-CD1 3.74Å; I338-F347 HydrophobicContact CD1-CG 4.45Å; I338-I350 HydrophobicContact CD1-CB 3.88Å; I338-I350 HydrophobicContact CD1-CD1 4.37Å; I338-I350 HydrophobicContact CD1-CG2 3.66Å; I338-I350 HydrophobicContact CG1-CB 4.38Å; I338-I350 HydrophobicContact CG1-CG2 3.83Å
339G98Very high97.9Very high0 Ų057.8 Ų57.80%031%0.311CS..Hα-helixtrans-60.8-33.6177.300000112T279 R282 L335 T336 W337 Q341T279-G339 WeakPolarHBondContact OG1-CA 3.35Å; T279-G339 PolarHBondContact OG1-N 2.91Å; R282-G339 PolarHBondContact NH2-O 2.78Å; L335-G339 PolarHBondContact O-N 3.11Å; T336-G339 PolarHBondContact O-N 3.36Å; W337-G339 PolarHBondContact O-N 3.09Å; G339-Q341 VanDerWaalsContact C-N 3.33Å
340G97Very high97.9Very high21 Ų2159.1 Ų59.122%0.21631%0.314CS..THydrogen-bonded Turntrans-80.4-8.4175.500000114.8H267 T336 W337 I338H267-G340 PolarHBondContact CE1-O 3.04Å; H267-G340 VanDerWaalsContact CE1-O 3.24Å; T336-G340 PolarHBondContact O-N 2.87Å; W337-G340 PolarHBondContact O-N 2.96Å; W337-G340 VanDerWaalsContact O-N 3.1Å; I338-G340 PolarHBondContact O-N 3.09Å
341Q97.9Very high97.9Very high52 Ų5257 Ų5724%0.24330%0.297CS..SBendtrans-93.3153.3-180-57.5-48.8-45.400112.3H267 R282 W337 I338 G339 F347H267-Q341 PolarHBondContact CE1-O 3.29Å; H267-Q341 PolarHBondContact NE2-O 3.08Å; R282-Q341 PolarHBondContact NH1-O 3.4Å; R282-Q341 PolarHBondContact NH2-O 3.1Å; W337-Q341 WeakPolarHBondContact O-CG 3.44Å; I338-Q341 WeakPolarHBondContact O-CB 3.25Å; I338-Q341 PolarHBondContact O-N 3.11Å; G339-Q341 VanDerWaalsContact C-N 3.33Å; Q341-F347 HydrophobicContact CB-CB 4.13Å; Q341-F347 HydrophobicContact CB-CD1 3.97Å; Q341-F347 HydrophobicContact CB-CD2 3.74Å; Q341-F347 HydrophobicContact CB-CE1 4.31Å; Q341-F347 HydrophobicContact CB-CE2 4.08Å; Q341-F347 HydrophobicContact CB-CG 3.67Å; Q341-F347 HydrophobicContact CB-CZ 4.35Å; Q341-F347 HydrophobicContact CG-CD1 3.83Å; Q341-F347 HydrophobicContact CG-CD2 4.32Å; Q341-F347 HydrophobicContact CG-CE1 3.83Å; Q341-F347 HydrophobicContact CG-CE2 4.3Å; Q341-F347 HydrophobicContact CG-CG 4.08Å; Q341-F347 HydrophobicContact CG-CZ 4.06Å
342P95.9Very high97.9Very high60 Ų6060.1 Ų60.139%0.3931%0.311SS..  trans-64.3158.2173.828.4-36.4000111.9S344 F347P342-S344 VanDerWaalsContact C-N 3.3Å; P342-S344 PolarHBondContact O-N 2.91Å; P342-F347 HydrophobicContact CG-CD2 4.36Å; P342-F347 HydrophobicContact CG-CE2 4.45Å
343V95.3Very high97.9Very high101 Ų10161.9 Ų61.961%0.61232%0.324SS*.SBendtrans-7981.3175.2-172.10000109.5
344S96Very high97.9Very high51 Ų5156.1 Ų56.136%0.35730%0.295SS..  trans-145.9165.7177.761.70000111.3P342 F347 T348P342-S344 VanDerWaalsContact C-N 3.3Å; P342-S344 PolarHBondContact O-N 2.91Å; S344-F347 WeakPolarHBondContact O-CA 3.44Å; S344-F347 WeakPolarHBondContact O-CB 3.38Å; S344-F347 PolarHBondContact O-N 3Å; S344-T348 PolarHBondContact O-N 3.3Å; S344-T348 PolarHBondContact O-OG1 2.86Å
345Y96.1Very high97.9Very high204 Ų20453.3 Ų53.380%0.828%0.281SS*.THydrogen-bonded Turntrans-66.6136.6169.8-179.2-91.2000110.3I349Y345-I349 HydrophobicContact CE2-CG2 4.4Å
346P97.4Very high97.9Very high51 Ų5157.8 Ų57.833%0.33131%0.309SS..THydrogen-bonded Turncis-92.31.61.936.8-35.8000114.7T348 I349 I350P346-T348 VanDerWaalsContact C-N 3.33Å; P346-T348 PolarHBondContact O-N 3.07Å; P346-I349 HydrophobicContact CB-CG2 4.49Å; P346-I349 WeakPolarHBondContact O-CG2 3.24Å; P346-I349 PolarHBondContact O-N 3.21Å; P346-I350 HydrophobicContact CB-CD1 4.24Å; P346-I350 HydrophobicContact CG-CD1 4.24Å; P346-I350 WeakPolarHBondContact O-CG1 3.4Å; P346-I350 PolarHBondContact O-N 3.04Å; P346-I350 VanDerWaalsContact O-N 3.17Å
347F98.4Very high97.9Very high44 Ų4458.7 Ų58.719%0.19331%0.311CS..Hα-helixtrans-63-34.8-173.3-56.5-54.7000113.9W337 I338 Q341 P342 S344 I349 I350 G351W337-F347 HydrophobicContact CH2-CD1 4.38Å; W337-F347 HydrophobicContact CH2-CE1 4.04Å; W337-F347 HydrophobicContact CZ2-CD1 4.41Å; W337-F347 AromaticContact CZ2-CE1 3.77Å; W337-F347 HydrophobicContact CZ2-CE1 3.77Å; I338-F347 HydrophobicContact CD1-CB 4.26Å; I338-F347 HydrophobicContact CD1-CD1 3.74Å; I338-F347 HydrophobicContact CD1-CG 4.45Å; Q341-F347 HydrophobicContact CB-CB 4.13Å; Q341-F347 HydrophobicContact CB-CD1 3.97Å; Q341-F347 HydrophobicContact CB-CD2 3.74Å; Q341-F347 HydrophobicContact CB-CE1 4.31Å; Q341-F347 HydrophobicContact CB-CE2 4.08Å; Q341-F347 HydrophobicContact CB-CG 3.67Å; Q341-F347 HydrophobicContact CB-CZ 4.35Å; Q341-F347 HydrophobicContact CG-CD1 3.83Å; Q341-F347 HydrophobicContact CG-CD2 4.32Å; Q341-F347 HydrophobicContact CG-CE1 3.83Å; Q341-F347 HydrophobicContact CG-CE2 4.3Å; Q341-F347 HydrophobicContact CG-CG 4.08Å; Q341-F347 HydrophobicContact CG-CZ 4.06Å; P342-F347 HydrophobicContact CG-CD2 4.36Å; P342-F347 HydrophobicContact CG-CE2 4.45Å; S344-F347 WeakPolarHBondContact O-CA 3.44Å; S344-F347 WeakPolarHBondContact O-CB 3.38Å; S344-F347 PolarHBondContact O-N 3Å; F347-I349 PolarHBondContact O-N 3.4Å; F347-I350 PolarHBondContact O-N 3.39Å; F347-G351 PolarHBondContact O-N 2.52Å
348T97.8Very high97.9Very high55 Ų5553.1 Ų53.134%0.33729%0.291SS..Hα-helixtrans-58.6-48.4176.5-53.30000111.9S344 P346 G351 Q352S344-T348 PolarHBondContact O-N 3.3Å; S344-T348 PolarHBondContact O-OG1 2.86Å; P346-T348 VanDerWaalsContact C-N 3.33Å; P346-T348 PolarHBondContact O-N 3.07Å; T348-G351 PolarHBondContact O-N 3.23Å; T348-Q352 WeakPolarHBondContact O-CG 3.45Å; T348-Q352 PolarHBondContact O-N 3.48Å; T348-Q352 VanDerWaalsContact O-N 3.08Å
349I98.5Very high97.9Very high83 Ų8355 Ų5543%0.42630%0.299SS..Hα-helixtrans-72.3-36.1-178.3-173.160.9000111.5Y345 P346 F347 G351 Q352 V353Y345-I349 HydrophobicContact CE2-CG2 4.4Å; P346-I349 HydrophobicContact CB-CG2 4.49Å; P346-I349 WeakPolarHBondContact O-CG2 3.24Å; P346-I349 PolarHBondContact O-N 3.21Å; F347-I349 PolarHBondContact O-N 3.4Å; I349-G351 VanDerWaalsContact C-N 3.34Å; I349-G351 PolarHBondContact O-N 2.97Å; I349-Q352 PolarHBondContact O-N 3.38Å; I349-V353 HydrophobicContact CD1-CG2 4.31Å; I349-V353 HydrophobicContact CG1-CG2 4.39Å; I349-V353 WeakPolarHBondContact O-CG2 3.48Å; I349-V353 PolarHBondContact O-N 3.24Å
350I98.8Very high98Very high54 Ų5457.2 Ų57.228%0.27731%0.312SS..Hα-helixtrans-61.9-45.4174.6-61.1165.6000110I334 W337 I338 P346 F347 Q352 V353 A354I334-I350 HydrophobicContact CG2-CG2 4Å; W337-I350 HydrophobicContact CZ3-CG2 4.5Å; I338-I350 HydrophobicContact CD1-CB 3.88Å; I338-I350 HydrophobicContact CD1-CD1 4.37Å; I338-I350 HydrophobicContact CD1-CG2 3.66Å; I338-I350 HydrophobicContact CG1-CB 4.38Å; I338-I350 HydrophobicContact CG1-CG2 3.83Å; P346-I350 HydrophobicContact CB-CD1 4.24Å; P346-I350 HydrophobicContact CG-CD1 4.24Å; P346-I350 WeakPolarHBondContact O-CG1 3.4Å; P346-I350 PolarHBondContact O-N 3.04Å; P346-I350 VanDerWaalsContact O-N 3.17Å; F347-I350 PolarHBondContact O-N 3.39Å; I350-Q352 VanDerWaalsContact C-N 3.34Å; I350-Q352 PolarHBondContact O-N 2.89Å; I350-V353 PolarHBondContact O-N 3.47Å; I350-A354 VanDerWaalsContact O-CB 3.27Å; I350-A354 WeakPolarHBondContact O-CB 3.33Å; I350-A354 PolarHBondContact O-N 3.49Å
351G98.7Very high98Very high2 Ų256.2 Ų56.22%0.02130%0.302CS..Hα-helixtrans-59.2-43176.700000112.8S283 F347 T348 I349 S355S283-G351 PolarHBondContact OG-O 3.44Å; S283-G351 VanDerWaalsContact OG-O 3.05Å; F347-G351 PolarHBondContact O-N 2.52Å; T348-G351 PolarHBondContact O-N 3.23Å; I349-G351 VanDerWaalsContact C-N 3.34Å; I349-G351 PolarHBondContact O-N 2.97Å; G351-S355 VanDerWaalsContact O-CB 3.32Å; G351-S355 WeakPolarHBondContact O-CB 3.5Å; G351-S355 PolarHBondContact O-N 3.14Å; G351-S355 PolarHBondContact O-OG 3.16Å
352Q98.8Very high98.1Very high67 Ų6754 Ų5431%0.31329%0.292SS..Hα-helixtrans-63.3-48.5176.6-74.6174-23.700112.4S283 T348 I349 I350 S355 V356S283-Q352 WeakPolarHBondContact O-CG 3.05Å; S283-Q352 PolarHBondContact O-NE2 3.45Å; S283-Q352 PolarHBondContact OG-N 2.96Å; T348-Q352 WeakPolarHBondContact O-CG 3.45Å; T348-Q352 PolarHBondContact O-N 3.48Å; T348-Q352 VanDerWaalsContact O-N 3.08Å; I349-Q352 PolarHBondContact O-N 3.38Å; I350-Q352 VanDerWaalsContact C-N 3.34Å; I350-Q352 PolarHBondContact O-N 2.89Å; Q352-S355 PolarHBondContact O-N 2.84Å; Q352-V356 WeakPolarHBondContact O-CG2 3.33Å; Q352-V356 PolarHBondContact O-N 3.41Å
353V98.8Very high98.2Very high91 Ų9154.8 Ų54.855%0.55229%0.292SS*.Hα-helixtrans-62.6-45.6178.8172.10000110.9I349 I350 S355 V356 L357I349-V353 HydrophobicContact CD1-CG2 4.31Å; I349-V353 HydrophobicContact CG1-CG2 4.39Å; I349-V353 WeakPolarHBondContact O-CG2 3.48Å; I349-V353 PolarHBondContact O-N 3.24Å; I350-V353 PolarHBondContact O-N 3.47Å; V353-S355 VanDerWaalsContact C-N 3.35Å; V353-S355 PolarHBondContact O-N 2.73Å; V353-V356 PolarHBondContact O-N 2.73Å; V353-L357 WeakPolarHBondContact O-CB 3.24Å; V353-L357 PolarHBondContact O-N 3.37Å
354A98.9Very high98.4Very high5 Ų554.5 Ų54.54%0.04129%0.286CS..Hα-helixtrans-61.7-42.1176.400000111.5D331 I334 L335 I350 V356 L357 Y358D331-A354 VanDerWaalsContact OD1-CA 3.3Å; D331-A354 WeakPolarHBondContact OD1-CA 3.38Å; D331-A354 WeakPolarHBondContact OD1-CB 3.08Å; D331-A354 VanDerWaalsContact OD2-O 3.07Å; I334-A354 HydrophobicContact CG2-CB 4.08Å; L335-A354 HydrophobicContact CD2-CB 3.6Å; L335-A354 HydrophobicContact CG-CB 3.96Å; I350-A354 VanDerWaalsContact O-CB 3.27Å; I350-A354 WeakPolarHBondContact O-CB 3.33Å; I350-A354 PolarHBondContact O-N 3.49Å; A354-V356 VanDerWaalsContact C-N 3.34Å; A354-V356 PolarHBondContact O-N 3.42Å; A354-L357 WeakPolarHBondContact O-CB 3.24Å; A354-L357 PolarHBondContact O-N 2.91Å; A354-L357 VanDerWaalsContact O-N 3.15Å; A354-Y358 PolarHBondContact O-N 3.06Å
355S98.8Very high98.5Very high10 Ų1054.8 Ų54.87%0.0728%0.283CS..Hα-helixtrans-63.3-40.4177.7-56.70000112S283 G351 Q352 V353 F359S283-S355 WeakPolarHBondContact CB-OG 3.48Å; S283-S355 PolarHBondContact OG-OG 2.8Å; G351-S355 VanDerWaalsContact O-CB 3.32Å; G351-S355 WeakPolarHBondContact O-CB 3.5Å; G351-S355 PolarHBondContact O-N 3.14Å; G351-S355 PolarHBondContact O-OG 3.16Å; Q352-S355 PolarHBondContact O-N 2.84Å; V353-S355 VanDerWaalsContact C-N 3.35Å; V353-S355 PolarHBondContact O-N 2.73Å; S355-F359 VanDerWaalsContact O-CD2 3.28Å; S355-F359 WeakPolarHBondContact O-CD2 3.43Å; S355-F359 PolarHBondContact O-N 2.87Å
356V98.8Very high98.6Very high94 Ų9446.3 Ų46.357%0.5725%0.251SS*.Hα-helixtrans-65.1-43.2173.6171.40000110.7Q352 V353 A354 Y358 F359 T360Q352-V356 WeakPolarHBondContact O-CG2 3.33Å; Q352-V356 PolarHBondContact O-N 3.41Å; V353-V356 PolarHBondContact O-N 2.73Å; A354-V356 VanDerWaalsContact C-N 3.34Å; A354-V356 PolarHBondContact O-N 3.42Å; V356-Y358 VanDerWaalsContact C-N 3.35Å; V356-Y358 PolarHBondContact O-N 2.78Å; V356-F359 PolarHBondContact O-N 2.68Å; V356-T360 WeakPolarHBondContact O-CB 3.39Å; V356-T360 PolarHBondContact O-N 3.47Å; V356-T360 PolarHBondContact O-OG1 3.32Å
357L98.8Very high98.6Very high54 Ų5444.6 Ų44.628%0.28324%0.24SC..Hα-helixtrans-61.2-42.5178.9-176.360.2000111.7L327 D331 V353 A354 T360 T361L327-L357 HydrophobicContact CD1-CD2 4.28Å; L327-L357 HydrophobicContact CD2-CD1 4.34Å; D331-L357 HydrophobicContact CB-CD2 4.25Å; V353-L357 WeakPolarHBondContact O-CB 3.24Å; V353-L357 PolarHBondContact O-N 3.37Å; A354-L357 WeakPolarHBondContact O-CB 3.24Å; A354-L357 PolarHBondContact O-N 2.91Å; A354-L357 VanDerWaalsContact O-N 3.15Å; L357-T360 PolarHBondContact O-N 2.91Å; L357-T361 VanDerWaalsContact O-CB 3.23Å; L357-T361 WeakPolarHBondContact O-CB 3.32Å; L357-T361 PolarHBondContact O-N 3.12Å; L357-T361 PolarHBondContact O-OG1 2.94Å
358Y98.9Very high98.6Very high12 Ų1245.4 Ų45.45%0.04725%0.249CC..Hα-helixtrans-53.2-58.7175.8176.1-97.7000112.1I280 S297 I300 L328 D331 L332 L335 A354 V356 T361 I362I280-Y358 HydrophobicContact CD1-CD1 3.95Å; I280-Y358 HydrophobicContact CD1-CE1 4.28Å; I280-Y358 HydrophobicContact CD1-CG 4.28Å; S297-Y358 PolarHBondContact O-OH 3.02Å; I300-Y358 HydrophobicContact CG2-CE1 4.15Å; I300-Y358 VanDerWaalsContact CG2-OH 3.27Å; I300-Y358 WeakPolarHBondContact CG2-OH 3.38Å; L328-Y358 HydrophobicContact CD1-CD2 3.63Å; L328-Y358 HydrophobicContact CD1-CE2 3.93Å; D331-Y358 VanDerWaalsContact OD2-CA 3.28Å; D331-Y358 WeakPolarHBondContact OD2-CA 3.31Å; D331-Y358 WeakPolarHBondContact OD2-CB 3.47Å; D331-Y358 PolarHBondContact OD2-N 2.55Å; D331-Y358 VanDerWaalsContact OD2-N 3.1Å; L332-Y358 HydrophobicContact CD2-CD2 4.01Å; L332-Y358 HydrophobicContact CD2-CE2 3.76Å; L332-Y358 HydrophobicContact CG-CD2 4.38Å; L332-Y358 HydrophobicContact CG-CE2 4.29Å; L335-Y358 HydrophobicContact CD1-CD2 4.26Å; L335-Y358 HydrophobicContact CD1-CG 4.31Å; A354-Y358 PolarHBondContact O-N 3.06Å; V356-Y358 VanDerWaalsContact C-N 3.35Å; V356-Y358 PolarHBondContact O-N 2.78Å; Y358-T361 PolarHBondContact O-N 2.95Å; Y358-I362 HydrophobicContact CD1-CD1 4.48Å; Y358-I362 HydrophobicContact CD2-CD1 4.25Å; Y358-I362 HydrophobicContact CE1-CD1 3.94Å; Y358-I362 HydrophobicContact CE2-CD1 3.69Å; Y358-I362 PolarHBondContact O-N 3.42Å
359F98.8Very high98.7Very high45 Ų4544.4 Ų44.420%0.19724%0.241CC..Hα-helixtrans-67.3-40.2-178.5-74.9-72.4000112I280 L296 I300 S355 V356 T361 I362 L363I280-F359 HydrophobicContact CG2-CE2 3.86Å; I280-F359 HydrophobicContact CG2-CZ 4.33Å; L296-F359 HydrophobicContact CB-CE1 4.18Å; L296-F359 HydrophobicContact CB-CZ 4.31Å; I300-F359 HydrophobicContact CD1-CD1 3.72Å; I300-F359 HydrophobicContact CD1-CE1 4.09Å; S355-F359 VanDerWaalsContact O-CD2 3.28Å; S355-F359 WeakPolarHBondContact O-CD2 3.43Å; S355-F359 PolarHBondContact O-N 2.87Å; V356-F359 PolarHBondContact O-N 2.68Å; F359-T361 VanDerWaalsContact C-N 3.34Å; F359-T361 PolarHBondContact O-N 3.33Å; F359-I362 PolarHBondContact O-N 3.46Å; F359-L363 HydrophobicContact CB-CD1 4.45Å; F359-L363 HydrophobicContact CD1-CD1 4.42Å; F359-L363 VanDerWaalsContact O-CB 3.28Å; F359-L363 WeakPolarHBondContact O-CB 3.33Å; F359-L363 WeakPolarHBondContact O-CG 3.28Å; F359-L363 PolarHBondContact O-N 3.29Å
360T98.8Very high98.6Very high45 Ų4540.7 Ų40.728%0.27622%0.223SC..Hα-helixtrans-64.3-40.5179.5-56.70000111.1V356 L357 I364 L365V356-T360 WeakPolarHBondContact O-CB 3.39Å; V356-T360 PolarHBondContact O-N 3.47Å; V356-T360 PolarHBondContact O-OG1 3.32Å; L357-T360 PolarHBondContact O-N 2.91Å; T360-I364 HydrophobicContact CG2-CB 4.41Å; T360-I364 HydrophobicContact CG2-CD1 4.33Å; T360-I364 WeakPolarHBondContact O-CA 3.27Å; T360-I364 WeakPolarHBondContact O-CB 3.18Å; T360-I364 PolarHBondContact O-N 2.97Å; T360-L365 HydrophobicContact CG2-CD1 4.47Å; T360-L365 HydrophobicContact CG2-CG 4.19Å; T360-L365 PolarHBondContact O-N 3.23Å
361T98.7Very high98.6Very high0 Ų042.1 Ų42.10%023%0.23CC..Iπ-helixtrans-62.1-47.3179.3-60.30000110.9L328 L357 Y358 F359 L365 M366L328-T361 HydrophobicContact CB-CG2 4.11Å; L357-T361 VanDerWaalsContact O-CB 3.23Å; L357-T361 WeakPolarHBondContact O-CB 3.32Å; L357-T361 PolarHBondContact O-N 3.12Å; L357-T361 PolarHBondContact O-OG1 2.94Å; Y358-T361 PolarHBondContact O-N 2.95Å; F359-T361 VanDerWaalsContact C-N 3.34Å; F359-T361 PolarHBondContact O-N 3.33Å; T361-L365 PolarHBondContact O-N 2.74Å; T361-M366 HydrophobicContact CG2-CE 4.23Å; T361-M366 HydrophobicContact CG2-CG 4.42Å; T361-M366 WeakPolarHBondContact O-CB 3.39Å; T361-M366 WeakPolarHBondContact O-CG 3.23Å; T361-M366 PolarHBondContact O-N 3.23Å
362I98.6Very high98.6Very high7 Ų745.8 Ų45.84%0.03625%0.248CC..Iπ-helixtrans-73.5-49.9-177.4-64.2167.9000111.9I300 I304 L307 L328 Y358 F359 P367I300-I362 HydrophobicContact CD1-CB 3.82Å; I300-I362 HydrophobicContact CD1-CD1 3.97Å; I300-I362 HydrophobicContact CD1-CG2 3.55Å; I300-I362 HydrophobicContact CG1-CG2 3.77Å; I300-I362 HydrophobicContact CG2-CD1 4.28Å; I304-I362 HydrophobicContact CD1-CG2 3.45Å; I304-I362 VanDerWaalsContact CD1-CG2 3.45Å; L307-I362 HydrophobicContact CD1-CG2 4.16Å; L328-I362 HydrophobicContact CD1-CD1 4.08Å; L328-I362 HydrophobicContact CD1-CG1 4.1Å; L328-I362 HydrophobicContact CD2-CD1 4.2Å; L328-I362 HydrophobicContact CD2-CG1 3.93Å; Y358-I362 HydrophobicContact CD1-CD1 4.48Å; Y358-I362 HydrophobicContact CD2-CD1 4.25Å; Y358-I362 HydrophobicContact CE1-CD1 3.94Å; Y358-I362 HydrophobicContact CE2-CD1 3.69Å; Y358-I362 PolarHBondContact O-N 3.42Å; F359-I362 PolarHBondContact O-N 3.46Å; I362-P367 WeakPolarHBondContact O-CD 3.32Å
363L98.6Very high98.6Very high76 Ų7643 Ų4340%0.39824%0.236SC..Iπ-helixtrans-80-28.9-170.7-61.9178000113.4I300 L307 F359I300-L363 HydrophobicContact CD1-CD1 4.45Å; I300-L363 HydrophobicContact CD1-CD2 3.77Å; I300-L363 HydrophobicContact CD1-CG 3.9Å; I300-L363 HydrophobicContact CG1-CD2 4.11Å; L307-L363 HydrophobicContact CD1-CD2 3.85Å; F359-L363 HydrophobicContact CB-CD1 4.45Å; F359-L363 HydrophobicContact CD1-CD1 4.42Å; F359-L363 VanDerWaalsContact O-CB 3.28Å; F359-L363 WeakPolarHBondContact O-CB 3.33Å; F359-L363 WeakPolarHBondContact O-CG 3.28Å; F359-L363 PolarHBondContact O-N 3.29Å
364I98.6Very high98.5Very high95 Ų9539.1 Ų39.149%0.48721%0.212SC..Iπ-helixtrans-121.7-57.6-169.5-58.6170.6000111.1T360 P367 T368T360-I364 HydrophobicContact CG2-CB 4.41Å; T360-I364 HydrophobicContact CG2-CD1 4.33Å; T360-I364 WeakPolarHBondContact O-CA 3.27Å; T360-I364 WeakPolarHBondContact O-CB 3.18Å; T360-I364 PolarHBondContact O-N 2.97Å; I364-P367 WeakPolarHBondContact O-CD 3.31Å; I364-T368 HydrophobicContact CG2-CG2 4.44Å; I364-T368 WeakPolarHBondContact O-CB 3.26Å; I364-T368 WeakPolarHBondContact O-CG2 3.45Å; I364-T368 PolarHBondContact O-N 3.26Å; I364-T368 VanDerWaalsContact O-N 3.13Å; I364-T368 PolarHBondContact O-OG1 3.4Å
365L98.6Very high98.5Very high57 Ų5746.8 Ų46.830%0.29824%0.244SC..Iπ-helixtrans-68.5-44.4-170.7-57.2179.6000112.4L324 T360 T361 T368 I369L324-L365 HydrophobicContact CD1-CB 3.72Å; L324-L365 WeakPolarHBondContact CD1-O 3.32Å; L324-L365 HydrophobicContact CD2-CB 4.17Å; L324-L365 HydrophobicContact CD2-CD1 4.19Å; T360-L365 HydrophobicContact CG2-CD1 4.47Å; T360-L365 HydrophobicContact CG2-CG 4.19Å; T360-L365 PolarHBondContact O-N 3.23Å; T361-L365 PolarHBondContact O-N 2.74Å; L365-T368 WeakPolarHBondContact CA-OG1 3.47Å; L365-T368 PolarHBondContact O-N 3.42Å; L365-T368 PolarHBondContact O-OG1 3.43Å; L365-I369 VanDerWaalsContact O-CB 3.31Å; L365-I369 WeakPolarHBondContact O-CB 3.48Å; L365-I369 WeakPolarHBondContact O-CG1 3.5Å; L365-I369 PolarHBondContact O-N 3.08Å
366M98.3Very high98.4Very high26 Ų2652.6 Ų52.613%0.12827%0.272CS..Hα-helixtrans-62.5-48.7-179.8-78.9-175.6175.500113.1L324 L328 T361 S370L324-M366 HydrophobicContact CB-CG 4.37Å; L324-M366 HydrophobicContact CD1-CG 4.19Å; L328-M366 HydrophobicContact CB-CE 4.3Å; L328-M366 HydrophobicContact CD2-CE 3.78Å; T361-M366 HydrophobicContact CG2-CE 4.23Å; T361-M366 HydrophobicContact CG2-CG 4.42Å; T361-M366 WeakPolarHBondContact O-CB 3.39Å; T361-M366 WeakPolarHBondContact O-CG 3.23Å; T361-M366 PolarHBondContact O-N 3.23Å; M366-S370 WeakPolarHBondContact O-CB 3.49Å; M366-S370 PolarHBondContact O-N 3.1Å; M366-S370 PolarHBondContact O-OG 2.79Å
367P98.3Very high98.4Very high14 Ų1452.2 Ų52.29%0.09127%0.266CS..Hα-helixtrans-62.4-42.7175.4-25.334.5000113.2L307 M309 I362 I364 S370 L371L307-P367 HydrophobicContact CB-CG 4.04Å; L307-P367 HydrophobicContact CD2-CG 4.09Å; M309-P367 HydrophobicContact CG-CB 4.05Å; I362-P367 WeakPolarHBondContact O-CD 3.32Å; I364-P367 WeakPolarHBondContact O-CD 3.31Å; P367-S370 WeakPolarHBondContact O-CB 3.26Å; P367-S370 PolarHBondContact O-N 3.03Å; P367-L371 WeakPolarHBondContact O-CG 3.21Å; P367-L371 PolarHBondContact O-N 3.16Å; P367-L371 VanDerWaalsContact O-N 3.12Å
368T98.4Very high98.3Very high61 Ų6159 Ų5937%0.37429%0.293SS..Hα-helixtrans-66.3-44.6-17952.50000112I364 L365 S370 L371 I372I364-T368 HydrophobicContact CG2-CG2 4.44Å; I364-T368 WeakPolarHBondContact O-CB 3.26Å; I364-T368 WeakPolarHBondContact O-CG2 3.45Å; I364-T368 PolarHBondContact O-N 3.26Å; I364-T368 VanDerWaalsContact O-N 3.13Å; I364-T368 PolarHBondContact O-OG1 3.4Å; L365-T368 WeakPolarHBondContact CA-OG1 3.47Å; L365-T368 PolarHBondContact O-N 3.42Å; L365-T368 PolarHBondContact O-OG1 3.43Å; T368-S370 VanDerWaalsContact C-N 3.31Å; T368-S370 PolarHBondContact O-N 3.35Å; T368-L371 PolarHBondContact O-N 2.79Å; T368-I372 WeakPolarHBondContact O-CG1 3.43Å; T368-I372 PolarHBondContact O-N 3.13Å
369I98.3Very high98Very high34 Ų3463.3 Ų63.317%0.17431%0.309CS..Hα-helixtrans-63.5-38.1174.9-72.8-64.9000111.4L320 L324 L365 L371 I372 E373L320-I369 HydrophobicContact CB-CD1 4.43Å; L320-I369 HydrophobicContact CB-CG2 3.42Å; L320-I369 VanDerWaalsContact CB-CG2 3.42Å; L320-I369 HydrophobicContact CD1-CD1 4.33Å; L320-I369 HydrophobicContact CD1-CG2 4.46Å; L324-I369 HydrophobicContact CD1-CB 3.88Å; L324-I369 HydrophobicContact CD1-CG1 3.57Å; L324-I369 HydrophobicContact CD1-CG2 4.33Å; L324-I369 HydrophobicContact CG-CG1 4.45Å; L365-I369 VanDerWaalsContact O-CB 3.31Å; L365-I369 WeakPolarHBondContact O-CB 3.48Å; L365-I369 WeakPolarHBondContact O-CG1 3.5Å; L365-I369 PolarHBondContact O-N 3.08Å; I369-L371 VanDerWaalsContact C-N 3.3Å; I369-L371 PolarHBondContact O-N 2.84Å; I369-I372 HydrophobicContact CD1-CD1 4.07Å; I369-I372 PolarHBondContact O-N 2.89Å; I369-I372 VanDerWaalsContact O-N 3.14Å; I369-E373 HydrophobicContact CG2-CG 4.26Å; I369-E373 WeakPolarHBondContact O-CG 3.31Å; I369-E373 PolarHBondContact O-N 3.28Å
370S97.8Very high96.7Very high6 Ų668.1 Ų68.14%0.04236%0.358CS..Hα-helixtrans-57.3-43.2174.2-580000111.9R318 M366 P367 T368 N374R318-S370 PolarHBondContact NH2-OG 3.44Å; M366-S370 WeakPolarHBondContact O-CB 3.49Å; M366-S370 PolarHBondContact O-N 3.1Å; M366-S370 PolarHBondContact O-OG 2.79Å; P367-S370 WeakPolarHBondContact O-CB 3.26Å; P367-S370 PolarHBondContact O-N 3.03Å; T368-S370 VanDerWaalsContact C-N 3.31Å; T368-S370 PolarHBondContact O-N 3.35Å; S370-N374 PolarHBondContact O-N 3.05Å; S370-N374 PolarHBondContact O-ND2 2.73Å; S370-N374 PolarHBondContact O-OD1 3.34Å
371L98.3Very high96.6Very high84 Ų8469.3 Ų69.344%0.4436%0.362SS..Hα-helixtrans-67.6-37.1176.4-68.1172.5000112.4M309 P367 T368 I369 K375M309-L371 HydrophobicContact CB-CD2 3.82Å; M309-L371 HydrophobicContact CB-CG 3.89Å; M309-L371 HydrophobicContact CG-CD2 4.47Å; M309-L371 HydrophobicContact CG-CG 4.39Å; P367-L371 WeakPolarHBondContact O-CG 3.21Å; P367-L371 PolarHBondContact O-N 3.16Å; P367-L371 VanDerWaalsContact O-N 3.12Å; T368-L371 PolarHBondContact O-N 2.79Å; I369-L371 VanDerWaalsContact C-N 3.3Å; I369-L371 PolarHBondContact O-N 2.84Å; L371-K375 WeakPolarHBondContact O-CG 3.39Å; L371-K375 PolarHBondContact O-N 3.31Å; L371-K375 VanDerWaalsContact O-N 3.12Å
372I98.3Very high96.5Very high78 Ų7872.9 Ų72.940%0.438%0.381SS..Hα-helixtrans-64.1-47.8175.5-69.5164.2000110.3L320 T368 I369 N374 K375 M376L320-I372 HydrophobicContact CD1-CG2 4.38Å; T368-I372 WeakPolarHBondContact O-CG1 3.43Å; T368-I372 PolarHBondContact O-N 3.13Å; I369-I372 HydrophobicContact CD1-CD1 4.07Å; I369-I372 PolarHBondContact O-N 2.89Å; I369-I372 VanDerWaalsContact O-N 3.14Å; I372-N374 VanDerWaalsContact C-N 3.33Å; I372-N374 PolarHBondContact O-N 3.41Å; I372-K375 PolarHBondContact O-N 2.94Å; I372-K375 VanDerWaalsContact O-N 3.11Å; I372-M376 HydrophobicContact CG2-CG 4.36Å; I372-M376 HydrophobicContact CG2-SD 3.97Å; I372-M376 WeakPolarHBondContact O-CG 3.21Å; I372-M376 PolarHBondContact O-N 3.33Å
373E98.4Very high96.3Very high10 Ų1076.6 Ų76.65%0.04740%0.4CS..Hα-helixtrans-60-42.2177.9-72.8176.9147.300111.7R318 L320 S321 I369 K375 M376 L377R318-E373 VanDerWaalsContact CA-OE1 3.31Å; R318-E373 WeakPolarHBondContact CA-OE1 3.36Å; R318-E373 WeakPolarHBondContact CB-OE1 3.46Å; R318-E373 WeakPolarHBondContact CB-OE2 3.35Å; R318-E373 IonicContact CZ-OE2 3.49Å; R318-E373 IonicContact NE-OE2 3.64Å; R318-E373 PolarHBondContact NE-OE2 3.18Å; R318-E373 IonicContact NH2-OE2 2.95Å; R318-E373 PolarHBondContact NH2-OE2 3.25Å; L320-E373 HydrophobicContact CB-CG 4.25Å; L320-E373 WeakPolarHBondContact CB-OE1 3.44Å; L320-E373 HydrophobicContact CD1-CG 4.22Å; L320-E373 PolarHBondContact N-OE1 3.45Å; S321-E373 PolarHBondContact N-OE1 3Å; S321-E373 PolarHBondContact OG-OE1 3.4Å; S321-E373 PolarHBondContact OG-OE2 2.9Å; I369-E373 HydrophobicContact CG2-CG 4.26Å; I369-E373 WeakPolarHBondContact O-CG 3.31Å; I369-E373 PolarHBondContact O-N 3.28Å; E373-K375 VanDerWaalsContact C-N 3.34Å; E373-K375 PolarHBondContact O-N 3.13Å; E373-M376 PolarHBondContact O-N 2.83Å; E373-L377 WeakPolarHBondContact O-CG 3.48Å; E373-L377 PolarHBondContact O-N 3.04Å; E373-L377 VanDerWaalsContact O-N 3.09Å
374N98.4Very high96.2Very high8 Ų876.6 Ų76.64%0.04340%0.4CS..Hα-helixtrans-56.9-46.7173.2-69.2-20.2000111.6M309 K311 S370 I372 L377 K378 W379M309-N374 PolarHBondContact O-ND2 3.1Å; K311-N374 PolarHBondContact N-OD1 3.46Å; S370-N374 PolarHBondContact O-N 3.05Å; S370-N374 PolarHBondContact O-ND2 2.73Å; S370-N374 PolarHBondContact O-OD1 3.34Å; I372-N374 VanDerWaalsContact C-N 3.33Å; I372-N374 PolarHBondContact O-N 3.41Å; N374-L377 CarbonylContact O-C 3.53Å; N374-L377 PolarHBondContact O-N 3.26Å; N374-K378 PolarHBondContact O-N 2.86Å; N374-W379 HydrophobicContact CB-CB 4.34Å; N374-W379 PolarHBondContact O-N 3.09Å
375K97.8Very high96.1Very high166 Ų16675.5 Ų75.572%0.72240%0.395SS*.Hα-helixtrans-64.8-39.2178.6-73.4-179.3-179.3-176.90112.3L371 I372 E373 L377 K378L371-K375 WeakPolarHBondContact O-CG 3.39Å; L371-K375 PolarHBondContact O-N 3.31Å; L371-K375 VanDerWaalsContact O-N 3.12Å; I372-K375 PolarHBondContact O-N 2.94Å; I372-K375 VanDerWaalsContact O-N 3.11Å; E373-K375 VanDerWaalsContact C-N 3.34Å; E373-K375 PolarHBondContact O-N 3.13Å; K375-L377 PolarHBondContact O-N 3.34Å; K375-K378 PolarHBondContact O-N 3.37Å
376M97.8Very high95.9Very high133 Ų13376.7 Ų76.766%0.65540%0.401SS*.Hα-helixtrans-60.3-34175.3-70.2173.366.300111.8L320 I372 E373 K378L320-M376 HydrophobicContact CD1-SD 4.09Å; I372-M376 HydrophobicContact CG2-CG 4.36Å; I372-M376 HydrophobicContact CG2-SD 3.97Å; I372-M376 WeakPolarHBondContact O-CG 3.21Å; I372-M376 PolarHBondContact O-N 3.33Å; E373-M376 PolarHBondContact O-N 2.83Å; M376-K378 VanDerWaalsContact C-N 3.28Å; M376-K378 PolarHBondContact O-N 2.94Å
377L97.8Very high95.7Very high85 Ų8580.4 Ų80.445%0.44542%0.421SS..THydrogen-bonded Turntrans-85.45.2175.2-64.5175.9000113.8E373 N374 K375 W379E373-L377 WeakPolarHBondContact O-CG 3.48Å; E373-L377 PolarHBondContact O-N 3.04Å; E373-L377 VanDerWaalsContact O-N 3.09Å; N374-L377 CarbonylContact O-C 3.53Å; N374-L377 PolarHBondContact O-N 3.26Å; K375-L377 PolarHBondContact O-N 3.34Å; L377-W379 HydrophobicContact CB-CD2 4.09Å; L377-W379 HydrophobicContact CB-CE3 4.12Å; L377-W379 HydrophobicContact CB-CG 4.44Å; L377-W379 HydrophobicContact CD1-CD2 4.46Å; L377-W379 HydrophobicContact CD1-CE3 3.85Å; L377-W379 HydrophobicContact CD1-CH2 3.76Å; L377-W379 HydrophobicContact CD1-CZ2 4.38Å; L377-W379 HydrophobicContact CD1-CZ3 3.46Å; L377-W379 VanDerWaalsContact CD1-CZ3 3.46Å; L377-W379 PolarHBondContact O-N 3.17Å
378K96.6Very high95.5Very high196 Ų19685.5 Ų85.585%0.85245%0.446SS*.THydrogen-bonded Turntrans56.531.8-176.3-51.8178.9-177.5177.20113.1N374 K375 M376N374-K378 PolarHBondContact O-N 2.86Å; K375-K378 PolarHBondContact O-N 3.37Å; M376-K378 VanDerWaalsContact C-N 3.28Å; M376-K378 PolarHBondContact O-N 2.94Å
379W93.6Very high95.3Very high103 Ų10387.5 Ų87.539%0.3945%0.452SS..  trans-82.9132.7169.9-72.9-25.1000110.8K311 Q312 N374 L377K311-W379 HydrophobicContact CB-CD2 4.06Å; K311-W379 HydrophobicContact CB-CE3 3.5Å; K311-W379 VanDerWaalsContact CB-CE3 3.5Å; K311-W379 HydrophobicContact CB-CZ3 3.79Å; K311-W379 HydrophobicContact CG-CB 4.19Å; K311-W379 HydrophobicContact CG-CD2 4.25Å; K311-W379 HydrophobicContact CG-CE3 3.9Å; K311-W379 HydrophobicContact CG-CG 4.43Å; Q312-W379 HydrophobicContact CB-CZ3 4.44Å; Q312-W379 VanDerWaalsContact CD-CH2 3.46Å; Q312-W379 HydrophobicContact CG-CH2 3.4Å; Q312-W379 VanDerWaalsContact CG-CH2 3.4Å; Q312-W379 HydrophobicContact CG-CZ3 3.56Å; N374-W379 HydrophobicContact CB-CB 4.34Å; N374-W379 PolarHBondContact O-N 3.09Å; L377-W379 HydrophobicContact CB-CD2 4.09Å; L377-W379 HydrophobicContact CB-CE3 4.12Å; L377-W379 HydrophobicContact CB-CG 4.44Å; L377-W379 HydrophobicContact CD1-CD2 4.46Å; L377-W379 HydrophobicContact CD1-CE3 3.85Å; L377-W379 HydrophobicContact CD1-CH2 3.76Å; L377-W379 HydrophobicContact CD1-CZ2 4.38Å; L377-W379 HydrophobicContact CD1-CZ3 3.46Å; L377-W379 VanDerWaalsContact CD1-CZ3 3.46Å; L377-W379 PolarHBondContact O-N 3.17Å
380A70.6Confident95Very high147 Ų14792.4 Ų92.4100%1.21548%0.477SS*.  trans-73.80-179.700000113.1K311K311-A380 WeakPolarHBondContact CE-O 3.47Å; K311-A380 PolarHBondContact NZ-O 3.33Å

Retrieved 380 of 380 residues in 189.2 ms (Link to these results)