A0A061IKE2_CRIGR Loading...

Ankyrin repeat and SOCS box protein 17

May be a substrate-recognition component of a SCF-like ECS (Elongin-Cullin-SOCS-box protein) E3 ubiquitin-protein ligase complex which mediates the ubiquitination and subsequent proteasomal degradation of target proteins.

AlphaFold DB , UniProt , Accession A0A061IKE2, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Asb17, Length 295 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
1M29.6Very low31.9Very low243 Ų243164.5 Ų164.5100%1.19782%0.821SS**  0106.40-83.3164.7133.200108.1N3M1-N3 PolarHBondContact O-N 2.68Å
2N27.4Very low32.3Very low166 Ų166160 Ų16089%0.88882%0.817SS**  trans-78.5105.5-178.3-96.6-13.7000109.9S4N2-S4 PolarHBondContact O-N 3.19Å
3N27.7Very low33.1Very low157 Ų157150.1 Ų150.184%0.8477%0.765SS**  trans-87.391.1161.6-83.1-7.5000108.4M1 F5M1-N3 PolarHBondContact O-N 2.68Å; N3-F5 PolarHBondContact O-N 2.85Å
4S29.2Very low33.9Very low95 Ų95145.7 Ų145.766%0.66475%0.751SS**  trans-54.1113.7168.754.10000110.4N2 K6N2-S4 PolarHBondContact O-N 3.19Å; S4-K6 PolarHBondContact O-N 3.48Å
5F31Very low34.9Very low173 Ų173153.6 Ų153.676%0.75977%0.768SS**  trans-60.997.2164.6-80.1-88.7000108.8N3 L7N3-F5 PolarHBondContact O-N 2.85Å; F5-L7 VanDerWaalsContact C-N 3.28Å; F5-L7 PolarHBondContact O-N 2.86Å
6K32.1Very low37Very low179 Ų179146.9 Ų146.978%0.77875%0.749SS**  trans-74.987.6168-86.6-179.5176.3173.70108.2S4 C8S4-K6 PolarHBondContact O-N 3.48Å; K6-C8 PolarHBondContact O-N 3.11Å
7L38.6Very low39.9Very low174 Ų174138.5 Ų138.591%0.91171%0.707SS**  trans-65.184.6159.7-144.3101.6000107.2F5F5-L7 VanDerWaalsContact C-N 3.28Å; F5-L7 PolarHBondContact O-N 2.86Å
8C33Very low42.6Very low96 Ų96133.3 Ų133.365%0.64968%0.68SS**  trans-91.5116.7-167.7-148.30000111.7K6K6-C8 PolarHBondContact O-N 3.11Å
9R32.2Very low45Very low212 Ų212126.3 Ų126.380%0.865%0.645SS**  trans64.7107.8157.2-70.8-178.9176.7-178.2-0.9119.4T11R9-T11 PolarHBondContact O-N 3.08Å
10K35.3Very low47Very low214 Ų214120.5 Ų120.593%0.9362%0.615SS**  trans-50.1100.2154.7-73.3174175.9173.50110.8
11T34.7Very low48.8Very low100 Ų100118.3 Ų118.361%0.61361%0.605SS**  trans-112.276.3158.344.90000108.1R9 F13 R80R9-T11 PolarHBondContact O-N 3.08Å; T11-F13 PolarHBondContact O-N 2.84Å; T11-R80 PolarHBondContact O-NH2 2.88Å; T11-R80 PolarHBondContact OG1-NH2 3.39Å
12S36.9Very low51.5Low111 Ų111107.1 Ų107.178%0.77655%0.55SS**  trans-35.7115.9-174.848.80000112.2
13F42.3Very low54.1Low31 Ų3199.2 Ų99.214%0.13651%0.508CS..  trans-53.7155158.7-80.9-82.5000107.6T11 R15 C20 F73 K76T11-F13 PolarHBondContact O-N 2.84Å; F13-R15 PolarHBondContact O-N 3.4Å; F13-C20 HydrophobicContact CB-CB 4.31Å; F13-C20 WeakPolarHBondContact CD1-SG 3.3Å; F13-C20 HydrophobicContact CD2-CB 3.83Å; F13-C20 WeakPolarHBondContact CD2-SG 3.47Å; F13-C20 WeakPolarHBondContact CE1-SG 3.4Å; F13-C20 HydrophobicContact CE2-CB 4.26Å; F13-C20 WeakPolarHBondContact CE2-SG 3.47Å; F13-C20 HydrophobicContact CG-CB 4Å; F13-C20 WeakPolarHBondContact CG-SG 3.05Å; F13-C20 WeakPolarHBondContact CZ-SG 3.46Å; F13-F73 HydrophobicContact CZ-CD2 4.46Å; F13-K76 HydrophobicContact CD1-CD 4.38Å; F13-K76 HydrophobicContact CE1-CB 3.73Å; F13-K76 HydrophobicContact CE1-CD 3.95Å; F13-K76 HydrophobicContact CE1-CG 4.47Å; F13-K76 HydrophobicContact CZ-CB 3.99Å
14P45.3Very low56.6Low89 Ų8994.5 Ų94.558%0.57848%0.483SS*.  trans-48.3124.7168-17.328.4000106.8G16 N17P14-G16 VanDerWaalsContact C-N 3.28Å; P14-G16 PolarHBondContact O-N 3Å; P14-N17 PolarHBondContact O-N 3.21Å
15R47.9Very low59Low264 Ų26497.3 Ų97.3100%0.99648%0.483SS*.THydrogen-bonded Turntrans-52.999.2172.5-78.6179.5173.4177.9-1.9106.2F13F13-R15 PolarHBondContact O-N 3.4Å
16G68.9Low61.2Low46 Ų4689.3 Ų89.347%0.47445%0.448SS..THydrogen-bonded Turntrans154.3-33.7-171.200000116.6P14 I18P14-G16 VanDerWaalsContact C-N 3.28Å; P14-G16 PolarHBondContact O-N 3Å; G16-I18 PolarHBondContact O-N 2.67Å
17N86.3Confident63Low5 Ų583.1 Ų83.13%0.02743%0.425CS..  trans-63.7122.6-172.2-175.3-78.2000112.7P14 F19 C20 N21 D69P14-N17 PolarHBondContact O-N 3.21Å; N17-F19 PolarHBondContact O-N 2.94Å; N17-F19 PolarHBondContact OD1-N 2.76Å; N17-C20 HydrophobicContact CB-CB 4.11Å; N17-C20 VanDerWaalsContact CG-SG 3.6Å; N17-C20 PolarHBondContact O-N 3.18Å; N17-C20 PolarHBondContact OD1-N 2.97Å; N17-C20 PolarHBondContact OD1-SG 3.18Å; N17-N21 WeakPolarHBondContact O-CB 3.45Å; N17-N21 VanDerWaalsContact O-CG 3.23Å; N17-N21 PolarHBondContact O-N 3.06Å; N17-N21 PolarHBondContact O-ND2 3.3Å; N17-N21 VanDerWaalsContact O-ND2 3.13Å; N17-D69 WeakPolarHBondContact CA-OD2 3.35Å; N17-D69 VanDerWaalsContact ND2-CA 3.29Å; N17-D69 WeakPolarHBondContact ND2-CA 3.41Å; N17-D69 WeakPolarHBondContact ND2-CB 3.34Å; N17-D69 PolarHBondContact ND2-O 3.25Å; N17-D69 PolarHBondContact ND2-OD1 3.35Å
18I87.9Confident64.2Low45 Ų4582.1 Ų82.123%0.23141%0.413CS..Hα-helixtrans-60.7-43.2-173.3-64.5169000111.8G16 N21 L22 I54 D69G16-I18 PolarHBondContact O-N 2.67Å; I18-N21 PolarHBondContact O-N 2.87Å; I18-L22 WeakPolarHBondContact O-CB 3.34Å; I18-L22 PolarHBondContact O-N 2.94Å; I18-I54 HydrophobicContact CG2-CD1 3.84Å; I18-D69 PolarHBondContact N-OD2 3.3Å
19F89.8Confident65.4Low0 Ų083 Ų830%040%0.403CS..Hα-helixtrans-74.4-39.5-175.1-62.9-85.8000112.1N17 N21 L22 I23 L51 L66 D69 Y70 F73 F89 C93 I97N17-F19 PolarHBondContact O-N 2.94Å; N17-F19 PolarHBondContact OD1-N 2.76Å; F19-N21 VanDerWaalsContact C-N 3.32Å; F19-N21 PolarHBondContact O-N 3.46Å; F19-L22 WeakPolarHBondContact O-CB 3.41Å; F19-L22 PolarHBondContact O-N 3.42Å; F19-L22 VanDerWaalsContact O-N 3.17Å; F19-I23 PolarHBondContact O-N 2.6Å; F19-L51 HydrophobicContact CE1-CD1 4.21Å; F19-L51 HydrophobicContact CE1-CD2 3.87Å; F19-L51 HydrophobicContact CZ-CD2 4.24Å; F19-L66 HydrophobicContact CE2-CG 4.33Å; F19-L66 WeakPolarHBondContact CE2-O 3.49Å; F19-L66 HydrophobicContact CZ-CD2 4.15Å; F19-L66 HydrophobicContact CZ-CG 4.23Å; F19-D69 HydrophobicContact CD2-CB 4.16Å; F19-D69 HydrophobicContact CE2-CB 4.25Å; F19-Y70 HydrophobicContact CD1-CD2 4.09Å; F19-Y70 HydrophobicContact CD2-CD2 4.42Å; F19-Y70 AromaticContact CE1-CD2 3.78Å; F19-Y70 HydrophobicContact CE1-CD2 3.78Å; F19-Y70 VanDerWaalsContact CE2-CB 3.47Å; F19-Y70 HydrophobicContact CE2-CD2 4.16Å; F19-Y70 HydrophobicContact CE2-CG 4.32Å; F19-Y70 HydrophobicContact CG-CD2 4.4Å; F19-Y70 AromaticContact CZ-CD2 3.82Å; F19-Y70 HydrophobicContact CZ-CD2 3.82Å; F19-Y70 HydrophobicContact CZ-CG 4.2Å; F19-F73 HydrophobicContact CB-CB 3.95Å; F19-F73 HydrophobicContact CB-CD1 3.99Å; F19-F73 HydrophobicContact CB-CD2 4.07Å; F19-F73 HydrophobicContact CB-CG 3.68Å; F19-F89 HydrophobicContact CB-CE1 4.35Å; F19-F89 HydrophobicContact CD1-CE1 4.26Å; F19-F89 HydrophobicContact CD1-CZ 4.42Å; F19-C93 HydrophobicContact CD1-CB 4.32Å; F19-C93 HydrophobicContact CE1-CB 3.96Å; F19-I97 HydrophobicContact CZ-CD1 4.21Å
20C85.1Confident66.3Low9 Ų977.7 Ų77.76%0.06140%0.396CS..Hα-helixtrans-60.4-44.7172.4-57.10000111.4F13 N17 L22 I23 D24F13-C20 HydrophobicContact CB-CB 4.31Å; F13-C20 WeakPolarHBondContact CD1-SG 3.3Å; F13-C20 HydrophobicContact CD2-CB 3.83Å; F13-C20 WeakPolarHBondContact CD2-SG 3.47Å; F13-C20 WeakPolarHBondContact CE1-SG 3.4Å; F13-C20 HydrophobicContact CE2-CB 4.26Å; F13-C20 WeakPolarHBondContact CE2-SG 3.47Å; F13-C20 HydrophobicContact CG-CB 4Å; F13-C20 WeakPolarHBondContact CG-SG 3.05Å; F13-C20 WeakPolarHBondContact CZ-SG 3.46Å; N17-C20 HydrophobicContact CB-CB 4.11Å; N17-C20 VanDerWaalsContact CG-SG 3.6Å; N17-C20 PolarHBondContact O-N 3.18Å; N17-C20 PolarHBondContact OD1-N 2.97Å; N17-C20 PolarHBondContact OD1-SG 3.18Å; C20-L22 VanDerWaalsContact C-N 3.27Å; C20-L22 PolarHBondContact O-N 3.36Å; C20-I23 PolarHBondContact O-N 3.07Å; C20-D24 WeakPolarHBondContact O-CB 3.49Å; C20-D24 PolarHBondContact O-N 3.06Å
21N84.8Confident67.1Low75 Ų7570.8 Ų70.840%0.40138%0.375SS..Hα-helixtrans-63.1-35.1176.4-72.8-29.7000112N17 I18 F19 K25N17-N21 WeakPolarHBondContact O-CB 3.45Å; N17-N21 VanDerWaalsContact O-CG 3.23Å; N17-N21 PolarHBondContact O-N 3.06Å; N17-N21 PolarHBondContact O-ND2 3.3Å; N17-N21 VanDerWaalsContact O-ND2 3.13Å; I18-N21 PolarHBondContact O-N 2.87Å; F19-N21 VanDerWaalsContact C-N 3.32Å; F19-N21 PolarHBondContact O-N 3.46Å; N21-K25 VanDerWaalsContact O-CG 3.31Å; N21-K25 WeakPolarHBondContact O-CG 3.45Å; N21-K25 PolarHBondContact O-N 2.9Å; N21-K25 VanDerWaalsContact O-N 3.16Å
22L86.1Confident67.9Low9 Ų966.6 Ų66.65%0.04735%0.349CS..Hα-helixtrans-67.7-45.3177.3-169.660000111.5I18 F19 C20 K25 I26 I47 T50 L51 F89I18-L22 WeakPolarHBondContact O-CB 3.34Å; I18-L22 PolarHBondContact O-N 2.94Å; F19-L22 WeakPolarHBondContact O-CB 3.41Å; F19-L22 PolarHBondContact O-N 3.42Å; F19-L22 VanDerWaalsContact O-N 3.17Å; C20-L22 VanDerWaalsContact C-N 3.27Å; C20-L22 PolarHBondContact O-N 3.36Å; L22-K25 PolarHBondContact O-N 3.47Å; L22-I26 WeakPolarHBondContact O-CG1 3.44Å; L22-I26 PolarHBondContact O-N 3.22Å; L22-I47 HydrophobicContact CD2-CB 4.26Å; L22-I47 HydrophobicContact CD2-CG1 4.2Å; L22-I47 HydrophobicContact CD2-CG2 3.85Å; L22-I47 HydrophobicContact CG-CG1 4.39Å; L22-T50 HydrophobicContact CD1-CG2 3.9Å; L22-L51 HydrophobicContact CD2-CD1 4.5Å; L22-L51 HydrophobicContact CD2-CD2 4.35Å; L22-L51 HydrophobicContact CD2-CG 4.15Å; L22-F89 HydrophobicContact CB-CZ 4.32Å; L22-F89 HydrophobicContact CD2-CE2 4.18Å; L22-F89 HydrophobicContact CD2-CZ 4.02Å; L22-F89 HydrophobicContact CG-CE2 4.23Å; L22-F89 HydrophobicContact CG-CZ 4.3Å
23I82.1Confident68.6Low0 Ų068.3 Ų68.30%034%0.344CS..Hα-helixtrans-63.9-46.1175.1-67.7-179.1000111.1F19 C20 K25 I26 V27 F73 F81 F85 F89F19-I23 PolarHBondContact O-N 2.6Å; C20-I23 PolarHBondContact O-N 3.07Å; I23-K25 PolarHBondContact O-N 3.14Å; I23-I26 WeakPolarHBondContact O-CA 3.46Å; I23-I26 WeakPolarHBondContact O-CB 3.22Å; I23-I26 PolarHBondContact O-N 2.96Å; I23-V27 HydrophobicContact CG2-CG2 3.72Å; I23-V27 WeakPolarHBondContact O-CG2 3.28Å; I23-V27 PolarHBondContact O-N 2.95Å; I23-F73 HydrophobicContact CD1-CE1 4.24Å; I23-F73 HydrophobicContact CD1-CE2 3.41Å; I23-F73 VanDerWaalsContact CD1-CE2 3.41Å; I23-F73 HydrophobicContact CD1-CZ 3.19Å; I23-F73 HydrophobicContact CG1-CZ 4.49Å; I23-F81 HydrophobicContact CB-CZ 4.45Å; I23-F81 HydrophobicContact CD1-CD2 4.47Å; I23-F81 HydrophobicContact CD1-CE2 4.12Å; I23-F81 HydrophobicContact CG2-CD1 4.44Å; I23-F81 HydrophobicContact CG2-CD2 4.47Å; I23-F81 HydrophobicContact CG2-CE1 3.74Å; I23-F81 HydrophobicContact CG2-CE2 3.78Å; I23-F81 HydrophobicContact CG2-CZ 3.36Å; I23-F85 HydrophobicContact CG2-CE1 4.13Å; I23-F89 HydrophobicContact CD1-CD1 3.67Å; I23-F89 HydrophobicContact CD1-CD2 4.13Å; I23-F89 HydrophobicContact CD1-CE1 3.63Å; I23-F89 HydrophobicContact CD1-CE2 4.11Å; I23-F89 HydrophobicContact CD1-CG 3.93Å; I23-F89 HydrophobicContact CD1-CZ 3.87Å; I23-F89 HydrophobicContact CG1-CD1 4.03Å; I23-F89 HydrophobicContact CG1-CD2 3.68Å; I23-F89 HydrophobicContact CG1-CE1 3.71Å; I23-F89 HydrophobicContact CG1-CE2 3.35Å; I23-F89 HydrophobicContact CG1-CG 4.02Å; I23-F89 HydrophobicContact CG1-CZ 3.36Å
24D79.6Confident69.1Low57 Ų5772.3 Ų72.331%0.30536%0.362SS..Hα-helixtrans-55.2-38.8178.1-94.221.4000111.8C20 I26 K28C20-D24 WeakPolarHBondContact O-CB 3.49Å; C20-D24 PolarHBondContact O-N 3.06Å; D24-I26 VanDerWaalsContact C-N 3.31Å; D24-I26 PolarHBondContact O-N 2.92Å; D24-K28 VanDerWaalsContact O-CB 3.24Å; D24-K28 WeakPolarHBondContact O-CB 3.46Å; D24-K28 WeakPolarHBondContact O-CG 3.25Å; D24-K28 PolarHBondContact O-N 3.4Å; D24-K28 IonicContact OD2-NZ 3.07Å; D24-K28 PolarHBondContact OD2-NZ 3.27Å
25K79.3Confident69.5Low154 Ų15470.4 Ų70.467%0.6735%0.347SS*.Hα-helixtrans-67.9-29.1175.9-76.2174.5-178.8178.70113.2N21 L22 I23N21-K25 VanDerWaalsContact O-CG 3.31Å; N21-K25 WeakPolarHBondContact O-CG 3.45Å; N21-K25 PolarHBondContact O-N 2.9Å; N21-K25 VanDerWaalsContact O-N 3.16Å; L22-K25 PolarHBondContact O-N 3.47Å; I23-K25 PolarHBondContact O-N 3.14Å
26I76.7Confident69.6Low6 Ų661.2 Ų61.23%0.03133%0.334CS..Hα-helixtrans-78.1-48177-65.1163.8000109.8L22 I23 D24 L32 Y43 I47 F85 F89L22-I26 WeakPolarHBondContact O-CG1 3.44Å; L22-I26 PolarHBondContact O-N 3.22Å; I23-I26 WeakPolarHBondContact O-CA 3.46Å; I23-I26 WeakPolarHBondContact O-CB 3.22Å; I23-I26 PolarHBondContact O-N 2.96Å; D24-I26 VanDerWaalsContact C-N 3.31Å; D24-I26 PolarHBondContact O-N 2.92Å; I26-L32 HydrophobicContact CG2-CD1 4.37Å; I26-Y43 HydrophobicContact CG2-CG 4.2Å; I26-I47 HydrophobicContact CD1-CD1 3.76Å; I26-I47 HydrophobicContact CD1-CG1 3.52Å; I26-F85 HydrophobicContact CG2-CZ 4.47Å; I26-F89 HydrophobicContact CD1-CD2 4.4Å; I26-F89 HydrophobicContact CD1-CE2 4.09Å
27V70.1Confident68.7Low48 Ų4866.4 Ų66.429%0.29135%0.346SS..Hα-helixtrans-73.5-35.5-173.8177.80000112.9I23 R29 L35 F81I23-V27 HydrophobicContact CG2-CG2 3.72Å; I23-V27 WeakPolarHBondContact O-CG2 3.28Å; I23-V27 PolarHBondContact O-N 2.95Å; V27-R29 PolarHBondContact O-N 2.94Å; V27-L35 HydrophobicContact CG2-CD1 4.34Å; V27-F81 HydrophobicContact CG2-CE1 4.19Å
28K64.4Low67.1Low153 Ų15372.1 Ų72.167%0.66537%0.367SS*.THydrogen-bonded Turntrans-70.21.2-179.3-73.3173.9-175.1163.80114.4D24 P30D24-K28 VanDerWaalsContact O-CB 3.24Å; D24-K28 WeakPolarHBondContact O-CB 3.46Å; D24-K28 WeakPolarHBondContact O-CG 3.25Å; D24-K28 PolarHBondContact O-N 3.4Å; D24-K28 IonicContact OD2-NZ 3.07Å; D24-K28 PolarHBondContact OD2-NZ 3.27Å; K28-P30 WeakPolarHBondContact O-CD 3.25Å
29R58.7Low65.7Low115 Ų11572.1 Ų72.143%0.43438%0.378SS..  trans-84121.3-178.3-140.8173.1-167.1-126.5-0.7110.2V27 S31 L32 R46V27-R29 PolarHBondContact O-N 2.94Å; R29-S31 PolarHBondContact O-N 3.22Å; R29-L32 HydrophobicContact CB-CD1 4.21Å; R29-L32 PolarHBondContact O-N 3.23Å; R29-R46 VanDerWaalsContact CD-NH1 3.31Å
30P50.1Low64.5Low101 Ų10176.9 Ų76.966%0.65640%0.397SS*.G310 helixtrans-56.8-28.1-177.3-24.832.7000114.1K28 L32 Q33K28-P30 WeakPolarHBondContact O-CD 3.25Å; P30-L32 VanDerWaalsContact C-N 3.26Å; P30-L32 PolarHBondContact O-N 3.38Å; P30-Q33 WeakPolarHBondContact O-CG 3.24Å
31S51.8Low63.6Low68 Ų6882 Ų8248%0.47642%0.419SS..G310 helixtrans-74.6-7.517965.20000114.9R29R29-S31 PolarHBondContact O-N 3.22Å
32L52Low62.9Low13 Ų1380.9 Ų80.97%0.06842%0.417CS..G310 helixtrans-11921-175.2-69.1169.3000112.3I26 R29 P30 F34 W38 C42I26-L32 HydrophobicContact CG2-CD1 4.37Å; R29-L32 HydrophobicContact CB-CD1 4.21Å; R29-L32 PolarHBondContact O-N 3.23Å; P30-L32 VanDerWaalsContact C-N 3.26Å; P30-L32 PolarHBondContact O-N 3.38Å; L32-F34 PolarHBondContact O-N 3.08Å; L32-W38 HydrophobicContact CD2-CB 4.4Å; L32-W38 HydrophobicContact CD2-CD2 4.27Å; L32-W38 HydrophobicContact CD2-CG 4.08Å; L32-C42 HydrophobicContact CD2-CB 4.41Å
33Q51.8Low62.3Low146 Ų14680.7 Ų80.768%0.68242%0.416SS*.SBendtrans-60.1-13.1-177.6-79.6175.9-6.500114.5P30P30-Q33 WeakPolarHBondContact O-CG 3.24Å
34F53.3Low62.3Low116 Ų11681.7 Ų81.751%0.50942%0.42SS..  trans-118.571.5176.7-59-77.2000110.8L32 G36 Q37 W38L32-F34 PolarHBondContact O-N 3.08Å; F34-G36 PolarHBondContact O-N 3.05Å; F34-Q37 HydrophobicContact CB-CB 4.17Å; F34-Q37 HydrophobicContact CB-CG 4.2Å; F34-Q37 PolarHBondContact O-N 3.14Å; F34-W38 VanDerWaalsContact O-CD1 3.29Å
35L52.3Low62.4Low49 Ų4981 Ų8126%0.25742%0.419SS..G310 helixtrans-52.4-31.4-177.8-75160.9000113.6V27 Q37 F85V27-L35 HydrophobicContact CG2-CD1 4.34Å; L35-Q37 VanDerWaalsContact C-N 3.28Å; L35-Q37 PolarHBondContact O-N 3.2Å; L35-F85 HydrophobicContact CD2-CD2 4.02Å; L35-F85 HydrophobicContact CD2-CE2 3.78Å; L35-F85 HydrophobicContact CD2-CZ 4.41Å
36G50.9Low62.6Low71 Ų7177.9 Ų77.973%0.73240%0.403SS*.G310 helixtrans-73.1-6.6175.800000116.3F34F34-G36 PolarHBondContact O-N 3.05Å
37Q49.7Very low63Low155 Ų15577.6 Ų77.672%0.72440%0.401SS*.G310 helixtrans-105.5-9.7179.5-70.9-175.6-15.600114F34 L35F34-Q37 HydrophobicContact CB-CB 4.17Å; F34-Q37 HydrophobicContact CB-CG 4.2Å; F34-Q37 PolarHBondContact O-N 3.14Å; L35-Q37 VanDerWaalsContact C-N 3.28Å; L35-Q37 PolarHBondContact O-N 3.2Å
38W53.2Low63.7Low125 Ų12576.9 Ų76.947%0.47339%0.394SS..SBendtrans-114.3120.4-177.6-62.584.9000110.2L32 F34 C42L32-W38 HydrophobicContact CD2-CB 4.4Å; L32-W38 HydrophobicContact CD2-CD2 4.27Å; L32-W38 HydrophobicContact CD2-CG 4.08Å; F34-W38 VanDerWaalsContact O-CD1 3.29Å; W38-C42 HydrophobicContact CB-CB 4.4Å; W38-C42 HydrophobicContact CE3-CB 4.49Å
39G58.3Low64.7Low44 Ų4477.4 Ų77.445%0.45439%0.391SS..  trans-62.1153.717300000112.4H41 C42G39-H41 PolarHBondContact O-N 3.11Å; G39-C42 PolarHBondContact O-N 3.08Å
40Y63.8Low66.2Low100 Ų10074.6 Ų74.639%0.39239%0.387SS..G310 helixtrans-47.5-28.2-176.467-89.6000115.3C42 Y43 E44Y40-C42 PolarHBondContact O-N 3.38Å; Y40-Y43 PolarHBondContact O-N 2.95Å; Y40-Y43 VanDerWaalsContact O-N 3.1Å; Y40-E44 HydrophobicContact CD2-CB 4.31Å; Y40-E44 VanDerWaalsContact CD2-OE2 3.3Å; Y40-E44 WeakPolarHBondContact CD2-OE2 3.48Å; Y40-E44 VanDerWaalsContact CE2-OE2 3.28Å; Y40-E44 WeakPolarHBondContact CE2-OE2 3.46Å; Y40-E44 VanDerWaalsContact O-CB 3.3Å; Y40-E44 WeakPolarHBondContact O-CB 3.43Å; Y40-E44 PolarHBondContact O-N 3.4Å
41H66.2Low68.2Low117 Ų11769.8 Ų69.854%0.54236%0.356SS..G310 helixtrans-49.9-25.1174.3-59.7-53.9000115G39 E44 P45G39-H41 PolarHBondContact O-N 3.11Å; H41-E44 IonicContact ND1-OE2 3.86Å; H41-P45 VanDerWaalsContact O-CD 3.28Å; H41-P45 WeakPolarHBondContact O-CD 3.31Å
42C69.8Low69.9Low52 Ų5266.8 Ų66.835%0.35134%0.335SS..G310 helixtrans-76.3-24.8-176.9-63.70000113.6L32 W38 G39 Y40L32-C42 HydrophobicContact CD2-CB 4.41Å; W38-C42 HydrophobicContact CB-CB 4.4Å; W38-C42 HydrophobicContact CE3-CB 4.49Å; G39-C42 PolarHBondContact O-N 3.08Å; Y40-C42 PolarHBondContact O-N 3.38Å
43Y75.3Confident71.8Confident5 Ų573.4 Ų73.42%0.0236%0.364CS..THydrogen-bonded Turntrans-123.4-22.8-175.860.1-102.4000113.5I26 Y40 R46 I47 F85 E88 I92I26-Y43 HydrophobicContact CG2-CG 4.2Å; Y40-Y43 PolarHBondContact O-N 2.95Å; Y40-Y43 VanDerWaalsContact O-N 3.1Å; Y43-R46 WeakPolarHBondContact O-CB 3.25Å; Y43-R46 PolarHBondContact O-N 3.44Å; Y43-I47 HydrophobicContact CD2-CD1 3.56Å; Y43-I47 HydrophobicContact CD2-CG1 4.49Å; Y43-I47 HydrophobicContact CE2-CD1 3.99Å; Y43-I47 PolarHBondContact O-N 3.48Å; Y43-F85 HydrophobicContact CD1-CE2 4.36Å; Y43-F85 HydrophobicContact CE1-CD2 4.22Å; Y43-F85 AromaticContact CE1-CE2 3.88Å; Y43-F85 HydrophobicContact CE1-CE2 3.88Å; Y43-F85 HydrophobicContact CE2-CE2 4.2Å; Y43-F85 AromaticContact CZ-CE2 3.8Å; Y43-E88 VanDerWaalsContact OH-CB 3.3Å; Y43-E88 WeakPolarHBondContact OH-CB 3.33Å; Y43-E88 PolarHBondContact OH-OE2 2.91Å; Y43-I92 HydrophobicContact CD2-CD1 4.19Å; Y43-I92 HydrophobicContact CE2-CD1 3.63Å
44E80.6Confident73.6Confident21 Ų2169 Ų6910%0.09834%0.344CS..Hα-helixtrans-49.7-50.8177.6170.6-170.7-157.100113.7Y40 H41 R46 I47 Y48 I92Y40-E44 HydrophobicContact CD2-CB 4.31Å; Y40-E44 VanDerWaalsContact CD2-OE2 3.3Å; Y40-E44 WeakPolarHBondContact CD2-OE2 3.48Å; Y40-E44 VanDerWaalsContact CE2-OE2 3.28Å; Y40-E44 WeakPolarHBondContact CE2-OE2 3.46Å; Y40-E44 VanDerWaalsContact O-CB 3.3Å; Y40-E44 WeakPolarHBondContact O-CB 3.43Å; Y40-E44 PolarHBondContact O-N 3.4Å; H41-E44 IonicContact ND1-OE2 3.86Å; E44-R46 PolarHBondContact O-N 3.05Å; E44-I47 PolarHBondContact O-N 2.83Å; E44-I47 VanDerWaalsContact O-N 3.15Å; E44-Y48 PolarHBondContact O-N 3.16Å; E44-I92 HydrophobicContact CB-CD1 3.8Å; E44-I92 HydrophobicContact CB-CG1 4.41Å; E44-I92 HydrophobicContact CG-CD1 4.16Å; E44-I92 HydrophobicContact CG-CG1 4.22Å; E44-I92 HydrophobicContact CG-CG2 4.14Å
45P82.3Confident75.5Confident41 Ų4163.6 Ų63.627%0.26632%0.321SS..Hα-helixtrans-59.9-26-178.5-25.834.9000113.6H41 R49H41-P45 VanDerWaalsContact O-CD 3.28Å; H41-P45 WeakPolarHBondContact O-CD 3.31Å; P45-R49 VanDerWaalsContact O-CB 3.28Å; P45-R49 WeakPolarHBondContact O-CB 3.47Å; P45-R49 WeakPolarHBondContact O-CD 3.4Å; P45-R49 WeakPolarHBondContact O-CG 3.31Å; P45-R49 PolarHBondContact O-N 3.4Å
46R82.9Confident77.2Confident90 Ų9067.7 Ų67.734%0.3433%0.333SS..Hα-helixtrans-81.1-42.4179.8-63.9178.8179.6-173.60.6111.9R29 Y43 E44 Y48 R49 T50R29-R46 VanDerWaalsContact CD-NH1 3.31Å; Y43-R46 WeakPolarHBondContact O-CB 3.25Å; Y43-R46 PolarHBondContact O-N 3.44Å; E44-R46 PolarHBondContact O-N 3.05Å; R46-Y48 VanDerWaalsContact C-N 3.31Å; R46-R49 PolarHBondContact O-N 2.82Å; R46-T50 WeakPolarHBondContact O-CB 3.5Å; R46-T50 PolarHBondContact O-N 3.17Å; R46-T50 PolarHBondContact O-OG1 2.76Å
47I85.7Confident79.1Confident0 Ų072.7 Ų72.70%033%0.331CS..Hα-helixtrans-56.9-53.3172.8-65173.4000108.1L22 I26 Y43 E44 R49 T50 L51 F89 I92L22-I47 HydrophobicContact CD2-CB 4.26Å; L22-I47 HydrophobicContact CD2-CG1 4.2Å; L22-I47 HydrophobicContact CD2-CG2 3.85Å; L22-I47 HydrophobicContact CG-CG1 4.39Å; I26-I47 HydrophobicContact CD1-CD1 3.76Å; I26-I47 HydrophobicContact CD1-CG1 3.52Å; Y43-I47 HydrophobicContact CD2-CD1 3.56Å; Y43-I47 HydrophobicContact CD2-CG1 4.49Å; Y43-I47 HydrophobicContact CE2-CD1 3.99Å; Y43-I47 PolarHBondContact O-N 3.48Å; E44-I47 PolarHBondContact O-N 2.83Å; E44-I47 VanDerWaalsContact O-N 3.15Å; I47-R49 PolarHBondContact O-N 3.43Å; I47-T50 PolarHBondContact O-N 2.88Å; I47-L51 HydrophobicContact CG2-CD1 3.8Å; I47-L51 HydrophobicContact CG2-CG 4.4Å; I47-L51 WeakPolarHBondContact O-CB 3.23Å; I47-L51 PolarHBondContact O-N 3.16Å; I47-F89 HydrophobicContact CD1-CD2 3.36Å; I47-F89 HydrophobicContact CD1-CE2 3.52Å; I47-F89 HydrophobicContact CD1-CG 4.43Å; I47-F89 HydrophobicContact CG1-CD2 4.3Å; I47-F89 HydrophobicContact CG1-CE2 3.96Å; I47-I92 HydrophobicContact CB-CG2 3.88Å; I47-I92 HydrophobicContact CD1-CB 4.49Å; I47-I92 HydrophobicContact CD1-CD1 4.08Å; I47-I92 HydrophobicContact CD1-CG2 4.29Å; I47-I92 HydrophobicContact CG2-CB 4.32Å; I47-I92 HydrophobicContact CG2-CG2 3.53Å
48Y85.4Confident81.1Confident32 Ų3266.2 Ų66.213%0.12530%0.302CS..Hα-helixtrans-56.7-54.1178.9177.3-105.6000112.1E44 R46 T50 L51 A52 T96 V139 Y140E44-Y48 PolarHBondContact O-N 3.16Å; R46-Y48 VanDerWaalsContact C-N 3.31Å; Y48-T50 VanDerWaalsContact C-N 3.26Å; Y48-T50 PolarHBondContact O-N 3.33Å; Y48-L51 PolarHBondContact O-N 3.13Å; Y48-A52 HydrophobicContact CE1-CB 4.35Å; Y48-A52 HydrophobicContact CE2-CB 4.4Å; Y48-A52 WeakPolarHBondContact O-CA 3.25Å; Y48-A52 WeakPolarHBondContact O-CB 3.48Å; Y48-A52 PolarHBondContact O-N 3.49Å; Y48-T96 HydrophobicContact CD2-CG2 3.67Å; Y48-T96 HydrophobicContact CE2-CG2 4.04Å; Y48-V139 HydrophobicContact CD1-CG1 3.76Å; Y48-V139 HydrophobicContact CD2-CB 4.14Å; Y48-V139 HydrophobicContact CD2-CG1 3.68Å; Y48-V139 HydrophobicContact CD2-CG2 3.58Å; Y48-V139 HydrophobicContact CE1-CG1 4.16Å; Y48-V139 HydrophobicContact CE2-CB 4.24Å; Y48-V139 HydrophobicContact CE2-CG1 4.1Å; Y48-V139 HydrophobicContact CE2-CG2 3.78Å; Y48-V139 HydrophobicContact CG-CB 4.42Å; Y48-V139 HydrophobicContact CG-CG1 3.48Å; Y48-V139 VanDerWaalsContact CG-CG1 3.48Å; Y48-V139 HydrophobicContact CG-CG2 4.25Å; Y48-Y140 HydrophobicContact CD1-CE2 4.39Å; Y48-Y140 AromaticContact CE1-CE2 3.86Å; Y48-Y140 HydrophobicContact CE1-CE2 3.86Å
49R85.8Confident83.1Confident164 Ų16465 Ų6562%0.61930%0.304SS*.Hα-helixtrans-57.5-39.3-179.6-77.9173.1-164.61575.3112.6P45 R46 I47 K53P45-R49 VanDerWaalsContact O-CB 3.28Å; P45-R49 WeakPolarHBondContact O-CB 3.47Å; P45-R49 WeakPolarHBondContact O-CD 3.4Å; P45-R49 WeakPolarHBondContact O-CG 3.31Å; P45-R49 PolarHBondContact O-N 3.4Å; R46-R49 PolarHBondContact O-N 2.82Å; I47-R49 PolarHBondContact O-N 3.43Å; R49-K53 WeakPolarHBondContact O-CB 3.27Å; R49-K53 PolarHBondContact O-N 2.76Å
50T89.2Confident84.8Confident56 Ų5665.9 Ų65.934%0.34430%0.299SS..Hα-helixtrans-70-51.8-178.6-53.80000110.8L22 R46 I47 Y48 K53 I54L22-T50 HydrophobicContact CD1-CG2 3.9Å; R46-T50 WeakPolarHBondContact O-CB 3.5Å; R46-T50 PolarHBondContact O-N 3.17Å; R46-T50 PolarHBondContact O-OG1 2.76Å; I47-T50 PolarHBondContact O-N 2.88Å; Y48-T50 VanDerWaalsContact C-N 3.26Å; Y48-T50 PolarHBondContact O-N 3.33Å; T50-K53 PolarHBondContact O-N 3.25Å; T50-I54 HydrophobicContact CG2-CD1 4.4Å; T50-I54 WeakPolarHBondContact O-CG1 3.3Å; T50-I54 PolarHBondContact O-N 2.92Å; T50-I54 VanDerWaalsContact O-N 3.16Å
51L91.1Very high86.3Confident0 Ų067 Ų670%031%0.311CS..Hα-helixtrans-64.5-41.9178.6-70-179.7000111.6F19 L22 I47 Y48 K53 I54 L55 C93 T96F19-L51 HydrophobicContact CE1-CD1 4.21Å; F19-L51 HydrophobicContact CE1-CD2 3.87Å; F19-L51 HydrophobicContact CZ-CD2 4.24Å; L22-L51 HydrophobicContact CD2-CD1 4.5Å; L22-L51 HydrophobicContact CD2-CD2 4.35Å; L22-L51 HydrophobicContact CD2-CG 4.15Å; I47-L51 HydrophobicContact CG2-CD1 3.8Å; I47-L51 HydrophobicContact CG2-CG 4.4Å; I47-L51 WeakPolarHBondContact O-CB 3.23Å; I47-L51 PolarHBondContact O-N 3.16Å; Y48-L51 PolarHBondContact O-N 3.13Å; L51-K53 VanDerWaalsContact C-N 3.29Å; L51-K53 PolarHBondContact O-N 2.78Å; L51-I54 PolarHBondContact O-N 2.85Å; L51-I54 VanDerWaalsContact O-N 3.13Å; L51-L55 HydrophobicContact CB-CD1 4.31Å; L51-L55 WeakPolarHBondContact O-CB 3.48Å; L51-L55 VanDerWaalsContact O-CG 3.29Å; L51-L55 WeakPolarHBondContact O-CG 3.3Å; L51-L55 PolarHBondContact O-N 3.12Å; L51-C93 HydrophobicContact CD1-CB 4.12Å; L51-T96 HydrophobicContact CB-CG2 3.69Å; L51-T96 HydrophobicContact CD1-CG2 4.39Å
52A89.1Confident87.6Confident6 Ų662.3 Ų62.35%0.0530%0.295CS..Hα-helixtrans-60.2-37.9175.800000112.3Y48 R56 W100Y48-A52 HydrophobicContact CE1-CB 4.35Å; Y48-A52 HydrophobicContact CE2-CB 4.4Å; Y48-A52 WeakPolarHBondContact O-CA 3.25Å; Y48-A52 WeakPolarHBondContact O-CB 3.48Å; Y48-A52 PolarHBondContact O-N 3.49Å; A52-R56 WeakPolarHBondContact O-CB 3.5Å; A52-R56 PolarHBondContact O-N 3.08Å; A52-W100 HydrophobicContact CB-CZ2 3.82Å; A52-W100 VanDerWaalsContact CB-NE1 3.32Å
53K90.3Very high88.9Confident152 Ų15259.9 Ų59.966%0.66128%0.278SS*.Hα-helixtrans-65.2-41.1175-174.8177.4178.5-179.70111.5R49 T50 L51 Y57R49-K53 WeakPolarHBondContact O-CB 3.27Å; R49-K53 PolarHBondContact O-N 2.76Å; T50-K53 PolarHBondContact O-N 3.25Å; L51-K53 VanDerWaalsContact C-N 3.29Å; L51-K53 PolarHBondContact O-N 2.78Å; K53-Y57 WeakPolarHBondContact O-CD2 3.27Å
54I91.4Very high89.9Confident54 Ų5461.9 Ų61.928%0.27729%0.289SS..Hα-helixtrans-66.1-56.9176.6-63.4166.3000109.6I18 T50 L51 R56 Y57 V58 L66I18-I54 HydrophobicContact CG2-CD1 3.84Å; T50-I54 HydrophobicContact CG2-CD1 4.4Å; T50-I54 WeakPolarHBondContact O-CG1 3.3Å; T50-I54 PolarHBondContact O-N 2.92Å; T50-I54 VanDerWaalsContact O-N 3.16Å; L51-I54 PolarHBondContact O-N 2.85Å; L51-I54 VanDerWaalsContact O-N 3.13Å; I54-R56 PolarHBondContact O-N 3.42Å; I54-R56 VanDerWaalsContact O-N 3.16Å; I54-Y57 PolarHBondContact O-N 2.93Å; I54-Y57 VanDerWaalsContact O-N 3.09Å; I54-V58 WeakPolarHBondContact O-CB 3.46Å; I54-V58 PolarHBondContact O-N 2.9Å; I54-L66 HydrophobicContact CG2-CD1 3.74Å
55L91.4Very high90.5Very high2 Ų265.7 Ų65.71%0.0131%0.309CS..Hα-helixtrans-61.3-27.4-175.6-69.7163.5000113.2L51 Y57 V58 F63 L66 T96 I97 W100 K105L51-L55 HydrophobicContact CB-CD1 4.31Å; L51-L55 WeakPolarHBondContact O-CB 3.48Å; L51-L55 VanDerWaalsContact O-CG 3.29Å; L51-L55 WeakPolarHBondContact O-CG 3.3Å; L51-L55 PolarHBondContact O-N 3.12Å; L55-Y57 VanDerWaalsContact C-N 3.34Å; L55-Y57 PolarHBondContact O-N 3.42Å; L55-V58 HydrophobicContact CD2-CG1 4.41Å; L55-F63 HydrophobicContact CD2-CD2 4.03Å; L55-F63 HydrophobicContact CD2-CE2 3.95Å; L55-L66 HydrophobicContact CD2-CD1 4.1Å; L55-L66 HydrophobicContact CD2-CD2 4.38Å; L55-L66 HydrophobicContact CG-CD1 4.46Å; L55-T96 HydrophobicContact CD1-CG2 4.05Å; L55-I97 HydrophobicContact CD1-CG1 4.3Å; L55-W100 HydrophobicContact CB-CB 3.89Å; L55-W100 HydrophobicContact CB-CD2 4.04Å; L55-W100 HydrophobicContact CB-CE3 4.46Å; L55-W100 HydrophobicContact CB-CG 3.76Å; L55-W100 HydrophobicContact CD1-CB 3.91Å; L55-W100 HydrophobicContact CD1-CG 3.98Å; L55-W100 HydrophobicContact CG-CB 4.37Å; L55-W100 HydrophobicContact CG-CG 4.49Å; L55-K105 WeakPolarHBondContact O-CE 3.46Å
56R88.9Confident91.1Very high135 Ų13563.8 Ų63.851%0.50930%0.297SS..Hα-helixtrans-62-39.5175.4-176.8179.5-63.1-174.6-3.6112.9A52 I54 W100A52-R56 WeakPolarHBondContact O-CB 3.5Å; A52-R56 PolarHBondContact O-N 3.08Å; I54-R56 PolarHBondContact O-N 3.42Å; I54-R56 VanDerWaalsContact O-N 3.16Å; R56-W100 HydrophobicContact CB-CH2 3.77Å; R56-W100 HydrophobicContact CB-CZ2 4.49Å; R56-W100 HydrophobicContact CB-CZ3 3.84Å; R56-W100 HydrophobicContact CG-CH2 4.04Å; R56-W100 HydrophobicContact CG-CZ3 4.14Å
57Y90.1Very high91.7Very high175 Ų17559.6 Ų59.669%0.68628%0.281SS*.Hα-helixtrans-112.7-3.6-171.5-59.2-70000113.8K53 I54 L55K53-Y57 WeakPolarHBondContact O-CD2 3.27Å; I54-Y57 PolarHBondContact O-N 2.93Å; I54-Y57 VanDerWaalsContact O-N 3.09Å; L55-Y57 VanDerWaalsContact C-N 3.34Å; L55-Y57 PolarHBondContact O-N 3.42Å
58V92.9Very high92.2Very high19 Ų1962.4 Ų62.412%0.11530%0.298CS..  trans-68.5135.7179.6800000111I54 L55 F63 K105 F110I54-V58 WeakPolarHBondContact O-CB 3.46Å; I54-V58 PolarHBondContact O-N 2.9Å; L55-V58 HydrophobicContact CD2-CG1 4.41Å; V58-F63 HydrophobicContact CG1-CB 4.21Å; V58-F63 HydrophobicContact CG1-CD2 4.49Å; V58-F63 HydrophobicContact CG2-CB 4.34Å; V58-F63 VanDerWaalsContact CG2-N 3.29Å; V58-K105 PolarHBondContact O-NZ 3.34Å; V58-F110 HydrophobicContact CG1-CE1 4.13Å
59D93.9Very high92.5Very high100 Ų10062.3 Ų62.354%0.53530%0.3SS..  trans-84.6-175166.758.15.6000110.7G62 F63D59-G62 WeakPolarHBondContact OD1-CA 3.49Å; D59-G62 PolarHBondContact OD1-N 2.96Å; D59-F63 VanDerWaalsContact O-CB 3.29Å; D59-F63 WeakPolarHBondContact O-CB 3.32Å; D59-F63 PolarHBondContact O-N 3.13Å
60L95.1Very high92.9Very high63 Ų6354.6 Ų54.633%0.3327%0.271SS..Hα-helixtrans-66.8-43.3-178.1-75.7170.7000112.1F63 D64 D109 F110 L113L60-F63 WeakPolarHBondContact O-CB 3.45Å; L60-F63 PolarHBondContact O-N 3.5Å; L60-F63 VanDerWaalsContact O-N 3.15Å; L60-D64 PolarHBondContact O-N 3.18Å; L60-D109 HydrophobicContact CD1-CB 3.82Å; L60-D109 HydrophobicContact CD2-CB 3.82Å; L60-D109 HydrophobicContact CG-CB 4.43Å; L60-F110 HydrophobicContact CD2-CD1 4.27Å; L60-F110 HydrophobicContact CD2-CD2 3.57Å; L60-F110 HydrophobicContact CD2-CE1 4.32Å; L60-F110 HydrophobicContact CD2-CE2 3.65Å; L60-F110 HydrophobicContact CD2-CG 3.89Å; L60-F110 HydrophobicContact CD2-CZ 4.03Å; L60-F110 HydrophobicContact CG-CD2 4.38Å; L60-F110 HydrophobicContact CG-CE2 3.99Å; L60-F110 HydrophobicContact CG-CZ 4.28Å; L60-L113 HydrophobicContact CD2-CD2 4.36Å; L60-L113 WeakPolarHBondContact O-CD2 3.4Å
61D94.6Very high93Very high123 Ų12352.9 Ų52.966%0.65826%0.26SS*.Hα-helixtrans-65.6-43.4179.5-66.4-30.3000111.4F63 D64 I65D61-F63 PolarHBondContact O-N 3.41Å; D61-D64 VanDerWaalsContact O-CB 3.31Å; D61-D64 WeakPolarHBondContact O-CB 3.5Å; D61-D64 PolarHBondContact O-N 2.85Å; D61-I65 WeakPolarHBondContact O-CG1 3.25Å; D61-I65 PolarHBondContact O-N 3.24Å; D61-I65 VanDerWaalsContact O-N 3.08Å
62G94.1Very high93Very high19 Ų1954.2 Ų54.220%0.19627%0.271CS..Hα-helixtrans-63.4-32.6173.500000112.5D59 L66D59-G62 WeakPolarHBondContact OD1-CA 3.49Å; D59-G62 PolarHBondContact OD1-N 2.96Å; G62-L66 WeakPolarHBondContact O-CB 3.42Å; G62-L66 PolarHBondContact O-N 2.96Å
63F96.1Very high93Very high0 Ų054 Ų540%027%0.268CS..Hα-helixtrans-72.7-36.6176.1-173.2-122000111.8L55 V58 D59 L60 D61 I65 L66 L67 I97 V101 F110 L113 L114L55-F63 HydrophobicContact CD2-CD2 4.03Å; L55-F63 HydrophobicContact CD2-CE2 3.95Å; V58-F63 HydrophobicContact CG1-CB 4.21Å; V58-F63 HydrophobicContact CG1-CD2 4.49Å; V58-F63 HydrophobicContact CG2-CB 4.34Å; V58-F63 VanDerWaalsContact CG2-N 3.29Å; D59-F63 VanDerWaalsContact O-CB 3.29Å; D59-F63 WeakPolarHBondContact O-CB 3.32Å; D59-F63 PolarHBondContact O-N 3.13Å; L60-F63 WeakPolarHBondContact O-CB 3.45Å; L60-F63 PolarHBondContact O-N 3.5Å; L60-F63 VanDerWaalsContact O-N 3.15Å; D61-F63 PolarHBondContact O-N 3.41Å; F63-I65 VanDerWaalsContact C-N 3.32Å; F63-I65 PolarHBondContact O-N 3.12Å; F63-L66 HydrophobicContact CD2-CD2 4.26Å; F63-L66 HydrophobicContact CE2-CD2 4.17Å; F63-L66 PolarHBondContact O-N 3.31Å; F63-L67 HydrophobicContact CD1-CD1 4.04Å; F63-L67 HydrophobicContact CD2-CG 4.49Å; F63-L67 HydrophobicContact CE1-CD1 3.57Å; F63-L67 HydrophobicContact CE1-CG 4.12Å; F63-L67 HydrophobicContact CE2-CD1 4.44Å; F63-L67 HydrophobicContact CE2-CD2 4.18Å; F63-L67 HydrophobicContact CE2-CG 4.09Å; F63-L67 HydrophobicContact CZ-CD1 3.78Å; F63-L67 HydrophobicContact CZ-CD2 3.92Å; F63-L67 HydrophobicContact CZ-CG 3.88Å; F63-L67 WeakPolarHBondContact O-CG 3.36Å; F63-L67 PolarHBondContact O-N 3.29Å; F63-I97 HydrophobicContact CE2-CG2 4.17Å; F63-I97 HydrophobicContact CZ-CG2 4.24Å; F63-V101 HydrophobicContact CE1-CG2 4.14Å; F63-V101 HydrophobicContact CE2-CG2 3.93Å; F63-V101 HydrophobicContact CZ-CG2 3.44Å; F63-V101 VanDerWaalsContact CZ-CG2 3.44Å; F63-F110 HydrophobicContact CB-CD1 4.02Å; F63-F110 HydrophobicContact CB-CE1 3.71Å; F63-F110 HydrophobicContact CD1-CB 4.47Å; F63-F110 AromaticContact CD1-CD1 3.46Å; F63-F110 HydrophobicContact CD1-CD1 3.46Å; F63-F110 VanDerWaalsContact CD1-CD1 3.46Å; F63-F110 HydrophobicContact CD1-CE1 4.08Å; F63-F110 HydrophobicContact CD1-CG 4.32Å; F63-F110 HydrophobicContact CD2-CD1 4.35Å; F63-F110 HydrophobicContact CE1-CB 4.38Å; F63-F110 AromaticContact CE1-CD1 3.99Å; F63-F110 HydrophobicContact CE1-CD1 3.99Å; F63-F110 WeakPolarHBondContact CE1-O 3.47Å; F63-F110 AromaticContact CG-CD1 3.68Å; F63-F110 HydrophobicContact CG-CD1 3.68Å; F63-F110 AromaticContact CG-CE1 3.88Å; F63-F110 HydrophobicContact CG-CE1 3.88Å; F63-L113 HydrophobicContact CD1-CD2 4.04Å; F63-L113 HydrophobicContact CD1-CG 4.49Å; F63-L114 HydrophobicContact CE1-CB 4.27Å; F63-L114 HydrophobicContact CZ-CB 4.49Å; F63-L114 HydrophobicContact CZ-CD1 4.39Å
64D96.1Very high93Very high48 Ų4847.9 Ų47.926%0.25724%0.244SC..Hα-helixtrans-56.1-47.3170.7-166.378.9000111.4L60 D61 L67 T68 L113 K117L60-D64 PolarHBondContact O-N 3.18Å; D61-D64 VanDerWaalsContact O-CB 3.31Å; D61-D64 WeakPolarHBondContact O-CB 3.5Å; D61-D64 PolarHBondContact O-N 2.85Å; D64-L67 PolarHBondContact O-N 2.92Å; D64-T68 WeakPolarHBondContact O-CB 3.42Å; D64-T68 PolarHBondContact O-N 3.16Å; D64-T68 PolarHBondContact O-OG1 3.24Å; D64-L113 HydrophobicContact CB-CD2 4.03Å; D64-L113 WeakPolarHBondContact OD1-CD1 3.34Å; D64-K117 WeakPolarHBondContact OD1-CE 3.47Å; D64-K117 IonicContact OD1-NZ 2.81Å; D64-K117 PolarHBondContact OD1-NZ 2.87Å; D64-K117 WeakPolarHBondContact OD2-CE 3.5Å; D64-K117 IonicContact OD2-NZ 3.27Å; D64-K117 PolarHBondContact OD2-NZ 3.27Å
65I94.4Very high92.8Very high101 Ų10150.9 Ų50.952%0.51826%0.257SS..Hα-helixtrans-62.7-45.9177-65167000110D61 F63 L67 T68 D69D61-I65 WeakPolarHBondContact O-CG1 3.25Å; D61-I65 PolarHBondContact O-N 3.24Å; D61-I65 VanDerWaalsContact O-N 3.08Å; F63-I65 VanDerWaalsContact C-N 3.32Å; F63-I65 PolarHBondContact O-N 3.12Å; I65-L67 PolarHBondContact O-N 3.35Å; I65-T68 PolarHBondContact O-N 3.43Å; I65-D69 WeakPolarHBondContact O-CB 3.49Å; I65-D69 PolarHBondContact O-N 3.23Å
66L95.1Very high92.3Very high1 Ų156.5 Ų56.51%0.00528%0.281CS..Hα-helixtrans-60.3-44.1178.8-177.6146.8000112.2F19 I54 L55 G62 F63 D69 Y70 I97F19-L66 HydrophobicContact CE2-CG 4.33Å; F19-L66 WeakPolarHBondContact CE2-O 3.49Å; F19-L66 HydrophobicContact CZ-CD2 4.15Å; F19-L66 HydrophobicContact CZ-CG 4.23Å; I54-L66 HydrophobicContact CG2-CD1 3.74Å; L55-L66 HydrophobicContact CD2-CD1 4.1Å; L55-L66 HydrophobicContact CD2-CD2 4.38Å; L55-L66 HydrophobicContact CG-CD1 4.46Å; G62-L66 WeakPolarHBondContact O-CB 3.42Å; G62-L66 PolarHBondContact O-N 2.96Å; F63-L66 HydrophobicContact CD2-CD2 4.26Å; F63-L66 HydrophobicContact CE2-CD2 4.17Å; F63-L66 PolarHBondContact O-N 3.31Å; L66-D69 PolarHBondContact O-N 3.29Å; L66-Y70 PolarHBondContact O-N 2.91Å; L66-I97 HydrophobicContact CD2-CD1 4.03Å; L66-I97 HydrophobicContact CD2-CG1 4.2Å
67L95.5Very high91.3Very high1 Ų150.3 Ų50.31%0.00526%0.259CS..Hα-helixtrans-66.7-41.2177-71.7176.8000111.8F63 D64 I65 D69 Y70 I71 I97 L114 K117 L131F63-L67 HydrophobicContact CD1-CD1 4.04Å; F63-L67 HydrophobicContact CD2-CG 4.49Å; F63-L67 HydrophobicContact CE1-CD1 3.57Å; F63-L67 HydrophobicContact CE1-CG 4.12Å; F63-L67 HydrophobicContact CE2-CD1 4.44Å; F63-L67 HydrophobicContact CE2-CD2 4.18Å; F63-L67 HydrophobicContact CE2-CG 4.09Å; F63-L67 HydrophobicContact CZ-CD1 3.78Å; F63-L67 HydrophobicContact CZ-CD2 3.92Å; F63-L67 HydrophobicContact CZ-CG 3.88Å; F63-L67 WeakPolarHBondContact O-CG 3.36Å; F63-L67 PolarHBondContact O-N 3.29Å; D64-L67 PolarHBondContact O-N 2.92Å; I65-L67 PolarHBondContact O-N 3.35Å; L67-D69 VanDerWaalsContact C-N 3.3Å; L67-D69 PolarHBondContact O-N 2.91Å; L67-Y70 WeakPolarHBondContact O-CB 3.35Å; L67-Y70 PolarHBondContact O-N 3.47Å; L67-I71 WeakPolarHBondContact O-CG1 3.4Å; L67-I71 PolarHBondContact O-N 3.27Å; L67-I97 HydrophobicContact CD2-CG2 4.49Å; L67-L114 HydrophobicContact CD1-CB 4.3Å; L67-K117 HydrophobicContact CB-CB 4.47Å; L67-K117 HydrophobicContact CB-CG 4.34Å; L67-K117 HydrophobicContact CD1-CB 4.16Å; L67-K117 HydrophobicContact CD1-CG 4.1Å; L67-L131 HydrophobicContact CD2-CD2 4.48Å
68T94.8Very high89.7Confident60 Ų6044.6 Ų44.637%0.36825%0.253SS..Hα-helixtrans-60.9-42.7176.1-56.40000110.8D64 I65 I71 A72 K117D64-T68 WeakPolarHBondContact O-CB 3.42Å; D64-T68 PolarHBondContact O-N 3.16Å; D64-T68 PolarHBondContact O-OG1 3.24Å; I65-T68 PolarHBondContact O-N 3.43Å; T68-I71 PolarHBondContact O-N 2.75Å; T68-A72 WeakPolarHBondContact O-CB 3.39Å; T68-A72 PolarHBondContact O-N 3.11Å; T68-K117 PolarHBondContact OG1-NZ 3.02Å
69D93Very high87.7Confident30 Ų3052.8 Ų52.816%0.1629%0.289CS..Hα-helixtrans-64-40.4174.5-100.6-5.4000112.4N17 I18 F19 I65 L66 L67 F73N17-D69 WeakPolarHBondContact CA-OD2 3.35Å; N17-D69 VanDerWaalsContact ND2-CA 3.29Å; N17-D69 WeakPolarHBondContact ND2-CA 3.41Å; N17-D69 WeakPolarHBondContact ND2-CB 3.34Å; N17-D69 PolarHBondContact ND2-O 3.25Å; N17-D69 PolarHBondContact ND2-OD1 3.35Å; I18-D69 PolarHBondContact N-OD2 3.3Å; F19-D69 HydrophobicContact CD2-CB 4.16Å; F19-D69 HydrophobicContact CE2-CB 4.25Å; I65-D69 WeakPolarHBondContact O-CB 3.49Å; I65-D69 PolarHBondContact O-N 3.23Å; L66-D69 PolarHBondContact O-N 3.29Å; L67-D69 VanDerWaalsContact C-N 3.3Å; L67-D69 PolarHBondContact O-N 2.91Å; D69-F73 VanDerWaalsContact O-CB 3.22Å; D69-F73 WeakPolarHBondContact O-CB 3.37Å; D69-F73 PolarHBondContact O-N 3.31Å
70Y92.9Very high86.2Confident1 Ų151.8 Ų51.80%0.00428%0.278CS..Hα-helixtrans-63.8-47.8177179.1-103.2000111.3F19 L66 L67 F73 V74 C93 V94 I97 L129 L131F19-Y70 HydrophobicContact CD1-CD2 4.09Å; F19-Y70 HydrophobicContact CD2-CD2 4.42Å; F19-Y70 AromaticContact CE1-CD2 3.78Å; F19-Y70 HydrophobicContact CE1-CD2 3.78Å; F19-Y70 VanDerWaalsContact CE2-CB 3.47Å; F19-Y70 HydrophobicContact CE2-CD2 4.16Å; F19-Y70 HydrophobicContact CE2-CG 4.32Å; F19-Y70 HydrophobicContact CG-CD2 4.4Å; F19-Y70 AromaticContact CZ-CD2 3.82Å; F19-Y70 HydrophobicContact CZ-CD2 3.82Å; F19-Y70 HydrophobicContact CZ-CG 4.2Å; L66-Y70 PolarHBondContact O-N 2.91Å; L67-Y70 WeakPolarHBondContact O-CB 3.35Å; L67-Y70 PolarHBondContact O-N 3.47Å; Y70-F73 WeakPolarHBondContact O-CB 3.46Å; Y70-F73 PolarHBondContact O-N 2.92Å; Y70-V74 HydrophobicContact CD1-CG2 4.39Å; Y70-V74 HydrophobicContact CD2-CG2 4.35Å; Y70-V74 HydrophobicContact CE1-CG2 3.82Å; Y70-V74 HydrophobicContact CE2-CG2 3.8Å; Y70-V74 VanDerWaalsContact CZ-CG2 3.48Å; Y70-V74 WeakPolarHBondContact O-CG2 3.35Å; Y70-V74 PolarHBondContact O-N 3.42Å; Y70-C93 HydrophobicContact CD2-CB 4.43Å; Y70-C93 HydrophobicContact CE2-CB 3.98Å; Y70-V94 HydrophobicContact CE1-CG2 4.14Å; Y70-V94 HydrophobicContact CE2-CG2 4.27Å; Y70-V94 WeakPolarHBondContact OH-CG2 3.49Å; Y70-I97 HydrophobicContact CD2-CD1 4.43Å; Y70-I97 HydrophobicContact CG-CD1 4.44Å; Y70-L129 HydrophobicContact CD1-CD2 4.08Å; Y70-L129 HydrophobicContact CE1-CD2 3.73Å; Y70-L131 HydrophobicContact CD1-CD1 4.35Å; Y70-L131 HydrophobicContact CE1-CD1 3.81Å
71I92.9Very high84.9Confident21 Ų2151.3 Ų51.311%0.10827%0.274CS..Hα-helixtrans-59.1-52.7178.7-69.1164.4000110L67 T68 F73 V74 E75 K117 L129L67-I71 WeakPolarHBondContact O-CG1 3.4Å; L67-I71 PolarHBondContact O-N 3.27Å; T68-I71 PolarHBondContact O-N 2.75Å; I71-F73 PolarHBondContact O-N 3.47Å; I71-V74 PolarHBondContact O-N 2.94Å; I71-V74 VanDerWaalsContact O-N 3.16Å; I71-E75 HydrophobicContact CG2-CG 4.41Å; I71-E75 WeakPolarHBondContact O-CG 3.39Å; I71-E75 PolarHBondContact O-N 3.26Å; I71-K117 HydrophobicContact CD1-CB 4.19Å; I71-L129 HydrophobicContact CB-CD2 4.41Å; I71-L129 HydrophobicContact CG1-CD2 4.06Å; I71-L129 HydrophobicContact CG2-CD1 4.26Å
72A90.9Very high83.8Confident28 Ų2850.8 Ų50.823%0.23127%0.267CS..Hα-helixtrans-60.7-31.6178.600000112.7T68 K76T68-A72 WeakPolarHBondContact O-CB 3.39Å; T68-A72 PolarHBondContact O-N 3.11Å; A72-K76 WeakPolarHBondContact O-CB 3.43Å; A72-K76 VanDerWaalsContact O-CG 3.29Å; A72-K76 WeakPolarHBondContact O-CG 3.42Å; A72-K76 PolarHBondContact O-N 3.2Å
73F89.6Confident82.8Confident1 Ų155.8 Ų55.80%0.00429%0.289CS..Hα-helixtrans-67-52.6174.2168.1-101.7000111.3F13 F19 I23 D69 Y70 I71 E75 K76 S77 F89 T90F13-F73 HydrophobicContact CZ-CD2 4.46Å; F19-F73 HydrophobicContact CB-CB 3.95Å; F19-F73 HydrophobicContact CB-CD1 3.99Å; F19-F73 HydrophobicContact CB-CD2 4.07Å; F19-F73 HydrophobicContact CB-CG 3.68Å; I23-F73 HydrophobicContact CD1-CE1 4.24Å; I23-F73 HydrophobicContact CD1-CE2 3.41Å; I23-F73 VanDerWaalsContact CD1-CE2 3.41Å; I23-F73 HydrophobicContact CD1-CZ 3.19Å; I23-F73 HydrophobicContact CG1-CZ 4.49Å; D69-F73 VanDerWaalsContact O-CB 3.22Å; D69-F73 WeakPolarHBondContact O-CB 3.37Å; D69-F73 PolarHBondContact O-N 3.31Å; Y70-F73 WeakPolarHBondContact O-CB 3.46Å; Y70-F73 PolarHBondContact O-N 2.92Å; I71-F73 PolarHBondContact O-N 3.47Å; F73-E75 PolarHBondContact O-N 2.96Å; F73-K76 PolarHBondContact O-N 3.1Å; F73-S77 WeakPolarHBondContact O-CB 3.38Å; F73-S77 PolarHBondContact O-N 2.84Å; F73-S77 PolarHBondContact O-OG 2.98Å; F73-S77 VanDerWaalsContact O-OG 3.12Å; F73-F89 HydrophobicContact CD1-CE1 4.43Å; F73-F89 AromaticContact CE1-CD1 3.78Å; F73-F89 HydrophobicContact CE1-CD1 3.78Å; F73-F89 AromaticContact CE1-CE1 3.74Å; F73-F89 HydrophobicContact CE1-CE1 3.74Å; F73-F89 AromaticContact CZ-CD1 3.97Å; F73-F89 HydrophobicContact CZ-CD1 3.97Å; F73-F89 AromaticContact CZ-CE1 3.96Å; F73-F89 HydrophobicContact CZ-CE1 3.96Å; F73-T90 HydrophobicContact CE1-CG2 4.07Å
74V88.6Confident81.7Confident23 Ų2361.2 Ų61.214%0.13932%0.318CS..Hα-helixtrans-63.6-40.4-177.4175.30000111.8Y70 I71 K76 S77 T90 N128 L129Y70-V74 HydrophobicContact CD1-CG2 4.39Å; Y70-V74 HydrophobicContact CD2-CG2 4.35Å; Y70-V74 HydrophobicContact CE1-CG2 3.82Å; Y70-V74 HydrophobicContact CE2-CG2 3.8Å; Y70-V74 VanDerWaalsContact CZ-CG2 3.48Å; Y70-V74 WeakPolarHBondContact O-CG2 3.35Å; Y70-V74 PolarHBondContact O-N 3.42Å; I71-V74 PolarHBondContact O-N 2.94Å; I71-V74 VanDerWaalsContact O-N 3.16Å; V74-K76 VanDerWaalsContact C-N 3.27Å; V74-K76 PolarHBondContact O-N 3.4Å; V74-S77 PolarHBondContact O-OG 3.16Å; V74-T90 HydrophobicContact CG2-CG2 4.01Å; V74-N128 HydrophobicContact CG1-CB 4.11Å; V74-L129 HydrophobicContact CB-CD2 3.69Å; V74-L129 HydrophobicContact CB-CG 4.21Å; V74-L129 HydrophobicContact CG1-CD1 4.37Å; V74-L129 HydrophobicContact CG1-CD2 3.89Å; V74-L129 HydrophobicContact CG1-CG 3.9Å; V74-L129 HydrophobicContact CG2-CD2 3.9Å
75E87.2Confident80.8Confident118 Ų11859.4 Ų59.455%0.55131%0.307SS*.Hα-helixtrans-64.7-31.2178.3-69.4-179.3155.400112.7I71 F73 Y121 L129I71-E75 HydrophobicContact CG2-CG 4.41Å; I71-E75 WeakPolarHBondContact O-CG 3.39Å; I71-E75 PolarHBondContact O-N 3.26Å; F73-E75 PolarHBondContact O-N 2.96Å; E75-Y121 PolarHBondContact OE1-OH 2.86Å; E75-L129 HydrophobicContact CG-CD1 3.97Å
76K81.6Confident80.1Confident119 Ų11955.1 Ų55.152%0.51729%0.286SS..Hα-helixtrans-100.1-16.8-176.5-65.7177.9-178.1176.10114.2F13 A72 F73 V74 G78F13-K76 HydrophobicContact CD1-CD 4.38Å; F13-K76 HydrophobicContact CE1-CB 3.73Å; F13-K76 HydrophobicContact CE1-CD 3.95Å; F13-K76 HydrophobicContact CE1-CG 4.47Å; F13-K76 HydrophobicContact CZ-CB 3.99Å; A72-K76 WeakPolarHBondContact O-CB 3.43Å; A72-K76 VanDerWaalsContact O-CG 3.29Å; A72-K76 WeakPolarHBondContact O-CG 3.42Å; A72-K76 PolarHBondContact O-N 3.2Å; F73-K76 PolarHBondContact O-N 3.1Å; V74-K76 VanDerWaalsContact C-N 3.27Å; V74-K76 PolarHBondContact O-N 3.4Å; K76-G78 VanDerWaalsContact C-N 3.34Å; K76-G78 PolarHBondContact O-N 3.07Å
77S67.1Low79.4Confident6 Ų658.5 Ų58.54%0.04230%0.303CS..Hα-helixtrans-77.9-16.9-172.162.70000114F73 V74 H79 R80 N86F73-S77 WeakPolarHBondContact O-CB 3.38Å; F73-S77 PolarHBondContact O-N 2.84Å; F73-S77 PolarHBondContact O-OG 2.98Å; F73-S77 VanDerWaalsContact O-OG 3.12Å; V74-S77 PolarHBondContact O-OG 3.16Å; S77-H79 PolarHBondContact O-N 3.09Å; S77-R80 PolarHBondContact O-N 3.44Å; S77-N86 PolarHBondContact O-ND2 2.88Å
78G56.6Low78.7Confident55 Ų5561.7 Ų61.757%0.56732%0.318SS*.THydrogen-bonded Turntrans-59.2-5.4-17800000115.8K76K76-G78 VanDerWaalsContact C-N 3.34Å; K76-G78 PolarHBondContact O-N 3.07Å
79H52.4Low78.2Confident190 Ų19058.9 Ų58.988%0.8830%0.301SS*.THydrogen-bonded Turntrans-122.32.7-176.4-610.5000114.4S77S77-H79 PolarHBondContact O-N 3.09Å
80R62.2Low78Confident80 Ų8057.7 Ų57.730%0.30230%0.295SS..THydrogen-bonded Turntrans-112.8-33-169.6-87.9-174170.4-155.2-3.9117.1T11 S77T11-R80 PolarHBondContact O-NH2 2.88Å; T11-R80 PolarHBondContact OG1-NH2 3.39Å; S77-R80 PolarHBondContact O-N 3.44Å
81F66.7Low77.6Confident53 Ų5362.6 Ų62.623%0.23232%0.318CS..SBendtrans-126.8163.8-174.8-54.1-76.3000109.8I23 V27 L83 F85 N86I23-F81 HydrophobicContact CB-CZ 4.45Å; I23-F81 HydrophobicContact CD1-CD2 4.47Å; I23-F81 HydrophobicContact CD1-CE2 4.12Å; I23-F81 HydrophobicContact CG2-CD1 4.44Å; I23-F81 HydrophobicContact CG2-CD2 4.47Å; I23-F81 HydrophobicContact CG2-CE1 3.74Å; I23-F81 HydrophobicContact CG2-CE2 3.78Å; I23-F81 HydrophobicContact CG2-CZ 3.36Å; V27-F81 HydrophobicContact CG2-CE1 4.19Å; F81-L83 PolarHBondContact O-N 3.34Å; F81-F85 HydrophobicContact CB-CD1 4.08Å; F81-F85 HydrophobicContact CG-CD1 4.41Å; F81-N86 WeakPolarHBondContact CD2-OD1 3.43Å; F81-N86 PolarHBondContact O-ND2 2.93Å
82E72.1Confident77.2Confident112 Ų11262.1 Ų62.152%0.52332%0.315SS..  trans-54.3136.9171.8-69.1-179177.500110.1N84 F85 N86E82-N84 VanDerWaalsContact C-N 3.27Å; E82-N84 PolarHBondContact O-N 3.31Å; E82-F85 HydrophobicContact CB-CB 4.5Å; E82-F85 PolarHBondContact O-N 3.12Å; E82-N86 PolarHBondContact O-N 2.96Å; E82-N86 VanDerWaalsContact O-N 3.07Å
83L72.7Confident77.2Confident123 Ų12360.8 Ų60.864%0.64430%0.304SS*.Hα-helixtrans-54.1-44.7-174.3-177.467.8000111.8F81 N86 L87F81-L83 PolarHBondContact O-N 3.34Å; L83-N86 PolarHBondContact O-N 2.82Å; L83-L87 HydrophobicContact CG-CD1 4.29Å; L83-L87 WeakPolarHBondContact O-CG 3.25Å; L83-L87 PolarHBondContact O-N 2.83Å
84N74.1Confident77.2Confident114 Ų11461 Ų6161%0.6131%0.305SS*.Hα-helixtrans-63-45.5-178.4-65.8-8.3000112E82 N86 L87 E88E82-N84 VanDerWaalsContact C-N 3.27Å; E82-N84 PolarHBondContact O-N 3.31Å; N84-N86 VanDerWaalsContact C-N 3.34Å; N84-N86 PolarHBondContact O-N 2.72Å; N84-L87 PolarHBondContact O-N 2.79Å; N84-E88 WeakPolarHBondContact O-CG 3.25Å; N84-E88 PolarHBondContact O-N 2.92Å
85F77.2Confident77.1Confident10 Ų1060.2 Ų60.24%0.04430%0.301CS..Hα-helixtrans-62.4-41.5177.1176.2-97.1000112I23 I26 L35 Y43 F81 E82 L87 E88 F89I23-F85 HydrophobicContact CG2-CE1 4.13Å; I26-F85 HydrophobicContact CG2-CZ 4.47Å; L35-F85 HydrophobicContact CD2-CD2 4.02Å; L35-F85 HydrophobicContact CD2-CE2 3.78Å; L35-F85 HydrophobicContact CD2-CZ 4.41Å; Y43-F85 HydrophobicContact CD1-CE2 4.36Å; Y43-F85 HydrophobicContact CE1-CD2 4.22Å; Y43-F85 AromaticContact CE1-CE2 3.88Å; Y43-F85 HydrophobicContact CE1-CE2 3.88Å; Y43-F85 HydrophobicContact CE2-CE2 4.2Å; Y43-F85 AromaticContact CZ-CE2 3.8Å; F81-F85 HydrophobicContact CB-CD1 4.08Å; F81-F85 HydrophobicContact CG-CD1 4.41Å; E82-F85 HydrophobicContact CB-CB 4.5Å; E82-F85 PolarHBondContact O-N 3.12Å; F85-L87 VanDerWaalsContact C-N 3.34Å; F85-L87 PolarHBondContact O-N 3Å; F85-E88 PolarHBondContact O-N 3.25Å; F85-F89 VanDerWaalsContact O-CB 3.29Å; F85-F89 WeakPolarHBondContact O-CB 3.31Å; F85-F89 PolarHBondContact O-N 3.49Å
86N79.2Confident77.2Confident11 Ų1154.6 Ų54.66%0.05927%0.274CS..Hα-helixtrans-60.7-44.1176.4-88.8-27.8000111.7S77 F81 E82 L83 N84 F89 T90S77-N86 PolarHBondContact O-ND2 2.88Å; F81-N86 WeakPolarHBondContact CD2-OD1 3.43Å; F81-N86 PolarHBondContact O-ND2 2.93Å; E82-N86 PolarHBondContact O-N 2.96Å; E82-N86 VanDerWaalsContact O-N 3.07Å; L83-N86 PolarHBondContact O-N 2.82Å; N84-N86 VanDerWaalsContact C-N 3.34Å; N84-N86 PolarHBondContact O-N 2.72Å; N86-F89 PolarHBondContact O-N 3.19Å; N86-T90 WeakPolarHBondContact O-CB 3.23Å; N86-T90 VanDerWaalsContact O-CG2 3.27Å; N86-T90 WeakPolarHBondContact O-CG2 3.35Å; N86-T90 PolarHBondContact O-N 3.48Å; N86-T90 PolarHBondContact O-OG1 2.68Å
87L79.9Confident77.7Confident72 Ų7248.9 Ų48.938%0.37725%0.25SC..Hα-helixtrans-61.3-51.9177.9-69.2173.4000111.1L83 N84 F85 F89 T90 E91L83-L87 HydrophobicContact CG-CD1 4.29Å; L83-L87 WeakPolarHBondContact O-CG 3.25Å; L83-L87 PolarHBondContact O-N 2.83Å; N84-L87 PolarHBondContact O-N 2.79Å; F85-L87 VanDerWaalsContact C-N 3.34Å; F85-L87 PolarHBondContact O-N 3Å; L87-F89 PolarHBondContact O-N 2.92Å; L87-T90 WeakPolarHBondContact CA-OG1 3.46Å; L87-T90 PolarHBondContact O-N 3.47Å; L87-T90 PolarHBondContact O-OG1 2.65Å; L87-E91 WeakPolarHBondContact O-CB 3.38Å; L87-E91 PolarHBondContact O-N 3.35Å
88E81Confident78.9Confident69 Ų6948.6 Ų48.632%0.32225%0.248SC..Hα-helixtrans-57.5-46177.6-70.1177.6-178.500111.9Y43 N84 F85 T90 E91 I92Y43-E88 VanDerWaalsContact OH-CB 3.3Å; Y43-E88 WeakPolarHBondContact OH-CB 3.33Å; Y43-E88 PolarHBondContact OH-OE2 2.91Å; N84-E88 WeakPolarHBondContact O-CG 3.25Å; N84-E88 PolarHBondContact O-N 2.92Å; F85-E88 PolarHBondContact O-N 3.25Å; E88-T90 PolarHBondContact O-N 2.94Å; E88-E91 PolarHBondContact O-N 3.03Å; E88-I92 WeakPolarHBondContact O-CD1 3.27Å; E88-I92 WeakPolarHBondContact O-CG1 3.44Å; E88-I92 PolarHBondContact O-N 3.04Å
89F85.1Confident80.4Confident0 Ų048.9 Ų48.90%023%0.232CC..Hα-helixtrans-61.5-46.3177.9179.6-89.2000111.9F19 L22 I23 I26 I47 F73 F85 N86 L87 E91 I92 C93F19-F89 HydrophobicContact CB-CE1 4.35Å; F19-F89 HydrophobicContact CD1-CE1 4.26Å; F19-F89 HydrophobicContact CD1-CZ 4.42Å; L22-F89 HydrophobicContact CB-CZ 4.32Å; L22-F89 HydrophobicContact CD2-CE2 4.18Å; L22-F89 HydrophobicContact CD2-CZ 4.02Å; L22-F89 HydrophobicContact CG-CE2 4.23Å; L22-F89 HydrophobicContact CG-CZ 4.3Å; I23-F89 HydrophobicContact CD1-CD1 3.67Å; I23-F89 HydrophobicContact CD1-CD2 4.13Å; I23-F89 HydrophobicContact CD1-CE1 3.63Å; I23-F89 HydrophobicContact CD1-CE2 4.11Å; I23-F89 HydrophobicContact CD1-CG 3.93Å; I23-F89 HydrophobicContact CD1-CZ 3.87Å; I23-F89 HydrophobicContact CG1-CD1 4.03Å; I23-F89 HydrophobicContact CG1-CD2 3.68Å; I23-F89 HydrophobicContact CG1-CE1 3.71Å; I23-F89 HydrophobicContact CG1-CE2 3.35Å; I23-F89 HydrophobicContact CG1-CG 4.02Å; I23-F89 HydrophobicContact CG1-CZ 3.36Å; I26-F89 HydrophobicContact CD1-CD2 4.4Å; I26-F89 HydrophobicContact CD1-CE2 4.09Å; I47-F89 HydrophobicContact CD1-CD2 3.36Å; I47-F89 HydrophobicContact CD1-CE2 3.52Å; I47-F89 HydrophobicContact CD1-CG 4.43Å; I47-F89 HydrophobicContact CG1-CD2 4.3Å; I47-F89 HydrophobicContact CG1-CE2 3.96Å; F73-F89 HydrophobicContact CD1-CE1 4.43Å; F73-F89 AromaticContact CE1-CD1 3.78Å; F73-F89 HydrophobicContact CE1-CD1 3.78Å; F73-F89 AromaticContact CE1-CE1 3.74Å; F73-F89 HydrophobicContact CE1-CE1 3.74Å; F73-F89 AromaticContact CZ-CD1 3.97Å; F73-F89 HydrophobicContact CZ-CD1 3.97Å; F73-F89 AromaticContact CZ-CE1 3.96Å; F73-F89 HydrophobicContact CZ-CE1 3.96Å; F85-F89 VanDerWaalsContact O-CB 3.29Å; F85-F89 WeakPolarHBondContact O-CB 3.31Å; F85-F89 PolarHBondContact O-N 3.49Å; N86-F89 PolarHBondContact O-N 3.19Å; L87-F89 PolarHBondContact O-N 2.92Å; F89-E91 VanDerWaalsContact C-N 3.29Å; F89-E91 PolarHBondContact O-N 3.11Å; F89-I92 PolarHBondContact O-N 2.69Å; F89-C93 WeakPolarHBondContact CE1-SG 3.47Å; F89-C93 VanDerWaalsContact CZ-SG 3.54Å; F89-C93 PolarHBondContact O-N 2.92Å; F89-C93 VanDerWaalsContact O-N 3.08Å; F89-C93 PolarHBondContact O-SG 3.47Å
90T87.2Confident82.2Confident6 Ų640.5 Ų40.54%0.03719%0.193CC..Hα-helixtrans-63-38.5178.654.30000111.7F73 V74 N86 L87 E88 C93 V94F73-T90 HydrophobicContact CE1-CG2 4.07Å; V74-T90 HydrophobicContact CG2-CG2 4.01Å; N86-T90 WeakPolarHBondContact O-CB 3.23Å; N86-T90 VanDerWaalsContact O-CG2 3.27Å; N86-T90 WeakPolarHBondContact O-CG2 3.35Å; N86-T90 PolarHBondContact O-N 3.48Å; N86-T90 PolarHBondContact O-OG1 2.68Å; L87-T90 WeakPolarHBondContact CA-OG1 3.46Å; L87-T90 PolarHBondContact O-N 3.47Å; L87-T90 PolarHBondContact O-OG1 2.65Å; E88-T90 PolarHBondContact O-N 2.94Å; T90-C93 PolarHBondContact O-N 3.4Å; T90-V94 WeakPolarHBondContact O-CG2 3.29Å; T90-V94 PolarHBondContact O-N 3.23Å
91E85.3Confident83.6Confident104 Ų10436.7 Ų36.749%0.48618%0.178SC..Hα-helixtrans-61.8-49.8176.9-178.3169-171.100111.3L87 E88 F89 C93 V94 N95L87-E91 WeakPolarHBondContact O-CB 3.38Å; L87-E91 PolarHBondContact O-N 3.35Å; E88-E91 PolarHBondContact O-N 3.03Å; F89-E91 VanDerWaalsContact C-N 3.29Å; F89-E91 PolarHBondContact O-N 3.11Å; E91-C93 VanDerWaalsContact C-N 3.27Å; E91-C93 PolarHBondContact O-N 2.87Å; E91-V94 PolarHBondContact O-N 3Å; E91-N95 WeakPolarHBondContact CG-ND2 3.34Å; E91-N95 WeakPolarHBondContact O-CB 3.48Å; E91-N95 PolarHBondContact O-N 3.32Å; E91-N95 PolarHBondContact O-ND2 3.39Å
92I85.4Confident84.7Confident11 Ų1134.2 Ų34.26%0.05617%0.167CC..Hα-helixtrans-59.4-40.5177.6-62158.7000111Y43 E44 I47 E88 F89 T96Y43-I92 HydrophobicContact CD2-CD1 4.19Å; Y43-I92 HydrophobicContact CE2-CD1 3.63Å; E44-I92 HydrophobicContact CB-CD1 3.8Å; E44-I92 HydrophobicContact CB-CG1 4.41Å; E44-I92 HydrophobicContact CG-CD1 4.16Å; E44-I92 HydrophobicContact CG-CG1 4.22Å; E44-I92 HydrophobicContact CG-CG2 4.14Å; I47-I92 HydrophobicContact CB-CG2 3.88Å; I47-I92 HydrophobicContact CD1-CB 4.49Å; I47-I92 HydrophobicContact CD1-CD1 4.08Å; I47-I92 HydrophobicContact CD1-CG2 4.29Å; I47-I92 HydrophobicContact CG2-CB 4.32Å; I47-I92 HydrophobicContact CG2-CG2 3.53Å; E88-I92 WeakPolarHBondContact O-CD1 3.27Å; E88-I92 WeakPolarHBondContact O-CG1 3.44Å; E88-I92 PolarHBondContact O-N 3.04Å; F89-I92 PolarHBondContact O-N 2.69Å; I92-T96 WeakPolarHBondContact O-CB 3.5Å; I92-T96 PolarHBondContact O-N 3.31Å; I92-T96 PolarHBondContact O-OG1 3.07Å
93C89.7Confident85.3Confident0 Ų029.1 Ų29.10%014%0.144CC..Hα-helixtrans-63.9-50.8178.1-68.20000112F19 L51 Y70 F89 T90 E91 N95 T96 I97F19-C93 HydrophobicContact CD1-CB 4.32Å; F19-C93 HydrophobicContact CE1-CB 3.96Å; L51-C93 HydrophobicContact CD1-CB 4.12Å; Y70-C93 HydrophobicContact CD2-CB 4.43Å; Y70-C93 HydrophobicContact CE2-CB 3.98Å; F89-C93 WeakPolarHBondContact CE1-SG 3.47Å; F89-C93 VanDerWaalsContact CZ-SG 3.54Å; F89-C93 PolarHBondContact O-N 2.92Å; F89-C93 VanDerWaalsContact O-N 3.08Å; F89-C93 PolarHBondContact O-SG 3.47Å; T90-C93 PolarHBondContact O-N 3.4Å; E91-C93 VanDerWaalsContact C-N 3.27Å; E91-C93 PolarHBondContact O-N 2.87Å; C93-N95 VanDerWaalsContact C-N 3.34Å; C93-N95 PolarHBondContact O-N 2.71Å; C93-T96 PolarHBondContact O-N 2.8Å; C93-I97 VanDerWaalsContact O-CG1 3.3Å; C93-I97 WeakPolarHBondContact O-CG1 3.38Å; C93-I97 PolarHBondContact O-N 2.89Å
94V89.9Confident85.9Confident4 Ų429.3 Ų29.32%0.02414%0.137CC..Hα-helixtrans-61.5-45.5-179.9174.40000110.7Y70 T90 E91 T96 I97 L98 L131 R134Y70-V94 HydrophobicContact CE1-CG2 4.14Å; Y70-V94 HydrophobicContact CE2-CG2 4.27Å; Y70-V94 WeakPolarHBondContact OH-CG2 3.49Å; T90-V94 WeakPolarHBondContact O-CG2 3.29Å; T90-V94 PolarHBondContact O-N 3.23Å; E91-V94 PolarHBondContact O-N 3Å; V94-T96 VanDerWaalsContact C-N 3.29Å; V94-T96 PolarHBondContact O-N 3.35Å; V94-I97 PolarHBondContact O-N 3.28Å; V94-I97 VanDerWaalsContact O-N 3.14Å; V94-L98 HydrophobicContact CG1-CD1 3.66Å; V94-L98 HydrophobicContact CG1-CG 3.96Å; V94-L98 WeakPolarHBondContact O-CB 3.37Å; V94-L98 WeakPolarHBondContact O-CG 3.48Å; V94-L98 PolarHBondContact O-N 3.07Å; V94-L131 HydrophobicContact CG1-CB 4.35Å; V94-L131 HydrophobicContact CG1-CG 3.97Å; V94-L131 HydrophobicContact CG2-CG 4.15Å; V94-R134 HydrophobicContact CG1-CB 3.81Å; V94-R134 HydrophobicContact CG1-CG 3.81Å
95N87.1Confident86.5Confident7 Ų726.6 Ų26.64%0.03712%0.119CC..Hα-helixtrans-61.4-40.2179.7-71.6-41.7000111.9E91 C93 Y99 T135 T137E91-N95 WeakPolarHBondContact CG-ND2 3.34Å; E91-N95 WeakPolarHBondContact O-CB 3.48Å; E91-N95 PolarHBondContact O-N 3.32Å; E91-N95 PolarHBondContact O-ND2 3.39Å; C93-N95 VanDerWaalsContact C-N 3.34Å; C93-N95 PolarHBondContact O-N 2.71Å; N95-Y99 VanDerWaalsContact O-CB 3.22Å; N95-Y99 WeakPolarHBondContact O-CB 3.29Å; N95-Y99 PolarHBondContact O-N 3Å; N95-T135 PolarHBondContact OD1-O 2.83Å; N95-T137 WeakPolarHBondContact CB-OG1 3.42Å; N95-T137 PolarHBondContact ND2-OG1 3.39Å; N95-T137 PolarHBondContact OD1-N 2.96Å
96T89.1Confident86.8Confident0 Ų027 Ų270%013%0.127CC..Hα-helixtrans-65-44.9174.6-53.30000111.5Y48 L51 L55 I92 C93 V94 W100Y48-T96 HydrophobicContact CD2-CG2 3.67Å; Y48-T96 HydrophobicContact CE2-CG2 4.04Å; L51-T96 HydrophobicContact CB-CG2 3.69Å; L51-T96 HydrophobicContact CD1-CG2 4.39Å; L55-T96 HydrophobicContact CD1-CG2 4.05Å; I92-T96 WeakPolarHBondContact O-CB 3.5Å; I92-T96 PolarHBondContact O-N 3.31Å; I92-T96 PolarHBondContact O-OG1 3.07Å; C93-T96 PolarHBondContact O-N 2.8Å; V94-T96 VanDerWaalsContact C-N 3.29Å; V94-T96 PolarHBondContact O-N 3.35Å; T96-W100 VanDerWaalsContact O-CD1 3.26Å; T96-W100 PolarHBondContact O-N 3.09Å; T96-W100 VanDerWaalsContact O-N 3.11Å
97I92.3Very high87.3Confident0 Ų029.1 Ų29.10%014%0.138CC..Hα-helixtrans-60.8-53.2178.3-68.8164.5000110.4F19 L55 F63 L66 L67 Y70 C93 V94 Y99 W100 V101 L114 L131F19-I97 HydrophobicContact CZ-CD1 4.21Å; L55-I97 HydrophobicContact CD1-CG1 4.3Å; F63-I97 HydrophobicContact CE2-CG2 4.17Å; F63-I97 HydrophobicContact CZ-CG2 4.24Å; L66-I97 HydrophobicContact CD2-CD1 4.03Å; L66-I97 HydrophobicContact CD2-CG1 4.2Å; L67-I97 HydrophobicContact CD2-CG2 4.49Å; Y70-I97 HydrophobicContact CD2-CD1 4.43Å; Y70-I97 HydrophobicContact CG-CD1 4.44Å; C93-I97 VanDerWaalsContact O-CG1 3.3Å; C93-I97 WeakPolarHBondContact O-CG1 3.38Å; C93-I97 PolarHBondContact O-N 2.89Å; V94-I97 PolarHBondContact O-N 3.28Å; V94-I97 VanDerWaalsContact O-N 3.14Å; I97-Y99 PolarHBondContact O-N 3.25Å; I97-W100 PolarHBondContact O-N 2.86Å; I97-V101 HydrophobicContact CG2-CG2 4.21Å; I97-V101 WeakPolarHBondContact O-CB 3.41Å; I97-V101 VanDerWaalsContact O-CG2 3.26Å; I97-V101 WeakPolarHBondContact O-CG2 3.46Å; I97-V101 PolarHBondContact O-N 3.14Å; I97-L114 HydrophobicContact CG2-CD1 4.18Å; I97-L131 HydrophobicContact CG2-CD2 4.31Å
98L91.8Very high88Confident0 Ų027.4 Ų27.40%013%0.131CC..Hα-helixtrans-59.3-47.3-178.8-69.8178.3000111.5V94 W100 V101 F102 L114 L131 R134 F136 P150V94-L98 HydrophobicContact CG1-CD1 3.66Å; V94-L98 HydrophobicContact CG1-CG 3.96Å; V94-L98 WeakPolarHBondContact O-CB 3.37Å; V94-L98 WeakPolarHBondContact O-CG 3.48Å; V94-L98 PolarHBondContact O-N 3.07Å; L98-W100 VanDerWaalsContact C-N 3.29Å; L98-W100 PolarHBondContact O-N 3.29Å; L98-V101 PolarHBondContact O-N 3.45Å; L98-F102 HydrophobicContact CD2-CD2 4.14Å; L98-F102 HydrophobicContact CD2-CE2 3.88Å; L98-F102 PolarHBondContact O-N 2.9Å; L98-L114 HydrophobicContact CD2-CD1 4.19Å; L98-L131 WeakPolarHBondContact CD1-O 3.31Å; L98-L131 HydrophobicContact CD2-CB 4.35Å; L98-R134 HydrophobicContact CD1-CB 3.91Å; L98-F136 HydrophobicContact CB-CD1 4.2Å; L98-F136 HydrophobicContact CB-CE1 3.8Å; L98-F136 HydrophobicContact CB-CZ 4.48Å; L98-P150 HydrophobicContact CD1-CG 4.16Å; L98-P150 HydrophobicContact CD2-CG 4Å
99Y88Confident88.8Confident60 Ų6028 Ų2824%0.23514%0.136CC..Iπ-helixtrans-57.7-44178.9178.3-102000111.6N95 I97 A103 R104 L145N95-Y99 VanDerWaalsContact O-CB 3.22Å; N95-Y99 WeakPolarHBondContact O-CB 3.29Å; N95-Y99 PolarHBondContact O-N 3Å; I97-Y99 PolarHBondContact O-N 3.25Å; Y99-A103 HydrophobicContact CD2-CB 3.83Å; Y99-A103 HydrophobicContact CE2-CB 3.87Å; Y99-A103 WeakPolarHBondContact O-CA 3.21Å; Y99-A103 VanDerWaalsContact O-CB 3.27Å; Y99-A103 WeakPolarHBondContact O-CB 3.33Å; Y99-A103 PolarHBondContact O-N 3.06Å; Y99-R104 HydrophobicContact CD1-CG 3.89Å; Y99-R104 HydrophobicContact CE1-CG 3.39Å; Y99-R104 PolarHBondContact O-N 3.12Å; Y99-R104 VanDerWaalsContact O-N 3.12Å; Y99-L145 HydrophobicContact CD2-CD1 4.26Å; Y99-L145 HydrophobicContact CE2-CD1 3.97Å
100W89.5Confident89.3Confident14 Ų1428.5 Ų28.55%0.05314%0.139CC..Iπ-helixtrans-70.3-39.6179.4-86.592.4000113.2A52 L55 R56 T96 I97 L98 R104 K105A52-W100 HydrophobicContact CB-CZ2 3.82Å; A52-W100 VanDerWaalsContact CB-NE1 3.32Å; L55-W100 HydrophobicContact CB-CB 3.89Å; L55-W100 HydrophobicContact CB-CD2 4.04Å; L55-W100 HydrophobicContact CB-CE3 4.46Å; L55-W100 HydrophobicContact CB-CG 3.76Å; L55-W100 HydrophobicContact CD1-CB 3.91Å; L55-W100 HydrophobicContact CD1-CG 3.98Å; L55-W100 HydrophobicContact CG-CB 4.37Å; L55-W100 HydrophobicContact CG-CG 4.49Å; R56-W100 HydrophobicContact CB-CH2 3.77Å; R56-W100 HydrophobicContact CB-CZ2 4.49Å; R56-W100 HydrophobicContact CB-CZ3 3.84Å; R56-W100 HydrophobicContact CG-CH2 4.04Å; R56-W100 HydrophobicContact CG-CZ3 4.14Å; T96-W100 VanDerWaalsContact O-CD1 3.26Å; T96-W100 PolarHBondContact O-N 3.09Å; T96-W100 VanDerWaalsContact O-N 3.11Å; I97-W100 PolarHBondContact O-N 2.86Å; L98-W100 VanDerWaalsContact C-N 3.29Å; L98-W100 PolarHBondContact O-N 3.29Å; W100-R104 HydrophobicContact CD2-CB 4.08Å; W100-R104 HydrophobicContact CD2-CG 4.12Å; W100-R104 HydrophobicContact CE3-CB 3.57Å; W100-R104 HydrophobicContact CE3-CG 4.03Å; W100-R104 HydrophobicContact CZ3-CB 3.91Å; W100-R104 HydrophobicContact CZ3-CG 4.28Å; W100-K105 WeakPolarHBondContact O-CB 3.5Å; W100-K105 PolarHBondContact O-N 3.16Å
101V92.1Very high89.8Confident1 Ų128.2 Ų28.21%0.00614%0.137CC..Iπ-helixtrans-67.9-54.1-179.8171.30000110.9F63 I97 L98 G106 F110 V111 L114F63-V101 HydrophobicContact CE1-CG2 4.14Å; F63-V101 HydrophobicContact CE2-CG2 3.93Å; F63-V101 HydrophobicContact CZ-CG2 3.44Å; F63-V101 VanDerWaalsContact CZ-CG2 3.44Å; I97-V101 HydrophobicContact CG2-CG2 4.21Å; I97-V101 WeakPolarHBondContact O-CB 3.41Å; I97-V101 VanDerWaalsContact O-CG2 3.26Å; I97-V101 WeakPolarHBondContact O-CG2 3.46Å; I97-V101 PolarHBondContact O-N 3.14Å; L98-V101 PolarHBondContact O-N 3.45Å; V101-G106 PolarHBondContact O-N 2.81Å; V101-F110 HydrophobicContact CG1-CB 4.24Å; V101-V111 HydrophobicContact CG1-CG2 3.75Å; V101-L114 HydrophobicContact CG1-CD1 4.49Å; V101-L114 HydrophobicContact CG2-CD1 4.38Å
102F89.9Confident90.4Very high0 Ų027.1 Ų27.10%013%0.132CC..Iπ-helixtrans-85.9-43.1-172.3-73.9-88.7000113.4L98 V111 I132 F136 P150 Y153 V154 I162 L166L98-F102 HydrophobicContact CD2-CD2 4.14Å; L98-F102 HydrophobicContact CD2-CE2 3.88Å; L98-F102 PolarHBondContact O-N 2.9Å; F102-V111 HydrophobicContact CD1-CG2 4.18Å; F102-V111 HydrophobicContact CE1-CG1 3.85Å; F102-V111 HydrophobicContact CE1-CG2 3.84Å; F102-V111 HydrophobicContact CZ-CB 4.48Å; F102-V111 HydrophobicContact CZ-CG1 3.73Å; F102-V111 HydrophobicContact CZ-CG2 4.03Å; F102-I132 HydrophobicContact CZ-CD1 3.92Å; F102-F136 HydrophobicContact CB-CE1 4.3Å; F102-F136 HydrophobicContact CB-CZ 3.83Å; F102-F136 HydrophobicContact CD2-CZ 4.45Å; F102-F136 HydrophobicContact CG-CZ 4.26Å; F102-P150 HydrophobicContact CD1-CB 4.22Å; F102-P150 HydrophobicContact CD2-CB 4.17Å; F102-P150 HydrophobicContact CD2-CG 4.48Å; F102-P150 HydrophobicContact CE1-CB 3.85Å; F102-P150 HydrophobicContact CE2-CB 3.81Å; F102-P150 HydrophobicContact CE2-CG 4.18Å; F102-P150 HydrophobicContact CG-CB 4.37Å; F102-P150 HydrophobicContact CZ-CB 3.64Å; F102-P150 HydrophobicContact CZ-CG 4.44Å; F102-Y153 HydrophobicContact CB-CD1 4.01Å; F102-Y153 HydrophobicContact CB-CE1 4.13Å; F102-Y153 WeakPolarHBondContact O-CE1 3.42Å; F102-V154 HydrophobicContact CD1-CG2 3.65Å; F102-V154 HydrophobicContact CE1-CG2 3.93Å; F102-I162 HydrophobicContact CD1-CG2 4.24Å; F102-I162 HydrophobicContact CE1-CG2 3.97Å; F102-L166 HydrophobicContact CE1-CD1 4.43Å; F102-L166 HydrophobicContact CE1-CD2 4.22Å; F102-L166 HydrophobicContact CZ-CD2 4.31Å
103A84.3Confident90.9Very high5 Ų527.9 Ų27.94%0.04114%0.136CC..Iπ-helixtrans-97.1-28.9-170.300000114.6Y99 Y153Y99-A103 HydrophobicContact CD2-CB 3.83Å; Y99-A103 HydrophobicContact CE2-CB 3.87Å; Y99-A103 WeakPolarHBondContact O-CA 3.21Å; Y99-A103 VanDerWaalsContact O-CB 3.27Å; Y99-A103 WeakPolarHBondContact O-CB 3.33Å; Y99-A103 PolarHBondContact O-N 3.06Å; A103-Y153 VanDerWaalsContact CA-OH 3.28Å; A103-Y153 WeakPolarHBondContact CA-OH 3.31Å; A103-Y153 HydrophobicContact CB-CE1 4.07Å; A103-Y153 HydrophobicContact CB-CE2 4.25Å; A103-Y153 VanDerWaalsContact CB-OH 3.29Å; A103-Y153 WeakPolarHBondContact CB-OH 3.42Å
104R85.1Confident91.3Very high127 Ų12727.9 Ų27.948%0.47914%0.136SC..Iπ-helixtrans-100.2-46.9-178.8-63.9-66.8-62.7156.51113.8Y99 W100Y99-R104 HydrophobicContact CD1-CG 3.89Å; Y99-R104 HydrophobicContact CE1-CG 3.39Å; Y99-R104 PolarHBondContact O-N 3.12Å; Y99-R104 VanDerWaalsContact O-N 3.12Å; W100-R104 HydrophobicContact CD2-CB 4.08Å; W100-R104 HydrophobicContact CD2-CG 4.12Å; W100-R104 HydrophobicContact CE3-CB 3.57Å; W100-R104 HydrophobicContact CE3-CG 4.03Å; W100-R104 HydrophobicContact CZ3-CB 3.91Å; W100-R104 HydrophobicContact CZ3-CG 4.28Å
105K86.7Confident91.6Very high57 Ų5727.7 Ų27.725%0.24814%0.135CC..Iπ-helixtrans-82.9-48.4177.9-76.5-176.6176.2-90.60111.2L55 V58 W100 N107 F110L55-K105 WeakPolarHBondContact O-CE 3.46Å; V58-K105 PolarHBondContact O-NZ 3.34Å; W100-K105 WeakPolarHBondContact O-CB 3.5Å; W100-K105 PolarHBondContact O-N 3.16Å; K105-N107 PolarHBondContact O-N 3.4Å; K105-N107 VanDerWaalsContact O-N 3.12Å; K105-F110 HydrophobicContact CD-CD1 3.92Å; K105-F110 HydrophobicContact CD-CD2 4.31Å; K105-F110 HydrophobicContact CD-CE1 3.86Å; K105-F110 HydrophobicContact CD-CE2 4.24Å; K105-F110 HydrophobicContact CD-CG 4.16Å; K105-F110 HydrophobicContact CD-CZ 4.03Å
106G83.6Confident92Very high19 Ų1933 Ų3320%0.19616%0.158CC..  trans57.925.5-178.500000113.1V101 I162V101-G106 PolarHBondContact O-N 2.81Å; G106-I162 WeakPolarHBondContact O-CD1 3.01Å
107N90.9Very high92.3Very high55 Ų5536 Ų3629%0.29417%0.17SC..  trans-94.3123.9-177.8-179.2-39.8000109.4K105 D109 F110 V111K105-N107 PolarHBondContact O-N 3.4Å; K105-N107 VanDerWaalsContact O-N 3.12Å; N107-D109 VanDerWaalsContact C-N 3.31Å; N107-D109 PolarHBondContact O-N 3.47Å; N107-D109 WeakPolarHBondContact OD1-CB 3.22Å; N107-D109 PolarHBondContact OD1-N 3.23Å; N107-D109 PolarHBondContact OD1-OD2 3.18Å; N107-F110 HydrophobicContact CB-CD2 3.84Å; N107-F110 PolarHBondContact O-N 2.8Å; N107-V111 PolarHBondContact O-N 2.79Å
108P94.5Very high92.4Very high36 Ų3636 Ų3623%0.23417%0.17CC..Hα-helixtrans-52.4-40.9177.9-26.534.7000114.7F110 V111 E112 N161 I162 I165P108-F110 VanDerWaalsContact C-N 3.32Å; P108-F110 PolarHBondContact O-N 3.47Å; P108-V111 WeakPolarHBondContact O-CB 3.47Å; P108-V111 PolarHBondContact O-N 2.81Å; P108-E112 PolarHBondContact O-N 2.93Å; P108-N161 HydrophobicContact CG-CB 3.97Å; P108-I162 HydrophobicContact CB-CG1 4.41Å; P108-I162 HydrophobicContact CG-CG1 4.17Å; P108-I165 HydrophobicContact CB-CD1 3.46Å; P108-I165 VanDerWaalsContact CB-CD1 3.46Å; P108-I165 WeakPolarHBondContact O-CD1 3.39Å
109D96.6Very high92.4Very high81 Ų8138.8 Ų38.843%0.43318%0.183SC..Hα-helixtrans-64.5-37.2-175.2-54.3-30.2000111.7L60 N107 V111 L113L60-D109 HydrophobicContact CD1-CB 3.82Å; L60-D109 HydrophobicContact CD2-CB 3.82Å; L60-D109 HydrophobicContact CG-CB 4.43Å; N107-D109 VanDerWaalsContact C-N 3.31Å; N107-D109 PolarHBondContact O-N 3.47Å; N107-D109 WeakPolarHBondContact OD1-CB 3.22Å; N107-D109 PolarHBondContact OD1-N 3.23Å; N107-D109 PolarHBondContact OD1-OD2 3.18Å; D109-V111 VanDerWaalsContact C-N 3.35Å; D109-L113 WeakPolarHBondContact O-CB 3.39Å; D109-L113 PolarHBondContact O-N 2.79Å
110F96.8Very high92.6Very high12 Ų1240.9 Ų40.95%0.05320%0.198CC..Hα-helixtrans-67.7-37175.5-79.1-100.7000111.4V58 L60 F63 V101 K105 N107 P108 L114V58-F110 HydrophobicContact CG1-CE1 4.13Å; L60-F110 HydrophobicContact CD2-CD1 4.27Å; L60-F110 HydrophobicContact CD2-CD2 3.57Å; L60-F110 HydrophobicContact CD2-CE1 4.32Å; L60-F110 HydrophobicContact CD2-CE2 3.65Å; L60-F110 HydrophobicContact CD2-CG 3.89Å; L60-F110 HydrophobicContact CD2-CZ 4.03Å; L60-F110 HydrophobicContact CG-CD2 4.38Å; L60-F110 HydrophobicContact CG-CE2 3.99Å; L60-F110 HydrophobicContact CG-CZ 4.28Å; F63-F110 HydrophobicContact CB-CD1 4.02Å; F63-F110 HydrophobicContact CB-CE1 3.71Å; F63-F110 HydrophobicContact CD1-CB 4.47Å; F63-F110 AromaticContact CD1-CD1 3.46Å; F63-F110 HydrophobicContact CD1-CD1 3.46Å; F63-F110 VanDerWaalsContact CD1-CD1 3.46Å; F63-F110 HydrophobicContact CD1-CE1 4.08Å; F63-F110 HydrophobicContact CD1-CG 4.32Å; F63-F110 HydrophobicContact CD2-CD1 4.35Å; F63-F110 HydrophobicContact CE1-CB 4.38Å; F63-F110 AromaticContact CE1-CD1 3.99Å; F63-F110 HydrophobicContact CE1-CD1 3.99Å; F63-F110 WeakPolarHBondContact CE1-O 3.47Å; F63-F110 AromaticContact CG-CD1 3.68Å; F63-F110 HydrophobicContact CG-CD1 3.68Å; F63-F110 AromaticContact CG-CE1 3.88Å; F63-F110 HydrophobicContact CG-CE1 3.88Å; V101-F110 HydrophobicContact CG1-CB 4.24Å; K105-F110 HydrophobicContact CD-CD1 3.92Å; K105-F110 HydrophobicContact CD-CD2 4.31Å; K105-F110 HydrophobicContact CD-CE1 3.86Å; K105-F110 HydrophobicContact CD-CE2 4.24Å; K105-F110 HydrophobicContact CD-CG 4.16Å; K105-F110 HydrophobicContact CD-CZ 4.03Å; N107-F110 HydrophobicContact CB-CD2 3.84Å; N107-F110 PolarHBondContact O-N 2.8Å; P108-F110 VanDerWaalsContact C-N 3.32Å; P108-F110 PolarHBondContact O-N 3.47Å; F110-L114 WeakPolarHBondContact O-CB 3.45Å; F110-L114 PolarHBondContact O-N 2.94Å
111V96.9Very high92.7Very high0 Ų042.8 Ų42.80%021%0.205CC..Hα-helixtrans-69-45.1177.2177.30000110.5V101 F102 N107 P108 D109 L113 L114 L115 I162 I165 L166V101-V111 HydrophobicContact CG1-CG2 3.75Å; F102-V111 HydrophobicContact CD1-CG2 4.18Å; F102-V111 HydrophobicContact CE1-CG1 3.85Å; F102-V111 HydrophobicContact CE1-CG2 3.84Å; F102-V111 HydrophobicContact CZ-CB 4.48Å; F102-V111 HydrophobicContact CZ-CG1 3.73Å; F102-V111 HydrophobicContact CZ-CG2 4.03Å; N107-V111 PolarHBondContact O-N 2.79Å; P108-V111 WeakPolarHBondContact O-CB 3.47Å; P108-V111 PolarHBondContact O-N 2.81Å; D109-V111 VanDerWaalsContact C-N 3.35Å; V111-L113 VanDerWaalsContact C-N 3.34Å; V111-L113 PolarHBondContact O-N 2.94Å; V111-L114 PolarHBondContact O-N 3.09Å; V111-L115 HydrophobicContact CG1-CD1 4.18Å; V111-L115 WeakPolarHBondContact O-CG 3.46Å; V111-L115 PolarHBondContact O-N 3.33Å; V111-I162 HydrophobicContact CB-CG2 4.42Å; V111-I162 HydrophobicContact CG1-CG2 4.12Å; V111-I162 HydrophobicContact CG2-CD1 4.15Å; V111-I162 HydrophobicContact CG2-CG1 4.19Å; V111-I162 HydrophobicContact CG2-CG2 3.97Å; V111-I165 HydrophobicContact CG1-CG2 4.33Å; V111-L166 HydrophobicContact CG1-CD2 3.82Å
112E97.4Very high92.5Very high80 Ų8043.1 Ų43.137%0.37421%0.207SC..Hα-helixtrans-59.6-45.8176.2-176.3174.4-166.200111.2P108 L114 L115 K116 I165 Y169P108-E112 PolarHBondContact O-N 2.93Å; E112-L114 VanDerWaalsContact C-N 3.34Å; E112-L114 PolarHBondContact O-N 3.03Å; E112-L115 PolarHBondContact O-N 3.04Å; E112-K116 VanDerWaalsContact O-CB 3.31Å; E112-K116 WeakPolarHBondContact O-CB 3.36Å; E112-K116 PolarHBondContact O-N 3.42Å; E112-I165 HydrophobicContact CB-CD1 4.29Å; E112-I165 HydrophobicContact CB-CG2 4.12Å; E112-Y169 HydrophobicContact CG-CE2 4.25Å
113L97.6Very high92.3Very high27 Ų2747.7 Ų47.714%0.14123%0.229CC..Hα-helixtrans-62.4-41.8178.5-173.956.4000112.2L60 F63 D64 D109 V111 K116 K117L60-L113 HydrophobicContact CD2-CD2 4.36Å; L60-L113 WeakPolarHBondContact O-CD2 3.4Å; F63-L113 HydrophobicContact CD1-CD2 4.04Å; F63-L113 HydrophobicContact CD1-CG 4.49Å; D64-L113 HydrophobicContact CB-CD2 4.03Å; D64-L113 WeakPolarHBondContact OD1-CD1 3.34Å; D109-L113 WeakPolarHBondContact O-CB 3.39Å; D109-L113 PolarHBondContact O-N 2.79Å; V111-L113 VanDerWaalsContact C-N 3.34Å; V111-L113 PolarHBondContact O-N 2.94Å; L113-K116 PolarHBondContact O-N 3.34Å; L113-K117 HydrophobicContact CD1-CG 4.44Å; L113-K117 WeakPolarHBondContact O-CG 3.43Å; L113-K117 PolarHBondContact O-N 3.45Å
114L97.2Very high92.4Very high0 Ų051.2 Ų51.20%025%0.247CC..Hα-helixtrans-57.2-52.2174.2-178.7150.2000110.7F63 L67 I97 L98 V101 F110 V111 E112 K116 K117 T118 L131F63-L114 HydrophobicContact CE1-CB 4.27Å; F63-L114 HydrophobicContact CZ-CB 4.49Å; F63-L114 HydrophobicContact CZ-CD1 4.39Å; L67-L114 HydrophobicContact CD1-CB 4.3Å; I97-L114 HydrophobicContact CG2-CD1 4.18Å; L98-L114 HydrophobicContact CD2-CD1 4.19Å; V101-L114 HydrophobicContact CG1-CD1 4.49Å; V101-L114 HydrophobicContact CG2-CD1 4.38Å; F110-L114 WeakPolarHBondContact O-CB 3.45Å; F110-L114 PolarHBondContact O-N 2.94Å; V111-L114 PolarHBondContact O-N 3.09Å; E112-L114 VanDerWaalsContact C-N 3.34Å; E112-L114 PolarHBondContact O-N 3.03Å; L114-K116 PolarHBondContact O-N 3.03Å; L114-K117 PolarHBondContact O-N 2.94Å; L114-T118 WeakPolarHBondContact O-CG2 3.45Å; L114-T118 PolarHBondContact O-N 3.36Å; L114-T118 PolarHBondContact O-OG1 3.19Å; L114-L131 HydrophobicContact CD1-CD2 4.21Å; L114-L131 HydrophobicContact CD2-CB 4.41Å
115L96.5Very high92.5Very high0 Ų049.8 Ų49.80%024%0.241CC..Hα-helixtrans-62.8-42.8-179.8-72.2172.6000112.2V111 E112 K117 T118 K119 I132 I165 L166 Y169 I171V111-L115 HydrophobicContact CG1-CD1 4.18Å; V111-L115 WeakPolarHBondContact O-CG 3.46Å; V111-L115 PolarHBondContact O-N 3.33Å; E112-L115 PolarHBondContact O-N 3.04Å; L115-K117 VanDerWaalsContact C-N 3.29Å; L115-K117 PolarHBondContact O-N 2.94Å; L115-T118 PolarHBondContact O-N 3.36Å; L115-K119 WeakPolarHBondContact O-CA 3.34Å; L115-K119 WeakPolarHBondContact O-CB 3.35Å; L115-K119 PolarHBondContact O-N 3.37Å; L115-I132 HydrophobicContact CD2-CB 4.08Å; L115-I132 HydrophobicContact CD2-CD1 3.96Å; L115-I132 HydrophobicContact CD2-CG1 3.91Å; L115-I165 HydrophobicContact CD1-CG2 3.85Å; L115-L166 HydrophobicContact CD1-CD2 3.8Å; L115-Y169 HydrophobicContact CB-CD1 3.74Å; L115-Y169 HydrophobicContact CB-CD2 4.12Å; L115-Y169 HydrophobicContact CB-CE1 3.65Å; L115-Y169 HydrophobicContact CB-CE2 4.04Å; L115-Y169 HydrophobicContact CB-CG 3.97Å; L115-Y169 HydrophobicContact CD1-CD1 4.37Å; L115-Y169 HydrophobicContact CD1-CD2 3.62Å; L115-Y169 HydrophobicContact CD1-CE2 4.14Å; L115-Y169 HydrophobicContact CD1-CG 3.74Å; L115-Y169 HydrophobicContact CG-CG 4.37Å; L115-I171 HydrophobicContact CD2-CD1 4.28Å
116K95.9Very high92.4Very high120 Ų12051.2 Ų51.252%0.52226%0.259SS..Hα-helixtrans-56.9-43.1177-176.5179178.3-179.70111.9E112 L113 L114E112-K116 VanDerWaalsContact O-CB 3.31Å; E112-K116 WeakPolarHBondContact O-CB 3.36Å; E112-K116 PolarHBondContact O-N 3.42Å; L113-K116 PolarHBondContact O-N 3.34Å; L114-K116 PolarHBondContact O-N 3.03Å
117K95.5Very high92.5Very high61 Ų6151.8 Ų51.827%0.26526%0.26SS..Hα-helixtrans-74.1-31.5179.5-75-73.2-175.7163.30113.3D64 L67 T68 I71 L113 L114 L115D64-K117 WeakPolarHBondContact OD1-CE 3.47Å; D64-K117 IonicContact OD1-NZ 2.81Å; D64-K117 PolarHBondContact OD1-NZ 2.87Å; D64-K117 WeakPolarHBondContact OD2-CE 3.5Å; D64-K117 IonicContact OD2-NZ 3.27Å; D64-K117 PolarHBondContact OD2-NZ 3.27Å; L67-K117 HydrophobicContact CB-CB 4.47Å; L67-K117 HydrophobicContact CB-CG 4.34Å; L67-K117 HydrophobicContact CD1-CB 4.16Å; L67-K117 HydrophobicContact CD1-CG 4.1Å; T68-K117 PolarHBondContact OG1-NZ 3.02Å; I71-K117 HydrophobicContact CD1-CB 4.19Å; L113-K117 HydrophobicContact CD1-CG 4.44Å; L113-K117 WeakPolarHBondContact O-CG 3.43Å; L113-K117 PolarHBondContact O-N 3.45Å; L114-K117 PolarHBondContact O-N 2.94Å; L115-K117 VanDerWaalsContact C-N 3.29Å; L115-K117 PolarHBondContact O-N 2.94Å
118T94.1Very high92.2Very high0 Ų051.2 Ų51.20%026%0.257CS..Hα-helixtrans-103.21.4-174.165.70000113.7L114 L115 D120 Y121 L129 L131L114-T118 WeakPolarHBondContact O-CG2 3.45Å; L114-T118 PolarHBondContact O-N 3.36Å; L114-T118 PolarHBondContact O-OG1 3.19Å; L115-T118 PolarHBondContact O-N 3.36Å; T118-D120 PolarHBondContact O-N 3.18Å; T118-D120 VanDerWaalsContact O-N 3.13Å; T118-Y121 PolarHBondContact O-N 3.31Å; T118-L129 WeakPolarHBondContact CB-O 2.65Å; T118-L131 HydrophobicContact CG2-CD1 3.82Å
119K92Very high92Very high60 Ų6049.8 Ų49.826%0.26125%0.247SC..G310 helixtrans-53.9-37.7-171.469.7176-171.31600113.1L115 Y121 V122 N272L115-K119 WeakPolarHBondContact O-CA 3.34Å; L115-K119 WeakPolarHBondContact O-CB 3.35Å; L115-K119 PolarHBondContact O-N 3.37Å; K119-Y121 PolarHBondContact O-N 3.1Å; K119-V122 WeakPolarHBondContact O-CB 3.41Å; K119-V122 PolarHBondContact O-N 3.06Å; K119-N272 PolarHBondContact O-ND2 3.39Å; K119-N272 PolarHBondContact O-OD1 2.77Å
120D91.4Very high91.7Very high104 Ų10446 Ų4656%0.55623%0.226SC*.G310 helixtrans-71.2-16.2-173.5-63.1-36.3000112.4T118 N272T118-D120 PolarHBondContact O-N 3.18Å; T118-D120 VanDerWaalsContact O-N 3.13Å; D120-N272 WeakPolarHBondContact CA-ND2 3.39Å; D120-N272 PolarHBondContact OD1-ND2 3.47Å; D120-N272 VanDerWaalsContact OD1-ND2 3.15Å
121Y91.2Very high91.4Very high53 Ų5345.4 Ų45.421%0.20822%0.224CC..G310 helixtrans-98.6-10.1178.4-47.6-75.4000112.9E75 T118 K119 Q123 D124 L129 A130E75-Y121 PolarHBondContact OE1-OH 2.86Å; T118-Y121 PolarHBondContact O-N 3.31Å; K119-Y121 PolarHBondContact O-N 3.1Å; Y121-Q123 PolarHBondContact O-N 2.69Å; Y121-Q123 VanDerWaalsContact O-N 3.14Å; Y121-D124 PolarHBondContact O-N 2.84Å; Y121-D124 VanDerWaalsContact O-N 3.14Å; Y121-L129 HydrophobicContact CD1-CB 3.73Å; Y121-L129 HydrophobicContact CD1-CD1 3.9Å; Y121-L129 HydrophobicContact CD1-CG 4.44Å; Y121-L129 HydrophobicContact CD2-CB 3.49Å; Y121-L129 VanDerWaalsContact CD2-CB 3.49Å; Y121-L129 HydrophobicContact CD2-CD1 4.28Å; Y121-L129 HydrophobicContact CD2-CG 4.48Å; Y121-L129 HydrophobicContact CE1-CB 4.11Å; Y121-L129 HydrophobicContact CE1-CD1 3.41Å; Y121-L129 VanDerWaalsContact CE1-CD1 3.41Å; Y121-L129 HydrophobicContact CE1-CG 4.38Å; Y121-L129 HydrophobicContact CE2-CB 3.9Å; Y121-L129 HydrophobicContact CE2-CD1 3.85Å; Y121-L129 HydrophobicContact CE2-CG 4.44Å; Y121-L129 HydrophobicContact CG-CB 3.4Å; Y121-L129 HydrophobicContact CG-CD1 4.3Å; Y121-L129 HydrophobicContact CG-CG 4.48Å; Y121-A130 VanDerWaalsContact O-CB 3.25Å; Y121-A130 WeakPolarHBondContact O-CB 3.4Å
122V87.8Confident91.2Very high8 Ų845.4 Ų45.45%0.04822%0.224CC..THydrogen-bonded Turntrans-63.3-23.8-173176.10000113K119 D124 I132 W133 I171K119-V122 WeakPolarHBondContact O-CB 3.41Å; K119-V122 PolarHBondContact O-N 3.06Å; V122-D124 VanDerWaalsContact C-N 3.35Å; V122-I132 HydrophobicContact CG1-CG2 4.32Å; V122-I132 HydrophobicContact CG2-CG2 4.12Å; V122-W133 HydrophobicContact CG1-CZ2 3.83Å; V122-W133 PolarHBondContact O-NE1 3.2Å; V122-I171 HydrophobicContact CG1-CD1 3.98Å
123Q85.7Confident90.9Very high97 Ų9742.6 Ų42.645%0.45321%0.21SC..THydrogen-bonded Turntrans-65.9-37.7177.3-65-71.7-0.100112.2Y121 L269Y121-Q123 PolarHBondContact O-N 2.69Å; Y121-Q123 VanDerWaalsContact O-N 3.14Å; Q123-L269 PolarHBondContact NE2-O 2.9Å; Q123-L269 VanDerWaalsContact NE2-O 3.15Å
124D87.6Confident90.5Very high79 Ų7944.8 Ų44.842%0.42222%0.216SC..  trans-98.898.6-180178.610.2000110.5Y121 V122 S126 C127 A130Y121-D124 PolarHBondContact O-N 2.84Å; Y121-D124 VanDerWaalsContact O-N 3.14Å; V122-D124 VanDerWaalsContact C-N 3.35Å; D124-S126 PolarHBondContact O-N 3.31Å; D124-S126 VanDerWaalsContact O-N 3.13Å; D124-S126 WeakPolarHBondContact OD1-CA 3.43Å; D124-S126 WeakPolarHBondContact OD1-CB 3.31Å; D124-S126 PolarHBondContact OD1-N 3.1Å; D124-S126 PolarHBondContact OD1-OG 3.04Å; D124-S126 PolarHBondContact OD2-OG 3.01Å; D124-C127 HydrophobicContact CB-CB 4.01Å; D124-C127 VanDerWaalsContact O-CB 3.26Å; D124-C127 WeakPolarHBondContact O-CB 3.5Å; D124-C127 PolarHBondContact O-N 3.33Å; D124-C127 PolarHBondContact OD1-N 2.87Å; D124-A130 VanDerWaalsContact O-CB 3.27Å; D124-A130 WeakPolarHBondContact O-CB 3.43Å
125R86.9Confident90Very high96 Ų9647.3 Ų47.336%0.36223%0.232SC..THydrogen-bonded Turntrans-60.9-20.6177.5-63.2-171.7173.9-143-0.5113.4W133 R174 E175R125-W133 HydrophobicContact CB-CB 4.39Å; R125-W133 HydrophobicContact CB-CG 4.19Å; R125-W133 HydrophobicContact CG-CB 4.47Å; R125-W133 HydrophobicContact CG-CD2 3.98Å; R125-W133 HydrophobicContact CG-CG 3.82Å; R125-R174 PolarHBondContact NH2-O 2.86Å; R125-E175 IonicContact CZ-OE2 3.78Å; R125-E175 IonicContact NH1-OE2 3.44Å; R125-E175 PolarHBondContact NH1-OE2 3.29Å; R125-E175 IonicContact NH2-OE2 3.09Å; R125-E175 PolarHBondContact NH2-OE2 3.12Å; R125-E175 VanDerWaalsContact NH2-OE2 3.09Å
126S84.2Confident89.3Confident88 Ų8847.5 Ų47.562%0.61523%0.233SC*.THydrogen-bonded Turntrans-84.9-16.3178.676.80000113.1D124 N128 R134D124-S126 PolarHBondContact O-N 3.31Å; D124-S126 VanDerWaalsContact O-N 3.13Å; D124-S126 WeakPolarHBondContact OD1-CA 3.43Å; D124-S126 WeakPolarHBondContact OD1-CB 3.31Å; D124-S126 PolarHBondContact OD1-N 3.1Å; D124-S126 PolarHBondContact OD1-OG 3.04Å; D124-S126 PolarHBondContact OD2-OG 3.01Å; S126-N128 PolarHBondContact O-N 3.28Å; S126-R134 PolarHBondContact O-NH2 3.5Å
127C86.8Confident88Confident31 Ų3143.9 Ų43.921%0.20922%0.22CC..SBendtrans-65.2133.5179.5-174.90000111.2D124 L129 A130 R134D124-C127 HydrophobicContact CB-CB 4.01Å; D124-C127 VanDerWaalsContact O-CB 3.26Å; D124-C127 WeakPolarHBondContact O-CB 3.5Å; D124-C127 PolarHBondContact O-N 3.33Å; D124-C127 PolarHBondContact OD1-N 2.87Å; C127-L129 PolarHBondContact O-N 2.94Å; C127-L129 PolarHBondContact SG-N 3.28Å; C127-A130 HydrophobicContact CB-CB 4.14Å; C127-A130 WeakPolarHBondContact O-CB 3.33Å; C127-A130 PolarHBondContact O-N 3.16Å; C127-A130 VanDerWaalsContact O-N 3.09Å; C127-R134 PolarHBondContact O-NH2 3.31Å
128N82.9Confident86.2Confident43 Ų4342.6 Ų42.623%0.2322%0.218CC..THydrogen-bonded Turntrans-66-20.7177.9-69.5-20.8000112.8V74 S126 R134V74-N128 HydrophobicContact CG1-CB 4.11Å; S126-N128 PolarHBondContact O-N 3.28Å; N128-R134 VanDerWaalsContact CA-NH2 3.32Å; N128-R134 PolarHBondContact OD1-NH2 2.78Å
129L90.3Very high84.2Confident6 Ų643.9 Ų43.93%0.03123%0.226CC..THydrogen-bonded Turntrans-86.8-6.2175.8-62.9177.2000113.4Y70 I71 V74 E75 T118 Y121 C127 L131Y70-L129 HydrophobicContact CD1-CD2 4.08Å; Y70-L129 HydrophobicContact CE1-CD2 3.73Å; I71-L129 HydrophobicContact CB-CD2 4.41Å; I71-L129 HydrophobicContact CG1-CD2 4.06Å; I71-L129 HydrophobicContact CG2-CD1 4.26Å; V74-L129 HydrophobicContact CB-CD2 3.69Å; V74-L129 HydrophobicContact CB-CG 4.21Å; V74-L129 HydrophobicContact CG1-CD1 4.37Å; V74-L129 HydrophobicContact CG1-CD2 3.89Å; V74-L129 HydrophobicContact CG1-CG 3.9Å; V74-L129 HydrophobicContact CG2-CD2 3.9Å; E75-L129 HydrophobicContact CG-CD1 3.97Å; T118-L129 WeakPolarHBondContact CB-O 2.65Å; Y121-L129 HydrophobicContact CD1-CB 3.73Å; Y121-L129 HydrophobicContact CD1-CD1 3.9Å; Y121-L129 HydrophobicContact CD1-CG 4.44Å; Y121-L129 HydrophobicContact CD2-CB 3.49Å; Y121-L129 VanDerWaalsContact CD2-CB 3.49Å; Y121-L129 HydrophobicContact CD2-CD1 4.28Å; Y121-L129 HydrophobicContact CD2-CG 4.48Å; Y121-L129 HydrophobicContact CE1-CB 4.11Å; Y121-L129 HydrophobicContact CE1-CD1 3.41Å; Y121-L129 VanDerWaalsContact CE1-CD1 3.41Å; Y121-L129 HydrophobicContact CE1-CG 4.38Å; Y121-L129 HydrophobicContact CE2-CB 3.9Å; Y121-L129 HydrophobicContact CE2-CD1 3.85Å; Y121-L129 HydrophobicContact CE2-CG 4.44Å; Y121-L129 HydrophobicContact CG-CB 3.4Å; Y121-L129 HydrophobicContact CG-CD1 4.3Å; Y121-L129 HydrophobicContact CG-CG 4.48Å; C127-L129 PolarHBondContact O-N 2.94Å; C127-L129 PolarHBondContact SG-N 3.28Å; L129-L131 VanDerWaalsContact C-CD1 3.49Å; L129-L131 WeakPolarHBondContact O-CD1 3.38Å; L129-L131 PolarHBondContact O-N 2.97Å
130A90.3Very high82.3Confident0 Ų047.6 Ų47.60%024%0.239CC..  trans-84.661173.800000110.7Y121 D124 C127 I132 W133Y121-A130 VanDerWaalsContact O-CB 3.25Å; Y121-A130 WeakPolarHBondContact O-CB 3.4Å; D124-A130 VanDerWaalsContact O-CB 3.27Å; D124-A130 WeakPolarHBondContact O-CB 3.43Å; C127-A130 HydrophobicContact CB-CB 4.14Å; C127-A130 WeakPolarHBondContact O-CB 3.33Å; C127-A130 PolarHBondContact O-N 3.16Å; C127-A130 VanDerWaalsContact O-N 3.09Å; A130-I132 PolarHBondContact O-N 3.19Å; A130-I132 VanDerWaalsContact O-N 3.1Å; A130-W133 PolarHBondContact O-N 3.39Å
131L91.8Very high80Confident0 Ų048.4 Ų48.40%025%0.252CS..G310 helixtrans-52.6-38-170.9-80.169.5000112.6L67 Y70 V94 I97 L98 L114 T118 L129 W133 R134L67-L131 HydrophobicContact CD2-CD2 4.48Å; Y70-L131 HydrophobicContact CD1-CD1 4.35Å; Y70-L131 HydrophobicContact CE1-CD1 3.81Å; V94-L131 HydrophobicContact CG1-CB 4.35Å; V94-L131 HydrophobicContact CG1-CG 3.97Å; V94-L131 HydrophobicContact CG2-CG 4.15Å; I97-L131 HydrophobicContact CG2-CD2 4.31Å; L98-L131 WeakPolarHBondContact CD1-O 3.31Å; L98-L131 HydrophobicContact CD2-CB 4.35Å; L114-L131 HydrophobicContact CD1-CD2 4.21Å; L114-L131 HydrophobicContact CD2-CB 4.41Å; T118-L131 HydrophobicContact CG2-CD1 3.82Å; L129-L131 VanDerWaalsContact C-CD1 3.49Å; L129-L131 WeakPolarHBondContact O-CD1 3.38Å; L129-L131 PolarHBondContact O-N 2.97Å; L131-W133 PolarHBondContact O-N 2.83Å; L131-W133 VanDerWaalsContact O-N 3.1Å; L131-R134 WeakPolarHBondContact O-CB 3.49Å; L131-R134 PolarHBondContact O-N 3.24Å
132I92.1Very high78.1Confident1 Ų151.9 Ų51.91%0.00528%0.281CS..G310 helixtrans-61-21.8-176.9-164.164.5000113.9F102 L115 V122 A130 P150 L166 I171F102-I132 HydrophobicContact CZ-CD1 3.92Å; L115-I132 HydrophobicContact CD2-CB 4.08Å; L115-I132 HydrophobicContact CD2-CD1 3.96Å; L115-I132 HydrophobicContact CD2-CG1 3.91Å; V122-I132 HydrophobicContact CG1-CG2 4.32Å; V122-I132 HydrophobicContact CG2-CG2 4.12Å; A130-I132 PolarHBondContact O-N 3.19Å; A130-I132 VanDerWaalsContact O-N 3.1Å; I132-P150 HydrophobicContact CD1-CB 3.65Å; I132-P150 HydrophobicContact CD1-CG 4.09Å; I132-P150 WeakPolarHBondContact O-CD 3.17Å; I132-L166 HydrophobicContact CD1-CD2 3.81Å; I132-I171 HydrophobicContact CG1-CD1 4.04Å; I132-I171 HydrophobicContact CG1-CG1 4.22Å; I132-I171 HydrophobicContact CG1-CG2 4.18Å; I132-I171 HydrophobicContact CG2-CD1 4.07Å
133W91.4Very high76.5Confident21 Ų2153.3 Ų53.38%0.0829%0.292CS..G310 helixtrans-91-10.2178.1-59.2124.9000113.8V122 R125 A130 L131 I171 R174V122-W133 HydrophobicContact CG1-CZ2 3.83Å; V122-W133 PolarHBondContact O-NE1 3.2Å; R125-W133 HydrophobicContact CB-CB 4.39Å; R125-W133 HydrophobicContact CB-CG 4.19Å; R125-W133 HydrophobicContact CG-CB 4.47Å; R125-W133 HydrophobicContact CG-CD2 3.98Å; R125-W133 HydrophobicContact CG-CG 3.82Å; A130-W133 PolarHBondContact O-N 3.39Å; L131-W133 PolarHBondContact O-N 2.83Å; L131-W133 VanDerWaalsContact O-N 3.1Å; W133-I171 HydrophobicContact CH2-CG2 3.76Å; W133-I171 HydrophobicContact CZ2-CD1 4.42Å; W133-I171 HydrophobicContact CZ3-CG2 3.98Å; W133-R174 HydrophobicContact CH2-CB 3.67Å; W133-R174 HydrophobicContact CZ2-CB 3.9Å; W133-R174 HydrophobicContact CZ2-CG 4.46Å
134R89.8Confident75.2Confident73 Ų7353 Ų5328%0.27530%0.298SS..PPolyproline II helixtrans-75139.2179.3-58.6-61.7174.5161.1-8.2109.7V94 L98 S126 C127 N128 L131 P150V94-R134 HydrophobicContact CG1-CB 3.81Å; V94-R134 HydrophobicContact CG1-CG 3.81Å; L98-R134 HydrophobicContact CD1-CB 3.91Å; S126-R134 PolarHBondContact O-NH2 3.5Å; C127-R134 PolarHBondContact O-NH2 3.31Å; N128-R134 VanDerWaalsContact CA-NH2 3.32Å; N128-R134 PolarHBondContact OD1-NH2 2.78Å; L131-R134 WeakPolarHBondContact O-CB 3.49Å; L131-R134 PolarHBondContact O-N 3.24Å; R134-P150 WeakPolarHBondContact O-CD 3.35Å
135T86.2Confident74.1Confident53 Ų5349.4 Ų49.433%0.32528%0.279SS..PPolyproline II helixtrans-81.6146.2175.848.90000109.5N95 T137 G147 I148 T149N95-T135 PolarHBondContact OD1-O 2.83Å; T135-T137 PolarHBondContact O-N 3.25Å; T135-G147 VanDerWaalsContact CG2-C 3.48Å; T135-G147 VanDerWaalsContact CG2-O 3.3Å; T135-G147 WeakPolarHBondContact CG2-O 3.2Å; T135-I148 CarbonylContact C-O 3.58Å; T135-I148 WeakPolarHBondContact CA-O 3.23Å; T135-T149 HydrophobicContact CG2-CG2 4.1Å
136F80.8Confident73.3Confident4 Ų448.2 Ų48.22%0.01829%0.285CS..BIsolated β-bridgetrans-59.5127.4166.8-61.4-83.6000108.3L98 F102 L145 S146 G147 I148 P150 Y153L98-F136 HydrophobicContact CB-CD1 4.2Å; L98-F136 HydrophobicContact CB-CE1 3.8Å; L98-F136 HydrophobicContact CB-CZ 4.48Å; F102-F136 HydrophobicContact CB-CE1 4.3Å; F102-F136 HydrophobicContact CB-CZ 3.83Å; F102-F136 HydrophobicContact CD2-CZ 4.45Å; F102-F136 HydrophobicContact CG-CZ 4.26Å; F136-L145 HydrophobicContact CB-CB 4.29Å; F136-L145 WeakPolarHBondContact CB-O 3.29Å; F136-S146 CarbonylContact O-C 3.53Å; F136-S146 WeakPolarHBondContact O-CA 3.4Å; F136-G147 PolarHBondContact O-N 3.15Å; F136-I148 HydrophobicContact CD2-CB 4.41Å; F136-I148 WeakPolarHBondContact CD2-O 3.32Å; F136-I148 PolarHBondContact N-O 3.08Å; F136-P150 HydrophobicContact CE2-CG 4.48Å; F136-P150 HydrophobicContact CZ-CG 4.46Å; F136-Y153 VanDerWaalsContact CE2-CB 3.45Å; F136-Y153 HydrophobicContact CE2-CD1 4.38Å; F136-Y153 HydrophobicContact CE2-CD2 4.34Å; F136-Y153 AromaticContact CE2-CG 3.8Å; F136-Y153 HydrophobicContact CE2-CG 3.8Å; F136-Y153 HydrophobicContact CZ-CD1 4.26Å; F136-Y153 HydrophobicContact CZ-CG 4.11Å
137T69.1Low73Confident43 Ų4346.4 Ų46.426%0.26428%0.28SS..  trans-105.2142.2164.165.40000109.5N95 T135 V139N95-T137 WeakPolarHBondContact CB-OG1 3.42Å; N95-T137 PolarHBondContact ND2-OG1 3.39Å; N95-T137 PolarHBondContact OD1-N 2.96Å; T135-T137 PolarHBondContact O-N 3.25Å; T137-V139 PolarHBondContact O-N 3.42Å
138P57Low73Confident34 Ų3445.6 Ų45.622%0.22127%0.274CS..  trans-62.2124.9173.916.9-24.7000110.4Y140 S146P138-Y140 VanDerWaalsContact CB-O 3.23Å; P138-Y140 WeakPolarHBondContact CB-O 3.46Å; P138-S146 VanDerWaalsContact CD-OG 3.23Å; P138-S146 WeakPolarHBondContact CD-OG 3.42Å
139V53.8Low73.4Confident27 Ų2745 Ų4516%0.16427%0.271CS..SBendtrans-72.5-20.6158.6-178.90000110.7Y48 T137Y48-V139 HydrophobicContact CD1-CG1 3.76Å; Y48-V139 HydrophobicContact CD2-CB 4.14Å; Y48-V139 HydrophobicContact CD2-CG1 3.68Å; Y48-V139 HydrophobicContact CD2-CG2 3.58Å; Y48-V139 HydrophobicContact CE1-CG1 4.16Å; Y48-V139 HydrophobicContact CE2-CB 4.24Å; Y48-V139 HydrophobicContact CE2-CG1 4.1Å; Y48-V139 HydrophobicContact CE2-CG2 3.78Å; Y48-V139 HydrophobicContact CG-CB 4.42Å; Y48-V139 HydrophobicContact CG-CG1 3.48Å; Y48-V139 VanDerWaalsContact CG-CG1 3.48Å; Y48-V139 HydrophobicContact CG-CG2 4.25Å; T137-V139 PolarHBondContact O-N 3.42Å
140Y50.7Low73.6Confident138 Ų13844.7 Ų44.754%0.54127%0.27SS..SBendtrans-135.5122.9176.5-57.4-73.5000109.6Y48 P138 P142 S143Y48-Y140 HydrophobicContact CD1-CE2 4.39Å; Y48-Y140 AromaticContact CE1-CE2 3.86Å; Y48-Y140 HydrophobicContact CE1-CE2 3.86Å; P138-Y140 VanDerWaalsContact CB-O 3.23Å; P138-Y140 WeakPolarHBondContact CB-O 3.46Å; Y140-P142 CarbonylContact O-C 3.49Å; Y140-S143 PolarHBondContact O-N 3.22Å
141C44.3Very low73.8Confident122 Ų12244.7 Ų44.782%0.82427%0.27SS*.SBendtrans-88.6135.1176.4-157.10000109.9
142P50.4Low73.9Confident126 Ų12646.8 Ų46.882%0.81828%0.281SS*.SBendcis-87134.4-4.332.6-30.3000112.3Y140Y140-P142 CarbonylContact O-C 3.49Å
143S55.6Low73.9Confident38 Ų3846.9 Ų46.927%0.26628%0.281SS..  trans-111.1133.4165.8-173.30000110Y140 L145 S146Y140-S143 PolarHBondContact O-N 3.22Å; S143-L145 PolarHBondContact O-N 3.45Å; S143-L145 VanDerWaalsContact O-N 3.09Å; S143-L145 PolarHBondContact OG-N 3.01Å; S143-S146 PolarHBondContact O-N 3.36Å
144P57.9Low73.9Confident90 Ų9045.9 Ų45.958%0.58428%0.278SS*.THydrogen-bonded Turntrans-66.9-6.5174.229.5-35.6000113.2
145L64.1Low74.1Confident4 Ų442.4 Ų42.42%0.02126%0.264CS..THydrogen-bonded Turntrans-92.2-6.3-176.2-56.3-179.5000113.9Y99 F136 S143 G147 I148 Y153 I194Y99-L145 HydrophobicContact CD2-CD1 4.26Å; Y99-L145 HydrophobicContact CE2-CD1 3.97Å; F136-L145 HydrophobicContact CB-CB 4.29Å; F136-L145 WeakPolarHBondContact CB-O 3.29Å; S143-L145 PolarHBondContact O-N 3.45Å; S143-L145 VanDerWaalsContact O-N 3.09Å; S143-L145 PolarHBondContact OG-N 3.01Å; L145-G147 PolarHBondContact O-N 2.82Å; L145-I148 WeakPolarHBondContact O-CB 3.46Å; L145-I148 WeakPolarHBondContact O-CG1 3.3Å; L145-I148 PolarHBondContact O-N 3.41Å; L145-Y153 HydrophobicContact CD1-CE2 4.22Å; L145-Y153 HydrophobicContact CD2-CD2 3.81Å; L145-Y153 HydrophobicContact CD2-CE2 3.67Å; L145-I194 HydrophobicContact CD1-CD1 4.42Å
146S69.9Low74.3Confident70 Ų7040.6 Ų40.649%0.4925%0.252SS..THydrogen-bonded Turntrans-59.5130.5-175.1-165.40000112.5F136 P138 S143 I148F136-S146 CarbonylContact O-C 3.53Å; F136-S146 WeakPolarHBondContact O-CA 3.4Å; P138-S146 VanDerWaalsContact CD-OG 3.23Å; P138-S146 WeakPolarHBondContact CD-OG 3.42Å; S143-S146 PolarHBondContact O-N 3.36Å; S146-I148 VanDerWaalsContact C-N 3.34Å; S146-I148 PolarHBondContact O-N 3.01Å
147G78.2Confident74.7Confident50 Ų5040.7 Ų40.752%0.51525%0.253SS..THydrogen-bonded Turntrans81.88.2173.100000115T135 F136 L145T135-G147 VanDerWaalsContact CG2-C 3.48Å; T135-G147 VanDerWaalsContact CG2-O 3.3Å; T135-G147 WeakPolarHBondContact CG2-O 3.2Å; F136-G147 PolarHBondContact O-N 3.15Å; L145-G147 PolarHBondContact O-N 2.82Å
148I86.1Confident75.8Confident15 Ų1538.9 Ų38.98%0.07724%0.241CC..BIsolated β-bridgetrans-98.9134.2-177-56.8176.8000109.1T135 F136 L145 S146 L152T135-I148 CarbonylContact C-O 3.58Å; T135-I148 WeakPolarHBondContact CA-O 3.23Å; F136-I148 HydrophobicContact CD2-CB 4.41Å; F136-I148 WeakPolarHBondContact CD2-O 3.32Å; F136-I148 PolarHBondContact N-O 3.08Å; L145-I148 WeakPolarHBondContact O-CB 3.46Å; L145-I148 WeakPolarHBondContact O-CG1 3.3Å; L145-I148 PolarHBondContact O-N 3.41Å; S146-I148 VanDerWaalsContact C-N 3.34Å; S146-I148 PolarHBondContact O-N 3.01Å; I148-L152 HydrophobicContact CG2-CB 3.71Å; I148-L152 HydrophobicContact CG2-CD2 3.89Å; I148-L152 HydrophobicContact CG2-CG 3.79Å
149T91.8Very high77.4Confident29 Ų2938.1 Ų38.118%0.17824%0.235CC..  trans-77.6158.4173.661.60000111.1T135 L151 L152 Y153T135-T149 HydrophobicContact CG2-CG2 4.1Å; T149-L151 VanDerWaalsContact C-N 3.27Å; T149-L151 PolarHBondContact O-N 3.25Å; T149-L152 PolarHBondContact O-N 2.87Å; T149-L152 WeakPolarHBondContact OG1-CB 2.91Å; T149-L152 PolarHBondContact OG1-N 3.04Å; T149-Y153 PolarHBondContact O-N 3.41Å
150P93.9Very high79.2Confident0 Ų037.4 Ų37.40%023%0.231CC..Hα-helixtrans-49.4-43.3172.1-32.735000114.3L98 F102 I132 R134 F136 Y153 V154L98-P150 HydrophobicContact CD1-CG 4.16Å; L98-P150 HydrophobicContact CD2-CG 4Å; F102-P150 HydrophobicContact CD1-CB 4.22Å; F102-P150 HydrophobicContact CD2-CB 4.17Å; F102-P150 HydrophobicContact CD2-CG 4.48Å; F102-P150 HydrophobicContact CE1-CB 3.85Å; F102-P150 HydrophobicContact CE2-CB 3.81Å; F102-P150 HydrophobicContact CE2-CG 4.18Å; F102-P150 HydrophobicContact CG-CB 4.37Å; F102-P150 HydrophobicContact CZ-CB 3.64Å; F102-P150 HydrophobicContact CZ-CG 4.44Å; I132-P150 HydrophobicContact CD1-CB 3.65Å; I132-P150 HydrophobicContact CD1-CG 4.09Å; I132-P150 WeakPolarHBondContact O-CD 3.17Å; R134-P150 WeakPolarHBondContact O-CD 3.35Å; F136-P150 HydrophobicContact CE2-CG 4.48Å; F136-P150 HydrophobicContact CZ-CG 4.46Å; P150-Y153 PolarHBondContact O-N 2.95Å; P150-V154 WeakPolarHBondContact O-CB 3.48Å; P150-V154 VanDerWaalsContact O-CG2 3.26Å; P150-V154 WeakPolarHBondContact O-CG2 3.19Å; P150-V154 PolarHBondContact O-N 2.83Å
151L95.6Very high81.3Confident1 Ų136.2 Ų36.21%0.00523%0.234CC..Hα-helixtrans-62-45.3176.6178.260.6000111.8T149 V154 A155 L163 L166 I171 L172 E175 I181T149-L151 VanDerWaalsContact C-N 3.27Å; T149-L151 PolarHBondContact O-N 3.25Å; L151-V154 PolarHBondContact O-N 3.46Å; L151-A155 WeakPolarHBondContact O-CB 3.27Å; L151-A155 PolarHBondContact O-N 3.09Å; L151-L163 HydrophobicContact CD1-CD1 3.69Å; L151-L166 HydrophobicContact CB-CD1 4.12Å; L151-L166 HydrophobicContact CD1-CB 4.27Å; L151-L166 HydrophobicContact CD1-CD1 3.77Å; L151-I171 HydrophobicContact CB-CG2 4.24Å; L151-I171 HydrophobicContact CD2-CG2 4Å; L151-L172 HydrophobicContact CD2-CB 4.41Å; L151-L172 HydrophobicContact CD2-CD1 4.27Å; L151-E175 HydrophobicContact CD2-CG 3.65Å; L151-I181 HydrophobicContact CD1-CG2 4.46Å; L151-I181 HydrophobicContact CD2-CD1 4.02Å; L151-I181 HydrophobicContact CD2-CG1 3.95Å; L151-I181 HydrophobicContact CG-CD1 3.87Å; L151-I181 HydrophobicContact CG-CG1 4.17Å
152L93.3Very high83.7Confident44 Ų4430.5 Ų30.523%0.2320%0.195CC..Hα-helixtrans-67-38.2179.2-172.564000111.5I148 T149 A155 Q156 I181 T184I148-L152 HydrophobicContact CG2-CB 3.71Å; I148-L152 HydrophobicContact CG2-CD2 3.89Å; I148-L152 HydrophobicContact CG2-CG 3.79Å; T149-L152 PolarHBondContact O-N 2.87Å; T149-L152 WeakPolarHBondContact OG1-CB 2.91Å; T149-L152 PolarHBondContact OG1-N 3.04Å; L152-A155 WeakPolarHBondContact O-CB 3.29Å; L152-A155 PolarHBondContact O-N 3.33Å; L152-Q156 VanDerWaalsContact O-CG 3.26Å; L152-Q156 WeakPolarHBondContact O-CG 3.39Å; L152-Q156 PolarHBondContact O-N 3.03Å; L152-I181 HydrophobicContact CB-CD1 4.45Å; L152-I181 HydrophobicContact CD1-CD1 3.98Å; L152-T184 HydrophobicContact CD1-CG2 3.84Å; L152-T184 VanDerWaalsContact CD1-OG1 3.29Å; L152-T184 WeakPolarHBondContact CD1-OG1 3.47Å
153Y91.4Very high86Confident3 Ų324.5 Ų24.51%0.01216%0.156CC..Hα-helixtrans-62.6-45174.6175.6-97000112.3F102 A103 F136 L145 T149 P150 A155 Q156 T157F102-Y153 HydrophobicContact CB-CD1 4.01Å; F102-Y153 HydrophobicContact CB-CE1 4.13Å; F102-Y153 WeakPolarHBondContact O-CE1 3.42Å; A103-Y153 VanDerWaalsContact CA-OH 3.28Å; A103-Y153 WeakPolarHBondContact CA-OH 3.31Å; A103-Y153 HydrophobicContact CB-CE1 4.07Å; A103-Y153 HydrophobicContact CB-CE2 4.25Å; A103-Y153 VanDerWaalsContact CB-OH 3.29Å; A103-Y153 WeakPolarHBondContact CB-OH 3.42Å; F136-Y153 VanDerWaalsContact CE2-CB 3.45Å; F136-Y153 HydrophobicContact CE2-CD1 4.38Å; F136-Y153 HydrophobicContact CE2-CD2 4.34Å; F136-Y153 AromaticContact CE2-CG 3.8Å; F136-Y153 HydrophobicContact CE2-CG 3.8Å; F136-Y153 HydrophobicContact CZ-CD1 4.26Å; F136-Y153 HydrophobicContact CZ-CG 4.11Å; L145-Y153 HydrophobicContact CD1-CE2 4.22Å; L145-Y153 HydrophobicContact CD2-CD2 3.81Å; L145-Y153 HydrophobicContact CD2-CE2 3.67Å; T149-Y153 PolarHBondContact O-N 3.41Å; P150-Y153 PolarHBondContact O-N 2.95Å; Y153-A155 VanDerWaalsContact C-N 3.26Å; Y153-A155 PolarHBondContact O-N 2.87Å; Y153-Q156 WeakPolarHBondContact O-CB 3.26Å; Y153-Q156 PolarHBondContact O-N 3.48Å; Y153-T157 HydrophobicContact CD2-CG2 4.34Å; Y153-T157 HydrophobicContact CE1-CG2 4.08Å; Y153-T157 HydrophobicContact CE2-CG2 3.83Å; Y153-T157 WeakPolarHBondContact O-CB 3.28Å; Y153-T157 PolarHBondContact O-N 3.46Å; Y153-T157 PolarHBondContact O-OG1 2.99Å
154V93Very high88Confident0 Ų025 Ų250%015%0.154CC..Hα-helixtrans-62.4-36.2176.1166.30000111F102 P150 L151 T157 R158 Q159 I162 L163 L166F102-V154 HydrophobicContact CD1-CG2 3.65Å; F102-V154 HydrophobicContact CE1-CG2 3.93Å; P150-V154 WeakPolarHBondContact O-CB 3.48Å; P150-V154 VanDerWaalsContact O-CG2 3.26Å; P150-V154 WeakPolarHBondContact O-CG2 3.19Å; P150-V154 PolarHBondContact O-N 2.83Å; L151-V154 PolarHBondContact O-N 3.46Å; V154-T157 CarbonylContact O-C 3.48Å; V154-T157 PolarHBondContact O-OG1 3.27Å; V154-R158 VanDerWaalsContact O-CA 3.31Å; V154-R158 WeakPolarHBondContact O-CA 3.39Å; V154-R158 PolarHBondContact O-N 3.44Å; V154-Q159 HydrophobicContact CG1-CB 4.28Å; V154-Q159 PolarHBondContact O-N 3.47Å; V154-I162 HydrophobicContact CB-CG2 4.48Å; V154-I162 HydrophobicContact CG1-CB 4.4Å; V154-I162 HydrophobicContact CG1-CG2 4.1Å; V154-I162 HydrophobicContact CG2-CB 4.41Å; V154-I162 HydrophobicContact CG2-CG2 3.52Å; V154-L163 HydrophobicContact CG1-CB 3.67Å; V154-L163 HydrophobicContact CG1-CD1 4.16Å; V154-L163 HydrophobicContact CG1-CG 4.49Å; V154-L166 HydrophobicContact CB-CD1 4.14Å; V154-L166 HydrophobicContact CG1-CD1 4.31Å; V154-L166 HydrophobicContact CG2-CD1 4.04Å
155A93.9Very high89.9Confident0 Ų021.3 Ų21.30%013%0.129CC..Hα-helixtrans-67.5-43173.400000112.8L151 L152 Y153 T157 R158 I181 T184 I185L151-A155 WeakPolarHBondContact O-CB 3.27Å; L151-A155 PolarHBondContact O-N 3.09Å; L152-A155 WeakPolarHBondContact O-CB 3.29Å; L152-A155 PolarHBondContact O-N 3.33Å; Y153-A155 VanDerWaalsContact C-N 3.26Å; Y153-A155 PolarHBondContact O-N 2.87Å; A155-T157 VanDerWaalsContact C-N 3.31Å; A155-T157 PolarHBondContact O-N 2.99Å; A155-R158 WeakPolarHBondContact O-CG 3.26Å; A155-R158 PolarHBondContact O-N 3.36Å; A155-I181 HydrophobicContact CB-CG2 3.87Å; A155-T184 HydrophobicContact CB-CG2 3.87Å; A155-I185 HydrophobicContact CB-CG1 3.94Å
156Q90.4Very high91.5Very high15 Ų1521.1 Ų21.17%0.0713%0.128CC..Hα-helixtrans-62.3-39.8176.7-73.6176.1-11.800112.3L152 Y153 R158 T184 Y188L152-Q156 VanDerWaalsContact O-CG 3.26Å; L152-Q156 WeakPolarHBondContact O-CG 3.39Å; L152-Q156 PolarHBondContact O-N 3.03Å; Y153-Q156 WeakPolarHBondContact O-CB 3.26Å; Y153-Q156 PolarHBondContact O-N 3.48Å; Q156-R158 PolarHBondContact O-NH1 3.32Å; Q156-R158 VanDerWaalsContact O-NH1 3.09Å; Q156-T184 HydrophobicContact CB-CG2 4.24Å; Q156-T184 HydrophobicContact CG-CG2 3.4Å; Q156-T184 VanDerWaalsContact CG-CG2 3.4Å; Q156-Y188 HydrophobicContact CB-CD1 3.62Å; Q156-Y188 HydrophobicContact CB-CE1 3.69Å; Q156-Y188 HydrophobicContact CB-CG 4.16Å; Q156-Y188 HydrophobicContact CG-CD1 3.64Å; Q156-Y188 HydrophobicContact CG-CD2 3.84Å; Q156-Y188 HydrophobicContact CG-CE1 3.67Å; Q156-Y188 HydrophobicContact CG-CE2 3.89Å; Q156-Y188 HydrophobicContact CG-CG 3.72Å; Q156-Y188 VanDerWaalsContact NE2-CE2 3.33Å
157T88.1Confident92.8Very high5 Ų517.8 Ų17.83%0.03111%0.105CC..Hα-helixtrans-92.9-2.9-179.158.50000113.4Y153 V154 A155 Q159 R193Y153-T157 HydrophobicContact CD2-CG2 4.34Å; Y153-T157 HydrophobicContact CE1-CG2 4.08Å; Y153-T157 HydrophobicContact CE2-CG2 3.83Å; Y153-T157 WeakPolarHBondContact O-CB 3.28Å; Y153-T157 PolarHBondContact O-N 3.46Å; Y153-T157 PolarHBondContact O-OG1 2.99Å; V154-T157 CarbonylContact O-C 3.48Å; V154-T157 PolarHBondContact O-OG1 3.27Å; A155-T157 VanDerWaalsContact C-N 3.31Å; A155-T157 PolarHBondContact O-N 2.99Å; T157-Q159 VanDerWaalsContact C-N 3.25Å; T157-Q159 PolarHBondContact O-N 3.09Å; T157-Q159 PolarHBondContact OG1-NE2 3.47Å; T157-R193 HydrophobicContact CG2-CG 4.42Å; T157-R193 PolarHBondContact O-NE 3.43Å; T157-R193 PolarHBondContact O-NH2 2.9Å
158R91.6Very high93.7Very high5 Ų516 Ų162%0.0198%0.083CC..THydrogen-bonded Turntrans50.641.5176.5-57.3165.3-174.278.326.5113.3V154 A155 Q156 S160 T184 I185 Y188 R193 D206 I237V154-R158 VanDerWaalsContact O-CA 3.31Å; V154-R158 WeakPolarHBondContact O-CA 3.39Å; V154-R158 PolarHBondContact O-N 3.44Å; A155-R158 WeakPolarHBondContact O-CG 3.26Å; A155-R158 PolarHBondContact O-N 3.36Å; Q156-R158 PolarHBondContact O-NH1 3.32Å; Q156-R158 VanDerWaalsContact O-NH1 3.09Å; R158-S160 VanDerWaalsContact C-N 3.32Å; R158-S160 PolarHBondContact O-N 2.98Å; R158-T184 PolarHBondContact NH2-O 2.74Å; R158-I185 PolarHBondContact NE-O 3.27Å; R158-I185 PolarHBondContact NH2-O 3.26Å; R158-Y188 PolarHBondContact NH2-O 3.28Å; R158-R193 PolarHBondContact O-NH2 3.49Å; R158-R193 VanDerWaalsContact O-NH2 3.16Å; R158-D206 HydrophobicContact CB-CB 3.94Å; R158-D206 WeakPolarHBondContact O-CB 3.47Å; R158-I237 VanDerWaalsContact NE-CD1 3.31Å
159Q90.6Very high94.2Very high19 Ų1916 Ų169%0.0898%0.082CC..  trans-78.484.7178.1-65.2172.74.500108.9V154 T157 N161 I162 L163V154-Q159 HydrophobicContact CG1-CB 4.28Å; V154-Q159 PolarHBondContact O-N 3.47Å; T157-Q159 VanDerWaalsContact C-N 3.25Å; T157-Q159 PolarHBondContact O-N 3.09Å; T157-Q159 PolarHBondContact OG1-NE2 3.47Å; Q159-N161 VanDerWaalsContact C-N 3.32Å; Q159-N161 PolarHBondContact O-N 2.93Å; Q159-I162 HydrophobicContact CB-CB 4.15Å; Q159-I162 HydrophobicContact CB-CD1 4.45Å; Q159-I162 PolarHBondContact O-N 3.28Å; Q159-I162 VanDerWaalsContact O-N 3.16Å; Q159-L163 WeakPolarHBondContact O-CB 3.42Å; Q159-L163 PolarHBondContact O-N 2.9Å
160S93Very high94.4Very high12 Ų1214.6 Ų14.68%0.0847%0.073CC..Hα-helixtrans-55.3-42.3-172.656.10000113.4R158 L163 K164 L213R158-S160 VanDerWaalsContact C-N 3.32Å; R158-S160 PolarHBondContact O-N 2.98Å; S160-L163 PolarHBondContact O-N 3.16Å; S160-K164 WeakPolarHBondContact O-CB 3.09Å; S160-K164 PolarHBondContact O-N 2.98Å; S160-L213 WeakPolarHBondContact O-CD1 3.38Å
161N93.5Very high94.6Very high112 Ų11214.6 Ų14.660%0.5997%0.074SC*.Hα-helixtrans-62.6-44.4177.9-65.7-24.9000112.6P108 Q159 I165P108-N161 HydrophobicContact CG-CB 3.97Å; Q159-N161 VanDerWaalsContact C-N 3.32Å; Q159-N161 PolarHBondContact O-N 2.93Å; N161-I165 PolarHBondContact O-N 2.83Å
162I95.8Very high94.6Very high3 Ų314.6 Ų14.62%0.0157%0.073CC..Hα-helixtrans-72-39.9177-71.7169.7000110.4F102 G106 P108 V111 V154 Q159 K164 I165 L166F102-I162 HydrophobicContact CD1-CG2 4.24Å; F102-I162 HydrophobicContact CE1-CG2 3.97Å; G106-I162 WeakPolarHBondContact O-CD1 3.01Å; P108-I162 HydrophobicContact CB-CG1 4.41Å; P108-I162 HydrophobicContact CG-CG1 4.17Å; V111-I162 HydrophobicContact CB-CG2 4.42Å; V111-I162 HydrophobicContact CG1-CG2 4.12Å; V111-I162 HydrophobicContact CG2-CD1 4.15Å; V111-I162 HydrophobicContact CG2-CG1 4.19Å; V111-I162 HydrophobicContact CG2-CG2 3.97Å; V154-I162 HydrophobicContact CB-CG2 4.48Å; V154-I162 HydrophobicContact CG1-CB 4.4Å; V154-I162 HydrophobicContact CG1-CG2 4.1Å; V154-I162 HydrophobicContact CG2-CB 4.41Å; V154-I162 HydrophobicContact CG2-CG2 3.52Å; Q159-I162 HydrophobicContact CB-CB 4.15Å; Q159-I162 HydrophobicContact CB-CD1 4.45Å; Q159-I162 PolarHBondContact O-N 3.28Å; Q159-I162 VanDerWaalsContact O-N 3.16Å; I162-K164 VanDerWaalsContact C-N 3.31Å; I162-K164 PolarHBondContact O-N 3.02Å; I162-I165 WeakPolarHBondContact O-CB 3.5Å; I162-I165 PolarHBondContact O-N 3.12Å; I162-I165 VanDerWaalsContact O-N 3.14Å; I162-L166 HydrophobicContact CG2-CG 4.39Å; I162-L166 WeakPolarHBondContact O-CG 3.45Å; I162-L166 PolarHBondContact O-N 3.27Å
163L97.3Very high94.7Very high0 Ų014.9 Ų14.90%07%0.074CC..Hα-helixtrans-56.6-47.7176.5-177.762000110.3L151 V154 Q159 S160 I165 L166 L167 I185 C210L151-L163 HydrophobicContact CD1-CD1 3.69Å; V154-L163 HydrophobicContact CG1-CB 3.67Å; V154-L163 HydrophobicContact CG1-CD1 4.16Å; V154-L163 HydrophobicContact CG1-CG 4.49Å; Q159-L163 WeakPolarHBondContact O-CB 3.42Å; Q159-L163 PolarHBondContact O-N 2.9Å; S160-L163 PolarHBondContact O-N 3.16Å; L163-I165 VanDerWaalsContact C-N 3.28Å; L163-I165 PolarHBondContact O-N 2.95Å; L163-L166 WeakPolarHBondContact O-CB 3.44Å; L163-L166 PolarHBondContact O-N 3.4Å; L163-L167 HydrophobicContact CD1-CD2 4.26Å; L163-L167 HydrophobicContact CD1-CG 4.25Å; L163-L167 HydrophobicContact CG-CD1 4.29Å; L163-L167 HydrophobicContact CG-CG 4.23Å; L163-L167 VanDerWaalsContact O-CG 3.29Å; L163-L167 WeakPolarHBondContact O-CG 3.37Å; L163-L167 PolarHBondContact O-N 3.36Å; L163-I185 HydrophobicContact CD2-CD1 4.1Å; L163-C210 HydrophobicContact CD2-CB 3.54Å
164K97.6Very high94.7Very high48 Ų4816.8 Ų16.821%0.2098%0.081CC..Hα-helixtrans-52.7-45.5176.7-179.7179.9166.6-1720111.8S160 I162 L167 Q168 L213 L293 E294S160-K164 WeakPolarHBondContact O-CB 3.09Å; S160-K164 PolarHBondContact O-N 2.98Å; I162-K164 VanDerWaalsContact C-N 3.31Å; I162-K164 PolarHBondContact O-N 3.02Å; K164-L167 CarbonylContact O-C 3.53Å; K164-L167 PolarHBondContact O-N 2.87Å; K164-Q168 HydrophobicContact CG-CG 4.49Å; K164-Q168 VanDerWaalsContact O-CG 3.29Å; K164-Q168 WeakPolarHBondContact O-CG 3.41Å; K164-Q168 PolarHBondContact O-N 2.96Å; K164-L213 HydrophobicContact CB-CD1 3.96Å; K164-L213 HydrophobicContact CB-CD2 4.15Å; K164-L213 HydrophobicContact CG-CD2 4.15Å; K164-L293 VanDerWaalsContact CE-O 3.3Å; K164-L293 WeakPolarHBondContact CE-O 3.39Å; K164-E294 VanDerWaalsContact CE-OE1 3.23Å; K164-E294 WeakPolarHBondContact CE-OE1 3.36Å; K164-E294 IonicContact NZ-OE1 2.93Å; K164-E294 PolarHBondContact NZ-OE1 2.86Å; K164-E294 VanDerWaalsContact NZ-OE1 3.16Å; K164-E294 IonicContact NZ-OE2 2.72Å; K164-E294 PolarHBondContact NZ-OE2 2.93Å
165I97.7Very high94.7Very high13 Ų1318.4 Ų18.47%0.0679%0.088CC..Hα-helixtrans-61.9-48176.3-65.7170.1000110.9P108 V111 E112 L115 N161 I162 L163 L167 Q168 Y169P108-I165 HydrophobicContact CB-CD1 3.46Å; P108-I165 VanDerWaalsContact CB-CD1 3.46Å; P108-I165 WeakPolarHBondContact O-CD1 3.39Å; V111-I165 HydrophobicContact CG1-CG2 4.33Å; E112-I165 HydrophobicContact CB-CD1 4.29Å; E112-I165 HydrophobicContact CB-CG2 4.12Å; L115-I165 HydrophobicContact CD1-CG2 3.85Å; N161-I165 PolarHBondContact O-N 2.83Å; I162-I165 WeakPolarHBondContact O-CB 3.5Å; I162-I165 PolarHBondContact O-N 3.12Å; I162-I165 VanDerWaalsContact O-N 3.14Å; L163-I165 VanDerWaalsContact C-N 3.28Å; L163-I165 PolarHBondContact O-N 2.95Å; I165-L167 PolarHBondContact O-N 3.33Å; I165-Q168 WeakPolarHBondContact O-CB 3.28Å; I165-Q168 PolarHBondContact O-N 2.98Å; I165-Q168 VanDerWaalsContact O-N 3.09Å; I165-Y169 HydrophobicContact CG2-CD2 4.11Å; I165-Y169 HydrophobicContact CG2-CE2 4.16Å; I165-Y169 WeakPolarHBondContact O-CD2 3.45Å; I165-Y169 PolarHBondContact O-N 3.2Å; I165-Y169 VanDerWaalsContact O-N 3.09Å
166L97.8Very high94.6Very high0 Ų027.5 Ų27.50%013%0.128CC..Hα-helixtrans-57.7-40.1177.1-60.5-170.5000111.5F102 V111 L115 I132 L151 V154 I162 L163 G170 I171F102-L166 HydrophobicContact CE1-CD1 4.43Å; F102-L166 HydrophobicContact CE1-CD2 4.22Å; F102-L166 HydrophobicContact CZ-CD2 4.31Å; V111-L166 HydrophobicContact CG1-CD2 3.82Å; L115-L166 HydrophobicContact CD1-CD2 3.8Å; I132-L166 HydrophobicContact CD1-CD2 3.81Å; L151-L166 HydrophobicContact CB-CD1 4.12Å; L151-L166 HydrophobicContact CD1-CB 4.27Å; L151-L166 HydrophobicContact CD1-CD1 3.77Å; V154-L166 HydrophobicContact CB-CD1 4.14Å; V154-L166 HydrophobicContact CG1-CD1 4.31Å; V154-L166 HydrophobicContact CG2-CD1 4.04Å; I162-L166 HydrophobicContact CG2-CG 4.39Å; I162-L166 WeakPolarHBondContact O-CG 3.45Å; I162-L166 PolarHBondContact O-N 3.27Å; L163-L166 WeakPolarHBondContact O-CB 3.44Å; L163-L166 PolarHBondContact O-N 3.4Å; L166-G170 PolarHBondContact O-N 3.39Å; L166-I171 HydrophobicContact CB-CB 4.34Å; L166-I171 HydrophobicContact CB-CG1 4.37Å; L166-I171 WeakPolarHBondContact O-CB 3.26Å; L166-I171 VanDerWaalsContact O-CG1 3.23Å; L166-I171 WeakPolarHBondContact O-CG1 3.4Å; L166-I171 PolarHBondContact O-N 2.95Å
167L97.9Very high94.7Very high0 Ų030.3 Ų30.30%014%0.143CC..Hα-helixtrans-68.8-39175.7-61.5-168.8000111.9L163 K164 I165 Y169 G170 L172 L213 V217 R265 L293L163-L167 HydrophobicContact CD1-CD2 4.26Å; L163-L167 HydrophobicContact CD1-CG 4.25Å; L163-L167 HydrophobicContact CG-CD1 4.29Å; L163-L167 HydrophobicContact CG-CG 4.23Å; L163-L167 VanDerWaalsContact O-CG 3.29Å; L163-L167 WeakPolarHBondContact O-CG 3.37Å; L163-L167 PolarHBondContact O-N 3.36Å; K164-L167 CarbonylContact O-C 3.53Å; K164-L167 PolarHBondContact O-N 2.87Å; I165-L167 PolarHBondContact O-N 3.33Å; L167-Y169 VanDerWaalsContact C-N 3.27Å; L167-Y169 PolarHBondContact O-N 3.23Å; L167-G170 WeakPolarHBondContact O-CA 3.29Å; L167-G170 PolarHBondContact O-N 3.07Å; L167-L172 HydrophobicContact CD2-CB 3.21Å; L167-L172 HydrophobicContact CD2-CD2 3.57Å; L167-L172 HydrophobicContact CD2-CG 4Å; L167-L213 HydrophobicContact CD1-CB 3.77Å; L167-L213 WeakPolarHBondContact CD1-O 3.2Å; L167-V217 HydrophobicContact CB-CG2 4.13Å; L167-V217 HydrophobicContact CD1-CG2 3.94Å; L167-V217 HydrophobicContact CG-CG2 4.43Å; L167-R265 PolarHBondContact O-NH2 3.02Å; L167-L293 HydrophobicContact CB-CD1 3.5Å; L167-L293 HydrophobicContact CD1-CD1 4.44Å
168Q97.4Very high95Very high13 Ų1331.7 Ų31.76%0.06115%0.152CC..Hα-helixtrans-58.9-39.1176.3-78.6171.5-26.600112.2K164 I165 G170 P275 N292 L293 E294K164-Q168 HydrophobicContact CG-CG 4.49Å; K164-Q168 VanDerWaalsContact O-CG 3.29Å; K164-Q168 WeakPolarHBondContact O-CG 3.41Å; K164-Q168 PolarHBondContact O-N 2.96Å; I165-Q168 WeakPolarHBondContact O-CB 3.28Å; I165-Q168 PolarHBondContact O-N 2.98Å; I165-Q168 VanDerWaalsContact O-N 3.09Å; Q168-G170 PolarHBondContact O-N 3.05Å; Q168-P275 HydrophobicContact CB-CB 4.28Å; Q168-N292 VanDerWaalsContact CG-O 3.25Å; Q168-N292 WeakPolarHBondContact CG-O 3.45Å; Q168-N292 PolarHBondContact NE2-ND2 2.99Å; Q168-N292 VanDerWaalsContact NE2-ND2 3.13Å; Q168-N292 PolarHBondContact NE2-O 3.05Å; Q168-L293 HydrophobicContact CG-CD1 4.42Å; Q168-E294 PolarHBondContact NE2-OE1 2.99Å
169Y97Very high95.2Very high13 Ų1332 Ų325%0.05115%0.154CC..THydrogen-bonded Turntrans-77.70.7173.4-80.2-98.2000114.2E112 L115 I165 L167 P275E112-Y169 HydrophobicContact CG-CE2 4.25Å; L115-Y169 HydrophobicContact CB-CD1 3.74Å; L115-Y169 HydrophobicContact CB-CD2 4.12Å; L115-Y169 HydrophobicContact CB-CE1 3.65Å; L115-Y169 HydrophobicContact CB-CE2 4.04Å; L115-Y169 HydrophobicContact CB-CG 3.97Å; L115-Y169 HydrophobicContact CD1-CD1 4.37Å; L115-Y169 HydrophobicContact CD1-CD2 3.62Å; L115-Y169 HydrophobicContact CD1-CE2 4.14Å; L115-Y169 HydrophobicContact CD1-CG 3.74Å; L115-Y169 HydrophobicContact CG-CG 4.37Å; I165-Y169 HydrophobicContact CG2-CD2 4.11Å; I165-Y169 HydrophobicContact CG2-CE2 4.16Å; I165-Y169 WeakPolarHBondContact O-CD2 3.45Å; I165-Y169 PolarHBondContact O-N 3.2Å; I165-Y169 VanDerWaalsContact O-N 3.09Å; L167-Y169 VanDerWaalsContact C-N 3.27Å; L167-Y169 PolarHBondContact O-N 3.23Å; Y169-P275 HydrophobicContact CD2-CG 4.18Å; Y169-P275 HydrophobicContact CE2-CG 3.89Å
170G96.2Very high95.4Very high0 Ų034.7 Ų34.70%017%0.169CC..THydrogen-bonded Turntrans7622.8174.800000114.5L166 L167 Q168 L172 E173 R174L166-G170 PolarHBondContact O-N 3.39Å; L167-G170 WeakPolarHBondContact O-CA 3.29Å; L167-G170 PolarHBondContact O-N 3.07Å; Q168-G170 PolarHBondContact O-N 3.05Å; G170-L172 PolarHBondContact O-N 3.15Å; G170-E173 WeakPolarHBondContact CA-OE2 3.45Å; G170-E173 PolarHBondContact O-N 3.22Å; G170-R174 VanDerWaalsContact O-CG 3.3Å; G170-R174 WeakPolarHBondContact O-CG 3.41Å; G170-R174 PolarHBondContact O-N 3.22Å
171I96.5Very high95.5Very high1 Ų134.4 Ų34.41%0.00517%0.167CC..THydrogen-bonded Turntrans-66.7-37.2-174.7-56.5-58.3000111.2L115 V122 I132 W133 L151 L166 R174 E175L115-I171 HydrophobicContact CD2-CD1 4.28Å; V122-I171 HydrophobicContact CG1-CD1 3.98Å; I132-I171 HydrophobicContact CG1-CD1 4.04Å; I132-I171 HydrophobicContact CG1-CG1 4.22Å; I132-I171 HydrophobicContact CG1-CG2 4.18Å; I132-I171 HydrophobicContact CG2-CD1 4.07Å; W133-I171 HydrophobicContact CH2-CG2 3.76Å; W133-I171 HydrophobicContact CZ2-CD1 4.42Å; W133-I171 HydrophobicContact CZ3-CG2 3.98Å; L151-I171 HydrophobicContact CB-CG2 4.24Å; L151-I171 HydrophobicContact CD2-CG2 4Å; L166-I171 HydrophobicContact CB-CB 4.34Å; L166-I171 HydrophobicContact CB-CG1 4.37Å; L166-I171 WeakPolarHBondContact O-CB 3.26Å; L166-I171 VanDerWaalsContact O-CG1 3.23Å; L166-I171 WeakPolarHBondContact O-CG1 3.4Å; L166-I171 PolarHBondContact O-N 2.95Å; I171-R174 PolarHBondContact O-N 3.25Å; I171-E175 PolarHBondContact O-N 2.9Å
172L96.5Very high95.7Very high0 Ų029.1 Ų29.10%014%0.138CC..THydrogen-bonded Turntrans-70-40.8177.4-179.965.6000112.3L151 L167 G170 R174 E175 P178 I181 C214 V217 L218L151-L172 HydrophobicContact CD2-CB 4.41Å; L151-L172 HydrophobicContact CD2-CD1 4.27Å; L167-L172 HydrophobicContact CD2-CB 3.21Å; L167-L172 HydrophobicContact CD2-CD2 3.57Å; L167-L172 HydrophobicContact CD2-CG 4Å; G170-L172 PolarHBondContact O-N 3.15Å; L172-R174 PolarHBondContact O-N 2.94Å; L172-E175 WeakPolarHBondContact O-CB 3.39Å; L172-E175 PolarHBondContact O-N 2.68Å; L172-P178 HydrophobicContact CD1-CB 3.57Å; L172-P178 HydrophobicContact CG-CB 4.07Å; L172-I181 HydrophobicContact CD1-CB 3.85Å; L172-I181 HydrophobicContact CD1-CG1 3.67Å; L172-I181 HydrophobicContact CD1-CG2 4.17Å; L172-C214 HydrophobicContact CD2-CB 4.39Å; L172-V217 HydrophobicContact CD2-CB 4.3Å; L172-V217 HydrophobicContact CD2-CG1 4.13Å; L172-L218 HydrophobicContact CD2-CD1 4.4Å; L172-L218 HydrophobicContact CD2-CD2 3.98Å; L172-L218 HydrophobicContact CD2-CG 4.09Å; L172-L218 HydrophobicContact CG-CD2 4.15Å
173E94.8Very high95.7Very high51 Ų5129.6 Ų29.624%0.23814%0.141CC..THydrogen-bonded Turntrans-60.9-26.3175.7-66.697.9131.800112.7G170 E175 V217 R265 L269G170-E173 WeakPolarHBondContact CA-OE2 3.45Å; G170-E173 PolarHBondContact O-N 3.22Å; E173-E175 VanDerWaalsContact C-N 3.33Å; E173-V217 HydrophobicContact CG-CG1 3.49Å; E173-V217 VanDerWaalsContact CG-CG1 3.49Å; E173-V217 WeakPolarHBondContact OE1-CG1 3.34Å; E173-V217 WeakPolarHBondContact OE2-CG1 3.37Å; E173-R265 IonicContact OE1-CZ 3.16Å; E173-R265 VanDerWaalsContact OE1-CZ 3.27Å; E173-R265 IonicContact OE1-NE 3.33Å; E173-R265 PolarHBondContact OE1-NE 2.67Å; E173-R265 IonicContact OE1-NH2 2.75Å; E173-R265 PolarHBondContact OE1-NH2 3.35Å; E173-R265 IonicContact OE2-NH2 2.92Å; E173-L269 HydrophobicContact CB-CD2 3.61Å
174R92.9Very high95.6Very high43 Ų4330.6 Ų30.616%0.16215%0.147CC..THydrogen-bonded Turntrans-81.4-11.1175.7-69.4174.8-177.9-76.11.7113R125 W133 G170 I171 L172 L269R125-R174 PolarHBondContact NH2-O 2.86Å; W133-R174 HydrophobicContact CH2-CB 3.67Å; W133-R174 HydrophobicContact CZ2-CB 3.9Å; W133-R174 HydrophobicContact CZ2-CG 4.46Å; G170-R174 VanDerWaalsContact O-CG 3.3Å; G170-R174 WeakPolarHBondContact O-CG 3.41Å; G170-R174 PolarHBondContact O-N 3.22Å; I171-R174 PolarHBondContact O-N 3.25Å; L172-R174 PolarHBondContact O-N 2.94Å; R174-L269 HydrophobicContact CG-CD1 4.21Å; R174-L269 HydrophobicContact CG-CD2 4.05Å; R174-L269 HydrophobicContact CG-CG 4.41Å; R174-L269 VanDerWaalsContact NE-CD1 3.28Å; R174-L269 PolarHBondContact NH2-O 3.36Å
175E92.8Very high95.5Very high34 Ų3428.3 Ų28.316%0.15914%0.137CC..  trans-71.6139.8-178.4-73.7-63.3-175.400112.7R125 L151 I171 L172 E173 N177 P178R125-E175 IonicContact CZ-OE2 3.78Å; R125-E175 IonicContact NH1-OE2 3.44Å; R125-E175 PolarHBondContact NH1-OE2 3.29Å; R125-E175 IonicContact NH2-OE2 3.09Å; R125-E175 PolarHBondContact NH2-OE2 3.12Å; R125-E175 VanDerWaalsContact NH2-OE2 3.09Å; L151-E175 HydrophobicContact CD2-CG 3.65Å; I171-E175 PolarHBondContact O-N 2.9Å; L172-E175 WeakPolarHBondContact O-CB 3.39Å; L172-E175 PolarHBondContact O-N 2.68Å; E173-E175 VanDerWaalsContact C-N 3.33Å; E175-N177 VanDerWaalsContact C-N 3.29Å; E175-N177 PolarHBondContact O-N 3.31Å; E175-P178 HydrophobicContact CB-CB 4.46Å
176K90.5Very high95.3Very high191 Ų19127.7 Ų27.783%0.8313%0.134SC*.SBendtrans-65.7-36.2176.9-68-174179-177.40111.9
177N92.5Very high95.1Very high73 Ų7328.3 Ų28.339%0.3914%0.137SC..  trans-134.578.1179.1-163.424.5000111E175 I179 N180E175-N177 VanDerWaalsContact C-N 3.29Å; E175-N177 PolarHBondContact O-N 3.31Å; N177-I179 PolarHBondContact O-N 3.46Å; N177-I179 WeakPolarHBondContact OD1-CG2 3.42Å; N177-N180 VanDerWaalsContact ND2-CG 3.33Å; N177-N180 PolarHBondContact ND2-ND2 2.93Å; N177-N180 PolarHBondContact ND2-OD1 3.37Å; N177-N180 VanDerWaalsContact ND2-OD1 3.15Å; N177-N180 WeakPolarHBondContact O-CB 3.49Å; N177-N180 PolarHBondContact O-N 3.4Å; N177-N180 VanDerWaalsContact O-N 3.15Å
178P95.1Very high94.7Very high34 Ų3431 Ų3122%0.22115%0.148CC..THydrogen-bonded Turntrans-65.4-22.2-173.924.9-33.4000113.5L172 E175 N180 I181 L218L172-P178 HydrophobicContact CD1-CB 3.57Å; L172-P178 HydrophobicContact CG-CB 4.07Å; E175-P178 HydrophobicContact CB-CB 4.46Å; P178-N180 PolarHBondContact O-N 2.7Å; P178-I181 WeakPolarHBondContact O-CB 3.41Å; P178-I181 PolarHBondContact O-N 3.18Å; P178-L218 HydrophobicContact CB-CD2 3.6Å; P178-L218 HydrophobicContact CG-CD2 3.85Å
179I95Very high94Very high12 Ų1234 Ų346%0.06217%0.169CC..Hα-helixtrans-59.7-29.3174.9-166.463.3000112.1N177 I181 V182 L183 I221 E225N177-I179 PolarHBondContact O-N 3.46Å; N177-I179 WeakPolarHBondContact OD1-CG2 3.42Å; I179-I181 PolarHBondContact O-N 2.69Å; I179-V182 HydrophobicContact CD1-CB 4.17Å; I179-V182 HydrophobicContact CD1-CG1 4.39Å; I179-V182 WeakPolarHBondContact O-CB 3.46Å; I179-V182 PolarHBondContact O-N 3.24Å; I179-L183 HydrophobicContact CG1-CD1 4.48Å; I179-L183 HydrophobicContact CG1-CG 4.35Å; I179-L183 WeakPolarHBondContact O-CG 3.46Å; I179-L183 PolarHBondContact O-N 3.38Å; I179-I221 HydrophobicContact CD1-CG2 3.61Å; I179-E225 WeakPolarHBondContact CG2-OE2 3.43Å
180N94.9Very high92.7Very high75 Ų7535.1 Ų35.140%0.40118%0.178SC..Hα-helixtrans-59.6-32176.3-77-17.1000112N177 P178 T184N177-N180 VanDerWaalsContact ND2-CG 3.33Å; N177-N180 PolarHBondContact ND2-ND2 2.93Å; N177-N180 PolarHBondContact ND2-OD1 3.37Å; N177-N180 VanDerWaalsContact ND2-OD1 3.15Å; N177-N180 WeakPolarHBondContact O-CB 3.49Å; N177-N180 PolarHBondContact O-N 3.4Å; N177-N180 VanDerWaalsContact O-N 3.15Å; P178-N180 PolarHBondContact O-N 2.7Å; N180-T184 VanDerWaalsContact O-CB 3.28Å; N180-T184 WeakPolarHBondContact O-CB 3.32Å; N180-T184 PolarHBondContact O-N 3.02Å; N180-T184 PolarHBondContact O-OG1 2.95Å
181I96.9Very high91Very high7 Ų746.8 Ų46.84%0.03622%0.222CC..Hα-helixtrans-70-43.6176.7-56.5-52.2000110.1L151 L152 A155 L172 P178 I179 T184 I185L151-I181 HydrophobicContact CD1-CG2 4.46Å; L151-I181 HydrophobicContact CD2-CD1 4.02Å; L151-I181 HydrophobicContact CD2-CG1 3.95Å; L151-I181 HydrophobicContact CG-CD1 3.87Å; L151-I181 HydrophobicContact CG-CG1 4.17Å; L152-I181 HydrophobicContact CB-CD1 4.45Å; L152-I181 HydrophobicContact CD1-CD1 3.98Å; A155-I181 HydrophobicContact CB-CG2 3.87Å; L172-I181 HydrophobicContact CD1-CB 3.85Å; L172-I181 HydrophobicContact CD1-CG1 3.67Å; L172-I181 HydrophobicContact CD1-CG2 4.17Å; P178-I181 WeakPolarHBondContact O-CB 3.41Å; P178-I181 PolarHBondContact O-N 3.18Å; I179-I181 PolarHBondContact O-N 2.69Å; I181-T184 PolarHBondContact O-N 2.81Å; I181-I185 HydrophobicContact CG2-CD1 4.11Å; I181-I185 WeakPolarHBondContact O-CG1 3.45Å; I181-I185 PolarHBondContact O-N 3.13Å
182V96.9Very high89Confident0 Ų048.4 Ų48.40%023%0.232CC..Hα-helixtrans-61.1-48.1174.8176.10000111.2I179 T184 I185 L186 L211 C214 L218 I221 I226I179-V182 HydrophobicContact CD1-CB 4.17Å; I179-V182 HydrophobicContact CD1-CG1 4.39Å; I179-V182 WeakPolarHBondContact O-CB 3.46Å; I179-V182 PolarHBondContact O-N 3.24Å; V182-T184 VanDerWaalsContact C-N 3.27Å; V182-T184 PolarHBondContact O-N 2.78Å; V182-I185 PolarHBondContact O-N 3.02Å; V182-L186 HydrophobicContact CG1-CD1 4.02Å; V182-L186 WeakPolarHBondContact O-CG 3.29Å; V182-L186 PolarHBondContact O-N 2.9Å; V182-L211 HydrophobicContact CG1-CD1 3.73Å; V182-C214 HydrophobicContact CG2-CB 4.02Å; V182-L218 HydrophobicContact CG2-CD1 3.81Å; V182-I221 HydrophobicContact CG1-CG2 4.15Å; V182-I221 HydrophobicContact CG2-CD1 4.41Å; V182-I226 HydrophobicContact CG1-CD1 4.34Å
183L95.8Very high87Confident13 Ų1351 Ų517%0.06824%0.242CC..Hα-helixtrans-59.5-39.4176-68.5174.1000111.7I179 L186 L187 E225 I226 Q229I179-L183 HydrophobicContact CG1-CD1 4.48Å; I179-L183 HydrophobicContact CG1-CG 4.35Å; I179-L183 WeakPolarHBondContact O-CG 3.46Å; I179-L183 PolarHBondContact O-N 3.38Å; L183-L186 PolarHBondContact O-N 2.99Å; L183-L187 HydrophobicContact CD2-CD1 3.99Å; L183-L187 VanDerWaalsContact O-CB 3.22Å; L183-L187 WeakPolarHBondContact O-CB 3.46Å; L183-L187 WeakPolarHBondContact O-CG 3.39Å; L183-L187 PolarHBondContact O-N 2.85Å; L183-E225 HydrophobicContact CD1-CG 4.21Å; L183-I226 HydrophobicContact CD2-CB 4.27Å; L183-I226 HydrophobicContact CD2-CG1 3.75Å; L183-Q229 HydrophobicContact CD1-CG 4.36Å; L183-Q229 HydrophobicContact CD2-CG 4.06Å
184T94.7Very high85Confident22 Ų2252.9 Ų52.914%0.13525%0.253CS..Hα-helixtrans-65.7-46.8177.9-61.70000111.2L152 A155 Q156 R158 N180 I181 V182 L186 Y188L152-T184 HydrophobicContact CD1-CG2 3.84Å; L152-T184 VanDerWaalsContact CD1-OG1 3.29Å; L152-T184 WeakPolarHBondContact CD1-OG1 3.47Å; A155-T184 HydrophobicContact CB-CG2 3.87Å; Q156-T184 HydrophobicContact CB-CG2 4.24Å; Q156-T184 HydrophobicContact CG-CG2 3.4Å; Q156-T184 VanDerWaalsContact CG-CG2 3.4Å; R158-T184 PolarHBondContact NH2-O 2.74Å; N180-T184 VanDerWaalsContact O-CB 3.28Å; N180-T184 WeakPolarHBondContact O-CB 3.32Å; N180-T184 PolarHBondContact O-N 3.02Å; N180-T184 PolarHBondContact O-OG1 2.95Å; I181-T184 PolarHBondContact O-N 2.81Å; V182-T184 VanDerWaalsContact C-N 3.27Å; V182-T184 PolarHBondContact O-N 2.78Å; T184-L186 VanDerWaalsContact C-N 3.27Å; T184-L186 PolarHBondContact O-N 3.23Å; T184-Y188 HydrophobicContact CG2-CD2 4.48Å; T184-Y188 HydrophobicContact CG2-CG 4.31Å; T184-Y188 WeakPolarHBondContact O-CB 3.38Å; T184-Y188 PolarHBondContact O-N 3.15Å
185I95.2Very high82.9Confident0 Ų054.7 Ų54.70%026%0.264CS..Hα-helixtrans-55.7-46.1176-70159000110.3A155 R158 L163 I181 V182 A207 C210A155-I185 HydrophobicContact CB-CG1 3.94Å; R158-I185 PolarHBondContact NE-O 3.27Å; R158-I185 PolarHBondContact NH2-O 3.26Å; L163-I185 HydrophobicContact CD2-CD1 4.1Å; I181-I185 HydrophobicContact CG2-CD1 4.11Å; I181-I185 WeakPolarHBondContact O-CG1 3.45Å; I181-I185 PolarHBondContact O-N 3.13Å; V182-I185 PolarHBondContact O-N 3.02Å; I185-A207 HydrophobicContact CG2-CB 4.32Å; I185-C210 HydrophobicContact CD1-CB 3.83Å; I185-C210 HydrophobicContact CG1-CB 4.11Å; I185-C210 HydrophobicContact CG2-CB 3.82Å
186L94.4Very high80.7Confident0 Ų058.9 Ų58.90%029%0.292CS..Hα-helixtrans-75.7-40.1-174.8-74.4175.7000114.5V182 L183 T184 L211 I226 P236 I237 I238 W241V182-L186 HydrophobicContact CG1-CD1 4.02Å; V182-L186 WeakPolarHBondContact O-CG 3.29Å; V182-L186 PolarHBondContact O-N 2.9Å; L183-L186 PolarHBondContact O-N 2.99Å; T184-L186 VanDerWaalsContact C-N 3.27Å; T184-L186 PolarHBondContact O-N 3.23Å; L186-L211 HydrophobicContact CD2-CD2 4.08Å; L186-I226 HydrophobicContact CD1-CD1 4.03Å; L186-I226 HydrophobicContact CD1-CG2 4.26Å; L186-P236 WeakPolarHBondContact O-CA 3.33Å; L186-I237 PolarHBondContact O-N 3.23Å; L186-I238 HydrophobicContact CD2-CD1 4.16Å; L186-W241 HydrophobicContact CD1-CE3 4.23Å; L186-W241 HydrophobicContact CD2-CB 3.69Å; L186-W241 HydrophobicContact CD2-CG 4.47Å
187L92.8Very high78.6Confident12 Ų1257.3 Ų57.36%0.06329%0.292CS..Hα-helixtrans-117-12.5-162.5-51.6178.6000114.1L183 Q229 L230 R234 P236L183-L187 HydrophobicContact CD2-CD1 3.99Å; L183-L187 VanDerWaalsContact O-CB 3.22Å; L183-L187 WeakPolarHBondContact O-CB 3.46Å; L183-L187 WeakPolarHBondContact O-CG 3.39Å; L183-L187 PolarHBondContact O-N 2.85Å; L187-Q229 HydrophobicContact CD1-CB 3.46Å; L187-Q229 VanDerWaalsContact CD1-CB 3.46Å; L187-Q229 HydrophobicContact CD1-CG 4.07Å; L187-L230 HydrophobicContact CD2-CD2 3.71Å; L187-R234 HydrophobicContact CD1-CB 4.32Å; L187-R234 HydrophobicContact CD2-CB 4.4Å; L187-P236 HydrophobicContact CD2-CB 4.11Å
188Y89.1Confident76.7Confident56 Ų5658.4 Ų58.422%0.2230%0.295CS..SBendtrans-73.5129.9-177.5-167.2-96.4000111.2Q156 R158 T184 V192 I237Q156-Y188 HydrophobicContact CB-CD1 3.62Å; Q156-Y188 HydrophobicContact CB-CE1 3.69Å; Q156-Y188 HydrophobicContact CB-CG 4.16Å; Q156-Y188 HydrophobicContact CG-CD1 3.64Å; Q156-Y188 HydrophobicContact CG-CD2 3.84Å; Q156-Y188 HydrophobicContact CG-CE1 3.67Å; Q156-Y188 HydrophobicContact CG-CE2 3.89Å; Q156-Y188 HydrophobicContact CG-CG 3.72Å; Q156-Y188 VanDerWaalsContact NE2-CE2 3.33Å; R158-Y188 PolarHBondContact NH2-O 3.28Å; T184-Y188 HydrophobicContact CG2-CD2 4.48Å; T184-Y188 HydrophobicContact CG2-CG 4.31Å; T184-Y188 WeakPolarHBondContact O-CB 3.38Å; T184-Y188 PolarHBondContact O-N 3.15Å; Y188-V192 HydrophobicContact CE1-CB 3.72Å; Y188-V192 HydrophobicContact CE1-CG1 3.96Å; Y188-V192 HydrophobicContact CE1-CG2 3.67Å; Y188-I237 WeakPolarHBondContact O-CD1 3.45Å
189P83.1Confident74.8Confident78 Ų7863.5 Ų63.551%0.50632%0.316SS..  trans-57.7139.4-172.7-2634.2000114.7R191P189-R191 PolarHBondContact O-N 3.45Å
190S69.5Low73.2Confident35 Ų3569.2 Ų69.225%0.24535%0.346CS..G310 helixtrans-66.2-16.9-179.2-49.20000114.7V192S190-V192 PolarHBondContact O-N 3.46Å
191R60.4Low71.5Confident245 Ų24570.8 Ų70.893%0.92535%0.353SS*.G310 helixtrans-70.2-0.2-174.2-63.9-176.4-179.6176.5-0.7115P189P189-R191 PolarHBondContact O-N 3.45Å
192V56.4Low70.5Confident35 Ų3573.8 Ų73.821%0.21237%0.369CS..G310 helixtrans-1041.8-171.9-172.20000113.1Y188 S190 I194Y188-V192 HydrophobicContact CE1-CB 3.72Å; Y188-V192 HydrophobicContact CE1-CG1 3.96Å; Y188-V192 HydrophobicContact CE1-CG2 3.67Å; S190-V192 PolarHBondContact O-N 3.46Å; V192-I194 PolarHBondContact O-N 2.95Å; V192-I194 VanDerWaalsContact O-N 3.1Å
193R53.2Low69.8Low54 Ų5474.6 Ų74.620%0.20437%0.373CS..  trans-70.8107.6171.7-124-175.8-168.3179.97.8108.8T157 R158 M195 D206T157-R193 HydrophobicContact CG2-CG 4.42Å; T157-R193 PolarHBondContact O-NE 3.43Å; T157-R193 PolarHBondContact O-NH2 2.9Å; R158-R193 PolarHBondContact O-NH2 3.49Å; R158-R193 VanDerWaalsContact O-NH2 3.16Å; R193-M195 PolarHBondContact O-N 2.85Å; R193-D206 IonicContact CZ-OD2 2.65Å; R193-D206 VanDerWaalsContact CZ-OD2 3.27Å; R193-D206 IonicContact NH1-OD2 2.97Å; R193-D206 PolarHBondContact NH1-OD2 3.35Å; R193-D206 IonicContact NH2-OD2 3.03Å; R193-D206 PolarHBondContact NH2-OD2 2.83Å
194I52.5Low69.4Low92 Ų9277.6 Ų77.647%0.47239%0.387SS..  trans-77.727.2175.2-55.9166000110.9L145 V192L145-I194 HydrophobicContact CD1-CD1 4.42Å; V192-I194 PolarHBondContact O-N 2.95Å; V192-I194 VanDerWaalsContact O-N 3.1Å
195M50.1Low69.2Low80 Ų8081 Ų8139%0.39440%0.401SS..SBendtrans-122.1133.8179.8-70-177.572.600109.1R193R193-M195 PolarHBondContact O-N 2.85Å
196V45.9Very low68.9Low122 Ų12282.6 Ų82.674%0.73941%0.41SS*.SBendtrans-50.3137.1-171.5-178.60000112.2H198V196-H198 PolarHBondContact O-N 2.98Å
197D47Very low68.8Low158 Ų15882.6 Ų82.685%0.84541%0.41SS*.  trans30.565.3159.6-60.7-26.4000117.6
198H52.5Low68.9Low97 Ų9783.5 Ų83.545%0.44941%0.413SS..  trans-100.9127.6159.2-78.7-71.5000109.9V196 D202V196-H198 PolarHBondContact O-N 2.98Å; H198-D202 HydrophobicContact CB-CB 4.28Å; H198-D202 IonicContact CE1-OD2 2.67Å; H198-D202 IonicContact CG-OD2 2.92Å; H198-D202 IonicContact ND1-OD2 3.98Å; H198-D202 PolarHBondContact ND1-OD2 3.23Å
199E55.6Low69.2Low140 Ų14083.8 Ų83.865%0.65442%0.421SS*.  trans-61.8155.8176.7-65.4-174.4171.200111I201 D202E199-I201 PolarHBondContact O-N 3.01Å; E199-I201 VanDerWaalsContact O-N 3.08Å; E199-D202 PolarHBondContact O-N 3.28Å; E199-D202 VanDerWaalsContact O-N 3.11Å
200L59.9Low69.8Low133 Ų13380.1 Ų80.170%0.69640%0.397SS*.Hα-helixtrans-57.2-26.2-180-75.7165.3000113.6I203 Q204L200-I203 PolarHBondContact O-N 3.27Å; L200-Q204 PolarHBondContact O-N 3.21Å
201I59.3Low71.1Confident108 Ų10878.4 Ų78.455%0.55439%0.385SS*.Hα-helixtrans-65.1-43.5178.2-66.9164.2000110.7E199 I203 Q204 E205E199-I201 PolarHBondContact O-N 3.01Å; E199-I201 VanDerWaalsContact O-N 3.08Å; I201-I203 PolarHBondContact O-N 3.2Å; I201-Q204 PolarHBondContact O-N 3.36Å; I201-E205 PolarHBondContact O-N 3.15Å; I201-E205 VanDerWaalsContact O-N 3.14Å
202D76.1Confident72.8Confident69 Ų6969 Ų6937%0.36936%0.355SS..Hα-helixtrans-59.7-37.5178.1-69-11.5000111.4H198 E199 E205 D206H198-D202 HydrophobicContact CB-CB 4.28Å; H198-D202 IonicContact CE1-OD2 2.67Å; H198-D202 IonicContact CG-OD2 2.92Å; H198-D202 IonicContact ND1-OD2 3.98Å; H198-D202 PolarHBondContact ND1-OD2 3.23Å; E199-D202 PolarHBondContact O-N 3.28Å; E199-D202 VanDerWaalsContact O-N 3.11Å; D202-E205 PolarHBondContact O-N 3.1Å; D202-D206 VanDerWaalsContact O-CB 3.25Å; D202-D206 WeakPolarHBondContact O-CB 3.34Å; D202-D206 PolarHBondContact O-N 3.13Å
203I82.4Confident74.7Confident17 Ų1767.8 Ų67.89%0.08735%0.348CS..Hα-helixtrans-69.5-36.5-177.7-57.6176.6000111.7L200 I201 A207 I237L200-I203 PolarHBondContact O-N 3.27Å; I201-I203 PolarHBondContact O-N 3.2Å; I203-A207 WeakPolarHBondContact O-CB 3.37Å; I203-A207 PolarHBondContact O-N 3.43Å; I203-I237 HydrophobicContact CG2-CG2 4.38Å
204Q87.9Confident76.8Confident77 Ų7765.2 Ų65.236%0.3634%0.338SS..Hα-helixtrans-70.5-44.1176.5-73.2-173-2000111.3L200 I201 A207 K208 I237L200-Q204 PolarHBondContact O-N 3.21Å; I201-Q204 PolarHBondContact O-N 3.36Å; Q204-A207 WeakPolarHBondContact O-CB 3.47Å; Q204-A207 PolarHBondContact O-N 3.27Å; Q204-K208 VanDerWaalsContact O-CG 3.24Å; Q204-K208 WeakPolarHBondContact O-CG 3.34Å; Q204-K208 PolarHBondContact O-N 3.23Å; Q204-I237 HydrophobicContact CG-CG2 3.92Å; Q204-I237 PolarHBondContact NE2-O 2.82Å
205E89.3Confident78.8Confident92 Ų9261.1 Ų61.143%0.4332%0.317SS..Hα-helixtrans-64.5-40.1176.5-69-52.313400112.4I201 D202 A207 K208 T209I201-E205 PolarHBondContact O-N 3.15Å; I201-E205 VanDerWaalsContact O-N 3.14Å; D202-E205 PolarHBondContact O-N 3.1Å; E205-A207 VanDerWaalsContact C-N 3.34Å; E205-A207 PolarHBondContact O-N 3.22Å; E205-K208 PolarHBondContact O-N 3.36Å; E205-K208 IonicContact OE1-NZ 2.68Å; E205-K208 PolarHBondContact OE1-NZ 3.45Å; E205-T209 WeakPolarHBondContact O-CB 3.36Å; E205-T209 PolarHBondContact O-N 3.16Å; E205-T209 PolarHBondContact O-OG1 3.36Å
206D89.6Confident81Confident35 Ų3560.3 Ų60.319%0.18731%0.31CS..Hα-helixtrans-60.1-43.9171.7-86.1-24.7000111.6R158 R193 D202 T209 C210R158-D206 HydrophobicContact CB-CB 3.94Å; R158-D206 WeakPolarHBondContact O-CB 3.47Å; R193-D206 IonicContact CZ-OD2 2.65Å; R193-D206 VanDerWaalsContact CZ-OD2 3.27Å; R193-D206 IonicContact NH1-OD2 2.97Å; R193-D206 PolarHBondContact NH1-OD2 3.35Å; R193-D206 IonicContact NH2-OD2 3.03Å; R193-D206 PolarHBondContact NH2-OD2 2.83Å; D202-D206 VanDerWaalsContact O-CB 3.25Å; D202-D206 WeakPolarHBondContact O-CB 3.34Å; D202-D206 PolarHBondContact O-N 3.13Å; D206-T209 PolarHBondContact O-N 3.07Å; D206-C210 WeakPolarHBondContact O-CB 3.1Å; D206-C210 PolarHBondContact O-N 2.79Å; D206-C210 PolarHBondContact O-SG 3.25Å
207A93Very high83.3Confident0 Ų054.8 Ų54.80%028%0.276CS..Hα-helixtrans-61.5-44.6176.800000111.8I185 I203 Q204 E205 C210 L211 I237 I238I185-A207 HydrophobicContact CG2-CB 4.32Å; I203-A207 WeakPolarHBondContact O-CB 3.37Å; I203-A207 PolarHBondContact O-N 3.43Å; Q204-A207 WeakPolarHBondContact O-CB 3.47Å; Q204-A207 PolarHBondContact O-N 3.27Å; E205-A207 VanDerWaalsContact C-N 3.34Å; E205-A207 PolarHBondContact O-N 3.22Å; A207-C210 PolarHBondContact O-N 2.98Å; A207-L211 WeakPolarHBondContact O-CB 3.02Å; A207-L211 PolarHBondContact O-N 3.15Å; A207-I237 HydrophobicContact CB-CG2 4.39Å; A207-I238 HydrophobicContact CB-CD1 3.7Å; A207-I238 HydrophobicContact CB-CG1 3.94Å
208K94.9Very high85.7Confident30 Ų3048 Ų4813%0.1324%0.24CC..Hα-helixtrans-61.9-44.9178.7-69.7166.8-175.6-177.70111Q204 E205 L211 T212 I238 Y244Q204-K208 VanDerWaalsContact O-CG 3.24Å; Q204-K208 WeakPolarHBondContact O-CG 3.34Å; Q204-K208 PolarHBondContact O-N 3.23Å; E205-K208 PolarHBondContact O-N 3.36Å; E205-K208 IonicContact OE1-NZ 2.68Å; E205-K208 PolarHBondContact OE1-NZ 3.45Å; K208-L211 PolarHBondContact O-N 3.09Å; K208-T212 WeakPolarHBondContact O-CB 3.48Å; K208-T212 PolarHBondContact O-N 3.44Å; K208-T212 PolarHBondContact O-OG1 3.5Å; K208-I238 HydrophobicContact CB-CD1 4.36Å; K208-I238 HydrophobicContact CG-CD1 3.64Å; K208-I238 HydrophobicContact CG-CG1 4.12Å; K208-I238 HydrophobicContact CG-CG2 4.42Å; K208-Y244 HydrophobicContact CB-CD1 3.85Å; K208-Y244 HydrophobicContact CB-CE1 3.81Å; K208-Y244 HydrophobicContact CB-CG 4.43Å; K208-Y244 HydrophobicContact CD-CD1 4.38Å; K208-Y244 HydrophobicContact CD-CE1 3.55Å; K208-Y244 HydrophobicContact CD-CE2 4.07Å; K208-Y244 VanDerWaalsContact CD-OH 3.3Å; K208-Y244 WeakPolarHBondContact CD-OH 3.3Å; K208-Y244 VanDerWaalsContact CE-CZ 3.46Å; K208-Y244 WeakPolarHBondContact CE-OH 3.23Å; K208-Y244 HydrophobicContact CG-CD1 3.84Å; K208-Y244 HydrophobicContact CG-CD2 4.17Å; K208-Y244 HydrophobicContact CG-CE1 3.51Å; K208-Y244 HydrophobicContact CG-CE2 3.85Å; K208-Y244 HydrophobicContact CG-CG 4.16Å; K208-Y244 PolarHBondContact NZ-OH 2.68Å
209T94.7Very high87.5Confident63 Ų6346.5 Ų46.539%0.38724%0.24SC..Hα-helixtrans-62.7-46.6177-56.10000110.7E205 D206 L211 T212 L213E205-T209 WeakPolarHBondContact O-CB 3.36Å; E205-T209 PolarHBondContact O-N 3.16Å; E205-T209 PolarHBondContact O-OG1 3.36Å; D206-T209 PolarHBondContact O-N 3.07Å; T209-L211 PolarHBondContact O-N 3.28Å; T209-T212 PolarHBondContact O-N 3.11Å; T209-L213 HydrophobicContact CG2-CD1 4.31Å; T209-L213 WeakPolarHBondContact O-CB 3.22Å; T209-L213 WeakPolarHBondContact O-CG 3.49Å; T209-L213 PolarHBondContact O-N 3.37Å
210C96.1Very high89.4Confident0 Ų043.1 Ų43.10%024%0.236CC..Hα-helixtrans-61.5-41.5177-69.10000112.4L163 I185 D206 A207 L213 C214L163-C210 HydrophobicContact CD2-CB 3.54Å; I185-C210 HydrophobicContact CD1-CB 3.83Å; I185-C210 HydrophobicContact CG1-CB 4.11Å; I185-C210 HydrophobicContact CG2-CB 3.82Å; D206-C210 WeakPolarHBondContact O-CB 3.1Å; D206-C210 PolarHBondContact O-N 2.79Å; D206-C210 PolarHBondContact O-SG 3.25Å; A207-C210 PolarHBondContact O-N 2.98Å; C210-L213 WeakPolarHBondContact O-CB 3.12Å; C210-L213 PolarHBondContact O-N 3.09Å; C210-C214 PolarHBondContact O-N 3.47Å; C210-C214 PolarHBondContact O-SG 2.84Å; C210-C214 VanDerWaalsContact O-SG 3.39Å
211L96.2Very high91Very high0 Ų037 Ų370%020%0.204CC..Hα-helixtrans-65.1-42.1178-175.660.1000111.6V182 L186 A207 K208 T209 L213 C214 S215 I245V182-L211 HydrophobicContact CG1-CD1 3.73Å; L186-L211 HydrophobicContact CD2-CD2 4.08Å; A207-L211 WeakPolarHBondContact O-CB 3.02Å; A207-L211 PolarHBondContact O-N 3.15Å; K208-L211 PolarHBondContact O-N 3.09Å; T209-L211 PolarHBondContact O-N 3.28Å; L211-L213 VanDerWaalsContact C-N 3.32Å; L211-L213 PolarHBondContact O-N 2.99Å; L211-C214 PolarHBondContact O-N 2.75Å; L211-S215 PolarHBondContact O-N 3.21Å; L211-I245 HydrophobicContact CD1-CD1 4.3Å; L211-I245 HydrophobicContact CD1-CG1 4.05Å; L211-I245 HydrophobicContact CD2-CD1 4.4Å; L211-I245 HydrophobicContact CD2-CG1 3.81Å; L211-I245 HydrophobicContact CG-CG1 4.08Å
212T95.6Very high92.7Very high47 Ų4734.3 Ų34.329%0.28820%0.195SC..Hα-helixtrans-62.6-39.3174.6-60.30000111.5K208 T209 S215 R216K208-T212 WeakPolarHBondContact O-CB 3.48Å; K208-T212 PolarHBondContact O-N 3.44Å; K208-T212 PolarHBondContact O-OG1 3.5Å; T209-T212 PolarHBondContact O-N 3.11Å; T212-S215 PolarHBondContact O-N 2.97Å; T212-S215 PolarHBondContact O-OG 2.9Å; T212-R216 VanDerWaalsContact O-CG 3.27Å; T212-R216 WeakPolarHBondContact O-CG 3.49Å; T212-R216 PolarHBondContact O-N 3.19Å
213L96.8Very high93.6Very high10 Ų1032 Ų325%0.05218%0.183CC..Hα-helixtrans-63.4-45.1174.2-76.5171.3000111.7S160 K164 L167 T209 C210 L211 S215 R216S160-L213 WeakPolarHBondContact O-CD1 3.38Å; K164-L213 HydrophobicContact CB-CD1 3.96Å; K164-L213 HydrophobicContact CB-CD2 4.15Å; K164-L213 HydrophobicContact CG-CD2 4.15Å; L167-L213 HydrophobicContact CD1-CB 3.77Å; L167-L213 WeakPolarHBondContact CD1-O 3.2Å; T209-L213 HydrophobicContact CG2-CD1 4.31Å; T209-L213 WeakPolarHBondContact O-CB 3.22Å; T209-L213 WeakPolarHBondContact O-CG 3.49Å; T209-L213 PolarHBondContact O-N 3.37Å; C210-L213 WeakPolarHBondContact O-CB 3.12Å; C210-L213 PolarHBondContact O-N 3.09Å; L211-L213 VanDerWaalsContact C-N 3.32Å; L211-L213 PolarHBondContact O-N 2.99Å; L213-S215 PolarHBondContact O-N 2.91Å; L213-R216 WeakPolarHBondContact O-CB 3.49Å; L213-R216 PolarHBondContact O-N 2.92Å
214C97.1Very high94.1Very high0 Ų040.7 Ų40.70%022%0.215CC..Hα-helixtrans-61.6-41.6175.6-71.10000112.2L172 V182 C210 L211 R216 V217 L218L172-C214 HydrophobicContact CD2-CB 4.39Å; V182-C214 HydrophobicContact CG2-CB 4.02Å; C210-C214 PolarHBondContact O-N 3.47Å; C210-C214 PolarHBondContact O-SG 2.84Å; C210-C214 VanDerWaalsContact O-SG 3.39Å; L211-C214 PolarHBondContact O-N 2.75Å; C214-R216 PolarHBondContact O-N 3.45Å; C214-V217 PolarHBondContact O-N 3.06Å; C214-L218 WeakPolarHBondContact O-CG 3.37Å; C214-L218 PolarHBondContact O-N 3.14Å
215S95.7Very high94.5Very high5 Ų540 Ų404%0.03521%0.212CC..Hα-helixtrans-68.3-22179.871.40000113.7L211 T212 L213 V217 R249 H258L211-S215 PolarHBondContact O-N 3.21Å; T212-S215 PolarHBondContact O-N 2.97Å; T212-S215 PolarHBondContact O-OG 2.9Å; L213-S215 PolarHBondContact O-N 2.91Å; S215-V217 VanDerWaalsContact C-N 3.28Å; S215-R249 PolarHBondContact O-NE 3.38Å; S215-R249 VanDerWaalsContact O-NE 3.1Å; S215-H258 PolarHBondContact O-CE1 3.46Å; S215-H258 VanDerWaalsContact O-CE1 3.23Å
216R95.2Very high94.8Very high63 Ų6335.6 Ų35.624%0.23819%0.191CC..THydrogen-bonded Turntrans-74.2-16.3171.6-70.7168-179-148.9-8.8113.7T212 L213 C214 H258 R261 L293 S295T212-R216 VanDerWaalsContact O-CG 3.27Å; T212-R216 WeakPolarHBondContact O-CG 3.49Å; T212-R216 PolarHBondContact O-N 3.19Å; L213-R216 WeakPolarHBondContact O-CB 3.49Å; L213-R216 PolarHBondContact O-N 2.92Å; C214-R216 PolarHBondContact O-N 3.45Å; R216-H258 VanDerWaalsContact C-CE1 3.46Å; R216-H258 PolarHBondContact O-CE1 3.41Å; R216-R261 VanDerWaalsContact O-CD 3.27Å; R216-R261 WeakPolarHBondContact O-CD 3.44Å; R216-R261 PolarHBondContact O-NH1 2.63Å; R216-L293 HydrophobicContact CB-CD2 3.98Å; R216-S295 VanDerWaalsContact CZ-OXT 3.24Å; R216-S295 PolarHBondContact NH1-O 3.18Å; R216-S295 PolarHBondContact NH1-OXT 3.32Å; R216-S295 PolarHBondContact NH2-OXT 3.42Å
217V95.4Very high95Very high7 Ų739 Ų394%0.04221%0.206CC..THydrogen-bonded Turntrans-107.1-42.7-178.8173.40000112.1L167 L172 E173 C214 S215 L293L167-V217 HydrophobicContact CB-CG2 4.13Å; L167-V217 HydrophobicContact CD1-CG2 3.94Å; L167-V217 HydrophobicContact CG-CG2 4.43Å; L172-V217 HydrophobicContact CD2-CB 4.3Å; L172-V217 HydrophobicContact CD2-CG1 4.13Å; E173-V217 HydrophobicContact CG-CG1 3.49Å; E173-V217 VanDerWaalsContact CG-CG1 3.49Å; E173-V217 WeakPolarHBondContact OE1-CG1 3.34Å; E173-V217 WeakPolarHBondContact OE2-CG1 3.37Å; C214-V217 PolarHBondContact O-N 3.06Å; S215-V217 VanDerWaalsContact C-N 3.28Å; V217-L293 HydrophobicContact CG2-CD1 3.72Å; V217-L293 HydrophobicContact CG2-CD2 4.11Å
218L95.4Very high95.1Very high15 Ų1542.1 Ų42.18%0.07923%0.225CC..  trans-78.7141.8-175.9-59.3177.5000111.6L172 P178 V182 C214 I221 R249 H258L172-L218 HydrophobicContact CD2-CD1 4.4Å; L172-L218 HydrophobicContact CD2-CD2 3.98Å; L172-L218 HydrophobicContact CD2-CG 4.09Å; L172-L218 HydrophobicContact CG-CD2 4.15Å; P178-L218 HydrophobicContact CB-CD2 3.6Å; P178-L218 HydrophobicContact CG-CD2 3.85Å; V182-L218 HydrophobicContact CG2-CD1 3.81Å; C214-L218 WeakPolarHBondContact O-CG 3.37Å; C214-L218 PolarHBondContact O-N 3.14Å; L218-I221 HydrophobicContact CB-CG1 4.23Å; L218-I221 HydrophobicContact CD1-CD1 4.22Å; L218-I221 HydrophobicContact CD1-CG1 4Å; L218-R249 VanDerWaalsContact O-CD 3.25Å; L218-R249 WeakPolarHBondContact O-CD 3.43Å; L218-R249 PolarHBondContact O-NE 3.24Å; L218-H258 PolarHBondContact O-NE2 2.87Å
219S92.2Very high95.1Very high66 Ų6642.7 Ų42.746%0.46223%0.228SC..SBendtrans-77.1-35.5172.550.40000111.9R249 I262S219-R249 WeakPolarHBondContact O-CD 3.4Å; S219-I262 VanDerWaalsContact CA-CD1 3.48Å
220A93.6Very high95Very high68 Ų6842 Ų4256%0.56222%0.222SC*.  trans-142.7146.6-179.800000111.4R249A220-R249 CarbonylContact C-O 3.48Å; A220-R249 WeakPolarHBondContact CA-O 3.36Å
221I95Very high94.9Very high4 Ų446.5 Ų46.52%0.02125%0.253CS..  trans-127.1120.1174.1-59.3-175.2000107.9I179 V182 L218 V223 I226 I245 R249 Y250I179-I221 HydrophobicContact CD1-CG2 3.61Å; V182-I221 HydrophobicContact CG1-CG2 4.15Å; V182-I221 HydrophobicContact CG2-CD1 4.41Å; L218-I221 HydrophobicContact CB-CG1 4.23Å; L218-I221 HydrophobicContact CD1-CD1 4.22Å; L218-I221 HydrophobicContact CD1-CG1 4Å; I221-V223 PolarHBondContact O-N 3Å; I221-I226 HydrophobicContact CG2-CD1 4.03Å; I221-I245 HydrophobicContact CB-CG2 4.35Å; I221-I245 HydrophobicContact CD1-CG2 4.1Å; I221-I245 HydrophobicContact CG2-CD1 4.03Å; I221-R249 HydrophobicContact CG1-CB 4.48Å; I221-R249 PolarHBondContact N-O 3.14Å; I221-Y250 WeakPolarHBondContact O-CB 3.22Å
222S94.1Very high94.7Very high53 Ų5352.4 Ų52.437%0.37128%0.284SS..  trans-74.694.6-178-177.70000111.2R224 E225 I226S222-R224 PolarHBondContact O-N 3.05Å; S222-E225 PolarHBondContact O-N 3.09Å; S222-E225 WeakPolarHBondContact OG-CB 3.29Å; S222-E225 PolarHBondContact OG-N 3.27Å; S222-I226 PolarHBondContact O-N 2.77Å
223V94.9Very high94.4Very high19 Ų1953 Ų5312%0.11530%0.3CS..Hα-helixtrans-58.3-38.3172.9161.30000111.4I221 E225 I226 E227 W241 L242 Y250I221-V223 PolarHBondContact O-N 3Å; V223-E225 VanDerWaalsContact C-N 3.28Å; V223-E225 PolarHBondContact O-N 3.37Å; V223-I226 WeakPolarHBondContact O-CB 3.5Å; V223-I226 PolarHBondContact O-N 2.94Å; V223-I226 VanDerWaalsContact O-N 3.1Å; V223-E227 HydrophobicContact CG1-CG 4.13Å; V223-E227 WeakPolarHBondContact O-CG 3.25Å; V223-E227 PolarHBondContact O-N 2.93Å; V223-W241 HydrophobicContact CG1-CH2 4.07Å; V223-W241 HydrophobicContact CG2-CH2 4.24Å; V223-W241 HydrophobicContact CG2-CZ3 4.2Å; V223-L242 HydrophobicContact CG1-CD1 4.45Å; V223-L242 HydrophobicContact CG2-CD1 3.71Å; V223-Y250 HydrophobicContact CB-CD2 4.35Å; V223-Y250 HydrophobicContact CG2-CD1 4.2Å; V223-Y250 HydrophobicContact CG2-CD2 3.62Å; V223-Y250 HydrophobicContact CG2-CE2 4.35Å; V223-Y250 HydrophobicContact CG2-CG 3.53Å
224R94.3Very high94Very high201 Ų20159 Ų5976%0.75832%0.322SS*.Hα-helixtrans-57.6-39.3176.7-175.6-179.9177.9-175.90.5112.7S222 T228S222-R224 PolarHBondContact O-N 3.05Å; R224-T228 WeakPolarHBondContact O-CB 3.11Å; R224-T228 PolarHBondContact O-N 3.36Å; R224-T228 PolarHBondContact O-OG1 2.93Å
225E94.9Very high93.6Very high61 Ų6169.2 Ų69.229%0.28536%0.36SS..Hα-helixtrans-69.7-38.6178.2-169.7173.4170.600111.4I179 L183 S222 V223 T228 Q229I179-E225 WeakPolarHBondContact CG2-OE2 3.43Å; L183-E225 HydrophobicContact CD1-CG 4.21Å; S222-E225 PolarHBondContact O-N 3.09Å; S222-E225 WeakPolarHBondContact OG-CB 3.29Å; S222-E225 PolarHBondContact OG-N 3.27Å; V223-E225 VanDerWaalsContact C-N 3.28Å; V223-E225 PolarHBondContact O-N 3.37Å; E225-T228 PolarHBondContact O-N 2.92Å; E225-Q229 WeakPolarHBondContact O-CG 3.27Å; E225-Q229 PolarHBondContact O-N 3.01Å; E225-Q229 VanDerWaalsContact O-N 3.12Å
226I95.2Very high93.4Very high1 Ų170.8 Ų70.81%0.00537%0.37CS..Hα-helixtrans-61.6-52173.4-58.5168.9000109.9V182 L183 L186 I221 S222 V223 T228 Q229 L230 W241 I245V182-I226 HydrophobicContact CG1-CD1 4.34Å; L183-I226 HydrophobicContact CD2-CB 4.27Å; L183-I226 HydrophobicContact CD2-CG1 3.75Å; L186-I226 HydrophobicContact CD1-CD1 4.03Å; L186-I226 HydrophobicContact CD1-CG2 4.26Å; I221-I226 HydrophobicContact CG2-CD1 4.03Å; S222-I226 PolarHBondContact O-N 2.77Å; V223-I226 WeakPolarHBondContact O-CB 3.5Å; V223-I226 PolarHBondContact O-N 2.94Å; V223-I226 VanDerWaalsContact O-N 3.1Å; I226-T228 VanDerWaalsContact C-N 3.27Å; I226-T228 PolarHBondContact O-N 3.14Å; I226-Q229 WeakPolarHBondContact O-CB 3.32Å; I226-Q229 PolarHBondContact O-N 3.28Å; I226-L230 HydrophobicContact CG2-CD1 4.42Å; I226-L230 WeakPolarHBondContact O-CG 3.44Å; I226-L230 PolarHBondContact O-N 3.47Å; I226-W241 HydrophobicContact CB-CH2 3.82Å; I226-W241 HydrophobicContact CB-CZ2 4.32Å; I226-W241 HydrophobicContact CB-CZ3 4.19Å; I226-W241 HydrophobicContact CD1-CE3 4.15Å; I226-W241 HydrophobicContact CD1-CH2 4Å; I226-W241 HydrophobicContact CD1-CZ3 3.49Å; I226-W241 VanDerWaalsContact CD1-CZ3 3.49Å; I226-W241 HydrophobicContact CG1-CZ3 4.43Å; I226-W241 HydrophobicContact CG2-CD2 4.28Å; I226-W241 HydrophobicContact CG2-CE3 4.21Å; I226-W241 HydrophobicContact CG2-CH2 3.52Å; I226-W241 HydrophobicContact CG2-CZ2 3.6Å; I226-W241 HydrophobicContact CG2-CZ3 3.85Å; I226-I245 HydrophobicContact CD1-CD1 4.1Å
227E94.9Very high93.2Very high107 Ų10769 Ų6950%0.537%0.365SS..Hα-helixtrans-58-38.7177.7-71.6174.6162.800112.5V223 Q229 L230 S231V223-E227 HydrophobicContact CG1-CG 4.13Å; V223-E227 WeakPolarHBondContact O-CG 3.25Å; V223-E227 PolarHBondContact O-N 2.93Å; E227-Q229 VanDerWaalsContact C-N 3.34Å; E227-Q229 PolarHBondContact O-N 3.1Å; E227-L230 WeakPolarHBondContact O-CB 3.45Å; E227-L230 PolarHBondContact O-N 2.98Å; E227-L230 VanDerWaalsContact O-N 3.16Å; E227-S231 PolarHBondContact O-N 3.47Å
228T95.7Very high92.9Very high65 Ų6568.7 Ų68.740%0.39936%0.363SS..Hα-helixtrans-59.6-46.1174.5-57.80000110.4R224 E225 I226 L230 S231 L232R224-T228 WeakPolarHBondContact O-CB 3.11Å; R224-T228 PolarHBondContact O-N 3.36Å; R224-T228 PolarHBondContact O-OG1 2.93Å; E225-T228 PolarHBondContact O-N 2.92Å; I226-T228 VanDerWaalsContact C-N 3.27Å; I226-T228 PolarHBondContact O-N 3.14Å; T228-L230 VanDerWaalsContact C-N 3.3Å; T228-L230 PolarHBondContact O-N 3.24Å; T228-S231 PolarHBondContact O-N 3Å; T228-S231 PolarHBondContact O-OG 3.29Å; T228-L232 WeakPolarHBondContact O-CG 3.35Å; T228-L232 PolarHBondContact O-N 3.49Å
229Q93.8Very high92.6Very high42 Ų4276.3 Ų76.320%0.19640%0.399CS..Hα-helixtrans-64.5-33.7176.3-65.4-61.8-47.300113.1L183 L187 E225 I226 E227 L232 R234L183-Q229 HydrophobicContact CD1-CG 4.36Å; L183-Q229 HydrophobicContact CD2-CG 4.06Å; L187-Q229 HydrophobicContact CD1-CB 3.46Å; L187-Q229 VanDerWaalsContact CD1-CB 3.46Å; L187-Q229 HydrophobicContact CD1-CG 4.07Å; E225-Q229 WeakPolarHBondContact O-CG 3.27Å; E225-Q229 PolarHBondContact O-N 3.01Å; E225-Q229 VanDerWaalsContact O-N 3.12Å; I226-Q229 WeakPolarHBondContact O-CB 3.32Å; I226-Q229 PolarHBondContact O-N 3.28Å; E227-Q229 VanDerWaalsContact C-N 3.34Å; E227-Q229 PolarHBondContact O-N 3.1Å; Q229-L232 PolarHBondContact O-N 2.75Å; Q229-R234 WeakPolarHBondContact O-CB 3.49Å; Q229-R234 PolarHBondContact O-N 3.39Å
230L93.1Very high92.5Very high47 Ų4776.7 Ų76.725%0.24640%0.396CS..Hα-helixtrans-67.3-42174.7-62.6-177.5000111.9L187 I226 E227 T228 L232 G233 R234 P236 W241L187-L230 HydrophobicContact CD2-CD2 3.71Å; I226-L230 HydrophobicContact CG2-CD1 4.42Å; I226-L230 WeakPolarHBondContact O-CG 3.44Å; I226-L230 PolarHBondContact O-N 3.47Å; E227-L230 WeakPolarHBondContact O-CB 3.45Å; E227-L230 PolarHBondContact O-N 2.98Å; E227-L230 VanDerWaalsContact O-N 3.16Å; T228-L230 VanDerWaalsContact C-N 3.3Å; T228-L230 PolarHBondContact O-N 3.24Å; L230-L232 PolarHBondContact O-N 3.23Å; L230-G233 PolarHBondContact O-N 2.76Å; L230-R234 WeakPolarHBondContact CD2-O 3.3Å; L230-P236 HydrophobicContact CD2-CB 4.24Å; L230-P236 HydrophobicContact CD2-CG 4.02Å; L230-W241 HydrophobicContact CD1-CZ2 4.07Å
231S93.3Very high92.5Very high95 Ų9574.6 Ų74.666%0.66437%0.373SS*.Hα-helixtrans-62.6-27.2175.372.70000113E227 T228 G233E227-S231 PolarHBondContact O-N 3.47Å; T228-S231 PolarHBondContact O-N 3Å; T228-S231 PolarHBondContact O-OG 3.29Å; S231-G233 PolarHBondContact O-N 3.02Å
232L93.1Very high92.5Very high124 Ų12477.1 Ų77.165%0.64939%0.386SS*.THydrogen-bonded Turntrans-77.89.1172.4-65.4173.2000113.3T228 Q229 L230T228-L232 WeakPolarHBondContact O-CG 3.35Å; T228-L232 PolarHBondContact O-N 3.49Å; Q229-L232 PolarHBondContact O-N 2.75Å; L230-L232 PolarHBondContact O-N 3.23Å
233G88.3Confident92.5Very high60 Ų6080.3 Ų80.362%0.61940%0.399SS*.THydrogen-bonded Turntrans87.65.6173.700000114.9L230 S231L230-G233 PolarHBondContact O-N 2.76Å; S231-G233 PolarHBondContact O-N 3.02Å
234R88.3Confident92.4Very high135 Ų13582.4 Ų82.451%0.50941%0.405SS..  trans-70.5143.3170.6-60.4-166.7178.9-164.32.9109.8L187 Q229 L230L187-R234 HydrophobicContact CD1-CB 4.32Å; L187-R234 HydrophobicContact CD2-CB 4.4Å; Q229-R234 WeakPolarHBondContact O-CB 3.49Å; Q229-R234 PolarHBondContact O-N 3.39Å; L230-R234 WeakPolarHBondContact CD2-O 3.3Å
235R89.4Confident92.4Very high216 Ų21673 Ų7382%0.81537%0.37SS*.  trans-108.9130.3178.8-64.6-172.1-179-169.2-0.1110
236P91.9Very high92.3Very high37 Ų3772 Ų7224%0.2437%0.369CS..  trans-75.2146.2176.533.9-30.8000109.4L186 L187 L230 I238L186-P236 WeakPolarHBondContact O-CA 3.33Å; L187-P236 HydrophobicContact CD2-CB 4.11Å; L230-P236 HydrophobicContact CD2-CB 4.24Å; L230-P236 HydrophobicContact CD2-CG 4.02Å; P236-I238 VanDerWaalsContact C-N 3.3Å; P236-I238 WeakPolarHBondContact CB-O 3.47Å
237I89.9Confident92.3Very high25 Ų2574.9 Ų74.913%0.12839%0.388CS..SBendtrans-70.5-34.1176.5-71.3169.9000111.2R158 L186 Y188 I203 Q204 A207R158-I237 VanDerWaalsContact NE-CD1 3.31Å; L186-I237 PolarHBondContact O-N 3.23Å; Y188-I237 WeakPolarHBondContact O-CD1 3.45Å; I203-I237 HydrophobicContact CG2-CG2 4.38Å; Q204-I237 HydrophobicContact CG-CG2 3.92Å; Q204-I237 PolarHBondContact NE2-O 2.82Å; A207-I237 HydrophobicContact CB-CG2 4.39Å
238I90.3Very high92.3Very high2 Ų270.9 Ų70.91%0.0137%0.371CS..SBendtrans-101.2117.7174.7-50.9163.5000107L186 A207 K208 P236 N240 W241 Y244L186-I238 HydrophobicContact CD2-CD1 4.16Å; A207-I238 HydrophobicContact CB-CD1 3.7Å; A207-I238 HydrophobicContact CB-CG1 3.94Å; K208-I238 HydrophobicContact CB-CD1 4.36Å; K208-I238 HydrophobicContact CG-CD1 3.64Å; K208-I238 HydrophobicContact CG-CG1 4.12Å; K208-I238 HydrophobicContact CG-CG2 4.42Å; P236-I238 VanDerWaalsContact C-N 3.3Å; P236-I238 WeakPolarHBondContact CB-O 3.47Å; I238-N240 WeakPolarHBondContact CG2-OD1 3.28Å; I238-W241 HydrophobicContact CB-CB 4.11Å; I238-W241 HydrophobicContact CG2-CB 4.41Å; I238-W241 WeakPolarHBondContact O-CB 3.41Å; I238-W241 PolarHBondContact O-N 2.88Å; I238-Y244 HydrophobicContact CG2-CD2 3.86Å; I238-Y244 HydrophobicContact CG2-CE2 3.61Å
239Q87.9Confident92.2Very high175 Ų17568.4 Ų68.482%0.81835%0.354SS*.THydrogen-bonded Turntrans-64.3-44.7-178.3-68.4-178.3-3.400111.5W241Q239-W241 VanDerWaalsContact C-N 3.33Å; Q239-W241 PolarHBondContact O-N 3.5Å
240N91.6Very high92.2Very high74 Ų7470.4 Ų70.440%0.39636%0.36SS..THydrogen-bonded Turntrans-9641.9178.167.2-41.9000112.4I238 L242 D243I238-N240 WeakPolarHBondContact CG2-OD1 3.28Å; N240-L242 PolarHBondContact O-N 3.3Å; N240-D243 WeakPolarHBondContact CB-OD2 3.42Å; N240-D243 PolarHBondContact ND2-OD2 3.39Å; N240-D243 WeakPolarHBondContact O-CB 3.46Å; N240-D243 PolarHBondContact O-N 3.39Å; N240-D243 VanDerWaalsContact O-N 3.08Å
241W93.5Very high92.1Very high23 Ų2375.8 Ų75.89%0.08738%0.382CS..G310 helixtrans-54.8-28.6-174.660.7-89.1000114.5L186 V223 I226 L230 I238 Q239 D243 Y244 I245L186-W241 HydrophobicContact CD1-CE3 4.23Å; L186-W241 HydrophobicContact CD2-CB 3.69Å; L186-W241 HydrophobicContact CD2-CG 4.47Å; V223-W241 HydrophobicContact CG1-CH2 4.07Å; V223-W241 HydrophobicContact CG2-CH2 4.24Å; V223-W241 HydrophobicContact CG2-CZ3 4.2Å; I226-W241 HydrophobicContact CB-CH2 3.82Å; I226-W241 HydrophobicContact CB-CZ2 4.32Å; I226-W241 HydrophobicContact CB-CZ3 4.19Å; I226-W241 HydrophobicContact CD1-CE3 4.15Å; I226-W241 HydrophobicContact CD1-CH2 4Å; I226-W241 HydrophobicContact CD1-CZ3 3.49Å; I226-W241 VanDerWaalsContact CD1-CZ3 3.49Å; I226-W241 HydrophobicContact CG1-CZ3 4.43Å; I226-W241 HydrophobicContact CG2-CD2 4.28Å; I226-W241 HydrophobicContact CG2-CE3 4.21Å; I226-W241 HydrophobicContact CG2-CH2 3.52Å; I226-W241 HydrophobicContact CG2-CZ2 3.6Å; I226-W241 HydrophobicContact CG2-CZ3 3.85Å; L230-W241 HydrophobicContact CD1-CZ2 4.07Å; I238-W241 HydrophobicContact CB-CB 4.11Å; I238-W241 HydrophobicContact CG2-CB 4.41Å; I238-W241 WeakPolarHBondContact O-CB 3.41Å; I238-W241 PolarHBondContact O-N 2.88Å; Q239-W241 VanDerWaalsContact C-N 3.33Å; Q239-W241 PolarHBondContact O-N 3.5Å; W241-D243 VanDerWaalsContact C-N 3.27Å; W241-D243 PolarHBondContact O-N 3.44Å; W241-Y244 PolarHBondContact O-N 3.42Å; W241-I245 HydrophobicContact CE3-CD1 3.82Å; W241-I245 HydrophobicContact CZ3-CD1 3.75Å
242L94.3Very high92.1Very high57 Ų5775 Ų7530%0.29837%0.37SS..G310 helixtrans-64.1-32.2-179.3-16964.7000112.1V223 N240 Y244 I245 Y250V223-L242 HydrophobicContact CG1-CD1 4.45Å; V223-L242 HydrophobicContact CG2-CD1 3.71Å; N240-L242 PolarHBondContact O-N 3.3Å; L242-Y244 PolarHBondContact O-N 2.74Å; L242-Y244 VanDerWaalsContact O-N 3.14Å; L242-I245 PolarHBondContact O-N 3.02Å; L242-Y250 HydrophobicContact CD1-CD1 4.46Å; L242-Y250 HydrophobicContact CD1-CD2 4.48Å; L242-Y250 HydrophobicContact CD1-CE1 3.93Å; L242-Y250 HydrophobicContact CD1-CE2 3.98Å
243D93.3Very high91.8Very high121 Ų12174.5 Ų74.565%0.64738%0.375SS*.G310 helixtrans-63.8-20.2179.1-60.9-14.9000112.7N240 W241N240-D243 WeakPolarHBondContact CB-OD2 3.42Å; N240-D243 PolarHBondContact ND2-OD2 3.39Å; N240-D243 WeakPolarHBondContact O-CB 3.46Å; N240-D243 PolarHBondContact O-N 3.39Å; N240-D243 VanDerWaalsContact O-N 3.08Å; W241-D243 VanDerWaalsContact C-N 3.27Å; W241-D243 PolarHBondContact O-N 3.44Å
244Y92.9Very high92Very high62 Ų6273 Ų7324%0.24335%0.354CS..G310 helixtrans-94.60.7-179.5-62.9-81.3000113K208 I238 W241 L242K208-Y244 HydrophobicContact CB-CD1 3.85Å; K208-Y244 HydrophobicContact CB-CE1 3.81Å; K208-Y244 HydrophobicContact CB-CG 4.43Å; K208-Y244 HydrophobicContact CD-CD1 4.38Å; K208-Y244 HydrophobicContact CD-CE1 3.55Å; K208-Y244 HydrophobicContact CD-CE2 4.07Å; K208-Y244 VanDerWaalsContact CD-OH 3.3Å; K208-Y244 WeakPolarHBondContact CD-OH 3.3Å; K208-Y244 VanDerWaalsContact CE-CZ 3.46Å; K208-Y244 WeakPolarHBondContact CE-OH 3.23Å; K208-Y244 HydrophobicContact CG-CD1 3.84Å; K208-Y244 HydrophobicContact CG-CD2 4.17Å; K208-Y244 HydrophobicContact CG-CE1 3.51Å; K208-Y244 HydrophobicContact CG-CE2 3.85Å; K208-Y244 HydrophobicContact CG-CG 4.16Å; K208-Y244 PolarHBondContact NZ-OH 2.68Å; I238-Y244 HydrophobicContact CG2-CD2 3.86Å; I238-Y244 HydrophobicContact CG2-CE2 3.61Å; W241-Y244 PolarHBondContact O-N 3.42Å; L242-Y244 PolarHBondContact O-N 2.74Å; L242-Y244 VanDerWaalsContact O-N 3.14Å
245I94.2Very high92.3Very high3 Ų370.4 Ų70.42%0.01535%0.348CS..SBendtrans-109.3119.4172.1-54.7179000107.5L211 I221 I226 W241 L242 R249 Y250L211-I245 HydrophobicContact CD1-CD1 4.3Å; L211-I245 HydrophobicContact CD1-CG1 4.05Å; L211-I245 HydrophobicContact CD2-CD1 4.4Å; L211-I245 HydrophobicContact CD2-CG1 3.81Å; L211-I245 HydrophobicContact CG-CG1 4.08Å; I221-I245 HydrophobicContact CB-CG2 4.35Å; I221-I245 HydrophobicContact CD1-CG2 4.1Å; I221-I245 HydrophobicContact CG2-CD1 4.03Å; I226-I245 HydrophobicContact CD1-CD1 4.1Å; W241-I245 HydrophobicContact CE3-CD1 3.82Å; W241-I245 HydrophobicContact CZ3-CD1 3.75Å; L242-I245 PolarHBondContact O-N 3.02Å; I245-R249 HydrophobicContact CG2-CB 3.96Å; I245-Y250 HydrophobicContact CB-CD1 4.28Å; I245-Y250 HydrophobicContact CB-CE1 4.38Å; I245-Y250 HydrophobicContact CG2-CD1 3.69Å; I245-Y250 HydrophobicContact CG2-CE1 4.24Å; I245-Y250 WeakPolarHBondContact O-CE1 3.33Å
246P94.5Very high92.5Very high42 Ų4266.3 Ų66.327%0.27334%0.342SS..  trans-57135.3175.5-23.733000111.1T248 R249 Y250P246-T248 PolarHBondContact O-N 3.13Å; P246-T248 VanDerWaalsContact O-N 3.07Å; P246-R249 HydrophobicContact CB-CG 4.12Å; P246-R249 HydrophobicContact CG-CG 4.27Å; P246-R249 WeakPolarHBondContact O-CB 3.41Å; P246-R249 PolarHBondContact O-N 3.06Å; P246-Y250 WeakPolarHBondContact O-CD1 3.45Å
247P94.3Very high92.6Very high60 Ų6069 Ų6939%0.3936%0.357SS..G310 helixtrans-51.6-33.1177.7-30.736.9000114R249 Y250 K251 D252P247-R249 PolarHBondContact O-N 3.48Å; P247-R249 VanDerWaalsContact O-N 3.07Å; P247-Y250 VanDerWaalsContact CA-CE1 3.44Å; P247-Y250 HydrophobicContact CB-CE1 4.41Å; P247-Y250 PolarHBondContact O-N 3Å; P247-Y250 VanDerWaalsContact O-N 3.12Å; P247-K251 PolarHBondContact O-N 3.32Å; P247-D252 VanDerWaalsContact CB-OD2 3.25Å; P247-D252 WeakPolarHBondContact CB-OD2 3.23Å; P247-D252 PolarHBondContact O-N 3.38Å
248T94Very high92.9Very high23 Ų2368.1 Ų68.114%0.14135%0.353CS..G310 helixtrans-68.21.417555.20000114.6P246 D252 P253 C254 E255P246-T248 PolarHBondContact O-N 3.13Å; P246-T248 VanDerWaalsContact O-N 3.07Å; T248-D252 CarbonylContact C-O 3.46Å; T248-D252 WeakPolarHBondContact CA-O 3.29Å; T248-D252 HydrophobicContact CG2-CB 4.14Å; T248-P253 WeakPolarHBondContact CG2-O 3.35Å; T248-C254 WeakPolarHBondContact O-CA 3.26Å; T248-E255 VanDerWaalsContact CB-CD 3.48Å; T248-E255 VanDerWaalsContact CB-OE1 3.28Å; T248-E255 WeakPolarHBondContact CB-OE1 3.43Å; T248-E255 HydrophobicContact CG2-CG 4.08Å; T248-E255 VanDerWaalsContact CG2-OE1 3.22Å; T248-E255 WeakPolarHBondContact CG2-OE1 3.42Å; T248-E255 PolarHBondContact OG1-OE1 2.97Å; T248-E255 PolarHBondContact OG1-OE2 3.16Å; T248-E255 VanDerWaalsContact OG1-OE2 3.11Å
249R94.8Very high93.1Very high14 Ų1471.6 Ų71.65%0.05337%0.371CS..G310 helixtrans-106.3-11.5172.3-58.8-66.1169.5-79.4-7.6113S215 L218 S219 A220 I221 I245 P246 P247 C254 E255 H258S215-R249 PolarHBondContact O-NE 3.38Å; S215-R249 VanDerWaalsContact O-NE 3.1Å; L218-R249 VanDerWaalsContact O-CD 3.25Å; L218-R249 WeakPolarHBondContact O-CD 3.43Å; L218-R249 PolarHBondContact O-NE 3.24Å; S219-R249 WeakPolarHBondContact O-CD 3.4Å; A220-R249 CarbonylContact C-O 3.48Å; A220-R249 WeakPolarHBondContact CA-O 3.36Å; I221-R249 HydrophobicContact CG1-CB 4.48Å; I221-R249 PolarHBondContact N-O 3.14Å; I245-R249 HydrophobicContact CG2-CB 3.96Å; P246-R249 HydrophobicContact CB-CG 4.12Å; P246-R249 HydrophobicContact CG-CG 4.27Å; P246-R249 WeakPolarHBondContact O-CB 3.41Å; P246-R249 PolarHBondContact O-N 3.06Å; P247-R249 PolarHBondContact O-N 3.48Å; P247-R249 VanDerWaalsContact O-N 3.07Å; R249-C254 PolarHBondContact NH1-SG 2.82Å; R249-E255 IonicContact CZ-OE2 3.89Å; R249-E255 IonicContact NH1-OE2 3.27Å; R249-E255 PolarHBondContact NH1-OE2 3.18Å; R249-E255 IonicContact NH2-OE2 3.73Å; R249-E255 PolarHBondContact NH2-OE2 3.02Å; R249-H258 VanDerWaalsContact CZ-CG 3.49Å; R249-H258 PolarHBondContact NE-CE1 3.45Å; R249-H258 PolarHBondContact NE-NE2 2.9Å; R249-H258 VanDerWaalsContact NE-NE2 3.12Å; R249-H258 VanDerWaalsContact NH2-CB 3.27Å; R249-H258 PolarHBondContact NH2-CD2 3.4Å; R249-H258 VanDerWaalsContact NH2-CD2 3.31Å; R249-H258 PolarHBondContact NH2-CE1 2.96Å; R249-H258 VanDerWaalsContact NH2-CE1 3.35Å; R249-H258 PolarHBondContact NH2-ND1 2.97Å
250Y93.6Very high93.5Very high83 Ų8366.2 Ų66.233%0.32535%0.351SS..THydrogen-bonded Turntrans-142.9-17.4-176.171.1-92.6000115.7I221 V223 L242 I245 P246 P247I221-Y250 WeakPolarHBondContact O-CB 3.22Å; V223-Y250 HydrophobicContact CB-CD2 4.35Å; V223-Y250 HydrophobicContact CG2-CD1 4.2Å; V223-Y250 HydrophobicContact CG2-CD2 3.62Å; V223-Y250 HydrophobicContact CG2-CE2 4.35Å; V223-Y250 HydrophobicContact CG2-CG 3.53Å; L242-Y250 HydrophobicContact CD1-CD1 4.46Å; L242-Y250 HydrophobicContact CD1-CD2 4.48Å; L242-Y250 HydrophobicContact CD1-CE1 3.93Å; L242-Y250 HydrophobicContact CD1-CE2 3.98Å; I245-Y250 HydrophobicContact CB-CD1 4.28Å; I245-Y250 HydrophobicContact CB-CE1 4.38Å; I245-Y250 HydrophobicContact CG2-CD1 3.69Å; I245-Y250 HydrophobicContact CG2-CE1 4.24Å; I245-Y250 WeakPolarHBondContact O-CE1 3.33Å; P246-Y250 WeakPolarHBondContact O-CD1 3.45Å; P247-Y250 VanDerWaalsContact CA-CE1 3.44Å; P247-Y250 HydrophobicContact CB-CE1 4.41Å; P247-Y250 PolarHBondContact O-N 3Å; P247-Y250 VanDerWaalsContact O-N 3.12Å
251K91.8Very high93.7Very high160 Ų16063.2 Ų63.270%0.69634%0.335SS*.THydrogen-bonded Turntrans-127.9-54.1-176.1-178-175.4176.9-173.30111.7P247P247-K251 PolarHBondContact O-N 3.32Å
252D91.4Very high93.8Very high78 Ų7863.9 Ų63.942%0.41734%0.339SS..SBendtrans-94.6158.7-174.8-55.8-44.8000110.9P247 T248P247-D252 VanDerWaalsContact CB-OD2 3.25Å; P247-D252 WeakPolarHBondContact CB-OD2 3.23Å; P247-D252 PolarHBondContact O-N 3.38Å; T248-D252 CarbonylContact C-O 3.46Å; T248-D252 WeakPolarHBondContact CA-O 3.29Å; T248-D252 HydrophobicContact CG2-CB 4.14Å
253P88.8Confident93.9Very high115 Ų11565.8 Ų65.875%0.74735%0.353SS*.PPolyproline II helixtrans-55.6141.9171.2-2434.1000111.8T248T248-P253 WeakPolarHBondContact CG2-O 3.35Å
254C92.3Very high94.1Very high28 Ų2863.1 Ų63.119%0.18934%0.339CS..PPolyproline II helixtrans-64.1139.8179.6-167.40000111.4T248 R249 L256 H258 L259T248-C254 WeakPolarHBondContact O-CA 3.26Å; R249-C254 PolarHBondContact NH1-SG 2.82Å; C254-L256 PolarHBondContact O-N 2.93Å; C254-H258 PolarHBondContact SG-CD2 3.17Å; C254-L259 HydrophobicContact CB-CD1 4.45Å; C254-L259 HydrophobicContact CB-CD2 3.85Å; C254-L259 HydrophobicContact CB-CG 4.01Å
255E93.8Very high94.3Very high80 Ų8060.3 Ų60.337%0.37433%0.328SS..PPolyproline II helixtrans-63.1139.6179.4-52.490.1165.700110.7T248 R249 V257 H258 L259T248-E255 VanDerWaalsContact CB-CD 3.48Å; T248-E255 VanDerWaalsContact CB-OE1 3.28Å; T248-E255 WeakPolarHBondContact CB-OE1 3.43Å; T248-E255 HydrophobicContact CG2-CG 4.08Å; T248-E255 VanDerWaalsContact CG2-OE1 3.22Å; T248-E255 WeakPolarHBondContact CG2-OE1 3.42Å; T248-E255 PolarHBondContact OG1-OE1 2.97Å; T248-E255 PolarHBondContact OG1-OE2 3.16Å; T248-E255 VanDerWaalsContact OG1-OE2 3.11Å; R249-E255 IonicContact CZ-OE2 3.89Å; R249-E255 IonicContact NH1-OE2 3.27Å; R249-E255 PolarHBondContact NH1-OE2 3.18Å; R249-E255 IonicContact NH2-OE2 3.73Å; R249-E255 PolarHBondContact NH2-OE2 3.02Å; E255-V257 PolarHBondContact O-N 3.21Å; E255-V257 VanDerWaalsContact O-N 3.13Å; E255-H258 WeakPolarHBondContact O-CA 3.37Å; E255-H258 WeakPolarHBondContact O-CB 3.46Å; E255-H258 PolarHBondContact O-N 3.01Å; E255-L259 PolarHBondContact O-N 2.88Å
256L94.4Very high94.4Very high131 Ų13163.6 Ų63.669%0.68635%0.348SS*.Hα-helixtrans-52.5-40.2177.8-179.861.4000112C254 H258 L259 C260C254-L256 PolarHBondContact O-N 2.93Å; L256-H258 VanDerWaalsContact C-N 3.28Å; L256-H258 PolarHBondContact O-N 3.45Å; L256-L259 PolarHBondContact O-N 3.25Å; L256-C260 WeakPolarHBondContact O-CB 3.32Å; L256-C260 PolarHBondContact O-N 3.5Å; L256-C260 PolarHBondContact O-SG 3.06Å
257V93.9Very high94.5Very high94 Ų9467.3 Ų67.357%0.5736%0.362SS*.Hα-helixtrans-59.7-38.4177.9175.70000111.9E255 R261 F290E255-V257 PolarHBondContact O-N 3.21Å; E255-V257 VanDerWaalsContact O-N 3.13Å; V257-R261 PolarHBondContact O-N 3.49Å; V257-R261 VanDerWaalsContact O-N 3.08Å; V257-F290 HydrophobicContact CG1-CE1 3.93Å; V257-F290 HydrophobicContact CG1-CE2 4.19Å; V257-F290 HydrophobicContact CG1-CZ 3.54Å
258H94.9Very high94.5Very high6 Ų664.9 Ų64.93%0.02835%0.345CS..Hα-helixtrans-77.1-38.2177.1-172.387.2000112.3S215 R216 L218 R249 C254 E255 L256 C260 R261 I262S215-H258 PolarHBondContact O-CE1 3.46Å; S215-H258 VanDerWaalsContact O-CE1 3.23Å; R216-H258 VanDerWaalsContact C-CE1 3.46Å; R216-H258 PolarHBondContact O-CE1 3.41Å; L218-H258 PolarHBondContact O-NE2 2.87Å; R249-H258 VanDerWaalsContact CZ-CG 3.49Å; R249-H258 PolarHBondContact NE-CE1 3.45Å; R249-H258 PolarHBondContact NE-NE2 2.9Å; R249-H258 VanDerWaalsContact NE-NE2 3.12Å; R249-H258 VanDerWaalsContact NH2-CB 3.27Å; R249-H258 PolarHBondContact NH2-CD2 3.4Å; R249-H258 VanDerWaalsContact NH2-CD2 3.31Å; R249-H258 PolarHBondContact NH2-CE1 2.96Å; R249-H258 VanDerWaalsContact NH2-CE1 3.35Å; R249-H258 PolarHBondContact NH2-ND1 2.97Å; C254-H258 PolarHBondContact SG-CD2 3.17Å; E255-H258 WeakPolarHBondContact O-CA 3.37Å; E255-H258 WeakPolarHBondContact O-CB 3.46Å; E255-H258 PolarHBondContact O-N 3.01Å; L256-H258 VanDerWaalsContact C-N 3.28Å; L256-H258 PolarHBondContact O-N 3.45Å; H258-C260 VanDerWaalsContact C-N 3.29Å; H258-C260 PolarHBondContact O-N 3.48Å; H258-R261 VanDerWaalsContact O-CB 3.3Å; H258-R261 WeakPolarHBondContact O-CB 3.42Å; H258-R261 PolarHBondContact O-N 3.13Å; H258-R261 VanDerWaalsContact O-N 3.12Å; H258-I262 VanDerWaalsContact CD2-CD1 3.45Å; H258-I262 WeakPolarHBondContact CD2-CD1 3.48Å; H258-I262 VanDerWaalsContact NE2-CD1 3.32Å; H258-I262 WeakPolarHBondContact NE2-CD1 3.36Å; H258-I262 WeakPolarHBondContact O-CG1 2.99Å; H258-I262 PolarHBondContact O-N 3.31Å
259L95.3Very high94.6Very high75 Ų7564.5 Ų64.539%0.39334%0.342SS..Hα-helixtrans-57.5-45.2171.4-67.7176.5000110.6C254 E255 L256 R261 I262 T263C254-L259 HydrophobicContact CB-CD1 4.45Å; C254-L259 HydrophobicContact CB-CD2 3.85Å; C254-L259 HydrophobicContact CB-CG 4.01Å; E255-L259 PolarHBondContact O-N 2.88Å; L256-L259 PolarHBondContact O-N 3.25Å; L259-R261 PolarHBondContact O-N 2.89Å; L259-I262 PolarHBondContact O-N 2.76Å; L259-T263 WeakPolarHBondContact O-CB 3.12Å; L259-T263 PolarHBondContact O-N 3.33Å; L259-T263 PolarHBondContact O-OG1 2.85Å
260C95.4Very high94.5Very high61 Ų6167 Ų6741%0.41237%0.366SS..Hα-helixtrans-58.8-43.4173.4-68.50000112.3L256 H258 I262 T263 I264L256-C260 WeakPolarHBondContact O-CB 3.32Å; L256-C260 PolarHBondContact O-N 3.5Å; L256-C260 PolarHBondContact O-SG 3.06Å; H258-C260 VanDerWaalsContact C-N 3.29Å; H258-C260 PolarHBondContact O-N 3.48Å; C260-I262 PolarHBondContact O-N 3.19Å; C260-T263 PolarHBondContact O-N 3.4Å; C260-I264 WeakPolarHBondContact O-CB 3.18Å; C260-I264 VanDerWaalsContact O-CG1 3.25Å; C260-I264 WeakPolarHBondContact O-CG1 3.28Å; C260-I264 PolarHBondContact O-N 3.31Å
261R96.1Very high94.4Very high12 Ų1267.2 Ų67.25%0.04537%0.373CS..Hα-helixtrans-54.7-53.1174.2-177.9-171.6-87.3167.6-12.8110.8R216 V257 H258 L259 I264 R265 F290 L291R216-R261 VanDerWaalsContact O-CD 3.27Å; R216-R261 WeakPolarHBondContact O-CD 3.44Å; R216-R261 PolarHBondContact O-NH1 2.63Å; V257-R261 PolarHBondContact O-N 3.49Å; V257-R261 VanDerWaalsContact O-N 3.08Å; H258-R261 VanDerWaalsContact O-CB 3.3Å; H258-R261 WeakPolarHBondContact O-CB 3.42Å; H258-R261 PolarHBondContact O-N 3.13Å; H258-R261 VanDerWaalsContact O-N 3.12Å; L259-R261 PolarHBondContact O-N 2.89Å; R261-I264 PolarHBondContact O-N 2.91Å; R261-R265 HydrophobicContact CG-CG 4.38Å; R261-R265 VanDerWaalsContact O-CB 3.31Å; R261-R265 WeakPolarHBondContact O-CB 3.28Å; R261-R265 VanDerWaalsContact O-CG 3.27Å; R261-R265 WeakPolarHBondContact O-CG 3.3Å; R261-R265 PolarHBondContact O-N 3.03Å; R261-F290 HydrophobicContact CB-CE1 3.7Å; R261-F290 HydrophobicContact CB-CZ 4.18Å; R261-F290 HydrophobicContact CG-CE1 4.08Å; R261-F290 VanDerWaalsContact CZ-O 3.25Å; R261-F290 VanDerWaalsContact NE-CE1 3.34Å; R261-F290 VanDerWaalsContact NE-CZ 3.28Å; R261-F290 PolarHBondContact NE-O 3Å; R261-F290 PolarHBondContact NH2-O 3.06Å; R261-L291 HydrophobicContact CB-CD2 4.35Å; R261-L291 HydrophobicContact CG-CD2 4.09Å
262I95.6Very high94.4Very high36 Ų3661 Ų6119%0.18535%0.347CS..Hα-helixtrans-61.5-47.6-177.6-69.2-179.5000110.1S219 H258 L259 C260 I264 R265 T266S219-I262 VanDerWaalsContact CA-CD1 3.48Å; H258-I262 VanDerWaalsContact CD2-CD1 3.45Å; H258-I262 WeakPolarHBondContact CD2-CD1 3.48Å; H258-I262 VanDerWaalsContact NE2-CD1 3.32Å; H258-I262 WeakPolarHBondContact NE2-CD1 3.36Å; H258-I262 WeakPolarHBondContact O-CG1 2.99Å; H258-I262 PolarHBondContact O-N 3.31Å; L259-I262 PolarHBondContact O-N 2.76Å; C260-I262 PolarHBondContact O-N 3.19Å; I262-I264 PolarHBondContact O-N 2.93Å; I262-R265 PolarHBondContact O-N 3.06Å; I262-T266 VanDerWaalsContact O-CB 3.23Å; I262-T266 WeakPolarHBondContact O-CB 3.46Å; I262-T266 PolarHBondContact O-N 3.08Å; I262-T266 PolarHBondContact O-OG1 3.3Å
263T96.5Very high94.6Very high97 Ų9761 Ų6160%0.59535%0.346SS*.Hα-helixtrans-60.5-47.9-179.2-59.30000111.6L259 C260 T266 Q267L259-T263 WeakPolarHBondContact O-CB 3.12Å; L259-T263 PolarHBondContact O-N 3.33Å; L259-T263 PolarHBondContact O-OG1 2.85Å; C260-T263 PolarHBondContact O-N 3.4Å; T263-T266 PolarHBondContact O-N 3.44Å; T263-Q267 PolarHBondContact O-N 3.23Å
264I97.1Very high94.9Very high65 Ų6556 Ų5633%0.33331%0.312SS..Hα-helixtrans-63.3-48.4178.6-66.6166.1000110.5C260 R261 I262 T266 Q267 L268 L281 L291C260-I264 WeakPolarHBondContact O-CB 3.18Å; C260-I264 VanDerWaalsContact O-CG1 3.25Å; C260-I264 WeakPolarHBondContact O-CG1 3.28Å; C260-I264 PolarHBondContact O-N 3.31Å; R261-I264 PolarHBondContact O-N 2.91Å; I262-I264 PolarHBondContact O-N 2.93Å; I264-T266 VanDerWaalsContact C-N 3.33Å; I264-T266 PolarHBondContact O-N 3.15Å; I264-Q267 PolarHBondContact O-N 3.2Å; I264-L268 HydrophobicContact CG2-CD1 4.2Å; I264-L268 WeakPolarHBondContact O-CG 3.35Å; I264-L268 PolarHBondContact O-N 3.25Å; I264-L281 HydrophobicContact CG2-CD1 3.94Å; I264-L291 HydrophobicContact CB-CD2 4.03Å; I264-L291 HydrophobicContact CD1-CD2 4.24Å; I264-L291 HydrophobicContact CG2-CD1 3.95Å; I264-L291 HydrophobicContact CG2-CD2 3.98Å
265R97.4Very high95Very high3 Ų354.9 Ų54.91%0.01131%0.305CS..Hα-helixtrans-61-41.8178.6-74.3177.162.5776.1111.9L167 E173 R261 I262 Q267 L268 L269 L274 L291L167-R265 PolarHBondContact O-NH2 3.02Å; E173-R265 IonicContact OE1-CZ 3.16Å; E173-R265 VanDerWaalsContact OE1-CZ 3.27Å; E173-R265 IonicContact OE1-NE 3.33Å; E173-R265 PolarHBondContact OE1-NE 2.67Å; E173-R265 IonicContact OE1-NH2 2.75Å; E173-R265 PolarHBondContact OE1-NH2 3.35Å; E173-R265 IonicContact OE2-NH2 2.92Å; R261-R265 HydrophobicContact CG-CG 4.38Å; R261-R265 VanDerWaalsContact O-CB 3.31Å; R261-R265 WeakPolarHBondContact O-CB 3.28Å; R261-R265 VanDerWaalsContact O-CG 3.27Å; R261-R265 WeakPolarHBondContact O-CG 3.3Å; R261-R265 PolarHBondContact O-N 3.03Å; I262-R265 PolarHBondContact O-N 3.06Å; R265-Q267 VanDerWaalsContact C-N 3.32Å; R265-Q267 PolarHBondContact O-N 3.07Å; R265-L268 PolarHBondContact O-N 2.82Å; R265-L269 WeakPolarHBondContact O-CB 3.27Å; R265-L269 PolarHBondContact O-N 3.35Å; R265-L274 HydrophobicContact CB-CD1 4.27Å; R265-L291 WeakPolarHBondContact CD-O 3.24Å; R265-L291 HydrophobicContact CG-CD2 4.42Å; R265-L291 PolarHBondContact NH1-O 3.35Å
266T95.9Very high95Very high72 Ų7254.9 Ų54.944%0.44231%0.308SS..Hα-helixtrans-60.8-42.9176.8-60.40000111I262 T263 I264 L269 A270I262-T266 VanDerWaalsContact O-CB 3.23Å; I262-T266 WeakPolarHBondContact O-CB 3.46Å; I262-T266 PolarHBondContact O-N 3.08Å; I262-T266 PolarHBondContact O-OG1 3.3Å; T263-T266 PolarHBondContact O-N 3.44Å; I264-T266 VanDerWaalsContact C-N 3.33Å; I264-T266 PolarHBondContact O-N 3.15Å; T266-L269 WeakPolarHBondContact O-CB 3.25Å; T266-L269 PolarHBondContact O-N 2.91Å; T266-A270 WeakPolarHBondContact O-CB 3.43Å; T266-A270 PolarHBondContact O-N 3.26Å
267Q96.4Very high95.1Very high121 Ų12149 Ų4957%0.56528%0.278SS*.Hα-helixtrans-64.3-43.9176.3-174.362.216.700111.8T263 I264 R265 L269 N271T263-Q267 PolarHBondContact O-N 3.23Å; I264-Q267 PolarHBondContact O-N 3.2Å; R265-Q267 VanDerWaalsContact C-N 3.32Å; R265-Q267 PolarHBondContact O-N 3.07Å; Q267-L269 VanDerWaalsContact C-N 3.33Å; Q267-L269 PolarHBondContact O-N 2.86Å; Q267-N271 PolarHBondContact NE2-ND2 2.92Å; Q267-N271 PolarHBondContact O-N 3.12Å; Q267-N271 PolarHBondContact O-ND2 3.22Å
268L96.1Very high95.2Very high8 Ų844.5 Ų44.54%0.04225%0.251CS..Hα-helixtrans-63.8-40.4175.3-66.7176.5000111.5I264 R265 N271 N272 M273 L274 I278 L281I264-L268 HydrophobicContact CG2-CD1 4.2Å; I264-L268 WeakPolarHBondContact O-CG 3.35Å; I264-L268 PolarHBondContact O-N 3.25Å; R265-L268 PolarHBondContact O-N 2.82Å; L268-N271 CarbonylContact O-C 3.59Å; L268-N271 PolarHBondContact O-N 3.19Å; L268-N272 PolarHBondContact O-N 3.16Å; L268-M273 HydrophobicContact CB-CB 4.31Å; L268-M273 HydrophobicContact CD2-CB 4.14Å; L268-M273 HydrophobicContact CD2-CE 3.56Å; L268-M273 PolarHBondContact O-N 3.04Å; L268-L274 HydrophobicContact CB-CD2 3.65Å; L268-L274 HydrophobicContact CB-CG 3.8Å; L268-L274 HydrophobicContact CD1-CD2 3.68Å; L268-L274 HydrophobicContact CG-CD2 4.34Å; L268-I278 HydrophobicContact CD1-CB 4.36Å; L268-I278 HydrophobicContact CD1-CG1 3.47Å; L268-I278 VanDerWaalsContact CD1-CG1 3.47Å; L268-L281 HydrophobicContact CD1-CD1 4.29Å; L268-L281 HydrophobicContact CD2-CD2 4.5Å
269L94.6Very high95.2Very high15 Ų1548.8 Ų48.88%0.07927%0.27CS..Hα-helixtrans-64-43.4179.3-174.866.5000112.1Q123 E173 R174 R265 T266 Q267 N271 N272 L274Q123-L269 PolarHBondContact NE2-O 2.9Å; Q123-L269 VanDerWaalsContact NE2-O 3.15Å; E173-L269 HydrophobicContact CB-CD2 3.61Å; R174-L269 HydrophobicContact CG-CD1 4.21Å; R174-L269 HydrophobicContact CG-CD2 4.05Å; R174-L269 HydrophobicContact CG-CG 4.41Å; R174-L269 VanDerWaalsContact NE-CD1 3.28Å; R174-L269 PolarHBondContact NH2-O 3.36Å; R265-L269 WeakPolarHBondContact O-CB 3.27Å; R265-L269 PolarHBondContact O-N 3.35Å; T266-L269 WeakPolarHBondContact O-CB 3.25Å; T266-L269 PolarHBondContact O-N 2.91Å; Q267-L269 VanDerWaalsContact C-N 3.33Å; Q267-L269 PolarHBondContact O-N 2.86Å; L269-N271 PolarHBondContact O-N 3.48Å; L269-N272 PolarHBondContact O-N 2.91Å; L269-L274 HydrophobicContact CB-CD1 3.97Å; L269-L274 HydrophobicContact CB-CG 4.47Å; L269-L274 HydrophobicContact CD1-CD1 4.13Å
270A93Very high95.2Very high67 Ų6749.2 Ų49.255%0.55428%0.279SS*.Hα-helixtrans-58.1-33.717600000111.8T266T266-A270 WeakPolarHBondContact O-CB 3.43Å; T266-A270 PolarHBondContact O-N 3.26Å
271N92.3Very high95.2Very high87 Ų8748.8 Ų48.847%0.46527%0.272SS..THydrogen-bonded Turntrans-9411.3178.2-64.7-67.7000113.9Q267 L268 L269 M273Q267-N271 PolarHBondContact NE2-ND2 2.92Å; Q267-N271 PolarHBondContact O-N 3.12Å; Q267-N271 PolarHBondContact O-ND2 3.22Å; L268-N271 CarbonylContact O-C 3.59Å; L268-N271 PolarHBondContact O-N 3.19Å; L269-N271 PolarHBondContact O-N 3.48Å; N271-M273 HydrophobicContact CB-CE 3.69Å; N271-M273 HydrophobicContact CB-CG 3.88Å; N271-M273 HydrophobicContact CB-SD 4.38Å; N271-M273 WeakPolarHBondContact O-CG 3.3Å; N271-M273 PolarHBondContact O-N 3.04Å
272N91.4Very high95.1Very high31 Ų3157 Ų5717%0.16632%0.316CS..THydrogen-bonded Turntrans53.733.1-176.5-155.243.6000114.8K119 D120 L268 L269K119-N272 PolarHBondContact O-ND2 3.39Å; K119-N272 PolarHBondContact O-OD1 2.77Å; D120-N272 WeakPolarHBondContact CA-ND2 3.39Å; D120-N272 PolarHBondContact OD1-ND2 3.47Å; D120-N272 VanDerWaalsContact OD1-ND2 3.15Å; L268-N272 PolarHBondContact O-N 3.16Å; L269-N272 PolarHBondContact O-N 2.91Å
273M94.5Very high95.1Very high78 Ų7857.9 Ų57.938%0.38432%0.321SS..  trans-97.2-11.5-175.3-64.5-161.4-75.500113.4L268 N271 P275 N276 G277L268-M273 HydrophobicContact CB-CB 4.31Å; L268-M273 HydrophobicContact CD2-CB 4.14Å; L268-M273 HydrophobicContact CD2-CE 3.56Å; L268-M273 PolarHBondContact O-N 3.04Å; N271-M273 HydrophobicContact CB-CE 3.69Å; N271-M273 HydrophobicContact CB-CG 3.88Å; N271-M273 HydrophobicContact CB-SD 4.38Å; N271-M273 WeakPolarHBondContact O-CG 3.3Å; N271-M273 PolarHBondContact O-N 3.04Å; M273-P275 CarbonylContact O-C 3.48Å; M273-N276 PolarHBondContact O-N 3.03Å; M273-G277 WeakPolarHBondContact O-CA 3.09Å; M273-G277 PolarHBondContact O-N 3.03Å
274L95.3Very high95.1Very high8 Ų857.4 Ų57.44%0.04232%0.319CS..THydrogen-bonded Turntrans-72.3144.6177.6-72.3-174.4000112.9R265 L268 L269 I278R265-L274 HydrophobicContact CB-CD1 4.27Å; L268-L274 HydrophobicContact CB-CD2 3.65Å; L268-L274 HydrophobicContact CB-CG 3.8Å; L268-L274 HydrophobicContact CD1-CD2 3.68Å; L268-L274 HydrophobicContact CG-CD2 4.34Å; L269-L274 HydrophobicContact CB-CD1 3.97Å; L269-L274 HydrophobicContact CB-CG 4.47Å; L269-L274 HydrophobicContact CD1-CD1 4.13Å; L274-I278 HydrophobicContact CD2-CD1 3.6Å; L274-I278 HydrophobicContact CD2-CG1 3.66Å
275P95.4Very high95Very high5 Ų557.2 Ų57.23%0.03233%0.327CS..THydrogen-bonded Turncis-81.1-22-10.831.3-33.4000113.3Q168 Y169 M273 G277 I278 N292Q168-P275 HydrophobicContact CB-CB 4.28Å; Y169-P275 HydrophobicContact CD2-CG 4.18Å; Y169-P275 HydrophobicContact CE2-CG 3.89Å; M273-P275 CarbonylContact O-C 3.48Å; P275-G277 VanDerWaalsContact C-N 3.28Å; P275-G277 PolarHBondContact O-N 3.48Å; P275-G277 VanDerWaalsContact O-N 3.11Å; P275-I278 VanDerWaalsContact O-CB 3.25Å; P275-I278 WeakPolarHBondContact O-CB 3.43Å; P275-I278 WeakPolarHBondContact O-CG1 3.31Å; P275-I278 PolarHBondContact O-N 2.96Å; P275-N292 WeakPolarHBondContact CB-OD1 3.46Å
276N94.1Very high94.8Very high81 Ų8167.3 Ų67.343%0.43337%0.365SS..Hα-helixtrans-55.9-36.3-166.7-65.4-17000114.9M273 I278 F279M273-N276 PolarHBondContact O-N 3.03Å; N276-I278 PolarHBondContact O-N 3.48Å; N276-F279 PolarHBondContact O-N 3.26Å
277G94.9Very high94.7Very high6 Ų668.1 Ų68.16%0.06237%0.367CS..Hα-helixtrans-67.3-14.8178.600000114.2M273 P275 F279 S280 L281M273-G277 WeakPolarHBondContact O-CA 3.09Å; M273-G277 PolarHBondContact O-N 3.03Å; P275-G277 VanDerWaalsContact C-N 3.28Å; P275-G277 PolarHBondContact O-N 3.48Å; P275-G277 VanDerWaalsContact O-N 3.11Å; G277-F279 VanDerWaalsContact C-N 3.3Å; G277-S280 WeakPolarHBondContact CA-OG 3.27Å; G277-S280 PolarHBondContact O-N 2.97Å; G277-S280 PolarHBondContact O-OG 2.91Å; G277-L281 WeakPolarHBondContact O-CG 3.43Å
278I96.9Very high94.7Very high0 Ų063.9 Ų63.90%035%0.347CS..Hα-helixtrans-63.2-43168.1-65171.3000109.6L268 L274 P275 N276 S280 L281 Q288 L291 N292L268-I278 HydrophobicContact CD1-CB 4.36Å; L268-I278 HydrophobicContact CD1-CG1 3.47Å; L268-I278 VanDerWaalsContact CD1-CG1 3.47Å; L274-I278 HydrophobicContact CD2-CD1 3.6Å; L274-I278 HydrophobicContact CD2-CG1 3.66Å; P275-I278 VanDerWaalsContact O-CB 3.25Å; P275-I278 WeakPolarHBondContact O-CB 3.43Å; P275-I278 WeakPolarHBondContact O-CG1 3.31Å; P275-I278 PolarHBondContact O-N 2.96Å; N276-I278 PolarHBondContact O-N 3.48Å; I278-S280 VanDerWaalsContact C-N 3.26Å; I278-S280 PolarHBondContact O-N 3.1Å; I278-L281 VanDerWaalsContact O-CB 3.31Å; I278-L281 WeakPolarHBondContact O-CB 3.44Å; I278-L281 WeakPolarHBondContact O-CG 3.41Å; I278-L281 PolarHBondContact O-N 3.06Å; I278-L281 VanDerWaalsContact O-N 3.16Å; I278-Q288 HydrophobicContact CG2-CB 3.93Å; I278-Q288 HydrophobicContact CG2-CG 4.36Å; I278-Q288 WeakPolarHBondContact CG2-O 3.3Å; I278-L291 HydrophobicContact CD1-CB 4.02Å; I278-L291 HydrophobicContact CG1-CB 4.28Å; I278-L291 HydrophobicContact CG2-CB 3.77Å; I278-L291 HydrophobicContact CG2-CD1 4.13Å; I278-N292 HydrophobicContact CD1-CB 3.98Å
279F95.5Very high94.7Very high97 Ų9766.6 Ų66.643%0.42536%0.361SS..Hα-helixtrans-76.8-13.8-176.6-57.9-72.8000113.1N276 G277 Q288 N292N276-F279 PolarHBondContact O-N 3.26Å; G277-F279 VanDerWaalsContact C-N 3.3Å; F279-Q288 HydrophobicContact CD1-CB 4.29Å; F279-Q288 HydrophobicContact CE1-CB 4.44Å; F279-Q288 PolarHBondContact O-NE2 3.04Å; F279-N292 HydrophobicContact CZ-CB 4.2Å
280S95.4Very high94.8Very high84 Ų8468.1 Ų68.159%0.58737%0.367SS*.THydrogen-bonded Turntrans-86.1-6.3169.766.50000113.4G277 I278G277-S280 WeakPolarHBondContact CA-OG 3.27Å; G277-S280 PolarHBondContact O-N 2.97Å; G277-S280 PolarHBondContact O-OG 2.91Å; I278-S280 VanDerWaalsContact C-N 3.26Å; I278-S280 PolarHBondContact O-N 3.1Å
281L94.1Very high95Very high52 Ų5265.1 Ų65.127%0.27234%0.342SS..SBendtrans-72.2133.3174-61.1177.6000110.1I264 L268 G277 I278 I283 Q288 L291I264-L281 HydrophobicContact CG2-CD1 3.94Å; L268-L281 HydrophobicContact CD1-CD1 4.29Å; L268-L281 HydrophobicContact CD2-CD2 4.5Å; G277-L281 WeakPolarHBondContact O-CG 3.43Å; I278-L281 VanDerWaalsContact O-CB 3.31Å; I278-L281 WeakPolarHBondContact O-CB 3.44Å; I278-L281 WeakPolarHBondContact O-CG 3.41Å; I278-L281 PolarHBondContact O-N 3.06Å; I278-L281 VanDerWaalsContact O-N 3.16Å; L281-I283 HydrophobicContact CB-CD1 3.88Å; L281-I283 HydrophobicContact CB-CG1 3.81Å; L281-I283 HydrophobicContact CB-CG2 4.42Å; L281-I283 HydrophobicContact CD1-CD1 3.8Å; L281-I283 PolarHBondContact O-N 2.92Å; L281-Q288 PolarHBondContact O-NE2 3.44Å; L281-L291 HydrophobicContact CD1-CD1 3.85Å
282L95.1Very high95.2Very high183 Ų18361.4 Ų61.496%0.95832%0.322SS*.SBendtrans-75.957.4175-59.2177.9000111.5
283I94.4Very high95.3Very high55 Ų5560 Ų6028%0.28232%0.315SS..SBendtrans-127.6157.7179.864.6-178.5000109.9L281 L287 Q288 L291L281-I283 HydrophobicContact CB-CD1 3.88Å; L281-I283 HydrophobicContact CB-CG1 3.81Å; L281-I283 HydrophobicContact CB-CG2 4.42Å; L281-I283 HydrophobicContact CD1-CD1 3.8Å; L281-I283 PolarHBondContact O-N 2.92Å; I283-L287 HydrophobicContact CD1-CB 3.94Å; I283-L287 HydrophobicContact CG1-CB 4.28Å; I283-Q288 HydrophobicContact CD1-CG 4.14Å; I283-Q288 HydrophobicContact CG1-CG 3.71Å; I283-Q288 PolarHBondContact O-NE2 2.56Å; I283-L291 HydrophobicContact CD1-CD1 3.54Å
284P96.3Very high95Very high88 Ų8860.6 Ų60.657%0.57132%0.316SS*.  trans-55.4144.6177.5-27.634.7000113.7R286 L287 Q288P284-R286 PolarHBondContact O-N 3.02Å; P284-R286 VanDerWaalsContact O-N 3.08Å; P284-L287 WeakPolarHBondContact O-CA 3.36Å; P284-L287 WeakPolarHBondContact O-CB 3.29Å; P284-L287 PolarHBondContact O-N 3.21Å; P284-Q288 PolarHBondContact O-N 3.06Å; P284-Q288 VanDerWaalsContact O-N 3.11Å
285A95.1Very high93.4Very high60 Ų6064 Ų6450%0.49634%0.341SS..Hα-helixtrans-53.7-33.618000000113.5L287 Q288 N289A285-L287 VanDerWaalsContact C-N 3.32Å; A285-L287 PolarHBondContact O-N 2.86Å; A285-Q288 WeakPolarHBondContact O-CB 3.48Å; A285-Q288 PolarHBondContact O-N 3.43Å; A285-N289 WeakPolarHBondContact O-CB 3.5Å; A285-N289 VanDerWaalsContact O-CG 3.28Å; A285-N289 PolarHBondContact O-N 3.3Å
286R94.4Very high93.3Very high216 Ų21667 Ų6782%0.81536%0.357SS*.Hα-helixtrans-60.9-39.4174.6-172177.5-179.4-179.50.4112.5P284 F290P284-R286 PolarHBondContact O-N 3.02Å; P284-R286 VanDerWaalsContact O-N 3.08Å; R286-F290 WeakPolarHBondContact O-CB 3.34Å; R286-F290 PolarHBondContact O-N 3.49Å
287L94.4Very high93.3Very high89 Ų8966.3 Ų66.347%0.46635%0.352SS..Hα-helixtrans-73.7-35.8175.4-66.1-176.4000111.4I283 P284 A285 F290 L291I283-L287 HydrophobicContact CD1-CB 3.94Å; I283-L287 HydrophobicContact CG1-CB 4.28Å; P284-L287 WeakPolarHBondContact O-CA 3.36Å; P284-L287 WeakPolarHBondContact O-CB 3.29Å; P284-L287 PolarHBondContact O-N 3.21Å; A285-L287 VanDerWaalsContact C-N 3.32Å; A285-L287 PolarHBondContact O-N 2.86Å; L287-F290 PolarHBondContact O-N 3.01Å; L287-L291 WeakPolarHBondContact O-CB 3.21Å; L287-L291 VanDerWaalsContact O-CG 3.25Å; L287-L291 WeakPolarHBondContact O-CG 3.42Å; L287-L291 PolarHBondContact O-N 3.49Å
288Q96.4Very high93.2Very high31 Ų3169.6 Ų69.615%0.14537%0.369CS..Hα-helixtrans-59.6-48.1172.3-62.2178.8-19.300110.9I278 F279 L281 I283 P284 A285 F290 L291 N292I278-Q288 HydrophobicContact CG2-CB 3.93Å; I278-Q288 HydrophobicContact CG2-CG 4.36Å; I278-Q288 WeakPolarHBondContact CG2-O 3.3Å; F279-Q288 HydrophobicContact CD1-CB 4.29Å; F279-Q288 HydrophobicContact CE1-CB 4.44Å; F279-Q288 PolarHBondContact O-NE2 3.04Å; L281-Q288 PolarHBondContact O-NE2 3.44Å; I283-Q288 HydrophobicContact CD1-CG 4.14Å; I283-Q288 HydrophobicContact CG1-CG 3.71Å; I283-Q288 PolarHBondContact O-NE2 2.56Å; P284-Q288 PolarHBondContact O-N 3.06Å; P284-Q288 VanDerWaalsContact O-N 3.11Å; A285-Q288 WeakPolarHBondContact O-CB 3.48Å; A285-Q288 PolarHBondContact O-N 3.43Å; Q288-F290 VanDerWaalsContact C-N 3.34Å; Q288-F290 PolarHBondContact O-N 3.07Å; Q288-L291 PolarHBondContact O-N 3.2Å; Q288-N292 VanDerWaalsContact O-CB 3.31Å; Q288-N292 WeakPolarHBondContact O-CB 3.3Å; Q288-N292 PolarHBondContact O-N 3.25Å
289N95.8Very high93Very high65 Ų6573.7 Ų73.735%0.34839%0.39SS..Hα-helixtrans-62.1-40.6176.6-71.1-9.2000112.3A285 N292 L293 E294A285-N289 WeakPolarHBondContact O-CB 3.5Å; A285-N289 VanDerWaalsContact O-CG 3.28Å; A285-N289 PolarHBondContact O-N 3.3Å; N289-N292 CarbonylContact O-C 3.44Å; N289-N292 PolarHBondContact O-N 2.62Å; N289-L293 PolarHBondContact O-N 3.44Å; N289-E294 HydrophobicContact CB-CB 3.95Å; N289-E294 PolarHBondContact O-N 3.07Å
290F95.6Very high92.8Very high48 Ų4872.3 Ų72.321%0.21139%0.388CS..Hα-helixtrans-62.7-40.5174.3172.7-95.6000112.4V257 R261 R286 L287 Q288 S295V257-F290 HydrophobicContact CG1-CE1 3.93Å; V257-F290 HydrophobicContact CG1-CE2 4.19Å; V257-F290 HydrophobicContact CG1-CZ 3.54Å; R261-F290 HydrophobicContact CB-CE1 3.7Å; R261-F290 HydrophobicContact CB-CZ 4.18Å; R261-F290 HydrophobicContact CG-CE1 4.08Å; R261-F290 VanDerWaalsContact CZ-O 3.25Å; R261-F290 VanDerWaalsContact NE-CE1 3.34Å; R261-F290 VanDerWaalsContact NE-CZ 3.28Å; R261-F290 PolarHBondContact NE-O 3Å; R261-F290 PolarHBondContact NH2-O 3.06Å; R286-F290 WeakPolarHBondContact O-CB 3.34Å; R286-F290 PolarHBondContact O-N 3.49Å; L287-F290 PolarHBondContact O-N 3.01Å; Q288-F290 VanDerWaalsContact C-N 3.34Å; Q288-F290 PolarHBondContact O-N 3.07Å; F290-S295 WeakPolarHBondContact CA-OG 3.38Å
291L96.8Very high92.6Very high4 Ų471.5 Ų71.52%0.02138%0.375CS..Hα-helixtrans-70.1-34.2174.4-69.5169.9000111.8R261 I264 R265 I278 L281 I283 L287 Q288 L293R261-L291 HydrophobicContact CB-CD2 4.35Å; R261-L291 HydrophobicContact CG-CD2 4.09Å; I264-L291 HydrophobicContact CB-CD2 4.03Å; I264-L291 HydrophobicContact CD1-CD2 4.24Å; I264-L291 HydrophobicContact CG2-CD1 3.95Å; I264-L291 HydrophobicContact CG2-CD2 3.98Å; R265-L291 WeakPolarHBondContact CD-O 3.24Å; R265-L291 HydrophobicContact CG-CD2 4.42Å; R265-L291 PolarHBondContact NH1-O 3.35Å; I278-L291 HydrophobicContact CD1-CB 4.02Å; I278-L291 HydrophobicContact CG1-CB 4.28Å; I278-L291 HydrophobicContact CG2-CB 3.77Å; I278-L291 HydrophobicContact CG2-CD1 4.13Å; L281-L291 HydrophobicContact CD1-CD1 3.85Å; I283-L291 HydrophobicContact CD1-CD1 3.54Å; L287-L291 WeakPolarHBondContact O-CB 3.21Å; L287-L291 VanDerWaalsContact O-CG 3.25Å; L287-L291 WeakPolarHBondContact O-CG 3.42Å; L287-L291 PolarHBondContact O-N 3.49Å; Q288-L291 PolarHBondContact O-N 3.2Å; L291-L293 VanDerWaalsContact C-N 3.3Å; L291-L293 PolarHBondContact O-N 2.91Å
292N96.6Very high92.5Very high9 Ų972.9 Ų72.95%0.04838%0.382CS..THydrogen-bonded Turntrans-87.710.3-179.2-163.350.3000113.6Q168 P275 I278 F279 Q288 N289 E294Q168-N292 VanDerWaalsContact CG-O 3.25Å; Q168-N292 WeakPolarHBondContact CG-O 3.45Å; Q168-N292 PolarHBondContact NE2-ND2 2.99Å; Q168-N292 VanDerWaalsContact NE2-ND2 3.13Å; Q168-N292 PolarHBondContact NE2-O 3.05Å; P275-N292 WeakPolarHBondContact CB-OD1 3.46Å; I278-N292 HydrophobicContact CD1-CB 3.98Å; F279-N292 HydrophobicContact CZ-CB 4.2Å; Q288-N292 VanDerWaalsContact O-CB 3.31Å; Q288-N292 WeakPolarHBondContact O-CB 3.3Å; Q288-N292 PolarHBondContact O-N 3.25Å; N289-N292 CarbonylContact O-C 3.44Å; N289-N292 PolarHBondContact O-N 2.62Å; N292-E294 HydrophobicContact CB-CG 4.33Å; N292-E294 PolarHBondContact O-N 3.33Å
293L95.1Very high92.3Very high1 Ų164.4 Ų64.41%0.00534%0.338CS..THydrogen-bonded Turntrans62.422.4176.4-43175.9000114.4K164 L167 Q168 R216 V217 N289 L291K164-L293 VanDerWaalsContact CE-O 3.3Å; K164-L293 WeakPolarHBondContact CE-O 3.39Å; L167-L293 HydrophobicContact CB-CD1 3.5Å; L167-L293 HydrophobicContact CD1-CD1 4.44Å; Q168-L293 HydrophobicContact CG-CD1 4.42Å; R216-L293 HydrophobicContact CB-CD2 3.98Å; V217-L293 HydrophobicContact CG2-CD1 3.72Å; V217-L293 HydrophobicContact CG2-CD2 4.11Å; N289-L293 PolarHBondContact O-N 3.44Å; L291-L293 VanDerWaalsContact C-N 3.3Å; L291-L293 PolarHBondContact O-N 2.91Å
294E87.8Confident92.2Very high91 Ų9165.2 Ų65.243%0.42534%0.343SS..  trans-82.7-23.4178.9-70.3-62.5146.200113.2K164 Q168 N289 N292K164-E294 VanDerWaalsContact CE-OE1 3.23Å; K164-E294 WeakPolarHBondContact CE-OE1 3.36Å; K164-E294 IonicContact NZ-OE1 2.93Å; K164-E294 PolarHBondContact NZ-OE1 2.86Å; K164-E294 VanDerWaalsContact NZ-OE1 3.16Å; K164-E294 IonicContact NZ-OE2 2.72Å; K164-E294 PolarHBondContact NZ-OE2 2.93Å; Q168-E294 PolarHBondContact NE2-OE1 2.99Å; N289-E294 HydrophobicContact CB-CB 3.95Å; N289-E294 PolarHBondContact O-N 3.07Å; N292-E294 HydrophobicContact CB-CG 4.33Å; N292-E294 PolarHBondContact O-N 3.33Å
295S61.5Low91.8Very high80 Ų8063.1 Ų63.156%0.55932%0.322SS*.  trans-1190-176.964.60000111.6R216 F290R216-S295 VanDerWaalsContact CZ-OXT 3.24Å; R216-S295 PolarHBondContact NH1-O 3.18Å; R216-S295 PolarHBondContact NH1-OXT 3.32Å; R216-S295 PolarHBondContact NH2-OXT 3.42Å; F290-S295 WeakPolarHBondContact CA-OG 3.38Å

Retrieved 295 of 295 residues in 278 ms (Link to these results)