A0A087Y6M7_POEFO Loading...

TAF6-like RNA polymerase II p300/CBP-associated factor-associated factor 65 kDa subunit 6L

Functions as a component of the PCAF complex. The PCAF complex is capable of efficiently acetylating histones in a nucleosomal context. The PCAF complex could be considered as the human version of the yeast SAGA complex. With TAF5L, acts as an epigenetic regulator essential for somatic reprogramming. Regulates target genes through H3K9ac deposition and MYC recruitment which trigger MYC regulatory network to orchestrate gene expression programs to control embryonic stem cell state. Functions with MYC to activate target gene expression through RNA polymerase II pause release.

AlphaFold DB , UniProt , Accession A0A087Y6M7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 646 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
1F32.8Very low34.8Very low264 Ų264159.5 Ų159.5100%1.15885%0.845SS**  0155.70-85.6-98.3000109.7R3F1-R3 PolarHBondContact O-N 3.41Å
2L32.8Very low35.8Very low174 Ų174161.6 Ų161.691%0.91185%0.846SS**  trans-48.2124-165.1-66.1159.9000114.3
3R33.5Very low36.6Very low243 Ų243162.3 Ų162.392%0.91784%0.842SS**  trans-9597.7159.9-162.2-179.6-162.4-173.45.6106.8F1F1-R3 PolarHBondContact O-N 3.41Å
4G32.7Very low37.7Very low51 Ų51166.3 Ų166.353%0.52684%0.841SS.*  trans-60.8160.3178.100000112.1V6G4-V6 PolarHBondContact O-N 3.33Å
5P36.2Very low39.2Very low134 Ų134170.9 Ų170.987%0.8784%0.844SS**  trans-60.2136.1176.427-34000109.8A7P5-A7 PolarHBondContact O-N 3.4Å
6V34.4Very low41.1Very low137 Ų137167.9 Ų167.983%0.8383%0.825SS**  trans-65.6108.6169.3174.90000106.7G4 M8G4-V6 PolarHBondContact O-N 3.33Å; V6-M8 PolarHBondContact O-N 3.12Å
7A33.6Very low43.1Very low83 Ų83164.1 Ų164.169%0.68683%0.826SS**  trans-54.2131.6164.400000107.5P5 A9P5-A7 PolarHBondContact O-N 3.4Å; A7-A9 PolarHBondContact O-N 3.38Å
8M33.1Very low45.5Very low187 Ų187162.6 Ų162.692%0.92182%0.816SS**  trans-57.4105.9168-74.4-73-159.800106.5V6 D10V6-M8 PolarHBondContact O-N 3.12Å; M8-D10 PolarHBondContact O-N 3.45Å
9A36.3Very low47.8Very low91 Ų91156.5 Ų156.575%0.75279%0.788SS**  trans-57.7128.4166.300000106.3A7 R11A7-A9 PolarHBondContact O-N 3.38Å; A9-R11 PolarHBondContact O-N 3.04Å
10D36.5Very low49.9Very low155 Ų155151.3 Ų151.383%0.82977%0.767SS**  trans-48.2135.5167.6-90.8-48.5000107.9M8 E12M8-D10 PolarHBondContact O-N 3.45Å; D10-E12 PolarHBondContact O-N 3.3Å
11R41.3Very low51.8Low236 Ų236149.6 Ų149.689%0.89175%0.751SS**  trans-59.5115163.7-81.6179.1167.2178.3-2.9105.1A9 E13A9-R11 PolarHBondContact O-N 3.04Å; R11-E13 PolarHBondContact O-N 2.95Å
12E46.8Very low54.6Low184 Ų184140.7 Ų140.786%0.8672%0.716SS**  trans-56.292.9159.6-68.6-177.6136.100106.8D10 R14D10-E12 PolarHBondContact O-N 3.3Å; E12-R14 PolarHBondContact O-N 2.9Å; E12-R14 VanDerWaalsContact O-N 3.11Å
13E46.6Very low57.3Low171 Ų171135.2 Ų135.280%0.79969%0.692SS**  trans-50.8121.4159-66.6-163.7134.500105.1R11 R15R11-E13 PolarHBondContact O-N 2.95Å; E13-R15 PolarHBondContact O-N 3.19Å
14R51.6Low60.1Low218 Ų218124.5 Ų124.582%0.82365%0.654SS**  trans-69.782.6-172.5-68.8179.1178.8166.5-0.8108.4E12 F16E12-R14 PolarHBondContact O-N 2.9Å; E12-R14 VanDerWaalsContact O-N 3.11Å; R14-F16 WeakPolarHBondContact O-CD2 3.36Å; R14-F16 PolarHBondContact O-N 2.73Å
15R60.4Low63Low236 Ų236124 Ų12489%0.89164%0.637SS**  trans-49.4112.7168.9-69-171.9178.6-165.8-0.8105.8E13E13-R15 PolarHBondContact O-N 3.19Å
16F68.7Low65.6Low123 Ų123121.9 Ų121.954%0.53962%0.618SS.*  trans-67.6153.6178-66.3-83000107.2R14 E18R14-F16 WeakPolarHBondContact O-CD2 3.36Å; R14-F16 PolarHBondContact O-N 2.73Å; F16-E18 PolarHBondContact O-N 3.19Å
17A75.9Confident68.3Low102 Ų102121.5 Ų121.584%0.84361%0.608SS**  trans-65.3107.3168.700000107.4
18E85.4Confident71.1Confident137 Ų137118.1 Ų118.164%0.6458%0.58SS**PPolyproline II helixtrans-103.9132.4-178.2-77.4159.3-157.900109.1F16F16-E18 PolarHBondContact O-N 3.19Å
19V89.1Confident74Confident47 Ų47114.1 Ų114.129%0.28556%0.559SS.*PPolyproline II helixtrans-71.5128.6173.3177.50000107.3V24 V47 C48 L51V19-V24 HydrophobicContact CG1-CG2 4.23Å; V19-V47 HydrophobicContact CG2-CG1 4.09Å; V19-C48 PolarHBondContact N-SG 3.49Å; V19-L51 HydrophobicContact CG2-CD1 3.96Å
20S89.6Confident76.6Confident52 Ų52114 Ų11436%0.36455%0.554SS.*PPolyproline II helixtrans-66.3141.817867.30000110.6D22 S23 V24S20-D22 PolarHBondContact O-N 2.91Å; S20-D22 VanDerWaalsContact O-N 3.14Å; S20-S23 VanDerWaalsContact O-CB 3.29Å; S20-S23 WeakPolarHBondContact O-CB 3.4Å; S20-S23 PolarHBondContact O-N 3.45Å; S20-S23 PolarHBondContact OG-N 3.37Å; S20-S23 VanDerWaalsContact OG-N 3.12Å; S20-S23 PolarHBondContact OG-OG 3.15Å; S20-V24 PolarHBondContact O-N 2.66Å
21R91.2Very high79.4Confident116 Ų116111.6 Ų111.644%0.43854%0.544SS..Hα-helixtrans-52.9-32170.567.1-173.1-178.9161.23.9111.8V24 K25 D37 A40R21-V24 WeakPolarHBondContact O-CB 3.29Å; R21-V24 PolarHBondContact O-N 3.37Å; R21-V24 VanDerWaalsContact O-N 3.12Å; R21-K25 PolarHBondContact O-N 2.95Å; R21-D37 IonicContact CZ-OD2 2.74Å; R21-D37 IonicContact NH1-OD2 3.35Å; R21-D37 PolarHBondContact NH1-OD2 3.01Å; R21-D37 IonicContact NH2-OD2 2.68Å; R21-A40 HydrophobicContact CB-CB 4.21Å
22D90.2Very high81.9Confident77 Ų77103.8 Ų103.841%0.41254%0.537SS..Hα-helixtrans-71.2-32.7-179.8-37.6-71.2000110.9S20 V24 K25 L26S20-D22 PolarHBondContact O-N 2.91Å; S20-D22 VanDerWaalsContact O-N 3.14Å; D22-V24 VanDerWaalsContact C-N 3.29Å; D22-V24 PolarHBondContact O-N 3.04Å; D22-K25 PolarHBondContact O-N 3.18Å; D22-L26 WeakPolarHBondContact O-CB 3.47Å; D22-L26 VanDerWaalsContact O-CG 3.31Å; D22-L26 WeakPolarHBondContact O-CG 3.46Å; D22-L26 PolarHBondContact O-N 3.46Å
23S90.5Very high84.1Confident59 Ų5998.4 Ų98.441%0.41352%0.517SS..Hα-helixtrans-63.7-34.8168.4-54.30000112.2S20 M27S20-S23 VanDerWaalsContact O-CB 3.29Å; S20-S23 WeakPolarHBondContact O-CB 3.4Å; S20-S23 PolarHBondContact O-N 3.45Å; S20-S23 PolarHBondContact OG-N 3.37Å; S20-S23 VanDerWaalsContact OG-N 3.12Å; S20-S23 PolarHBondContact OG-OG 3.15Å; S23-M27 WeakPolarHBondContact O-CB 3.41Å; S23-M27 PolarHBondContact O-N 3.36Å
24V92.6Very high86.4Confident19 Ų1996.9 Ų96.912%0.11551%0.514CS..Hα-helixtrans-73.2-39.7177.5-1790000110.9V19 S20 R21 D22 M27 A28 L35 L43 A44V19-V24 HydrophobicContact CG1-CG2 4.23Å; S20-V24 PolarHBondContact O-N 2.66Å; R21-V24 WeakPolarHBondContact O-CB 3.29Å; R21-V24 PolarHBondContact O-N 3.37Å; R21-V24 VanDerWaalsContact O-N 3.12Å; D22-V24 VanDerWaalsContact C-N 3.29Å; D22-V24 PolarHBondContact O-N 3.04Å; V24-M27 PolarHBondContact O-N 2.83Å; V24-A28 PolarHBondContact O-N 3.2Å; V24-L35 HydrophobicContact CG1-CD1 4.27Å; V24-L43 HydrophobicContact CG1-CB 3.91Å; V24-L43 HydrophobicContact CG1-CD1 4.24Å; V24-A44 HydrophobicContact CG2-CB 3.95Å
25K92.9Very high88.4Confident40 Ų4088 Ų8817%0.17448%0.483CS..Hα-helixtrans-59.7-53.8172.2-73.7-173.5172.3-167.70111.8R21 D22 M27 A28 E29 L35 D37 A40R21-K25 PolarHBondContact O-N 2.95Å; D22-K25 PolarHBondContact O-N 3.18Å; K25-M27 PolarHBondContact O-N 2.98Å; K25-A28 CarbonylContact O-C 3.35Å; K25-A28 WeakPolarHBondContact O-CA 3.23Å; K25-A28 WeakPolarHBondContact O-CB 3.28Å; K25-A28 PolarHBondContact O-N 3Å; K25-E29 WeakPolarHBondContact O-CG 3.27Å; K25-E29 PolarHBondContact O-N 3.23Å; K25-L35 VanDerWaalsContact CE-O 3.27Å; K25-L35 WeakPolarHBondContact CE-O 3.46Å; K25-D37 IonicContact NZ-OD1 3.1Å; K25-D37 PolarHBondContact NZ-OD1 3.27Å; K25-D37 IonicContact NZ-OD2 2.69Å; K25-A40 HydrophobicContact CG-CB 3.89Å
26L90.1Very high90Very high89 Ų8979.8 Ų79.847%0.46647%0.466SS..Hα-helixtrans-56.7-35.3178.1-71.1169000112.7D22 S30 L106D22-L26 WeakPolarHBondContact O-CB 3.47Å; D22-L26 VanDerWaalsContact O-CG 3.31Å; D22-L26 WeakPolarHBondContact O-CG 3.46Å; D22-L26 PolarHBondContact O-N 3.46Å; L26-S30 PolarHBondContact O-N 3.48Å; L26-L106 HydrophobicContact CD1-CD2 4.42Å
27M91.6Very high91.1Very high129 Ų12977 Ų7764%0.63546%0.456SS*.Hα-helixtrans-66.8-43.1174-171.860.157.500112S23 V24 K25 S30 T31S23-M27 WeakPolarHBondContact O-CB 3.41Å; S23-M27 PolarHBondContact O-N 3.36Å; V24-M27 PolarHBondContact O-N 2.83Å; K25-M27 PolarHBondContact O-N 2.98Å; M27-S30 PolarHBondContact O-N 3.22Å; M27-S30 PolarHBondContact O-OG 3.05Å; M27-T31 PolarHBondContact O-N 3Å
28A93.8Very high92Very high12 Ų1278.4 Ų78.410%0.09945%0.45CS..Hα-helixtrans-67.2-41.4176.100000112.6V24 K25 S30 T31 G32 V33 L35V24-A28 PolarHBondContact O-N 3.2Å; K25-A28 CarbonylContact O-C 3.35Å; K25-A28 WeakPolarHBondContact O-CA 3.23Å; K25-A28 WeakPolarHBondContact O-CB 3.28Å; K25-A28 PolarHBondContact O-N 3Å; A28-S30 VanDerWaalsContact C-N 3.27Å; A28-S30 PolarHBondContact O-N 3Å; A28-T31 CarbonylContact O-C 3.59Å; A28-T31 WeakPolarHBondContact O-CA 3.49Å; A28-T31 PolarHBondContact O-N 3.01Å; A28-T31 PolarHBondContact O-OG1 3.13Å; A28-G32 PolarHBondContact O-N 3.25Å; A28-V33 CarbonylContact C-O 3.3Å; A28-V33 HydrophobicContact CB-CB 4.38Å; A28-V33 VanDerWaalsContact CB-O 3.29Å; A28-V33 WeakPolarHBondContact CB-O 3.47Å; A28-V33 PolarHBondContact O-N 3.11Å; A28-L35 HydrophobicContact CB-CD1 3.46Å; A28-L35 VanDerWaalsContact CB-CD1 3.46Å; A28-L35 HydrophobicContact CB-CG 3.68Å
29E92.9Very high92.4Very high103 Ų10375.2 Ų75.248%0.48144%0.439SS..Hα-helixtrans-58.4-39.6173.7-72.2167.8-142.500111.1K25 T31 G32 V33K25-E29 WeakPolarHBondContact O-CG 3.27Å; K25-E29 PolarHBondContact O-N 3.23Å; E29-T31 PolarHBondContact O-N 2.72Å; E29-G32 PolarHBondContact O-N 3.25Å; E29-V33 PolarHBondContact N-O 3.2Å
30S91.9Very high92.7Very high90 Ų9073 Ų7363%0.62943%0.426SS*.Hα-helixtrans-62.3-22.4174.184.90000113.5L26 M27 A28L26-S30 PolarHBondContact O-N 3.48Å; M27-S30 PolarHBondContact O-N 3.22Å; M27-S30 PolarHBondContact O-OG 3.05Å; A28-S30 VanDerWaalsContact C-N 3.27Å; A28-S30 PolarHBondContact O-N 3Å
31T94Very high92.8Very high103 Ų10372.8 Ų72.863%0.63243%0.427SS*.THydrogen-bonded Turntrans-95.33.5171.866.20000114.1M27 A28 E29M27-T31 PolarHBondContact O-N 3Å; A28-T31 CarbonylContact O-C 3.59Å; A28-T31 WeakPolarHBondContact O-CA 3.49Å; A28-T31 PolarHBondContact O-N 3.01Å; A28-T31 PolarHBondContact O-OG1 3.13Å; E29-T31 PolarHBondContact O-N 2.72Å
32G93.3Very high92.9Very high72 Ų7273 Ų7374%0.74244%0.436SS*.THydrogen-bonded Turntrans80.123.4-178.100000114.8A28 E29A28-G32 PolarHBondContact O-N 3.25Å; E29-G32 PolarHBondContact O-N 3.25Å
33V94.6Very high93.1Very high71 Ų7173 Ų7343%0.4344%0.436SS..  trans-121.9124.1-177.2-178.60000110.6A28 E29 L35A28-V33 CarbonylContact C-O 3.3Å; A28-V33 HydrophobicContact CB-CB 4.38Å; A28-V33 VanDerWaalsContact CB-O 3.29Å; A28-V33 WeakPolarHBondContact CB-O 3.47Å; A28-V33 PolarHBondContact O-N 3.11Å; E29-V33 PolarHBondContact N-O 3.2Å; V33-L35 HydrophobicContact CG1-CD2 4.32Å
34D93.7Very high93.3Very high140 Ų14070.6 Ų70.675%0.74942%0.42SS*.  trans-84.9143.9170.2-170.94.6000110.5
35L93.1Very high93.2Very high31 Ų3175.9 Ų75.916%0.16244%0.443CS..  trans-129.8124.5-175.8-73.1-176.8000112.2V24 K25 A28 V33 V39 L43V24-L35 HydrophobicContact CG1-CD1 4.27Å; K25-L35 VanDerWaalsContact CE-O 3.27Å; K25-L35 WeakPolarHBondContact CE-O 3.46Å; A28-L35 HydrophobicContact CB-CD1 3.46Å; A28-L35 VanDerWaalsContact CB-CD1 3.46Å; A28-L35 HydrophobicContact CB-CG 3.68Å; V33-L35 HydrophobicContact CG1-CD2 4.32Å; L35-V39 HydrophobicContact CD2-CG1 4.26Å; L35-L43 HydrophobicContact CD1-CD1 4.08Å
36A94.8Very high93.3Very high64 Ų6477.8 Ų77.853%0.52946%0.455SS..  trans-59.7142168.400000111.8D38 V39 A40A36-D38 VanDerWaalsContact C-N 3.29Å; A36-D38 PolarHBondContact O-N 3.12Å; A36-D38 VanDerWaalsContact O-N 3.17Å; A36-V39 PolarHBondContact O-N 2.84Å; A36-A40 PolarHBondContact O-N 3.31Å
37D92.7Very high93.4Very high65 Ų6576.5 Ų76.535%0.34845%0.451SS..Hα-helixtrans-49.5-43.2-175.2-76.857.3000114.2R21 K25 V39 A40 A41R21-D37 IonicContact CZ-OD2 2.74Å; R21-D37 IonicContact NH1-OD2 3.35Å; R21-D37 PolarHBondContact NH1-OD2 3.01Å; R21-D37 IonicContact NH2-OD2 2.68Å; K25-D37 IonicContact NZ-OD1 3.1Å; K25-D37 PolarHBondContact NZ-OD1 3.27Å; K25-D37 IonicContact NZ-OD2 2.69Å; D37-V39 VanDerWaalsContact C-N 3.32Å; D37-V39 PolarHBondContact O-N 3.41Å; D37-A40 PolarHBondContact O-N 3.45Å; D37-A41 WeakPolarHBondContact O-CB 3.35Å; D37-A41 PolarHBondContact O-N 3.49Å
38D94Very high93.5Very high131 Ų13170.6 Ų70.670%0.70142%0.422SS*.Hα-helixtrans-63.7-37.8-178.8-56.6-36.7000112A36 L42A36-D38 VanDerWaalsContact C-N 3.29Å; A36-D38 PolarHBondContact O-N 3.12Å; A36-D38 VanDerWaalsContact O-N 3.17Å; D38-L42 WeakPolarHBondContact O-CG 3.49Å; D38-L42 PolarHBondContact O-N 3.08Å; D38-L42 VanDerWaalsContact O-N 3.14Å
39V94.5Very high93.4Very high69 Ų6976.2 Ų76.242%0.41844%0.442SS..Hα-helixtrans-73.4-42.5178.3-1770000110.2L35 A36 D37 A41 L42 L43L35-V39 HydrophobicContact CD2-CG1 4.26Å; A36-V39 PolarHBondContact O-N 2.84Å; D37-V39 VanDerWaalsContact C-N 3.32Å; D37-V39 PolarHBondContact O-N 3.41Å; V39-A41 VanDerWaalsContact C-N 3.3Å; V39-A41 PolarHBondContact O-N 3.04Å; V39-L42 PolarHBondContact O-N 3.17Å; V39-L43 HydrophobicContact CG1-CD1 3.98Å; V39-L43 HydrophobicContact CG1-CG 4.43Å; V39-L43 WeakPolarHBondContact O-CB 3.31Å; V39-L43 VanDerWaalsContact O-CG 3.31Å; V39-L43 WeakPolarHBondContact O-CG 3.35Å; V39-L43 PolarHBondContact O-N 3.44Å
40A93.9Very high93.3Very high0 Ų077.4 Ų77.40%044%0.442CS..Hα-helixtrans-62.5-36.4175.700000112.2R21 K25 A36 D37 A44R21-A40 HydrophobicContact CB-CB 4.21Å; K25-A40 HydrophobicContact CG-CB 3.89Å; A36-A40 PolarHBondContact O-N 3.31Å; D37-A40 PolarHBondContact O-N 3.45Å; A40-A44 WeakPolarHBondContact O-CB 3.29Å; A40-A44 PolarHBondContact O-N 2.84Å
41A92Very high93.4Very high48 Ų4878 Ų7840%0.39744%0.437SS..Hα-helixtrans-67-47175.400000112.6D37 V39 L43 A44 E45D37-A41 WeakPolarHBondContact O-CB 3.35Å; D37-A41 PolarHBondContact O-N 3.49Å; V39-A41 VanDerWaalsContact C-N 3.3Å; V39-A41 PolarHBondContact O-N 3.04Å; A41-L43 PolarHBondContact O-N 2.98Å; A41-A44 WeakPolarHBondContact O-CB 3.38Å; A41-A44 PolarHBondContact O-N 3.42Å; A41-E45 PolarHBondContact O-N 3.34Å; A41-E45 VanDerWaalsContact O-N 3.11Å
42L94.1Very high93.3Very high121 Ų12177.2 Ų77.263%0.63442%0.423SS*.Hα-helixtrans-64.2-39.7177.6-71169.9000112.4D38 V39 E45 D46D38-L42 WeakPolarHBondContact O-CG 3.49Å; D38-L42 PolarHBondContact O-N 3.08Å; D38-L42 VanDerWaalsContact O-N 3.14Å; V39-L42 PolarHBondContact O-N 3.17Å; L42-E45 PolarHBondContact O-N 3.03Å; L42-D46 PolarHBondContact O-N 3.48Å
43L94.7Very high93.2Very high78 Ų7877 Ų7741%0.40840%0.403SS..Hα-helixtrans-65.7-38.9174.5-73.4172.2000112V24 L35 V39 A41 E45 D46 V47V24-L43 HydrophobicContact CG1-CB 3.91Å; V24-L43 HydrophobicContact CG1-CD1 4.24Å; L35-L43 HydrophobicContact CD1-CD1 4.08Å; V39-L43 HydrophobicContact CG1-CD1 3.98Å; V39-L43 HydrophobicContact CG1-CG 4.43Å; V39-L43 WeakPolarHBondContact O-CB 3.31Å; V39-L43 VanDerWaalsContact O-CG 3.31Å; V39-L43 WeakPolarHBondContact O-CG 3.35Å; V39-L43 PolarHBondContact O-N 3.44Å; A41-L43 PolarHBondContact O-N 2.98Å; L43-E45 VanDerWaalsContact C-N 3.31Å; L43-E45 PolarHBondContact O-N 3.49Å; L43-D46 PolarHBondContact O-N 3Å; L43-V47 WeakPolarHBondContact O-CB 3.41Å; L43-V47 VanDerWaalsContact O-CG2 3.29Å; L43-V47 WeakPolarHBondContact O-CG2 3.4Å; L43-V47 PolarHBondContact O-N 3.39Å
44A93.6Very high93.2Very high8 Ų874.4 Ų74.47%0.06639%0.388CS..Hα-helixtrans-60.2-4017400000111.8V24 A40 A41 C48V24-A44 HydrophobicContact CG2-CB 3.95Å; A40-A44 WeakPolarHBondContact O-CB 3.29Å; A40-A44 PolarHBondContact O-N 2.84Å; A41-A44 WeakPolarHBondContact O-CB 3.38Å; A41-A44 PolarHBondContact O-N 3.42Å; A44-C48 WeakPolarHBondContact O-CB 3.28Å; A44-C48 PolarHBondContact O-N 3.42Å; A44-C48 PolarHBondContact O-SG 2.9Å
45E91.9Very high93.2Very high129 Ų12970.2 Ų70.260%0.60337%0.373SS*.Hα-helixtrans-65.5-46.2178.6-167.7179.7-179.700112.9A41 L42 L43 C48 Y49A41-E45 PolarHBondContact O-N 3.34Å; A41-E45 VanDerWaalsContact O-N 3.11Å; L42-E45 PolarHBondContact O-N 3.03Å; L43-E45 VanDerWaalsContact C-N 3.31Å; L43-E45 PolarHBondContact O-N 3.49Å; E45-C48 CarbonylContact O-C 3.02Å; E45-C48 WeakPolarHBondContact O-CB 3.2Å; E45-C48 PolarHBondContact O-N 3Å; E45-Y49 PolarHBondContact O-N 3.39Å
46D93.8Very high93.3Very high80 Ų8074.2 Ų74.243%0.42839%0.391SS..Hα-helixtrans-64.9-42176.4-176.353.3000111.3L42 L43 C48 Y49 R50L42-D46 PolarHBondContact O-N 3.48Å; L43-D46 PolarHBondContact O-N 3Å; D46-C48 VanDerWaalsContact C-N 3.27Å; D46-C48 PolarHBondContact O-N 3.14Å; D46-Y49 CarbonylContact O-C 3.59Å; D46-Y49 WeakPolarHBondContact O-CA 3.46Å; D46-Y49 WeakPolarHBondContact O-CB 3.5Å; D46-Y49 PolarHBondContact O-N 2.92Å; D46-R50 WeakPolarHBondContact O-CG 3.31Å; D46-R50 PolarHBondContact O-N 3.39Å; D46-R50 IonicContact OD1-NE 3.41Å; D46-R50 PolarHBondContact OD1-NE 3.12Å; D46-R50 IonicContact OD2-NE 3.94Å
47V93.8Very high93.4Very high62 Ų6272.2 Ų72.238%0.37637%0.373SS..Hα-helixtrans-56.7-43.3173.2170.90000110.8V19 L43 Y49 R50 L51V19-V47 HydrophobicContact CG2-CG1 4.09Å; L43-V47 WeakPolarHBondContact O-CB 3.41Å; L43-V47 VanDerWaalsContact O-CG2 3.29Å; L43-V47 WeakPolarHBondContact O-CG2 3.4Å; L43-V47 PolarHBondContact O-N 3.39Å; V47-Y49 PolarHBondContact O-N 3.07Å; V47-R50 PolarHBondContact O-N 3.06Å; V47-L51 HydrophobicContact CG1-CD1 3.93Å; V47-L51 HydrophobicContact CG1-CG 4.4Å; V47-L51 WeakPolarHBondContact O-CB 3.48Å; V47-L51 VanDerWaalsContact O-CG 3.28Å; V47-L51 WeakPolarHBondContact O-CG 3.42Å; V47-L51 PolarHBondContact O-N 2.9Å
48C92.4Very high93.6Very high5 Ų569.2 Ų69.23%0.03436%0.356CS..Hα-helixtrans-64.9-36.7174.4-67.10000112.8V19 A44 E45 D46 R52V19-C48 PolarHBondContact N-SG 3.49Å; A44-C48 WeakPolarHBondContact O-CB 3.28Å; A44-C48 PolarHBondContact O-N 3.42Å; A44-C48 PolarHBondContact O-SG 2.9Å; E45-C48 CarbonylContact O-C 3.02Å; E45-C48 WeakPolarHBondContact O-CB 3.2Å; E45-C48 PolarHBondContact O-N 3Å; D46-C48 VanDerWaalsContact C-N 3.27Å; D46-C48 PolarHBondContact O-N 3.14Å; C48-R52 WeakPolarHBondContact O-CB 3.25Å; C48-R52 VanDerWaalsContact O-CG 3.24Å; C48-R52 WeakPolarHBondContact O-CG 3.42Å; C48-R52 PolarHBondContact O-N 2.9Å; C48-R52 VanDerWaalsContact O-N 3.13Å; C48-R52 PolarHBondContact O-NE 3.17Å
49Y91.8Very high93.7Very high131 Ų13164 Ų6451%0.51433%0.331SS..Hα-helixtrans-62.4-48.8172.8179.2-92.9000111.4E45 D46 V47 L51 R52 E53E45-Y49 PolarHBondContact O-N 3.39Å; D46-Y49 CarbonylContact O-C 3.59Å; D46-Y49 WeakPolarHBondContact O-CA 3.46Å; D46-Y49 WeakPolarHBondContact O-CB 3.5Å; D46-Y49 PolarHBondContact O-N 2.92Å; V47-Y49 PolarHBondContact O-N 3.07Å; Y49-L51 PolarHBondContact O-N 3.2Å; Y49-R52 PolarHBondContact O-N 3.18Å; Y49-E53 PolarHBondContact O-N 2.97Å
50R91.9Very high93.8Very high128 Ų12865 Ų6548%0.48333%0.33SS..Hα-helixtrans-63.3-40.4178.6-62.7-54.5175.71753.8113.5D46 V47 R52 E53 A54D46-R50 WeakPolarHBondContact O-CG 3.31Å; D46-R50 PolarHBondContact O-N 3.39Å; D46-R50 IonicContact OD1-NE 3.41Å; D46-R50 PolarHBondContact OD1-NE 3.12Å; D46-R50 IonicContact OD2-NE 3.94Å; V47-R50 PolarHBondContact O-N 3.06Å; R50-R52 VanDerWaalsContact C-N 3.34Å; R50-E53 WeakPolarHBondContact CD-OE2 3.4Å; R50-E53 IonicContact CZ-OE2 3.82Å; R50-E53 IonicContact NH1-OE1 3.98Å; R50-E53 IonicContact NH1-OE2 2.84Å; R50-E53 PolarHBondContact NH1-OE2 2.69Å; R50-E53 PolarHBondContact O-N 3.33Å; R50-A54 WeakPolarHBondContact O-CB 3.38Å; R50-A54 PolarHBondContact O-N 3.45Å
51L92.1Very high93.9Very high102 Ų10267.8 Ų67.853%0.53434%0.343SS..Hα-helixtrans-63.3-40.6173.9-71.7171.4000111.5V19 V47 Y49 A55V19-L51 HydrophobicContact CG2-CD1 3.96Å; V47-L51 HydrophobicContact CG1-CD1 3.93Å; V47-L51 HydrophobicContact CG1-CG 4.4Å; V47-L51 WeakPolarHBondContact O-CB 3.48Å; V47-L51 VanDerWaalsContact O-CG 3.28Å; V47-L51 WeakPolarHBondContact O-CG 3.42Å; V47-L51 PolarHBondContact O-N 2.9Å; Y49-L51 PolarHBondContact O-N 3.2Å; L51-A55 VanDerWaalsContact O-CB 3.22Å; L51-A55 WeakPolarHBondContact O-CB 3.43Å; L51-A55 PolarHBondContact O-N 3.37Å
52R92Very high94.2Very high87 Ų8766.6 Ų66.633%0.32833%0.329SS..Hα-helixtrans-65.7-40.7174.4-73175-73.2-162.31.7112.1C48 Y49 R50 Q56C48-R52 WeakPolarHBondContact O-CB 3.25Å; C48-R52 VanDerWaalsContact O-CG 3.24Å; C48-R52 WeakPolarHBondContact O-CG 3.42Å; C48-R52 PolarHBondContact O-N 2.9Å; C48-R52 VanDerWaalsContact O-N 3.13Å; C48-R52 PolarHBondContact O-NE 3.17Å; Y49-R52 PolarHBondContact O-N 3.18Å; R50-R52 VanDerWaalsContact C-N 3.34Å; R52-Q56 VanDerWaalsContact O-CB 3.31Å; R52-Q56 WeakPolarHBondContact O-CB 3.42Å; R52-Q56 PolarHBondContact O-N 3.4Å
53E92.6Very high94.3Very high68 Ų6869.1 Ų69.132%0.31833%0.33SS..Hα-helixtrans-60.4-48.6174.3-178.1176.9-15200111.9Y49 R50 Q56 T57Y49-E53 PolarHBondContact O-N 2.97Å; R50-E53 WeakPolarHBondContact CD-OE2 3.4Å; R50-E53 IonicContact CZ-OE2 3.82Å; R50-E53 IonicContact NH1-OE1 3.98Å; R50-E53 IonicContact NH1-OE2 2.84Å; R50-E53 PolarHBondContact NH1-OE2 2.69Å; R50-E53 PolarHBondContact O-N 3.33Å; E53-Q56 PolarHBondContact O-N 3.25Å; E53-T57 WeakPolarHBondContact O-CB 3.34Å; E53-T57 PolarHBondContact O-N 2.93Å; E53-T57 PolarHBondContact O-OG1 3.48Å
54A93.8Very high94.3Very high15 Ų1572.9 Ų72.912%0.12435%0.345CS..Hα-helixtrans-67.4-41178.700000112.8R50 T57 S58 L75R50-A54 WeakPolarHBondContact O-CB 3.38Å; R50-A54 PolarHBondContact O-N 3.45Å; A54-T57 PolarHBondContact O-N 3.11Å; A54-S58 WeakPolarHBondContact O-CB 3.37Å; A54-S58 PolarHBondContact O-N 3.32Å; A54-S58 PolarHBondContact O-OG 3.21Å; A54-L75 HydrophobicContact CB-CD1 4.34Å
55A93.8Very high94.4Very high53 Ų5374.8 Ų74.844%0.43836%0.361SS..Hα-helixtrans-64.3-41.4176.400000112.2L51 S58 S59L51-A55 VanDerWaalsContact O-CB 3.22Å; L51-A55 WeakPolarHBondContact O-CB 3.43Å; L51-A55 PolarHBondContact O-N 3.37Å; A55-S58 WeakPolarHBondContact CA-OG 3.36Å; A55-S58 PolarHBondContact O-OG 3.23Å; A55-S58 VanDerWaalsContact O-OG 3.12Å; A55-S59 VanDerWaalsContact O-CB 3.25Å; A55-S59 WeakPolarHBondContact O-CB 3.47Å; A55-S59 PolarHBondContact O-N 3.15Å
56Q94.9Very high94.6Very high114 Ų11478 Ų7853%0.53337%0.373SS..Hα-helixtrans-66-41.9176.2175.863.7-14.400111.7R52 E53 S59 Q60R52-Q56 VanDerWaalsContact O-CB 3.31Å; R52-Q56 WeakPolarHBondContact O-CB 3.42Å; R52-Q56 PolarHBondContact O-N 3.4Å; E53-Q56 PolarHBondContact O-N 3.25Å; Q56-S59 WeakPolarHBondContact O-CB 3.45Å; Q56-S59 PolarHBondContact O-N 3.02Å; Q56-Q60 WeakPolarHBondContact O-CG 3.47Å; Q56-Q60 PolarHBondContact O-N 3.03Å
57T96.4Very high94.6Very high23 Ų2377.7 Ų77.714%0.14137%0.366CS..Hα-helixtrans-71-40.1-179-55.40000112E53 A54 Q60 F61 A78E53-T57 WeakPolarHBondContact O-CB 3.34Å; E53-T57 PolarHBondContact O-N 2.93Å; E53-T57 PolarHBondContact O-OG1 3.48Å; A54-T57 PolarHBondContact O-N 3.11Å; T57-Q60 WeakPolarHBondContact O-CB 3.44Å; T57-Q60 PolarHBondContact O-N 3.16Å; T57-F61 HydrophobicContact CG2-CD2 4.34Å; T57-F61 HydrophobicContact CG2-CE2 3.91Å; T57-F61 WeakPolarHBondContact O-CD2 3.15Å; T57-F61 PolarHBondContact O-N 3.33Å; T57-F61 VanDerWaalsContact O-N 3.17Å; T57-A78 HydrophobicContact CG2-CB 3.84Å
58S96.8Very high94.7Very high1 Ų186.4 Ų86.41%0.00739%0.392CS..Hα-helixtrans-68.1-34.9174.253.20000112.8A54 A55 Q60 F61 M62 D74A54-S58 WeakPolarHBondContact O-CB 3.37Å; A54-S58 PolarHBondContact O-N 3.32Å; A54-S58 PolarHBondContact O-OG 3.21Å; A55-S58 WeakPolarHBondContact CA-OG 3.36Å; A55-S58 PolarHBondContact O-OG 3.23Å; A55-S58 VanDerWaalsContact O-OG 3.12Å; S58-Q60 VanDerWaalsContact C-N 3.27Å; S58-Q60 PolarHBondContact O-N 2.85Å; S58-F61 PolarHBondContact O-N 2.91Å; S58-M62 PolarHBondContact O-N 3.26Å; S58-D74 VanDerWaalsContact CB-O 3.3Å; S58-D74 WeakPolarHBondContact CB-O 3.47Å
59S96.7Very high94.7Very high23 Ų2394.2 Ų94.216%0.16143%0.426CS..Hα-helixtrans-59.7-34.9169.5-174.20000112.5A55 Q56 R63A55-S59 VanDerWaalsContact O-CB 3.25Å; A55-S59 WeakPolarHBondContact O-CB 3.47Å; A55-S59 PolarHBondContact O-N 3.15Å; Q56-S59 WeakPolarHBondContact O-CB 3.45Å; Q56-S59 PolarHBondContact O-N 3.02Å; S59-R63 WeakPolarHBondContact O-CD 3.44Å; S59-R63 WeakPolarHBondContact O-CG 3.28Å; S59-R63 PolarHBondContact O-N 3.48Å; S59-R63 VanDerWaalsContact O-N 3.12Å
60Q96.3Very high94.8Very high88 Ų8891.6 Ų91.641%0.41142%0.42SS..Hα-helixtrans-66.7-48.5172.2-65.8170.634.200111.5Q56 T57 S58 M62 R63 H64Q56-Q60 WeakPolarHBondContact O-CG 3.47Å; Q56-Q60 PolarHBondContact O-N 3.03Å; T57-Q60 WeakPolarHBondContact O-CB 3.44Å; T57-Q60 PolarHBondContact O-N 3.16Å; S58-Q60 VanDerWaalsContact C-N 3.27Å; S58-Q60 PolarHBondContact O-N 2.85Å; Q60-M62 VanDerWaalsContact C-N 3.33Å; Q60-M62 PolarHBondContact O-N 2.92Å; Q60-R63 PolarHBondContact O-N 3Å; Q60-R63 VanDerWaalsContact O-N 3.12Å; Q60-H64 PolarHBondContact O-CD2 3.08Å; Q60-H64 PolarHBondContact O-N 3.3Å
61F96.8Very high94.8Very high59 Ų5987.7 Ų87.726%0.25941%0.411SS..Hα-helixtrans-57.4-43.8176.7-75.7-63000112.6T57 S58 R63 H64 A65 D74 R77 A78 W81T57-F61 HydrophobicContact CG2-CD2 4.34Å; T57-F61 HydrophobicContact CG2-CE2 3.91Å; T57-F61 WeakPolarHBondContact O-CD2 3.15Å; T57-F61 PolarHBondContact O-N 3.33Å; T57-F61 VanDerWaalsContact O-N 3.17Å; S58-F61 PolarHBondContact O-N 2.91Å; F61-R63 PolarHBondContact O-N 3.48Å; F61-H64 PolarHBondContact O-N 3.21Å; F61-A65 WeakPolarHBondContact O-CB 3.44Å; F61-A65 PolarHBondContact O-N 3.11Å; F61-D74 HydrophobicContact CB-CB 4.18Å; F61-R77 HydrophobicContact CD1-CB 4.17Å; F61-R77 HydrophobicContact CD2-CB 3.64Å; F61-R77 HydrophobicContact CE1-CB 4.29Å; F61-R77 HydrophobicContact CE2-CB 3.78Å; F61-R77 HydrophobicContact CG-CB 3.87Å; F61-R77 HydrophobicContact CZ-CB 4.11Å; F61-A78 HydrophobicContact CD2-CB 4.39Å; F61-A78 HydrophobicContact CE2-CB 4.43Å; F61-W81 HydrophobicContact CE2-CB 4.45Å; F61-W81 HydrophobicContact CZ-CB 4.49Å; F61-W81 HydrophobicContact CZ-CE3 4.39Å
62M97.3Very high94.9Very high23 Ų2385.5 Ų85.511%0.11340%0.401CS..Hα-helixtrans-56.6-46.7173.9-179.2-160.664.900112.1S58 Q60 A65 K66 R67 L70S58-M62 PolarHBondContact O-N 3.26Å; Q60-M62 VanDerWaalsContact C-N 3.33Å; Q60-M62 PolarHBondContact O-N 2.92Å; M62-A65 CarbonylContact O-C 3.55Å; M62-A65 PolarHBondContact O-N 3.27Å; M62-K66 PolarHBondContact O-N 3.43Å; M62-R67 HydrophobicContact CG-CB 4.04Å; M62-R67 WeakPolarHBondContact CG-O 3.4Å; M62-R67 PolarHBondContact O-N 3.35Å; M62-L70 HydrophobicContact CG-CB 4.49Å; M62-L70 HydrophobicContact SD-CB 3.84Å; M62-L70 PolarHBondContact SD-N 2.82Å
63R96.2Very high94.9Very high174 Ų17486.6 Ų86.666%0.65741%0.41SS*.Hα-helixtrans-66.4-42.1179.2-71.1169-170.9-143.80.5112.2S59 Q60 F61 A65 K66S59-R63 WeakPolarHBondContact O-CD 3.44Å; S59-R63 WeakPolarHBondContact O-CG 3.28Å; S59-R63 PolarHBondContact O-N 3.48Å; S59-R63 VanDerWaalsContact O-N 3.12Å; Q60-R63 PolarHBondContact O-N 3Å; Q60-R63 VanDerWaalsContact O-N 3.12Å; F61-R63 PolarHBondContact O-N 3.48Å; R63-A65 VanDerWaalsContact C-N 3.29Å; R63-A65 PolarHBondContact O-N 2.72Å; R63-K66 WeakPolarHBondContact O-CA 3.41Å; R63-K66 PolarHBondContact O-N 2.84Å
64H96.1Very high95Very high157 Ų15783.4 Ų83.473%0.72740%0.395SS*.Hα-helixtrans-64.2-34174.9-77.9-68.2000112.2Q60 F61 K66Q60-H64 PolarHBondContact O-CD2 3.08Å; Q60-H64 PolarHBondContact O-N 3.3Å; F61-H64 PolarHBondContact O-N 3.21Å; H64-K66 PolarHBondContact O-N 2.95Å
65A95.6Very high95.1Very high48 Ų4885.5 Ų85.540%0.39740%0.404SS..THydrogen-bonded Turntrans-74.65.7170.200000114.2F61 M62 R63 R67F61-A65 WeakPolarHBondContact O-CB 3.44Å; F61-A65 PolarHBondContact O-N 3.11Å; M62-A65 CarbonylContact O-C 3.55Å; M62-A65 PolarHBondContact O-N 3.27Å; R63-A65 VanDerWaalsContact C-N 3.29Å; R63-A65 PolarHBondContact O-N 2.72Å; A65-R67 PolarHBondContact O-N 2.82Å; A65-R67 VanDerWaalsContact O-N 3.14Å
66K95.3Very high95.1Very high196 Ų19683.8 Ų83.885%0.85239%0.387SS*.THydrogen-bonded Turntrans56.421.6-177-56.2-178-178.4177.80114.7M62 R63 H64M62-K66 PolarHBondContact O-N 3.43Å; R63-K66 WeakPolarHBondContact O-CA 3.41Å; R63-K66 PolarHBondContact O-N 2.84Å; H64-K66 PolarHBondContact O-N 2.95Å
67R95Very high95.1Very high75 Ų7582.7 Ų82.728%0.28338%0.378SS..  trans-93.3156.5179-74.8-175.2-76.295.8-0.6111.6M62 A65 K69 D74M62-R67 HydrophobicContact CG-CB 4.04Å; M62-R67 WeakPolarHBondContact CG-O 3.4Å; M62-R67 PolarHBondContact O-N 3.35Å; A65-R67 PolarHBondContact O-N 2.82Å; A65-R67 VanDerWaalsContact O-N 3.14Å; R67-K69 PolarHBondContact NH1-O 2.86Å; R67-K69 VanDerWaalsContact NH1-O 3.09Å; R67-D74 IonicContact CZ-OD1 2.85Å; R67-D74 IonicContact CZ-OD2 2.7Å; R67-D74 IonicContact NH1-OD1 3.59Å; R67-D74 IonicContact NH1-OD2 3.89Å; R67-D74 PolarHBondContact NH1-OD2 2.75Å; R67-D74 VanDerWaalsContact NH2-CG 3.31Å; R67-D74 IonicContact NH2-OD1 3.18Å; R67-D74 PolarHBondContact NH2-OD1 3.29Å; R67-D74 IonicContact NH2-OD2 3.41Å; R67-D74 PolarHBondContact NH2-OD2 3.49Å; R67-D74 VanDerWaalsContact NH2-OD2 3.1Å
68R94.1Very high95.1Very high244 Ų24481.6 Ų81.692%0.92137%0.372SS*.SBendtrans-109.5-9.5174-55.4-177.981.6176.95.4113.3
69K93.8Very high95Very high170 Ų17082.7 Ų82.774%0.73938%0.378SS*.SBendtrans-111.1124.5172-174179-179-178.80108.4R67R67-K69 PolarHBondContact NH1-O 2.86Å; R67-K69 VanDerWaalsContact NH1-O 3.09Å
70L92.9Very high94.9Very high76 Ų7688.9 Ų88.940%0.39840%0.397SS..  trans-73.3137.8174.6-171149.9000108.6M62 D74M62-L70 HydrophobicContact CG-CB 4.49Å; M62-L70 HydrophobicContact SD-CB 3.84Å; M62-L70 PolarHBondContact SD-N 2.82Å; L70-D74 HydrophobicContact CG-CB 4.35Å
71T92.4Very high94.7Very high46 Ų4693.9 Ų93.928%0.28241%0.412SS..  trans-117.9161.6179.561.40000111.3E73 D74 L75T71-E73 PolarHBondContact O-N 2.98Å; T71-E73 VanDerWaalsContact O-N 3.15Å; T71-D74 PolarHBondContact N-OD2 3.12Å; T71-D74 WeakPolarHBondContact O-CB 3.29Å; T71-D74 PolarHBondContact O-N 3.03Å; T71-D74 PolarHBondContact OG1-OD2 2.85Å; T71-L75 PolarHBondContact O-N 2.92Å
72V93.3Very high94.5Very high56 Ų5693.4 Ų93.434%0.33942%0.416SS..Hα-helixtrans-53.9-34.3175-176.70000111.2D74 L75 N76V72-D74 VanDerWaalsContact C-N 3.3Å; V72-D74 PolarHBondContact O-N 3.15Å; V72-L75 PolarHBondContact O-N 3.01Å; V72-N76 WeakPolarHBondContact O-CB 3.3Å; V72-N76 PolarHBondContact O-N 2.85Å
73E92.9Very high94.4Very high109 Ų109103.6 Ų103.651%0.50945%0.454SS..Hα-helixtrans-59.4-36173.9-54.8-174.4156.700113.7T71 N76 R77T71-E73 PolarHBondContact O-N 2.98Å; T71-E73 VanDerWaalsContact O-N 3.15Å; E73-N76 CarbonylContact O-C 3.58Å; E73-N76 PolarHBondContact O-N 3.14Å; E73-R77 WeakPolarHBondContact O-CB 3.38Å; E73-R77 WeakPolarHBondContact O-CD 3.49Å; E73-R77 WeakPolarHBondContact O-CG 3.43Å; E73-R77 PolarHBondContact O-N 3.47Å; E73-R77 IonicContact OE2-CZ 3.63Å; E73-R77 VanDerWaalsContact OE2-CZ 3.23Å; E73-R77 IonicContact OE2-NH1 3.03Å; E73-R77 PolarHBondContact OE2-NH1 3.18Å; E73-R77 IonicContact OE2-NH2 4Å; E73-R77 PolarHBondContact OE2-NH2 2.85Å
74D95.2Very high94.3Very high1 Ų199 Ų991%0.00545%0.445CS..Hα-helixtrans-73.4-35.6-178.9-60.7-33.3000111.3S58 F61 R67 L70 T71 V72 R77 A78S58-D74 VanDerWaalsContact CB-O 3.3Å; S58-D74 WeakPolarHBondContact CB-O 3.47Å; F61-D74 HydrophobicContact CB-CB 4.18Å; R67-D74 IonicContact CZ-OD1 2.85Å; R67-D74 IonicContact CZ-OD2 2.7Å; R67-D74 IonicContact NH1-OD1 3.59Å; R67-D74 IonicContact NH1-OD2 3.89Å; R67-D74 PolarHBondContact NH1-OD2 2.75Å; R67-D74 VanDerWaalsContact NH2-CG 3.31Å; R67-D74 IonicContact NH2-OD1 3.18Å; R67-D74 PolarHBondContact NH2-OD1 3.29Å; R67-D74 IonicContact NH2-OD2 3.41Å; R67-D74 PolarHBondContact NH2-OD2 3.49Å; R67-D74 VanDerWaalsContact NH2-OD2 3.1Å; L70-D74 HydrophobicContact CG-CB 4.35Å; T71-D74 PolarHBondContact N-OD2 3.12Å; T71-D74 WeakPolarHBondContact O-CB 3.29Å; T71-D74 PolarHBondContact O-N 3.03Å; T71-D74 PolarHBondContact OG1-OD2 2.85Å; V72-D74 VanDerWaalsContact C-N 3.3Å; V72-D74 PolarHBondContact O-N 3.15Å; D74-R77 PolarHBondContact O-N 2.93Å; D74-R77 IonicContact OD1-CZ 3.23Å; D74-R77 IonicContact OD1-NH1 3.77Å; D74-R77 PolarHBondContact OD1-NH1 2.71Å; D74-A78 PolarHBondContact O-N 2.71Å
75L94.9Very high94.1Very high59 Ų5999.9 Ų99.931%0.30945%0.449SS..Hα-helixtrans-66.8-46.5170.6-169.864.3000110.8A54 T71 V72 R77 A78 L79A54-L75 HydrophobicContact CB-CD1 4.34Å; T71-L75 PolarHBondContact O-N 2.92Å; V72-L75 PolarHBondContact O-N 3.01Å; L75-R77 PolarHBondContact O-N 3.41Å; L75-A78 CarbonylContact O-C 3.57Å; L75-A78 WeakPolarHBondContact O-CA 3.28Å; L75-A78 WeakPolarHBondContact O-CB 3.43Å; L75-A78 PolarHBondContact O-N 2.85Å; L75-L79 HydrophobicContact CG-CD1 4.4Å; L75-L79 WeakPolarHBondContact O-CG 3.34Å; L75-L79 PolarHBondContact O-N 3.22Å
76N95Very high93.8Very high17 Ų1798.8 Ų98.89%0.09144%0.44CS..Hα-helixtrans-68.7-17.5175.5-81.6-21.1000113.8V72 E73 R80 A86 I87V72-N76 WeakPolarHBondContact O-CB 3.3Å; V72-N76 PolarHBondContact O-N 2.85Å; E73-N76 CarbonylContact O-C 3.58Å; E73-N76 PolarHBondContact O-N 3.14Å; N76-R80 VanDerWaalsContact O-CD 3.28Å; N76-R80 WeakPolarHBondContact O-CD 3.25Å; N76-R80 WeakPolarHBondContact O-CG 3.43Å; N76-R80 PolarHBondContact O-NH1 2.93Å; N76-A86 HydrophobicContact CB-CB 4.16Å; N76-A86 WeakPolarHBondContact OD1-CA 3.24Å; N76-I87 PolarHBondContact ND2-O 3.27Å; N76-I87 PolarHBondContact OD1-N 2.85Å
77R94.7Very high93.5Very high91 Ų9193.5 Ų93.534%0.34342%0.42SS..Hα-helixtrans-75.2-43.6164.7-75.7162.2-173.3122.513.1111.1F61 E73 D74 L75 W81F61-R77 HydrophobicContact CD1-CB 4.17Å; F61-R77 HydrophobicContact CD2-CB 3.64Å; F61-R77 HydrophobicContact CE1-CB 4.29Å; F61-R77 HydrophobicContact CE2-CB 3.78Å; F61-R77 HydrophobicContact CG-CB 3.87Å; F61-R77 HydrophobicContact CZ-CB 4.11Å; E73-R77 WeakPolarHBondContact O-CB 3.38Å; E73-R77 WeakPolarHBondContact O-CD 3.49Å; E73-R77 WeakPolarHBondContact O-CG 3.43Å; E73-R77 PolarHBondContact O-N 3.47Å; E73-R77 IonicContact OE2-CZ 3.63Å; E73-R77 VanDerWaalsContact OE2-CZ 3.23Å; E73-R77 IonicContact OE2-NH1 3.03Å; E73-R77 PolarHBondContact OE2-NH1 3.18Å; E73-R77 IonicContact OE2-NH2 4Å; E73-R77 PolarHBondContact OE2-NH2 2.85Å; D74-R77 PolarHBondContact O-N 2.93Å; D74-R77 IonicContact OD1-CZ 3.23Å; D74-R77 IonicContact OD1-NH1 3.77Å; D74-R77 PolarHBondContact OD1-NH1 2.71Å; L75-R77 PolarHBondContact O-N 3.41Å; R77-W81 WeakPolarHBondContact O-CB 3.37Å; R77-W81 PolarHBondContact O-N 3.18Å
78A96.1Very high93.1Very high0 Ų095 Ų950%044%0.442CS..Hα-helixtrans-64.2-45.8177.200000113.1T57 F61 D74 L75 R80 W81 S82T57-A78 HydrophobicContact CG2-CB 3.84Å; F61-A78 HydrophobicContact CD2-CB 4.39Å; F61-A78 HydrophobicContact CE2-CB 4.43Å; D74-A78 PolarHBondContact O-N 2.71Å; L75-A78 CarbonylContact O-C 3.57Å; L75-A78 WeakPolarHBondContact O-CA 3.28Å; L75-A78 WeakPolarHBondContact O-CB 3.43Å; L75-A78 PolarHBondContact O-N 2.85Å; A78-R80 PolarHBondContact O-N 3.17Å; A78-W81 WeakPolarHBondContact O-CB 3.22Å; A78-W81 PolarHBondContact O-N 3.41Å; A78-S82 PolarHBondContact O-N 3.01Å; A78-S82 PolarHBondContact O-OG 3.5Å
79L94.1Very high92.6Very high25 Ų2587.4 Ų87.413%0.13144%0.439CS..Hα-helixtrans-59.1-50.2177.9-68174.1000111.4L75 W81 S82 R83 V84 I87L75-L79 HydrophobicContact CG-CD1 4.4Å; L75-L79 WeakPolarHBondContact O-CG 3.34Å; L75-L79 PolarHBondContact O-N 3.22Å; L79-W81 VanDerWaalsContact C-N 3.28Å; L79-W81 PolarHBondContact O-N 3.04Å; L79-S82 CarbonylContact O-C 3.6Å; L79-S82 WeakPolarHBondContact O-CA 3.44Å; L79-S82 PolarHBondContact O-N 3.12Å; L79-S82 VanDerWaalsContact O-N 3.08Å; L79-R83 PolarHBondContact O-N 3Å; L79-R83 VanDerWaalsContact O-N 3.11Å; L79-V84 CarbonylContact C-O 3.59Å; L79-V84 VanDerWaalsContact C-O 3.3Å; L79-V84 HydrophobicContact CB-CB 4.14Å; L79-V84 HydrophobicContact CD2-CB 4.16Å; L79-V84 HydrophobicContact CD2-CG1 4.09Å; L79-V84 PolarHBondContact O-N 3.18Å; L79-I87 HydrophobicContact CD1-CD1 3.89Å; L79-I87 HydrophobicContact CD1-CG1 3.71Å
80R94.6Very high92Very high152 Ų15285.9 Ų85.957%0.57443%0.43SS*.Hα-helixtrans-60.5-34.9175.8-68.5173.8-168.4134.60.7113N76 A78 R83 V84 A86N76-R80 VanDerWaalsContact O-CD 3.28Å; N76-R80 WeakPolarHBondContact O-CD 3.25Å; N76-R80 WeakPolarHBondContact O-CG 3.43Å; N76-R80 PolarHBondContact O-NH1 2.93Å; A78-R80 PolarHBondContact O-N 3.17Å; R80-R83 PolarHBondContact O-N 2.92Å; R80-R83 VanDerWaalsContact O-N 3.12Å; R80-V84 PolarHBondContact N-O 3.13Å; R80-A86 HydrophobicContact CG-CB 4.35Å
81W93.5Very high91.1Very high193 Ų19385.4 Ų85.473%0.73144%0.443SS*.Hα-helixtrans-63.8-42.5174.7-176.9-89.7000111.4F61 R77 A78 L79 R83F61-W81 HydrophobicContact CE2-CB 4.45Å; F61-W81 HydrophobicContact CZ-CB 4.49Å; F61-W81 HydrophobicContact CZ-CE3 4.39Å; R77-W81 WeakPolarHBondContact O-CB 3.37Å; R77-W81 PolarHBondContact O-N 3.18Å; A78-W81 WeakPolarHBondContact O-CB 3.22Å; A78-W81 PolarHBondContact O-N 3.41Å; L79-W81 VanDerWaalsContact C-N 3.28Å; L79-W81 PolarHBondContact O-N 3.04Å; W81-R83 PolarHBondContact O-N 2.88Å
82S92.5Very high90.4Very high49 Ų4986.7 Ų86.734%0.34346%0.458SS..THydrogen-bonded Turntrans-77.39.6171.8-58.20000114.3A78 L79 V84A78-S82 PolarHBondContact O-N 3.01Å; A78-S82 PolarHBondContact O-OG 3.5Å; L79-S82 CarbonylContact O-C 3.6Å; L79-S82 WeakPolarHBondContact O-CA 3.44Å; L79-S82 PolarHBondContact O-N 3.12Å; L79-S82 VanDerWaalsContact O-N 3.08Å; S82-V84 PolarHBondContact O-N 2.74Å
83R93.4Very high89.3Confident237 Ų23793.4 Ų93.489%0.89449%0.486SS*.THydrogen-bonded Turntrans60.719.3-176.6-51-179.2-178178.50.8115.5L79 R80 W81L79-R83 PolarHBondContact O-N 3Å; L79-R83 VanDerWaalsContact O-N 3.11Å; R80-R83 PolarHBondContact O-N 2.92Å; R80-R83 VanDerWaalsContact O-N 3.12Å; W81-R83 PolarHBondContact O-N 2.88Å
84V93.9Very high88.6Confident78 Ų7894.4 Ų94.447%0.47349%0.494SS..PPolyproline II helixtrans-85.1148170.5-174.50000109.1L79 R80 S82L79-V84 CarbonylContact C-O 3.59Å; L79-V84 VanDerWaalsContact C-O 3.3Å; L79-V84 HydrophobicContact CB-CB 4.14Å; L79-V84 HydrophobicContact CD2-CB 4.16Å; L79-V84 HydrophobicContact CD2-CG1 4.09Å; L79-V84 PolarHBondContact O-N 3.18Å; R80-V84 PolarHBondContact N-O 3.13Å; S82-V84 PolarHBondContact O-N 2.74Å
85E92.2Very high87.7Confident175 Ų17598.7 Ų98.782%0.81853%0.53SS*.PPolyproline II helixtrans-63.1155.1175.2-59.6-164154.800111.8
86A89.6Confident87Confident25 Ų25100.2 Ų100.221%0.20754%0.538CS..PPolyproline II helixtrans-87.1130.2-179.400000110.6N76 R80 C88N76-A86 HydrophobicContact CB-CB 4.16Å; N76-A86 WeakPolarHBondContact OD1-CA 3.24Å; R80-A86 HydrophobicContact CG-CB 4.35Å; A86-C88 PolarHBondContact O-N 3.17Å
87I89.3Confident86.2Confident85 Ų85102.3 Ų102.344%0.43655%0.553SS.*PPolyproline II helixtrans-71.2116.6-179.5-48176.1000108.4N76 L79 Y90N76-I87 PolarHBondContact ND2-O 3.27Å; N76-I87 PolarHBondContact OD1-N 2.85Å; L79-I87 HydrophobicContact CD1-CD1 3.89Å; L79-I87 HydrophobicContact CD1-CG1 3.71Å; I87-Y90 HydrophobicContact CB-CD2 4.48Å; I87-Y90 HydrophobicContact CG2-CD2 3.55Å; I87-Y90 HydrophobicContact CG2-CE2 3.54Å
88C86.6Confident85.6Confident108 Ų108105.3 Ų105.373%0.7357%0.569SS**PPolyproline II helixtrans-87.4170.7177.6-66.60000111.2A86 Y90A86-C88 PolarHBondContact O-N 3.17Å; C88-Y90 VanDerWaalsContact O-CD2 3.25Å; C88-Y90 WeakPolarHBondContact O-CD2 3.42Å; C88-Y90 PolarHBondContact O-N 2.84Å
89G83.6Confident85Confident84 Ų84110.3 Ų110.387%0.86659%0.587SS**SBendtrans83.1-25.2-178.900000115.3
90Y81.1Confident84.5Confident138 Ų138112.8 Ų112.854%0.54161%0.607SS.*  trans-92.9131.8178.7-59-88.8000112.1I87 C88 L96I87-Y90 HydrophobicContact CB-CD2 4.48Å; I87-Y90 HydrophobicContact CG2-CD2 3.55Å; I87-Y90 HydrophobicContact CG2-CE2 3.54Å; C88-Y90 VanDerWaalsContact O-CD2 3.25Å; C88-Y90 WeakPolarHBondContact O-CD2 3.42Å; C88-Y90 PolarHBondContact O-N 2.84Å; Y90-L96 HydrophobicContact CD1-CD1 3.75Å; Y90-L96 HydrophobicContact CE1-CD1 3.55Å
91G75.3Confident83.8Confident66 Ų66108.8 Ų108.868%0.6860%0.599SS**  trans145.9-10.1-179.900000115.4
92A76.8Confident82.9Confident72 Ų72109.6 Ų109.660%0.59561%0.608SS**  trans-59.3160.5168.200000111.9D94A92-D94 VanDerWaalsContact C-N 3.35Å; A92-D94 HydrophobicContact CB-CB 4.48Å
93Q70.8Confident81.6Confident198 Ų198116.6 Ų116.693%0.92564%0.635SS**SBendtrans-83.8-16.9171.5-63.9-170.241.500112.2
94D78.2Confident80.1Confident129 Ų129107 Ų10769%0.6961%0.61SS**SBendtrans-64.6138.2178.8-52.6-75.1000111.3A92A92-D94 VanDerWaalsContact C-N 3.35Å; A92-D94 HydrophobicContact CB-CB 4.48Å
95A76.6Confident79.1Confident92 Ų92112.2 Ų112.276%0.7663%0.629SS**  trans-72.3139.8175.600000110.3P97A95-P97 WeakPolarHBondContact O-CD 3.3Å
96L79.2Confident78.5Confident90 Ų90108.7 Ų108.747%0.47162%0.616SS.*  trans-97.995.7169.7-62176.8000108.5Y90 F98 V109Y90-L96 HydrophobicContact CD1-CD1 3.75Å; Y90-L96 HydrophobicContact CE1-CD1 3.55Å; L96-F98 PolarHBondContact O-N 2.87Å; L96-V109 HydrophobicContact CB-CG1 4.35Å; L96-V109 HydrophobicContact CD2-CG1 4.32Å
97P79.1Confident78.1Confident61 Ų61114.3 Ų114.340%0.39664%0.635SS.*  trans-75.7118.6-179.730.4-34.6000110.6A95 R99A95-P97 WeakPolarHBondContact O-CD 3.3Å; P97-R99 PolarHBondContact O-N 3.1Å
98F81.4Confident77.9Confident155 Ų155114.9 Ų114.968%0.6864%0.635SS**EExtended strand (participates in β ladder)trans-67.8127.3165.1-64.8-84.1000109.5L96 F108 V109L96-F98 PolarHBondContact O-N 2.87Å; F98-F108 WeakPolarHBondContact CA-O 3.45Å; F98-V109 HydrophobicContact CD1-CG2 4.02Å; F98-V109 HydrophobicContact CE1-CG2 3.91Å
99R84Confident77.8Confident105 Ų105112 Ų11240%0.39661%0.614SS.*EExtended strand (participates in β ladder)trans-110.5138.6174.4-64.2-171.2176.3-163.94.7109.7P97 F107 F108 E110P97-R99 PolarHBondContact O-N 3.1Å; R99-F107 CarbonylContact O-C 3.59Å; R99-F107 VanDerWaalsContact O-CA 3.3Å; R99-F107 WeakPolarHBondContact O-CA 3.39Å; R99-F108 HydrophobicContact CB-CD1 4.3Å; R99-F108 HydrophobicContact CB-CE1 3.85Å; R99-F108 HydrophobicContact CB-CE2 4.41Å; R99-F108 HydrophobicContact CB-CZ 3.91Å; R99-F108 PolarHBondContact N-O 3.23Å; R99-F108 VanDerWaalsContact O-CD1 3.28Å; R99-F108 WeakPolarHBondContact O-CD1 3.31Å; R99-F108 PolarHBondContact O-N 3.34Å; R99-E110 IonicContact CZ-OE1 3.94Å; R99-E110 IonicContact CZ-OE2 3.84Å; R99-E110 VanDerWaalsContact CZ-OE2 3.3Å; R99-E110 IonicContact NE-OE1 2.98Å; R99-E110 IonicContact NE-OE2 2.68Å; R99-E110 IonicContact NH1-OE1 2.83Å; R99-E110 PolarHBondContact NH1-OE1 2.89Å; R99-E110 IonicContact NH1-OE2 2.68Å; R99-E110 IonicContact NH2-OE1 3.93Å; R99-E110 PolarHBondContact NH2-OE1 3.35Å; R99-E110 IonicContact NH2-OE2 3.74Å; R99-E110 PolarHBondContact NH2-OE2 2.95Å
100S82.9Confident77.7Confident77 Ų77110.9 Ų110.954%0.53859%0.586SS.*EExtended strand (participates in β ladder)trans-90.6145.2171.849.30000111.8L106S100-L106 WeakPolarHBondContact CA-O 3.14Å
101V80.8Confident77.7Confident67 Ų67111.8 Ų111.841%0.40660%0.6SS.*  trans-77.9148.3164.3-175.60000108.6E103 L106 F108V101-E103 VanDerWaalsContact C-N 3.34Å; V101-L106 HydrophobicContact CG2-CB 4.3Å; V101-L106 PolarHBondContact N-O 2.68Å; V101-F108 HydrophobicContact CG2-CD1 4.03Å; V101-F108 HydrophobicContact CG2-CE1 3.95Å
102K74.1Confident77.9Confident211 Ų211116.9 Ų116.992%0.91760%0.599SS**THydrogen-bonded Turntrans-78.9-14.4-176.3-70.5-175.1177.8179.80114.8
103E65.6Low78.3Confident195 Ų195123.1 Ų123.191%0.91162%0.616SS**THydrogen-bonded Turntrans-119.418.7-169.6-62.6179.9152.400112.5V101V101-E103 VanDerWaalsContact C-N 3.34Å
104G61.8Low78.9Confident36 Ų36119.4 Ų119.437%0.37160%0.601SS.*SBendtrans-178.7161.9172.800000111.7L106G104-L106 PolarHBondContact O-N 2.74Å
105E72.1Confident79.4Confident187 Ų187116.8 Ų116.887%0.87459%0.587SS**SBendtrans-74.932.8-178.8-57.6-167.6153.900113.5F107E105-F107 WeakPolarHBondContact O-CD2 3.44Å
106L79.5Confident80.1Confident102 Ų102118.7 Ų118.753%0.53458%0.584SS.*  trans-91.1127.5-176.9-65.3174.4000110.9L26 S100 V101 G104L26-L106 HydrophobicContact CD1-CD2 4.42Å; S100-L106 WeakPolarHBondContact CA-O 3.14Å; V101-L106 HydrophobicContact CG2-CB 4.3Å; V101-L106 PolarHBondContact N-O 2.68Å; G104-L106 PolarHBondContact O-N 2.74Å
107F82.3Confident80.7Confident142 Ų142120.1 Ų120.162%0.62359%0.591SS**EExtended strand (participates in β ladder)trans-113133.2175.7-63.6-92.9000110.5R99 E105R99-F107 CarbonylContact O-C 3.59Å; R99-F107 VanDerWaalsContact O-CA 3.3Å; R99-F107 WeakPolarHBondContact O-CA 3.39Å; E105-F107 WeakPolarHBondContact O-CD2 3.44Å
108F83.9Confident81.1Confident97 Ų97123.7 Ų123.743%0.42560%0.602SS.*EExtended strand (participates in β ladder)trans-131.5159.5177.269-78.7000111.3F98 R99 V101 E110F98-F108 WeakPolarHBondContact CA-O 3.45Å; R99-F108 HydrophobicContact CB-CD1 4.3Å; R99-F108 HydrophobicContact CB-CE1 3.85Å; R99-F108 HydrophobicContact CB-CE2 4.41Å; R99-F108 HydrophobicContact CB-CZ 3.91Å; R99-F108 PolarHBondContact N-O 3.23Å; R99-F108 VanDerWaalsContact O-CD1 3.28Å; R99-F108 WeakPolarHBondContact O-CD1 3.31Å; R99-F108 PolarHBondContact O-N 3.34Å; V101-F108 HydrophobicContact CG2-CD1 4.03Å; V101-F108 HydrophobicContact CG2-CE1 3.95Å; F108-E110 HydrophobicContact CE2-CB 4.4Å
109V84.6Confident81.3Confident48 Ų48121.6 Ų121.629%0.29160%0.597SS.*EExtended strand (participates in β ladder)trans-94.4131.4165.8179.50000107.1L96 F98 D111L96-V109 HydrophobicContact CB-CG1 4.35Å; L96-V109 HydrophobicContact CD2-CG1 4.32Å; F98-V109 HydrophobicContact CD1-CG2 4.02Å; F98-V109 HydrophobicContact CE1-CG2 3.91Å; V109-D111 PolarHBondContact O-N 3.39Å
110E81.7Confident81.3Confident61 Ų61120.7 Ų120.729%0.28561%0.612SS.*  trans-76.1103.1175.7175.6-171.1-110.400109.7R99 F108 R112R99-E110 IonicContact CZ-OE1 3.94Å; R99-E110 IonicContact CZ-OE2 3.84Å; R99-E110 VanDerWaalsContact CZ-OE2 3.3Å; R99-E110 IonicContact NE-OE1 2.98Å; R99-E110 IonicContact NE-OE2 2.68Å; R99-E110 IonicContact NH1-OE1 2.83Å; R99-E110 PolarHBondContact NH1-OE1 2.89Å; R99-E110 IonicContact NH1-OE2 2.68Å; R99-E110 IonicContact NH2-OE1 3.93Å; R99-E110 PolarHBondContact NH2-OE1 3.35Å; R99-E110 IonicContact NH2-OE2 3.74Å; R99-E110 PolarHBondContact NH2-OE2 2.95Å; F108-E110 HydrophobicContact CE2-CB 4.4Å; E110-R112 HydrophobicContact CG-CG 4.37Å; E110-R112 PolarHBondContact O-N 3.32Å; E110-R112 IonicContact OE2-CZ 2.72Å; E110-R112 IonicContact OE2-NE 3.92Å; E110-R112 PolarHBondContact OE2-NE 2.96Å; E110-R112 IonicContact OE2-NH2 3.49Å; E110-R112 PolarHBondContact OE2-NH2 3.38Å
111D80.9Confident81.5Confident157 Ų157123.4 Ų123.484%0.8462%0.62SS**PPolyproline II helixtrans-65.5124167.7-77-31.9000109.6V109V109-D111 PolarHBondContact O-N 3.39Å
112R80.4Confident81.7Confident173 Ų173122.7 Ų122.765%0.65362%0.622SS**PPolyproline II helixtrans-102.4127.6179.7-66.1-178.7177.7175.50.5109.7E110 I114E110-R112 HydrophobicContact CG-CG 4.37Å; E110-R112 PolarHBondContact O-N 3.32Å; E110-R112 IonicContact OE2-CZ 2.72Å; E110-R112 IonicContact OE2-NE 3.92Å; E110-R112 PolarHBondContact OE2-NE 2.96Å; E110-R112 IonicContact OE2-NH2 3.49Å; E110-R112 PolarHBondContact OE2-NH2 3.38Å; R112-I114 PolarHBondContact O-N 3.18Å
113E84.5Confident81.8Confident203 Ų203118.8 Ų118.895%0.94962%0.616SS**PPolyproline II helixtrans-63.1133.2169.7-63.3-175.3179.200110.1
114I83.9Confident82.3Confident119 Ų119116.4 Ų116.461%0.6161%0.609SS**  trans-116.9117.7-178.8-59.7176.5000108.3R112 L116 L119R112-I114 PolarHBondContact O-N 3.18Å; I114-L116 PolarHBondContact O-N 2.94Å; I114-L119 HydrophobicContact CG2-CD2 4.04Å
115N88.9Confident83Confident75 Ų75121.6 Ų121.640%0.40163%0.627SS.*  trans-70.3101.9173.1-173-9000110.2I117 E118 L119N115-I117 PolarHBondContact O-N 3.17Å; N115-I117 WeakPolarHBondContact OD1-CB 3.42Å; N115-I117 PolarHBondContact OD1-N 3.33Å; N115-E118 HydrophobicContact CB-CB 4.17Å; N115-E118 HydrophobicContact CB-CG 4.24Å; N115-E118 VanDerWaalsContact ND2-CD 3.31Å; N115-E118 WeakPolarHBondContact ND2-CG 3.39Å; N115-E118 PolarHBondContact ND2-OE1 3.44Å; N115-E118 PolarHBondContact O-N 3.05Å; N115-L119 PolarHBondContact O-N 3.17Å
116L89.7Confident83.1Confident132 Ų132118.3 Ų118.369%0.69162%0.621SS**Hα-helixtrans-59.6-27.2179.9-61.1178.9000113.1I114 A120I114-L116 PolarHBondContact O-N 2.94Å; L116-A120 VanDerWaalsContact O-CB 3.23Å; L116-A120 WeakPolarHBondContact O-CB 3.21Å; L116-A120 PolarHBondContact O-N 2.88Å
117I91.4Very high83.1Confident120 Ų120123.3 Ų123.362%0.61564%0.639SS**Hα-helixtrans-72.4-46.8178.9-56.7175000109.9N115 A120 L121N115-I117 PolarHBondContact O-N 3.17Å; N115-I117 WeakPolarHBondContact OD1-CB 3.42Å; N115-I117 PolarHBondContact OD1-N 3.33Å; I117-A120 PolarHBondContact O-N 2.96Å; I117-L121 HydrophobicContact CG2-CD1 4.02Å; I117-L121 WeakPolarHBondContact O-CB 3.48Å; I117-L121 VanDerWaalsContact O-CG 3.28Å; I117-L121 WeakPolarHBondContact O-CG 3.42Å; I117-L121 PolarHBondContact O-N 3.12Å
118E87.8Confident82.7Confident135 Ų135120 Ų12063%0.63165%0.645SS**Hα-helixtrans-63.7-42.1175.5-73.4168.5-141.400111.5N115 A120 L121 A122N115-E118 HydrophobicContact CB-CB 4.17Å; N115-E118 HydrophobicContact CB-CG 4.24Å; N115-E118 VanDerWaalsContact ND2-CD 3.31Å; N115-E118 WeakPolarHBondContact ND2-CG 3.39Å; N115-E118 PolarHBondContact ND2-OE1 3.44Å; N115-E118 PolarHBondContact O-N 3.05Å; E118-A120 PolarHBondContact O-N 3.44Å; E118-L121 CarbonylContact O-C 3.44Å; E118-L121 PolarHBondContact O-N 3.12Å; E118-A122 PolarHBondContact O-N 3.24Å
119L85.5Confident82.4Confident111 Ų111121.7 Ų121.758%0.58167%0.667SS**Hα-helixtrans-63-39.4176.7-17662.5000112.3I114 N115 L121 A122I114-L119 HydrophobicContact CG2-CD2 4.04Å; N115-L119 PolarHBondContact O-N 3.17Å; L119-L121 VanDerWaalsContact C-N 3.33Å; L119-A122 WeakPolarHBondContact O-CB 3.47Å; L119-A122 PolarHBondContact O-N 3.36Å
120A84.2Confident82Confident86 Ų86123.8 Ų123.871%0.71169%0.69SS**Hα-helixtrans-72.4-24.2176.700000113.5L116 I117 E118L116-A120 VanDerWaalsContact O-CB 3.23Å; L116-A120 WeakPolarHBondContact O-CB 3.21Å; L116-A120 PolarHBondContact O-N 2.88Å; I117-A120 PolarHBondContact O-N 2.96Å; E118-A120 PolarHBondContact O-N 3.44Å
121L88.4Confident82.2Confident134 Ų134129.3 Ų129.370%0.70272%0.716SS**Hα-helixtrans-89.9-8175.1-67.5172.9000113.2I117 E118 L119 T123I117-L121 HydrophobicContact CG2-CD1 4.02Å; I117-L121 WeakPolarHBondContact O-CB 3.48Å; I117-L121 VanDerWaalsContact O-CG 3.28Å; I117-L121 WeakPolarHBondContact O-CG 3.42Å; I117-L121 PolarHBondContact O-N 3.12Å; E118-L121 CarbonylContact O-C 3.44Å; E118-L121 PolarHBondContact O-N 3.12Å; L119-L121 VanDerWaalsContact C-N 3.33Å; L121-T123 PolarHBondContact O-N 3.37Å
122A83.9Confident82.4Confident53 Ų53128.7 Ų128.744%0.43872%0.718SS.*  trans-66.3117.1-178.700000111.8E118 L119 N124E118-A122 PolarHBondContact O-N 3.24Å; L119-A122 WeakPolarHBondContact O-CB 3.47Å; L119-A122 PolarHBondContact O-N 3.36Å; A122-N124 PolarHBondContact O-N 3.38Å; A122-N124 VanDerWaalsContact O-N 3.15Å
123T76.2Confident82.8Confident129 Ų129127.2 Ų127.279%0.79172%0.721SS**  trans-73.6-1.1-17950.90000114.5L121 I125L121-T123 PolarHBondContact O-N 3.37Å; T123-I125 VanDerWaalsContact C-N 3.26Å; T123-I125 PolarHBondContact O-N 3.18Å
124N76.9Confident82.9Confident145 Ų145123.6 Ų123.678%0.77571%0.712SS**  trans-8064-176.9-69.9-41.6000112.3A122 P126A122-N124 PolarHBondContact O-N 3.38Å; A122-N124 VanDerWaalsContact O-N 3.15Å; N124-P126 WeakPolarHBondContact O-CD 3.5Å
125I76.2Confident82.8Confident145 Ų145128.2 Ų128.274%0.74472%0.722SS**PPolyproline II helixtrans-60.4127173.8-57.5174.6000109.1T123 K127T123-I125 VanDerWaalsContact C-N 3.26Å; T123-I125 PolarHBondContact O-N 3.18Å; I125-K127 PolarHBondContact O-N 2.97Å
126P74.5Confident82.4Confident117 Ų117130.6 Ų130.676%0.7674%0.739SS**PPolyproline II helixtrans-56.8121.9176-26.435.3000111.5N124 G128N124-P126 WeakPolarHBondContact O-CD 3.5Å; P126-G128 PolarHBondContact O-N 3.47Å
127K78.9Confident81.7Confident207 Ų207130.9 Ų130.990%0.974%0.741SS**PPolyproline II helixtrans-66.5121.3175.4-64.9179.7-177.5176.80108.7I125I125-K127 PolarHBondContact O-N 2.97Å
128G73.3Confident80.6Confident73 Ų73130 Ų13075%0.75374%0.742SS**PPolyproline II helixtrans-58.7146.817800000112P126P126-G128 PolarHBondContact O-N 3.47Å
129C78.4Confident79.2Confident132 Ų132128 Ų12889%0.89275%0.748SS**PPolyproline II helixtrans-64.4143.7172.7-59.80000110.5
130A76.5Confident78.1Confident92 Ų92129.7 Ų129.776%0.7675%0.748SS**PPolyproline II helixtrans-63.3153.5171.500000111.3
131E84.8Confident76.3Confident178 Ų178134.4 Ų134.483%0.83276%0.76SS**PPolyproline II helixtrans-61.4148.4177.5-63.1-168.3155.500112.1I133E131-I133 PolarHBondContact O-N 3.37Å
132T86.1Confident74.3Confident144 Ų144133.8 Ų133.888%0.88376%0.757SS**  trans-81.491.3-172.8-54.30000111.4
133I88.5Confident72.5Confident142 Ų142134.4 Ų134.473%0.72877%0.769SS**  trans-86.1129.5178.7-59.6171.7000110.8E131 R135E131-I133 PolarHBondContact O-N 3.37Å; I133-R135 HydrophobicContact CG2-CG 4.48Å
134V86.9Confident71Confident126 Ų126137.1 Ų137.176%0.76477%0.77SS**  trans-84.7115.2172-179.60000109.7V136V134-V136 HydrophobicContact CG1-CG2 4.32Å
135R81.8Confident69.2Low217 Ų217133.6 Ų133.682%0.81977%0.767SS**  trans-99.6126.9170-62.8-176.670.8163.93.9109.6I133I133-R135 HydrophobicContact CG2-CG 4.48Å
136V81.4Confident67.6Low125 Ų125130.9 Ų130.976%0.75876%0.755SS**  trans-102.5113.3178.7-178.90000109.2V134V134-V136 HydrophobicContact CG1-CG2 4.32Å
137N73.6Confident66.3Low137 Ų137132.1 Ų132.173%0.73376%0.76SS**  trans-110.1130.2172.7-64.9-0.4000108.7A139N137-A139 PolarHBondContact O-N 3.43Å; N137-A139 VanDerWaalsContact O-N 3.16Å
138V69.4Low64.4Low103 Ų103129.2 Ų129.262%0.62475%0.749SS**  trans-8491.8178.3-172.80000109.9Y140V138-Y140 HydrophobicContact CB-CE2 4.19Å; V138-Y140 HydrophobicContact CG1-CD1 4.27Å; V138-Y140 HydrophobicContact CG1-CD2 3.9Å; V138-Y140 HydrophobicContact CG1-CE1 3.94Å; V138-Y140 HydrophobicContact CG1-CE2 3.55Å; V138-Y140 HydrophobicContact CG1-CG 4.25Å; V138-Y140 PolarHBondContact O-N 3.16Å
139A58.4Low62.9Low92 Ų92131.3 Ų131.376%0.7675%0.75SS**  trans-81.296.7167.600000109.4N137 L141N137-A139 PolarHBondContact O-N 3.43Å; N137-A139 VanDerWaalsContact O-N 3.16Å; A139-L141 PolarHBondContact O-N 3.36Å
140Y63Low61.1Low147 Ų147129.4 Ų129.458%0.57673%0.728SS**  trans-66.8112.3172.8-65.7-87.1000109.9V138 D142 Y237V138-Y140 HydrophobicContact CB-CE2 4.19Å; V138-Y140 HydrophobicContact CG1-CD1 4.27Å; V138-Y140 HydrophobicContact CG1-CD2 3.9Å; V138-Y140 HydrophobicContact CG1-CE1 3.94Å; V138-Y140 HydrophobicContact CG1-CE2 3.55Å; V138-Y140 HydrophobicContact CG1-CG 4.25Å; V138-Y140 PolarHBondContact O-N 3.16Å; Y140-D142 PolarHBondContact O-N 3.35Å; Y140-Y237 HydrophobicContact CE1-CD1 4.34Å; Y140-Y237 AromaticContact CE1-CE1 3.64Å; Y140-Y237 HydrophobicContact CE1-CE1 3.64Å; Y140-Y237 PolarHBondContact OH-OH 2.96Å
141L45.4Very low59.7Low184 Ų184127.7 Ų127.796%0.96372%0.719SS**  trans-78.157.1163.6-78.2167.1000110A139A139-L141 PolarHBondContact O-N 3.36Å
142D47.3Very low57.9Low121 Ų121124.6 Ų124.665%0.64771%0.712SS**  trans-80.3145.3164.2-160.21.5000109.6Y140 K144Y140-D142 PolarHBondContact O-N 3.35Å; D142-K144 VanDerWaalsContact C-N 3.3Å; D142-K144 PolarHBondContact O-N 3.14Å
143G45.8Very low56.5Low67 Ų67119 Ų11969%0.69168%0.678SS**SBendtrans-76.173.6-168.300000113
144K43.1Very low54.8Low186 Ų186116 Ų11681%0.80967%0.667SS**SBendtrans85134.4-161-53.8161.9-177.3177.20110.9D142 N146D142-K144 VanDerWaalsContact C-N 3.3Å; D142-K144 PolarHBondContact O-N 3.14Å; K144-N146 PolarHBondContact O-N 3.02Å
145G39.3Very low53.2Low70 Ų70114.5 Ų114.572%0.72266%0.659SS**  trans-70.191.2177.300000111.6V147G145-V147 PolarHBondContact O-N 3.26Å; G145-V147 VanDerWaalsContact O-N 3.1Å
146N42.9Very low52Low89 Ų89104.6 Ų104.648%0.47662%0.624SS.*THydrogen-bonded Turntrans-88.947.1-178.2-149.323.5000111.6K144 E148 Q150K144-N146 PolarHBondContact O-N 3.02Å; N146-E148 VanDerWaalsContact C-N 3.33Å; N146-Q150 VanDerWaalsContact ND2-CD 3.28Å; N146-Q150 PolarHBondContact ND2-NE2 3.28Å; N146-Q150 PolarHBondContact OD1-NE2 3.4Å
147V47.1Very low51Low143 Ų143100 Ų10087%0.86760%0.595SS**THydrogen-bonded Turntrans-95.33.3168.6-162.30000110.6G145G145-V147 PolarHBondContact O-N 3.26Å; G145-V147 VanDerWaalsContact O-N 3.1Å
148E40.1Very low50.4Low145 Ų145101 Ų10168%0.67860%0.596SS**SBendtrans-51.7132149.9-78.9-7690.900108.9N146 Q150N146-E148 VanDerWaalsContact C-N 3.33Å; E148-Q150 VanDerWaalsContact C-N 3.32Å; E148-Q150 PolarHBondContact O-N 3.09Å
149P41.2Very low50.5Low117 Ų117101.6 Ų101.676%0.7660%0.6SS**  trans-69.393.2171.929.3-32.7000108.3G151P149-G151 PolarHBondContact O-N 3.39Å
150Q41.3Very low51.5Low93 Ų9398.2 Ų98.244%0.43557%0.569SS.*  trans-53.3114.4176.1-71.5-158.2-44.400109.4N146 E148N146-Q150 VanDerWaalsContact ND2-CD 3.28Å; N146-Q150 PolarHBondContact ND2-NE2 3.28Å; N146-Q150 PolarHBondContact OD1-NE2 3.4Å; E148-Q150 VanDerWaalsContact C-N 3.32Å; E148-Q150 PolarHBondContact O-N 3.09Å
151G47.1Very low52.6Low56 Ų5694.5 Ų94.558%0.57756%0.564SS**SBendtrans-55.1153.5174.500000110.9P149 V153P149-G151 PolarHBondContact O-N 3.39Å; G151-V153 PolarHBondContact O-N 3.05Å
152T46.4Very low54.7Low112 Ų11291 Ų9169%0.68755%0.547SS*.SBendtrans-6.3108.7-176410000115.2P154 T155T152-P154 VanDerWaalsContact C-N 3.3Å; T152-P154 WeakPolarHBondContact O-CD 3.5Å; T152-T155 PolarHBondContact O-N 3.29Å
153V55.9Low56.8Low26 Ų2690.6 Ų90.616%0.15854%0.544CS..THydrogen-bonded Turntrans-44.2-33.8-167.9174.20000116.9G151 T155 A156 V157 Y202 Y205G151-V153 PolarHBondContact O-N 3.05Å; V153-T155 PolarHBondContact O-N 3.47Å; V153-A156 PolarHBondContact O-N 2.84Å; V153-V157 HydrophobicContact CG1-CG2 4.39Å; V153-V157 PolarHBondContact O-N 3.14Å; V153-Y202 HydrophobicContact CG1-CD1 3.49Å; V153-Y202 VanDerWaalsContact CG1-CD1 3.49Å; V153-Y202 HydrophobicContact CG1-CE1 3.85Å; V153-Y205 HydrophobicContact CB-CD1 3.93Å; V153-Y205 HydrophobicContact CB-CD2 3.86Å; V153-Y205 HydrophobicContact CB-CE1 4.09Å; V153-Y205 HydrophobicContact CB-CE2 4Å; V153-Y205 HydrophobicContact CB-CG 3.81Å; V153-Y205 HydrophobicContact CG1-CD1 3.94Å; V153-Y205 HydrophobicContact CG1-CD2 4.5Å; V153-Y205 HydrophobicContact CG1-CE1 4.44Å; V153-Y205 HydrophobicContact CG1-CG 3.97Å; V153-Y205 HydrophobicContact CG2-CD1 4.3Å; V153-Y205 HydrophobicContact CG2-CD2 3.39Å; V153-Y205 HydrophobicContact CG2-CE2 3.83Å; V153-Y205 HydrophobicContact CG2-CG 3.65Å
154P53.6Low58.9Low79 Ų7989.8 Ų89.851%0.51352%0.524SS..Hα-helixtrans-46.4-33.1175.5-34.738.5000116.7T152T152-P154 VanDerWaalsContact C-N 3.3Å; T152-P154 WeakPolarHBondContact O-CD 3.5Å
155T53.1Low61.1Low96 Ų9682.8 Ų82.859%0.58950%0.495SS*.Hα-helixtrans-73.3-36.4179.2-45.60000112.2T152 V153 V157 Q158T152-T155 PolarHBondContact O-N 3.29Å; V153-T155 PolarHBondContact O-N 3.47Å; T155-V157 VanDerWaalsContact C-N 3.32Å; T155-V157 PolarHBondContact O-N 3.16Å; T155-Q158 PolarHBondContact O-N 2.68Å
156A56.5Low63.7Low9 Ų984.3 Ų84.37%0.07448%0.482CS..Hα-helixtrans-68-32.5179.200000112.3V153 Q158 T159 Y202V153-A156 PolarHBondContact O-N 2.84Å; A156-Q158 PolarHBondContact O-N 3.11Å; A156-Q158 VanDerWaalsContact O-N 3.08Å; A156-T159 WeakPolarHBondContact O-CB 3.5Å; A156-T159 PolarHBondContact O-N 3.49Å; A156-T159 PolarHBondContact O-OG1 3.24Å; A156-Y202 VanDerWaalsContact C-OH 3.23Å; A156-Y202 HydrophobicContact CB-CE1 4.06Å; A156-Y202 PolarHBondContact O-OH 2.84Å; A156-Y202 VanDerWaalsContact O-OH 3.04Å
157V59.9Low66.1Low27 Ų2782.1 Ų82.116%0.16447%0.467CS..Hα-helixtrans-53.1-33.8179-179.70000112V153 T155 T159 L160 L165 Y202V153-V157 HydrophobicContact CG1-CG2 4.39Å; V153-V157 PolarHBondContact O-N 3.14Å; T155-V157 VanDerWaalsContact C-N 3.32Å; T155-V157 PolarHBondContact O-N 3.16Å; V157-T159 PolarHBondContact O-N 3.49Å; V157-L160 HydrophobicContact CG1-CD1 4.41Å; V157-L160 WeakPolarHBondContact O-CB 3.4Å; V157-L160 PolarHBondContact O-N 3.19Å; V157-L160 VanDerWaalsContact O-N 3.17Å; V157-L165 HydrophobicContact CG1-CD1 3.44Å; V157-L165 VanDerWaalsContact CG1-CD1 3.44Å; V157-Y202 HydrophobicContact CB-CE1 4.18Å; V157-Y202 HydrophobicContact CG2-CD1 3.58Å; V157-Y202 HydrophobicContact CG2-CE1 3.51Å
158Q61.2Low68.3Low160 Ų16076.8 Ų76.875%0.74843%0.432SS*.THydrogen-bonded Turntrans-70.4-7.7-179.2-56.2-177.813.600113.8T155 A156T155-Q158 PolarHBondContact O-N 2.68Å; A156-Q158 PolarHBondContact O-N 3.11Å; A156-Q158 VanDerWaalsContact O-N 3.08Å
159T70.9Confident70.8Confident114 Ų11473.2 Ų73.270%0.69942%0.415SS*.THydrogen-bonded Turntrans-91.4-6.5174.268.40000113.5A156 V157A156-T159 WeakPolarHBondContact O-CB 3.5Å; A156-T159 PolarHBondContact O-N 3.49Å; A156-T159 PolarHBondContact O-OG1 3.24Å; V157-T159 PolarHBondContact O-N 3.49Å
160L80.4Confident73.4Confident22 Ų2273.7 Ų73.712%0.11541%0.407CS..SBendtrans-77.2144.1173.1-64.7169.5000110.8V157 L164 L199 Y202V157-L160 HydrophobicContact CG1-CD1 4.41Å; V157-L160 WeakPolarHBondContact O-CB 3.4Å; V157-L160 PolarHBondContact O-N 3.19Å; V157-L160 VanDerWaalsContact O-N 3.17Å; L160-L164 HydrophobicContact CD2-CD1 4.37Å; L160-L199 HydrophobicContact CD1-CD2 3.58Å; L160-L199 HydrophobicContact CD2-CD2 3.88Å; L160-L199 HydrophobicContact CG-CD2 4.37Å; L160-Y202 HydrophobicContact CD1-CD2 4.19Å; L160-Y202 HydrophobicContact CD1-CE1 4.48Å; L160-Y202 HydrophobicContact CD1-CE2 3.84Å; L160-Y202 HydrophobicContact CD2-CE2 3.99Å; L160-Y202 HydrophobicContact CG-CE2 4.14Å
161S87Confident76Confident68 Ų6870 Ų7048%0.47639%0.39SS..  trans-62.4142.4166.158.10000111.1D163 L164 L165S161-D163 PolarHBondContact O-N 3.08Å; S161-L164 WeakPolarHBondContact O-CB 3.4Å; S161-L164 PolarHBondContact O-N 3.06Å; S161-L164 WeakPolarHBondContact OG-CG 3.42Å; S161-L165 PolarHBondContact O-N 3.47Å; S161-L165 VanDerWaalsContact O-N 3.11Å
162D88.6Confident78.2Confident112 Ų11268.3 Ų68.360%0.59937%0.369SS*.Hα-helixtrans-41.5-41.5179.7-69.7-4.4000115L165 K166D162-L165 PolarHBondContact O-N 3.36Å; D162-K166 WeakPolarHBondContact O-CB 3.28Å; D162-K166 WeakPolarHBondContact O-CD 3.31Å; D162-K166 WeakPolarHBondContact O-CG 3.29Å; D162-K166 PolarHBondContact O-N 3.08Å
163D90.6Very high80.5Confident112 Ų11270.8 Ų70.860%0.59937%0.365SS*.Hα-helixtrans-74.4-34.1-176.1-61.7-27.5000113S161 L165 K166 Y167S161-D163 PolarHBondContact O-N 3.08Å; D163-L165 VanDerWaalsContact C-N 3.34Å; D163-K166 IonicContact OD1-NZ 3.46Å; D163-K166 PolarHBondContact OD1-NZ 3.22Å; D163-Y167 VanDerWaalsContact O-CB 3.31Å; D163-Y167 WeakPolarHBondContact O-CB 3.48Å; D163-Y167 PolarHBondContact O-N 3.26Å
164L90.2Very high82.4Confident49 Ų4970.6 Ų70.626%0.25737%0.366SS..Hα-helixtrans-67.3-37.3169.5-71.3177.1000110.9L160 S161 Y168 A198 L199L160-L164 HydrophobicContact CD2-CD1 4.37Å; S161-L164 WeakPolarHBondContact O-CB 3.4Å; S161-L164 PolarHBondContact O-N 3.06Å; S161-L164 WeakPolarHBondContact OG-CG 3.42Å; L164-Y168 VanDerWaalsContact O-CB 3.3Å; L164-Y168 WeakPolarHBondContact O-CB 3.44Å; L164-Y168 PolarHBondContact O-N 3.09Å; L164-A198 HydrophobicContact CD1-CB 4.44Å; L164-L199 HydrophobicContact CB-CD1 4.42Å; L164-L199 HydrophobicContact CB-CD2 4.2Å; L164-L199 HydrophobicContact CD2-CD1 4.1Å; L164-L199 HydrophobicContact CD2-CG 4.4Å
165L90.5Very high84.4Confident40 Ų4066.8 Ų66.821%0.20934%0.342CS..Hα-helixtrans-67.8-44.9176.318054.8000112V157 S161 D162 D163 Y168 Q169V157-L165 HydrophobicContact CG1-CD1 3.44Å; V157-L165 VanDerWaalsContact CG1-CD1 3.44Å; S161-L165 PolarHBondContact O-N 3.47Å; S161-L165 VanDerWaalsContact O-N 3.11Å; D162-L165 PolarHBondContact O-N 3.36Å; D163-L165 VanDerWaalsContact C-N 3.34Å; L165-Y168 HydrophobicContact CD1-CD1 4.42Å; L165-Y168 PolarHBondContact O-N 2.93Å; L165-Q169 HydrophobicContact CD1-CG 4.31Å; L165-Q169 WeakPolarHBondContact O-CG 3.47Å; L165-Q169 PolarHBondContact O-N 3.31Å
166K92.4Very high86.3Confident101 Ų10164.8 Ų64.844%0.43933%0.327SS..Hα-helixtrans-58.1-48.7173.3-70.3161.7-153.7157.90111D162 D163 Q169 Q170D162-K166 WeakPolarHBondContact O-CB 3.28Å; D162-K166 WeakPolarHBondContact O-CD 3.31Å; D162-K166 WeakPolarHBondContact O-CG 3.29Å; D162-K166 PolarHBondContact O-N 3.08Å; D163-K166 IonicContact OD1-NZ 3.46Å; D163-K166 PolarHBondContact OD1-NZ 3.22Å; K166-Q169 PolarHBondContact O-N 3.42Å; K166-Q170 WeakPolarHBondContact O-CB 3.21Å; K166-Q170 VanDerWaalsContact O-CG 3.32Å; K166-Q170 WeakPolarHBondContact O-CG 3.4Å; K166-Q170 PolarHBondContact O-N 3.45Å
167Y94.6Very high88Confident43 Ų4365.4 Ų65.417%0.16933%0.334CS..Hα-helixtrans-59.5-48.6177.1171.4-87.9000111.6D163 Q169 Q170 I171 D189 N193 I196 L199 F203D163-Y167 VanDerWaalsContact O-CB 3.31Å; D163-Y167 WeakPolarHBondContact O-CB 3.48Å; D163-Y167 PolarHBondContact O-N 3.26Å; Y167-Q169 PolarHBondContact O-N 3.17Å; Y167-Q170 PolarHBondContact O-N 3.31Å; Y167-I171 HydrophobicContact CD1-CG1 4.21Å; Y167-I171 HydrophobicContact CD2-CG1 4.11Å; Y167-I171 HydrophobicContact CE1-CG1 3.82Å; Y167-I171 HydrophobicContact CE2-CD1 4Å; Y167-I171 HydrophobicContact CE2-CG1 3.72Å; Y167-I171 HydrophobicContact CG-CG1 4.35Å; Y167-I171 WeakPolarHBondContact O-CB 3.47Å; Y167-I171 WeakPolarHBondContact O-CG1 3.5Å; Y167-I171 PolarHBondContact O-N 2.72Å; Y167-D189 VanDerWaalsContact CE2-OD2 3.3Å; Y167-D189 WeakPolarHBondContact CE2-OD2 3.45Å; Y167-D189 PolarHBondContact OH-OD2 3.4Å; Y167-N193 PolarHBondContact OH-ND2 2.87Å; Y167-I196 HydrophobicContact CE1-CG2 3.58Å; Y167-I196 WeakPolarHBondContact OH-CG2 3.5Å; Y167-L199 HydrophobicContact CD1-CD1 3.44Å; Y167-L199 VanDerWaalsContact CD1-CD1 3.44Å; Y167-L199 HydrophobicContact CE1-CD1 3.84Å; Y167-F203 HydrophobicContact CE1-CZ 4.28Å
168Y93.4Very high89.6Confident31 Ų3171 Ų7112%0.12236%0.363CS..Hα-helixtrans-57.3-45.7176.7168.9-100.1000112.2L164 L165 T172 F203 V206L164-Y168 VanDerWaalsContact O-CB 3.3Å; L164-Y168 WeakPolarHBondContact O-CB 3.44Å; L164-Y168 PolarHBondContact O-N 3.09Å; L165-Y168 HydrophobicContact CD1-CD1 4.42Å; L165-Y168 PolarHBondContact O-N 2.93Å; Y168-T172 HydrophobicContact CD2-CG2 4.14Å; Y168-T172 HydrophobicContact CE2-CG2 3.74Å; Y168-T172 WeakPolarHBondContact O-CB 3.23Å; Y168-T172 WeakPolarHBondContact O-CG2 3.4Å; Y168-T172 PolarHBondContact O-N 3.16Å; Y168-T172 PolarHBondContact O-OG1 3.12Å; Y168-F203 HydrophobicContact CD2-CD1 4.01Å; Y168-F203 AromaticContact CD2-CE1 3.61Å; Y168-F203 HydrophobicContact CD2-CE1 3.61Å; Y168-F203 AromaticContact CD2-CZ 3.91Å; Y168-F203 HydrophobicContact CD2-CZ 3.91Å; Y168-F203 AromaticContact CE2-CD1 3.97Å; Y168-F203 HydrophobicContact CE2-CD1 3.97Å; Y168-F203 HydrophobicContact CE2-CE1 4.01Å; Y168-V206 WeakPolarHBondContact OH-CG2 3.27Å
169Q93Very high91.2Very high70 Ų7066.6 Ų66.633%0.32735%0.345SS..Hα-helixtrans-64.6-38.5176.3-71.4-177.926.500113.1L165 K166 Y167 T172 R173L165-Q169 HydrophobicContact CD1-CG 4.31Å; L165-Q169 WeakPolarHBondContact O-CG 3.47Å; L165-Q169 PolarHBondContact O-N 3.31Å; K166-Q169 PolarHBondContact O-N 3.42Å; Y167-Q169 PolarHBondContact O-N 3.17Å; Q169-T172 WeakPolarHBondContact CA-OG1 3.21Å; Q169-T172 PolarHBondContact O-OG1 3.01Å; Q169-R173 WeakPolarHBondContact O-CB 3.33Å; Q169-R173 WeakPolarHBondContact O-CD 3.3Å; Q169-R173 WeakPolarHBondContact O-CG 3.42Å; Q169-R173 PolarHBondContact O-N 3.02Å; Q169-R173 VanDerWaalsContact O-N 3.13Å
170Q94.6Very high92.3Very high128 Ų12865 Ų6560%0.59834%0.337SS*.Hα-helixtrans-68.8-45.7178-75172.9-1300111.8K166 Y167 R173 A174K166-Q170 WeakPolarHBondContact O-CB 3.21Å; K166-Q170 VanDerWaalsContact O-CG 3.32Å; K166-Q170 WeakPolarHBondContact O-CG 3.4Å; K166-Q170 PolarHBondContact O-N 3.45Å; Y167-Q170 PolarHBondContact O-N 3.31Å; Q170-R173 PolarHBondContact O-N 3.39Å; Q170-A174 VanDerWaalsContact O-CB 3.26Å; Q170-A174 WeakPolarHBondContact O-CB 3.15Å; Q170-A174 PolarHBondContact O-N 3.11Å
171I95.7Very high92.9Very high15 Ų1571 Ų718%0.07736%0.364CS..Hα-helixtrans-66.1-43.9179.4-68-66.8000111.8Y167 A174 I175 A186 L190 F203Y167-I171 HydrophobicContact CD1-CG1 4.21Å; Y167-I171 HydrophobicContact CD2-CG1 4.11Å; Y167-I171 HydrophobicContact CE1-CG1 3.82Å; Y167-I171 HydrophobicContact CE2-CD1 4Å; Y167-I171 HydrophobicContact CE2-CG1 3.72Å; Y167-I171 HydrophobicContact CG-CG1 4.35Å; Y167-I171 WeakPolarHBondContact O-CB 3.47Å; Y167-I171 WeakPolarHBondContact O-CG1 3.5Å; Y167-I171 PolarHBondContact O-N 2.72Å; I171-A174 PolarHBondContact O-N 3.24Å; I171-I175 HydrophobicContact CG2-CD1 3.72Å; I171-I175 WeakPolarHBondContact O-CG1 3.34Å; I171-I175 PolarHBondContact O-N 2.95Å; I171-A186 HydrophobicContact CD1-CB 3.77Å; I171-A186 HydrophobicContact CG2-CB 4.46Å; I171-L190 HydrophobicContact CG2-CD1 3.83Å; I171-L190 HydrophobicContact CG2-CD2 3.93Å; I171-L190 HydrophobicContact CG2-CG 3.8Å; I171-F203 HydrophobicContact CB-CE1 4.45Å; I171-F203 HydrophobicContact CG2-CE1 3.88Å; I171-F203 HydrophobicContact CG2-CZ 4.1Å
172T93.8Very high93.3Very high20 Ų2072.4 Ų72.412%0.12337%0.366CS..Hα-helixtrans-63.5-43.9176.946.90000111.9Y168 Q169 A174 I175 L176 F203 V206Y168-T172 HydrophobicContact CD2-CG2 4.14Å; Y168-T172 HydrophobicContact CE2-CG2 3.74Å; Y168-T172 WeakPolarHBondContact O-CB 3.23Å; Y168-T172 WeakPolarHBondContact O-CG2 3.4Å; Y168-T172 PolarHBondContact O-N 3.16Å; Y168-T172 PolarHBondContact O-OG1 3.12Å; Q169-T172 WeakPolarHBondContact CA-OG1 3.21Å; Q169-T172 PolarHBondContact O-OG1 3.01Å; T172-A174 PolarHBondContact O-N 3.26Å; T172-I175 PolarHBondContact O-N 3.27Å; T172-L176 WeakPolarHBondContact O-CB 3.32Å; T172-L176 WeakPolarHBondContact O-CG 3.36Å; T172-L176 PolarHBondContact O-N 3.26Å; T172-L176 VanDerWaalsContact O-N 3.08Å; T172-F203 HydrophobicContact CG2-CD1 4.29Å; T172-F203 HydrophobicContact CG2-CE1 4.1Å; T172-V206 HydrophobicContact CG2-CG2 4.43Å
173R94.6Very high93.7Very high164 Ų16468.2 Ų68.262%0.61934%0.343SS*.Hα-helixtrans-63.5-37.2173.3-72.2173.8-168.8143.811.6113Q169 Q170 G177Q169-R173 WeakPolarHBondContact O-CB 3.33Å; Q169-R173 WeakPolarHBondContact O-CD 3.3Å; Q169-R173 WeakPolarHBondContact O-CG 3.42Å; Q169-R173 PolarHBondContact O-N 3.02Å; Q169-R173 VanDerWaalsContact O-N 3.13Å; Q170-R173 PolarHBondContact O-N 3.39Å; R173-G177 VanDerWaalsContact O-CA 3.3Å; R173-G177 WeakPolarHBondContact O-CA 3.49Å; R173-G177 PolarHBondContact O-N 3.01Å
174A96.2Very high93.9Very high22 Ų2269.5 Ų69.518%0.18234%0.343CS..Hα-helixtrans-70.9-32.9-18000000113Q170 I171 T172 L182 M183 A186Q170-A174 VanDerWaalsContact O-CB 3.26Å; Q170-A174 WeakPolarHBondContact O-CB 3.15Å; Q170-A174 PolarHBondContact O-N 3.11Å; I171-A174 PolarHBondContact O-N 3.24Å; T172-A174 PolarHBondContact O-N 3.26Å; A174-L182 HydrophobicContact CB-CB 4.35Å; A174-M183 WeakPolarHBondContact O-CA 3.35Å; A174-M183 WeakPolarHBondContact O-CB 3.43Å; A174-M183 PolarHBondContact O-N 3.02Å; A174-A186 HydrophobicContact CB-CB 3.73Å
175I95.4Very high94.2Very high0 Ų073.3 Ų73.30%036%0.361CS..Hα-helixtrans-82.1-39-179.6-65.4169.4000111.8I171 T172 A186 L187 L190 R222 M226I171-I175 HydrophobicContact CG2-CD1 3.72Å; I171-I175 WeakPolarHBondContact O-CG1 3.34Å; I171-I175 PolarHBondContact O-N 2.95Å; T172-I175 PolarHBondContact O-N 3.27Å; I175-A186 HydrophobicContact CD1-CB 4.14Å; I175-A186 HydrophobicContact CG1-CB 3.69Å; I175-L187 HydrophobicContact CD1-CD2 3.88Å; I175-L187 HydrophobicContact CD1-CG 4.3Å; I175-L187 HydrophobicContact CG1-CD2 4.21Å; I175-L187 HydrophobicContact CG1-CG 4.2Å; I175-L187 HydrophobicContact CG2-CD2 4.31Å; I175-L190 HydrophobicContact CD1-CD1 3.43Å; I175-L190 VanDerWaalsContact CD1-CD1 3.43Å; I175-L190 HydrophobicContact CD1-CG 4.41Å; I175-R222 HydrophobicContact CG2-CB 4.35Å; I175-R222 PolarHBondContact O-NH1 3.46Å; I175-M226 HydrophobicContact CB-CE 4.11Å; I175-M226 HydrophobicContact CD1-CE 4.01Å; I175-M226 HydrophobicContact CD1-CG 4.22Å; I175-M226 HydrophobicContact CG2-CB 4.46Å; I175-M226 HydrophobicContact CG2-CE 3.74Å
176L93.2Very high94.5Very high54 Ų5471.7 Ų71.728%0.28335%0.353SS..Hα-helixtrans-94.10.2-178.4-53.9177.5000113.4T172 V206 Q219 R222 L223T172-L176 WeakPolarHBondContact O-CB 3.32Å; T172-L176 WeakPolarHBondContact O-CG 3.36Å; T172-L176 PolarHBondContact O-N 3.26Å; T172-L176 VanDerWaalsContact O-N 3.08Å; L176-V206 HydrophobicContact CD1-CG1 4.26Å; L176-Q219 PolarHBondContact O-NE2 3.4Å; L176-Q219 PolarHBondContact O-OE1 3.32Å; L176-R222 HydrophobicContact CD2-CB 4.41Å; L176-L223 HydrophobicContact CD2-CD2 3.97Å; L176-L223 HydrophobicContact CD2-CG 4.21Å
177G92.7Very high94.7Very high21 Ų2167.8 Ų67.822%0.21634%0.337CS..SBendtrans-96.8164.9176.100000112.6R173 D179 R222R173-G177 VanDerWaalsContact O-CA 3.3Å; R173-G177 WeakPolarHBondContact O-CA 3.49Å; R173-G177 PolarHBondContact O-N 3.01Å; G177-D179 PolarHBondContact O-N 3.48Å; G177-R222 PolarHBondContact O-NH1 3.04Å
178D92.5Very high94.9Very high145 Ų14569.8 Ų69.878%0.77535%0.35SS*.SBendtrans-65.3-33.9-162.1-44.5-61.2000114.1P180 R222D178-P180 WeakPolarHBondContact O-CD 3.48Å; D178-R222 PolarHBondContact O-NH2 3.29Å
179D94.8Very high95Very high67 Ų6771 Ų7136%0.35836%0.359SS..  trans-68.1113-173.3-176.9-21.6000113.4G177 H181 L182 M183G177-D179 PolarHBondContact O-N 3.48Å; D179-H181 VanDerWaalsContact C-N 3.32Å; D179-H181 PolarHBondContact O-N 2.86Å; D179-H181 WeakPolarHBondContact OD1-CA 3.23Å; D179-H181 VanDerWaalsContact OD1-CB 3.3Å; D179-H181 WeakPolarHBondContact OD1-CB 3.43Å; D179-H181 IonicContact OD1-CD2 2.71Å; D179-H181 PolarHBondContact OD1-N 3.02Å; D179-L182 HydrophobicContact CB-CB 4.1Å; D179-L182 HydrophobicContact CB-CD1 4.05Å; D179-L182 HydrophobicContact CB-CG 4.22Å; D179-L182 PolarHBondContact O-N 2.82Å; D179-L182 PolarHBondContact OD1-N 3.16Å; D179-L182 VanDerWaalsContact OD1-N 3.13Å; D179-L182 WeakPolarHBondContact OD2-CD1 3.24Å; D179-L182 WeakPolarHBondContact OD2-CG 3.34Å; D179-M183 WeakPolarHBondContact O-CB 3.34Å; D179-M183 PolarHBondContact O-N 3.31Å
180P93.2Very high95.2Very high82 Ų8267.7 Ų67.753%0.53234%0.343SS..Hα-helixtrans-72.2-22-178.631-36000113.5D178 K184D178-P180 WeakPolarHBondContact O-CD 3.48Å; P180-K184 VanDerWaalsContact O-CB 3.22Å; P180-K184 WeakPolarHBondContact O-CB 3.49Å; P180-K184 PolarHBondContact O-N 2.75Å
181H94.8Very high95.2Very high146 Ų14664.6 Ų64.668%0.67633%0.329SS*.Hα-helixtrans-74.4-44.6175.3-64.9-85.9000110.8D179 K184 M185D179-H181 VanDerWaalsContact C-N 3.32Å; D179-H181 PolarHBondContact O-N 2.86Å; D179-H181 WeakPolarHBondContact OD1-CA 3.23Å; D179-H181 VanDerWaalsContact OD1-CB 3.3Å; D179-H181 WeakPolarHBondContact OD1-CB 3.43Å; D179-H181 IonicContact OD1-CD2 2.71Å; D179-H181 PolarHBondContact OD1-N 3.02Å; H181-K184 PolarHBondContact O-N 3.43Å; H181-M185 WeakPolarHBondContact O-CG 3.37Å; H181-M185 PolarHBondContact O-N 2.87Å
182L95Very high95.2Very high99 Ų9967.4 Ų67.452%0.51835%0.35SS..Hα-helixtrans-64.4-43.8174.5-72.1176.9000111.5A174 D179 K184 M185 A186A174-L182 HydrophobicContact CB-CB 4.35Å; D179-L182 HydrophobicContact CB-CB 4.1Å; D179-L182 HydrophobicContact CB-CD1 4.05Å; D179-L182 HydrophobicContact CB-CG 4.22Å; D179-L182 PolarHBondContact O-N 2.82Å; D179-L182 PolarHBondContact OD1-N 3.16Å; D179-L182 VanDerWaalsContact OD1-N 3.13Å; D179-L182 WeakPolarHBondContact OD2-CD1 3.24Å; D179-L182 WeakPolarHBondContact OD2-CG 3.34Å; L182-K184 PolarHBondContact O-N 2.68Å; L182-M185 PolarHBondContact O-N 3.14Å; L182-A186 WeakPolarHBondContact O-CB 3.43Å; L182-A186 PolarHBondContact O-N 3.4Å
183M95.8Very high95.3Very high23 Ų2368.1 Ų68.111%0.11335%0.353CS..Hα-helixtrans-53.2-51.8171.7175.8-163.1169.400111.4A174 D179 M185 A186 L187 R222 H225A174-M183 WeakPolarHBondContact O-CA 3.35Å; A174-M183 WeakPolarHBondContact O-CB 3.43Å; A174-M183 PolarHBondContact O-N 3.02Å; D179-M183 WeakPolarHBondContact O-CB 3.34Å; D179-M183 PolarHBondContact O-N 3.31Å; M183-M185 VanDerWaalsContact C-N 3.35Å; M183-M185 PolarHBondContact O-N 2.99Å; M183-A186 PolarHBondContact O-N 2.91Å; M183-L187 HydrophobicContact CE-CD1 3.75Å; M183-L187 HydrophobicContact CG-CD1 3.89Å; M183-L187 WeakPolarHBondContact O-CB 3.47Å; M183-L187 VanDerWaalsContact O-CG 3.26Å; M183-L187 WeakPolarHBondContact O-CG 3.39Å; M183-L187 PolarHBondContact O-N 3.31Å; M183-R222 HydrophobicContact CE-CB 4.24Å; M183-R222 HydrophobicContact CE-CG 3.68Å; M183-R222 HydrophobicContact SD-CG 3.92Å; M183-H225 HydrophobicContact CE-CB 4.27Å
184K96Very high95.2Very high139 Ų13963.7 Ų63.760%0.60435%0.347SS*.Hα-helixtrans-61.9-39.8-179.5-175.8173.8-178.1174.60112.7P180 H181 L182 L188P180-K184 VanDerWaalsContact O-CB 3.22Å; P180-K184 WeakPolarHBondContact O-CB 3.49Å; P180-K184 PolarHBondContact O-N 2.75Å; H181-K184 PolarHBondContact O-N 3.43Å; L182-K184 PolarHBondContact O-N 2.68Å; K184-L188 HydrophobicContact CG-CD1 4.32Å; K184-L188 VanDerWaalsContact O-CG 3.3Å; K184-L188 WeakPolarHBondContact O-CG 3.5Å; K184-L188 PolarHBondContact O-N 3.07Å; K184-L188 VanDerWaalsContact O-N 3.16Å
185M96.5Very high94.9Very high130 Ų13070.6 Ų70.664%0.6437%0.373SS*.Hα-helixtrans-66.7-44.5176.3-71.8-61.9-66.700112H181 L182 M183 L187 L188 D189H181-M185 WeakPolarHBondContact O-CG 3.37Å; H181-M185 PolarHBondContact O-N 2.87Å; L182-M185 PolarHBondContact O-N 3.14Å; M183-M185 VanDerWaalsContact C-N 3.35Å; M183-M185 PolarHBondContact O-N 2.99Å; M185-L187 PolarHBondContact O-N 3.03Å; M185-L188 PolarHBondContact O-N 2.9Å; M185-D189 PolarHBondContact O-N 3.2Å
186A97.1Very high94.6Very high5 Ų570.7 Ų70.74%0.04137%0.373CS..Hα-helixtrans-63.8-38.9177.600000112.6I171 A174 I175 L182 M183 D189 L190I171-A186 HydrophobicContact CD1-CB 3.77Å; I171-A186 HydrophobicContact CG2-CB 4.46Å; A174-A186 HydrophobicContact CB-CB 3.73Å; I175-A186 HydrophobicContact CD1-CB 4.14Å; I175-A186 HydrophobicContact CG1-CB 3.69Å; L182-A186 WeakPolarHBondContact O-CB 3.43Å; L182-A186 PolarHBondContact O-N 3.4Å; M183-A186 PolarHBondContact O-N 2.91Å; A186-D189 PolarHBondContact O-N 3.25Å; A186-L190 WeakPolarHBondContact O-CG 3.48Å; A186-L190 PolarHBondContact O-N 3.2Å
187L96.8Very high94.4Very high19 Ų1970.8 Ų70.810%0.09938%0.382CS..Hα-helixtrans-65.7-34.7174.8-72.2171.2000113.1I175 M183 M185 Q191 H225 M226 S229I175-L187 HydrophobicContact CD1-CD2 3.88Å; I175-L187 HydrophobicContact CD1-CG 4.3Å; I175-L187 HydrophobicContact CG1-CD2 4.21Å; I175-L187 HydrophobicContact CG1-CG 4.2Å; I175-L187 HydrophobicContact CG2-CD2 4.31Å; M183-L187 HydrophobicContact CE-CD1 3.75Å; M183-L187 HydrophobicContact CG-CD1 3.89Å; M183-L187 WeakPolarHBondContact O-CB 3.47Å; M183-L187 VanDerWaalsContact O-CG 3.26Å; M183-L187 WeakPolarHBondContact O-CG 3.39Å; M183-L187 PolarHBondContact O-N 3.31Å; M185-L187 PolarHBondContact O-N 3.03Å; L187-Q191 WeakPolarHBondContact O-CB 3.39Å; L187-Q191 PolarHBondContact O-N 3Å; L187-H225 HydrophobicContact CD1-CB 3.78Å; L187-H225 HydrophobicContact CD2-CB 4.17Å; L187-M226 HydrophobicContact CD2-CB 4.34Å; L187-S229 WeakPolarHBondContact O-CB 3.43Å; L187-S229 PolarHBondContact O-OG 3.24Å
188L96.9Very high94.1Very high85 Ų8572.4 Ų72.445%0.44539%0.394SS..Hα-helixtrans-73.9-35.1175.9-73.1169.4000112.3K184 M185 Q191 S192K184-L188 HydrophobicContact CG-CD1 4.32Å; K184-L188 VanDerWaalsContact O-CG 3.3Å; K184-L188 WeakPolarHBondContact O-CG 3.5Å; K184-L188 PolarHBondContact O-N 3.07Å; K184-L188 VanDerWaalsContact O-N 3.16Å; M185-L188 PolarHBondContact O-N 2.9Å; L188-Q191 PolarHBondContact O-N 3.24Å; L188-S192 PolarHBondContact O-N 3.46Å; L188-S192 PolarHBondContact O-OG 2.96Å
189D96.6Very high94Very high57 Ų5765.5 Ų65.531%0.30536%0.357SS..Hα-helixtrans-66.3-48.3171.6-166.177.9000110.7Y167 M185 A186 Q191 S192 N193Y167-D189 VanDerWaalsContact CE2-OD2 3.3Å; Y167-D189 WeakPolarHBondContact CE2-OD2 3.45Å; Y167-D189 PolarHBondContact OH-OD2 3.4Å; M185-D189 PolarHBondContact O-N 3.2Å; A186-D189 PolarHBondContact O-N 3.25Å; D189-Q191 PolarHBondContact O-N 3.48Å; D189-Q191 VanDerWaalsContact O-N 3.09Å; D189-S192 PolarHBondContact O-N 2.83Å; D189-N193 WeakPolarHBondContact O-CB 3.5Å; D189-N193 PolarHBondContact O-N 2.68Å; D189-N193 WeakPolarHBondContact OD2-CB 3.47Å; D189-N193 PolarHBondContact OD2-ND2 3.33Å
190L96.1Very high93.8Very high0 Ų062.7 Ų62.70%034%0.341CS..Hα-helixtrans-54.9-31.2174.3-78.5-175.5000113.8I171 I175 A186 I196 F203 M226 L230 N233I171-L190 HydrophobicContact CG2-CD1 3.83Å; I171-L190 HydrophobicContact CG2-CD2 3.93Å; I171-L190 HydrophobicContact CG2-CG 3.8Å; I175-L190 HydrophobicContact CD1-CD1 3.43Å; I175-L190 VanDerWaalsContact CD1-CD1 3.43Å; I175-L190 HydrophobicContact CD1-CG 4.41Å; A186-L190 WeakPolarHBondContact O-CG 3.48Å; A186-L190 PolarHBondContact O-N 3.2Å; L190-I196 HydrophobicContact CD2-CD1 3.7Å; L190-I196 WeakPolarHBondContact O-CD1 3.34Å; L190-F203 HydrophobicContact CD2-CD2 4.31Å; L190-F203 HydrophobicContact CD2-CE1 4.21Å; L190-F203 HydrophobicContact CD2-CE2 3.73Å; L190-F203 HydrophobicContact CD2-CZ 3.69Å; L190-M226 HydrophobicContact CD1-CG 3.82Å; L190-L230 HydrophobicContact CD2-CD2 4.3Å; L190-N233 PolarHBondContact O-ND2 3.32Å
191Q96.3Very high93.6Very high63 Ų6360.6 Ų60.629%0.29433%0.328SS..Hα-helixtrans-77.4-25177.6-176.5170.721.300113.7L187 L188 D189 Q232 N233L187-Q191 WeakPolarHBondContact O-CB 3.39Å; L187-Q191 PolarHBondContact O-N 3Å; L188-Q191 PolarHBondContact O-N 3.24Å; D189-Q191 PolarHBondContact O-N 3.48Å; D189-Q191 VanDerWaalsContact O-N 3.09Å; Q191-Q232 HydrophobicContact CG-CB 4.19Å; Q191-N233 WeakPolarHBondContact O-CA 3.39Å; Q191-N233 WeakPolarHBondContact O-CB 3.31Å
192S95.4Very high93.3Very high74 Ų7454.2 Ų54.252%0.51730%0.298SS..Hα-helixtrans-120.4-17.9-168.460.40000114.9L188 D189 Y235L188-S192 PolarHBondContact O-N 3.46Å; L188-S192 PolarHBondContact O-OG 2.96Å; D189-S192 PolarHBondContact O-N 2.83Å; S192-Y235 WeakPolarHBondContact O-CE2 3.29Å
193N94.7Very high93.2Very high35 Ų3549.5 Ų49.519%0.18727%0.273CS..  trans-76.3124.3-176.4-171.7-25000111.2Y167 D189 K195 I196 N233Y167-N193 PolarHBondContact OH-ND2 2.87Å; D189-N193 WeakPolarHBondContact O-CB 3.5Å; D189-N193 PolarHBondContact O-N 2.68Å; D189-N193 WeakPolarHBondContact OD2-CB 3.47Å; D189-N193 PolarHBondContact OD2-ND2 3.33Å; N193-K195 PolarHBondContact OD1-N 3.18Å; N193-I196 HydrophobicContact CB-CG2 4.02Å; N193-N233 PolarHBondContact O-ND2 3.07Å
194S93.1Very high93Very high71 Ų7148.7 Ų48.750%0.49727%0.27SS..SBendtrans-88.1-3.9-175.657.80000114.7
195K89.4Confident92.7Very high167 Ų16747.3 Ų47.373%0.72626%0.261SS*.SBendtrans-101.2-4.1-174.9-64.3-176178.6-179.70114.3N193 A197N193-K195 PolarHBondContact OD1-N 3.18Å; K195-A197 VanDerWaalsContact C-N 3.3Å; K195-A197 PolarHBondContact O-N 3.16Å
196I90.3Very high92.5Very high2 Ų242.6 Ų42.61%0.0124%0.24CC..G310 helixtrans-84.35.4-171.670.4-177.5000114.6Y167 L190 N193 A198 L199 L200 L230 L236Y167-I196 HydrophobicContact CE1-CG2 3.58Å; Y167-I196 WeakPolarHBondContact OH-CG2 3.5Å; L190-I196 HydrophobicContact CD2-CD1 3.7Å; L190-I196 WeakPolarHBondContact O-CD1 3.34Å; N193-I196 HydrophobicContact CB-CG2 4.02Å; I196-A198 VanDerWaalsContact C-N 3.32Å; I196-A198 PolarHBondContact O-N 2.97Å; I196-L199 WeakPolarHBondContact O-CA 3.25Å; I196-L199 WeakPolarHBondContact O-CB 3.23Å; I196-L199 PolarHBondContact O-N 3.02Å; I196-L200 PolarHBondContact O-N 3.17Å; I196-L230 HydrophobicContact CD1-CD2 4.42Å; I196-L236 HydrophobicContact CD1-CD1 4.18Å; I196-L236 HydrophobicContact CG1-CD1 4.23Å; I196-L236 HydrophobicContact CG1-CD2 4.01Å; I196-L236 HydrophobicContact CG1-CG 4.45Å
197A88.1Confident92.3Very high56 Ų5642.4 Ų42.446%0.46324%0.238SC..G310 helixtrans-56.8-41.7-178.600000113.1K195 L199 L200 L236K195-A197 VanDerWaalsContact C-N 3.3Å; K195-A197 PolarHBondContact O-N 3.16Å; A197-L199 PolarHBondContact O-N 3.44Å; A197-L200 WeakPolarHBondContact O-CB 3.46Å; A197-L200 PolarHBondContact O-N 3Å; A197-L236 HydrophobicContact CB-CD2 4.04Å
198A86.8Confident92Very high56 Ų5644 Ų4446%0.46325%0.251SS..G310 helixtrans-66.9-15.2175.100000113.9L164 I196 Y202L164-A198 HydrophobicContact CD1-CB 4.44Å; I196-A198 VanDerWaalsContact C-N 3.32Å; I196-A198 PolarHBondContact O-N 2.97Å; A198-Y202 WeakPolarHBondContact O-CE2 3.41Å
199L89.9Confident91.5Very high0 Ų041 Ų410%024%0.241CC..G310 helixtrans-97.8-12.3178.3-66.9176.7000113.6L160 L164 Y167 I196 A197 P201 Y202 F203L160-L199 HydrophobicContact CD1-CD2 3.58Å; L160-L199 HydrophobicContact CD2-CD2 3.88Å; L160-L199 HydrophobicContact CG-CD2 4.37Å; L164-L199 HydrophobicContact CB-CD1 4.42Å; L164-L199 HydrophobicContact CB-CD2 4.2Å; L164-L199 HydrophobicContact CD2-CD1 4.1Å; L164-L199 HydrophobicContact CD2-CG 4.4Å; Y167-L199 HydrophobicContact CD1-CD1 3.44Å; Y167-L199 VanDerWaalsContact CD1-CD1 3.44Å; Y167-L199 HydrophobicContact CE1-CD1 3.84Å; I196-L199 WeakPolarHBondContact O-CA 3.25Å; I196-L199 WeakPolarHBondContact O-CB 3.23Å; I196-L199 PolarHBondContact O-N 3.02Å; A197-L199 PolarHBondContact O-N 3.44Å; L199-P201 VanDerWaalsContact C-CD 3.4Å; L199-Y202 HydrophobicContact CD2-CD2 4.36Å; L199-Y202 PolarHBondContact O-N 3.49Å; L199-Y202 VanDerWaalsContact O-N 3.09Å; L199-F203 HydrophobicContact CB-CD2 4.01Å; L199-F203 HydrophobicContact CB-CE2 3.54Å; L199-F203 HydrophobicContact CB-CZ 4.36Å; L199-F203 HydrophobicContact CD1-CE2 4.33Å; L199-F203 VanDerWaalsContact O-CD2 3.3Å; L199-F203 WeakPolarHBondContact O-CD2 3.33Å; L199-F203 PolarHBondContact O-N 3.35Å
200L90.5Very high91.2Very high7 Ų738.6 Ų38.64%0.03723%0.228CC..Hα-helixtrans-50.9-44.3-179.9177.461.4000113.8I196 A197 Y202 F203 V204 L236 L238 Y241I196-L200 PolarHBondContact O-N 3.17Å; A197-L200 WeakPolarHBondContact O-CB 3.46Å; A197-L200 PolarHBondContact O-N 3Å; L200-Y202 PolarHBondContact O-N 2.91Å; L200-F203 PolarHBondContact O-N 3.23Å; L200-V204 HydrophobicContact CD1-CG2 3.74Å; L200-V204 HydrophobicContact CG-CG2 4.21Å; L200-V204 WeakPolarHBondContact O-CB 3.35Å; L200-V204 VanDerWaalsContact O-CG2 3.23Å; L200-V204 WeakPolarHBondContact O-CG2 3.19Å; L200-V204 PolarHBondContact O-N 3.09Å; L200-L236 HydrophobicContact CD1-CD1 4.37Å; L200-L238 HydrophobicContact CD1-CD2 3.94Å; L200-L238 HydrophobicContact CD2-CD2 4.04Å; L200-Y241 HydrophobicContact CD2-CD2 3.88Å; L200-Y241 HydrophobicContact CD2-CE2 4.26Å; L200-Y241 HydrophobicContact CG-CD2 4.21Å
201P89.1Confident90.9Very high39 Ų3945.3 Ų45.325%0.25326%0.257SS..Hα-helixtrans-60.8-34.3-179.4-21.833.5000112.9L199 Y205 Y241L199-P201 VanDerWaalsContact C-CD 3.4Å; P201-Y205 WeakPolarHBondContact O-CB 3.34Å; P201-Y205 PolarHBondContact O-N 3.18Å; P201-Y241 HydrophobicContact CB-CE1 4.44Å
202Y89.5Confident90.6Very high11 Ų1146.6 Ų46.64%0.04327%0.274CS..Hα-helixtrans-77.1-40.3-177.8-53-84.3000111.7V153 A156 V157 L160 A198 L199 L200 Y205 V206V153-Y202 HydrophobicContact CG1-CD1 3.49Å; V153-Y202 VanDerWaalsContact CG1-CD1 3.49Å; V153-Y202 HydrophobicContact CG1-CE1 3.85Å; A156-Y202 VanDerWaalsContact C-OH 3.23Å; A156-Y202 HydrophobicContact CB-CE1 4.06Å; A156-Y202 PolarHBondContact O-OH 2.84Å; A156-Y202 VanDerWaalsContact O-OH 3.04Å; V157-Y202 HydrophobicContact CB-CE1 4.18Å; V157-Y202 HydrophobicContact CG2-CD1 3.58Å; V157-Y202 HydrophobicContact CG2-CE1 3.51Å; L160-Y202 HydrophobicContact CD1-CD2 4.19Å; L160-Y202 HydrophobicContact CD1-CE1 4.48Å; L160-Y202 HydrophobicContact CD1-CE2 3.84Å; L160-Y202 HydrophobicContact CD2-CE2 3.99Å; L160-Y202 HydrophobicContact CG-CE2 4.14Å; A198-Y202 WeakPolarHBondContact O-CE2 3.41Å; L199-Y202 HydrophobicContact CD2-CD2 4.36Å; L199-Y202 PolarHBondContact O-N 3.49Å; L199-Y202 VanDerWaalsContact O-N 3.09Å; L200-Y202 PolarHBondContact O-N 2.91Å; Y202-Y205 WeakPolarHBondContact O-CB 3.41Å; Y202-Y205 PolarHBondContact O-N 2.82Å; Y202-V206 WeakPolarHBondContact O-CG2 3.38Å; Y202-V206 PolarHBondContact O-N 3.29Å
203F92.7Very high90.4Very high0 Ų044.9 Ų44.90%026%0.26CS..Hα-helixtrans-64.3-40.4171.2-64.2-59.3000111.6Y167 Y168 I171 T172 L190 L199 L200 Y205 V206 I207 M226 L230Y167-F203 HydrophobicContact CE1-CZ 4.28Å; Y168-F203 HydrophobicContact CD2-CD1 4.01Å; Y168-F203 AromaticContact CD2-CE1 3.61Å; Y168-F203 HydrophobicContact CD2-CE1 3.61Å; Y168-F203 AromaticContact CD2-CZ 3.91Å; Y168-F203 HydrophobicContact CD2-CZ 3.91Å; Y168-F203 AromaticContact CE2-CD1 3.97Å; Y168-F203 HydrophobicContact CE2-CD1 3.97Å; Y168-F203 HydrophobicContact CE2-CE1 4.01Å; I171-F203 HydrophobicContact CB-CE1 4.45Å; I171-F203 HydrophobicContact CG2-CE1 3.88Å; I171-F203 HydrophobicContact CG2-CZ 4.1Å; T172-F203 HydrophobicContact CG2-CD1 4.29Å; T172-F203 HydrophobicContact CG2-CE1 4.1Å; L190-F203 HydrophobicContact CD2-CD2 4.31Å; L190-F203 HydrophobicContact CD2-CE1 4.21Å; L190-F203 HydrophobicContact CD2-CE2 3.73Å; L190-F203 HydrophobicContact CD2-CZ 3.69Å; L199-F203 HydrophobicContact CB-CD2 4.01Å; L199-F203 HydrophobicContact CB-CE2 3.54Å; L199-F203 HydrophobicContact CB-CZ 4.36Å; L199-F203 HydrophobicContact CD1-CE2 4.33Å; L199-F203 VanDerWaalsContact O-CD2 3.3Å; L199-F203 WeakPolarHBondContact O-CD2 3.33Å; L199-F203 PolarHBondContact O-N 3.35Å; L200-F203 PolarHBondContact O-N 3.23Å; F203-Y205 VanDerWaalsContact C-N 3.3Å; F203-Y205 PolarHBondContact O-N 3.35Å; F203-V206 PolarHBondContact O-N 3.37Å; F203-I207 WeakPolarHBondContact O-CB 3.37Å; F203-I207 WeakPolarHBondContact O-CD1 3.47Å; F203-I207 WeakPolarHBondContact O-CG1 3.39Å; F203-I207 PolarHBondContact O-N 3.38Å; F203-M226 HydrophobicContact CB-SD 4.46Å; F203-M226 HydrophobicContact CD1-SD 4.18Å; F203-L230 HydrophobicContact CB-CD1 3.86Å; F203-L230 HydrophobicContact CD2-CD2 4.35Å
204V91.6Very high90.1Very high6 Ų644.2 Ų44.24%0.03626%0.258CS..Hα-helixtrans-63.7-34.7174.2173.90000111.7L200 S208 Y241 S244 L245L200-V204 HydrophobicContact CD1-CG2 3.74Å; L200-V204 HydrophobicContact CG-CG2 4.21Å; L200-V204 WeakPolarHBondContact O-CB 3.35Å; L200-V204 VanDerWaalsContact O-CG2 3.23Å; L200-V204 WeakPolarHBondContact O-CG2 3.19Å; L200-V204 PolarHBondContact O-N 3.09Å; V204-S208 WeakPolarHBondContact O-CB 3.44Å; V204-S208 PolarHBondContact O-N 2.76Å; V204-S208 PolarHBondContact O-OG 2.98Å; V204-Y241 HydrophobicContact CB-CD1 4.38Å; V204-Y241 HydrophobicContact CG1-CD1 3.99Å; V204-Y241 HydrophobicContact CG1-CG 4.47Å; V204-Y241 HydrophobicContact CG2-CD1 4.35Å; V204-Y241 HydrophobicContact CG2-CG 4.21Å; V204-S244 WeakPolarHBondContact CG1-OG 3.33Å; V204-L245 HydrophobicContact CG2-CD2 4.11Å; V204-L245 HydrophobicContact CG2-CG 4.44Å
205Y89.9Confident90.1Very high110 Ų11046.8 Ų46.843%0.43126%0.262SS..Hα-helixtrans-66.2-45.3172.8177.4-103.3000112.6V153 P201 Y202 F203 I207 S208 G209V153-Y205 HydrophobicContact CB-CD1 3.93Å; V153-Y205 HydrophobicContact CB-CD2 3.86Å; V153-Y205 HydrophobicContact CB-CE1 4.09Å; V153-Y205 HydrophobicContact CB-CE2 4Å; V153-Y205 HydrophobicContact CB-CG 3.81Å; V153-Y205 HydrophobicContact CG1-CD1 3.94Å; V153-Y205 HydrophobicContact CG1-CD2 4.5Å; V153-Y205 HydrophobicContact CG1-CE1 4.44Å; V153-Y205 HydrophobicContact CG1-CG 3.97Å; V153-Y205 HydrophobicContact CG2-CD1 4.3Å; V153-Y205 HydrophobicContact CG2-CD2 3.39Å; V153-Y205 HydrophobicContact CG2-CE2 3.83Å; V153-Y205 HydrophobicContact CG2-CG 3.65Å; P201-Y205 WeakPolarHBondContact O-CB 3.34Å; P201-Y205 PolarHBondContact O-N 3.18Å; Y202-Y205 WeakPolarHBondContact O-CB 3.41Å; Y202-Y205 PolarHBondContact O-N 2.82Å; F203-Y205 VanDerWaalsContact C-N 3.3Å; F203-Y205 PolarHBondContact O-N 3.35Å; Y205-I207 VanDerWaalsContact C-N 3.31Å; Y205-I207 PolarHBondContact O-N 2.86Å; Y205-S208 WeakPolarHBondContact O-CB 3.42Å; Y205-S208 PolarHBondContact O-N 2.98Å; Y205-S208 VanDerWaalsContact O-N 3.14Å; Y205-G209 PolarHBondContact O-N 2.92Å
206V91.8Very high90.2Very high31 Ų3141.4 Ų41.419%0.18824%0.241CC..Hα-helixtrans-58.7-44.2174.1170.80000110.9Y168 T172 L176 Y202 F203 S208 G209 L223 M226Y168-V206 WeakPolarHBondContact OH-CG2 3.27Å; T172-V206 HydrophobicContact CG2-CG2 4.43Å; L176-V206 HydrophobicContact CD1-CG1 4.26Å; Y202-V206 WeakPolarHBondContact O-CG2 3.38Å; Y202-V206 PolarHBondContact O-N 3.29Å; F203-V206 PolarHBondContact O-N 3.37Å; V206-S208 PolarHBondContact O-N 3.37Å; V206-G209 WeakPolarHBondContact O-CA 3.5Å; V206-G209 PolarHBondContact O-N 3.06Å; V206-L223 HydrophobicContact CG1-CD2 3.86Å; V206-M226 HydrophobicContact CG1-CE 4.35Å
207I93.7Very high90.3Very high1 Ų143.1 Ų43.11%0.00525%0.25CS..Hα-helixtrans-63.8-38.1175.2-71.6161.6000111.9F203 Y205 G209 V210 L223 M226 V227 L230 L245 S248F203-I207 WeakPolarHBondContact O-CB 3.37Å; F203-I207 WeakPolarHBondContact O-CD1 3.47Å; F203-I207 WeakPolarHBondContact O-CG1 3.39Å; F203-I207 PolarHBondContact O-N 3.38Å; Y205-I207 VanDerWaalsContact C-N 3.31Å; Y205-I207 PolarHBondContact O-N 2.86Å; I207-G209 PolarHBondContact O-N 2.98Å; I207-G209 VanDerWaalsContact O-N 3.15Å; I207-V210 WeakPolarHBondContact O-CG1 3.49Å; I207-V210 PolarHBondContact O-N 2.98Å; I207-L223 HydrophobicContact CG1-CD2 4.46Å; I207-M226 HydrophobicContact CD1-CB 4.42Å; I207-M226 HydrophobicContact CD1-CG 4.18Å; I207-M226 HydrophobicContact CD1-SD 4.04Å; I207-M226 HydrophobicContact CG1-SD 4.04Å; I207-V227 HydrophobicContact CB-CG2 4.4Å; I207-V227 HydrophobicContact CD1-CG2 3.76Å; I207-V227 HydrophobicContact CG1-CG2 4Å; I207-V227 HydrophobicContact CG2-CG2 3.51Å; I207-L230 HydrophobicContact CD1-CD1 3.59Å; I207-L245 HydrophobicContact CB-CD2 4.44Å; I207-L245 HydrophobicContact CD1-CD2 3.96Å; I207-L245 HydrophobicContact CG2-CD2 3.85Å; I207-S248 PolarHBondContact O-OG 2.89Å
208S89.6Confident90.5Very high52 Ų5246.2 Ų46.236%0.36426%0.255SS..Hα-helixtrans-64.7-15.8173.9-59.80000112.9V204 Y205 V206 V210 S244V204-S208 WeakPolarHBondContact O-CB 3.44Å; V204-S208 PolarHBondContact O-N 2.76Å; V204-S208 PolarHBondContact O-OG 2.98Å; Y205-S208 WeakPolarHBondContact O-CB 3.42Å; Y205-S208 PolarHBondContact O-N 2.98Å; Y205-S208 VanDerWaalsContact O-N 3.14Å; V206-S208 PolarHBondContact O-N 3.37Å; S208-V210 VanDerWaalsContact C-N 3.27Å; S208-V210 PolarHBondContact O-N 3.09Å; S208-S244 PolarHBondContact OG-OG 3.2Å
209G87.1Confident90.8Very high24 Ų2445.2 Ų45.225%0.24724%0.241CC..G310 helixtrans-72.9-2.4174.800000115.9Y205 V206 I207 K211 S212Y205-G209 PolarHBondContact O-N 2.92Å; V206-G209 WeakPolarHBondContact O-CA 3.5Å; V206-G209 PolarHBondContact O-N 3.06Å; I207-G209 PolarHBondContact O-N 2.98Å; I207-G209 VanDerWaalsContact O-N 3.15Å; G209-K211 PolarHBondContact O-N 2.68Å; G209-S212 PolarHBondContact O-N 2.93Å; G209-S212 PolarHBondContact O-OG 2.93Å
210V90.5Very high91.1Very high5 Ų545.2 Ų45.23%0.0324%0.241CC..G310 helixtrans-45.7-29-178.9-80.10000115.1I207 S208 V213 S214 L220 L223 Y251I207-V210 WeakPolarHBondContact O-CG1 3.49Å; I207-V210 PolarHBondContact O-N 2.98Å; S208-V210 VanDerWaalsContact C-N 3.27Å; S208-V210 PolarHBondContact O-N 3.09Å; V210-V213 PolarHBondContact O-N 3.36Å; V210-S214 PolarHBondContact O-N 3.21Å; V210-L220 HydrophobicContact CB-CD2 4.04Å; V210-L220 HydrophobicContact CG1-CD2 4.03Å; V210-L223 HydrophobicContact CG1-CB 4.41Å; V210-L223 HydrophobicContact CG1-CD1 3.78Å; V210-Y251 HydrophobicContact CB-CD1 3.96Å; V210-Y251 HydrophobicContact CB-CE1 4.4Å; V210-Y251 HydrophobicContact CG2-CD1 3.65Å; V210-Y251 HydrophobicContact CG2-CE1 4.39Å; V210-Y251 HydrophobicContact CG2-CG 4.21Å
211K89.4Confident91.3Very high141 Ų14147.6 Ų47.661%0.61325%0.254SS*.G310 helixtrans-63.4-40.9178.3-61.9-164.7175-171.80113.9G209 V213 S214 Y251G209-K211 PolarHBondContact O-N 2.68Å; K211-V213 VanDerWaalsContact C-N 3.26Å; K211-V213 PolarHBondContact O-N 3.33Å; K211-S214 WeakPolarHBondContact O-CB 3.44Å; K211-S214 PolarHBondContact O-N 2.95Å; K211-S214 PolarHBondContact O-OG 3.47Å; K211-Y251 HydrophobicContact CD-CE2 4.31Å; K211-Y251 HydrophobicContact CG-CD1 4.44Å; K211-Y251 HydrophobicContact CG-CD2 4.15Å; K211-Y251 HydrophobicContact CG-CE1 4.13Å; K211-Y251 HydrophobicContact CG-CE2 3.85Å; K211-Y251 HydrophobicContact CG-CG 4.46Å
212S89.8Confident91.6Very high91 Ų9146.6 Ų46.664%0.63625%0.245SC*.THydrogen-bonded Turntrans-74.6-19.4-179.656.10000112.8G209 H215G209-S212 PolarHBondContact O-N 2.93Å; G209-S212 PolarHBondContact O-OG 2.93Å; S212-H215 PolarHBondContact O-CE1 3.08Å; S212-H215 VanDerWaalsContact O-CE1 3.22Å; S212-H215 PolarHBondContact O-ND1 3.06Å
213V90.1Very high91.9Very high37 Ų3746.3 Ų46.322%0.22424%0.244CC..THydrogen-bonded Turntrans-102.512.4-179-153.50000112V210 K211 H215 D216 Q219V210-V213 PolarHBondContact O-N 3.36Å; K211-V213 VanDerWaalsContact C-N 3.26Å; K211-V213 PolarHBondContact O-N 3.33Å; V213-H215 PolarHBondContact O-N 3.24Å; V213-D216 HydrophobicContact CG1-CB 4.14Å; V213-D216 PolarHBondContact O-N 3.36Å; V213-Q219 HydrophobicContact CG1-CB 3.4Å; V213-Q219 HydrophobicContact CG1-CG 4.17Å
214S90.4Very high92.1Very high22 Ų2246.5 Ų46.515%0.15425%0.245CC..THydrogen-bonded Turntrans-62.9-5.8-176.9550000115.9V210 K211 Y251 A258 A259V210-S214 PolarHBondContact O-N 3.21Å; K211-S214 WeakPolarHBondContact O-CB 3.44Å; K211-S214 PolarHBondContact O-N 2.95Å; K211-S214 PolarHBondContact O-OG 3.47Å; S214-Y251 WeakPolarHBondContact CB-OH 3.27Å; S214-A258 PolarHBondContact O-N 2.93Å; S214-A259 PolarHBondContact O-N 3.49Å
215H91.2Very high92.3Very high124 Ų12448.6 Ų48.657%0.57425%0.254SS*.THydrogen-bonded Turntrans-94.3-18.3175.858.9-89.5000113.8S212 V213 A258S212-H215 PolarHBondContact O-CE1 3.08Å; S212-H215 VanDerWaalsContact O-CE1 3.22Å; S212-H215 PolarHBondContact O-ND1 3.06Å; V213-H215 PolarHBondContact O-N 3.24Å; H215-A258 HydrophobicContact CB-CB 4.13Å
216D92.8Very high92.7Very high55 Ų5543.4 Ų43.429%0.29423%0.234SC..  trans-112.7113-175.9-177.2-34.2000110.2V213 E218 Q219 L220V213-D216 HydrophobicContact CG1-CB 4.14Å; V213-D216 PolarHBondContact O-N 3.36Å; D216-E218 WeakPolarHBondContact OD1-CB 3.1Å; D216-E218 PolarHBondContact OD1-N 3.44Å; D216-Q219 HydrophobicContact CB-CB 4.12Å; D216-Q219 HydrophobicContact CB-CG 4.14Å; D216-Q219 WeakPolarHBondContact OD1-CG 3.18Å; D216-Q219 PolarHBondContact OD1-N 3.43Å; D216-Q219 WeakPolarHBondContact OD2-CG 3.47Å; D216-L220 VanDerWaalsContact O-CG 3.27Å; D216-L220 WeakPolarHBondContact O-CG 3.47Å; D216-L220 PolarHBondContact O-N 3.32Å
217L92.7Very high92.9Very high38 Ų3842 Ų4220%0.19923%0.225CC..Hα-helixtrans-72.8-34-176.5-169.170.2000112.7N221 A259 N265 H267 L270L217-N221 PolarHBondContact O-N 3.04Å; L217-N221 VanDerWaalsContact O-N 3.08Å; L217-A259 HydrophobicContact CB-CB 4.3Å; L217-N265 HydrophobicContact CD2-CB 4.38Å; L217-H267 HydrophobicContact CD1-CB 3.98Å; L217-L270 HydrophobicContact CD1-CB 3.98Å; L217-L270 HydrophobicContact CD1-CD1 3.92Å; L217-L270 HydrophobicContact CD1-CD2 4.25Å; L217-L270 HydrophobicContact CD1-CG 4.25Å
218E92.3Very high93.1Very high121 Ų12145.6 Ų45.657%0.56524%0.241SC*.Hα-helixtrans-67.4-46.3178.2-78.6-163.5-144.700110.8D216 L220 N221 R222D216-E218 WeakPolarHBondContact OD1-CB 3.1Å; D216-E218 PolarHBondContact OD1-N 3.44Å; E218-L220 PolarHBondContact O-N 3.39Å; E218-N221 CarbonylContact O-C 3.59Å; E218-N221 WeakPolarHBondContact O-CB 3.48Å; E218-N221 PolarHBondContact O-N 2.91Å; E218-N221 VanDerWaalsContact O-N 3.1Å; E218-R222 WeakPolarHBondContact O-CB 3.39Å; E218-R222 WeakPolarHBondContact O-CD 3.19Å; E218-R222 WeakPolarHBondContact O-CG 3.38Å; E218-R222 PolarHBondContact O-N 3.35Å; E218-R222 IonicContact OE2-CZ 3.69Å; E218-R222 IonicContact OE2-NE 2.87Å; E218-R222 PolarHBondContact OE2-NE 2.87Å; E218-R222 IonicContact OE2-NH2 2.84Å; E218-R222 PolarHBondContact OE2-NH2 3.47Å
219Q93.3Very high93.5Very high34 Ų3443.5 Ų43.516%0.15923%0.226CC..Hα-helixtrans-66.5-37.2-179.2-63.9-70.1-7.300111.9L176 V213 D216 N221 R222 L223L176-Q219 PolarHBondContact O-NE2 3.4Å; L176-Q219 PolarHBondContact O-OE1 3.32Å; V213-Q219 HydrophobicContact CG1-CB 3.4Å; V213-Q219 HydrophobicContact CG1-CG 4.17Å; D216-Q219 HydrophobicContact CB-CB 4.12Å; D216-Q219 HydrophobicContact CB-CG 4.14Å; D216-Q219 WeakPolarHBondContact OD1-CG 3.18Å; D216-Q219 PolarHBondContact OD1-N 3.43Å; D216-Q219 WeakPolarHBondContact OD2-CG 3.47Å; Q219-N221 VanDerWaalsContact C-N 3.34Å; Q219-N221 PolarHBondContact O-N 3.34Å; Q219-R222 PolarHBondContact O-N 2.98Å; Q219-L223 VanDerWaalsContact O-CG 3.31Å; Q219-L223 WeakPolarHBondContact O-CG 3.35Å; Q219-L223 PolarHBondContact O-N 3.41Å
220L94.6Very high93.9Very high0 Ų042.4 Ų42.40%022%0.215CC..Hα-helixtrans-59.8-43.3169-70.3172.7000111.7V210 D216 E218 L223 L224 L257 L270V210-L220 HydrophobicContact CB-CD2 4.04Å; V210-L220 HydrophobicContact CG1-CD2 4.03Å; D216-L220 VanDerWaalsContact O-CG 3.27Å; D216-L220 WeakPolarHBondContact O-CG 3.47Å; D216-L220 PolarHBondContact O-N 3.32Å; E218-L220 PolarHBondContact O-N 3.39Å; L220-L223 PolarHBondContact O-N 3.24Å; L220-L224 WeakPolarHBondContact O-CG 3.27Å; L220-L224 PolarHBondContact O-N 3.16Å; L220-L257 HydrophobicContact CD1-CD1 3.83Å; L220-L257 HydrophobicContact CD1-CD2 3.96Å; L220-L257 HydrophobicContact CD1-CG 4.38Å; L220-L270 HydrophobicContact CB-CD1 3.81Å
221N94.9Very high94.1Very high58 Ų5842.6 Ų42.631%0.3122%0.216SC..Hα-helixtrans-66-41.6177.3-166.229.8000112.1L217 E218 Q219 L223 L224 H225 L270L217-N221 PolarHBondContact O-N 3.04Å; L217-N221 VanDerWaalsContact O-N 3.08Å; E218-N221 CarbonylContact O-C 3.59Å; E218-N221 WeakPolarHBondContact O-CB 3.48Å; E218-N221 PolarHBondContact O-N 2.91Å; E218-N221 VanDerWaalsContact O-N 3.1Å; Q219-N221 VanDerWaalsContact C-N 3.34Å; Q219-N221 PolarHBondContact O-N 3.34Å; N221-L223 VanDerWaalsContact C-N 3.31Å; N221-L223 PolarHBondContact O-N 3.11Å; N221-L224 PolarHBondContact O-N 3.22Å; N221-L224 VanDerWaalsContact O-N 3.16Å; N221-H225 PolarHBondContact ND2-NE2 2.95Å; N221-H225 PolarHBondContact O-CD2 2.64Å; N221-H225 VanDerWaalsContact O-CD2 3.24Å; N221-H225 PolarHBondContact O-N 3.08Å; N221-H225 PolarHBondContact OD1-NE2 3.31Å; N221-L270 HydrophobicContact CB-CD1 3.92Å
222R95.6Very high94.4Very high18 Ų1839.1 Ų39.17%0.06820%0.202CC..Hα-helixtrans-58.7-40.5174.1-69157.7-175-94.511.5111.5I175 L176 G177 D178 M183 E218 Q219 H225 M226I175-R222 HydrophobicContact CG2-CB 4.35Å; I175-R222 PolarHBondContact O-NH1 3.46Å; L176-R222 HydrophobicContact CD2-CB 4.41Å; G177-R222 PolarHBondContact O-NH1 3.04Å; D178-R222 PolarHBondContact O-NH2 3.29Å; M183-R222 HydrophobicContact CE-CB 4.24Å; M183-R222 HydrophobicContact CE-CG 3.68Å; M183-R222 HydrophobicContact SD-CG 3.92Å; E218-R222 WeakPolarHBondContact O-CB 3.39Å; E218-R222 WeakPolarHBondContact O-CD 3.19Å; E218-R222 WeakPolarHBondContact O-CG 3.38Å; E218-R222 PolarHBondContact O-N 3.35Å; E218-R222 IonicContact OE2-CZ 3.69Å; E218-R222 IonicContact OE2-NE 2.87Å; E218-R222 PolarHBondContact OE2-NE 2.87Å; E218-R222 IonicContact OE2-NH2 2.84Å; E218-R222 PolarHBondContact OE2-NH2 3.47Å; Q219-R222 PolarHBondContact O-N 2.98Å; R222-H225 PolarHBondContact O-N 3.08Å; R222-M226 PolarHBondContact O-N 2.92Å
223L96.2Very high94.6Very high5 Ų535 Ų353%0.02617%0.173CC..Hα-helixtrans-66.2-42.8172.5-70.2171.7000112.6L176 V206 I207 V210 Q219 L220 N221 H225 M226 V227L176-L223 HydrophobicContact CD2-CD2 3.97Å; L176-L223 HydrophobicContact CD2-CG 4.21Å; V206-L223 HydrophobicContact CG1-CD2 3.86Å; I207-L223 HydrophobicContact CG1-CD2 4.46Å; V210-L223 HydrophobicContact CG1-CB 4.41Å; V210-L223 HydrophobicContact CG1-CD1 3.78Å; Q219-L223 VanDerWaalsContact O-CG 3.31Å; Q219-L223 WeakPolarHBondContact O-CG 3.35Å; Q219-L223 PolarHBondContact O-N 3.41Å; L220-L223 PolarHBondContact O-N 3.24Å; N221-L223 VanDerWaalsContact C-N 3.31Å; N221-L223 PolarHBondContact O-N 3.11Å; L223-H225 VanDerWaalsContact C-N 3.3Å; L223-H225 PolarHBondContact O-N 3.48Å; L223-M226 HydrophobicContact CD2-CE 4.3Å; L223-M226 WeakPolarHBondContact O-CB 3.3Å; L223-M226 PolarHBondContact O-N 2.93Å; L223-M226 VanDerWaalsContact O-N 3.1Å; L223-V227 WeakPolarHBondContact O-CG2 3.4Å; L223-V227 PolarHBondContact O-N 2.89Å
224L96.7Very high94.8Very high3 Ų338.3 Ų38.32%0.01620%0.195CC..Hα-helixtrans-65.2-31.7175-67.1170.8000112.4L220 N221 K228 V249 C252 L270 Y273 A274 L277L220-L224 WeakPolarHBondContact O-CG 3.27Å; L220-L224 PolarHBondContact O-N 3.16Å; N221-L224 PolarHBondContact O-N 3.22Å; N221-L224 VanDerWaalsContact O-N 3.16Å; L224-K228 PolarHBondContact O-N 3.14Å; L224-K228 VanDerWaalsContact O-N 3.12Å; L224-V249 HydrophobicContact CD2-CB 4.48Å; L224-V249 HydrophobicContact CD2-CG1 4.47Å; L224-V249 HydrophobicContact CD2-CG2 3.96Å; L224-C252 HydrophobicContact CD1-CB 4.3Å; L224-C252 HydrophobicContact CD2-CB 4.33Å; L224-L270 HydrophobicContact CD1-CD1 3.92Å; L224-L270 HydrophobicContact CD1-CD2 4.4Å; L224-L270 HydrophobicContact CD1-CG 3.86Å; L224-Y273 HydrophobicContact CB-CD1 4.02Å; L224-Y273 HydrophobicContact CB-CE1 3.59Å; L224-Y273 HydrophobicContact CD1-CD1 4.21Å; L224-Y273 PolarHBondContact O-OH 3.32Å; L224-A274 HydrophobicContact CD1-CB 3.92Å; L224-A274 HydrophobicContact CD2-CB 4.22Å; L224-L277 HydrophobicContact CB-CD2 4.19Å; L224-L277 HydrophobicContact CD2-CD2 4.15Å; L224-L277 VanDerWaalsContact O-CD2 3.22Å; L224-L277 WeakPolarHBondContact O-CD2 3.42Å
225H96.6Very high94.9Very high51 Ų5144 Ų4424%0.23621%0.214CC..Hα-helixtrans-68.3-39.4168.9-69.3-45.9000112.3M183 L187 N221 R222 L223 K228 S229 Y273M183-H225 HydrophobicContact CE-CB 4.27Å; L187-H225 HydrophobicContact CD1-CB 3.78Å; L187-H225 HydrophobicContact CD2-CB 4.17Å; N221-H225 PolarHBondContact ND2-NE2 2.95Å; N221-H225 PolarHBondContact O-CD2 2.64Å; N221-H225 VanDerWaalsContact O-CD2 3.24Å; N221-H225 PolarHBondContact O-N 3.08Å; N221-H225 PolarHBondContact OD1-NE2 3.31Å; R222-H225 PolarHBondContact O-N 3.08Å; L223-H225 VanDerWaalsContact C-N 3.3Å; L223-H225 PolarHBondContact O-N 3.48Å; H225-K228 WeakPolarHBondContact O-CB 3.43Å; H225-K228 PolarHBondContact O-N 2.82Å; H225-S229 PolarHBondContact O-N 2.83Å; H225-Y273 AromaticContact CE1-CE1 3.67Å; H225-Y273 AromaticContact CE1-CZ 3.66Å; H225-Y273 AromaticContact ND1-CE1 3.57Å; H225-Y273 AromaticContact ND1-CZ 3.4Å; H225-Y273 PolarHBondContact ND1-OH 2.92Å
226M96.8Very high94.8Very high0 Ų039 Ų390%019%0.191CC..Hα-helixtrans-60.5-44.8173.4-165.5-169.8-61.900111.8I175 L187 L190 F203 V206 I207 R222 L223 K228 S229 L230I175-M226 HydrophobicContact CB-CE 4.11Å; I175-M226 HydrophobicContact CD1-CE 4.01Å; I175-M226 HydrophobicContact CD1-CG 4.22Å; I175-M226 HydrophobicContact CG2-CB 4.46Å; I175-M226 HydrophobicContact CG2-CE 3.74Å; L187-M226 HydrophobicContact CD2-CB 4.34Å; L190-M226 HydrophobicContact CD1-CG 3.82Å; F203-M226 HydrophobicContact CB-SD 4.46Å; F203-M226 HydrophobicContact CD1-SD 4.18Å; V206-M226 HydrophobicContact CG1-CE 4.35Å; I207-M226 HydrophobicContact CD1-CB 4.42Å; I207-M226 HydrophobicContact CD1-CG 4.18Å; I207-M226 HydrophobicContact CD1-SD 4.04Å; I207-M226 HydrophobicContact CG1-SD 4.04Å; R222-M226 PolarHBondContact O-N 2.92Å; L223-M226 HydrophobicContact CD2-CE 4.3Å; L223-M226 WeakPolarHBondContact O-CB 3.3Å; L223-M226 PolarHBondContact O-N 2.93Å; L223-M226 VanDerWaalsContact O-N 3.1Å; M226-K228 VanDerWaalsContact C-N 3.34Å; M226-K228 PolarHBondContact O-N 3.31Å; M226-S229 PolarHBondContact O-N 3.35Å; M226-L230 HydrophobicContact CG-CD1 4.46Å; M226-L230 WeakPolarHBondContact O-CG 3.34Å; M226-L230 PolarHBondContact O-N 3.01Å; M226-L230 VanDerWaalsContact O-N 3.09Å
227V97.6Very high94.7Very high2 Ų242.3 Ų42.31%0.01220%0.2CC..Hα-helixtrans-54-50.6172.6173.50000110.6I207 L223 S229 L230 V231 L245 V249 L277 I281I207-V227 HydrophobicContact CB-CG2 4.4Å; I207-V227 HydrophobicContact CD1-CG2 3.76Å; I207-V227 HydrophobicContact CG1-CG2 4Å; I207-V227 HydrophobicContact CG2-CG2 3.51Å; L223-V227 WeakPolarHBondContact O-CG2 3.4Å; L223-V227 PolarHBondContact O-N 2.89Å; V227-S229 PolarHBondContact O-N 2.89Å; V227-L230 PolarHBondContact O-N 3.02Å; V227-V231 HydrophobicContact CG1-CG2 4.08Å; V227-V231 VanDerWaalsContact O-CB 3.31Å; V227-V231 WeakPolarHBondContact O-CB 3.33Å; V227-V231 WeakPolarHBondContact O-CG2 3.2Å; V227-V231 PolarHBondContact O-N 3.49Å; V227-L245 HydrophobicContact CG2-CD2 4.31Å; V227-V249 HydrophobicContact CG1-CG2 4.03Å; V227-V249 HydrophobicContact CG2-CG2 4.5Å; V227-L277 HydrophobicContact CB-CD2 4.02Å; V227-L277 HydrophobicContact CG1-CD1 4.41Å; V227-L277 HydrophobicContact CG1-CD2 3.84Å; V227-L277 HydrophobicContact CG1-CG 4.27Å; V227-I281 HydrophobicContact CG1-CD1 3.83Å
228K97.2Very high94.4Very high77 Ų7740.6 Ų40.634%0.33519%0.191SC..Hα-helixtrans-58.6-45179.3180179.6171-1750112.4L224 H225 M226 V231 Q232 Y273 L277L224-K228 PolarHBondContact O-N 3.14Å; L224-K228 VanDerWaalsContact O-N 3.12Å; H225-K228 WeakPolarHBondContact O-CB 3.43Å; H225-K228 PolarHBondContact O-N 2.82Å; M226-K228 VanDerWaalsContact C-N 3.34Å; M226-K228 PolarHBondContact O-N 3.31Å; K228-V231 PolarHBondContact O-N 3Å; K228-Q232 HydrophobicContact CG-CG 4.47Å; K228-Q232 WeakPolarHBondContact O-CB 3.32Å; K228-Q232 VanDerWaalsContact O-CG 3.3Å; K228-Q232 WeakPolarHBondContact O-CG 3.32Å; K228-Q232 PolarHBondContact O-N 2.98Å; K228-Y273 HydrophobicContact CD-CE2 4.35Å; K228-Y273 WeakPolarHBondContact CD-OH 3.46Å; K228-L277 HydrophobicContact CB-CD1 3.86Å; K228-L277 HydrophobicContact CG-CD1 4.34Å
229S96.9Very high94Very high8 Ų835.2 Ų35.26%0.05617%0.169CC..Hα-helixtrans-61.2-44.9178.2-75.70000112.6L187 H225 M226 V227 Q232 N233L187-S229 WeakPolarHBondContact O-CB 3.43Å; L187-S229 PolarHBondContact O-OG 3.24Å; H225-S229 PolarHBondContact O-N 2.83Å; M226-S229 PolarHBondContact O-N 3.35Å; V227-S229 PolarHBondContact O-N 2.89Å; S229-Q232 PolarHBondContact O-N 3.5Å; S229-N233 PolarHBondContact O-N 3.16Å
230L95.9Very high93.5Very high1 Ų137.7 Ų37.71%0.00519%0.19CC..Hα-helixtrans-65.2-42.5177.2-64.8170.6000112L190 I196 F203 I207 M226 V227 Q232 N233 L236L190-L230 HydrophobicContact CD2-CD2 4.3Å; I196-L230 HydrophobicContact CD1-CD2 4.42Å; F203-L230 HydrophobicContact CB-CD1 3.86Å; F203-L230 HydrophobicContact CD2-CD2 4.35Å; I207-L230 HydrophobicContact CD1-CD1 3.59Å; M226-L230 HydrophobicContact CG-CD1 4.46Å; M226-L230 WeakPolarHBondContact O-CG 3.34Å; M226-L230 PolarHBondContact O-N 3.01Å; M226-L230 VanDerWaalsContact O-N 3.09Å; V227-L230 PolarHBondContact O-N 3.02Å; L230-Q232 VanDerWaalsContact C-N 3.26Å; L230-Q232 PolarHBondContact O-N 3.19Å; L230-N233 PolarHBondContact O-N 3.41Å; L230-L236 HydrophobicContact CD2-CD1 3.86Å
231V95.2Very high93.3Very high8 Ų841.6 Ų41.65%0.04821%0.205CC..Hα-helixtrans-64.3-30179.6165.50000112.7V227 K228 L238 L245 I281 H285V227-V231 HydrophobicContact CG1-CG2 4.08Å; V227-V231 VanDerWaalsContact O-CB 3.31Å; V227-V231 WeakPolarHBondContact O-CB 3.33Å; V227-V231 WeakPolarHBondContact O-CG2 3.2Å; V227-V231 PolarHBondContact O-N 3.49Å; K228-V231 PolarHBondContact O-N 3Å; V231-L238 HydrophobicContact CG2-CD1 4.04Å; V231-L245 HydrophobicContact CG2-CD1 4.3Å; V231-I281 HydrophobicContact CB-CG1 4.48Å; V231-I281 HydrophobicContact CG1-CG1 3.96Å; V231-I281 HydrophobicContact CG2-CD1 4.26Å; V231-I281 HydrophobicContact CG2-CG1 3.76Å; V231-H285 PolarHBondContact O-NE2 3.35Å; V231-H285 VanDerWaalsContact O-NE2 3.09Å
232Q95.4Very high93.1Very high69 Ų6938.9 Ų38.932%0.32219%0.191SC..THydrogen-bonded Turntrans-92.9-0.5179.2-66.2-174.3-12.300114.1Q191 K228 S229 L230 P234 H280Q191-Q232 HydrophobicContact CG-CB 4.19Å; K228-Q232 HydrophobicContact CG-CG 4.47Å; K228-Q232 WeakPolarHBondContact O-CB 3.32Å; K228-Q232 VanDerWaalsContact O-CG 3.3Å; K228-Q232 WeakPolarHBondContact O-CG 3.32Å; K228-Q232 PolarHBondContact O-N 2.98Å; S229-Q232 PolarHBondContact O-N 3.5Å; L230-Q232 VanDerWaalsContact C-N 3.26Å; L230-Q232 PolarHBondContact O-N 3.19Å; Q232-P234 WeakPolarHBondContact O-CD 3.29Å; Q232-H280 WeakPolarHBondContact CG-NE2 3.13Å; Q232-H280 PolarHBondContact NE2-NE2 2.75Å
233N95.4Very high92.9Very high5 Ų543.7 Ų43.73%0.02721%0.209CC..  trans-81.5115.9178.2-174.4-32.5000111.1L190 Q191 N193 S229 L230 Y235 L236L190-N233 PolarHBondContact O-ND2 3.32Å; Q191-N233 WeakPolarHBondContact O-CA 3.39Å; Q191-N233 WeakPolarHBondContact O-CB 3.31Å; N193-N233 PolarHBondContact O-ND2 3.07Å; S229-N233 PolarHBondContact O-N 3.16Å; L230-N233 PolarHBondContact O-N 3.41Å; N233-Y235 PolarHBondContact O-N 2.86Å; N233-Y235 WeakPolarHBondContact OD1-CB 3.37Å; N233-Y235 WeakPolarHBondContact OD1-CD2 3.3Å; N233-Y235 PolarHBondContact OD1-N 3.43Å; N233-L236 HydrophobicContact CB-CB 4.49Å; N233-L236 HydrophobicContact CB-CD1 3.96Å; N233-L236 HydrophobicContact CB-CG 4.08Å; N233-L236 PolarHBondContact O-N 3Å
234P92.8Very high92.7Very high105 Ų10545.1 Ų45.168%0.68222%0.219SC*.THydrogen-bonded Turntrans-76.1-3.6-175.434.1-37.9000114.2Q232Q232-P234 WeakPolarHBondContact O-CD 3.29Å
235Y92.3Very high92.6Very high143 Ų14345 Ų4556%0.56122%0.218SC*.THydrogen-bonded Turntrans-99.1-2.6178.2-52.8-68.4000112.9S192 N233S192-Y235 WeakPolarHBondContact O-CE2 3.29Å; N233-Y235 PolarHBondContact O-N 2.86Å; N233-Y235 WeakPolarHBondContact OD1-CB 3.37Å; N233-Y235 WeakPolarHBondContact OD1-CD2 3.3Å; N233-Y235 PolarHBondContact OD1-N 3.43Å
236L90.9Very high92.6Very high18 Ų1843 Ų439%0.09421%0.21CC..  trans-102.9135.8179.1-66.2-176.9000111.9I196 A197 L200 L230 N233I196-L236 HydrophobicContact CD1-CD1 4.18Å; I196-L236 HydrophobicContact CG1-CD1 4.23Å; I196-L236 HydrophobicContact CG1-CD2 4.01Å; I196-L236 HydrophobicContact CG1-CG 4.45Å; A197-L236 HydrophobicContact CB-CD2 4.04Å; L200-L236 HydrophobicContact CD1-CD1 4.37Å; L230-L236 HydrophobicContact CD2-CD1 3.86Å; N233-L236 HydrophobicContact CB-CB 4.49Å; N233-L236 HydrophobicContact CB-CD1 3.96Å; N233-L236 HydrophobicContact CB-CG 4.08Å; N233-L236 PolarHBondContact O-N 3Å
237Y88.8Confident92.5Very high124 Ų12446.7 Ų46.749%0.48624%0.236SC..  trans-103.8108.9167.8-177.4-113.4000109.2Y140 L288Y140-Y237 HydrophobicContact CE1-CD1 4.34Å; Y140-Y237 AromaticContact CE1-CE1 3.64Å; Y140-Y237 HydrophobicContact CE1-CE1 3.64Å; Y140-Y237 PolarHBondContact OH-OH 2.96Å; Y237-L288 HydrophobicContact CE2-CD1 4.01Å; Y237-L288 HydrophobicContact CE2-CD2 3.89Å
238L87.4Confident92.4Very high2 Ų247 Ų471%0.0124%0.238CC..  trans-77.7-32.7-175.4-61.4-177.6000113.1L200 V231 S240 Y241 V242 L245L200-L238 HydrophobicContact CD1-CD2 3.94Å; L200-L238 HydrophobicContact CD2-CD2 4.04Å; V231-L238 HydrophobicContact CG2-CD1 4.04Å; L238-S240 PolarHBondContact O-N 3.49Å; L238-Y241 WeakPolarHBondContact O-CA 3.27Å; L238-Y241 VanDerWaalsContact O-CB 3.27Å; L238-Y241 WeakPolarHBondContact O-CB 3.48Å; L238-Y241 VanDerWaalsContact O-CD2 3.3Å; L238-Y241 WeakPolarHBondContact O-CD2 3.3Å; L238-Y241 PolarHBondContact O-N 3.39Å; L238-V242 HydrophobicContact CB-CG2 3.55Å; L238-V242 HydrophobicContact CD1-CG2 4.32Å; L238-L245 HydrophobicContact CD1-CD1 4.02Å; L238-L245 HydrophobicContact CD2-CD1 4.24Å
239G84.5Confident92.4Very high9 Ų943.3 Ų43.39%0.09322%0.222CC..THydrogen-bonded Turntrans44.2-119.1175.600000114Y241 V242G239-Y241 VanDerWaalsContact C-N 3.32Å; G239-Y241 PolarHBondContact O-N 3.44Å; G239-V242 VanDerWaalsContact O-CG2 3.32Å; G239-V242 WeakPolarHBondContact O-CG2 3.37Å; G239-V242 PolarHBondContact O-N 3.37Å
240S82.3Confident92.4Very high86 Ų8643.8 Ų43.860%0.60122%0.223SC*.THydrogen-bonded Turntrans-66.3-26.5178.651.60000114.4L238 V242 R243L238-S240 PolarHBondContact O-N 3.49Å; S240-V242 PolarHBondContact O-N 3.1Å; S240-R243 PolarHBondContact O-N 2.95Å
241Y89.2Confident92.4Very high82 Ų8245.4 Ų45.432%0.32223%0.23SC..Hα-helixtrans-65.9-20.3-179.8-57.1-65000112.8L200 P201 V204 L238 G239 R243 S244 L245L200-Y241 HydrophobicContact CD2-CD2 3.88Å; L200-Y241 HydrophobicContact CD2-CE2 4.26Å; L200-Y241 HydrophobicContact CG-CD2 4.21Å; P201-Y241 HydrophobicContact CB-CE1 4.44Å; V204-Y241 HydrophobicContact CB-CD1 4.38Å; V204-Y241 HydrophobicContact CG1-CD1 3.99Å; V204-Y241 HydrophobicContact CG1-CG 4.47Å; V204-Y241 HydrophobicContact CG2-CD1 4.35Å; V204-Y241 HydrophobicContact CG2-CG 4.21Å; L238-Y241 WeakPolarHBondContact O-CA 3.27Å; L238-Y241 VanDerWaalsContact O-CB 3.27Å; L238-Y241 WeakPolarHBondContact O-CB 3.48Å; L238-Y241 VanDerWaalsContact O-CD2 3.3Å; L238-Y241 WeakPolarHBondContact O-CD2 3.3Å; L238-Y241 PolarHBondContact O-N 3.39Å; G239-Y241 VanDerWaalsContact C-N 3.32Å; G239-Y241 PolarHBondContact O-N 3.44Å; Y241-R243 PolarHBondContact O-N 2.98Å; Y241-S244 PolarHBondContact O-N 2.95Å; Y241-L245 WeakPolarHBondContact O-CG 3.36Å; Y241-L245 PolarHBondContact O-N 3.27Å
242V91.8Very high92.4Very high0 Ų045 Ų450%023%0.227CC..Hα-helixtrans-51.7-41.2174.2177.60000111.3L238 G239 S240 S244 L245 V246 I281 H285 L288 V289 L292L238-V242 HydrophobicContact CB-CG2 3.55Å; L238-V242 HydrophobicContact CD1-CG2 4.32Å; G239-V242 VanDerWaalsContact O-CG2 3.32Å; G239-V242 WeakPolarHBondContact O-CG2 3.37Å; G239-V242 PolarHBondContact O-N 3.37Å; S240-V242 PolarHBondContact O-N 3.1Å; V242-S244 PolarHBondContact O-N 3.47Å; V242-L245 PolarHBondContact O-N 3.27Å; V242-V246 HydrophobicContact CG1-CG2 4.27Å; V242-V246 WeakPolarHBondContact O-CB 3.19Å; V242-V246 VanDerWaalsContact O-CG2 3.29Å; V242-V246 WeakPolarHBondContact O-CG2 3.28Å; V242-V246 PolarHBondContact O-N 3.14Å; V242-I281 HydrophobicContact CG1-CG2 4.07Å; V242-H285 HydrophobicContact CG1-CB 4.39Å; V242-H285 HydrophobicContact CG2-CB 3.94Å; V242-L288 HydrophobicContact CG2-CD1 4.25Å; V242-V289 HydrophobicContact CB-CG2 4.01Å; V242-V289 HydrophobicContact CG1-CG2 4.25Å; V242-L292 HydrophobicContact CG1-CD2 4.03Å
243R90.6Very high92.5Very high119 Ų11941.7 Ų41.745%0.44921%0.212SC..Hα-helixtrans-65.8-35.7178.6-171.9-178.6-72.3116.3-6.8112.7S240 Y241 S247 V289S240-R243 PolarHBondContact O-N 2.95Å; Y241-R243 PolarHBondContact O-N 2.98Å; R243-S247 VanDerWaalsContact O-CB 3.32Å; R243-S247 WeakPolarHBondContact O-CB 3.21Å; R243-S247 PolarHBondContact O-N 2.96Å; R243-V289 VanDerWaalsContact NH2-CG1 3.32Å
244S92.3Very high92.5Very high35 Ų3542 Ų4225%0.24521%0.214CC..Hα-helixtrans-72.7-41.9177160.70000111.6V204 S208 Y241 V242 S247 S248V204-S244 WeakPolarHBondContact CG1-OG 3.33Å; S208-S244 PolarHBondContact OG-OG 3.2Å; Y241-S244 PolarHBondContact O-N 2.95Å; V242-S244 PolarHBondContact O-N 3.47Å; S244-S247 PolarHBondContact O-N 3.19Å; S244-S248 PolarHBondContact O-N 3.27Å; S244-S248 PolarHBondContact O-OG 3.31Å
245L95.1Very high92.5Very high0 Ų040.2 Ų40.20%020%0.196CC..Hα-helixtrans-62.1-47.7173.4-65.4176.2000111.3V204 I207 V227 V231 L238 Y241 V242 S247 S248 V249V204-L245 HydrophobicContact CG2-CD2 4.11Å; V204-L245 HydrophobicContact CG2-CG 4.44Å; I207-L245 HydrophobicContact CB-CD2 4.44Å; I207-L245 HydrophobicContact CD1-CD2 3.96Å; I207-L245 HydrophobicContact CG2-CD2 3.85Å; V227-L245 HydrophobicContact CG2-CD2 4.31Å; V231-L245 HydrophobicContact CG2-CD1 4.3Å; L238-L245 HydrophobicContact CD1-CD1 4.02Å; L238-L245 HydrophobicContact CD2-CD1 4.24Å; Y241-L245 WeakPolarHBondContact O-CG 3.36Å; Y241-L245 PolarHBondContact O-N 3.27Å; V242-L245 PolarHBondContact O-N 3.27Å; L245-S247 VanDerWaalsContact C-N 3.35Å; L245-S247 PolarHBondContact O-N 3.41Å; L245-S248 PolarHBondContact O-N 2.78Å; L245-V249 WeakPolarHBondContact O-CG2 3.39Å; L245-V249 PolarHBondContact O-N 2.96Å
246V95.6Very high92.4Very high9 Ų936.6 Ų36.66%0.05519%0.19CC..Hα-helixtrans-59.6-43.3175.1167.10000111.3V242 S248 V249 M250 L278 I281 L292 I296V242-V246 HydrophobicContact CG1-CG2 4.27Å; V242-V246 WeakPolarHBondContact O-CB 3.19Å; V242-V246 VanDerWaalsContact O-CG2 3.29Å; V242-V246 WeakPolarHBondContact O-CG2 3.28Å; V242-V246 PolarHBondContact O-N 3.14Å; V246-S248 VanDerWaalsContact C-N 3.3Å; V246-S248 PolarHBondContact O-N 3.18Å; V246-V249 PolarHBondContact O-N 2.82Å; V246-M250 HydrophobicContact CG1-CG 4Å; V246-M250 VanDerWaalsContact O-CB 3.25Å; V246-M250 WeakPolarHBondContact O-CB 3.39Å; V246-M250 WeakPolarHBondContact O-CG 3.33Å; V246-M250 PolarHBondContact O-N 3Å; V246-L278 HydrophobicContact CG1-CD1 3.85Å; V246-L278 HydrophobicContact CG2-CD1 4.36Å; V246-I281 HydrophobicContact CG2-CG2 3.74Å; V246-L292 HydrophobicContact CG1-CD1 4.24Å; V246-L292 HydrophobicContact CG2-CD1 4.42Å; V246-L292 HydrophobicContact CG2-CD2 4.44Å; V246-I296 HydrophobicContact CG1-CD1 4.04Å; V246-I296 HydrophobicContact CG1-CG1 4.01Å
247S94.8Very high92.3Very high79 Ų7935.8 Ų35.855%0.55219%0.186SC*.Hα-helixtrans-59.1-41.2176-171.30000112.3R243 S244 L245 M250 Y251R243-S247 VanDerWaalsContact O-CB 3.32Å; R243-S247 WeakPolarHBondContact O-CB 3.21Å; R243-S247 PolarHBondContact O-N 2.96Å; S244-S247 PolarHBondContact O-N 3.19Å; L245-S247 VanDerWaalsContact C-N 3.35Å; L245-S247 PolarHBondContact O-N 3.41Å; S247-M250 PolarHBondContact O-N 3.03Å; S247-Y251 WeakPolarHBondContact O-CB 3.44Å; S247-Y251 PolarHBondContact O-N 3.39Å
248S95.8Very high92.2Very high8 Ų832 Ų326%0.05618%0.181CC..Hα-helixtrans-69.7-39.8179.5-51.10000112.2I207 S244 L245 V246 Y251 C252I207-S248 PolarHBondContact O-OG 2.89Å; S244-S248 PolarHBondContact O-N 3.27Å; S244-S248 PolarHBondContact O-OG 3.31Å; L245-S248 PolarHBondContact O-N 2.78Å; V246-S248 VanDerWaalsContact C-N 3.3Å; V246-S248 PolarHBondContact O-N 3.18Å; S248-Y251 WeakPolarHBondContact O-CB 3.34Å; S248-Y251 PolarHBondContact O-N 3.09Å; S248-C252 PolarHBondContact O-N 3.25Å; S248-C252 PolarHBondContact O-SG 3.36Å
249V97.5Very high92.1Very high0 Ų032.1 Ų32.10%018%0.181CC..Hα-helixtrans-68.9-42.4174.1176.10000111L224 V227 L245 V246 Y251 C252 I253 A274 L277 L278 I281L224-V249 HydrophobicContact CD2-CB 4.48Å; L224-V249 HydrophobicContact CD2-CG1 4.47Å; L224-V249 HydrophobicContact CD2-CG2 3.96Å; V227-V249 HydrophobicContact CG1-CG2 4.03Å; V227-V249 HydrophobicContact CG2-CG2 4.5Å; L245-V249 WeakPolarHBondContact O-CG2 3.39Å; L245-V249 PolarHBondContact O-N 2.96Å; V246-V249 PolarHBondContact O-N 2.82Å; V249-Y251 VanDerWaalsContact C-N 3.3Å; V249-Y251 PolarHBondContact O-N 2.79Å; V249-C252 WeakPolarHBondContact O-CB 3.42Å; V249-C252 PolarHBondContact O-N 3.27Å; V249-C252 VanDerWaalsContact O-N 3.15Å; V249-I253 HydrophobicContact CG1-CD1 3.93Å; V249-I253 HydrophobicContact CG1-CG1 4.49Å; V249-I253 WeakPolarHBondContact O-CG1 3.12Å; V249-I253 PolarHBondContact O-N 3.42Å; V249-A274 HydrophobicContact CG1-CB 4.15Å; V249-A274 WeakPolarHBondContact CG1-O 3.19Å; V249-L277 HydrophobicContact CG2-CD2 4.23Å; V249-L277 HydrophobicContact CG2-CG 4.47Å; V249-L278 HydrophobicContact CG1-CB 3.93Å; V249-I281 HydrophobicContact CG2-CD1 4.05Å
250M96.1Very high92.1Very high17 Ų1732.8 Ų32.88%0.08419%0.185CC..Hα-helixtrans-63-33.8176-74.3-71.5-77.600112.5V246 S247 I253 L254 L278 I296 L300V246-M250 HydrophobicContact CG1-CG 4Å; V246-M250 VanDerWaalsContact O-CB 3.25Å; V246-M250 WeakPolarHBondContact O-CB 3.39Å; V246-M250 WeakPolarHBondContact O-CG 3.33Å; V246-M250 PolarHBondContact O-N 3Å; S247-M250 PolarHBondContact O-N 3.03Å; M250-I253 PolarHBondContact O-N 2.93Å; M250-I253 HydrophobicContact SD-CD1 4.25Å; M250-L254 HydrophobicContact CE-CD1 3.63Å; M250-L254 HydrophobicContact CE-CG 4.49Å; M250-L254 WeakPolarHBondContact O-CB 3.38Å; M250-L254 PolarHBondContact O-N 3.44Å; M250-L278 HydrophobicContact CG-CD1 4.06Å; M250-L278 HydrophobicContact SD-CD1 4.04Å; M250-L278 HydrophobicContact SD-CD2 3.51Å; M250-L278 VanDerWaalsContact SD-CD2 3.51Å; M250-L278 HydrophobicContact SD-CG 4.42Å; M250-I296 HydrophobicContact CE-CG2 4.21Å; M250-I296 HydrophobicContact SD-CG2 4.26Å; M250-L300 HydrophobicContact CE-CD2 4.02Å; M250-L300 HydrophobicContact CE-CG 4.15Å; M250-L300 HydrophobicContact SD-CD2 4.4Å
251Y96.1Very high92.3Very high35 Ų3535.3 Ų35.314%0.13719%0.19CC..Hα-helixtrans-59.3-48171.2179.4-100000111.3V210 K211 S214 S247 S248 V249 I253 E255 L257V210-Y251 HydrophobicContact CB-CD1 3.96Å; V210-Y251 HydrophobicContact CB-CE1 4.4Å; V210-Y251 HydrophobicContact CG2-CD1 3.65Å; V210-Y251 HydrophobicContact CG2-CE1 4.39Å; V210-Y251 HydrophobicContact CG2-CG 4.21Å; K211-Y251 HydrophobicContact CD-CE2 4.31Å; K211-Y251 HydrophobicContact CG-CD1 4.44Å; K211-Y251 HydrophobicContact CG-CD2 4.15Å; K211-Y251 HydrophobicContact CG-CE1 4.13Å; K211-Y251 HydrophobicContact CG-CE2 3.85Å; K211-Y251 HydrophobicContact CG-CG 4.46Å; S214-Y251 WeakPolarHBondContact CB-OH 3.27Å; S247-Y251 WeakPolarHBondContact O-CB 3.44Å; S247-Y251 PolarHBondContact O-N 3.39Å; S248-Y251 WeakPolarHBondContact O-CB 3.34Å; S248-Y251 PolarHBondContact O-N 3.09Å; V249-Y251 VanDerWaalsContact C-N 3.3Å; V249-Y251 PolarHBondContact O-N 2.79Å; Y251-I253 VanDerWaalsContact C-N 3.31Å; Y251-I253 PolarHBondContact O-N 3.02Å; Y251-E255 HydrophobicContact CD2-CB 3.84Å; Y251-E255 HydrophobicContact CD2-CG 3.61Å; Y251-E255 HydrophobicContact CE2-CB 3.72Å; Y251-E255 HydrophobicContact CE2-CG 3.82Å; Y251-E255 PolarHBondContact O-N 3.41Å; Y251-E255 VanDerWaalsContact O-N 3.08Å; Y251-L257 HydrophobicContact CD1-CD2 4.41Å; Y251-L257 HydrophobicContact CE1-CD2 3.87Å
252C96.1Very high92.1Very high0 Ų034.5 Ų34.50%019%0.191CC..Hα-helixtrans-63.4-32.9175.5-61.20000113.3L224 S248 V249 L270 R271 A274L224-C252 HydrophobicContact CD1-CB 4.3Å; L224-C252 HydrophobicContact CD2-CB 4.33Å; S248-C252 PolarHBondContact O-N 3.25Å; S248-C252 PolarHBondContact O-SG 3.36Å; V249-C252 WeakPolarHBondContact O-CB 3.42Å; V249-C252 PolarHBondContact O-N 3.27Å; V249-C252 VanDerWaalsContact O-N 3.15Å; C252-L270 HydrophobicContact CB-CD2 4.19Å; C252-R271 PolarHBondContact O-NH1 3.23Å; C252-A274 HydrophobicContact CB-CB 4.2Å
253I96.6Very high91.7Very high0 Ų038.7 Ų38.70%022%0.219CC..Hα-helixtrans-74.2-47.5177.8-65.4165.8000111.6V249 M250 Y251 R271 A274 A275 L278 G316V249-I253 HydrophobicContact CG1-CD1 3.93Å; V249-I253 HydrophobicContact CG1-CG1 4.49Å; V249-I253 WeakPolarHBondContact O-CG1 3.12Å; V249-I253 PolarHBondContact O-N 3.42Å; M250-I253 PolarHBondContact O-N 2.93Å; M250-I253 HydrophobicContact SD-CD1 4.25Å; Y251-I253 VanDerWaalsContact C-N 3.31Å; Y251-I253 PolarHBondContact O-N 3.02Å; I253-R271 PolarHBondContact O-NH1 3.46Å; I253-A274 HydrophobicContact CD1-CB 4.28Å; I253-A274 HydrophobicContact CG1-CB 3.55Å; I253-A275 HydrophobicContact CD1-CB 4.35Å; I253-L278 HydrophobicContact CD1-CB 3.86Å; I253-L278 HydrophobicContact CD1-CD2 3.7Å; I253-L278 HydrophobicContact CD1-CG 4.33Å; I253-G316 WeakPolarHBondContact CG2-O 3.47Å; I253-G316 WeakPolarHBondContact O-CA 3.31Å
254L95.4Very high91.4Very high11 Ų1140.4 Ų40.46%0.05824%0.236CC..Hα-helixtrans-104.4-29.9-162.8-70.7-178.3000115.7M250 L300 V303 S313 A317M250-L254 HydrophobicContact CE-CD1 3.63Å; M250-L254 HydrophobicContact CE-CG 4.49Å; M250-L254 WeakPolarHBondContact O-CB 3.38Å; M250-L254 PolarHBondContact O-N 3.44Å; L254-L300 HydrophobicContact CD1-CD2 4.31Å; L254-L300 HydrophobicContact CD2-CD2 4.07Å; L254-L300 HydrophobicContact CG-CD2 4.45Å; L254-V303 HydrophobicContact CD1-CG2 4.11Å; L254-V303 HydrophobicContact CD2-CB 4.24Å; L254-V303 HydrophobicContact CD2-CG1 4.28Å; L254-V303 HydrophobicContact CD2-CG2 4.08Å; L254-V303 HydrophobicContact CG-CG2 4.48Å; L254-S313 WeakPolarHBondContact O-CA 3.42Å; L254-S313 WeakPolarHBondContact O-CB 3.34Å; L254-S313 PolarHBondContact O-OG 2.81Å; L254-A317 HydrophobicContact CD2-CB 3.76Å
255E93.5Very high91.3Very high68 Ų6841 Ų4132%0.31824%0.236SC..SBendtrans-86.3154.5-169.7-68-67.7114.300112.1Y251 L257 R271 R309Y251-E255 HydrophobicContact CD2-CB 3.84Å; Y251-E255 HydrophobicContact CD2-CG 3.61Å; Y251-E255 HydrophobicContact CE2-CB 3.72Å; Y251-E255 HydrophobicContact CE2-CG 3.82Å; Y251-E255 PolarHBondContact O-N 3.41Å; Y251-E255 VanDerWaalsContact O-N 3.08Å; E255-L257 PolarHBondContact O-N 2.9Å; E255-L257 VanDerWaalsContact O-N 3.07Å; E255-R271 PolarHBondContact O-NH1 3.41Å; E255-R271 PolarHBondContact O-NH2 2.86Å; E255-R309 IonicContact OE1-CZ 3.76Å; E255-R309 IonicContact OE1-NH1 2.87Å; E255-R309 PolarHBondContact OE1-NH1 2.95Å
256P89.8Confident91.1Very high66 Ų6644.2 Ų44.243%0.42925%0.254SS..  trans-73.396.5171.829.1-32.5000109.6P310P256-P310 HydrophobicContact CB-CG 3.94Å; P256-P310 HydrophobicContact CG-CG 4.49Å
257L89.8Confident90.9Very high1 Ų144.2 Ų44.21%0.00525%0.253CS..  trans-65.4138.6175.4-57.9172.4000109.1L220 Y251 E255 A259 S260 L270L220-L257 HydrophobicContact CD1-CD1 3.83Å; L220-L257 HydrophobicContact CD1-CD2 3.96Å; L220-L257 HydrophobicContact CD1-CG 4.38Å; Y251-L257 HydrophobicContact CD1-CD2 4.41Å; Y251-L257 HydrophobicContact CE1-CD2 3.87Å; E255-L257 PolarHBondContact O-N 2.9Å; E255-L257 VanDerWaalsContact O-N 3.07Å; L257-A259 HydrophobicContact CB-CB 4.44Å; L257-A259 PolarHBondContact O-N 3.48Å; L257-S260 PolarHBondContact N-OG 3.26Å; L257-S260 WeakPolarHBondContact O-CB 3.32Å; L257-S260 PolarHBondContact O-N 3.42Å; L257-S260 PolarHBondContact O-OG 3.18Å; L257-L270 HydrophobicContact CD1-CD2 3.75Å
258A86Confident90.9Very high46 Ų4641.3 Ų41.338%0.3823%0.23SC..G310 helixtrans-58.5-31.8173.500000111.4S214 H215 S260 I261S214-A258 PolarHBondContact O-N 2.93Å; H215-A258 HydrophobicContact CB-CB 4.13Å; A258-S260 PolarHBondContact O-N 3.2Å; A258-I261 WeakPolarHBondContact O-CB 3.3Å; A258-I261 WeakPolarHBondContact O-CG1 3.3Å; A258-I261 PolarHBondContact O-N 3.3Å
259A84.7Confident90.8Very high3 Ų343.5 Ų43.53%0.02524%0.243CC..G310 helixtrans-57.1-28.2170.500000113.9S214 L217 L257 I261 N265S214-A259 PolarHBondContact O-N 3.49Å; L217-A259 HydrophobicContact CB-CB 4.3Å; L257-A259 HydrophobicContact CB-CB 4.44Å; L257-A259 PolarHBondContact O-N 3.48Å; A259-I261 VanDerWaalsContact C-N 3.3Å; A259-I261 PolarHBondContact O-N 3.35Å; A259-N265 VanDerWaalsContact O-CB 3.29Å; A259-N265 WeakPolarHBondContact O-CB 3.39Å; A259-N265 PolarHBondContact O-ND2 3.41Å
260S85.5Confident90.8Very high23 Ų2343.8 Ų43.816%0.16124%0.244CC..G310 helixtrans-80.3-3.9-179.864.50000114.9L257 A258 N262 H267L257-S260 PolarHBondContact N-OG 3.26Å; L257-S260 WeakPolarHBondContact O-CB 3.32Å; L257-S260 PolarHBondContact O-N 3.42Å; L257-S260 PolarHBondContact O-OG 3.18Å; A258-S260 PolarHBondContact O-N 3.2Å; S260-N262 VanDerWaalsContact C-N 3.31Å; S260-H267 VanDerWaalsContact CB-CG 3.49Å
261I85.1Confident90.8Very high139 Ų13943 Ų4371%0.71324%0.24SC*.G310 helixtrans-73.4-25.7174.5-59172.2000111.2A258 A259 P263A258-I261 WeakPolarHBondContact O-CB 3.3Å; A258-I261 WeakPolarHBondContact O-CG1 3.3Å; A258-I261 PolarHBondContact O-N 3.3Å; A259-I261 VanDerWaalsContact C-N 3.3Å; A259-I261 PolarHBondContact O-N 3.35Å; I261-P263 WeakPolarHBondContact O-CD 3.49Å
262N86.1Confident90.8Very high65 Ų6543.2 Ų43.235%0.34824%0.244SC..SBendtrans-90.1116.6176.617813.9000110.6S260 L264 N265S260-N262 VanDerWaalsContact C-N 3.31Å; N262-L264 PolarHBondContact O-N 3.12Å; N262-L264 VanDerWaalsContact O-N 3.11Å; N262-L264 WeakPolarHBondContact OD1-CB 3.41Å; N262-L264 PolarHBondContact OD1-N 3.36Å; N262-L264 VanDerWaalsContact OD1-N 3.13Å; N262-N265 HydrophobicContact CB-CB 4.42Å; N262-N265 PolarHBondContact ND2-OD1 2.98Å; N262-N265 VanDerWaalsContact ND2-OD1 3.12Å; N262-N265 WeakPolarHBondContact O-CB 3.49Å; N262-N265 PolarHBondContact O-N 3.45Å
263P82.6Confident90.9Very high89 Ų8945.4 Ų45.458%0.57825%0.253SS*.THydrogen-bonded Turntrans-62-19179-24.535.6000114.9I261 N265I261-P263 WeakPolarHBondContact O-CD 3.49Å; P263-N265 VanDerWaalsContact C-N 3.3Å
264L85.1Confident91Very high155 Ų15545.4 Ų45.481%0.81225%0.253SS*.THydrogen-bonded Turntrans-76-17176.1-57.2176.4000113.1N262 D266N262-L264 PolarHBondContact O-N 3.12Å; N262-L264 VanDerWaalsContact O-N 3.11Å; N262-L264 WeakPolarHBondContact OD1-CB 3.41Å; N262-L264 PolarHBondContact OD1-N 3.36Å; N262-L264 VanDerWaalsContact OD1-N 3.13Å; L264-D266 PolarHBondContact O-N 3.12Å
265N89.6Confident91.1Very high48 Ų4844.9 Ų44.926%0.25725%0.25SC..SBendtrans-86.3111.8-179.4-71.6-5.4000110.2L217 A259 N262 P263 H267L217-N265 HydrophobicContact CD2-CB 4.38Å; A259-N265 VanDerWaalsContact O-CB 3.29Å; A259-N265 WeakPolarHBondContact O-CB 3.39Å; A259-N265 PolarHBondContact O-ND2 3.41Å; N262-N265 HydrophobicContact CB-CB 4.42Å; N262-N265 PolarHBondContact ND2-OD1 2.98Å; N262-N265 VanDerWaalsContact ND2-OD1 3.12Å; N262-N265 WeakPolarHBondContact O-CB 3.49Å; N262-N265 PolarHBondContact O-N 3.45Å; P263-N265 VanDerWaalsContact C-N 3.3Å; N265-H267 PolarHBondContact O-N 3.31Å; N265-H267 PolarHBondContact O-ND1 3.39Å
266D90.7Very high91.2Very high67 Ų6747.1 Ų47.136%0.35826%0.263SS..  trans-73.368.6175.5-176.236000112.6L264 W268 T269L264-D266 PolarHBondContact O-N 3.12Å; D266-W268 PolarHBondContact O-N 2.86Å; D266-W268 WeakPolarHBondContact OD1-CB 3.16Å; D266-W268 VanDerWaalsContact OD1-CD1 3.29Å; D266-T269 PolarHBondContact O-OG1 3.42Å; D266-T269 WeakPolarHBondContact OD2-CB 3.31Å; D266-T269 WeakPolarHBondContact OD2-CG2 3.41Å; D266-T269 PolarHBondContact OD2-OG1 3.44Å
267H92.2Very high91.6Very high8 Ų844.2 Ų44.24%0.03724%0.244CC..Hα-helixtrans-72.3-4.1175.467.2-88.1000113.1L217 S260 N265 R271 C312L217-H267 HydrophobicContact CD1-CB 3.98Å; S260-H267 VanDerWaalsContact CB-CG 3.49Å; N265-H267 PolarHBondContact O-N 3.31Å; N265-H267 PolarHBondContact O-ND1 3.39Å; H267-R271 WeakPolarHBondContact O-CG 3.22Å; H267-R271 PolarHBondContact O-N 2.87Å; H267-C312 WeakPolarHBondContact NE2-CB 3.41Å
268W94.2Very high92Very high19 Ų1944.2 Ų44.27%0.07224%0.244CC..Hα-helixtrans-73-49.1178.5-52.496.1000111D266 L270 R271 D272 C312 Y315 D361 K364D266-W268 PolarHBondContact O-N 2.86Å; D266-W268 WeakPolarHBondContact OD1-CB 3.16Å; D266-W268 VanDerWaalsContact OD1-CD1 3.29Å; W268-L270 VanDerWaalsContact C-N 3.26Å; W268-L270 PolarHBondContact O-N 3.49Å; W268-R271 PolarHBondContact O-N 3.05Å; W268-D272 PolarHBondContact O-N 2.93Å; W268-C312 HydrophobicContact CH2-CB 4.12Å; W268-C312 HydrophobicContact CZ3-CB 4.29Å; W268-Y315 AromaticContact CE3-CD1 3.67Å; W268-Y315 HydrophobicContact CE3-CD1 3.67Å; W268-Y315 AromaticContact CE3-CD2 3.82Å; W268-Y315 HydrophobicContact CE3-CD2 3.82Å; W268-Y315 AromaticContact CE3-CE1 3.93Å; W268-Y315 HydrophobicContact CE3-CE1 3.93Å; W268-Y315 HydrophobicContact CE3-CE2 4.05Å; W268-Y315 AromaticContact CE3-CG 3.63Å; W268-Y315 HydrophobicContact CE3-CG 3.63Å; W268-Y315 HydrophobicContact CZ3-CD1 4.07Å; W268-Y315 AromaticContact CZ3-CD2 3.85Å; W268-Y315 HydrophobicContact CZ3-CD2 3.85Å; W268-Y315 HydrophobicContact CZ3-CE2 4.5Å; W268-Y315 AromaticContact CZ3-CG 3.6Å; W268-Y315 HydrophobicContact CZ3-CG 3.6Å; W268-D361 HydrophobicContact CH2-CB 3.99Å; W268-D361 HydrophobicContact CZ2-CB 4.26Å; W268-D361 WeakPolarHBondContact CZ2-OD1 3.35Å; W268-K364 HydrophobicContact CD2-CD 4.02Å; W268-K364 HydrophobicContact CD2-CG 4.26Å; W268-K364 HydrophobicContact CE3-CB 4.1Å; W268-K364 HydrophobicContact CE3-CD 4.28Å; W268-K364 HydrophobicContact CE3-CG 4.29Å; W268-K364 HydrophobicContact CG-CD 4.31Å; W268-K364 HydrophobicContact CH2-CB 4.02Å; W268-K364 HydrophobicContact CH2-CG 4.16Å; W268-K364 HydrophobicContact CZ2-CB 4.48Å; W268-K364 HydrophobicContact CZ2-CG 4.11Å; W268-K364 HydrophobicContact CZ3-CB 3.81Å; W268-K364 HydrophobicContact CZ3-CG 4.24Å
269T95.3Very high92.4Very high54 Ų5442.8 Ų42.833%0.33123%0.231SC..Hα-helixtrans-63.8-30.2177.449.70000112.8D266 D272 Y273 L644D266-T269 PolarHBondContact O-OG1 3.42Å; D266-T269 WeakPolarHBondContact OD2-CB 3.31Å; D266-T269 WeakPolarHBondContact OD2-CG2 3.41Å; D266-T269 PolarHBondContact OD2-OG1 3.44Å; T269-D272 PolarHBondContact O-N 2.84Å; T269-Y273 WeakPolarHBondContact O-CB 3.26Å; T269-Y273 PolarHBondContact O-N 2.94Å; T269-L644 HydrophobicContact CG2-CD1 3.8Å
270L95.6Very high92.9Very high6 Ų645.6 Ų45.63%0.03124%0.244CC..Hα-helixtrans-64.4-43.5170-176.4120.7000112L217 L220 N221 L224 C252 L257 W268 Y273 A274L217-L270 HydrophobicContact CD1-CB 3.98Å; L217-L270 HydrophobicContact CD1-CD1 3.92Å; L217-L270 HydrophobicContact CD1-CD2 4.25Å; L217-L270 HydrophobicContact CD1-CG 4.25Å; L220-L270 HydrophobicContact CB-CD1 3.81Å; N221-L270 HydrophobicContact CB-CD1 3.92Å; L224-L270 HydrophobicContact CD1-CD1 3.92Å; L224-L270 HydrophobicContact CD1-CD2 4.4Å; L224-L270 HydrophobicContact CD1-CG 3.86Å; C252-L270 HydrophobicContact CB-CD2 4.19Å; L257-L270 HydrophobicContact CD1-CD2 3.75Å; W268-L270 VanDerWaalsContact C-N 3.26Å; W268-L270 PolarHBondContact O-N 3.49Å; L270-Y273 PolarHBondContact O-N 2.96Å; L270-A274 WeakPolarHBondContact O-CB 3.31Å; L270-A274 PolarHBondContact O-N 3.3Å
271R96.6Very high93.4Very high0 Ų044.5 Ų44.50%024%0.236CC..Hα-helixtrans-64.6-39.6175.1-69-176.7-162.1-83.50.1111.4C252 I253 E255 H267 W268 A274 A275 C312 Y315C252-R271 PolarHBondContact O-NH1 3.23Å; I253-R271 PolarHBondContact O-NH1 3.46Å; E255-R271 PolarHBondContact O-NH1 3.41Å; E255-R271 PolarHBondContact O-NH2 2.86Å; H267-R271 WeakPolarHBondContact O-CG 3.22Å; H267-R271 PolarHBondContact O-N 2.87Å; W268-R271 PolarHBondContact O-N 3.05Å; R271-A274 PolarHBondContact O-N 3.04Å; R271-A275 WeakPolarHBondContact O-CB 3.21Å; R271-A275 PolarHBondContact O-N 2.97Å; R271-C312 VanDerWaalsContact CD-O 3.29Å; R271-C312 WeakPolarHBondContact CD-O 3.41Å; R271-C312 PolarHBondContact NE-O 2.87Å; R271-C312 PolarHBondContact NH2-SG 3.17Å; R271-C312 VanDerWaalsContact NH2-SG 3.41Å; R271-Y315 HydrophobicContact CB-CD1 4.37Å; R271-Y315 HydrophobicContact CB-CE1 4.37Å
272D96.7Very high93.8Very high40 Ų4038.7 Ų38.721%0.21421%0.206CC..Hα-helixtrans-62.7-49.3175.6-66.8-14.8000112W268 T269 A274 A275 L276 Y315W268-D272 PolarHBondContact O-N 2.93Å; T269-D272 PolarHBondContact O-N 2.84Å; D272-A274 PolarHBondContact O-N 3.31Å; D272-A275 PolarHBondContact O-N 2.82Å; D272-L276 WeakPolarHBondContact O-CG 3.23Å; D272-L276 PolarHBondContact O-N 2.85Å; D272-Y315 VanDerWaalsContact OD1-CE1 3.26Å; D272-Y315 WeakPolarHBondContact OD1-CE1 3.48Å; D272-Y315 PolarHBondContact OD1-OH 2.81Å; D272-Y315 PolarHBondContact OD2-OH 2.96Å
273Y97.8Very high94.1Very high46 Ų4639.9 Ų39.918%0.1821%0.205CC..Hα-helixtrans-63.4-41177.5176-120.6000111.8L224 H225 K228 T269 L270 L276 L277L224-Y273 HydrophobicContact CB-CD1 4.02Å; L224-Y273 HydrophobicContact CB-CE1 3.59Å; L224-Y273 HydrophobicContact CD1-CD1 4.21Å; L224-Y273 PolarHBondContact O-OH 3.32Å; H225-Y273 AromaticContact CE1-CE1 3.67Å; H225-Y273 AromaticContact CE1-CZ 3.66Å; H225-Y273 AromaticContact ND1-CE1 3.57Å; H225-Y273 AromaticContact ND1-CZ 3.4Å; H225-Y273 PolarHBondContact ND1-OH 2.92Å; K228-Y273 HydrophobicContact CD-CE2 4.35Å; K228-Y273 WeakPolarHBondContact CD-OH 3.46Å; T269-Y273 WeakPolarHBondContact O-CB 3.26Å; T269-Y273 PolarHBondContact O-N 2.94Å; L270-Y273 PolarHBondContact O-N 2.96Å; Y273-L276 PolarHBondContact O-N 3.23Å; Y273-L277 VanDerWaalsContact O-CB 3.31Å; Y273-L277 WeakPolarHBondContact O-CB 3.46Å; Y273-L277 PolarHBondContact O-N 3.43Å
274A97.9Very high94.5Very high0 Ų039 Ų390%020%0.199CC..Hα-helixtrans-63.4-41.4175.300000112.1L224 V249 C252 I253 L270 R271 D272 L277 L278L224-A274 HydrophobicContact CD1-CB 3.92Å; L224-A274 HydrophobicContact CD2-CB 4.22Å; V249-A274 HydrophobicContact CG1-CB 4.15Å; V249-A274 WeakPolarHBondContact CG1-O 3.19Å; C252-A274 HydrophobicContact CB-CB 4.2Å; I253-A274 HydrophobicContact CD1-CB 4.28Å; I253-A274 HydrophobicContact CG1-CB 3.55Å; L270-A274 WeakPolarHBondContact O-CB 3.31Å; L270-A274 PolarHBondContact O-N 3.3Å; R271-A274 PolarHBondContact O-N 3.04Å; D272-A274 PolarHBondContact O-N 3.31Å; A274-L277 PolarHBondContact O-N 2.95Å; A274-L278 WeakPolarHBondContact O-CB 3.45Å; A274-L278 PolarHBondContact O-N 3.04Å
275A97.8Very high94.6Very high0 Ų033.2 Ų33.20%017%0.167CC..Hα-helixtrans-65.2-41.5176.600000112.7I253 R271 D272 L277 L278 S279 V319 A323I253-A275 HydrophobicContact CD1-CB 4.35Å; R271-A275 WeakPolarHBondContact O-CB 3.21Å; R271-A275 PolarHBondContact O-N 2.97Å; D272-A275 PolarHBondContact O-N 2.82Å; A275-L277 VanDerWaalsContact C-N 3.32Å; A275-L277 PolarHBondContact O-N 3.29Å; A275-L278 PolarHBondContact O-N 3.4Å; A275-S279 PolarHBondContact O-N 3.29Å; A275-V319 HydrophobicContact CB-CB 4.43Å; A275-V319 HydrophobicContact CB-CG1 3.79Å; A275-A323 HydrophobicContact CB-CB 4.06Å; A275-A323 WeakPolarHBondContact O-CB 3.4Å
276L97.3Very high94.4Very high114 Ų11431.3 Ų31.360%0.59716%0.159SC*.Hα-helixtrans-64-37.9172.6-69.2173.1000111.8D272 Y273 S279 H280D272-L276 WeakPolarHBondContact O-CG 3.23Å; D272-L276 PolarHBondContact O-N 2.85Å; Y273-L276 PolarHBondContact O-N 3.23Å; L276-S279 PolarHBondContact O-N 3.35Å; L276-H280 WeakPolarHBondContact O-CB 3.43Å; L276-H280 PolarHBondContact O-N 3.22Å
277L97.7Very high94.1Very high6 Ų635.4 Ų35.43%0.03118%0.181CC..Hα-helixtrans-69.5-39.4176.1-178.257.6000112.5L224 V227 K228 V249 Y273 A274 A275 H280 I281L224-L277 HydrophobicContact CB-CD2 4.19Å; L224-L277 HydrophobicContact CD2-CD2 4.15Å; L224-L277 VanDerWaalsContact O-CD2 3.22Å; L224-L277 WeakPolarHBondContact O-CD2 3.42Å; V227-L277 HydrophobicContact CB-CD2 4.02Å; V227-L277 HydrophobicContact CG1-CD1 4.41Å; V227-L277 HydrophobicContact CG1-CD2 3.84Å; V227-L277 HydrophobicContact CG1-CG 4.27Å; K228-L277 HydrophobicContact CB-CD1 3.86Å; K228-L277 HydrophobicContact CG-CD1 4.34Å; V249-L277 HydrophobicContact CG2-CD2 4.23Å; V249-L277 HydrophobicContact CG2-CG 4.47Å; Y273-L277 VanDerWaalsContact O-CB 3.31Å; Y273-L277 WeakPolarHBondContact O-CB 3.46Å; Y273-L277 PolarHBondContact O-N 3.43Å; A274-L277 PolarHBondContact O-N 2.95Å; A275-L277 VanDerWaalsContact C-N 3.32Å; A275-L277 PolarHBondContact O-N 3.29Å; L277-H280 WeakPolarHBondContact O-CB 3.35Å; L277-H280 PolarHBondContact O-N 3.37Å; L277-I281 HydrophobicContact CD1-CD1 4.34Å; L277-I281 HydrophobicContact CD1-CG1 4.42Å; L277-I281 HydrophobicContact CG-CD1 4.1Å; L277-I281 VanDerWaalsContact O-CG1 3.27Å; L277-I281 WeakPolarHBondContact O-CG1 3.38Å; L277-I281 PolarHBondContact O-N 3.12Å
278L97.3Very high93.7Very high0 Ų038.2 Ų38.20%020%0.196CC..Hα-helixtrans-57.4-48.6171.8176.371.2000110.9V246 V249 M250 I253 A274 A275 H280 I281 F282 I296V246-L278 HydrophobicContact CG1-CD1 3.85Å; V246-L278 HydrophobicContact CG2-CD1 4.36Å; V249-L278 HydrophobicContact CG1-CB 3.93Å; M250-L278 HydrophobicContact CG-CD1 4.06Å; M250-L278 HydrophobicContact SD-CD1 4.04Å; M250-L278 HydrophobicContact SD-CD2 3.51Å; M250-L278 VanDerWaalsContact SD-CD2 3.51Å; M250-L278 HydrophobicContact SD-CG 4.42Å; I253-L278 HydrophobicContact CD1-CB 3.86Å; I253-L278 HydrophobicContact CD1-CD2 3.7Å; I253-L278 HydrophobicContact CD1-CG 4.33Å; A274-L278 WeakPolarHBondContact O-CB 3.45Å; A274-L278 PolarHBondContact O-N 3.04Å; A275-L278 PolarHBondContact O-N 3.4Å; L278-H280 VanDerWaalsContact C-N 3.33Å; L278-H280 PolarHBondContact O-N 3.46Å; L278-I281 PolarHBondContact O-N 3.3Å; L278-F282 WeakPolarHBondContact O-CB 3.36Å; L278-F282 PolarHBondContact O-N 3.04Å; L278-I296 HydrophobicContact CD1-CD1 4.06Å; L278-I296 HydrophobicContact CD2-CG2 4.06Å
279S95.8Very high93.2Very high16 Ų1637.8 Ų37.811%0.11220%0.195CC..Hα-helixtrans-60.4-43.4176-174.80000111.4A275 L276 F282 W283 A323A275-S279 PolarHBondContact O-N 3.29Å; L276-S279 PolarHBondContact O-N 3.35Å; S279-F282 PolarHBondContact O-N 2.98Å; S279-W283 PolarHBondContact O-N 2.76Å; S279-A323 VanDerWaalsContact CB-O 3.23Å; S279-A323 WeakPolarHBondContact CB-O 3.36Å; S279-A323 PolarHBondContact OG-O 3.44Å
280H95.4Very high92.7Very high62 Ų6240.3 Ų40.329%0.28722%0.216SC..Hα-helixtrans-59.3-49.2175.9-174.334000112.4Q232 L276 L277 L278 F282 W283 T284Q232-H280 WeakPolarHBondContact CG-NE2 3.13Å; Q232-H280 PolarHBondContact NE2-NE2 2.75Å; L276-H280 WeakPolarHBondContact O-CB 3.43Å; L276-H280 PolarHBondContact O-N 3.22Å; L277-H280 WeakPolarHBondContact O-CB 3.35Å; L277-H280 PolarHBondContact O-N 3.37Å; L278-H280 VanDerWaalsContact C-N 3.33Å; L278-H280 PolarHBondContact O-N 3.46Å; H280-F282 VanDerWaalsContact C-N 3.32Å; H280-F282 PolarHBondContact O-N 3.38Å; H280-W283 PolarHBondContact O-N 3.4Å; H280-T284 WeakPolarHBondContact O-CG2 3.4Å; H280-T284 PolarHBondContact O-N 2.76Å; H280-T284 VanDerWaalsContact O-N 3.08Å; H280-T284 PolarHBondContact O-OG1 3.4Å; H280-T284 VanDerWaalsContact O-OG1 3.06Å
281I95.1Very high92.2Very high0 Ų041.2 Ų41.20%023%0.226CC..Hα-helixtrans-58.5-45.3177.1-67.1161.7000110.8V227 V231 V242 V246 V249 L277 L278 T284 H285V227-I281 HydrophobicContact CG1-CD1 3.83Å; V231-I281 HydrophobicContact CB-CG1 4.48Å; V231-I281 HydrophobicContact CG1-CG1 3.96Å; V231-I281 HydrophobicContact CG2-CD1 4.26Å; V231-I281 HydrophobicContact CG2-CG1 3.76Å; V242-I281 HydrophobicContact CG1-CG2 4.07Å; V246-I281 HydrophobicContact CG2-CG2 3.74Å; V249-I281 HydrophobicContact CG2-CD1 4.05Å; L277-I281 HydrophobicContact CD1-CD1 4.34Å; L277-I281 HydrophobicContact CD1-CG1 4.42Å; L277-I281 HydrophobicContact CG-CD1 4.1Å; L277-I281 VanDerWaalsContact O-CG1 3.27Å; L277-I281 WeakPolarHBondContact O-CG1 3.38Å; L277-I281 PolarHBondContact O-N 3.12Å; L278-I281 PolarHBondContact O-N 3.3Å; I281-T284 PolarHBondContact O-N 3Å; I281-H285 PolarHBondContact O-N 2.97Å
282F93.5Very high91.9Very high17 Ų1741.4 Ų41.48%0.07523%0.227CC..Hα-helixtrans-60.8-50.2179.5176.1-109.6000111.9L278 S279 H280 T284 G286 Y293 L324 P414L278-F282 WeakPolarHBondContact O-CB 3.36Å; L278-F282 PolarHBondContact O-N 3.04Å; S279-F282 PolarHBondContact O-N 2.98Å; H280-F282 VanDerWaalsContact C-N 3.32Å; H280-F282 PolarHBondContact O-N 3.38Å; F282-T284 VanDerWaalsContact C-N 3.31Å; F282-T284 PolarHBondContact O-N 3.08Å; F282-G286 VanDerWaalsContact O-CA 3.25Å; F282-G286 WeakPolarHBondContact O-CA 3.45Å; F282-G286 PolarHBondContact O-N 3.12Å; F282-Y293 AromaticContact CE1-CD2 3.74Å; F282-Y293 HydrophobicContact CE1-CD2 3.74Å; F282-Y293 HydrophobicContact CE1-CE2 4.15Å; F282-Y293 AromaticContact CE2-CD2 3.77Å; F282-Y293 HydrophobicContact CE2-CD2 3.77Å; F282-Y293 HydrophobicContact CE2-CG 4.13Å; F282-Y293 AromaticContact CZ-CD2 3.32Å; F282-Y293 HydrophobicContact CZ-CD2 3.32Å; F282-Y293 HydrophobicContact CZ-CE2 4.13Å; F282-Y293 AromaticContact CZ-CG 3.83Å; F282-Y293 HydrophobicContact CZ-CG 3.83Å; F282-L324 HydrophobicContact CB-CD2 4.28Å; F282-L324 HydrophobicContact CD1-CD2 4.07Å; F282-L324 HydrophobicContact CG-CD2 4.21Å; F282-P414 HydrophobicContact CZ-CB 4.24Å
283W91.4Very high91.6Very high90 Ų9040.9 Ų40.934%0.34122%0.223SC..Hα-helixtrans-76.1-10.2-177.8-67.5113.4000114.8S279 H280 L412S279-W283 PolarHBondContact O-N 2.76Å; H280-W283 PolarHBondContact O-N 3.4Å; W283-L412 HydrophobicContact CD2-CD2 4.21Å; W283-L412 HydrophobicContact CE3-CD2 4.37Å; W283-L412 HydrophobicContact CH2-CB 4.06Å; W283-L412 HydrophobicContact CH2-CD2 4.06Å; W283-L412 HydrophobicContact CZ2-CB 4.03Å; W283-L412 HydrophobicContact CZ2-CD2 3.87Å; W283-L412 HydrophobicContact CZ2-CG 4.41Å; W283-L412 HydrophobicContact CZ3-CD2 4.3Å
284T91.1Very high91.3Very high71 Ų7142.7 Ų42.744%0.43623%0.232SC..Hα-helixtrans-106.9-28.7174.362.50000115H280 I281 F282H280-T284 WeakPolarHBondContact O-CG2 3.4Å; H280-T284 PolarHBondContact O-N 2.76Å; H280-T284 VanDerWaalsContact O-N 3.08Å; H280-T284 PolarHBondContact O-OG1 3.4Å; H280-T284 VanDerWaalsContact O-OG1 3.06Å; I281-T284 PolarHBondContact O-N 3Å; F282-T284 VanDerWaalsContact C-N 3.31Å; F282-T284 PolarHBondContact O-N 3.08Å
285H88.8Confident91.1Very high33 Ų3347.3 Ų47.315%0.15325%0.254CS..Hα-helixtrans-131.24.4-173.1-61.3-73.2000113.8V231 V242 I281 D287 L288V231-H285 PolarHBondContact O-NE2 3.35Å; V231-H285 VanDerWaalsContact O-NE2 3.09Å; V242-H285 HydrophobicContact CG1-CB 4.39Å; V242-H285 HydrophobicContact CG2-CB 3.94Å; I281-H285 PolarHBondContact O-N 2.97Å; H285-D287 VanDerWaalsContact C-N 3.32Å; H285-D287 PolarHBondContact O-N 3.02Å; H285-L288 HydrophobicContact CB-CD1 4.19Å; H285-L288 WeakPolarHBondContact O-CB 3.49Å; H285-L288 WeakPolarHBondContact O-CG 3.19Å; H285-L288 PolarHBondContact O-N 3.16Å; H285-L288 VanDerWaalsContact O-N 3.14Å
286G84.9Confident91Very high9 Ų947.4 Ų47.49%0.09326%0.255CS..G310 helixtrans-58.9-38.7-177.800000114F282 L288 V289F282-G286 VanDerWaalsContact O-CA 3.25Å; F282-G286 WeakPolarHBondContact O-CA 3.45Å; F282-G286 PolarHBondContact O-N 3.12Å; G286-L288 PolarHBondContact O-N 3.41Å; G286-V289 PolarHBondContact O-N 3.25Å
287D84.6Confident90.8Very high153 Ų15342.1 Ų42.182%0.81823%0.227SC*.G310 helixtrans-61.1-14.4178.5-59.5-27.3000113.7H285 V289H285-D287 VanDerWaalsContact C-N 3.32Å; H285-D287 PolarHBondContact O-N 3.02Å; D287-V289 VanDerWaalsContact C-N 3.31Å
288L82.5Confident90.7Very high66 Ų6645.7 Ų45.735%0.34625%0.245SC..G310 helixtrans-78.6-13.3176.1-54.7-176.3000113.1Y237 V242 H285 G286Y237-L288 HydrophobicContact CE2-CD1 4.01Å; Y237-L288 HydrophobicContact CE2-CD2 3.89Å; V242-L288 HydrophobicContact CG2-CD1 4.25Å; H285-L288 HydrophobicContact CB-CD1 4.19Å; H285-L288 WeakPolarHBondContact O-CB 3.49Å; H285-L288 WeakPolarHBondContact O-CG 3.19Å; H285-L288 PolarHBondContact O-N 3.16Å; H285-L288 VanDerWaalsContact O-N 3.14Å; G286-L288 PolarHBondContact O-N 3.41Å
289V83.4Confident90.6Very high10 Ų1048 Ų486%0.06126%0.262CS..SBendtrans-138.9100.5-174.6-174.30000110.4V242 R243 G286 D287 L292V242-V289 HydrophobicContact CB-CG2 4.01Å; V242-V289 HydrophobicContact CG1-CG2 4.25Å; R243-V289 VanDerWaalsContact NH2-CG1 3.32Å; G286-V289 PolarHBondContact O-N 3.25Å; D287-V289 VanDerWaalsContact C-N 3.31Å; V289-L292 HydrophobicContact CB-CB 4.04Å; V289-L292 HydrophobicContact CB-CD2 4.31Å; V289-L292 HydrophobicContact CG1-CB 4.02Å; V289-L292 HydrophobicContact CG1-CD1 4.39Å; V289-L292 WeakPolarHBondContact O-CB 3.38Å; V289-L292 PolarHBondContact O-N 3.47Å
290S84.9Confident90.6Very high108 Ų10847.2 Ų47.276%0.75526%0.256SS*.THydrogen-bonded Turntrans-54.9141.8173.948.90000112.3L292S290-L292 PolarHBondContact O-N 2.83Å; S290-L292 VanDerWaalsContact O-N 3.14Å
291G86.8Confident90.6Very high25 Ų2546.7 Ų46.726%0.25825%0.254SS..THydrogen-bonded Turntrans68.41.3-178.800000115.9Y293 H294 Q295 E417G291-Y293 VanDerWaalsContact C-N 3.29Å; G291-Y293 PolarHBondContact O-N 3.42Å; G291-H294 PolarHBondContact O-N 2.97Å; G291-H294 VanDerWaalsContact O-N 3.1Å; G291-Q295 PolarHBondContact O-N 2.59Å; G291-E417 PolarHBondContact N-OE1 3.29Å
292L90.1Very high90.6Very high3 Ų353.5 Ų53.52%0.01628%0.283CS..Hα-helixtrans-57.2-41-177.8-178.467.5000112.4V242 V246 V289 S290 H294 Q295 I296V242-L292 HydrophobicContact CG1-CD2 4.03Å; V246-L292 HydrophobicContact CG1-CD1 4.24Å; V246-L292 HydrophobicContact CG2-CD1 4.42Å; V246-L292 HydrophobicContact CG2-CD2 4.44Å; V289-L292 HydrophobicContact CB-CB 4.04Å; V289-L292 HydrophobicContact CB-CD2 4.31Å; V289-L292 HydrophobicContact CG1-CB 4.02Å; V289-L292 HydrophobicContact CG1-CD1 4.39Å; V289-L292 WeakPolarHBondContact O-CB 3.38Å; V289-L292 PolarHBondContact O-N 3.47Å; S290-L292 PolarHBondContact O-N 2.83Å; S290-L292 VanDerWaalsContact O-N 3.14Å; L292-H294 PolarHBondContact O-N 3.34Å; L292-Q295 PolarHBondContact O-N 2.98Å; L292-I296 HydrophobicContact CD1-CD1 4.21Å; L292-I296 HydrophobicContact CD1-CG1 4.47Å; L292-I296 HydrophobicContact CG-CD1 3.9Å; L292-I296 VanDerWaalsContact O-CG1 3.28Å; L292-I296 WeakPolarHBondContact O-CG1 3.17Å; L292-I296 PolarHBondContact O-N 3.43Å
293Y90.6Very high90.6Very high30 Ų3052.9 Ų52.912%0.11828%0.281CS..Hα-helixtrans-58.8-46.3176.6-174.6-116.1000111.8F282 G291 I296 L297 P414F282-Y293 AromaticContact CE1-CD2 3.74Å; F282-Y293 HydrophobicContact CE1-CD2 3.74Å; F282-Y293 HydrophobicContact CE1-CE2 4.15Å; F282-Y293 AromaticContact CE2-CD2 3.77Å; F282-Y293 HydrophobicContact CE2-CD2 3.77Å; F282-Y293 HydrophobicContact CE2-CG 4.13Å; F282-Y293 AromaticContact CZ-CD2 3.32Å; F282-Y293 HydrophobicContact CZ-CD2 3.32Å; F282-Y293 HydrophobicContact CZ-CE2 4.13Å; F282-Y293 AromaticContact CZ-CG 3.83Å; F282-Y293 HydrophobicContact CZ-CG 3.83Å; G291-Y293 VanDerWaalsContact C-N 3.29Å; G291-Y293 PolarHBondContact O-N 3.42Å; Y293-I296 PolarHBondContact O-N 3.24Å; Y293-L297 HydrophobicContact CD1-CD1 4.02Å; Y293-L297 HydrophobicContact CE1-CD1 3.47Å; Y293-L297 VanDerWaalsContact CE1-CD1 3.47Å; Y293-L297 HydrophobicContact CE1-CG 4.2Å; Y293-L297 HydrophobicContact CE2-CD1 4.41Å; Y293-L297 HydrophobicContact CE2-CD2 4.43Å; Y293-L297 HydrophobicContact CE2-CG 4.36Å; Y293-L297 WeakPolarHBondContact O-CG 3.32Å; Y293-L297 PolarHBondContact O-N 2.74Å; Y293-P414 HydrophobicContact CD1-CG 4.23Å; Y293-P414 HydrophobicContact CE1-CG 4.16Å
294H91.3Very high90.7Very high83 Ų8348.9 Ų48.938%0.38427%0.267SS..Hα-helixtrans-66.6-42.7179.3-176.472000111.5G291 L292 I296 L297 L298 W439G291-H294 PolarHBondContact O-N 2.97Å; G291-H294 VanDerWaalsContact O-N 3.1Å; L292-H294 PolarHBondContact O-N 3.34Å; H294-I296 VanDerWaalsContact C-N 3.32Å; H294-I296 PolarHBondContact O-N 3.28Å; H294-L297 PolarHBondContact O-N 3.43Å; H294-L298 WeakPolarHBondContact NE2-CD1 3.46Å; H294-L298 WeakPolarHBondContact O-CG 3.4Å; H294-L298 PolarHBondContact O-N 3.09Å; H294-W439 AromaticContact CE1-CE3 3.98Å
295Q93.3Very high90.7Very high97 Ų9748.8 Ų48.845%0.45327%0.269SS..Hα-helixtrans-59.3-41.8174.9-173.4177.46.100112.1G291 L292 S299G291-Q295 PolarHBondContact O-N 2.59Å; L292-Q295 PolarHBondContact O-N 2.98Å; Q295-S299 PolarHBondContact O-N 3.41Å; Q295-S299 PolarHBondContact O-OG 2.99Å
296I95.1Very high90.9Very high3 Ų349.6 Ų49.62%0.01527%0.274CS..Hα-helixtrans-65.5-50.3175.6-66.5164.2000110.5V246 M250 L278 L292 Y293 H294 L298 S299 L300 L324V246-I296 HydrophobicContact CG1-CD1 4.04Å; V246-I296 HydrophobicContact CG1-CG1 4.01Å; M250-I296 HydrophobicContact CE-CG2 4.21Å; M250-I296 HydrophobicContact SD-CG2 4.26Å; L278-I296 HydrophobicContact CD1-CD1 4.06Å; L278-I296 HydrophobicContact CD2-CG2 4.06Å; L292-I296 HydrophobicContact CD1-CD1 4.21Å; L292-I296 HydrophobicContact CD1-CG1 4.47Å; L292-I296 HydrophobicContact CG-CD1 3.9Å; L292-I296 VanDerWaalsContact O-CG1 3.28Å; L292-I296 WeakPolarHBondContact O-CG1 3.17Å; L292-I296 PolarHBondContact O-N 3.43Å; Y293-I296 PolarHBondContact O-N 3.24Å; H294-I296 VanDerWaalsContact C-N 3.32Å; H294-I296 PolarHBondContact O-N 3.28Å; I296-L298 PolarHBondContact O-N 3.19Å; I296-S299 WeakPolarHBondContact O-CB 3.4Å; I296-S299 PolarHBondContact O-N 3.23Å; I296-S299 VanDerWaalsContact O-N 3.12Å; I296-L300 HydrophobicContact CG2-CD1 3.81Å; I296-L300 HydrophobicContact CG2-CG 4.34Å; I296-L300 WeakPolarHBondContact O-CG 3.5Å; I296-L300 PolarHBondContact O-N 3.12Å; I296-L324 HydrophobicContact CG2-CD1 3.66Å
297L94.6Very high91Very high3 Ų353.1 Ų53.12%0.01630%0.296CS..Hα-helixtrans-58.3-46.7-179.8-72.4-173.4000112.6Y293 H294 S299 L300 Q301 L321 L324 A328 V332Y293-L297 HydrophobicContact CD1-CD1 4.02Å; Y293-L297 HydrophobicContact CE1-CD1 3.47Å; Y293-L297 VanDerWaalsContact CE1-CD1 3.47Å; Y293-L297 HydrophobicContact CE1-CG 4.2Å; Y293-L297 HydrophobicContact CE2-CD1 4.41Å; Y293-L297 HydrophobicContact CE2-CD2 4.43Å; Y293-L297 HydrophobicContact CE2-CG 4.36Å; Y293-L297 WeakPolarHBondContact O-CG 3.32Å; Y293-L297 PolarHBondContact O-N 2.74Å; H294-L297 PolarHBondContact O-N 3.43Å; L297-S299 VanDerWaalsContact C-N 3.27Å; L297-S299 PolarHBondContact O-N 2.91Å; L297-L300 PolarHBondContact O-N 3.32Å; L297-Q301 WeakPolarHBondContact O-CB 3.25Å; L297-Q301 PolarHBondContact O-N 2.88Å; L297-L321 HydrophobicContact CD2-CD2 3.71Å; L297-L324 HydrophobicContact CD2-CD1 4.25Å; L297-A328 HydrophobicContact CD2-CB 3.71Å; L297-V332 HydrophobicContact CB-CG2 4.26Å; L297-V332 HydrophobicContact CD1-CG2 4.35Å; L297-V332 HydrophobicContact CD2-CG2 4.03Å; L297-V332 HydrophobicContact CG-CG2 4.44Å
298L94.9Very high91.4Very high80 Ų8052.1 Ų52.142%0.41930%0.295SS..Hα-helixtrans-59.8-37.3176.5-72.8179.1000112.3H294 I296 K302H294-L298 WeakPolarHBondContact NE2-CD1 3.46Å; H294-L298 WeakPolarHBondContact O-CG 3.4Å; H294-L298 PolarHBondContact O-N 3.09Å; I296-L298 PolarHBondContact O-N 3.19Å; L298-K302 VanDerWaalsContact O-CB 3.3Å; L298-K302 WeakPolarHBondContact O-CB 3.3Å; L298-K302 PolarHBondContact O-N 3.21Å
299S95.3Very high91.8Very high49 Ų4952 Ų5234%0.34329%0.29SS..Hα-helixtrans-67.5-40.2178.1-57.20000112Q295 I296 L297Q295-S299 PolarHBondContact O-N 3.41Å; Q295-S299 PolarHBondContact O-OG 2.99Å; I296-S299 WeakPolarHBondContact O-CB 3.4Å; I296-S299 PolarHBondContact O-N 3.23Å; I296-S299 VanDerWaalsContact O-N 3.12Å; L297-S299 VanDerWaalsContact C-N 3.27Å; L297-S299 PolarHBondContact O-N 2.91Å
300L95.5Very high92.3Very high0 Ų054.2 Ų54.20%030%0.304CS..Hα-helixtrans-69.2-45.1175.9-60.9167.8000110.9M250 L254 I296 L297 K302 V303 L304 L321 L324M250-L300 HydrophobicContact CE-CD2 4.02Å; M250-L300 HydrophobicContact CE-CG 4.15Å; M250-L300 HydrophobicContact SD-CD2 4.4Å; L254-L300 HydrophobicContact CD1-CD2 4.31Å; L254-L300 HydrophobicContact CD2-CD2 4.07Å; L254-L300 HydrophobicContact CG-CD2 4.45Å; I296-L300 HydrophobicContact CG2-CD1 3.81Å; I296-L300 HydrophobicContact CG2-CG 4.34Å; I296-L300 WeakPolarHBondContact O-CG 3.5Å; I296-L300 PolarHBondContact O-N 3.12Å; L297-L300 PolarHBondContact O-N 3.32Å; L300-K302 PolarHBondContact O-N 3.25Å; L300-V303 PolarHBondContact O-N 3.31Å; L300-L304 PolarHBondContact O-N 2.76Å; L300-L321 HydrophobicContact CB-CD2 4.02Å; L300-L321 HydrophobicContact CB-CG 4.08Å; L300-L321 HydrophobicContact CD1-CD2 3.62Å; L300-L321 HydrophobicContact CD1-CG 3.91Å; L300-L321 HydrophobicContact CG-CD2 4.46Å; L300-L324 HydrophobicContact CD1-CD1 3.55Å
301Q95.1Very high92.7Very high51 Ų5150.1 Ų50.124%0.23827%0.273CS..Hα-helixtrans-57.2-48.6176.7-175.1-178.5-3.600111.6L297 V303 L304 S305 V332 H336L297-Q301 WeakPolarHBondContact O-CB 3.25Å; L297-Q301 PolarHBondContact O-N 2.88Å; Q301-V303 PolarHBondContact O-N 3.28Å; Q301-V303 VanDerWaalsContact O-N 3.15Å; Q301-L304 WeakPolarHBondContact O-CA 3.36Å; Q301-L304 PolarHBondContact O-N 3.48Å; Q301-S305 PolarHBondContact O-N 3.46Å; Q301-S305 PolarHBondContact O-OG 3.49Å; Q301-V332 HydrophobicContact CB-CG1 3.63Å; Q301-V332 HydrophobicContact CG-CG1 4Å; Q301-H336 PolarHBondContact NE2-CE1 3.44Å; Q301-H336 PolarHBondContact NE2-NE2 2.95Å
302K95Very high93Very high142 Ų14249.3 Ų49.362%0.61726%0.264SS*.Hα-helixtrans-57-32-178.8-178172.4-179.61760113.1L298 L300 D306L298-K302 VanDerWaalsContact O-CB 3.3Å; L298-K302 WeakPolarHBondContact O-CB 3.3Å; L298-K302 PolarHBondContact O-N 3.21Å; L300-K302 PolarHBondContact O-N 3.25Å; K302-D306 WeakPolarHBondContact O-CB 3.37Å
303V94.7Very high93.2Very high4 Ų449.2 Ų49.22%0.02426%0.263CS..Hα-helixtrans-78-31176.2174.30000111.9L254 L300 Q301 R309 H314 A317L254-V303 HydrophobicContact CD1-CG2 4.11Å; L254-V303 HydrophobicContact CD2-CB 4.24Å; L254-V303 HydrophobicContact CD2-CG1 4.28Å; L254-V303 HydrophobicContact CD2-CG2 4.08Å; L254-V303 HydrophobicContact CG-CG2 4.48Å; L300-V303 PolarHBondContact O-N 3.31Å; Q301-V303 PolarHBondContact O-N 3.28Å; Q301-V303 VanDerWaalsContact O-N 3.15Å; V303-R309 HydrophobicContact CG1-CG 4.32Å; V303-H314 PolarHBondContact O-CE1 3.49Å; V303-H314 PolarHBondContact O-ND1 3.19Å; V303-A317 HydrophobicContact CB-CB 4.19Å; V303-A317 HydrophobicContact CG1-CB 4.08Å
304L92.3Very high93.5Very high7 Ų748 Ų484%0.03726%0.259CS..Hα-helixtrans-72.3-32173.2-63.5175.9000112.8L300 Q301 D306 A317 V318 L321 V332 L333L300-L304 PolarHBondContact O-N 2.76Å; Q301-L304 WeakPolarHBondContact O-CA 3.36Å; Q301-L304 PolarHBondContact O-N 3.48Å; L304-D306 VanDerWaalsContact C-N 3.3Å; L304-D306 PolarHBondContact O-N 2.9Å; L304-A317 HydrophobicContact CD2-CB 3.9Å; L304-A317 HydrophobicContact CG-CB 4.01Å; L304-V318 HydrophobicContact CD2-CG2 3.98Å; L304-L321 HydrophobicContact CD1-CD1 3.66Å; L304-V332 HydrophobicContact CD1-CG1 4.34Å; L304-L333 HydrophobicContact CD1-CD1 3.77Å; L304-L333 HydrophobicContact CD2-CD1 4.44Å
305S92Very high93.8Very high69 Ų6945.1 Ų45.148%0.48325%0.245SC..THydrogen-bonded Turntrans-77.1-7.7177.7-55.90000115.1Q301 P307Q301-S305 PolarHBondContact O-N 3.46Å; Q301-S305 PolarHBondContact O-OG 3.49Å; S305-P307 VanDerWaalsContact O-CD 3.31Å; S305-P307 WeakPolarHBondContact O-CD 3.22Å
306D92.3Very high93.9Very high50 Ų5040.5 Ų40.527%0.26722%0.223SC..  trans-112.388.5-170.3179.33.9000110.2K302 L304 V308 R309 H314K302-D306 WeakPolarHBondContact O-CB 3.37Å; L304-D306 VanDerWaalsContact C-N 3.3Å; L304-D306 PolarHBondContact O-N 2.9Å; D306-V308 PolarHBondContact O-N 2.91Å; D306-V308 VanDerWaalsContact O-N 3.09Å; D306-V308 PolarHBondContact OD1-N 3.44Å; D306-R309 HydrophobicContact CB-CG 3.8Å; D306-R309 VanDerWaalsContact CG-CG 3.47Å; D306-R309 WeakPolarHBondContact O-CB 3.26Å; D306-R309 WeakPolarHBondContact O-CG 3.45Å; D306-R309 PolarHBondContact O-N 3.3Å; D306-R309 VanDerWaalsContact O-N 3.11Å; D306-R309 VanDerWaalsContact OD2-CG 3.29Å; D306-R309 WeakPolarHBondContact OD2-CG 3.13Å; D306-R309 IonicContact OD2-CZ 3.94Å; D306-R309 IonicContact OD2-NE 2.85Å; D306-R309 PolarHBondContact OD2-NE 2.96Å; D306-H314 PolarHBondContact O-CE1 2.91Å; D306-H314 VanDerWaalsContact O-CE1 3.24Å
307P87.9Confident94Very high83 Ų8340.3 Ų40.354%0.53922%0.222SC..THydrogen-bonded Turntrans-72.5-0.2-172.632-37.9000114.1S305S305-P307 VanDerWaalsContact O-CD 3.31Å; S305-P307 WeakPolarHBondContact O-CD 3.22Å
308V91.2Very high94.1Very high132 Ų13240.2 Ų40.280%0.822%0.221SC*.THydrogen-bonded Turntrans-89.2-8.5174.1-169.20000110.9D306D306-V308 PolarHBondContact O-N 2.91Å; D306-V308 VanDerWaalsContact O-N 3.09Å; D306-V308 PolarHBondContact OD1-N 3.44Å
309R92.3Very high94.3Very high64 Ų6437.3 Ų37.324%0.24221%0.207CC..SBendtrans-67.8147.1174.2-69.4-81.2177.6155.4-7.4111.4E255 V303 D306 H314E255-R309 IonicContact OE1-CZ 3.76Å; E255-R309 IonicContact OE1-NH1 2.87Å; E255-R309 PolarHBondContact OE1-NH1 2.95Å; V303-R309 HydrophobicContact CG1-CG 4.32Å; D306-R309 HydrophobicContact CB-CG 3.8Å; D306-R309 VanDerWaalsContact CG-CG 3.47Å; D306-R309 WeakPolarHBondContact O-CB 3.26Å; D306-R309 WeakPolarHBondContact O-CG 3.45Å; D306-R309 PolarHBondContact O-N 3.3Å; D306-R309 VanDerWaalsContact O-N 3.11Å; D306-R309 VanDerWaalsContact OD2-CG 3.29Å; D306-R309 WeakPolarHBondContact OD2-CG 3.13Å; D306-R309 IonicContact OD2-CZ 3.94Å; D306-R309 IonicContact OD2-NE 2.85Å; D306-R309 PolarHBondContact OD2-NE 2.96Å; R309-H314 PolarHBondContact O-NE2 2.91Å
310P92.9Very high94.4Very high55 Ų5535 Ų3536%0.35719%0.191SC..  trans-70151.1172.227.6-30.7000111.2P256 C312 S313 H314P256-P310 HydrophobicContact CB-CG 3.94Å; P256-P310 HydrophobicContact CG-CG 4.49Å; P310-C312 PolarHBondContact O-N 3.34Å; P310-C312 VanDerWaalsContact O-N 3.13Å; P310-S313 VanDerWaalsContact O-CB 3.28Å; P310-S313 WeakPolarHBondContact O-CB 3.36Å; P310-S313 PolarHBondContact O-N 3.24Å; P310-H314 PolarHBondContact O-N 3.37Å
311L93.3Very high94.4Very high22 Ų2235 Ų3512%0.11519%0.191CC..Hα-helixtrans-59.8-28.2-174.8-66.7165.9000113.5S313 H314 Y315 V347 V358 D361 V365L311-S313 VanDerWaalsContact C-N 3.31Å; L311-S313 PolarHBondContact O-N 2.99Å; L311-H314 PolarHBondContact O-N 3.37Å; L311-Y315 WeakPolarHBondContact O-CB 3.47Å; L311-Y315 PolarHBondContact O-N 3.48Å; L311-V347 HydrophobicContact CD1-CG1 4.09Å; L311-V358 HydrophobicContact CD1-CG1 3.65Å; L311-V358 VanDerWaalsContact CD1-O 3.27Å; L311-V358 WeakPolarHBondContact CD1-O 3.33Å; L311-D361 HydrophobicContact CB-CB 3.97Å; L311-D361 HydrophobicContact CD1-CB 4.02Å; L311-V365 HydrophobicContact CB-CG2 4.06Å; L311-V365 HydrophobicContact CD2-CG2 4.28Å; L311-V365 VanDerWaalsContact O-CG2 3.3Å; L311-V365 WeakPolarHBondContact O-CG2 3.43Å
312C93.4Very high94.5Very high9 Ų935.6 Ų35.66%0.06119%0.193CC..Hα-helixtrans-65.4-30.5173.366.80000113.3H267 W268 R271 P310 G316H267-C312 WeakPolarHBondContact NE2-CB 3.41Å; W268-C312 HydrophobicContact CH2-CB 4.12Å; W268-C312 HydrophobicContact CZ3-CB 4.29Å; R271-C312 VanDerWaalsContact CD-O 3.29Å; R271-C312 WeakPolarHBondContact CD-O 3.41Å; R271-C312 PolarHBondContact NE-O 2.87Å; R271-C312 PolarHBondContact NH2-SG 3.17Å; R271-C312 VanDerWaalsContact NH2-SG 3.41Å; P310-C312 PolarHBondContact O-N 3.34Å; P310-C312 VanDerWaalsContact O-N 3.13Å; C312-G316 PolarHBondContact O-N 3.34Å
313S95.3Very high94.5Very high0 Ų029.6 Ų29.60%017%0.17CC..Hα-helixtrans-70.2-43.9170.9-67.70000111.8L254 P310 L311 G316 A317L254-S313 WeakPolarHBondContact O-CA 3.42Å; L254-S313 WeakPolarHBondContact O-CB 3.34Å; L254-S313 PolarHBondContact O-OG 2.81Å; P310-S313 VanDerWaalsContact O-CB 3.28Å; P310-S313 WeakPolarHBondContact O-CB 3.36Å; P310-S313 PolarHBondContact O-N 3.24Å; L311-S313 VanDerWaalsContact C-N 3.31Å; L311-S313 PolarHBondContact O-N 2.99Å; S313-G316 PolarHBondContact O-N 3.19Å; S313-A317 PolarHBondContact O-N 3.44Å
314H95.9Very high94.4Very high4 Ų429.6 Ų29.62%0.01917%0.17CC..Hα-helixtrans-63.4-43176.4-66.5-67.3000112.1V303 D306 R309 P310 L311 G316 A317 V318 Y340 V365V303-H314 PolarHBondContact O-CE1 3.49Å; V303-H314 PolarHBondContact O-ND1 3.19Å; D306-H314 PolarHBondContact O-CE1 2.91Å; D306-H314 VanDerWaalsContact O-CE1 3.24Å; R309-H314 PolarHBondContact O-NE2 2.91Å; P310-H314 PolarHBondContact O-N 3.37Å; L311-H314 PolarHBondContact O-N 3.37Å; H314-G316 VanDerWaalsContact C-N 3.35Å; H314-G316 PolarHBondContact O-N 3.07Å; H314-A317 WeakPolarHBondContact O-CB 3.3Å; H314-A317 PolarHBondContact O-N 2.95Å; H314-A317 VanDerWaalsContact O-N 3.16Å; H314-V318 WeakPolarHBondContact O-CG2 3.48Å; H314-V318 PolarHBondContact O-N 3.34Å; H314-Y340 VanDerWaalsContact CB-OH 3.26Å; H314-Y340 WeakPolarHBondContact CB-OH 3.4Å; H314-Y340 PolarHBondContact CD2-OH 3.4Å; H314-Y340 AromaticContact CE1-CE2 3.64Å; H314-Y340 AromaticContact CG-CE2 3.89Å; H314-Y340 AromaticContact CG-CZ 3.9Å; H314-Y340 VanDerWaalsContact CG-OH 3.24Å; H314-Y340 AromaticContact ND1-CE2 3.53Å; H314-Y340 AromaticContact ND1-CZ 3.99Å; H314-V365 HydrophobicContact CB-CG2 4.44Å
315Y96.9Very high94.4Very high23 Ų2329.8 Ų29.89%0.0917%0.174CC..Hα-helixtrans-54.2-50.7172.6178.9-88.1000111.3W268 R271 D272 L311 A317 V318 V319 K364 A368W268-Y315 AromaticContact CE3-CD1 3.67Å; W268-Y315 HydrophobicContact CE3-CD1 3.67Å; W268-Y315 AromaticContact CE3-CD2 3.82Å; W268-Y315 HydrophobicContact CE3-CD2 3.82Å; W268-Y315 AromaticContact CE3-CE1 3.93Å; W268-Y315 HydrophobicContact CE3-CE1 3.93Å; W268-Y315 HydrophobicContact CE3-CE2 4.05Å; W268-Y315 AromaticContact CE3-CG 3.63Å; W268-Y315 HydrophobicContact CE3-CG 3.63Å; W268-Y315 HydrophobicContact CZ3-CD1 4.07Å; W268-Y315 AromaticContact CZ3-CD2 3.85Å; W268-Y315 HydrophobicContact CZ3-CD2 3.85Å; W268-Y315 HydrophobicContact CZ3-CE2 4.5Å; W268-Y315 AromaticContact CZ3-CG 3.6Å; W268-Y315 HydrophobicContact CZ3-CG 3.6Å; R271-Y315 HydrophobicContact CB-CD1 4.37Å; R271-Y315 HydrophobicContact CB-CE1 4.37Å; D272-Y315 VanDerWaalsContact OD1-CE1 3.26Å; D272-Y315 WeakPolarHBondContact OD1-CE1 3.48Å; D272-Y315 PolarHBondContact OD1-OH 2.81Å; D272-Y315 PolarHBondContact OD2-OH 2.96Å; L311-Y315 WeakPolarHBondContact O-CB 3.47Å; L311-Y315 PolarHBondContact O-N 3.48Å; Y315-A317 VanDerWaalsContact C-N 3.3Å; Y315-A317 PolarHBondContact O-N 2.84Å; Y315-V318 PolarHBondContact O-N 2.99Å; Y315-V318 VanDerWaalsContact O-N 3.17Å; Y315-V319 HydrophobicContact CD1-CG2 4.06Å; Y315-V319 HydrophobicContact CE1-CG2 3.69Å; Y315-V319 HydrophobicContact CE2-CG2 4.22Å; Y315-V319 HydrophobicContact CG-CG2 4.46Å; Y315-V319 WeakPolarHBondContact O-CG2 3.38Å; Y315-V319 PolarHBondContact O-N 3.43Å; Y315-K364 HydrophobicContact CD2-CB 4.07Å; Y315-K364 HydrophobicContact CE2-CB 4.23Å; Y315-A368 HydrophobicContact CD2-CB 3.88Å; Y315-A368 HydrophobicContact CE2-CB 3.81Å
316G96.7Very high94.4Very high0 Ų027.9 Ų27.90%016%0.157CC..Hα-helixtrans-58.2-40.1176.700000113.2I253 C312 S313 H314 G320I253-G316 WeakPolarHBondContact CG2-O 3.47Å; I253-G316 WeakPolarHBondContact O-CA 3.31Å; C312-G316 PolarHBondContact O-N 3.34Å; S313-G316 PolarHBondContact O-N 3.19Å; H314-G316 VanDerWaalsContact C-N 3.35Å; H314-G316 PolarHBondContact O-N 3.07Å; G316-G320 PolarHBondContact O-N 3.17Å
317A97.1Very high94.4Very high0 Ų028 Ų280%016%0.155CC..Hα-helixtrans-62.9-44.5175.400000112.4L254 V303 L304 S313 H314 Y315 L321L254-A317 HydrophobicContact CD2-CB 3.76Å; V303-A317 HydrophobicContact CB-CB 4.19Å; V303-A317 HydrophobicContact CG1-CB 4.08Å; L304-A317 HydrophobicContact CD2-CB 3.9Å; L304-A317 HydrophobicContact CG-CB 4.01Å; S313-A317 PolarHBondContact O-N 3.44Å; H314-A317 WeakPolarHBondContact O-CB 3.3Å; H314-A317 PolarHBondContact O-N 2.95Å; H314-A317 VanDerWaalsContact O-N 3.16Å; Y315-A317 VanDerWaalsContact C-N 3.3Å; Y315-A317 PolarHBondContact O-N 2.84Å; A317-L321 WeakPolarHBondContact O-CG 3.45Å; A317-L321 PolarHBondContact O-N 3.01Å
318V97.3Very high94.7Very high0 Ų024.1 Ų24.10%013%0.13CC..Hα-helixtrans-64.5-48.6177.61750000111.6L304 H314 Y315 G320 L321 H322 L333 A368 I369 A372L304-V318 HydrophobicContact CD2-CG2 3.98Å; H314-V318 WeakPolarHBondContact O-CG2 3.48Å; H314-V318 PolarHBondContact O-N 3.34Å; Y315-V318 PolarHBondContact O-N 2.99Å; Y315-V318 VanDerWaalsContact O-N 3.17Å; V318-G320 VanDerWaalsContact C-N 3.33Å; V318-G320 PolarHBondContact O-N 2.98Å; V318-L321 PolarHBondContact O-N 3.21Å; V318-H322 PolarHBondContact O-N 3.35Å; V318-L333 HydrophobicContact CG1-CD2 4.2Å; V318-L333 HydrophobicContact CG2-CD1 4.1Å; V318-A368 HydrophobicContact CB-CB 4.42Å; V318-A368 HydrophobicContact CG1-CB 3.86Å; V318-I369 HydrophobicContact CB-CG1 4.38Å; V318-I369 HydrophobicContact CG1-CB 4.45Å; V318-I369 HydrophobicContact CG1-CG1 3.79Å; V318-I369 HydrophobicContact CG2-CD1 4.27Å; V318-I369 HydrophobicContact CG2-CG1 3.68Å; V318-A372 HydrophobicContact CG1-CB 4.28Å
319V97.3Very high94.8Very high20 Ų2018 Ų1812%0.1219%0.092CC..Hα-helixtrans-68.2-34.8180-177.20000111.1A275 Y315 H322 A323 A368A275-V319 HydrophobicContact CB-CB 4.43Å; A275-V319 HydrophobicContact CB-CG1 3.79Å; Y315-V319 HydrophobicContact CD1-CG2 4.06Å; Y315-V319 HydrophobicContact CE1-CG2 3.69Å; Y315-V319 HydrophobicContact CE2-CG2 4.22Å; Y315-V319 HydrophobicContact CG-CG2 4.46Å; Y315-V319 WeakPolarHBondContact O-CG2 3.38Å; Y315-V319 PolarHBondContact O-N 3.43Å; V319-H322 PolarHBondContact O-N 3.01Å; V319-A323 WeakPolarHBondContact O-CB 3.04Å; V319-A323 PolarHBondContact O-N 2.88Å; V319-A368 HydrophobicContact CG2-CB 3.95Å
320G97.1Very high94.9Very high0 Ų015.7 Ų15.70%08%0.084CC..Hα-helixtrans-58.4-48.5170.600000112.8G316 V318 A323 L324G316-G320 PolarHBondContact O-N 3.17Å; V318-G320 VanDerWaalsContact C-N 3.33Å; V318-G320 PolarHBondContact O-N 2.98Å; G320-A323 PolarHBondContact O-N 3Å; G320-L324 WeakPolarHBondContact O-CG 3.3Å; G320-L324 PolarHBondContact O-N 2.98Å; G320-L324 VanDerWaalsContact O-N 3.08Å
321L96.6Very high94.8Very high0 Ų017.6 Ų17.60%08%0.084CC..Hα-helixtrans-63-41.6174.7-70.1171.7000112.1L297 L300 L304 A317 V318 L324 G325 A328 V329 V332 L333L297-L321 HydrophobicContact CD2-CD2 3.71Å; L300-L321 HydrophobicContact CB-CD2 4.02Å; L300-L321 HydrophobicContact CB-CG 4.08Å; L300-L321 HydrophobicContact CD1-CD2 3.62Å; L300-L321 HydrophobicContact CD1-CG 3.91Å; L300-L321 HydrophobicContact CG-CD2 4.46Å; L304-L321 HydrophobicContact CD1-CD1 3.66Å; A317-L321 WeakPolarHBondContact O-CG 3.45Å; A317-L321 PolarHBondContact O-N 3.01Å; V318-L321 PolarHBondContact O-N 3.21Å; L321-L324 PolarHBondContact O-N 2.86Å; L321-G325 PolarHBondContact O-N 3.1Å; L321-G325 VanDerWaalsContact O-N 3.16Å; L321-A328 HydrophobicContact CD2-CB 4.03Å; L321-V329 HydrophobicContact CB-CG2 4.29Å; L321-V332 HydrophobicContact CD1-CB 3.93Å; L321-V332 HydrophobicContact CD1-CG1 3.73Å; L321-V332 HydrophobicContact CD2-CB 3.83Å; L321-V332 HydrophobicContact CD2-CG1 4.07Å; L321-V332 HydrophobicContact CD2-CG2 4.13Å; L321-L333 HydrophobicContact CD1-CB 4.04Å
322H96.3Very high94.8Very high63 Ų6316.6 Ų16.629%0.2928%0.079SC..Hα-helixtrans-59.7-46.3176.1179.483.1000112.1V318 V319 G325 A372V318-H322 PolarHBondContact O-N 3.35Å; V319-H322 PolarHBondContact O-N 3.01Å; H322-G325 WeakPolarHBondContact O-CA 3.45Å; H322-G325 PolarHBondContact O-N 3.16Å; H322-A372 HydrophobicContact CB-CB 4.22Å; H322-A372 WeakPolarHBondContact ND1-CA 3.45Å
323A95.6Very high94.8Very high16 Ų1616.3 Ų16.313%0.1328%0.077CC..Hα-helixtrans-67.8-36.4-178.400000112.8A275 S279 V319 G320 G325A275-A323 HydrophobicContact CB-CB 4.06Å; A275-A323 WeakPolarHBondContact O-CB 3.4Å; S279-A323 VanDerWaalsContact CB-O 3.23Å; S279-A323 WeakPolarHBondContact CB-O 3.36Å; S279-A323 PolarHBondContact OG-O 3.44Å; V319-A323 WeakPolarHBondContact O-CB 3.04Å; V319-A323 PolarHBondContact O-N 2.88Å; G320-A323 PolarHBondContact O-N 3Å; A323-G325 VanDerWaalsContact C-N 3.31Å
324L93.9Very high94.7Very high4 Ų416.8 Ų16.82%0.0218%0.079CC..Hα-helixtrans-64.4-36.4172.7-70.3167.1000111.9F282 I296 L297 L300 G320 L321 A328F282-L324 HydrophobicContact CB-CD2 4.28Å; F282-L324 HydrophobicContact CD1-CD2 4.07Å; F282-L324 HydrophobicContact CG-CD2 4.21Å; I296-L324 HydrophobicContact CG2-CD1 3.66Å; L297-L324 HydrophobicContact CD2-CD1 4.25Å; L300-L324 HydrophobicContact CD1-CD1 3.55Å; G320-L324 WeakPolarHBondContact O-CG 3.3Å; G320-L324 PolarHBondContact O-N 2.98Å; G320-L324 VanDerWaalsContact O-N 3.08Å; L321-L324 PolarHBondContact O-N 2.86Å; L324-A328 HydrophobicContact CB-CB 3.97Å
325G92.1Very high94.5Very high12 Ų1219 Ų1912%0.1249%0.094CC..  trans131.1172.8166.900000114.1L321 H322 A323 K327 A328 V329L321-G325 PolarHBondContact O-N 3.1Å; L321-G325 VanDerWaalsContact O-N 3.16Å; H322-G325 WeakPolarHBondContact O-CA 3.45Å; H322-G325 PolarHBondContact O-N 3.16Å; A323-G325 VanDerWaalsContact C-N 3.31Å; G325-K327 VanDerWaalsContact C-N 3.26Å; G325-K327 PolarHBondContact O-N 3.15Å; G325-K327 VanDerWaalsContact O-N 3.09Å; G325-A328 WeakPolarHBondContact O-CB 3.39Å; G325-A328 PolarHBondContact O-N 3.43Å; G325-V329 PolarHBondContact O-N 3.42Å
326W92Very high94.2Very high29 Ų2920.3 Ų20.311%0.1110%0.101CC..Hα-helixtrans-55.4-34.8-170.868.4-87.3000114.5A328 V329 E330 L376 M379 K380W326-A328 VanDerWaalsContact C-N 3.29Å; W326-A328 PolarHBondContact O-N 2.94Å; W326-V329 WeakPolarHBondContact O-CB 3.45Å; W326-V329 PolarHBondContact O-N 3.31Å; W326-E330 VanDerWaalsContact CZ3-OE2 3.29Å; W326-E330 WeakPolarHBondContact CZ3-OE2 3.38Å; W326-E330 VanDerWaalsContact O-CB 3.32Å; W326-E330 WeakPolarHBondContact O-CB 3.47Å; W326-E330 PolarHBondContact O-N 3.28Å; W326-L376 HydrophobicContact CB-CD1 4.37Å; W326-L376 HydrophobicContact CE3-CD1 3.92Å; W326-M379 HydrophobicContact CB-CB 3.9Å; W326-M379 HydrophobicContact CB-CG 4.26Å; W326-M379 HydrophobicContact CD2-CB 3.94Å; W326-M379 HydrophobicContact CG-CB 3.53Å; W326-M379 HydrophobicContact CG-CG 4.12Å; W326-K380 HydrophobicContact CE3-CB 4.43Å; W326-K380 HydrophobicContact CZ3-CB 4.15Å; W326-K380 HydrophobicContact CZ3-CG 4.27Å
327K91.1Very high94Very high53 Ų5320.3 Ų20.323%0.2310%0.101CC..Hα-helixtrans-68.7-21.8176.8-63.7-172.6177.3-173.90114.1G325 R331 S413G325-K327 VanDerWaalsContact C-N 3.26Å; G325-K327 PolarHBondContact O-N 3.15Å; G325-K327 VanDerWaalsContact O-N 3.09Å; K327-R331 WeakPolarHBondContact O-CB 3.45Å; K327-R331 WeakPolarHBondContact O-CD 3.44Å; K327-R331 VanDerWaalsContact O-CG 3.24Å; K327-R331 WeakPolarHBondContact O-CG 3.44Å; K327-R331 PolarHBondContact O-N 3.48Å; K327-S413 PolarHBondContact NZ-OG 3.45Å
328A93.6Very high93.6Very high1 Ų123.2 Ų23.21%0.00812%0.121CC..Hα-helixtrans-77.6-45.1171.600000110.4L297 L321 L324 G325 W326 E330 R331 V332L297-A328 HydrophobicContact CD2-CB 3.71Å; L321-A328 HydrophobicContact CD2-CB 4.03Å; L324-A328 HydrophobicContact CB-CB 3.97Å; G325-A328 WeakPolarHBondContact O-CB 3.39Å; G325-A328 PolarHBondContact O-N 3.43Å; W326-A328 VanDerWaalsContact C-N 3.29Å; W326-A328 PolarHBondContact O-N 2.94Å; A328-E330 VanDerWaalsContact C-N 3.31Å; A328-E330 PolarHBondContact O-N 3.23Å; A328-R331 PolarHBondContact O-N 3.45Å; A328-V332 WeakPolarHBondContact O-CB 3.33Å; A328-V332 PolarHBondContact O-N 2.98Å
329V94.9Very high93.3Very high3 Ų326.5 Ų26.52%0.01815%0.148CC..Iπ-helixtrans-57.5-44.5172.6-174.90000111.1L321 G325 W326 R331 L333 F334 A372 L376L321-V329 HydrophobicContact CB-CG2 4.29Å; G325-V329 PolarHBondContact O-N 3.42Å; W326-V329 WeakPolarHBondContact O-CB 3.45Å; W326-V329 PolarHBondContact O-N 3.31Å; V329-R331 PolarHBondContact O-N 3.21Å; V329-L333 HydrophobicContact CG1-CB 3.96Å; V329-L333 HydrophobicContact CG1-CD2 3.86Å; V329-L333 HydrophobicContact CG1-CG 4.47Å; V329-L333 WeakPolarHBondContact O-CA 3.48Å; V329-L333 WeakPolarHBondContact O-CB 3.48Å; V329-L333 PolarHBondContact O-N 3.3Å; V329-F334 PolarHBondContact O-N 2.99Å; V329-A372 HydrophobicContact CG1-CB 4.05Å; V329-A372 HydrophobicContact CG2-CB 4.28Å; V329-L376 HydrophobicContact CG1-CB 4.3Å; V329-L376 HydrophobicContact CG1-CD2 4.19Å
330E92.9Very high93.1Very high16 Ų1626.2 Ų26.28%0.07515%0.145CC..Iπ-helixtrans-63.7-40.1-179.1-163.4-178-158.700113.4W326 A328 P335 L376 K380 W442 M450W326-E330 VanDerWaalsContact CZ3-OE2 3.29Å; W326-E330 WeakPolarHBondContact CZ3-OE2 3.38Å; W326-E330 VanDerWaalsContact O-CB 3.32Å; W326-E330 WeakPolarHBondContact O-CB 3.47Å; W326-E330 PolarHBondContact O-N 3.28Å; A328-E330 VanDerWaalsContact C-N 3.31Å; A328-E330 PolarHBondContact O-N 3.23Å; E330-P335 WeakPolarHBondContact O-CD 3.47Å; E330-L376 HydrophobicContact CB-CD1 3.68Å; E330-L376 HydrophobicContact CB-CD2 4.41Å; E330-L376 HydrophobicContact CG-CD1 3.9Å; E330-K380 WeakPolarHBondContact OE1-CD 3.34Å; E330-K380 VanDerWaalsContact OE1-CE 3.23Å; E330-K380 WeakPolarHBondContact OE1-CE 3.47Å; E330-K380 IonicContact OE1-NZ 3.3Å; E330-K380 PolarHBondContact OE1-NZ 3.16Å; E330-W442 HydrophobicContact CG-CH2 3.49Å; E330-W442 VanDerWaalsContact CG-CH2 3.49Å; E330-W442 HydrophobicContact CG-CZ2 4.2Å; E330-W442 HydrophobicContact CG-CZ3 4.13Å; E330-M450 HydrophobicContact CG-CE 4.1Å
331R91Very high92.9Very high94 Ų9427.7 Ų27.736%0.35515%0.151SC..Iπ-helixtrans-86.4-30.3-176.7-69171.3-179.3-178.7-2113.7K327 A328 V329 W439 W442K327-R331 WeakPolarHBondContact O-CB 3.45Å; K327-R331 WeakPolarHBondContact O-CD 3.44Å; K327-R331 VanDerWaalsContact O-CG 3.24Å; K327-R331 WeakPolarHBondContact O-CG 3.44Å; K327-R331 PolarHBondContact O-N 3.48Å; A328-R331 PolarHBondContact O-N 3.45Å; V329-R331 PolarHBondContact O-N 3.21Å; R331-W439 HydrophobicContact CB-CH2 4.47Å; R331-W442 HydrophobicContact CG-CE3 4.29Å
332V93.5Very high92.6Very high1 Ų130.6 Ų30.61%0.00618%0.175CC..Iπ-helixtrans-110.5-55.4-173.2-178.10000111.8L297 Q301 L304 L321 A328 H336L297-V332 HydrophobicContact CB-CG2 4.26Å; L297-V332 HydrophobicContact CD1-CG2 4.35Å; L297-V332 HydrophobicContact CD2-CG2 4.03Å; L297-V332 HydrophobicContact CG-CG2 4.44Å; Q301-V332 HydrophobicContact CB-CG1 3.63Å; Q301-V332 HydrophobicContact CG-CG1 4Å; L304-V332 HydrophobicContact CD1-CG1 4.34Å; L321-V332 HydrophobicContact CD1-CB 3.93Å; L321-V332 HydrophobicContact CD1-CG1 3.73Å; L321-V332 HydrophobicContact CD2-CB 3.83Å; L321-V332 HydrophobicContact CD2-CG1 4.07Å; L321-V332 HydrophobicContact CD2-CG2 4.13Å; A328-V332 WeakPolarHBondContact O-CB 3.33Å; A328-V332 PolarHBondContact O-N 2.98Å; V332-H336 PolarHBondContact O-ND1 3.03Å
333L93.7Very high92.3Very high3 Ų331.6 Ų31.62%0.01618%0.182CC..Iπ-helixtrans-69.7-48.9-174.7-173.662.1000111.3L304 V318 L321 V329 H336 L337 I369 A372L304-L333 HydrophobicContact CD1-CD1 3.77Å; L304-L333 HydrophobicContact CD2-CD1 4.44Å; V318-L333 HydrophobicContact CG1-CD2 4.2Å; V318-L333 HydrophobicContact CG2-CD1 4.1Å; L321-L333 HydrophobicContact CD1-CB 4.04Å; V329-L333 HydrophobicContact CG1-CB 3.96Å; V329-L333 HydrophobicContact CG1-CD2 3.86Å; V329-L333 HydrophobicContact CG1-CG 4.47Å; V329-L333 WeakPolarHBondContact O-CA 3.48Å; V329-L333 WeakPolarHBondContact O-CB 3.48Å; V329-L333 PolarHBondContact O-N 3.3Å; L333-H336 PolarHBondContact O-N 3.47Å; L333-L337 WeakPolarHBondContact O-CB 3.29Å; L333-L337 PolarHBondContact O-N 2.95Å; L333-I369 HydrophobicContact CD2-CG2 4.2Å; L333-A372 HydrophobicContact CD2-CB 4.05Å
334F93.1Very high92.2Very high10 Ų1030.9 Ų30.94%0.04418%0.176CC..Hα-helixtrans-59-49.6-173.7174.1-97.7000113.7V329 H336 L337 L376 W442 V445 M450 E453 L454V329-F334 PolarHBondContact O-N 2.99Å; F334-H336 VanDerWaalsContact C-N 3.28Å; F334-H336 PolarHBondContact O-N 3.36Å; F334-L337 WeakPolarHBondContact O-CB 3.45Å; F334-L337 PolarHBondContact O-N 3.41Å; F334-L376 HydrophobicContact CB-CD2 4.48Å; F334-W442 HydrophobicContact CD1-CZ2 4.44Å; F334-V445 HydrophobicContact CE1-CB 4.34Å; F334-V445 HydrophobicContact CE1-CG2 4.05Å; F334-V445 HydrophobicContact CZ-CG1 4.49Å; F334-M450 HydrophobicContact CD1-CE 3.61Å; F334-M450 HydrophobicContact CD2-CE 3.91Å; F334-M450 HydrophobicContact CD2-CG 4.27Å; F334-M450 HydrophobicContact CE1-CE 3.59Å; F334-M450 HydrophobicContact CE2-CB 4.34Å; F334-M450 HydrophobicContact CE2-CE 3.89Å; F334-M450 HydrophobicContact CE2-CG 3.76Å; F334-M450 HydrophobicContact CG-CE 3.78Å; F334-M450 HydrophobicContact CZ-CB 4.28Å; F334-M450 HydrophobicContact CZ-CE 3.73Å; F334-M450 HydrophobicContact CZ-CG 4.09Å; F334-E453 VanDerWaalsContact CZ-OE2 3.23Å; F334-E453 WeakPolarHBondContact CZ-OE2 3.34Å; F334-L454 HydrophobicContact CD2-CD1 4.17Å; F334-L454 HydrophobicContact CD2-CD2 4.12Å; F334-L454 HydrophobicContact CD2-CG 4.25Å; F334-L454 HydrophobicContact CE2-CD1 4.17Å; F334-L454 HydrophobicContact CE2-CD2 4.37Å; F334-L454 HydrophobicContact CE2-CG 4.09Å
335P91.8Very high92.1Very high51 Ų5134.5 Ų34.533%0.33119%0.193SC..Hα-helixtrans-67.5-24.2-179.4-22.736.2000114.7E330E330-P335 WeakPolarHBondContact O-CD 3.47Å
336H90.7Very high92.1Very high50 Ų5037.2 Ų37.223%0.23121%0.214CC..Hα-helixtrans-93.1-10.4178.3-61.680.5000112.6Q301 V332 L333 F334 S338 A339 Y340Q301-H336 PolarHBondContact NE2-CE1 3.44Å; Q301-H336 PolarHBondContact NE2-NE2 2.95Å; V332-H336 PolarHBondContact O-ND1 3.03Å; L333-H336 PolarHBondContact O-N 3.47Å; F334-H336 VanDerWaalsContact C-N 3.28Å; F334-H336 PolarHBondContact O-N 3.36Å; H336-S338 PolarHBondContact O-N 3.42Å; H336-A339 PolarHBondContact O-N 3.36Å; H336-Y340 WeakPolarHBondContact O-CB 3.45Å; H336-Y340 PolarHBondContact O-N 3.28Å
337L91.8Very high92Very high1 Ų137.7 Ų37.71%0.00522%0.22CC..Hα-helixtrans-64.2-39-171.8-178.161.7000112.2L333 F334 A339 Y340 W341 I369 L454 F457 F458L333-L337 WeakPolarHBondContact O-CB 3.29Å; L333-L337 PolarHBondContact O-N 2.95Å; F334-L337 WeakPolarHBondContact O-CB 3.45Å; F334-L337 PolarHBondContact O-N 3.41Å; L337-A339 PolarHBondContact O-N 3.24Å; L337-Y340 PolarHBondContact O-N 3.31Å; L337-W341 WeakPolarHBondContact O-CA 3.49Å; L337-W341 WeakPolarHBondContact O-CB 3.43Å; L337-W341 PolarHBondContact O-N 2.93Å; L337-I369 HydrophobicContact CD1-CD1 4.42Å; L337-I369 HydrophobicContact CD1-CG2 3.93Å; L337-L454 HydrophobicContact CD2-CD2 3.49Å; L337-L454 VanDerWaalsContact CD2-CD2 3.49Å; L337-F457 HydrophobicContact CD2-CD2 3.84Å; L337-F457 HydrophobicContact CD2-CE2 4.15Å; L337-F457 HydrophobicContact CG-CD2 4.15Å; L337-F457 HydrophobicContact CG-CE2 4.22Å; L337-F458 HydrophobicContact CD1-CZ 4.41Å; L337-F458 HydrophobicContact CD2-CE2 3.92Å; L337-F458 HydrophobicContact CD2-CZ 4.15Å
338S89.9Confident92.1Very high61 Ų6136.1 Ų36.143%0.42721%0.214SC..Hα-helixtrans-60.5-43.9179.354.40000112.7H336H336-S338 PolarHBondContact O-N 3.42Å
339A90.8Very high92Very high69 Ų6940.1 Ų40.157%0.5724%0.236SC*.Hα-helixtrans-72.9-37.1175.800000112.6H336 L337 N343H336-A339 PolarHBondContact O-N 3.36Å; L337-A339 PolarHBondContact O-N 3.24Å; A339-N343 PolarHBondContact O-ND2 2.91Å
340Y92.2Very high91.7Very high13 Ų1342.4 Ų42.45%0.05125%0.248CC..Hα-helixtrans-70.7-35.2177.5-171.9-103.5000112.5H314 H336 L337 A342 N343 L344 V365 I369H314-Y340 VanDerWaalsContact CB-OH 3.26Å; H314-Y340 WeakPolarHBondContact CB-OH 3.4Å; H314-Y340 PolarHBondContact CD2-OH 3.4Å; H314-Y340 AromaticContact CE1-CE2 3.64Å; H314-Y340 AromaticContact CG-CE2 3.89Å; H314-Y340 AromaticContact CG-CZ 3.9Å; H314-Y340 VanDerWaalsContact CG-OH 3.24Å; H314-Y340 AromaticContact ND1-CE2 3.53Å; H314-Y340 AromaticContact ND1-CZ 3.99Å; H336-Y340 WeakPolarHBondContact O-CB 3.45Å; H336-Y340 PolarHBondContact O-N 3.28Å; L337-Y340 PolarHBondContact O-N 3.31Å; Y340-A342 PolarHBondContact O-N 3.19Å; Y340-N343 PolarHBondContact O-N 3.38Å; Y340-L344 HydrophobicContact CD1-CB 4.44Å; Y340-L344 HydrophobicContact CE1-CB 4.11Å; Y340-L344 HydrophobicContact CE1-CD2 4.17Å; Y340-L344 PolarHBondContact O-N 2.94Å; Y340-V365 HydrophobicContact CE1-CG1 4.01Å; Y340-I369 HydrophobicContact CD1-CD1 4.1Å; Y340-I369 HydrophobicContact CE1-CD1 3.9Å
341W92.6Very high91.3Very high31 Ų3150.6 Ų50.612%0.11728%0.279CS..Hα-helixtrans-59.8-44.1-175.5177.7-97.5000112.5L337 N343 L344 Q345 Y366 F457 F458L337-W341 WeakPolarHBondContact O-CA 3.49Å; L337-W341 WeakPolarHBondContact O-CB 3.43Å; L337-W341 PolarHBondContact O-N 2.93Å; W341-N343 VanDerWaalsContact C-N 3.27Å; W341-N343 PolarHBondContact O-N 2.89Å; W341-L344 HydrophobicContact CE3-CD2 4.45Å; W341-L344 HydrophobicContact CZ3-CD2 4.3Å; W341-L344 PolarHBondContact O-N 2.99Å; W341-Q345 HydrophobicContact CZ2-CB 4.27Å; W341-Q345 VanDerWaalsContact O-CB 3.3Å; W341-Q345 WeakPolarHBondContact O-CB 3.36Å; W341-Q345 PolarHBondContact O-N 2.66Å; W341-Y366 AromaticContact CH2-CD2 3.95Å; W341-Y366 HydrophobicContact CH2-CD2 3.95Å; W341-Y366 AromaticContact CH2-CE2 3.75Å; W341-Y366 HydrophobicContact CH2-CE2 3.75Å; W341-Y366 AromaticContact CZ3-CD2 3.84Å; W341-Y366 HydrophobicContact CZ3-CD2 3.84Å; W341-Y366 AromaticContact CZ3-CE2 3.94Å; W341-Y366 HydrophobicContact CZ3-CE2 3.94Å; W341-F457 HydrophobicContact CB-CD1 4.04Å; W341-F457 HydrophobicContact CB-CE1 4.24Å; W341-F457 AromaticContact CD1-CD1 3.55Å; W341-F457 HydrophobicContact CD2-CB 3.89Å; W341-F457 HydrophobicContact CD2-CD1 4.03Å; W341-F457 HydrophobicContact CD2-CG 4.21Å; W341-F457 HydrophobicContact CE3-CB 4.07Å; W341-F457 HydrophobicContact CG-CB 4.32Å; W341-F457 AromaticContact CG-CD1 3.54Å; W341-F457 HydrophobicContact CG-CD1 3.54Å; W341-F457 HydrophobicContact CG-CE1 4.15Å; W341-F457 HydrophobicContact CG-CG 4.11Å; W341-F457 WeakPolarHBondContact CH2-O 3.15Å; W341-F457 WeakPolarHBondContact CZ2-O 3.49Å; W341-F457 HydrophobicContact CZ3-CB 4.48Å; W341-F458 HydrophobicContact CE3-CE1 4.28Å; W341-F458 HydrophobicContact CE3-CZ 4.46Å; W341-F458 HydrophobicContact CZ3-CD1 4.22Å; W341-F458 AromaticContact CZ3-CE1 3.7Å; W341-F458 HydrophobicContact CZ3-CE1 3.7Å; W341-F458 HydrophobicContact CZ3-CZ 4.32Å
342A90.4Very high91.2Very high62 Ų6248.1 Ų48.151%0.51228%0.276SS..Hα-helixtrans-58.2-39.7179.200000112.5Y340 A346Y340-A342 PolarHBondContact O-N 3.19Å; A342-A346 PolarHBondContact O-N 2.81Å
343N91.1Very high90.6Very high83 Ų8354.6 Ų54.644%0.44432%0.316SS..Hα-helixtrans-71.8-42.9177.6-60.5-39.9000111.6A339 Y340 W341 A346 V347A339-N343 PolarHBondContact O-ND2 2.91Å; Y340-N343 PolarHBondContact O-N 3.38Å; W341-N343 VanDerWaalsContact C-N 3.27Å; W341-N343 PolarHBondContact O-N 2.89Å; N343-A346 PolarHBondContact O-N 3.37Å; N343-V347 PolarHBondContact O-N 2.86Å
344L92.6Very high90Very high2 Ų259.2 Ų59.21%0.0135%0.348CS..Hα-helixtrans-64.7-42.8177-178.164000111.4Y340 W341 A346 V347 L348 V365 I369Y340-L344 HydrophobicContact CD1-CB 4.44Å; Y340-L344 HydrophobicContact CE1-CB 4.11Å; Y340-L344 HydrophobicContact CE1-CD2 4.17Å; Y340-L344 PolarHBondContact O-N 2.94Å; W341-L344 HydrophobicContact CE3-CD2 4.45Å; W341-L344 HydrophobicContact CZ3-CD2 4.3Å; W341-L344 PolarHBondContact O-N 2.99Å; L344-A346 PolarHBondContact O-N 2.97Å; L344-V347 WeakPolarHBondContact O-CB 3.39Å; L344-V347 PolarHBondContact O-N 3.11Å; L344-V347 VanDerWaalsContact O-N 3.16Å; L344-L348 HydrophobicContact CG-CD1 4.08Å; L344-L348 HydrophobicContact CG-CG 4.42Å; L344-L348 WeakPolarHBondContact O-CG 3.3Å; L344-L348 PolarHBondContact O-N 3.16Å; L344-V365 HydrophobicContact CD1-CB 4.26Å; L344-V365 HydrophobicContact CD1-CG1 4.24Å; L344-V365 HydrophobicContact CD2-CG1 4.3Å; L344-I369 HydrophobicContact CD2-CD1 4.04Å
345Q92.3Very high89.8Confident80 Ų8061.9 Ų61.937%0.37436%0.363SS..Hα-helixtrans-61.4-43.1178.1179.8171-8.100111.3W341 V347 L348 D349W341-Q345 HydrophobicContact CZ2-CB 4.27Å; W341-Q345 VanDerWaalsContact O-CB 3.3Å; W341-Q345 WeakPolarHBondContact O-CB 3.36Å; W341-Q345 PolarHBondContact O-N 2.66Å; Q345-V347 PolarHBondContact O-N 3.22Å; Q345-L348 CarbonylContact O-C 3.55Å; Q345-L348 PolarHBondContact O-N 3.4Å; Q345-D349 WeakPolarHBondContact CG-OD2 3.12Å; Q345-D349 PolarHBondContact NE2-OD2 3.42Å; Q345-D349 WeakPolarHBondContact O-CB 3.28Å; Q345-D349 PolarHBondContact O-N 2.97Å
346A91.6Very high89.7Confident68 Ų6862.1 Ų62.156%0.56237%0.369SS*.Hα-helixtrans-58.2-32.9175.900000113.3A342 N343 L344 D350A342-A346 PolarHBondContact O-N 2.81Å; N343-A346 PolarHBondContact O-N 3.37Å; L344-A346 PolarHBondContact O-N 2.97Å; A346-D350 PolarHBondContact O-N 3.41Å
347V91.2Very high89.6Confident39 Ų3964.1 Ų64.124%0.23638%0.379CS..Hα-helixtrans-74.6-36.4173.1173.70000112.1L311 N343 L344 Q345 V358L311-V347 HydrophobicContact CD1-CG1 4.09Å; N343-V347 PolarHBondContact O-N 2.86Å; L344-V347 WeakPolarHBondContact O-CB 3.39Å; L344-V347 PolarHBondContact O-N 3.11Å; L344-V347 VanDerWaalsContact O-N 3.16Å; Q345-V347 PolarHBondContact O-N 3.22Å; V347-V358 HydrophobicContact CG1-CG1 3.95Å
348L91.6Very high89.5Confident20 Ų2067.1 Ų67.111%0.10540%0.397CS..Hα-helixtrans-74.4-27.7178.2-65.9176.5000113L344 Q345 K359 Y366L344-L348 HydrophobicContact CG-CD1 4.08Å; L344-L348 HydrophobicContact CG-CG 4.42Å; L344-L348 WeakPolarHBondContact O-CG 3.3Å; L344-L348 PolarHBondContact O-N 3.16Å; Q345-L348 CarbonylContact O-C 3.55Å; Q345-L348 PolarHBondContact O-N 3.4Å; L348-K359 VanDerWaalsContact O-CE 3.26Å; L348-K359 WeakPolarHBondContact O-CE 3.26Å; L348-K359 PolarHBondContact O-NZ 3.1Å; L348-Y366 HydrophobicContact CD1-CD2 3.99Å; L348-Y366 HydrophobicContact CD1-CG 4.34Å
349D91.8Very high89.6Confident86 Ų8666 Ų6646%0.4638%0.384SS..SBendtrans-90.7-3.3178.2-70.9-24.8000112.9Q345 Y351Q345-D349 WeakPolarHBondContact CG-OD2 3.12Å; Q345-D349 PolarHBondContact NE2-OD2 3.42Å; Q345-D349 WeakPolarHBondContact O-CB 3.28Å; Q345-D349 PolarHBondContact O-N 2.97Å; D349-Y351 WeakPolarHBondContact O-CD2 3.43Å; D349-Y351 VanDerWaalsContact O-CE2 3.23Å; D349-Y351 WeakPolarHBondContact O-CE2 3.49Å
350D89.7Confident89.6Confident50 Ų5064.9 Ų64.927%0.26738%0.375SS..  trans-76.6122.2171.7-174.2-4.6000111.1A346 S352 N355 K359A346-D350 PolarHBondContact O-N 3.41Å; D350-S352 VanDerWaalsContact CG-OG 3.3Å; D350-S352 WeakPolarHBondContact OD1-CB 3.15Å; D350-S352 PolarHBondContact OD1-N 2.93Å; D350-S352 PolarHBondContact OD1-OG 3.09Å; D350-S352 PolarHBondContact OD2-OG 3.19Å; D350-N355 WeakPolarHBondContact OD2-CB 3.48Å; D350-N355 PolarHBondContact OD2-ND2 2.98Å; D350-K359 WeakPolarHBondContact O-CD 3.29Å; D350-K359 PolarHBondContact O-NZ 2.94Å
351Y84.4Confident89.7Confident189 Ų18965.8 Ų65.874%0.74138%0.381SS*.  trans-107.411.6178.4-66.5-87.4000113.5D349D349-Y351 WeakPolarHBondContact O-CD2 3.43Å; D349-Y351 VanDerWaalsContact O-CE2 3.23Å; D349-Y351 WeakPolarHBondContact O-CE2 3.49Å
352S88.4Confident89.7Confident42 Ų4264.3 Ų64.329%0.29438%0.375SS..  trans-68.9132.3176.766.60000111.9D350 S354 N355D350-S352 VanDerWaalsContact CG-OG 3.3Å; D350-S352 WeakPolarHBondContact OD1-CB 3.15Å; D350-S352 PolarHBondContact OD1-N 2.93Å; D350-S352 PolarHBondContact OD1-OG 3.09Å; D350-S352 PolarHBondContact OD2-OG 3.19Å; S352-S354 PolarHBondContact O-N 3.34Å; S352-S354 PolarHBondContact OG-OG 3.17Å; S352-N355 PolarHBondContact O-N 3.32Å; S352-N355 WeakPolarHBondContact OG-CB 3.45Å; S352-N355 PolarHBondContact OG-ND2 3.04Å
353V80.4Confident89.9Confident137 Ų13766.1 Ų66.183%0.8337%0.373SS*.G310 helixtrans-62.4-30.2-178.4-177.70000111.7N355 A356V353-N355 VanDerWaalsContact C-N 3.28Å; V353-N355 PolarHBondContact O-N 3.23Å; V353-A356 WeakPolarHBondContact O-CB 3.3Å; V353-A356 PolarHBondContact O-N 3.29Å
354S82.7Confident90.1Very high100 Ų10066.5 Ų66.570%0.69937%0.37SS*.G310 helixtrans-60.3-33.3174.242.70000113.7S352S352-S354 PolarHBondContact O-N 3.34Å; S352-S354 PolarHBondContact OG-OG 3.17Å
355N87.9Confident90.3Very high66 Ų6666.4 Ų66.435%0.35337%0.37SS..G310 helixtrans-102.811.4-173.2-63.8-9.4000112.8D350 S352 V353 Q357 V358 K359D350-N355 WeakPolarHBondContact OD2-CB 3.48Å; D350-N355 PolarHBondContact OD2-ND2 2.98Å; S352-N355 PolarHBondContact O-N 3.32Å; S352-N355 WeakPolarHBondContact OG-CB 3.45Å; S352-N355 PolarHBondContact OG-ND2 3.04Å; V353-N355 VanDerWaalsContact C-N 3.28Å; V353-N355 PolarHBondContact O-N 3.23Å; N355-Q357 VanDerWaalsContact C-N 3.28Å; N355-Q357 PolarHBondContact O-N 3.43Å; N355-V358 WeakPolarHBondContact O-CA 3.49Å; N355-V358 WeakPolarHBondContact O-CB 3.26Å; N355-V358 PolarHBondContact O-N 3.43Å; N355-K359 PolarHBondContact O-N 3.27Å
356A88.9Confident90.5Very high56 Ų5664.6 Ų64.646%0.46336%0.36SS..Hα-helixtrans-55.2-36.8-177.300000114.1V353 A360V353-A356 WeakPolarHBondContact O-CB 3.3Å; V353-A356 PolarHBondContact O-N 3.29Å; A356-A360 PolarHBondContact O-N 3.29Å
357Q88.6Confident90.6Very high92 Ų9262.9 Ų62.943%0.4335%0.349SS..Hα-helixtrans-66.5-45.2173.5-177.363.248.600111.7N355 K359 A360 D361N355-Q357 VanDerWaalsContact C-N 3.28Å; N355-Q357 PolarHBondContact O-N 3.43Å; Q357-K359 VanDerWaalsContact C-N 3.28Å; Q357-K359 PolarHBondContact O-N 2.96Å; Q357-A360 WeakPolarHBondContact O-CB 3.31Å; Q357-A360 PolarHBondContact O-N 3Å; Q357-A360 VanDerWaalsContact O-N 3.1Å; Q357-D361 PolarHBondContact NE2-OD1 3.12Å; Q357-D361 PolarHBondContact O-N 2.68Å
358V90.9Very high90.9Very high64 Ų6461.7 Ų61.739%0.38834%0.343SS..Hα-helixtrans-62.9-38.1179.4-1700000110.5L311 V347 N355 D361 G362L311-V358 HydrophobicContact CD1-CG1 3.65Å; L311-V358 VanDerWaalsContact CD1-O 3.27Å; L311-V358 WeakPolarHBondContact CD1-O 3.33Å; V347-V358 HydrophobicContact CG1-CG1 3.95Å; N355-V358 WeakPolarHBondContact O-CA 3.49Å; N355-V358 WeakPolarHBondContact O-CB 3.26Å; N355-V358 PolarHBondContact O-N 3.43Å; V358-D361 PolarHBondContact O-N 3.15Å; V358-G362 PolarHBondContact O-N 3.43Å
359K91.6Very high91.1Very high37 Ų3760.7 Ų60.716%0.16134%0.338CS..Hα-helixtrans-62.9-43.3172.1-164.4-170.6-172.5102.10112.1L348 D350 N355 Q357 G362 H363L348-K359 VanDerWaalsContact O-CE 3.26Å; L348-K359 WeakPolarHBondContact O-CE 3.26Å; L348-K359 PolarHBondContact O-NZ 3.1Å; D350-K359 WeakPolarHBondContact O-CD 3.29Å; D350-K359 PolarHBondContact O-NZ 2.94Å; N355-K359 PolarHBondContact O-N 3.27Å; Q357-K359 VanDerWaalsContact C-N 3.28Å; Q357-K359 PolarHBondContact O-N 2.96Å; K359-G362 PolarHBondContact O-N 3.17Å; K359-H363 PolarHBondContact O-CD2 3.24Å; K359-H363 PolarHBondContact O-N 3.08Å
360A91.5Very high91.2Very high46 Ų4656.9 Ų56.938%0.3832%0.317SS..Hα-helixtrans-63.6-42.5176.800000112.2A356 Q357 G362 H363 K364A356-A360 PolarHBondContact O-N 3.29Å; Q357-A360 WeakPolarHBondContact O-CB 3.31Å; Q357-A360 PolarHBondContact O-N 3Å; Q357-A360 VanDerWaalsContact O-N 3.1Å; A360-G362 VanDerWaalsContact C-N 3.32Å; A360-H363 PolarHBondContact O-N 3.04Å; A360-K364 PolarHBondContact O-N 3.5Å; A360-K364 VanDerWaalsContact O-N 3.12Å
361D92.6Very high91.5Very high32 Ų3257.6 Ų57.617%0.17132%0.323CS..Hα-helixtrans-64.9-36.8173.4-63.3-5.6000111.2W268 L311 Q357 V358 K364 V365W268-D361 HydrophobicContact CH2-CB 3.99Å; W268-D361 HydrophobicContact CZ2-CB 4.26Å; W268-D361 WeakPolarHBondContact CZ2-OD1 3.35Å; L311-D361 HydrophobicContact CB-CB 3.97Å; L311-D361 HydrophobicContact CD1-CB 4.02Å; Q357-D361 PolarHBondContact NE2-OD1 3.12Å; Q357-D361 PolarHBondContact O-N 2.68Å; V358-D361 PolarHBondContact O-N 3.15Å; D361-K364 WeakPolarHBondContact O-CB 3.3Å; D361-K364 PolarHBondContact O-N 2.92Å; D361-K364 VanDerWaalsContact O-N 3.17Å; D361-V365 PolarHBondContact O-N 3.2Å; D361-V365 VanDerWaalsContact O-N 3.08Å
362G94.4Very high92Very high0 Ų048.6 Ų48.60%029%0.288CS..Hα-helixtrans-60.8-42.4172.200000112.4V358 K359 A360 K364 V365 Y366V358-G362 PolarHBondContact O-N 3.43Å; K359-G362 PolarHBondContact O-N 3.17Å; A360-G362 VanDerWaalsContact C-N 3.32Å; G362-K364 VanDerWaalsContact C-N 3.31Å; G362-K364 PolarHBondContact O-N 2.76Å; G362-V365 PolarHBondContact O-N 3Å; G362-Y366 WeakPolarHBondContact O-CB 3.37Å; G362-Y366 PolarHBondContact O-N 3.4Å
363H94.6Very high92.3Very high100 Ų10046.7 Ų46.746%0.46328%0.275SS..Hα-helixtrans-64.7-31.8173.6-74.8-65.1000112.9K359 A360 G367K359-H363 PolarHBondContact O-CD2 3.24Å; K359-H363 PolarHBondContact O-N 3.08Å; A360-H363 PolarHBondContact O-N 3.04Å; H363-G367 PolarHBondContact O-N 3.28Å
364K95Very high92.9Very high90 Ų9042 Ų4239%0.39124%0.244SC..Hα-helixtrans-63.3-47.3171-66.4-90.4-171.2158.30111.1W268 Y315 A360 D361 G362 G367 A368W268-K364 HydrophobicContact CD2-CD 4.02Å; W268-K364 HydrophobicContact CD2-CG 4.26Å; W268-K364 HydrophobicContact CE3-CB 4.1Å; W268-K364 HydrophobicContact CE3-CD 4.28Å; W268-K364 HydrophobicContact CE3-CG 4.29Å; W268-K364 HydrophobicContact CG-CD 4.31Å; W268-K364 HydrophobicContact CH2-CB 4.02Å; W268-K364 HydrophobicContact CH2-CG 4.16Å; W268-K364 HydrophobicContact CZ2-CB 4.48Å; W268-K364 HydrophobicContact CZ2-CG 4.11Å; W268-K364 HydrophobicContact CZ3-CB 3.81Å; W268-K364 HydrophobicContact CZ3-CG 4.24Å; Y315-K364 HydrophobicContact CD2-CB 4.07Å; Y315-K364 HydrophobicContact CE2-CB 4.23Å; A360-K364 PolarHBondContact O-N 3.5Å; A360-K364 VanDerWaalsContact O-N 3.12Å; D361-K364 WeakPolarHBondContact O-CB 3.3Å; D361-K364 PolarHBondContact O-N 2.92Å; D361-K364 VanDerWaalsContact O-N 3.17Å; G362-K364 VanDerWaalsContact C-N 3.31Å; G362-K364 PolarHBondContact O-N 2.76Å; K364-G367 PolarHBondContact O-N 3.44Å; K364-A368 PolarHBondContact O-N 3.4Å
365V96.2Very high93.3Very high0 Ų043.4 Ų43.40%023%0.234CC..Hα-helixtrans-61.1-48.4176.4177.70000111.1L311 H314 Y340 L344 D361 G362 G367 A368 I369L311-V365 HydrophobicContact CB-CG2 4.06Å; L311-V365 HydrophobicContact CD2-CG2 4.28Å; L311-V365 VanDerWaalsContact O-CG2 3.3Å; L311-V365 WeakPolarHBondContact O-CG2 3.43Å; H314-V365 HydrophobicContact CB-CG2 4.44Å; Y340-V365 HydrophobicContact CE1-CG1 4.01Å; L344-V365 HydrophobicContact CD1-CB 4.26Å; L344-V365 HydrophobicContact CD1-CG1 4.24Å; L344-V365 HydrophobicContact CD2-CG1 4.3Å; D361-V365 PolarHBondContact O-N 3.2Å; D361-V365 VanDerWaalsContact O-N 3.08Å; G362-V365 PolarHBondContact O-N 3Å; V365-G367 VanDerWaalsContact C-N 3.33Å; V365-G367 PolarHBondContact O-N 3.15Å; V365-A368 PolarHBondContact O-N 3.49Å; V365-I369 HydrophobicContact CG1-CD1 3.81Å; V365-I369 HydrophobicContact CG1-CG1 4.36Å; V365-I369 WeakPolarHBondContact O-CG1 3.43Å; V365-I369 PolarHBondContact O-N 3.47Å
366Y96Very high93.6Very high43 Ų4340.3 Ų40.317%0.16922%0.217CC..Hα-helixtrans-53.8-47.6175.8174.5-92.1000112.1W341 L348 G362 A368 I369 L370 F458 S461W341-Y366 AromaticContact CH2-CD2 3.95Å; W341-Y366 HydrophobicContact CH2-CD2 3.95Å; W341-Y366 AromaticContact CH2-CE2 3.75Å; W341-Y366 HydrophobicContact CH2-CE2 3.75Å; W341-Y366 AromaticContact CZ3-CD2 3.84Å; W341-Y366 HydrophobicContact CZ3-CD2 3.84Å; W341-Y366 AromaticContact CZ3-CE2 3.94Å; W341-Y366 HydrophobicContact CZ3-CE2 3.94Å; L348-Y366 HydrophobicContact CD1-CD2 3.99Å; L348-Y366 HydrophobicContact CD1-CG 4.34Å; G362-Y366 WeakPolarHBondContact O-CB 3.37Å; G362-Y366 PolarHBondContact O-N 3.4Å; Y366-A368 PolarHBondContact O-N 3.39Å; Y366-I369 PolarHBondContact O-N 2.97Å; Y366-L370 WeakPolarHBondContact O-CB 3.44Å; Y366-L370 PolarHBondContact O-N 2.79Å; Y366-F458 HydrophobicContact CD2-CD1 4.34Å; Y366-F458 HydrophobicContact CD2-CE1 4.19Å; Y366-F458 AromaticContact CE2-CD1 3.61Å; Y366-F458 HydrophobicContact CE2-CD1 3.61Å; Y366-F458 AromaticContact CE2-CE1 3.92Å; Y366-F458 HydrophobicContact CE2-CE1 3.92Å; Y366-S461 WeakPolarHBondContact OH-CB 3.45Å; Y366-S461 PolarHBondContact OH-OG 3.01Å
367G95.1Very high93.8Very high31 Ų3138 Ų3832%0.3220%0.197SC..Hα-helixtrans-61.4-42.8177.800000113.3H363 K364 V365 L370 V371H363-G367 PolarHBondContact O-N 3.28Å; K364-G367 PolarHBondContact O-N 3.44Å; V365-G367 VanDerWaalsContact C-N 3.33Å; V365-G367 PolarHBondContact O-N 3.15Å; G367-L370 PolarHBondContact O-N 3.38Å; G367-V371 WeakPolarHBondContact O-CG2 3.26Å; G367-V371 PolarHBondContact O-N 2.86Å; G367-V371 VanDerWaalsContact O-N 3.12Å
368A96.1Very high93.9Very high14 Ų1437 Ų3712%0.11619%0.191CC..Hα-helixtrans-63.9-42176.300000112.2Y315 V318 V319 K364 V365 Y366 V371 A372Y315-A368 HydrophobicContact CD2-CB 3.88Å; Y315-A368 HydrophobicContact CE2-CB 3.81Å; V318-A368 HydrophobicContact CB-CB 4.42Å; V318-A368 HydrophobicContact CG1-CB 3.86Å; V319-A368 HydrophobicContact CG2-CB 3.95Å; K364-A368 PolarHBondContact O-N 3.4Å; V365-A368 PolarHBondContact O-N 3.49Å; Y366-A368 PolarHBondContact O-N 3.39Å; A368-V371 PolarHBondContact O-N 3.15Å; A368-A372 WeakPolarHBondContact O-CB 3.34Å; A368-A372 PolarHBondContact O-N 2.66Å
369I95.9Very high93.9Very high0 Ų035.3 Ų35.30%018%0.179CC..Hα-helixtrans-64.8-45176.9-64170.9000110.2V318 L333 L337 Y340 L344 V365 Y366 V371 A372 V373 F458V318-I369 HydrophobicContact CB-CG1 4.38Å; V318-I369 HydrophobicContact CG1-CB 4.45Å; V318-I369 HydrophobicContact CG1-CG1 3.79Å; V318-I369 HydrophobicContact CG2-CD1 4.27Å; V318-I369 HydrophobicContact CG2-CG1 3.68Å; L333-I369 HydrophobicContact CD2-CG2 4.2Å; L337-I369 HydrophobicContact CD1-CD1 4.42Å; L337-I369 HydrophobicContact CD1-CG2 3.93Å; Y340-I369 HydrophobicContact CD1-CD1 4.1Å; Y340-I369 HydrophobicContact CE1-CD1 3.9Å; L344-I369 HydrophobicContact CD2-CD1 4.04Å; V365-I369 HydrophobicContact CG1-CD1 3.81Å; V365-I369 HydrophobicContact CG1-CG1 4.36Å; V365-I369 WeakPolarHBondContact O-CG1 3.43Å; V365-I369 PolarHBondContact O-N 3.47Å; Y366-I369 PolarHBondContact O-N 2.97Å; I369-V371 VanDerWaalsContact C-N 3.32Å; I369-V371 PolarHBondContact O-N 3.28Å; I369-A372 PolarHBondContact O-N 2.93Å; I369-A372 VanDerWaalsContact O-N 3.12Å; I369-V373 HydrophobicContact CG2-CG2 4.1Å; I369-V373 WeakPolarHBondContact O-CB 3.32Å; I369-V373 WeakPolarHBondContact O-CG2 3.49Å; I369-V373 PolarHBondContact O-N 3.31Å; I369-F458 HydrophobicContact CB-CZ 4.45Å; I369-F458 HydrophobicContact CG2-CE1 4.12Å; I369-F458 HydrophobicContact CG2-CE2 4.33Å; I369-F458 HydrophobicContact CG2-CZ 3.47Å; I369-F458 VanDerWaalsContact CG2-CZ 3.47Å
370L94.9Very high93.8Very high6 Ų634.3 Ų34.33%0.03118%0.175CC..Hα-helixtrans-57.8-43.5178.8-169.974.1000111.7Y366 G367 V373 E374 F458 L462 R465Y366-L370 WeakPolarHBondContact O-CB 3.44Å; Y366-L370 PolarHBondContact O-N 2.79Å; G367-L370 PolarHBondContact O-N 3.38Å; L370-V373 PolarHBondContact O-N 3.14Å; L370-E374 VanDerWaalsContact O-CB 3.31Å; L370-E374 WeakPolarHBondContact O-CB 3.19Å; L370-E374 PolarHBondContact O-N 3.2Å; L370-F458 HydrophobicContact CD1-CB 3.92Å; L370-F458 HydrophobicContact CD1-CD1 3.82Å; L370-F458 HydrophobicContact CD1-CG 3.82Å; L370-L462 HydrophobicContact CD1-CB 4.32Å; L370-L462 HydrophobicContact CD1-CD1 4.23Å; L370-R465 HydrophobicContact CD2-CG 4.45Å
371V94.6Very high93.6Very high64 Ų6434.3 Ų34.339%0.38818%0.175SC..Hα-helixtrans-67.8-37.9176.1171.90000111.9G367 A368 I369 R375G367-V371 WeakPolarHBondContact O-CG2 3.26Å; G367-V371 PolarHBondContact O-N 2.86Å; G367-V371 VanDerWaalsContact O-N 3.12Å; A368-V371 PolarHBondContact O-N 3.15Å; I369-V371 VanDerWaalsContact C-N 3.32Å; I369-V371 PolarHBondContact O-N 3.28Å; V371-R375 VanDerWaalsContact O-CB 3.29Å; V371-R375 WeakPolarHBondContact O-CB 3.2Å; V371-R375 PolarHBondContact O-N 3.27Å
372A94.9Very high93.5Very high0 Ų035.3 Ų35.30%018%0.182CC..Hα-helixtrans-64.5-42.5174.600000112.6V318 H322 V329 L333 A368 I369 R375 L376V318-A372 HydrophobicContact CG1-CB 4.28Å; H322-A372 HydrophobicContact CB-CB 4.22Å; H322-A372 WeakPolarHBondContact ND1-CA 3.45Å; V329-A372 HydrophobicContact CG1-CB 4.05Å; V329-A372 HydrophobicContact CG2-CB 4.28Å; L333-A372 HydrophobicContact CD2-CB 4.05Å; A368-A372 WeakPolarHBondContact O-CB 3.34Å; A368-A372 PolarHBondContact O-N 2.66Å; I369-A372 PolarHBondContact O-N 2.93Å; I369-A372 VanDerWaalsContact O-N 3.12Å; A372-R375 PolarHBondContact O-N 3.39Å; A372-L376 WeakPolarHBondContact O-CB 3.42Å; A372-L376 PolarHBondContact O-N 2.9Å
373V94.6Very high93.2Very high3 Ų337.8 Ų37.82%0.01820%0.2CC..Hα-helixtrans-67.3-45.9177158.50000112I369 L370 R375 L376 L377 L454 F458 L462I369-V373 HydrophobicContact CG2-CG2 4.1Å; I369-V373 WeakPolarHBondContact O-CB 3.32Å; I369-V373 WeakPolarHBondContact O-CG2 3.49Å; I369-V373 PolarHBondContact O-N 3.31Å; L370-V373 PolarHBondContact O-N 3.14Å; V373-R375 VanDerWaalsContact C-N 3.3Å; V373-R375 PolarHBondContact O-N 3.43Å; V373-L376 WeakPolarHBondContact O-CB 3.48Å; V373-L376 PolarHBondContact O-N 3.08Å; V373-L377 HydrophobicContact CG1-CD1 4.06Å; V373-L377 PolarHBondContact O-N 2.63Å; V373-L454 HydrophobicContact CG1-CB 4.27Å; V373-L454 HydrophobicContact CG1-CD1 3.98Å; V373-L454 HydrophobicContact CG1-CD2 3.98Å; V373-L454 HydrophobicContact CG1-CG 4.3Å; V373-L454 HydrophobicContact CG2-CD2 3.76Å; V373-F458 HydrophobicContact CB-CE2 4.49Å; V373-F458 HydrophobicContact CG1-CD2 4.32Å; V373-F458 HydrophobicContact CG1-CE2 4.31Å; V373-F458 HydrophobicContact CG2-CE2 3.98Å; V373-L462 HydrophobicContact CG1-CD1 3.7Å; V373-L462 HydrophobicContact CG1-CD2 4.45Å
374E93.6Very high92.6Very high39 Ų3938 Ų3818%0.18220%0.204CC..Hα-helixtrans-57-46.7174.3-172.5-156.6132.600110.6L370 L377 K378 R465 F466L370-E374 VanDerWaalsContact O-CB 3.31Å; L370-E374 WeakPolarHBondContact O-CB 3.19Å; L370-E374 PolarHBondContact O-N 3.2Å; E374-L377 PolarHBondContact O-N 2.87Å; E374-K378 HydrophobicContact CG-CD 4.03Å; E374-K378 WeakPolarHBondContact O-CB 3.47Å; E374-K378 WeakPolarHBondContact O-CG 3.18Å; E374-K378 PolarHBondContact O-N 2.96Å; E374-K378 WeakPolarHBondContact OE1-CE 3.47Å; E374-K378 IonicContact OE1-NZ 2.71Å; E374-K378 PolarHBondContact OE1-NZ 2.82Å; E374-R465 HydrophobicContact CG-CB 3.92Å; E374-R465 WeakPolarHBondContact OE2-CB 3.39Å; E374-R465 WeakPolarHBondContact OE2-CD 3.49Å; E374-F466 HydrophobicContact CG-CZ 4.34Å
375R91.7Very high91.7Very high129 Ų12936.7 Ų36.749%0.48721%0.206SC..Hα-helixtrans-65.9-38.4178.7-173.259.5171.1170.30.2112.3V371 A372 V373 M379V371-R375 VanDerWaalsContact O-CB 3.29Å; V371-R375 WeakPolarHBondContact O-CB 3.2Å; V371-R375 PolarHBondContact O-N 3.27Å; A372-R375 PolarHBondContact O-N 3.39Å; V373-R375 VanDerWaalsContact C-N 3.3Å; V373-R375 PolarHBondContact O-N 3.43Å; R375-M379 HydrophobicContact CG-CG 4.35Å; R375-M379 VanDerWaalsContact CZ-SD 3.54Å; R375-M379 VanDerWaalsContact O-CB 3.3Å; R375-M379 WeakPolarHBondContact O-CB 3.33Å; R375-M379 WeakPolarHBondContact O-CG 3.43Å; R375-M379 PolarHBondContact O-N 3Å
376L93.5Very high90.4Very high1 Ų141 Ų411%0.00523%0.226CC..Hα-helixtrans-58.4-57.1174.4168.656.3000110.9W326 V329 E330 F334 A372 V373 K378 M379 K380 M450W326-L376 HydrophobicContact CB-CD1 4.37Å; W326-L376 HydrophobicContact CE3-CD1 3.92Å; V329-L376 HydrophobicContact CG1-CB 4.3Å; V329-L376 HydrophobicContact CG1-CD2 4.19Å; E330-L376 HydrophobicContact CB-CD1 3.68Å; E330-L376 HydrophobicContact CB-CD2 4.41Å; E330-L376 HydrophobicContact CG-CD1 3.9Å; F334-L376 HydrophobicContact CB-CD2 4.48Å; A372-L376 WeakPolarHBondContact O-CB 3.42Å; A372-L376 PolarHBondContact O-N 2.9Å; V373-L376 WeakPolarHBondContact O-CB 3.48Å; V373-L376 PolarHBondContact O-N 3.08Å; L376-K378 PolarHBondContact O-N 2.93Å; L376-M379 PolarHBondContact O-N 3.01Å; L376-K380 VanDerWaalsContact O-CB 3.28Å; L376-K380 WeakPolarHBondContact O-CB 3.43Å; L376-K380 PolarHBondContact O-N 2.78Å; L376-M450 HydrophobicContact CD2-CE 4.43Å; L376-M450 HydrophobicContact CD2-SD 4.12Å; L376-M450 HydrophobicContact CG-SD 4.32Å
377L92.6Very high88.6Confident6 Ų643.8 Ų43.83%0.03125%0.251CS..Hα-helixtrans-59.5-46.8-178.1-72.6164.6000111.9V373 E374 M379 K380 A381 M450 Y451 L454 L462 F466V373-L377 HydrophobicContact CG1-CD1 4.06Å; V373-L377 PolarHBondContact O-N 2.63Å; E374-L377 PolarHBondContact O-N 2.87Å; L377-M379 PolarHBondContact O-N 3.22Å; L377-K380 PolarHBondContact O-N 2.88Å; L377-A381 WeakPolarHBondContact O-CB 3.31Å; L377-A381 PolarHBondContact O-N 2.94Å; L377-M450 HydrophobicContact CD2-CG 4.19Å; L377-Y451 HydrophobicContact CD1-CD2 3.99Å; L377-Y451 HydrophobicContact CD2-CD2 4.38Å; L377-L454 HydrophobicContact CD1-CD1 4.14Å; L377-L454 HydrophobicContact CD2-CD1 4.23Å; L377-L454 HydrophobicContact CG-CD1 4.22Å; L377-L462 HydrophobicContact CD1-CD1 4.26Å; L377-L462 HydrophobicContact CD1-CD2 4.3Å; L377-F466 HydrophobicContact CB-CE1 4.24Å; L377-F466 HydrophobicContact CB-CZ 3.76Å; L377-F466 HydrophobicContact CD1-CE2 4.11Å; L377-F466 HydrophobicContact CD1-CZ 3.8Å; L377-F466 HydrophobicContact CG-CZ 4.45Å
378K91.6Very high86.3Confident72 Ų7245.8 Ų45.831%0.31327%0.265SS..Hα-helixtrans-62.2-42.6178.4-70.1-179.8-178.5176.80112.2E374 L376 V382 R465 F466E374-K378 HydrophobicContact CG-CD 4.03Å; E374-K378 WeakPolarHBondContact O-CB 3.47Å; E374-K378 WeakPolarHBondContact O-CG 3.18Å; E374-K378 PolarHBondContact O-N 2.96Å; E374-K378 WeakPolarHBondContact OE1-CE 3.47Å; E374-K378 IonicContact OE1-NZ 2.71Å; E374-K378 PolarHBondContact OE1-NZ 2.82Å; L376-K378 PolarHBondContact O-N 2.93Å; K378-V382 WeakPolarHBondContact O-CG2 3.27Å; K378-V382 PolarHBondContact O-N 3.05Å; K378-R465 PolarHBondContact NZ-O 2.86Å; K378-F466 HydrophobicContact CD-CE1 4.26Å; K378-F466 HydrophobicContact CG-CD1 4.37Å; K378-F466 HydrophobicContact CG-CE1 3.62Å; K378-F466 HydrophobicContact CG-CZ 4.37Å
379M91Very high84Confident28 Ų2853 Ų5314%0.13830%0.297CS..Hα-helixtrans-72.8-37178.9-70.2-59.5-55.100113.1W326 R375 L376 L377 V382 S383 P410W326-M379 HydrophobicContact CB-CB 3.9Å; W326-M379 HydrophobicContact CB-CG 4.26Å; W326-M379 HydrophobicContact CD2-CB 3.94Å; W326-M379 HydrophobicContact CG-CB 3.53Å; W326-M379 HydrophobicContact CG-CG 4.12Å; R375-M379 HydrophobicContact CG-CG 4.35Å; R375-M379 VanDerWaalsContact CZ-SD 3.54Å; R375-M379 VanDerWaalsContact O-CB 3.3Å; R375-M379 WeakPolarHBondContact O-CB 3.33Å; R375-M379 WeakPolarHBondContact O-CG 3.43Å; R375-M379 PolarHBondContact O-N 3Å; L376-M379 PolarHBondContact O-N 3.01Å; L377-M379 PolarHBondContact O-N 3.22Å; M379-V382 PolarHBondContact O-N 3.46Å; M379-S383 WeakPolarHBondContact O-CB 3.41Å; M379-S383 PolarHBondContact O-N 3.24Å; M379-P410 HydrophobicContact CE-CB 4.43Å
380K89Confident81.5Confident16 Ų1656.6 Ų56.67%0.0733%0.334CS..Hα-helixtrans-67.5-38.2177.9-170.6171.1176.9164.80111.6W326 E330 L376 L377 S383 L384 V445 L447 M450W326-K380 HydrophobicContact CE3-CB 4.43Å; W326-K380 HydrophobicContact CZ3-CB 4.15Å; W326-K380 HydrophobicContact CZ3-CG 4.27Å; E330-K380 WeakPolarHBondContact OE1-CD 3.34Å; E330-K380 VanDerWaalsContact OE1-CE 3.23Å; E330-K380 WeakPolarHBondContact OE1-CE 3.47Å; E330-K380 IonicContact OE1-NZ 3.3Å; E330-K380 PolarHBondContact OE1-NZ 3.16Å; L376-K380 VanDerWaalsContact O-CB 3.28Å; L376-K380 WeakPolarHBondContact O-CB 3.43Å; L376-K380 PolarHBondContact O-N 2.78Å; L377-K380 PolarHBondContact O-N 2.88Å; K380-S383 PolarHBondContact O-N 2.97Å; K380-L384 WeakPolarHBondContact O-CG 3.44Å; K380-L384 PolarHBondContact O-N 2.98Å; K380-L384 VanDerWaalsContact O-N 3.12Å; K380-V445 WeakPolarHBondContact CE-O 3.48Å; K380-V445 PolarHBondContact NZ-O 3.47Å; K380-L447 HydrophobicContact CB-CD1 4.08Å; K380-L447 HydrophobicContact CG-CD1 4.08Å; K380-M450 HydrophobicContact CD-SD 3.75Å; K380-M450 PolarHBondContact NZ-SD 3.21Å
381A88.6Confident78.7Confident46 Ų4659.6 Ų59.638%0.3837%0.366SS..Hα-helixtrans-60.1-48.4172.100000112.3L377 S383 L384 S385 L447L377-A381 WeakPolarHBondContact O-CB 3.31Å; L377-A381 PolarHBondContact O-N 2.94Å; A381-S383 VanDerWaalsContact C-N 3.31Å; A381-S383 PolarHBondContact O-N 2.83Å; A381-L384 PolarHBondContact O-N 3.46Å; A381-L384 VanDerWaalsContact O-N 3.16Å; A381-S385 PolarHBondContact O-N 3.11Å; A381-S385 VanDerWaalsContact O-N 3.11Å; A381-L447 HydrophobicContact CB-CD1 3.86Å
382V89.4Confident75.9Confident53 Ų5361.6 Ų61.632%0.32138%0.383SS..Hα-helixtrans-63.1-36.6176.4172.40000112K378 M379 L384 S385 Q386K378-V382 WeakPolarHBondContact O-CG2 3.27Å; K378-V382 PolarHBondContact O-N 3.05Å; M379-V382 PolarHBondContact O-N 3.46Å; V382-L384 VanDerWaalsContact C-N 3.27Å; V382-L384 PolarHBondContact O-N 3.32Å; V382-S385 PolarHBondContact O-N 2.99Å; V382-S385 PolarHBondContact O-OG 3.44Å; V382-S385 VanDerWaalsContact O-OG 3.09Å; V382-Q386 WeakPolarHBondContact O-CG 3.21Å; V382-Q386 PolarHBondContact O-N 2.76Å
383S87.2Confident72.9Confident53 Ų5366.7 Ų66.737%0.37142%0.418SS..Hα-helixtrans-66.2-28.3176.3-166.40000113M379 K380 A381M379-S383 WeakPolarHBondContact O-CB 3.41Å; M379-S383 PolarHBondContact O-N 3.24Å; K380-S383 PolarHBondContact O-N 2.97Å; A381-S383 VanDerWaalsContact C-N 3.31Å; A381-S383 PolarHBondContact O-N 2.83Å
384L83.4Confident69.7Low104 Ų10473 Ų7355%0.54546%0.461SS..Hα-helixtrans-78.6-42.1176-70.7166.7000111.6K380 A381 V382 Q386 S387 L447K380-L384 WeakPolarHBondContact O-CG 3.44Å; K380-L384 PolarHBondContact O-N 2.98Å; K380-L384 VanDerWaalsContact O-N 3.12Å; A381-L384 PolarHBondContact O-N 3.46Å; A381-L384 VanDerWaalsContact O-N 3.16Å; V382-L384 VanDerWaalsContact C-N 3.27Å; V382-L384 PolarHBondContact O-N 3.32Å; L384-Q386 PolarHBondContact O-N 3.39Å; L384-S387 WeakPolarHBondContact O-CB 3.43Å; L384-S387 PolarHBondContact O-N 3.18Å; L384-L447 HydrophobicContact CD1-CB 4.07Å; L384-L447 HydrophobicContact CD1-CD1 4.18Å
385S76.3Confident66.6Low63 Ų6380 Ų8044%0.44149%0.494SS..Hα-helixtrans-64-40.9179.567.30000112.5A381 V382 S387 A388 E389A381-S385 PolarHBondContact O-N 3.11Å; A381-S385 VanDerWaalsContact O-N 3.11Å; V382-S385 PolarHBondContact O-N 2.99Å; V382-S385 PolarHBondContact O-OG 3.44Å; V382-S385 VanDerWaalsContact O-OG 3.09Å; S385-S387 PolarHBondContact O-N 3.09Å; S385-A388 WeakPolarHBondContact O-CB 3.43Å; S385-A388 PolarHBondContact O-N 3.13Å; S385-A388 VanDerWaalsContact O-N 3.08Å; S385-E389 PolarHBondContact O-N 3.2Å
386Q67.8Low63.9Low91 Ų9180.3 Ų80.343%0.42551%0.512SS..Hα-helixtrans-65.4-24.1177.9-70.3-179.9-5.300113.4V382 L384 A388V382-Q386 WeakPolarHBondContact O-CG 3.21Å; V382-Q386 PolarHBondContact O-N 2.76Å; L384-Q386 PolarHBondContact O-N 3.39Å; Q386-A388 VanDerWaalsContact C-N 3.32Å
387S58.4Low60.7Low100 Ų10083.5 Ų83.570%0.69955%0.546SS*.Hα-helixtrans-77.5-16.5175.3-162.90000113.4L384 S385L384-S387 WeakPolarHBondContact O-CB 3.43Å; L384-S387 PolarHBondContact O-N 3.18Å; S385-S387 PolarHBondContact O-N 3.09Å
388A47.8Very low57.5Low74 Ų7489.7 Ų89.761%0.61259%0.59SS**Hα-helixtrans-88.1-39.9177.600000112.3S385 Q386 G390 G391S385-A388 WeakPolarHBondContact O-CB 3.43Å; S385-A388 PolarHBondContact O-N 3.13Å; S385-A388 VanDerWaalsContact O-N 3.08Å; Q386-A388 VanDerWaalsContact C-N 3.32Å; A388-G390 VanDerWaalsContact C-N 3.29Å; A388-G390 PolarHBondContact O-N 2.88Å; A388-G391 PolarHBondContact O-N 3.04Å
389E46.7Very low54.7Low165 Ų16590.3 Ų90.377%0.77162%0.617SS**Hα-helixtrans-70.4-22.1-178.2-65.7-175.5146.100113.6S385 G391S385-E389 PolarHBondContact O-N 3.2Å; E389-G391 PolarHBondContact O-N 3.49Å; E389-G391 VanDerWaalsContact O-N 3.16Å
390G43Very low51.7Low76 Ų7693.9 Ų93.978%0.78465%0.651SS**THydrogen-bonded Turntrans-69.5-2.8173.500000115A388A388-G390 VanDerWaalsContact C-N 3.29Å; A388-G390 PolarHBondContact O-N 2.88Å
391G36.5Very low48.9Very low68 Ų6897 Ų9770%0.70169%0.688SS**THydrogen-bonded Turntrans-102.920.7-170.100000116.6A388 E389A388-G391 PolarHBondContact O-N 3.04Å; E389-G391 PolarHBondContact O-N 3.49Å; E389-G391 VanDerWaalsContact O-N 3.16Å
392S35.4Very low45.8Very low107 Ų107104.6 Ų104.675%0.74871%0.712SS**SBendtrans-137.3131178.8-154.20000114.8
393S32.4Very low43Very low106 Ų106108.4 Ų108.474%0.74174%0.735SS**  trans-11.4135.2176.958.80000120.8
394C27.2Very low40Very low137 Ų137108.5 Ų108.593%0.92675%0.745SS**  -165.6158.5121.3-115.50000113.9
395Q28.4Very low37.1Very low185 Ų185114 Ų11486%0.86476%0.76SS**  trans-86.1161.9176.2-84.9-172.7-17.200113.1
396P34.8Very low34.7Very low135 Ų135122.9 Ų122.988%0.87778%0.784SS**  trans-80.6122.8175.632-33.6000112.5
397G26.3Very low32.6Very low69 Ų69125.2 Ų125.271%0.71180%0.804SS**  trans-176138171.300000114
398S26.9Very low31.3Very low135 Ų135123.8 Ų123.894%0.94481%0.805SS**  trans54.9120.5171.1-66.70000118.7
399G32.2Very low30.5Very low86 Ų86125.5 Ų125.589%0.88781%0.813SS**  trans-94.2136.4170.500000112.9
400A27Very low30.2Very low103 Ų103120.6 Ų120.685%0.85180%0.795SS**  trans-137.9141159.300000108.4
401G31.6Very low29.6Very low82 Ų82119.9 Ų119.985%0.84579%0.788SS**  trans-81.3128-171.300000113.3
402F23.8Very low29.9Very low204 Ų204120.6 Ų120.690%0.89578%0.775SS**  trans-130.3120.8164.6-153.7-96.9000110.2G404F402-G404 PolarHBondContact O-N 2.85Å
403V29.2Very low30.2Very low133 Ų133118.3 Ų118.381%0.80676%0.759SS**  trans-87.675.1-171.4-174.40000110.3Y405V403-Y405 PolarHBondContact O-N 2.7Å
404G24.8Very low30.6Very low56 Ų56114.9 Ų114.958%0.57774%0.735SS**  trans-75.1117173.400000112.2F402 R406F402-G404 PolarHBondContact O-N 2.85Å; G404-R406 PolarHBondContact O-N 3.46Å; G404-R406 VanDerWaalsContact O-N 3.14Å
405Y23.4Very low31Very low218 Ų218113 Ų11386%0.85572%0.721SS**  trans-66107.6172.4-85.1-107.4000110.5V403 V407V403-Y405 PolarHBondContact O-N 2.7Å; Y405-V407 PolarHBondContact O-N 3.44Å
406R24.4Very low31.4Very low250 Ų250109.9 Ų109.994%0.94372%0.719SS**  trans-73.1104.8171.5-74.3-165.5-179.5-152.51.7111G404G404-R406 PolarHBondContact O-N 3.46Å; G404-R406 VanDerWaalsContact O-N 3.14Å
407V24.8Very low31.5Very low141 Ų141109.2 Ų109.286%0.85570%0.704SS**  trans-63.9132.3156.8178.30000108.2Y405 S409Y405-V407 PolarHBondContact O-N 3.44Å; V407-S409 PolarHBondContact O-N 2.71Å
408G29.8Very low31.6Very low70 Ų70111 Ų11172%0.72270%0.704SS**  trans-90.689.6-16500000115.4
409S31.6Very low31.8Very low109 Ų109113 Ų11376%0.76270%0.703SS**  trans-175.7160.9157.4-880000110.6V407V407-S409 PolarHBondContact O-N 2.71Å
410P39.7Very low31.8Very low63 Ų63114.2 Ų114.241%0.40970%0.697SS.*  cis-111.5163.83.339-28.8000113.7M379M379-P410 HydrophobicContact CE-CB 4.43Å
411G31.4Very low32Very low61 Ų61118.3 Ų118.363%0.62970%0.699SS**  trans-172.118.9176.600000114.7S413G411-S413 PolarHBondContact O-N 3.08Å
412L42.5Very low31.8Very low82 Ų82118.8 Ų118.843%0.42970%0.695SS.*  trans-78.275.4-175.8-60.3-178.6000111.4W283W283-L412 HydrophobicContact CD2-CD2 4.21Å; W283-L412 HydrophobicContact CE3-CD2 4.37Å; W283-L412 HydrophobicContact CH2-CB 4.06Å; W283-L412 HydrophobicContact CH2-CD2 4.06Å; W283-L412 HydrophobicContact CZ2-CB 4.03Å; W283-L412 HydrophobicContact CZ2-CD2 3.87Å; W283-L412 HydrophobicContact CZ2-CG 4.41Å; W283-L412 HydrophobicContact CZ3-CD2 4.3Å
413S42.7Very low32Very low59 Ų59113.7 Ų113.741%0.41369%0.691SS.*  trans-123.3131.9156.2-43.90000106.2K327 G411K327-S413 PolarHBondContact NZ-OG 3.45Å; G411-S413 PolarHBondContact O-N 3.08Å
414P41.1Very low32.6Very low35 Ų35116 Ų11623%0.22770%0.698CS.*  trans-58.3152.4156.228.5-33.1000108.5F282 Y293F282-P414 HydrophobicContact CZ-CB 4.24Å; Y293-P414 HydrophobicContact CD1-CG 4.23Å; Y293-P414 HydrophobicContact CE1-CG 4.16Å
415P35.4Very low32.8Very low98 Ų98116.3 Ų116.364%0.63670%0.7SS**  trans-52.1146167.3-23.334000110.2E417P415-E417 PolarHBondContact O-N 3.03Å; P415-E417 VanDerWaalsContact O-N 3.07Å
416S35.7Very low33.4Very low118 Ų118114.1 Ų114.183%0.82570%0.702SS**  trans-63.6109.8165.949.30000108.2
417E36.5Very low33.6Very low121 Ų121106.4 Ų106.457%0.56569%0.691SS**  trans-55.4126.3174.7-71.7-174.1131.200108.8G291 P415 L419G291-E417 PolarHBondContact N-OE1 3.29Å; P415-E417 PolarHBondContact O-N 3.03Å; P415-E417 VanDerWaalsContact O-N 3.07Å; E417-L419 PolarHBondContact O-N 3.49Å
418P29.3Very low34Very low108 Ų108104.9 Ų104.970%0.70169%0.687SS**  trans-65.3132.4171.827.7-32.6000108.6S420P418-S420 PolarHBondContact O-N 2.7Å; P418-S420 PolarHBondContact O-OG 3.13Å
419L30.5Very low34Very low176 Ų176109.5 Ų109.592%0.92169%0.689SS**  trans-54.7107.3169.7-74.1167.3000108E417 E421E417-L419 PolarHBondContact O-N 3.49Å; L419-E421 PolarHBondContact O-N 3.24Å
420S33.4Very low34Very low111 Ų111112.7 Ų112.778%0.77670%0.697SS**  trans-70.7117.9-171.7-65.40000109.7P418P418-S420 PolarHBondContact O-N 2.7Å; P418-S420 PolarHBondContact O-OG 3.13Å
421E29.5Very low33.7Very low189 Ų189119.4 Ų119.488%0.88372%0.723SS**  trans-55.6143.1169.2-68.1-173123.400110.1L419 A423L419-E421 PolarHBondContact O-N 3.24Å; E421-A423 PolarHBondContact O-N 2.99Å
422A28.2Very low33.5Very low92 Ų92121.2 Ų121.276%0.7673%0.732SS**  trans-64.6104.9-169.600000112.2L424A422-L424 PolarHBondContact O-N 3.33Å
423A28.8Very low32.9Very low98 Ų98121.7 Ų121.781%0.8176%0.757SS**  trans-69.195.5170.100000110.1E421 G425E421-A423 PolarHBondContact O-N 2.99Å; A423-G425 PolarHBondContact O-N 2.9Å
424L40.1Very low32.1Very low182 Ų182122.5 Ų122.595%0.95377%0.774SS**  trans-63.495172.8-70.9168.3000110.1A422A422-L424 PolarHBondContact O-N 3.33Å
425G29.4Very low31.4Very low61 Ų61125.6 Ų125.663%0.62980%0.803SS**  trans-153.583.1-17200000113.5A423 A427A423-G425 PolarHBondContact O-N 2.9Å; G425-A427 PolarHBondContact O-N 2.95Å
426I37.6Very low31Very low173 Ų173124.6 Ų124.689%0.88781%0.81SS**  trans-11.8100.3170.5-49.7173.9000115.4
427A27.7Very low30.7Very low87 Ų87124.7 Ų124.772%0.71981%0.809SS**  trans-146.540.7169.600000111.9G425 H429G425-A427 PolarHBondContact O-N 2.95Å; A427-H429 PolarHBondContact O-N 2.82Å
428S32.4Very low30.6Very low110 Ų110124 Ų12477%0.76982%0.815SS**  trans-82.169.9-168.156.80000114.2
429H30.7Very low31.1Very low167 Ų167125.4 Ų125.477%0.77381%0.807SS**SBendtrans-165.163.7160.757.9-84000114.6A427A427-H429 PolarHBondContact O-N 2.82Å
430L30.7Very low31.5Very low176 Ų176124.9 Ų124.992%0.92180%0.799SS**SBendtrans-164.134.8156.1-112.1172.1000113.1
431Q34.3Very low31.9Very low204 Ų204128.8 Ų128.895%0.95381%0.806SS**  trans-120.476.3-172.5-159166.816.300110.8
432A27.8Very low32.9Very low99 Ų99123.5 Ų123.582%0.81878%0.778SS**  trans-126.8127.7177.800000110.2
433G29Very low34.4Very low92 Ų92123.3 Ų123.395%0.94877%0.77SS**SBendtrans71.263.5166.700000116.3
434G25.8Very low36.3Very low75 Ų75123.4 Ų123.477%0.77376%0.763SS**  trans-152.991.9169.600000111.4G436G434-G436 PolarHBondContact O-N 3.31Å
435A27.1Very low38.2Very low101 Ų101116.5 Ų116.584%0.83573%0.728SS**  trans-64.1128.9172.300000109C437A435-C437 PolarHBondContact O-N 3.5Å; A435-C437 VanDerWaalsContact O-N 3.08Å
436G26.6Very low40.9Very low76 Ų76117.7 Ų117.778%0.78473%0.725SS**  trans-67.4109.3-18000000110.6G434 P438G434-G436 PolarHBondContact O-N 3.31Å; G436-P438 VanDerWaalsContact O-CD 3.27Å; G436-P438 WeakPolarHBondContact O-CD 3.47Å
437C28.5Very low43.3Very low121 Ų121111.6 Ų111.682%0.81869%0.694SS**  trans-63116.3159.7-65.30000107.4A435 W439A435-C437 PolarHBondContact O-N 3.5Å; A435-C437 VanDerWaalsContact O-N 3.08Å; C437-W439 PolarHBondContact O-N 3.1Å
438P35Very low46.2Very low106 Ų106111.6 Ų111.669%0.68869%0.686SS**  trans-61.9130.6166.228.1-32.2000107.3G436 E440G436-P438 VanDerWaalsContact O-CD 3.27Å; G436-P438 WeakPolarHBondContact O-CD 3.47Å; P438-E440 VanDerWaalsContact C-N 3.34Å; P438-E440 PolarHBondContact O-N 3.08Å
439W40.2Very low48.9Very low138 Ų138108.5 Ų108.552%0.52367%0.668SS.*  trans-64.4102.8162.4172.1-77.1000106H294 R331 C437H294-W439 AromaticContact CE1-CE3 3.98Å; R331-W439 HydrophobicContact CB-CH2 4.47Å; C437-W439 PolarHBondContact O-N 3.1Å
440E37.8Very low51.7Low164 Ų164100.6 Ų100.677%0.76663%0.631SS**  trans-59.8151.3-179.6-73.1-170.9124.500110.9P438 W442P438-E440 VanDerWaalsContact C-N 3.34Å; P438-E440 PolarHBondContact O-N 3.08Å; E440-W442 PolarHBondContact O-N 3.48Å
441E42.5Very low54.6Low194 Ų19495.7 Ų95.791%0.90760%0.601SS**  trans-73.475-178.2-168166.9-162.700110.2S443E441-S443 PolarHBondContact O-N 2.89Å
442W51.7Low57.3Low78 Ų7891.6 Ų91.630%0.29558%0.584SS.*  trans-59.6107.4-173.9-178.776.8000111.1E330 R331 F334 E440 P444E330-W442 HydrophobicContact CG-CH2 3.49Å; E330-W442 VanDerWaalsContact CG-CH2 3.49Å; E330-W442 HydrophobicContact CG-CZ2 4.2Å; E330-W442 HydrophobicContact CG-CZ3 4.13Å; R331-W442 HydrophobicContact CG-CE3 4.29Å; F334-W442 HydrophobicContact CD1-CZ2 4.44Å; E440-W442 PolarHBondContact O-N 3.48Å; W442-P444 HydrophobicContact CZ3-CB 4.32Å
443S58.1Low60.4Low87 Ų8790.2 Ų90.261%0.60856%0.561SS**  trans-74.8132.5-177640000111.3E441 V445E441-S443 PolarHBondContact O-N 2.89Å; S443-V445 PolarHBondContact O-N 3.48Å
444P68.4Low63.4Low101 Ų10185.8 Ų85.866%0.65652%0.516SS*.  trans-75.1100-174.528.8-34.5000111.5W442W442-P444 HydrophobicContact CZ3-CB 4.32Å
445V81.2Confident66.6Low36 Ų3686.4 Ų86.422%0.21850%0.495CS..  trans-55.7131.6178.7179.70000111.3F334 K380 S443 A449 M450F334-V445 HydrophobicContact CE1-CB 4.34Å; F334-V445 HydrophobicContact CE1-CG2 4.05Å; F334-V445 HydrophobicContact CZ-CG1 4.49Å; K380-V445 WeakPolarHBondContact CE-O 3.48Å; K380-V445 PolarHBondContact NZ-O 3.47Å; S443-V445 PolarHBondContact O-N 3.48Å; V445-A449 HydrophobicContact CG1-CB 4.01Å; V445-M450 HydrophobicContact CB-CE 4.45Å; V445-M450 HydrophobicContact CG1-CB 4.19Å
446P86.1Confident69.7Low87 Ų8786 Ų8657%0.56549%0.486SS*.  trans-57.5142.8177.2-26.835.4000113.1A449 M450P446-A449 PolarHBondContact O-N 3.23Å; P446-A449 VanDerWaalsContact O-N 3.14Å; P446-M450 WeakPolarHBondContact O-CB 3.48Å; P446-M450 PolarHBondContact O-N 2.93Å
447L87.9Confident72.7Confident44 Ų4483.9 Ų83.923%0.2346%0.455CS..Hα-helixtrans-55.4-39.6-177.4-176148.6000114.2K380 A381 L384 Y451K380-L447 HydrophobicContact CB-CD1 4.08Å; K380-L447 HydrophobicContact CG-CD1 4.08Å; A381-L447 HydrophobicContact CB-CD1 3.86Å; L384-L447 HydrophobicContact CD1-CB 4.07Å; L384-L447 HydrophobicContact CD1-CD1 4.18Å; L447-Y451 WeakPolarHBondContact O-CB 3.45Å; L447-Y451 PolarHBondContact O-N 3.18Å
448P87.6Confident75.7Confident87 Ų8778.5 Ų78.557%0.56542%0.418SS*.Hα-helixtrans-64.4-41.8176.2-24.135.5000113.5Y451 I452P448-Y451 PolarHBondContact O-N 3.05Å; P448-I452 VanDerWaalsContact O-CG1 3.31Å; P448-I452 WeakPolarHBondContact O-CG1 3.18Å; P448-I452 PolarHBondContact O-N 2.78Å
449A89.2Confident78.3Confident46 Ų4674.4 Ų74.438%0.3840%0.395SS..Hα-helixtrans-65.5-45.7177.600000111V445 P446 Y451 I452 E453V445-A449 HydrophobicContact CG1-CB 4.01Å; P446-A449 PolarHBondContact O-N 3.23Å; P446-A449 VanDerWaalsContact O-N 3.14Å; A449-Y451 VanDerWaalsContact C-N 3.3Å; A449-Y451 PolarHBondContact O-N 3.49Å; A449-I452 PolarHBondContact O-N 3.46Å; A449-E453 PolarHBondContact O-N 3.38Å
450M90.1Very high80.6Confident0 Ų073.1 Ų73.10%040%0.399CS..Hα-helixtrans-57.1-40.6173.2175.3170.2-84.200112E330 F334 L376 L377 K380 V445 P446 L454E330-M450 HydrophobicContact CG-CE 4.1Å; F334-M450 HydrophobicContact CD1-CE 3.61Å; F334-M450 HydrophobicContact CD2-CE 3.91Å; F334-M450 HydrophobicContact CD2-CG 4.27Å; F334-M450 HydrophobicContact CE1-CE 3.59Å; F334-M450 HydrophobicContact CE2-CB 4.34Å; F334-M450 HydrophobicContact CE2-CE 3.89Å; F334-M450 HydrophobicContact CE2-CG 3.76Å; F334-M450 HydrophobicContact CG-CE 3.78Å; F334-M450 HydrophobicContact CZ-CB 4.28Å; F334-M450 HydrophobicContact CZ-CE 3.73Å; F334-M450 HydrophobicContact CZ-CG 4.09Å; L376-M450 HydrophobicContact CD2-CE 4.43Å; L376-M450 HydrophobicContact CD2-SD 4.12Å; L376-M450 HydrophobicContact CG-SD 4.32Å; L377-M450 HydrophobicContact CD2-CG 4.19Å; K380-M450 HydrophobicContact CD-SD 3.75Å; K380-M450 PolarHBondContact NZ-SD 3.21Å; V445-M450 HydrophobicContact CB-CE 4.45Å; V445-M450 HydrophobicContact CG1-CB 4.19Å; P446-M450 WeakPolarHBondContact O-CB 3.48Å; P446-M450 PolarHBondContact O-N 2.93Å; M450-L454 HydrophobicContact CG-CD1 3.66Å; M450-L454 WeakPolarHBondContact O-CB 3.27Å; M450-L454 WeakPolarHBondContact O-CD1 3.04Å; M450-L454 WeakPolarHBondContact O-CG 3.23Å; M450-L454 PolarHBondContact O-N 3.04Å
451Y91.9Very high83Confident73 Ų7368 Ų6829%0.28638%0.381SS..Hα-helixtrans-65.9-43.8175-178-93.3000112.6L377 L447 P448 A449 L454 Y455 L462 F466L377-Y451 HydrophobicContact CD1-CD2 3.99Å; L377-Y451 HydrophobicContact CD2-CD2 4.38Å; L447-Y451 WeakPolarHBondContact O-CB 3.45Å; L447-Y451 PolarHBondContact O-N 3.18Å; P448-Y451 PolarHBondContact O-N 3.05Å; A449-Y451 VanDerWaalsContact C-N 3.3Å; A449-Y451 PolarHBondContact O-N 3.49Å; Y451-L454 PolarHBondContact O-N 3.08Å; Y451-Y455 AromaticContact CE1-CD2 3.87Å; Y451-Y455 HydrophobicContact CE1-CD2 3.87Å; Y451-Y455 AromaticContact CZ-CD2 3.92Å; Y451-Y455 WeakPolarHBondContact O-CB 3.32Å; Y451-Y455 PolarHBondContact O-N 3.46Å; Y451-L462 HydrophobicContact CE2-CD2 4.26Å; Y451-F466 HydrophobicContact CE2-CD2 4.33Å; Y451-F466 HydrophobicContact CE2-CE2 4.25Å
452I91.3Very high85.3Confident119 Ų11958.8 Ų58.861%0.6134%0.338SS*.Hα-helixtrans-62.5-44.4179.4-68.7162.3000111.1P448 A449 Y455 S456P448-I452 VanDerWaalsContact O-CG1 3.31Å; P448-I452 WeakPolarHBondContact O-CG1 3.18Å; P448-I452 PolarHBondContact O-N 2.78Å; A449-I452 PolarHBondContact O-N 3.46Å; I452-Y455 WeakPolarHBondContact O-CB 3.48Å; I452-Y455 PolarHBondContact O-N 3.26Å; I452-S456 PolarHBondContact O-N 2.84Å; I452-S456 VanDerWaalsContact O-N 3.16Å
453E92.3Very high86.9Confident69 Ų6956 Ų5632%0.32233%0.331SS..Hα-helixtrans-62.7-45.1176.2-173.6177.1172.500111.5F334 A449 Y455 S456 F457F334-E453 VanDerWaalsContact CZ-OE2 3.23Å; F334-E453 WeakPolarHBondContact CZ-OE2 3.34Å; A449-E453 PolarHBondContact O-N 3.38Å; E453-Y455 VanDerWaalsContact C-N 3.31Å; E453-Y455 PolarHBondContact O-N 3.1Å; E453-S456 PolarHBondContact O-N 2.92Å; E453-S456 PolarHBondContact O-OG 2.93Å; E453-F457 HydrophobicContact CG-CE2 3.92Å; E453-F457 HydrophobicContact CG-CZ 4.3Å; E453-F457 WeakPolarHBondContact O-CD2 3.3Å
454L92.3Very high88.2Confident0 Ų055.7 Ų55.70%033%0.326CS..Hα-helixtrans-68.2-30.7177.5-67.9163.2000112.4F334 L337 V373 L377 M450 Y451 S456 F457 F458 L462F334-L454 HydrophobicContact CD2-CD1 4.17Å; F334-L454 HydrophobicContact CD2-CD2 4.12Å; F334-L454 HydrophobicContact CD2-CG 4.25Å; F334-L454 HydrophobicContact CE2-CD1 4.17Å; F334-L454 HydrophobicContact CE2-CD2 4.37Å; F334-L454 HydrophobicContact CE2-CG 4.09Å; L337-L454 HydrophobicContact CD2-CD2 3.49Å; L337-L454 VanDerWaalsContact CD2-CD2 3.49Å; V373-L454 HydrophobicContact CG1-CB 4.27Å; V373-L454 HydrophobicContact CG1-CD1 3.98Å; V373-L454 HydrophobicContact CG1-CD2 3.98Å; V373-L454 HydrophobicContact CG1-CG 4.3Å; V373-L454 HydrophobicContact CG2-CD2 3.76Å; L377-L454 HydrophobicContact CD1-CD1 4.14Å; L377-L454 HydrophobicContact CD2-CD1 4.23Å; L377-L454 HydrophobicContact CG-CD1 4.22Å; M450-L454 HydrophobicContact CG-CD1 3.66Å; M450-L454 WeakPolarHBondContact O-CB 3.27Å; M450-L454 WeakPolarHBondContact O-CD1 3.04Å; M450-L454 WeakPolarHBondContact O-CG 3.23Å; M450-L454 PolarHBondContact O-N 3.04Å; Y451-L454 PolarHBondContact O-N 3.08Å; L454-S456 VanDerWaalsContact C-N 3.32Å; L454-S456 PolarHBondContact O-N 3.41Å; L454-F457 PolarHBondContact O-N 2.92Å; L454-F458 HydrophobicContact CD2-CE2 4.03Å; L454-F458 WeakPolarHBondContact O-CD2 3.48Å; L454-F458 PolarHBondContact O-N 3.46Å; L454-L462 HydrophobicContact CB-CD2 3.92Å
455Y92Very high88.9Confident88 Ų8856.3 Ų56.335%0.34532%0.315SS..Hα-helixtrans-65.1-34.8172.9-163.4-77.1000111.9Y451 I452 E453 F457 F458 G459 D460 A463Y451-Y455 AromaticContact CE1-CD2 3.87Å; Y451-Y455 HydrophobicContact CE1-CD2 3.87Å; Y451-Y455 AromaticContact CZ-CD2 3.92Å; Y451-Y455 WeakPolarHBondContact O-CB 3.32Å; Y451-Y455 PolarHBondContact O-N 3.46Å; I452-Y455 WeakPolarHBondContact O-CB 3.48Å; I452-Y455 PolarHBondContact O-N 3.26Å; E453-Y455 VanDerWaalsContact C-N 3.31Å; E453-Y455 PolarHBondContact O-N 3.1Å; Y455-F457 VanDerWaalsContact C-N 3.26Å; Y455-F457 PolarHBondContact O-N 3.05Å; Y455-F458 PolarHBondContact O-N 3.39Å; Y455-G459 VanDerWaalsContact O-CA 3.3Å; Y455-G459 WeakPolarHBondContact O-CA 3.29Å; Y455-G459 PolarHBondContact O-N 3.5Å; Y455-D460 PolarHBondContact OH-OD1 3.36Å; Y455-A463 HydrophobicContact CE2-CB 4.12Å
456S91.9Very high88.7Confident91 Ų9158 Ų5864%0.63632%0.32SS*.Hα-helixtrans-67.5-27.1-179.878.40000113I452 E453 L454I452-S456 PolarHBondContact O-N 2.84Å; I452-S456 VanDerWaalsContact O-N 3.16Å; E453-S456 PolarHBondContact O-N 2.92Å; E453-S456 PolarHBondContact O-OG 2.93Å; L454-S456 VanDerWaalsContact C-N 3.32Å; L454-S456 PolarHBondContact O-N 3.41Å
457F90.5Very high87.6Confident33 Ų3358.8 Ų58.815%0.14533%0.327CS..Hα-helixtrans-84.3-44.1173.1-53.1-50000113.2L337 W341 E453 L454 Y455L337-F457 HydrophobicContact CD2-CD2 3.84Å; L337-F457 HydrophobicContact CD2-CE2 4.15Å; L337-F457 HydrophobicContact CG-CD2 4.15Å; L337-F457 HydrophobicContact CG-CE2 4.22Å; W341-F457 HydrophobicContact CB-CD1 4.04Å; W341-F457 HydrophobicContact CB-CE1 4.24Å; W341-F457 AromaticContact CD1-CD1 3.55Å; W341-F457 HydrophobicContact CD2-CB 3.89Å; W341-F457 HydrophobicContact CD2-CD1 4.03Å; W341-F457 HydrophobicContact CD2-CG 4.21Å; W341-F457 HydrophobicContact CE3-CB 4.07Å; W341-F457 HydrophobicContact CG-CB 4.32Å; W341-F457 AromaticContact CG-CD1 3.54Å; W341-F457 HydrophobicContact CG-CD1 3.54Å; W341-F457 HydrophobicContact CG-CE1 4.15Å; W341-F457 HydrophobicContact CG-CG 4.11Å; W341-F457 WeakPolarHBondContact CH2-O 3.15Å; W341-F457 WeakPolarHBondContact CZ2-O 3.49Å; W341-F457 HydrophobicContact CZ3-CB 4.48Å; E453-F457 HydrophobicContact CG-CE2 3.92Å; E453-F457 HydrophobicContact CG-CZ 4.3Å; E453-F457 WeakPolarHBondContact O-CD2 3.3Å; L454-F457 PolarHBondContact O-N 2.92Å; Y455-F457 VanDerWaalsContact C-N 3.26Å; Y455-F457 PolarHBondContact O-N 3.05Å
458F91.4Very high85.8Confident7 Ų761.7 Ų61.73%0.03135%0.347CS..Hα-helixtrans-104.1-17.8-168.1-61.6-64.8000115.3L337 W341 Y366 I369 L370 V373 L454 Y455 S461 L462L337-F458 HydrophobicContact CD1-CZ 4.41Å; L337-F458 HydrophobicContact CD2-CE2 3.92Å; L337-F458 HydrophobicContact CD2-CZ 4.15Å; W341-F458 HydrophobicContact CE3-CE1 4.28Å; W341-F458 HydrophobicContact CE3-CZ 4.46Å; W341-F458 HydrophobicContact CZ3-CD1 4.22Å; W341-F458 AromaticContact CZ3-CE1 3.7Å; W341-F458 HydrophobicContact CZ3-CE1 3.7Å; W341-F458 HydrophobicContact CZ3-CZ 4.32Å; Y366-F458 HydrophobicContact CD2-CD1 4.34Å; Y366-F458 HydrophobicContact CD2-CE1 4.19Å; Y366-F458 AromaticContact CE2-CD1 3.61Å; Y366-F458 HydrophobicContact CE2-CD1 3.61Å; Y366-F458 AromaticContact CE2-CE1 3.92Å; Y366-F458 HydrophobicContact CE2-CE1 3.92Å; I369-F458 HydrophobicContact CB-CZ 4.45Å; I369-F458 HydrophobicContact CG2-CE1 4.12Å; I369-F458 HydrophobicContact CG2-CE2 4.33Å; I369-F458 HydrophobicContact CG2-CZ 3.47Å; I369-F458 VanDerWaalsContact CG2-CZ 3.47Å; L370-F458 HydrophobicContact CD1-CB 3.92Å; L370-F458 HydrophobicContact CD1-CD1 3.82Å; L370-F458 HydrophobicContact CD1-CG 3.82Å; V373-F458 HydrophobicContact CB-CE2 4.49Å; V373-F458 HydrophobicContact CG1-CD2 4.32Å; V373-F458 HydrophobicContact CG1-CE2 4.31Å; V373-F458 HydrophobicContact CG2-CE2 3.98Å; L454-F458 HydrophobicContact CD2-CE2 4.03Å; L454-F458 WeakPolarHBondContact O-CD2 3.48Å; L454-F458 PolarHBondContact O-N 3.46Å; Y455-F458 PolarHBondContact O-N 3.39Å; F458-S461 WeakPolarHBondContact O-CB 3.42Å; F458-S461 PolarHBondContact O-N 3.28Å; F458-L462 HydrophobicContact CB-CB 3.71Å; F458-L462 HydrophobicContact CB-CD2 4.49Å
459G89.9Confident83.5Confident20 Ų2059.5 Ų59.521%0.20634%0.34CS..THydrogen-bonded Turntrans49.7-137.5-179.500000113.9Y455 S461 L462 A463Y455-G459 VanDerWaalsContact O-CA 3.3Å; Y455-G459 WeakPolarHBondContact O-CA 3.29Å; Y455-G459 PolarHBondContact O-N 3.5Å; G459-S461 PolarHBondContact O-N 3.37Å; G459-L462 WeakPolarHBondContact O-CB 3.49Å; G459-L462 PolarHBondContact O-N 2.99Å; G459-A463 PolarHBondContact O-N 3.17Å
460D87.9Confident81.1Confident112 Ų11263.7 Ų63.760%0.59936%0.363SS*.Hα-helixtrans-61.3-27-176.4-59.8-14.2000113.1Y455 L462 A463 V464Y455-D460 PolarHBondContact OH-OD1 3.36Å; D460-L462 PolarHBondContact O-N 3.07Å; D460-A463 PolarHBondContact O-N 2.85Å; D460-A463 VanDerWaalsContact O-N 3.11Å; D460-V464 WeakPolarHBondContact O-CG2 3.36Å; D460-V464 PolarHBondContact O-N 3.02Å
461S89.3Confident78.5Confident57 Ų5767.1 Ų67.140%0.39940%0.399SS..Hα-helixtrans-59.9-28.6174.1-61.10000112.7Y366 F458 G459 R465Y366-S461 WeakPolarHBondContact OH-CB 3.45Å; Y366-S461 PolarHBondContact OH-OG 3.01Å; F458-S461 WeakPolarHBondContact O-CB 3.42Å; F458-S461 PolarHBondContact O-N 3.28Å; G459-S461 PolarHBondContact O-N 3.37Å; S461-R465 WeakPolarHBondContact O-CG 3.46Å
462L89.5Confident75.8Confident0 Ų073.4 Ų73.40%043%0.428CS..Hα-helixtrans-81-46.1171.3-175.463.9000111L370 V373 L377 Y451 L454 F458 G459 D460 V464 R465 F466L370-L462 HydrophobicContact CD1-CB 4.32Å; L370-L462 HydrophobicContact CD1-CD1 4.23Å; V373-L462 HydrophobicContact CG1-CD1 3.7Å; V373-L462 HydrophobicContact CG1-CD2 4.45Å; L377-L462 HydrophobicContact CD1-CD1 4.26Å; L377-L462 HydrophobicContact CD1-CD2 4.3Å; Y451-L462 HydrophobicContact CE2-CD2 4.26Å; L454-L462 HydrophobicContact CB-CD2 3.92Å; F458-L462 HydrophobicContact CB-CB 3.71Å; F458-L462 HydrophobicContact CB-CD2 4.49Å; G459-L462 WeakPolarHBondContact O-CB 3.49Å; G459-L462 PolarHBondContact O-N 2.99Å; D460-L462 PolarHBondContact O-N 3.07Å; L462-V464 VanDerWaalsContact C-N 3.34Å; L462-V464 PolarHBondContact O-N 3.25Å; L462-R465 WeakPolarHBondContact O-CB 3.35Å; L462-R465 PolarHBondContact O-N 3.23Å; L462-R465 VanDerWaalsContact O-N 3.08Å; L462-F466 HydrophobicContact CD1-CE2 3.77Å; L462-F466 HydrophobicContact CG-CE2 4.02Å; L462-F466 VanDerWaalsContact O-CD2 3.27Å; L462-F466 WeakPolarHBondContact O-CD2 3.45Å
463A86.1Confident72.9Confident19 Ų1971.7 Ų71.716%0.15743%0.431CS..Hα-helixtrans-55.8-45.7-178.900000112.6Y455 G459 D460 R465 F466 S467Y455-A463 HydrophobicContact CE2-CB 4.12Å; G459-A463 PolarHBondContact O-N 3.17Å; D460-A463 PolarHBondContact O-N 2.85Å; D460-A463 VanDerWaalsContact O-N 3.11Å; A463-R465 PolarHBondContact O-N 3.34Å; A463-R465 VanDerWaalsContact O-N 3.16Å; A463-F466 PolarHBondContact O-N 2.99Å; A463-S467 PolarHBondContact O-N 2.91Å; A463-S467 PolarHBondContact O-OG 3.39Å
464V86.3Confident69.8Low81 Ų8174 Ų7449%0.49146%0.455SS..Hα-helixtrans-57.9-31.1179.3171.30000112.2D460 L462 F466 S467 T468D460-V464 WeakPolarHBondContact O-CG2 3.36Å; D460-V464 PolarHBondContact O-N 3.02Å; L462-V464 VanDerWaalsContact C-N 3.34Å; L462-V464 PolarHBondContact O-N 3.25Å; V464-F466 PolarHBondContact O-N 2.68Å; V464-S467 PolarHBondContact O-N 3.13Å; V464-T468 HydrophobicContact CG1-CG2 4.11Å; V464-T468 WeakPolarHBondContact O-CB 3.21Å; V464-T468 WeakPolarHBondContact O-CG2 3.41Å; V464-T468 PolarHBondContact O-N 3.4Å; V464-T468 PolarHBondContact O-OG1 3.47Å
465R81.4Confident66.8Low114 Ų11483.9 Ų83.943%0.4349%0.494SS..Hα-helixtrans-71.9-13.9177.5-58.8-66.9179.5169.7-0.8114.1L370 E374 K378 S461 L462 A463L370-R465 HydrophobicContact CD2-CG 4.45Å; E374-R465 HydrophobicContact CG-CB 3.92Å; E374-R465 WeakPolarHBondContact OE2-CB 3.39Å; E374-R465 WeakPolarHBondContact OE2-CD 3.49Å; K378-R465 PolarHBondContact NZ-O 2.86Å; S461-R465 WeakPolarHBondContact O-CG 3.46Å; L462-R465 WeakPolarHBondContact O-CB 3.35Å; L462-R465 PolarHBondContact O-N 3.23Å; L462-R465 VanDerWaalsContact O-N 3.08Å; A463-R465 PolarHBondContact O-N 3.34Å; A463-R465 VanDerWaalsContact O-N 3.16Å
466F76.9Confident63.8Low72 Ų7284.7 Ų84.732%0.31651%0.51SS..Hα-helixtrans-101.5-38.5172-64.2-83.9000111.6E374 L377 K378 Y451 L462 A463 V464 T468E374-F466 HydrophobicContact CG-CZ 4.34Å; L377-F466 HydrophobicContact CB-CE1 4.24Å; L377-F466 HydrophobicContact CB-CZ 3.76Å; L377-F466 HydrophobicContact CD1-CE2 4.11Å; L377-F466 HydrophobicContact CD1-CZ 3.8Å; L377-F466 HydrophobicContact CG-CZ 4.45Å; K378-F466 HydrophobicContact CD-CE1 4.26Å; K378-F466 HydrophobicContact CG-CD1 4.37Å; K378-F466 HydrophobicContact CG-CE1 3.62Å; K378-F466 HydrophobicContact CG-CZ 4.37Å; Y451-F466 HydrophobicContact CE2-CD2 4.33Å; Y451-F466 HydrophobicContact CE2-CE2 4.25Å; L462-F466 HydrophobicContact CD1-CE2 3.77Å; L462-F466 HydrophobicContact CG-CE2 4.02Å; L462-F466 VanDerWaalsContact O-CD2 3.27Å; L462-F466 WeakPolarHBondContact O-CD2 3.45Å; A463-F466 PolarHBondContact O-N 2.99Å; V464-F466 PolarHBondContact O-N 2.68Å; F466-T468 PolarHBondContact O-N 3.49Å
467S63.1Low60.8Low103 Ų10386.5 Ų86.572%0.7252%0.519SS*.Hα-helixtrans-69.3-9.6-179.6-55.10000115.4A463 V464A463-S467 PolarHBondContact O-N 2.91Å; A463-S467 PolarHBondContact O-OG 3.39Å; V464-S467 PolarHBondContact O-N 3.13Å
468T49.8Very low57.6Low104 Ų10491 Ų9164%0.63855%0.554SS**THydrogen-bonded Turntrans-108.84.9-175.350.60000114.8V464 F466V464-T468 HydrophobicContact CG1-CG2 4.11Å; V464-T468 WeakPolarHBondContact O-CB 3.21Å; V464-T468 WeakPolarHBondContact O-CG2 3.41Å; V464-T468 PolarHBondContact O-N 3.4Å; V464-T468 PolarHBondContact O-OG1 3.47Å; F466-T468 PolarHBondContact O-N 3.49Å
469G40.8Very low54.5Low41 Ų4194.9 Ų94.942%0.42359%0.587SS.*SBendtrans-80.5150.6173.600000112.8G471G469-G471 PolarHBondContact O-N 3.26Å
470P39.3Very low51.6Low134 Ų134100 Ų10087%0.8762%0.616SS**SBendtrans-58.8126.8165.327.3-33.3000108.6
471G34.9Very low48.7Very low73 Ų7399 Ų9975%0.75362%0.624SS**PPolyproline II helixtrans-60.4137.9-158.800000114.8G469G469-G471 PolarHBondContact O-N 3.26Å
472F34.4Very low45.4Very low204 Ų204101.8 Ų101.890%0.89564%0.642SS**PPolyproline II helixtrans-55.6139.1150.2-79.5-92.2000108.3S474F472-S474 PolarHBondContact O-N 2.92Å
473A30.6Very low42.3Very low83 Ų83111.3 Ų111.369%0.68668%0.684SS**PPolyproline II helixtrans-55.7140-169.200000112.5Y475A473-Y475 PolarHBondContact O-N 3.42Å; A473-Y475 VanDerWaalsContact O-N 3.16Å
474S27Very low39.4Very low117 Ų117119.7 Ų119.782%0.81872%0.717SS**PPolyproline II helixtrans-61.3118.2176.3173.30000110.3F472F472-S474 PolarHBondContact O-N 2.92Å
475Y28.9Very low36.3Very low209 Ų209124.6 Ų124.682%0.8274%0.735SS**PPolyproline II helixtrans-81.8143.6153.8-70.8-85.9000108.6A473A473-Y475 PolarHBondContact O-N 3.42Å; A473-Y475 VanDerWaalsContact O-N 3.16Å
476P28.9Very low33.7Very low104 Ų104124.2 Ų124.268%0.67576%0.756SS**PPolyproline II helixtrans-69153.3174.130.5-35.1000110.6C478P476-C478 PolarHBondContact O-N 3.12Å
477P29Very low31.2Very low129 Ų129132.1 Ų132.184%0.83878%0.783SS**PPolyproline II helixtrans-68.3118.1177.128.1-33.7000110.6A479P477-A479 PolarHBondContact O-N 2.82Å
478C24.5Very low29.4Very low128 Ų128137 Ų13787%0.86579%0.792SS**PPolyproline II helixtrans-63.4126.9166-73.30000109.6P476P476-C478 PolarHBondContact O-N 3.12Å
479A24.9Very low28.1Very low89 Ų89140.5 Ų140.574%0.73680%0.801SS**PPolyproline II helixtrans-62.7147.5177.200000111.4P477 A481P477-A479 PolarHBondContact O-N 2.82Å; A479-A481 PolarHBondContact O-N 3.13Å
480P29.8Very low28.1Very low126 Ų126143.4 Ų143.482%0.81881%0.812SS**PPolyproline II helixtrans-65.9129.7-179.927.1-34.3000111.2C482P480-C482 PolarHBondContact O-N 3.03Å
481A26.6Very low27.5Very low91 Ų91145.6 Ų145.675%0.75282%0.816SS**PPolyproline II helixtrans-68125.517500000110.5A479 F483A479-A481 PolarHBondContact O-N 3.13Å; A481-F483 PolarHBondContact O-N 3.11Å
482C21.6Very low27.1Very low117 Ų117145.3 Ų145.379%0.79181%0.813SS**PPolyproline II helixtrans-66.8118.1-177.7176.50000111.8P480P480-C482 PolarHBondContact O-N 3.03Å
483F24.2Very low27.3Very low200 Ų200141.7 Ų141.788%0.87781%0.81SS**PPolyproline II helixtrans-84.8134.9158.4-90.7-90000109.8A481A481-F483 PolarHBondContact O-N 3.11Å
484K25.3Very low27.1Very low195 Ų195142.5 Ų142.585%0.84882%0.816SS**PPolyproline II helixtrans-78.1152.9-176.9-71.9-175.5175.9-178.50112.3
485E21.4Very low27.2Very low184 Ų184142.2 Ų142.286%0.8682%0.815SS**PPolyproline II helixtrans-62.1145.7-178.4-56.9163.1103.200113.4
486A25.8Very low27.1Very low106 Ų106139.6 Ų139.688%0.87682%0.815SS**  trans-122.9122.6151.100000107.6
487R24.3Very low27.3Very low237 Ų237141.5 Ų141.589%0.89482%0.824SS**  trans-101.1119.3-157.7-175.4-174.9-173.1-171.45.4112.5
488K25.1Very low27.2Very low207 Ų207142.3 Ų142.390%0.982%0.822SS**  trans-156140157.5-132.3174.2-177.1-179.30113.1
489E22.4Very low27.6Very low176 Ų176143.3 Ų143.382%0.82282%0.824SS**  trans-151.6173.4-174.8-115-168.916300107.1
490P42.3Very low27.7Very low103 Ų103143 Ų14367%0.66982%0.822SS**  cis-129.6-179-20.638.5-23.4000112.1
491L25.9Very low28Very low180 Ų180149 Ų14994%0.94283%0.828SS**  trans174.8140.4140.3-95157.5000109.7
492G26.4Very low28.2Very low67 Ų67154.1 Ų154.169%0.69183%0.833SS**  trans-129.1-148.2175.900000110.9
493P39.1Very low28.5Very low127 Ų127155.9 Ų155.983%0.82583%0.832SS**  cis-134-167.8-8.442.7-25.8000113.8
494A24.8Very low29Very low100 Ų100152.3 Ų152.383%0.82683%0.829SS**  trans71.1158.9171.700000116.1
495S30.9Very low29.2Very low112 Ų112150.2 Ų150.278%0.78382%0.822SS**  cis-137.7166.911.558.90000114.3
496N26.1Very low29.6Very low153 Ų153150.1 Ų150.182%0.81883%0.826SS**  trans-94.2148.9175.1-61-19.8000111.7
497T33.1Very low29.8Very low144 Ų144150.6 Ų150.688%0.88382%0.818SS**  trans-145.7110.814841.50000111.4
498D27.5Very low30.1Very low146 Ų146144.1 Ų144.178%0.78182%0.816SS**  trans-71.4144.4164.2-88.5-67.4000111.2
499T31.9Very low30.4Very low149 Ų149141.6 Ų141.691%0.91481%0.812SS**  trans-147.791.1142.929.80000110.8
500A28.1Very low30.8Very low83 Ų83140.8 Ų140.869%0.68681%0.812SS**  trans-84.2141.4173.300000112.5
501R34.8Very low30.1Very low253 Ų253143.2 Ų143.296%0.95582%0.82SS**  trans-136.1141.7152.3-70.6-165.5172.8169.20.5110
502K30.8Very low30.4Very low198 Ų198142.8 Ų142.886%0.86182%0.817SS**  trans-106161.9-169.1-70.4179.2176177.10112.4
503M29.4Very low30.5Very low153 Ų153144.8 Ų144.875%0.75482%0.82SS**PPolyproline II helixtrans-54.7157.3160.7-60.7174.9-77.800112.3
504P33.8Very low30.4Very low126 Ų126144.6 Ų144.682%0.81882%0.819SS**PPolyproline II helixtrans-91.9134.5135.334-26.3000110.8
505Q30.2Very low30.6Very low150 Ų150150.8 Ų150.870%0.70182%0.821SS**PPolyproline II helixtrans-100.2156.1156.6-75.7-169.1-12.500108.9
506L30.1Very low30.6Very low182 Ų182152.8 Ų152.895%0.95382%0.818SS**  trans-131.7140.3160.2-80.6175.4000110.1
507T30.1Very low30.7Very low116 Ų116152.9 Ų152.971%0.71282%0.819SS**  trans-128.8135.9-169.7-40.60000108.7
508A30.5Very low30.5Very low101 Ų101149.8 Ų149.884%0.83582%0.815SS**  trans-149137.6169.500000110.8
509N29.6Very low30.7Very low155 Ų155148 Ų14883%0.82981%0.814SS**  trans-91.4163.6-164.8-65.7-31.2000114.4
510L31.7Very low31.3Very low158 Ų158146.5 Ų146.583%0.82781%0.807SS**  trans-74148.7163.6-68.6153.8000111.7
511N28.6Very low31.4Very low154 Ų154153 Ų15382%0.82481%0.814SS**  169.7167.2117.7-89.1-25.6000114.5
512I30.3Very low31.2Very low171 Ų171146.8 Ų146.888%0.87780%0.804SS**  trans114.6139.1159.8-60169.4000115.2
513S30Very low31.2Very low110 Ų110144.7 Ų144.777%0.76980%0.802SS**  trans-97.7163.8-163.4-44.90000114.9
514P37Very low31.7Very low123 Ų123142.9 Ų142.980%0.79980%0.802SS**  trans-104.1130.7167.536-29.3000114.4
515R28.3Very low32.4Very low229 Ų229142.4 Ų142.486%0.86480%0.799SS**  trans-154.3152.3155.9-73.6-166.7177.6-176.6-0.4105.8
516Q30.2Very low33.5Very low155 Ų155141 Ų14172%0.72480%0.803SS**  cis-150.3-176.57.7-146.1161.5-1900110.6
517D29.6Very low34.3Very low155 Ų155137.3 Ų137.383%0.82979%0.79SS**  trans77.1138.3166.2-52.1-28.4000118.8
518G27.8Very low34.2Very low78 Ų78136.5 Ų136.580%0.80479%0.789SS**  cis-155.9162.4-0.800000113.8
519S32.8Very low34.1Very low110 Ų110139.7 Ų139.777%0.76979%0.791SS**  trans-89.4157.1-175.5-149.50000112.2
520P43.9Very low34Very low117 Ų117137.2 Ų137.276%0.7679%0.792SS**  -145.1169.875.432.8-12000115.1
521R30.1Very low33.9Very low219 Ų219134 Ų13483%0.82679%0.788SS**  cis-164.7136-16.1-110.8176.6-176.6178.81.1111.3
522T30.8Very low34Very low123 Ų123133.1 Ų133.176%0.75579%0.789SS**  trans46.7125.4141.160.10000124.1
523D31.1Very low33.9Very low153 Ų153128.7 Ų128.782%0.81879%0.785SS**  trans-58.4-175.6146.2-45.2-90.6000112.5
524P40Very low33.8Very low116 Ų116128.7 Ų128.775%0.75379%0.792SS**  cis-140.7-173.413.342.1-19.6000116.4
525P48.3Very low33.4Very low116 Ų116126.3 Ų126.375%0.75379%0.789SS**  trans-89.4-173.2173.238.7-39000112.5
526P52.7Low33.4Very low119 Ų119126.8 Ų126.877%0.77379%0.791SS**  cis-127.2-135.42.236.5-12000110.7
527P46.2Very low33.3Very low105 Ų105124 Ų12468%0.68279%0.789SS**  cis-138.7169-20.740.7-21.8000118.5
528S28.9Very low33.3Very low100 Ų100124.2 Ų124.270%0.69979%0.789SS**  trans41.5129.3142.868.40000125.3
529L27.3Very low33.4Very low167 Ų167124.7 Ų124.787%0.87479%0.785SS**  trans135.2141.4132.8-76172.3000116.8
530A27.9Very low33.2Very low103 Ų103130.7 Ų130.785%0.85179%0.791SS**  trans60161.216100000118.4
531A30Very low32.4Very low90 Ų90129.4 Ų129.474%0.74479%0.785SS**  cis-154.5172-3100000105.5
532T30.6Very low32.3Very low137 Ų137123.6 Ų123.684%0.8478%0.778SS**  cis-159.8149.438.448.20000107.9
533G27.6Very low32.3Very low77 Ų77123 Ų12379%0.79478%0.779SS**  99.1133.869.200000111.3
534A29.1Very low32.3Very low111 Ų111122.4 Ų122.492%0.91778%0.78SS**  cis-104.3-137.7-400000110.7
535G27.5Very low32.5Very low72 Ų72122 Ų12274%0.74278%0.777SS**  cis155.81490.300000108.7
536R29.2Very low31.4Very low239 Ų239127.2 Ų127.290%0.90278%0.782SS**  cis-138.5132.56.7-76.3179.9178.9169.2-0.9108.2
537S28.1Very low30.2Very low98 Ų98126.4 Ų126.469%0.68578%0.779SS**  42.7128.8102.282.50000116.1
538L30.2Very low29.2Very low159 Ų159132.7 Ų132.783%0.83279%0.789SS**  cis-149.5137.331.9-76.9167.7000111.3
539A28.9Very low29Very low87 Ų87132.7 Ų132.772%0.71979%0.789SS**  81.4146.994.700000115.8
540R29.2Very low29Very low236 Ų236130.3 Ų130.389%0.89179%0.787SS**  cis-160.4170.5-0.6-131.5-178.1177.4162.9-1.5113.8
541S27.2Very low29Very low91 Ų91130.7 Ų130.764%0.63678%0.783SS**  trans-41.1167160.452.50000117.9
542S27.6Very low29Very low97 Ų97131.4 Ų131.468%0.67878%0.783SS**  cis-177.9-178.7-5.448.70000112.3
543S30Very low28.9Very low110 Ų110136 Ų13677%0.76978%0.784SS**  trans78.3142.6143.942.40000123.3
544V31.9Very low29.1Very low140 Ų140137.7 Ų137.785%0.84878%0.784SS**  trans-92.1-180171.4-115.10000110.5
545P43.8Very low29Very low107 Ų107135.5 Ų135.570%0.69577%0.773SS**  cis-142.1-173.22.739.6-18.2000118.3
546R26.3Very low29Very low227 Ų227140.8 Ų140.886%0.85778%0.778SS**  trans79.8107.9142.9-90.8-179.4176.1171.6-0.9123.7
547S26.1Very low28.9Very low101 Ų101140.5 Ų140.571%0.70678%0.777SS**  87.9155116.678.20000123.8
548R26Very low28.9Very low237 Ų237140.9 Ų140.989%0.89478%0.78SS**  trans78.2162.5169-65.3-175.1171.4177.9-2.4119
549S25.5Very low28.8Very low100 Ų100138.2 Ų138.270%0.69978%0.781SS**  169.1115.2-67.555.70000113.3
550S27.1Very low28.7Very low118 Ų118137.7 Ų137.783%0.82578%0.784SS**  trans179156.5168.847.30000108.9
551S27.7Very low28.6Very low111 Ų111133.5 Ų133.578%0.77678%0.784SS**  cis-176.8158.90.737.20000107.6
552S29.3Very low28.7Very low104 Ų104134.3 Ų134.373%0.72779%0.79SS**  cis-169.7-157-10.860.60000108.5
553R29.6Very low28.8Very low233 Ų233141.4 Ų141.488%0.87980%0.802SS**  trans70.4145.1175.1-71.8-176.8166.3-174.2-6.1117.1
554S30.1Very low28.8Very low113 Ų113143.5 Ų143.579%0.7980%0.804SS**  cis178.3145.2-25.245.10000107.8
555G27.3Very low28.5Very low66 Ų66143.4 Ų143.468%0.6880%0.804SS**  cis176.1-175.3-1.700000111.4
556Q28.5Very low27.8Very low182 Ų182146.6 Ų146.685%0.8581%0.807SS**  trans66.8119.2174.1-72162.4-76.700116.5
557R26.9Very low28.1Very low234 Ų234142 Ų14288%0.88381%0.806SS**  76.4136.473.6-75.6-174.9-176.7-173.31.4112.9
558S28.5Very low28.4Very low106 Ų106146.2 Ų146.274%0.74181%0.812SS**  cis-170.5157.22.941.90000112.9
559A27.8Very low28.3Very low103 Ų103139.7 Ų139.785%0.85181%0.809SS**  trans46.2124.3158.800000119.1
560G25.8Very low28.4Very low76 Ų76145.7 Ų145.778%0.78482%0.816SS**  120.5174.369.700000109
561V27.7Very low28.3Very low147 Ų147149.1 Ų149.189%0.89182%0.816SS**  cis-147157.6-8.1-177.50000107.1
562S29Very low28.5Very low108 Ų108151 Ų15176%0.75582%0.816SS**  trans-98.1158.8-173.753.20000115.8
563R30Very low28.4Very low246 Ų246151.4 Ų151.493%0.92882%0.819SS**  trans-167.1133.4150.7-116.7170.9-177.8173.70.4113.9
564D30.4Very low28.7Very low154 Ų154145.8 Ų145.882%0.82481%0.812SS**  trans-91.3149.6166.9-65.3-72.1000111.5
565V25.5Very low29.1Very low139 Ų139150 Ų15084%0.84282%0.82SS**  trans-143.6125.6160.7-177.80000110
566F29.4Very low29.3Very low174 Ų174152.4 Ų152.476%0.76383%0.826SS**  trans-90.3151.8169.2-96.5-82.8000110.3
567P32.1Very low29.9Very low129 Ų129146.6 Ų146.684%0.83882%0.815SS**  -142.5-179.394.137.7-22.1000114.5
568K31.2Very low30.4Very low191 Ų191141.3 Ų141.383%0.8381%0.811SS**  trans-136.4129.1-172.5-177.1-179.6-173.1174.60109.7
569A25.4Very low30.8Very low100 Ų100141.1 Ų141.183%0.82681%0.808SS**  trans-134.7155.2175.900000111.5
570R27.8Very low31.2Very low226 Ų226140.8 Ų140.885%0.85381%0.805SS**  trans-125.7146.7167.5-71.2176.8170.8170.7-4.1107.3
571F24.7Very low31.6Very low189 Ų189144.9 Ų144.983%0.82980%0.801SS**  -174.5147.5119.1-94.8-62.2000111.5
572I30.6Very low31.9Very low152 Ų152143.1 Ų143.178%0.77980%0.795SS**  trans18.6132.3156.6-60.1150.2000119.7
573S27.8Very low32.2Very low111 Ų111146.4 Ų146.478%0.77680%0.796SS**  trans-127.9166.5151.780.70000109.9
574P35.8Very low32.4Very low115 Ų115140.4 Ų140.475%0.74779%0.787SS**  trans-89.4157.2-142.133.2-38000117S576P574-S576 PolarHBondContact O-N 2.83Å
575Q37.8Very low32.8Very low202 Ų202139.7 Ų139.794%0.94478%0.782SS**  trans-78.8102.9161.6-66.6178.9-4.300110.3
576S31.6Very low33.4Very low116 Ų116136.6 Ų136.681%0.81178%0.777SS**  trans-169.5113.8150.8-171.40000109.5P574P574-S576 PolarHBondContact O-N 2.83Å
577G42.4Very low34Very low60 Ų60129.8 Ų129.862%0.61976%0.757SS**PPolyproline II helixtrans-99.3153.5166.900000110.2
578P37.8Very low34.5Very low124 Ų124135.3 Ų135.381%0.80576%0.761SS**PPolyproline II helixtrans-62.4150.2173.928.3-34.9000111.1A580P578-A580 PolarHBondContact O-N 3.44Å
579P35.7Very low35.1Very low102 Ų102134.9 Ų134.966%0.66276%0.762SS**PPolyproline II helixtrans-66.3124.5-176.526.4-34.3000111.8F581P579-F581 HydrophobicContact CB-CE2 4.25Å; P579-F581 HydrophobicContact CB-CZ 4.38Å; P579-F581 HydrophobicContact CG-CE2 3.99Å; P579-F581 HydrophobicContact CG-CZ 4.24Å
580A36.9Very low35.7Very low96 Ų96139.3 Ų139.379%0.79377%0.768SS**  trans-86.3110.8174.200000110.5P578P578-A580 PolarHBondContact O-N 3.44Å
581F34.6Very low36.2Very low161 Ų161131.9 Ų131.971%0.70676%0.762SS**  trans-84.6112.3176.9-65.5-83.2000111.2P579 F583P579-F581 HydrophobicContact CB-CE2 4.25Å; P579-F581 HydrophobicContact CB-CZ 4.38Å; P579-F581 HydrophobicContact CG-CE2 3.99Å; P579-F581 HydrophobicContact CG-CZ 4.24Å; F581-F583 HydrophobicContact CB-CE2 4.02Å; F581-F583 HydrophobicContact CB-CZ 4.21Å
582S32.7Very low37.1Very low110 Ų110134.9 Ų134.977%0.76977%0.767SS**  trans-93.4110173.360.10000111.4
583F35.4Very low37.9Very low177 Ų177139.4 Ų139.478%0.77678%0.775SS**  trans-85.3125.4175.5-63.3-81.5000111.4F581F581-F583 HydrophobicContact CB-CE2 4.02Å; F581-F583 HydrophobicContact CB-CZ 4.21Å
584V34.1Very low38.4Very low120 Ų120140.4 Ų140.473%0.72778%0.78SS**  trans-107.8105.9175.7-179.40000109
585I39.3Very low38.7Very low140 Ų140145 Ų14572%0.71879%0.791SS**  trans-99.198.1178.2-57.4178.9000109.2G587I585-G587 PolarHBondContact O-N 3.04Å
586G37.8Very low38.8Very low73 Ų73138.9 Ų138.975%0.75378%0.783SS**  trans-87.293.2176.700000112.5
587G42.6Very low39.3Very low32 Ų32145.5 Ų145.533%0.3379%0.79SS.*  trans-80.9141.717800000113.9I585I585-G587 PolarHBondContact O-N 3.04Å
588R43.2Very low39.2Very low245 Ų245154 Ų15493%0.92580%0.803SS**  trans-108.6118.8163.7-68.4-170.6-178.4-158.12.5109.4
589Q42.4Very low39.3Very low182 Ų182154 Ų15485%0.8580%0.804SS**  trans-79.3129.3177.3-162.7179.428.900110.3
590M39Very low39.8Very low193 Ų193154.4 Ų154.495%0.95180%0.795SS**  trans-12488.7-176.4-161.370.9168.700109.9
591G38.3Very low39.8Very low70 Ų70157.5 Ų157.572%0.72279%0.793SS**  trans-169.5111.7-17600000114.7
592R42.7Very low40Very low252 Ų252154 Ų15495%0.95179%0.785SS**SBendtrans29.598.2165.4-68.5-171.5173.4-127.6-2.2119.4
593R48.2Very low40.1Very low247 Ų247153.9 Ų153.993%0.93278%0.78SS**  trans41.387.4141.8-64.7-172.4179.1-172.90.4118.4
594C37.8Very low40.1Very low132 Ų132154.7 Ų154.789%0.89278%0.783SS**  trans-144.1151.8137.5-104.80000108.8
595Q41.8Very low40.1Very low210 Ų210154.3 Ų154.398%0.98179%0.786SS**  trans-87.5121.9179.8-71.4-162.48.700111.6
596G40.8Very low39.8Very low74 Ų74152.7 Ų152.776%0.76379%0.787SS**  trans166.698.9173.300000111.7R598G596-R598 PolarHBondContact O-N 2.95Å
597R41.9Very low39.5Very low256 Ų256154.9 Ų154.997%0.96679%0.791SS**  trans-84111179.6-66.3-172.8-176.1-160.53.2110.9
598R41.1Very low38.9Very low237 Ų237158.2 Ų158.289%0.89481%0.809SS**  trans-140.1132.4156.5-66.8-169.2-179.5-138.3-0.8109.6G596G596-R598 PolarHBondContact O-N 2.95Å
599P39.8Very low38.4Very low126 Ų126152 Ų15282%0.81880%0.804SS**  trans-70.1148.3163.631.9-33000109.1
600F46.3Very low38Very low110 Ų110151 Ų15148%0.48280%0.803SS.*  trans-96140.516564.2-91.9000109.5
601Q36.6Very low37.7Very low160 Ų160147 Ų14775%0.74879%0.792SS**  trans-132.2111.9176.5179.8179.5-400107.7T603Q601-T603 HydrophobicContact CG-CG2 4.44Å
602T38.3Very low37.6Very low87 Ų87148.8 Ų148.853%0.53480%0.8SS.*  trans-109.5105.2178.744.80000109.5
603T34.5Very low37.1Very low108 Ų108143.9 Ų143.966%0.66379%0.792SS**  trans-93.2108.8174.848.40000110Q601 S605Q601-T603 HydrophobicContact CG-CG2 4.44Å; T603-S605 PolarHBondContact O-N 3.19Å
604F34.7Very low36.4Very low194 Ų194136.9 Ų136.985%0.85178%0.779SS**  trans-78111.7168.9-65.7-82.3000109.3
605S34.7Very low36Very low113 Ų113137 Ų13779%0.7978%0.778SS**PPolyproline II helixtrans-78.9126.8169-600000109.4T603T603-S605 PolarHBondContact O-N 3.19Å
606S33.9Very low35.5Very low106 Ų106137.4 Ų137.474%0.74177%0.771SS**PPolyproline II helixtrans-59.4137164.654.80000109.6S608S606-S608 PolarHBondContact O-N 3.19Å; S606-S608 VanDerWaalsContact O-N 3.12Å
607S32Very low35Very low119 Ų119138.6 Ų138.683%0.83277%0.773SS**PPolyproline II helixtrans-58.3117174.836.90000110.6
608S29.1Very low34.5Very low101 Ų101135.7 Ų135.771%0.70676%0.763SS**PPolyproline II helixtrans-61137.5170.453.20000109.8S606 L610S606-S608 PolarHBondContact O-N 3.19Å; S606-S608 VanDerWaalsContact O-N 3.12Å; S608-L610 PolarHBondContact O-N 2.65Å
609S32Very low33.9Very low116 Ų116128.8 Ų128.881%0.81176%0.757SS**PPolyproline II helixtrans-55.8127.4167.341.80000109.8
610L34.3Very low33.5Very low160 Ų160131.2 Ų131.284%0.83876%0.757SS**PPolyproline II helixtrans-64.6135.5177.6-92.476000109.8S608S608-L610 PolarHBondContact O-N 2.65Å
611P33.4Very low32.8Very low109 Ų109135.4 Ų135.471%0.70878%0.775SS**PPolyproline II helixtrans-67.6138.6174.928.5-34.2000110.5N613P611-N613 PolarHBondContact O-N 3.21Å
612A35.5Very low32.5Very low108 Ų108135.3 Ų135.389%0.89378%0.779SS**  trans-68103.2177.200000111
613N32.1Very low32.2Very low148 Ų148136.8 Ų136.879%0.79179%0.79SS**  trans-78.7138.3168.7-93.2-54.8000110.6P611P611-N613 PolarHBondContact O-N 3.21Å
614P33.7Very low32Very low101 Ų101138 Ų13866%0.65680%0.797SS**  trans-70.7155.4-178.129.4-35.5000112.5R616P614-R616 PolarHBondContact O-N 2.84Å; P614-R616 VanDerWaalsContact O-N 3.15Å
615P30.3Very low32.2Very low134 Ų134136.7 Ų136.787%0.8780%0.797SS**  trans-66.3113.4-176.126.5-34.7000112.2A617P615-A617 PolarHBondContact O-N 3.2Å
616R30.4Very low31.9Very low219 Ų219134 Ų13483%0.82679%0.787SS**  trans-74.4106.1168.2-84.1-174.5167-177.2-3.2110.2P614 Y618P614-R616 PolarHBondContact O-N 2.84Å; P614-R616 VanDerWaalsContact O-N 3.15Å; R616-Y618 PolarHBondContact O-N 2.95Å; R616-Y618 VanDerWaalsContact O-N 3.16Å
617A31.4Very low31.9Very low98 Ų98140.9 Ų140.981%0.8180%0.797SS**  trans-65.8108.4171.900000111.1P615 A619P615-A617 PolarHBondContact O-N 3.2Å; A617-A619 PolarHBondContact O-N 3Å; A617-A619 VanDerWaalsContact O-N 3.13Å
618Y30.2Very low31.9Very low196 Ų196141.9 Ų141.977%0.76980%0.798SS**  trans-80.787172.3-93.3-82.8000111R616 H620R616-Y618 PolarHBondContact O-N 2.95Å; R616-Y618 VanDerWaalsContact O-N 3.16Å; Y618-H620 PolarHBondContact O-N 2.78Å; Y618-H620 VanDerWaalsContact O-N 3.11Å
619A29.2Very low32Very low91 Ų91140.2 Ų140.275%0.75280%0.796SS**  trans-70.2100.7167.900000110.1A617 K621A617-A619 PolarHBondContact O-N 3Å; A617-A619 VanDerWaalsContact O-N 3.13Å; A619-K621 PolarHBondContact O-N 3.49Å
620H31.5Very low32.1Very low178 Ų178143.9 Ų143.982%0.82480%0.798SS**  trans-66.693.1175.5-83.3-92.9000111.5Y618Y618-H620 PolarHBondContact O-N 2.78Å; Y618-H620 VanDerWaalsContact O-N 3.11Å
621K31.4Very low31.8Very low197 Ų197141.9 Ų141.986%0.85779%0.794SS**  trans-79.2120.2156.6-74.7-168.1177-175.80108.9A619A619-K621 PolarHBondContact O-N 3.49Å
622L30.7Very low31.7Very low158 Ų158143.1 Ų143.183%0.82780%0.799SS**  trans-61.8131.4174.6-68160.6000110V624L622-V624 PolarHBondContact O-N 3.44Å
623P31Very low31.3Very low118 Ų118148 Ų14877%0.76680%0.795SS**  trans-71.7109.2171.228.9-32.1000109.5I625P623-I625 PolarHBondContact O-N 3.48Å
624V30.8Very low31.1Very low135 Ų135152.3 Ų152.382%0.81880%0.8SS**  trans-63133.5170.4175.20000109L622 G626L622-V624 PolarHBondContact O-N 3.44Å; V624-G626 VanDerWaalsContact C-N 3.27Å; V624-G626 PolarHBondContact O-N 3.07Å
625I38Very low30.9Very low166 Ų166158.2 Ų158.285%0.85181%0.809SS**  trans-73.881.6179.8-58175000109.6P623P623-I625 PolarHBondContact O-N 3.48Å
626G29.3Very low30.7Very low57 Ų57158.2 Ų158.259%0.58881%0.807SS**  trans-80.4120.9170.400000111.1V624 V628V624-G626 VanDerWaalsContact C-N 3.27Å; V624-G626 PolarHBondContact O-N 3.07Å; G626-V628 PolarHBondContact O-N 3.38Å; G626-V628 VanDerWaalsContact O-N 3.08Å
627R34.7Very low30.6Very low249 Ų249153.2 Ų153.294%0.9480%0.804SS**  trans-68.6102.4171.3-73.1179.2175.1165.3-2.2109.8G629R627-G629 PolarHBondContact O-N 2.97Å
628V30.5Very low30.3Very low141 Ų141153.9 Ų153.986%0.85580%0.803SS**  trans-73.197.9170-177.30000108.8G626 K630G626-V628 PolarHBondContact O-N 3.38Å; G626-V628 VanDerWaalsContact O-N 3.08Å; V628-K630 PolarHBondContact O-N 3.24Å
629G32.2Very low30.2Very low65 Ų65153 Ų15367%0.6781%0.805SS**PPolyproline II helixtrans-64.9122.3171.600000110.5R627R627-G629 PolarHBondContact O-N 2.97Å
630K33Very low30.2Very low194 Ų194159.6 Ų159.684%0.84381%0.812SS**PPolyproline II helixtrans-61.9132.1168.8-68.4178.3178.3177.80108.4V628 V632V628-K630 PolarHBondContact O-N 3.24Å; K630-V632 PolarHBondContact O-N 2.8Å
631P28.5Very low30Very low118 Ų118155 Ų15577%0.76680%0.801SS**PPolyproline II helixtrans-64.7123.6174.926.3-33.1000109.5R633P631-R633 PolarHBondContact O-N 3.15Å
632V31.6Very low29.8Very low134 Ų134153.4 Ų153.481%0.81280%0.801SS**  trans-65.8105.8174.3177.30000108.1K630 R634K630-V632 PolarHBondContact O-N 2.8Å; V632-R634 PolarHBondContact O-N 2.73Å
633R27.4Very low29.5Very low212 Ų212156.2 Ų156.280%0.880%0.802SS**  trans-65.8102.7169.2-73.4-171.2176-163.70.1108.3P631 W635P631-R633 PolarHBondContact O-N 3.15Å; R633-W635 PolarHBondContact O-N 3.4Å
634R26.5Very low29.5Very low237 Ų237156.8 Ų156.889%0.89480%0.797SS**  trans-63114.1158.1-77.5-175.4175.4173.1-1.2107.2V632V632-R634 PolarHBondContact O-N 2.73Å
635W30.3Very low29.3Very low226 Ų226155.7 Ų155.786%0.85679%0.793SS**PPolyproline II helixtrans-76.8123.6166.5-7266.1000107.6R633R633-W635 PolarHBondContact O-N 3.4Å
636T26.3Very low29Very low133 Ų133159.9 Ų159.982%0.81682%0.816SS**PPolyproline II helixtrans-70.6134.5169.346.30000109.1S638T636-S638 PolarHBondContact O-N 3.37Å
637C27.3Very low29Very low115 Ų115165 Ų16578%0.77783%0.827SS**PPolyproline II helixtrans-54.7135.1173.5-65.20000110.8H639C637-H639 PolarHBondContact O-N 2.72Å
638S27Very low28.7Very low111 Ų111160.6 Ų160.678%0.77682%0.821SS**  trans-67.5114.2167.548.60000109.2T636 Y640T636-S638 PolarHBondContact O-N 3.37Å; S638-Y640 PolarHBondContact O-N 3.32Å
639H26.4Very low28.6Very low178 Ų178161.7 Ų161.782%0.82482%0.82SS**  trans-69.887.9174.2-74.9-95.4000111.1C637C637-H639 PolarHBondContact O-N 2.72Å
640Y30.1Very low28.3Very low229 Ų229167.4 Ų167.490%0.89883%0.828SS**  trans-141128.6149.1-83.7-69.9000109.2S638S638-Y640 PolarHBondContact O-N 3.32Å
641S26.1Very low28Very low83 Ų83165.7 Ų165.758%0.5883%0.827SS**  trans-101.5117.1176.8178.70000108.8Y643S641-Y643 WeakPolarHBondContact OG-CD2 3.45Å
642L27.7Very low28Very low163 Ų163168.9 Ų168.985%0.85383%0.831SS**  trans-85.3112.1144.6-66.5177000105.3L644L642-L644 PolarHBondContact O-N 3.22Å
643Y25.5Very low27.8Very low217 Ų217171.4 Ų171.485%0.85183%0.833SS**  trans-75.7106.8-179-115.3-85.5000109.2S641S641-Y643 WeakPolarHBondContact OG-CD2 3.45Å
644L30.5Very low27.8Very low129 Ų129168.2 Ų168.268%0.67584%0.835SS**  trans-129.7127161.8-82.6169.2000107.9T269 L642T269-L644 HydrophobicContact CG2-CD1 3.8Å; L642-L644 PolarHBondContact O-N 3.22Å
645P26.9Very low27.9Very low113 Ų113162.5 Ų162.573%0.73483%0.83SS**  trans-87.5122.1179.832.5-30.8000111.8
646L30.7Very low27.7Very low253 Ų253156.7 Ų156.7100%1.32583%0.828SS**  trans59.60167.5-65.1172.2000116.3

Retrieved 646 of 646 residues in 952.1 ms (Link to these results)