A0A087XIY6_POEFO Loading...

Alpha-1D adrenergic receptor

This alpha-adrenergic receptor mediates its effect through the influx of extracellular calcium.

AlphaFold DB , UniProt , Accession A0A087XIY6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 501 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
1M32.3Very low30.6Very low236 Ų236153.2 Ų153.2100%1.16380%0.798SS**  0115.30-81.7170160.800106.6
2T33.7Very low30.4Very low123 Ų123159.7 Ų159.776%0.75581%0.807SS**  cis-171.2118.98.118.80000103.3
3D30.6Very low30.2Very low156 Ų156152.2 Ų152.283%0.83480%0.795SS**  64.7112.4102.2-84.5-33.5000117.6
4A31.8Very low29.9Very low80 Ų80153.5 Ų153.566%0.66180%0.802SS**  51.7123.1129.200000121.3
5N31.7Very low29.6Very low159 Ų159158.2 Ų158.285%0.8581%0.807SS**  -156.4123.2124.4-115.6-41.4000114.4
6L31.3Very low29.5Very low146 Ų146160.4 Ų160.476%0.76481%0.81SS**  trans-65.4143.9162.2-76.283.8000111.1
7R29.2Very low29.5Very low224 Ų224161.3 Ų161.385%0.84581%0.81SS**  175.5124.2109.7-114.5174.6-101.8-137.3-6.8114.8
8N27.9Very low29.7Very low136 Ų136159.7 Ų159.773%0.72781%0.811SS**  trans35.7114.6134.3-85.3-7.2000120.3
9K30.4Very low29.9Very low217 Ų217160.8 Ų160.894%0.94381%0.81SS**  -135.3110.2124-114.2175.7-178.5175.60109.8
10S29.3Very low29.8Very low76 Ų76158.6 Ų158.653%0.53180%0.8SS.*  trans-77.1152.7179.4-52.70000113
11N28.3Very low30.4Very low132 Ų132156.2 Ų156.271%0.70679%0.794SS**  trans70.8126147.4-57.2-19.7000116
12Y28Very low30.6Very low231 Ų231148 Ų14891%0.90676%0.759SS**  cis-150.1138.749.5-66.1-93.9000111.8
13G28.1Very low30.7Very low63 Ų63145 Ų14565%0.64975%0.747SS**  trans176.293.7170.400000110.6Y15G13-Y15 PolarHBondContact O-N 3.29Å
14L25.8Very low31.1Very low170 Ų170143.1 Ų143.189%0.8974%0.736SS**  trans-53.3115.2-178.8-120.883.1000111.1
15Y26.1Very low31.5Very low224 Ų224146.5 Ų146.588%0.87874%0.738SS**PPolyproline II helixtrans-74123.7160.9-81.6-99.1000108.1G13G13-Y15 PolarHBondContact O-N 3.29Å
16F27.8Very low31.9Very low194 Ų194149.3 Ų149.385%0.85174%0.737SS**PPolyproline II helixtrans-99.8127.3157.9-140.4-90.3000107.1
17E29.7Very low32.6Very low175 Ų175147.9 Ų147.982%0.81873%0.729SS**PPolyproline II helixtrans-50.7133.7-165.4-69.8176.3136.500114.1F19E17-F19 PolarHBondContact O-N 3.04Å; E17-F19 VanDerWaalsContact O-N 3.09Å
18T33.4Very low33.1Very low133 Ų133144.5 Ų144.582%0.81672%0.721SS**  trans-52.8108.6157.439.70000109.3N20T18-N20 PolarHBondContact O-N 3.36Å
19F32.2Very low33.6Very low181 Ų181143.5 Ų143.579%0.79472%0.722SS**  trans-60.6119.6167.7-152-100.2000107.9E17 V21 L24E17-F19 PolarHBondContact O-N 3.04Å; E17-F19 VanDerWaalsContact O-N 3.09Å; F19-V21 PolarHBondContact O-N 2.99Å; F19-L24 HydrophobicContact CE1-CD1 4.43Å
20N29.2Very low33.9Very low116 Ų116140.2 Ų140.262%0.6271%0.714SS**  trans-64.896.3-174.9-119.6-18.7000110.2T18 S22 A23T18-N20 PolarHBondContact O-N 3.36Å; N20-S22 PolarHBondContact O-N 3.43Å; N20-S22 VanDerWaalsContact O-N 3.12Å; N20-S22 PolarHBondContact OD1-OG 2.82Å; N20-A23 PolarHBondContact O-N 2.95Å
21V42.3Very low34.6Very low109 Ų109144.4 Ų144.466%0.66173%0.731SS**Hα-helixtrans-56.3-25.7176.8176.90000111.8F19 A23 L24F19-V21 PolarHBondContact O-N 2.99Å; V21-A23 VanDerWaalsContact C-N 3.34Å; V21-A23 PolarHBondContact O-N 3.36Å; V21-L24 PolarHBondContact O-N 2.94Å
22S35.5Very low35.2Very low63 Ų63145.2 Ų145.244%0.44174%0.735SS.*Hα-helixtrans-73-14.7-179.354.30000115.6N20N20-S22 PolarHBondContact O-N 3.43Å; N20-S22 VanDerWaalsContact O-N 3.12Å; N20-S22 PolarHBondContact OD1-OG 2.82Å
23A36.7Very low36.1Very low61 Ų61141.4 Ų141.450%0.50473%0.729SS.*Hα-helixtrans-90.3-25.3176.600000112.7N20 V21N20-A23 PolarHBondContact O-N 2.95Å; V21-A23 VanDerWaalsContact C-N 3.34Å; V21-A23 PolarHBondContact O-N 3.36Å
24L38.9Very low37.2Very low115 Ų115144.7 Ų144.760%0.60274%0.736SS**Hα-helixtrans-82.9-27.1179.1-138.498000112.4F19 V21 R26 I27F19-L24 HydrophobicContact CE1-CD1 4.43Å; V21-L24 PolarHBondContact O-N 2.94Å; L24-R26 PolarHBondContact O-N 3.28Å; L24-I27 PolarHBondContact O-N 3.15Å
25E39.3Very low38.4Very low152 Ų152144.2 Ų144.271%0.7173%0.727SS**THydrogen-bonded Turntrans-65.1-17176.4-104.5174.2164.300114.2
26R41.6Very low39.9Very low218 Ų218136.2 Ų136.282%0.82370%0.703SS**THydrogen-bonded Turntrans-92-5.1-179.3-96.3-168.5-82.7-179.5-7115.2L24L24-R26 PolarHBondContact O-N 3.28Å
27I45.7Very low41Very low116 Ų116130.2 Ų130.260%0.59570%0.697SS**THydrogen-bonded Turntrans-105.1-17.5-172.5-58.9178.3000112.4L24L24-I27 PolarHBondContact O-N 3.15Å
28F38.6Very low42Very low152 Ų152129.2 Ų129.267%0.66770%0.697SS**  trans-137.295-179.8-64.3-78.5000111.6D30F28-D30 PolarHBondContact O-N 2.78Å
29P39.3Very low43.1Very low116 Ų116128 Ų12875%0.75368%0.68SS**  trans-89.488.8172.733.7-24.1000108.2
30D37.1Very low44.3Very low147 Ų147124.1 Ų124.179%0.78667%0.672SS**  trans-154.3118.4160.6-88.8-39000110.1F28 N32F28-D30 PolarHBondContact O-N 2.78Å; D30-N32 VanDerWaalsContact C-N 3.31Å; D30-N32 PolarHBondContact O-N 3.07Å
31D43.3Very low46.1Very low165 Ų165125.7 Ų125.788%0.88268%0.677SS**THydrogen-bonded Turntrans-64.365.2-173.3-76.8-45.7000114.9
32N40.6Very low47.9Very low149 Ų149123.6 Ų123.680%0.79766%0.662SS**THydrogen-bonded Turntrans-138.61.3168.2-85.7-38.7000115D30 T34D30-N32 VanDerWaalsContact C-N 3.31Å; D30-N32 PolarHBondContact O-N 3.07Å; N32-T34 PolarHBondContact O-N 3.05Å
33I46.2Very low50.2Low151 Ų151125.7 Ų125.777%0.77467%0.674SS**SBendtrans-103.859.1-178.3-48.4178.4000110.2
34T51Low52.5Low131 Ų131129.8 Ų129.880%0.80468%0.683SS**  trans-160.281.2166.30.30000110N32N32-T34 PolarHBondContact O-N 3.05Å
35K51.9Low54.8Low161 Ų161126.3 Ų126.370%0.767%0.666SS**  trans-163.116.3164.6-111.5169.7-164.9-174.40116.3T193K35-T193 HydrophobicContact CB-CG2 4.28Å
36C56.9Low57.1Low55 Ų55122 Ų12237%0.37265%0.65SS.*SBendtrans-99.1109.3160.2-72.50000106.6C110 V112C36-C110 HydrophobicContact CB-CB 4.11Å; C36-C110 WeakPolarHBondContact CB-SG 3.26Å; C36-C110 WeakPolarHBondContact SG-CB 3.35Å; C36-C110 CovalentContact SG-SG 2Å; C36-C110 PolarHBondContact SG-SG 3.44Å; C36-V112 VanDerWaalsContact SG-CG1 3.58Å
37G51.4Low59.4Low69 Ų69113.4 Ų113.471%0.71163%0.629SS**  trans-53.3151.9-174.300000112.6F39G37-F39 PolarHBondContact O-N 3.44Å; G37-F39 VanDerWaalsContact O-N 3.14Å
38N51.1Low61.5Low154 Ų154110.8 Ų110.882%0.82462%0.619SS**  trans-38.9118.5179.7-69.1-21.4000111.5T40N38-T40 VanDerWaalsContact C-N 3.27Å; N38-T40 PolarHBondContact O-N 3.47Å
39F55.7Low64Low107 Ų107104.6 Ų104.647%0.46960%0.598SS.*  trans-60.291.9171-175.6-97.9000108.5G37 M41 V45 V107 L108G37-F39 PolarHBondContact O-N 3.44Å; G37-F39 VanDerWaalsContact O-N 3.14Å; F39-M41 HydrophobicContact CD1-CE 4.21Å; F39-M41 HydrophobicContact CD1-CG 4.26Å; F39-M41 HydrophobicContact CD1-SD 4.5Å; F39-M41 HydrophobicContact CE1-CE 3.72Å; F39-M41 HydrophobicContact CE1-CG 4.02Å; F39-M41 HydrophobicContact CE1-SD 3.76Å; F39-V45 HydrophobicContact CE2-CG1 4.38Å; F39-V107 HydrophobicContact CE2-CG1 4.02Å; F39-L108 HydrophobicContact CD2-CD2 4.33Å
40T58.7Low66.5Low99 Ų99104.1 Ų104.161%0.60759%0.588SS**  trans-76125.3170.450.50000106.5N38 D42N38-T40 VanDerWaalsContact C-N 3.27Å; N38-T40 PolarHBondContact O-N 3.47Å; T40-D42 PolarHBondContact O-N 2.8Å
41M66Low69.2Low149 Ų149103.8 Ų103.873%0.73458%0.58SS**  trans-70.857.2173.1-69.8-98.6-175.900109.8F39 P43F39-M41 HydrophobicContact CD1-CE 4.21Å; F39-M41 HydrophobicContact CD1-CG 4.26Å; F39-M41 HydrophobicContact CD1-SD 4.5Å; F39-M41 HydrophobicContact CE1-CE 3.72Å; F39-M41 HydrophobicContact CE1-CG 4.02Å; F39-M41 HydrophobicContact CE1-SD 3.76Å; M41-P43 WeakPolarHBondContact O-CD 3.27Å
42D80.8Confident71.6Confident65 Ų6596.2 Ų96.235%0.34854%0.54SS..  trans-67.4125.8172.6-176.5-3.7000108T40 Q44 V45 V46T40-D42 PolarHBondContact O-N 2.8Å; D42-Q44 PolarHBondContact O-N 3.16Å; D42-Q44 PolarHBondContact OD1-N 2.89Å; D42-Q44 VanDerWaalsContact OD1-N 3.17Å; D42-V45 HydrophobicContact CB-CB 4.49Å; D42-V45 HydrophobicContact CB-CG2 4.11Å; D42-V45 PolarHBondContact O-N 2.96Å; D42-V46 PolarHBondContact O-N 3.45Å; D42-V46 VanDerWaalsContact O-N 3.14Å
43P84.4Confident74.2Confident107 Ų10792 Ų9270%0.69553%0.525SS*.Hα-helixtrans-47.4-30.7174-30.635.3000114.3M41 G47M41-P43 WeakPolarHBondContact O-CD 3.27Å; P43-G47 PolarHBondContact O-N 3.31Å
44Q84.8Confident76.5Confident148 Ų14888.7 Ų88.769%0.69251%0.512SS*.Hα-helixtrans-68.9-41.4178.2-59.8-170.38.200113D42 G47 T48D42-Q44 PolarHBondContact O-N 3.16Å; D42-Q44 PolarHBondContact OD1-N 2.89Å; D42-Q44 VanDerWaalsContact OD1-N 3.17Å; Q44-G47 PolarHBondContact O-N 3.07Å; Q44-T48 WeakPolarHBondContact O-CB 3.34Å; Q44-T48 PolarHBondContact O-N 3.01Å; Q44-T48 PolarHBondContact O-OG1 3.45Å
45V85.6Confident78.6Confident41 Ų4183.3 Ų83.325%0.24848%0.477CS..Hα-helixtrans-69.3-43.3178.7176.80000110F39 D42 G47 T48 G49 V107F39-V45 HydrophobicContact CE2-CG1 4.38Å; D42-V45 HydrophobicContact CB-CB 4.49Å; D42-V45 HydrophobicContact CB-CG2 4.11Å; D42-V45 PolarHBondContact O-N 2.96Å; V45-G47 PolarHBondContact O-N 3.49Å; V45-T48 PolarHBondContact O-N 3.17Å; V45-G49 PolarHBondContact O-N 3.18Å; V45-V107 HydrophobicContact CG1-CG1 3.86Å
46V87.6Confident80.7Confident61 Ų6176.5 Ų76.537%0.3745%0.448SS..Hα-helixtrans-61.9-44.2175.1178.30000110.9D42 T48 G49 I50D42-V46 PolarHBondContact O-N 3.45Å; D42-V46 VanDerWaalsContact O-N 3.14Å; V46-T48 PolarHBondContact O-N 3.2Å; V46-G49 PolarHBondContact O-N 3.41Å; V46-I50 HydrophobicContact CG1-CD1 3.98Å; V46-I50 WeakPolarHBondContact O-CG1 3.43Å; V46-I50 PolarHBondContact O-N 3.2Å
47G90.4Very high82.6Confident38 Ų3879.1 Ų79.139%0.39246%0.458SS..Hα-helixtrans-59.2-45175.700000112.7P43 Q44 V45 I50 F51P43-G47 PolarHBondContact O-N 3.31Å; Q44-G47 PolarHBondContact O-N 3.07Å; V45-G47 PolarHBondContact O-N 3.49Å; G47-I50 PolarHBondContact O-N 3.47Å; G47-F51 WeakPolarHBondContact O-CB 3.24Å; G47-F51 PolarHBondContact O-N 3.09Å
48T89.3Confident84.6Confident61 Ų6179.5 Ų79.537%0.37445%0.446SS..Hα-helixtrans-62.2-46.3176-57.50000111.3Q44 V45 V46 I50 F51 L52 E106Q44-T48 WeakPolarHBondContact O-CB 3.34Å; Q44-T48 PolarHBondContact O-N 3.01Å; Q44-T48 PolarHBondContact O-OG1 3.45Å; V45-T48 PolarHBondContact O-N 3.17Å; V46-T48 PolarHBondContact O-N 3.2Å; T48-I50 PolarHBondContact O-N 3.03Å; T48-F51 PolarHBondContact O-N 3.29Å; T48-L52 HydrophobicContact CG2-CD1 4Å; T48-L52 HydrophobicContact CG2-CG 4.3Å; T48-L52 VanDerWaalsContact O-CG 3.32Å; T48-L52 WeakPolarHBondContact O-CG 3.39Å; T48-L52 PolarHBondContact O-N 3.37Å; T48-E106 HydrophobicContact CG2-CG 4.34Å
49G91.2Very high86.7Confident22 Ų2272.1 Ų72.123%0.22741%0.407CS..Hα-helixtrans-59.3-44.2177.400000113.3V45 V46 L52 A53V45-G49 PolarHBondContact O-N 3.18Å; V46-G49 PolarHBondContact O-N 3.41Å; G49-L52 PolarHBondContact O-N 3.34Å; G49-A53 WeakPolarHBondContact O-CB 2.96Å; G49-A53 PolarHBondContact O-N 3.48Å
50I93.2Very high88.7Confident107 Ų10768.9 Ų68.955%0.54939%0.394SS..Hα-helixtrans-63.5-45.2176-67.3168.4000110.7V46 G47 T48 L52 A53 V54V46-I50 HydrophobicContact CG1-CD1 3.98Å; V46-I50 WeakPolarHBondContact O-CG1 3.43Å; V46-I50 PolarHBondContact O-N 3.2Å; G47-I50 PolarHBondContact O-N 3.47Å; T48-I50 PolarHBondContact O-N 3.03Å; I50-L52 PolarHBondContact O-N 2.92Å; I50-A53 PolarHBondContact O-N 3.17Å; I50-V54 WeakPolarHBondContact O-CG2 3.22Å; I50-V54 PolarHBondContact O-N 3.21Å
51F94.2Very high90.5Very high139 Ų13967.5 Ų67.561%0.6139%0.386SS*.Hα-helixtrans-59.1-47.9178.2172.9-99.3000111.7G47 T48 A53 V54 F55G47-F51 WeakPolarHBondContact O-CB 3.24Å; G47-F51 PolarHBondContact O-N 3.09Å; T48-F51 PolarHBondContact O-N 3.29Å; F51-A53 PolarHBondContact O-N 2.95Å; F51-V54 PolarHBondContact O-N 3.05Å; F51-F55 WeakPolarHBondContact O-CB 3.36Å; F51-F55 PolarHBondContact O-N 3.11Å
52L93.4Very high91.8Very high7 Ų760.9 Ų60.94%0.03736%0.355CS..Hα-helixtrans-64.9-38.7178.5-66.7-179.4000112.1T48 G49 I50 F55 I56 A103 E106 W337T48-L52 HydrophobicContact CG2-CD1 4Å; T48-L52 HydrophobicContact CG2-CG 4.3Å; T48-L52 VanDerWaalsContact O-CG 3.32Å; T48-L52 WeakPolarHBondContact O-CG 3.39Å; T48-L52 PolarHBondContact O-N 3.37Å; G49-L52 PolarHBondContact O-N 3.34Å; I50-L52 PolarHBondContact O-N 2.92Å; L52-F55 WeakPolarHBondContact O-CB 3.43Å; L52-F55 PolarHBondContact O-N 3.31Å; L52-I56 WeakPolarHBondContact O-CD1 3.19Å; L52-I56 WeakPolarHBondContact O-CG1 3.41Å; L52-I56 PolarHBondContact O-N 3.01Å; L52-A103 HydrophobicContact CB-CB 4.03Å; L52-A103 HydrophobicContact CD1-CB 3.87Å; L52-E106 HydrophobicContact CD1-CB 4.12Å; L52-E106 HydrophobicContact CD1-CG 4.24Å; L52-W337 HydrophobicContact CD1-CH2 4.13Å; L52-W337 HydrophobicContact CD1-CZ2 3.8Å; L52-W337 HydrophobicContact CD2-CD2 3.96Å; L52-W337 HydrophobicContact CD2-CE3 3.83Å; L52-W337 HydrophobicContact CD2-CH2 3.58Å; L52-W337 HydrophobicContact CD2-CZ2 3.68Å; L52-W337 HydrophobicContact CD2-CZ3 3.64Å; L52-W337 HydrophobicContact CG-CH2 4.34Å; L52-W337 HydrophobicContact CG-CZ2 4.36Å
53A94.3Very high92.6Very high59 Ų5957.9 Ų57.949%0.48834%0.339SS..Hα-helixtrans-63.2-44175.500000112.3G49 I50 F51 F55 I56 L57G49-A53 WeakPolarHBondContact O-CB 2.96Å; G49-A53 PolarHBondContact O-N 3.48Å; I50-A53 PolarHBondContact O-N 3.17Å; F51-A53 PolarHBondContact O-N 2.95Å; A53-F55 VanDerWaalsContact C-N 3.35Å; A53-I56 PolarHBondContact O-N 2.89Å; A53-L57 WeakPolarHBondContact O-CB 3.21Å; A53-L57 PolarHBondContact O-N 2.98Å
54V95.3Very high93.1Very high82 Ų8256 Ų5650%0.49732%0.323SS..Hα-helixtrans-63.6-43.1174.9172.50000110.7I50 F51 I56 L57 V58I50-V54 WeakPolarHBondContact O-CG2 3.22Å; I50-V54 PolarHBondContact O-N 3.21Å; F51-V54 PolarHBondContact O-N 3.05Å; V54-I56 PolarHBondContact O-N 2.78Å; V54-L57 PolarHBondContact O-N 3.35Å; V54-V58 HydrophobicContact CG1-CG2 4.4Å; V54-V58 VanDerWaalsContact O-CG2 3.32Å; V54-V58 WeakPolarHBondContact O-CG2 3.49Å; V54-V58 PolarHBondContact O-N 3.39Å
55F94.6Very high93.5Very high18 Ų1850.5 Ų50.58%0.07930%0.298CS..Hα-helixtrans-56.8-49.7176.5171.7-102.2000111.9F51 L52 A53 L57 V58 A59 L99 W337 F341 C344F51-F55 WeakPolarHBondContact O-CB 3.36Å; F51-F55 PolarHBondContact O-N 3.11Å; L52-F55 WeakPolarHBondContact O-CB 3.43Å; L52-F55 PolarHBondContact O-N 3.31Å; A53-F55 VanDerWaalsContact C-N 3.35Å; F55-L57 PolarHBondContact O-N 2.92Å; F55-V58 PolarHBondContact O-N 2.82Å; F55-A59 PolarHBondContact O-N 3.45Å; F55-L99 HydrophobicContact CD1-CD1 4.47Å; F55-L99 HydrophobicContact CE1-CD1 3.83Å; F55-L99 HydrophobicContact CE1-CD2 4.48Å; F55-W337 HydrophobicContact CD1-CE3 4.21Å; F55-W337 AromaticContact CD1-CZ3 3.84Å; F55-W337 HydrophobicContact CD1-CZ3 3.84Å; F55-W337 AromaticContact CE1-CE3 3.9Å; F55-W337 HydrophobicContact CE1-CE3 3.9Å; F55-W337 AromaticContact CE1-CZ3 3.72Å; F55-W337 HydrophobicContact CE1-CZ3 3.72Å; F55-F341 HydrophobicContact CD2-CD2 4.28Å; F55-F341 HydrophobicContact CE2-CB 4.27Å; F55-F341 AromaticContact CE2-CD2 3.69Å; F55-F341 HydrophobicContact CE2-CD2 3.69Å; F55-F341 HydrophobicContact CE2-CG 4.44Å; F55-C344 HydrophobicContact CE2-CB 4.11Å; F55-C344 WeakPolarHBondContact CE2-SG 3.49Å
56I96Very high93.9Very high19 Ų1948.5 Ų48.510%0.09729%0.286CS..Hα-helixtrans-61.8-44.4177.5-67.3165.5000111L52 A53 V54 V58 A59 I60 L99 P100 A103L52-I56 WeakPolarHBondContact O-CD1 3.19Å; L52-I56 WeakPolarHBondContact O-CG1 3.41Å; L52-I56 PolarHBondContact O-N 3.01Å; A53-I56 PolarHBondContact O-N 2.89Å; V54-I56 PolarHBondContact O-N 2.78Å; I56-V58 VanDerWaalsContact C-N 3.33Å; I56-V58 PolarHBondContact O-N 3.4Å; I56-A59 WeakPolarHBondContact O-CB 3.45Å; I56-A59 PolarHBondContact O-N 3.12Å; I56-I60 HydrophobicContact CG2-CD1 3.7Å; I56-I60 HydrophobicContact CG2-CG1 4.32Å; I56-I60 WeakPolarHBondContact O-CG1 3.4Å; I56-I60 PolarHBondContact O-N 3.01Å; I56-L99 HydrophobicContact CD1-CB 4.06Å; I56-L99 HydrophobicContact CG1-CB 3.74Å; I56-L99 HydrophobicContact CG1-CD1 4.25Å; I56-P100 HydrophobicContact CG2-CG 4.45Å; I56-A103 HydrophobicContact CD1-CB 3.94Å
57L96Very high94.3Very high110 Ų11047.2 Ų47.258%0.57628%0.277SS*.Hα-helixtrans-60.7-43.6179-175.371.2000111.6A53 V54 F55 A59 I60 V61A53-L57 WeakPolarHBondContact O-CB 3.21Å; A53-L57 PolarHBondContact O-N 2.98Å; V54-L57 PolarHBondContact O-N 3.35Å; F55-L57 PolarHBondContact O-N 2.92Å; L57-A59 VanDerWaalsContact C-N 3.34Å; L57-I60 PolarHBondContact O-N 3.42Å; L57-V61 HydrophobicContact CD1-CG2 4.09Å; L57-V61 HydrophobicContact CG-CG2 4.26Å; L57-V61 WeakPolarHBondContact O-CB 3.45Å; L57-V61 VanDerWaalsContact O-CG2 3.28Å; L57-V61 WeakPolarHBondContact O-CG2 3.22Å; L57-V61 PolarHBondContact O-N 3.41Å
58V94.9Very high94.4Very high76 Ų7648.7 Ų48.746%0.46128%0.275SS..Hα-helixtrans-61.7-43.4176.3169.90000110.7V54 F55 I56 G62 C344V54-V58 HydrophobicContact CG1-CG2 4.4Å; V54-V58 VanDerWaalsContact O-CG2 3.32Å; V54-V58 WeakPolarHBondContact O-CG2 3.49Å; V54-V58 PolarHBondContact O-N 3.39Å; F55-V58 PolarHBondContact O-N 2.82Å; I56-V58 VanDerWaalsContact C-N 3.33Å; I56-V58 PolarHBondContact O-N 3.4Å; V58-G62 WeakPolarHBondContact O-CA 3.43Å; V58-G62 PolarHBondContact O-N 2.89Å; V58-C344 HydrophobicContact CG1-CB 4.49Å
59A95.4Very high94.5Very high0 Ų045.8 Ų45.80%026%0.257CS..Hα-helixtrans-60-49.8177.200000111.7F55 I56 L57 N63 S95 L99 C344F55-A59 PolarHBondContact O-N 3.45Å; I56-A59 WeakPolarHBondContact O-CB 3.45Å; I56-A59 PolarHBondContact O-N 3.12Å; L57-A59 VanDerWaalsContact C-N 3.34Å; A59-N63 WeakPolarHBondContact O-CB 3.46Å; A59-N63 PolarHBondContact O-N 3.38Å; A59-N63 PolarHBondContact O-ND2 3.23Å; A59-S95 VanDerWaalsContact CB-OG 3.29Å; A59-S95 WeakPolarHBondContact CB-OG 3.48Å; A59-L99 HydrophobicContact CB-CD1 4.42Å; A59-C344 VanDerWaalsContact CB-SG 3.52Å
60I96.7Very high94.5Very high39 Ų3945 Ų4520%0.225%0.248CC..Hα-helixtrans-63.9-54.8-179-67.2172.8000110.6I56 L57 G62 N63 I64 L92 I96I56-I60 HydrophobicContact CG2-CD1 3.7Å; I56-I60 HydrophobicContact CG2-CG1 4.32Å; I56-I60 WeakPolarHBondContact O-CG1 3.4Å; I56-I60 PolarHBondContact O-N 3.01Å; L57-I60 PolarHBondContact O-N 3.42Å; I60-G62 VanDerWaalsContact C-N 3.33Å; I60-G62 PolarHBondContact O-N 2.93Å; I60-N63 PolarHBondContact O-N 3.42Å; I60-I64 HydrophobicContact CG2-CD1 3.65Å; I60-I64 WeakPolarHBondContact O-CB 3.31Å; I60-I64 VanDerWaalsContact O-CG1 3.24Å; I60-I64 WeakPolarHBondContact O-CG1 3.4Å; I60-I64 PolarHBondContact O-N 3.08Å; I60-L92 HydrophobicContact CB-CD1 4.39Å; I60-L92 HydrophobicContact CG1-CD1 4.49Å; I60-L92 HydrophobicContact CG2-CD1 4.05Å; I60-I96 HydrophobicContact CD1-CG1 4.12Å; I60-I96 HydrophobicContact CG1-CG1 4.19Å
61V95.8Very high94.2Very high70 Ų7043 Ų4342%0.42424%0.24SC..Hα-helixtrans-62.7-43.1-177.2173.50000110.7L57 I64 L65L57-V61 HydrophobicContact CD1-CG2 4.09Å; L57-V61 HydrophobicContact CG-CG2 4.26Å; L57-V61 WeakPolarHBondContact O-CB 3.45Å; L57-V61 VanDerWaalsContact O-CG2 3.28Å; L57-V61 WeakPolarHBondContact O-CG2 3.22Å; L57-V61 PolarHBondContact O-N 3.41Å; V61-I64 PolarHBondContact O-N 2.73Å; V61-L65 HydrophobicContact CG1-CD1 4.05Å; V61-L65 HydrophobicContact CG1-CG 4.42Å; V61-L65 WeakPolarHBondContact O-CB 3.29Å; V61-L65 VanDerWaalsContact O-CG 3.28Å; V61-L65 WeakPolarHBondContact O-CG 3.16Å; V61-L65 PolarHBondContact O-N 3.05Å
62G94.9Very high93.9Very high10 Ų1038.2 Ų38.210%0.10322%0.224CC..Hα-helixtrans-59.1-51.5178.800000112.2V58 I60 I64 L65 V66 P347V58-G62 WeakPolarHBondContact O-CA 3.43Å; V58-G62 PolarHBondContact O-N 2.89Å; I60-G62 VanDerWaalsContact C-N 3.33Å; I60-G62 PolarHBondContact O-N 2.93Å; G62-I64 PolarHBondContact O-N 3.29Å; G62-L65 WeakPolarHBondContact O-CB 3.4Å; G62-L65 PolarHBondContact O-N 2.92Å; G62-V66 WeakPolarHBondContact O-CG2 3.2Å; G62-V66 PolarHBondContact O-N 3.06Å; G62-P347 VanDerWaalsContact C-CB 3.49Å
63N96Very high93.5Very high1 Ų138.6 Ų38.61%0.00523%0.226CC..Hα-helixtrans-68.3-35.9-178.4-74.4-60.9000112.4A59 I60 L65 V66 I67 A88 L92 S343A59-N63 WeakPolarHBondContact O-CB 3.46Å; A59-N63 PolarHBondContact O-N 3.38Å; A59-N63 PolarHBondContact O-ND2 3.23Å; I60-N63 PolarHBondContact O-N 3.42Å; N63-L65 VanDerWaalsContact C-N 3.34Å; N63-L65 PolarHBondContact O-N 3.4Å; N63-V66 WeakPolarHBondContact O-CB 3.41Å; N63-V66 PolarHBondContact O-N 2.88Å; N63-I67 WeakPolarHBondContact O-CG1 3.3Å; N63-I67 PolarHBondContact O-N 3.2Å; N63-I67 VanDerWaalsContact O-N 3.08Å; N63-A88 HydrophobicContact CB-CB 4.4Å; N63-L92 HydrophobicContact CB-CB 4.3Å; N63-S343 PolarHBondContact ND2-O 3.32Å
64I95.6Very high92.9Very high69 Ų6942.4 Ų42.435%0.35423%0.232SC..Hα-helixtrans-60.2-43.8170.7-69.4169000111.1I60 V61 G62 V66 I67 L68 L92I60-I64 HydrophobicContact CG2-CD1 3.65Å; I60-I64 WeakPolarHBondContact O-CB 3.31Å; I60-I64 VanDerWaalsContact O-CG1 3.24Å; I60-I64 WeakPolarHBondContact O-CG1 3.4Å; I60-I64 PolarHBondContact O-N 3.08Å; V61-I64 PolarHBondContact O-N 2.73Å; G62-I64 PolarHBondContact O-N 3.29Å; I64-V66 VanDerWaalsContact C-N 3.32Å; I64-V66 PolarHBondContact O-N 2.99Å; I64-I67 PolarHBondContact O-N 2.97Å; I64-L68 HydrophobicContact CG2-CD1 3.77Å; I64-L68 HydrophobicContact CG2-CG 4.14Å; I64-L68 WeakPolarHBondContact O-CB 3.37Å; I64-L68 WeakPolarHBondContact O-CG 3.49Å; I64-L68 PolarHBondContact O-N 3.07Å; I64-L92 HydrophobicContact CD1-CD1 4.33Å; I64-L92 HydrophobicContact CG1-CD1 3.94Å; I64-L92 HydrophobicContact CG1-CD2 4.12Å
65L93.9Very high92.2Very high31 Ų3146.3 Ų46.316%0.16224%0.244CC..Hα-helixtrans-62.2-39177.3-74.1172.1000112V61 G62 N63 L68 S69 F361 L364 L365V61-L65 HydrophobicContact CG1-CD1 4.05Å; V61-L65 HydrophobicContact CG1-CG 4.42Å; V61-L65 WeakPolarHBondContact O-CB 3.29Å; V61-L65 VanDerWaalsContact O-CG 3.28Å; V61-L65 WeakPolarHBondContact O-CG 3.16Å; V61-L65 PolarHBondContact O-N 3.05Å; G62-L65 WeakPolarHBondContact O-CB 3.4Å; G62-L65 PolarHBondContact O-N 2.92Å; N63-L65 VanDerWaalsContact C-N 3.34Å; N63-L65 PolarHBondContact O-N 3.4Å; L65-L68 PolarHBondContact O-N 2.84Å; L65-S69 VanDerWaalsContact O-CB 3.23Å; L65-S69 WeakPolarHBondContact O-CB 3.49Å; L65-S69 PolarHBondContact O-N 3.44Å; L65-F361 HydrophobicContact CB-CD1 4.28Å; L65-F361 HydrophobicContact CB-CE1 3.68Å; L65-F361 HydrophobicContact CB-CZ 3.82Å; L65-F361 HydrophobicContact CD1-CD1 4.4Å; L65-F361 HydrophobicContact CD1-CE1 4.24Å; L65-L364 HydrophobicContact CD2-CB 4.34Å; L65-L364 HydrophobicContact CD2-CD1 4.48Å; L65-L365 HydrophobicContact CD1-CD2 4.45Å
66V94.2Very high91.7Very high0 Ų045.9 Ų45.90%024%0.243CC..Hα-helixtrans-58.4-51.7173.9175.40000110.3G62 N63 I64 L68 S69 V70 I84 A88 P347 Y350 F361G62-V66 WeakPolarHBondContact O-CG2 3.2Å; G62-V66 PolarHBondContact O-N 3.06Å; N63-V66 WeakPolarHBondContact O-CB 3.41Å; N63-V66 PolarHBondContact O-N 2.88Å; I64-V66 VanDerWaalsContact C-N 3.32Å; I64-V66 PolarHBondContact O-N 2.99Å; V66-L68 PolarHBondContact O-N 3.28Å; V66-S69 WeakPolarHBondContact O-CB 3.36Å; V66-S69 PolarHBondContact O-N 3.29Å; V66-S69 PolarHBondContact O-OG 2.93Å; V66-V70 PolarHBondContact O-N 3.22Å; V66-I84 HydrophobicContact CG1-CG2 3.89Å; V66-A88 HydrophobicContact CB-CB 4.08Å; V66-A88 HydrophobicContact CG1-CB 3.86Å; V66-P347 HydrophobicContact CG2-CB 3.95Å; V66-P347 HydrophobicContact CG2-CG 4.11Å; V66-Y350 HydrophobicContact CG1-CD2 4.19Å; V66-Y350 HydrophobicContact CG1-CE2 4.26Å; V66-Y350 HydrophobicContact CG2-CD2 3.88Å; V66-Y350 HydrophobicContact CG2-CE2 4.31Å; V66-F361 HydrophobicContact CB-CZ 4.5Å; V66-F361 HydrophobicContact CG2-CE2 4.43Å; V66-F361 HydrophobicContact CG2-CZ 3.78Å
67I94.6Very high91.3Very high34 Ų3449.2 Ų49.217%0.17426%0.258CS..Hα-helixtrans-59.2-50.9179.6-63.2168000110.6N63 I64 S69 V70 V71 V85 A88 M89 L92N63-I67 WeakPolarHBondContact O-CG1 3.3Å; N63-I67 PolarHBondContact O-N 3.2Å; N63-I67 VanDerWaalsContact O-N 3.08Å; I64-I67 PolarHBondContact O-N 2.97Å; I67-S69 VanDerWaalsContact C-N 3.26Å; I67-S69 PolarHBondContact O-N 3.49Å; I67-V70 PolarHBondContact O-N 3.41Å; I67-V71 HydrophobicContact CG2-CG2 4.21Å; I67-V71 WeakPolarHBondContact O-CG2 3.47Å; I67-V71 PolarHBondContact O-N 3.41Å; I67-V85 HydrophobicContact CG1-CG1 4.38Å; I67-V85 HydrophobicContact CG2-CG1 4.49Å; I67-A88 HydrophobicContact CD1-CB 4.37Å; I67-A88 HydrophobicContact CG1-CB 3.89Å; I67-M89 HydrophobicContact CD1-CG 4.04Å; I67-L92 HydrophobicContact CD1-CD2 4.1Å
68L92.3Very high90.8Very high69 Ų6947.2 Ų47.236%0.36125%0.248SC..Hα-helixtrans-61.8-33.6179.8-70.7178.5000112.5I64 L65 V66 V70 V71 C72 L364I64-L68 HydrophobicContact CG2-CD1 3.77Å; I64-L68 HydrophobicContact CG2-CG 4.14Å; I64-L68 WeakPolarHBondContact O-CB 3.37Å; I64-L68 WeakPolarHBondContact O-CG 3.49Å; I64-L68 PolarHBondContact O-N 3.07Å; L65-L68 PolarHBondContact O-N 2.84Å; V66-L68 PolarHBondContact O-N 3.28Å; L68-V70 VanDerWaalsContact C-N 3.29Å; L68-V70 PolarHBondContact O-N 2.98Å; L68-V71 PolarHBondContact O-N 3.27Å; L68-C72 WeakPolarHBondContact O-CB 3.4Å; L68-C72 PolarHBondContact O-N 3.39Å; L68-C72 PolarHBondContact O-SG 3.43Å; L68-L364 HydrophobicContact CB-CD1 3.93Å; L68-L364 HydrophobicContact CB-CD2 3.96Å
69S91.3Very high90.4Very high0 Ų045 Ų450%023%0.233CC..Hα-helixtrans-62.6-38.1-179.277.70000111.8L65 V66 I67 N73 F357L65-S69 VanDerWaalsContact O-CB 3.23Å; L65-S69 WeakPolarHBondContact O-CB 3.49Å; L65-S69 PolarHBondContact O-N 3.44Å; V66-S69 WeakPolarHBondContact O-CB 3.36Å; V66-S69 PolarHBondContact O-N 3.29Å; V66-S69 PolarHBondContact O-OG 2.93Å; I67-S69 VanDerWaalsContact C-N 3.26Å; I67-S69 PolarHBondContact O-N 3.49Å; S69-N73 WeakPolarHBondContact O-CB 3.28Å; S69-N73 PolarHBondContact O-ND2 2.96Å; S69-F357 WeakPolarHBondContact OG-CD1 3.37Å; S69-F357 WeakPolarHBondContact OG-CE1 3.41Å
70V91.1Very high90Very high4 Ų445.7 Ų45.72%0.02424%0.237CC..Hα-helixtrans-79.7-48.2177.6179.90000110.5V66 I67 L68 C72 N73 Q77 N81 V85 F357V66-V70 PolarHBondContact O-N 3.22Å; I67-V70 PolarHBondContact O-N 3.41Å; L68-V70 VanDerWaalsContact C-N 3.29Å; L68-V70 PolarHBondContact O-N 2.98Å; V70-C72 VanDerWaalsContact C-N 3.31Å; V70-C72 PolarHBondContact O-N 2.94Å; V70-N73 PolarHBondContact O-N 2.92Å; V70-Q77 HydrophobicContact CG1-CG 4.36Å; V70-Q77 WeakPolarHBondContact O-CG 3.43Å; V70-Q77 PolarHBondContact O-NE2 2.98Å; V70-N81 HydrophobicContact CG1-CB 4.22Å; V70-N81 HydrophobicContact CG2-CB 4.19Å; V70-V85 HydrophobicContact CB-CG2 3.74Å; V70-V85 HydrophobicContact CG1-CG2 3.92Å; V70-V85 HydrophobicContact CG2-CG2 3.8Å; V70-F357 HydrophobicContact CG2-CE1 3.81Å; V70-F357 HydrophobicContact CG2-CZ 4.11Å
71V88.8Confident89.7Confident65 Ų6544.4 Ų44.439%0.39423%0.231SC..Hα-helixtrans-63.2-35.7-177.4173.40000112.3I67 L68 Q77I67-V71 HydrophobicContact CG2-CG2 4.21Å; I67-V71 WeakPolarHBondContact O-CG2 3.47Å; I67-V71 PolarHBondContact O-N 3.41Å; L68-V71 PolarHBondContact O-N 3.27Å; V71-Q77 PolarHBondContact O-NE2 3.26Å; V71-Q77 VanDerWaalsContact O-NE2 3.11Å
72C86.3Confident89.5Confident40 Ų4045.7 Ų45.727%0.2723%0.231SC..Hα-helixtrans-84.9-16.1-178.4-65.30000114.1L68 V70 C369L68-C72 WeakPolarHBondContact O-CB 3.4Å; L68-C72 PolarHBondContact O-N 3.39Å; L68-C72 PolarHBondContact O-SG 3.43Å; V70-C72 VanDerWaalsContact C-N 3.31Å; V70-C72 PolarHBondContact O-N 2.94Å; C72-C369 HydrophobicContact CB-CB 4.28Å
73N85.8Confident89.5Confident15 Ų1545.4 Ų45.48%0.0823%0.227CC..  trans-118.6101.9-176.7-66.5-75.5000111.1S69 V70 H75 L76 A360S69-N73 WeakPolarHBondContact O-CB 3.28Å; S69-N73 PolarHBondContact O-ND2 2.96Å; V70-N73 PolarHBondContact O-N 2.92Å; N73-H75 PolarHBondContact O-N 3.18Å; N73-L76 HydrophobicContact CB-CB 4.26Å; N73-L76 HydrophobicContact CB-CD1 4.05Å; N73-L76 HydrophobicContact CB-CG 4.2Å; N73-L76 WeakPolarHBondContact O-CA 3.24Å; N73-L76 WeakPolarHBondContact O-CB 3.47Å; N73-L76 PolarHBondContact O-N 3.28Å; N73-A360 VanDerWaalsContact ND2-CB 3.32Å; N73-A360 WeakPolarHBondContact ND2-CB 3Å
74K81.8Confident89.3Confident139 Ų13945.7 Ų45.760%0.60423%0.228SC*.G310 helixtrans-50.8-34.9177.2-67.8-168.5175-1680114.5L76 Q77K74-L76 PolarHBondContact O-N 3.42Å; K74-Q77 WeakPolarHBondContact O-CB 3.31Å; K74-Q77 PolarHBondContact O-N 3.48Å; K74-Q77 VanDerWaalsContact O-N 3.14Å
75H80.7Confident89.3Confident163 Ų16343.2 Ų43.276%0.75522%0.216SC*.G310 helixtrans-66.5-22.7177.7-177.2-76.3000113.4N73N73-H75 PolarHBondContact O-N 3.18Å
76L83.8Confident89.3Confident10 Ų1042.2 Ų42.25%0.05221%0.211CC..G310 helixtrans-92.2-3.5176.2-69.5177.3000112.4N73 K74 N78 N81 E356 A360N73-L76 HydrophobicContact CB-CB 4.26Å; N73-L76 HydrophobicContact CB-CD1 4.05Å; N73-L76 HydrophobicContact CB-CG 4.2Å; N73-L76 WeakPolarHBondContact O-CA 3.24Å; N73-L76 WeakPolarHBondContact O-CB 3.47Å; N73-L76 PolarHBondContact O-N 3.28Å; K74-L76 PolarHBondContact O-N 3.42Å; L76-N78 PolarHBondContact O-N 3.08Å; L76-N81 VanDerWaalsContact O-CB 3.24Å; L76-N81 WeakPolarHBondContact O-CB 3.34Å; L76-N81 PolarHBondContact O-ND2 2.91Å; L76-E356 HydrophobicContact CD2-CB 3.76Å; L76-A360 HydrophobicContact CD1-CB 3.64Å
77Q86.4Confident89.3Confident89 Ų8942.3 Ų42.342%0.41621%0.211SC..  trans-82.771179.6-65.5174.5-14.800110.1V70 V71 K74V70-Q77 HydrophobicContact CG1-CG 4.36Å; V70-Q77 WeakPolarHBondContact O-CG 3.43Å; V70-Q77 PolarHBondContact O-NE2 2.98Å; V71-Q77 PolarHBondContact O-NE2 3.26Å; V71-Q77 VanDerWaalsContact O-NE2 3.11Å; K74-Q77 WeakPolarHBondContact O-CB 3.31Å; K74-Q77 PolarHBondContact O-N 3.48Å; K74-Q77 VanDerWaalsContact O-N 3.14Å
78N85.7Confident89.4Confident68 Ų6840.8 Ų40.836%0.36420%0.204SC..SBendtrans-114.7162.6171.864.933.7000109.7L76 T80 N81 F82L76-N78 PolarHBondContact O-N 3.08Å; N78-T80 VanDerWaalsContact C-N 3.28Å; N78-T80 PolarHBondContact O-N 3.42Å; N78-T80 PolarHBondContact OD1-N 2.86Å; N78-N81 PolarHBondContact ND2-ND2 2.86Å; N78-N81 PolarHBondContact O-N 2.86Å; N78-N81 VanDerWaalsContact O-N 3.08Å; N78-N81 WeakPolarHBondContact OD1-CB 3.41Å; N78-N81 PolarHBondContact OD1-N 3.48Å; N78-N81 PolarHBondContact OD1-ND2 2.59Å; N78-N81 PolarHBondContact OD1-OD1 3.06Å; N78-F82 VanDerWaalsContact O-CD2 3.26Å; N78-F82 WeakPolarHBondContact O-CD2 3.47Å; N78-F82 PolarHBondContact O-N 3.31Å; N78-F82 VanDerWaalsContact O-N 3.15Å
79I87.9Confident89.6Confident29 Ų2942.1 Ų42.115%0.14921%0.209CC..Hα-helixtrans-59.5-39.9-173.9-59.3168.4000111.8N81 F82 F83 M157 E159 A162I79-N81 VanDerWaalsContact C-N 3.32Å; I79-N81 PolarHBondContact O-N 3.35Å; I79-F82 WeakPolarHBondContact O-CB 3.44Å; I79-F82 PolarHBondContact O-N 3.11Å; I79-F82 VanDerWaalsContact O-N 3.12Å; I79-F83 HydrophobicContact CG2-CE2 3.99Å; I79-F83 HydrophobicContact CG2-CZ 4.34Å; I79-F83 WeakPolarHBondContact O-CD2 3.41Å; I79-F83 PolarHBondContact O-N 3.27Å; I79-M157 HydrophobicContact CB-CG 4.49Å; I79-M157 HydrophobicContact CD1-CG 4.47Å; I79-M157 WeakPolarHBondContact CD1-O 3.5Å; I79-M157 HydrophobicContact CG2-CG 3.66Å; I79-E159 HydrophobicContact CG1-CG 4.48Å; I79-A162 HydrophobicContact CG2-CB 3.61Å
80T86.8Confident89.9Confident14 Ų1442.1 Ų42.19%0.08621%0.209CC..Hα-helixtrans-56.7-44.9175-470000112.8N78 F82 F83 I84 D142 R143 Y153N78-T80 VanDerWaalsContact C-N 3.28Å; N78-T80 PolarHBondContact O-N 3.42Å; N78-T80 PolarHBondContact OD1-N 2.86Å; T80-F82 VanDerWaalsContact C-N 3.28Å; T80-F82 PolarHBondContact O-N 3.4Å; T80-F83 PolarHBondContact O-N 3.47Å; T80-I84 PolarHBondContact O-N 3.35Å; T80-D142 WeakPolarHBondContact CG2-OD2 3.2Å; T80-D142 PolarHBondContact OG1-OD2 3.42Å; T80-R143 VanDerWaalsContact CG2-NH2 3.28Å; T80-R143 PolarHBondContact OG1-NH2 3.45Å; T80-Y153 PolarHBondContact OG1-OH 3Å; T80-Y153 VanDerWaalsContact OG1-OH 3.06Å
81N90.3Very high90.1Very high12 Ų1242 Ų426%0.06421%0.209CC..Hα-helixtrans-73.9-20.8-179-69-15.2000111.9V70 L76 N78 I79 I84 V85V70-N81 HydrophobicContact CG1-CB 4.22Å; V70-N81 HydrophobicContact CG2-CB 4.19Å; L76-N81 VanDerWaalsContact O-CB 3.24Å; L76-N81 WeakPolarHBondContact O-CB 3.34Å; L76-N81 PolarHBondContact O-ND2 2.91Å; N78-N81 PolarHBondContact ND2-ND2 2.86Å; N78-N81 PolarHBondContact O-N 2.86Å; N78-N81 VanDerWaalsContact O-N 3.08Å; N78-N81 WeakPolarHBondContact OD1-CB 3.41Å; N78-N81 PolarHBondContact OD1-N 3.48Å; N78-N81 PolarHBondContact OD1-ND2 2.59Å; N78-N81 PolarHBondContact OD1-OD1 3.06Å; I79-N81 VanDerWaalsContact C-N 3.32Å; I79-N81 PolarHBondContact O-N 3.35Å; N81-I84 PolarHBondContact O-N 2.95Å; N81-V85 WeakPolarHBondContact O-CG2 3.43Å; N81-V85 PolarHBondContact O-N 2.96Å
82F91.7Very high90.5Very high97 Ų9740.3 Ų40.343%0.42520%0.197SC..Hα-helixtrans-64.5-38.1168.5-81.1-77.4000112.1N78 I79 T80 I84 V85 N86N78-F82 VanDerWaalsContact O-CD2 3.26Å; N78-F82 WeakPolarHBondContact O-CD2 3.47Å; N78-F82 PolarHBondContact O-N 3.31Å; N78-F82 VanDerWaalsContact O-N 3.15Å; I79-F82 WeakPolarHBondContact O-CB 3.44Å; I79-F82 PolarHBondContact O-N 3.11Å; I79-F82 VanDerWaalsContact O-N 3.12Å; T80-F82 VanDerWaalsContact C-N 3.28Å; T80-F82 PolarHBondContact O-N 3.4Å; F82-I84 VanDerWaalsContact C-N 3.33Å; F82-I84 PolarHBondContact O-N 3.01Å; F82-V85 PolarHBondContact O-N 3.44Å; F82-N86 PolarHBondContact O-N 2.99Å
83F93.7Very high91Very high4 Ų441 Ų412%0.01820%0.198CC..Hα-helixtrans-65-37.4172.9-60.7-58.4000112.2I79 T80 V85 N86 L87 I138 I139 D142 M157 A162 I165 L166I79-F83 HydrophobicContact CG2-CE2 3.99Å; I79-F83 HydrophobicContact CG2-CZ 4.34Å; I79-F83 WeakPolarHBondContact O-CD2 3.41Å; I79-F83 PolarHBondContact O-N 3.27Å; T80-F83 PolarHBondContact O-N 3.47Å; F83-V85 VanDerWaalsContact C-N 3.33Å; F83-N86 PolarHBondContact O-N 2.94Å; F83-L87 PolarHBondContact O-N 2.88Å; F83-I138 HydrophobicContact CD1-CG2 3.81Å; F83-I138 HydrophobicContact CE1-CG2 3.68Å; F83-I138 HydrophobicContact CE2-CG2 4.48Å; F83-I138 HydrophobicContact CG-CG2 4.29Å; F83-I138 HydrophobicContact CZ-CG2 4.04Å; F83-I139 HydrophobicContact CB-CD1 4.3Å; F83-I139 HydrophobicContact CB-CG1 3.67Å; F83-D142 HydrophobicContact CD2-CB 4.26Å; F83-D142 HydrophobicContact CE2-CB 4.1Å; F83-M157 HydrophobicContact CE2-CE 3.79Å; F83-M157 HydrophobicContact CZ-CE 3.84Å; F83-M157 HydrophobicContact CZ-SD 4.4Å; F83-A162 HydrophobicContact CE1-CB 4.22Å; F83-A162 HydrophobicContact CZ-CB 3.84Å; F83-I165 HydrophobicContact CE1-CG2 4.37Å; F83-L166 HydrophobicContact CD1-CD2 3.7Å; F83-L166 HydrophobicContact CD1-CG 4.25Å; F83-L166 HydrophobicContact CE1-CD2 4.08Å; F83-L166 HydrophobicContact CE1-CG 4.22Å
84I93Very high91.5Very high7 Ų740.4 Ų40.44%0.03620%0.195CC..Hα-helixtrans-64.1-39.4174-62.9175000110.9V66 T80 N81 F82 L87 A88 Y350 F357V66-I84 HydrophobicContact CG1-CG2 3.89Å; T80-I84 PolarHBondContact O-N 3.35Å; N81-I84 PolarHBondContact O-N 2.95Å; F82-I84 VanDerWaalsContact C-N 3.33Å; F82-I84 PolarHBondContact O-N 3.01Å; I84-L87 PolarHBondContact O-N 2.98Å; I84-A88 PolarHBondContact O-N 3.39Å; I84-Y350 HydrophobicContact CD1-CE1 4.33Å; I84-Y350 HydrophobicContact CG2-CD2 4.14Å; I84-Y350 HydrophobicContact CG2-CE1 4.13Å; I84-Y350 HydrophobicContact CG2-CE2 3.61Å; I84-F357 HydrophobicContact CD1-CE2 4.31Å; I84-F357 HydrophobicContact CD1-CZ 4.23Å
85V94.3Very high92.2Very high18 Ų1833.8 Ų33.811%0.10917%0.166CC..Hα-helixtrans-64.5-42.1174.1169.60000111.1I67 V70 N81 F82 F83 L87 A88 M89I67-V85 HydrophobicContact CG1-CG1 4.38Å; I67-V85 HydrophobicContact CG2-CG1 4.49Å; V70-V85 HydrophobicContact CB-CG2 3.74Å; V70-V85 HydrophobicContact CG1-CG2 3.92Å; V70-V85 HydrophobicContact CG2-CG2 3.8Å; N81-V85 WeakPolarHBondContact O-CG2 3.43Å; N81-V85 PolarHBondContact O-N 2.96Å; F82-V85 PolarHBondContact O-N 3.44Å; F83-V85 VanDerWaalsContact C-N 3.33Å; V85-L87 VanDerWaalsContact C-N 3.32Å; V85-L87 PolarHBondContact O-N 3.28Å; V85-A88 PolarHBondContact O-N 2.99Å; V85-M89 HydrophobicContact CG1-CG 4.44Å; V85-M89 HydrophobicContact CG1-SD 4.24Å; V85-M89 WeakPolarHBondContact O-CG 3.48Å; V85-M89 PolarHBondContact O-N 3.48Å
86N95.5Very high92.9Very high10 Ų1030.3 Ų30.35%0.05315%0.152CC..Hα-helixtrans-59.7-43.6175.5-173.176.6000111.9F82 F83 M89 A90 S135 L166 W170F82-N86 PolarHBondContact O-N 2.99Å; F83-N86 PolarHBondContact O-N 2.94Å; N86-M89 WeakPolarHBondContact O-CB 3.38Å; N86-M89 PolarHBondContact O-N 3.43Å; N86-A90 PolarHBondContact O-N 2.91Å; N86-S135 PolarHBondContact ND2-OG 3.47Å; N86-L166 HydrophobicContact CB-CD1 4.29Å; N86-L166 HydrophobicContact CB-CD2 3.64Å; N86-L166 VanDerWaalsContact CG-CD2 3.46Å; N86-W170 PolarHBondContact OD1-NE1 2.76Å
87L94.6Very high93.4Very high1 Ų132.9 Ų32.91%0.00517%0.165CC..Hα-helixtrans-59.9-46.7174.5179.861.5000111.4F83 I84 V85 M89 A90 D91 L136 I139 Y350F83-L87 PolarHBondContact O-N 2.88Å; I84-L87 PolarHBondContact O-N 2.98Å; V85-L87 VanDerWaalsContact C-N 3.32Å; V85-L87 PolarHBondContact O-N 3.28Å; L87-M89 VanDerWaalsContact C-N 3.25Å; L87-M89 PolarHBondContact O-N 2.85Å; L87-A90 PolarHBondContact O-N 2.92Å; L87-D91 PolarHBondContact O-N 3.32Å; L87-L136 HydrophobicContact CD1-CG 4.31Å; L87-L136 HydrophobicContact CD2-CD2 3.64Å; L87-L136 HydrophobicContact CD2-CG 4.15Å; L87-I139 HydrophobicContact CB-CD1 4.49Å; L87-I139 HydrophobicContact CD2-CD1 4.05Å; L87-Y350 WeakPolarHBondContact CD2-OH 3.43Å
88A96.1Very high93.8Very high2 Ų228.7 Ų28.72%0.01715%0.146CC..Hα-helixtrans-63.6-29.217600000113.1N63 V66 I67 I84 V85 L92N63-A88 HydrophobicContact CB-CB 4.4Å; V66-A88 HydrophobicContact CB-CB 4.08Å; V66-A88 HydrophobicContact CG1-CB 3.86Å; I67-A88 HydrophobicContact CD1-CB 4.37Å; I67-A88 HydrophobicContact CG1-CB 3.89Å; I84-A88 PolarHBondContact O-N 3.39Å; V85-A88 PolarHBondContact O-N 2.99Å; A88-L92 WeakPolarHBondContact O-CB 3.47Å; A88-L92 PolarHBondContact O-N 3.18Å
89M96.1Very high94.3Very high97 Ų9725.4 Ų25.448%0.47813%0.128SC..Hα-helixtrans-70.4-42.9173.8-73.7176.661.400112I67 V85 N86 L87 L92 L93I67-M89 HydrophobicContact CD1-CG 4.04Å; V85-M89 HydrophobicContact CG1-CG 4.44Å; V85-M89 HydrophobicContact CG1-SD 4.24Å; V85-M89 WeakPolarHBondContact O-CG 3.48Å; V85-M89 PolarHBondContact O-N 3.48Å; N86-M89 WeakPolarHBondContact O-CB 3.38Å; N86-M89 PolarHBondContact O-N 3.43Å; L87-M89 VanDerWaalsContact C-N 3.25Å; L87-M89 PolarHBondContact O-N 2.85Å; M89-L92 PolarHBondContact O-N 3.44Å; M89-L93 WeakPolarHBondContact O-CB 3.41Å; M89-L93 PolarHBondContact O-N 3.34Å
90A96.8Very high94.6Very high0 Ų026.3 Ų26.30%014%0.136CC..Hα-helixtrans-63.6-45175.500000111.4N86 L87 L92 L93 L94 A131 S132 W170N86-A90 PolarHBondContact O-N 2.91Å; L87-A90 PolarHBondContact O-N 2.92Å; A90-L92 VanDerWaalsContact C-N 3.32Å; A90-L92 PolarHBondContact O-N 3.3Å; A90-L93 WeakPolarHBondContact O-CB 3.49Å; A90-L93 PolarHBondContact O-N 2.82Å; A90-L94 PolarHBondContact O-N 3.46Å; A90-A131 HydrophobicContact CB-CB 4.23Å; A90-S132 VanDerWaalsContact CB-OG 3.28Å; A90-S132 WeakPolarHBondContact CB-OG 3.25Å; A90-W170 HydrophobicContact CB-CH2 4.12Å; A90-W170 HydrophobicContact CB-CZ2 4.31Å
91D96.5Very high94.9Very high1 Ų128.2 Ų28.21%0.00514%0.143CC..Hα-helixtrans-66.1-33.8177.1-68.2-10.8000112L87 S95 S132 N346L87-D91 PolarHBondContact O-N 3.32Å; D91-S95 WeakPolarHBondContact O-CB 3.45Å; D91-S95 PolarHBondContact O-N 3.29Å; D91-S95 PolarHBondContact O-OG 3.47Å; D91-S132 PolarHBondContact OD1-OG 2.93Å; D91-N346 PolarHBondContact OD2-ND2 2.9Å
92L96.8Very high95Very high30 Ų3028 Ų2816%0.15714%0.142CC..Hα-helixtrans-68.7-40.3174.2-175.164.5000111.7I60 N63 I64 I67 A88 M89 A90 S95 I96I60-L92 HydrophobicContact CB-CD1 4.39Å; I60-L92 HydrophobicContact CG1-CD1 4.49Å; I60-L92 HydrophobicContact CG2-CD1 4.05Å; N63-L92 HydrophobicContact CB-CB 4.3Å; I64-L92 HydrophobicContact CD1-CD1 4.33Å; I64-L92 HydrophobicContact CG1-CD1 3.94Å; I64-L92 HydrophobicContact CG1-CD2 4.12Å; I67-L92 HydrophobicContact CD1-CD2 4.1Å; A88-L92 WeakPolarHBondContact O-CB 3.47Å; A88-L92 PolarHBondContact O-N 3.18Å; M89-L92 PolarHBondContact O-N 3.44Å; A90-L92 VanDerWaalsContact C-N 3.32Å; A90-L92 PolarHBondContact O-N 3.3Å; L92-S95 PolarHBondContact O-N 3.38Å; L92-I96 HydrophobicContact CD1-CD1 3.78Å; L92-I96 HydrophobicContact CD1-CG1 4.21Å; L92-I96 HydrophobicContact CD2-CD1 4.46Å; L92-I96 HydrophobicContact CG-CD1 3.78Å; L92-I96 HydrophobicContact CG-CG1 4.49Å; L92-I96 WeakPolarHBondContact O-CG1 3.46Å; L92-I96 PolarHBondContact O-N 3.43Å
93L96.4Very high95Very high56 Ų5623.9 Ų23.929%0.29313%0.127SC..Hα-helixtrans-61.4-47.1175.5-170.866.3000110.7M89 A90 S95 I96 I97 C128 W170M89-L93 WeakPolarHBondContact O-CB 3.41Å; M89-L93 PolarHBondContact O-N 3.34Å; A90-L93 WeakPolarHBondContact O-CB 3.49Å; A90-L93 PolarHBondContact O-N 2.82Å; L93-S95 VanDerWaalsContact C-N 3.31Å; L93-S95 PolarHBondContact O-N 2.84Å; L93-I96 PolarHBondContact O-N 2.97Å; L93-I97 HydrophobicContact CD1-CD1 3.34Å; L93-I97 HydrophobicContact CD1-CG1 4.12Å; L93-I97 HydrophobicContact CG-CD1 4.2Å; L93-I97 WeakPolarHBondContact O-CB 3.41Å; L93-I97 PolarHBondContact O-N 3.38Å; L93-C128 VanDerWaalsContact CD2-SG 3.57Å; L93-W170 HydrophobicContact CD2-CH2 4.33Å; L93-W170 HydrophobicContact CD2-CZ3 4.31Å
94L96.3Very high94.8Very high2 Ų225 Ų251%0.0114%0.135CC..Hα-helixtrans-55.4-47.2172-173.678.1000111.1A90 I96 V98 L99 D125 C128 Y340 S343A90-L94 PolarHBondContact O-N 3.46Å; L94-I96 VanDerWaalsContact C-N 3.32Å; L94-I96 PolarHBondContact O-N 2.96Å; L94-V98 HydrophobicContact CD1-CB 3.77Å; L94-V98 HydrophobicContact CD1-CG1 3.93Å; L94-V98 HydrophobicContact CD1-CG2 3.89Å; L94-V98 HydrophobicContact CG-CB 4.31Å; L94-V98 WeakPolarHBondContact O-CA 3.43Å; L94-V98 VanDerWaalsContact O-CB 3.32Å; L94-V98 WeakPolarHBondContact O-CB 3.23Å; L94-V98 PolarHBondContact O-N 2.9Å; L94-L99 HydrophobicContact CG-CD2 4.48Å; L94-L99 PolarHBondContact O-N 3.49Å; L94-D125 WeakPolarHBondContact CD1-OD1 3.48Å; L94-C128 HydrophobicContact CB-CB 3.96Å; L94-C128 HydrophobicContact CD1-CB 3.88Å; L94-Y340 HydrophobicContact CD1-CE1 4.11Å; L94-Y340 HydrophobicContact CD2-CD1 3.99Å; L94-Y340 HydrophobicContact CD2-CE1 4.41Å; L94-S343 WeakPolarHBondContact CD2-OG 3.16Å
95S96.3Very high94.5Very high0 Ų026.5 Ų26.50%014%0.143CC..Hα-helixtrans-68.4-29-174.7-56.10000114.2A59 D91 L92 L93 P100A59-S95 VanDerWaalsContact CB-OG 3.29Å; A59-S95 WeakPolarHBondContact CB-OG 3.48Å; D91-S95 WeakPolarHBondContact O-CB 3.45Å; D91-S95 PolarHBondContact O-N 3.29Å; D91-S95 PolarHBondContact O-OG 3.47Å; L92-S95 PolarHBondContact O-N 3.38Å; L93-S95 VanDerWaalsContact C-N 3.31Å; L93-S95 PolarHBondContact O-N 2.84Å; S95-P100 WeakPolarHBondContact O-CD 3.44Å
96I95.8Very high94.2Very high90 Ų9028.4 Ų28.446%0.46215%0.15SC..Hα-helixtrans-90.8-39.8-179.2-66.3172000111.3I60 L92 L93 L94 P100I60-I96 HydrophobicContact CD1-CG1 4.12Å; I60-I96 HydrophobicContact CG1-CG1 4.19Å; L92-I96 HydrophobicContact CD1-CD1 3.78Å; L92-I96 HydrophobicContact CD1-CG1 4.21Å; L92-I96 HydrophobicContact CD2-CD1 4.46Å; L92-I96 HydrophobicContact CG-CD1 3.78Å; L92-I96 HydrophobicContact CG-CG1 4.49Å; L92-I96 WeakPolarHBondContact O-CG1 3.46Å; L92-I96 PolarHBondContact O-N 3.43Å; L93-I96 PolarHBondContact O-N 2.97Å; L94-I96 VanDerWaalsContact C-N 3.32Å; L94-I96 PolarHBondContact O-N 2.96Å; I96-P100 WeakPolarHBondContact O-CG 3.28Å
97I94.3Very high93.8Very high64 Ų6429.8 Ų29.833%0.32816%0.159SC..Hα-helixtrans-101.8-29.4-169.6-56.3-173.5000112.8L93 F101 V124L93-I97 HydrophobicContact CD1-CD1 3.34Å; L93-I97 HydrophobicContact CD1-CG1 4.12Å; L93-I97 HydrophobicContact CG-CD1 4.2Å; L93-I97 WeakPolarHBondContact O-CB 3.41Å; L93-I97 PolarHBondContact O-N 3.38Å; I97-F101 WeakPolarHBondContact O-CD2 3.21Å; I97-V124 HydrophobicContact CB-CG1 4.38Å; I97-V124 HydrophobicContact CG2-CG1 3.93Å
98V95.4Very high93.3Very high0 Ų033.2 Ų33.20%018%0.177CC..THydrogen-bonded Turntrans-101.8-55.8-174.1178.80000110.4L94 F101 S102 W121 V124 D125 Y340L94-V98 HydrophobicContact CD1-CB 3.77Å; L94-V98 HydrophobicContact CD1-CG1 3.93Å; L94-V98 HydrophobicContact CD1-CG2 3.89Å; L94-V98 HydrophobicContact CG-CB 4.31Å; L94-V98 WeakPolarHBondContact O-CA 3.43Å; L94-V98 VanDerWaalsContact O-CB 3.32Å; L94-V98 WeakPolarHBondContact O-CB 3.23Å; L94-V98 PolarHBondContact O-N 2.9Å; V98-F101 PolarHBondContact O-N 3.49Å; V98-S102 PolarHBondContact O-N 3.28Å; V98-S102 PolarHBondContact O-OG 2.68Å; V98-W121 PolarHBondContact O-NE1 3.01Å; V98-V124 HydrophobicContact CG2-CB 4.43Å; V98-V124 HydrophobicContact CG2-CG1 3.83Å; V98-D125 HydrophobicContact CG1-CB 3.84Å; V98-D125 HydrophobicContact CG2-CB 4.19Å; V98-Y340 WeakPolarHBondContact CG1-OH 3.47Å
99L94.8Very high92.5Very high0 Ų036.4 Ų36.40%021%0.21CC..Hα-helixtrans-58.7-40.1-171.2-58.1-175.4000115.2F55 I56 A59 L94 F101 S102 A103 W337 Y340F55-L99 HydrophobicContact CD1-CD1 4.47Å; F55-L99 HydrophobicContact CE1-CD1 3.83Å; F55-L99 HydrophobicContact CE1-CD2 4.48Å; I56-L99 HydrophobicContact CD1-CB 4.06Å; I56-L99 HydrophobicContact CG1-CB 3.74Å; I56-L99 HydrophobicContact CG1-CD1 4.25Å; A59-L99 HydrophobicContact CB-CD1 4.42Å; L94-L99 HydrophobicContact CG-CD2 4.48Å; L94-L99 PolarHBondContact O-N 3.49Å; L99-F101 VanDerWaalsContact C-N 3.31Å; L99-F101 PolarHBondContact O-N 3.49Å; L99-S102 PolarHBondContact O-N 3.36Å; L99-A103 VanDerWaalsContact O-CB 3.31Å; L99-A103 WeakPolarHBondContact O-CB 3.39Å; L99-A103 PolarHBondContact O-N 3.36Å; L99-W337 HydrophobicContact CD2-CZ3 4.33Å; L99-Y340 HydrophobicContact CD2-CD1 3.96Å; L99-Y340 HydrophobicContact CD2-CD2 3.33Å; L99-Y340 HydrophobicContact CD2-CE1 4.34Å; L99-Y340 HydrophobicContact CD2-CE2 3.74Å; L99-Y340 HydrophobicContact CD2-CG 3.43Å; L99-Y340 VanDerWaalsContact CD2-CG 3.43Å
100P94.5Very high91.9Very high48 Ų4832.2 Ų32.231%0.31219%0.19SC..Hα-helixtrans-64.1-37.3-179.9-24.537000112.6I56 S95 I96 A103 S104I56-P100 HydrophobicContact CG2-CG 4.45Å; S95-P100 WeakPolarHBondContact O-CD 3.44Å; I96-P100 WeakPolarHBondContact O-CG 3.28Å; P100-A103 PolarHBondContact O-N 3.3Å; P100-S104 PolarHBondContact O-N 2.99Å
101F92.9Very high91.3Very high54 Ų5432.6 Ų32.624%0.23719%0.192CC..Hα-helixtrans-76.3-39.2179.1-61.8-84000111.1I97 V98 L99 A103 S104 L105 W111 F113 F117I97-F101 WeakPolarHBondContact O-CD2 3.21Å; V98-F101 PolarHBondContact O-N 3.49Å; L99-F101 VanDerWaalsContact C-N 3.31Å; L99-F101 PolarHBondContact O-N 3.49Å; F101-A103 VanDerWaalsContact C-N 3.29Å; F101-A103 PolarHBondContact O-N 2.94Å; F101-S104 WeakPolarHBondContact CA-OG 3.32Å; F101-S104 PolarHBondContact O-N 3.36Å; F101-S104 PolarHBondContact O-OG 2.84Å; F101-L105 PolarHBondContact O-N 2.94Å; F101-W111 HydrophobicContact CB-CH2 4.25Å; F101-W111 HydrophobicContact CB-CZ3 4.28Å; F101-F113 HydrophobicContact CD1-CD1 4.38Å; F101-F113 HydrophobicContact CD1-CD2 4.06Å; F101-F113 HydrophobicContact CD1-CE1 4.06Å; F101-F113 AromaticContact CD1-CE2 3.74Å; F101-F113 HydrophobicContact CD1-CE2 3.74Å; F101-F113 HydrophobicContact CD1-CG 4.39Å; F101-F113 AromaticContact CD1-CZ 3.73Å; F101-F113 HydrophobicContact CD1-CZ 3.73Å; F101-F113 HydrophobicContact CE1-CD1 4.24Å; F101-F113 AromaticContact CE1-CE1 3.93Å; F101-F113 HydrophobicContact CE1-CE1 3.93Å; F101-F113 HydrophobicContact CE1-CE2 4.43Å; F101-F113 HydrophobicContact CE1-CZ 4.04Å; F101-F117 HydrophobicContact CB-CE1 4.48Å; F101-F117 HydrophobicContact CD1-CD1 4.44Å; F101-F117 AromaticContact CD1-CE1 3.38Å; F101-F117 HydrophobicContact CD1-CE1 3.38Å; F101-F117 AromaticContact CD1-CZ 3.92Å; F101-F117 HydrophobicContact CD1-CZ 3.92Å; F101-F117 HydrophobicContact CD2-CE1 4.22Å; F101-F117 HydrophobicContact CD2-CZ 4.16Å; F101-F117 AromaticContact CE1-CE1 3.45Å; F101-F117 HydrophobicContact CE1-CE1 3.45Å; F101-F117 VanDerWaalsContact CE1-CE1 3.45Å; F101-F117 AromaticContact CE1-CZ 3.58Å; F101-F117 HydrophobicContact CE1-CZ 3.58Å; F101-F117 HydrophobicContact CE2-CE1 4.27Å; F101-F117 AromaticContact CE2-CZ 3.84Å; F101-F117 HydrophobicContact CE2-CZ 3.84Å; F101-F117 AromaticContact CG-CE1 3.77Å; F101-F117 HydrophobicContact CG-CE1 3.77Å; F101-F117 HydrophobicContact CG-CZ 4.17Å; F101-F117 AromaticContact CZ-CE1 3.9Å; F101-F117 HydrophobicContact CZ-CE1 3.9Å; F101-F117 AromaticContact CZ-CZ 3.52Å; F101-F117 HydrophobicContact CZ-CZ 3.52Å
102S92.4Very high90.8Very high6 Ų636.4 Ų36.44%0.04222%0.215CC..Hα-helixtrans-59.3-40.8170.5-48.50000111.7V98 L99 L105 E106 W121V98-S102 PolarHBondContact O-N 3.28Å; V98-S102 PolarHBondContact O-OG 2.68Å; L99-S102 PolarHBondContact O-N 3.36Å; S102-L105 PolarHBondContact O-N 2.9Å; S102-E106 PolarHBondContact O-N 2.94Å; S102-E106 VanDerWaalsContact O-N 3.1Å; S102-W121 VanDerWaalsContact OG-CZ2 3.28Å; S102-W121 WeakPolarHBondContact OG-CZ2 3.16Å; S102-W121 PolarHBondContact OG-NE1 3.44Å
103A92.1Very high90.2Very high12 Ų1239 Ų3910%0.09923%0.225CC..Hα-helixtrans-66.8-39.517600000112.4L52 I56 L99 P100 F101 L105 E106 V107 W337L52-A103 HydrophobicContact CB-CB 4.03Å; L52-A103 HydrophobicContact CD1-CB 3.87Å; I56-A103 HydrophobicContact CD1-CB 3.94Å; L99-A103 VanDerWaalsContact O-CB 3.31Å; L99-A103 WeakPolarHBondContact O-CB 3.39Å; L99-A103 PolarHBondContact O-N 3.36Å; P100-A103 PolarHBondContact O-N 3.3Å; F101-A103 VanDerWaalsContact C-N 3.29Å; F101-A103 PolarHBondContact O-N 2.94Å; A103-L105 VanDerWaalsContact C-N 3.31Å; A103-L105 PolarHBondContact O-N 3.37Å; A103-E106 PolarHBondContact O-N 2.85Å; A103-V107 WeakPolarHBondContact O-CG2 3.26Å; A103-V107 PolarHBondContact O-N 3.05Å; A103-W337 HydrophobicContact CB-CH2 4.09Å; A103-W337 HydrophobicContact CB-CZ2 4.46Å
104S89.7Confident89.7Confident28 Ų2837.5 Ų37.520%0.19622%0.223CC..Hα-helixtrans-63.9-37.9175.871.90000112.3P100 F101 E106 V107 L108 F113P100-S104 PolarHBondContact O-N 2.99Å; F101-S104 WeakPolarHBondContact CA-OG 3.32Å; F101-S104 PolarHBondContact O-N 3.36Å; F101-S104 PolarHBondContact O-OG 2.84Å; S104-E106 VanDerWaalsContact C-N 3.35Å; S104-V107 PolarHBondContact O-N 3.21Å; S104-L108 VanDerWaalsContact O-CB 3.24Å; S104-L108 WeakPolarHBondContact O-CB 3.35Å; S104-L108 VanDerWaalsContact O-CG 3.31Å; S104-L108 WeakPolarHBondContact O-CG 3.37Å; S104-L108 PolarHBondContact O-N 3.36Å; S104-F113 WeakPolarHBondContact OG-CE2 3.47Å
105L87.3Confident89.1Confident38 Ų3842.5 Ų42.520%0.19924%0.242CC..Hα-helixtrans-64-40.2174.7179.662.5000111.3F101 S102 A103 G109 C110 W111 C195F101-L105 PolarHBondContact O-N 2.94Å; S102-L105 PolarHBondContact O-N 2.9Å; A103-L105 VanDerWaalsContact C-N 3.31Å; A103-L105 PolarHBondContact O-N 3.37Å; L105-G109 VanDerWaalsContact O-CA 3.3Å; L105-G109 WeakPolarHBondContact O-CA 3.4Å; L105-G109 PolarHBondContact O-N 3.28Å; L105-C110 VanDerWaalsContact CD1-C 3.43Å; L105-W111 HydrophobicContact CB-CE3 4.41Å; L105-W111 HydrophobicContact CD1-CB 4.17Å; L105-W111 HydrophobicContact CD1-CE3 4.35Å; L105-W111 HydrophobicContact CD2-CE3 4.41Å; L105-C195 WeakPolarHBondContact CD2-O 3.49Å
106E87.4Confident88.6Confident57 Ų5747.8 Ų47.827%0.26627%0.274SS..Hα-helixtrans-67.4-39.3177.4-168.164.5-130.200112.3T48 L52 S102 A103 S104 K333T48-E106 HydrophobicContact CG2-CG 4.34Å; L52-E106 HydrophobicContact CD1-CB 4.12Å; L52-E106 HydrophobicContact CD1-CG 4.24Å; S102-E106 PolarHBondContact O-N 2.94Å; S102-E106 VanDerWaalsContact O-N 3.1Å; A103-E106 PolarHBondContact O-N 2.85Å; S104-E106 VanDerWaalsContact C-N 3.35Å; E106-K333 WeakPolarHBondContact OE1-CD 3.46Å; E106-K333 WeakPolarHBondContact OE1-CE 3.37Å; E106-K333 IonicContact OE1-NZ 3.12Å; E106-K333 PolarHBondContact OE1-NZ 3.42Å; E106-K333 IonicContact OE2-NZ 2.82Å
107V86.9Confident88.3Confident39 Ų3946.4 Ų46.424%0.23627%0.265CS..Hα-helixtrans-77.4-39.3-178.3171.50000112.2F39 V45 A103 S104F39-V107 HydrophobicContact CE2-CG1 4.02Å; V45-V107 HydrophobicContact CG1-CG1 3.86Å; A103-V107 WeakPolarHBondContact O-CG2 3.26Å; A103-V107 PolarHBondContact O-N 3.05Å; S104-V107 PolarHBondContact O-N 3.21Å
108L84Confident88.1Confident74 Ų7444 Ų4439%0.38725%0.254SS..Hα-helixtrans-86.6-20.9-178.4-64.3172.5000112.8F39 S104 C110 V112F39-L108 HydrophobicContact CD2-CD2 4.33Å; S104-L108 VanDerWaalsContact O-CB 3.24Å; S104-L108 WeakPolarHBondContact O-CB 3.35Å; S104-L108 VanDerWaalsContact O-CG 3.31Å; S104-L108 WeakPolarHBondContact O-CG 3.37Å; S104-L108 PolarHBondContact O-N 3.36Å; L108-C110 PolarHBondContact O-N 2.96Å; L108-V112 HydrophobicContact CD1-CG1 4.48Å; L108-V112 HydrophobicContact CD1-CG2 4.37Å
109G79.6Confident87.8Confident69 Ų6946.4 Ų46.471%0.71127%0.267SS*.SBendtrans697.2-175.300000114.4L105L105-G109 VanDerWaalsContact O-CA 3.3Å; L105-G109 WeakPolarHBondContact O-CA 3.4Å; L105-G109 PolarHBondContact O-N 3.28Å
110C82.9Confident87.6Confident8 Ų850.3 Ų50.35%0.05429%0.287CS..SBendtrans-152.7156.1-177.365.50000111.2C36 L105 L108C36-C110 HydrophobicContact CB-CB 4.11Å; C36-C110 WeakPolarHBondContact CB-SG 3.26Å; C36-C110 WeakPolarHBondContact SG-CB 3.35Å; C36-C110 CovalentContact SG-SG 2Å; C36-C110 PolarHBondContact SG-SG 3.44Å; L105-C110 VanDerWaalsContact CD1-C 3.43Å; L108-C110 PolarHBondContact O-N 2.96Å
111W85.4Confident87.6Confident8 Ų848.4 Ų48.43%0.0327%0.273CS..  trans-94.9120177-173.2-99.6000111.9F101 L105 F113 G114 F117 C118 W121 T193 C195F101-W111 HydrophobicContact CB-CH2 4.25Å; F101-W111 HydrophobicContact CB-CZ3 4.28Å; L105-W111 HydrophobicContact CB-CE3 4.41Å; L105-W111 HydrophobicContact CD1-CB 4.17Å; L105-W111 HydrophobicContact CD1-CE3 4.35Å; L105-W111 HydrophobicContact CD2-CE3 4.41Å; W111-F113 HydrophobicContact CD2-CD2 4.12Å; W111-F113 HydrophobicContact CE3-CD2 4.17Å; W111-F113 HydrophobicContact CH2-CD2 4.15Å; W111-F113 HydrophobicContact CZ2-CB 3.98Å; W111-F113 HydrophobicContact CZ2-CD2 4.1Å; W111-F113 HydrophobicContact CZ2-CG 4.47Å; W111-F113 HydrophobicContact CZ3-CD2 4.18Å; W111-G114 PolarHBondContact NE1-O 2.86Å; W111-F117 AromaticContact CH2-CD1 3.88Å; W111-F117 HydrophobicContact CH2-CD1 3.88Å; W111-F117 HydrophobicContact CH2-CE1 4.09Å; W111-F117 HydrophobicContact CZ2-CB 4.39Å; W111-F117 AromaticContact CZ2-CD1 3.42Å; W111-F117 HydrophobicContact CZ2-CD1 3.42Å; W111-F117 VanDerWaalsContact CZ2-CD1 3.42Å; W111-F117 HydrophobicContact CZ2-CE1 4.1Å; W111-F117 HydrophobicContact CZ2-CG 4.33Å; W111-C118 VanDerWaalsContact CZ2-CA 3.47Å; W111-C118 HydrophobicContact CZ2-CB 3.95Å; W111-W121 HydrophobicContact CH2-CB 3.94Å; W111-W121 HydrophobicContact CH2-CD2 4.04Å; W111-W121 HydrophobicContact CH2-CE3 4.41Å; W111-W121 AromaticContact CH2-CG 3.81Å; W111-W121 HydrophobicContact CH2-CG 3.81Å; W111-W121 HydrophobicContact CZ2-CB 4.37Å; W111-W121 HydrophobicContact CZ3-CD2 4.37Å; W111-T193 PolarHBondContact N-O 3.5Å; W111-C195 HydrophobicContact CB-CB 3.67Å; W111-C195 HydrophobicContact CD2-CB 3.42Å; W111-C195 VanDerWaalsContact CD2-CB 3.42Å; W111-C195 HydrophobicContact CE3-CB 3.68Å; W111-C195 HydrophobicContact CG-CB 3.44Å; W111-C195 VanDerWaalsContact CG-CB 3.44Å; W111-C195 HydrophobicContact CZ3-CB 4.41Å
112V84.6Confident87.5Confident81 Ų8146.4 Ų46.449%0.49127%0.267SS..  trans-106.2-7.4-175.6-62.30000114.4C36 L108 G114C36-V112 VanDerWaalsContact SG-CG1 3.58Å; L108-V112 HydrophobicContact CD1-CG1 4.48Å; L108-V112 HydrophobicContact CD1-CG2 4.37Å; V112-G114 VanDerWaalsContact C-N 3.32Å; V112-G114 PolarHBondContact O-N 2.85Å
113F85.7Confident87.6Confident85 Ų8546.5 Ų46.537%0.37327%0.268SS..SBendtrans-915.4-171.1-55-78.4000113.7F101 S104 W111 F117F101-F113 HydrophobicContact CD1-CD1 4.38Å; F101-F113 HydrophobicContact CD1-CD2 4.06Å; F101-F113 HydrophobicContact CD1-CE1 4.06Å; F101-F113 AromaticContact CD1-CE2 3.74Å; F101-F113 HydrophobicContact CD1-CE2 3.74Å; F101-F113 HydrophobicContact CD1-CG 4.39Å; F101-F113 AromaticContact CD1-CZ 3.73Å; F101-F113 HydrophobicContact CD1-CZ 3.73Å; F101-F113 HydrophobicContact CE1-CD1 4.24Å; F101-F113 AromaticContact CE1-CE1 3.93Å; F101-F113 HydrophobicContact CE1-CE1 3.93Å; F101-F113 HydrophobicContact CE1-CE2 4.43Å; F101-F113 HydrophobicContact CE1-CZ 4.04Å; S104-F113 WeakPolarHBondContact OG-CE2 3.47Å; W111-F113 HydrophobicContact CD2-CD2 4.12Å; W111-F113 HydrophobicContact CE3-CD2 4.17Å; W111-F113 HydrophobicContact CH2-CD2 4.15Å; W111-F113 HydrophobicContact CZ2-CB 3.98Å; W111-F113 HydrophobicContact CZ2-CD2 4.1Å; W111-F113 HydrophobicContact CZ2-CG 4.47Å; W111-F113 HydrophobicContact CZ3-CD2 4.18Å; F113-F117 HydrophobicContact CB-CB 3.97Å; F113-F117 HydrophobicContact CB-CD1 3.39Å; F113-F117 HydrophobicContact CB-CE1 4.26Å; F113-F117 HydrophobicContact CB-CG 3.97Å; F113-F117 HydrophobicContact CD2-CD1 4.39Å; F113-F117 AromaticContact CG-CD1 3.89Å; F113-F117 HydrophobicContact CG-CD1 3.89Å; F113-F117 HydrophobicContact CG-CE1 4.28Å; F113-F117 VanDerWaalsContact O-CB 3.3Å; F113-F117 WeakPolarHBondContact O-CB 3.36Å
114G85.1Confident87.7Confident25 Ų2547.3 Ų47.326%0.25827%0.271SS..Hα-helixtrans75.9168.3-179.300000114.5W111 V112 V116 F117 C118W111-G114 PolarHBondContact NE1-O 2.86Å; V112-G114 VanDerWaalsContact C-N 3.32Å; V112-G114 PolarHBondContact O-N 2.85Å; G114-V116 PolarHBondContact O-N 3.42Å; G114-F117 PolarHBondContact O-N 2.84Å; G114-C118 PolarHBondContact O-N 3.14Å
115R83.4Confident87.9Confident106 Ų10646.1 Ų46.140%0.426%0.263SS..Hα-helixtrans-67.6-37.6-171.3-56.2-174.7-146-124.916.5114F117 C118 N119 P189 E192R115-F117 VanDerWaalsContact C-N 3.33Å; R115-F117 PolarHBondContact O-N 3.46Å; R115-C118 WeakPolarHBondContact O-CB 3.45Å; R115-C118 PolarHBondContact O-N 3.39Å; R115-N119 PolarHBondContact O-N 3.36Å; R115-N119 PolarHBondContact O-ND2 2.89Å; R115-N119 VanDerWaalsContact O-ND2 3.09Å; R115-P189 PolarHBondContact NH1-O 2.94Å; R115-E192 IonicContact CZ-OE1 2.62Å; R115-E192 VanDerWaalsContact NE-CD 3.32Å; R115-E192 IonicContact NE-OE1 3.02Å; R115-E192 PolarHBondContact NE-OE1 3.17Å; R115-E192 VanDerWaalsContact NH2-CG 3.32Å; R115-E192 IonicContact NH2-OE1 3.85Å; R115-E192 PolarHBondContact NH2-OE1 3Å
116V86.8Confident88.2Confident111 Ų11145.2 Ų45.267%0.67326%0.259SS*.Hα-helixtrans-61.6-46.3-179.6177.90000110.1G114 C118 N119 I120G114-V116 PolarHBondContact O-N 3.42Å; V116-C118 VanDerWaalsContact C-N 3.33Å; V116-C118 PolarHBondContact O-N 3.29Å; V116-N119 PolarHBondContact O-N 3.42Å; V116-I120 HydrophobicContact CG1-CD1 4.04Å; V116-I120 WeakPolarHBondContact O-CG1 3.18Å; V116-I120 PolarHBondContact O-N 3.1Å; V116-I120 VanDerWaalsContact O-N 3.13Å
117F89.4Confident88.6Confident61 Ų6144 Ų4427%0.26825%0.254SS..Hα-helixtrans-66.6-36.3178.2-165.2-107.5000111.8F101 W111 F113 G114 R115 N119 I120 W121F101-F117 HydrophobicContact CB-CE1 4.48Å; F101-F117 HydrophobicContact CD1-CD1 4.44Å; F101-F117 AromaticContact CD1-CE1 3.38Å; F101-F117 HydrophobicContact CD1-CE1 3.38Å; F101-F117 AromaticContact CD1-CZ 3.92Å; F101-F117 HydrophobicContact CD1-CZ 3.92Å; F101-F117 HydrophobicContact CD2-CE1 4.22Å; F101-F117 HydrophobicContact CD2-CZ 4.16Å; F101-F117 AromaticContact CE1-CE1 3.45Å; F101-F117 HydrophobicContact CE1-CE1 3.45Å; F101-F117 VanDerWaalsContact CE1-CE1 3.45Å; F101-F117 AromaticContact CE1-CZ 3.58Å; F101-F117 HydrophobicContact CE1-CZ 3.58Å; F101-F117 HydrophobicContact CE2-CE1 4.27Å; F101-F117 AromaticContact CE2-CZ 3.84Å; F101-F117 HydrophobicContact CE2-CZ 3.84Å; F101-F117 AromaticContact CG-CE1 3.77Å; F101-F117 HydrophobicContact CG-CE1 3.77Å; F101-F117 HydrophobicContact CG-CZ 4.17Å; F101-F117 AromaticContact CZ-CE1 3.9Å; F101-F117 HydrophobicContact CZ-CE1 3.9Å; F101-F117 AromaticContact CZ-CZ 3.52Å; F101-F117 HydrophobicContact CZ-CZ 3.52Å; W111-F117 AromaticContact CH2-CD1 3.88Å; W111-F117 HydrophobicContact CH2-CD1 3.88Å; W111-F117 HydrophobicContact CH2-CE1 4.09Å; W111-F117 HydrophobicContact CZ2-CB 4.39Å; W111-F117 AromaticContact CZ2-CD1 3.42Å; W111-F117 HydrophobicContact CZ2-CD1 3.42Å; W111-F117 VanDerWaalsContact CZ2-CD1 3.42Å; W111-F117 HydrophobicContact CZ2-CE1 4.1Å; W111-F117 HydrophobicContact CZ2-CG 4.33Å; F113-F117 HydrophobicContact CB-CB 3.97Å; F113-F117 HydrophobicContact CB-CD1 3.39Å; F113-F117 HydrophobicContact CB-CE1 4.26Å; F113-F117 HydrophobicContact CB-CG 3.97Å; F113-F117 HydrophobicContact CD2-CD1 4.39Å; F113-F117 AromaticContact CG-CD1 3.89Å; F113-F117 HydrophobicContact CG-CD1 3.89Å; F113-F117 HydrophobicContact CG-CE1 4.28Å; F113-F117 VanDerWaalsContact O-CB 3.3Å; F113-F117 WeakPolarHBondContact O-CB 3.36Å; G114-F117 PolarHBondContact O-N 2.84Å; R115-F117 VanDerWaalsContact C-N 3.33Å; R115-F117 PolarHBondContact O-N 3.46Å; F117-N119 PolarHBondContact O-N 2.96Å; F117-I120 PolarHBondContact O-N 3.17Å; F117-W121 VanDerWaalsContact O-CB 3.27Å; F117-W121 WeakPolarHBondContact O-CB 3.5Å; F117-W121 PolarHBondContact O-N 2.92Å
118C89.4Confident89.1Confident15 Ų1542.1 Ų42.110%0.10124%0.243CC..Hα-helixtrans-58.5-46.7174179.60000112.2W111 G114 R115 V116 I120 W121 A122 C195W111-C118 VanDerWaalsContact CZ2-CA 3.47Å; W111-C118 HydrophobicContact CZ2-CB 3.95Å; G114-C118 PolarHBondContact O-N 3.14Å; R115-C118 WeakPolarHBondContact O-CB 3.45Å; R115-C118 PolarHBondContact O-N 3.39Å; V116-C118 VanDerWaalsContact C-N 3.33Å; V116-C118 PolarHBondContact O-N 3.29Å; C118-I120 VanDerWaalsContact C-N 3.34Å; C118-I120 PolarHBondContact O-N 3.23Å; C118-W121 PolarHBondContact O-N 3.15Å; C118-A122 WeakPolarHBondContact O-CB 3.38Å; C118-A122 PolarHBondContact O-N 2.76Å; C118-C195 WeakPolarHBondContact CA-SG 3.45Å; C118-C195 HydrophobicContact CB-CB 3.9Å; C118-C195 WeakPolarHBondContact CB-SG 3.29Å; C118-C195 WeakPolarHBondContact SG-CA 3.09Å; C118-C195 WeakPolarHBondContact SG-CB 3.03Å; C118-C195 CovalentContact SG-SG 2.03Å; C118-C195 PolarHBondContact SG-SG 3.47Å
119N88.9Confident89.5Confident50 Ų5039 Ų3927%0.26723%0.227SC..Hα-helixtrans-62.1-42.2178.5-64.7-44.5000111.6R115 V116 F117 A123 L181 K185R115-N119 PolarHBondContact O-N 3.36Å; R115-N119 PolarHBondContact O-ND2 2.89Å; R115-N119 VanDerWaalsContact O-ND2 3.09Å; V116-N119 PolarHBondContact O-N 3.42Å; F117-N119 PolarHBondContact O-N 2.96Å; N119-A123 WeakPolarHBondContact O-CB 3.49Å; N119-A123 PolarHBondContact O-N 3.43Å; N119-L181 HydrophobicContact CB-CD2 3.87Å; N119-K185 PolarHBondContact OD1-NZ 2.92Å
120I91.5Very high90.3Very high82 Ų8235.8 Ų35.842%0.42119%0.194SC..Hα-helixtrans-65.9-47.2177.5-65.3168.2000110.4V116 F117 C118 A122 A123 V124V116-I120 HydrophobicContact CG1-CD1 4.04Å; V116-I120 WeakPolarHBondContact O-CG1 3.18Å; V116-I120 PolarHBondContact O-N 3.1Å; V116-I120 VanDerWaalsContact O-N 3.13Å; F117-I120 PolarHBondContact O-N 3.17Å; C118-I120 VanDerWaalsContact C-N 3.34Å; C118-I120 PolarHBondContact O-N 3.23Å; I120-A122 PolarHBondContact O-N 3.43Å; I120-A123 PolarHBondContact O-N 3.12Å; I120-V124 HydrophobicContact CG2-CG2 4.19Å; I120-V124 WeakPolarHBondContact O-CB 3.31Å; I120-V124 VanDerWaalsContact O-CG2 3.29Å; I120-V124 WeakPolarHBondContact O-CG2 3.43Å; I120-V124 PolarHBondContact O-N 3.5Å
121W93.7Very high91Very high7 Ų735.4 Ų35.43%0.02719%0.191CC..Hα-helixtrans-57.4-48.8178.4166.785.5000111.3V98 S102 W111 F117 C118 A123 V124 D125 C195V98-W121 PolarHBondContact O-NE1 3.01Å; S102-W121 VanDerWaalsContact OG-CZ2 3.28Å; S102-W121 WeakPolarHBondContact OG-CZ2 3.16Å; S102-W121 PolarHBondContact OG-NE1 3.44Å; W111-W121 HydrophobicContact CH2-CB 3.94Å; W111-W121 HydrophobicContact CH2-CD2 4.04Å; W111-W121 HydrophobicContact CH2-CE3 4.41Å; W111-W121 AromaticContact CH2-CG 3.81Å; W111-W121 HydrophobicContact CH2-CG 3.81Å; W111-W121 HydrophobicContact CZ2-CB 4.37Å; W111-W121 HydrophobicContact CZ3-CD2 4.37Å; F117-W121 VanDerWaalsContact O-CB 3.27Å; F117-W121 WeakPolarHBondContact O-CB 3.5Å; F117-W121 PolarHBondContact O-N 2.92Å; C118-W121 PolarHBondContact O-N 3.15Å; W121-A123 VanDerWaalsContact C-N 3.34Å; W121-A123 PolarHBondContact O-N 2.83Å; W121-V124 PolarHBondContact O-N 3.48Å; W121-D125 WeakPolarHBondContact O-CB 3.48Å; W121-D125 PolarHBondContact O-N 3.24Å; W121-C195 VanDerWaalsContact CE3-SG 3.54Å
122A91.6Very high91.5Very high13 Ų1335.2 Ų35.211%0.10719%0.191CC..Hα-helixtrans-62.4-40.7178.300000112C118 I120 D125 V126C118-A122 WeakPolarHBondContact O-CB 3.38Å; C118-A122 PolarHBondContact O-N 2.76Å; I120-A122 PolarHBondContact O-N 3.43Å; A122-D125 PolarHBondContact O-N 3.37Å; A122-V126 WeakPolarHBondContact O-CG2 3.46Å; A122-V126 PolarHBondContact O-N 3.08Å; A122-V126 VanDerWaalsContact O-N 3.11Å
123A93.5Very high92Very high8 Ų831.4 Ų31.47%0.06617%0.168CC..Hα-helixtrans-66.8-40.4176.400000112.3N119 I120 W121 D125 L127 S177 L181N119-A123 WeakPolarHBondContact O-CB 3.49Å; N119-A123 PolarHBondContact O-N 3.43Å; I120-A123 PolarHBondContact O-N 3.12Å; W121-A123 VanDerWaalsContact C-N 3.34Å; W121-A123 PolarHBondContact O-N 2.83Å; A123-D125 VanDerWaalsContact C-N 3.34Å; A123-L127 VanDerWaalsContact O-CB 3.25Å; A123-L127 WeakPolarHBondContact O-CB 3.35Å; A123-L127 PolarHBondContact O-N 3.3Å; A123-S177 WeakPolarHBondContact O-CB 3.35Å; A123-L181 HydrophobicContact CB-CD1 3.79Å; A123-L181 HydrophobicContact CB-CD2 4.14Å; A123-L181 HydrophobicContact CB-CG 3.92Å
124V95Very high92.4Very high28 Ų2828.6 Ų28.617%0.1716%0.157CC..Hα-helixtrans-67.7-36.5176.6173.50000111.1I97 V98 I120 W121 L127 C128I97-V124 HydrophobicContact CB-CG1 4.38Å; I97-V124 HydrophobicContact CG2-CG1 3.93Å; V98-V124 HydrophobicContact CG2-CB 4.43Å; V98-V124 HydrophobicContact CG2-CG1 3.83Å; I120-V124 HydrophobicContact CG2-CG2 4.19Å; I120-V124 WeakPolarHBondContact O-CB 3.31Å; I120-V124 VanDerWaalsContact O-CG2 3.29Å; I120-V124 WeakPolarHBondContact O-CG2 3.43Å; I120-V124 PolarHBondContact O-N 3.5Å; W121-V124 PolarHBondContact O-N 3.48Å; V124-L127 WeakPolarHBondContact O-CB 3.27Å; V124-L127 PolarHBondContact O-N 3.38Å; V124-C128 WeakPolarHBondContact O-CB 3.32Å; V124-C128 PolarHBondContact O-N 3.32Å; V124-C128 PolarHBondContact O-SG 3.4Å
125D94.4Very high92.9Very high4 Ų427.6 Ų27.62%0.02115%0.146CC..Hα-helixtrans-61-52.5174.9-171.825.8000111.5L94 V98 W121 A122 A123 L127 C128 C129 I197 Y340L94-D125 WeakPolarHBondContact CD1-OD1 3.48Å; V98-D125 HydrophobicContact CG1-CB 3.84Å; V98-D125 HydrophobicContact CG2-CB 4.19Å; W121-D125 WeakPolarHBondContact O-CB 3.48Å; W121-D125 PolarHBondContact O-N 3.24Å; A122-D125 PolarHBondContact O-N 3.37Å; A123-D125 VanDerWaalsContact C-N 3.34Å; D125-L127 VanDerWaalsContact C-N 3.29Å; D125-L127 PolarHBondContact O-N 2.97Å; D125-C128 PolarHBondContact O-N 3.46Å; D125-C129 WeakPolarHBondContact O-CB 3.21Å; D125-C129 PolarHBondContact O-N 3.42Å; D125-C129 PolarHBondContact O-SG 2.94Å; D125-C129 PolarHBondContact OD1-SG 3.41Å; D125-C129 VanDerWaalsContact OD1-SG 3.33Å; D125-I197 WeakPolarHBondContact OD2-CD1 3.26Å; D125-Y340 WeakPolarHBondContact OD1-CE1 3.37Å; D125-Y340 PolarHBondContact OD1-OH 2.82Å; D125-Y340 PolarHBondContact OD2-OH 3.3Å
126V93.8Very high93.3Very high19 Ų1922.7 Ų22.712%0.11513%0.127CC..Hα-helixtrans-60.1-41.1175.9177.40000111.2A122 T130 I197A122-V126 WeakPolarHBondContact O-CG2 3.46Å; A122-V126 PolarHBondContact O-N 3.08Å; A122-V126 VanDerWaalsContact O-N 3.11Å; V126-T130 WeakPolarHBondContact O-CB 3.4Å; V126-T130 PolarHBondContact O-N 3.39Å; V126-T130 PolarHBondContact O-OG1 3.1Å; V126-I197 HydrophobicContact CG2-CG2 4.41Å
127L95.9Very high93.7Very high30 Ų3017.9 Ų17.916%0.15710%0.099CC..Hα-helixtrans-59.2-53.9177.9175.168.5000111.7A123 V124 D125 T130 A131 T174A123-L127 VanDerWaalsContact O-CB 3.25Å; A123-L127 WeakPolarHBondContact O-CB 3.35Å; A123-L127 PolarHBondContact O-N 3.3Å; V124-L127 WeakPolarHBondContact O-CB 3.27Å; V124-L127 PolarHBondContact O-N 3.38Å; D125-L127 VanDerWaalsContact C-N 3.29Å; D125-L127 PolarHBondContact O-N 2.97Å; L127-T130 PolarHBondContact O-N 3.12Å; L127-A131 VanDerWaalsContact O-CB 3.32Å; L127-A131 WeakPolarHBondContact O-CB 3.45Å; L127-A131 PolarHBondContact O-N 3.27Å; L127-T174 WeakPolarHBondContact CD1-OG1 3.38Å
128C95.8Very high94Very high0 Ų016.6 Ų16.60%09%0.094CC..Hα-helixtrans-65.3-44.4-175.7-64.20000110.8L93 L94 V124 D125 A131 S132L93-C128 VanDerWaalsContact CD2-SG 3.57Å; L94-C128 HydrophobicContact CB-CB 3.96Å; L94-C128 HydrophobicContact CD1-CB 3.88Å; V124-C128 WeakPolarHBondContact O-CB 3.32Å; V124-C128 PolarHBondContact O-N 3.32Å; V124-C128 PolarHBondContact O-SG 3.4Å; D125-C128 PolarHBondContact O-N 3.46Å; C128-A131 PolarHBondContact O-N 2.97Å; C128-S132 PolarHBondContact O-N 3.44Å; C128-S132 PolarHBondContact O-OG 3.19Å
129C94.1Very high94.2Very high9 Ų916.1 Ų16.16%0.0619%0.09CC..Hα-helixtrans-61.7-47.4177.9-64.50000111D125 A131 S132 I133 W309D125-C129 WeakPolarHBondContact O-CB 3.21Å; D125-C129 PolarHBondContact O-N 3.42Å; D125-C129 PolarHBondContact O-SG 2.94Å; D125-C129 PolarHBondContact OD1-SG 3.41Å; D125-C129 VanDerWaalsContact OD1-SG 3.33Å; C129-A131 PolarHBondContact O-N 3.05Å; C129-S132 PolarHBondContact O-N 3.37Å; C129-I133 WeakPolarHBondContact O-CG1 3.28Å; C129-I133 PolarHBondContact O-N 3.48Å; C129-W309 HydrophobicContact CB-CH2 3.86Å; C129-W309 HydrophobicContact CB-CZ2 4.32Å; C129-W309 HydrophobicContact CB-CZ3 4.42Å; C129-W309 WeakPolarHBondContact SG-CH2 3.38Å
130T95.8Very high94.4Very high2 Ų213.7 Ų13.71%0.0128%0.078CC..Hα-helixtrans-60.9-44.1177.2-56.70000111.7V126 L127 S132 I133 L134 I176 S211V126-T130 WeakPolarHBondContact O-CB 3.4Å; V126-T130 PolarHBondContact O-N 3.39Å; V126-T130 PolarHBondContact O-OG1 3.1Å; L127-T130 PolarHBondContact O-N 3.12Å; T130-S132 VanDerWaalsContact C-N 3.34Å; T130-S132 PolarHBondContact O-N 3.31Å; T130-I133 PolarHBondContact O-N 3.22Å; T130-L134 HydrophobicContact CG2-CD1 3.89Å; T130-L134 HydrophobicContact CG2-CG 4.26Å; T130-L134 WeakPolarHBondContact O-CB 3.2Å; T130-L134 WeakPolarHBondContact O-CG 3.36Å; T130-L134 PolarHBondContact O-N 2.96Å; T130-I176 HydrophobicContact CG2-CD1 3.81Å; T130-S211 WeakPolarHBondContact CG2-OG 3.17Å; T130-S211 WeakPolarHBondContact OG1-CB 3.46Å; T130-S211 PolarHBondContact OG1-OG 3.14Å
131A97.1Very high94.5Very high0 Ų012.4 Ų12.40%07%0.071CC..Hα-helixtrans-61.6-40.8177.800000112.2A90 L127 C128 C129 S135 W170 S173A90-A131 HydrophobicContact CB-CB 4.23Å; L127-A131 VanDerWaalsContact O-CB 3.32Å; L127-A131 WeakPolarHBondContact O-CB 3.45Å; L127-A131 PolarHBondContact O-N 3.27Å; C128-A131 PolarHBondContact O-N 2.97Å; C129-A131 PolarHBondContact O-N 3.05Å; A131-S135 VanDerWaalsContact O-CB 3.24Å; A131-S135 WeakPolarHBondContact O-CB 3.44Å; A131-S135 PolarHBondContact O-N 2.64Å; A131-S135 PolarHBondContact O-OG 2.73Å; A131-W170 HydrophobicContact CB-CE3 4.2Å; A131-W170 HydrophobicContact CB-CH2 4.24Å; A131-W170 HydrophobicContact CB-CZ3 4.04Å; A131-S173 VanDerWaalsContact CA-OG 3.24Å; A131-S173 WeakPolarHBondContact CA-OG 3.49Å; A131-S173 PolarHBondContact N-OG 3.3Å
132S95.2Very high94.4Very high4 Ų412.1 Ų12.13%0.0287%0.07CC..Hα-helixtrans-66-43.9175.9-71.60000112.1A90 D91 C128 C129 T130 S135 L136A90-S132 VanDerWaalsContact CB-OG 3.28Å; A90-S132 WeakPolarHBondContact CB-OG 3.25Å; D91-S132 PolarHBondContact OD1-OG 2.93Å; C128-S132 PolarHBondContact O-N 3.44Å; C128-S132 PolarHBondContact O-OG 3.19Å; C129-S132 PolarHBondContact O-N 3.37Å; T130-S132 VanDerWaalsContact C-N 3.34Å; T130-S132 PolarHBondContact O-N 3.31Å; S132-S135 WeakPolarHBondContact O-CB 3.41Å; S132-S135 PolarHBondContact O-N 2.89Å; S132-L136 WeakPolarHBondContact O-CG 3.44Å; S132-L136 PolarHBondContact O-N 3.15Å
133I95Very high94.2Very high0 Ų012 Ų120%07%0.067CC..Hα-helixtrans-66.3-45.9179.7-57.4164.1000111.3C129 T130 S135 L136 C137 S211 F212 P215 F305 F313C129-I133 WeakPolarHBondContact O-CG1 3.28Å; C129-I133 PolarHBondContact O-N 3.48Å; T130-I133 PolarHBondContact O-N 3.22Å; I133-S135 VanDerWaalsContact C-N 3.28Å; I133-S135 PolarHBondContact O-N 3.48Å; I133-L136 WeakPolarHBondContact O-CB 3.18Å; I133-L136 PolarHBondContact O-N 3.34Å; I133-L136 VanDerWaalsContact O-N 3.17Å; I133-C137 PolarHBondContact O-N 3.12Å; I133-S211 WeakPolarHBondContact CB-O 3.36Å; I133-S211 VanDerWaalsContact CD1-O 3.26Å; I133-S211 WeakPolarHBondContact CD1-O 3.23Å; I133-S211 WeakPolarHBondContact CG2-O 3.28Å; I133-F212 HydrophobicContact CD1-CD2 4.34Å; I133-P215 HydrophobicContact CG2-CB 3.81Å; I133-P215 HydrophobicContact CG2-CG 4.37Å; I133-F305 HydrophobicContact CB-CE2 4.35Å; I133-F305 HydrophobicContact CB-CZ 4.09Å; I133-F305 HydrophobicContact CD1-CZ 4.35Å; I133-F305 HydrophobicContact CG1-CE2 3.63Å; I133-F305 HydrophobicContact CG1-CZ 3.61Å; I133-F305 HydrophobicContact CG2-CE1 4.31Å; I133-F305 HydrophobicContact CG2-CE2 4.34Å; I133-F305 HydrophobicContact CG2-CZ 3.6Å; I133-F313 HydrophobicContact CD1-CE2 3.68Å; I133-F313 HydrophobicContact CD1-CZ 3.75Å
134L95.8Very high94.1Very high27 Ų2713.4 Ų13.414%0.1417%0.071CC..Hα-helixtrans-64.4-35.2176.2-70.4-179.8000111.7T130 C137 I138 V169 S172 P215T130-L134 HydrophobicContact CG2-CD1 3.89Å; T130-L134 HydrophobicContact CG2-CG 4.26Å; T130-L134 WeakPolarHBondContact O-CB 3.2Å; T130-L134 WeakPolarHBondContact O-CG 3.36Å; T130-L134 PolarHBondContact O-N 2.96Å; L134-C137 WeakPolarHBondContact O-CB 3.48Å; L134-C137 PolarHBondContact O-N 2.94Å; L134-I138 WeakPolarHBondContact O-CG1 3.26Å; L134-I138 PolarHBondContact O-N 3.34Å; L134-V169 HydrophobicContact CB-CG1 3.85Å; L134-V169 HydrophobicContact CB-CG2 4.28Å; L134-S172 WeakPolarHBondContact CD1-OG 3.49Å; L134-P215 HydrophobicContact CD2-CB 4.34Å; L134-P215 HydrophobicContact CD2-CG 3.63Å
135S95.1Very high93.9Very high3 Ų313.6 Ų13.62%0.0217%0.07CC..Hα-helixtrans-61.6-42.6172.3-64.70000111.9N86 A131 S132 I133 C137 I138 I139N86-S135 PolarHBondContact ND2-OG 3.47Å; A131-S135 VanDerWaalsContact O-CB 3.24Å; A131-S135 WeakPolarHBondContact O-CB 3.44Å; A131-S135 PolarHBondContact O-N 2.64Å; A131-S135 PolarHBondContact O-OG 2.73Å; S132-S135 WeakPolarHBondContact O-CB 3.41Å; S132-S135 PolarHBondContact O-N 2.89Å; I133-S135 VanDerWaalsContact C-N 3.28Å; I133-S135 PolarHBondContact O-N 3.48Å; S135-C137 VanDerWaalsContact C-N 3.32Å; S135-C137 PolarHBondContact O-N 2.93Å; S135-I138 PolarHBondContact O-N 2.61Å; S135-I139 WeakPolarHBondContact O-CD1 3.29Å; S135-I139 WeakPolarHBondContact O-CG1 3.48Å; S135-I139 PolarHBondContact O-N 3.2Å
136L92.4Very high93.5Very high3 Ų313.5 Ų13.52%0.0167%0.07CC..Hα-helixtrans-63.4-38.1174.1-72.7171.4000112.3L87 S132 I133 I139 S140 I219 V301 F305L87-L136 HydrophobicContact CD1-CG 4.31Å; L87-L136 HydrophobicContact CD2-CD2 3.64Å; L87-L136 HydrophobicContact CD2-CG 4.15Å; S132-L136 WeakPolarHBondContact O-CG 3.44Å; S132-L136 PolarHBondContact O-N 3.15Å; I133-L136 WeakPolarHBondContact O-CB 3.18Å; I133-L136 PolarHBondContact O-N 3.34Å; I133-L136 VanDerWaalsContact O-N 3.17Å; L136-I139 HydrophobicContact CD2-CD1 4.44Å; L136-I139 PolarHBondContact O-N 3.41Å; L136-S140 PolarHBondContact O-N 3.26Å; L136-I219 HydrophobicContact CB-CD1 4.31Å; L136-V301 HydrophobicContact CD2-CG1 3.82Å; L136-F305 HydrophobicContact CD1-CB 3.92Å; L136-F305 HydrophobicContact CD1-CD1 4.13Å; L136-F305 HydrophobicContact CD1-CD2 3.19Å; L136-F305 HydrophobicContact CD1-CE2 3.72Å; L136-F305 HydrophobicContact CD1-CG 3.44Å; L136-F305 VanDerWaalsContact CD1-CG 3.44Å; L136-F305 HydrophobicContact CD1-CZ 4.39Å
137C95.2Very high93.1Very high11 Ų1112.7 Ų12.77%0.0747%0.066CC..Hα-helixtrans-60.2-48.9173.2-176.30000111.6I133 L134 S135 I139 S140 I141 P215 V218 I219I133-C137 PolarHBondContact O-N 3.12Å; L134-C137 WeakPolarHBondContact O-CB 3.48Å; L134-C137 PolarHBondContact O-N 2.94Å; S135-C137 VanDerWaalsContact C-N 3.32Å; S135-C137 PolarHBondContact O-N 2.93Å; C137-I139 VanDerWaalsContact C-N 3.35Å; C137-I139 PolarHBondContact O-N 2.86Å; C137-S140 WeakPolarHBondContact O-CB 3.28Å; C137-S140 PolarHBondContact O-N 3.44Å; C137-S140 VanDerWaalsContact O-N 3.12Å; C137-S140 PolarHBondContact O-OG 3.43Å; C137-I141 PolarHBondContact O-N 3.03Å; C137-I141 VanDerWaalsContact O-N 3.15Å; C137-P215 HydrophobicContact CB-CB 4.15Å; C137-V218 WeakPolarHBondContact SG-CG1 3.18Å; C137-I219 HydrophobicContact CB-CD1 4.19Å; C137-I219 HydrophobicContact CB-CG1 4.05Å
138I94.9Very high92.6Very high34 Ų3415.3 Ų15.317%0.1748%0.076CC..Hα-helixtrans-61.8-41.7175.6-66.7-54.5000111.9F83 L134 S135 S140 I141 D142 I165 V169F83-I138 HydrophobicContact CD1-CG2 3.81Å; F83-I138 HydrophobicContact CE1-CG2 3.68Å; F83-I138 HydrophobicContact CE2-CG2 4.48Å; F83-I138 HydrophobicContact CG-CG2 4.29Å; F83-I138 HydrophobicContact CZ-CG2 4.04Å; L134-I138 WeakPolarHBondContact O-CG1 3.26Å; L134-I138 PolarHBondContact O-N 3.34Å; S135-I138 PolarHBondContact O-N 2.61Å; I138-S140 VanDerWaalsContact C-N 3.26Å; I138-S140 PolarHBondContact O-N 3.27Å; I138-I141 HydrophobicContact CD1-CD1 4.37Å; I138-I141 PolarHBondContact O-N 3.25Å; I138-D142 WeakPolarHBondContact O-CB 3.46Å; I138-D142 PolarHBondContact O-N 3.09Å; I138-I165 HydrophobicContact CB-CG2 4.31Å; I138-I165 HydrophobicContact CD1-CG2 3.61Å; I138-I165 HydrophobicContact CG1-CG2 3.69Å; I138-I165 HydrophobicContact CG2-CG2 3.63Å; I138-V169 HydrophobicContact CG1-CG2 3.86Å
139I92.9Very high92Very high4 Ų420.1 Ų20.12%0.02110%0.095CC..Hα-helixtrans-58.3-41175.3-69.9163.1000110.3F83 L87 S135 L136 C137 I141 D142 R143 L298F83-I139 HydrophobicContact CB-CD1 4.3Å; F83-I139 HydrophobicContact CB-CG1 3.67Å; L87-I139 HydrophobicContact CB-CD1 4.49Å; L87-I139 HydrophobicContact CD2-CD1 4.05Å; S135-I139 WeakPolarHBondContact O-CD1 3.29Å; S135-I139 WeakPolarHBondContact O-CG1 3.48Å; S135-I139 PolarHBondContact O-N 3.2Å; L136-I139 HydrophobicContact CD2-CD1 4.44Å; L136-I139 PolarHBondContact O-N 3.41Å; C137-I139 VanDerWaalsContact C-N 3.35Å; C137-I139 PolarHBondContact O-N 2.86Å; I139-I141 PolarHBondContact O-N 3.47Å; I139-D142 PolarHBondContact O-N 3.41Å; I139-R143 HydrophobicContact CG2-CG 4.44Å; I139-R143 WeakPolarHBondContact O-CB 3.24Å; I139-R143 VanDerWaalsContact O-CG 3.27Å; I139-R143 WeakPolarHBondContact O-CG 3.31Å; I139-R143 PolarHBondContact O-N 2.84Å; I139-L298 HydrophobicContact CG2-CD1 4.29Å; I139-L298 HydrophobicContact CG2-CD2 4Å
140S92.6Very high91.4Very high0 Ų021.3 Ų21.30%010%0.103CC..Hα-helixtrans-61.6-43177.682.50000112.7L136 C137 I138 R143 Y144L136-S140 PolarHBondContact O-N 3.26Å; C137-S140 WeakPolarHBondContact O-CB 3.28Å; C137-S140 PolarHBondContact O-N 3.44Å; C137-S140 VanDerWaalsContact O-N 3.12Å; C137-S140 PolarHBondContact O-OG 3.43Å; I138-S140 VanDerWaalsContact C-N 3.26Å; I138-S140 PolarHBondContact O-N 3.27Å; S140-R143 PolarHBondContact O-N 3.4Å; S140-Y144 PolarHBondContact O-N 2.92Å
141I93.6Very high90.5Very high55 Ų5525.3 Ų25.328%0.28212%0.124SC..Hα-helixtrans-67.5-47177.9-64.3168.1000110.1C137 I138 I139 R143 Y144 I145 V218 M222C137-I141 PolarHBondContact O-N 3.03Å; C137-I141 VanDerWaalsContact O-N 3.15Å; I138-I141 HydrophobicContact CD1-CD1 4.37Å; I138-I141 PolarHBondContact O-N 3.25Å; I139-I141 PolarHBondContact O-N 3.47Å; I141-R143 VanDerWaalsContact C-N 3.25Å; I141-R143 PolarHBondContact O-N 3.12Å; I141-Y144 WeakPolarHBondContact O-CB 3.27Å; I141-Y144 PolarHBondContact O-N 3.41Å; I141-Y144 VanDerWaalsContact O-N 3.11Å; I141-I145 HydrophobicContact CG2-CD1 3.94Å; I141-I145 HydrophobicContact CG2-CG1 4.49Å; I141-I145 WeakPolarHBondContact O-CG1 3.5Å; I141-I145 PolarHBondContact O-N 2.79Å; I141-V218 HydrophobicContact CD1-CG1 4.06Å; I141-V218 HydrophobicContact CG1-CG1 4.2Å; I141-M222 HydrophobicContact CG1-CG 3.83Å; I141-M222 HydrophobicContact CG1-SD 4.23Å
142D91.9Very high89.8Confident1 Ų131.4 Ų31.41%0.00515%0.15CC..Hα-helixtrans-56.3-41.9176.7173.977.3000111.2T80 F83 I138 I139 I145 G146 Y153 M157T80-D142 WeakPolarHBondContact CG2-OD2 3.2Å; T80-D142 PolarHBondContact OG1-OD2 3.42Å; F83-D142 HydrophobicContact CD2-CB 4.26Å; F83-D142 HydrophobicContact CE2-CB 4.1Å; I138-D142 WeakPolarHBondContact O-CB 3.46Å; I138-D142 PolarHBondContact O-N 3.09Å; I139-D142 PolarHBondContact O-N 3.41Å; D142-I145 PolarHBondContact O-N 3.42Å; D142-G146 PolarHBondContact O-N 2.84Å; D142-Y153 VanDerWaalsContact OD1-CE2 3.24Å; D142-Y153 WeakPolarHBondContact OD1-CE2 3.35Å; D142-Y153 PolarHBondContact OD1-OH 3.42Å; D142-M157 HydrophobicContact CB-CE 3.98Å; D142-M157 VanDerWaalsContact OD1-CE 3.28Å; D142-M157 WeakPolarHBondContact OD1-CE 3.38Å
143R89.1Confident89.4Confident9 Ų932.7 Ų32.73%0.03415%0.154CC..Hα-helixtrans-66.6-40.4175.1-72.5-52.287.9-165-10.5113.7T80 I139 S140 I141 I145 G146 V147 E291 L298T80-R143 VanDerWaalsContact CG2-NH2 3.28Å; T80-R143 PolarHBondContact OG1-NH2 3.45Å; I139-R143 HydrophobicContact CG2-CG 4.44Å; I139-R143 WeakPolarHBondContact O-CB 3.24Å; I139-R143 VanDerWaalsContact O-CG 3.27Å; I139-R143 WeakPolarHBondContact O-CG 3.31Å; I139-R143 PolarHBondContact O-N 2.84Å; S140-R143 PolarHBondContact O-N 3.4Å; I141-R143 VanDerWaalsContact C-N 3.25Å; I141-R143 PolarHBondContact O-N 3.12Å; R143-I145 VanDerWaalsContact C-N 3.33Å; R143-I145 PolarHBondContact O-N 3.06Å; R143-G146 PolarHBondContact O-N 3.24Å; R143-V147 WeakPolarHBondContact O-CB 3.33Å; R143-V147 VanDerWaalsContact O-CG2 3.31Å; R143-V147 WeakPolarHBondContact O-CG2 3.48Å; R143-V147 PolarHBondContact O-N 3.22Å; R143-E291 IonicContact CZ-OE2 2.86Å; R143-E291 IonicContact NH1-OE2 2.76Å; R143-E291 PolarHBondContact NH1-OE2 3.26Å; R143-L298 HydrophobicContact CG-CD1 3.22Å; R143-L298 HydrophobicContact CG-CG 4.46Å
144Y90.3Very high88.8Confident38 Ų3837 Ų3715%0.14918%0.183CC..Hα-helixtrans-57.5-47.7172.5171.6-108.3000111.6S140 I141 V147 K148 M222 Q225 V226 V229S140-Y144 PolarHBondContact O-N 2.92Å; I141-Y144 WeakPolarHBondContact O-CB 3.27Å; I141-Y144 PolarHBondContact O-N 3.41Å; I141-Y144 VanDerWaalsContact O-N 3.11Å; Y144-V147 PolarHBondContact O-N 3.27Å; Y144-K148 HydrophobicContact CE1-CD 3.96Å; Y144-K148 HydrophobicContact CE2-CB 4.35Å; Y144-K148 HydrophobicContact CE2-CD 3.8Å; Y144-K148 WeakPolarHBondContact O-CB 3.29Å; Y144-K148 PolarHBondContact O-N 3.36Å; Y144-K148 WeakPolarHBondContact OH-CD 3.31Å; Y144-K148 WeakPolarHBondContact OH-CE 3.1Å; Y144-K148 PolarHBondContact OH-NZ 3.49Å; Y144-M222 HydrophobicContact CD1-SD 3.94Å; Y144-M222 HydrophobicContact CG-SD 4.01Å; Y144-Q225 HydrophobicContact CD2-CB 3.77Å; Y144-Q225 HydrophobicContact CE2-CB 3.55Å; Y144-Q225 HydrophobicContact CE2-CG 4.45Å; Y144-V226 HydrophobicContact CD2-CG2 4.22Å; Y144-V229 HydrophobicContact CE2-CG2 4.42Å
145I90.9Very high88.3Confident32 Ų3239.8 Ų39.816%0.16420%0.204CC..Hα-helixtrans-64-44178.4-60.7168.1000110.5I141 D142 R143 V147 Y149 Y153 I156I141-I145 HydrophobicContact CG2-CD1 3.94Å; I141-I145 HydrophobicContact CG2-CG1 4.49Å; I141-I145 WeakPolarHBondContact O-CG1 3.5Å; I141-I145 PolarHBondContact O-N 2.79Å; D142-I145 PolarHBondContact O-N 3.42Å; R143-I145 VanDerWaalsContact C-N 3.33Å; R143-I145 PolarHBondContact O-N 3.06Å; I145-V147 PolarHBondContact O-N 3.23Å; I145-Y149 HydrophobicContact CG2-CD2 4.28Å; I145-Y149 WeakPolarHBondContact O-CA 3.37Å; I145-Y149 WeakPolarHBondContact O-CB 3.33Å; I145-Y149 PolarHBondContact O-N 2.91Å; I145-Y153 HydrophobicContact CG2-CD2 4.03Å; I145-I156 HydrophobicContact CG2-CB 4.47Å; I145-I156 HydrophobicContact CG2-CD1 4.24Å; I145-I156 HydrophobicContact CG2-CG2 3.96Å
146G87Confident87.9Confident2 Ų242.2 Ų42.22%0.02122%0.216CC..Hα-helixtrans-62-39.3178.400000113.6D142 R143 C150D142-G146 PolarHBondContact O-N 2.84Å; R143-G146 PolarHBondContact O-N 3.24Å; G146-C150 WeakPolarHBondContact O-CA 3.39Å; G146-C150 WeakPolarHBondContact O-CB 3.47Å; G146-C150 PolarHBondContact O-N 3.35Å
147V85.2Confident87.8Confident3 Ų342.6 Ų42.62%0.01822%0.218CC..Hα-helixtrans-78.1-41.5178.9173.80000111.8R143 Y144 I145 V226 V229 F288 E291 A295R143-V147 WeakPolarHBondContact O-CB 3.33Å; R143-V147 VanDerWaalsContact O-CG2 3.31Å; R143-V147 WeakPolarHBondContact O-CG2 3.48Å; R143-V147 PolarHBondContact O-N 3.22Å; Y144-V147 PolarHBondContact O-N 3.27Å; I145-V147 PolarHBondContact O-N 3.23Å; V147-V226 HydrophobicContact CG2-CG1 4.27Å; V147-V229 HydrophobicContact CG1-CG1 4.02Å; V147-F288 HydrophobicContact CG1-CE2 4.31Å; V147-E291 HydrophobicContact CG2-CB 4.34Å; V147-A295 HydrophobicContact CG2-CB 4.11Å
148K85Confident87.5Confident85 Ų8544.5 Ų44.537%0.3723%0.23SC..Hα-helixtrans-75.3-40.7-178.5-175.5174.6179.2-163.40112.9Y144 V229Y144-K148 HydrophobicContact CE1-CD 3.96Å; Y144-K148 HydrophobicContact CE2-CB 4.35Å; Y144-K148 HydrophobicContact CE2-CD 3.8Å; Y144-K148 WeakPolarHBondContact O-CB 3.29Å; Y144-K148 PolarHBondContact O-N 3.36Å; Y144-K148 WeakPolarHBondContact OH-CD 3.31Å; Y144-K148 WeakPolarHBondContact OH-CE 3.1Å; Y144-K148 PolarHBondContact OH-NZ 3.49Å; K148-V229 HydrophobicContact CB-CG1 4.4Å
149Y83.5Confident87.3Confident101 Ų10149.6 Ų49.640%0.39625%0.253SS..SBendtrans-120.446-173.7-57.3-70.2000111.8I145 L151 K152 Y153 I156I145-Y149 HydrophobicContact CG2-CD2 4.28Å; I145-Y149 WeakPolarHBondContact O-CA 3.37Å; I145-Y149 WeakPolarHBondContact O-CB 3.33Å; I145-Y149 PolarHBondContact O-N 2.91Å; Y149-L151 PolarHBondContact O-N 2.98Å; Y149-K152 CarbonylContact O-C 3.52Å; Y149-K152 PolarHBondContact O-N 3.48Å; Y149-Y153 WeakPolarHBondContact O-CB 3.36Å; Y149-Y153 PolarHBondContact O-N 3.44Å; Y149-I156 HydrophobicContact CD2-CD1 4.33Å; Y149-I156 HydrophobicContact CG-CD1 4.17Å
150C79.9Confident87.2Confident34 Ų3460 Ų6023%0.2329%0.291CS..THydrogen-bonded Turntrans-53.1-24.8-172.265.20000116.2G146G146-C150 WeakPolarHBondContact O-CA 3.39Å; G146-C150 WeakPolarHBondContact O-CB 3.47Å; G146-C150 PolarHBondContact O-N 3.35Å
151L77.4Confident87.3Confident86 Ų8666.7 Ų66.745%0.4532%0.317SS..THydrogen-bonded Turntrans-93.1-31.2176.9-57.9176000113.9Y149 R284Y149-L151 PolarHBondContact O-N 2.98Å; L151-R284 HydrophobicContact CD1-CG 3.81Å; L151-R284 HydrophobicContact CD2-CG 3.78Å; L151-R284 HydrophobicContact CG-CG 4.35Å
152K83Confident87.2Confident127 Ų12764.3 Ų64.355%0.55231%0.306SS*.THydrogen-bonded Turntrans-90.6-7.7176.8-61.3-171.5177.3-169.70112Y149 S155 I156Y149-K152 CarbonylContact O-C 3.52Å; Y149-K152 PolarHBondContact O-N 3.48Å; K152-S155 PolarHBondContact O-N 2.86Å; K152-S155 PolarHBondContact O-OG 2.89Å; K152-I156 HydrophobicContact CB-CD1 3.78Å; K152-I156 HydrophobicContact CB-CG1 4.31Å; K152-I156 VanDerWaalsContact O-CG1 3.27Å; K152-I156 WeakPolarHBondContact O-CG1 3.49Å; K152-I156 PolarHBondContact O-N 3.35Å
153Y86.2Confident87.3Confident31 Ų3168.5 Ų68.512%0.12233%0.331CS..Hα-helixtrans-51.5-47.6-179.5176-93.5000113.3T80 D142 I145 Y149 S155 I156 M157T80-Y153 PolarHBondContact OG1-OH 3Å; T80-Y153 VanDerWaalsContact OG1-OH 3.06Å; D142-Y153 VanDerWaalsContact OD1-CE2 3.24Å; D142-Y153 WeakPolarHBondContact OD1-CE2 3.35Å; D142-Y153 PolarHBondContact OD1-OH 3.42Å; I145-Y153 HydrophobicContact CG2-CD2 4.03Å; Y149-Y153 WeakPolarHBondContact O-CB 3.36Å; Y149-Y153 PolarHBondContact O-N 3.44Å; Y153-S155 PolarHBondContact O-N 3.49Å; Y153-I156 PolarHBondContact O-N 2.92Å; Y153-I156 VanDerWaalsContact O-N 3.16Å; Y153-M157 HydrophobicContact CD2-CB 4.32Å; Y153-M157 HydrophobicContact CE1-CB 4.44Å; Y153-M157 HydrophobicContact CE2-CB 3.85Å; Y153-M157 HydrophobicContact CE2-CG 4.33Å; Y153-M157 PolarHBondContact O-N 2.87Å
154P82.4Confident87.6Confident92 Ų9270.9 Ų70.960%0.59735%0.353SS*.Hα-helixtrans-64.7-23.5-179.7-21.434.5000114.4
155S84.9Confident87.9Confident85 Ų8571.3 Ų71.359%0.59436%0.357SS*.Hα-helixtrans-90-26.6175.462.60000112.8K152 Y153K152-S155 PolarHBondContact O-N 2.86Å; K152-S155 PolarHBondContact O-OG 2.89Å; Y153-S155 PolarHBondContact O-N 3.49Å
156I88.2Confident88.1Confident53 Ų5371.3 Ų71.327%0.27236%0.357SS..Hα-helixtrans-77.5-51.7177.5-65.1164.1000110.6I145 Y149 K152 Y153 R161I145-I156 HydrophobicContact CG2-CB 4.47Å; I145-I156 HydrophobicContact CG2-CD1 4.24Å; I145-I156 HydrophobicContact CG2-CG2 3.96Å; Y149-I156 HydrophobicContact CD2-CD1 4.33Å; Y149-I156 HydrophobicContact CG-CD1 4.17Å; K152-I156 HydrophobicContact CB-CD1 3.78Å; K152-I156 HydrophobicContact CB-CG1 4.31Å; K152-I156 VanDerWaalsContact O-CG1 3.27Å; K152-I156 WeakPolarHBondContact O-CG1 3.49Å; K152-I156 PolarHBondContact O-N 3.35Å; Y153-I156 PolarHBondContact O-N 2.92Å; Y153-I156 VanDerWaalsContact O-N 3.16Å; I156-R161 WeakPolarHBondContact O-CD 3.34Å; I156-R161 PolarHBondContact O-NH1 3.11Å
157M88.5Confident88.6Confident12 Ų1275.2 Ų75.26%0.05938%0.381CS..SBendtrans-97.8101.5-176.3-163.764.9107.200108.6I79 F83 D142 Y153 I165I79-M157 HydrophobicContact CB-CG 4.49Å; I79-M157 HydrophobicContact CD1-CG 4.47Å; I79-M157 WeakPolarHBondContact CD1-O 3.5Å; I79-M157 HydrophobicContact CG2-CG 3.66Å; F83-M157 HydrophobicContact CE2-CE 3.79Å; F83-M157 HydrophobicContact CZ-CE 3.84Å; F83-M157 HydrophobicContact CZ-SD 4.4Å; D142-M157 HydrophobicContact CB-CE 3.98Å; D142-M157 VanDerWaalsContact OD1-CE 3.28Å; D142-M157 WeakPolarHBondContact OD1-CE 3.38Å; Y153-M157 HydrophobicContact CD2-CB 4.32Å; Y153-M157 HydrophobicContact CE1-CB 4.44Å; Y153-M157 HydrophobicContact CE2-CB 3.85Å; Y153-M157 HydrophobicContact CE2-CG 4.33Å; Y153-M157 PolarHBondContact O-N 2.87Å; M157-I165 HydrophobicContact CE-CD1 4.37Å; M157-I165 HydrophobicContact SD-CD1 4.29Å
158T90.9Very high89.1Confident51 Ų5180.7 Ų80.731%0.31341%0.409SS..  trans-103.8158.8178.265.70000110.5R160 R161 A162T158-R160 VanDerWaalsContact C-N 3.31Å; T158-R160 PolarHBondContact O-N 3.39Å; T158-R161 PolarHBondContact O-N 2.94Å; T158-R161 VanDerWaalsContact O-N 3.17Å; T158-R161 WeakPolarHBondContact OG1-CG 3.44Å; T158-R161 PolarHBondContact OG1-N 3.18Å; T158-A162 PolarHBondContact O-N 3.27Å
159E89.2Confident89.7Confident140 Ų14077 Ų7765%0.65439%0.393SS*.Hα-helixtrans-57.7-42.7179.7-64.7-178.417200112.4I79 R161 A162 V163I79-E159 HydrophobicContact CG1-CG 4.48Å; E159-R161 VanDerWaalsContact C-N 3.33Å; E159-R161 PolarHBondContact O-N 2.85Å; E159-A162 PolarHBondContact O-N 2.94Å; E159-V163 WeakPolarHBondContact O-CG2 3.48Å; E159-V163 PolarHBondContact O-N 3.44Å
160R91.7Very high90.4Very high222 Ų22275.5 Ų75.584%0.83839%0.387SS*.Hα-helixtrans-60.6-42.1177.7-64.5-176.6-175.3173.10.8112.2T158 A164T158-R160 VanDerWaalsContact C-N 3.31Å; T158-R160 PolarHBondContact O-N 3.39Å; R160-A164 WeakPolarHBondContact O-CB 3.36Å; R160-A164 PolarHBondContact O-N 3.45Å
161R93.6Very high91.2Very high141 Ų14177.7 Ų77.753%0.53240%0.399SS..Hα-helixtrans-66.5-42.5176.6-73.3178176.1179.9-2.6111.2I156 T158 E159 A164 I165I156-R161 WeakPolarHBondContact O-CD 3.34Å; I156-R161 PolarHBondContact O-NH1 3.11Å; T158-R161 PolarHBondContact O-N 2.94Å; T158-R161 VanDerWaalsContact O-N 3.17Å; T158-R161 WeakPolarHBondContact OG1-CG 3.44Å; T158-R161 PolarHBondContact OG1-N 3.18Å; E159-R161 VanDerWaalsContact C-N 3.33Å; E159-R161 PolarHBondContact O-N 2.85Å; R161-A164 PolarHBondContact O-N 3.03Å; R161-I165 VanDerWaalsContact O-CG1 3.24Å; R161-I165 WeakPolarHBondContact O-CG1 3.34Å; R161-I165 PolarHBondContact O-N 2.89Å
162A92.4Very high92.1Very high6 Ų675.4 Ų75.45%0.0539%0.391CS..Hα-helixtrans-60.9-46.6177.400000111.7I79 F83 T158 E159 A164 I165 L166I79-A162 HydrophobicContact CG2-CB 3.61Å; F83-A162 HydrophobicContact CE1-CB 4.22Å; F83-A162 HydrophobicContact CZ-CB 3.84Å; T158-A162 PolarHBondContact O-N 3.27Å; E159-A162 PolarHBondContact O-N 2.94Å; A162-A164 PolarHBondContact O-N 3.45Å; A162-I165 PolarHBondContact O-N 3.28Å; A162-L166 WeakPolarHBondContact O-CG 3.24Å; A162-L166 PolarHBondContact O-N 3.01Å
163V93.8Very high92.8Very high88 Ų8869.3 Ų69.353%0.53336%0.364SS..Hα-helixtrans-61.2-44.4175.7173.70000111.3E159 I165 L166 V167E159-V163 WeakPolarHBondContact O-CG2 3.48Å; E159-V163 PolarHBondContact O-N 3.44Å; V163-I165 VanDerWaalsContact C-N 3.33Å; V163-I165 PolarHBondContact O-N 3.49Å; V163-L166 PolarHBondContact O-N 2.84Å; V163-V167 HydrophobicContact CG1-CG2 4.43Å; V163-V167 WeakPolarHBondContact O-CG2 3.47Å; V163-V167 PolarHBondContact O-N 2.99Å
164A96.1Very high93.2Very high60 Ų6071.2 Ų71.250%0.49638%0.379SS..Hα-helixtrans-60.4-41.5176.800000112.5R160 R161 A162 V167 L168R160-A164 WeakPolarHBondContact O-CB 3.36Å; R160-A164 PolarHBondContact O-N 3.45Å; R161-A164 PolarHBondContact O-N 3.03Å; A162-A164 PolarHBondContact O-N 3.45Å; A164-V167 PolarHBondContact O-N 3.45Å; A164-L168 WeakPolarHBondContact O-CB 3.39Å; A164-L168 PolarHBondContact O-N 3.17Å
165I95.9Very high93.8Very high46 Ų4671.2 Ų71.224%0.23638%0.377CS..Hα-helixtrans-62.4-43.8174.8-68.9163.7000110.7F83 I138 M157 R161 A162 V163 L168 V169F83-I165 HydrophobicContact CE1-CG2 4.37Å; I138-I165 HydrophobicContact CB-CG2 4.31Å; I138-I165 HydrophobicContact CD1-CG2 3.61Å; I138-I165 HydrophobicContact CG1-CG2 3.69Å; I138-I165 HydrophobicContact CG2-CG2 3.63Å; M157-I165 HydrophobicContact CE-CD1 4.37Å; M157-I165 HydrophobicContact SD-CD1 4.29Å; R161-I165 VanDerWaalsContact O-CG1 3.24Å; R161-I165 WeakPolarHBondContact O-CG1 3.34Å; R161-I165 PolarHBondContact O-N 2.89Å; A162-I165 PolarHBondContact O-N 3.28Å; V163-I165 VanDerWaalsContact C-N 3.33Å; V163-I165 PolarHBondContact O-N 3.49Å; I165-L168 WeakPolarHBondContact O-CB 3.32Å; I165-L168 PolarHBondContact O-N 2.92Å; I165-V169 WeakPolarHBondContact O-CG2 3.43Å; I165-V169 PolarHBondContact O-N 3.24Å
166L95.4Very high94.2Very high32 Ų3267.8 Ų67.817%0.16835%0.352CS..Hα-helixtrans-63-44.8177.9-70-178.8000111.8F83 N86 A162 V163 L168 V169 W170F83-L166 HydrophobicContact CD1-CD2 3.7Å; F83-L166 HydrophobicContact CD1-CG 4.25Å; F83-L166 HydrophobicContact CE1-CD2 4.08Å; F83-L166 HydrophobicContact CE1-CG 4.22Å; N86-L166 HydrophobicContact CB-CD1 4.29Å; N86-L166 HydrophobicContact CB-CD2 3.64Å; N86-L166 VanDerWaalsContact CG-CD2 3.46Å; A162-L166 WeakPolarHBondContact O-CG 3.24Å; A162-L166 PolarHBondContact O-N 3.01Å; V163-L166 PolarHBondContact O-N 2.84Å; L166-L168 VanDerWaalsContact C-N 3.29Å; L166-L168 PolarHBondContact O-N 3.28Å; L166-V169 WeakPolarHBondContact O-CB 3.34Å; L166-V169 PolarHBondContact O-N 3.06Å; L166-V169 VanDerWaalsContact O-N 3.17Å; L166-W170 PolarHBondContact O-N 2.97Å; L166-W170 VanDerWaalsContact O-N 3.1Å
167V96.8Very high94.5Very high85 Ų8565.6 Ų65.652%0.51534%0.341SS..Hα-helixtrans-58.3-44.6174.9171.20000110.5V163 A164 V169 W170 V171V163-V167 HydrophobicContact CG1-CG2 4.43Å; V163-V167 WeakPolarHBondContact O-CG2 3.47Å; V163-V167 PolarHBondContact O-N 2.99Å; A164-V167 PolarHBondContact O-N 3.45Å; V167-V169 VanDerWaalsContact C-N 3.31Å; V167-V169 PolarHBondContact O-N 3.4Å; V167-W170 PolarHBondContact O-N 2.88Å; V167-V171 HydrophobicContact CG1-CG2 4.23Å; V167-V171 WeakPolarHBondContact O-CB 3.24Å; V167-V171 VanDerWaalsContact O-CG2 3.3Å; V167-V171 WeakPolarHBondContact O-CG2 3.24Å; V167-V171 PolarHBondContact O-N 3.02Å
168L96.5Very high94.7Very high117 Ų11767.4 Ų67.461%0.61335%0.353SS*.Hα-helixtrans-59.4-41.9176.9-177.264.2000112.1A164 I165 L166 V171 S172A164-L168 WeakPolarHBondContact O-CB 3.39Å; A164-L168 PolarHBondContact O-N 3.17Å; I165-L168 WeakPolarHBondContact O-CB 3.32Å; I165-L168 PolarHBondContact O-N 2.92Å; L166-L168 VanDerWaalsContact C-N 3.29Å; L166-L168 PolarHBondContact O-N 3.28Å; L168-V171 PolarHBondContact O-N 3.39Å; L168-S172 WeakPolarHBondContact O-CB 3.48Å; L168-S172 PolarHBondContact O-N 3.21Å; L168-S172 PolarHBondContact O-OG 2.87Å; L168-S172 VanDerWaalsContact O-OG 3.08Å
169V97.2Very high94.6Very high7 Ų765.4 Ų65.44%0.04234%0.342CS..Hα-helixtrans-59.8-46.4176.9165.80000111.6L134 I138 I165 L166 V167 S172 S173L134-V169 HydrophobicContact CB-CG1 3.85Å; L134-V169 HydrophobicContact CB-CG2 4.28Å; I138-V169 HydrophobicContact CG1-CG2 3.86Å; I165-V169 WeakPolarHBondContact O-CG2 3.43Å; I165-V169 PolarHBondContact O-N 3.24Å; L166-V169 WeakPolarHBondContact O-CB 3.34Å; L166-V169 PolarHBondContact O-N 3.06Å; L166-V169 VanDerWaalsContact O-N 3.17Å; V167-V169 VanDerWaalsContact C-N 3.31Å; V167-V169 PolarHBondContact O-N 3.4Å; V169-S172 PolarHBondContact O-OG 3.11Å; V169-S172 VanDerWaalsContact O-OG 3.05Å; V169-S173 VanDerWaalsContact O-CB 3.32Å; V169-S173 WeakPolarHBondContact O-CB 3.25Å; V169-S173 PolarHBondContact O-N 3.24Å; V169-S173 PolarHBondContact O-OG 2.93Å
170W97.6Very high94.4Very high70 Ų7059.4 Ų59.427%0.26532%0.316SS..Hα-helixtrans-68.9-40179.8-75.6102.9000112.3N86 A90 L93 A131 L166 V167 S173 T174N86-W170 PolarHBondContact OD1-NE1 2.76Å; A90-W170 HydrophobicContact CB-CH2 4.12Å; A90-W170 HydrophobicContact CB-CZ2 4.31Å; L93-W170 HydrophobicContact CD2-CH2 4.33Å; L93-W170 HydrophobicContact CD2-CZ3 4.31Å; A131-W170 HydrophobicContact CB-CE3 4.2Å; A131-W170 HydrophobicContact CB-CH2 4.24Å; A131-W170 HydrophobicContact CB-CZ3 4.04Å; L166-W170 PolarHBondContact O-N 2.97Å; L166-W170 VanDerWaalsContact O-N 3.1Å; V167-W170 PolarHBondContact O-N 2.88Å; W170-S173 PolarHBondContact O-N 3.49Å; W170-T174 WeakPolarHBondContact O-CB 3.43Å; W170-T174 PolarHBondContact O-N 3.32Å; W170-T174 PolarHBondContact O-OG1 3.23Å
171V97.6Very high94.2Very high80 Ų8053 Ų5349%0.48530%0.297SS..Hα-helixtrans-63.3-49.1175.8171.10000110.6V167 L168 S173 T174 V175V167-V171 HydrophobicContact CG1-CG2 4.23Å; V167-V171 WeakPolarHBondContact O-CB 3.24Å; V167-V171 VanDerWaalsContact O-CG2 3.3Å; V167-V171 WeakPolarHBondContact O-CG2 3.24Å; V167-V171 PolarHBondContact O-N 3.02Å; L168-V171 PolarHBondContact O-N 3.39Å; V171-S173 VanDerWaalsContact C-N 3.31Å; V171-S173 PolarHBondContact O-N 3.14Å; V171-T174 PolarHBondContact O-N 2.95Å; V171-V175 WeakPolarHBondContact O-CG2 3.1Å; V171-V175 PolarHBondContact O-N 2.96Å
172S96Very high93.9Very high38 Ų3853 Ų5327%0.26631%0.308SS..Hα-helixtrans-63.2-38.5178.563.80000112.1L134 L168 V169 T174 V175 I176L134-S172 WeakPolarHBondContact CD1-OG 3.49Å; L168-S172 WeakPolarHBondContact O-CB 3.48Å; L168-S172 PolarHBondContact O-N 3.21Å; L168-S172 PolarHBondContact O-OG 2.87Å; L168-S172 VanDerWaalsContact O-OG 3.08Å; V169-S172 PolarHBondContact O-OG 3.11Å; V169-S172 VanDerWaalsContact O-OG 3.05Å; S172-T174 VanDerWaalsContact C-N 3.33Å; S172-T174 PolarHBondContact O-N 3.3Å; S172-V175 PolarHBondContact O-N 3.26Å; S172-I176 WeakPolarHBondContact O-CD1 3.48Å; S172-I176 VanDerWaalsContact O-CG1 3.31Å; S172-I176 WeakPolarHBondContact O-CG1 3.44Å; S172-I176 PolarHBondContact O-N 3.42Å; S172-I176 VanDerWaalsContact O-N 3.1Å
173S97.3Very high93.3Very high0 Ų055.2 Ų55.20%033%0.331CS..Hα-helixtrans-63.2-39.8175.8-54.40000112A131 V169 W170 V171 I176 S177A131-S173 VanDerWaalsContact CA-OG 3.24Å; A131-S173 WeakPolarHBondContact CA-OG 3.49Å; A131-S173 PolarHBondContact N-OG 3.3Å; V169-S173 VanDerWaalsContact O-CB 3.32Å; V169-S173 WeakPolarHBondContact O-CB 3.25Å; V169-S173 PolarHBondContact O-N 3.24Å; V169-S173 PolarHBondContact O-OG 2.93Å; W170-S173 PolarHBondContact O-N 3.49Å; V171-S173 VanDerWaalsContact C-N 3.31Å; V171-S173 PolarHBondContact O-N 3.14Å; S173-I176 PolarHBondContact O-N 2.68Å; S173-S177 WeakPolarHBondContact O-CB 3.5Å; S173-S177 PolarHBondContact O-N 3.33Å; S173-S177 PolarHBondContact O-OG 3.43Å
174T95.6Very high92.8Very high70 Ų7056.3 Ų56.343%0.42933%0.325SS..Hα-helixtrans-67.5-41.2177.6-54.10000111.9L127 W170 V171 S172 I176 S177 V178L127-T174 WeakPolarHBondContact CD1-OG1 3.38Å; W170-T174 WeakPolarHBondContact O-CB 3.43Å; W170-T174 PolarHBondContact O-N 3.32Å; W170-T174 PolarHBondContact O-OG1 3.23Å; V171-T174 PolarHBondContact O-N 2.95Å; S172-T174 VanDerWaalsContact C-N 3.33Å; S172-T174 PolarHBondContact O-N 3.3Å; T174-I176 VanDerWaalsContact C-N 3.28Å; T174-I176 PolarHBondContact O-N 2.94Å; T174-S177 PolarHBondContact O-N 3.03Å; T174-S177 PolarHBondContact O-OG 3.42Å; T174-V178 WeakPolarHBondContact O-CB 3.19Å; T174-V178 PolarHBondContact O-N 2.9Å; T174-V178 VanDerWaalsContact O-N 3.12Å
175V95Very high92.1Very high93 Ų9356.8 Ų56.856%0.56432%0.316SS*.Hα-helixtrans-61.9-38.5176.41700000111.2V171 S172V171-V175 WeakPolarHBondContact O-CG2 3.1Å; V171-V175 PolarHBondContact O-N 2.96Å; S172-V175 PolarHBondContact O-N 3.26Å
176I93.9Very high91.1Very high12 Ų1258.6 Ų58.66%0.06232%0.324CS..Hα-helixtrans-72.2-39.9178.5-63.6161.1000110.9T130 S172 S173 T174 Y203 F206 F210 S211T130-I176 HydrophobicContact CG2-CD1 3.81Å; S172-I176 WeakPolarHBondContact O-CD1 3.48Å; S172-I176 VanDerWaalsContact O-CG1 3.31Å; S172-I176 WeakPolarHBondContact O-CG1 3.44Å; S172-I176 PolarHBondContact O-N 3.42Å; S172-I176 VanDerWaalsContact O-N 3.1Å; S173-I176 PolarHBondContact O-N 2.68Å; T174-I176 VanDerWaalsContact C-N 3.28Å; T174-I176 PolarHBondContact O-N 2.94Å; I176-Y203 WeakPolarHBondContact O-CE2 3.49Å; I176-Y203 PolarHBondContact O-OH 2.69Å; I176-F206 HydrophobicContact CG2-CE1 4.49Å; I176-F210 HydrophobicContact CD1-CB 3.73Å; I176-F210 HydrophobicContact CG1-CB 4.3Å; I176-S211 WeakPolarHBondContact CG2-OG 3.19Å
177S94.1Very high89.9Confident7 Ų762.3 Ų62.35%0.04935%0.35CS..Hα-helixtrans-79.6-16.6-174.271.20000115.4A123 S173 T174 P180A123-S177 WeakPolarHBondContact O-CB 3.35Å; S173-S177 WeakPolarHBondContact O-CB 3.5Å; S173-S177 PolarHBondContact O-N 3.33Å; S173-S177 PolarHBondContact O-OG 3.43Å; T174-S177 PolarHBondContact O-N 3.03Å; T174-S177 PolarHBondContact O-OG 3.42Å; S177-P180 WeakPolarHBondContact O-CD 3.5Å
178V91.7Very high88.4Confident50 Ų5062.5 Ų62.530%0.30335%0.353SS..THydrogen-bonded Turntrans-77.5-18-176.578.20000113.6T174 L181 L182T174-V178 WeakPolarHBondContact O-CB 3.19Å; T174-V178 PolarHBondContact O-N 2.9Å; T174-V178 VanDerWaalsContact O-N 3.12Å; V178-L181 HydrophobicContact CG2-CB 4.36Å; V178-L181 HydrophobicContact CG2-CD1 4.38Å; V178-L181 WeakPolarHBondContact O-CA 3.32Å; V178-L181 WeakPolarHBondContact O-CB 3.29Å; V178-L181 PolarHBondContact O-N 2.68Å; V178-L182 HydrophobicContact CG1-CD1 4.09Å; V178-L182 HydrophobicContact CG2-CD1 4.45Å; V178-L182 HydrophobicContact CG2-CG 4.25Å; V178-L182 PolarHBondContact O-N 2.96Å
179G88.7Confident86.9Confident9 Ų960.4 Ų60.49%0.09335%0.346CS..G310 helixtrans-46.7-51.5-175.700000114.8L181 L182 W184G179-L181 VanDerWaalsContact C-N 3.26Å; G179-L181 PolarHBondContact O-N 3.42Å; G179-L182 PolarHBondContact O-N 3.27Å; G179-L182 VanDerWaalsContact O-N 3.11Å; G179-W184 WeakPolarHBondContact O-CB 3.45Å; G179-W184 PolarHBondContact O-N 3.31Å; G179-W184 VanDerWaalsContact O-N 3.14Å
180P86.7Confident85Confident15 Ų1568.9 Ų68.910%0.09739%0.386CS..G310 helixtrans-67.3-26.2-179.2-21.936.5000113.2S177 L182 G183 K185 T198 Y203S177-P180 WeakPolarHBondContact O-CD 3.5Å; P180-L182 VanDerWaalsContact C-N 3.32Å; P180-G183 PolarHBondContact O-N 2.75Å; P180-K185 HydrophobicContact CB-CB 4.29Å; P180-T198 HydrophobicContact CB-CG2 3.93Å; P180-T198 HydrophobicContact CG-CG2 3.58Å; P180-Y203 VanDerWaalsContact CD-CE2 3.48Å; P180-Y203 VanDerWaalsContact CD-CZ 3.4Å; P180-Y203 WeakPolarHBondContact CD-OH 3.27Å; P180-Y203 HydrophobicContact CG-CD1 4.08Å; P180-Y203 HydrophobicContact CG-CD2 4.35Å; P180-Y203 HydrophobicContact CG-CE1 3.5Å; P180-Y203 VanDerWaalsContact CG-CE1 3.5Å; P180-Y203 HydrophobicContact CG-CE2 3.84Å; P180-Y203 HydrophobicContact CG-CG 4.44Å; P180-Y203 WeakPolarHBondContact CG-OH 3.25Å
181L86.3Confident83.2Confident86 Ų8670.5 Ų70.545%0.4540%0.396SS..G310 helixtrans-72.7-26.4175.8-60.6179.4000112.2N119 A123 V178 G179 G183N119-L181 HydrophobicContact CB-CD2 3.87Å; A123-L181 HydrophobicContact CB-CD1 3.79Å; A123-L181 HydrophobicContact CB-CD2 4.14Å; A123-L181 HydrophobicContact CB-CG 3.92Å; V178-L181 HydrophobicContact CG2-CB 4.36Å; V178-L181 HydrophobicContact CG2-CD1 4.38Å; V178-L181 WeakPolarHBondContact O-CA 3.32Å; V178-L181 WeakPolarHBondContact O-CB 3.29Å; V178-L181 PolarHBondContact O-N 2.68Å; G179-L181 VanDerWaalsContact C-N 3.26Å; G179-L181 PolarHBondContact O-N 3.42Å; L181-G183 VanDerWaalsContact C-N 3.27Å
182L87.1Confident81.5Confident142 Ų14271 Ų7174%0.74339%0.393SS*.G310 helixtrans-876.4176.2-61.1177.9000113.2V178 G179 P180V178-L182 HydrophobicContact CG1-CD1 4.09Å; V178-L182 HydrophobicContact CG2-CD1 4.45Å; V178-L182 HydrophobicContact CG2-CG 4.25Å; V178-L182 PolarHBondContact O-N 2.96Å; G179-L182 PolarHBondContact O-N 3.27Å; G179-L182 VanDerWaalsContact O-N 3.11Å; P180-L182 VanDerWaalsContact C-N 3.32Å
183G80.8Confident80.1Confident52 Ų5271.2 Ų71.254%0.53639%0.393SS..THydrogen-bonded Turntrans92.18.3179.300000114.7P180 L181 K185P180-G183 PolarHBondContact O-N 2.75Å; L181-G183 VanDerWaalsContact C-N 3.27Å; G183-K185 PolarHBondContact O-N 3.14Å
184W82.9Confident79.2Confident111 Ų11176 Ų7642%0.4242%0.422SS..  trans-80.964.7169.2-162.73.8000110.4G179 G202 Y203 F206G179-W184 WeakPolarHBondContact O-CB 3.45Å; G179-W184 PolarHBondContact O-N 3.31Å; G179-W184 VanDerWaalsContact O-N 3.14Å; W184-G202 VanDerWaalsContact CZ2-C 3.43Å; W184-Y203 HydrophobicContact CD2-CD2 4.15Å; W184-Y203 AromaticContact CE3-CD2 3.93Å; W184-Y203 HydrophobicContact CE3-CD2 3.93Å; W184-Y203 HydrophobicContact CZ3-CD2 4.38Å; W184-F206 HydrophobicContact CH2-CB 3.82Å; W184-F206 HydrophobicContact CH2-CD1 4.22Å; W184-F206 HydrophobicContact CH2-CD2 4.41Å; W184-F206 AromaticContact CH2-CG 3.9Å; W184-F206 HydrophobicContact CH2-CG 3.9Å; W184-F206 HydrophobicContact CZ3-CB 4.39Å; W184-F206 AromaticContact CZ3-CD1 3.95Å; W184-F206 HydrophobicContact CZ3-CD1 3.95Å; W184-F206 HydrophobicContact CZ3-CE1 4.42Å; W184-F206 HydrophobicContact CZ3-CG 4.09Å
185K80.1Confident78.6Confident71 Ų7173.2 Ų73.231%0.30941%0.405SS..SBendtrans-151.3161.9-17962.9168.4-178.4167.90110.8N119 P180 G183 T198N119-K185 PolarHBondContact OD1-NZ 2.92Å; P180-K185 HydrophobicContact CB-CB 4.29Å; G183-K185 PolarHBondContact O-N 3.14Å; K185-T198 WeakPolarHBondContact CA-OG1 3.2Å; K185-T198 HydrophobicContact CB-CG2 4.43Å
186E75.5Confident77.9Confident83 Ų8371 Ų7139%0.38840%0.4SS..PPolyproline II helixtrans-58152.1175.7-80.8152-11000111.3E199 E200E186-E199 WeakPolarHBondContact OE1-CA 3.42Å; E186-E199 WeakPolarHBondContact OE1-CB 3.47Å; E186-E199 PolarHBondContact OE1-N 3.3Å; E186-E200 VanDerWaalsContact CA-OE1 3.29Å; E186-E200 WeakPolarHBondContact CA-OE1 3.43Å; E186-E200 HydrophobicContact CB-CG 4.42Å; E186-E200 HydrophobicContact CG-CG 3.86Å; E186-E200 WeakPolarHBondContact CG-OE1 3.48Å; E186-E200 PolarHBondContact OE1-N 3.05Å
187P71.6Confident77.4Confident110 Ų11071.9 Ų71.971%0.71441%0.405SS*.PPolyproline II helixtrans-56.3139.7169.424.7-32.5000109.8
188P64.4Low76.8Confident89 Ų8972.4 Ų72.458%0.57841%0.408SS*.PPolyproline II helixtrans-61.6137.9-174.425.1-33000110.7
189P63.9Low76.3Confident74 Ų7472.4 Ų72.448%0.48141%0.405SS..PPolyproline II helixtrans-60.9152.7174.824.2-32000111R115 H191R115-P189 PolarHBondContact NH1-O 2.94Å; P189-H191 PolarHBondContact O-N 2.99Å; P189-H191 VanDerWaalsContact O-N 3.08Å
190E57.2Low76.2Confident185 Ų18574.5 Ų74.586%0.86441%0.412SS*.SBendtrans-61-18179.5-66.6-173.3169.100113.1
191H61.1Low76.2Confident103 Ų10376 Ų7648%0.47742%0.422SS..  trans-114.3127.3179.4-60-31.4000111.6P189 T193P189-H191 PolarHBondContact O-N 2.99Å; P189-H191 VanDerWaalsContact O-N 3.08Å; H191-T193 PolarHBondContact O-N 3.35Å
192E61.8Low76.3Confident91 Ų9173.6 Ų73.643%0.42542%0.417SS..THydrogen-bonded Turntrans-70.1-7.2179.7-48.5-152.6151.600114.2R115 V194R115-E192 IonicContact CZ-OE1 2.62Å; R115-E192 VanDerWaalsContact NE-CD 3.32Å; R115-E192 IonicContact NE-OE1 3.02Å; R115-E192 PolarHBondContact NE-OE1 3.17Å; R115-E192 VanDerWaalsContact NH2-CG 3.32Å; R115-E192 IonicContact NH2-OE1 3.85Å; R115-E192 PolarHBondContact NH2-OE1 3Å; E192-V194 VanDerWaalsContact C-N 3.33Å; E192-V194 PolarHBondContact O-N 3.19Å
193T67.4Low76.5Confident43 Ų4366.9 Ų66.926%0.26438%0.382SS..THydrogen-bonded Turntrans-82.4-7.2-17251.90000113.9K35 W111 H191K35-T193 HydrophobicContact CB-CG2 4.28Å; W111-T193 PolarHBondContact N-O 3.5Å; H191-T193 PolarHBondContact O-N 3.35Å
194V76.8Confident76.9Confident101 Ų10164.4 Ų64.461%0.61236%0.357SS*.  trans-106122.4179.2-176.10000109.6E192E192-V194 VanDerWaalsContact C-N 3.33Å; E192-V194 PolarHBondContact O-N 3.19Å
195C82.8Confident77.3Confident11 Ų1163.1 Ų63.17%0.07436%0.358CS..  trans-126.6128.5173.2-178.80000109.9L105 W111 C118 W121L105-C195 WeakPolarHBondContact CD2-O 3.49Å; W111-C195 HydrophobicContact CB-CB 3.67Å; W111-C195 HydrophobicContact CD2-CB 3.42Å; W111-C195 VanDerWaalsContact CD2-CB 3.42Å; W111-C195 HydrophobicContact CE3-CB 3.68Å; W111-C195 HydrophobicContact CG-CB 3.44Å; W111-C195 VanDerWaalsContact CG-CB 3.44Å; W111-C195 HydrophobicContact CZ3-CB 4.41Å; C118-C195 WeakPolarHBondContact CA-SG 3.45Å; C118-C195 HydrophobicContact CB-CB 3.9Å; C118-C195 WeakPolarHBondContact CB-SG 3.29Å; C118-C195 WeakPolarHBondContact SG-CA 3.09Å; C118-C195 WeakPolarHBondContact SG-CB 3.03Å; C118-C195 CovalentContact SG-SG 2.03Å; C118-C195 PolarHBondContact SG-SG 3.47Å; W121-C195 VanDerWaalsContact CE3-SG 3.54Å
196G80.8Confident77.9Confident45 Ų4563 Ų6346%0.46436%0.357SS..  trans-154165.5-18000000111.5
197I83.4Confident78.7Confident31 Ų3159.4 Ų59.416%0.15934%0.342CS..  trans-67139.7168.9-57.9174.6000107.5D125 V126 E199 F312 F336D125-I197 WeakPolarHBondContact OD2-CD1 3.26Å; V126-I197 HydrophobicContact CG2-CG2 4.41Å; I197-E199 PolarHBondContact O-N 3.28Å; I197-F312 HydrophobicContact CD1-CZ 4.1Å; I197-F336 HydrophobicContact CD1-CE2 3.73Å; I197-F336 HydrophobicContact CD1-CZ 4.32Å
198T81.8Confident79.8Confident18 Ų1854.2 Ų54.211%0.1131%0.308CS..  trans-61.5133.4178.8179.60000111.2P180 K185 E200 Y203P180-T198 HydrophobicContact CB-CG2 3.93Å; P180-T198 HydrophobicContact CG-CG2 3.58Å; K185-T198 WeakPolarHBondContact CA-OG1 3.2Å; K185-T198 HydrophobicContact CB-CG2 4.43Å; T198-E200 PolarHBondContact OG1-N 3.3Å; T198-Y203 HydrophobicContact CG2-CD1 3.33Å; T198-Y203 HydrophobicContact CG2-CE1 3.58Å; T198-Y203 HydrophobicContact CG2-CG 4.22Å
199E80.4Confident81.2Confident51 Ų5153.7 Ų53.724%0.23830%0.3CS..  trans-102.818.8177.6-61.9-175.2-17100110.9E186 I197 S320 K326E186-E199 WeakPolarHBondContact OE1-CA 3.42Å; E186-E199 WeakPolarHBondContact OE1-CB 3.47Å; E186-E199 PolarHBondContact OE1-N 3.3Å; I197-E199 PolarHBondContact O-N 3.28Å; E199-S320 VanDerWaalsContact O-CB 3.26Å; E199-S320 WeakPolarHBondContact O-CB 3.16Å; E199-S320 PolarHBondContact O-OG 3.49Å; E199-K326 IonicContact OE1-NZ 2.69Å; E199-K326 PolarHBondContact OE1-NZ 2.78Å; E199-K326 IonicContact OE2-NZ 2.8Å; E199-K326 PolarHBondContact OE2-NZ 3.08Å
200E86.9Confident82.7Confident52 Ų5254.1 Ų54.124%0.24329%0.294CS..  trans-57.2123.5175.3-90.4-62.3147.600109.9E186 T198 G202 Y203 A204E186-E200 VanDerWaalsContact CA-OE1 3.29Å; E186-E200 WeakPolarHBondContact CA-OE1 3.43Å; E186-E200 HydrophobicContact CB-CG 4.42Å; E186-E200 HydrophobicContact CG-CG 3.86Å; E186-E200 WeakPolarHBondContact CG-OE1 3.48Å; E186-E200 PolarHBondContact OE1-N 3.05Å; T198-E200 PolarHBondContact OG1-N 3.3Å; E200-G202 VanDerWaalsContact C-N 3.29Å; E200-G202 PolarHBondContact O-N 3.06Å; E200-Y203 PolarHBondContact O-N 2.8Å; E200-Y203 VanDerWaalsContact O-N 3.08Å; E200-A204 VanDerWaalsContact O-CB 3.28Å; E200-A204 WeakPolarHBondContact O-CB 3.26Å; E200-A204 PolarHBondContact O-N 3.41Å
201P86.5Confident84.4Confident48 Ų4845.4 Ų45.431%0.31225%0.254SS..Hα-helixtrans-59.2-38.2-17119.9-32000113.8L205 S320 F321P201-L205 VanDerWaalsContact O-CB 3.26Å; P201-L205 WeakPolarHBondContact O-CB 3.49Å; P201-L205 PolarHBondContact O-N 3.3Å; P201-L205 VanDerWaalsContact O-N 3.09Å; P201-S320 WeakPolarHBondContact CA-OG 3.01Å; P201-S320 WeakPolarHBondContact CB-OG 3.36Å; P201-F321 HydrophobicContact CB-CD1 4.03Å; P201-F321 HydrophobicContact CB-CE1 3.71Å; P201-F321 HydrophobicContact CB-CE2 4.49Å; P201-F321 HydrophobicContact CB-CZ 3.94Å
202G89.3Confident86Confident34 Ų3440.5 Ų40.535%0.35123%0.231SC..Hα-helixtrans-63.6-47.5176.600000112.4W184 E200 F206W184-G202 VanDerWaalsContact CZ2-C 3.43Å; E200-G202 VanDerWaalsContact C-N 3.29Å; E200-G202 PolarHBondContact O-N 3.06Å; G202-F206 VanDerWaalsContact O-CB 3.28Å; G202-F206 WeakPolarHBondContact O-CB 3.26Å; G202-F206 PolarHBondContact O-N 2.76Å
203Y90.3Very high87.6Confident1 Ų139.8 Ų39.80%0.00423%0.225CC..Hα-helixtrans-75.3-41.1-178176.8-97.5000112.2I176 P180 W184 T198 E200 L205 F206 S207I176-Y203 WeakPolarHBondContact O-CE2 3.49Å; I176-Y203 PolarHBondContact O-OH 2.69Å; P180-Y203 VanDerWaalsContact CD-CE2 3.48Å; P180-Y203 VanDerWaalsContact CD-CZ 3.4Å; P180-Y203 WeakPolarHBondContact CD-OH 3.27Å; P180-Y203 HydrophobicContact CG-CD1 4.08Å; P180-Y203 HydrophobicContact CG-CD2 4.35Å; P180-Y203 HydrophobicContact CG-CE1 3.5Å; P180-Y203 VanDerWaalsContact CG-CE1 3.5Å; P180-Y203 HydrophobicContact CG-CE2 3.84Å; P180-Y203 HydrophobicContact CG-CG 4.44Å; P180-Y203 WeakPolarHBondContact CG-OH 3.25Å; W184-Y203 HydrophobicContact CD2-CD2 4.15Å; W184-Y203 AromaticContact CE3-CD2 3.93Å; W184-Y203 HydrophobicContact CE3-CD2 3.93Å; W184-Y203 HydrophobicContact CZ3-CD2 4.38Å; T198-Y203 HydrophobicContact CG2-CD1 3.33Å; T198-Y203 HydrophobicContact CG2-CE1 3.58Å; T198-Y203 HydrophobicContact CG2-CG 4.22Å; E200-Y203 PolarHBondContact O-N 2.8Å; E200-Y203 VanDerWaalsContact O-N 3.08Å; Y203-L205 VanDerWaalsContact C-N 3.31Å; Y203-L205 PolarHBondContact O-N 3.28Å; Y203-F206 PolarHBondContact O-N 2.87Å; Y203-S207 VanDerWaalsContact O-CB 3.29Å; Y203-S207 WeakPolarHBondContact O-CB 3.16Å; Y203-S207 PolarHBondContact O-N 3.01Å; Y203-S207 PolarHBondContact O-OG 3.49Å
204A90.4Very high88.9Confident1 Ų141.9 Ų41.91%0.00823%0.234CC..Hα-helixtrans-59.8-41.617700000111.2E200 S207 S208E200-A204 VanDerWaalsContact O-CB 3.28Å; E200-A204 WeakPolarHBondContact O-CB 3.26Å; E200-A204 PolarHBondContact O-N 3.41Å; A204-S207 PolarHBondContact O-OG 3.45Å; A204-S208 WeakPolarHBondContact O-CB 3.39Å; A204-S208 PolarHBondContact O-N 3.29Å; A204-S208 PolarHBondContact O-OG 3Å
205L91.6Very high89.8Confident83 Ų8337.1 Ų37.144%0.43521%0.205SC..Hα-helixtrans-67.7-48173.9-176.161.4000112.2P201 Y203 S208 L209 F321P201-L205 VanDerWaalsContact O-CB 3.26Å; P201-L205 WeakPolarHBondContact O-CB 3.49Å; P201-L205 PolarHBondContact O-N 3.3Å; P201-L205 VanDerWaalsContact O-N 3.09Å; Y203-L205 VanDerWaalsContact C-N 3.31Å; Y203-L205 PolarHBondContact O-N 3.28Å; L205-S208 PolarHBondContact O-OG 2.8Å; L205-S208 VanDerWaalsContact O-OG 3.06Å; L205-L209 VanDerWaalsContact O-CB 3.24Å; L205-L209 WeakPolarHBondContact O-CB 3.23Å; L205-L209 PolarHBondContact O-N 3.45Å; L205-F321 HydrophobicContact CB-CE2 3.99Å; L205-F321 HydrophobicContact CB-CZ 4.07Å; L205-F321 HydrophobicContact CD1-CE2 4.39Å; L205-F321 HydrophobicContact CD2-CE2 4.23Å; L205-F321 HydrophobicContact CD2-CZ 3.92Å; L205-F321 HydrophobicContact CG-CE2 4.43Å; L205-F321 HydrophobicContact CG-CZ 4.5Å
206F92.9Very high90.4Very high68 Ų6837.4 Ų37.430%0.29821%0.206SC..Hα-helixtrans-59.5-51.3-179.7171.9-98000111.8I176 W184 G202 Y203 L209 F210I176-F206 HydrophobicContact CG2-CE1 4.49Å; W184-F206 HydrophobicContact CH2-CB 3.82Å; W184-F206 HydrophobicContact CH2-CD1 4.22Å; W184-F206 HydrophobicContact CH2-CD2 4.41Å; W184-F206 AromaticContact CH2-CG 3.9Å; W184-F206 HydrophobicContact CH2-CG 3.9Å; W184-F206 HydrophobicContact CZ3-CB 4.39Å; W184-F206 AromaticContact CZ3-CD1 3.95Å; W184-F206 HydrophobicContact CZ3-CD1 3.95Å; W184-F206 HydrophobicContact CZ3-CE1 4.42Å; W184-F206 HydrophobicContact CZ3-CG 4.09Å; G202-F206 VanDerWaalsContact O-CB 3.28Å; G202-F206 WeakPolarHBondContact O-CB 3.26Å; G202-F206 PolarHBondContact O-N 2.76Å; Y203-F206 PolarHBondContact O-N 2.87Å; F206-L209 PolarHBondContact O-N 3.42Å; F206-F210 AromaticContact CD2-CD2 3.75Å; F206-F210 HydrophobicContact CD2-CD2 3.75Å; F206-F210 AromaticContact CD2-CE2 3.68Å; F206-F210 HydrophobicContact CD2-CE2 3.68Å; F206-F210 AromaticContact CE2-CD2 3.57Å; F206-F210 HydrophobicContact CE2-CD2 3.57Å; F206-F210 AromaticContact CE2-CE2 3.46Å; F206-F210 HydrophobicContact CE2-CE2 3.46Å; F206-F210 VanDerWaalsContact CE2-CE2 3.46Å; F206-F210 HydrophobicContact CG-CD2 4.4Å; F206-F210 HydrophobicContact CZ-CD2 4.09Å; F206-F210 HydrophobicContact CZ-CE2 4.34Å; F206-F210 WeakPolarHBondContact O-CD2 3.48Å; F206-F210 PolarHBondContact O-N 2.96Å
207S92.3Very high91.1Very high9 Ų940.7 Ų40.76%0.06321%0.211CC..Hα-helixtrans-64.3-45.118060.40000111.8Y203 A204 L209 S211Y203-S207 VanDerWaalsContact O-CB 3.29Å; Y203-S207 WeakPolarHBondContact O-CB 3.16Å; Y203-S207 PolarHBondContact O-N 3.01Å; Y203-S207 PolarHBondContact O-OG 3.49Å; A204-S207 PolarHBondContact O-OG 3.45Å; S207-L209 PolarHBondContact O-N 3.05Å; S207-S211 WeakPolarHBondContact O-CB 3.47Å; S207-S211 PolarHBondContact O-N 3.49Å; S207-S211 PolarHBondContact O-OG 3.39Å; S207-S211 VanDerWaalsContact O-OG 3.14Å
208S93.9Very high91.7Very high0 Ų041.1 Ų41.10%021%0.214CC..Hα-helixtrans-64.1-37.1177.460.30000113.1A204 L205 F212 Y213A204-S208 WeakPolarHBondContact O-CB 3.39Å; A204-S208 PolarHBondContact O-N 3.29Å; A204-S208 PolarHBondContact O-OG 3Å; L205-S208 PolarHBondContact O-OG 2.8Å; L205-S208 VanDerWaalsContact O-OG 3.06Å; S208-F212 WeakPolarHBondContact O-CA 3.38Å; S208-F212 WeakPolarHBondContact O-CB 3.32Å; S208-F212 PolarHBondContact O-N 3.09Å; S208-Y213 WeakPolarHBondContact O-CD2 3.46Å; S208-Y213 PolarHBondContact O-N 3.01Å
209L94.6Very high92.3Very high78 Ų7840.2 Ų40.241%0.40821%0.209SC..Iπ-helixtrans-62.5-51.7178.1-177.165000112.2L205 F206 S207 Y213 L214L205-L209 VanDerWaalsContact O-CB 3.24Å; L205-L209 WeakPolarHBondContact O-CB 3.23Å; L205-L209 PolarHBondContact O-N 3.45Å; F206-L209 PolarHBondContact O-N 3.42Å; S207-L209 PolarHBondContact O-N 3.05Å; L209-Y213 PolarHBondContact O-N 3.39Å; L209-L214 WeakPolarHBondContact O-CB 3.49Å; L209-L214 PolarHBondContact O-N 3.27Å
210F93.9Very high93Very high84 Ų8441.7 Ų41.737%0.36822%0.218SC..Iπ-helixtrans-82.9-32.6-175.2-73.7-74.6000113.5I176 F206 L214 P215I176-F210 HydrophobicContact CD1-CB 3.73Å; I176-F210 HydrophobicContact CG1-CB 4.3Å; F206-F210 AromaticContact CD2-CD2 3.75Å; F206-F210 HydrophobicContact CD2-CD2 3.75Å; F206-F210 AromaticContact CD2-CE2 3.68Å; F206-F210 HydrophobicContact CD2-CE2 3.68Å; F206-F210 AromaticContact CE2-CD2 3.57Å; F206-F210 HydrophobicContact CE2-CD2 3.57Å; F206-F210 AromaticContact CE2-CE2 3.46Å; F206-F210 HydrophobicContact CE2-CE2 3.46Å; F206-F210 VanDerWaalsContact CE2-CE2 3.46Å; F206-F210 HydrophobicContact CG-CD2 4.4Å; F206-F210 HydrophobicContact CZ-CD2 4.09Å; F206-F210 HydrophobicContact CZ-CE2 4.34Å; F206-F210 WeakPolarHBondContact O-CD2 3.48Å; F206-F210 PolarHBondContact O-N 2.96Å; F210-L214 HydrophobicContact CD1-CD1 4.5Å; F210-P215 VanDerWaalsContact O-CD 3.23Å; F210-P215 WeakPolarHBondContact O-CD 3.29Å; F210-P215 WeakPolarHBondContact O-CG 3.4Å
211S93.1Very high93.3Very high2 Ų243.2 Ų43.21%0.01423%0.227CC..Iπ-helixtrans-83.6-28.6180-60.10000113.1T130 I133 I176 S207T130-S211 WeakPolarHBondContact CG2-OG 3.17Å; T130-S211 WeakPolarHBondContact OG1-CB 3.46Å; T130-S211 PolarHBondContact OG1-OG 3.14Å; I133-S211 WeakPolarHBondContact CB-O 3.36Å; I133-S211 VanDerWaalsContact CD1-O 3.26Å; I133-S211 WeakPolarHBondContact CD1-O 3.23Å; I133-S211 WeakPolarHBondContact CG2-O 3.28Å; I176-S211 WeakPolarHBondContact CG2-OG 3.19Å; S207-S211 WeakPolarHBondContact O-CB 3.47Å; S207-S211 PolarHBondContact O-N 3.49Å; S207-S211 PolarHBondContact O-OG 3.39Å; S207-S211 VanDerWaalsContact O-OG 3.14Å
212F94.8Very high93.6Very high0 Ų042.8 Ų42.80%022%0.221CC..Iπ-helixtrans-126.6-60.5-174.5-175.7-103.4000114.5I133 S208 L214 P215 L216 F305 W309 L310 F313I133-F212 HydrophobicContact CD1-CD2 4.34Å; S208-F212 WeakPolarHBondContact O-CA 3.38Å; S208-F212 WeakPolarHBondContact O-CB 3.32Å; S208-F212 PolarHBondContact O-N 3.09Å; F212-L214 PolarHBondContact O-N 3.06Å; F212-P215 WeakPolarHBondContact O-CD 3.49Å; F212-L216 HydrophobicContact CD1-CD2 4.49Å; F212-L216 HydrophobicContact CE1-CD2 3.71Å; F212-L216 HydrophobicContact CZ-CD2 3.81Å; F212-L216 WeakPolarHBondContact O-CB 3.43Å; F212-L216 PolarHBondContact O-N 3.23Å; F212-F305 HydrophobicContact CD2-CE1 4.42Å; F212-F305 HydrophobicContact CD2-CZ 4.04Å; F212-F305 AromaticContact CE2-CE1 3.97Å; F212-F305 HydrophobicContact CE2-CE1 3.97Å; F212-F305 AromaticContact CE2-CZ 3.9Å; F212-F305 HydrophobicContact CE2-CZ 3.9Å; F212-W309 HydrophobicContact CD2-CB 4.19Å; F212-W309 HydrophobicContact CE2-CB 3.62Å; F212-W309 HydrophobicContact CZ-CB 4.42Å; F212-L310 HydrophobicContact CE1-CD1 3.74Å; F212-L310 HydrophobicContact CZ-CB 4.01Å; F212-L310 HydrophobicContact CZ-CD1 3.95Å; F212-F313 HydrophobicContact CB-CB 4.13Å; F212-F313 HydrophobicContact CB-CD1 3.59Å; F212-F313 HydrophobicContact CB-CD2 3.53Å; F212-F313 HydrophobicContact CB-CE1 3.77Å; F212-F313 HydrophobicContact CB-CE2 3.7Å; F212-F313 HydrophobicContact CB-CG 3.46Å; F212-F313 VanDerWaalsContact CB-CG 3.46Å; F212-F313 HydrophobicContact CB-CZ 3.83Å; F212-F313 HydrophobicContact CD1-CB 3.36Å; F212-F313 HydrophobicContact CD1-CD1 4.45Å; F212-F313 AromaticContact CD1-CD2 3.82Å; F212-F313 HydrophobicContact CD1-CD2 3.82Å; F212-F313 AromaticContact CD1-CG 3.64Å; F212-F313 HydrophobicContact CD1-CG 3.64Å; F212-F313 HydrophobicContact CD2-CB 4.39Å; F212-F313 AromaticContact CD2-CD2 3.23Å; F212-F313 HydrophobicContact CD2-CD2 3.23Å; F212-F313 AromaticContact CD2-CE2 3.58Å; F212-F313 HydrophobicContact CD2-CE2 3.58Å; F212-F313 AromaticContact CD2-CG 3.92Å; F212-F313 HydrophobicContact CD2-CG 3.92Å; F212-F313 HydrophobicContact CE1-CB 3.78Å; F212-F313 HydrophobicContact CE1-CD2 4.32Å; F212-F313 HydrophobicContact CE1-CG 4.33Å; F212-F313 AromaticContact CE2-CD2 3.82Å; F212-F313 HydrophobicContact CE2-CD2 3.82Å; F212-F313 HydrophobicContact CE2-CE2 4.4Å; F212-F313 HydrophobicContact CG-CB 3.71Å; F212-F313 HydrophobicContact CG-CD1 4.07Å; F212-F313 AromaticContact CG-CD2 3.23Å; F212-F313 HydrophobicContact CG-CD2 3.23Å; F212-F313 AromaticContact CG-CE2 3.78Å; F212-F313 HydrophobicContact CG-CE2 3.78Å; F212-F313 AromaticContact CG-CG 3.39Å; F212-F313 HydrophobicContact CG-CG 3.39Å; F212-F313 HydrophobicContact CG-CZ 4.4Å; F212-F313 HydrophobicContact CZ-CB 4.45Å; F212-F313 HydrophobicContact CZ-CD2 4.31Å
213Y95.5Very high93.6Very high75 Ų7542.5 Ų42.529%0.29421%0.21SC..Iπ-helixtrans-65.3-46.5-168.6-66.9-61.4000113.6S208 L209 L216 M217 F313S208-Y213 WeakPolarHBondContact O-CD2 3.46Å; S208-Y213 PolarHBondContact O-N 3.01Å; L209-Y213 PolarHBondContact O-N 3.39Å; Y213-L216 PolarHBondContact O-N 3.18Å; Y213-M217 VanDerWaalsContact O-CG 3.31Å; Y213-M217 WeakPolarHBondContact O-CG 3.42Å; Y213-M217 PolarHBondContact O-N 3.17Å; Y213-F313 PolarHBondContact OH-O 3.24Å
214L95.7Very high93.6Very high88 Ų8848.4 Ų48.446%0.46124%0.236SC..Hα-helixtrans-66-49.4177.2-177.8161.3000111.5L209 F210 F212 L216 M217 V218L209-L214 WeakPolarHBondContact O-CB 3.49Å; L209-L214 PolarHBondContact O-N 3.27Å; F210-L214 HydrophobicContact CD1-CD1 4.5Å; F212-L214 PolarHBondContact O-N 3.06Å; L214-L216 VanDerWaalsContact C-N 3.3Å; L214-L216 PolarHBondContact O-N 3.42Å; L214-M217 PolarHBondContact O-N 3.47Å; L214-V218 HydrophobicContact CD2-CG2 4.26Å; L214-V218 WeakPolarHBondContact O-CG2 3.36Å; L214-V218 PolarHBondContact O-N 3.41Å
215P95.8Very high93.6Very high1 Ų151.6 Ų51.61%0.00625%0.25CS..Hα-helixtrans-55.9-41.8172.6-29.637.7000113.4I133 L134 C137 F210 F212 M217 V218 I219I133-P215 HydrophobicContact CG2-CB 3.81Å; I133-P215 HydrophobicContact CG2-CG 4.37Å; L134-P215 HydrophobicContact CD2-CB 4.34Å; L134-P215 HydrophobicContact CD2-CG 3.63Å; C137-P215 HydrophobicContact CB-CB 4.15Å; F210-P215 VanDerWaalsContact O-CD 3.23Å; F210-P215 WeakPolarHBondContact O-CD 3.29Å; F210-P215 WeakPolarHBondContact O-CG 3.4Å; F212-P215 WeakPolarHBondContact O-CD 3.49Å; P215-M217 PolarHBondContact O-N 3.06Å; P215-V218 PolarHBondContact O-N 3.49Å; P215-I219 WeakPolarHBondContact O-CB 3.42Å; P215-I219 WeakPolarHBondContact O-CD1 3.45Å; P215-I219 WeakPolarHBondContact O-CG1 3.18Å; P215-I219 PolarHBondContact O-N 3.49Å
216L95.1Very high93.5Very high17 Ų1748 Ų489%0.08923%0.232CC..Hα-helixtrans-60.5-46.2177.2177.163.2000111.4F212 Y213 L214 V218 I219 L220 I306F212-L216 HydrophobicContact CD1-CD2 4.49Å; F212-L216 HydrophobicContact CE1-CD2 3.71Å; F212-L216 HydrophobicContact CZ-CD2 3.81Å; F212-L216 WeakPolarHBondContact O-CB 3.43Å; F212-L216 PolarHBondContact O-N 3.23Å; Y213-L216 PolarHBondContact O-N 3.18Å; L214-L216 VanDerWaalsContact C-N 3.3Å; L214-L216 PolarHBondContact O-N 3.42Å; L216-V218 VanDerWaalsContact C-N 3.33Å; L216-V218 PolarHBondContact O-N 3.47Å; L216-I219 PolarHBondContact O-N 3.31Å; L216-L220 HydrophobicContact CD1-CD1 4.15Å; L216-L220 HydrophobicContact CD1-CG 4.09Å; L216-L220 HydrophobicContact CG-CD1 4.03Å; L216-L220 HydrophobicContact CG-CG 4.38Å; L216-L220 WeakPolarHBondContact O-CB 3.33Å; L216-L220 VanDerWaalsContact O-CG 3.29Å; L216-L220 WeakPolarHBondContact O-CG 3.45Å; L216-L220 PolarHBondContact O-N 3.39Å; L216-I306 HydrophobicContact CD1-CD1 3.65Å; L216-I306 HydrophobicContact CD1-CG1 3.56Å
217M95.8Very high93.2Very high114 Ų11451 Ų5156%0.56224%0.243SC*.Hα-helixtrans-59.6-44.6176.5-72.9-62.3-73.700111.6Y213 L214 P215 L220 I221Y213-M217 VanDerWaalsContact O-CG 3.31Å; Y213-M217 WeakPolarHBondContact O-CG 3.42Å; Y213-M217 PolarHBondContact O-N 3.17Å; L214-M217 PolarHBondContact O-N 3.47Å; P215-M217 PolarHBondContact O-N 3.06Å; M217-L220 PolarHBondContact O-N 3.41Å; M217-I221 WeakPolarHBondContact O-CB 3.36Å; M217-I221 WeakPolarHBondContact O-CD1 3.29Å; M217-I221 VanDerWaalsContact O-CG1 3.23Å; M217-I221 WeakPolarHBondContact O-CG1 3.46Å; M217-I221 PolarHBondContact O-N 3.47Å
218V96.1Very high93.1Very high39 Ų3952.3 Ų52.324%0.23625%0.248CC..Hα-helixtrans-61.3-47175.8175.50000110.8C137 I141 L214 P215 L216 L220 I221 M222C137-V218 WeakPolarHBondContact SG-CG1 3.18Å; I141-V218 HydrophobicContact CD1-CG1 4.06Å; I141-V218 HydrophobicContact CG1-CG1 4.2Å; L214-V218 HydrophobicContact CD2-CG2 4.26Å; L214-V218 WeakPolarHBondContact O-CG2 3.36Å; L214-V218 PolarHBondContact O-N 3.41Å; P215-V218 PolarHBondContact O-N 3.49Å; L216-V218 VanDerWaalsContact C-N 3.33Å; L216-V218 PolarHBondContact O-N 3.47Å; V218-L220 PolarHBondContact O-N 3.06Å; V218-I221 PolarHBondContact O-N 3.09Å; V218-M222 HydrophobicContact CG1-CG 4.12Å; V218-M222 WeakPolarHBondContact O-CB 3.47Å; V218-M222 VanDerWaalsContact O-CG 3.25Å; V218-M222 WeakPolarHBondContact O-CG 3.26Å; V218-M222 PolarHBondContact O-N 3.28Å
219I93.9Very high92.7Very high0 Ų053.4 Ų53.40%026%0.255CS..Hα-helixtrans-56-54177.3-71.4164.5000110L136 C137 P215 L216 I221 M222 Y223 V302 F305L136-I219 HydrophobicContact CB-CD1 4.31Å; C137-I219 HydrophobicContact CB-CD1 4.19Å; C137-I219 HydrophobicContact CB-CG1 4.05Å; P215-I219 WeakPolarHBondContact O-CB 3.42Å; P215-I219 WeakPolarHBondContact O-CD1 3.45Å; P215-I219 WeakPolarHBondContact O-CG1 3.18Å; P215-I219 PolarHBondContact O-N 3.49Å; L216-I219 PolarHBondContact O-N 3.31Å; I219-I221 VanDerWaalsContact C-N 3.33Å; I219-I221 PolarHBondContact O-N 2.89Å; I219-M222 PolarHBondContact O-N 2.86Å; I219-Y223 HydrophobicContact CG2-CD2 3.75Å; I219-Y223 HydrophobicContact CG2-CE2 3.95Å; I219-Y223 VanDerWaalsContact O-CD2 3.28Å; I219-Y223 WeakPolarHBondContact O-CD2 2.88Å; I219-Y223 PolarHBondContact O-N 3.21Å; I219-V302 HydrophobicContact CG2-CB 4.26Å; I219-V302 HydrophobicContact CG2-CG1 3.38Å; I219-V302 HydrophobicContact CG2-CG2 3.83Å; I219-F305 HydrophobicContact CD1-CE1 4.5Å
220L93.9Very high92Very high81 Ų8150.3 Ų50.342%0.42424%0.24SC..Hα-helixtrans-58.1-45.1-178.4-69.6175000111.8L216 M217 V218 Y223 F224 I306L216-L220 HydrophobicContact CD1-CD1 4.15Å; L216-L220 HydrophobicContact CD1-CG 4.09Å; L216-L220 HydrophobicContact CG-CD1 4.03Å; L216-L220 HydrophobicContact CG-CG 4.38Å; L216-L220 WeakPolarHBondContact O-CB 3.33Å; L216-L220 VanDerWaalsContact O-CG 3.29Å; L216-L220 WeakPolarHBondContact O-CG 3.45Å; L216-L220 PolarHBondContact O-N 3.39Å; M217-L220 PolarHBondContact O-N 3.41Å; V218-L220 PolarHBondContact O-N 3.06Å; L220-Y223 PolarHBondContact O-N 3.49Å; L220-F224 VanDerWaalsContact O-CB 3.27Å; L220-F224 WeakPolarHBondContact O-CB 3.45Å; L220-F224 PolarHBondContact O-N 3.32Å; L220-I306 HydrophobicContact CD2-CD1 3.88Å
221I94.6Very high91.5Very high84 Ų8452.7 Ų52.743%0.43125%0.247SC..Hα-helixtrans-62.2-48.3176.6-67.1166.7000110.5M217 V218 I219 Y223 F224 Q225M217-I221 WeakPolarHBondContact O-CB 3.36Å; M217-I221 WeakPolarHBondContact O-CD1 3.29Å; M217-I221 VanDerWaalsContact O-CG1 3.23Å; M217-I221 WeakPolarHBondContact O-CG1 3.46Å; M217-I221 PolarHBondContact O-N 3.47Å; V218-I221 PolarHBondContact O-N 3.09Å; I219-I221 VanDerWaalsContact C-N 3.33Å; I219-I221 PolarHBondContact O-N 2.89Å; I221-Y223 PolarHBondContact O-N 3.39Å; I221-F224 PolarHBondContact O-N 3.25Å; I221-Q225 HydrophobicContact CG2-CG 4.34Å; I221-Q225 WeakPolarHBondContact O-CB 3.36Å; I221-Q225 WeakPolarHBondContact O-CG 3.07Å; I221-Q225 PolarHBondContact O-N 3.42Å
222M92.8Very high91Very high39 Ų3960.9 Ų60.919%0.19228%0.277CS..Hα-helixtrans-61.8-43.3-179.3-70.8-56.5123.200111.9I141 Y144 V218 I219 Q225 V226I141-M222 HydrophobicContact CG1-CG 3.83Å; I141-M222 HydrophobicContact CG1-SD 4.23Å; Y144-M222 HydrophobicContact CD1-SD 3.94Å; Y144-M222 HydrophobicContact CG-SD 4.01Å; V218-M222 HydrophobicContact CG1-CG 4.12Å; V218-M222 WeakPolarHBondContact O-CB 3.47Å; V218-M222 VanDerWaalsContact O-CG 3.25Å; V218-M222 WeakPolarHBondContact O-CG 3.26Å; V218-M222 PolarHBondContact O-N 3.28Å; I219-M222 PolarHBondContact O-N 2.86Å; M222-Q225 PolarHBondContact O-N 2.88Å; M222-V226 VanDerWaalsContact O-CG2 3.26Å; M222-V226 WeakPolarHBondContact O-CG2 3.13Å; M222-V226 PolarHBondContact O-N 3.25Å
223Y88.1Confident90Very high29 Ų2963 Ų6311%0.11429%0.29CS..Hα-helixtrans-69.6-37.1178.2-86.4-87.6000113I219 L220 I221 Q225 V226 Y227 L298 A299 V302I219-Y223 HydrophobicContact CG2-CD2 3.75Å; I219-Y223 HydrophobicContact CG2-CE2 3.95Å; I219-Y223 VanDerWaalsContact O-CD2 3.28Å; I219-Y223 WeakPolarHBondContact O-CD2 2.88Å; I219-Y223 PolarHBondContact O-N 3.21Å; L220-Y223 PolarHBondContact O-N 3.49Å; I221-Y223 PolarHBondContact O-N 3.39Å; Y223-Q225 VanDerWaalsContact C-N 3.3Å; Y223-Q225 PolarHBondContact O-N 3.27Å; Y223-V226 PolarHBondContact O-N 3.47Å; Y223-Y227 WeakPolarHBondContact O-CB 3.31Å; Y223-Y227 PolarHBondContact O-N 3.48Å; Y223-L298 HydrophobicContact CE1-CB 4.28Å; Y223-L298 VanDerWaalsContact OH-C 3.24Å; Y223-L298 VanDerWaalsContact OH-CB 3.27Å; Y223-L298 WeakPolarHBondContact OH-CB 3.21Å; Y223-L298 PolarHBondContact OH-O 3.42Å; Y223-A299 HydrophobicContact CD1-CB 4.09Å; Y223-A299 HydrophobicContact CE1-CB 4.01Å; Y223-V302 HydrophobicContact CD2-CG1 4.37Å; Y223-V302 HydrophobicContact CD2-CG2 4.19Å; Y223-V302 HydrophobicContact CE1-CG2 4.48Å; Y223-V302 HydrophobicContact CE2-CB 4.1Å; Y223-V302 HydrophobicContact CE2-CG1 4.35Å; Y223-V302 HydrophobicContact CE2-CG2 3.37Å; Y223-V302 VanDerWaalsContact OH-CG2 3.29Å; Y223-V302 WeakPolarHBondContact OH-CG2 3.5Å
224F90.3Very high89Confident124 Ų12460.7 Ų60.754%0.54429%0.285SS..Hα-helixtrans-60.3-44.2171.6-179.1-110.7000111L220 I221 Y227 I228L220-F224 VanDerWaalsContact O-CB 3.27Å; L220-F224 WeakPolarHBondContact O-CB 3.45Å; L220-F224 PolarHBondContact O-N 3.32Å; I221-F224 PolarHBondContact O-N 3.25Å; F224-Y227 WeakPolarHBondContact O-CB 3.28Å; F224-Y227 PolarHBondContact O-N 3.25Å; F224-I228 HydrophobicContact CD1-CD1 3.82Å; F224-I228 HydrophobicContact CE1-CD1 3.31Å; F224-I228 HydrophobicContact CE1-CG1 4.33Å; F224-I228 HydrophobicContact CE2-CD1 4.25Å; F224-I228 HydrophobicContact CG-CD1 4.49Å; F224-I228 HydrophobicContact CZ-CD1 3.56Å; F224-I228 HydrophobicContact CZ-CG1 4.29Å; F224-I228 WeakPolarHBondContact O-CG1 3.38Å; F224-I228 PolarHBondContact O-N 3.14Å
225Q91.3Very high88.2Confident68 Ų6862.3 Ų62.332%0.31829%0.288SS..Hα-helixtrans-64.7-41.3175.5-66.7-72.53.600112.2Y144 I221 M222 Y223 Y227 I228 V229Y144-Q225 HydrophobicContact CD2-CB 3.77Å; Y144-Q225 HydrophobicContact CE2-CB 3.55Å; Y144-Q225 HydrophobicContact CE2-CG 4.45Å; I221-Q225 HydrophobicContact CG2-CG 4.34Å; I221-Q225 WeakPolarHBondContact O-CB 3.36Å; I221-Q225 WeakPolarHBondContact O-CG 3.07Å; I221-Q225 PolarHBondContact O-N 3.42Å; M222-Q225 PolarHBondContact O-N 2.88Å; Y223-Q225 VanDerWaalsContact C-N 3.3Å; Y223-Q225 PolarHBondContact O-N 3.27Å; Q225-Y227 VanDerWaalsContact C-N 3.33Å; Q225-Y227 PolarHBondContact O-N 3.08Å; Q225-I228 PolarHBondContact O-N 2.82Å; Q225-V229 WeakPolarHBondContact O-CB 3.22Å; Q225-V229 VanDerWaalsContact O-CG2 3.28Å; Q225-V229 WeakPolarHBondContact O-CG2 3.13Å; Q225-V229 PolarHBondContact O-N 2.85Å
226V88.8Confident87.1Confident9 Ų964.3 Ų64.36%0.05530%0.302CS..Hα-helixtrans-57.6-46.3172.71680000110.7Y144 V147 M222 Y223 V229 A230 A295Y144-V226 HydrophobicContact CD2-CG2 4.22Å; V147-V226 HydrophobicContact CG2-CG1 4.27Å; M222-V226 VanDerWaalsContact O-CG2 3.26Å; M222-V226 WeakPolarHBondContact O-CG2 3.13Å; M222-V226 PolarHBondContact O-N 3.25Å; Y223-V226 PolarHBondContact O-N 3.47Å; V226-V229 PolarHBondContact O-N 3.24Å; V226-A230 WeakPolarHBondContact O-CB 3.32Å; V226-A230 PolarHBondContact O-N 2.98Å; V226-A295 HydrophobicContact CG1-CB 3.85Å
227Y87.6Confident85.8Confident131 Ų13166.7 Ų66.751%0.51431%0.314SS..Hα-helixtrans-60.7-47.5177.7172-97.4000111.6Y223 F224 Q225 A230 R231Y223-Y227 WeakPolarHBondContact O-CB 3.31Å; Y223-Y227 PolarHBondContact O-N 3.48Å; F224-Y227 WeakPolarHBondContact O-CB 3.28Å; F224-Y227 PolarHBondContact O-N 3.25Å; Q225-Y227 VanDerWaalsContact C-N 3.33Å; Q225-Y227 PolarHBondContact O-N 3.08Å; Y227-A230 PolarHBondContact O-N 3.22Å; Y227-R231 WeakPolarHBondContact O-CB 3.26Å; Y227-R231 PolarHBondContact O-N 2.97Å
228I88.7Confident84.6Confident35 Ų3568.6 Ų68.618%0.17932%0.322CS..Hα-helixtrans-59.1-51.2177.4-73177.2000110.7F224 Q225 A230 R231 R232F224-I228 HydrophobicContact CD1-CD1 3.82Å; F224-I228 HydrophobicContact CE1-CD1 3.31Å; F224-I228 HydrophobicContact CE1-CG1 4.33Å; F224-I228 HydrophobicContact CE2-CD1 4.25Å; F224-I228 HydrophobicContact CG-CD1 4.49Å; F224-I228 HydrophobicContact CZ-CD1 3.56Å; F224-I228 HydrophobicContact CZ-CG1 4.29Å; F224-I228 WeakPolarHBondContact O-CG1 3.38Å; F224-I228 PolarHBondContact O-N 3.14Å; Q225-I228 PolarHBondContact O-N 2.82Å; I228-A230 VanDerWaalsContact C-N 3.34Å; I228-A230 PolarHBondContact O-N 3.38Å; I228-R231 PolarHBondContact O-N 2.64Å; I228-R232 HydrophobicContact CG2-CG 4.24Å; I228-R232 VanDerWaalsContact CG2-CZ 3.43Å; I228-R232 VanDerWaalsContact CG2-NE 3.35Å; I228-R232 WeakPolarHBondContact O-CB 3.35Å; I228-R232 WeakPolarHBondContact O-CG 3.47Å; I228-R232 PolarHBondContact O-N 2.98Å
229V85.7Confident83.1Confident23 Ų2370 Ų7014%0.13934%0.338CS..Hα-helixtrans-61.5-45.3-179.2172.60000110.2Y144 V147 K148 Q225 V226 R231 R232 T233Y144-V229 HydrophobicContact CE2-CG2 4.42Å; V147-V229 HydrophobicContact CG1-CG1 4.02Å; K148-V229 HydrophobicContact CB-CG1 4.4Å; Q225-V229 WeakPolarHBondContact O-CB 3.22Å; Q225-V229 VanDerWaalsContact O-CG2 3.28Å; Q225-V229 WeakPolarHBondContact O-CG2 3.13Å; Q225-V229 PolarHBondContact O-N 2.85Å; V226-V229 PolarHBondContact O-N 3.24Å; V229-R231 VanDerWaalsContact C-N 3.33Å; V229-R231 PolarHBondContact O-N 3.11Å; V229-R232 PolarHBondContact O-N 3.42Å; V229-T233 PolarHBondContact O-N 3.35Å; V229-T233 PolarHBondContact O-OG1 3.05Å
230A81.1Confident81.4Confident13 Ų1370.8 Ų70.811%0.10735%0.345CS..Hα-helixtrans-60.3-42.4178.100000112.2V226 Y227 I228 T234V226-A230 WeakPolarHBondContact O-CB 3.32Å; V226-A230 PolarHBondContact O-N 2.98Å; Y227-A230 PolarHBondContact O-N 3.22Å; I228-A230 VanDerWaalsContact C-N 3.34Å; I228-A230 PolarHBondContact O-N 3.38Å; A230-T234 WeakPolarHBondContact O-CB 3.42Å; A230-T234 PolarHBondContact O-N 2.96Å; A230-T234 PolarHBondContact O-OG1 3.31Å
231R83.5Confident79.4Confident134 Ų13468.9 Ų68.951%0.50634%0.337SS..Hα-helixtrans-69.9-42.9178.9-165.8177.9-174.3-168.7-0111.9Y227 I228 V229 T234 K235Y227-R231 WeakPolarHBondContact O-CB 3.26Å; Y227-R231 PolarHBondContact O-N 2.97Å; I228-R231 PolarHBondContact O-N 2.64Å; V229-R231 VanDerWaalsContact C-N 3.33Å; V229-R231 PolarHBondContact O-N 3.11Å; R231-T234 PolarHBondContact O-N 2.82Å; R231-K235 WeakPolarHBondContact O-CG 3.41Å; R231-K235 PolarHBondContact O-N 3.49Å
232R82.3Confident77.2Confident174 Ų17472.7 Ų72.766%0.65735%0.35SS*.Hα-helixtrans-60.7-47176.5-76.3-179.7-176.4169.44.4111.4I228 V229 K235 S236I228-R232 HydrophobicContact CG2-CG 4.24Å; I228-R232 VanDerWaalsContact CG2-CZ 3.43Å; I228-R232 VanDerWaalsContact CG2-NE 3.35Å; I228-R232 WeakPolarHBondContact O-CB 3.35Å; I228-R232 WeakPolarHBondContact O-CG 3.47Å; I228-R232 PolarHBondContact O-N 2.98Å; V229-R232 PolarHBondContact O-N 3.42Å; R232-K235 PolarHBondContact O-N 3.09Å; R232-S236 WeakPolarHBondContact O-CB 3.45Å; R232-S236 PolarHBondContact O-N 3.26Å
233T72.7Confident74.8Confident44 Ų4480.1 Ų80.127%0.2738%0.376SS..Hα-helixtrans-66.7-39.3178.3-51.50000111.6V229 S236 L237 F288V229-T233 PolarHBondContact O-N 3.35Å; V229-T233 PolarHBondContact O-OG1 3.05Å; T233-S236 PolarHBondContact O-N 3.49Å; T233-L237 HydrophobicContact CG2-CD1 4.08Å; T233-L237 HydrophobicContact CG2-CG 4.43Å; T233-L237 WeakPolarHBondContact O-CB 3.44Å; T233-L237 WeakPolarHBondContact O-CG 3.04Å; T233-L237 PolarHBondContact O-N 3.35Å; T233-F288 HydrophobicContact CG2-CD1 3.85Å; T233-F288 HydrophobicContact CG2-CD2 4.06Å; T233-F288 HydrophobicContact CG2-CE1 3.42Å; T233-F288 VanDerWaalsContact CG2-CE1 3.42Å; T233-F288 HydrophobicContact CG2-CE2 3.66Å; T233-F288 HydrophobicContact CG2-CG 4.17Å; T233-F288 HydrophobicContact CG2-CZ 3.33Å
234T76.1Confident72.5Confident28 Ų2887.3 Ų87.317%0.17241%0.411CS..Hα-helixtrans-61.2-46.7175.3-53.30000111A230 R231 S236 L237 E238 K292A230-T234 WeakPolarHBondContact O-CB 3.42Å; A230-T234 PolarHBondContact O-N 2.96Å; A230-T234 PolarHBondContact O-OG1 3.31Å; R231-T234 PolarHBondContact O-N 2.82Å; T234-S236 PolarHBondContact O-N 3.05Å; T234-L237 PolarHBondContact O-N 2.89Å; T234-E238 WeakPolarHBondContact CG2-OE1 3Å; T234-E238 WeakPolarHBondContact O-CG 3.36Å; T234-E238 PolarHBondContact O-N 2.92Å; T234-K292 PolarHBondContact OG1-NZ 2.93Å
235K78.9Confident70.1Confident122 Ų12292.7 Ų92.753%0.5343%0.428SS..Hα-helixtrans-63.4-40.2176.5-76.1-171174-167.20113.2R231 R232 L237 E238 A239R231-K235 WeakPolarHBondContact O-CG 3.41Å; R231-K235 PolarHBondContact O-N 3.49Å; R232-K235 PolarHBondContact O-N 3.09Å; K235-L237 VanDerWaalsContact C-N 3.31Å; K235-L237 PolarHBondContact O-N 3.34Å; K235-E238 PolarHBondContact O-N 3.42Å; K235-A239 WeakPolarHBondContact O-CB 3.22Å; K235-A239 PolarHBondContact O-N 3.11Å
236S72Confident67.7Low42 Ų4296.8 Ų96.829%0.29445%0.452SS..Hα-helixtrans-66.4-34.2177.6174.60000112.2R232 T233 T234 G240 V241R232-S236 WeakPolarHBondContact O-CB 3.45Å; R232-S236 PolarHBondContact O-N 3.26Å; T233-S236 PolarHBondContact O-N 3.49Å; T234-S236 PolarHBondContact O-N 3.05Å; S236-G240 PolarHBondContact O-N 2.66Å; S236-G240 VanDerWaalsContact O-N 3.08Å; S236-V241 PolarHBondContact O-N 2.92Å; S236-V241 PolarHBondContact OG-O 3.43Å
237L68.3Low65.3Low67 Ų67105.8 Ų105.835%0.35149%0.49SS..Hα-helixtrans-72.1-41.9174.3-70.5171.2000112.3T233 T234 K235 A239 G240 L285 F288T233-L237 HydrophobicContact CG2-CD1 4.08Å; T233-L237 HydrophobicContact CG2-CG 4.43Å; T233-L237 WeakPolarHBondContact O-CB 3.44Å; T233-L237 WeakPolarHBondContact O-CG 3.04Å; T233-L237 PolarHBondContact O-N 3.35Å; T234-L237 PolarHBondContact O-N 2.89Å; K235-L237 VanDerWaalsContact C-N 3.31Å; K235-L237 PolarHBondContact O-N 3.34Å; L237-A239 VanDerWaalsContact C-N 3.33Å; L237-G240 PolarHBondContact O-N 3.36Å; L237-L285 HydrophobicContact CD1-CD2 3.41Å; L237-L285 VanDerWaalsContact CD1-CD2 3.41Å; L237-L285 HydrophobicContact CD2-CD1 4.32Å; L237-L285 HydrophobicContact CD2-CD2 3.56Å; L237-L285 HydrophobicContact CD2-CG 4.08Å; L237-L285 HydrophobicContact CG-CD2 4.04Å; L237-F288 HydrophobicContact CD1-CD1 4.3Å
238E69.3Low62.9Low155 Ų155106.4 Ų106.472%0.72451%0.514SS*.Hα-helixtrans-65.6-36174.2-73.7170.3-179.200112T234 K235 G240T234-E238 WeakPolarHBondContact CG2-OE1 3Å; T234-E238 WeakPolarHBondContact O-CG 3.36Å; T234-E238 PolarHBondContact O-N 2.92Å; K235-E238 PolarHBondContact O-N 3.42Å; E238-G240 VanDerWaalsContact C-N 3.29Å
239A66.3Low60.3Low69 Ų69108.2 Ų108.257%0.5753%0.533SS*.THydrogen-bonded Turntrans-75.8-15.717500000113.1K235 L237 V241K235-A239 WeakPolarHBondContact O-CB 3.22Å; K235-A239 PolarHBondContact O-N 3.11Å; L237-A239 VanDerWaalsContact C-N 3.33Å; A239-V241 WeakPolarHBondContact O-CG2 3.17Å; A239-V241 PolarHBondContact O-N 3.13Å
240G57.5Low57.7Low15 Ų15113.3 Ų113.316%0.15556%0.556CS.*THydrogen-bonded Turntrans63.520.3-177.900000114.4S236 L237 E238S236-G240 PolarHBondContact O-N 2.66Å; S236-G240 VanDerWaalsContact O-N 3.08Å; L237-G240 PolarHBondContact O-N 3.36Å; E238-G240 VanDerWaalsContact C-N 3.29Å
241V50.9Low55.5Low42 Ų42117.7 Ų117.726%0.25558%0.581SS.*  trans-129.2118-176.3-172.20000109.9S236 A239 V252S236-V241 PolarHBondContact O-N 2.92Å; S236-V241 PolarHBondContact OG-O 3.43Å; A239-V241 WeakPolarHBondContact O-CG2 3.17Å; A239-V241 PolarHBondContact O-N 3.13Å; V241-V252 HydrophobicContact CG1-CG1 4.21Å; V241-V252 HydrophobicContact CG1-CG2 4.37Å; V241-V252 HydrophobicContact CG2-CG1 3.64Å
242K48.3Very low53.3Low163 Ų163115 Ų11571%0.70958%0.579SS**  trans-96100.9167.4-144.5-172.8-177.5-159.50107E244K242-E244 PolarHBondContact O-N 2.99Å
243R43.4Very low51.4Low196 Ų196112.2 Ų112.274%0.7458%0.577SS**  trans-80105.2179.7-149.8178.9-161.6-166.22.6108.5E250R243-E250 IonicContact CZ-OE1 3.93Å; R243-E250 IonicContact NE-OE1 3.92Å; R243-E250 PolarHBondContact NE-OE1 2.79Å; R243-E250 VanDerWaalsContact NE-OE1 3.07Å; R243-E250 IonicContact NH2-OE1 3.07Å; R243-E250 PolarHBondContact NH2-OE1 3.5Å; R243-E250 IonicContact NH2-OE2 2.78Å
244E39.1Very low49.8Very low180 Ų180119.6 Ų119.684%0.84160%0.599SS**  trans-89.7121.7172.3-159.5163.8-133.700108.8K242 N246K242-E244 PolarHBondContact O-N 2.99Å; E244-N246 PolarHBondContact O-N 2.87Å
245R40.8Very low48.6Very low237 Ų237121.7 Ų121.789%0.89461%0.609SS**  trans-9685.9179.7179.5176159.1158.9-4.6107.6
246N41.1Very low46.6Very low154 Ų154123.5 Ų123.582%0.82462%0.619SS**SBendtrans-158.6120.7152.6-96.5-17.7000110.5E244E244-N246 PolarHBondContact O-N 2.87Å
247K38.9Very low45.2Very low198 Ų198127.2 Ų127.286%0.86164%0.644SS**SBendtrans59.795.8174.7-62.5-176.4178.3179.10116.8A249K247-A249 VanDerWaalsContact C-N 3.3Å; K247-A249 PolarHBondContact O-N 3.36Å
248S35.3Very low43.8Very low144 Ų144133.2 Ų133.2100%1.00766%0.662SS**SBendtrans42.719.1147-49.60000122.3
249A34.6Very low42.1Very low72 Ų72130.4 Ų130.460%0.59566%0.659SS**  trans-133.4109.3166.900000110.5K247 V251K247-A249 VanDerWaalsContact C-N 3.3Å; K247-A249 PolarHBondContact O-N 3.36Å; A249-V251 VanDerWaalsContact C-N 3.33Å; A249-V251 HydrophobicContact CB-CG2 4.32Å; A249-V251 PolarHBondContact O-N 2.72Å
250E31.5Very low40.7Very low131 Ų131134.3 Ų134.361%0.61268%0.675SS**  trans-74.186.4172-178160.6-137.400109.3R243 V252R243-E250 IonicContact CZ-OE1 3.93Å; R243-E250 IonicContact NE-OE1 3.92Å; R243-E250 PolarHBondContact NE-OE1 2.79Å; R243-E250 VanDerWaalsContact NE-OE1 3.07Å; R243-E250 IonicContact NH2-OE1 3.07Å; R243-E250 PolarHBondContact NH2-OE1 3.5Å; R243-E250 IonicContact NH2-OE2 2.78Å; E250-V252 HydrophobicContact CG-CG2 4.13Å; E250-V252 PolarHBondContact O-N 3.45Å
251V35.9Very low39.9Very low105 Ų105140.5 Ų140.564%0.63670%0.704SS**  trans-84.997.8174.4-174.90000108.9A249 L253A249-V251 VanDerWaalsContact C-N 3.33Å; A249-V251 HydrophobicContact CB-CG2 4.32Å; A249-V251 PolarHBondContact O-N 2.72Å; V251-L253 PolarHBondContact O-N 2.93Å; V251-L253 VanDerWaalsContact O-N 3.15Å
252V36.8Very low39.3Very low77 Ų77146.3 Ų146.347%0.46773%0.729SS.*  trans-75.396.6171.7177.20000109V241 E250 R254V241-V252 HydrophobicContact CG1-CG1 4.21Å; V241-V252 HydrophobicContact CG1-CG2 4.37Å; V241-V252 HydrophobicContact CG2-CG1 3.64Å; E250-V252 HydrophobicContact CG-CG2 4.13Å; E250-V252 PolarHBondContact O-N 3.45Å; V252-R254 PolarHBondContact O-N 3.26Å
253L40.9Very low38.6Very low115 Ų115145.6 Ų145.660%0.60273%0.732SS**  trans-80.584.8178.8-148.5139.2000110V251 I255V251-L253 PolarHBondContact O-N 2.93Å; V251-L253 VanDerWaalsContact O-N 3.15Å; L253-I255 PolarHBondContact O-N 3.17Å
254R40.5Very low38.4Very low199 Ų199140.7 Ų140.775%0.75173%0.734SS**  trans-58.7110.5175.4-100.1-174.7-161.8135.15.7110.1V252 H256V252-R254 PolarHBondContact O-N 3.26Å; R254-H256 PolarHBondContact O-N 3.29Å
255I49.4Very low38.4Very low73 Ų73143.2 Ų143.237%0.37474%0.736SS.*  trans-7787.8174.5-53.5173.7000108.4L253 C257 L281L253-I255 PolarHBondContact O-N 3.17Å; I255-C257 PolarHBondContact O-N 3.39Å; I255-L281 HydrophobicContact CG2-CD2 4.35Å
256H38.5Very low38.3Very low159 Ų159138.1 Ų138.174%0.73674%0.736SS**  trans-81.3102.3166.3-90.6-83.9000109.7R254 R258R254-H256 PolarHBondContact O-N 3.29Å; H256-R258 VanDerWaalsContact C-N 3.25Å; H256-R258 PolarHBondContact O-N 3.41Å
257C42.6Very low38Very low120 Ų120135.9 Ų135.981%0.81174%0.74SS**  trans-74.879.4160-78.70000108.8I255 S259I255-C257 PolarHBondContact O-N 3.39Å; C257-S259 PolarHBondContact O-N 3.48Å
258R38.6Very low37.7Very low194 Ų194132 Ų13273%0.73274%0.737SS**  trans-69.8116.1168.1-170.6170.1177178.5-7.3107.6H256 V260H256-R258 VanDerWaalsContact C-N 3.25Å; H256-R258 PolarHBondContact O-N 3.41Å; R258-V260 PolarHBondContact O-N 2.61Å
259S33.2Very low37.7Very low96 Ų96129.9 Ų129.967%0.67172%0.723SS**  trans-59.3133171.456.30000108.9C257 L261C257-S259 PolarHBondContact O-N 3.48Å; S259-L261 PolarHBondContact O-N 3.35Å
260V37.9Very low37.7Very low150 Ų150135.9 Ų135.991%0.90974%0.735SS**SBendtrans-71.687.4169.11800000107.5R258R258-V260 PolarHBondContact O-N 2.61Å
261L39.3Very low38.1Very low145 Ų145137.8 Ų137.876%0.75975%0.75SS**  trans-146.2128.3152.9-15874.7000105.5S259S259-L261 PolarHBondContact O-N 3.35Å
262E38.5Very low38Very low165 Ų165137.2 Ų137.277%0.77175%0.751SS**  trans8084.6-171.1-54-170.4135.900115.2
263D34.8Very low38.1Very low147 Ų147143 Ų14379%0.78677%0.769SS**  -161.174.3129.5-89.1-28.8000107.9
264A37.7Very low37.9Very low94 Ų94143.3 Ų143.378%0.77778%0.776SS**  trans-119.461.9163.700000108.1
265R39.4Very low38.1Very low232 Ų232141.4 Ų141.488%0.87578%0.776SS**SBendtrans-161.2127160.3-102150.5-166.3-163.64.3108.4
266S38.5Very low38.1Very low130 Ų130142.4 Ų142.491%0.90979%0.787SS**  trans77.388178.166.30000117.6
267A35.4Very low38.4Very low108 Ų108142 Ų14289%0.89378%0.783SS**  trans-121.496154.600000109
268S31.7Very low38.5Very low116 Ų116147.2 Ų147.281%0.81179%0.786SS**  trans-101.7120.5152.4178.30000107.4
269S36.7Very low39.2Very low100 Ų100141.5 Ų141.570%0.69978%0.776SS**  trans42.7106.6152.7-160.70000118.8
270K34.6Very low40.4Very low197 Ų197139 Ų13986%0.85776%0.758SS**  178.8135.7114.2-94.4165.1-174.3179.70111.9S272K270-S272 PolarHBondContact O-N 3.19Å
271N39Very low41.3Very low171 Ų171135 Ų13591%0.91473%0.731SS**  trans-52.2119.1171.8-90.8-27000112.5
272S33.7Very low42.2Very low94 Ų94131 Ų13166%0.65772%0.716SS**  trans-144113.1150.362.90000109.9K270 T274K270-S272 PolarHBondContact O-N 3.19Å; S272-T274 PolarHBondContact O-N 3.03Å; S272-T274 PolarHBondContact O-OG1 2.55Å
273K39.1Very low43.4Very low197 Ų197126.9 Ų126.986%0.85770%0.702SS**  trans-67.792.3172.8-67.6179-179.6176.50108.2
274T36.2Very low44.8Very low123 Ų123124.7 Ų124.776%0.75568%0.682SS**  trans-104.1104.9175.1-29.70000108.6S272S272-T274 PolarHBondContact O-N 3.03Å; S272-T274 PolarHBondContact O-OG1 2.55Å
275H45.3Very low46.2Very low159 Ų159123.3 Ų123.374%0.73666%0.662SS**  trans-71.1166.7-174.5-93-82.4000114.1F277H275-F277 PolarHBondContact O-N 3.22Å
276P49.1Very low47.4Very low93 Ų93119 Ų11960%0.60465%0.653SS**  trans-87.149.9-149.937.8-37.6000114.5R278 S279P276-R278 PolarHBondContact O-N 3.11Å; P276-S279 PolarHBondContact O-N 3.48Å; P276-S279 PolarHBondContact O-OG 3.36Å
277F44.5Very low48.7Very low150 Ų150117 Ų11766%0.65863%0.628SS**Hα-helixtrans-63.4-27.1-175.5-166.7-102.3000113.9H275 S279 S280H275-F277 PolarHBondContact O-N 3.22Å; F277-S279 PolarHBondContact O-N 3Å; F277-S280 PolarHBondContact O-N 3.24Å
278R45.7Very low50.1Low230 Ų230112.6 Ų112.687%0.86859%0.589SS**Hα-helixtrans-69.4-24.4-176.5-68.9-174.9177.1169.80.9114.5P276 S282P276-R278 PolarHBondContact O-N 3.11Å; R278-S282 PolarHBondContact O-OG 3.41Å
279S53.9Low51.8Low75 Ų75110.8 Ų110.852%0.52458%0.576SS.*Hα-helixtrans-78.7-34.5176.968.10000112P276 F277 V283P276-S279 PolarHBondContact O-N 3.48Å; P276-S279 PolarHBondContact O-OG 3.36Å; F277-S279 PolarHBondContact O-N 3Å; S279-V283 WeakPolarHBondContact O-CG2 2.99Å; S279-V283 PolarHBondContact O-N 2.96Å; S279-V283 VanDerWaalsContact O-N 3.11Å
280S57.7Low53.3Low44 Ų44112.9 Ų112.931%0.30857%0.569SS.*Hα-helixtrans-64.8-42.8-175.8-175.10000112.9F277 V283 R284F277-S280 PolarHBondContact O-N 3.24Å; S280-V283 PolarHBondContact O-N 3.47Å; S280-R284 WeakPolarHBondContact O-CG 3.29Å; S280-R284 PolarHBondContact O-N 2.99Å; S280-R284 PolarHBondContact OG-NE 3.33Å
281L57.3Low55Low64 Ų64105.3 Ų105.334%0.33554%0.536SS..Hα-helixtrans-67.7-44-179.8-166.4103.4000112.5I255 V283 R284 L285I255-L281 HydrophobicContact CG2-CD2 4.35Å; L281-V283 VanDerWaalsContact C-N 3.29Å; L281-V283 PolarHBondContact O-N 2.94Å; L281-R284 WeakPolarHBondContact O-CB 3.31Å; L281-R284 PolarHBondContact O-N 3.24Å; L281-R284 VanDerWaalsContact O-N 3.12Å; L281-L285 HydrophobicContact CD2-CD1 4.09Å; L281-L285 HydrophobicContact CG-CD1 4.47Å; L281-L285 PolarHBondContact O-N 3.49Å
282S58.6Low56.4Low62 Ų62101.3 Ų101.343%0.43451%0.511SS..Hα-helixtrans-61.1-39.6176.5-60.10000111.4R278 L285 M286R278-S282 PolarHBondContact O-OG 3.41Å; S282-L285 PolarHBondContact O-N 2.93Å; S282-M286 WeakPolarHBondContact O-CG 3.23Å; S282-M286 PolarHBondContact O-N 3.49Å
283V62.9Low58.2Low79 Ų79101.9 Ų101.948%0.47950%0.501SS..Hα-helixtrans-64.7-40.5173.3171.60000111.8S279 S280 L281 M286 K287S279-V283 WeakPolarHBondContact O-CG2 2.99Å; S279-V283 PolarHBondContact O-N 2.96Å; S279-V283 VanDerWaalsContact O-N 3.11Å; S280-V283 PolarHBondContact O-N 3.47Å; L281-V283 VanDerWaalsContact C-N 3.29Å; L281-V283 PolarHBondContact O-N 2.94Å; V283-M286 PolarHBondContact O-N 3.22Å; V283-K287 WeakPolarHBondContact O-CG 3.48Å; V283-K287 PolarHBondContact O-N 3.18Å
284R64.4Low59.6Low100 Ų10094 Ų9438%0.37747%0.473SS..Hα-helixtrans-62.4-43.8175.6-68.8168.8-176.8-174.4-0.8111.9L151 S280 L281 K287 F288L151-R284 HydrophobicContact CD1-CG 3.81Å; L151-R284 HydrophobicContact CD2-CG 3.78Å; L151-R284 HydrophobicContact CG-CG 4.35Å; S280-R284 WeakPolarHBondContact O-CG 3.29Å; S280-R284 PolarHBondContact O-N 2.99Å; S280-R284 PolarHBondContact OG-NE 3.33Å; L281-R284 WeakPolarHBondContact O-CB 3.31Å; L281-R284 PolarHBondContact O-N 3.24Å; L281-R284 VanDerWaalsContact O-N 3.12Å; R284-K287 PolarHBondContact O-N 3.31Å; R284-F288 WeakPolarHBondContact O-CB 3.18Å; R284-F288 PolarHBondContact O-N 3.28Å
285L65.9Low61.4Low66 Ų6688.6 Ų88.635%0.34644%0.441SS..Hα-helixtrans-63-44.9176.8-99.3156.2000112.6L237 L281 S282 F288 S289L237-L285 HydrophobicContact CD1-CD2 3.41Å; L237-L285 VanDerWaalsContact CD1-CD2 3.41Å; L237-L285 HydrophobicContact CD2-CD1 4.32Å; L237-L285 HydrophobicContact CD2-CD2 3.56Å; L237-L285 HydrophobicContact CD2-CG 4.08Å; L237-L285 HydrophobicContact CG-CD2 4.04Å; L281-L285 HydrophobicContact CD2-CD1 4.09Å; L281-L285 HydrophobicContact CG-CD1 4.47Å; L281-L285 PolarHBondContact O-N 3.49Å; S282-L285 PolarHBondContact O-N 2.93Å; L285-F288 PolarHBondContact O-N 3.29Å; L285-S289 WeakPolarHBondContact O-CB 3.31Å; L285-S289 PolarHBondContact O-N 3.38Å
286M64.9Low62.9Low141 Ų14188.4 Ų88.470%0.69544%0.438SS*.Hα-helixtrans-65.2-42175.9-70.5-145.8-136.300112.5S282 V283 S289 R290S282-M286 WeakPolarHBondContact O-CG 3.23Å; S282-M286 PolarHBondContact O-N 3.49Å; V283-M286 PolarHBondContact O-N 3.22Å; M286-S289 PolarHBondContact O-N 2.97Å; M286-R290 PolarHBondContact O-N 2.91Å; M286-R290 VanDerWaalsContact O-N 3.09Å
287K65.8Low64.2Low87 Ų8784.8 Ų84.838%0.37841%0.414SS..Hα-helixtrans-59.4-47.8174.1-79.3-175.3177.4179.60110.8V283 R284 S289 R290 E291V283-K287 WeakPolarHBondContact O-CG 3.48Å; V283-K287 PolarHBondContact O-N 3.18Å; R284-K287 PolarHBondContact O-N 3.31Å; K287-S289 PolarHBondContact O-N 3.48Å; K287-R290 PolarHBondContact O-N 3.23Å; K287-E291 WeakPolarHBondContact O-CG 3.43Å; K287-E291 PolarHBondContact O-N 3Å
288F65.8Low65.8Low17 Ų1778.1 Ų78.18%0.07539%0.385CS..Hα-helixtrans-61.3-43.4178.3-178.6-98.9000113.1V147 T233 L237 R284 L285 R290 E291 K292V147-F288 HydrophobicContact CG1-CE2 4.31Å; T233-F288 HydrophobicContact CG2-CD1 3.85Å; T233-F288 HydrophobicContact CG2-CD2 4.06Å; T233-F288 HydrophobicContact CG2-CE1 3.42Å; T233-F288 VanDerWaalsContact CG2-CE1 3.42Å; T233-F288 HydrophobicContact CG2-CE2 3.66Å; T233-F288 HydrophobicContact CG2-CG 4.17Å; T233-F288 HydrophobicContact CG2-CZ 3.33Å; L237-F288 HydrophobicContact CD1-CD1 4.3Å; R284-F288 WeakPolarHBondContact O-CB 3.18Å; R284-F288 PolarHBondContact O-N 3.28Å; L285-F288 PolarHBondContact O-N 3.29Å; F288-R290 VanDerWaalsContact C-N 3.32Å; F288-R290 PolarHBondContact O-N 3.09Å; F288-E291 PolarHBondContact O-N 3.12Å; F288-K292 PolarHBondContact O-N 3.49Å
289S67.9Low67.5Low78 Ų7869.3 Ų69.355%0.54536%0.362SS..Hα-helixtrans-60.6-40.2176.7-177.30000112.3L285 M286 K287 K292 K293L285-S289 WeakPolarHBondContact O-CB 3.31Å; L285-S289 PolarHBondContact O-N 3.38Å; M286-S289 PolarHBondContact O-N 2.97Å; K287-S289 PolarHBondContact O-N 3.48Å; S289-K292 PolarHBondContact O-N 2.79Å; S289-K293 PolarHBondContact O-N 3.45Å; S289-K293 VanDerWaalsContact O-N 3.12Å
290R66.9Low69Low143 Ų14369.7 Ų69.754%0.5436%0.357SS..Hα-helixtrans-65.5-44.3175.3-172.8174.463.1-143.31.6112.1M286 K287 F288 K292 K293 A294M286-R290 PolarHBondContact O-N 2.91Å; M286-R290 VanDerWaalsContact O-N 3.09Å; K287-R290 PolarHBondContact O-N 3.23Å; F288-R290 VanDerWaalsContact C-N 3.32Å; F288-R290 PolarHBondContact O-N 3.09Å; R290-K292 VanDerWaalsContact C-N 3.33Å; R290-K292 PolarHBondContact O-N 3.15Å; R290-K293 PolarHBondContact O-N 3.15Å; R290-A294 PolarHBondContact O-N 3.28Å
291E69.9Low70.2Confident38 Ų3867.7 Ų67.718%0.17834%0.343CS..Hα-helixtrans-63.2-38175.9-65.9-51.9137.400111.9R143 V147 K287 F288 K293 A294 A295R143-E291 IonicContact CZ-OE2 2.86Å; R143-E291 IonicContact NH1-OE2 2.76Å; R143-E291 PolarHBondContact NH1-OE2 3.26Å; V147-E291 HydrophobicContact CG2-CB 4.34Å; K287-E291 WeakPolarHBondContact O-CG 3.43Å; K287-E291 PolarHBondContact O-N 3Å; F288-E291 PolarHBondContact O-N 3.12Å; E291-K293 VanDerWaalsContact C-N 3.34Å; E291-K293 PolarHBondContact O-N 3.24Å; E291-A294 PolarHBondContact O-N 3.49Å; E291-A295 WeakPolarHBondContact O-CB 3.47Å; E291-A295 PolarHBondContact O-N 3.5Å
292K68.9Low71.6Confident88 Ų8865 Ų6538%0.38333%0.329SS..Hα-helixtrans-61.5-41174.5-177178.2178.5178.60112.1T234 F288 S289 R290 A295 K296T234-K292 PolarHBondContact OG1-NZ 2.93Å; F288-K292 PolarHBondContact O-N 3.49Å; S289-K292 PolarHBondContact O-N 2.79Å; R290-K292 VanDerWaalsContact C-N 3.33Å; R290-K292 PolarHBondContact O-N 3.15Å; K292-A295 PolarHBondContact O-N 3.4Å; K292-K296 PolarHBondContact O-N 3.3Å; K292-K296 VanDerWaalsContact O-N 3.14Å
293K71.8Confident73Confident105 Ų10563.6 Ų63.646%0.45732%0.324SS..Hα-helixtrans-65.6-42.9176-172-179.2176.2-171.60111.4S289 R290 E291 A295 K296 T297S289-K293 PolarHBondContact O-N 3.45Å; S289-K293 VanDerWaalsContact O-N 3.12Å; R290-K293 PolarHBondContact O-N 3.15Å; E291-K293 VanDerWaalsContact C-N 3.34Å; E291-K293 PolarHBondContact O-N 3.24Å; K293-A295 VanDerWaalsContact C-N 3.33Å; K293-A295 PolarHBondContact O-N 3.36Å; K293-K296 PolarHBondContact O-N 3.23Å; K293-T297 PolarHBondContact O-N 3.09Å; K293-T297 PolarHBondContact O-OG1 3.32Å
294A68.6Low74.3Confident32 Ų3263 Ų6326%0.26432%0.317SS..Hα-helixtrans-63.6-36.8175.200000112.3R290 E291 K296 T297 L298R290-A294 PolarHBondContact O-N 3.28Å; E291-A294 PolarHBondContact O-N 3.49Å; A294-K296 PolarHBondContact O-N 3.26Å; A294-T297 WeakPolarHBondContact O-CB 3.33Å; A294-T297 PolarHBondContact O-N 2.95Å; A294-L298 WeakPolarHBondContact O-CG 3.34Å; A294-L298 PolarHBondContact O-N 3.08Å
295A72.9Confident75.5Confident9 Ų958.2 Ų58.27%0.07430%0.299CS..Hα-helixtrans-64-3917500000112.5V147 V226 E291 K292 K293 T297 L298 A299V147-A295 HydrophobicContact CG2-CB 4.11Å; V226-A295 HydrophobicContact CG1-CB 3.85Å; E291-A295 WeakPolarHBondContact O-CB 3.47Å; E291-A295 PolarHBondContact O-N 3.5Å; K292-A295 PolarHBondContact O-N 3.4Å; K293-A295 VanDerWaalsContact C-N 3.33Å; K293-A295 PolarHBondContact O-N 3.36Å; A295-T297 PolarHBondContact O-N 3.43Å; A295-L298 PolarHBondContact O-N 3.47Å; A295-A299 PolarHBondContact O-N 3.45Å
296K78Confident76.8Confident156 Ų15656.6 Ų56.668%0.67829%0.29SS*.Hα-helixtrans-60.1-46174.7-177.6-178.7177.8179.60111.6K292 K293 A294 L298 A299 I300K292-K296 PolarHBondContact O-N 3.3Å; K292-K296 VanDerWaalsContact O-N 3.14Å; K293-K296 PolarHBondContact O-N 3.23Å; A294-K296 PolarHBondContact O-N 3.26Å; K296-L298 VanDerWaalsContact C-N 3.28Å; K296-L298 PolarHBondContact O-N 3.5Å; K296-A299 PolarHBondContact O-N 3.19Å; K296-I300 PolarHBondContact O-N 2.99Å
297T75.4Confident78.1Confident16 Ų1655.3 Ų55.310%0.09829%0.285CS..Hα-helixtrans-52.6-48.9175.2-680000111.7K293 A294 A295 A299 I300 V301 S353K293-T297 PolarHBondContact O-N 3.09Å; K293-T297 PolarHBondContact O-OG1 3.32Å; A294-T297 WeakPolarHBondContact O-CB 3.33Å; A294-T297 PolarHBondContact O-N 2.95Å; A295-T297 PolarHBondContact O-N 3.43Å; T297-A299 VanDerWaalsContact C-N 3.31Å; T297-A299 PolarHBondContact O-N 3.13Å; T297-I300 WeakPolarHBondContact O-CB 3.24Å; T297-I300 PolarHBondContact O-N 2.92Å; T297-V301 PolarHBondContact O-N 3.28Å; T297-S353 WeakPolarHBondContact CG2-OG 3.44Å; T297-S353 VanDerWaalsContact OG1-CB 3.22Å; T297-S353 WeakPolarHBondContact OG1-CB 3.34Å; T297-S353 PolarHBondContact OG1-O 3Å
298L77.9Confident79.4Confident10 Ų1051.3 Ų51.35%0.05227%0.268CS..Hα-helixtrans-77.2-20.7-173.5-67.6165.3000112.6I139 R143 Y223 A294 A295 K296 I300 V301 V302I139-L298 HydrophobicContact CG2-CD1 4.29Å; I139-L298 HydrophobicContact CG2-CD2 4Å; R143-L298 HydrophobicContact CG-CD1 3.22Å; R143-L298 HydrophobicContact CG-CG 4.46Å; Y223-L298 HydrophobicContact CE1-CB 4.28Å; Y223-L298 VanDerWaalsContact OH-C 3.24Å; Y223-L298 VanDerWaalsContact OH-CB 3.27Å; Y223-L298 WeakPolarHBondContact OH-CB 3.21Å; Y223-L298 PolarHBondContact OH-O 3.42Å; A294-L298 WeakPolarHBondContact O-CG 3.34Å; A294-L298 PolarHBondContact O-N 3.08Å; A295-L298 PolarHBondContact O-N 3.47Å; K296-L298 VanDerWaalsContact C-N 3.28Å; K296-L298 PolarHBondContact O-N 3.5Å; L298-I300 VanDerWaalsContact C-N 3.32Å; L298-V301 HydrophobicContact CD2-CG2 4.29Å; L298-V301 PolarHBondContact O-N 3.42Å; L298-V302 PolarHBondContact O-N 2.96Å
299A81.8Confident80.8Confident46 Ų4651 Ų5138%0.3827%0.267SS..Hα-helixtrans-67.4-35.2168.900000111.4Y223 A295 K296 T297 V302 G303Y223-A299 HydrophobicContact CD1-CB 4.09Å; Y223-A299 HydrophobicContact CE1-CB 4.01Å; A295-A299 PolarHBondContact O-N 3.45Å; K296-A299 PolarHBondContact O-N 3.19Å; T297-A299 VanDerWaalsContact C-N 3.31Å; T297-A299 PolarHBondContact O-N 3.13Å; A299-V302 PolarHBondContact O-N 3.26Å; A299-G303 PolarHBondContact O-N 3.09Å
300I85Confident82Confident83 Ų8350.6 Ų50.643%0.42626%0.258SS..Hα-helixtrans-66.2-45.4173.4-60.6168.1000110.1K296 T297 L298 V302 G303 M304 I349K296-I300 PolarHBondContact O-N 2.99Å; T297-I300 WeakPolarHBondContact O-CB 3.24Å; T297-I300 PolarHBondContact O-N 2.92Å; L298-I300 VanDerWaalsContact C-N 3.32Å; I300-V302 VanDerWaalsContact C-N 3.3Å; I300-V302 PolarHBondContact O-N 3.05Å; I300-G303 PolarHBondContact O-N 3.48Å; I300-M304 HydrophobicContact CG2-CG 4.44Å; I300-M304 WeakPolarHBondContact O-CG 3.43Å; I300-M304 PolarHBondContact O-N 3.25Å; I300-I349 HydrophobicContact CG2-CD1 4.27Å
301V83.9Confident83.3Confident2 Ų245.5 Ų45.51%0.01224%0.243CC..Hα-helixtrans-54.5-48.7175.8178.10000110.7L136 T297 L298 M304 F305 I349 Y350L136-V301 HydrophobicContact CD2-CG1 3.82Å; T297-V301 PolarHBondContact O-N 3.28Å; L298-V301 HydrophobicContact CD2-CG2 4.29Å; L298-V301 PolarHBondContact O-N 3.42Å; V301-M304 PolarHBondContact O-N 3.48Å; V301-F305 WeakPolarHBondContact O-CB 3.49Å; V301-F305 PolarHBondContact O-N 3.43Å; V301-I349 HydrophobicContact CB-CD1 4.39Å; V301-I349 HydrophobicContact CG2-CB 4.16Å; V301-I349 HydrophobicContact CG2-CD1 4Å; V301-I349 HydrophobicContact CG2-CG2 3.49Å; V301-I349 VanDerWaalsContact CG2-CG2 3.49Å; V301-Y350 HydrophobicContact CG2-CE1 4.18Å
302V85.7Confident84.3Confident8 Ų844.2 Ų44.25%0.04824%0.237CC..Hα-helixtrans-66.7-39.9179.4163.10000113.2I219 Y223 L298 A299 I300 M304 F305 I306I219-V302 HydrophobicContact CG2-CB 4.26Å; I219-V302 HydrophobicContact CG2-CG1 3.38Å; I219-V302 HydrophobicContact CG2-CG2 3.83Å; Y223-V302 HydrophobicContact CD2-CG1 4.37Å; Y223-V302 HydrophobicContact CD2-CG2 4.19Å; Y223-V302 HydrophobicContact CE1-CG2 4.48Å; Y223-V302 HydrophobicContact CE2-CB 4.1Å; Y223-V302 HydrophobicContact CE2-CG1 4.35Å; Y223-V302 HydrophobicContact CE2-CG2 3.37Å; Y223-V302 VanDerWaalsContact OH-CG2 3.29Å; Y223-V302 WeakPolarHBondContact OH-CG2 3.5Å; L298-V302 PolarHBondContact O-N 2.96Å; A299-V302 PolarHBondContact O-N 3.26Å; I300-V302 VanDerWaalsContact C-N 3.3Å; I300-V302 PolarHBondContact O-N 3.05Å; V302-M304 PolarHBondContact O-N 3.29Å; V302-F305 WeakPolarHBondContact O-CB 3.49Å; V302-F305 PolarHBondContact O-N 3.47Å; V302-I306 HydrophobicContact CG1-CD1 3.96Å; V302-I306 HydrophobicContact CG1-CG1 4.49Å; V302-I306 VanDerWaalsContact O-CG1 3.32Å; V302-I306 WeakPolarHBondContact O-CG1 3.46Å; V302-I306 PolarHBondContact O-N 2.8Å
303G88.6Confident85.4Confident31 Ų3140.6 Ų40.632%0.3222%0.222SC..Hα-helixtrans-59.1-47.2175.100000112.1A299 I300 I306 L307A299-G303 PolarHBondContact O-N 3.09Å; I300-G303 PolarHBondContact O-N 3.48Å; G303-I306 PolarHBondContact O-N 3.48Å; G303-L307 VanDerWaalsContact O-CG 3.31Å; G303-L307 WeakPolarHBondContact O-CG 3.45Å; G303-L307 PolarHBondContact O-N 3.05Å; G303-L307 VanDerWaalsContact O-N 3.09Å
304M90.4Very high86.4Confident66 Ų6638.8 Ų38.833%0.32522%0.217SC..Hα-helixtrans-65.2-39.3177.4-65.7-52.2-59.100112.4I300 V301 V302 I306 L307 C308 I345 I349I300-M304 HydrophobicContact CG2-CG 4.44Å; I300-M304 WeakPolarHBondContact O-CG 3.43Å; I300-M304 PolarHBondContact O-N 3.25Å; V301-M304 PolarHBondContact O-N 3.48Å; V302-M304 PolarHBondContact O-N 3.29Å; M304-I306 PolarHBondContact O-N 3.34Å; M304-L307 PolarHBondContact O-N 3.13Å; M304-L307 HydrophobicContact SD-CD1 4.14Å; M304-C308 WeakPolarHBondContact O-CB 3.41Å; M304-C308 PolarHBondContact O-N 2.9Å; M304-C308 PolarHBondContact O-SG 3.38Å; M304-I345 HydrophobicContact CB-CD1 4.3Å; M304-I345 HydrophobicContact CB-CG2 4.03Å; M304-I345 HydrophobicContact CE-CD1 3.75Å; M304-I345 HydrophobicContact CG-CG2 4.24Å; M304-I349 HydrophobicContact CB-CD1 4.27Å; M304-I349 HydrophobicContact CG-CD1 4.02Å
305F90.2Very high87.4Confident0 Ų040.4 Ų40.40%022%0.218CC..Hα-helixtrans-57.3-48.1174.4166.3-98.6000112.2I133 L136 F212 I219 V301 V302 L307 C308 W309I133-F305 HydrophobicContact CB-CE2 4.35Å; I133-F305 HydrophobicContact CB-CZ 4.09Å; I133-F305 HydrophobicContact CD1-CZ 4.35Å; I133-F305 HydrophobicContact CG1-CE2 3.63Å; I133-F305 HydrophobicContact CG1-CZ 3.61Å; I133-F305 HydrophobicContact CG2-CE1 4.31Å; I133-F305 HydrophobicContact CG2-CE2 4.34Å; I133-F305 HydrophobicContact CG2-CZ 3.6Å; L136-F305 HydrophobicContact CD1-CB 3.92Å; L136-F305 HydrophobicContact CD1-CD1 4.13Å; L136-F305 HydrophobicContact CD1-CD2 3.19Å; L136-F305 HydrophobicContact CD1-CE2 3.72Å; L136-F305 HydrophobicContact CD1-CG 3.44Å; L136-F305 VanDerWaalsContact CD1-CG 3.44Å; L136-F305 HydrophobicContact CD1-CZ 4.39Å; F212-F305 HydrophobicContact CD2-CE1 4.42Å; F212-F305 HydrophobicContact CD2-CZ 4.04Å; F212-F305 AromaticContact CE2-CE1 3.97Å; F212-F305 HydrophobicContact CE2-CE1 3.97Å; F212-F305 AromaticContact CE2-CZ 3.9Å; F212-F305 HydrophobicContact CE2-CZ 3.9Å; I219-F305 HydrophobicContact CD1-CE1 4.5Å; V301-F305 WeakPolarHBondContact O-CB 3.49Å; V301-F305 PolarHBondContact O-N 3.43Å; V302-F305 WeakPolarHBondContact O-CB 3.49Å; V302-F305 PolarHBondContact O-N 3.47Å; F305-L307 VanDerWaalsContact C-N 3.34Å; F305-L307 PolarHBondContact O-N 3.32Å; F305-C308 PolarHBondContact O-N 3.47Å; F305-W309 AromaticContact CD2-CD1 3.31Å; F305-W309 HydrophobicContact CD2-CG 4.19Å; F305-W309 AromaticContact CD2-NE1 3.94Å; F305-W309 HydrophobicContact CE2-CB 4.1Å; F305-W309 AromaticContact CE2-CD1 3.15Å; F305-W309 AromaticContact CE2-CG 3.68Å; F305-W309 HydrophobicContact CE2-CG 3.68Å; F305-W309 AromaticContact CE2-NE1 3.73Å; F305-W309 HydrophobicContact CZ-CB 4.18Å; F305-W309 HydrophobicContact CZ-CG 4.21Å; F305-W309 PolarHBondContact O-N 3.18Å
306I92.2Very high88.1Confident33 Ų3340.6 Ų40.617%0.16922%0.217CC..Hα-helixtrans-61.7-45178.4-65.6169.8000110.2L216 L220 V302 G303 M304 C308 W309 L310L216-I306 HydrophobicContact CD1-CD1 3.65Å; L216-I306 HydrophobicContact CD1-CG1 3.56Å; L220-I306 HydrophobicContact CD2-CD1 3.88Å; V302-I306 HydrophobicContact CG1-CD1 3.96Å; V302-I306 HydrophobicContact CG1-CG1 4.49Å; V302-I306 VanDerWaalsContact O-CG1 3.32Å; V302-I306 WeakPolarHBondContact O-CG1 3.46Å; V302-I306 PolarHBondContact O-N 2.8Å; G303-I306 PolarHBondContact O-N 3.48Å; M304-I306 PolarHBondContact O-N 3.34Å; I306-C308 VanDerWaalsContact C-N 3.26Å; I306-C308 PolarHBondContact O-N 2.94Å; I306-W309 PolarHBondContact O-N 3.41Å; I306-L310 HydrophobicContact CG2-CB 4.14Å; I306-L310 HydrophobicContact CG2-CD2 4.09Å; I306-L310 WeakPolarHBondContact O-CB 3.48Å; I306-L310 PolarHBondContact O-N 2.83Å
307L93.1Very high88.6Confident113 Ų11333.5 Ų33.559%0.59219%0.187SC*.Hα-helixtrans-61-36.1178.8-69.3171.6000112.5G303 M304 F305 P311G303-L307 VanDerWaalsContact O-CG 3.31Å; G303-L307 WeakPolarHBondContact O-CG 3.45Å; G303-L307 PolarHBondContact O-N 3.05Å; G303-L307 VanDerWaalsContact O-N 3.09Å; M304-L307 PolarHBondContact O-N 3.13Å; M304-L307 HydrophobicContact SD-CD1 4.14Å; F305-L307 VanDerWaalsContact C-N 3.34Å; F305-L307 PolarHBondContact O-N 3.32Å; L307-P311 WeakPolarHBondContact O-CD 3.27Å
308C93.7Very high89.2Confident3 Ų336 Ų362%0.0220%0.2CC..Hα-helixtrans-75.6-43.3179.3-76.10000113.3M304 F305 I306 L338 G339 N342 I345M304-C308 WeakPolarHBondContact O-CB 3.41Å; M304-C308 PolarHBondContact O-N 2.9Å; M304-C308 PolarHBondContact O-SG 3.38Å; F305-C308 PolarHBondContact O-N 3.47Å; I306-C308 VanDerWaalsContact C-N 3.26Å; I306-C308 PolarHBondContact O-N 2.94Å; C308-L338 WeakPolarHBondContact CB-O 3.26Å; C308-L338 PolarHBondContact SG-O 3Å; C308-G339 PolarHBondContact O-N 3.36Å; C308-N342 HydrophobicContact CB-CB 4Å; C308-I345 VanDerWaalsContact SG-CD1 3.56Å
309W93.4Very high89.6Confident12 Ų1235.9 Ų35.95%0.04520%0.201CC..Hα-helixtrans-99.3-28.2-168.4-77.899.9000114.9C129 F212 F305 I306 P311 F312 F313 G339 N342C129-W309 HydrophobicContact CB-CH2 3.86Å; C129-W309 HydrophobicContact CB-CZ2 4.32Å; C129-W309 HydrophobicContact CB-CZ3 4.42Å; C129-W309 WeakPolarHBondContact SG-CH2 3.38Å; F212-W309 HydrophobicContact CD2-CB 4.19Å; F212-W309 HydrophobicContact CE2-CB 3.62Å; F212-W309 HydrophobicContact CZ-CB 4.42Å; F305-W309 AromaticContact CD2-CD1 3.31Å; F305-W309 HydrophobicContact CD2-CG 4.19Å; F305-W309 AromaticContact CD2-NE1 3.94Å; F305-W309 HydrophobicContact CE2-CB 4.1Å; F305-W309 AromaticContact CE2-CD1 3.15Å; F305-W309 AromaticContact CE2-CG 3.68Å; F305-W309 HydrophobicContact CE2-CG 3.68Å; F305-W309 AromaticContact CE2-NE1 3.73Å; F305-W309 HydrophobicContact CZ-CB 4.18Å; F305-W309 HydrophobicContact CZ-CG 4.21Å; F305-W309 PolarHBondContact O-N 3.18Å; I306-W309 PolarHBondContact O-N 3.41Å; W309-P311 VanDerWaalsContact C-CD 3.46Å; W309-F312 HydrophobicContact CE3-CD1 4.2Å; W309-F312 HydrophobicContact CZ3-CD1 4.07Å; W309-F312 PolarHBondContact O-N 3.22Å; W309-F313 HydrophobicContact CB-CD2 4.11Å; W309-F313 HydrophobicContact CB-CE2 4.25Å; W309-F313 HydrophobicContact CD2-CE2 4.02Å; W309-F313 AromaticContact CE3-CD2 3.94Å; W309-F313 HydrophobicContact CE3-CD2 3.94Å; W309-F313 AromaticContact CE3-CE2 3.32Å; W309-F313 HydrophobicContact CE3-CE2 3.32Å; W309-F313 HydrophobicContact CE3-CZ 4.16Å; W309-F313 HydrophobicContact CG-CE2 4.44Å; W309-F313 AromaticContact CZ3-CE2 3.99Å; W309-F313 HydrophobicContact CZ3-CE2 3.99Å; W309-F313 HydrophobicContact CZ3-CZ 4.42Å; W309-F313 WeakPolarHBondContact O-CD2 3.42Å; W309-F313 PolarHBondContact O-N 2.92Å; W309-F313 VanDerWaalsContact O-N 3.11Å; W309-G339 WeakPolarHBondContact CZ2-O 3.49Å; W309-G339 PolarHBondContact NE1-O 3.05Å; W309-N342 PolarHBondContact NE1-ND2 2.65Å
310L93.6Very high89.8Confident68 Ų6834.5 Ų34.536%0.35619%0.189SC..Hα-helixtrans-56.4-42.4-178.6-178.465.7000113.2F212 I306 F312 L314F212-L310 HydrophobicContact CE1-CD1 3.74Å; F212-L310 HydrophobicContact CZ-CB 4.01Å; F212-L310 HydrophobicContact CZ-CD1 3.95Å; I306-L310 HydrophobicContact CG2-CB 4.14Å; I306-L310 HydrophobicContact CG2-CD2 4.09Å; I306-L310 WeakPolarHBondContact O-CB 3.48Å; I306-L310 PolarHBondContact O-N 2.83Å; L310-F312 PolarHBondContact O-N 3.02Å; L310-L314 VanDerWaalsContact O-CB 3.23Å; L310-L314 WeakPolarHBondContact O-CB 3.44Å; L310-L314 PolarHBondContact O-N 3.06Å
311P94.1Very high89.8Confident36 Ų3635.1 Ų35.123%0.23419%0.189CC..Hα-helixtrans-60.2-45.6178.6-2436.1000112.1L307 W309 L314 F315 I335 L338L307-P311 WeakPolarHBondContact O-CD 3.27Å; W309-P311 VanDerWaalsContact C-CD 3.46Å; P311-L314 PolarHBondContact O-N 3.04Å; P311-F315 VanDerWaalsContact O-CD2 3.22Å; P311-F315 WeakPolarHBondContact O-CD2 3.5Å; P311-F315 PolarHBondContact O-N 3.41Å; P311-I335 HydrophobicContact CB-CG1 4.12Å; P311-I335 HydrophobicContact CB-CG2 3.95Å; P311-L338 HydrophobicContact CG-CD2 4.11Å
312F91.7Very high90Very high12 Ų1240.7 Ų40.75%0.05321%0.213CC..Hα-helixtrans-62.6-50-179.3177.6-102000111.8I197 W309 L310 L314 F315 L316 F332 I335 F336I197-F312 HydrophobicContact CD1-CZ 4.1Å; W309-F312 HydrophobicContact CE3-CD1 4.2Å; W309-F312 HydrophobicContact CZ3-CD1 4.07Å; W309-F312 PolarHBondContact O-N 3.22Å; L310-F312 PolarHBondContact O-N 3.02Å; F312-L314 PolarHBondContact O-N 2.86Å; F312-F315 PolarHBondContact O-N 3.33Å; F312-L316 HydrophobicContact CE1-CD2 3.95Å; F312-L316 HydrophobicContact CZ-CB 4.47Å; F312-L316 HydrophobicContact CZ-CD1 4.22Å; F312-L316 HydrophobicContact CZ-CD2 4.01Å; F312-L316 HydrophobicContact CZ-CG 4.47Å; F312-L316 VanDerWaalsContact O-CB 3.3Å; F312-L316 WeakPolarHBondContact O-CB 3.32Å; F312-L316 PolarHBondContact O-N 2.98Å; F312-F332 HydrophobicContact CE2-CZ 4.29Å; F312-I335 HydrophobicContact CB-CG2 3.71Å; F312-I335 HydrophobicContact CD2-CG2 4.31Å; F312-I335 VanDerWaalsContact N-CG2 3.3Å; F312-F336 HydrophobicContact CD2-CD2 4.14Å; F312-F336 AromaticContact CE2-CD2 3.67Å; F312-F336 HydrophobicContact CE2-CD2 3.67Å; F312-F336 HydrophobicContact CE2-CE2 4.16Å; F312-F336 HydrophobicContact CZ-CD2 4.41Å; F312-F336 HydrophobicContact CZ-CE2 4.5Å
313F92.1Very high89.9Confident11 Ų1145 Ų455%0.04824%0.241CC..Hα-helixtrans-71.4-16.5-179.6-75.4-71.2000113.8I133 F212 Y213 W309 P317I133-F313 HydrophobicContact CD1-CE2 3.68Å; I133-F313 HydrophobicContact CD1-CZ 3.75Å; F212-F313 HydrophobicContact CB-CB 4.13Å; F212-F313 HydrophobicContact CB-CD1 3.59Å; F212-F313 HydrophobicContact CB-CD2 3.53Å; F212-F313 HydrophobicContact CB-CE1 3.77Å; F212-F313 HydrophobicContact CB-CE2 3.7Å; F212-F313 HydrophobicContact CB-CG 3.46Å; F212-F313 VanDerWaalsContact CB-CG 3.46Å; F212-F313 HydrophobicContact CB-CZ 3.83Å; F212-F313 HydrophobicContact CD1-CB 3.36Å; F212-F313 HydrophobicContact CD1-CD1 4.45Å; F212-F313 AromaticContact CD1-CD2 3.82Å; F212-F313 HydrophobicContact CD1-CD2 3.82Å; F212-F313 AromaticContact CD1-CG 3.64Å; F212-F313 HydrophobicContact CD1-CG 3.64Å; F212-F313 HydrophobicContact CD2-CB 4.39Å; F212-F313 AromaticContact CD2-CD2 3.23Å; F212-F313 HydrophobicContact CD2-CD2 3.23Å; F212-F313 AromaticContact CD2-CE2 3.58Å; F212-F313 HydrophobicContact CD2-CE2 3.58Å; F212-F313 AromaticContact CD2-CG 3.92Å; F212-F313 HydrophobicContact CD2-CG 3.92Å; F212-F313 HydrophobicContact CE1-CB 3.78Å; F212-F313 HydrophobicContact CE1-CD2 4.32Å; F212-F313 HydrophobicContact CE1-CG 4.33Å; F212-F313 AromaticContact CE2-CD2 3.82Å; F212-F313 HydrophobicContact CE2-CD2 3.82Å; F212-F313 HydrophobicContact CE2-CE2 4.4Å; F212-F313 HydrophobicContact CG-CB 3.71Å; F212-F313 HydrophobicContact CG-CD1 4.07Å; F212-F313 AromaticContact CG-CD2 3.23Å; F212-F313 HydrophobicContact CG-CD2 3.23Å; F212-F313 AromaticContact CG-CE2 3.78Å; F212-F313 HydrophobicContact CG-CE2 3.78Å; F212-F313 AromaticContact CG-CG 3.39Å; F212-F313 HydrophobicContact CG-CG 3.39Å; F212-F313 HydrophobicContact CG-CZ 4.4Å; F212-F313 HydrophobicContact CZ-CB 4.45Å; F212-F313 HydrophobicContact CZ-CD2 4.31Å; Y213-F313 PolarHBondContact OH-O 3.24Å; W309-F313 HydrophobicContact CB-CD2 4.11Å; W309-F313 HydrophobicContact CB-CE2 4.25Å; W309-F313 HydrophobicContact CD2-CE2 4.02Å; W309-F313 AromaticContact CE3-CD2 3.94Å; W309-F313 HydrophobicContact CE3-CD2 3.94Å; W309-F313 AromaticContact CE3-CE2 3.32Å; W309-F313 HydrophobicContact CE3-CE2 3.32Å; W309-F313 HydrophobicContact CE3-CZ 4.16Å; W309-F313 HydrophobicContact CG-CE2 4.44Å; W309-F313 AromaticContact CZ3-CE2 3.99Å; W309-F313 HydrophobicContact CZ3-CE2 3.99Å; W309-F313 HydrophobicContact CZ3-CZ 4.42Å; W309-F313 WeakPolarHBondContact O-CD2 3.42Å; W309-F313 PolarHBondContact O-N 2.92Å; W309-F313 VanDerWaalsContact O-N 3.11Å; F313-P317 WeakPolarHBondContact O-CD 3.41Å; F313-P317 WeakPolarHBondContact O-CG 3.33Å
314L91.3Very high89.6Confident68 Ų6848.5 Ų48.536%0.35627%0.267SS..Hα-helixtrans-76.8-50170-176.6139.4000111L310 P311 F312 L318L310-L314 VanDerWaalsContact O-CB 3.23Å; L310-L314 WeakPolarHBondContact O-CB 3.44Å; L310-L314 PolarHBondContact O-N 3.06Å; P311-L314 PolarHBondContact O-N 3.04Å; F312-L314 PolarHBondContact O-N 2.86Å; L314-L318 HydrophobicContact CD2-CD1 3.7Å; L314-L318 HydrophobicContact CG-CD1 3.88Å; L314-L318 VanDerWaalsContact O-CB 3.31Å; L314-L318 WeakPolarHBondContact O-CB 3.06Å; L314-L318 VanDerWaalsContact O-CD1 3.29Å; L314-L318 WeakPolarHBondContact O-CD1 3.41Å; L314-L318 WeakPolarHBondContact O-CG 3.33Å; L314-L318 PolarHBondContact O-N 2.81Å
315F90.4Very high89.4Confident66 Ų6650.5 Ų50.529%0.28928%0.278SS..Hα-helixtrans-79.1-26.3-174.5-74.2-71.2000114.4P311 F312 G319 P327 I335P311-F315 VanDerWaalsContact O-CD2 3.22Å; P311-F315 WeakPolarHBondContact O-CD2 3.5Å; P311-F315 PolarHBondContact O-N 3.41Å; F312-F315 PolarHBondContact O-N 3.33Å; F315-G319 WeakPolarHBondContact O-CA 3.43Å; F315-G319 PolarHBondContact O-N 2.93Å; F315-P327 HydrophobicContact CD1-CG 4.12Å; F315-P327 HydrophobicContact CG-CG 4.3Å; F315-I335 HydrophobicContact CD2-CD1 3.52Å; F315-I335 HydrophobicContact CE2-CD1 3.8Å; F315-I335 HydrophobicContact CG-CD1 4.32Å
316L88.2Confident89Confident12 Ų1255.1 Ų55.16%0.06330%0.298CS..Hα-helixtrans-60.4-60.9178.9179.474.7000112.6F312 S320F312-L316 HydrophobicContact CE1-CD2 3.95Å; F312-L316 HydrophobicContact CZ-CB 4.47Å; F312-L316 HydrophobicContact CZ-CD1 4.22Å; F312-L316 HydrophobicContact CZ-CD2 4.01Å; F312-L316 HydrophobicContact CZ-CG 4.47Å; F312-L316 VanDerWaalsContact O-CB 3.3Å; F312-L316 WeakPolarHBondContact O-CB 3.32Å; F312-L316 PolarHBondContact O-N 2.98Å; L316-S320 WeakPolarHBondContact O-CB 3.47Å; L316-S320 PolarHBondContact O-N 3.33Å
317P88.6Confident88.7Confident7 Ų754.8 Ų54.85%0.04530%0.298CS..Hα-helixtrans-67.7-37.8177.627.1-34.1000111.8F313 G319 S320 F321F313-P317 WeakPolarHBondContact O-CD 3.41Å; F313-P317 WeakPolarHBondContact O-CG 3.33Å; P317-G319 PolarHBondContact O-N 2.93Å; P317-S320 WeakPolarHBondContact O-CB 3.41Å; P317-S320 PolarHBondContact O-N 2.91Å; P317-F321 WeakPolarHBondContact O-CD2 3.29Å; P317-F321 PolarHBondContact O-N 3.17Å
318L88.1Confident88.5Confident68 Ų6852.9 Ų52.936%0.35630%0.295SS..Hα-helixtrans-62.7-43.4179.1-75.4176.2000112.5L314 S320 F321 F322L314-L318 HydrophobicContact CD2-CD1 3.7Å; L314-L318 HydrophobicContact CG-CD1 3.88Å; L314-L318 VanDerWaalsContact O-CB 3.31Å; L314-L318 WeakPolarHBondContact O-CB 3.06Å; L314-L318 VanDerWaalsContact O-CD1 3.29Å; L314-L318 WeakPolarHBondContact O-CD1 3.41Å; L314-L318 WeakPolarHBondContact O-CG 3.33Å; L314-L318 PolarHBondContact O-N 2.81Å; L318-S320 VanDerWaalsContact C-N 3.26Å; L318-S320 PolarHBondContact O-N 3.04Å; L318-F321 PolarHBondContact O-N 3.28Å; L318-F322 HydrophobicContact CD2-CD2 4.42Å; L318-F322 WeakPolarHBondContact O-CA 3.35Å; L318-F322 WeakPolarHBondContact O-CB 3.47Å; L318-F322 PolarHBondContact O-N 3.34Å
319G85.3Confident88Confident8 Ų859.1 Ų59.18%0.08232%0.323CS..Hα-helixtrans-66.3-31.2176.900000112.6F315 P317 F322F315-G319 WeakPolarHBondContact O-CA 3.43Å; F315-G319 PolarHBondContact O-N 2.93Å; P317-G319 PolarHBondContact O-N 2.93Å; G319-F322 CarbonylContact O-C 3.55Å
320S85.4Confident87.6Confident18 Ų1863 Ų6313%0.12635%0.352CS..Hα-helixtrans-70.5-44.3175.8175.70000113.2E199 P201 L316 P317 L318E199-S320 VanDerWaalsContact O-CB 3.26Å; E199-S320 WeakPolarHBondContact O-CB 3.16Å; E199-S320 PolarHBondContact O-OG 3.49Å; P201-S320 WeakPolarHBondContact CA-OG 3.01Å; P201-S320 WeakPolarHBondContact CB-OG 3.36Å; L316-S320 WeakPolarHBondContact O-CB 3.47Å; L316-S320 PolarHBondContact O-N 3.33Å; P317-S320 WeakPolarHBondContact O-CB 3.41Å; P317-S320 PolarHBondContact O-N 2.91Å; L318-S320 VanDerWaalsContact C-N 3.26Å; L318-S320 PolarHBondContact O-N 3.04Å
321F86.7Confident87.4Confident96 Ų9662.9 Ų62.942%0.42135%0.354SS..Hα-helixtrans-78.4-33.1176.9-73.8-73.1000113.5P201 L205 P317 L318P201-F321 HydrophobicContact CB-CD1 4.03Å; P201-F321 HydrophobicContact CB-CE1 3.71Å; P201-F321 HydrophobicContact CB-CE2 4.49Å; P201-F321 HydrophobicContact CB-CZ 3.94Å; L205-F321 HydrophobicContact CB-CE2 3.99Å; L205-F321 HydrophobicContact CB-CZ 4.07Å; L205-F321 HydrophobicContact CD1-CE2 4.39Å; L205-F321 HydrophobicContact CD2-CE2 4.23Å; L205-F321 HydrophobicContact CD2-CZ 3.92Å; L205-F321 HydrophobicContact CG-CE2 4.43Å; L205-F321 HydrophobicContact CG-CZ 4.5Å; P317-F321 WeakPolarHBondContact O-CD2 3.29Å; P317-F321 PolarHBondContact O-N 3.17Å; L318-F321 PolarHBondContact O-N 3.28Å
322F88.3Confident87.1Confident118 Ų11863.4 Ų63.452%0.51835%0.353SS..  trans-128.685.4-175.9-56.5-77000110L318 G319 A324 L325L318-F322 HydrophobicContact CD2-CD2 4.42Å; L318-F322 WeakPolarHBondContact O-CA 3.35Å; L318-F322 WeakPolarHBondContact O-CB 3.47Å; L318-F322 PolarHBondContact O-N 3.34Å; G319-F322 CarbonylContact O-C 3.55Å; F322-A324 PolarHBondContact O-N 3.19Å; F322-L325 HydrophobicContact CB-CB 4.23Å; F322-L325 HydrophobicContact CB-CD1 3.81Å; F322-L325 HydrophobicContact CB-CG 4.09Å; F322-L325 HydrophobicContact CD2-CD1 4.34Å; F322-L325 HydrophobicContact CG-CD1 4.16Å; F322-L325 PolarHBondContact O-N 2.98Å
323P82.8Confident86.9Confident100 Ų10066.1 Ų66.165%0.64937%0.365SS*.G310 helixtrans-55.4-28.6179.6-2835.6000113.7L325 K326P323-L325 VanDerWaalsContact C-N 3.26Å; P323-L325 PolarHBondContact O-N 3.24Å; P323-K326 WeakPolarHBondContact O-CB 3.41Å; P323-K326 PolarHBondContact O-N 3.22Å
324A83.1Confident86.8Confident103 Ų10372.3 Ų72.385%0.85139%0.392SS*.G310 helixtrans-67.9-19.517700000114.5F322F322-A324 PolarHBondContact O-N 3.19Å
325L84.4Confident86.8Confident109 Ų10969.6 Ų69.657%0.57138%0.378SS*.G310 helixtrans-95.63.9177.8-66.7174.8000112.6F322 P323F322-L325 HydrophobicContact CB-CB 4.23Å; F322-L325 HydrophobicContact CB-CD1 3.81Å; F322-L325 HydrophobicContact CB-CG 4.09Å; F322-L325 HydrophobicContact CD2-CD1 4.34Å; F322-L325 HydrophobicContact CG-CD1 4.16Å; F322-L325 PolarHBondContact O-N 2.98Å; P323-L325 VanDerWaalsContact C-N 3.26Å; P323-L325 PolarHBondContact O-N 3.24Å
326K81.8Confident86.8Confident96 Ų9668 Ų6842%0.41737%0.37SS..PPolyproline II helixtrans-64.2124.7-179.6-165.6167.2-174.7161.70109.3E199 P323E199-K326 IonicContact OE1-NZ 2.69Å; E199-K326 PolarHBondContact OE1-NZ 2.78Å; E199-K326 IonicContact OE2-NZ 2.8Å; E199-K326 PolarHBondContact OE2-NZ 3.08Å; P323-K326 WeakPolarHBondContact O-CB 3.41Å; P323-K326 PolarHBondContact O-N 3.22Å
327P86.3Confident87Confident26 Ų2669.2 Ų69.217%0.16937%0.374CS..PPolyproline II helixtrans-64.2161.717727.2-33.8000110.6F315 V331 F332F315-P327 HydrophobicContact CD1-CG 4.12Å; F315-P327 HydrophobicContact CG-CG 4.3Å; P327-V331 HydrophobicContact CB-CB 4.04Å; P327-V331 HydrophobicContact CB-CG1 3.76Å; P327-F332 HydrophobicContact CG-CB 4.32Å; P327-F332 HydrophobicContact CG-CD2 4.37Å
328S88.5Confident87.3Confident74 Ų7471 Ų7152%0.51738%0.383SS..PPolyproline II helixtrans-58.2152.7172.862.70000111.2S330 V331 F332S328-S330 VanDerWaalsContact C-N 3.26Å; S328-S330 PolarHBondContact O-N 3.31Å; S328-V331 PolarHBondContact O-N 3.43Å; S328-V331 WeakPolarHBondContact OG-CG2 3.43Å; S328-F332 PolarHBondContact O-N 3.42Å
329E83.2Confident87.5Confident133 Ų13367.7 Ų67.762%0.62137%0.366SS*.Hα-helixtrans-53.6-42.4-175.6-166.8-170.8148.300112.4V331 F332 K333E329-V331 VanDerWaalsContact C-N 3.33Å; E329-V331 PolarHBondContact O-N 3.41Å; E329-F332 PolarHBondContact O-N 3.29Å; E329-K333 HydrophobicContact CG-CD 4.4Å; E329-K333 WeakPolarHBondContact O-CB 3.46Å; E329-K333 WeakPolarHBondContact O-CG 3.28Å; E329-K333 PolarHBondContact O-N 3.4Å; E329-K333 WeakPolarHBondContact OE1-CE 2.92Å; E329-K333 IonicContact OE1-NZ 3.33Å; E329-K333 PolarHBondContact OE1-NZ 3.04Å; E329-K333 VanDerWaalsContact OE1-NZ 3.12Å
330S85.9Confident87.9Confident93 Ų9367.4 Ų67.465%0.6536%0.363SS*.Hα-helixtrans-61.8-38.3177.2-45.40000113S328 F334S328-S330 VanDerWaalsContact C-N 3.26Å; S328-S330 PolarHBondContact O-N 3.31Å; S330-F334 PolarHBondContact O-N 3.1Å
331V89.3Confident88.2Confident66 Ų6671.2 Ų71.240%0.438%0.377SS..Hα-helixtrans-72.1-40.9178.6172.40000110.2P327 S328 E329 F334 I335P327-V331 HydrophobicContact CB-CB 4.04Å; P327-V331 HydrophobicContact CB-CG1 3.76Å; S328-V331 PolarHBondContact O-N 3.43Å; S328-V331 WeakPolarHBondContact OG-CG2 3.43Å; E329-V331 VanDerWaalsContact C-N 3.33Å; E329-V331 PolarHBondContact O-N 3.41Å; V331-F334 PolarHBondContact O-N 3.29Å; V331-I335 HydrophobicContact CG1-CD1 3.74Å; V331-I335 HydrophobicContact CG1-CG1 4.48Å; V331-I335 WeakPolarHBondContact O-CB 3.3Å; V331-I335 WeakPolarHBondContact O-CD1 3.39Å; V331-I335 VanDerWaalsContact O-CG1 3.28Å; V331-I335 WeakPolarHBondContact O-CG1 3.47Å; V331-I335 PolarHBondContact O-N 3.16Å
332F87.1Confident88.4Confident48 Ų4866.7 Ų66.721%0.21136%0.357CS..Hα-helixtrans-61.6-45.3175.1-171.9-96.9000111.6F312 P327 S328 E329 F334 I335 F336F312-F332 HydrophobicContact CE2-CZ 4.29Å; P327-F332 HydrophobicContact CG-CB 4.32Å; P327-F332 HydrophobicContact CG-CD2 4.37Å; S328-F332 PolarHBondContact O-N 3.42Å; E329-F332 PolarHBondContact O-N 3.29Å; F332-F334 PolarHBondContact O-N 3.17Å; F332-I335 PolarHBondContact O-N 3.23Å; F332-F336 WeakPolarHBondContact O-CB 3.43Å; F332-F336 PolarHBondContact O-N 2.95Å
333K87.6Confident88.6Confident69 Ų6961.1 Ų61.130%0.333%0.333SS..Hα-helixtrans-58.1-45.4174.3-74.4175171.6-1700112.1E106 E329 I335 F336 W337E106-K333 WeakPolarHBondContact OE1-CD 3.46Å; E106-K333 WeakPolarHBondContact OE1-CE 3.37Å; E106-K333 IonicContact OE1-NZ 3.12Å; E106-K333 PolarHBondContact OE1-NZ 3.42Å; E106-K333 IonicContact OE2-NZ 2.82Å; E329-K333 HydrophobicContact CG-CD 4.4Å; E329-K333 WeakPolarHBondContact O-CB 3.46Å; E329-K333 WeakPolarHBondContact O-CG 3.28Å; E329-K333 PolarHBondContact O-N 3.4Å; E329-K333 WeakPolarHBondContact OE1-CE 2.92Å; E329-K333 IonicContact OE1-NZ 3.33Å; E329-K333 PolarHBondContact OE1-NZ 3.04Å; E329-K333 VanDerWaalsContact OE1-NZ 3.12Å; K333-I335 PolarHBondContact O-N 3.21Å; K333-F336 WeakPolarHBondContact O-CB 3.41Å; K333-F336 PolarHBondContact O-N 3.2Å; K333-W337 VanDerWaalsContact O-CD1 3.28Å; K333-W337 PolarHBondContact O-N 3.49Å
334F90.6Very high89Confident141 Ų14156.8 Ų56.862%0.61831%0.305SS*.Hα-helixtrans-59.9-46.7176.1177.9-95.1000111.9S330 V331 F332 F336 W337 L338S330-F334 PolarHBondContact O-N 3.1Å; V331-F334 PolarHBondContact O-N 3.29Å; F332-F334 PolarHBondContact O-N 3.17Å; F334-F336 VanDerWaalsContact C-N 3.31Å; F334-F336 PolarHBondContact O-N 3.01Å; F334-W337 PolarHBondContact O-N 3.45Å; F334-L338 HydrophobicContact CE1-CD2 4.23Å; F334-L338 WeakPolarHBondContact O-CB 3.11Å; F334-L338 PolarHBondContact O-N 3.34Å
335I91.9Very high89.4Confident10 Ų1052.6 Ų52.65%0.05127%0.268CS..Hα-helixtrans-61.3-40.8177.9-72.8163.6000111.4P311 F312 F315 V331 F332 K333 L338 G339P311-I335 HydrophobicContact CB-CG1 4.12Å; P311-I335 HydrophobicContact CB-CG2 3.95Å; F312-I335 HydrophobicContact CB-CG2 3.71Å; F312-I335 HydrophobicContact CD2-CG2 4.31Å; F312-I335 VanDerWaalsContact N-CG2 3.3Å; F315-I335 HydrophobicContact CD2-CD1 3.52Å; F315-I335 HydrophobicContact CE2-CD1 3.8Å; F315-I335 HydrophobicContact CG-CD1 4.32Å; V331-I335 HydrophobicContact CG1-CD1 3.74Å; V331-I335 HydrophobicContact CG1-CG1 4.48Å; V331-I335 WeakPolarHBondContact O-CB 3.3Å; V331-I335 WeakPolarHBondContact O-CD1 3.39Å; V331-I335 VanDerWaalsContact O-CG1 3.28Å; V331-I335 WeakPolarHBondContact O-CG1 3.47Å; V331-I335 PolarHBondContact O-N 3.16Å; F332-I335 PolarHBondContact O-N 3.23Å; K333-I335 PolarHBondContact O-N 3.21Å; I335-L338 WeakPolarHBondContact O-CB 3.47Å; I335-L338 PolarHBondContact O-N 2.97Å; I335-G339 PolarHBondContact O-N 3.29Å
336F90.2Very high89.5Confident32 Ų3247.4 Ų47.414%0.1424%0.241CC..Hα-helixtrans-62.6-52.8178.4-169.7-107.1000111.7I197 F312 F332 K333 F334 L338 G339 Y340I197-F336 HydrophobicContact CD1-CE2 3.73Å; I197-F336 HydrophobicContact CD1-CZ 4.32Å; F312-F336 HydrophobicContact CD2-CD2 4.14Å; F312-F336 AromaticContact CE2-CD2 3.67Å; F312-F336 HydrophobicContact CE2-CD2 3.67Å; F312-F336 HydrophobicContact CE2-CE2 4.16Å; F312-F336 HydrophobicContact CZ-CD2 4.41Å; F312-F336 HydrophobicContact CZ-CE2 4.5Å; F332-F336 WeakPolarHBondContact O-CB 3.43Å; F332-F336 PolarHBondContact O-N 2.95Å; K333-F336 WeakPolarHBondContact O-CB 3.41Å; K333-F336 PolarHBondContact O-N 3.2Å; F334-F336 VanDerWaalsContact C-N 3.31Å; F334-F336 PolarHBondContact O-N 3.01Å; F336-L338 VanDerWaalsContact C-N 3.28Å; F336-L338 PolarHBondContact O-N 2.89Å; F336-G339 PolarHBondContact O-N 2.76Å; F336-G339 VanDerWaalsContact O-N 3.13Å; F336-Y340 HydrophobicContact CD1-CD2 4.35Å; F336-Y340 AromaticContact CD1-CE2 3.77Å; F336-Y340 HydrophobicContact CD1-CE2 3.77Å; F336-Y340 HydrophobicContact CE1-CD2 4.24Å; F336-Y340 AromaticContact CE1-CE2 3.25Å; F336-Y340 HydrophobicContact CE1-CE2 3.25Å; F336-Y340 AromaticContact CE1-CZ 3.55Å; F336-Y340 WeakPolarHBondContact CE1-OH 3.41Å; F336-Y340 AromaticContact CZ-CE2 3.81Å; F336-Y340 HydrophobicContact CZ-CE2 3.81Å; F336-Y340 AromaticContact CZ-CZ 3.56Å; F336-Y340 WeakPolarHBondContact CZ-OH 3.2Å; F336-Y340 PolarHBondContact O-N 2.69Å
337W92.5Very high89.9Confident39 Ų3943.3 Ų43.315%0.14822%0.224CC..Hα-helixtrans-66.8-28177.3-78.4103.2000113.1L52 F55 L99 A103 K333 F334 G339 Y340 F341L52-W337 HydrophobicContact CD1-CH2 4.13Å; L52-W337 HydrophobicContact CD1-CZ2 3.8Å; L52-W337 HydrophobicContact CD2-CD2 3.96Å; L52-W337 HydrophobicContact CD2-CE3 3.83Å; L52-W337 HydrophobicContact CD2-CH2 3.58Å; L52-W337 HydrophobicContact CD2-CZ2 3.68Å; L52-W337 HydrophobicContact CD2-CZ3 3.64Å; L52-W337 HydrophobicContact CG-CH2 4.34Å; L52-W337 HydrophobicContact CG-CZ2 4.36Å; F55-W337 HydrophobicContact CD1-CE3 4.21Å; F55-W337 AromaticContact CD1-CZ3 3.84Å; F55-W337 HydrophobicContact CD1-CZ3 3.84Å; F55-W337 AromaticContact CE1-CE3 3.9Å; F55-W337 HydrophobicContact CE1-CE3 3.9Å; F55-W337 AromaticContact CE1-CZ3 3.72Å; F55-W337 HydrophobicContact CE1-CZ3 3.72Å; L99-W337 HydrophobicContact CD2-CZ3 4.33Å; A103-W337 HydrophobicContact CB-CH2 4.09Å; A103-W337 HydrophobicContact CB-CZ2 4.46Å; K333-W337 VanDerWaalsContact O-CD1 3.28Å; K333-W337 PolarHBondContact O-N 3.49Å; F334-W337 PolarHBondContact O-N 3.45Å; W337-G339 VanDerWaalsContact C-N 3.31Å; W337-G339 PolarHBondContact O-N 3.46Å; W337-Y340 HydrophobicContact CD2-CD2 4.32Å; W337-Y340 AromaticContact CE3-CD2 3.89Å; W337-Y340 HydrophobicContact CE3-CD2 3.89Å; W337-Y340 HydrophobicContact CZ3-CD2 4.08Å; W337-Y340 PolarHBondContact O-N 2.92Å; W337-F341 PolarHBondContact O-N 3.43Å
338L93.8Very high90.1Very high43 Ų4346.2 Ų46.223%0.22524%0.241CC..Hα-helixtrans-63.3-36.3172.7179.964.7000112C308 P311 F334 I335 F336 F341C308-L338 WeakPolarHBondContact CB-O 3.26Å; C308-L338 PolarHBondContact SG-O 3Å; P311-L338 HydrophobicContact CG-CD2 4.11Å; F334-L338 HydrophobicContact CE1-CD2 4.23Å; F334-L338 WeakPolarHBondContact O-CB 3.11Å; F334-L338 PolarHBondContact O-N 3.34Å; I335-L338 WeakPolarHBondContact O-CB 3.47Å; I335-L338 PolarHBondContact O-N 2.97Å; F336-L338 VanDerWaalsContact C-N 3.28Å; F336-L338 PolarHBondContact O-N 2.89Å; L338-F341 WeakPolarHBondContact O-CB 3.34Å; L338-F341 PolarHBondContact O-N 3.05Å
339G92.4Very high90.1Very high0 Ų043.4 Ų43.40%022%0.22CC..Hα-helixtrans-61.5-48.517200000111.7C308 W309 I335 F336 W337 F341 N342C308-G339 PolarHBondContact O-N 3.36Å; W309-G339 WeakPolarHBondContact CZ2-O 3.49Å; W309-G339 PolarHBondContact NE1-O 3.05Å; I335-G339 PolarHBondContact O-N 3.29Å; F336-G339 PolarHBondContact O-N 2.76Å; F336-G339 VanDerWaalsContact O-N 3.13Å; W337-G339 VanDerWaalsContact C-N 3.31Å; W337-G339 PolarHBondContact O-N 3.46Å; G339-F341 VanDerWaalsContact C-N 3.26Å; G339-F341 PolarHBondContact O-N 3.45Å; G339-N342 WeakPolarHBondContact O-CB 3.42Å; G339-N342 PolarHBondContact O-N 3.21Å
340Y93.8Very high90.3Very high2 Ų237.4 Ų37.41%0.00819%0.192CC..Hα-helixtrans-63.9-29.4176.8-64.7-25000113.8L94 V98 L99 D125 F336 W337 N342 S343L94-Y340 HydrophobicContact CD1-CE1 4.11Å; L94-Y340 HydrophobicContact CD2-CD1 3.99Å; L94-Y340 HydrophobicContact CD2-CE1 4.41Å; V98-Y340 WeakPolarHBondContact CG1-OH 3.47Å; L99-Y340 HydrophobicContact CD2-CD1 3.96Å; L99-Y340 HydrophobicContact CD2-CD2 3.33Å; L99-Y340 HydrophobicContact CD2-CE1 4.34Å; L99-Y340 HydrophobicContact CD2-CE2 3.74Å; L99-Y340 HydrophobicContact CD2-CG 3.43Å; L99-Y340 VanDerWaalsContact CD2-CG 3.43Å; D125-Y340 WeakPolarHBondContact OD1-CE1 3.37Å; D125-Y340 PolarHBondContact OD1-OH 2.82Å; D125-Y340 PolarHBondContact OD2-OH 3.3Å; F336-Y340 HydrophobicContact CD1-CD2 4.35Å; F336-Y340 AromaticContact CD1-CE2 3.77Å; F336-Y340 HydrophobicContact CD1-CE2 3.77Å; F336-Y340 HydrophobicContact CE1-CD2 4.24Å; F336-Y340 AromaticContact CE1-CE2 3.25Å; F336-Y340 HydrophobicContact CE1-CE2 3.25Å; F336-Y340 AromaticContact CE1-CZ 3.55Å; F336-Y340 WeakPolarHBondContact CE1-OH 3.41Å; F336-Y340 AromaticContact CZ-CE2 3.81Å; F336-Y340 HydrophobicContact CZ-CE2 3.81Å; F336-Y340 AromaticContact CZ-CZ 3.56Å; F336-Y340 WeakPolarHBondContact CZ-OH 3.2Å; F336-Y340 PolarHBondContact O-N 2.69Å; W337-Y340 HydrophobicContact CD2-CD2 4.32Å; W337-Y340 AromaticContact CE3-CD2 3.89Å; W337-Y340 HydrophobicContact CE3-CD2 3.89Å; W337-Y340 HydrophobicContact CZ3-CD2 4.08Å; W337-Y340 PolarHBondContact O-N 2.92Å; Y340-N342 PolarHBondContact O-N 3.43Å; Y340-N342 VanDerWaalsContact O-N 3.1Å; Y340-S343 WeakPolarHBondContact O-CB 3.49Å; Y340-S343 PolarHBondContact O-N 3.01Å
341F92.3Very high90.4Very high97 Ų9734 Ų3443%0.42517%0.167SC..Hα-helixtrans-58.4-24.3176.7-173.3-106.7000112.8F55 W337 L338 G339 S343 C344 I345F55-F341 HydrophobicContact CD2-CD2 4.28Å; F55-F341 HydrophobicContact CE2-CB 4.27Å; F55-F341 AromaticContact CE2-CD2 3.69Å; F55-F341 HydrophobicContact CE2-CD2 3.69Å; F55-F341 HydrophobicContact CE2-CG 4.44Å; W337-F341 PolarHBondContact O-N 3.43Å; L338-F341 WeakPolarHBondContact O-CB 3.34Å; L338-F341 PolarHBondContact O-N 3.05Å; G339-F341 VanDerWaalsContact C-N 3.26Å; G339-F341 PolarHBondContact O-N 3.45Å; F341-S343 PolarHBondContact O-N 3.04Å; F341-C344 HydrophobicContact CD2-CB 4.47Å; F341-C344 WeakPolarHBondContact O-CB 3.3Å; F341-C344 PolarHBondContact O-N 2.92Å; F341-I345 HydrophobicContact CD1-CD1 3.44Å; F341-I345 VanDerWaalsContact CD1-CD1 3.44Å; F341-I345 HydrophobicContact CD1-CG1 3.71Å; F341-I345 HydrophobicContact CE1-CD1 3.48Å; F341-I345 VanDerWaalsContact CE1-CD1 3.48Å; F341-I345 HydrophobicContact CE1-CG1 3.46Å; F341-I345 VanDerWaalsContact CE1-CG1 3.46Å; F341-I345 HydrophobicContact CZ-CG1 4.14Å; F341-I345 WeakPolarHBondContact O-CG1 3.44Å; F341-I345 PolarHBondContact O-N 3.31Å
342N91.3Very high90.1Very high1 Ų136 Ų361%0.00518%0.183CC..Hα-helixtrans-52-39.9172-173.664.1000113.2C308 W309 G339 Y340 C344 I345 N346C308-N342 HydrophobicContact CB-CB 4Å; W309-N342 PolarHBondContact NE1-ND2 2.65Å; G339-N342 WeakPolarHBondContact O-CB 3.42Å; G339-N342 PolarHBondContact O-N 3.21Å; Y340-N342 PolarHBondContact O-N 3.43Å; Y340-N342 VanDerWaalsContact O-N 3.1Å; N342-C344 PolarHBondContact O-N 2.85Å; N342-I345 PolarHBondContact O-N 2.87Å; N342-I345 VanDerWaalsContact O-N 3.16Å; N342-N346 PolarHBondContact O-N 3.27Å; N342-N346 PolarHBondContact O-ND2 2.8Å
343S91Very high89.7Confident1 Ų134.8 Ų34.81%0.00718%0.18CC..Hα-helixtrans-65.8-25-179.7-59.70000113.3N63 L94 Y340 F341 P347N63-S343 PolarHBondContact ND2-O 3.32Å; L94-S343 WeakPolarHBondContact CD2-OG 3.16Å; Y340-S343 WeakPolarHBondContact O-CB 3.49Å; Y340-S343 PolarHBondContact O-N 3.01Å; F341-S343 PolarHBondContact O-N 3.04Å; S343-P347 VanDerWaalsContact O-CD 3.28Å; S343-P347 WeakPolarHBondContact O-CD 3.44Å
344C91.7Very high89.3Confident9 Ų932.5 Ų32.56%0.06117%0.173CC..Hα-helixtrans-85.1-29.9175.3-69.70000112.6F55 V58 A59 F341 N342F55-C344 HydrophobicContact CE2-CB 4.11Å; F55-C344 WeakPolarHBondContact CE2-SG 3.49Å; V58-C344 HydrophobicContact CG1-CB 4.49Å; A59-C344 VanDerWaalsContact CB-SG 3.52Å; F341-C344 HydrophobicContact CD2-CB 4.47Å; F341-C344 WeakPolarHBondContact O-CB 3.3Å; F341-C344 PolarHBondContact O-N 2.92Å; N342-C344 PolarHBondContact O-N 2.85Å
345I91.1Very high88.9Confident15 Ų1531.2 Ų31.28%0.07717%0.168CC..Hα-helixtrans-69-41.3-179.6-69.4172000110.8M304 C308 F341 N342 V348 I349M304-I345 HydrophobicContact CB-CD1 4.3Å; M304-I345 HydrophobicContact CB-CG2 4.03Å; M304-I345 HydrophobicContact CE-CD1 3.75Å; M304-I345 HydrophobicContact CG-CG2 4.24Å; C308-I345 VanDerWaalsContact SG-CD1 3.56Å; F341-I345 HydrophobicContact CD1-CD1 3.44Å; F341-I345 VanDerWaalsContact CD1-CD1 3.44Å; F341-I345 HydrophobicContact CD1-CG1 3.71Å; F341-I345 HydrophobicContact CE1-CD1 3.48Å; F341-I345 VanDerWaalsContact CE1-CD1 3.48Å; F341-I345 HydrophobicContact CE1-CG1 3.46Å; F341-I345 VanDerWaalsContact CE1-CG1 3.46Å; F341-I345 HydrophobicContact CZ-CG1 4.14Å; F341-I345 WeakPolarHBondContact O-CG1 3.44Å; F341-I345 PolarHBondContact O-N 3.31Å; N342-I345 PolarHBondContact O-N 2.87Å; N342-I345 VanDerWaalsContact O-N 3.16Å; I345-V348 WeakPolarHBondContact O-CB 3.22Å; I345-V348 PolarHBondContact O-N 2.62Å; I345-I349 HydrophobicContact CG2-CD1 3.25Å; I345-I349 HydrophobicContact CG2-CG1 3.64Å; I345-I349 WeakPolarHBondContact O-CG1 3.45Å; I345-I349 PolarHBondContact O-N 3.19Å
346N87.5Confident88.6Confident1 Ų134.1 Ų34.11%0.00518%0.181CC..Hα-helixtrans-53.8-53.1-173.9-71.3-28000112.8D91 N342 V348 I349 Y350D91-N346 PolarHBondContact OD2-ND2 2.9Å; N342-N346 PolarHBondContact O-N 3.27Å; N342-N346 PolarHBondContact O-ND2 2.8Å; N346-V348 PolarHBondContact O-N 2.83Å; N346-I349 PolarHBondContact O-N 3.12Å; N346-Y350 HydrophobicContact CB-CE2 4.1Å; N346-Y350 WeakPolarHBondContact O-CD2 3.4Å; N346-Y350 WeakPolarHBondContact O-CE2 3.3Å; N346-Y350 PolarHBondContact O-N 3.41Å
347P90.6Very high88.4Confident9 Ų933 Ų336%0.05818%0.176CC..Hα-helixtrans-60.8-22.8175.2-26.536000115.9G62 V66 S343 P351G62-P347 VanDerWaalsContact C-CB 3.49Å; V66-P347 HydrophobicContact CG2-CB 3.95Å; V66-P347 HydrophobicContact CG2-CG 4.11Å; S343-P347 VanDerWaalsContact O-CD 3.28Å; S343-P347 WeakPolarHBondContact O-CD 3.44Å; P347-P351 WeakPolarHBondContact O-CD 3.46Å; P347-P351 VanDerWaalsContact O-CG 3.3Å; P347-P351 WeakPolarHBondContact O-CG 3.47Å
348V90.4Very high88.1Confident87 Ų8736 Ų3653%0.52719%0.192SC..Hα-helixtrans-83.7-38.2177.7177.90000110.9I345 N346 P351 C352I345-V348 WeakPolarHBondContact O-CB 3.22Å; I345-V348 PolarHBondContact O-N 2.62Å; N346-V348 PolarHBondContact O-N 2.83Å; V348-P351 WeakPolarHBondContact O-CD 3.28Å; V348-C352 WeakPolarHBondContact O-CB 3.4Å; V348-C352 PolarHBondContact O-N 2.94Å; V348-C352 PolarHBondContact O-SG 3.47Å
349I88.6Confident87.8Confident16 Ų1640.8 Ų40.88%0.08221%0.207CC..Hα-helixtrans-66-45.7-179-65.1177.4000110.9I300 V301 M304 I345 N346 C352 S353I300-I349 HydrophobicContact CG2-CD1 4.27Å; V301-I349 HydrophobicContact CB-CD1 4.39Å; V301-I349 HydrophobicContact CG2-CB 4.16Å; V301-I349 HydrophobicContact CG2-CD1 4Å; V301-I349 HydrophobicContact CG2-CG2 3.49Å; V301-I349 VanDerWaalsContact CG2-CG2 3.49Å; M304-I349 HydrophobicContact CB-CD1 4.27Å; M304-I349 HydrophobicContact CG-CD1 4.02Å; I345-I349 HydrophobicContact CG2-CD1 3.25Å; I345-I349 HydrophobicContact CG2-CG1 3.64Å; I345-I349 WeakPolarHBondContact O-CG1 3.45Å; I345-I349 PolarHBondContact O-N 3.19Å; N346-I349 PolarHBondContact O-N 3.12Å; I349-C352 PolarHBondContact O-N 3.42Å; I349-S353 WeakPolarHBondContact O-CB 3.24Å; I349-S353 PolarHBondContact O-N 3.2Å; I349-S353 PolarHBondContact O-OG 3.03Å
350Y86.8Confident87.6Confident6 Ų640.9 Ų40.92%0.02421%0.208CC..Hα-helixtrans-59.5-47-172.3-53.6-52.5000113.9V66 I84 L87 V301 N346 S353 S354V66-Y350 HydrophobicContact CG1-CD2 4.19Å; V66-Y350 HydrophobicContact CG1-CE2 4.26Å; V66-Y350 HydrophobicContact CG2-CD2 3.88Å; V66-Y350 HydrophobicContact CG2-CE2 4.31Å; I84-Y350 HydrophobicContact CD1-CE1 4.33Å; I84-Y350 HydrophobicContact CG2-CD2 4.14Å; I84-Y350 HydrophobicContact CG2-CE1 4.13Å; I84-Y350 HydrophobicContact CG2-CE2 3.61Å; L87-Y350 WeakPolarHBondContact CD2-OH 3.43Å; V301-Y350 HydrophobicContact CG2-CE1 4.18Å; N346-Y350 HydrophobicContact CB-CE2 4.1Å; N346-Y350 WeakPolarHBondContact O-CD2 3.4Å; N346-Y350 WeakPolarHBondContact O-CE2 3.3Å; N346-Y350 PolarHBondContact O-N 3.41Å; Y350-S353 PolarHBondContact O-N 3Å; Y350-S353 PolarHBondContact O-OG 3Å; Y350-S354 PolarHBondContact O-N 3.42Å
351P87Confident87.3Confident21 Ų2141.7 Ų41.714%0.13621%0.211CC..Hα-helixtrans-68.3-34.5175.9-21.235.2000113.8P347 V348 S353 Q358 F361P347-P351 WeakPolarHBondContact O-CD 3.46Å; P347-P351 VanDerWaalsContact O-CG 3.3Å; P347-P351 WeakPolarHBondContact O-CG 3.47Å; V348-P351 WeakPolarHBondContact O-CD 3.28Å; P351-S353 VanDerWaalsContact C-N 3.25Å; P351-S353 PolarHBondContact O-N 3.37Å; P351-Q358 WeakPolarHBondContact O-CB 3.28Å; P351-F361 HydrophobicContact CB-CD1 4.46Å; P351-F361 HydrophobicContact CB-CG 4.45Å; P351-F361 HydrophobicContact CG-CD1 3.59Å; P351-F361 HydrophobicContact CG-CD2 4.04Å; P351-F361 HydrophobicContact CG-CE1 3.61Å; P351-F361 HydrophobicContact CG-CE2 4.06Å; P351-F361 HydrophobicContact CG-CG 3.81Å; P351-F361 HydrophobicContact CG-CZ 3.86Å
352C84.9Confident87.1Confident109 Ų10939.7 Ų39.774%0.73621%0.207SC*.Hα-helixtrans-69.5-27178.9-720000112.6V348 I349V348-C352 WeakPolarHBondContact O-CB 3.4Å; V348-C352 PolarHBondContact O-N 2.94Å; V348-C352 PolarHBondContact O-SG 3.47Å; I349-C352 PolarHBondContact O-N 3.42Å
353S77.3Confident86.8Confident22 Ų2244.8 Ų44.815%0.15423%0.226CC..Hα-helixtrans-107.5-29.8-168.267.70000113.1T297 I349 Y350 P351T297-S353 WeakPolarHBondContact CG2-OG 3.44Å; T297-S353 VanDerWaalsContact OG1-CB 3.22Å; T297-S353 WeakPolarHBondContact OG1-CB 3.34Å; T297-S353 PolarHBondContact OG1-O 3Å; I349-S353 WeakPolarHBondContact O-CB 3.24Å; I349-S353 PolarHBondContact O-N 3.2Å; I349-S353 PolarHBondContact O-OG 3.03Å; Y350-S353 PolarHBondContact O-N 3Å; Y350-S353 PolarHBondContact O-OG 3Å; P351-S353 VanDerWaalsContact C-N 3.25Å; P351-S353 PolarHBondContact O-N 3.37Å
354S80.6Confident86.6Confident22 Ų2245.8 Ų45.815%0.15423%0.231CC..  trans-116.5122.8175.3165.80000111.5Y350 E356 F357 Q358Y350-S354 PolarHBondContact O-N 3.42Å; S354-E356 PolarHBondContact O-N 2.91Å; S354-E356 PolarHBondContact OG-N 3.43Å; S354-E356 PolarHBondContact OG-OE2 3.3Å; S354-F357 PolarHBondContact O-N 3.42Å; S354-F357 PolarHBondContact OG-N 2.85Å; S354-Q358 WeakPolarHBondContact O-CB 3.39Å; S354-Q358 PolarHBondContact O-N 3.48Å
355K82.3Confident86.3Confident114 Ų11451.4 Ų51.450%0.49626%0.26SS..Hα-helixtrans-65.4-27.1175.5-70.1-171.6175.2-1760111.5R359K355-R359 WeakPolarHBondContact O-CB 3.44Å; K355-R359 WeakPolarHBondContact O-CD 3.43Å; K355-R359 WeakPolarHBondContact O-CG 3.36Å; K355-R359 PolarHBondContact O-N 2.87Å
356E84.8Confident86Confident71 Ų7158.8 Ų58.833%0.33229%0.287SS..Hα-helixtrans-69.1-47.8178.6-57.572.4-161.600110.6L76 S354 R359 A360L76-E356 HydrophobicContact CD2-CB 3.76Å; S354-E356 PolarHBondContact O-N 2.91Å; S354-E356 PolarHBondContact OG-N 3.43Å; S354-E356 PolarHBondContact OG-OE2 3.3Å; E356-R359 PolarHBondContact O-N 2.03Å; E356-A360 PolarHBondContact O-N 3.13Å; E356-A360 VanDerWaalsContact O-N 3.11Å
357F85.2Confident85.5Confident9 Ų963.8 Ų63.84%0.03932%0.321CS..Hα-helixtrans-64-43.5171.9-83.3-77.8000111.8S69 V70 I84 S354 R359 A360 F361S69-F357 WeakPolarHBondContact OG-CD1 3.37Å; S69-F357 WeakPolarHBondContact OG-CE1 3.41Å; V70-F357 HydrophobicContact CG2-CE1 3.81Å; V70-F357 HydrophobicContact CG2-CZ 4.11Å; I84-F357 HydrophobicContact CD1-CE2 4.31Å; I84-F357 HydrophobicContact CD1-CZ 4.23Å; S354-F357 PolarHBondContact O-N 3.42Å; S354-F357 PolarHBondContact OG-N 2.85Å; F357-R359 VanDerWaalsContact C-N 3.33Å; F357-R359 PolarHBondContact O-N 3.08Å; F357-A360 WeakPolarHBondContact O-CB 3.01Å; F357-A360 PolarHBondContact O-N 3.36Å; F357-A360 VanDerWaalsContact O-N 3.09Å; F357-F361 HydrophobicContact CD1-CE2 4.35Å; F357-F361 WeakPolarHBondContact O-CD2 3.28Å; F357-F361 PolarHBondContact O-N 3.3Å
358Q87.8Confident84.6Confident101 Ų10167.4 Ų67.447%0.47234%0.337SS..Hα-helixtrans-53.5-49176.3-164.8-174.612.400112.4P351 S354 A360 F361 T362P351-Q358 WeakPolarHBondContact O-CB 3.28Å; S354-Q358 WeakPolarHBondContact O-CB 3.39Å; S354-Q358 PolarHBondContact O-N 3.48Å; Q358-A360 VanDerWaalsContact C-N 3.34Å; Q358-A360 PolarHBondContact O-N 3.36Å; Q358-F361 PolarHBondContact O-N 3.44Å; Q358-T362 PolarHBondContact O-N 3.23Å; Q358-T362 PolarHBondContact O-OG1 2.93Å
359R87.5Confident83.1Confident144 Ų14464.6 Ų64.654%0.54332%0.321SS..Hα-helixtrans-64.8-38.7178.2-71.8167.7-173.9163.1-1.3111.9K355 E356 F357 R363K355-R359 WeakPolarHBondContact O-CB 3.44Å; K355-R359 WeakPolarHBondContact O-CD 3.43Å; K355-R359 WeakPolarHBondContact O-CG 3.36Å; K355-R359 PolarHBondContact O-N 2.87Å; E356-R359 PolarHBondContact O-N 2.03Å; F357-R359 VanDerWaalsContact C-N 3.33Å; F357-R359 PolarHBondContact O-N 3.08Å; R359-R363 WeakPolarHBondContact O-CB 3.31Å; R359-R363 VanDerWaalsContact O-CG 3.26Å; R359-R363 WeakPolarHBondContact O-CG 3.26Å; R359-R363 PolarHBondContact O-N 3.41Å
360A87.3Confident81.6Confident2 Ų269.8 Ų69.82%0.01735%0.345CS..Hα-helixtrans-64.6-45.8177.100000111.6N73 L76 E356 F357 Q358 R363 L364N73-A360 VanDerWaalsContact ND2-CB 3.32Å; N73-A360 WeakPolarHBondContact ND2-CB 3Å; L76-A360 HydrophobicContact CD1-CB 3.64Å; E356-A360 PolarHBondContact O-N 3.13Å; E356-A360 VanDerWaalsContact O-N 3.11Å; F357-A360 WeakPolarHBondContact O-CB 3.01Å; F357-A360 PolarHBondContact O-N 3.36Å; F357-A360 VanDerWaalsContact O-N 3.09Å; Q358-A360 VanDerWaalsContact C-N 3.34Å; Q358-A360 PolarHBondContact O-N 3.36Å; A360-R363 PolarHBondContact O-N 2.86Å; A360-L364 WeakPolarHBondContact O-CG 3.41Å; A360-L364 PolarHBondContact O-N 2.98Å
361F88.4Confident80Confident19 Ų1976.1 Ų76.18%0.08337%0.374CS..Hα-helixtrans-60-48.6175-89.2-123.1000111.6L65 V66 P351 F357 Q358 R363 L364 L365L65-F361 HydrophobicContact CB-CD1 4.28Å; L65-F361 HydrophobicContact CB-CE1 3.68Å; L65-F361 HydrophobicContact CB-CZ 3.82Å; L65-F361 HydrophobicContact CD1-CD1 4.4Å; L65-F361 HydrophobicContact CD1-CE1 4.24Å; V66-F361 HydrophobicContact CB-CZ 4.5Å; V66-F361 HydrophobicContact CG2-CE2 4.43Å; V66-F361 HydrophobicContact CG2-CZ 3.78Å; P351-F361 HydrophobicContact CB-CD1 4.46Å; P351-F361 HydrophobicContact CB-CG 4.45Å; P351-F361 HydrophobicContact CG-CD1 3.59Å; P351-F361 HydrophobicContact CG-CD2 4.04Å; P351-F361 HydrophobicContact CG-CE1 3.61Å; P351-F361 HydrophobicContact CG-CE2 4.06Å; P351-F361 HydrophobicContact CG-CG 3.81Å; P351-F361 HydrophobicContact CG-CZ 3.86Å; F357-F361 HydrophobicContact CD1-CE2 4.35Å; F357-F361 WeakPolarHBondContact O-CD2 3.28Å; F357-F361 PolarHBondContact O-N 3.3Å; Q358-F361 PolarHBondContact O-N 3.44Å; F361-R363 VanDerWaalsContact C-N 3.26Å; F361-R363 PolarHBondContact O-N 3.44Å; F361-L364 WeakPolarHBondContact O-CB 3.47Å; F361-L364 PolarHBondContact O-N 3.48Å; F361-L364 VanDerWaalsContact O-N 3.13Å; F361-L365 WeakPolarHBondContact O-CG 3.45Å; F361-L365 PolarHBondContact O-N 3.22Å
362T86.1Confident78.3Confident55 Ų5581.1 Ų81.134%0.33739%0.394SS..Hα-helixtrans-60.5-36.4178.1-56.70000112Q358 R366Q358-T362 PolarHBondContact O-N 3.23Å; Q358-T362 PolarHBondContact O-OG1 2.93Å; T362-R366 WeakPolarHBondContact O-CB 3.35Å; T362-R366 VanDerWaalsContact O-CG 3.24Å; T362-R366 WeakPolarHBondContact O-CG 3.47Å; T362-R366 PolarHBondContact O-N 2.91Å; T362-R366 VanDerWaalsContact O-N 3.12Å
363R85.2Confident76.8Confident107 Ų10783.7 Ų83.740%0.40439%0.388SS..Hα-helixtrans-69-38.9176-75.7171.7-178167.63112.6R359 A360 F361 R366 C367 Q368R359-R363 WeakPolarHBondContact O-CB 3.31Å; R359-R363 VanDerWaalsContact O-CG 3.26Å; R359-R363 WeakPolarHBondContact O-CG 3.26Å; R359-R363 PolarHBondContact O-N 3.41Å; A360-R363 PolarHBondContact O-N 2.86Å; F361-R363 VanDerWaalsContact C-N 3.26Å; F361-R363 PolarHBondContact O-N 3.44Å; R363-R366 CarbonylContact O-C 3.53Å; R363-R366 PolarHBondContact O-N 2.88Å; R363-C367 PolarHBondContact O-N 3.47Å; R363-Q368 PolarHBondContact O-N 2.7Å
364L86.8Confident75.6Confident23 Ų2389.7 Ų89.712%0.1241%0.407CS..Hα-helixtrans-64.5-48.2176.4-80.5164.5000111.3L65 L68 A360 F361 R366 C367 C369L65-L364 HydrophobicContact CD2-CB 4.34Å; L65-L364 HydrophobicContact CD2-CD1 4.48Å; L68-L364 HydrophobicContact CB-CD1 3.93Å; L68-L364 HydrophobicContact CB-CD2 3.96Å; A360-L364 WeakPolarHBondContact O-CG 3.41Å; A360-L364 PolarHBondContact O-N 2.98Å; F361-L364 WeakPolarHBondContact O-CB 3.47Å; F361-L364 PolarHBondContact O-N 3.48Å; F361-L364 VanDerWaalsContact O-N 3.13Å; L364-R366 PolarHBondContact O-N 2.95Å; L364-C367 WeakPolarHBondContact O-CA 3.47Å; L364-C367 PolarHBondContact O-N 3.34Å; L364-C369 HydrophobicContact CD2-CB 4.16Å; L364-C369 WeakPolarHBondContact CD2-SG 3.45Å
365L85.4Confident74.4Confident126 Ų12693 Ų9366%0.6643%0.426SS*.Hα-helixtrans-63.7-26.7177-67.2172.9000112.7L65 F361 C367L65-L365 HydrophobicContact CD1-CD2 4.45Å; F361-L365 WeakPolarHBondContact O-CG 3.45Å; F361-L365 PolarHBondContact O-N 3.22Å; L365-C367 VanDerWaalsContact C-N 3.28Å
366R86.3Confident73.1Confident171 Ų17190.7 Ų90.765%0.64542%0.419SS*.THydrogen-bonded Turntrans-86.38.6171.4-67.9177.3-177.3-170.21113.5T362 R363 L364 Q368T362-R366 WeakPolarHBondContact O-CB 3.35Å; T362-R366 VanDerWaalsContact O-CG 3.24Å; T362-R366 WeakPolarHBondContact O-CG 3.47Å; T362-R366 PolarHBondContact O-N 2.91Å; T362-R366 VanDerWaalsContact O-N 3.12Å; R363-R366 CarbonylContact O-C 3.53Å; R363-R366 PolarHBondContact O-N 2.88Å; L364-R366 PolarHBondContact O-N 2.95Å; R366-Q368 HydrophobicContact CB-CG 3.95Å; R366-Q368 WeakPolarHBondContact O-CG 3.2Å; R366-Q368 PolarHBondContact O-N 2.97Å; R366-Q368 VanDerWaalsContact O-N 3.08Å
367C77.4Confident71.6Confident106 Ų10696.3 Ų96.372%0.71644%0.437SS*.THydrogen-bonded Turntrans55.322.8-178.5-61.10000115.1R363 L364 L365 C369R363-C367 PolarHBondContact O-N 3.47Å; L364-C367 WeakPolarHBondContact O-CA 3.47Å; L364-C367 PolarHBondContact O-N 3.34Å; L365-C367 VanDerWaalsContact C-N 3.28Å; C367-C369 VanDerWaalsContact C-N 3.27Å; C367-C369 PolarHBondContact O-N 3.26Å
368Q70Confident70Confident84 Ų84103.7 Ų103.739%0.39347%0.465SS..THydrogen-bonded Turntrans-80.6-3-174.1-65.3-176.8-9.600113.9R363 R366 H370 Q371R363-Q368 PolarHBondContact O-N 2.7Å; R366-Q368 HydrophobicContact CB-CG 3.95Å; R366-Q368 WeakPolarHBondContact O-CG 3.2Å; R366-Q368 PolarHBondContact O-N 2.97Å; R366-Q368 VanDerWaalsContact O-N 3.08Å; Q368-H370 VanDerWaalsContact C-N 3.26Å; Q368-H370 PolarHBondContact O-N 3.3Å; Q368-Q371 PolarHBondContact O-N 2.98Å
369C59.8Low68.7Low29 Ų29105.4 Ų105.420%0.19647%0.471CS..Hα-helixtrans-65-28.2179.7-730000113.3C72 L364 C367 Q371C72-C369 HydrophobicContact CB-CB 4.28Å; L364-C369 HydrophobicContact CD2-CB 4.16Å; L364-C369 WeakPolarHBondContact CD2-SG 3.45Å; C367-C369 VanDerWaalsContact C-N 3.27Å; C367-C369 PolarHBondContact O-N 3.26Å; C369-Q371 PolarHBondContact O-N 3.49Å
370H56.1Low67Low125 Ų125105.9 Ų105.958%0.57947%0.474SS*.Hα-helixtrans-70-30.3177.2-111.3-60.5000113.5Q368 R374Q368-H370 VanDerWaalsContact C-N 3.26Å; Q368-H370 PolarHBondContact O-N 3.3Å; H370-R374 WeakPolarHBondContact O-CB 3.28Å; H370-R374 VanDerWaalsContact O-CG 3.26Å; H370-R374 WeakPolarHBondContact O-CG 3.48Å; H370-R374 PolarHBondContact O-N 3.48Å; H370-R374 VanDerWaalsContact O-N 3.09Å
371Q54.3Low65.7Low139 Ų139109.2 Ų109.265%0.6549%0.491SS*.Hα-helixtrans-68.8-38.6-175.8-121.7164-13.600111.5Q368 C369 V375Q368-Q371 PolarHBondContact O-N 2.98Å; C369-Q371 PolarHBondContact O-N 3.49Å; Q371-V375 VanDerWaalsContact O-CG2 3.26Å; Q371-V375 WeakPolarHBondContact O-CG2 3.33Å; Q371-V375 PolarHBondContact O-N 3.5Å
372K51.9Low64.4Low126 Ų126114.4 Ų114.455%0.54852%0.516SS..Hα-helixtrans-75.8-38.7-178.6-138178-174.6-1760113.4V375 L376K372-V375 PolarHBondContact O-N 2.95Å; K372-L376 PolarHBondContact O-N 3.45Å
373R53.3Low63.1Low163 Ų163120.1 Ų120.162%0.61553%0.531SS*.Hα-helixtrans-65.7-38.2172.2-91.9-174.3179-176.20.4111.8R377R373-R377 WeakPolarHBondContact O-CB 3.4Å; R373-R377 PolarHBondContact O-N 3.48Å
374R51.7Low61.4Low147 Ų147123.7 Ų123.756%0.55555%0.545SS*.Hα-helixtrans-66-40.9174.8-74.9179.4-170.1179.76112.4H370 R378H370-R374 WeakPolarHBondContact O-CB 3.28Å; H370-R374 VanDerWaalsContact O-CG 3.26Å; H370-R374 WeakPolarHBondContact O-CG 3.48Å; H370-R374 PolarHBondContact O-N 3.48Å; H370-R374 VanDerWaalsContact O-N 3.09Å; R374-R378 WeakPolarHBondContact O-CB 3.49Å; R374-R378 VanDerWaalsContact O-CG 3.25Å; R374-R378 WeakPolarHBondContact O-CG 3.21Å; R374-R378 PolarHBondContact O-N 2.83Å
375V54.7Low59.8Low91 Ų91130 Ų13055%0.55257%0.567SS**Hα-helixtrans-66.3-44.3176.7171.20000111.3Q371 K372 R378 F379Q371-V375 VanDerWaalsContact O-CG2 3.26Å; Q371-V375 WeakPolarHBondContact O-CG2 3.33Å; Q371-V375 PolarHBondContact O-N 3.5Å; K372-V375 PolarHBondContact O-N 2.95Å; V375-R378 PolarHBondContact O-N 3.26Å; V375-F379 WeakPolarHBondContact O-CB 3.41Å; V375-F379 PolarHBondContact O-N 2.98Å
376L55.3Low58.9Low66 Ų66128.4 Ų128.435%0.34656%0.563SS.*Hα-helixtrans-62.8-45.2175.3-111.697000111.9K372 R378 F379 Y380K372-L376 PolarHBondContact O-N 3.45Å; L376-R378 VanDerWaalsContact C-N 3.33Å; L376-R378 PolarHBondContact O-N 3.1Å; L376-F379 PolarHBondContact O-N 3.33Å; L376-Y380 HydrophobicContact CD2-CD2 4.5Å; L376-Y380 HydrophobicContact CD2-CE2 4.04Å; L376-Y380 WeakPolarHBondContact O-CD2 3.32Å; L376-Y380 PolarHBondContact O-N 3.48Å
377R52.7Low57.6Low189 Ų189123 Ų12371%0.71356%0.555SS**Hα-helixtrans-60.7-42.9177.9-160.9-179.7-155.1178.77.1111.4R373 Y380 D381R373-R377 WeakPolarHBondContact O-CB 3.4Å; R373-R377 PolarHBondContact O-N 3.48Å; R377-Y380 PolarHBondContact O-N 3.17Å; R377-D381 VanDerWaalsContact O-CB 3.31Å; R377-D381 WeakPolarHBondContact O-CB 3.5Å; R377-D381 PolarHBondContact O-N 3.4Å
378R52Low56.7Low165 Ų165121 Ų12162%0.62354%0.539SS*.Hα-helixtrans-63.2-40.5174.1-74.5178.2-171.3179.91112.4R374 V375 L376 D381 Q382R374-R378 WeakPolarHBondContact O-CB 3.49Å; R374-R378 VanDerWaalsContact O-CG 3.25Å; R374-R378 WeakPolarHBondContact O-CG 3.21Å; R374-R378 PolarHBondContact O-N 2.83Å; V375-R378 PolarHBondContact O-N 3.26Å; L376-R378 VanDerWaalsContact C-N 3.33Å; L376-R378 PolarHBondContact O-N 3.1Å; R378-D381 PolarHBondContact O-N 2.91Å; R378-Q382 WeakPolarHBondContact O-CB 3.34Å; R378-Q382 PolarHBondContact O-N 2.89Å
379F60.1Low56Low137 Ų137124.7 Ų124.760%0.60155%0.554SS**Hα-helixtrans-66.5-42.3178.6-164.8-93.8000112V375 L376 Q382 R383V375-F379 WeakPolarHBondContact O-CB 3.41Å; V375-F379 PolarHBondContact O-N 2.98Å; L376-F379 PolarHBondContact O-N 3.33Å; F379-Q382 PolarHBondContact O-N 3.27Å; F379-R383 WeakPolarHBondContact O-CB 3.15Å; F379-R383 PolarHBondContact O-N 3.29Å
380Y52.6Low55.4Low153 Ų153125 Ų12560%0.656%0.562SS**Hα-helixtrans-66.4-44.1173.1-86.5-83.8000112.1L376 R377 Q382 R383 W384L376-Y380 HydrophobicContact CD2-CD2 4.5Å; L376-Y380 HydrophobicContact CD2-CE2 4.04Å; L376-Y380 WeakPolarHBondContact O-CD2 3.32Å; L376-Y380 PolarHBondContact O-N 3.48Å; R377-Y380 PolarHBondContact O-N 3.17Å; Y380-Q382 VanDerWaalsContact C-N 3.26Å; Y380-Q382 PolarHBondContact O-N 3.39Å; Y380-R383 PolarHBondContact O-N 3.2Å; Y380-W384 VanDerWaalsContact O-CB 3.26Å; Y380-W384 WeakPolarHBondContact O-CB 3.33Å; Y380-W384 PolarHBondContact O-N 3.39Å
381D59.3Low55Low72 Ų72125.7 Ų125.739%0.38557%0.567SS.*Hα-helixtrans-62.1-33.7174.8-84.5-16.1000112.6R377 R378 R385R377-D381 VanDerWaalsContact O-CB 3.31Å; R377-D381 WeakPolarHBondContact O-CB 3.5Å; R377-D381 PolarHBondContact O-N 3.4Å; R378-D381 PolarHBondContact O-N 2.91Å; D381-R385 WeakPolarHBondContact O-CB 3.43Å; D381-R385 WeakPolarHBondContact O-CG 3.49Å; D381-R385 PolarHBondContact O-N 3.04Å; D381-R385 PolarHBondContact O-NE 3.31Å
382Q61.5Low54.7Low128 Ų128123.5 Ų123.560%0.59856%0.563SS**Hα-helixtrans-77.5-40.9-179.6-165.1153-4.400110.9R378 F379 Y380 R385 T386R378-Q382 WeakPolarHBondContact O-CB 3.34Å; R378-Q382 PolarHBondContact O-N 2.89Å; F379-Q382 PolarHBondContact O-N 3.27Å; Y380-Q382 VanDerWaalsContact C-N 3.26Å; Y380-Q382 PolarHBondContact O-N 3.39Å; Q382-R385 PolarHBondContact O-N 3.19Å; Q382-T386 PolarHBondContact O-N 2.97Å; Q382-T386 PolarHBondContact O-OG1 3.34Å; Q382-T386 VanDerWaalsContact O-OG1 3.07Å
383R59.4Low54.5Low176 Ų176125.9 Ų125.966%0.66457%0.569SS**Hα-helixtrans-65.4-40.1172.9-170.9171.4-178.2165.40.3112.5F379 Y380 T386 A387F379-R383 WeakPolarHBondContact O-CB 3.15Å; F379-R383 PolarHBondContact O-N 3.29Å; Y380-R383 PolarHBondContact O-N 3.2Å; R383-T386 VanDerWaalsContact CA-OG1 3.29Å; R383-T386 WeakPolarHBondContact CA-OG1 3.33Å; R383-T386 PolarHBondContact O-N 2.95Å; R383-T386 PolarHBondContact O-OG1 2.84Å; R383-A387 WeakPolarHBondContact O-CB 3.31Å; R383-A387 PolarHBondContact O-N 3.28Å
384W48.6Very low54Low181 Ų181124.4 Ų124.469%0.68657%0.573SS**Hα-helixtrans-61-47.9172.6176.2-105.5000111.2Y380 T386 A387 V388Y380-W384 VanDerWaalsContact O-CB 3.26Å; Y380-W384 WeakPolarHBondContact O-CB 3.33Å; Y380-W384 PolarHBondContact O-N 3.39Å; W384-T386 PolarHBondContact O-N 2.91Å; W384-A387 PolarHBondContact O-N 3.31Å; W384-V388 HydrophobicContact CD2-CG2 4.13Å; W384-V388 HydrophobicContact CG-CG2 4.49Å; W384-V388 HydrophobicContact CZ2-CG2 4.03Å; W384-V388 VanDerWaalsContact O-CG2 3.31Å; W384-V388 WeakPolarHBondContact O-CG2 3.35Å; W384-V388 PolarHBondContact O-N 3.48Å
385R54.4Low53.4Low155 Ų155125.1 Ų125.159%0.58558%0.583SS**Hα-helixtrans-63.2-36.2177-83.5-174.7-84.2-140.7-2.4113.8D381 Q382 K389D381-R385 WeakPolarHBondContact O-CB 3.43Å; D381-R385 WeakPolarHBondContact O-CG 3.49Å; D381-R385 PolarHBondContact O-N 3.04Å; D381-R385 PolarHBondContact O-NE 3.31Å; Q382-R385 PolarHBondContact O-N 3.19Å; R385-K389 WeakPolarHBondContact O-CB 3.38Å; R385-K389 WeakPolarHBondContact O-CG 2.93Å; R385-K389 PolarHBondContact O-N 3.34Å
386T64.8Low52.5Low93 Ų93128.2 Ų128.257%0.57159%0.593SS**Hα-helixtrans-71.1-35.1174.446.90000112.5Q382 R383 W384 G390Q382-T386 PolarHBondContact O-N 2.97Å; Q382-T386 PolarHBondContact O-OG1 3.34Å; Q382-T386 VanDerWaalsContact O-OG1 3.07Å; R383-T386 VanDerWaalsContact CA-OG1 3.29Å; R383-T386 WeakPolarHBondContact CA-OG1 3.33Å; R383-T386 PolarHBondContact O-N 2.95Å; R383-T386 PolarHBondContact O-OG1 2.84Å; W384-T386 PolarHBondContact O-N 2.91Å; T386-G390 PolarHBondContact O-N 2.98Å
387A60.8Low51.6Low59 Ų59134.4 Ų134.449%0.48861%0.612SS.*Hα-helixtrans-68.8-42.2175.700000111.8R383 W384 G390 M391R383-A387 WeakPolarHBondContact O-CB 3.31Å; R383-A387 PolarHBondContact O-N 3.28Å; W384-A387 PolarHBondContact O-N 3.31Å; A387-G390 PolarHBondContact O-N 2Å; A387-M391 PolarHBondContact O-N 3.21Å; A387-M391 VanDerWaalsContact O-N 3.09Å
388V57.1Low50.8Low63 Ų63131.7 Ų131.738%0.38261%0.612SS.*Hα-helixtrans-67.6-37.1177174.80000111.8W384 M391 T392W384-V388 HydrophobicContact CD2-CG2 4.13Å; W384-V388 HydrophobicContact CG-CG2 4.49Å; W384-V388 HydrophobicContact CZ2-CG2 4.03Å; W384-V388 VanDerWaalsContact O-CG2 3.31Å; W384-V388 WeakPolarHBondContact O-CG2 3.35Å; W384-V388 PolarHBondContact O-N 3.48Å; V388-M391 PolarHBondContact O-N 2.89Å; V388-T392 PolarHBondContact O-N 2.88Å; V388-T392 PolarHBondContact O-OG1 3Å
389K54.9Low49.8Very low161 Ų161134.4 Ų134.470%0.762%0.623SS**Hα-helixtrans-71.7-27.7173.6-81.5-174174.3-171.80113.9R385 T392 R393R385-K389 WeakPolarHBondContact O-CB 3.38Å; R385-K389 WeakPolarHBondContact O-CG 2.93Å; R385-K389 PolarHBondContact O-N 3.34Å; K389-T392 WeakPolarHBondContact CA-OG1 3.01Å; K389-R393 PolarHBondContact O-N 2.94Å
390G48.7Very low48.4Very low35 Ų35132.7 Ų132.736%0.36163%0.634SS.*Hα-helixtrans-67.9-44.4171.300000111.2T386 A387 T392 R393 D394T386-G390 PolarHBondContact O-N 2.98Å; A387-G390 PolarHBondContact O-N 2Å; G390-T392 PolarHBondContact O-N 3.39Å; G390-R393 PolarHBondContact O-N 3.49Å; G390-D394 PolarHBondContact O-N 3.33Å
391M47.5Very low47.4Very low141 Ų141130.6 Ų130.670%0.69565%0.649SS**Hα-helixtrans-68.1-31.5-178.4-154131.579.400113.5A387 V388A387-M391 PolarHBondContact O-N 3.21Å; A387-M391 VanDerWaalsContact O-N 3.09Å; V388-M391 PolarHBondContact O-N 2.89Å
392T48Very low45.9Very low92 Ų92130.5 Ų130.556%0.56467%0.665SS**Hα-helixtrans-79.5-15.2175.225.50000113.9V388 K389 G390V388-T392 PolarHBondContact O-N 2.88Å; V388-T392 PolarHBondContact O-OG1 3Å; K389-T392 WeakPolarHBondContact CA-OG1 3.01Å; G390-T392 PolarHBondContact O-N 3.39Å
393R47.7Very low44.2Very low176 Ų176135.5 Ų135.566%0.66468%0.68SS**Hα-helixtrans-91.5-26.5178.6-141.6175.384.2147.53.4113.1K389 G390K389-R393 PolarHBondContact O-N 2.94Å; G390-R393 PolarHBondContact O-N 3.49Å
394D43Very low43.3Very low133 Ų133132.2 Ų132.271%0.71168%0.681SS**Hα-helixtrans-85.2-17.1175.9-71.6-19000112.9G390G390-D394 PolarHBondContact O-N 3.33Å
395Q38.2Very low42.2Very low162 Ų162132.6 Ų132.676%0.75769%0.693SS**SBendtrans-95.40.8178.9-143.2172.82000114.4
396M36.7Very low40.8Very low155 Ų155133 Ų13376%0.76470%0.701SS**SBendtrans-124.627.9-177.3-160.494.6-174.200112.6
397R35.6Very low38.9Very low197 Ų197136.8 Ų136.874%0.74371%0.712SS**SBendtrans-106.2-13.2169.9-96.8-174.6-178.4171.8-2114.4
398D35.3Very low37.1Very low132 Ų132139.1 Ų139.171%0.70673%0.725SS**SBendtrans-112.9124170.3-64.3-32.4000107.4
399Y31.8Very low35.5Very low221 Ų221142.1 Ų142.187%0.86775%0.748SS**SBendtrans99.5114.6-178.7-65.5-85.1000118
400A31.3Very low34.1Very low101 Ų101137.7 Ų137.784%0.83575%0.748SS**  trans94.692.6151.400000118.7
401A30.2Very low33Very low109 Ų109147.5 Ų147.590%0.90177%0.774SS**  trans-65146.4142.300000111
402G27.5Very low31.9Very low70 Ų70145.5 Ų145.572%0.72277%0.774SS**  trans14178.6161.700000117.8
403Y26.6Very low30.9Very low234 Ų234149.4 Ų149.492%0.91879%0.79SS**  trans54.5154.4148.6-79.9-93.2000123.2
404P41.5Very low29.9Very low106 Ų106147.9 Ų147.969%0.68879%0.794SS**  trans-108.3158.4-146.340.7-34.8000114.9
405M23.9Very low29.1Very low189 Ų189150.4 Ų150.493%0.93180%0.801SS**  trans-154.3154.7150.9-109.2-61.1143.700112.4
406H25.1Very low28.6Very low163 Ų163151.7 Ų151.776%0.75580%0.804SS**  trans-99.9174-152.1-164.1-108.7000113.2
407E25.2Very low28.1Very low173 Ų173156.2 Ų156.281%0.80881%0.813SS**  trans79.8141.7165.6-64.8-160.6136.300119.3
408S23.6Very low27.7Very low109 Ų109156.8 Ų156.876%0.76282%0.82SS**  cis-166.1165.9-11.3-174.20000108.9
409C24.1Very low27.3Very low126 Ų126159.8 Ų159.885%0.85183%0.83SS**  trans-66.8155.4-174.9-178.10000115.1
410G24.9Very low27.1Very low68 Ų68154.8 Ų154.870%0.70183%0.826SS**  trans179.682.9165.600000119.2
411R25.8Very low26.9Very low240 Ų240155.5 Ų155.591%0.90683%0.825SS**  trans52.5115.1142.4-66.9176.7-179178.40.6120
412S24.6Very low26.8Very low99 Ų99157.9 Ų157.969%0.69282%0.821SS**  63107.376.3-170.40000115
413L25.5Very low27Very low174 Ų174158.3 Ų158.391%0.91183%0.826SS**  trans-145.896.7149.4-98.2170.8000109.9
414I27.7Very low27.2Very low145 Ų145155.4 Ų155.474%0.74483%0.825SS**  trans-83.5111.7169.2-66.7171.2000107.7
415H26.1Very low26.6Very low185 Ų185159.9 Ų159.986%0.85683%0.834SS**  trans-93.1100.6165.5-128.4-55.2000110
416K27.7Very low26.9Very low190 Ų190160.3 Ų160.383%0.82683%0.831SS**  trans-64131.8161.8-90.6176.7173.6173.60108.7
417R26.9Very low27Very low249 Ų249160.4 Ų160.494%0.9484%0.836SS**  trans-127.8124.9159.8-148.7172.3-173.41711.7110
418K26.2Very low27.1Very low209 Ų209157 Ų15791%0.90983%0.831SS**  trans-60.5137.2-173.3-70.6173.6174.2177.80112
419H27.5Very low27.2Very low195 Ų195158 Ų15890%0.90383%0.827SS**  trans-72.5131.1164.4-111.5-94.9000109
420C27.2Very low27.4Very low117 Ų117161.4 Ų161.479%0.79183%0.828SS**  trans-110.7114.5167.4-145.40000107.8
421S27.3Very low27.3Very low115 Ų115163.5 Ų163.580%0.80483%0.832SS**  trans-89.2114.7174.4540000109.5
422L28.3Very low27.4Very low159 Ų159157.6 Ų157.683%0.83283%0.825SS**  trans-114.5107164.8-97.3144.9000107.8
423G30.4Very low27.5Very low79 Ų79161.7 Ų161.781%0.81484%0.838SS**PPolyproline II helixtrans-78.2116.717300000110
424L30.9Very low27.9Very low173 Ų173159.9 Ų159.991%0.90683%0.825SS**PPolyproline II helixtrans-102.1118.9168.6-106.1149.4000109
425K30.6Very low28.1Very low201 Ų201162.7 Ų162.787%0.87483%0.832SS**PPolyproline II helixtrans-61142.9178.6-71176.5178.3177.80110.4L427K425-L427 PolarHBondContact O-N 3.47Å
426K29Very low28.4Very low197 Ų197159.1 Ų159.186%0.85783%0.827SS**  trans-49.2110.4178.5-168.2-179.4-175-175.30112
427L26.4Very low28.6Very low165 Ų165153.7 Ų153.786%0.86481%0.813SS**  trans-90.2101.1163.8-152.384.2000107.9K425K425-L427 PolarHBondContact O-N 3.47Å
428S27.6Very low28.9Very low101 Ų101148.6 Ų148.671%0.70680%0.798SS**  trans-92.491.6173.654.30000109.7
429L26Very low29.2Very low131 Ų131145.6 Ų145.669%0.68679%0.788SS**  trans-104.9134.9155.9-121.582.1000106.5
430F27.7Very low29.4Very low197 Ų197144 Ų14486%0.86478%0.778SS**  trans90.196.5-175.6-50.1-69.1000116.3
431S23.5Very low29.8Very low113 Ų113145.2 Ų145.279%0.7977%0.77SS**  trans-64.6142.6161.75.70000110.7L433S431-L433 PolarHBondContact O-N 2.91Å
432P27.3Very low30.2Very low116 Ų116146.2 Ų146.275%0.75376%0.762SS**  trans-75.5114.6176.3-3.219.4000110.4Q434P432-Q434 VanDerWaalsContact C-N 3.25Å; P432-Q434 PolarHBondContact O-N 3.49Å
433L28.5Very low30.6Very low184 Ų184146 Ų14696%0.96375%0.754SS**  trans-66.785.7161-95.9152.1000109.2S431S431-L433 PolarHBondContact O-N 2.91Å
434Q33.6Very low31.2Very low136 Ų136145.7 Ų145.764%0.63674%0.737SS**  trans-106.478.8170.8-173.8172.3-32.300109.7P432P432-Q434 VanDerWaalsContact C-N 3.25Å; P432-Q434 PolarHBondContact O-N 3.49Å
435K31.5Very low31.4Very low205 Ų205142.1 Ų142.189%0.89172%0.719SS**  trans-144.388.2164.5-82.6-171.7177.6177.70109.9
436S31.8Very low31.6Very low109 Ų109137.6 Ų137.676%0.76270%0.704SS**SBendtrans-168.3-26164.4165.50000112.1F438S436-F438 PolarHBondContact O-N 3.32Å
437S32.6Very low31.9Very low77 Ų77133.5 Ų133.554%0.53869%0.691SS.*Hα-helixtrans-83.3-2.5-176.262.80000115.7
438F32Very low32.5Very low142 Ų142128.6 Ų128.662%0.62367%0.67SS**Hα-helixtrans-87.1-39.2-178.9-101.4-87000113.1S436 F440 K441 E442S436-F438 PolarHBondContact O-N 3.32Å; F438-F440 VanDerWaalsContact C-N 3.31Å; F438-F440 PolarHBondContact O-N 3.43Å; F438-K441 PolarHBondContact O-N 3Å; F438-K441 VanDerWaalsContact O-N 3.15Å; F438-E442 WeakPolarHBondContact O-CB 3.24Å; F438-E442 PolarHBondContact O-N 2.89Å
439Q33.8Very low32.9Very low146 Ų146129 Ų12968%0.68266%0.664SS**Hα-helixtrans-65.5-30.3-178.4-81.3-150.7-2300114.2K443Q439-K443 WeakPolarHBondContact O-CB 3.3Å; Q439-K443 WeakPolarHBondContact O-CG 3.37Å; Q439-K443 PolarHBondContact O-N 2.82Å
440F31.9Very low33.5Very low161 Ų161130.5 Ų130.571%0.70667%0.666SS**Hα-helixtrans-75.7-34.2176.5-169-100.7000111.8F438 V444F438-F440 VanDerWaalsContact C-N 3.31Å; F438-F440 PolarHBondContact O-N 3.43Å; F440-V444 HydrophobicContact CD1-CG2 4.22Å; F440-V444 HydrophobicContact CE1-CG2 3.95Å; F440-V444 HydrophobicContact CZ-CG2 4.25Å; F440-V444 WeakPolarHBondContact O-CB 3.32Å; F440-V444 WeakPolarHBondContact O-CG2 3.45Å; F440-V444 PolarHBondContact O-N 3.23Å; F440-V444 VanDerWaalsContact O-N 3.15Å
441K35.5Very low34.1Very low143 Ų143127.4 Ų127.462%0.62266%0.656SS**Hα-helixtrans-74.3-34.9-179.4-152.6177.1-176.7-169.20111.6F438 N445F438-K441 PolarHBondContact O-N 3Å; F438-K441 VanDerWaalsContact O-N 3.15Å; K441-N445 PolarHBondContact O-N 3.25Å; K441-N445 VanDerWaalsContact O-N 3.12Å
442E35.9Very low34.9Very low136 Ų136130.7 Ų130.764%0.63666%0.656SS**Hα-helixtrans-70.6-43.2176-155168.2-156.700111.5F438 V444 N445 D446F438-E442 WeakPolarHBondContact O-CB 3.24Å; F438-E442 PolarHBondContact O-N 2.89Å; E442-V444 VanDerWaalsContact C-N 3.3Å; E442-V444 PolarHBondContact O-N 3.12Å; E442-N445 PolarHBondContact O-N 3.14Å; E442-D446 WeakPolarHBondContact O-CB 3.34Å; E442-D446 PolarHBondContact O-N 3.14Å
443K36.4Very low35.3Very low153 Ų153128.6 Ų128.667%0.66566%0.656SS**Hα-helixtrans-63.6-31.5173.4-81.1-176.7174.8-177.70113.9Q439 L447Q439-K443 WeakPolarHBondContact O-CB 3.3Å; Q439-K443 WeakPolarHBondContact O-CG 3.37Å; Q439-K443 PolarHBondContact O-N 2.82Å; K443-L447 WeakPolarHBondContact O-CB 3.37Å; K443-L447 PolarHBondContact O-N 3.49Å
444V42.5Very low35.7Very low74 Ų74122.4 Ų122.445%0.44864%0.637SS.*Hα-helixtrans-74.5-36.6176.5168.90000111.3F440 E442 S448F440-V444 HydrophobicContact CD1-CG2 4.22Å; F440-V444 HydrophobicContact CE1-CG2 3.95Å; F440-V444 HydrophobicContact CZ-CG2 4.25Å; F440-V444 WeakPolarHBondContact O-CB 3.32Å; F440-V444 WeakPolarHBondContact O-CG2 3.45Å; F440-V444 PolarHBondContact O-N 3.23Å; F440-V444 VanDerWaalsContact O-N 3.15Å; E442-V444 VanDerWaalsContact C-N 3.3Å; E442-V444 PolarHBondContact O-N 3.12Å; V444-S448 PolarHBondContact O-N 3.41Å
445N34.5Very low35.7Very low98 Ų98123.1 Ų123.152%0.52465%0.65SS.*Hα-helixtrans-72-37.5175.6-80.41.3000112.5K441 E442 L447 S448 N449K441-N445 PolarHBondContact O-N 3.25Å; K441-N445 VanDerWaalsContact O-N 3.12Å; E442-N445 PolarHBondContact O-N 3.14Å; N445-L447 VanDerWaalsContact C-N 3.34Å; N445-L447 PolarHBondContact O-N 3.44Å; N445-S448 WeakPolarHBondContact O-CB 3.47Å; N445-S448 PolarHBondContact O-N 3.44Å; N445-N449 PolarHBondContact O-N 2.86Å
446D35.4Very low35.8Very low106 Ų106116.9 Ų116.957%0.56765%0.645SS**Hα-helixtrans-67.7-35.3178.7-155.444.6000111.9E442 N449 K450E442-D446 WeakPolarHBondContact O-CB 3.34Å; E442-D446 PolarHBondContact O-N 3.14Å; D446-N449 PolarHBondContact O-N 2.94Å; D446-K450 PolarHBondContact O-N 3.3Å; D446-K450 VanDerWaalsContact O-N 3.09Å
447L36Very low35.8Very low111 Ų111121.9 Ų121.958%0.58165%0.653SS**Hα-helixtrans-68.5-37.3172.6-144.981.4000112.1K443 N445 N449 K450 I451K443-L447 WeakPolarHBondContact O-CB 3.37Å; K443-L447 PolarHBondContact O-N 3.49Å; N445-L447 VanDerWaalsContact C-N 3.34Å; N445-L447 PolarHBondContact O-N 3.44Å; L447-N449 VanDerWaalsContact C-N 3.3Å; L447-N449 PolarHBondContact O-N 3.44Å; L447-K450 PolarHBondContact O-N 2.99Å; L447-I451 WeakPolarHBondContact O-CD1 3.45Å; L447-I451 VanDerWaalsContact O-CG1 3.29Å; L447-I451 WeakPolarHBondContact O-CG1 3.36Å; L447-I451 PolarHBondContact O-N 2.91Å
448S38.3Very low35.5Very low62 Ų62122.2 Ų122.243%0.43467%0.668SS.*Hα-helixtrans-66.8-31.5176.5-169.90000112.5V444 N445 K452V444-S448 PolarHBondContact O-N 3.41Å; N445-S448 WeakPolarHBondContact O-CB 3.47Å; N445-S448 PolarHBondContact O-N 3.44Å; S448-K452 PolarHBondContact O-N 3.48Å
449N37.1Very low35.3Very low108 Ų108122 Ų12258%0.57868%0.679SS**Hα-helixtrans-78.8-34.2176.9-72.2-16.4000112.1N445 D446 L447 I451 K452 G453N445-N449 PolarHBondContact O-N 2.86Å; D446-N449 PolarHBondContact O-N 2.94Å; L447-N449 VanDerWaalsContact C-N 3.3Å; L447-N449 PolarHBondContact O-N 3.44Å; N449-I451 VanDerWaalsContact C-N 3.33Å; N449-I451 PolarHBondContact O-N 3.36Å; N449-K452 PolarHBondContact O-N 3.12Å; N449-G453 PolarHBondContact O-N 3.2Å
450K38.1Very low35.6Very low164 Ų164120.2 Ų120.271%0.71368%0.68SS**Hα-helixtrans-66.4-31.4173.5-111.8171.9178.21700113.7D446 L447D446-K450 PolarHBondContact O-N 3.3Å; D446-K450 VanDerWaalsContact O-N 3.09Å; L447-K450 PolarHBondContact O-N 2.99Å
451I40.5Very low35.9Very low131 Ų131118.3 Ų118.367%0.67268%0.683SS**Hα-helixtrans-77.3-28.3178.3-65.7166.2000111.7L447 N449 G453L447-I451 WeakPolarHBondContact O-CD1 3.45Å; L447-I451 VanDerWaalsContact O-CG1 3.29Å; L447-I451 WeakPolarHBondContact O-CG1 3.36Å; L447-I451 PolarHBondContact O-N 2.91Å; N449-I451 VanDerWaalsContact C-N 3.33Å; N449-I451 PolarHBondContact O-N 3.36Å; I451-G453 VanDerWaalsContact C-N 3.31Å
452K39.3Very low35.4Very low182 Ų182116 Ų11679%0.79169%0.691SS**Hα-helixtrans-75.8-15.5173-84.6-174.5173.8-175.20114.1S448 N449S448-K452 PolarHBondContact O-N 3.48Å; N449-K452 PolarHBondContact O-N 3.12Å
453G36.9Very low34.8Very low72 Ų72118.2 Ų118.274%0.74271%0.706SS**THydrogen-bonded Turntrans-96.29-174.400000116.4N449 I451N449-G453 PolarHBondContact O-N 3.2Å; I451-G453 VanDerWaalsContact C-N 3.31Å
454G35.4Very low34.2Very low54 Ų54114.3 Ų114.356%0.55771%0.71SS**  trans-141.962.1-164.700000116.8
455T35.4Very low33.3Very low151 Ų151119.7 Ų119.793%0.92673%0.73SS**  trans178.3116.7153.140.20000107.9
456G31.6Very low32.9Very low75 Ų75120.5 Ų120.577%0.77374%0.738SS**  cis-164-175.8-5.300000105.6
457K32.9Very low32.4Very low214 Ų214122.7 Ų122.793%0.9375%0.75SS**  cis-172.3146.5-1.2-109-179.6175.7179.70104.1
458G27Very low31.9Very low83 Ų83123.3 Ų123.386%0.85676%0.758SS**  trans88.6129.6155.200000118.5
459T26.7Very low31.4Very low138 Ų138127.2 Ų127.285%0.84778%0.78SS**  trans-104.2170.2173.8-6.70000108.9
460P41.2Very low30.8Very low109 Ų109130 Ų13071%0.70879%0.789SS**  -136.2-147.2-57.142.6-22.6000109.7
461P37.8Very low30.2Very low120 Ų120129 Ų12978%0.77980%0.797SS**  cis-130.4166.5-22.235.1-17.1000114.6
462A24.3Very low29.4Very low95 Ų95129.1 Ų129.179%0.78580%0.803SS**  160.6124.1129.300000114
463L23.6Very low28.7Very low183 Ų183125.9 Ų125.996%0.95880%0.804SS**  trans48.4126.9134.9-137.574.9000121.8
464G23.8Very low28.2Very low71 Ų71131.6 Ų131.673%0.73281%0.814SS**  trans145.499.2152.300000117.4
465E24.5Very low27.6Very low186 Ų186132.5 Ų132.587%0.86982%0.823SS**  trans39.7127.6140.5-79.3173.9142.600124.7
466T24.4Very low27.1Very low115 Ų115132.8 Ų132.871%0.70682%0.817SS**  trans13.1131.313749.50000120.5
467D25.7Very low26.7Very low153 Ų153140.1 Ų140.182%0.81882%0.823SS**  -171.5150.8104.3-113.6-19000115.2
468T25.9Very low26.4Very low123 Ų123137.3 Ų137.376%0.75582%0.818SS**  trans-66.7142.5174.347.60000113.3
469V27.1Very low26.2Very low145 Ų145139 Ų13988%0.87982%0.817SS**  trans-141.5136.5154.6-177.50000112.1
470E25.6Very low26Very low167 Ų167137.6 Ų137.678%0.7881%0.811SS**  trans-68154.1-169.8-61.1166.5131.800115.8
471T24.4Very low25.2Very low142 Ų142141.5 Ų141.587%0.87182%0.82SS**  trans-57.5128156.538.80000112.1
472V24.2Very low24.8Very low133 Ų133144.7 Ų144.781%0.80683%0.825SS**  trans-133.1122.2160.4-1790000110.4
473S24.4Very low24.8Very low115 Ų115145.4 Ų145.480%0.80482%0.824SS**  trans-52.7145.5172-76.60000113.3
474M25.3Very low24.8Very low192 Ų192143.2 Ų143.295%0.94682%0.818SS**  trans-119113.4155.9-109.9-175.4-108.700110
475G23.9Very low24.8Very low73 Ų73149.8 Ų149.875%0.75383%0.827SS**  trans-69.1153.3178.700000113
476I25Very low24.7Very low157 Ų157148.9 Ų148.981%0.80582%0.823SS**  trans-75.2121.2172.7-63.5171.2000108
477Y23Very low24.7Very low229 Ų229153 Ų15390%0.89883%0.831SS**  trans-122.6121.1158-109.8-87.9000109.6
478N26.2Very low24.7Very low154 Ų154155.6 Ų155.682%0.82483%0.831SS**  trans-73.5132.5168.5-89.5-24.9000109.6
479S23Very low24.6Very low119 Ų119156.4 Ų156.483%0.83283%0.831SS**  trans-147.1132.3154.2-1790000109.6
480C23.6Very low24.9Very low108 Ų108156.7 Ų156.773%0.7383%0.827SS**  trans-55.7141.7179.9-168.20000112.5
481E24Very low25.2Very low191 Ų191151.9 Ų151.989%0.89382%0.815SS**  -167.7149.6123.4-110.8177.9-178.200114.4
482Q28.9Very low25.6Very low187 Ų187153.9 Ų153.987%0.87482%0.815SS**  trans-94.5108.7-162.6-170.2166.5-1.700108.2
483S24.3Very low26.1Very low110 Ų110152.9 Ų152.977%0.76981%0.813SS**  trans-127.6128.9170.255.90000111.9F485S483-F485 PolarHBondContact O-N 2.78Å
484T23Very low26.3Very low137 Ų137157.7 Ų157.784%0.8482%0.815SS**  trans-55.1117.4-174.540.30000113.9Q486T484-Q486 PolarHBondContact O-N 2.74Å
485F23.5Very low26.6Very low209 Ų209151.7 Ų151.792%0.91780%0.802SS**  trans-76.6103158.5-97.2-92.7000109S483 F487S483-F485 PolarHBondContact O-N 2.78Å; F485-F487 PolarHBondContact O-N 3.01Å
486Q23.4Very low26.9Very low167 Ų167156.4 Ų156.478%0.7881%0.809SS**  trans-67.1115.7164.5-107.6177.4-15.300109T484 Y488T484-Q486 PolarHBondContact O-N 2.74Å; Q486-Y488 PolarHBondContact O-N 3.01Å
487F23.5Very low27.1Very low201 Ų201158 Ų15888%0.88281%0.81SS**PPolyproline II helixtrans-64.9121.5162.6-108.5-98.6000108.1F485 D489F485-F487 PolarHBondContact O-N 3.01Å; F487-D489 PolarHBondContact O-N 3.17Å
488Y26.3Very low27.6Very low208 Ų208155.4 Ų155.482%0.81681%0.806SS**PPolyproline II helixtrans-72.1119.1161.4-84.6-88.5000108.3Q486Q486-Y488 PolarHBondContact O-N 3.01Å
489D24.3Very low27.9Very low140 Ų140153.7 Ų153.775%0.74980%0.801SS**PPolyproline II helixtrans-70134.1176.1-154-9.8000109.7F487 A491F487-D489 PolarHBondContact O-N 3.17Å; D489-A491 PolarHBondContact O-N 3.4Å
490L33.3Very low28.3Very low151 Ų151155.5 Ų155.579%0.79180%0.802SS**THydrogen-bonded Turntrans-77.19.9-171.7-138.391000112.7
491A31Very low28.9Very low66 Ų66161.5 Ų161.555%0.54582%0.824SS.*THydrogen-bonded Turntrans-88-18.6-168.200000114.6D489 C493D489-A491 PolarHBondContact O-N 3.4Å; A491-C493 PolarHBondContact O-N 2.93Å
492E32.9Very low29.1Very low184 Ų184160.1 Ų160.186%0.8682%0.821SS**G310 helixtrans-86.10.7-178.3-77.4-174153.600115.1Y494E492-Y494 VanDerWaalsContact C-N 3.35Å; E492-Y494 PolarHBondContact O-N 3.21Å
493C35.8Very low29.1Very low112 Ų112158.6 Ų158.676%0.75782%0.818SS**G310 helixtrans-84.52-179.9-77.40000115.4A491A491-C493 PolarHBondContact O-N 2.93Å
494Y28.3Very low29.4Very low217 Ų217161.3 Ų161.385%0.85182%0.821SS**G310 helixtrans-93.43.4-172.4-83.1-78.6000115.6E492E492-Y494 VanDerWaalsContact C-N 3.35Å; E492-Y494 PolarHBondContact O-N 3.21Å
495G31.4Very low29.8Very low65 Ų65162.8 Ų162.867%0.6782%0.819SS**  trans-115.50.5-167.300000118.9K497G495-K497 PolarHBondContact O-N 3.09Å
496L30.3Very low30.2Very low172 Ų172159.9 Ų159.990%0.90181%0.813SS**  trans-86.6105.4-172.4-70.9166.7000112.2
497K28.5Very low30.6Very low190 Ų190159.4 Ų159.483%0.82682%0.815SS**  trans-77.3157.8168.3-84.2-178.1176.1177.30111.8G495 T499G495-K497 PolarHBondContact O-N 3.09Å; K497-T499 VanDerWaalsContact C-N 3.26Å; K497-T499 PolarHBondContact O-N 3.21Å
498E33.9Very low31.1Very low176 Ų176156.4 Ų156.482%0.82281%0.811SS**THydrogen-bonded Turntrans-75.624.6-164.7-161.3158.6-159.300116.1
499T32.2Very low31.5Very low118 Ų118152.5 Ų152.572%0.72481%0.81SS**THydrogen-bonded Turntrans-121.8-2.1-171.852.20000117.5K497K497-T499 VanDerWaalsContact C-N 3.26Å; K497-T499 PolarHBondContact O-N 3.21Å
500D31.8Very low32.1Very low157 Ų157153.5 Ų153.584%0.8482%0.816SS**  trans-113.782.7175.6-62.8-26000110.1
501I35.6Very low32Very low234 Ų234153.7 Ų153.7100%1.282%0.818SS**  trans-104.90165.3-65.7-179.2000108.2

Retrieved 501 of 501 residues in 471.4 ms (Link to these results)