A0A077Z7C1_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z7C1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 307 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

 

Download Structure   PDB   PAE   Table  
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
1M34.4Very low32.5Very low247 Ų247141.7 Ų141.7100%1.21781%0.811SS**  086.10-75.4176.3172.900108.8
2V33.8Very low32.8Very low145 Ų145139.3 Ų139.388%0.87980%0.804SS**  trans-143.1106.2161.5-177.90000104.7
3S29.7Very low32.8Very low116 Ų116143.9 Ų143.981%0.81181%0.809SS**  trans-89.4105.3178.1-170.80000107.2
4S31.4Very low33.1Very low93 Ų93145.4 Ų145.465%0.6581%0.813SS**  trans-87.9110.4173.747.60000109.1D6S4-D6 PolarHBondContact O-N 3.2Å
5V36Very low33.5Very low121 Ų121150.9 Ų150.973%0.73382%0.816SS**  trans-7794.3173.5177.10000107.9T7V5-T7 PolarHBondContact O-N 3.02Å; V5-T7 PolarHBondContact O-OG1 2.9Å
6D34Very low34.1Very low151 Ų151149.9 Ų149.981%0.80782%0.817SS**  trans-69.699.8170.3-83.9-37.4000109.3S4 A8S4-D6 PolarHBondContact O-N 3.2Å; D6-A8 VanDerWaalsContact C-N 3.32Å; D6-A8 PolarHBondContact O-N 3.43Å
7T31.5Very low35.3Very low115 Ų115145.2 Ų145.271%0.70679%0.79SS**  trans-76.987.6176.1-46.10000107.2V5 V9V5-T7 PolarHBondContact O-N 3.02Å; V5-T7 PolarHBondContact O-OG1 2.9Å; T7-V9 PolarHBondContact O-N 3Å
8A33.9Very low37.3Very low89 Ų89139.6 Ų139.674%0.73677%0.771SS**  trans-6397.5174.900000109.9D6 R10D6-A8 VanDerWaalsContact C-N 3.32Å; D6-A8 PolarHBondContact O-N 3.43Å; A8-R10 PolarHBondContact O-N 2.98Å
9V34.2Very low39.4Very low122 Ų122136.5 Ų136.574%0.73977%0.766SS**  trans-56.9104.8168.5176.20000107.5T7 T11T7-V9 PolarHBondContact O-N 3Å; V9-T11 VanDerWaalsContact C-N 3.28Å; V9-T11 PolarHBondContact O-N 2.9Å
10R29.3Very low41.4Very low241 Ų241135.2 Ų135.291%0.90975%0.753SS**  trans-67.886.3172.1-76.2-179.9177.1178.4-0.7108.7A8A8-R10 PolarHBondContact O-N 2.98Å
11T29.6Very low43.3Very low119 Ų119132.7 Ų132.773%0.7374%0.736SS**  trans-62.5125.6158.17.80000107.6V9 K13V9-T11 VanDerWaalsContact C-N 3.28Å; V9-T11 PolarHBondContact O-N 2.9Å; T11-K13 PolarHBondContact O-N 2.85Å; T11-K13 VanDerWaalsContact O-N 3.1Å
12P35.2Very low45.6Very low113 Ų113125.7 Ų125.773%0.73470%0.697SS**  trans-63.4119.5-179.3-12.325.2000107.9L14P12-L14 VanDerWaalsContact C-N 3.32Å; P12-L14 PolarHBondContact O-N 3.1Å
13K33.2Very low48.2Very low199 Ų199119.3 Ų119.387%0.86566%0.658SS**  trans-57.3100.6166.6-74.7-179.1175.8-178.60106.8T11 R15T11-K13 PolarHBondContact O-N 2.85Å; T11-K13 VanDerWaalsContact O-N 3.1Å; K13-R15 PolarHBondContact O-N 3.25Å
14L36.3Very low50.9Low165 Ų165114.2 Ų114.286%0.86462%0.622SS**  trans-54101.5154.2-94.797.3000104.7P12 T16P12-L14 VanDerWaalsContact C-N 3.32Å; P12-L14 PolarHBondContact O-N 3.1Å; L14-T16 VanDerWaalsContact C-N 3.3Å; L14-T16 PolarHBondContact O-N 2.92Å
15R39.9Very low53.3Low227 Ų227113.6 Ų113.686%0.85761%0.608SS**  trans-58.9105.2165.2-81.3179171.7175.6-3.3104.4K13 L17K13-R15 PolarHBondContact O-N 3.25Å; R15-L17 PolarHBondContact O-N 2.84Å
16T43.3Very low55.8Low136 Ų136111.6 Ų111.683%0.83459%0.588SS**  trans-55.994.2160.441.30000105.9L14 G18L14-T16 VanDerWaalsContact C-N 3.3Å; L14-T16 PolarHBondContact O-N 2.92Å; T16-G18 PolarHBondContact O-N 2.81Å
17L53.7Low58.4Low70 Ų70104.4 Ų104.437%0.36655%0.549SS..  trans-49134.5165.6-71156.8000106.2R15 A19 Q21R15-L17 PolarHBondContact O-N 2.84Å; L17-A19 PolarHBondContact O-N 3Å; L17-Q21 HydrophobicContact CB-CB 4.39Å; L17-Q21 HydrophobicContact CD2-CB 4.45Å; L17-Q21 HydrophobicContact CD2-CG 3.84Å
18G72.5Confident61Low43 Ų43102 Ų10244%0.44353%0.53SS..  trans-52.6144.1173.500000108.9T16 E20 Q21 Y22T16-G18 PolarHBondContact O-N 2.81Å; G18-E20 PolarHBondContact O-N 3.39Å; G18-Q21 WeakPolarHBondContact O-CA 3.49Å; G18-Q21 WeakPolarHBondContact O-CB 3.49Å; G18-Q21 PolarHBondContact O-N 3.46Å; G18-Y22 PolarHBondContact O-N 2.86Å
19A77.2Confident63.6Low81 Ų81102.2 Ų102.267%0.66952%0.516SS*.Hα-helixtrans-50.2-35-176.100000112.6L17 C23L17-A19 PolarHBondContact O-N 3Å; A19-C23 PolarHBondContact O-N 3.05Å; A19-C23 VanDerWaalsContact O-N 3.13Å; A19-C23 PolarHBondContact O-SG 3.43Å
20E78.7Confident66.2Low111 Ų11196.7 Ų96.752%0.51948%0.482SS..Hα-helixtrans-63.3-48.4174.5-148.2-165.5151.800112.8G18 Y22 C23 F24 H125G18-E20 PolarHBondContact O-N 3.39Å; E20-Y22 VanDerWaalsContact C-N 3.31Å; E20-Y22 PolarHBondContact O-N 3.06Å; E20-C23 PolarHBondContact O-N 3.23Å; E20-F24 HydrophobicContact CB-CE2 4.26Å; E20-F24 HydrophobicContact CG-CD2 4.39Å; E20-F24 HydrophobicContact CG-CE2 3.47Å; E20-F24 VanDerWaalsContact CG-CE2 3.47Å; E20-F24 HydrophobicContact CG-CZ 3.84Å; E20-F24 WeakPolarHBondContact O-CD2 3.36Å; E20-F24 PolarHBondContact O-N 3.26Å; E20-F24 VanDerWaalsContact OE1-CE2 3.27Å; E20-F24 WeakPolarHBondContact OE1-CE2 3.36Å; E20-F24 WeakPolarHBondContact OE1-CZ 3.3Å; E20-H125 IonicContact OE1-CE1 3.44Å; E20-H125 PolarHBondContact OE1-CE1 2.98Å; E20-H125 VanDerWaalsContact OE1-CE1 3.29Å; E20-H125 IonicContact OE1-ND1 3.34Å; E20-H125 PolarHBondContact OE1-ND1 3.05Å
21Q80.3Confident69.1Low82 Ų8286.4 Ų86.438%0.38344%0.444SS..Hα-helixtrans-63.7-38.2179.2-168170.32.100111.7L17 G18 C23 F24 E25L17-Q21 HydrophobicContact CB-CB 4.39Å; L17-Q21 HydrophobicContact CD2-CB 4.45Å; L17-Q21 HydrophobicContact CD2-CG 3.84Å; G18-Q21 WeakPolarHBondContact O-CA 3.49Å; G18-Q21 WeakPolarHBondContact O-CB 3.49Å; G18-Q21 PolarHBondContact O-N 3.46Å; Q21-C23 VanDerWaalsContact C-N 3.33Å; Q21-C23 PolarHBondContact O-N 2.05Å; Q21-F24 PolarHBondContact O-N 3.47Å; Q21-E25 PolarHBondContact O-N 3.13Å; Q21-E25 VanDerWaalsContact O-N 3.1Å
22Y84.7Confident71.9Confident100 Ų10084.5 Ų84.539%0.39243%0.432SS..Hα-helixtrans-58.1-44.5170.9171.8-97.3000111.8G18 E20 F24 E25 R26G18-Y22 PolarHBondContact O-N 2.86Å; E20-Y22 VanDerWaalsContact C-N 3.31Å; E20-Y22 PolarHBondContact O-N 3.06Å; Y22-F24 PolarHBondContact O-N 3.11Å; Y22-E25 PolarHBondContact O-N 3.29Å; Y22-R26 HydrophobicContact CD1-CG 4.42Å; Y22-R26 HydrophobicContact CE1-CG 3.98Å; Y22-R26 HydrophobicContact CE2-CG 4.21Å; Y22-R26 WeakPolarHBondContact O-CG 3.39Å; Y22-R26 PolarHBondContact O-N 3.09Å; Y22-R26 VanDerWaalsContact O-N 3.08Å; Y22-R26 PolarHBondContact OH-NE 3.4Å; Y22-R26 PolarHBondContact OH-NH2 3.1Å
23C88.3Confident74.6Confident11 Ų1180.6 Ų80.67%0.07441%0.407CS..Hα-helixtrans-67.6-31.5178.2-700000113.4A19 E20 Q21 R26 L27 C224 T227A19-C23 PolarHBondContact O-N 3.05Å; A19-C23 VanDerWaalsContact O-N 3.13Å; A19-C23 PolarHBondContact O-SG 3.43Å; E20-C23 PolarHBondContact O-N 3.23Å; Q21-C23 VanDerWaalsContact C-N 3.33Å; Q21-C23 PolarHBondContact O-N 2.05Å; C23-R26 PolarHBondContact O-N 3.38Å; C23-L27 VanDerWaalsContact O-CB 3.3Å; C23-L27 WeakPolarHBondContact O-CB 3.33Å; C23-L27 PolarHBondContact O-N 3.28Å; C23-C224 WeakPolarHBondContact CA-SG 3.31Å; C23-C224 HydrophobicContact CB-CB 3.56Å; C23-C224 WeakPolarHBondContact CB-SG 3.44Å; C23-C224 WeakPolarHBondContact SG-CA 3.05Å; C23-C224 WeakPolarHBondContact SG-CB 3.43Å; C23-C224 CovalentContact SG-SG 2.05Å; C23-C224 PolarHBondContact SG-SG 2.9Å; C23-T227 HydrophobicContact CB-CG2 4.06Å; C23-T227 WeakPolarHBondContact CB-OG1 3.05Å
24F84.9Confident77.4Confident10 Ų1071.2 Ų71.24%0.04437%0.366CS..Hα-helixtrans-70.3-38.1173.8-65.3-51.9000113.6E20 Q21 Y22 R26 L27 Q28 H125 Y128 T227 V231E20-F24 HydrophobicContact CB-CE2 4.26Å; E20-F24 HydrophobicContact CG-CD2 4.39Å; E20-F24 HydrophobicContact CG-CE2 3.47Å; E20-F24 VanDerWaalsContact CG-CE2 3.47Å; E20-F24 HydrophobicContact CG-CZ 3.84Å; E20-F24 WeakPolarHBondContact O-CD2 3.36Å; E20-F24 PolarHBondContact O-N 3.26Å; E20-F24 VanDerWaalsContact OE1-CE2 3.27Å; E20-F24 WeakPolarHBondContact OE1-CE2 3.36Å; E20-F24 WeakPolarHBondContact OE1-CZ 3.3Å; Q21-F24 PolarHBondContact O-N 3.47Å; Y22-F24 PolarHBondContact O-N 3.11Å; F24-R26 VanDerWaalsContact C-N 3.32Å; F24-L27 HydrophobicContact CD1-CD2 4.33Å; F24-L27 WeakPolarHBondContact O-CB 3.46Å; F24-L27 PolarHBondContact O-N 3.47Å; F24-Q28 PolarHBondContact O-N 3.18Å; F24-H125 HydrophobicContact CD2-CB 4.05Å; F24-H125 HydrophobicContact CE1-CB 4.15Å; F24-H125 AromaticContact CE1-CG 3.82Å; F24-H125 AromaticContact CE1-ND1 3.89Å; F24-H125 HydrophobicContact CE2-CB 3.61Å; F24-H125 AromaticContact CE2-CG 3.6Å; F24-H125 AromaticContact CE2-ND1 3.26Å; F24-H125 VanDerWaalsContact CE2-ND1 3.26Å; F24-H125 WeakPolarHBondContact CE2-ND1 3.41Å; F24-H125 HydrophobicContact CZ-CB 3.74Å; F24-H125 AromaticContact CZ-CE1 3.72Å; F24-H125 AromaticContact CZ-CG 3.28Å; F24-H125 AromaticContact CZ-ND1 2.94Å; F24-H125 WeakPolarHBondContact CZ-ND1 3.34Å; F24-Y128 HydrophobicContact CD1-CD2 4.19Å; F24-T227 HydrophobicContact CD1-CG2 3.69Å; F24-T227 HydrophobicContact CE1-CG2 3.39Å; F24-T227 HydrophobicContact CZ-CG2 4.17Å; F24-V231 HydrophobicContact CD1-CG2 3.99Å; F24-V231 HydrophobicContact CE1-CG2 3.46Å; F24-V231 VanDerWaalsContact CE1-CG2 3.46Å
25E82.4Confident80Confident79 Ų7967.3 Ų67.337%0.36934%0.342SS..Hα-helixtrans-63.4-41.2173.2-71.9178.9-175.800111Q21 Y22 L27 Q28 Q29Q21-E25 PolarHBondContact O-N 3.13Å; Q21-E25 VanDerWaalsContact O-N 3.1Å; Y22-E25 PolarHBondContact O-N 3.29Å; E25-L27 VanDerWaalsContact C-N 3.33Å; E25-Q28 PolarHBondContact O-N 3.46Å; E25-Q29 PolarHBondContact O-N 3.08Å
26R88Confident82.3Confident79 Ų7961.3 Ų61.330%0.29833%0.327SS..Hα-helixtrans-66.1-34.8173.4-67.8-65.6-168.4174.37.3112.5Y22 C23 F24 Q28 Q29 Y30 L220Y22-R26 HydrophobicContact CD1-CG 4.42Å; Y22-R26 HydrophobicContact CE1-CG 3.98Å; Y22-R26 HydrophobicContact CE2-CG 4.21Å; Y22-R26 WeakPolarHBondContact O-CG 3.39Å; Y22-R26 PolarHBondContact O-N 3.09Å; Y22-R26 VanDerWaalsContact O-N 3.08Å; Y22-R26 PolarHBondContact OH-NE 3.4Å; Y22-R26 PolarHBondContact OH-NH2 3.1Å; C23-R26 PolarHBondContact O-N 3.38Å; F24-R26 VanDerWaalsContact C-N 3.32Å; R26-Q28 VanDerWaalsContact C-N 3.31Å; R26-Q28 PolarHBondContact O-N 3.2Å; R26-Q29 WeakPolarHBondContact O-CB 2.94Å; R26-Q29 PolarHBondContact O-N 3.39Å; R26-Y30 PolarHBondContact O-N 3.13Å; R26-L220 VanDerWaalsContact C-CD1 3.44Å; R26-L220 HydrophobicContact CB-CD1 3.54Å
27L88.5Confident84.7Confident0 Ų057.8 Ų57.80%030%0.303CS..Hα-helixtrans-64.1-36.7176.1-177.964.2000111.7C23 F24 E25 Y30 F31 Y128 L220 T227 V228 V231C23-L27 VanDerWaalsContact O-CB 3.3Å; C23-L27 WeakPolarHBondContact O-CB 3.33Å; C23-L27 PolarHBondContact O-N 3.28Å; F24-L27 HydrophobicContact CD1-CD2 4.33Å; F24-L27 WeakPolarHBondContact O-CB 3.46Å; F24-L27 PolarHBondContact O-N 3.47Å; E25-L27 VanDerWaalsContact C-N 3.33Å; L27-Y30 HydrophobicContact CD1-CD1 3.97Å; L27-Y30 WeakPolarHBondContact O-CB 3.27Å; L27-Y30 PolarHBondContact O-N 3.46Å; L27-F31 HydrophobicContact CD1-CD2 4.17Å; L27-F31 HydrophobicContact CD1-CE2 3.6Å; L27-F31 HydrophobicContact CD1-CZ 4.03Å; L27-F31 HydrophobicContact CD2-CE2 4.01Å; L27-F31 HydrophobicContact CG-CD2 3.97Å; L27-F31 HydrophobicContact CG-CE2 3.54Å; L27-F31 HydrophobicContact CG-CZ 4.42Å; L27-F31 WeakPolarHBondContact O-CD2 3.26Å; L27-F31 PolarHBondContact O-N 3.29Å; L27-Y128 HydrophobicContact CD2-CD2 4.08Å; L27-Y128 HydrophobicContact CD2-CE2 3.55Å; L27-Y128 HydrophobicContact CG-CE2 4.2Å; L27-L220 HydrophobicContact CB-CD1 4.31Å; L27-T227 HydrophobicContact CD2-CG2 4.34Å; L27-V228 HydrophobicContact CD1-CB 4.28Å; L27-V228 HydrophobicContact CD1-CG1 4.47Å; L27-V228 HydrophobicContact CD1-CG2 3.73Å; L27-V231 HydrophobicContact CD2-CB 3.93Å; L27-V231 HydrophobicContact CD2-CG1 4.08Å; L27-V231 HydrophobicContact CD2-CG2 3.6Å
28Q86.5Confident86.5Confident64 Ų6454.4 Ų54.430%0.29929%0.286SS..Hα-helixtrans-63.3-44.3172.1-71.7174.8-3.300111.3F24 E25 R26 Y30 F31 T32 G127F24-Q28 PolarHBondContact O-N 3.18Å; E25-Q28 PolarHBondContact O-N 3.46Å; R26-Q28 VanDerWaalsContact C-N 3.31Å; R26-Q28 PolarHBondContact O-N 3.2Å; Q28-Y30 VanDerWaalsContact C-N 3.27Å; Q28-Y30 PolarHBondContact O-N 2.91Å; Q28-F31 PolarHBondContact O-N 2.84Å; Q28-T32 PolarHBondContact O-N 3.22Å; Q28-T32 PolarHBondContact O-OG1 3.45Å; Q28-T32 VanDerWaalsContact O-OG1 3.12Å; Q28-G127 PolarHBondContact NE2-O 3.33Å; Q28-G127 VanDerWaalsContact NE2-O 3.14Å
29Q87.9Confident87.2Confident95 Ų9555.4 Ų55.444%0.44428%0.283SS..Hα-helixtrans-59.8-39175.3-65.1172.7600112E25 R26 T32 C33E25-Q29 PolarHBondContact O-N 3.08Å; R26-Q29 WeakPolarHBondContact O-CB 2.94Å; R26-Q29 PolarHBondContact O-N 3.39Å; Q29-T32 PolarHBondContact O-N 3.39Å; Q29-C33 VanDerWaalsContact O-CB 3.32Å; Q29-C33 WeakPolarHBondContact O-CB 3.44Å; Q29-C33 PolarHBondContact O-N 2.89Å
30Y90.1Very high87.8Confident6 Ų656.7 Ų56.72%0.02428%0.275CS..Hα-helixtrans-58.9-52.4173.6167.1-107.3000111.7R26 L27 Q28 T32 C33 L34 D213 C216 L217 V228R26-Y30 PolarHBondContact O-N 3.13Å; L27-Y30 HydrophobicContact CD1-CD1 3.97Å; L27-Y30 WeakPolarHBondContact O-CB 3.27Å; L27-Y30 PolarHBondContact O-N 3.46Å; Q28-Y30 VanDerWaalsContact C-N 3.27Å; Q28-Y30 PolarHBondContact O-N 2.91Å; Y30-T32 VanDerWaalsContact C-N 3.32Å; Y30-T32 PolarHBondContact O-N 3.01Å; Y30-C33 WeakPolarHBondContact O-CB 3.36Å; Y30-C33 PolarHBondContact O-N 2.61Å; Y30-L34 HydrophobicContact CD1-CD1 4.29Å; Y30-L34 HydrophobicContact CD2-CG 4.32Å; Y30-L34 HydrophobicContact CE1-CD1 3.6Å; Y30-L34 HydrophobicContact CE1-CG 4.31Å; Y30-L34 HydrophobicContact CE2-CD1 3.93Å; Y30-L34 HydrophobicContact CE2-CD2 3.94Å; Y30-L34 HydrophobicContact CE2-CG 3.88Å; Y30-L34 VanDerWaalsContact CZ-CD1 3.42Å; Y30-L34 WeakPolarHBondContact O-CG 3.16Å; Y30-L34 PolarHBondContact O-N 3.31Å; Y30-D213 PolarHBondContact OH-OD1 3.05Å; Y30-D213 VanDerWaalsContact OH-OD1 3.05Å; Y30-C216 HydrophobicContact CD2-CB 3.71Å; Y30-C216 HydrophobicContact CE2-CB 3.86Å; Y30-L217 HydrophobicContact CD2-CD2 4.13Å; Y30-L217 HydrophobicContact CD2-CG 4.41Å; Y30-L217 HydrophobicContact CE2-CB 4.39Å; Y30-L217 HydrophobicContact CE2-CD2 3.52Å; Y30-L217 HydrophobicContact CE2-CG 3.62Å; Y30-V228 HydrophobicContact CE1-CG1 4.29Å; Y30-V228 HydrophobicContact CE1-CG2 4.41Å
31F89.5Confident88.3Confident25 Ų2551.5 Ų51.511%0.1125%0.251CS..Hα-helixtrans-65.2-34.9179.5-71.4-56.8000113L27 Q28 L34 K35 Y128 P131L27-F31 HydrophobicContact CD1-CD2 4.17Å; L27-F31 HydrophobicContact CD1-CE2 3.6Å; L27-F31 HydrophobicContact CD1-CZ 4.03Å; L27-F31 HydrophobicContact CD2-CE2 4.01Å; L27-F31 HydrophobicContact CG-CD2 3.97Å; L27-F31 HydrophobicContact CG-CE2 3.54Å; L27-F31 HydrophobicContact CG-CZ 4.42Å; L27-F31 WeakPolarHBondContact O-CD2 3.26Å; L27-F31 PolarHBondContact O-N 3.29Å; Q28-F31 PolarHBondContact O-N 2.84Å; F31-L34 HydrophobicContact CD1-CD1 4.29Å; F31-L34 PolarHBondContact O-N 3.24Å; F31-K35 WeakPolarHBondContact O-CB 3.45Å; F31-K35 PolarHBondContact O-N 2.98Å; F31-Y128 HydrophobicContact CE2-CE2 4.42Å; F31-P131 HydrophobicContact CB-CB 4.43Å; F31-P131 HydrophobicContact CB-CG 3.78Å; F31-P131 HydrophobicContact CD1-CG 3.9Å; F31-P131 HydrophobicContact CD2-CG 3.55Å; F31-P131 HydrophobicContact CE1-CG 4.36Å; F31-P131 HydrophobicContact CE2-CG 4.02Å; F31-P131 HydrophobicContact CG-CG 3.48Å; F31-P131 VanDerWaalsContact CG-CG 3.48Å; F31-P131 HydrophobicContact CZ-CG 4.41Å
32T89.2Confident88.5Confident78 Ų7848.6 Ų48.648%0.47924%0.238SC..Hα-helixtrans-63.3-46.8171.9-61.50000111.1Q28 Q29 Y30 L34 K35 D36Q28-T32 PolarHBondContact O-N 3.22Å; Q28-T32 PolarHBondContact O-OG1 3.45Å; Q28-T32 VanDerWaalsContact O-OG1 3.12Å; Q29-T32 PolarHBondContact O-N 3.39Å; Y30-T32 VanDerWaalsContact C-N 3.32Å; Y30-T32 PolarHBondContact O-N 3.01Å; T32-L34 VanDerWaalsContact C-N 3.33Å; T32-L34 PolarHBondContact O-N 3.06Å; T32-K35 WeakPolarHBondContact O-CB 3.42Å; T32-K35 PolarHBondContact O-N 3.46Å; T32-K35 VanDerWaalsContact O-N 3.14Å; T32-D36 PolarHBondContact O-N 2.82Å; T32-D36 VanDerWaalsContact O-N 3.08Å
33C91.8Very high88.5Confident32 Ų3246.9 Ų46.922%0.21624%0.235CC..Hα-helixtrans-56.1-47.1175.3178.80000111.4Q29 Y30 K35 N37 C216Q29-C33 VanDerWaalsContact O-CB 3.32Å; Q29-C33 WeakPolarHBondContact O-CB 3.44Å; Q29-C33 PolarHBondContact O-N 2.89Å; Y30-C33 WeakPolarHBondContact O-CB 3.36Å; Y30-C33 PolarHBondContact O-N 2.61Å; C33-K35 PolarHBondContact O-N 3.36Å; C33-N37 WeakPolarHBondContact O-CB 3.18Å; C33-N37 PolarHBondContact O-N 3.49Å; C33-N37 PolarHBondContact O-ND2 3.48Å; C33-C216 HydrophobicContact CB-CB 3.77Å; C33-C216 WeakPolarHBondContact CB-SG 3.25Å; C33-C216 VanDerWaalsContact SG-CA 3.55Å; C33-C216 WeakPolarHBondContact SG-CB 3.33Å; C33-C216 CovalentContact SG-SG 2.05Å; C33-C216 PolarHBondContact SG-SG 3.07Å
34L91.8Very high88.4Confident1 Ų150 Ų501%0.00525%0.249CC..Hα-helixtrans-61.6-44.7176.4-66.9-175000111.8Y30 F31 T32 D36 N37 F38 V135 D213 C216Y30-L34 HydrophobicContact CD1-CD1 4.29Å; Y30-L34 HydrophobicContact CD2-CG 4.32Å; Y30-L34 HydrophobicContact CE1-CD1 3.6Å; Y30-L34 HydrophobicContact CE1-CG 4.31Å; Y30-L34 HydrophobicContact CE2-CD1 3.93Å; Y30-L34 HydrophobicContact CE2-CD2 3.94Å; Y30-L34 HydrophobicContact CE2-CG 3.88Å; Y30-L34 VanDerWaalsContact CZ-CD1 3.42Å; Y30-L34 WeakPolarHBondContact O-CG 3.16Å; Y30-L34 PolarHBondContact O-N 3.31Å; F31-L34 HydrophobicContact CD1-CD1 4.29Å; F31-L34 PolarHBondContact O-N 3.24Å; T32-L34 VanDerWaalsContact C-N 3.33Å; T32-L34 PolarHBondContact O-N 3.06Å; L34-D36 PolarHBondContact O-N 3.22Å; L34-N37 PolarHBondContact O-N 3.38Å; L34-F38 HydrophobicContact CB-CD2 4.32Å; L34-F38 HydrophobicContact CB-CE2 4.26Å; L34-F38 HydrophobicContact CD1-CE2 4.39Å; L34-F38 HydrophobicContact CD2-CE1 4.01Å; L34-F38 HydrophobicContact CD2-CE2 4.11Å; L34-F38 HydrophobicContact CD2-CZ 3.66Å; L34-F38 WeakPolarHBondContact O-CB 3.42Å; L34-F38 WeakPolarHBondContact O-CG 3.5Å; L34-F38 PolarHBondContact O-N 3.17Å; L34-V135 HydrophobicContact CB-CG1 3.35Å; L34-V135 HydrophobicContact CD1-CG1 4.29Å; L34-D213 HydrophobicContact CD2-CB 4.29Å; L34-C216 HydrophobicContact CD2-CB 3.8Å; L34-C216 HydrophobicContact CG-CB 4.33Å
35K90.4Very high88.4Confident83 Ų8349.7 Ų49.736%0.36125%0.247SC..Hα-helixtrans-57.5-53.2-176.5-174.3-178.3179.11780110.2F31 T32 C33 N37 T39 E132 V135F31-K35 WeakPolarHBondContact O-CB 3.45Å; F31-K35 PolarHBondContact O-N 2.98Å; T32-K35 WeakPolarHBondContact O-CB 3.42Å; T32-K35 PolarHBondContact O-N 3.46Å; T32-K35 VanDerWaalsContact O-N 3.14Å; C33-K35 PolarHBondContact O-N 3.36Å; K35-N37 PolarHBondContact O-N 3.09Å; K35-T39 VanDerWaalsContact O-CB 3.26Å; K35-T39 WeakPolarHBondContact O-CB 3.49Å; K35-T39 PolarHBondContact O-N 3.45Å; K35-T39 PolarHBondContact O-OG1 3.39Å; K35-E132 IonicContact NZ-OE2 3Å; K35-V135 HydrophobicContact CB-CG1 4.18Å; K35-V135 HydrophobicContact CB-CG2 4.1Å; K35-V135 HydrophobicContact CG-CG2 4.4Å
36D89.6Confident88.2Confident101 Ų10148 Ų4854%0.5424%0.238SC..Hα-helixtrans-64.6-46.4-174.4-64.7-17.2000111.2T32 L34 Q40T32-D36 PolarHBondContact O-N 2.82Å; T32-D36 VanDerWaalsContact O-N 3.08Å; L34-D36 PolarHBondContact O-N 3.22Å; D36-Q40 PolarHBondContact O-N 2.84Å
37N93.1Very high87.8Confident62 Ų6248.6 Ų48.633%0.33225%0.25SC..Hα-helixtrans-75.7-38-176.3-72.4-80.2000112.9C33 L34 K35 Q40 A41 I212C33-N37 WeakPolarHBondContact O-CB 3.18Å; C33-N37 PolarHBondContact O-N 3.49Å; C33-N37 PolarHBondContact O-ND2 3.48Å; L34-N37 PolarHBondContact O-N 3.38Å; K35-N37 PolarHBondContact O-N 3.09Å; N37-Q40 PolarHBondContact O-N 3.04Å; N37-A41 PolarHBondContact O-N 3.06Å; N37-I212 HydrophobicContact CB-CB 4.39Å; N37-I212 HydrophobicContact CB-CD1 4.02Å; N37-I212 HydrophobicContact CB-CG1 4.14Å; N37-I212 HydrophobicContact CB-CG2 3.35Å
38F91.8Very high87.4Confident0 Ų051.1 Ų51.10%027%0.267CS..Hα-helixtrans-69.4-39.3176.7-71.5-2.3000111.4L34 Q40 A41 F42 V135 V137 F140 L209 I212 D213L34-F38 HydrophobicContact CB-CD2 4.32Å; L34-F38 HydrophobicContact CB-CE2 4.26Å; L34-F38 HydrophobicContact CD1-CE2 4.39Å; L34-F38 HydrophobicContact CD2-CE1 4.01Å; L34-F38 HydrophobicContact CD2-CE2 4.11Å; L34-F38 HydrophobicContact CD2-CZ 3.66Å; L34-F38 WeakPolarHBondContact O-CB 3.42Å; L34-F38 WeakPolarHBondContact O-CG 3.5Å; L34-F38 PolarHBondContact O-N 3.17Å; F38-Q40 VanDerWaalsContact C-N 3.27Å; F38-Q40 PolarHBondContact O-N 2.99Å; F38-A41 PolarHBondContact O-N 3.47Å; F38-F42 WeakPolarHBondContact O-CB 3.5Å; F38-F42 PolarHBondContact O-N 3.02Å; F38-V135 HydrophobicContact CD2-CG1 4.15Å; F38-V137 HydrophobicContact CE2-CG2 4.05Å; F38-V137 HydrophobicContact CZ-CG2 3.63Å; F38-F140 HydrophobicContact CB-CD1 3.88Å; F38-F140 HydrophobicContact CB-CD2 3.74Å; F38-F140 HydrophobicContact CB-CE1 3.61Å; F38-F140 HydrophobicContact CB-CE2 3.46Å; F38-F140 VanDerWaalsContact CB-CE2 3.46Å; F38-F140 HydrophobicContact CB-CG 3.94Å; F38-F140 HydrophobicContact CB-CZ 3.37Å; F38-F140 AromaticContact CD2-CD2 3.48Å; F38-F140 HydrophobicContact CD2-CD2 3.48Å; F38-F140 VanDerWaalsContact CD2-CD2 3.48Å; F38-F140 AromaticContact CD2-CE2 3.7Å; F38-F140 HydrophobicContact CD2-CE2 3.7Å; F38-F140 HydrophobicContact CD2-CG 4.12Å; F38-F140 HydrophobicContact CD2-CZ 4.49Å; F38-F140 HydrophobicContact CE2-CD2 4.43Å; F38-F140 HydrophobicContact CG-CD2 4.04Å; F38-F140 HydrophobicContact CG-CE2 4.09Å; F38-F140 HydrophobicContact CG-CG 4.35Å; F38-F140 HydrophobicContact CG-CZ 4.46Å; F38-F140 VanDerWaalsContact O-CE1 3.25Å; F38-F140 WeakPolarHBondContact O-CE1 3.47Å; F38-L209 HydrophobicContact CB-CD2 4.02Å; F38-L209 HydrophobicContact CD1-CB 4.46Å; F38-L209 HydrophobicContact CD1-CD2 3.35Å; F38-L209 HydrophobicContact CD1-CG 4.49Å; F38-L209 HydrophobicContact CD2-CD2 4.4Å; F38-L209 HydrophobicContact CE1-CB 4.03Å; F38-L209 HydrophobicContact CE1-CD2 3.8Å; F38-L209 WeakPolarHBondContact CE1-O 3.28Å; F38-L209 HydrophobicContact CG-CD2 3.68Å; F38-L209 HydrophobicContact CZ-CB 4.4Å; F38-L209 HydrophobicContact CZ-CD2 4.48Å; F38-I212 HydrophobicContact CD1-CB 4.17Å; F38-I212 HydrophobicContact CD1-CD1 4.28Å; F38-I212 HydrophobicContact CD1-CG2 3.63Å; F38-I212 HydrophobicContact CE1-CB 3.82Å; F38-I212 HydrophobicContact CE1-CG2 3.48Å; F38-I212 VanDerWaalsContact CE1-CG2 3.48Å; F38-D213 HydrophobicContact CZ-CB 4.23Å
39T86.8Confident87Confident64 Ų6448.7 Ų48.739%0.39326%0.256SS..Hα-helixtrans-58.6-41.7173.4-69.40000111.2K35 N43K35-T39 VanDerWaalsContact O-CB 3.26Å; K35-T39 WeakPolarHBondContact O-CB 3.49Å; K35-T39 PolarHBondContact O-N 3.45Å; K35-T39 PolarHBondContact O-OG1 3.39Å; T39-N43 VanDerWaalsContact O-CG 3.27Å; T39-N43 PolarHBondContact O-N 2.97Å; T39-N43 PolarHBondContact O-ND2 3.12Å
40Q89.5Confident86.4Confident107 Ų10746.3 Ų46.350%0.525%0.246SC..Hα-helixtrans-62.7-50.4174.2-177-177.4-15.400112.1D36 N37 F38 F42 N43 E44D36-Q40 PolarHBondContact O-N 2.84Å; N37-Q40 PolarHBondContact O-N 3.04Å; F38-Q40 VanDerWaalsContact C-N 3.27Å; F38-Q40 PolarHBondContact O-N 2.99Å; Q40-F42 VanDerWaalsContact C-N 3.27Å; Q40-F42 PolarHBondContact O-N 2.99Å; Q40-N43 PolarHBondContact O-N 3.14Å; Q40-N43 VanDerWaalsContact O-N 3.12Å; Q40-E44 PolarHBondContact NE2-OE1 2.92Å; Q40-E44 PolarHBondContact O-N 2.84Å
41A89.3Confident85.5Confident2 Ų246.1 Ų46.12%0.01725%0.246CC..Hα-helixtrans-58.8-39.9179.800000112.2N37 F38 E44 F45 T205 K208 L209 I212N37-A41 PolarHBondContact O-N 3.06Å; F38-A41 PolarHBondContact O-N 3.47Å; A41-E44 PolarHBondContact O-N 3.15Å; A41-F45 PolarHBondContact O-N 3.06Å; A41-T205 HydrophobicContact CB-CG2 4.43Å; A41-K208 HydrophobicContact CB-CD 4.22Å; A41-L209 HydrophobicContact CB-CD2 3.88Å; A41-I212 HydrophobicContact CB-CD1 4.16Å
42F84.9Confident85Confident21 Ų2147.9 Ų47.99%0.09226%0.256CS..Hα-helixtrans-64.4-41.4175.3-176.5-105.7000112.9F38 Q40 E44 F45 R46 F140 K143 M144 L147F38-F42 WeakPolarHBondContact O-CB 3.5Å; F38-F42 PolarHBondContact O-N 3.02Å; Q40-F42 VanDerWaalsContact C-N 3.27Å; Q40-F42 PolarHBondContact O-N 2.99Å; F42-E44 VanDerWaalsContact C-N 3.34Å; F42-E44 PolarHBondContact O-N 3.26Å; F42-F45 WeakPolarHBondContact O-CB 3.48Å; F42-F45 PolarHBondContact O-N 3.45Å; F42-R46 PolarHBondContact O-N 3.31Å; F42-F140 HydrophobicContact CB-CD1 3.8Å; F42-F140 HydrophobicContact CB-CE1 3.78Å; F42-F140 HydrophobicContact CD2-CD1 4.39Å; F42-F140 HydrophobicContact CG-CD1 4.26Å; F42-F140 HydrophobicContact CG-CE1 4.34Å; F42-K143 HydrophobicContact CD2-CB 4.07Å; F42-K143 HydrophobicContact CE2-CB 3.47Å; F42-K143 VanDerWaalsContact CE2-CB 3.47Å; F42-K143 HydrophobicContact CZ-CB 3.98Å; F42-M144 HydrophobicContact CD2-CG 4.01Å; F42-M144 HydrophobicContact CE2-CG 4.27Å; F42-L147 HydrophobicContact CE2-CD2 4.34Å; F42-L147 HydrophobicContact CZ-CD2 4.11Å
43N84.2Confident84.8Confident64 Ų6451.3 Ų51.334%0.34226%0.26SS..Hα-helixtrans-63.8-40.3176.7-74.3-30.2000111.7T39 Q40 R46 V47T39-N43 VanDerWaalsContact O-CG 3.27Å; T39-N43 PolarHBondContact O-N 2.97Å; T39-N43 PolarHBondContact O-ND2 3.12Å; Q40-N43 PolarHBondContact O-N 3.14Å; Q40-N43 VanDerWaalsContact O-N 3.12Å; N43-R46 PolarHBondContact O-N 3.34Å; N43-V47 WeakPolarHBondContact O-CG2 3.4Å; N43-V47 PolarHBondContact O-N 3.39Å
44E86.7Confident84.6Confident78 Ų7849.8 Ų49.836%0.36425%0.25SS..Hα-helixtrans-63.6-41174.4-68.3173.4-158.100112.2Q40 A41 F42 V47 S48 K208Q40-E44 PolarHBondContact NE2-OE1 2.92Å; Q40-E44 PolarHBondContact O-N 2.84Å; A41-E44 PolarHBondContact O-N 3.15Å; F42-E44 VanDerWaalsContact C-N 3.34Å; F42-E44 PolarHBondContact O-N 3.26Å; E44-V47 PolarHBondContact O-N 3.22Å; E44-S48 WeakPolarHBondContact O-CB 3.47Å; E44-S48 PolarHBondContact O-N 3.36Å; E44-S48 PolarHBondContact O-OG 3.12Å; E44-K208 IonicContact OE1-NZ 2.75Å; E44-K208 PolarHBondContact OE1-NZ 3.34Å; E44-K208 IonicContact OE2-NZ 3.29Å; E44-K208 PolarHBondContact OE2-NZ 2.95Å
45F85Confident84.3Confident2 Ų251 Ų511%0.00926%0.256CS..Hα-helixtrans-60-47.4172.6175.2-96.7000111.3A41 F42 V47 S48 I49 M144 L147 L201 Q202 T205A41-F45 PolarHBondContact O-N 3.06Å; F42-F45 WeakPolarHBondContact O-CB 3.48Å; F42-F45 PolarHBondContact O-N 3.45Å; F45-V47 VanDerWaalsContact C-N 3.32Å; F45-V47 PolarHBondContact O-N 3.46Å; F45-S48 WeakPolarHBondContact O-CA 3.42Å; F45-S48 WeakPolarHBondContact O-CB 3.09Å; F45-S48 PolarHBondContact O-N 2.05Å; F45-I49 HydrophobicContact CD1-CG2 4.45Å; F45-I49 HydrophobicContact CD2-CG2 4.41Å; F45-I49 HydrophobicContact CE1-CD1 4.44Å; F45-I49 HydrophobicContact CE1-CG2 3.94Å; F45-I49 HydrophobicContact CE2-CG2 3.89Å; F45-I49 HydrophobicContact CZ-CG2 3.63Å; F45-I49 PolarHBondContact O-N 3.5Å; F45-M144 HydrophobicContact CB-SD 4.47Å; F45-M144 HydrophobicContact CD1-CB 4.09Å; F45-M144 HydrophobicContact CD1-CG 3.74Å; F45-M144 HydrophobicContact CD1-SD 4.46Å; F45-M144 HydrophobicContact CD2-CG 4.43Å; F45-M144 HydrophobicContact CD2-SD 4.2Å; F45-M144 HydrophobicContact CE1-CB 3.75Å; F45-M144 HydrophobicContact CE1-CG 3.95Å; F45-M144 WeakPolarHBondContact CE1-O 3.37Å; F45-M144 HydrophobicContact CE2-CB 4.43Å; F45-M144 HydrophobicContact CG-CG 4Å; F45-M144 HydrophobicContact CG-SD 4.12Å; F45-M144 HydrophobicContact CZ-CB 3.94Å; F45-M144 HydrophobicContact CZ-CG 4.39Å; F45-M144 WeakPolarHBondContact CZ-O 3.25Å; F45-L147 HydrophobicContact CD1-CD2 3.97Å; F45-L147 HydrophobicContact CE1-CB 4.26Å; F45-L147 HydrophobicContact CE1-CD2 3.95Å; F45-L201 HydrophobicContact CD2-CB 4.03Å; F45-L201 HydrophobicContact CE2-CB 3.71Å; F45-Q202 HydrophobicContact CE2-CB 4.45Å; F45-Q202 HydrophobicContact CE2-CG 3.66Å; F45-Q202 HydrophobicContact CZ-CG 3.67Å; F45-T205 HydrophobicContact CB-CG2 4.17Å; F45-T205 WeakPolarHBondContact CD2-OG1 3.44Å
46R78.7Confident84.3Confident45 Ų4549.2 Ų49.217%0.1726%0.257CS..Hα-helixtrans-56.5-44.6177.3-175.9-177.984.1-163.5-3.6112.2F42 N43 S48 I49 A51 D52 L147F42-R46 PolarHBondContact O-N 3.31Å; N43-R46 PolarHBondContact O-N 3.34Å; R46-S48 VanDerWaalsContact C-N 3.29Å; R46-S48 PolarHBondContact O-N 2.77Å; R46-I49 WeakPolarHBondContact O-CG1 3.37Å; R46-A51 HydrophobicContact CG-CB 3.91Å; R46-D52 IonicContact CZ-OD2 2.58Å; R46-D52 IonicContact NE-OD1 2.67Å; R46-D52 IonicContact NE-OD2 3.31Å; R46-D52 PolarHBondContact NE-OD2 2.79Å; R46-D52 VanDerWaalsContact NE-OD2 3.11Å; R46-D52 IonicContact NH2-OD2 3.33Å; R46-D52 PolarHBondContact NH2-OD2 2.92Å; R46-L147 HydrophobicContact CB-CD2 3.88Å; R46-L147 HydrophobicContact CG-CD2 3.94Å
47V79.6Confident84.5Confident90 Ų9045.2 Ų45.255%0.54524%0.238SC..Hα-helixtrans-62.5-40.9176.1171.60000110.6N43 E44 F45 I49 M50N43-V47 WeakPolarHBondContact O-CG2 3.4Å; N43-V47 PolarHBondContact O-N 3.39Å; E44-V47 PolarHBondContact O-N 3.22Å; F45-V47 VanDerWaalsContact C-N 3.32Å; F45-V47 PolarHBondContact O-N 3.46Å; V47-I49 VanDerWaalsContact C-N 3.35Å; V47-I49 PolarHBondContact O-N 3.22Å; V47-M50 PolarHBondContact O-N 3.19Å; V47-M50 VanDerWaalsContact O-N 3.16Å
48S79.9Confident84.5Confident53 Ų5342.2 Ų42.237%0.37122%0.222SC..Hα-helixtrans-68-31.3-176.6-60.70000113.7E44 F45 R46 M50E44-S48 WeakPolarHBondContact O-CB 3.47Å; E44-S48 PolarHBondContact O-N 3.36Å; E44-S48 PolarHBondContact O-OG 3.12Å; F45-S48 WeakPolarHBondContact O-CA 3.42Å; F45-S48 WeakPolarHBondContact O-CB 3.09Å; F45-S48 PolarHBondContact O-N 2.05Å; R46-S48 VanDerWaalsContact C-N 3.29Å; R46-S48 PolarHBondContact O-N 2.77Å; S48-M50 PolarHBondContact O-N 2.86Å
49I77.4Confident84.5Confident14 Ų1443.9 Ų43.97%0.07223%0.234CC..THydrogen-bonded Turntrans-83.65.7175.664.6151.6000113.9F45 R46 V47 A51 L147 V193 L201F45-I49 HydrophobicContact CD1-CG2 4.45Å; F45-I49 HydrophobicContact CD2-CG2 4.41Å; F45-I49 HydrophobicContact CE1-CD1 4.44Å; F45-I49 HydrophobicContact CE1-CG2 3.94Å; F45-I49 HydrophobicContact CE2-CG2 3.89Å; F45-I49 HydrophobicContact CZ-CG2 3.63Å; F45-I49 PolarHBondContact O-N 3.5Å; R46-I49 WeakPolarHBondContact O-CG1 3.37Å; V47-I49 VanDerWaalsContact C-N 3.35Å; V47-I49 PolarHBondContact O-N 3.22Å; I49-A51 HydrophobicContact CD1-CB 4Å; I49-A51 HydrophobicContact CG1-CB 4.11Å; I49-A51 PolarHBondContact O-N 3.44Å; I49-A51 VanDerWaalsContact O-N 3.13Å; I49-L147 HydrophobicContact CD1-CB 4.27Å; I49-L147 HydrophobicContact CD1-CD1 4.2Å; I49-L147 HydrophobicContact CD1-CD2 3.37Å; I49-L147 HydrophobicContact CD1-CG 3.29Å; I49-L147 WeakPolarHBondContact CD1-O 3.38Å; I49-L147 HydrophobicContact CG1-CD2 4.16Å; I49-V193 HydrophobicContact CB-CG2 4.45Å; I49-V193 WeakPolarHBondContact O-CG2 3.44Å; I49-L201 HydrophobicContact CG2-CD1 3.91Å
50M74.8Confident84.9Confident44 Ų4447.2 Ų47.222%0.21725%0.245CC..THydrogen-bonded Turntrans62.516.3175.6-55.4-170175.300116V47 S48 D52 R53 L54 V193V47-M50 PolarHBondContact O-N 3.19Å; V47-M50 VanDerWaalsContact O-N 3.16Å; S48-M50 PolarHBondContact O-N 2.86Å; M50-D52 VanDerWaalsContact C-N 3.33Å; M50-D52 PolarHBondContact O-N 2.73Å; M50-R53 HydrophobicContact CB-CB 4.23Å; M50-R53 WeakPolarHBondContact O-CB 3.1Å; M50-R53 PolarHBondContact O-N 2.97Å; M50-L54 PolarHBondContact O-N 3.4Å; M50-V193 HydrophobicContact CG-CG2 4.36Å
51A72.4Confident85.1Confident3 Ų342.3 Ų42.33%0.02522%0.222CC..Hα-helixtrans-44.1-53.8173.900000113.2R46 I49 R53 L54 L55 L75R46-A51 HydrophobicContact CG-CB 3.91Å; I49-A51 HydrophobicContact CD1-CB 4Å; I49-A51 HydrophobicContact CG1-CB 4.11Å; I49-A51 PolarHBondContact O-N 3.44Å; I49-A51 VanDerWaalsContact O-N 3.13Å; A51-R53 VanDerWaalsContact C-N 3.31Å; A51-R53 PolarHBondContact O-N 3.39Å; A51-L54 PolarHBondContact O-N 3.05Å; A51-L55 PolarHBondContact O-N 3.33Å; A51-L75 HydrophobicContact CB-CB 4.3Å; A51-L75 HydrophobicContact CB-CD1 3.32Å; A51-L75 HydrophobicContact CB-CG 4.37Å
52D78.2Confident85.3Confident61 Ų6142.2 Ų42.233%0.32622%0.222SC..Hα-helixtrans-71.5-27.2-177.4-63.2-31.7000112.2R46 M50 A56R46-D52 IonicContact CZ-OD2 2.58Å; R46-D52 IonicContact NE-OD1 2.67Å; R46-D52 IonicContact NE-OD2 3.31Å; R46-D52 PolarHBondContact NE-OD2 2.79Å; R46-D52 VanDerWaalsContact NE-OD2 3.11Å; R46-D52 IonicContact NH2-OD2 3.33Å; R46-D52 PolarHBondContact NH2-OD2 2.92Å; M50-D52 VanDerWaalsContact C-N 3.33Å; M50-D52 PolarHBondContact O-N 2.73Å; D52-A56 WeakPolarHBondContact O-CB 3.32Å; D52-A56 PolarHBondContact O-N 3.16Å; D52-A56 VanDerWaalsContact O-N 3.09Å
53R84.3Confident85.5Confident150 Ų15044.3 Ų44.357%0.56624%0.239SC*.Hα-helixtrans-71.6-39.3175.7-64.7-174.6177.8-174.6-2111.7M50 A51 A56 A57M50-R53 HydrophobicContact CB-CB 4.23Å; M50-R53 WeakPolarHBondContact O-CB 3.1Å; M50-R53 PolarHBondContact O-N 2.97Å; A51-R53 VanDerWaalsContact C-N 3.31Å; A51-R53 PolarHBondContact O-N 3.39Å; R53-A56 PolarHBondContact O-N 2.96Å; R53-A57 WeakPolarHBondContact O-CB 3.37Å; R53-A57 PolarHBondContact O-N 3.07Å
54L87.4Confident85.8Confident1 Ų148.1 Ų48.11%0.00525%0.252CS..Hα-helixtrans-60.9-48174.2176.864.5000110.8M50 A51 A56 A57 V58 L153 F188 N191M50-L54 PolarHBondContact O-N 3.4Å; A51-L54 PolarHBondContact O-N 3.05Å; L54-A56 VanDerWaalsContact C-N 3.32Å; L54-A56 PolarHBondContact O-N 3.27Å; L54-A57 PolarHBondContact O-N 3.46Å; L54-V58 HydrophobicContact CD1-CG2 4.09Å; L54-V58 HydrophobicContact CG-CG2 4.39Å; L54-V58 VanDerWaalsContact O-CG2 3.31Å; L54-V58 WeakPolarHBondContact O-CG2 3.45Å; L54-V58 PolarHBondContact O-N 3.41Å; L54-L153 HydrophobicContact CD2-CD1 4.07Å; L54-L153 HydrophobicContact CD2-CD2 3.82Å; L54-L153 HydrophobicContact CD2-CG 4.38Å; L54-F188 HydrophobicContact CD1-CB 4.5Å; L54-F188 HydrophobicContact CD1-CD1 3.93Å; L54-F188 HydrophobicContact CD1-CD2 4.24Å; L54-F188 HydrophobicContact CD1-CE1 4.16Å; L54-F188 HydrophobicContact CD1-CE2 4.43Å; L54-F188 HydrophobicContact CD1-CG 3.97Å; L54-F188 HydrophobicContact CD1-CZ 4.39Å; L54-F188 HydrophobicContact CD2-CD1 3.97Å; L54-F188 HydrophobicContact CD2-CE1 3.73Å; L54-F188 HydrophobicContact CD2-CZ 4.37Å; L54-F188 HydrophobicContact CG-CE1 4.41Å; L54-N191 HydrophobicContact CB-CB 3.88Å; L54-N191 HydrophobicContact CD1-CB 4.12Å
55L87.3Confident85.9Confident25 Ų2546.9 Ų46.913%0.13125%0.245CC..Hα-helixtrans-56.5-46.8176.8-76.2171.7000111.4A51 A57 V58 S59 L72 L75 I156A51-L55 PolarHBondContact O-N 3.33Å; L55-A57 PolarHBondContact O-N 3.47Å; L55-V58 PolarHBondContact O-N 3.05Å; L55-S59 PolarHBondContact O-N 2.87Å; L55-S59 PolarHBondContact O-OG 3.24Å; L55-L72 HydrophobicContact CD2-CB 3.87Å; L55-L72 HydrophobicContact CD2-CD1 3.99Å; L55-L72 HydrophobicContact CD2-CG 4.49Å; L55-L75 HydrophobicContact CD1-CD1 4.02Å; L55-L75 HydrophobicContact CD1-CG 4.29Å; L55-L75 HydrophobicContact CG-CD1 4.29Å; L55-I156 HydrophobicContact CD2-CD1 3.53Å; L55-I156 HydrophobicContact CD2-CG1 3.91Å; L55-I156 HydrophobicContact CD2-CG2 4.24Å; L55-I156 HydrophobicContact CG-CD1 3.97Å
56A90.3Very high86Confident47 Ų4753.6 Ų53.639%0.38828%0.281SS..Hα-helixtrans-61.7-43.9176.700000112.5D52 R53 L54 S59 Q60D52-A56 WeakPolarHBondContact O-CB 3.32Å; D52-A56 PolarHBondContact O-N 3.16Å; D52-A56 VanDerWaalsContact O-N 3.09Å; R53-A56 PolarHBondContact O-N 2.96Å; L54-A56 VanDerWaalsContact C-N 3.32Å; L54-A56 PolarHBondContact O-N 3.27Å; A56-S59 PolarHBondContact O-N 3.32Å; A56-Q60 WeakPolarHBondContact O-CB 3.34Å; A56-Q60 VanDerWaalsContact O-CG 3.25Å; A56-Q60 WeakPolarHBondContact O-CG 3.46Å; A56-Q60 PolarHBondContact O-N 3.2Å
57A93.5Very high86.4Confident16 Ų1651.9 Ų51.913%0.13228%0.276CS..Hα-helixtrans-64.6-41.217900000112.1R53 L54 L55 Q60 C61 A187R53-A57 WeakPolarHBondContact O-CB 3.37Å; R53-A57 PolarHBondContact O-N 3.07Å; L54-A57 PolarHBondContact O-N 3.46Å; L55-A57 PolarHBondContact O-N 3.47Å; A57-Q60 PolarHBondContact O-N 2.98Å; A57-C61 PolarHBondContact O-N 3.13Å; A57-C61 PolarHBondContact O-SG 2.82Å; A57-A187 HydrophobicContact CB-CB 3.79Å
58V93Very high86.8Confident0 Ų051.5 Ų51.50%028%0.277CS..Hα-helixtrans-60.9-50.5174169.90000110.3L54 L55 Q60 C61 F62 L72 I156 S160 L184 F188L54-V58 HydrophobicContact CD1-CG2 4.09Å; L54-V58 HydrophobicContact CG-CG2 4.39Å; L54-V58 VanDerWaalsContact O-CG2 3.31Å; L54-V58 WeakPolarHBondContact O-CG2 3.45Å; L54-V58 PolarHBondContact O-N 3.41Å; L55-V58 PolarHBondContact O-N 3.05Å; V58-Q60 VanDerWaalsContact C-N 3.28Å; V58-Q60 PolarHBondContact O-N 3.44Å; V58-C61 WeakPolarHBondContact O-CB 3.2Å; V58-C61 PolarHBondContact O-N 3.44Å; V58-C61 VanDerWaalsContact O-N 3.11Å; V58-F62 HydrophobicContact CG1-CD2 4.02Å; V58-F62 HydrophobicContact CG1-CE2 3.78Å; V58-F62 VanDerWaalsContact O-CD2 3.29Å; V58-F62 WeakPolarHBondContact O-CD2 3.35Å; V58-F62 PolarHBondContact O-N 3.44Å; V58-L72 HydrophobicContact CB-CD1 4.33Å; V58-L72 HydrophobicContact CG1-CD1 3.79Å; V58-L72 HydrophobicContact CG1-CD2 4.22Å; V58-I156 HydrophobicContact CG2-CG2 4.23Å; V58-S160 WeakPolarHBondContact CG1-OG 3.28Å; V58-L184 HydrophobicContact CB-CD2 4.24Å; V58-L184 HydrophobicContact CG1-CD2 3.83Å; V58-L184 HydrophobicContact CG2-CD2 4.17Å; V58-F188 HydrophobicContact CG2-CE2 3.96Å; V58-F188 HydrophobicContact CG2-CZ 4.41Å
59S92.3Very high87.1Confident35 Ų3552.9 Ų52.925%0.24528%0.279CS..Hα-helixtrans-59.2-38177.1-64.50000112.9L55 A56 F62 S63L55-S59 PolarHBondContact O-N 2.87Å; L55-S59 PolarHBondContact O-OG 3.24Å; A56-S59 PolarHBondContact O-N 3.32Å; S59-F62 PolarHBondContact O-N 3.37Å; S59-S63 WeakPolarHBondContact O-CB 3.43Å; S59-S63 PolarHBondContact O-N 2.94Å; S59-S63 PolarHBondContact O-OG 3.19Å
60Q94.2Very high87.4Confident133 Ų13353.3 Ų53.362%0.62128%0.283SS*.Hα-helixtrans-65.2-39.7174.9-75.6172.910.800112.3A56 A57 V58 S63 K64A56-Q60 WeakPolarHBondContact O-CB 3.34Å; A56-Q60 VanDerWaalsContact O-CG 3.25Å; A56-Q60 WeakPolarHBondContact O-CG 3.46Å; A56-Q60 PolarHBondContact O-N 3.2Å; A57-Q60 PolarHBondContact O-N 2.98Å; V58-Q60 VanDerWaalsContact C-N 3.28Å; V58-Q60 PolarHBondContact O-N 3.44Å; Q60-S63 PolarHBondContact O-N 2.86Å; Q60-K64 VanDerWaalsContact O-CB 3.26Å; Q60-K64 WeakPolarHBondContact O-CB 3.33Å; Q60-K64 PolarHBondContact O-N 3.45Å
61C94.3Very high87.7Confident5 Ų560.5 Ų60.53%0.03431%0.313CS..Hα-helixtrans-59.7-47.9174.7-74.10000111.6A57 V58 S63 K64 Y65 L180 C183 L184A57-C61 PolarHBondContact O-N 3.13Å; A57-C61 PolarHBondContact O-SG 2.82Å; V58-C61 WeakPolarHBondContact O-CB 3.2Å; V58-C61 PolarHBondContact O-N 3.44Å; V58-C61 VanDerWaalsContact O-N 3.11Å; C61-S63 PolarHBondContact O-N 3.35Å; C61-K64 PolarHBondContact O-N 3.06Å; C61-Y65 WeakPolarHBondContact O-CD2 3.49Å; C61-Y65 PolarHBondContact O-N 2.04Å; C61-L180 HydrophobicContact CB-CD1 3.89Å; C61-C183 VanDerWaalsContact CA-SG 3.5Å; C61-C183 HydrophobicContact CB-CB 3.81Å; C61-C183 WeakPolarHBondContact CB-SG 3.19Å; C61-C183 WeakPolarHBondContact SG-CB 3.23Å; C61-C183 PolarHBondContact SG-O 3.48Å; C61-C183 CovalentContact SG-SG 2.05Å; C61-C183 PolarHBondContact SG-SG 3.02Å; C61-L184 HydrophobicContact CB-CD2 3.88Å; C61-L184 HydrophobicContact CB-CG 4.24Å
62F92.1Very high87.9Confident0 Ų061.8 Ų61.80%032%0.319CS..Hα-helixtrans-60.3-45.5176.1-78.2-78.7000112.1V58 S59 K64 Y65 N66 C67 I69 P70 A163 L180 L184V58-F62 HydrophobicContact CG1-CD2 4.02Å; V58-F62 HydrophobicContact CG1-CE2 3.78Å; V58-F62 VanDerWaalsContact O-CD2 3.29Å; V58-F62 WeakPolarHBondContact O-CD2 3.35Å; V58-F62 PolarHBondContact O-N 3.44Å; S59-F62 PolarHBondContact O-N 3.37Å; F62-K64 PolarHBondContact O-N 3.49Å; F62-Y65 PolarHBondContact O-N 2.94Å; F62-N66 PolarHBondContact O-N 2.96Å; F62-C67 HydrophobicContact CB-CB 4.41Å; F62-C67 HydrophobicContact CD1-CB 3.75Å; F62-C67 PolarHBondContact O-N 3.47Å; F62-I69 HydrophobicContact CB-CG1 3.93Å; F62-P70 HydrophobicContact CD2-CG 4.4Å; F62-P70 HydrophobicContact CE1-CG 4.45Å; F62-P70 HydrophobicContact CE2-CG 3.83Å; F62-P70 HydrophobicContact CZ-CG 3.89Å; F62-A163 HydrophobicContact CE1-CB 3.62Å; F62-A163 HydrophobicContact CZ-CB 3.68Å; F62-L180 HydrophobicContact CD1-CD1 4.31Å; F62-L180 HydrophobicContact CD1-CD2 3.93Å; F62-L180 HydrophobicContact CE1-CD1 4.49Å; F62-L180 HydrophobicContact CE1-CD2 3.73Å; F62-L180 HydrophobicContact CG-CD1 4.41Å; F62-L180 HydrophobicContact CZ-CD2 4.45Å; F62-L184 HydrophobicContact CD2-CD2 4.4Å; F62-L184 HydrophobicContact CE2-CD1 4.32Å; F62-L184 HydrophobicContact CE2-CD2 3.92Å; F62-L184 HydrophobicContact CZ-CD1 4.15Å
63S91Very high87.4Confident64 Ų6461 Ų6145%0.44832%0.318SS..Hα-helixtrans-62.1-43.8179.4-56.10000112.3S59 Q60 C61 Y65 N66S59-S63 WeakPolarHBondContact O-CB 3.43Å; S59-S63 PolarHBondContact O-N 2.94Å; S59-S63 PolarHBondContact O-OG 3.19Å; Q60-S63 PolarHBondContact O-N 2.86Å; C61-S63 PolarHBondContact O-N 3.35Å; S63-Y65 PolarHBondContact O-N 3.32Å; S63-N66 PolarHBondContact O-N 3.12Å; S63-N66 VanDerWaalsContact O-N 3.09Å
64K90.5Very high86.5Confident145 Ų14558.1 Ų58.163%0.6332%0.317SS*.Hα-helixtrans-59-30.5-179.3-179.6176.6178.6179.30113Q60 C61 F62Q60-K64 VanDerWaalsContact O-CB 3.26Å; Q60-K64 WeakPolarHBondContact O-CB 3.33Å; Q60-K64 PolarHBondContact O-N 3.45Å; C61-K64 PolarHBondContact O-N 3.06Å; F62-K64 PolarHBondContact O-N 3.49Å
65Y88.7Confident85.3Confident51 Ų5158.2 Ų58.220%0.232%0.318CS..THydrogen-bonded Turntrans-105.818.3-179.5-61.9-68.9000113.2C61 F62 S63 C67 N179 L180 C183C61-Y65 WeakPolarHBondContact O-CD2 3.49Å; C61-Y65 PolarHBondContact O-N 2.04Å; F62-Y65 PolarHBondContact O-N 2.94Å; S63-Y65 PolarHBondContact O-N 3.32Å; Y65-C67 PolarHBondContact O-N 3.23Å; Y65-N179 HydrophobicContact CD1-CB 4.29Å; Y65-N179 HydrophobicContact CE1-CB 3.58Å; Y65-N179 HydrophobicContact CE2-CB 4.47Å; Y65-N179 WeakPolarHBondContact CE2-O 3.38Å; Y65-N179 PolarHBondContact OH-O 3.14Å; Y65-L180 HydrophobicContact CD2-CB 3.91Å; Y65-L180 HydrophobicContact CD2-CD1 3.97Å; Y65-L180 HydrophobicContact CE2-CB 4.45Å; Y65-L180 HydrophobicContact CG-CB 4.41Å; Y65-C183 HydrophobicContact CE2-CB 3.75Å
66N86.2Confident83.9Confident144 Ų14463.3 Ų63.377%0.7734%0.341SS*.THydrogen-bonded Turntrans53.139.5179.1-60.3-43.9000113.2F62 S63F62-N66 PolarHBondContact O-N 2.96Å; S63-N66 PolarHBondContact O-N 3.12Å; S63-N66 VanDerWaalsContact O-N 3.09Å
67C87.2Confident82Confident9 Ų965.8 Ų65.86%0.06135%0.345CS..PPolyproline II helixtrans-102.4147.7176-61.80000110.9F62 Y65 I69 A169 C170 L180F62-C67 HydrophobicContact CB-CB 4.41Å; F62-C67 HydrophobicContact CD1-CB 3.75Å; F62-C67 PolarHBondContact O-N 3.47Å; Y65-C67 PolarHBondContact O-N 3.23Å; C67-I69 PolarHBondContact O-N 2.96Å; C67-A169 CarbonylContact C-O 3.47Å; C67-A169 VanDerWaalsContact CA-O 3.3Å; C67-A169 WeakPolarHBondContact CA-O 3.49Å; C67-C170 HydrophobicContact CB-CB 4.12Å; C67-C170 WeakPolarHBondContact CB-SG 3.41Å; C67-C170 VanDerWaalsContact SG-CA 3.58Å; C67-C170 WeakPolarHBondContact SG-CB 3.26Å; C67-C170 CovalentContact SG-SG 2.03Å; C67-C170 PolarHBondContact SG-SG 3.26Å; C67-L180 HydrophobicContact CB-CD2 4.48Å
68S87.6Confident80.1Confident81 Ų8166.9 Ų66.957%0.56635%0.347SS*.PPolyproline II helixtrans-61.4128.7170.3-61.20000110A169S68-A169 PolarHBondContact N-O 3.34Å
69I87.2Confident78.3Confident83 Ų8367 Ų6743%0.42635%0.348SS..PPolyproline II helixtrans-72.9125.2177.3-52.9174.4000107.7F62 C67F62-I69 HydrophobicContact CB-CG1 3.93Å; C67-I69 PolarHBondContact O-N 2.96Å
70P82.7Confident76.2Confident22 Ų2270.5 Ų70.514%0.14336%0.361CS..PPolyproline II helixtrans-64.1160.6175.426.6-33.3000110.9F62 L72 E159 A163F62-P70 HydrophobicContact CD2-CG 4.4Å; F62-P70 HydrophobicContact CE1-CG 4.45Å; F62-P70 HydrophobicContact CE2-CG 3.83Å; F62-P70 HydrophobicContact CZ-CG 3.89Å; P70-L72 VanDerWaalsContact C-N 3.31Å; P70-L72 HydrophobicContact CG-CD2 3.79Å; P70-L72 HydrophobicContact CG-CG 4.31Å; P70-L72 PolarHBondContact O-N 3.2Å; P70-E159 HydrophobicContact CB-CB 4.43Å; P70-A163 HydrophobicContact CB-CB 4.08Å; P70-A163 HydrophobicContact CG-CB 3.99Å
71K81.6Confident74.4Confident195 Ų19569.3 Ų69.385%0.84836%0.355SS*.  trans-70.790.7171.5-172.4-179.1179.7-176.30108.9
72L76Confident72.7Confident30 Ų3069.5 Ų69.516%0.15736%0.355CS..PPolyproline II helixtrans-75.4130.2179-60.9176000110.3L55 V58 P70 T74 I156 E159L55-L72 HydrophobicContact CD2-CB 3.87Å; L55-L72 HydrophobicContact CD2-CD1 3.99Å; L55-L72 HydrophobicContact CD2-CG 4.49Å; V58-L72 HydrophobicContact CB-CD1 4.33Å; V58-L72 HydrophobicContact CG1-CD1 3.79Å; V58-L72 HydrophobicContact CG1-CD2 4.22Å; P70-L72 VanDerWaalsContact C-N 3.31Å; P70-L72 HydrophobicContact CG-CD2 3.79Å; P70-L72 HydrophobicContact CG-CG 4.31Å; P70-L72 PolarHBondContact O-N 3.2Å; L72-T74 PolarHBondContact O-N 3.29Å; L72-I156 HydrophobicContact CD2-CG2 4.21Å; L72-E159 HydrophobicContact CD2-CB 4.45Å
73S67.9Low71.1Confident45 Ų4571.7 Ų71.732%0.31537%0.365SS..PPolyproline II helixtrans-66.9123.9176.5-55.50000111.1
74T65.1Low69.5Low89 Ų8972.7 Ų72.755%0.54636%0.364SS..PPolyproline II helixtrans-62139.2175.449.60000111.1L72 Q76 R82L72-T74 PolarHBondContact O-N 3.29Å; T74-Q76 PolarHBondContact O-N 3.17Å; T74-R82 VanDerWaalsContact O-CZ 3.26Å; T74-R82 PolarHBondContact O-NH1 3.39Å; T74-R82 PolarHBondContact O-NH2 3.29Å
75L63.4Low68.1Low4 Ų469.7 Ų69.72%0.02135%0.349CS..THydrogen-bonded Turntrans-75.532.5-179.9-74162.2000114.3A51 L55 R82 L147 I156A51-L75 HydrophobicContact CB-CB 4.3Å; A51-L75 HydrophobicContact CB-CD1 3.32Å; A51-L75 HydrophobicContact CB-CG 4.37Å; L55-L75 HydrophobicContact CD1-CD1 4.02Å; L55-L75 HydrophobicContact CD1-CG 4.29Å; L55-L75 HydrophobicContact CG-CD1 4.29Å; L75-R82 VanDerWaalsContact C-NH2 3.3Å; L75-L147 HydrophobicContact CB-CD1 4.08Å; L75-L147 HydrophobicContact CD2-CD1 3.99Å; L75-I156 HydrophobicContact CD1-CD1 3.8Å; L75-I156 HydrophobicContact CD2-CD1 4.2Å; L75-I156 HydrophobicContact CG-CD1 4.07Å
76Q56.6Low66.8Low131 Ų13168.7 Ų68.761%0.61235%0.345SS*.THydrogen-bonded Turntrans-89-32.1177.8-65.2-169.95.100113.8T74T74-Q76 PolarHBondContact O-N 3.17Å
77E51.6Low65.5Low100 Ų10064.4 Ų64.447%0.46732%0.324SS..SBendtrans-86.4148.1-178.3-60.8-171137.200113.2G79 R82 R85E77-G79 PolarHBondContact O-N 3.27Å; E77-R82 PolarHBondContact O-NE 3.49Å; E77-R82 VanDerWaalsContact O-NE 3.15Å; E77-R82 PolarHBondContact O-NH2 3.15Å; E77-R85 IonicContact OE1-CZ 3.92Å; E77-R85 IonicContact OE1-NH1 2.81Å; E77-R85 PolarHBondContact OE1-NH1 2.89Å; E77-R85 IonicContact OE2-NH1 3.13Å; E77-R85 PolarHBondContact OE2-NH1 3.13Å; E77-R85 VanDerWaalsContact OE2-NH1 3.13Å
78E54Low64.1Low38 Ų3868 Ų6818%0.17834%0.342CS..  trans-51126.7179.1-73.5171.2-15400111.2E81 R82 H139 K143E78-E81 HydrophobicContact CB-CB 4.14Å; E78-E81 HydrophobicContact CB-CG 4.47Å; E78-R82 WeakPolarHBondContact O-CA 3.32Å; E78-R82 WeakPolarHBondContact O-CB 3.48Å; E78-R82 PolarHBondContact O-N 3.27Å; E78-H139 IonicContact OE1-CE1 3.53Å; E78-H139 PolarHBondContact OE1-CE1 3.5Å; E78-K143 HydrophobicContact CG-CG 3.95Å; E78-K143 WeakPolarHBondContact OE1-CE 3.25Å; E78-K143 IonicContact OE1-NZ 3.88Å
79G54.4Low62.7Low2 Ų268.3 Ų68.32%0.02133%0.334CS..Hα-helixtrans-68.8-38.7-167.400000114.4E77 F83 D146E77-G79 PolarHBondContact O-N 3.27Å; G79-F83 VanDerWaalsContact O-CB 3.23Å; G79-F83 WeakPolarHBondContact O-CB 3.48Å; G79-F83 PolarHBondContact O-N 2.88Å; G79-D146 VanDerWaalsContact N-CB 3.35Å; G79-D146 PolarHBondContact N-OD2 3.14Å
80E48.3Very low61.3Low109 Ų10966.9 Ų66.951%0.50933%0.328SS..Hα-helixtrans-75.3-46.9178.2-170.6170.7-162.700110.5R82 F83 I84 D146E80-R82 VanDerWaalsContact C-N 3.27Å; E80-R82 PolarHBondContact O-N 3.49Å; E80-F83 PolarHBondContact O-N 3.49Å; E80-F83 VanDerWaalsContact O-N 3.13Å; E80-I84 HydrophobicContact CG-CD1 4.11Å; E80-I84 WeakPolarHBondContact O-CB 3.29Å; E80-I84 VanDerWaalsContact O-CG1 3.29Å; E80-I84 WeakPolarHBondContact O-CG1 3.29Å; E80-I84 PolarHBondContact O-N 3.36Å; E80-D146 PolarHBondContact N-OD2 2.87Å
81E55.6Low59.8Low108 Ų10868.2 Ų68.251%0.50534%0.34SS..Hα-helixtrans-61.1-36.7171.7-70-163.2166.500112.1E78 R85E78-E81 HydrophobicContact CB-CB 4.14Å; E78-E81 HydrophobicContact CB-CG 4.47Å; E81-R85 WeakPolarHBondContact O-CA 2.96Å; E81-R85 WeakPolarHBondContact O-CB 3.01Å; E81-R85 PolarHBondContact O-N 3.21Å
82R59.5Low57.9Low9 Ų964.3 Ų64.33%0.03433%0.333CS..Hα-helixtrans-65.8-44.4173.1173.2-153.4-60.7-119.5-17.6110.5T74 L75 E77 E78 E80 R85 W86 P155T74-R82 VanDerWaalsContact O-CZ 3.26Å; T74-R82 PolarHBondContact O-NH1 3.39Å; T74-R82 PolarHBondContact O-NH2 3.29Å; L75-R82 VanDerWaalsContact C-NH2 3.3Å; E77-R82 PolarHBondContact O-NE 3.49Å; E77-R82 VanDerWaalsContact O-NE 3.15Å; E77-R82 PolarHBondContact O-NH2 3.15Å; E78-R82 WeakPolarHBondContact O-CA 3.32Å; E78-R82 WeakPolarHBondContact O-CB 3.48Å; E78-R82 PolarHBondContact O-N 3.27Å; E80-R82 VanDerWaalsContact C-N 3.27Å; E80-R82 PolarHBondContact O-N 3.49Å; R82-R85 PolarHBondContact O-N 3.21Å; R82-W86 WeakPolarHBondContact O-CA 3.38Å; R82-W86 WeakPolarHBondContact O-CB 3.34Å; R82-W86 PolarHBondContact O-N 3.09Å; R82-P155 HydrophobicContact CG-CG 4.06Å
83F57.4Low56.5Low46 Ų4668.4 Ų68.420%0.20236%0.359CS..Hα-helixtrans-64.2-46.3177.9176-105.1000109.8G79 E80 W86 V87 W154G79-F83 VanDerWaalsContact O-CB 3.23Å; G79-F83 WeakPolarHBondContact O-CB 3.48Å; G79-F83 PolarHBondContact O-N 2.88Å; E80-F83 PolarHBondContact O-N 3.49Å; E80-F83 VanDerWaalsContact O-N 3.13Å; F83-W86 AromaticContact CD2-CE3 3.86Å; F83-W86 HydrophobicContact CD2-CE3 3.86Å; F83-W86 HydrophobicContact CD2-CZ3 4.24Å; F83-W86 AromaticContact CE2-CE3 3.88Å; F83-W86 HydrophobicContact CE2-CE3 3.88Å; F83-W86 AromaticContact CE2-CZ3 3.78Å; F83-W86 HydrophobicContact CE2-CZ3 3.78Å; F83-W86 PolarHBondContact O-N 3.49Å; F83-V87 HydrophobicContact CD1-CG2 4.04Å; F83-V87 HydrophobicContact CD2-CG2 4.02Å; F83-V87 HydrophobicContact CE1-CG2 3.6Å; F83-V87 HydrophobicContact CE2-CG2 3.56Å; F83-V87 HydrophobicContact CG-CG2 4.24Å; F83-V87 HydrophobicContact CZ-CG2 3.34Å; F83-V87 VanDerWaalsContact O-CB 3.31Å; F83-V87 WeakPolarHBondContact O-CB 3.47Å; F83-V87 VanDerWaalsContact O-CG2 3.24Å; F83-V87 WeakPolarHBondContact O-CG2 3.48Å; F83-V87 PolarHBondContact O-N 3.45Å; F83-W154 HydrophobicContact CD2-CB 4.06Å; F83-W154 HydrophobicContact CD2-CE3 4.48Å; F83-W154 HydrophobicContact CE2-CB 4.21Å; F83-W154 HydrophobicContact CE2-CD2 4.08Å; F83-W154 AromaticContact CE2-CE3 3.55Å; F83-W154 HydrophobicContact CE2-CE3 3.55Å; F83-W154 HydrophobicContact CE2-CG 4.41Å; F83-W154 HydrophobicContact CE2-CZ3 4.2Å; F83-W154 HydrophobicContact CZ-CE3 4.12Å; F83-W154 HydrophobicContact CZ-CZ3 4.33Å
84I58Low55Low85 Ų8576.8 Ų76.844%0.43638%0.384SS..Hα-helixtrans-58.8-51.4174-68.8168.4000109.7E80 W86 V87 L88E80-I84 HydrophobicContact CG-CD1 4.11Å; E80-I84 WeakPolarHBondContact O-CB 3.29Å; E80-I84 VanDerWaalsContact O-CG1 3.29Å; E80-I84 WeakPolarHBondContact O-CG1 3.29Å; E80-I84 PolarHBondContact O-N 3.36Å; I84-W86 VanDerWaalsContact C-N 3.3Å; I84-W86 PolarHBondContact O-N 3.22Å; I84-V87 PolarHBondContact O-N 3.08Å; I84-L88 HydrophobicContact CG2-CD1 3.59Å; I84-L88 HydrophobicContact CG2-CG 4.19Å; I84-L88 VanDerWaalsContact O-CB 3.26Å; I84-L88 WeakPolarHBondContact O-CB 3.26Å; I84-L88 WeakPolarHBondContact O-CG 3.33Å; I84-L88 PolarHBondContact O-N 2.99Å
85R61.3Low53.8Low83 Ų8378.8 Ų78.831%0.31339%0.391SS..Hα-helixtrans-58.8-41.6177.3-168.7-171.7-61.4174.20.1111.5E77 E81 R82 L88 Q89 Y99E77-R85 IonicContact OE1-CZ 3.92Å; E77-R85 IonicContact OE1-NH1 2.81Å; E77-R85 PolarHBondContact OE1-NH1 2.89Å; E77-R85 IonicContact OE2-NH1 3.13Å; E77-R85 PolarHBondContact OE2-NH1 3.13Å; E77-R85 VanDerWaalsContact OE2-NH1 3.13Å; E81-R85 WeakPolarHBondContact O-CA 2.96Å; E81-R85 WeakPolarHBondContact O-CB 3.01Å; E81-R85 PolarHBondContact O-N 3.21Å; R82-R85 PolarHBondContact O-N 3.21Å; R85-L88 PolarHBondContact O-N 2.92Å; R85-Q89 HydrophobicContact CG-CG 4.49Å; R85-Q89 WeakPolarHBondContact O-CB 3.42Å; R85-Q89 WeakPolarHBondContact O-CG 3.42Å; R85-Q89 PolarHBondContact O-N 3.5Å; R85-Y99 WeakPolarHBondContact CG-OH 3.18Å; R85-Y99 PolarHBondContact O-OH 2.81Å
86W61.4Low53Low29 Ų2988.3 Ų88.311%0.1144%0.435CS..Hα-helixtrans-69.5-44.1179.1171.981.4000111.7R82 F83 I84 L88 Q89 N90 P155 F158R82-W86 WeakPolarHBondContact O-CA 3.38Å; R82-W86 WeakPolarHBondContact O-CB 3.34Å; R82-W86 PolarHBondContact O-N 3.09Å; F83-W86 AromaticContact CD2-CE3 3.86Å; F83-W86 HydrophobicContact CD2-CE3 3.86Å; F83-W86 HydrophobicContact CD2-CZ3 4.24Å; F83-W86 AromaticContact CE2-CE3 3.88Å; F83-W86 HydrophobicContact CE2-CE3 3.88Å; F83-W86 AromaticContact CE2-CZ3 3.78Å; F83-W86 HydrophobicContact CE2-CZ3 3.78Å; F83-W86 PolarHBondContact O-N 3.49Å; I84-W86 VanDerWaalsContact C-N 3.3Å; I84-W86 PolarHBondContact O-N 3.22Å; W86-L88 VanDerWaalsContact C-N 3.34Å; W86-Q89 PolarHBondContact O-N 3.01Å; W86-N90 VanDerWaalsContact CD1-ND2 3.26Å; W86-N90 HydrophobicContact CZ2-CB 4.2Å; W86-N90 PolarHBondContact NE1-ND2 2.93Å; W86-N90 WeakPolarHBondContact O-CB 3.39Å; W86-N90 PolarHBondContact O-N 2.92Å; W86-N90 PolarHBondContact O-ND2 2.7Å; W86-P155 HydrophobicContact CB-CG 4.18Å; W86-P155 HydrophobicContact CD2-CB 4.5Å; W86-P155 HydrophobicContact CD2-CG 4.35Å; W86-P155 HydrophobicContact CG-CB 4.06Å; W86-P155 HydrophobicContact CG-CG 4Å; W86-F158 AromaticContact CE2-CD1 3.66Å; W86-F158 AromaticContact CE2-CG 3.8Å; W86-F158 HydrophobicContact CH2-CB 4.03Å; W86-F158 HydrophobicContact CH2-CD1 4.22Å; W86-F158 AromaticContact CH2-CD2 3.51Å; W86-F158 HydrophobicContact CH2-CD2 3.51Å; W86-F158 AromaticContact CH2-CE2 3.9Å; W86-F158 HydrophobicContact CH2-CE2 3.9Å; W86-F158 AromaticContact CH2-CG 3.67Å; W86-F158 HydrophobicContact CH2-CG 3.67Å; W86-F158 HydrophobicContact CH2-CZ 4.4Å; W86-F158 HydrophobicContact CZ2-CB 3.57Å; W86-F158 AromaticContact CZ2-CD1 3.17Å; W86-F158 HydrophobicContact CZ2-CD1 3.17Å; W86-F158 AromaticContact CZ2-CD2 3.28Å; W86-F158 HydrophobicContact CZ2-CD2 3.28Å; W86-F158 AromaticContact CZ2-CE1 3.5Å; W86-F158 HydrophobicContact CZ2-CE1 3.5Å; W86-F158 VanDerWaalsContact CZ2-CE1 3.5Å; W86-F158 AromaticContact CZ2-CE2 3.61Å; W86-F158 HydrophobicContact CZ2-CE2 3.61Å; W86-F158 AromaticContact CZ2-CG 3.02Å; W86-F158 HydrophobicContact CZ2-CG 3.02Å; W86-F158 AromaticContact CZ2-CZ 3.7Å; W86-F158 HydrophobicContact CZ2-CZ 3.7Å; W86-F158 AromaticContact NE1-CD1 3.64Å
87V58.2Low52.6Low55 Ų5585.7 Ų85.733%0.33342%0.424SS..Hα-helixtrans-58.5-49.5172.3166.50000108.7F83 I84 Q89 N90 A91F83-V87 HydrophobicContact CD1-CG2 4.04Å; F83-V87 HydrophobicContact CD2-CG2 4.02Å; F83-V87 HydrophobicContact CE1-CG2 3.6Å; F83-V87 HydrophobicContact CE2-CG2 3.56Å; F83-V87 HydrophobicContact CG-CG2 4.24Å; F83-V87 HydrophobicContact CZ-CG2 3.34Å; F83-V87 VanDerWaalsContact O-CB 3.31Å; F83-V87 WeakPolarHBondContact O-CB 3.47Å; F83-V87 VanDerWaalsContact O-CG2 3.24Å; F83-V87 WeakPolarHBondContact O-CG2 3.48Å; F83-V87 PolarHBondContact O-N 3.45Å; I84-V87 PolarHBondContact O-N 3.08Å; V87-Q89 PolarHBondContact O-N 3.14Å; V87-N90 PolarHBondContact O-N 3.32Å; V87-A91 WeakPolarHBondContact O-CB 3.02Å; V87-A91 PolarHBondContact O-N 3.19Å
88L58.2Low52.7Low85 Ų8584 Ų8445%0.44542%0.424SS..Hα-helixtrans-63.3-41.1178.5-67.6172.4000112.1I84 R85 W86 N90 Y99I84-L88 HydrophobicContact CG2-CD1 3.59Å; I84-L88 HydrophobicContact CG2-CG 4.19Å; I84-L88 VanDerWaalsContact O-CB 3.26Å; I84-L88 WeakPolarHBondContact O-CB 3.26Å; I84-L88 WeakPolarHBondContact O-CG 3.33Å; I84-L88 PolarHBondContact O-N 2.99Å; R85-L88 PolarHBondContact O-N 2.92Å; W86-L88 VanDerWaalsContact C-N 3.34Å; L88-N90 PolarHBondContact O-N 2.04Å; L88-Y99 HydrophobicContact CB-CE2 4.04Å
89Q59.4Low52.7Low86 Ų8685.5 Ų85.540%0.40243%0.428SS..Hα-helixtrans-65.8-33.1176.1-82.9171.5-2.200113.6R85 W86 V87 T92 Y99R85-Q89 HydrophobicContact CG-CG 4.49Å; R85-Q89 WeakPolarHBondContact O-CB 3.42Å; R85-Q89 WeakPolarHBondContact O-CG 3.42Å; R85-Q89 PolarHBondContact O-N 3.5Å; W86-Q89 PolarHBondContact O-N 3.01Å; V87-Q89 PolarHBondContact O-N 3.14Å; Q89-T92 WeakPolarHBondContact O-CG2 3.49Å; Q89-Y99 HydrophobicContact CB-CE1 4.45Å; Q89-Y99 HydrophobicContact CG-CD1 4.22Å; Q89-Y99 HydrophobicContact CG-CE1 3.27Å; Q89-Y99 WeakPolarHBondContact CG-OH 3.18Å
90N56.8Low53Low53 Ų5393 Ų9328%0.28346%0.463SS..Hα-helixtrans-98.4-10.6-178.6-72.8-91.2000112.6W86 V87 L88 T92W86-N90 VanDerWaalsContact CD1-ND2 3.26Å; W86-N90 HydrophobicContact CZ2-CB 4.2Å; W86-N90 PolarHBondContact NE1-ND2 2.93Å; W86-N90 WeakPolarHBondContact O-CB 3.39Å; W86-N90 PolarHBondContact O-N 2.92Å; W86-N90 PolarHBondContact O-ND2 2.7Å; V87-N90 PolarHBondContact O-N 3.32Å; L88-N90 PolarHBondContact O-N 2.04Å; N90-T92 PolarHBondContact O-N 3.19Å
91A51Low53.7Low50 Ų5093 Ų9341%0.41347%0.466SS..  trans-8229.6172.200000112.8V87 V93V87-A91 WeakPolarHBondContact O-CB 3.02Å; V87-A91 PolarHBondContact O-N 3.19Å; A91-V93 PolarHBondContact O-N 3Å
92T41.5Very low54.2Low113 Ų11388.1 Ų88.169%0.69344%0.444SS*.THydrogen-bonded Turntrans-63.846.8-176.843.40000115.3Q89 N90Q89-T92 WeakPolarHBondContact O-CG2 3.49Å; N90-T92 PolarHBondContact O-N 3.19Å
93V47.4Very low54.6Low117 Ų11790.9 Ų90.971%0.70946%0.459SS*.THydrogen-bonded Turntrans-131.1-20.1176.1-1790000112.9A91A91-V93 PolarHBondContact O-N 3Å
94W37Very low55.2Low221 Ų22192 Ų9284%0.83747%0.465SS*.SBendtrans-108.4-16.4-164.6-68.397.1000117.4
95L39.6Very low55.9Low130 Ų13088.3 Ų88.368%0.68145%0.447SS*.  trans-116.2-10.3-167.3-70.4174000116.5I97L95-I97 WeakPolarHBondContact O-CG1 3.43Å; L95-I97 PolarHBondContact O-N 3.25Å
96E45.5Very low56.3Low205 Ų20588.7 Ų88.796%0.95845%0.453SS*.  trans43.710.7178.8-71.9-170.8167.400117.1
97I48.2Very low57Low75 Ų7594.4 Ų94.439%0.38548%0.475SS..SBendtrans-87.5130.1172.6-64.3157.1000106.2L95 Y99 Y258L95-I97 WeakPolarHBondContact O-CG1 3.43Å; L95-I97 PolarHBondContact O-N 3.25Å; I97-Y99 VanDerWaalsContact C-N 3.29Å; I97-Y99 PolarHBondContact O-N 2.99Å; I97-Y258 HydrophobicContact CD1-CD1 4.14Å; I97-Y258 HydrophobicContact CG2-CD1 3.7Å; I97-Y258 HydrophobicContact CG2-CE1 3.86Å
98S53.5Low57.9Low64 Ų6495.3 Ų95.345%0.44848%0.475SS..  trans-55.295.3168.3176.70000109E100 D101 G102S98-E100 PolarHBondContact O-N 3.38Å; S98-D101 WeakPolarHBondContact CB-OD2 3.39Å; S98-D101 PolarHBondContact O-N 2.87Å; S98-D101 VanDerWaalsContact O-N 3.13Å; S98-D101 PolarHBondContact OG-OD2 3.26Å; S98-G102 PolarHBondContact O-N 2.93Å
99Y54.6Low58.8Low71 Ų7191.6 Ų91.628%0.27846%0.456SS..Hα-helixtrans-60.8-35.3-170.2172.8-97.3000112.5R85 L88 Q89 I97 G102 I103R85-Y99 WeakPolarHBondContact CG-OH 3.18Å; R85-Y99 PolarHBondContact O-OH 2.81Å; L88-Y99 HydrophobicContact CB-CE2 4.04Å; Q89-Y99 HydrophobicContact CB-CE1 4.45Å; Q89-Y99 HydrophobicContact CG-CD1 4.22Å; Q89-Y99 HydrophobicContact CG-CE1 3.27Å; Q89-Y99 WeakPolarHBondContact CG-OH 3.18Å; I97-Y99 VanDerWaalsContact C-N 3.29Å; I97-Y99 PolarHBondContact O-N 2.99Å; Y99-G102 PolarHBondContact O-N 3.5Å; Y99-I103 HydrophobicContact CD1-CD1 3.92Å; Y99-I103 HydrophobicContact CD1-CG1 4.41Å; Y99-I103 HydrophobicContact CE1-CD1 3.13Å; Y99-I103 HydrophobicContact CE1-CG1 3.92Å; Y99-I103 HydrophobicContact CE2-CD1 4.18Å; Y99-I103 HydrophobicContact CE2-CG1 4.22Å; Y99-I103 PolarHBondContact O-N 3.39Å; Y99-I103 WeakPolarHBondContact OH-CD1 3.45Å
100E60.1Low59.6Low160 Ų16093.8 Ų93.875%0.74847%0.466SS*.Hα-helixtrans-65.2-43.8176.7-67.9-177.6163.200111.1S98 G102 I103 E104S98-E100 PolarHBondContact O-N 3.38Å; E100-G102 VanDerWaalsContact C-N 3.33Å; E100-G102 PolarHBondContact O-N 3.23Å; E100-I103 PolarHBondContact O-N 3.41Å; E100-E104 WeakPolarHBondContact O-CB 3.45Å; E100-E104 PolarHBondContact O-N 3.34Å
101D62.9Low60.8Low109 Ų10993.5 Ų93.558%0.58347%0.472SS*.Hα-helixtrans-65.3-39175.2-62.4-33.2000110.9S98 E104 C105S98-D101 WeakPolarHBondContact CB-OD2 3.39Å; S98-D101 PolarHBondContact O-N 2.87Å; S98-D101 VanDerWaalsContact O-N 3.13Å; S98-D101 PolarHBondContact OG-OD2 3.26Å; D101-E104 PolarHBondContact O-N 3.44Å; D101-C105 VanDerWaalsContact O-CB 3.24Å; D101-C105 WeakPolarHBondContact O-CB 2.99Å; D101-C105 PolarHBondContact O-N 3.37Å
102G66.2Low62.5Low4 Ų493.3 Ų93.34%0.04146%0.461CS..Hα-helixtrans-62.7-47.3175.400000113.5S98 Y99 E100 C105 M106 Y258S98-G102 PolarHBondContact O-N 2.93Å; Y99-G102 PolarHBondContact O-N 3.5Å; E100-G102 VanDerWaalsContact C-N 3.33Å; E100-G102 PolarHBondContact O-N 3.23Å; G102-C105 PolarHBondContact O-N 2.58Å; G102-M106 WeakPolarHBondContact O-CG 3.36Å; G102-M106 PolarHBondContact O-N 3.31Å; G102-Y258 WeakPolarHBondContact CA-OH 3.49Å; G102-Y258 PolarHBondContact O-OH 3.1Å
103I67.6Low64.5Low68 Ų6889.7 Ų89.735%0.34944%0.439SS..Hα-helixtrans-59.4-51.5175.1-75.7179.5000110.2Y99 E100 C105 M106 R107Y99-I103 HydrophobicContact CD1-CD1 3.92Å; Y99-I103 HydrophobicContact CD1-CG1 4.41Å; Y99-I103 HydrophobicContact CE1-CD1 3.13Å; Y99-I103 HydrophobicContact CE1-CG1 3.92Å; Y99-I103 HydrophobicContact CE2-CD1 4.18Å; Y99-I103 HydrophobicContact CE2-CG1 4.22Å; Y99-I103 PolarHBondContact O-N 3.39Å; Y99-I103 WeakPolarHBondContact OH-CD1 3.45Å; E100-I103 PolarHBondContact O-N 3.41Å; I103-C105 PolarHBondContact O-N 2.84Å; I103-M106 PolarHBondContact O-N 2.96Å; I103-M106 VanDerWaalsContact O-N 3.14Å; I103-R107 WeakPolarHBondContact O-CB 3.31Å; I103-R107 PolarHBondContact O-N 2.98Å
104E71.8Confident66.4Low70 Ų7087.4 Ų87.433%0.32742%0.418SS..Hα-helixtrans-61.9-38.9-175.3177.452.4-15300110E100 D101 R107 Q108E100-E104 WeakPolarHBondContact O-CB 3.45Å; E100-E104 PolarHBondContact O-N 3.34Å; D101-E104 PolarHBondContact O-N 3.44Å; E104-R107 WeakPolarHBondContact O-CB 3.36Å; E104-R107 PolarHBondContact O-N 3.39Å; E104-R107 IonicContact OE1-CZ 3.62Å; E104-R107 IonicContact OE1-NE 3.89Å; E104-R107 PolarHBondContact OE1-NE 3.38Å; E104-R107 IonicContact OE1-NH2 3.66Å; E104-R107 PolarHBondContact OE1-NH2 3.21Å; E104-R107 IonicContact OE2-CZ 3.38Å; E104-R107 IonicContact OE2-NE 2.68Å; E104-R107 PolarHBondContact OE2-NE 2.98Å; E104-R107 IonicContact OE2-NH2 3.11Å; E104-R107 PolarHBondContact OE2-NH2 3.36Å; E104-Q108 VanDerWaalsContact O-CG 3.28Å; E104-Q108 WeakPolarHBondContact O-CG 3.28Å; E104-Q108 PolarHBondContact O-N 2.9Å; E104-Q108 PolarHBondContact OE1-NE2 3.15Å
105C71.8Confident68.9Low6 Ų682.2 Ų82.24%0.04140%0.403CS..Hα-helixtrans-59.3-50172.21800000112.8D101 G102 I103 R107 Q108 S109 C257D101-C105 VanDerWaalsContact O-CB 3.24Å; D101-C105 WeakPolarHBondContact O-CB 2.99Å; D101-C105 PolarHBondContact O-N 3.37Å; G102-C105 PolarHBondContact O-N 2.58Å; I103-C105 PolarHBondContact O-N 2.84Å; C105-R107 VanDerWaalsContact C-N 3.28Å; C105-R107 PolarHBondContact O-N 3.25Å; C105-Q108 CarbonylContact O-C 3.55Å; C105-Q108 WeakPolarHBondContact O-CB 3.47Å; C105-Q108 PolarHBondContact O-N 2.84Å; C105-Q108 VanDerWaalsContact O-N 3.08Å; C105-S109 PolarHBondContact O-N 2.91Å; C105-S109 PolarHBondContact O-OG 3.14Å; C105-C257 HydrophobicContact CB-CB 3.49Å; C105-C257 VanDerWaalsContact CB-CB 3.49Å; C105-C257 WeakPolarHBondContact CB-SG 3.2Å; C105-C257 WeakPolarHBondContact SG-CB 3.11Å; C105-C257 CovalentContact SG-SG 1.99Å; C105-C257 PolarHBondContact SG-SG 2.84Å
106M70.1Confident71.4Confident92 Ų9276 Ų7645%0.45337%0.37SS..Hα-helixtrans-63.6-35.3179-72.4-60.1-64.800112.4G102 I103 Q108 S109 H110 Y258G102-M106 WeakPolarHBondContact O-CG 3.36Å; G102-M106 PolarHBondContact O-N 3.31Å; I103-M106 PolarHBondContact O-N 2.96Å; I103-M106 VanDerWaalsContact O-N 3.14Å; M106-Q108 VanDerWaalsContact C-N 3.3Å; M106-Q108 PolarHBondContact O-N 3.42Å; M106-S109 WeakPolarHBondContact O-CB 3.23Å; M106-S109 PolarHBondContact O-N 2.02Å; M106-H110 WeakPolarHBondContact O-CB 3.35Å; M106-H110 PolarHBondContact O-N 2.79Å; M106-Y258 HydrophobicContact CG-CE2 4.37Å; M106-Y258 WeakPolarHBondContact CG-OH 3.37Å; M106-Y258 HydrophobicContact SD-CE2 4.17Å
107R74.7Confident73.4Confident148 Ų14867.3 Ų67.356%0.55833%0.33SS*.Hα-helixtrans-60.5-42.7172.9-168.6-172.27482.62.3110.9I103 E104 C105 H110 A111I103-R107 WeakPolarHBondContact O-CB 3.31Å; I103-R107 PolarHBondContact O-N 2.98Å; E104-R107 WeakPolarHBondContact O-CB 3.36Å; E104-R107 PolarHBondContact O-N 3.39Å; E104-R107 IonicContact OE1-CZ 3.62Å; E104-R107 IonicContact OE1-NE 3.89Å; E104-R107 PolarHBondContact OE1-NE 3.38Å; E104-R107 IonicContact OE1-NH2 3.66Å; E104-R107 PolarHBondContact OE1-NH2 3.21Å; E104-R107 IonicContact OE2-CZ 3.38Å; E104-R107 IonicContact OE2-NE 2.68Å; E104-R107 PolarHBondContact OE2-NE 2.98Å; E104-R107 IonicContact OE2-NH2 3.11Å; E104-R107 PolarHBondContact OE2-NH2 3.36Å; C105-R107 VanDerWaalsContact C-N 3.28Å; C105-R107 PolarHBondContact O-N 3.25Å; R107-H110 PolarHBondContact O-N 3.17Å; R107-A111 WeakPolarHBondContact O-CB 3.5Å; R107-A111 PolarHBondContact O-N 3.17Å
108Q77.4Confident75.4Confident75 Ų7565.1 Ų65.135%0.3532%0.318SS..Hα-helixtrans-70-38.2176.4-67.5173.512.900112.5E104 C105 M106 H110 A111 F112E104-Q108 VanDerWaalsContact O-CG 3.28Å; E104-Q108 WeakPolarHBondContact O-CG 3.28Å; E104-Q108 PolarHBondContact O-N 2.9Å; E104-Q108 PolarHBondContact OE1-NE2 3.15Å; C105-Q108 CarbonylContact O-C 3.55Å; C105-Q108 WeakPolarHBondContact O-CB 3.47Å; C105-Q108 PolarHBondContact O-N 2.84Å; C105-Q108 VanDerWaalsContact O-N 3.08Å; M106-Q108 VanDerWaalsContact C-N 3.3Å; M106-Q108 PolarHBondContact O-N 3.42Å; Q108-H110 VanDerWaalsContact C-N 3.34Å; Q108-H110 PolarHBondContact O-N 3.35Å; Q108-A111 PolarHBondContact O-N 2.97Å; Q108-F112 WeakPolarHBondContact O-CB 3.4Å; Q108-F112 PolarHBondContact O-N 2.86Å
109S77Confident77.3Confident6 Ų665.8 Ų65.84%0.04231%0.313CS..Hα-helixtrans-57.8-47.4172-61.20000110.9C105 M106 A111 F112 T113 R253C105-S109 PolarHBondContact O-N 2.91Å; C105-S109 PolarHBondContact O-OG 3.14Å; M106-S109 WeakPolarHBondContact O-CB 3.23Å; M106-S109 PolarHBondContact O-N 2.02Å; S109-A111 PolarHBondContact O-N 2.85Å; S109-F112 WeakPolarHBondContact O-CB 3.49Å; S109-F112 PolarHBondContact O-N 2.86Å; S109-T113 PolarHBondContact O-N 2.69Å; S109-T113 PolarHBondContact O-OG1 3.21Å; S109-T113 VanDerWaalsContact O-OG1 3.14Å; S109-R253 WeakPolarHBondContact OG-CD 3.45Å
110H76Confident79.1Confident132 Ų13262.5 Ų62.561%0.61130%0.3SS*.Hα-helixtrans-62.9-42.3176.8-179.4-93.7000112.3M106 R107 Q108 F112 T113 R114M106-H110 WeakPolarHBondContact O-CB 3.35Å; M106-H110 PolarHBondContact O-N 2.79Å; R107-H110 PolarHBondContact O-N 3.17Å; Q108-H110 VanDerWaalsContact C-N 3.34Å; Q108-H110 PolarHBondContact O-N 3.35Å; H110-F112 VanDerWaalsContact C-N 3.32Å; H110-F112 PolarHBondContact O-N 3.04Å; H110-T113 PolarHBondContact O-N 3.34Å; H110-R114 VanDerWaalsContact O-CB 3.3Å; H110-R114 WeakPolarHBondContact O-CB 3.49Å; H110-R114 PolarHBondContact O-N 2.76Å
111A82.9Confident80.6Confident48 Ų4854.9 Ų54.940%0.39727%0.265SS..Hα-helixtrans-62.4-38.9175.600000112.2R107 Q108 S109 H115R107-A111 WeakPolarHBondContact O-CB 3.5Å; R107-A111 PolarHBondContact O-N 3.17Å; Q108-A111 PolarHBondContact O-N 2.97Å; S109-A111 PolarHBondContact O-N 2.85Å; A111-H115 WeakPolarHBondContact O-CB 2.9Å; A111-H115 PolarHBondContact O-N 2.89Å
112F86.2Confident81.8Confident45 Ų4555 Ų5520%0.19726%0.257CS..Hα-helixtrans-65.2-53175172.4-93.7000111.8Q108 S109 H110 R114 H115 V116 E245 T249Q108-F112 WeakPolarHBondContact O-CB 3.4Å; Q108-F112 PolarHBondContact O-N 2.86Å; S109-F112 WeakPolarHBondContact O-CB 3.49Å; S109-F112 PolarHBondContact O-N 2.86Å; H110-F112 VanDerWaalsContact C-N 3.32Å; H110-F112 PolarHBondContact O-N 3.04Å; F112-R114 PolarHBondContact O-N 2.93Å; F112-H115 WeakPolarHBondContact O-CA 3.34Å; F112-H115 WeakPolarHBondContact O-CB 3.22Å; F112-H115 PolarHBondContact O-N 3.38Å; F112-V116 HydrophobicContact CD1-CG2 4.13Å; F112-V116 HydrophobicContact CD2-CG2 4.37Å; F112-V116 HydrophobicContact CE1-CG2 3.52Å; F112-V116 HydrophobicContact CE2-CG2 3.81Å; F112-V116 HydrophobicContact CZ-CG2 3.35Å; F112-V116 PolarHBondContact O-N 2.56Å; F112-E245 HydrophobicContact CZ-CG 4.19Å; F112-T249 HydrophobicContact CD1-CG2 3.47Å; F112-T249 VanDerWaalsContact CD1-CG2 3.47Å; F112-T249 HydrophobicContact CD2-CG2 4.04Å; F112-T249 HydrophobicContact CE1-CG2 3.43Å; F112-T249 VanDerWaalsContact CE1-CG2 3.43Å; F112-T249 VanDerWaalsContact CE1-OG1 3.32Å; F112-T249 WeakPolarHBondContact CE1-OG1 3.15Å; F112-T249 HydrophobicContact CE2-CG2 3.98Å; F112-T249 HydrophobicContact CG-CG2 3.78Å; F112-T249 HydrophobicContact CZ-CG2 3.69Å; F112-T249 WeakPolarHBondContact CZ-OG1 3.32Å
113T85Confident83Confident38 Ų3861.1 Ų61.123%0.23328%0.284CS..Hα-helixtrans-54.5-45.2178.2-57.70000110.1S109 H110 H115 V116 I117 I246S109-T113 PolarHBondContact O-N 2.69Å; S109-T113 PolarHBondContact O-OG1 3.21Å; S109-T113 VanDerWaalsContact O-OG1 3.14Å; H110-T113 PolarHBondContact O-N 3.34Å; T113-H115 VanDerWaalsContact C-N 3.33Å; T113-H115 PolarHBondContact O-N 3.16Å; T113-V116 PolarHBondContact O-N 2.87Å; T113-I117 WeakPolarHBondContact O-CG1 2.82Å; T113-I117 PolarHBondContact O-N 3.4Å; T113-I246 HydrophobicContact CG2-CD1 4.12Å; T113-I246 HydrophobicContact CG2-CG1 4.36Å; T113-I246 HydrophobicContact CG2-CG2 4.23Å
114R86.2Confident84Confident68 Ų6861.3 Ų61.326%0.25728%0.283SS..Hα-helixtrans-58.4-43.3175.1-178.3-178.9168.897.114112.5H110 F112 I117 E118 L130 P131 E132H110-R114 VanDerWaalsContact O-CB 3.3Å; H110-R114 WeakPolarHBondContact O-CB 3.49Å; H110-R114 PolarHBondContact O-N 2.76Å; F112-R114 PolarHBondContact O-N 2.93Å; R114-I117 PolarHBondContact O-N 2.67Å; R114-E118 VanDerWaalsContact O-CB 3.31Å; R114-E118 WeakPolarHBondContact O-CB 3.5Å; R114-E118 PolarHBondContact O-N 3.31Å; R114-L130 PolarHBondContact NH2-O 2.87Å; R114-P131 PolarHBondContact NH1-O 3.5Å; R114-P131 PolarHBondContact NH2-O 2.94Å; R114-E132 PolarHBondContact NH1-O 2.87Å; R114-E132 VanDerWaalsContact NH2-CA 3.33Å
115H90.2Very high84.6Confident112 Ų11258.3 Ų58.352%0.51927%0.269SS..Hα-helixtrans-62.9-41.9178.2-178.570.4000112.4A111 F112 T113 E118 K119A111-H115 WeakPolarHBondContact O-CB 2.9Å; A111-H115 PolarHBondContact O-N 2.89Å; F112-H115 WeakPolarHBondContact O-CA 3.34Å; F112-H115 WeakPolarHBondContact O-CB 3.22Å; F112-H115 PolarHBondContact O-N 3.38Å; T113-H115 VanDerWaalsContact C-N 3.33Å; T113-H115 PolarHBondContact O-N 3.16Å; H115-E118 PolarHBondContact O-N 2.92Å; H115-K119 VanDerWaalsContact O-CB 3.31Å; H115-K119 WeakPolarHBondContact O-CB 3.38Å; H115-K119 PolarHBondContact O-N 3.01Å
116V91Very high85Confident0 Ų062.5 Ų62.50%030%0.296CS..Hα-helixtrans-61.8-48.3176.7173.10000110.9F112 T113 E118 K119 C120 E242 E245 I246F112-V116 HydrophobicContact CD1-CG2 4.13Å; F112-V116 HydrophobicContact CD2-CG2 4.37Å; F112-V116 HydrophobicContact CE1-CG2 3.52Å; F112-V116 HydrophobicContact CE2-CG2 3.81Å; F112-V116 HydrophobicContact CZ-CG2 3.35Å; F112-V116 PolarHBondContact O-N 2.56Å; T113-V116 PolarHBondContact O-N 2.87Å; V116-E118 VanDerWaalsContact C-N 3.33Å; V116-E118 PolarHBondContact O-N 3.31Å; V116-K119 WeakPolarHBondContact O-CB 3.29Å; V116-K119 PolarHBondContact O-N 3.36Å; V116-C120 PolarHBondContact O-N 2.85Å; V116-E242 HydrophobicContact CG1-CB 3.4Å; V116-E242 HydrophobicContact CG1-CG 3.7Å; V116-E245 HydrophobicContact CG1-CG 4.47Å; V116-E245 HydrophobicContact CG2-CG 4.26Å; V116-I246 HydrophobicContact CB-CG1 4.49Å; V116-I246 HydrophobicContact CG1-CG1 4.1Å
117I89Confident85.3Confident23 Ų2360.7 Ų60.712%0.11830%0.301CS..Hα-helixtrans-61.8-42.5176.2-59.1-59.5000111.2T113 R114 K119 C120 L121 L130 C238 G239 I246T113-I117 WeakPolarHBondContact O-CG1 2.82Å; T113-I117 PolarHBondContact O-N 3.4Å; R114-I117 PolarHBondContact O-N 2.67Å; I117-K119 PolarHBondContact O-N 3.27Å; I117-C120 PolarHBondContact O-N 3.49Å; I117-L121 HydrophobicContact CG2-CD1 4.06Å; I117-L121 WeakPolarHBondContact O-CB 3.46Å; I117-L121 WeakPolarHBondContact O-CG 3.47Å; I117-L121 PolarHBondContact O-N 3.42Å; I117-L130 HydrophobicContact CG2-CD1 4.09Å; I117-C238 HydrophobicContact CD1-CB 4.08Å; I117-C238 HydrophobicContact CG2-CB 4.13Å; I117-G239 VanDerWaalsContact CD1-CA 3.49Å; I117-I246 HydrophobicContact CD1-CD1 4.09Å
118E89.9Confident85.7Confident28 Ų2853.8 Ų53.813%0.13128%0.275CS..Hα-helixtrans-64-40.5178.2-167.9175.5178.600112.1R114 H115 V116 L121 R122 L130R114-E118 VanDerWaalsContact O-CB 3.31Å; R114-E118 WeakPolarHBondContact O-CB 3.5Å; R114-E118 PolarHBondContact O-N 3.31Å; H115-E118 PolarHBondContact O-N 2.92Å; V116-E118 VanDerWaalsContact C-N 3.33Å; V116-E118 PolarHBondContact O-N 3.31Å; E118-L121 PolarHBondContact O-N 3.34Å; E118-R122 WeakPolarHBondContact O-CB 3.33Å; E118-R122 VanDerWaalsContact O-CG 3.29Å; E118-R122 WeakPolarHBondContact O-CG 3.31Å; E118-R122 PolarHBondContact O-N 3.2Å; E118-R122 IonicContact OE1-CZ 2.89Å; E118-R122 IonicContact OE1-NE 2.93Å; E118-R122 PolarHBondContact OE1-NE 2.86Å; E118-R122 IonicContact OE1-NH2 2.7Å; E118-R122 PolarHBondContact OE1-NH2 3.33Å; E118-L130 HydrophobicContact CB-CD1 4.04Å; E118-L130 HydrophobicContact CG-CD1 4.47Å
119K92.1Very high85.9Confident79 Ų7955.4 Ų55.434%0.34328%0.282SS..Hα-helixtrans-60.6-48.2174.9174.1-171.3165.7-154.30110.8H115 V116 I117 L121 R122 Q123 E245H115-K119 VanDerWaalsContact O-CB 3.31Å; H115-K119 WeakPolarHBondContact O-CB 3.38Å; H115-K119 PolarHBondContact O-N 3.01Å; V116-K119 WeakPolarHBondContact O-CB 3.29Å; V116-K119 PolarHBondContact O-N 3.36Å; I117-K119 PolarHBondContact O-N 3.27Å; K119-L121 PolarHBondContact O-N 2.89Å; K119-R122 PolarHBondContact O-N 3.05Å; K119-Q123 WeakPolarHBondContact O-CG 3.47Å; K119-Q123 PolarHBondContact O-N 3.04Å; K119-Q123 VanDerWaalsContact O-N 3.09Å; K119-E245 IonicContact NZ-OE1 3.52Å; K119-E245 IonicContact NZ-OE2 3.48Å
120C93.9Very high86Confident1 Ų156.9 Ų56.91%0.00729%0.289CS..Hα-helixtrans-59.4-45.8175.5169.30000111.7V116 I117 R122 Q123 K124 C238 E242V116-C120 PolarHBondContact O-N 2.85Å; I117-C120 PolarHBondContact O-N 3.49Å; C120-R122 VanDerWaalsContact C-N 3.34Å; C120-R122 PolarHBondContact O-N 2.7Å; C120-Q123 WeakPolarHBondContact O-CB 3.26Å; C120-Q123 PolarHBondContact O-N 3.45Å; C120-K124 PolarHBondContact O-N 3.46Å; C120-K124 WeakPolarHBondContact SG-CE 3.36Å; C120-C238 VanDerWaalsContact C-SG 3.54Å; C120-C238 HydrophobicContact CB-CB 3.62Å; C120-C238 WeakPolarHBondContact CB-SG 3.39Å; C120-C238 WeakPolarHBondContact SG-CA 3.45Å; C120-C238 WeakPolarHBondContact SG-CB 3.32Å; C120-C238 CovalentContact SG-SG 2.04Å; C120-C238 PolarHBondContact SG-SG 3.47Å; C120-E242 HydrophobicContact CB-CG 3.84Å
121L90.3Very high86Confident0 Ų052.1 Ų52.10%027%0.27CS..Hα-helixtrans-62.8-38.6177.3-78.2172.2000112.8I117 E118 K119 Q123 K124 H125 Y128 L130 Q234 A235I117-L121 HydrophobicContact CG2-CD1 4.06Å; I117-L121 WeakPolarHBondContact O-CB 3.46Å; I117-L121 WeakPolarHBondContact O-CG 3.47Å; I117-L121 PolarHBondContact O-N 3.42Å; E118-L121 PolarHBondContact O-N 3.34Å; K119-L121 PolarHBondContact O-N 2.89Å; L121-Q123 VanDerWaalsContact C-N 3.33Å; L121-Q123 PolarHBondContact O-N 2.99Å; L121-K124 PolarHBondContact O-N 3.48Å; L121-H125 PolarHBondContact O-N 3.19Å; L121-Y128 HydrophobicContact CB-CD1 4.3Å; L121-Y128 HydrophobicContact CD1-CE1 4.06Å; L121-L130 HydrophobicContact CD1-CD1 3.84Å; L121-L130 HydrophobicContact CD1-CD2 3.8Å; L121-L130 HydrophobicContact CD1-CG 3.76Å; L121-Q234 HydrophobicContact CD2-CB 3.92Å; L121-A235 HydrophobicContact CD1-CB 3.89Å; L121-A235 HydrophobicContact CD2-CB 4.32Å
122R89.7Confident85.6Confident111 Ų11157.4 Ų57.442%0.41929%0.287SS..Hα-helixtrans-68.1-30.7177-76.8176.3-176.6-166.95.6113.1E118 K119 C120 K124 H125 Y128E118-R122 WeakPolarHBondContact O-CB 3.33Å; E118-R122 VanDerWaalsContact O-CG 3.29Å; E118-R122 WeakPolarHBondContact O-CG 3.31Å; E118-R122 PolarHBondContact O-N 3.2Å; E118-R122 IonicContact OE1-CZ 2.89Å; E118-R122 IonicContact OE1-NE 2.93Å; E118-R122 PolarHBondContact OE1-NE 2.86Å; E118-R122 IonicContact OE1-NH2 2.7Å; E118-R122 PolarHBondContact OE1-NH2 3.33Å; K119-R122 PolarHBondContact O-N 3.05Å; C120-R122 VanDerWaalsContact C-N 3.34Å; C120-R122 PolarHBondContact O-N 2.7Å; R122-K124 VanDerWaalsContact C-N 3.33Å; R122-H125 CarbonylContact O-C 3.57Å; R122-Y128 WeakPolarHBondContact CG-O 3.39Å
123Q90.6Very high84.9Confident133 Ų13358 Ų5862%0.62130%0.297SS*.Hα-helixtrans-67.1-38.3173.3-71.2175.13.700111.3K119 C120 L121K119-Q123 WeakPolarHBondContact O-CG 3.47Å; K119-Q123 PolarHBondContact O-N 3.04Å; K119-Q123 VanDerWaalsContact O-N 3.09Å; C120-Q123 WeakPolarHBondContact O-CB 3.26Å; C120-Q123 PolarHBondContact O-N 3.45Å; L121-Q123 VanDerWaalsContact C-N 3.33Å; L121-Q123 PolarHBondContact O-N 2.99Å
124K87.9Confident84.2Confident73 Ų7360.1 Ų60.132%0.31731%0.311SS..Hα-helixtrans-76.1-36.1175.9-61176.1-166.6-91.70111.8C120 L121 R122 E241C120-K124 PolarHBondContact O-N 3.46Å; C120-K124 WeakPolarHBondContact SG-CE 3.36Å; L121-K124 PolarHBondContact O-N 3.48Å; R122-K124 VanDerWaalsContact C-N 3.33Å; K124-E241 WeakPolarHBondContact CE-OE2 3.48Å; K124-E241 IonicContact NZ-OE1 2.78Å; K124-E241 PolarHBondContact NZ-OE1 3.42Å; K124-E241 IonicContact NZ-OE2 3.45Å; K124-E241 PolarHBondContact NZ-OE2 2.85Å
125H84.8Confident83.9Confident7 Ų757.5 Ų57.53%0.03230%0.303CS..SBendtrans-135.387.8-175-54.6-59.6000111.9E20 F24 L121 R122 G127 Y128 Q234E20-H125 IonicContact OE1-CE1 3.44Å; E20-H125 PolarHBondContact OE1-CE1 2.98Å; E20-H125 VanDerWaalsContact OE1-CE1 3.29Å; E20-H125 IonicContact OE1-ND1 3.34Å; E20-H125 PolarHBondContact OE1-ND1 3.05Å; F24-H125 HydrophobicContact CD2-CB 4.05Å; F24-H125 HydrophobicContact CE1-CB 4.15Å; F24-H125 AromaticContact CE1-CG 3.82Å; F24-H125 AromaticContact CE1-ND1 3.89Å; F24-H125 HydrophobicContact CE2-CB 3.61Å; F24-H125 AromaticContact CE2-CG 3.6Å; F24-H125 AromaticContact CE2-ND1 3.26Å; F24-H125 VanDerWaalsContact CE2-ND1 3.26Å; F24-H125 WeakPolarHBondContact CE2-ND1 3.41Å; F24-H125 HydrophobicContact CZ-CB 3.74Å; F24-H125 AromaticContact CZ-CE1 3.72Å; F24-H125 AromaticContact CZ-CG 3.28Å; F24-H125 AromaticContact CZ-ND1 2.94Å; F24-H125 WeakPolarHBondContact CZ-ND1 3.34Å; L121-H125 PolarHBondContact O-N 3.19Å; R122-H125 CarbonylContact O-C 3.57Å; H125-G127 PolarHBondContact O-N 3.03Å; H125-G127 VanDerWaalsContact O-N 3.15Å; H125-Y128 PolarHBondContact O-N 3.39Å; H125-Y128 VanDerWaalsContact O-N 3.12Å; H125-Q234 PolarHBondContact CE1-NE2 3.12Å; H125-Q234 VanDerWaalsContact CE1-NE2 3.34Å; H125-Q234 PolarHBondContact CE1-OE1 3.05Å; H125-Q234 PolarHBondContact NE2-NE2 3.13Å; H125-Q234 PolarHBondContact NE2-OE1 3.34Å
126P81.3Confident83.6Confident93 Ų9354 Ų5460%0.60429%0.291SS*.THydrogen-bonded Turntrans-56.4121178.7-26.835.6000112.1
127G76.4Confident83.3Confident54 Ų5454.2 Ų54.256%0.55729%0.292SS*.THydrogen-bonded Turntrans96.8-13.2178.500000115.3Q28 H125Q28-G127 PolarHBondContact NE2-O 3.33Å; Q28-G127 VanDerWaalsContact NE2-O 3.14Å; H125-G127 PolarHBondContact O-N 3.03Å; H125-G127 VanDerWaalsContact O-N 3.15Å
128Y82.5Confident82.9Confident4 Ų453.6 Ų53.62%0.01629%0.291CS..  trans-67.8145.1171179.4-103.3000111.2F24 L27 F31 L121 R122 H125 L130 V231F24-Y128 HydrophobicContact CD1-CD2 4.19Å; L27-Y128 HydrophobicContact CD2-CD2 4.08Å; L27-Y128 HydrophobicContact CD2-CE2 3.55Å; L27-Y128 HydrophobicContact CG-CE2 4.2Å; F31-Y128 HydrophobicContact CE2-CE2 4.42Å; L121-Y128 HydrophobicContact CB-CD1 4.3Å; L121-Y128 HydrophobicContact CD1-CE1 4.06Å; R122-Y128 WeakPolarHBondContact CG-O 3.39Å; H125-Y128 PolarHBondContact O-N 3.39Å; H125-Y128 VanDerWaalsContact O-N 3.12Å; Y128-L130 HydrophobicContact CE1-CD2 4.14Å; Y128-L130 HydrophobicContact CE1-CG 4.16Å; Y128-V231 HydrophobicContact CD1-CG1 4.46Å; Y128-V231 HydrophobicContact CE1-CG1 3.72Å; Y128-V231 HydrophobicContact CE2-CG1 3.97Å; Y128-V231 VanDerWaalsContact CZ-CG1 3.42Å; Y128-V231 WeakPolarHBondContact OH-CG1 3.48Å
129Q81.3Confident82.5Confident108 Ų10853.6 Ų53.651%0.50529%0.291SS..  trans-135.8133.7176.7-66.6-175.6-3.400108.4
130L78.9Confident82.1Confident37 Ų3750.4 Ų50.419%0.19428%0.278CS..  trans-66.5137174.6-83.6168000109.7R114 I117 E118 L121 Y128 E132R114-L130 PolarHBondContact NH2-O 2.87Å; I117-L130 HydrophobicContact CG2-CD1 4.09Å; E118-L130 HydrophobicContact CB-CD1 4.04Å; E118-L130 HydrophobicContact CG-CD1 4.47Å; L121-L130 HydrophobicContact CD1-CD1 3.84Å; L121-L130 HydrophobicContact CD1-CD2 3.8Å; L121-L130 HydrophobicContact CD1-CG 3.76Å; Y128-L130 HydrophobicContact CE1-CD2 4.14Å; Y128-L130 HydrophobicContact CE1-CG 4.16Å; L130-E132 PolarHBondContact O-N 3.02Å
131P77Confident81.5Confident33 Ų3350.9 Ų50.921%0.21428%0.28CS..  trans-55.3129.9172.6-25.134.1000111.1F31 R114 S133 V135F31-P131 HydrophobicContact CB-CB 4.43Å; F31-P131 HydrophobicContact CB-CG 3.78Å; F31-P131 HydrophobicContact CD1-CG 3.9Å; F31-P131 HydrophobicContact CD2-CG 3.55Å; F31-P131 HydrophobicContact CE1-CG 4.36Å; F31-P131 HydrophobicContact CE2-CG 4.02Å; F31-P131 HydrophobicContact CG-CG 3.48Å; F31-P131 VanDerWaalsContact CG-CG 3.48Å; F31-P131 HydrophobicContact CZ-CG 4.41Å; R114-P131 PolarHBondContact NH1-O 3.5Å; R114-P131 PolarHBondContact NH2-O 2.94Å; P131-S133 PolarHBondContact O-N 3.21Å; P131-V135 HydrophobicContact CB-CG2 4.31Å
132E73.6Confident80.9Confident158 Ų15855.5 Ų55.574%0.73830%0.298SS*.SBendtrans-52.8-31.5-176.2-70.5-176.7151.800113.7K35 R114 L130K35-E132 IonicContact NZ-OE2 3Å; R114-E132 PolarHBondContact NH1-O 2.87Å; R114-E132 VanDerWaalsContact NH2-CA 3.33Å; L130-E132 PolarHBondContact O-N 3.02Å
133S71.6Confident80.4Confident59 Ų5952.5 Ų52.541%0.41329%0.288SS..SBendtrans-125.6152.6177-53.90000109.4P131 V135P131-S133 PolarHBondContact O-N 3.21Å; S133-V135 VanDerWaalsContact O-CG2 3.25Å; S133-V135 WeakPolarHBondContact O-CG2 3.48Å; S133-V135 PolarHBondContact O-N 3.31Å
134P71.3Confident79.8Confident81 Ų8146.3 Ų46.353%0.52626%0.259SS..  trans-58.1123.7171.5-20.531.6000110H139P134-H139 HydrophobicContact CB-CB 4.29Å; P134-H139 PolarHBondContact O-CD2 3.3Å; P134-H139 PolarHBondContact O-NE2 3.38Å
135V79.4Confident79.1Confident14 Ų1447.8 Ų47.89%0.08527%0.265CS..  trans-125.686.7177.4-163.80000108.6L34 K35 F38 P131 S133L34-V135 HydrophobicContact CB-CG1 3.35Å; L34-V135 HydrophobicContact CD1-CG1 4.29Å; K35-V135 HydrophobicContact CB-CG1 4.18Å; K35-V135 HydrophobicContact CB-CG2 4.1Å; K35-V135 HydrophobicContact CG-CG2 4.4Å; F38-V135 HydrophobicContact CD2-CG1 4.15Å; P131-V135 HydrophobicContact CB-CG2 4.31Å; S133-V135 VanDerWaalsContact O-CG2 3.25Å; S133-V135 WeakPolarHBondContact O-CG2 3.48Å; S133-V135 PolarHBondContact O-N 3.31Å
136S82.6Confident78.5Confident39 Ų3948 Ų4827%0.27327%0.267SS..SBendtrans-146.9157.8176.370.70000110.5G138 H139 F140 S285S136-G138 VanDerWaalsContact C-N 3.29Å; S136-G138 PolarHBondContact O-N 3.39Å; S136-H139 WeakPolarHBondContact O-CB 3.39Å; S136-H139 PolarHBondContact O-N 3.28Å; S136-H139 VanDerWaalsContact O-N 3.17Å; S136-H139 WeakPolarHBondContact OG-CB 3.31Å; S136-H139 PolarHBondContact OG-N 3.4Å; S136-F140 WeakPolarHBondContact O-CD2 3.31Å; S136-F140 PolarHBondContact O-N 3.02Å; S136-F140 VanDerWaalsContact O-N 3.17Å; S136-S285 VanDerWaalsContact CB-OG 3.23Å; S136-S285 WeakPolarHBondContact CB-OG 3.04Å; S136-S285 PolarHBondContact OG-OG 3.29Å
137V85Confident78.1Confident3 Ų344.1 Ų44.12%0.01824%0.241CC..Hα-helixtrans-58.5-45178.4-176.50000110.2F38 H139 F140 V141 F206 L209 D213 L288F38-V137 HydrophobicContact CE2-CG2 4.05Å; F38-V137 HydrophobicContact CZ-CG2 3.63Å; V137-H139 VanDerWaalsContact C-N 3.3Å; V137-H139 PolarHBondContact O-N 3Å; V137-F140 PolarHBondContact O-N 2.8Å; V137-F140 VanDerWaalsContact O-N 3.14Å; V137-V141 HydrophobicContact CG1-CG2 4.07Å; V137-V141 VanDerWaalsContact O-CG2 3.28Å; V137-V141 WeakPolarHBondContact O-CG2 3.45Å; V137-V141 PolarHBondContact O-N 3.49Å; V137-F206 HydrophobicContact CG1-CD2 4.11Å; V137-F206 HydrophobicContact CG1-CE2 4.02Å; V137-L209 HydrophobicContact CG1-CB 4.12Å; V137-L209 HydrophobicContact CG1-CD1 4.36Å; V137-D213 HydrophobicContact CG2-CB 4.22Å; V137-L288 HydrophobicContact CB-CD2 4.28Å; V137-L288 HydrophobicContact CG1-CD2 3.86Å
138G81.8Confident77.8Confident10 Ų1042.6 Ų42.610%0.10323%0.225CC..Hα-helixtrans-60.4-35.1177.700000114S136 R142 S285S136-G138 VanDerWaalsContact C-N 3.29Å; S136-G138 PolarHBondContact O-N 3.39Å; G138-R142 PolarHBondContact O-N 3.47Å; G138-R142 VanDerWaalsContact O-N 3.14Å; G138-S285 WeakPolarHBondContact CA-OG 2.99Å; G138-S285 PolarHBondContact N-OG 3.18Å
139H81Confident77.3Confident29 Ų2944.4 Ų44.413%0.13424%0.238CC..Hα-helixtrans-62.6-49.2173.1-179.163.9000111.5E78 P134 S136 V137 R142 K143E78-H139 IonicContact OE1-CE1 3.53Å; E78-H139 PolarHBondContact OE1-CE1 3.5Å; P134-H139 HydrophobicContact CB-CB 4.29Å; P134-H139 PolarHBondContact O-CD2 3.3Å; P134-H139 PolarHBondContact O-NE2 3.38Å; S136-H139 WeakPolarHBondContact O-CB 3.39Å; S136-H139 PolarHBondContact O-N 3.28Å; S136-H139 VanDerWaalsContact O-N 3.17Å; S136-H139 WeakPolarHBondContact OG-CB 3.31Å; S136-H139 PolarHBondContact OG-N 3.4Å; V137-H139 VanDerWaalsContact C-N 3.3Å; V137-H139 PolarHBondContact O-N 3Å; H139-R142 WeakPolarHBondContact O-CB 3.31Å; H139-R142 PolarHBondContact O-N 2.89Å; H139-K143 VanDerWaalsContact NE2-CE 3.31Å; H139-K143 WeakPolarHBondContact NE2-CE 3.48Å; H139-K143 PolarHBondContact O-N 2.96Å; H139-K143 VanDerWaalsContact O-N 3.15Å
140F83.3Confident76.6Confident12 Ų1243.3 Ų43.35%0.05324%0.242CC..Hα-helixtrans-70-34.2-179.2-84.8-93.9000112.9F38 F42 S136 V137 R142 K143 M144 L209F38-F140 HydrophobicContact CB-CD1 3.88Å; F38-F140 HydrophobicContact CB-CD2 3.74Å; F38-F140 HydrophobicContact CB-CE1 3.61Å; F38-F140 HydrophobicContact CB-CE2 3.46Å; F38-F140 VanDerWaalsContact CB-CE2 3.46Å; F38-F140 HydrophobicContact CB-CG 3.94Å; F38-F140 HydrophobicContact CB-CZ 3.37Å; F38-F140 AromaticContact CD2-CD2 3.48Å; F38-F140 HydrophobicContact CD2-CD2 3.48Å; F38-F140 VanDerWaalsContact CD2-CD2 3.48Å; F38-F140 AromaticContact CD2-CE2 3.7Å; F38-F140 HydrophobicContact CD2-CE2 3.7Å; F38-F140 HydrophobicContact CD2-CG 4.12Å; F38-F140 HydrophobicContact CD2-CZ 4.49Å; F38-F140 HydrophobicContact CE2-CD2 4.43Å; F38-F140 HydrophobicContact CG-CD2 4.04Å; F38-F140 HydrophobicContact CG-CE2 4.09Å; F38-F140 HydrophobicContact CG-CG 4.35Å; F38-F140 HydrophobicContact CG-CZ 4.46Å; F38-F140 VanDerWaalsContact O-CE1 3.25Å; F38-F140 WeakPolarHBondContact O-CE1 3.47Å; F42-F140 HydrophobicContact CB-CD1 3.8Å; F42-F140 HydrophobicContact CB-CE1 3.78Å; F42-F140 HydrophobicContact CD2-CD1 4.39Å; F42-F140 HydrophobicContact CG-CD1 4.26Å; F42-F140 HydrophobicContact CG-CE1 4.34Å; S136-F140 WeakPolarHBondContact O-CD2 3.31Å; S136-F140 PolarHBondContact O-N 3.02Å; S136-F140 VanDerWaalsContact O-N 3.17Å; V137-F140 PolarHBondContact O-N 2.8Å; V137-F140 VanDerWaalsContact O-N 3.14Å; F140-R142 VanDerWaalsContact C-N 3.34Å; F140-R142 PolarHBondContact O-N 3.15Å; F140-K143 WeakPolarHBondContact O-CB 3.31Å; F140-K143 PolarHBondContact O-N 3.33Å; F140-M144 VanDerWaalsContact O-CG 3.3Å; F140-M144 WeakPolarHBondContact O-CG 3.25Å; F140-M144 PolarHBondContact O-N 3.31Å; F140-L209 HydrophobicContact CB-CD1 3.75Å; F140-L209 HydrophobicContact CB-CD2 4.39Å
141V81.5Confident76.1Confident10 Ų1044.2 Ų44.26%0.06125%0.247CC..Hα-helixtrans-60.7-43.4172.7171.30000111.5V137 K143 M144 K145 F206 L209 L288 A301V137-V141 HydrophobicContact CG1-CG2 4.07Å; V137-V141 VanDerWaalsContact O-CG2 3.28Å; V137-V141 WeakPolarHBondContact O-CG2 3.45Å; V137-V141 PolarHBondContact O-N 3.49Å; V141-K143 PolarHBondContact O-N 2.83Å; V141-M144 HydrophobicContact CB-CE 4.29Å; V141-M144 HydrophobicContact CG2-CE 3.85Å; V141-M144 PolarHBondContact O-N 3.28Å; V141-K145 WeakPolarHBondContact O-CB 3.46Å; V141-K145 PolarHBondContact O-N 2.88Å; V141-F206 HydrophobicContact CG2-CD2 3.72Å; V141-F206 HydrophobicContact CG2-CE2 4.4Å; V141-L209 HydrophobicContact CG2-CD1 4.46Å; V141-L288 HydrophobicContact CG2-CD2 4.22Å; V141-A301 WeakPolarHBondContact CG1-O 3.32Å
142R77.8Confident75.8Confident97 Ų9742.7 Ų42.737%0.36624%0.237SC..Hα-helixtrans-60-47.3174.7-167.3-179.6-54.7-104-10.2111.6G138 H139 F140 M144 K145 D146G138-R142 PolarHBondContact O-N 3.47Å; G138-R142 VanDerWaalsContact O-N 3.14Å; H139-R142 WeakPolarHBondContact O-CB 3.31Å; H139-R142 PolarHBondContact O-N 2.89Å; F140-R142 VanDerWaalsContact C-N 3.34Å; F140-R142 PolarHBondContact O-N 3.15Å; R142-M144 VanDerWaalsContact C-N 3.29Å; R142-M144 PolarHBondContact O-N 3.19Å; R142-K145 WeakPolarHBondContact O-CB 3.3Å; R142-K145 PolarHBondContact O-N 3.4Å; R142-K145 VanDerWaalsContact O-N 3.14Å; R142-D146 PolarHBondContact O-N 3.38Å
143K78.5Confident76Confident48 Ų4836.6 Ų36.621%0.20921%0.21CC..Hα-helixtrans-56.2-42.3175-69.8-167.4162.5-171.90112.8F42 E78 H139 F140 V141 L147F42-K143 HydrophobicContact CD2-CB 4.07Å; F42-K143 HydrophobicContact CE2-CB 3.47Å; F42-K143 VanDerWaalsContact CE2-CB 3.47Å; F42-K143 HydrophobicContact CZ-CB 3.98Å; E78-K143 HydrophobicContact CG-CG 3.95Å; E78-K143 WeakPolarHBondContact OE1-CE 3.25Å; E78-K143 IonicContact OE1-NZ 3.88Å; H139-K143 VanDerWaalsContact NE2-CE 3.31Å; H139-K143 WeakPolarHBondContact NE2-CE 3.48Å; H139-K143 PolarHBondContact O-N 2.96Å; H139-K143 VanDerWaalsContact O-N 3.15Å; F140-K143 WeakPolarHBondContact O-CB 3.31Å; F140-K143 PolarHBondContact O-N 3.33Å; V141-K143 PolarHBondContact O-N 2.83Å; K143-L147 VanDerWaalsContact O-CB 3.24Å; K143-L147 WeakPolarHBondContact O-CB 3.24Å; K143-L147 PolarHBondContact O-N 3.22Å; K143-L147 VanDerWaalsContact O-N 3.08Å
144M77.6Confident76.3Confident3 Ų339.9 Ų39.92%0.01521%0.213CC..Hα-helixtrans-69.7-37.7178-68.1-174.8-63.800112.8F42 F45 F140 V141 R142 G148 Q202 T205 L209F42-M144 HydrophobicContact CD2-CG 4.01Å; F42-M144 HydrophobicContact CE2-CG 4.27Å; F45-M144 HydrophobicContact CB-SD 4.47Å; F45-M144 HydrophobicContact CD1-CB 4.09Å; F45-M144 HydrophobicContact CD1-CG 3.74Å; F45-M144 HydrophobicContact CD1-SD 4.46Å; F45-M144 HydrophobicContact CD2-CG 4.43Å; F45-M144 HydrophobicContact CD2-SD 4.2Å; F45-M144 HydrophobicContact CE1-CB 3.75Å; F45-M144 HydrophobicContact CE1-CG 3.95Å; F45-M144 WeakPolarHBondContact CE1-O 3.37Å; F45-M144 HydrophobicContact CE2-CB 4.43Å; F45-M144 HydrophobicContact CG-CG 4Å; F45-M144 HydrophobicContact CG-SD 4.12Å; F45-M144 HydrophobicContact CZ-CB 3.94Å; F45-M144 HydrophobicContact CZ-CG 4.39Å; F45-M144 WeakPolarHBondContact CZ-O 3.25Å; F140-M144 VanDerWaalsContact O-CG 3.3Å; F140-M144 WeakPolarHBondContact O-CG 3.25Å; F140-M144 PolarHBondContact O-N 3.31Å; V141-M144 HydrophobicContact CB-CE 4.29Å; V141-M144 HydrophobicContact CG2-CE 3.85Å; V141-M144 PolarHBondContact O-N 3.28Å; R142-M144 VanDerWaalsContact C-N 3.29Å; R142-M144 PolarHBondContact O-N 3.19Å; M144-G148 PolarHBondContact O-N 2.98Å; M144-Q202 HydrophobicContact CB-CG 4.26Å; M144-Q202 PolarHBondContact O-NE2 3.14Å; M144-T205 HydrophobicContact CE-CG2 4.26Å; M144-T205 WeakPolarHBondContact SD-CB 3.5Å; M144-T205 HydrophobicContact SD-CG2 3.26Å; M144-T205 WeakPolarHBondContact SD-CG2 3.49Å; M144-L209 HydrophobicContact CE-CD1 3.55Å; M144-L209 HydrophobicContact SD-CD1 4.43Å
145K74.4Confident76.6Confident105 Ų10536 Ų3646%0.45719%0.188SC..Hα-helixtrans-60.6-50.9175.6-176-175.9174-172.80110.4V141 R142 L147 G148 S149V141-K145 WeakPolarHBondContact O-CB 3.46Å; V141-K145 PolarHBondContact O-N 2.88Å; R142-K145 WeakPolarHBondContact O-CB 3.3Å; R142-K145 PolarHBondContact O-N 3.4Å; R142-K145 VanDerWaalsContact O-N 3.14Å; K145-L147 VanDerWaalsContact C-N 3.34Å; K145-L147 PolarHBondContact O-N 3.5Å; K145-G148 CarbonylContact O-C 3.31Å; K145-G148 PolarHBondContact O-N 3.07Å; K145-S149 PolarHBondContact O-N 2.82Å
146D72.7Confident76.8Confident11 Ų1135.4 Ų35.46%0.05918%0.184CC..Hα-helixtrans-58.3-49.5179.3-75.312.3000111.3G79 E80 R142 G148 S149 A152G79-D146 VanDerWaalsContact N-CB 3.35Å; G79-D146 PolarHBondContact N-OD2 3.14Å; E80-D146 PolarHBondContact N-OD2 2.87Å; R142-D146 PolarHBondContact O-N 3.38Å; D146-G148 VanDerWaalsContact C-N 3.31Å; D146-G148 PolarHBondContact O-N 3.05Å; D146-S149 VanDerWaalsContact O-CB 3.25Å; D146-S149 WeakPolarHBondContact O-CB 3.4Å; D146-S149 PolarHBondContact O-N 2.53Å; D146-S149 VanDerWaalsContact O-N 3.11Å; D146-A152 WeakPolarHBondContact O-CB 3.47Å
147L71.9Confident77Confident12 Ų1235.4 Ų35.46%0.06319%0.186CC..Hα-helixtrans-69.3-30.4-177.9-167.777.8000112.5F42 F45 R46 I49 L75 K143 K145 S149F42-L147 HydrophobicContact CE2-CD2 4.34Å; F42-L147 HydrophobicContact CZ-CD2 4.11Å; F45-L147 HydrophobicContact CD1-CD2 3.97Å; F45-L147 HydrophobicContact CE1-CB 4.26Å; F45-L147 HydrophobicContact CE1-CD2 3.95Å; R46-L147 HydrophobicContact CB-CD2 3.88Å; R46-L147 HydrophobicContact CG-CD2 3.94Å; I49-L147 HydrophobicContact CD1-CB 4.27Å; I49-L147 HydrophobicContact CD1-CD1 4.2Å; I49-L147 HydrophobicContact CD1-CD2 3.37Å; I49-L147 HydrophobicContact CD1-CG 3.29Å; I49-L147 WeakPolarHBondContact CD1-O 3.38Å; I49-L147 HydrophobicContact CG1-CD2 4.16Å; L75-L147 HydrophobicContact CB-CD1 4.08Å; L75-L147 HydrophobicContact CD2-CD1 3.99Å; K143-L147 VanDerWaalsContact O-CB 3.24Å; K143-L147 WeakPolarHBondContact O-CB 3.24Å; K143-L147 PolarHBondContact O-N 3.22Å; K143-L147 VanDerWaalsContact O-N 3.08Å; K145-L147 VanDerWaalsContact C-N 3.34Å; K145-L147 PolarHBondContact O-N 3.5Å; L147-S149 VanDerWaalsContact C-N 3.31Å
148G70.9Confident76.9Confident22 Ų2238.6 Ų38.623%0.22720%0.2CC..Hα-helixtrans-79.2-10.8172.500000114.2M144 K145 D146M144-G148 PolarHBondContact O-N 2.98Å; K145-G148 CarbonylContact O-C 3.31Å; K145-G148 PolarHBondContact O-N 3.07Å; D146-G148 VanDerWaalsContact C-N 3.31Å; D146-G148 PolarHBondContact O-N 3.05Å
149S70.4Confident77Confident42 Ų4239.8 Ų39.829%0.29420%0.203SC..SBendtrans-75.8142.3174.3-177.80000110.4K145 D146 L147 L151 A152K145-S149 PolarHBondContact O-N 2.82Å; D146-S149 VanDerWaalsContact O-CB 3.25Å; D146-S149 WeakPolarHBondContact O-CB 3.4Å; D146-S149 PolarHBondContact O-N 2.53Å; D146-S149 VanDerWaalsContact O-N 3.11Å; L147-S149 VanDerWaalsContact C-N 3.31Å; S149-L151 PolarHBondContact O-N 3.18Å; S149-L151 VanDerWaalsContact O-N 3.13Å; S149-L151 WeakPolarHBondContact OG-CB 3.3Å; S149-L151 PolarHBondContact OG-N 3.09Å; S149-A152 PolarHBondContact O-N 3.36Å; S149-A152 VanDerWaalsContact O-N 3.12Å
150S68.3Low77.3Confident84 Ų8438.5 Ų38.559%0.58720%0.198SC*.G310 helixtrans-57-27.3170.2560000111.8A152 L153 W154S150-A152 VanDerWaalsContact C-N 3.29Å; S150-A152 PolarHBondContact O-N 3.47Å; S150-L153 WeakPolarHBondContact O-CB 3.49Å; S150-L153 PolarHBondContact O-N 2.95Å; S150-L153 VanDerWaalsContact O-N 3.13Å; S150-W154 VanDerWaalsContact O-CD1 3.27Å
151L68.3Low77.5Confident57 Ų5742.3 Ų42.330%0.29822%0.218SC..G310 helixtrans-60.7-31.7177.3-64.6177.1000113.4S149 L153 W154S149-L151 PolarHBondContact O-N 3.18Å; S149-L151 VanDerWaalsContact O-N 3.13Å; S149-L151 WeakPolarHBondContact OG-CB 3.3Å; S149-L151 PolarHBondContact OG-N 3.09Å; L151-L153 PolarHBondContact O-N 3.43Å; L151-L153 VanDerWaalsContact O-N 3.09Å; L151-W154 HydrophobicContact CD2-CD2 4.26Å; L151-W154 HydrophobicContact CD2-CG 4.42Å; L151-W154 HydrophobicContact CD2-CZ2 4.22Å; L151-W154 WeakPolarHBondContact O-CB 3.43Å; L151-W154 PolarHBondContact O-N 3.35Å; L151-W154 VanDerWaalsContact O-N 3.08Å
152A70.6Confident77.6Confident0 Ų045.9 Ų45.90%023%0.233CC..G310 helixtrans-62-21.3177.200000113.2D146 S149 S150D146-A152 WeakPolarHBondContact O-CB 3.47Å; S149-A152 PolarHBondContact O-N 3.36Å; S149-A152 VanDerWaalsContact O-N 3.12Å; S150-A152 VanDerWaalsContact C-N 3.29Å; S150-A152 PolarHBondContact O-N 3.47Å
153L77.8Confident77.9Confident31 Ų3141.5 Ų41.516%0.16222%0.217CC..G310 helixtrans-90.8-13.5-179.5-51.4-176.7000113L54 S150 L151 I156 A157 F188 T192L54-L153 HydrophobicContact CD2-CD1 4.07Å; L54-L153 HydrophobicContact CD2-CD2 3.82Å; L54-L153 HydrophobicContact CD2-CG 4.38Å; S150-L153 WeakPolarHBondContact O-CB 3.49Å; S150-L153 PolarHBondContact O-N 2.95Å; S150-L153 VanDerWaalsContact O-N 3.13Å; L151-L153 PolarHBondContact O-N 3.43Å; L151-L153 VanDerWaalsContact O-N 3.09Å; L153-I156 WeakPolarHBondContact O-CB 3.5Å; L153-I156 PolarHBondContact O-N 3.12Å; L153-I156 VanDerWaalsContact O-N 3.1Å; L153-A157 PolarHBondContact O-N 3.49Å; L153-F188 HydrophobicContact CB-CE1 4.39Å; L153-T192 HydrophobicContact CD1-CG2 3.38Å
154W76.2Confident78.2Confident128 Ų12839.2 Ų39.249%0.48521%0.207SC..Hα-helixtrans-58.1-42.5-176.6-82.647.5000113.6F83 S150 L151 I156 A157 F158F83-W154 HydrophobicContact CD2-CB 4.06Å; F83-W154 HydrophobicContact CD2-CE3 4.48Å; F83-W154 HydrophobicContact CE2-CB 4.21Å; F83-W154 HydrophobicContact CE2-CD2 4.08Å; F83-W154 AromaticContact CE2-CE3 3.55Å; F83-W154 HydrophobicContact CE2-CE3 3.55Å; F83-W154 HydrophobicContact CE2-CG 4.41Å; F83-W154 HydrophobicContact CE2-CZ3 4.2Å; F83-W154 HydrophobicContact CZ-CE3 4.12Å; F83-W154 HydrophobicContact CZ-CZ3 4.33Å; S150-W154 VanDerWaalsContact O-CD1 3.27Å; L151-W154 HydrophobicContact CD2-CD2 4.26Å; L151-W154 HydrophobicContact CD2-CG 4.42Å; L151-W154 HydrophobicContact CD2-CZ2 4.22Å; L151-W154 WeakPolarHBondContact O-CB 3.43Å; L151-W154 PolarHBondContact O-N 3.35Å; L151-W154 VanDerWaalsContact O-N 3.08Å; W154-I156 VanDerWaalsContact C-N 3.28Å; W154-I156 PolarHBondContact O-N 3.16Å; W154-A157 PolarHBondContact O-N 3.12Å; W154-F158 WeakPolarHBondContact O-CB 3.3Å; W154-F158 PolarHBondContact O-N 3.33Å
155P78.3Confident78.5Confident0 Ų044.1 Ų44.10%023%0.226CC..Hα-helixtrans-60.6-37.7176.5-2838.8000112.7R82 W86 E159R82-P155 HydrophobicContact CG-CG 4.06Å; W86-P155 HydrophobicContact CB-CG 4.18Å; W86-P155 HydrophobicContact CD2-CB 4.5Å; W86-P155 HydrophobicContact CD2-CG 4.35Å; W86-P155 HydrophobicContact CG-CB 4.06Å; W86-P155 HydrophobicContact CG-CG 4Å; P155-E159 WeakPolarHBondContact O-CB 3.43Å; P155-E159 WeakPolarHBondContact O-CG 3.28Å; P155-E159 PolarHBondContact O-N 3.45Å
156I84.3Confident78.4Confident0 Ų046.6 Ų46.60%024%0.239CC..Hα-helixtrans-67.2-45.9175.9-57.8170.1000109.6L55 V58 L72 L75 L153 W154 S160 F188L55-I156 HydrophobicContact CD2-CD1 3.53Å; L55-I156 HydrophobicContact CD2-CG1 3.91Å; L55-I156 HydrophobicContact CD2-CG2 4.24Å; L55-I156 HydrophobicContact CG-CD1 3.97Å; V58-I156 HydrophobicContact CG2-CG2 4.23Å; L72-I156 HydrophobicContact CD2-CG2 4.21Å; L75-I156 HydrophobicContact CD1-CD1 3.8Å; L75-I156 HydrophobicContact CD2-CD1 4.2Å; L75-I156 HydrophobicContact CG-CD1 4.07Å; L153-I156 WeakPolarHBondContact O-CB 3.5Å; L153-I156 PolarHBondContact O-N 3.12Å; L153-I156 VanDerWaalsContact O-N 3.1Å; W154-I156 VanDerWaalsContact C-N 3.28Å; W154-I156 PolarHBondContact O-N 3.16Å; I156-S160 VanDerWaalsContact O-CB 3.25Å; I156-S160 WeakPolarHBondContact O-CB 3.46Å; I156-S160 PolarHBondContact O-N 3.13Å; I156-S160 PolarHBondContact O-OG 2.65Å; I156-F188 HydrophobicContact CB-CZ 4.37Å; I156-F188 HydrophobicContact CG2-CZ 3.91Å
157A86.2Confident78.2Confident39 Ų3947.7 Ų47.732%0.32225%0.247SC..Hα-helixtrans-61.8-45.117900000111.7L153 W154 S160 L161 F188L153-A157 PolarHBondContact O-N 3.49Å; W154-A157 PolarHBondContact O-N 3.12Å; A157-S160 PolarHBondContact O-N 2.93Å; A157-L161 WeakPolarHBondContact O-CB 3.47Å; A157-L161 PolarHBondContact O-N 3.38Å; A157-F188 HydrophobicContact CB-CE1 3.95Å; A157-F188 HydrophobicContact CB-CZ 3.78Å
158F82.5Confident78.1Confident71 Ų7154.7 Ų54.731%0.31129%0.285SS..Hα-helixtrans-63.4-52178.9177.3-91.1000112W86 W154 S160 L161 K162W86-F158 AromaticContact CE2-CD1 3.66Å; W86-F158 AromaticContact CE2-CG 3.8Å; W86-F158 HydrophobicContact CH2-CB 4.03Å; W86-F158 HydrophobicContact CH2-CD1 4.22Å; W86-F158 AromaticContact CH2-CD2 3.51Å; W86-F158 HydrophobicContact CH2-CD2 3.51Å; W86-F158 AromaticContact CH2-CE2 3.9Å; W86-F158 HydrophobicContact CH2-CE2 3.9Å; W86-F158 AromaticContact CH2-CG 3.67Å; W86-F158 HydrophobicContact CH2-CG 3.67Å; W86-F158 HydrophobicContact CH2-CZ 4.4Å; W86-F158 HydrophobicContact CZ2-CB 3.57Å; W86-F158 AromaticContact CZ2-CD1 3.17Å; W86-F158 HydrophobicContact CZ2-CD1 3.17Å; W86-F158 AromaticContact CZ2-CD2 3.28Å; W86-F158 HydrophobicContact CZ2-CD2 3.28Å; W86-F158 AromaticContact CZ2-CE1 3.5Å; W86-F158 HydrophobicContact CZ2-CE1 3.5Å; W86-F158 VanDerWaalsContact CZ2-CE1 3.5Å; W86-F158 AromaticContact CZ2-CE2 3.61Å; W86-F158 HydrophobicContact CZ2-CE2 3.61Å; W86-F158 AromaticContact CZ2-CG 3.02Å; W86-F158 HydrophobicContact CZ2-CG 3.02Å; W86-F158 AromaticContact CZ2-CZ 3.7Å; W86-F158 HydrophobicContact CZ2-CZ 3.7Å; W86-F158 AromaticContact NE1-CD1 3.64Å; W154-F158 WeakPolarHBondContact O-CB 3.3Å; W154-F158 PolarHBondContact O-N 3.33Å; F158-S160 PolarHBondContact O-N 3.1Å; F158-L161 PolarHBondContact O-N 2.93Å; F158-L161 VanDerWaalsContact O-N 3.14Å; F158-K162 HydrophobicContact CD1-CD 4.49Å; F158-K162 HydrophobicContact CE1-CB 4.4Å; F158-K162 HydrophobicContact CE1-CD 3.74Å; F158-K162 HydrophobicContact CZ-CD 4.28Å; F158-K162 VanDerWaalsContact O-CB 3.28Å; F158-K162 WeakPolarHBondContact O-CB 3.28Å; F158-K162 PolarHBondContact O-N 3.39Å
159E84.1Confident78.2Confident34 Ų3454.5 Ų54.516%0.15928%0.281CS..Hα-helixtrans-62.9-34.5-179.9-70.3-55.5145.100111.2P70 L72 P155 A163P70-E159 HydrophobicContact CB-CB 4.43Å; L72-E159 HydrophobicContact CD2-CB 4.45Å; P155-E159 WeakPolarHBondContact O-CB 3.43Å; P155-E159 WeakPolarHBondContact O-CG 3.28Å; P155-E159 PolarHBondContact O-N 3.45Å; E159-A163 VanDerWaalsContact O-CB 3.22Å; E159-A163 WeakPolarHBondContact O-CB 3.21Å; E159-A163 PolarHBondContact O-N 2.91Å
160S88.4Confident78.3Confident3 Ų352.8 Ų52.82%0.02127%0.269CS..Hα-helixtrans-64.1-48.2173.3-580000111.7V58 I156 A157 F158 A163 V164V58-S160 WeakPolarHBondContact CG1-OG 3.28Å; I156-S160 VanDerWaalsContact O-CB 3.25Å; I156-S160 WeakPolarHBondContact O-CB 3.46Å; I156-S160 PolarHBondContact O-N 3.13Å; I156-S160 PolarHBondContact O-OG 2.65Å; A157-S160 PolarHBondContact O-N 2.93Å; F158-S160 PolarHBondContact O-N 3.1Å; S160-A163 PolarHBondContact O-N 2.88Å; S160-V164 WeakPolarHBondContact O-CG2 3.39Å; S160-V164 PolarHBondContact O-N 2.99Å; S160-V164 VanDerWaalsContact O-N 3.09Å
161L87.6Confident78.3Confident91 Ų9154.5 Ų54.548%0.47628%0.281SS..Hα-helixtrans-65.2-45.1-179.7-169.274.2000111.8A157 F158 A163 V164 Y165A157-L161 WeakPolarHBondContact O-CB 3.47Å; A157-L161 PolarHBondContact O-N 3.38Å; F158-L161 PolarHBondContact O-N 2.93Å; F158-L161 VanDerWaalsContact O-N 3.14Å; L161-A163 VanDerWaalsContact C-N 3.28Å; L161-A163 PolarHBondContact O-N 3.25Å; L161-V164 PolarHBondContact O-N 2.98Å; L161-Y165 HydrophobicContact CD1-CD2 3.61Å; L161-Y165 HydrophobicContact CD1-CE2 3.51Å; L161-Y165 HydrophobicContact CG-CD2 4.02Å; L161-Y165 HydrophobicContact CG-CE2 4.42Å; L161-Y165 WeakPolarHBondContact O-CD2 3.21Å; L161-Y165 PolarHBondContact O-N 3.18Å
162K83.2Confident78Confident86 Ų8653.4 Ų53.437%0.37428%0.28SS..Hα-helixtrans-56.8-43.9173.7-178.4179.8177-176.80110.7F158 V164 H166 S167F158-K162 HydrophobicContact CD1-CD 4.49Å; F158-K162 HydrophobicContact CE1-CB 4.4Å; F158-K162 HydrophobicContact CE1-CD 3.74Å; F158-K162 HydrophobicContact CZ-CD 4.28Å; F158-K162 VanDerWaalsContact O-CB 3.28Å; F158-K162 WeakPolarHBondContact O-CB 3.28Å; F158-K162 PolarHBondContact O-N 3.39Å; K162-V164 PolarHBondContact O-N 2.95Å; K162-H166 HydrophobicContact CG-CB 4.3Å; K162-H166 CarbonylContact O-C 3.55Å; K162-H166 WeakPolarHBondContact O-CA 3.49Å; K162-H166 PolarHBondContact O-N 2.94Å; K162-S167 PolarHBondContact O-N 3.26Å
163A84.8Confident77.7Confident4 Ų458.8 Ų58.83%0.03331%0.313CS..Hα-helixtrans-62.5-41.5178.200000112.5F62 P70 E159 S160 L161 S167 A169F62-A163 HydrophobicContact CE1-CB 3.62Å; F62-A163 HydrophobicContact CZ-CB 3.68Å; P70-A163 HydrophobicContact CB-CB 4.08Å; P70-A163 HydrophobicContact CG-CB 3.99Å; E159-A163 VanDerWaalsContact O-CB 3.22Å; E159-A163 WeakPolarHBondContact O-CB 3.21Å; E159-A163 PolarHBondContact O-N 2.91Å; S160-A163 PolarHBondContact O-N 2.88Å; L161-A163 VanDerWaalsContact C-N 3.28Å; L161-A163 PolarHBondContact O-N 3.25Å; A163-S167 VanDerWaalsContact CA-OG 3.24Å; A163-S167 WeakPolarHBondContact CA-OG 3.31Å; A163-S167 PolarHBondContact O-OG 3.01Å; A163-A169 HydrophobicContact CB-CB 4.32Å
164V84.9Confident77.3Confident0 Ų068 Ų680%035%0.345CS..Hα-helixtrans-65.9-50.4178.6175.90000112.1S160 L161 K162 K177 L180 L184S160-V164 WeakPolarHBondContact O-CG2 3.39Å; S160-V164 PolarHBondContact O-N 2.99Å; S160-V164 VanDerWaalsContact O-N 3.09Å; L161-V164 PolarHBondContact O-N 2.98Å; K162-V164 PolarHBondContact O-N 2.95Å; V164-K177 HydrophobicContact CG1-CB 4.37Å; V164-K177 WeakPolarHBondContact O-CD 3.43Å; V164-K177 WeakPolarHBondContact O-CE 3.06Å; V164-K177 PolarHBondContact O-NZ 3.31Å; V164-K177 VanDerWaalsContact O-NZ 3.12Å; V164-L180 HydrophobicContact CG2-CD2 3.68Å; V164-L180 HydrophobicContact CG2-CG 3.91Å; V164-L184 HydrophobicContact CG2-CD1 3.53Å
165Y81.9Confident77.1Confident106 Ų10666.1 Ų66.142%0.41635%0.348SS..Hα-helixtrans-102.5-32.7-165.2-66.6-72.5000114.5L161 D181L161-Y165 HydrophobicContact CD1-CD2 3.61Å; L161-Y165 HydrophobicContact CD1-CE2 3.51Å; L161-Y165 HydrophobicContact CG-CD2 4.02Å; L161-Y165 HydrophobicContact CG-CE2 4.42Å; L161-Y165 WeakPolarHBondContact O-CD2 3.21Å; L161-Y165 PolarHBondContact O-N 3.18Å; Y165-D181 WeakPolarHBondContact CE2-OD1 3.3Å; Y165-D181 PolarHBondContact OH-OD1 3.32Å
166H74.2Confident77Confident158 Ų15867 Ų6773%0.73135%0.354SS*.THydrogen-bonded Turntrans-115.8-3.2-168.4-64.3-73.1000114.3K162K162-H166 HydrophobicContact CG-CB 4.3Å; K162-H166 CarbonylContact O-C 3.55Å; K162-H166 WeakPolarHBondContact O-CA 3.49Å; K162-H166 PolarHBondContact O-N 2.94Å
167S67.7Low77Confident33 Ų3369.7 Ų69.723%0.23137%0.366CS..SBendtrans-116.2160.2178.289.50000112K162 A163 A169K162-S167 PolarHBondContact O-N 3.26Å; A163-S167 VanDerWaalsContact CA-OG 3.24Å; A163-S167 WeakPolarHBondContact CA-OG 3.31Å; A163-S167 PolarHBondContact O-OG 3.01Å; S167-A169 PolarHBondContact O-N 3.38Å; S167-A169 WeakPolarHBondContact OG-CB 3.39Å; S167-A169 PolarHBondContact OG-N 3.49Å
168N69.9Low77Confident160 Ų16072.1 Ų72.186%0.85637%0.373SS*.THydrogen-bonded Turntrans-80.111.6170.8-52.3-11.2000111.6C170N168-C170 PolarHBondContact O-N 3.11Å; N168-C170 VanDerWaalsContact O-N 3.17Å
169A72.2Confident77.4Confident17 Ų1771.6 Ų71.614%0.1437%0.374CS..THydrogen-bonded Turntrans-59.1-29.9-175.100000112.7C67 S68 A163 S167C67-A169 CarbonylContact C-O 3.47Å; C67-A169 VanDerWaalsContact CA-O 3.3Å; C67-A169 WeakPolarHBondContact CA-O 3.49Å; S68-A169 PolarHBondContact N-O 3.34Å; A163-A169 HydrophobicContact CB-CB 4.32Å; S167-A169 PolarHBondContact O-N 3.38Å; S167-A169 WeakPolarHBondContact OG-CB 3.39Å; S167-A169 PolarHBondContact OG-N 3.49Å
170C73.2Confident77.7Confident7 Ų770 Ų705%0.04737%0.366CS..  trans-108.3105.2170.2-64.10000109.6C67 N168 A172 L180C67-C170 HydrophobicContact CB-CB 4.12Å; C67-C170 WeakPolarHBondContact CB-SG 3.41Å; C67-C170 VanDerWaalsContact SG-CA 3.58Å; C67-C170 WeakPolarHBondContact SG-CB 3.26Å; C67-C170 CovalentContact SG-SG 2.03Å; C67-C170 PolarHBondContact SG-SG 3.26Å; N168-C170 PolarHBondContact O-N 3.11Å; N168-C170 VanDerWaalsContact O-N 3.17Å; C170-A172 PolarHBondContact O-N 2.82Å; C170-L180 WeakPolarHBondContact SG-CD2 3.43Å
171S69.3Low77.9Confident120 Ų12071.2 Ų71.284%0.83937%0.372SS*.  trans-68.5-5167.155.30000112.9
172A60.3Low78.2Confident34 Ų3472.7 Ų72.728%0.28138%0.375SS..SBendtrans-81.5146.5-170.800000113.7C170 S176C170-A172 PolarHBondContact O-N 2.82Å; A172-S176 VanDerWaalsContact CB-OG 3.26Å; A172-S176 WeakPolarHBondContact CB-OG 3.42Å
173V64.7Low78.8Confident112 Ų11269.9 Ų69.968%0.67937%0.366SS*.  trans-43.9151.3177.8-1780000112.1T175 S176V173-T175 PolarHBondContact O-N 2.68Å; V173-S176 WeakPolarHBondContact O-CA 3.48Å; V173-S176 VanDerWaalsContact O-CB 3.24Å; V173-S176 WeakPolarHBondContact O-CB 3.37Å; V173-S176 PolarHBondContact O-N 3.34Å
174R70.5Confident79.2Confident226 Ų22670.1 Ų70.185%0.85337%0.366SS*.Hα-helixtrans-40.7-38.7-180-172.8178.5-178.8173.71.1114.4S176 K177 L178R174-S176 VanDerWaalsContact C-N 3.31Å; R174-S176 PolarHBondContact O-N 3.32Å; R174-K177 PolarHBondContact O-N 3.46Å; R174-L178 PolarHBondContact O-N 3.45Å
175T71.2Confident79.7Confident88 Ų8874 Ų7454%0.5439%0.387SS..Hα-helixtrans-60.4-36.7176.8-18.40000113.2V173 L178 N179V173-T175 PolarHBondContact O-N 2.68Å; T175-L178 PolarHBondContact O-N 2.7Å; T175-N179 WeakPolarHBondContact O-CB 3.46Å; T175-N179 VanDerWaalsContact O-CG 3.23Å; T175-N179 PolarHBondContact O-N 2.81Å; T175-N179 PolarHBondContact O-ND2 3.32Å
176S77.2Confident80.3Confident19 Ų1970.5 Ų70.513%0.13338%0.38CS..Hα-helixtrans-67.2-38.7176.5-166.20000112.1A172 V173 R174 N179 L180A172-S176 VanDerWaalsContact CB-OG 3.26Å; A172-S176 WeakPolarHBondContact CB-OG 3.42Å; V173-S176 WeakPolarHBondContact O-CA 3.48Å; V173-S176 VanDerWaalsContact O-CB 3.24Å; V173-S176 WeakPolarHBondContact O-CB 3.37Å; V173-S176 PolarHBondContact O-N 3.34Å; R174-S176 VanDerWaalsContact C-N 3.31Å; R174-S176 PolarHBondContact O-N 3.32Å; S176-N179 PolarHBondContact O-N 3.01Å; S176-L180 WeakPolarHBondContact O-CB 3.34Å; S176-L180 PolarHBondContact O-N 3.36Å
177K83.3Confident81.3Confident56 Ų5663.2 Ų63.224%0.24335%0.348CS..Hα-helixtrans-62.6-44.8175.8-68.2-170173.6-156.30111.4V164 R174 N179 L180 D181V164-K177 HydrophobicContact CG1-CB 4.37Å; V164-K177 WeakPolarHBondContact O-CD 3.43Å; V164-K177 WeakPolarHBondContact O-CE 3.06Å; V164-K177 PolarHBondContact O-NZ 3.31Å; V164-K177 VanDerWaalsContact O-NZ 3.12Å; R174-K177 PolarHBondContact O-N 3.46Å; K177-N179 VanDerWaalsContact C-N 3.33Å; K177-N179 PolarHBondContact O-N 3.08Å; K177-L180 PolarHBondContact O-N 3.41Å; K177-D181 WeakPolarHBondContact O-CB 3.4Å; K177-D181 PolarHBondContact O-N 3.36Å
178L86.5Confident82.4Confident89 Ų8963.5 Ų63.547%0.46635%0.345SS..Hα-helixtrans-61.8-40.2175.5-176.168.2000112.1R174 T175 K182R174-L178 PolarHBondContact O-N 3.45Å; T175-L178 PolarHBondContact O-N 2.7Å; L178-K182 WeakPolarHBondContact O-CG 3.37Å; L178-K182 PolarHBondContact O-N 3.38Å
179N89.9Confident83.3Confident61 Ų6163.1 Ų63.133%0.32634%0.338SS..Hα-helixtrans-72.6-34.9179.2-70.6-20.3000112.7Y65 T175 S176 K177 C183Y65-N179 HydrophobicContact CD1-CB 4.29Å; Y65-N179 HydrophobicContact CE1-CB 3.58Å; Y65-N179 HydrophobicContact CE2-CB 4.47Å; Y65-N179 WeakPolarHBondContact CE2-O 3.38Å; Y65-N179 PolarHBondContact OH-O 3.14Å; T175-N179 WeakPolarHBondContact O-CB 3.46Å; T175-N179 VanDerWaalsContact O-CG 3.23Å; T175-N179 PolarHBondContact O-N 2.81Å; T175-N179 PolarHBondContact O-ND2 3.32Å; S176-N179 PolarHBondContact O-N 3.01Å; K177-N179 VanDerWaalsContact C-N 3.33Å; K177-N179 PolarHBondContact O-N 3.08Å; N179-C183 WeakPolarHBondContact O-CB 3.35Å; N179-C183 PolarHBondContact O-N 3.42Å
180L91.1Very high84Confident0 Ų069.1 Ų69.10%036%0.363CS..Hα-helixtrans-64.7-47.8171.6174.560.4000110.6C61 F62 Y65 C67 V164 C170 S176 K177 K182 C183 L184C61-L180 HydrophobicContact CB-CD1 3.89Å; F62-L180 HydrophobicContact CD1-CD1 4.31Å; F62-L180 HydrophobicContact CD1-CD2 3.93Å; F62-L180 HydrophobicContact CE1-CD1 4.49Å; F62-L180 HydrophobicContact CE1-CD2 3.73Å; F62-L180 HydrophobicContact CG-CD1 4.41Å; F62-L180 HydrophobicContact CZ-CD2 4.45Å; Y65-L180 HydrophobicContact CD2-CB 3.91Å; Y65-L180 HydrophobicContact CD2-CD1 3.97Å; Y65-L180 HydrophobicContact CE2-CB 4.45Å; Y65-L180 HydrophobicContact CG-CB 4.41Å; C67-L180 HydrophobicContact CB-CD2 4.48Å; V164-L180 HydrophobicContact CG2-CD2 3.68Å; V164-L180 HydrophobicContact CG2-CG 3.91Å; C170-L180 WeakPolarHBondContact SG-CD2 3.43Å; S176-L180 WeakPolarHBondContact O-CB 3.34Å; S176-L180 PolarHBondContact O-N 3.36Å; K177-L180 PolarHBondContact O-N 3.41Å; L180-K182 PolarHBondContact O-N 3.48Å; L180-C183 WeakPolarHBondContact O-CB 3.31Å; L180-C183 PolarHBondContact O-N 3.16Å; L180-L184 HydrophobicContact CD1-CD1 4Å; L180-L184 HydrophobicContact CD1-CG 4.02Å; L180-L184 HydrophobicContact CG-CD1 3.91Å; L180-L184 HydrophobicContact CG-CG 4.38Å; L180-L184 WeakPolarHBondContact O-CG 3.3Å; L180-L184 PolarHBondContact O-N 3.01Å
181D91.8Very high84.6Confident29 Ų2970.1 Ų70.116%0.15537%0.368CS..Hα-helixtrans-55.8-47.9176.5-174.986.2000111.8Y165 K177 C183 L184 N185Y165-D181 WeakPolarHBondContact CE2-OD1 3.3Å; Y165-D181 PolarHBondContact OH-OD1 3.32Å; K177-D181 WeakPolarHBondContact O-CB 3.4Å; K177-D181 PolarHBondContact O-N 3.36Å; D181-C183 VanDerWaalsContact C-N 3.32Å; D181-C183 PolarHBondContact O-N 3.44Å; D181-L184 PolarHBondContact O-N 2.85Å; D181-N185 PolarHBondContact O-N 3.43Å; D181-N185 PolarHBondContact O-ND2 3.03Å; D181-N185 PolarHBondContact OD2-ND2 3.25Å
182K93.9Very high85.2Confident121 Ų12167.2 Ų67.253%0.52635%0.345SS..Hα-helixtrans-58.8-40.4173.6-74.5176.5-179.9-178.10113.2L178 L180 A186L178-K182 WeakPolarHBondContact O-CG 3.37Å; L178-K182 PolarHBondContact O-N 3.38Å; L180-K182 PolarHBondContact O-N 3.48Å; K182-A186 PolarHBondContact O-N 3.44Å; K182-A186 VanDerWaalsContact O-N 3.12Å
183C95.3Very high86Confident27 Ų2767 Ų6718%0.18234%0.34CS..Hα-helixtrans-65.4-45.3177.5-1730000111.4C61 Y65 N179 L180 D181 A186 A187C61-C183 VanDerWaalsContact CA-SG 3.5Å; C61-C183 HydrophobicContact CB-CB 3.81Å; C61-C183 WeakPolarHBondContact CB-SG 3.19Å; C61-C183 WeakPolarHBondContact SG-CB 3.23Å; C61-C183 PolarHBondContact SG-O 3.48Å; C61-C183 CovalentContact SG-SG 2.05Å; C61-C183 PolarHBondContact SG-SG 3.02Å; Y65-C183 HydrophobicContact CE2-CB 3.75Å; N179-C183 WeakPolarHBondContact O-CB 3.35Å; N179-C183 PolarHBondContact O-N 3.42Å; L180-C183 WeakPolarHBondContact O-CB 3.31Å; L180-C183 PolarHBondContact O-N 3.16Å; D181-C183 VanDerWaalsContact C-N 3.32Å; D181-C183 PolarHBondContact O-N 3.44Å; C183-A186 PolarHBondContact O-N 3.08Å; C183-A187 WeakPolarHBondContact O-CB 3.37Å; C183-A187 PolarHBondContact O-N 3.14Å
184L94.9Very high86.7Confident9 Ų966 Ų665%0.04733%0.331CS..Hα-helixtrans-62.6-46.2178.2-68.6169.1000110.8V58 C61 F62 V164 L180 D181 A186 A187 F188V58-L184 HydrophobicContact CB-CD2 4.24Å; V58-L184 HydrophobicContact CG1-CD2 3.83Å; V58-L184 HydrophobicContact CG2-CD2 4.17Å; C61-L184 HydrophobicContact CB-CD2 3.88Å; C61-L184 HydrophobicContact CB-CG 4.24Å; F62-L184 HydrophobicContact CD2-CD2 4.4Å; F62-L184 HydrophobicContact CE2-CD1 4.32Å; F62-L184 HydrophobicContact CE2-CD2 3.92Å; F62-L184 HydrophobicContact CZ-CD1 4.15Å; V164-L184 HydrophobicContact CG2-CD1 3.53Å; L180-L184 HydrophobicContact CD1-CD1 4Å; L180-L184 HydrophobicContact CD1-CG 4.02Å; L180-L184 HydrophobicContact CG-CD1 3.91Å; L180-L184 HydrophobicContact CG-CG 4.38Å; L180-L184 WeakPolarHBondContact O-CG 3.3Å; L180-L184 PolarHBondContact O-N 3.01Å; D181-L184 PolarHBondContact O-N 2.85Å; L184-A186 VanDerWaalsContact C-N 3.34Å; L184-A186 PolarHBondContact O-N 3.02Å; L184-A187 WeakPolarHBondContact O-CA 3.44Å; L184-A187 WeakPolarHBondContact O-CB 3.16Å; L184-A187 PolarHBondContact O-N 3.3Å; L184-F188 WeakPolarHBondContact O-CD2 2.99Å; L184-F188 PolarHBondContact O-N 3.32Å
185N94.6Very high87.2Confident82 Ų8260.5 Ų60.544%0.43932%0.324SS..Hα-helixtrans-54.9-49.1175.3-75-31.8000111.6D181 A187 F188 E189D181-N185 PolarHBondContact O-N 3.43Å; D181-N185 PolarHBondContact O-ND2 3.03Å; D181-N185 PolarHBondContact OD2-ND2 3.25Å; N185-A187 VanDerWaalsContact C-N 3.3Å; N185-A187 PolarHBondContact O-N 3.1Å; N185-F188 PolarHBondContact O-N 2.99Å; N185-E189 WeakPolarHBondContact O-CG 3.22Å; N185-E189 PolarHBondContact O-N 2.95Å
186A95.3Very high87.7Confident32 Ų3264.2 Ų64.226%0.26433%0.33SS..Hα-helixtrans-61.8-37176.100000112.7K182 C183 L184 E189 Q190K182-A186 PolarHBondContact O-N 3.44Å; K182-A186 VanDerWaalsContact O-N 3.12Å; C183-A186 PolarHBondContact O-N 3.08Å; L184-A186 VanDerWaalsContact C-N 3.34Å; L184-A186 PolarHBondContact O-N 3.02Å; A186-E189 PolarHBondContact O-N 2.95Å; A186-Q190 VanDerWaalsContact O-CB 3.29Å; A186-Q190 WeakPolarHBondContact O-CB 3.29Å; A186-Q190 WeakPolarHBondContact O-CG 3.49Å; A186-Q190 PolarHBondContact O-N 3.24Å
187A93.8Very high88Confident6 Ų667.3 Ų67.35%0.0534%0.341CS..Hα-helixtrans-62.8-44176.100000111.7A57 C183 L184 N185 N191A57-A187 HydrophobicContact CB-CB 3.79Å; C183-A187 WeakPolarHBondContact O-CB 3.37Å; C183-A187 PolarHBondContact O-N 3.14Å; L184-A187 WeakPolarHBondContact O-CA 3.44Å; L184-A187 WeakPolarHBondContact O-CB 3.16Å; L184-A187 PolarHBondContact O-N 3.3Å; N185-A187 VanDerWaalsContact C-N 3.3Å; N185-A187 PolarHBondContact O-N 3.1Å; A187-N191 VanDerWaalsContact O-CB 3.28Å; A187-N191 WeakPolarHBondContact O-CB 3.33Å; A187-N191 PolarHBondContact O-N 2.97Å; A187-N191 PolarHBondContact O-ND2 3.49Å
188F90.7Very high88Confident39 Ų3964.8 Ų64.817%0.17133%0.33CS..Hα-helixtrans-66.9-43.7175.3-83-88.3000111.8L54 V58 L153 I156 A157 L184 N185 Q190 T192L54-F188 HydrophobicContact CD1-CB 4.5Å; L54-F188 HydrophobicContact CD1-CD1 3.93Å; L54-F188 HydrophobicContact CD1-CD2 4.24Å; L54-F188 HydrophobicContact CD1-CE1 4.16Å; L54-F188 HydrophobicContact CD1-CE2 4.43Å; L54-F188 HydrophobicContact CD1-CG 3.97Å; L54-F188 HydrophobicContact CD1-CZ 4.39Å; L54-F188 HydrophobicContact CD2-CD1 3.97Å; L54-F188 HydrophobicContact CD2-CE1 3.73Å; L54-F188 HydrophobicContact CD2-CZ 4.37Å; L54-F188 HydrophobicContact CG-CE1 4.41Å; V58-F188 HydrophobicContact CG2-CE2 3.96Å; V58-F188 HydrophobicContact CG2-CZ 4.41Å; L153-F188 HydrophobicContact CB-CE1 4.39Å; I156-F188 HydrophobicContact CB-CZ 4.37Å; I156-F188 HydrophobicContact CG2-CZ 3.91Å; A157-F188 HydrophobicContact CB-CE1 3.95Å; A157-F188 HydrophobicContact CB-CZ 3.78Å; L184-F188 WeakPolarHBondContact O-CD2 2.99Å; L184-F188 PolarHBondContact O-N 3.32Å; N185-F188 PolarHBondContact O-N 2.99Å; F188-Q190 VanDerWaalsContact C-N 3.33Å; F188-Q190 PolarHBondContact O-N 3.15Å; F188-T192 HydrophobicContact CD1-CG2 4.35Å; F188-T192 VanDerWaalsContact O-CB 3.28Å; F188-T192 WeakPolarHBondContact O-CB 3.47Å; F188-T192 WeakPolarHBondContact O-CG2 3.48Å; F188-T192 PolarHBondContact O-N 3.46Å; F188-T192 PolarHBondContact O-OG1 3.24Å
189E88.8Confident87.9Confident152 Ų15264 Ų6471%0.7133%0.325SS*.Hα-helixtrans-62.2-38.7178.1-72.4175.8175.500112.9N185 A186N185-E189 WeakPolarHBondContact O-CG 3.22Å; N185-E189 PolarHBondContact O-N 2.95Å; A186-E189 PolarHBondContact O-N 2.95Å
190Q88.2Confident87.8Confident143 Ų14366 Ų6667%0.66833%0.331SS*.Hα-helixtrans-85.6-25.4-175-67.7171.817.400114A186 F188A186-Q190 VanDerWaalsContact O-CB 3.29Å; A186-Q190 WeakPolarHBondContact O-CB 3.29Å; A186-Q190 WeakPolarHBondContact O-CG 3.49Å; A186-Q190 PolarHBondContact O-N 3.24Å; F188-Q190 VanDerWaalsContact C-N 3.33Å; F188-Q190 PolarHBondContact O-N 3.15Å
191N85.7Confident87.7Confident28 Ų2867.8 Ų67.815%0.1534%0.34CS..Hα-helixtrans-11411.8-173-58.5-84.7000113.3L54 A187L54-N191 HydrophobicContact CB-CB 3.88Å; L54-N191 HydrophobicContact CD1-CB 4.12Å; A187-N191 VanDerWaalsContact O-CB 3.28Å; A187-N191 WeakPolarHBondContact O-CB 3.33Å; A187-N191 PolarHBondContact O-N 2.97Å; A187-N191 PolarHBondContact O-ND2 3.49Å
192T81Confident87.4Confident59 Ų5967.4 Ų67.436%0.36234%0.338SS..PPolyproline II helixtrans-98.5133.7170.252.90000111.3L153 F188L153-T192 HydrophobicContact CD1-CG2 3.38Å; F188-T192 HydrophobicContact CD1-CG2 4.35Å; F188-T192 VanDerWaalsContact O-CB 3.28Å; F188-T192 WeakPolarHBondContact O-CB 3.47Å; F188-T192 WeakPolarHBondContact O-CG2 3.48Å; F188-T192 PolarHBondContact O-N 3.46Å; F188-T192 PolarHBondContact O-OG1 3.24Å
193V77.4Confident87.2Confident29 Ų2965.1 Ų65.118%0.17633%0.329CS..PPolyproline II helixtrans-83.9127.5174.7172.80000108.9I49 M50 K197 A198I49-V193 HydrophobicContact CB-CG2 4.45Å; I49-V193 WeakPolarHBondContact O-CG2 3.44Å; M50-V193 HydrophobicContact CG-CG2 4.36Å; V193-K197 HydrophobicContact CG1-CB 3.68Å; V193-K197 HydrophobicContact CG1-CD 3.95Å; V193-K197 HydrophobicContact CG1-CG 3.7Å; V193-A198 HydrophobicContact CG1-CB 4.07Å
194N80.4Confident87Confident90 Ų9066.7 Ų66.748%0.48134%0.343SS..PPolyproline II helixtrans-62.3151.2175.771.767.6000111Y196 K197 A198N194-Y196 VanDerWaalsContact C-N 3.27Å; N194-Y196 PolarHBondContact O-N 2.87Å; N194-Y196 VanDerWaalsContact O-N 3.15Å; N194-Y196 WeakPolarHBondContact OD1-CB 3.37Å; N194-Y196 PolarHBondContact OD1-N 3.48Å; N194-K197 PolarHBondContact O-N 3.29Å; N194-K197 VanDerWaalsContact O-N 3.1Å; N194-K197 PolarHBondContact OD1-N 3.48Å; N194-A198 PolarHBondContact O-N 2.91Å
195P79.3Confident86.8Confident111 Ų11167 Ų6772%0.72135%0.346SS*.Hα-helixtrans-56.7-36.3-172.8-28.235.6000114.4A198 M199P195-A198 PolarHBondContact O-N 3.14Å; P195-M199 PolarHBondContact O-N 3.47Å
196Y81.9Confident86.7Confident166 Ų16663.2 Ų63.265%0.65133%0.325SS*.Hα-helixtrans-65.5-44.4179.3-179.9-102.9000112N194 A198 M199 K200N194-Y196 VanDerWaalsContact C-N 3.27Å; N194-Y196 PolarHBondContact O-N 2.87Å; N194-Y196 VanDerWaalsContact O-N 3.15Å; N194-Y196 WeakPolarHBondContact OD1-CB 3.37Å; N194-Y196 PolarHBondContact OD1-N 3.48Å; Y196-A198 VanDerWaalsContact C-N 3.35Å; Y196-M199 PolarHBondContact O-N 3.23Å; Y196-K200 HydrophobicContact CD1-CD 4.48Å; Y196-K200 HydrophobicContact CE1-CD 3.8Å; Y196-K200 HydrophobicContact CE1-CG 4.39Å; Y196-K200 PolarHBondContact O-N 2.96Å; Y196-K200 VanDerWaalsContact O-N 3.12Å
197K84.2Confident86.5Confident84 Ų8466.2 Ų66.237%0.36533%0.334SS..Hα-helixtrans-67.1-36.9175-179.5176.4174.9-171.90111.5V193 N194 K200 L201V193-K197 HydrophobicContact CG1-CB 3.68Å; V193-K197 HydrophobicContact CG1-CD 3.95Å; V193-K197 HydrophobicContact CG1-CG 3.7Å; N194-K197 PolarHBondContact O-N 3.29Å; N194-K197 VanDerWaalsContact O-N 3.1Å; N194-K197 PolarHBondContact OD1-N 3.48Å; K197-K200 PolarHBondContact O-N 3.5Å; K197-L201 HydrophobicContact CG-CD1 4.42Å; K197-L201 WeakPolarHBondContact O-CG 3.45Å; K197-L201 PolarHBondContact O-N 3.4Å; K197-L201 VanDerWaalsContact O-N 3.09Å
198A83.2Confident86.6Confident3 Ų369.5 Ų69.53%0.02535%0.347CS..Hα-helixtrans-60.7-45.2174.500000111.2V193 N194 P195 Y196 K200 L201 Q202V193-A198 HydrophobicContact CG1-CB 4.07Å; N194-A198 PolarHBondContact O-N 2.91Å; P195-A198 PolarHBondContact O-N 3.14Å; Y196-A198 VanDerWaalsContact C-N 3.35Å; A198-K200 PolarHBondContact O-N 2.91Å; A198-L201 WeakPolarHBondContact O-CB 3.48Å; A198-L201 PolarHBondContact O-N 3.05Å; A198-Q202 WeakPolarHBondContact O-CG 3.24Å; A198-Q202 PolarHBondContact O-N 3.32Å
199M84.2Confident86.7Confident72 Ų7267.6 Ų67.636%0.35534%0.339SS..Hα-helixtrans-61-44.5177.3-170.264.875.800112.4P195 Y196 L201 Q202 E203 F293P195-M199 PolarHBondContact O-N 3.47Å; Y196-M199 PolarHBondContact O-N 3.23Å; M199-L201 VanDerWaalsContact C-N 3.29Å; M199-L201 PolarHBondContact O-N 3.39Å; M199-Q202 WeakPolarHBondContact O-CB 3.46Å; M199-Q202 PolarHBondContact O-N 2.9Å; M199-Q202 VanDerWaalsContact O-N 3.12Å; M199-E203 PolarHBondContact O-N 3.42Å; M199-F293 HydrophobicContact CG-CE1 4.49Å; M199-F293 HydrophobicContact SD-CE1 3.78Å; M199-F293 HydrophobicContact SD-CZ 3.77Å
200K87.9Confident86.9Confident103 Ų10361.3 Ų61.345%0.44831%0.311SS..Hα-helixtrans-61.2-37.4175.3-70.8-166.6-59.7177.90113Y196 K197 A198 Q202 A204Y196-K200 HydrophobicContact CD1-CD 4.48Å; Y196-K200 HydrophobicContact CE1-CD 3.8Å; Y196-K200 HydrophobicContact CE1-CG 4.39Å; Y196-K200 PolarHBondContact O-N 2.96Å; Y196-K200 VanDerWaalsContact O-N 3.12Å; K197-K200 PolarHBondContact O-N 3.5Å; A198-K200 PolarHBondContact O-N 2.91Å; K200-Q202 VanDerWaalsContact C-N 3.35Å; K200-A204 WeakPolarHBondContact O-CB 3.37Å; K200-A204 PolarHBondContact O-N 2.95Å
201L88.4Confident87.2Confident39 Ų3958.2 Ų58.220%0.20431%0.306CS..Hα-helixtrans-67.9-37.3175.4-72.3170.6000111.3F45 I49 K197 A198 M199 T205F45-L201 HydrophobicContact CD2-CB 4.03Å; F45-L201 HydrophobicContact CE2-CB 3.71Å; I49-L201 HydrophobicContact CG2-CD1 3.91Å; K197-L201 HydrophobicContact CG-CD1 4.42Å; K197-L201 WeakPolarHBondContact O-CG 3.45Å; K197-L201 PolarHBondContact O-N 3.4Å; K197-L201 VanDerWaalsContact O-N 3.09Å; A198-L201 WeakPolarHBondContact O-CB 3.48Å; A198-L201 PolarHBondContact O-N 3.05Å; M199-L201 VanDerWaalsContact C-N 3.29Å; M199-L201 PolarHBondContact O-N 3.39Å; L201-T205 WeakPolarHBondContact O-CB 3.45Å; L201-T205 PolarHBondContact O-N 3.46Å; L201-T205 PolarHBondContact O-OG1 3.09Å
202Q87.1Confident87.6Confident21 Ų2157.9 Ų57.910%0.09830%0.303CS..Hα-helixtrans-65-46.3176-72171-1.100111.4F45 M144 A198 M199 K200 T205 F206 F293F45-Q202 HydrophobicContact CE2-CB 4.45Å; F45-Q202 HydrophobicContact CE2-CG 3.66Å; F45-Q202 HydrophobicContact CZ-CG 3.67Å; M144-Q202 HydrophobicContact CB-CG 4.26Å; M144-Q202 PolarHBondContact O-NE2 3.14Å; A198-Q202 WeakPolarHBondContact O-CG 3.24Å; A198-Q202 PolarHBondContact O-N 3.32Å; M199-Q202 WeakPolarHBondContact O-CB 3.46Å; M199-Q202 PolarHBondContact O-N 2.9Å; M199-Q202 VanDerWaalsContact O-N 3.12Å; K200-Q202 VanDerWaalsContact C-N 3.35Å; Q202-T205 PolarHBondContact O-N 3.43Å; Q202-F206 VanDerWaalsContact O-CB 3.29Å; Q202-F206 WeakPolarHBondContact O-CB 3.07Å; Q202-F206 PolarHBondContact O-N 3.27Å; Q202-F293 HydrophobicContact CB-CE2 4.28Å; Q202-F293 HydrophobicContact CB-CZ 4.09Å
203E89.3Confident88.1Confident73 Ų7356.1 Ų56.134%0.34129%0.292SS..Hα-helixtrans-60-49.8175.9-179-176.4-152.200111.7M199 T205 F206 H207 F293M199-E203 PolarHBondContact O-N 3.42Å; E203-T205 VanDerWaalsContact C-N 3.3Å; E203-T205 PolarHBondContact O-N 3Å; E203-F206 WeakPolarHBondContact O-CB 3.48Å; E203-F206 PolarHBondContact O-N 3.26Å; E203-H207 PolarHBondContact O-CD2 2.72Å; E203-H207 PolarHBondContact O-N 3.38Å; E203-F293 HydrophobicContact CB-CD1 3.95Å; E203-F293 HydrophobicContact CB-CD2 4.47Å; E203-F293 HydrophobicContact CB-CE1 4.01Å; E203-F293 HydrophobicContact CB-CG 4.18Å; E203-F293 HydrophobicContact CB-CZ 4.29Å; E203-F293 HydrophobicContact CG-CB 4.35Å; E203-F293 HydrophobicContact CG-CD1 4.02Å; E203-F293 HydrophobicContact CG-CG 4.12Å
204A91Very high88.7Confident59 Ų5963.6 Ų63.649%0.48832%0.317SS..Hα-helixtrans-60.6-40.7178.200000112.1K200 H207 K208K200-A204 WeakPolarHBondContact O-CB 3.37Å; K200-A204 PolarHBondContact O-N 2.95Å; A204-H207 PolarHBondContact O-N 2.7Å; A204-K208 PolarHBondContact O-N 3.15Å
205T91.4Very high89.3Confident16 Ų1661.8 Ų61.810%0.09832%0.315CS..Hα-helixtrans-71.6-36.6178.3-50.10000111.3A41 F45 M144 L201 Q202 E203 H207 K208 L209A41-T205 HydrophobicContact CB-CG2 4.43Å; F45-T205 HydrophobicContact CB-CG2 4.17Å; F45-T205 WeakPolarHBondContact CD2-OG1 3.44Å; M144-T205 HydrophobicContact CE-CG2 4.26Å; M144-T205 WeakPolarHBondContact SD-CB 3.5Å; M144-T205 HydrophobicContact SD-CG2 3.26Å; M144-T205 WeakPolarHBondContact SD-CG2 3.49Å; L201-T205 WeakPolarHBondContact O-CB 3.45Å; L201-T205 PolarHBondContact O-N 3.46Å; L201-T205 PolarHBondContact O-OG1 3.09Å; Q202-T205 PolarHBondContact O-N 3.43Å; E203-T205 VanDerWaalsContact C-N 3.3Å; E203-T205 PolarHBondContact O-N 3Å; T205-H207 PolarHBondContact O-N 3.41Å; T205-K208 WeakPolarHBondContact O-CA 3.43Å; T205-K208 WeakPolarHBondContact O-CB 3.36Å; T205-K208 PolarHBondContact O-N 2.83Å; T205-K208 VanDerWaalsContact O-N 3.12Å; T205-L209 WeakPolarHBondContact O-CG 3.17Å; T205-L209 PolarHBondContact O-N 3.18Å
206F91.5Very high89.9Confident2 Ų256.6 Ų56.61%0.00928%0.281CS..Hα-helixtrans-56-48.5172.6170.1-94.6000111.6V137 V141 Q202 E203 K208 L209 C210 L288 G292 F293 A301V137-F206 HydrophobicContact CG1-CD2 4.11Å; V137-F206 HydrophobicContact CG1-CE2 4.02Å; V141-F206 HydrophobicContact CG2-CD2 3.72Å; V141-F206 HydrophobicContact CG2-CE2 4.4Å; Q202-F206 VanDerWaalsContact O-CB 3.29Å; Q202-F206 WeakPolarHBondContact O-CB 3.07Å; Q202-F206 PolarHBondContact O-N 3.27Å; E203-F206 WeakPolarHBondContact O-CB 3.48Å; E203-F206 PolarHBondContact O-N 3.26Å; F206-K208 VanDerWaalsContact C-N 3.27Å; F206-K208 PolarHBondContact O-N 3.5Å; F206-L209 WeakPolarHBondContact O-CB 3.36Å; F206-L209 PolarHBondContact O-N 3.19Å; F206-L209 VanDerWaalsContact O-N 3.13Å; F206-C210 PolarHBondContact O-N 3.44Å; F206-L288 HydrophobicContact CE2-CD2 3.8Å; F206-L288 HydrophobicContact CE2-CG 3.88Å; F206-L288 HydrophobicContact CZ-CG 4.41Å; F206-G292 VanDerWaalsContact CE1-C 3.49Å; F206-G292 VanDerWaalsContact CZ-C 3.5Å; F206-G292 WeakPolarHBondContact CZ-O 3.32Å; F206-F293 HydrophobicContact CB-CD2 3.64Å; F206-F293 HydrophobicContact CB-CE2 4.15Å; F206-F293 HydrophobicContact CD1-CB 3.71Å; F206-F293 AromaticContact CD1-CD2 3.92Å; F206-F293 HydrophobicContact CD1-CD2 3.92Å; F206-F293 HydrophobicContact CD1-CG 4.29Å; F206-F293 HydrophobicContact CD2-CD2 4.13Å; F206-F293 HydrophobicContact CE1-CB 3.91Å; F206-F293 HydrophobicContact CG-CB 4.31Å; F206-F293 AromaticContact CG-CD2 3.63Å; F206-F293 HydrophobicContact CG-CD2 3.63Å; F206-F293 HydrophobicContact CG-CG 4.44Å; F206-A301 HydrophobicContact CD2-CB 4.47Å; F206-A301 HydrophobicContact CE2-CB 4.04Å
207H92.2Very high90.2Very high96 Ų9650.6 Ų50.644%0.44426%0.26SS..Hα-helixtrans-61.8-35.3176.4-70-56.4000112.9E203 A204 T205 C210 S211E203-H207 PolarHBondContact O-CD2 2.72Å; E203-H207 PolarHBondContact O-N 3.38Å; A204-H207 PolarHBondContact O-N 2.7Å; T205-H207 PolarHBondContact O-N 3.41Å; H207-C210 PolarHBondContact O-N 3.47Å; H207-S211 WeakPolarHBondContact O-CB 2.83Å; H207-S211 PolarHBondContact O-N 3.36Å; H207-S211 PolarHBondContact O-OG 3.11Å
208K94.2Very high90.3Very high74 Ų7452.6 Ų52.632%0.32227%0.273SS..Hα-helixtrans-64.5-45.8173-176.3173175.8168.50111.5A41 E44 A204 T205 F206 C210 S211 I212A41-K208 HydrophobicContact CB-CD 4.22Å; E44-K208 IonicContact OE1-NZ 2.75Å; E44-K208 PolarHBondContact OE1-NZ 3.34Å; E44-K208 IonicContact OE2-NZ 3.29Å; E44-K208 PolarHBondContact OE2-NZ 2.95Å; A204-K208 PolarHBondContact O-N 3.15Å; T205-K208 WeakPolarHBondContact O-CA 3.43Å; T205-K208 WeakPolarHBondContact O-CB 3.36Å; T205-K208 PolarHBondContact O-N 2.83Å; T205-K208 VanDerWaalsContact O-N 3.12Å; F206-K208 VanDerWaalsContact C-N 3.27Å; F206-K208 PolarHBondContact O-N 3.5Å; K208-C210 VanDerWaalsContact C-N 3.32Å; K208-C210 PolarHBondContact O-N 3.4Å; K208-S211 WeakPolarHBondContact O-CB 3.32Å; K208-S211 PolarHBondContact O-N 3.13Å; K208-I212 HydrophobicContact CG-CD1 3.98Å; K208-I212 WeakPolarHBondContact O-CG1 3.43Å; K208-I212 PolarHBondContact O-N 3.21Å
209L93.6Very high90.3Very high0 Ų055.7 Ų55.70%029%0.292CS..Hα-helixtrans-59-43.9176-65.2173.8000111.2F38 A41 V137 F140 V141 M144 T205 F206 S211 I212 D213F38-L209 HydrophobicContact CB-CD2 4.02Å; F38-L209 HydrophobicContact CD1-CB 4.46Å; F38-L209 HydrophobicContact CD1-CD2 3.35Å; F38-L209 HydrophobicContact CD1-CG 4.49Å; F38-L209 HydrophobicContact CD2-CD2 4.4Å; F38-L209 HydrophobicContact CE1-CB 4.03Å; F38-L209 HydrophobicContact CE1-CD2 3.8Å; F38-L209 WeakPolarHBondContact CE1-O 3.28Å; F38-L209 HydrophobicContact CG-CD2 3.68Å; F38-L209 HydrophobicContact CZ-CB 4.4Å; F38-L209 HydrophobicContact CZ-CD2 4.48Å; A41-L209 HydrophobicContact CB-CD2 3.88Å; V137-L209 HydrophobicContact CG1-CB 4.12Å; V137-L209 HydrophobicContact CG1-CD1 4.36Å; F140-L209 HydrophobicContact CB-CD1 3.75Å; F140-L209 HydrophobicContact CB-CD2 4.39Å; V141-L209 HydrophobicContact CG2-CD1 4.46Å; M144-L209 HydrophobicContact CE-CD1 3.55Å; M144-L209 HydrophobicContact SD-CD1 4.43Å; T205-L209 WeakPolarHBondContact O-CG 3.17Å; T205-L209 PolarHBondContact O-N 3.18Å; F206-L209 WeakPolarHBondContact O-CB 3.36Å; F206-L209 PolarHBondContact O-N 3.19Å; F206-L209 VanDerWaalsContact O-N 3.13Å; L209-S211 VanDerWaalsContact C-N 3.33Å; L209-S211 PolarHBondContact O-N 3Å; L209-I212 WeakPolarHBondContact O-CB 3.26Å; L209-I212 PolarHBondContact O-N 3.21Å; L209-D213 WeakPolarHBondContact O-CB 3.42Å; L209-D213 PolarHBondContact O-N 2.75Å
210C93.4Very high90.4Very high19 Ų1952.3 Ų52.313%0.12828%0.275CS..Hα-helixtrans-66-34.5176.8-70.10000113.8F206 H207 K208 D213 R214 C289F206-C210 PolarHBondContact O-N 3.44Å; H207-C210 PolarHBondContact O-N 3.47Å; K208-C210 VanDerWaalsContact C-N 3.32Å; K208-C210 PolarHBondContact O-N 3.4Å; C210-D213 PolarHBondContact O-N 3.27Å; C210-R214 WeakPolarHBondContact O-CB 3.29Å; C210-R214 PolarHBondContact O-N 3.17Å; C210-C289 WeakPolarHBondContact CA-SG 3.24Å; C210-C289 HydrophobicContact CB-CB 3.64Å; C210-C289 WeakPolarHBondContact CB-SG 3.26Å; C210-C289 WeakPolarHBondContact SG-CA 3.49Å; C210-C289 WeakPolarHBondContact SG-CB 3.22Å; C210-C289 CovalentContact SG-SG 2.04Å; C210-C289 PolarHBondContact SG-SG 3.4Å
211S94.2Very high90.1Very high79 Ų7948.8 Ų48.855%0.55227%0.268SS*.Hα-helixtrans-66.8-40.5174-58.30000111.4H207 K208 L209 A215H207-S211 WeakPolarHBondContact O-CB 2.83Å; H207-S211 PolarHBondContact O-N 3.36Å; H207-S211 PolarHBondContact O-OG 3.11Å; K208-S211 WeakPolarHBondContact O-CB 3.32Å; K208-S211 PolarHBondContact O-N 3.13Å; L209-S211 VanDerWaalsContact C-N 3.33Å; L209-S211 PolarHBondContact O-N 3Å; S211-A215 WeakPolarHBondContact O-CB 3.28Å; S211-A215 PolarHBondContact O-N 3.13Å
212I94.1Very high89.6Confident20 Ų2055.6 Ų55.610%0.10330%0.299CS..Hα-helixtrans-63.8-47.3173.9-70.8160.5000110.5N37 F38 A41 K208 L209 R214 A215 C216N37-I212 HydrophobicContact CB-CB 4.39Å; N37-I212 HydrophobicContact CB-CD1 4.02Å; N37-I212 HydrophobicContact CB-CG1 4.14Å; N37-I212 HydrophobicContact CB-CG2 3.35Å; F38-I212 HydrophobicContact CD1-CB 4.17Å; F38-I212 HydrophobicContact CD1-CD1 4.28Å; F38-I212 HydrophobicContact CD1-CG2 3.63Å; F38-I212 HydrophobicContact CE1-CB 3.82Å; F38-I212 HydrophobicContact CE1-CG2 3.48Å; F38-I212 VanDerWaalsContact CE1-CG2 3.48Å; A41-I212 HydrophobicContact CB-CD1 4.16Å; K208-I212 HydrophobicContact CG-CD1 3.98Å; K208-I212 WeakPolarHBondContact O-CG1 3.43Å; K208-I212 PolarHBondContact O-N 3.21Å; L209-I212 WeakPolarHBondContact O-CB 3.26Å; L209-I212 PolarHBondContact O-N 3.21Å; I212-R214 VanDerWaalsContact C-N 3.34Å; I212-R214 PolarHBondContact O-N 2.78Å; I212-A215 WeakPolarHBondContact O-CB 3.47Å; I212-A215 PolarHBondContact O-N 3.22Å; I212-A215 VanDerWaalsContact O-N 3.09Å; I212-C216 PolarHBondContact O-N 3.42Å; I212-C216 PolarHBondContact O-SG 3.34Å; I212-C216 VanDerWaalsContact O-SG 3.39Å
213D91.5Very high89.3Confident23 Ų2362 Ų6212%0.12333%0.334CS..Hα-helixtrans-55.4-50.5179.9-174.491.4000111Y30 L34 F38 V137 L209 C210 A215 C216 L217Y30-D213 PolarHBondContact OH-OD1 3.05Å; Y30-D213 VanDerWaalsContact OH-OD1 3.05Å; L34-D213 HydrophobicContact CD2-CB 4.29Å; F38-D213 HydrophobicContact CZ-CB 4.23Å; V137-D213 HydrophobicContact CG2-CB 4.22Å; L209-D213 WeakPolarHBondContact O-CB 3.42Å; L209-D213 PolarHBondContact O-N 2.75Å; C210-D213 PolarHBondContact O-N 3.27Å; D213-A215 VanDerWaalsContact C-N 3.35Å; D213-A215 PolarHBondContact O-N 2.71Å; D213-C216 PolarHBondContact O-N 3.43Å; D213-L217 WeakPolarHBondContact O-CB 3.19Å; D213-L217 WeakPolarHBondContact O-CG 3.25Å; D213-L217 PolarHBondContact O-N 2.85Å; D213-L217 WeakPolarHBondContact OD2-CD1 3.28Å
214R90.2Very high89.2Confident185 Ų18558.6 Ų58.670%0.69832%0.318SS*.Hα-helixtrans-58.6-43.7174.6-174.3177.6-179.2173.41.7112.6C210 I212 L217 I218C210-R214 WeakPolarHBondContact O-CB 3.29Å; C210-R214 PolarHBondContact O-N 3.17Å; I212-R214 VanDerWaalsContact C-N 3.34Å; I212-R214 PolarHBondContact O-N 2.78Å; R214-L217 PolarHBondContact O-N 3.36Å; R214-I218 WeakPolarHBondContact O-CG1 3.43Å; R214-I218 PolarHBondContact O-N 2.99Å; R214-I218 VanDerWaalsContact O-N 3.13Å
215A92.5Very high88.7Confident53 Ų5357.9 Ų57.944%0.43831%0.309SS..Hα-helixtrans-64.1-41.9178.500000112S211 I212 D213 I218S211-A215 WeakPolarHBondContact O-CB 3.28Å; S211-A215 PolarHBondContact O-N 3.13Å; I212-A215 WeakPolarHBondContact O-CB 3.47Å; I212-A215 PolarHBondContact O-N 3.22Å; I212-A215 VanDerWaalsContact O-N 3.09Å; D213-A215 VanDerWaalsContact C-N 3.35Å; D213-A215 PolarHBondContact O-N 2.71Å; A215-I218 PolarHBondContact O-N 3.31Å
216C91.5Very high88.3Confident1 Ų163.3 Ų63.31%0.00733%0.334CS..Hα-helixtrans-68.1-38.7175.3-65.60000111.8Y30 C33 L34 I212 D213 I218 T219 L220Y30-C216 HydrophobicContact CD2-CB 3.71Å; Y30-C216 HydrophobicContact CE2-CB 3.86Å; C33-C216 HydrophobicContact CB-CB 3.77Å; C33-C216 WeakPolarHBondContact CB-SG 3.25Å; C33-C216 VanDerWaalsContact SG-CA 3.55Å; C33-C216 WeakPolarHBondContact SG-CB 3.33Å; C33-C216 CovalentContact SG-SG 2.05Å; C33-C216 PolarHBondContact SG-SG 3.07Å; L34-C216 HydrophobicContact CD2-CB 3.8Å; L34-C216 HydrophobicContact CG-CB 4.33Å; I212-C216 PolarHBondContact O-N 3.42Å; I212-C216 PolarHBondContact O-SG 3.34Å; I212-C216 VanDerWaalsContact O-SG 3.39Å; D213-C216 PolarHBondContact O-N 3.43Å; C216-I218 VanDerWaalsContact C-N 3.28Å; C216-I218 PolarHBondContact O-N 2.77Å; C216-T219 WeakPolarHBondContact O-CB 3.44Å; C216-T219 PolarHBondContact O-N 3.08Å; C216-T219 PolarHBondContact O-OG1 3.14Å; C216-L220 PolarHBondContact O-N 3.03Å
217L88.6Confident87.9Confident40 Ų4064.1 Ų64.121%0.20934%0.339CS..Hα-helixtrans-59.9-37174.3-78.1173.5000112.3Y30 D213 R214 T219 L220 V228Y30-L217 HydrophobicContact CD2-CD2 4.13Å; Y30-L217 HydrophobicContact CD2-CG 4.41Å; Y30-L217 HydrophobicContact CE2-CB 4.39Å; Y30-L217 HydrophobicContact CE2-CD2 3.52Å; Y30-L217 HydrophobicContact CE2-CG 3.62Å; D213-L217 WeakPolarHBondContact O-CB 3.19Å; D213-L217 WeakPolarHBondContact O-CG 3.25Å; D213-L217 PolarHBondContact O-N 2.85Å; D213-L217 WeakPolarHBondContact OD2-CD1 3.28Å; R214-L217 PolarHBondContact O-N 3.36Å; L217-T219 PolarHBondContact O-N 2.98Å; L217-L220 HydrophobicContact CD2-CD2 4.35Å; L217-L220 VanDerWaalsContact O-CB 3.25Å; L217-L220 WeakPolarHBondContact O-CB 3.47Å; L217-L220 PolarHBondContact O-N 3.19Å; L217-V228 HydrophobicContact CD2-CG2 4.2Å
218I86.7Confident87.5Confident127 Ų12759.7 Ų59.765%0.65132%0.319SS*.Hα-helixtrans-58.9-34.4175.7-69.8165.1000111.1R214 A215 C216 L220 G221R214-I218 WeakPolarHBondContact O-CG1 3.43Å; R214-I218 PolarHBondContact O-N 2.99Å; R214-I218 VanDerWaalsContact O-N 3.13Å; A215-I218 PolarHBondContact O-N 3.31Å; C216-I218 VanDerWaalsContact C-N 3.28Å; C216-I218 PolarHBondContact O-N 2.77Å; I218-L220 VanDerWaalsContact C-N 3.3Å; I218-L220 PolarHBondContact O-N 2.83Å; I218-G221 PolarHBondContact O-N 3.47Å
219T84Confident86.9Confident68 Ų6861.3 Ų61.342%0.41732%0.323SS..Hα-helixtrans-70.2-23.8178.273.10000114.2C216 L217 G221C216-T219 WeakPolarHBondContact O-CB 3.44Å; C216-T219 PolarHBondContact O-N 3.08Å; C216-T219 PolarHBondContact O-OG1 3.14Å; L217-T219 PolarHBondContact O-N 2.98Å; T219-G221 VanDerWaalsContact C-N 3.3Å
220L85.4Confident86.5Confident1 Ų163.6 Ų63.61%0.00534%0.337CS..Hα-helixtrans-69.8-33.3174.8-176.760.8000110.8R26 L27 C216 L217 I218 C224 V228R26-L220 VanDerWaalsContact C-CD1 3.44Å; R26-L220 HydrophobicContact CB-CD1 3.54Å; L27-L220 HydrophobicContact CB-CD1 4.31Å; C216-L220 PolarHBondContact O-N 3.03Å; L217-L220 HydrophobicContact CD2-CD2 4.35Å; L217-L220 VanDerWaalsContact O-CB 3.25Å; L217-L220 WeakPolarHBondContact O-CB 3.47Å; L217-L220 PolarHBondContact O-N 3.19Å; I218-L220 VanDerWaalsContact C-N 3.3Å; I218-L220 PolarHBondContact O-N 2.83Å; L220-C224 HydrophobicContact CD1-CB 3.73Å; L220-C224 WeakPolarHBondContact CD2-O 3.15Å; L220-C224 HydrophobicContact CG-CB 3.72Å; L220-C224 WeakPolarHBondContact O-CB 3.49Å; L220-V228 HydrophobicContact CD2-CG2 3.28Å
221G81.7Confident86.2Confident29 Ų2962.8 Ų62.830%0.29933%0.331SS..  trans85.4153-177.700000113I218 T219 N223 C224 S225I218-G221 PolarHBondContact O-N 3.47Å; T219-G221 VanDerWaalsContact C-N 3.3Å; G221-N223 VanDerWaalsContact C-N 3.27Å; G221-N223 PolarHBondContact O-N 3Å; G221-C224 PolarHBondContact O-N 3.05Å; G221-C224 VanDerWaalsContact O-N 3.09Å; G221-S225 PolarHBondContact O-N 3.49Å; G221-S225 PolarHBondContact O-OG 3.3Å; G221-S225 VanDerWaalsContact O-OG 3.11Å
222E77.4Confident85.6Confident182 Ų18261 Ų6185%0.8532%0.315SS*.G310 helixtrans-57.7-39.6-174.7-65.2-178.2166.400112.2C224 S225E222-C224 PolarHBondContact O-N 3.31Å; E222-S225 PolarHBondContact O-N 2.82Å
223N81.7Confident85.3Confident155 Ų15565.6 Ų65.683%0.82934%0.336SS*.G310 helixtrans-68.3-16.6-179-65.3-18.4000114.6G221G221-N223 VanDerWaalsContact C-N 3.27Å; G221-N223 PolarHBondContact O-N 3Å
224C86.7Confident85.2Confident1 Ų166.6 Ų66.61%0.00734%0.34CS..G310 helixtrans-113.30.1-177-61.10000112.8C23 L220 G221 E222 E226 T227C23-C224 WeakPolarHBondContact CA-SG 3.31Å; C23-C224 HydrophobicContact CB-CB 3.56Å; C23-C224 WeakPolarHBondContact CB-SG 3.44Å; C23-C224 WeakPolarHBondContact SG-CA 3.05Å; C23-C224 WeakPolarHBondContact SG-CB 3.43Å; C23-C224 CovalentContact SG-SG 2.05Å; C23-C224 PolarHBondContact SG-SG 2.9Å; L220-C224 HydrophobicContact CD1-CB 3.73Å; L220-C224 WeakPolarHBondContact CD2-O 3.15Å; L220-C224 HydrophobicContact CG-CB 3.72Å; L220-C224 WeakPolarHBondContact O-CB 3.49Å; G221-C224 PolarHBondContact O-N 3.05Å; G221-C224 VanDerWaalsContact O-N 3.09Å; E222-C224 PolarHBondContact O-N 3.31Å; C224-E226 VanDerWaalsContact C-N 3.26Å; C224-E226 PolarHBondContact O-N 3.37Å; C224-T227 WeakPolarHBondContact O-CB 3.25Å; C224-T227 PolarHBondContact O-N 3.13Å; C224-T227 PolarHBondContact O-OG1 2.81Å
225S80.8Confident85.1Confident44 Ų4458.5 Ų58.531%0.30831%0.313SS..Hα-helixtrans-62.1-35.2-177.3-65.70000112.4G221 E222 T227 V228G221-S225 PolarHBondContact O-N 3.49Å; G221-S225 PolarHBondContact O-OG 3.3Å; G221-S225 VanDerWaalsContact O-OG 3.11Å; E222-S225 PolarHBondContact O-N 2.82Å; S225-T227 VanDerWaalsContact C-N 3.29Å; S225-T227 PolarHBondContact O-N 3.45Å; S225-V228 PolarHBondContact O-N 3.5Å
226E82.4Confident85Confident130 Ų13056.8 Ų56.861%0.60730%0.297SS*.Hα-helixtrans-68.9-28.6176.7-171.1157.7-149.900112.5C224 V228 R229 T230C224-E226 VanDerWaalsContact C-N 3.26Å; C224-E226 PolarHBondContact O-N 3.37Å; E226-V228 PolarHBondContact O-N 3.19Å; E226-R229 WeakPolarHBondContact O-CB 3.46Å; E226-R229 PolarHBondContact O-N 3.39Å; E226-T230 PolarHBondContact O-N 3.37Å; E226-T230 PolarHBondContact O-OG1 2.74Å
227T84.2Confident85.1Confident19 Ų1960.9 Ų60.912%0.11732%0.317CS..Hα-helixtrans-58.6-31.9178.8-490000112.4C23 F24 L27 C224 S225 T230 V231C23-T227 HydrophobicContact CB-CG2 4.06Å; C23-T227 WeakPolarHBondContact CB-OG1 3.05Å; F24-T227 HydrophobicContact CD1-CG2 3.69Å; F24-T227 HydrophobicContact CE1-CG2 3.39Å; F24-T227 HydrophobicContact CZ-CG2 4.17Å; L27-T227 HydrophobicContact CD2-CG2 4.34Å; C224-T227 WeakPolarHBondContact O-CB 3.25Å; C224-T227 PolarHBondContact O-N 3.13Å; C224-T227 PolarHBondContact O-OG1 2.81Å; S225-T227 VanDerWaalsContact C-N 3.29Å; S225-T227 PolarHBondContact O-N 3.45Å; T227-T230 PolarHBondContact O-N 3.32Å; T227-V231 HydrophobicContact CG2-CG2 4.27Å; T227-V231 WeakPolarHBondContact O-CB 3.46Å; T227-V231 WeakPolarHBondContact O-CG2 3.16Å; T227-V231 PolarHBondContact O-N 2.87Å
228V82.6Confident85.3Confident3 Ų359 Ų592%0.01831%0.307CS..Hα-helixtrans-59.3-51.3173.9-172.40000110.1L27 Y30 L217 L220 S225 E226 V231 L232 Y286L27-V228 HydrophobicContact CD1-CB 4.28Å; L27-V228 HydrophobicContact CD1-CG1 4.47Å; L27-V228 HydrophobicContact CD1-CG2 3.73Å; Y30-V228 HydrophobicContact CE1-CG1 4.29Å; Y30-V228 HydrophobicContact CE1-CG2 4.41Å; L217-V228 HydrophobicContact CD2-CG2 4.2Å; L220-V228 HydrophobicContact CD2-CG2 3.28Å; S225-V228 PolarHBondContact O-N 3.5Å; E226-V228 PolarHBondContact O-N 3.19Å; V228-V231 PolarHBondContact O-N 3.04Å; V228-L232 HydrophobicContact CG1-CD1 4.04Å; V228-L232 VanDerWaalsContact O-CG 3.23Å; V228-L232 WeakPolarHBondContact O-CG 3.33Å; V228-L232 PolarHBondContact O-N 3.36Å; V228-Y286 HydrophobicContact CB-CE2 4.06Å; V228-Y286 HydrophobicContact CG1-CD2 4.02Å; V228-Y286 HydrophobicContact CG1-CE2 3.62Å
229R81.5Confident85.5Confident108 Ų10853.2 Ų53.241%0.40828%0.278SS..Hα-helixtrans-63.7-44.7-178.7-173.1-174.5-62.3134.50.1110.8E226 V231 L232 Q233E226-R229 WeakPolarHBondContact O-CB 3.46Å; E226-R229 PolarHBondContact O-N 3.39Å; R229-V231 PolarHBondContact O-N 2.7Å; R229-L232 PolarHBondContact O-N 2.72Å; R229-Q233 HydrophobicContact CG-CG 4.48Å; R229-Q233 WeakPolarHBondContact O-CB 3.32Å; R229-Q233 WeakPolarHBondContact O-CG 3.2Å; R229-Q233 PolarHBondContact O-N 3.45Å
230T85.8Confident85.9Confident49 Ų4953.7 Ų53.730%0.30127%0.273SS..Hα-helixtrans-58.5-48.3179.4-47.40000111.2E226 T227 L232 Q233 Q234E226-T230 PolarHBondContact O-N 3.37Å; E226-T230 PolarHBondContact O-OG1 2.74Å; T227-T230 PolarHBondContact O-N 3.32Å; T230-L232 PolarHBondContact O-N 3.2Å; T230-Q233 PolarHBondContact O-N 2.85Å; T230-Q234 WeakPolarHBondContact O-CB 3Å; T230-Q234 VanDerWaalsContact O-CG 3.28Å; T230-Q234 WeakPolarHBondContact O-CG 3.06Å; T230-Q234 PolarHBondContact O-N 2.87Å; T230-Q234 PolarHBondContact O-OE1 3.12Å
231V86.1Confident86.4Confident2 Ų258 Ų581%0.01229%0.293CS..Hα-helixtrans-65.5-39.4179.7169.60000112.3F24 L27 Y128 T227 V228 R229 Q234 A235F24-V231 HydrophobicContact CD1-CG2 3.99Å; F24-V231 HydrophobicContact CE1-CG2 3.46Å; F24-V231 VanDerWaalsContact CE1-CG2 3.46Å; L27-V231 HydrophobicContact CD2-CB 3.93Å; L27-V231 HydrophobicContact CD2-CG1 4.08Å; L27-V231 HydrophobicContact CD2-CG2 3.6Å; Y128-V231 HydrophobicContact CD1-CG1 4.46Å; Y128-V231 HydrophobicContact CE1-CG1 3.72Å; Y128-V231 HydrophobicContact CE2-CG1 3.97Å; Y128-V231 VanDerWaalsContact CZ-CG1 3.42Å; Y128-V231 WeakPolarHBondContact OH-CG1 3.48Å; T227-V231 HydrophobicContact CG2-CG2 4.27Å; T227-V231 WeakPolarHBondContact O-CB 3.46Å; T227-V231 WeakPolarHBondContact O-CG2 3.16Å; T227-V231 PolarHBondContact O-N 2.87Å; V228-V231 PolarHBondContact O-N 3.04Å; R229-V231 PolarHBondContact O-N 2.7Å; V231-Q234 PolarHBondContact O-N 3.08Å; V231-A235 WeakPolarHBondContact O-CB 3.48Å; V231-A235 PolarHBondContact O-N 3.44Å
232L82.6Confident87Confident40 Ų4058 Ų5821%0.20929%0.285CS..Hα-helixtrans-62.3-44.6175.5-67.8171.8000111.2V228 R229 T230 A235 C236 M282 Y286V228-L232 HydrophobicContact CG1-CD1 4.04Å; V228-L232 VanDerWaalsContact O-CG 3.23Å; V228-L232 WeakPolarHBondContact O-CG 3.33Å; V228-L232 PolarHBondContact O-N 3.36Å; R229-L232 PolarHBondContact O-N 2.72Å; T230-L232 PolarHBondContact O-N 3.2Å; L232-A235 PolarHBondContact O-N 3.1Å; L232-C236 PolarHBondContact O-N 3.12Å; L232-M282 HydrophobicContact CB-CE 4.04Å; L232-M282 HydrophobicContact CD2-CE 3.28Å; L232-M282 HydrophobicContact CG-CE 4.25Å; L232-Y286 HydrophobicContact CD1-CD2 3.86Å; L232-Y286 HydrophobicContact CD1-CG 4.17Å
233Q86.8Confident87.7Confident117 Ų11750.1 Ų50.155%0.54725%0.249SC..Hα-helixtrans-64.9-38.7176.8-72.8173.9-22.300112.2R229 T230 C236 Q237R229-Q233 HydrophobicContact CG-CG 4.48Å; R229-Q233 WeakPolarHBondContact O-CB 3.32Å; R229-Q233 WeakPolarHBondContact O-CG 3.2Å; R229-Q233 PolarHBondContact O-N 3.45Å; T230-Q233 PolarHBondContact O-N 2.85Å; Q233-C236 VanDerWaalsContact O-CB 3.31Å; Q233-C236 WeakPolarHBondContact O-CB 3.43Å; Q233-C236 PolarHBondContact O-N 2.77Å; Q233-Q237 PolarHBondContact O-N 2.97Å
234Q90.1Very high88.3Confident45 Ų4546.9 Ų46.921%0.2123%0.232CC..Hα-helixtrans-74.7-30.3178.8-72.4163.7-36.800112.8L121 H125 T230 V231 C236 Q237 C238L121-Q234 HydrophobicContact CD2-CB 3.92Å; H125-Q234 PolarHBondContact CE1-NE2 3.12Å; H125-Q234 VanDerWaalsContact CE1-NE2 3.34Å; H125-Q234 PolarHBondContact CE1-OE1 3.05Å; H125-Q234 PolarHBondContact NE2-NE2 3.13Å; H125-Q234 PolarHBondContact NE2-OE1 3.34Å; T230-Q234 WeakPolarHBondContact O-CB 3Å; T230-Q234 VanDerWaalsContact O-CG 3.28Å; T230-Q234 WeakPolarHBondContact O-CG 3.06Å; T230-Q234 PolarHBondContact O-N 2.87Å; T230-Q234 PolarHBondContact O-OE1 3.12Å; V231-Q234 PolarHBondContact O-N 3.08Å; Q234-C236 VanDerWaalsContact C-N 3.28Å; Q234-C236 PolarHBondContact O-N 3.13Å; Q234-Q237 PolarHBondContact O-N 3.37Å; Q234-C238 WeakPolarHBondContact O-CB 3.31Å; Q234-C238 PolarHBondContact O-N 3.09Å; Q234-C238 PolarHBondContact O-SG 3.35Å
235A88.1Confident88.6Confident14 Ų1449.4 Ų49.412%0.11624%0.243CC..Hα-helixtrans-63-40.7172.100000110.6L121 V231 L232 C238 G239 M282L121-A235 HydrophobicContact CD1-CB 3.89Å; L121-A235 HydrophobicContact CD2-CB 4.32Å; V231-A235 WeakPolarHBondContact O-CB 3.48Å; V231-A235 PolarHBondContact O-N 3.44Å; L232-A235 PolarHBondContact O-N 3.1Å; A235-C238 PolarHBondContact O-N 3.23Å; A235-G239 PolarHBondContact O-N 3.49Å; A235-M282 HydrophobicContact CB-CE 4.28Å
236C89.3Confident89Confident17 Ų1747.6 Ų47.612%0.11523%0.23CC..Hα-helixtrans-61.7-47.4170.6-78.30000112.7L232 Q233 Q234 C238 G239 Y240 C279L232-C236 PolarHBondContact O-N 3.12Å; Q233-C236 VanDerWaalsContact O-CB 3.31Å; Q233-C236 WeakPolarHBondContact O-CB 3.43Å; Q233-C236 PolarHBondContact O-N 2.77Å; Q234-C236 VanDerWaalsContact C-N 3.28Å; Q234-C236 PolarHBondContact O-N 3.13Å; C236-C238 VanDerWaalsContact C-N 3.28Å; C236-C238 PolarHBondContact O-N 2.95Å; C236-G239 WeakPolarHBondContact O-CA 3.23Å; C236-G239 PolarHBondContact O-N 3.44Å; C236-Y240 VanDerWaalsContact O-CD2 3.24Å; C236-Y240 WeakPolarHBondContact O-CD2 3.28Å; C236-Y240 PolarHBondContact O-N 2.78Å; C236-C279 WeakPolarHBondContact CA-SG 2.94Å; C236-C279 HydrophobicContact CB-CB 3.96Å; C236-C279 WeakPolarHBondContact CB-SG 3.34Å; C236-C279 WeakPolarHBondContact SG-CA 3.17Å; C236-C279 WeakPolarHBondContact SG-CB 3.33Å; C236-C279 CovalentContact SG-SG 2.02Å; C236-C279 PolarHBondContact SG-SG 3.05Å
237Q93.5Very high89.3Confident88 Ų8841.4 Ų41.441%0.41120%0.201SC..Hα-helixtrans-59.3-40.1177.4-17360.524.600112.3Q233 Q234 G239 Y240 E241Q233-Q237 PolarHBondContact O-N 2.97Å; Q234-Q237 PolarHBondContact O-N 3.37Å; Q237-G239 VanDerWaalsContact C-N 3.25Å; Q237-G239 PolarHBondContact O-N 3.44Å; Q237-Y240 PolarHBondContact O-N 2.67Å; Q237-Y240 VanDerWaalsContact O-N 3.15Å; Q237-E241 HydrophobicContact CG-CG 4.25Å; Q237-E241 WeakPolarHBondContact CG-OE1 3.29Å; Q237-E241 PolarHBondContact NE2-OE1 3.08Å; Q237-E241 WeakPolarHBondContact O-CG 3.19Å; Q237-E241 PolarHBondContact O-N 2.92Å
238C93.6Very high89.5Confident0 Ų046.7 Ų46.70%022%0.219CC..Hα-helixtrans-61.3-32.6172.9-74.60000112.7I117 C120 Q234 A235 C236 Y240 E242I117-C238 HydrophobicContact CD1-CB 4.08Å; I117-C238 HydrophobicContact CG2-CB 4.13Å; C120-C238 VanDerWaalsContact C-SG 3.54Å; C120-C238 HydrophobicContact CB-CB 3.62Å; C120-C238 WeakPolarHBondContact CB-SG 3.39Å; C120-C238 WeakPolarHBondContact SG-CA 3.45Å; C120-C238 WeakPolarHBondContact SG-CB 3.32Å; C120-C238 CovalentContact SG-SG 2.04Å; C120-C238 PolarHBondContact SG-SG 3.47Å; Q234-C238 WeakPolarHBondContact O-CB 3.31Å; Q234-C238 PolarHBondContact O-N 3.09Å; Q234-C238 PolarHBondContact O-SG 3.35Å; A235-C238 PolarHBondContact O-N 3.23Å; C236-C238 VanDerWaalsContact C-N 3.28Å; C236-C238 PolarHBondContact O-N 2.95Å; C238-Y240 VanDerWaalsContact C-N 3.32Å; C238-Y240 PolarHBondContact O-N 3.03Å; C238-E242 VanDerWaalsContact O-CB 3.25Å; C238-E242 WeakPolarHBondContact O-CB 3.08Å; C238-E242 VanDerWaalsContact O-CG 3.3Å; C238-E242 WeakPolarHBondContact O-CG 3.45Å; C238-E242 PolarHBondContact O-N 3.47Å
239G90.6Very high89.6Confident5 Ų547.7 Ų47.75%0.05223%0.225CC..Hα-helixtrans-61.2-39.9173.100000112.9I117 A235 C236 Q237I117-G239 VanDerWaalsContact CD1-CA 3.49Å; A235-G239 PolarHBondContact O-N 3.49Å; C236-G239 WeakPolarHBondContact O-CA 3.23Å; C236-G239 PolarHBondContact O-N 3.44Å; Q237-G239 VanDerWaalsContact C-N 3.25Å; Q237-G239 PolarHBondContact O-N 3.44Å
240Y93.7Very high89.7Confident79 Ų7944.1 Ų44.131%0.3121%0.214SC..Hα-helixtrans-76.4-44.4176.3-56.3-61.9000112.7C236 Q237 C238 E242 N243 I272 T275 D276C236-Y240 VanDerWaalsContact O-CD2 3.24Å; C236-Y240 WeakPolarHBondContact O-CD2 3.28Å; C236-Y240 PolarHBondContact O-N 2.78Å; Q237-Y240 PolarHBondContact O-N 2.67Å; Q237-Y240 VanDerWaalsContact O-N 3.15Å; C238-Y240 VanDerWaalsContact C-N 3.32Å; C238-Y240 PolarHBondContact O-N 3.03Å; Y240-E242 VanDerWaalsContact C-N 3.33Å; Y240-E242 PolarHBondContact O-N 3.34Å; Y240-N243 VanDerWaalsContact O-CB 3.3Å; Y240-N243 WeakPolarHBondContact O-CB 3.29Å; Y240-N243 PolarHBondContact O-N 1.99Å; Y240-I272 HydrophobicContact CE1-CG2 4.37Å; Y240-T275 HydrophobicContact CD1-CG2 3.92Å; Y240-T275 HydrophobicContact CD2-CG2 4.45Å; Y240-T275 HydrophobicContact CE1-CG2 3.58Å; Y240-T275 HydrophobicContact CE2-CG2 4.12Å; Y240-T275 HydrophobicContact CG-CG2 4.34Å; Y240-D276 VanDerWaalsContact CE1-OD1 3.28Å; Y240-D276 WeakPolarHBondContact CE1-OD1 3.42Å; Y240-D276 VanDerWaalsContact CZ-OD1 3.29Å; Y240-D276 PolarHBondContact OH-OD1 2.86Å
241E95.2Very high89.7Confident92 Ų9244.3 Ų44.343%0.4321%0.211SC..Hα-helixtrans-64.6-38.1-177.7-73.7174.4-172.200112.2K124 Q237 N243K124-E241 WeakPolarHBondContact CE-OE2 3.48Å; K124-E241 IonicContact NZ-OE1 2.78Å; K124-E241 PolarHBondContact NZ-OE1 3.42Å; K124-E241 IonicContact NZ-OE2 3.45Å; K124-E241 PolarHBondContact NZ-OE2 2.85Å; Q237-E241 HydrophobicContact CG-CG 4.25Å; Q237-E241 WeakPolarHBondContact CG-OE1 3.29Å; Q237-E241 PolarHBondContact NE2-OE1 3.08Å; Q237-E241 WeakPolarHBondContact O-CG 3.19Å; Q237-E241 PolarHBondContact O-N 2.92Å; E241-N243 VanDerWaalsContact C-N 3.35Å
242E94.1Very high89.6Confident29 Ų2949.3 Ų49.314%0.13624%0.235CC..THydrogen-bonded Turntrans-94.210-176.8-56.9-66.1167.500113.2V116 C120 C238 Y240 D244 E245 I246V116-E242 HydrophobicContact CG1-CB 3.4Å; V116-E242 HydrophobicContact CG1-CG 3.7Å; C120-E242 HydrophobicContact CB-CG 3.84Å; C238-E242 VanDerWaalsContact O-CB 3.25Å; C238-E242 WeakPolarHBondContact O-CB 3.08Å; C238-E242 VanDerWaalsContact O-CG 3.3Å; C238-E242 WeakPolarHBondContact O-CG 3.45Å; C238-E242 PolarHBondContact O-N 3.47Å; Y240-E242 VanDerWaalsContact C-N 3.33Å; Y240-E242 PolarHBondContact O-N 3.34Å; E242-D244 PolarHBondContact O-N 3.01Å; E242-E245 PolarHBondContact O-N 3.28Å; E242-I246 HydrophobicContact CB-CD1 4.21Å; E242-I246 HydrophobicContact CB-CG1 4.49Å; E242-I246 WeakPolarHBondContact O-CG1 3.15Å; E242-I246 PolarHBondContact O-N 3.37Å
243N92.7Very high89.6Confident16 Ų1649.8 Ų49.89%0.08623%0.233CC..Hα-helixtrans-53.8-40.4-176.5-174.720.7000112.5Y240 E241 E245 I246 A247 R268 I271 I272Y240-N243 VanDerWaalsContact O-CB 3.3Å; Y240-N243 WeakPolarHBondContact O-CB 3.29Å; Y240-N243 PolarHBondContact O-N 1.99Å; E241-N243 VanDerWaalsContact C-N 3.35Å; N243-E245 PolarHBondContact O-N 2.96Å; N243-I246 PolarHBondContact O-N 3.44Å; N243-A247 WeakPolarHBondContact O-CB 3.15Å; N243-A247 PolarHBondContact O-N 3.08Å; N243-R268 PolarHBondContact ND2-O 3.29Å; N243-I271 VanDerWaalsContact OD1-CB 3.3Å; N243-I271 WeakPolarHBondContact OD1-CB 2.92Å; N243-I271 WeakPolarHBondContact OD1-CG2 3.24Å; N243-I272 WeakPolarHBondContact ND2-CG1 3.45Å
244D93.2Very high89.2Confident87 Ų8745.6 Ų45.647%0.46522%0.215SC..Hα-helixtrans-66-35.4177.9-81.6-32.7000113.9E242 R248 R268E242-D244 PolarHBondContact O-N 3.01Å; D244-R248 WeakPolarHBondContact O-CG 3.49Å; D244-R248 PolarHBondContact O-N 3.3Å; D244-R248 PolarHBondContact O-NE 3.21Å; D244-R268 IonicContact OD1-CZ 3.42Å; D244-R268 IonicContact OD1-NE 2.71Å; D244-R268 PolarHBondContact OD1-NE 2.87Å; D244-R268 IonicContact OD1-NH2 3.43Å; D244-R268 PolarHBondContact OD1-NH2 2.88Å
245E93.3Very high88.9Confident53 Ų5348.1 Ų48.125%0.24823%0.226CC..Hα-helixtrans-72.8-43.8175.7-172.3167.9153.500109.8F112 V116 K119 E242 N243 T249F112-E245 HydrophobicContact CZ-CG 4.19Å; V116-E245 HydrophobicContact CG1-CG 4.47Å; V116-E245 HydrophobicContact CG2-CG 4.26Å; K119-E245 IonicContact NZ-OE1 3.52Å; K119-E245 IonicContact NZ-OE2 3.48Å; E242-E245 PolarHBondContact O-N 3.28Å; N243-E245 PolarHBondContact O-N 2.96Å; E245-T249 PolarHBondContact O-N 3.11Å; E245-T249 PolarHBondContact O-OG1 2.91Å
246I90.2Very high88.6Confident6 Ų654.5 Ų54.53%0.03125%0.254CS..Hα-helixtrans-62.4-46.6177.9-62165.5000111.3T113 V116 I117 E242 N243 T249 L250 I271T113-I246 HydrophobicContact CG2-CD1 4.12Å; T113-I246 HydrophobicContact CG2-CG1 4.36Å; T113-I246 HydrophobicContact CG2-CG2 4.23Å; V116-I246 HydrophobicContact CB-CG1 4.49Å; V116-I246 HydrophobicContact CG1-CG1 4.1Å; I117-I246 HydrophobicContact CD1-CD1 4.09Å; E242-I246 HydrophobicContact CB-CD1 4.21Å; E242-I246 HydrophobicContact CB-CG1 4.49Å; E242-I246 WeakPolarHBondContact O-CG1 3.15Å; E242-I246 PolarHBondContact O-N 3.37Å; N243-I246 PolarHBondContact O-N 3.44Å; I246-T249 PolarHBondContact O-N 2.98Å; I246-L250 HydrophobicContact CG2-CD1 3.84Å; I246-L250 HydrophobicContact CG2-CG 4.4Å; I246-L250 WeakPolarHBondContact O-CB 3.24Å; I246-L250 WeakPolarHBondContact O-CG 2.91Å; I246-L250 PolarHBondContact O-N 2.98Å; I246-I271 HydrophobicContact CB-CD1 4.34Å; I246-I271 HydrophobicContact CG2-CD1 3.84Å; I246-I271 HydrophobicContact CG2-CG1 4.26Å; I246-I271 HydrophobicContact CG2-CG2 4.3Å
247A88.7Confident88Confident0 Ų055.4 Ų55.40%026%0.26CS..Hα-helixtrans-63.1-45.6-177.600000112.6N243 L250 E251 L267 R268 I271N243-A247 WeakPolarHBondContact O-CB 3.15Å; N243-A247 PolarHBondContact O-N 3.08Å; A247-L250 PolarHBondContact O-N 3.34Å; A247-E251 PolarHBondContact O-N 3.17Å; A247-L267 HydrophobicContact CB-CB 4.19Å; A247-R268 HydrophobicContact CB-CG 3.64Å; A247-I271 VanDerWaalsContact CA-CD1 3.48Å; A247-I271 HydrophobicContact CB-CD1 3.62Å
248R88.2Confident87.1Confident131 Ų13153.9 Ų53.949%0.49425%0.251SS..Hα-helixtrans-63.6-43.4179.2-74.7-177.2-65.7153.70.7112.1D244 L250 E251 E252D244-R248 WeakPolarHBondContact O-CG 3.49Å; D244-R248 PolarHBondContact O-N 3.3Å; D244-R248 PolarHBondContact O-NE 3.21Å; R248-L250 VanDerWaalsContact C-N 3.33Å; R248-L250 PolarHBondContact O-N 3.01Å; R248-E251 WeakPolarHBondContact O-CB 3.38Å; R248-E251 PolarHBondContact O-N 3.35Å; R248-E252 WeakPolarHBondContact O-CG 3.42Å; R248-E252 PolarHBondContact O-N 2.99Å
249T85.2Confident86.3Confident24 Ų2460.6 Ų60.615%0.14729%0.287CS..Hα-helixtrans-70.1-32.4177.9-59.30000112.2F112 E245 I246 R253F112-T249 HydrophobicContact CD1-CG2 3.47Å; F112-T249 VanDerWaalsContact CD1-CG2 3.47Å; F112-T249 HydrophobicContact CD2-CG2 4.04Å; F112-T249 HydrophobicContact CE1-CG2 3.43Å; F112-T249 VanDerWaalsContact CE1-CG2 3.43Å; F112-T249 VanDerWaalsContact CE1-OG1 3.32Å; F112-T249 WeakPolarHBondContact CE1-OG1 3.15Å; F112-T249 HydrophobicContact CE2-CG2 3.98Å; F112-T249 HydrophobicContact CG-CG2 3.78Å; F112-T249 HydrophobicContact CZ-CG2 3.69Å; F112-T249 WeakPolarHBondContact CZ-OG1 3.32Å; E245-T249 PolarHBondContact O-N 3.11Å; E245-T249 PolarHBondContact O-OG1 2.91Å; I246-T249 PolarHBondContact O-N 2.98Å; T249-R253 HydrophobicContact CG2-CG 4.37Å; T249-R253 VanDerWaalsContact O-CB 3.31Å; T249-R253 WeakPolarHBondContact O-CB 3.48Å; T249-R253 VanDerWaalsContact O-CG 3.25Å; T249-R253 WeakPolarHBondContact O-CG 3.25Å; T249-R253 PolarHBondContact O-N 3.32Å
250L83.5Confident85.7Confident33 Ų3364 Ų6417%0.17330%0.303CS..Hα-helixtrans-67.7-38.8172.2-76.3174.3000112.1I246 A247 R248 R253 L254 L267 I271I246-L250 HydrophobicContact CG2-CD1 3.84Å; I246-L250 HydrophobicContact CG2-CG 4.4Å; I246-L250 WeakPolarHBondContact O-CB 3.24Å; I246-L250 WeakPolarHBondContact O-CG 2.91Å; I246-L250 PolarHBondContact O-N 2.98Å; A247-L250 PolarHBondContact O-N 3.34Å; R248-L250 VanDerWaalsContact C-N 3.33Å; R248-L250 PolarHBondContact O-N 3.01Å; L250-R253 PolarHBondContact O-N 3.41Å; L250-L254 WeakPolarHBondContact O-CB 3.38Å; L250-L254 WeakPolarHBondContact O-CG 3.46Å; L250-L254 PolarHBondContact O-N 3.45Å; L250-L267 HydrophobicContact CB-CD1 4.36Å; L250-I271 HydrophobicContact CD1-CD1 3.95Å; L250-I271 HydrophobicContact CD1-CG1 4.12Å
251E85.2Confident85Confident53 Ų5365 Ų6525%0.24832%0.318CS..Hα-helixtrans-57.4-54.8173178.4170.7-137.900110.8A247 R248 R253 L254 E255 M262 A264 L267A247-E251 PolarHBondContact O-N 3.17Å; R248-E251 WeakPolarHBondContact O-CB 3.38Å; R248-E251 PolarHBondContact O-N 3.35Å; E251-R253 VanDerWaalsContact C-N 3.28Å; E251-R253 PolarHBondContact O-N 3.37Å; E251-L254 PolarHBondContact O-N 3.38Å; E251-E255 PolarHBondContact O-N 3.18Å; E251-E255 VanDerWaalsContact O-N 3.08Å; E251-M262 WeakPolarHBondContact CG-O 3.36Å; E251-A264 PolarHBondContact OE1-N 2.77Å; E251-A264 WeakPolarHBondContact OE2-CB 3.11Å; E251-L267 HydrophobicContact CB-CD1 3.7Å
252E84.6Confident84.3Confident107 Ų10763.7 Ų63.750%0.531%0.312SS..Hα-helixtrans-57-40.6178-70.6172.4-175.900112.2R248 Q256R248-E252 WeakPolarHBondContact O-CG 3.42Å; R248-E252 PolarHBondContact O-N 2.99Å; E252-Q256 WeakPolarHBondContact O-CB 3.36Å; E252-Q256 WeakPolarHBondContact O-CG 3.26Å; E252-Q256 PolarHBondContact O-N 2.93Å
253R81.5Confident83.7Confident49 Ų4969.9 Ų69.919%0.18534%0.335CS..Hα-helixtrans-74.9-39-179.3-75.9-175.4173.6-89.1-1.1113.1S109 T249 L250 E251 E255 Q256 C257S109-R253 WeakPolarHBondContact OG-CD 3.45Å; T249-R253 HydrophobicContact CG2-CG 4.37Å; T249-R253 VanDerWaalsContact O-CB 3.31Å; T249-R253 WeakPolarHBondContact O-CB 3.48Å; T249-R253 VanDerWaalsContact O-CG 3.25Å; T249-R253 WeakPolarHBondContact O-CG 3.25Å; T249-R253 PolarHBondContact O-N 3.32Å; L250-R253 PolarHBondContact O-N 3.41Å; E251-R253 VanDerWaalsContact C-N 3.28Å; E251-R253 PolarHBondContact O-N 3.37Å; R253-E255 VanDerWaalsContact C-N 3.28Å; R253-E255 PolarHBondContact O-N 3.34Å; R253-Q256 PolarHBondContact O-N 3.27Å; R253-C257 WeakPolarHBondContact O-CB 3.16Å; R253-C257 PolarHBondContact O-N 2.76Å; R253-C257 PolarHBondContact O-SG 2.67Å
254L79.1Confident83.2Confident30 Ų3069.8 Ų69.816%0.15734%0.336CS..Hα-helixtrans-63.8-39176.9-74.5170.9000110.9L250 E251 Y258 D259 I260 M262 L267L250-L254 WeakPolarHBondContact O-CB 3.38Å; L250-L254 WeakPolarHBondContact O-CG 3.46Å; L250-L254 PolarHBondContact O-N 3.45Å; E251-L254 PolarHBondContact O-N 3.38Å; L254-Y258 HydrophobicContact CD2-CD2 3.81Å; L254-Y258 HydrophobicContact CD2-CE2 4.14Å; L254-Y258 WeakPolarHBondContact O-CA 3.47Å; L254-Y258 WeakPolarHBondContact O-CB 3.43Å; L254-Y258 PolarHBondContact O-N 3.47Å; L254-D259 PolarHBondContact O-N 2.05Å; L254-I260 CarbonylContact C-O 3.32Å; L254-I260 VanDerWaalsContact C-O 3.31Å; L254-I260 PolarHBondContact O-N 3.45Å; L254-M262 HydrophobicContact CD1-CB 4.16Å; L254-M262 HydrophobicContact CD1-CG 4.23Å; L254-M262 HydrophobicContact CD1-SD 3.78Å; L254-L267 HydrophobicContact CD1-CD1 4.38Å; L254-L267 HydrophobicContact CD1-CD2 3.82Å
255E82.9Confident83Confident97 Ų9769 Ų6945%0.45333%0.331SS..Hα-helixtrans-64.6-49.8173.3-173.1173.9-158.400110.9E251 R253 C257 D259 I260E251-E255 PolarHBondContact O-N 3.18Å; E251-E255 VanDerWaalsContact O-N 3.08Å; R253-E255 VanDerWaalsContact C-N 3.28Å; R253-E255 PolarHBondContact O-N 3.34Å; E255-C257 PolarHBondContact O-N 3.17Å; E255-D259 WeakPolarHBondContact O-CA 3.22Å; E255-D259 PolarHBondContact O-N 3.31Å; E255-I260 WeakPolarHBondContact CA-O 3.29Å; E255-I260 PolarHBondContact N-O 3.33Å
256Q81.6Confident82.7Confident149 Ų14969.1 Ų69.170%0.69634%0.336SS*.Hα-helixtrans-64.1-36.9-179.3-74.6168.715.900114E252 R253E252-Q256 WeakPolarHBondContact O-CB 3.36Å; E252-Q256 WeakPolarHBondContact O-CG 3.26Å; E252-Q256 PolarHBondContact O-N 2.93Å; R253-Q256 PolarHBondContact O-N 3.27Å
257C77.4Confident82.5Confident36 Ų3669.4 Ų69.424%0.24334%0.337CS..Hα-helixtrans-95.8-27.4-169.5-59.80000113.6C105 R253 E255C105-C257 HydrophobicContact CB-CB 3.49Å; C105-C257 VanDerWaalsContact CB-CB 3.49Å; C105-C257 WeakPolarHBondContact CB-SG 3.2Å; C105-C257 WeakPolarHBondContact SG-CB 3.11Å; C105-C257 CovalentContact SG-SG 1.99Å; C105-C257 PolarHBondContact SG-SG 2.84Å; R253-C257 WeakPolarHBondContact O-CB 3.16Å; R253-C257 PolarHBondContact O-N 2.76Å; R253-C257 PolarHBondContact O-SG 2.67Å; E255-C257 PolarHBondContact O-N 3.17Å
258Y74.8Confident82.5Confident55 Ų5573.1 Ų73.122%0.21635%0.351CS..Hα-helixtrans-129.2-2-173.6-57.1-67.3000113.5I97 G102 M106 L254 I260I97-Y258 HydrophobicContact CD1-CD1 4.14Å; I97-Y258 HydrophobicContact CG2-CD1 3.7Å; I97-Y258 HydrophobicContact CG2-CE1 3.86Å; G102-Y258 WeakPolarHBondContact CA-OH 3.49Å; G102-Y258 PolarHBondContact O-OH 3.1Å; M106-Y258 HydrophobicContact CG-CE2 4.37Å; M106-Y258 WeakPolarHBondContact CG-OH 3.37Å; M106-Y258 HydrophobicContact SD-CE2 4.17Å; L254-Y258 HydrophobicContact CD2-CD2 3.81Å; L254-Y258 HydrophobicContact CD2-CE2 4.14Å; L254-Y258 WeakPolarHBondContact O-CA 3.47Å; L254-Y258 WeakPolarHBondContact O-CB 3.43Å; L254-Y258 PolarHBondContact O-N 3.47Å; Y258-I260 HydrophobicContact CG-CD1 4.34Å; Y258-I260 WeakPolarHBondContact O-CG1 3.22Å; Y258-I260 PolarHBondContact O-N 2.99Å
259D76.7Confident82.5Confident142 Ų14273.8 Ų73.876%0.75936%0.36SS*.SBendtrans54.731.4-169.7-159.831000111.5L254 E255L254-D259 PolarHBondContact O-N 2.05Å; E255-D259 WeakPolarHBondContact O-CA 3.22Å; E255-D259 PolarHBondContact O-N 3.31Å
260I77.7Confident82.5Confident77 Ų7777.2 Ų77.240%0.39537%0.373SS..  trans-105.1110.1-179.9-62.9173.7000108.5L254 E255 Y258 M262L254-I260 CarbonylContact C-O 3.32Å; L254-I260 VanDerWaalsContact C-O 3.31Å; L254-I260 PolarHBondContact O-N 3.45Å; E255-I260 WeakPolarHBondContact CA-O 3.29Å; E255-I260 PolarHBondContact N-O 3.33Å; Y258-I260 HydrophobicContact CG-CD1 4.34Å; Y258-I260 WeakPolarHBondContact O-CG1 3.22Å; Y258-I260 PolarHBondContact O-N 2.99Å; I260-M262 HydrophobicContact CG2-CG 3.95Å; I260-M262 PolarHBondContact O-N 3.03Å
261T80.1Confident82.7Confident100 Ų10076.2 Ų76.261%0.61337%0.368SS*.  trans-82.3106168.8-43.50000109.7
262M79.5Confident82.9Confident64 Ų6477 Ų7732%0.31537%0.373SS..  trans-106.1124.6168.1-82.6-168.264.600109.7E251 L254 I260 A264 V266 L267E251-M262 WeakPolarHBondContact CG-O 3.36Å; L254-M262 HydrophobicContact CD1-CB 4.16Å; L254-M262 HydrophobicContact CD1-CG 4.23Å; L254-M262 HydrophobicContact CD1-SD 3.78Å; I260-M262 HydrophobicContact CG2-CG 3.95Å; I260-M262 PolarHBondContact O-N 3.03Å; M262-A264 PolarHBondContact O-N 2.78Å; M262-V266 HydrophobicContact CE-CG1 3.95Å; M262-L267 HydrophobicContact CB-CD1 3.99Å; M262-L267 HydrophobicContact CB-CD2 4.2Å; M262-L267 HydrophobicContact CB-CG 4.01Å; M262-L267 HydrophobicContact CE-CD2 3.51Å; M262-L267 HydrophobicContact CE-CG 3.98Å; M262-L267 HydrophobicContact SD-CD2 3.93Å
263R82.7Confident82.9Confident159 Ų15975.8 Ų75.860%0.637%0.367SS*.  trans-61.6136178.5-56.8-175.7-57.8-178.74.8111.1D265 V266 L267R263-D265 WeakPolarHBondContact CB-OD1 3.06Å; R263-D265 IonicContact CZ-OD1 3.97Å; R263-D265 IonicContact CZ-OD2 3.72Å; R263-D265 IonicContact NE-OD1 3.45Å; R263-D265 PolarHBondContact NE-OD1 3.04Å; R263-D265 IonicContact NE-OD2 3.96Å; R263-D265 IonicContact NH2-OD2 3.52Å; R263-D265 PolarHBondContact O-N 3.36Å; R263-D265 VanDerWaalsContact O-N 3.12Å; R263-V266 HydrophobicContact CB-CG2 4.49Å; R263-V266 PolarHBondContact O-N 3.34Å; R263-V266 VanDerWaalsContact O-N 3.1Å; R263-L267 PolarHBondContact O-N 3.37Å
264A82.3Confident82.9Confident13 Ų1377.2 Ų77.211%0.10738%0.378CS..Hα-helixtrans-52.7-32.4178.600000115.1E251 M262 L267 R268E251-A264 PolarHBondContact OE1-N 2.77Å; E251-A264 WeakPolarHBondContact OE2-CB 3.11Å; M262-A264 PolarHBondContact O-N 2.78Å; A264-L267 PolarHBondContact O-N 3.31Å; A264-R268 VanDerWaalsContact O-CG 3.24Å; A264-R268 WeakPolarHBondContact O-CG 3.42Å; A264-R268 PolarHBondContact O-N 2.72Å; A264-R268 PolarHBondContact O-NH1 2.9Å
265D87.8Confident83.2Confident70 Ų7076.6 Ų76.637%0.37438%0.375SS..Hα-helixtrans-63.9-44.3177.363.1-34.8000112.2R263 L267 R268 E269R263-D265 WeakPolarHBondContact CB-OD1 3.06Å; R263-D265 IonicContact CZ-OD1 3.97Å; R263-D265 IonicContact CZ-OD2 3.72Å; R263-D265 IonicContact NE-OD1 3.45Å; R263-D265 PolarHBondContact NE-OD1 3.04Å; R263-D265 IonicContact NE-OD2 3.96Å; R263-D265 IonicContact NH2-OD2 3.52Å; R263-D265 PolarHBondContact O-N 3.36Å; R263-D265 VanDerWaalsContact O-N 3.12Å; D265-L267 VanDerWaalsContact C-N 3.34Å; D265-R268 PolarHBondContact O-N 3.36Å; D265-E269 PolarHBondContact O-N 3.13Å
266V86.8Confident83.4Confident57 Ų5775.7 Ų75.735%0.34537%0.373SS..Hα-helixtrans-65.3-40.4175.7-1790000110.9M262 R263 E269 K270M262-V266 HydrophobicContact CE-CG1 3.95Å; R263-V266 HydrophobicContact CB-CG2 4.49Å; R263-V266 PolarHBondContact O-N 3.34Å; R263-V266 VanDerWaalsContact O-N 3.1Å; V266-E269 PolarHBondContact O-N 3.12Å; V266-K270 PolarHBondContact O-N 3.37Å
267L85.9Confident83.4Confident11 Ų1172 Ų726%0.05836%0.356CS..Hα-helixtrans-63.4-42.7177-72.7169.2000111.8A247 L250 E251 L254 M262 R263 A264 D265 E269 K270 I271A247-L267 HydrophobicContact CB-CB 4.19Å; L250-L267 HydrophobicContact CB-CD1 4.36Å; E251-L267 HydrophobicContact CB-CD1 3.7Å; L254-L267 HydrophobicContact CD1-CD1 4.38Å; L254-L267 HydrophobicContact CD1-CD2 3.82Å; M262-L267 HydrophobicContact CB-CD1 3.99Å; M262-L267 HydrophobicContact CB-CD2 4.2Å; M262-L267 HydrophobicContact CB-CG 4.01Å; M262-L267 HydrophobicContact CE-CD2 3.51Å; M262-L267 HydrophobicContact CE-CG 3.98Å; M262-L267 HydrophobicContact SD-CD2 3.93Å; R263-L267 PolarHBondContact O-N 3.37Å; A264-L267 PolarHBondContact O-N 3.31Å; D265-L267 VanDerWaalsContact C-N 3.34Å; L267-E269 PolarHBondContact O-N 2.89Å; L267-K270 PolarHBondContact O-N 2.93Å; L267-I271 HydrophobicContact CB-CD1 4.37Å; L267-I271 WeakPolarHBondContact O-CB 3.46Å; L267-I271 VanDerWaalsContact O-CD1 3.28Å; L267-I271 WeakPolarHBondContact O-CD1 3.31Å; L267-I271 WeakPolarHBondContact O-CG1 3.33Å; L267-I271 PolarHBondContact O-N 2.76Å
268R89.1Confident83.6Confident79 Ų7973 Ų7330%0.29836%0.361SS..Hα-helixtrans-58.3-45.5177.4-75.9173.1-168.5110.2-5.1112.8N243 D244 A247 A264 D265 K270 I271 I272N243-R268 PolarHBondContact ND2-O 3.29Å; D244-R268 IonicContact OD1-CZ 3.42Å; D244-R268 IonicContact OD1-NE 2.71Å; D244-R268 PolarHBondContact OD1-NE 2.87Å; D244-R268 IonicContact OD1-NH2 3.43Å; D244-R268 PolarHBondContact OD1-NH2 2.88Å; A247-R268 HydrophobicContact CB-CG 3.64Å; A264-R268 VanDerWaalsContact O-CG 3.24Å; A264-R268 WeakPolarHBondContact O-CG 3.42Å; A264-R268 PolarHBondContact O-N 2.72Å; A264-R268 PolarHBondContact O-NH1 2.9Å; D265-R268 PolarHBondContact O-N 3.36Å; R268-K270 VanDerWaalsContact C-N 3.3Å; R268-K270 PolarHBondContact O-N 2.92Å; R268-I271 PolarHBondContact O-N 2.58Å; R268-I272 WeakPolarHBondContact O-CG1 3.11Å; R268-I272 PolarHBondContact O-N 3.41Å
269E89.4Confident84.1Confident145 Ų14571 Ų7168%0.67836%0.355SS*.Hα-helixtrans-60.2-44.3177.2-71.6-177.5174.100110.5D265 V266 L267 I271 I272 E273D265-E269 PolarHBondContact O-N 3.13Å; V266-E269 PolarHBondContact O-N 3.12Å; L267-E269 PolarHBondContact O-N 2.89Å; E269-I271 PolarHBondContact O-N 3.24Å; E269-I272 PolarHBondContact O-N 3.47Å; E269-E273 PolarHBondContact O-N 3.19Å; E269-E273 VanDerWaalsContact O-N 3.1Å
270K84.8Confident84.5Confident95 Ų9567.6 Ų67.641%0.41334%0.336SS..Hα-helixtrans-69-35.7-179.9-165.656.7174.7179.80113.1V266 L267 R268 I272 E273 I274V266-K270 PolarHBondContact O-N 3.37Å; L267-K270 PolarHBondContact O-N 2.93Å; R268-K270 VanDerWaalsContact C-N 3.3Å; R268-K270 PolarHBondContact O-N 2.92Å; K270-I272 VanDerWaalsContact C-N 3.34Å; K270-E273 VanDerWaalsContact CD-OE2 3.29Å; K270-E273 WeakPolarHBondContact CD-OE2 3.25Å; K270-E273 IonicContact NZ-OE1 2.77Å; K270-E273 PolarHBondContact NZ-OE1 3.35Å; K270-E273 IonicContact NZ-OE2 3.61Å; K270-E273 PolarHBondContact NZ-OE2 3.28Å; K270-E273 PolarHBondContact O-N 2.83Å; K270-I274 HydrophobicContact CG-CD1 4.1Å; K270-I274 WeakPolarHBondContact O-CB 3.33Å; K270-I274 VanDerWaalsContact O-CG1 3.26Å; K270-I274 WeakPolarHBondContact O-CG1 3.4Å; K270-I274 PolarHBondContact O-N 3.37Å
271I86.5Confident84.5Confident13 Ų1368.1 Ų68.17%0.06733%0.334CS..Hα-helixtrans-65.7-39.2175.6-68.7156.2000110.6N243 I246 A247 L250 L267 R268 E269 I274 T275N243-I271 VanDerWaalsContact OD1-CB 3.3Å; N243-I271 WeakPolarHBondContact OD1-CB 2.92Å; N243-I271 WeakPolarHBondContact OD1-CG2 3.24Å; I246-I271 HydrophobicContact CB-CD1 4.34Å; I246-I271 HydrophobicContact CG2-CD1 3.84Å; I246-I271 HydrophobicContact CG2-CG1 4.26Å; I246-I271 HydrophobicContact CG2-CG2 4.3Å; A247-I271 VanDerWaalsContact CA-CD1 3.48Å; A247-I271 HydrophobicContact CB-CD1 3.62Å; L250-I271 HydrophobicContact CD1-CD1 3.95Å; L250-I271 HydrophobicContact CD1-CG1 4.12Å; L267-I271 HydrophobicContact CB-CD1 4.37Å; L267-I271 WeakPolarHBondContact O-CB 3.46Å; L267-I271 VanDerWaalsContact O-CD1 3.28Å; L267-I271 WeakPolarHBondContact O-CD1 3.31Å; L267-I271 WeakPolarHBondContact O-CG1 3.33Å; L267-I271 PolarHBondContact O-N 2.76Å; R268-I271 PolarHBondContact O-N 2.58Å; E269-I271 PolarHBondContact O-N 3.24Å; I271-I274 PolarHBondContact O-N 2.86Å; I271-T275 VanDerWaalsContact O-CB 3.28Å; I271-T275 WeakPolarHBondContact O-CB 3.15Å; I271-T275 PolarHBondContact O-N 2.94Å; I271-T275 PolarHBondContact O-OG1 3.04Å
272I89.9Confident84.4Confident69 Ų6965.8 Ų65.835%0.35432%0.316SS..Hα-helixtrans-60.9-49.8174.2-69.6165.2000110.1Y240 N243 R268 E269 K270 I274 T275 D276Y240-I272 HydrophobicContact CE1-CG2 4.37Å; N243-I272 WeakPolarHBondContact ND2-CG1 3.45Å; R268-I272 WeakPolarHBondContact O-CG1 3.11Å; R268-I272 PolarHBondContact O-N 3.41Å; E269-I272 PolarHBondContact O-N 3.47Å; K270-I272 VanDerWaalsContact C-N 3.34Å; I272-I274 VanDerWaalsContact C-N 3.33Å; I272-I274 PolarHBondContact O-N 3.09Å; I272-T275 CarbonylContact O-C 3.58Å; I272-T275 WeakPolarHBondContact O-CB 3.19Å; I272-T275 PolarHBondContact O-N 3.32Å; I272-T275 VanDerWaalsContact O-N 3.08Å; I272-D276 VanDerWaalsContact O-CG 3.31Å; I272-D276 PolarHBondContact O-N 2.92Å
273E84.9Confident84.5Confident82 Ų8266.4 Ų66.438%0.38332%0.324SS..Hα-helixtrans-57.6-44.9178-172-161.7138.600112E269 K270 T275 D276 Q277E269-E273 PolarHBondContact O-N 3.19Å; E269-E273 VanDerWaalsContact O-N 3.1Å; K270-E273 VanDerWaalsContact CD-OE2 3.29Å; K270-E273 WeakPolarHBondContact CD-OE2 3.25Å; K270-E273 IonicContact NZ-OE1 2.77Å; K270-E273 PolarHBondContact NZ-OE1 3.35Å; K270-E273 IonicContact NZ-OE2 3.61Å; K270-E273 PolarHBondContact NZ-OE2 3.28Å; K270-E273 PolarHBondContact O-N 2.83Å; E273-T275 VanDerWaalsContact C-N 3.34Å; E273-D276 PolarHBondContact O-N 3.5Å; E273-Q277 WeakPolarHBondContact O-CG 3.5Å; E273-Q277 PolarHBondContact O-N 3.31Å
274I81.9Confident84.3Confident79 Ų7962.1 Ų62.141%0.40531%0.312SS..Hα-helixtrans-64.1-41.9176.6-69.8167.1000110.7K270 I271 I272 Q277 V278K270-I274 HydrophobicContact CG-CD1 4.1Å; K270-I274 WeakPolarHBondContact O-CB 3.33Å; K270-I274 VanDerWaalsContact O-CG1 3.26Å; K270-I274 WeakPolarHBondContact O-CG1 3.4Å; K270-I274 PolarHBondContact O-N 3.37Å; I271-I274 PolarHBondContact O-N 2.86Å; I272-I274 VanDerWaalsContact C-N 3.33Å; I272-I274 PolarHBondContact O-N 3.09Å; I274-Q277 PolarHBondContact O-N 3.47Å; I274-V278 HydrophobicContact CG2-CG2 4.27Å; I274-V278 WeakPolarHBondContact O-CB 3.26Å; I274-V278 VanDerWaalsContact O-CG2 3.29Å; I274-V278 WeakPolarHBondContact O-CG2 3.37Å; I274-V278 PolarHBondContact O-N 2.91Å
275T84Confident84.1Confident17 Ų1762.1 Ų62.110%0.10431%0.312CS..Hα-helixtrans-61.5-46.8177.8-58.80000110Y240 I271 I272 E273 Q277 V278 C279Y240-T275 HydrophobicContact CD1-CG2 3.92Å; Y240-T275 HydrophobicContact CD2-CG2 4.45Å; Y240-T275 HydrophobicContact CE1-CG2 3.58Å; Y240-T275 HydrophobicContact CE2-CG2 4.12Å; Y240-T275 HydrophobicContact CG-CG2 4.34Å; I271-T275 VanDerWaalsContact O-CB 3.28Å; I271-T275 WeakPolarHBondContact O-CB 3.15Å; I271-T275 PolarHBondContact O-N 2.94Å; I271-T275 PolarHBondContact O-OG1 3.04Å; I272-T275 CarbonylContact O-C 3.58Å; I272-T275 WeakPolarHBondContact O-CB 3.19Å; I272-T275 PolarHBondContact O-N 3.32Å; I272-T275 VanDerWaalsContact O-N 3.08Å; E273-T275 VanDerWaalsContact C-N 3.34Å; T275-Q277 VanDerWaalsContact C-N 3.34Å; T275-Q277 PolarHBondContact O-N 3.32Å; T275-V278 PolarHBondContact O-N 3.49Å; T275-C279 WeakPolarHBondContact O-CB 3.4Å; T275-C279 PolarHBondContact O-N 3.14Å; T275-C279 PolarHBondContact O-SG 3.4Å
276D88.7Confident83.6Confident77 Ų7761.6 Ų61.641%0.41231%0.305SS..Hα-helixtrans-55.2-49.1175.5-69.1-19.3000111.2Y240 I272 E273 V278 C279 L280Y240-D276 VanDerWaalsContact CE1-OD1 3.28Å; Y240-D276 WeakPolarHBondContact CE1-OD1 3.42Å; Y240-D276 VanDerWaalsContact CZ-OD1 3.29Å; Y240-D276 PolarHBondContact OH-OD1 2.86Å; I272-D276 VanDerWaalsContact O-CG 3.31Å; I272-D276 PolarHBondContact O-N 2.92Å; E273-D276 PolarHBondContact O-N 3.5Å; D276-V278 PolarHBondContact O-N 3.34Å; D276-C279 PolarHBondContact O-N 3.27Å; D276-L280 VanDerWaalsContact O-CB 3.31Å; D276-L280 WeakPolarHBondContact O-CB 3.36Å; D276-L280 PolarHBondContact O-N 3.31Å
277Q81.1Confident83.2Confident71 Ų7161 Ų6133%0.33230%0.3SS..Hα-helixtrans-64-40.5178.7-71.3176.1-2.600112.8E273 I274 T275 R281E273-Q277 WeakPolarHBondContact O-CG 3.5Å; E273-Q277 PolarHBondContact O-N 3.31Å; I274-Q277 PolarHBondContact O-N 3.47Å; T275-Q277 VanDerWaalsContact C-N 3.34Å; T275-Q277 PolarHBondContact O-N 3.32Å; Q277-R281 VanDerWaalsContact O-CB 3.31Å; Q277-R281 WeakPolarHBondContact O-CB 3.35Å; Q277-R281 WeakPolarHBondContact O-CG 3.28Å; Q277-R281 PolarHBondContact O-N 2.95Å; Q277-R281 VanDerWaalsContact O-N 3.07Å; Q277-R281 PolarHBondContact O-NE 2.81Å
278V81.6Confident83.1Confident58 Ų5861.1 Ų61.135%0.35230%0.3SS..Hα-helixtrans-66.6-42177.3169.40000110.1I274 T275 D276 R281 M282I274-V278 HydrophobicContact CG2-CG2 4.27Å; I274-V278 WeakPolarHBondContact O-CB 3.26Å; I274-V278 VanDerWaalsContact O-CG2 3.29Å; I274-V278 WeakPolarHBondContact O-CG2 3.37Å; I274-V278 PolarHBondContact O-N 2.91Å; T275-V278 PolarHBondContact O-N 3.49Å; D276-V278 PolarHBondContact O-N 3.34Å; V278-R281 WeakPolarHBondContact O-CB 3.47Å; V278-R281 PolarHBondContact O-N 2.88Å; V278-M282 HydrophobicContact CG1-CG 4.46Å; V278-M282 HydrophobicContact CG1-SD 3.93Å; V278-M282 WeakPolarHBondContact O-CG 3.42Å; V278-M282 PolarHBondContact O-N 2.79Å
279C85.4Confident83Confident14 Ų1459.4 Ų59.410%0.09530%0.3CS..Hα-helixtrans-68.8-41.6-179-72.50000113.5C236 T275 D276 R281 M282 T283C236-C279 WeakPolarHBondContact CA-SG 2.94Å; C236-C279 HydrophobicContact CB-CB 3.96Å; C236-C279 WeakPolarHBondContact CB-SG 3.34Å; C236-C279 WeakPolarHBondContact SG-CA 3.17Å; C236-C279 WeakPolarHBondContact SG-CB 3.33Å; C236-C279 CovalentContact SG-SG 2.02Å; C236-C279 PolarHBondContact SG-SG 3.05Å; T275-C279 WeakPolarHBondContact O-CB 3.4Å; T275-C279 PolarHBondContact O-N 3.14Å; T275-C279 PolarHBondContact O-SG 3.4Å; D276-C279 PolarHBondContact O-N 3.27Å; C279-R281 VanDerWaalsContact C-N 3.34Å; C279-M282 PolarHBondContact O-N 3.26Å; C279-T283 WeakPolarHBondContact O-CB 3.19Å; C279-T283 PolarHBondContact O-N 3.36Å; C279-T283 PolarHBondContact O-OG1 3.09Å
280L84.7Confident82.5Confident70 Ų7059.7 Ų59.737%0.36630%0.301SS..Hα-helixtrans-60.8-46.3170.8-179.356.3000110.5D276 M282 T283 L284 D306D276-L280 VanDerWaalsContact O-CB 3.31Å; D276-L280 WeakPolarHBondContact O-CB 3.36Å; D276-L280 PolarHBondContact O-N 3.31Å; L280-M282 PolarHBondContact O-N 3.24Å; L280-T283 PolarHBondContact O-N 3.06Å; L280-L284 HydrophobicContact CD1-CD1 4.14Å; L280-L284 HydrophobicContact CD1-CG 4.16Å; L280-L284 HydrophobicContact CG-CD1 4.03Å; L280-L284 HydrophobicContact CG-CG 4.47Å; L280-L284 WeakPolarHBondContact O-CB 3.03Å; L280-L284 WeakPolarHBondContact O-CG 3.32Å; L280-L284 PolarHBondContact O-N 3.42Å; L280-D306 WeakPolarHBondContact CD2-OD2 3.4Å
281R77.9Confident82.2Confident88 Ų8859.4 Ų59.433%0.33230%0.304SS..Hα-helixtrans-60.5-41.5176.1-79.3-179.7-79.1-180-11.7112.8Q277 V278 C279 S285Q277-R281 VanDerWaalsContact O-CB 3.31Å; Q277-R281 WeakPolarHBondContact O-CB 3.35Å; Q277-R281 WeakPolarHBondContact O-CG 3.28Å; Q277-R281 PolarHBondContact O-N 2.95Å; Q277-R281 VanDerWaalsContact O-N 3.07Å; Q277-R281 PolarHBondContact O-NE 2.81Å; V278-R281 WeakPolarHBondContact O-CB 3.47Å; V278-R281 PolarHBondContact O-N 2.88Å; C279-R281 VanDerWaalsContact C-N 3.34Å; R281-S285 WeakPolarHBondContact O-CB 3.36Å; R281-S285 PolarHBondContact O-N 3.03Å
282M78.1Confident81.9Confident51 Ų5160 Ų6025%0.25131%0.313SS..Hα-helixtrans-62.6-44.1176.1-75.5171.164.900111.2L232 A235 V278 C279 L280 S285 Y286L232-M282 HydrophobicContact CB-CE 4.04Å; L232-M282 HydrophobicContact CD2-CE 3.28Å; L232-M282 HydrophobicContact CG-CE 4.25Å; A235-M282 HydrophobicContact CB-CE 4.28Å; V278-M282 HydrophobicContact CG1-CG 4.46Å; V278-M282 HydrophobicContact CG1-SD 3.93Å; V278-M282 WeakPolarHBondContact O-CG 3.42Å; V278-M282 PolarHBondContact O-N 2.79Å; C279-M282 PolarHBondContact O-N 3.26Å; L280-M282 PolarHBondContact O-N 3.24Å; M282-S285 PolarHBondContact O-N 2.87Å; M282-Y286 WeakPolarHBondContact O-CB 3.3Å; M282-Y286 PolarHBondContact O-N 2.84Å
283T80.6Confident81.6Confident77 Ų7757.1 Ų57.147%0.47230%0.298SS..Hα-helixtrans-63.9-47178.1-57.60000111.7C279 L280 S285 Y286 N287C279-T283 WeakPolarHBondContact O-CB 3.19Å; C279-T283 PolarHBondContact O-N 3.36Å; C279-T283 PolarHBondContact O-OG1 3.09Å; L280-T283 PolarHBondContact O-N 3.06Å; T283-S285 VanDerWaalsContact C-N 3.35Å; T283-S285 PolarHBondContact O-N 3.05Å; T283-Y286 PolarHBondContact O-N 3.26Å; T283-N287 PolarHBondContact O-N 2.03Å; T283-N287 VanDerWaalsContact O-N 3.17Å; T283-N287 PolarHBondContact O-ND2 2.66Å
284L79.2Confident81.3Confident69 Ų6957.8 Ų57.836%0.36130%0.3SS..Hα-helixtrans-63.3-41.1176.3-69.8173.7000111.7L280 Y286 N287 L288L280-L284 HydrophobicContact CD1-CD1 4.14Å; L280-L284 HydrophobicContact CD1-CG 4.16Å; L280-L284 HydrophobicContact CG-CD1 4.03Å; L280-L284 HydrophobicContact CG-CG 4.47Å; L280-L284 WeakPolarHBondContact O-CB 3.03Å; L280-L284 WeakPolarHBondContact O-CG 3.32Å; L280-L284 PolarHBondContact O-N 3.42Å; L284-Y286 VanDerWaalsContact C-N 3.34Å; L284-Y286 PolarHBondContact O-N 3.43Å; L284-N287 CarbonylContact O-C 3.6Å; L284-N287 PolarHBondContact O-N 3.01Å; L284-L288 WeakPolarHBondContact O-CA 2.99Å; L284-L288 WeakPolarHBondContact O-CB 3.24Å; L284-L288 PolarHBondContact O-N 2.82Å
285S77.4Confident80.7Confident13 Ų1356.6 Ų56.69%0.09130%0.295CS..Hα-helixtrans-62.9-39.8177.6-171.20000112S136 G138 R281 M282 T283 N287 L288S136-S285 VanDerWaalsContact CB-OG 3.23Å; S136-S285 WeakPolarHBondContact CB-OG 3.04Å; S136-S285 PolarHBondContact OG-OG 3.29Å; G138-S285 WeakPolarHBondContact CA-OG 2.99Å; G138-S285 PolarHBondContact N-OG 3.18Å; R281-S285 WeakPolarHBondContact O-CB 3.36Å; R281-S285 PolarHBondContact O-N 3.03Å; M282-S285 PolarHBondContact O-N 2.87Å; T283-S285 VanDerWaalsContact C-N 3.35Å; T283-S285 PolarHBondContact O-N 3.05Å; S285-N287 VanDerWaalsContact C-N 3.35Å; S285-L288 VanDerWaalsContact O-CB 3.29Å; S285-L288 WeakPolarHBondContact O-CB 3.45Å; S285-L288 PolarHBondContact O-N 3.29Å
286Y77.4Confident79.8Confident58 Ų5865.9 Ų65.923%0.22734%0.337CS..Hα-helixtrans-64.6-38.1176.1-179.6-99000112.3V228 L232 M282 T283 L284 L288V228-Y286 HydrophobicContact CB-CE2 4.06Å; V228-Y286 HydrophobicContact CG1-CD2 4.02Å; V228-Y286 HydrophobicContact CG1-CE2 3.62Å; L232-Y286 HydrophobicContact CD1-CD2 3.86Å; L232-Y286 HydrophobicContact CD1-CG 4.17Å; M282-Y286 WeakPolarHBondContact O-CB 3.3Å; M282-Y286 PolarHBondContact O-N 2.84Å; T283-Y286 PolarHBondContact O-N 3.26Å; L284-Y286 VanDerWaalsContact C-N 3.34Å; L284-Y286 PolarHBondContact O-N 3.43Å; Y286-L288 VanDerWaalsContact C-N 3.35Å
287N79.1Confident78.8Confident46 Ų4666.3 Ų66.325%0.24635%0.346CS..Hα-helixtrans-88.4-1.1179.4-64.1-35.8000113.6T283 L284 S285 C289 Q290 N291T283-N287 PolarHBondContact O-N 2.03Å; T283-N287 VanDerWaalsContact O-N 3.17Å; T283-N287 PolarHBondContact O-ND2 2.66Å; L284-N287 CarbonylContact O-C 3.6Å; L284-N287 PolarHBondContact O-N 3.01Å; S285-N287 VanDerWaalsContact C-N 3.35Å; N287-C289 VanDerWaalsContact C-N 3.3Å; N287-C289 PolarHBondContact O-N 3.01Å; N287-Q290 WeakPolarHBondContact O-CB 3.31Å; N287-Q290 PolarHBondContact O-N 3.05Å; N287-N291 PolarHBondContact O-N 2.74Å
288L83.5Confident78.1Confident13 Ų1365.2 Ų65.27%0.06835%0.353CS..Hα-helixtrans-60.7-39.8-167.9-156.973.4000112.6V137 V141 F206 L284 S285 Y286 Q290 N291 G292 A301V137-L288 HydrophobicContact CB-CD2 4.28Å; V137-L288 HydrophobicContact CG1-CD2 3.86Å; V141-L288 HydrophobicContact CG2-CD2 4.22Å; F206-L288 HydrophobicContact CE2-CD2 3.8Å; F206-L288 HydrophobicContact CE2-CG 3.88Å; F206-L288 HydrophobicContact CZ-CG 4.41Å; L284-L288 WeakPolarHBondContact O-CA 2.99Å; L284-L288 WeakPolarHBondContact O-CB 3.24Å; L284-L288 PolarHBondContact O-N 2.82Å; S285-L288 VanDerWaalsContact O-CB 3.29Å; S285-L288 WeakPolarHBondContact O-CB 3.45Å; S285-L288 PolarHBondContact O-N 3.29Å; Y286-L288 VanDerWaalsContact C-N 3.35Å; L288-Q290 PolarHBondContact O-N 2.87Å; L288-N291 PolarHBondContact O-N 3.46Å; L288-G292 PolarHBondContact O-N 3.2Å; L288-G292 VanDerWaalsContact O-N 3.14Å; L288-A301 HydrophobicContact CD1-CB 3.81Å; L288-A301 HydrophobicContact CD2-CB 4.05Å; L288-A301 HydrophobicContact CG-CB 3.97Å
289C86.5Confident77.5Confident43 Ų4363.8 Ų63.829%0.29135%0.346SS..Hα-helixtrans-70.6-17.1178.9-68.60000114.5C210 N287C210-C289 WeakPolarHBondContact CA-SG 3.24Å; C210-C289 HydrophobicContact CB-CB 3.64Å; C210-C289 WeakPolarHBondContact CB-SG 3.26Å; C210-C289 WeakPolarHBondContact SG-CA 3.49Å; C210-C289 WeakPolarHBondContact SG-CB 3.22Å; C210-C289 CovalentContact SG-SG 2.04Å; C210-C289 PolarHBondContact SG-SG 3.4Å; N287-C289 VanDerWaalsContact C-N 3.3Å; N287-C289 PolarHBondContact O-N 3.01Å
290Q80.2Confident76.3Confident151 Ų15165 Ų6571%0.70635%0.353SS*.Hα-helixtrans-83.4-37.6173-60.3-179.8-1.100111N287 L288 G292N287-Q290 WeakPolarHBondContact O-CB 3.31Å; N287-Q290 PolarHBondContact O-N 3.05Å; L288-Q290 PolarHBondContact O-N 2.87Å; Q290-G292 VanDerWaalsContact C-N 3.33Å
291N77.3Confident75.3Confident88 Ų8862.1 Ų62.147%0.47134%0.34SS..Hα-helixtrans-76.8-21-177.4-63.1-9.8000113N287 L288N287-N291 PolarHBondContact O-N 2.74Å; L288-N291 PolarHBondContact O-N 3.46Å
292G81.4Confident74.5Confident25 Ų2559.6 Ų59.626%0.25834%0.341SS..  trans88.1-176.7-178.600000113.1F206 L288 Q290F206-G292 VanDerWaalsContact CE1-C 3.49Å; F206-G292 VanDerWaalsContact CZ-C 3.5Å; F206-G292 WeakPolarHBondContact CZ-O 3.32Å; L288-G292 PolarHBondContact O-N 3.2Å; L288-G292 VanDerWaalsContact O-N 3.14Å; Q290-G292 VanDerWaalsContact C-N 3.33Å
293F82.6Confident73.2Confident10 Ų1059.9 Ų59.94%0.04434%0.343CS..SBendtrans-73.8-30.1-176.2-177.3-107.5000112.7M199 Q202 E203 F206 P300 A301M199-F293 HydrophobicContact CG-CE1 4.49Å; M199-F293 HydrophobicContact SD-CE1 3.78Å; M199-F293 HydrophobicContact SD-CZ 3.77Å; Q202-F293 HydrophobicContact CB-CE2 4.28Å; Q202-F293 HydrophobicContact CB-CZ 4.09Å; E203-F293 HydrophobicContact CB-CD1 3.95Å; E203-F293 HydrophobicContact CB-CD2 4.47Å; E203-F293 HydrophobicContact CB-CE1 4.01Å; E203-F293 HydrophobicContact CB-CG 4.18Å; E203-F293 HydrophobicContact CB-CZ 4.29Å; E203-F293 HydrophobicContact CG-CB 4.35Å; E203-F293 HydrophobicContact CG-CD1 4.02Å; E203-F293 HydrophobicContact CG-CG 4.12Å; F206-F293 HydrophobicContact CB-CD2 3.64Å; F206-F293 HydrophobicContact CB-CE2 4.15Å; F206-F293 HydrophobicContact CD1-CB 3.71Å; F206-F293 AromaticContact CD1-CD2 3.92Å; F206-F293 HydrophobicContact CD1-CD2 3.92Å; F206-F293 HydrophobicContact CD1-CG 4.29Å; F206-F293 HydrophobicContact CD2-CD2 4.13Å; F206-F293 HydrophobicContact CE1-CB 3.91Å; F206-F293 HydrophobicContact CG-CB 4.31Å; F206-F293 AromaticContact CG-CD2 3.63Å; F206-F293 HydrophobicContact CG-CD2 3.63Å; F206-F293 HydrophobicContact CG-CG 4.44Å; F293-P300 CarbonylContact O-C 3.6Å; F293-P300 WeakPolarHBondContact O-CA 3.32Å; F293-A301 WeakPolarHBondContact O-CB 3.39Å; F293-A301 PolarHBondContact O-N 3.18Å
294F78.1Confident71.6Confident96 Ų9658.4 Ų58.442%0.42134%0.336SS..BIsolated β-bridgetrans-109.3132.7169.5-61-75.8000107.7G298 S299 P300F294-G298 WeakPolarHBondContact CD1-O 3.48Å; F294-S299 CarbonylContact C-O 3.56Å; F294-S299 WeakPolarHBondContact CA-O 3.45Å; F294-P300 HydrophobicContact CD1-CG 4.41Å; F294-P300 HydrophobicContact CE1-CG 4.23Å
295D69.9Low69.6Low54 Ų5460 Ų6029%0.28935%0.348SS..  trans-72.6179171.269.320.3000111.4S297 G298 S299D295-S297 PolarHBondContact O-N 2.7Å; D295-S297 VanDerWaalsContact O-N 3.13Å; D295-S297 VanDerWaalsContact OD1-CA 3.31Å; D295-S297 WeakPolarHBondContact OD1-CA 3.33Å; D295-S297 VanDerWaalsContact OD1-CB 3.31Å; D295-S297 WeakPolarHBondContact OD1-CB 3.33Å; D295-S297 PolarHBondContact OD1-N 2.88Å; D295-S297 PolarHBondContact OD1-OG 3.35Å; D295-S297 PolarHBondContact OD2-OG 3.04Å; D295-G298 PolarHBondContact O-N 3.31Å; D295-G298 PolarHBondContact OD1-N 3.44Å; D295-G298 VanDerWaalsContact OD1-N 3.16Å; D295-S299 PolarHBondContact N-O 2.77Å; D295-S299 PolarHBondContact OD1-N 3.27Å; D295-S299 WeakPolarHBondContact OD2-CB 3.46Å
296E65.9Low67.5Low211 Ų21163.3 Ų63.399%0.98637%0.365SS*.THydrogen-bonded Turntrans-61.4-21.2-179.9-62.4-174168.500113.6G298E296-G298 VanDerWaalsContact C-N 3.28Å
297S67.4Low65.3Low87 Ų8773.4 Ų73.461%0.60841%0.411SS*.THydrogen-bonded Turntrans-83.1-5.8174.679.50000113.1D295 S299D295-S297 PolarHBondContact O-N 2.7Å; D295-S297 VanDerWaalsContact O-N 3.13Å; D295-S297 VanDerWaalsContact OD1-CA 3.31Å; D295-S297 WeakPolarHBondContact OD1-CA 3.33Å; D295-S297 VanDerWaalsContact OD1-CB 3.31Å; D295-S297 WeakPolarHBondContact OD1-CB 3.33Å; D295-S297 PolarHBondContact OD1-N 2.88Å; D295-S297 PolarHBondContact OD1-OG 3.35Å; D295-S297 PolarHBondContact OD2-OG 3.04Å; S297-S299 VanDerWaalsContact C-N 3.26Å; S297-S299 WeakPolarHBondContact OG-CB 3.24Å; S297-S299 PolarHBondContact OG-N 3.47Å; S297-S299 PolarHBondContact OG-OG 3.21Å
298G66.4Low64.6Low47 Ų4774.8 Ų74.849%0.48542%0.419SS..SBendtrans79.18-17100000113.3F294 D295 E296F294-G298 WeakPolarHBondContact CD1-O 3.48Å; D295-G298 PolarHBondContact O-N 3.31Å; D295-G298 PolarHBondContact OD1-N 3.44Å; D295-G298 VanDerWaalsContact OD1-N 3.16Å; E296-G298 VanDerWaalsContact C-N 3.28Å
299S67.9Low63.6Low29 Ų2978.1 Ų78.120%0.20344%0.437CS..PPolyproline II helixtrans-79137.1177.3-62.30000109.8F294 D295 S297F294-S299 CarbonylContact C-O 3.56Å; F294-S299 WeakPolarHBondContact CA-O 3.45Å; D295-S299 PolarHBondContact N-O 2.77Å; D295-S299 PolarHBondContact OD1-N 3.27Å; D295-S299 WeakPolarHBondContact OD2-CB 3.46Å; S297-S299 VanDerWaalsContact C-N 3.26Å; S297-S299 WeakPolarHBondContact OG-CB 3.24Å; S297-S299 PolarHBondContact OG-N 3.47Å; S297-S299 PolarHBondContact OG-OG 3.21Å
300P61.4Low62.3Low38 Ų3880 Ų8025%0.24745%0.445CS..BIsolated β-bridgetrans-57.1142.7173.7-24.930.8000112.5F293 F294 G302 I303F293-P300 CarbonylContact O-C 3.6Å; F293-P300 WeakPolarHBondContact O-CA 3.32Å; F294-P300 HydrophobicContact CD1-CG 4.41Å; F294-P300 HydrophobicContact CE1-CG 4.23Å; P300-G302 PolarHBondContact O-N 3.17Å; P300-I303 HydrophobicContact CB-CD1 4.25Å; P300-I303 HydrophobicContact CG-CD1 4.19Å; P300-I303 WeakPolarHBondContact O-CG1 3.45Å; P300-I303 PolarHBondContact O-N 2.9Å
301A64.1Low61.3Low11 Ų1175.8 Ų75.89%0.09143%0.43CS..THydrogen-bonded Turntrans-48.2134.117600000112V141 F206 L288 F293V141-A301 WeakPolarHBondContact CG1-O 3.32Å; F206-A301 HydrophobicContact CD2-CB 4.47Å; F206-A301 HydrophobicContact CE2-CB 4.04Å; L288-A301 HydrophobicContact CD1-CB 3.81Å; L288-A301 HydrophobicContact CD2-CB 4.05Å; L288-A301 HydrophobicContact CG-CB 3.97Å; F293-A301 WeakPolarHBondContact O-CB 3.39Å; F293-A301 PolarHBondContact O-N 3.18Å
302G60.3Low60.3Low34 Ų3475.1 Ų75.135%0.35143%0.428SS..THydrogen-bonded Turntrans91.6-1.517800000115.7P300 S304P300-G302 PolarHBondContact O-N 3.17Å; G302-S304 PolarHBondContact O-N 3.27Å
303I51.2Low58.9Low58 Ų5878.4 Ų78.430%0.29744%0.439SS..  trans-84.292164.6-52.6176.3000107.4P300 T305P300-I303 HydrophobicContact CB-CD1 4.25Å; P300-I303 HydrophobicContact CG-CD1 4.19Å; P300-I303 WeakPolarHBondContact O-CG1 3.45Å; P300-I303 PolarHBondContact O-N 2.9Å; I303-T305 VanDerWaalsContact C-N 3.35Å; I303-T305 HydrophobicContact CG2-CG2 3.53Å; I303-T305 PolarHBondContact O-N 2.74Å; I303-T305 VanDerWaalsContact O-N 3.13Å
304S46.4Very low57.2Low45 Ų4583.3 Ų83.332%0.31547%0.467SS..  trans-69.9106.2154.6129.30000104.7G302 D306G302-S304 PolarHBondContact O-N 3.27Å; S304-D306 WeakPolarHBondContact CB-OD2 3.37Å; S304-D306 PolarHBondContact O-N 3.12Å; S304-D306 VanDerWaalsContact O-N 3.16Å; S304-D306 PolarHBondContact OG-N 3.42Å; S304-D306 PolarHBondContact OG-OD2 3.26Å
305T36.7Very low55.5Low102 Ų10282.3 Ų82.363%0.62647%0.471SS*.  trans-80.360.1162.754.50000107.6I303I303-T305 VanDerWaalsContact C-N 3.35Å; I303-T305 HydrophobicContact CG2-CG2 3.53Å; I303-T305 PolarHBondContact O-N 2.74Å; I303-T305 VanDerWaalsContact O-N 3.13Å
306D34.2Very low54.3Low83 Ų8384.7 Ų84.744%0.44449%0.486SS..  trans-88.3117.4165-65.4-55.1000107.5L280 S304L280-D306 WeakPolarHBondContact CD2-OD2 3.4Å; S304-D306 WeakPolarHBondContact CB-OD2 3.37Å; S304-D306 PolarHBondContact O-N 3.12Å; S304-D306 VanDerWaalsContact O-N 3.16Å; S304-D306 PolarHBondContact OG-N 3.42Å; S304-D306 PolarHBondContact OG-OD2 3.26Å
307K30.4Very low53.3Low271 Ų27173.2 Ų73.2100%1.17844%0.44SS*.  trans-60.90174.7-72.1174.4173.9175.30111.7

Retrieved 307 of 307 residues in 91.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).