A0A087YQU3_POEFO Loading...

Ankyrin repeat domain 9

AlphaFold DB , UniProt , Accession A0A087YQU3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 285 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M45Very low37.9Very low73 Ų7398.7 Ų98.736%0.3659%0.592SS.*  01180-78.4-71157.200108.8W3 L4 F30 Y33M1-W3 PolarHBondContact O-N 3.43Å; M1-W3 VanDerWaalsContact O-N 3.1Å; M1-L4 HydrophobicContact CB-CB 3.73Å; M1-L4 HydrophobicContact CB-CD1 3.64Å; M1-L4 HydrophobicContact CB-CG 4.12Å; M1-L4 HydrophobicContact CG-CD1 3.61Å; M1-L4 HydrophobicContact SD-CD1 4.39Å; M1-F30 VanDerWaalsContact CE-CA 3.45Å; M1-F30 HydrophobicContact CE-CB 3.75Å; M1-F30 HydrophobicContact CE-CD2 3.18Å; M1-F30 HydrophobicContact CE-CE2 4.01Å; M1-F30 HydrophobicContact CE-CG 3.81Å; M1-Y33 HydrophobicContact CE-CD1 3.76Å; M1-Y33 HydrophobicContact CE-CD2 4.37Å; M1-Y33 HydrophobicContact CE-CG 3.67Å; M1-Y33 HydrophobicContact SD-CD2 4.39Å; M1-Y33 HydrophobicContact SD-CG 4.23Å
2P39.8Very low37.4Very low83 Ų83102.2 Ų102.254%0.53962%0.615SS.*THydrogen-bonded Turntrans-59.9-22.9-174.4-20.431000113.6
3W47.5Very low37.2Very low33 Ų3399.5 Ų99.513%0.12562%0.62CS.*THydrogen-bonded Turntrans-113.6-10.5-169.6-37109000114.7M1 R5 V75 F101 L151 H152M1-W3 PolarHBondContact O-N 3.43Å; M1-W3 VanDerWaalsContact O-N 3.1Å; W3-R5 PolarHBondContact O-N 2.93Å; W3-V75 HydrophobicContact CZ2-CG2 4.19Å; W3-F101 HydrophobicContact CB-CD1 4.48Å; W3-L151 HydrophobicContact CB-CD2 4.4Å; W3-L151 HydrophobicContact CD2-CD2 3.96Å; W3-L151 HydrophobicContact CE3-CB 4.04Å; W3-L151 HydrophobicContact CE3-CD2 3.39Å; W3-L151 HydrophobicContact CE3-CG 4.32Å; W3-L151 HydrophobicContact CG-CD2 4.41Å; W3-L151 HydrophobicContact CZ3-CB 3.69Å; W3-L151 HydrophobicContact CZ3-CD2 3.87Å; W3-L151 HydrophobicContact CZ3-CG 4.37Å; W3-L151 VanDerWaalsContact CZ3-O 3.26Å; W3-L151 WeakPolarHBondContact CZ3-O 3.38Å; W3-H152 AromaticContact CH2-CE1 3.3Å; W3-H152 WeakPolarHBondContact CH2-CE1 3.46Å; W3-H152 AromaticContact CH2-ND1 3.19Å; W3-H152 WeakPolarHBondContact CH2-ND1 3.31Å; W3-H152 AromaticContact CZ3-CE1 3.7Å; W3-H152 AromaticContact CZ3-ND1 3.27Å; W3-H152 VanDerWaalsContact CZ3-ND1 3.27Å; W3-H152 WeakPolarHBondContact CZ3-ND1 3.29Å
4L44.3Very low36.8Very low68 Ų68105.2 Ų105.236%0.35664%0.636SS.*  trans-91.428.9178.7-79.5158.1000112.1M1 S6 A29M1-L4 HydrophobicContact CB-CB 3.73Å; M1-L4 HydrophobicContact CB-CD1 3.64Å; M1-L4 HydrophobicContact CB-CG 4.12Å; M1-L4 HydrophobicContact CG-CD1 3.61Å; M1-L4 HydrophobicContact SD-CD1 4.39Å; L4-S6 PolarHBondContact O-N 3.23Å; L4-S6 VanDerWaalsContact O-N 3.13Å; L4-A29 HydrophobicContact CD1-CB 4.42Å
5R36.8Very low36.9Very low205 Ų205107.1 Ų107.177%0.77465%0.654SS**  trans-82.395.2175-79-173171.6-113.31.5109.2W3 S7W3-R5 PolarHBondContact O-N 2.93Å; R5-S7 PolarHBondContact O-N 2.88Å
6S38Very low37.1Very low86 Ų86110.1 Ų110.160%0.60166%0.664SS**  trans-48.1127.3160.4-430000109.4L4 S8L4-S6 PolarHBondContact O-N 3.23Å; L4-S6 VanDerWaalsContact O-N 3.13Å; S6-S8 PolarHBondContact O-N 2.85Å; S6-S8 PolarHBondContact O-OG 2.84Å
7S35.4Very low37.4Very low106 Ų106109.8 Ų109.874%0.74167%0.668SS**  trans-37.8109.9177.7-50.10000111.9R5R5-S7 PolarHBondContact O-N 2.88Å
8S35.4Very low38.3Very low106 Ų106106 Ų10674%0.74165%0.646SS**  trans-124.286.217514.90000108.9S6S6-S8 PolarHBondContact O-N 2.85Å; S6-S8 PolarHBondContact O-OG 2.84Å
9S32.1Very low39.6Very low109 Ų109103.1 Ų103.176%0.76263%0.631SS**  trans-136.983.9163.961.40000109.6
10S30.7Very low40.9Very low111 Ų111103.3 Ų103.378%0.77663%0.634SS**SBendtrans170.6122.3136.335.20000111.2
11S31.5Very low42Very low106 Ų106101.9 Ų101.974%0.74163%0.628SS**  trans26.1123.7147.850.60000121
12T32Very low43Very low140 Ų140101.5 Ų101.586%0.85963%0.625SS**SBendtrans66.7103.3150.6250000118.6
13G35.6Very low44.6Very low67 Ų67105.2 Ų105.269%0.69163%0.628SS**  trans64.884.5136.400000117.6
14Q31.3Very low45.8Very low180 Ų180107.4 Ų107.484%0.84164%0.64SS**  trans-172.5116.6137.8-102.2156.754.500109.2L16Q14-L16 PolarHBondContact O-N 2.85Å
15C37.6Very low47.2Very low133 Ų133104.6 Ų104.690%0.89963%0.626SS**  trans-70.792.7172.5-166.20000107.7S17C15-S17 PolarHBondContact O-N 3.5Å
16L40.7Very low49.1Very low156 Ų15699.1 Ų99.182%0.81761%0.609SS**  trans-65.9100.1169.1-73.2165.8000107.2Q14 C18Q14-L16 PolarHBondContact O-N 2.85Å; L16-C18 PolarHBondContact O-N 2.84Å
17S43Very low51.2Low105 Ų105102.2 Ų102.273%0.73461%0.607SS**  trans-53.3111.4174.750.70000110.2C15 S19C15-S17 PolarHBondContact O-N 3.5Å; S17-S19 PolarHBondContact O-N 2.94Å
18C52.7Low53.5Low41 Ų4198 Ų9828%0.27758%0.577SS.*  trans-55.6134169.4-84.70000109.8L16 Q22 R23L16-C18 PolarHBondContact O-N 2.84Å; C18-Q22 HydrophobicContact CB-CB 4.32Å; C18-Q22 HydrophobicContact CB-CG 4.4Å; C18-Q22 PolarHBondContact SG-NE2 3.01Å; C18-Q22 VanDerWaalsContact SG-NE2 3.39Å; C18-Q22 PolarHBondContact SG-OE1 3.35Å; C18-Q22 VanDerWaalsContact SG-OE1 3.37Å; C18-R23 HydrophobicContact CB-CG 4.25Å
19S64.1Low55.8Low51 Ų5193 Ų9336%0.35754%0.542SS..  trans-60.8150.7173.970.60000110.2S17 C21 Q22 R23S17-S19 PolarHBondContact O-N 2.94Å; S19-C21 PolarHBondContact O-N 2.89Å; S19-C21 VanDerWaalsContact O-N 3.12Å; S19-Q22 WeakPolarHBondContact O-CB 3.45Å; S19-Q22 PolarHBondContact O-N 3.28Å; S19-Q22 PolarHBondContact OG-N 3.05Å; S19-R23 PolarHBondContact O-N 3.24Å
20P64.8Low58.3Low107 Ų10793.1 Ų93.170%0.69553%0.529SS*.Hα-helixtrans-51.9-35.6177.7-28.335.1000113.4Q22 R23 E24P20-Q22 VanDerWaalsContact C-N 3.35Å; P20-Q22 PolarHBondContact O-N 3.24Å; P20-R23 PolarHBondContact O-N 3.36Å; P20-E24 PolarHBondContact O-N 3.47Å; P20-E24 VanDerWaalsContact O-N 3.17Å
21C63.4Low61.2Low73 Ų7390.2 Ų90.249%0.49351%0.509SS..Hα-helixtrans-73.3-24.6-179.9-47.40000113.3S19 C25 W56S19-C21 PolarHBondContact O-N 2.89Å; S19-C21 VanDerWaalsContact O-N 3.12Å; C21-C25 PolarHBondContact O-N 3.35Å; C21-C25 PolarHBondContact O-SG 2.98Å; C21-W56 HydrophobicContact CB-CH2 4.1Å; C21-W56 HydrophobicContact CB-CZ2 3.38Å; C21-W56 PolarHBondContact O-NE1 3.24Å; C21-W56 VanDerWaalsContact O-NE1 3.09Å
22Q67.4Low64Low65 Ų6585.1 Ų85.130%0.30447%0.473SS..Hα-helixtrans-71.8-40.9172.1-173.8174.4-4.700111.3C18 S19 P20 E24 C25 E26C18-Q22 HydrophobicContact CB-CB 4.32Å; C18-Q22 HydrophobicContact CB-CG 4.4Å; C18-Q22 PolarHBondContact SG-NE2 3.01Å; C18-Q22 VanDerWaalsContact SG-NE2 3.39Å; C18-Q22 PolarHBondContact SG-OE1 3.35Å; C18-Q22 VanDerWaalsContact SG-OE1 3.37Å; S19-Q22 WeakPolarHBondContact O-CB 3.45Å; S19-Q22 PolarHBondContact O-N 3.28Å; S19-Q22 PolarHBondContact OG-N 3.05Å; P20-Q22 VanDerWaalsContact C-N 3.35Å; P20-Q22 PolarHBondContact O-N 3.24Å; Q22-E24 VanDerWaalsContact C-N 3.3Å; Q22-E24 PolarHBondContact O-N 2.64Å; Q22-C25 PolarHBondContact O-N 3.35Å; Q22-E26 PolarHBondContact O-N 3.2Å; Q22-E26 VanDerWaalsContact O-N 3.09Å
23R72.2Confident66.8Low162 Ų16280.7 Ų80.761%0.61144%0.441SS*.Hα-helixtrans-63.6-36.4175.4-67.1-178176.6169.70.1112.5C18 S19 P20 E26 R27C18-R23 HydrophobicContact CB-CG 4.25Å; S19-R23 PolarHBondContact O-N 3.24Å; P20-R23 PolarHBondContact O-N 3.36Å; R23-E26 PolarHBondContact O-N 3.41Å; R23-R27 PolarHBondContact O-N 2.83Å; R23-R27 VanDerWaalsContact O-N 3.09Å
24E72.6Confident69.6Low79 Ų7978.3 Ų78.337%0.36941%0.414SS..Hα-helixtrans-63.8-42.1175.9-170.556.9-137.200111.6P20 Q22 E26 R27 T28P20-E24 PolarHBondContact O-N 3.47Å; P20-E24 VanDerWaalsContact O-N 3.17Å; Q22-E24 VanDerWaalsContact C-N 3.3Å; Q22-E24 PolarHBondContact O-N 2.64Å; E24-E26 PolarHBondContact O-N 3.29Å; E24-R27 WeakPolarHBondContact O-CB 3.33Å; E24-R27 PolarHBondContact O-N 3.21Å; E24-R27 VanDerWaalsContact O-N 3.16Å; E24-R27 IonicContact OE1-CZ 3.24Å; E24-R27 IonicContact OE1-NE 3.44Å; E24-R27 PolarHBondContact OE1-NE 3.15Å; E24-R27 VanDerWaalsContact OE1-NE 3.1Å; E24-R27 IonicContact OE1-NH2 2.98Å; E24-R27 PolarHBondContact OE1-NH2 3.16Å; E24-R27 IonicContact OE2-CZ 2.83Å; E24-R27 VanDerWaalsContact OE2-CZ 3.24Å; E24-R27 IonicContact OE2-NE 2.65Å; E24-R27 PolarHBondContact OE2-NE 2.96Å; E24-R27 IonicContact OE2-NH2 3.06Å; E24-R27 PolarHBondContact OE2-NH2 3.35Å; E24-T28 PolarHBondContact O-N 3.24Å; E24-T28 PolarHBondContact O-OG1 3.46Å; E24-T28 VanDerWaalsContact O-OG1 3.14Å
25C74.2Confident72.7Confident8 Ų870 Ų705%0.05438%0.375CS..Hα-helixtrans-66.3-36176.6-65.40000112.8C21 Q22 R27 T28 A29 V53 W56C21-C25 PolarHBondContact O-N 3.35Å; C21-C25 PolarHBondContact O-SG 2.98Å; Q22-C25 PolarHBondContact O-N 3.35Å; C25-R27 VanDerWaalsContact C-N 3.29Å; C25-R27 PolarHBondContact O-N 3.35Å; C25-T28 WeakPolarHBondContact CA-OG1 3.46Å; C25-T28 PolarHBondContact O-OG1 3.5Å; C25-A29 WeakPolarHBondContact O-CB 3.4Å; C25-A29 PolarHBondContact O-N 3.43Å; C25-V53 WeakPolarHBondContact SG-CG1 3.48Å; C25-W56 PolarHBondContact SG-NE1 2.9Å
26E76.6Confident75.5Confident90 Ų9063.6 Ų63.642%0.42133%0.333SS..Hα-helixtrans-64-37173.2-71.6174.4-178.900111.7Q22 R23 E24 F30Q22-E26 PolarHBondContact O-N 3.2Å; Q22-E26 VanDerWaalsContact O-N 3.09Å; R23-E26 PolarHBondContact O-N 3.41Å; E24-E26 PolarHBondContact O-N 3.29Å; E26-F30 VanDerWaalsContact O-CB 3.25Å; E26-F30 WeakPolarHBondContact O-CB 3.35Å; E26-F30 PolarHBondContact O-N 3.4Å
27R82.2Confident78.1Confident152 Ų15261.7 Ų61.757%0.57431%0.314SS*.Hα-helixtrans-69.7-47.4179.9-175.617774.2166.16.8112.4R23 E24 C25 F30 S31R23-R27 PolarHBondContact O-N 2.83Å; R23-R27 VanDerWaalsContact O-N 3.09Å; E24-R27 WeakPolarHBondContact O-CB 3.33Å; E24-R27 PolarHBondContact O-N 3.21Å; E24-R27 VanDerWaalsContact O-N 3.16Å; E24-R27 IonicContact OE1-CZ 3.24Å; E24-R27 IonicContact OE1-NE 3.44Å; E24-R27 PolarHBondContact OE1-NE 3.15Å; E24-R27 VanDerWaalsContact OE1-NE 3.1Å; E24-R27 IonicContact OE1-NH2 2.98Å; E24-R27 PolarHBondContact OE1-NH2 3.16Å; E24-R27 IonicContact OE2-CZ 2.83Å; E24-R27 VanDerWaalsContact OE2-CZ 3.24Å; E24-R27 IonicContact OE2-NE 2.65Å; E24-R27 PolarHBondContact OE2-NE 2.96Å; E24-R27 IonicContact OE2-NH2 3.06Å; E24-R27 PolarHBondContact OE2-NH2 3.35Å; C25-R27 VanDerWaalsContact C-N 3.29Å; C25-R27 PolarHBondContact O-N 3.35Å; R27-F30 PolarHBondContact O-N 2.93Å; R27-S31 PolarHBondContact O-N 3.24Å; R27-S31 PolarHBondContact O-OG 3.04Å
28T82.9Confident80.7Confident17 Ų1762.1 Ų62.110%0.10431%0.305CS..Hα-helixtrans-64.1-44.117549.50000110.5E24 C25 F30 S31 F32 E52 V53 F54E24-T28 PolarHBondContact O-N 3.24Å; E24-T28 PolarHBondContact O-OG1 3.46Å; E24-T28 VanDerWaalsContact O-OG1 3.14Å; C25-T28 WeakPolarHBondContact CA-OG1 3.46Å; C25-T28 PolarHBondContact O-OG1 3.5Å; T28-F30 VanDerWaalsContact C-N 3.25Å; T28-F30 PolarHBondContact O-N 3.13Å; T28-S31 WeakPolarHBondContact O-CA 3.48Å; T28-S31 WeakPolarHBondContact O-CB 3.49Å; T28-S31 PolarHBondContact O-N 3.05Å; T28-F32 PolarHBondContact O-N 3.14Å; T28-E52 VanDerWaalsContact CB-OE2 3.28Å; T28-E52 WeakPolarHBondContact CB-OE2 3.42Å; T28-E52 HydrophobicContact CG2-CB 4.27Å; T28-E52 HydrophobicContact CG2-CG 4.39Å; T28-V53 WeakPolarHBondContact CB-O 3.38Å; T28-V53 PolarHBondContact OG1-O 3.24Å; T28-F54 WeakPolarHBondContact O-CE1 3.41Å
29A83.5Confident82.9Confident0 Ų065.7 Ų65.70%032%0.317CS..Hα-helixtrans-60.5-36.817600000112.1L4 C25 Y33 F54 F64L4-A29 HydrophobicContact CD1-CB 4.42Å; C25-A29 WeakPolarHBondContact O-CB 3.4Å; C25-A29 PolarHBondContact O-N 3.43Å; A29-Y33 WeakPolarHBondContact O-CB 3.46Å; A29-Y33 PolarHBondContact O-N 3.31Å; A29-F54 HydrophobicContact CB-CD1 4.32Å; A29-F64 HydrophobicContact CB-CE2 4.26Å; A29-F64 HydrophobicContact CB-CZ 3.92Å
30F86.1Confident84.5Confident112 Ų11265.8 Ų65.849%0.49131%0.314SS..Hα-helixtrans-66.5-40.7172.6-175-88.8000112.9M1 E26 R27 T28 Y33 C34M1-F30 VanDerWaalsContact CE-CA 3.45Å; M1-F30 HydrophobicContact CE-CB 3.75Å; M1-F30 HydrophobicContact CE-CD2 3.18Å; M1-F30 HydrophobicContact CE-CE2 4.01Å; M1-F30 HydrophobicContact CE-CG 3.81Å; E26-F30 VanDerWaalsContact O-CB 3.25Å; E26-F30 WeakPolarHBondContact O-CB 3.35Å; E26-F30 PolarHBondContact O-N 3.4Å; R27-F30 PolarHBondContact O-N 2.93Å; T28-F30 VanDerWaalsContact C-N 3.25Å; T28-F30 PolarHBondContact O-N 3.13Å; F30-Y33 WeakPolarHBondContact O-CB 3.38Å; F30-Y33 PolarHBondContact O-N 2.9Å; F30-C34 WeakPolarHBondContact CE1-SG 3.45Å; F30-C34 PolarHBondContact O-N 3.22Å; F30-C34 PolarHBondContact O-SG 2.88Å; F30-C34 VanDerWaalsContact O-SG 3.38Å
31S90.3Very high86.1Confident50 Ų5063.6 Ų63.635%0.3530%0.3SS..Hα-helixtrans-64-45.8177.6-55.90000111.2R27 T28 Y33 C34 A35R27-S31 PolarHBondContact O-N 3.24Å; R27-S31 PolarHBondContact O-OG 3.04Å; T28-S31 WeakPolarHBondContact O-CA 3.48Å; T28-S31 WeakPolarHBondContact O-CB 3.49Å; T28-S31 PolarHBondContact O-N 3.05Å; S31-Y33 PolarHBondContact O-N 2.9Å; S31-C34 PolarHBondContact O-N 3.48Å; S31-A35 WeakPolarHBondContact O-CB 3.46Å; S31-A35 PolarHBondContact O-N 2.63Å
32F91.6Very high87.7Confident0 Ų061.7 Ų61.70%029%0.285CS..Hα-helixtrans-61.4-43.7174.3-178.1-99.1000112.5T28 C34 A35 V36 M48 R49 F54 F64 A69 Y72 Y81T28-F32 PolarHBondContact O-N 3.14Å; F32-C34 VanDerWaalsContact C-N 3.34Å; F32-C34 PolarHBondContact O-N 3.27Å; F32-A35 PolarHBondContact O-N 2.8Å; F32-V36 HydrophobicContact CD1-CG2 4.16Å; F32-V36 HydrophobicContact CE1-CG2 3.76Å; F32-V36 HydrophobicContact CE2-CG2 4.22Å; F32-V36 HydrophobicContact CZ-CG2 3.79Å; F32-V36 WeakPolarHBondContact O-CG2 3.27Å; F32-V36 PolarHBondContact O-N 3.17Å; F32-M48 HydrophobicContact CD2-CB 4.12Å; F32-R49 HydrophobicContact CE2-CB 3.86Å; F32-R49 HydrophobicContact CE2-CG 4.33Å; F32-R49 HydrophobicContact CZ-CB 4.36Å; F32-R49 HydrophobicContact CZ-CG 4.37Å; F32-F54 HydrophobicContact CB-CD1 4.19Å; F32-F54 HydrophobicContact CB-CE1 3.48Å; F32-F54 VanDerWaalsContact CB-CE1 3.48Å; F32-F54 HydrophobicContact CB-CZ 3.97Å; F32-F54 HydrophobicContact CD2-CZ 4.14Å; F32-F54 HydrophobicContact CG-CE1 4.14Å; F32-F54 HydrophobicContact CG-CZ 4.21Å; F32-F64 AromaticContact CD1-CD2 3.75Å; F32-F64 HydrophobicContact CD1-CD2 3.75Å; F32-F64 AromaticContact CD1-CE2 3.83Å; F32-F64 HydrophobicContact CD1-CE2 3.83Å; F32-F64 AromaticContact CE1-CD2 4Å; F32-F64 HydrophobicContact CE1-CD2 4Å; F32-F64 HydrophobicContact CE1-CE2 4.42Å; F32-F64 HydrophobicContact CG-CD2 4.32Å; F32-F64 HydrophobicContact CG-CE2 4.46Å; F32-A69 HydrophobicContact CE1-CB 4.3Å; F32-A69 HydrophobicContact CZ-CB 3.95Å; F32-Y72 HydrophobicContact CD1-CD2 4.47Å; F32-Y72 HydrophobicContact CE1-CD2 4.12Å; F32-Y72 HydrophobicContact CE1-CG 4.38Å; F32-Y81 AromaticContact CZ-CE1 3.89Å; F32-Y81 HydrophobicContact CZ-CE1 3.89Å
33Y90.9Very high89.1Confident46 Ų4666.8 Ų66.818%0.1830%0.302CS..Hα-helixtrans-56.7-46.9173.6166.4-92.2000112.2M1 A29 F30 S31 V36 R37 Y72 H76M1-Y33 HydrophobicContact CE-CD1 3.76Å; M1-Y33 HydrophobicContact CE-CD2 4.37Å; M1-Y33 HydrophobicContact CE-CG 3.67Å; M1-Y33 HydrophobicContact SD-CD2 4.39Å; M1-Y33 HydrophobicContact SD-CG 4.23Å; A29-Y33 WeakPolarHBondContact O-CB 3.46Å; A29-Y33 PolarHBondContact O-N 3.31Å; F30-Y33 WeakPolarHBondContact O-CB 3.38Å; F30-Y33 PolarHBondContact O-N 2.9Å; S31-Y33 PolarHBondContact O-N 2.9Å; Y33-V36 PolarHBondContact O-N 2.91Å; Y33-R37 WeakPolarHBondContact O-CB 3.43Å; Y33-R37 PolarHBondContact O-N 3.21Å; Y33-Y72 AromaticContact CD2-CD1 3.76Å; Y33-Y72 HydrophobicContact CD2-CD1 3.76Å; Y33-Y72 AromaticContact CD2-CE1 3.71Å; Y33-Y72 HydrophobicContact CD2-CE1 3.71Å; Y33-Y72 HydrophobicContact CG-CE1 4.38Å; Y33-H76 AromaticContact CD2-NE2 3.61Å; Y33-H76 AromaticContact CE2-CE1 3.66Å; Y33-H76 AromaticContact CE2-NE2 3.05Å; Y33-H76 WeakPolarHBondContact CE2-NE2 3.43Å; Y33-H76 AromaticContact CZ-CE1 3.81Å; Y33-H76 AromaticContact CZ-NE2 3.64Å
34C94.3Very high90.2Very high18 Ų1861.3 Ų61.312%0.12229%0.285CS..Hα-helixtrans-61.6-44.9177.4-72.50000111.3F30 S31 F32 V36 R37 E38F30-C34 WeakPolarHBondContact CE1-SG 3.45Å; F30-C34 PolarHBondContact O-N 3.22Å; F30-C34 PolarHBondContact O-SG 2.88Å; F30-C34 VanDerWaalsContact O-SG 3.38Å; S31-C34 PolarHBondContact O-N 3.48Å; F32-C34 VanDerWaalsContact C-N 3.34Å; F32-C34 PolarHBondContact O-N 3.27Å; C34-V36 PolarHBondContact O-N 2.85Å; C34-R37 PolarHBondContact O-N 2.86Å; C34-E38 VanDerWaalsContact O-CB 3.31Å; C34-E38 WeakPolarHBondContact O-CB 3.44Å; C34-E38 VanDerWaalsContact O-CG 3.32Å; C34-E38 WeakPolarHBondContact O-CG 3.48Å; C34-E38 PolarHBondContact O-N 3.36Å
35A96.1Very high91.4Very high4 Ų457.5 Ų57.53%0.03327%0.267CS..Hα-helixtrans-59.4-44177.700000112.9S31 F32 E38 Q39 L40 L45 M48S31-A35 WeakPolarHBondContact O-CB 3.46Å; S31-A35 PolarHBondContact O-N 2.63Å; F32-A35 PolarHBondContact O-N 2.8Å; A35-E38 PolarHBondContact O-N 3.48Å; A35-Q39 PolarHBondContact O-N 2.69Å; A35-L40 HydrophobicContact CB-CD1 3.65Å; A35-L40 HydrophobicContact CB-CG 4.21Å; A35-L40 WeakPolarHBondContact O-CG 3.2Å; A35-L40 PolarHBondContact O-N 3.35Å; A35-L40 VanDerWaalsContact O-N 3.08Å; A35-L45 HydrophobicContact CB-CD2 3.62Å; A35-M48 HydrophobicContact CB-CE 3.96Å; A35-M48 HydrophobicContact CB-SD 3.69Å
36V96.4Very high92.4Very high0 Ų058 Ų580%027%0.268CS..Hα-helixtrans-66.5-43.4176.2176.50000111F32 Y33 C34 E38 Q39 L45 H76 H78 Y81F32-V36 HydrophobicContact CD1-CG2 4.16Å; F32-V36 HydrophobicContact CE1-CG2 3.76Å; F32-V36 HydrophobicContact CE2-CG2 4.22Å; F32-V36 HydrophobicContact CZ-CG2 3.79Å; F32-V36 WeakPolarHBondContact O-CG2 3.27Å; F32-V36 PolarHBondContact O-N 3.17Å; Y33-V36 PolarHBondContact O-N 2.91Å; C34-V36 PolarHBondContact O-N 2.85Å; V36-E38 VanDerWaalsContact C-N 3.29Å; V36-E38 PolarHBondContact O-N 3.34Å; V36-Q39 PolarHBondContact O-N 3.19Å; V36-Q39 VanDerWaalsContact O-N 3.08Å; V36-L45 HydrophobicContact CG2-CD1 4.3Å; V36-L45 HydrophobicContact CG2-CD2 3.88Å; V36-H76 HydrophobicContact CG1-CB 4.31Å; V36-H78 HydrophobicContact CG1-CB 4.32Å; V36-Y81 HydrophobicContact CG2-CD1 4.34Å; V36-Y81 HydrophobicContact CG2-CE1 4.19Å
37R96Very high93.2Very high115 Ų11557.7 Ų57.743%0.43427%0.267SS..Hα-helixtrans-61.9-37.3177.5-179-172.267.8-178.7-3.4112.3Y33 C34 Q39Y33-R37 WeakPolarHBondContact O-CB 3.43Å; Y33-R37 PolarHBondContact O-N 3.21Å; C34-R37 PolarHBondContact O-N 2.86Å; R37-Q39 PolarHBondContact O-N 2.94Å
38E97.4Very high93.7Very high115 Ų11551.7 Ų51.754%0.53725%0.246SC..THydrogen-bonded Turntrans-80.34.9177.5-72.1164.5-158.800112.8C34 A35 V36 L40C34-E38 VanDerWaalsContact O-CB 3.31Å; C34-E38 WeakPolarHBondContact O-CB 3.44Å; C34-E38 VanDerWaalsContact O-CG 3.32Å; C34-E38 WeakPolarHBondContact O-CG 3.48Å; C34-E38 PolarHBondContact O-N 3.36Å; A35-E38 PolarHBondContact O-N 3.48Å; V36-E38 VanDerWaalsContact C-N 3.29Å; V36-E38 PolarHBondContact O-N 3.34Å; E38-L40 VanDerWaalsContact C-N 3.27Å; E38-L40 HydrophobicContact CB-CD2 4.46Å; E38-L40 HydrophobicContact CB-CG 4.47Å; E38-L40 PolarHBondContact O-N 3.16Å
39Q97.3Very high94.1Very high115 Ų11552 Ų5254%0.53725%0.245SC..THydrogen-bonded Turntrans53.640179-59.4-165.93.400114A35 V36 R37 H78A35-Q39 PolarHBondContact O-N 2.69Å; V36-Q39 PolarHBondContact O-N 3.19Å; V36-Q39 VanDerWaalsContact O-N 3.08Å; R37-Q39 PolarHBondContact O-N 2.94Å; Q39-H78 VanDerWaalsContact CA-CD2 3.49Å; Q39-H78 WeakPolarHBondContact CA-CD2 3.49Å; Q39-H78 WeakPolarHBondContact CA-NE2 3.39Å
40L97.9Very high94.2Very high53 Ų5355.5 Ų55.528%0.27727%0.269SS..  trans-59154.9176.2-62.9-169.9000111.6A35 E38 L44 L45 H78A35-L40 HydrophobicContact CB-CD1 3.65Å; A35-L40 HydrophobicContact CB-CG 4.21Å; A35-L40 WeakPolarHBondContact O-CG 3.2Å; A35-L40 PolarHBondContact O-N 3.35Å; A35-L40 VanDerWaalsContact O-N 3.08Å; E38-L40 VanDerWaalsContact C-N 3.27Å; E38-L40 HydrophobicContact CB-CD2 4.46Å; E38-L40 HydrophobicContact CB-CG 4.47Å; E38-L40 PolarHBondContact O-N 3.16Å; L40-L44 HydrophobicContact CB-CD2 4.34Å; L40-L44 HydrophobicContact CD1-CD2 3.74Å; L40-L45 HydrophobicContact CB-CD2 4.2Å; L40-L45 HydrophobicContact CB-CG 4.41Å; L40-L45 VanDerWaalsContact O-CD1 3.29Å; L40-L45 WeakPolarHBondContact O-CD1 3.15Å; L40-H78 PolarHBondContact O-NE2 3.48Å
41P97.9Very high93.9Very high62 Ų6256.7 Ų56.740%0.40328%0.278SS..  trans-58.8146.9-177.9-26.235.6000113.3W43 L44 L45P41-W43 VanDerWaalsContact C-N 3.26Å; P41-W43 HydrophobicContact CB-CG 4.38Å; P41-W43 VanDerWaalsContact CB-NE1 3.27Å; P41-W43 PolarHBondContact O-N 3.31Å; P41-W43 VanDerWaalsContact O-N 3.15Å; P41-L44 PolarHBondContact O-N 3.38Å; P41-L45 PolarHBondContact O-N 3.04Å; P41-L45 VanDerWaalsContact O-N 3.14Å
42V97.6Very high93.2Very high32 Ų3257 Ų5719%0.19427%0.274CS..Hα-helixtrans-51.8-41.1-177.1173.30000113.4L44 L45 E46 D80 Y81 Y84V42-L44 VanDerWaalsContact C-N 3.34Å; V42-L44 PolarHBondContact O-N 3.45Å; V42-L45 PolarHBondContact O-N 3.25Å; V42-E46 PolarHBondContact O-N 3.11Å; V42-D80 HydrophobicContact CG2-CB 4.21Å; V42-Y81 HydrophobicContact CG1-CD2 4.23Å; V42-Y81 HydrophobicContact CG2-CD2 4.41Å; V42-Y84 HydrophobicContact CG1-CD1 3.66Å; V42-Y84 HydrophobicContact CG1-CD2 3.48Å; V42-Y84 VanDerWaalsContact CG1-CD2 3.48Å; V42-Y84 HydrophobicContact CG1-CE1 4.22Å; V42-Y84 HydrophobicContact CG1-CE2 4.02Å; V42-Y84 HydrophobicContact CG1-CG 3.26Å
43W96.4Very high92Very high172 Ų17259.7 Ų59.765%0.65229%0.291SS*.Hα-helixtrans-62.7-40.8-178.761.6-97.5000112.1P41 E46 E47P41-W43 VanDerWaalsContact C-N 3.26Å; P41-W43 HydrophobicContact CB-CG 4.38Å; P41-W43 VanDerWaalsContact CB-NE1 3.27Å; P41-W43 PolarHBondContact O-N 3.31Å; P41-W43 VanDerWaalsContact O-N 3.15Å; W43-E46 PolarHBondContact O-N 3.02Å; W43-E47 WeakPolarHBondContact O-CB 3.4Å; W43-E47 PolarHBondContact O-N 2.88Å
44L96.4Very high90.7Very high47 Ų4757.7 Ų57.725%0.24628%0.283CS..Hα-helixtrans-71.6-40.4179.6-178.658.9000110.7L40 P41 V42 E46 E47 M48L40-L44 HydrophobicContact CB-CD2 4.34Å; L40-L44 HydrophobicContact CD1-CD2 3.74Å; P41-L44 PolarHBondContact O-N 3.38Å; V42-L44 VanDerWaalsContact C-N 3.34Å; V42-L44 PolarHBondContact O-N 3.45Å; L44-E46 VanDerWaalsContact C-N 3.32Å; L44-E46 PolarHBondContact O-N 3.31Å; L44-E47 PolarHBondContact O-N 2.84Å; L44-M48 HydrophobicContact CG-SD 4.46Å; L44-M48 VanDerWaalsContact O-CG 3.31Å; L44-M48 WeakPolarHBondContact O-CG 2.8Å; L44-M48 PolarHBondContact O-N 3.44Å
45L96.8Very high89.3Confident0 Ų057 Ų570%028%0.279CS..Hα-helixtrans-61.7-40.2175.5-66178.4000111.8A35 V36 L40 P41 V42 R49 Y81A35-L45 HydrophobicContact CB-CD2 3.62Å; V36-L45 HydrophobicContact CG2-CD1 4.3Å; V36-L45 HydrophobicContact CG2-CD2 3.88Å; L40-L45 HydrophobicContact CB-CD2 4.2Å; L40-L45 HydrophobicContact CB-CG 4.41Å; L40-L45 VanDerWaalsContact O-CD1 3.29Å; L40-L45 WeakPolarHBondContact O-CD1 3.15Å; P41-L45 PolarHBondContact O-N 3.04Å; P41-L45 VanDerWaalsContact O-N 3.14Å; V42-L45 PolarHBondContact O-N 3.25Å; L45-R49 VanDerWaalsContact O-CB 3.24Å; L45-R49 WeakPolarHBondContact O-CB 3.32Å; L45-R49 PolarHBondContact O-N 2.89Å; L45-Y81 HydrophobicContact CB-CD2 4.25Å; L45-Y81 HydrophobicContact CB-CE1 4.19Å; L45-Y81 HydrophobicContact CB-CE2 3.91Å; L45-Y81 HydrophobicContact CD1-CD1 3.66Å; L45-Y81 HydrophobicContact CD1-CD2 4.07Å; L45-Y81 HydrophobicContact CD1-CE1 4.07Å; L45-Y81 HydrophobicContact CD1-CE2 4.46Å; L45-Y81 HydrophobicContact CD1-CG 3.67Å
46E95.9Very high87.7Confident17 Ų1761.5 Ų61.58%0.07930%0.295CS..Hα-helixtrans-72.8-33.4176.3-74.6-6498.200113.4V42 W43 L44 R49 S50 Y81 Y84 Y89V42-E46 PolarHBondContact O-N 3.11Å; W43-E46 PolarHBondContact O-N 3.02Å; L44-E46 VanDerWaalsContact C-N 3.32Å; L44-E46 PolarHBondContact O-N 3.31Å; E46-R49 PolarHBondContact O-N 3.24Å; E46-R49 IonicContact OE1-CZ 3.93Å; E46-R49 IonicContact OE1-NE 2.74Å; E46-R49 PolarHBondContact OE1-NE 3.18Å; E46-R49 IonicContact OE1-NH2 2.67Å; E46-R49 IonicContact OE2-CZ 2.74Å; E46-R49 IonicContact OE2-NE 3.96Å; E46-R49 PolarHBondContact OE2-NE 2.85Å; E46-R49 IonicContact OE2-NH2 3.03Å; E46-R49 PolarHBondContact OE2-NH2 3.12Å; E46-S50 VanDerWaalsContact O-CB 3.28Å; E46-S50 WeakPolarHBondContact O-CB 3.38Å; E46-S50 PolarHBondContact O-N 2.97Å; E46-S50 PolarHBondContact O-OG 2.91Å; E46-Y81 HydrophobicContact CG-CE2 4.06Å; E46-Y81 VanDerWaalsContact OE1-CE2 3.26Å; E46-Y81 WeakPolarHBondContact OE1-CE2 3.33Å; E46-Y81 PolarHBondContact OE1-OH 3.04Å; E46-Y84 HydrophobicContact CG-CD1 4.05Å; E46-Y84 HydrophobicContact CG-CE1 3.31Å; E46-Y84 WeakPolarHBondContact OE2-CE1 2.99Å; E46-Y89 PolarHBondContact OE2-OH 3.34Å
47E93.4Very high86.3Confident85 Ų8562.7 Ų62.740%0.39730%0.301SS..Hα-helixtrans-60-53.6170.9-173.4173.3-16100110W43 L44 R49 S50 M51W43-E47 WeakPolarHBondContact O-CB 3.4Å; W43-E47 PolarHBondContact O-N 2.88Å; L44-E47 PolarHBondContact O-N 2.84Å; E47-R49 PolarHBondContact O-N 3.34Å; E47-S50 PolarHBondContact O-N 3.41Å; E47-S50 PolarHBondContact O-OG 2.9Å; E47-M51 HydrophobicContact CG-CE 3.77Å; E47-M51 HydrophobicContact CG-CG 4.4Å; E47-M51 HydrophobicContact CG-SD 3.66Å; E47-M51 WeakPolarHBondContact O-CB 3.45Å; E47-M51 WeakPolarHBondContact O-CG 3.48Å; E47-M51 PolarHBondContact O-N 3.43Å
48M92.2Very high84.8Confident26 Ų2664.6 Ų64.613%0.12832%0.32CS..Hα-helixtrans-55.2-52.8174.6-67.1177.176.500110.8F32 A35 L44 S50 M51 E52 F54F32-M48 HydrophobicContact CD2-CB 4.12Å; A35-M48 HydrophobicContact CB-CE 3.96Å; A35-M48 HydrophobicContact CB-SD 3.69Å; L44-M48 HydrophobicContact CG-SD 4.46Å; L44-M48 VanDerWaalsContact O-CG 3.31Å; L44-M48 WeakPolarHBondContact O-CG 2.8Å; L44-M48 PolarHBondContact O-N 3.44Å; M48-S50 PolarHBondContact O-N 3.3Å; M48-M51 PolarHBondContact O-N 3.05Å; M48-E52 WeakPolarHBondContact O-CB 3.48Å; M48-E52 PolarHBondContact O-N 3.2Å; M48-F54 WeakPolarHBondContact O-CE2 3.22Å; M48-F54 WeakPolarHBondContact O-CZ 3.24Å
49R91.9Very high83.3Confident23 Ų2362 Ų629%0.08732%0.324CS..Hα-helixtrans-57.4-35.7-176.9-165.2-171.558.569.76.8112.8F32 L45 E46 E47 F54 A63 F64 A69 Y81 Y89F32-R49 HydrophobicContact CE2-CB 3.86Å; F32-R49 HydrophobicContact CE2-CG 4.33Å; F32-R49 HydrophobicContact CZ-CB 4.36Å; F32-R49 HydrophobicContact CZ-CG 4.37Å; L45-R49 VanDerWaalsContact O-CB 3.24Å; L45-R49 WeakPolarHBondContact O-CB 3.32Å; L45-R49 PolarHBondContact O-N 2.89Å; E46-R49 PolarHBondContact O-N 3.24Å; E46-R49 IonicContact OE1-CZ 3.93Å; E46-R49 IonicContact OE1-NE 2.74Å; E46-R49 PolarHBondContact OE1-NE 3.18Å; E46-R49 IonicContact OE1-NH2 2.67Å; E46-R49 IonicContact OE2-CZ 2.74Å; E46-R49 IonicContact OE2-NE 3.96Å; E46-R49 PolarHBondContact OE2-NE 2.85Å; E46-R49 IonicContact OE2-NH2 3.03Å; E46-R49 PolarHBondContact OE2-NH2 3.12Å; E47-R49 PolarHBondContact O-N 3.34Å; R49-F54 VanDerWaalsContact CA-CE2 3.48Å; R49-F54 WeakPolarHBondContact O-CE2 3.45Å; R49-A63 VanDerWaalsContact O-CB 3.29Å; R49-A63 WeakPolarHBondContact O-CB 3.34Å; R49-F64 HydrophobicContact CG-CB 3.97Å; R49-F64 WeakPolarHBondContact CG-O 3.48Å; R49-F64 PolarHBondContact NH1-O 3.36Å; R49-A69 VanDerWaalsContact CD-CB 3.49Å; R49-A69 HydrophobicContact CG-CB 4.44Å; R49-Y81 WeakPolarHBondContact CD-OH 3.4Å; R49-Y89 PolarHBondContact NH2-OH 3.3Å
50S86.1Confident81.9Confident73 Ų7359.5 Ų59.551%0.5132%0.319SS..Hα-helixtrans-91.4-28-174.660.50000114.2E46 E47 M48E46-S50 VanDerWaalsContact O-CB 3.28Å; E46-S50 WeakPolarHBondContact O-CB 3.38Å; E46-S50 PolarHBondContact O-N 2.97Å; E46-S50 PolarHBondContact O-OG 2.91Å; E47-S50 PolarHBondContact O-N 3.41Å; E47-S50 PolarHBondContact O-OG 2.9Å; M48-S50 PolarHBondContact O-N 3.3Å
51M78.6Confident80.8Confident138 Ų13860.5 Ų60.568%0.6833%0.329SS*.Hα-helixtrans-96.2-28.2-175.2-64.7-170.4-178.500113.7E47 M48E47-M51 HydrophobicContact CG-CE 3.77Å; E47-M51 HydrophobicContact CG-CG 4.4Å; E47-M51 HydrophobicContact CG-SD 3.66Å; E47-M51 WeakPolarHBondContact O-CB 3.45Å; E47-M51 WeakPolarHBondContact O-CG 3.48Å; E47-M51 PolarHBondContact O-N 3.43Å; M48-M51 PolarHBondContact O-N 3.05Å
52E75.5Confident80.1Confident55 Ų5560.2 Ų60.226%0.25732%0.32SS..SBendtrans-92.6155-178-65.3176.9-16100112.3T28 M48 F54T28-E52 VanDerWaalsContact CB-OE2 3.28Å; T28-E52 WeakPolarHBondContact CB-OE2 3.42Å; T28-E52 HydrophobicContact CG2-CB 4.27Å; T28-E52 HydrophobicContact CG2-CG 4.39Å; M48-E52 WeakPolarHBondContact O-CB 3.48Å; M48-E52 PolarHBondContact O-N 3.2Å; E52-F54 HydrophobicContact CB-CD1 4.41Å; E52-F54 HydrophobicContact CB-CD2 4.31Å; E52-F54 HydrophobicContact CB-CE1 3.74Å; E52-F54 HydrophobicContact CB-CE2 3.59Å; E52-F54 HydrophobicContact CB-CZ 3.34Å; E52-F54 HydrophobicContact CG-CZ 4.16Å; E52-F54 VanDerWaalsContact O-CD2 3.31Å; E52-F54 WeakPolarHBondContact O-CD2 3.33Å; E52-F54 WeakPolarHBondContact O-CE2 3.37Å; E52-F54 WeakPolarHBondContact OE2-CE1 3.44Å; E52-F54 WeakPolarHBondContact OE2-CZ 3.34Å
53V67.1Low79.5Confident58 Ų5860.1 Ų60.135%0.35232%0.322SS..  trans-95.5121.3172.8176.90000108.2C25 T28 P61C25-V53 WeakPolarHBondContact SG-CG1 3.48Å; T28-V53 WeakPolarHBondContact CB-O 3.38Å; T28-V53 PolarHBondContact OG1-O 3.24Å; V53-P61 HydrophobicContact CB-CB 4.23Å; V53-P61 HydrophobicContact CG1-CB 3.13Å; V53-P61 HydrophobicContact CG2-CB 4.09Å
54F63.1Low79.1Confident3 Ų352.1 Ų52.11%0.01329%0.292CS..  trans-117-28.6-171.2-64.1-70.2000114.6T28 A29 F32 M48 R49 E52 R62 F64T28-F54 WeakPolarHBondContact O-CE1 3.41Å; A29-F54 HydrophobicContact CB-CD1 4.32Å; F32-F54 HydrophobicContact CB-CD1 4.19Å; F32-F54 HydrophobicContact CB-CE1 3.48Å; F32-F54 VanDerWaalsContact CB-CE1 3.48Å; F32-F54 HydrophobicContact CB-CZ 3.97Å; F32-F54 HydrophobicContact CD2-CZ 4.14Å; F32-F54 HydrophobicContact CG-CE1 4.14Å; F32-F54 HydrophobicContact CG-CZ 4.21Å; M48-F54 WeakPolarHBondContact O-CE2 3.22Å; M48-F54 WeakPolarHBondContact O-CZ 3.24Å; R49-F54 VanDerWaalsContact CA-CE2 3.48Å; R49-F54 WeakPolarHBondContact O-CE2 3.45Å; E52-F54 HydrophobicContact CB-CD1 4.41Å; E52-F54 HydrophobicContact CB-CD2 4.31Å; E52-F54 HydrophobicContact CB-CE1 3.74Å; E52-F54 HydrophobicContact CB-CE2 3.59Å; E52-F54 HydrophobicContact CB-CZ 3.34Å; E52-F54 HydrophobicContact CG-CZ 4.16Å; E52-F54 VanDerWaalsContact O-CD2 3.31Å; E52-F54 WeakPolarHBondContact O-CD2 3.33Å; E52-F54 WeakPolarHBondContact O-CE2 3.37Å; E52-F54 WeakPolarHBondContact OE2-CE1 3.44Å; E52-F54 WeakPolarHBondContact OE2-CZ 3.34Å; F54-R62 PolarHBondContact N-O 3.38Å; F54-F64 HydrophobicContact CB-CD1 3.68Å; F54-F64 HydrophobicContact CB-CD2 3.64Å; F54-F64 HydrophobicContact CB-CE1 3.61Å; F54-F64 HydrophobicContact CB-CE2 3.6Å; F54-F64 HydrophobicContact CB-CG 3.68Å; F54-F64 HydrophobicContact CB-CZ 3.59Å; F54-F64 HydrophobicContact CD1-CD2 4Å; F54-F64 AromaticContact CD1-CE2 3.88Å; F54-F64 HydrophobicContact CD1-CE2 3.88Å; F54-F64 HydrophobicContact CD2-CB 4.17Å; F54-F64 AromaticContact CD2-CD2 3.84Å; F54-F64 HydrophobicContact CD2-CD2 3.84Å; F54-F64 HydrophobicContact CD2-CE2 4.47Å; F54-F64 AromaticContact CD2-CG 4Å; F54-F64 HydrophobicContact CD2-CG 4Å; F54-F64 HydrophobicContact CE2-CD2 4.45Å; F54-F64 HydrophobicContact CG-CD1 4.41Å; F54-F64 AromaticContact CG-CD2 3.54Å; F54-F64 HydrophobicContact CG-CD2 3.54Å; F54-F64 AromaticContact CG-CE2 3.73Å; F54-F64 HydrophobicContact CG-CE2 3.73Å; F54-F64 AromaticContact CG-CG 3.91Å; F54-F64 HydrophobicContact CG-CG 3.91Å; F54-F64 HydrophobicContact CG-CZ 4.24Å
55C64.6Low78.7Confident5 Ų553.4 Ų53.43%0.03430%0.297CS..EExtended strand (participates in β ladder)trans-133.4150.5-176.963.30000112.2R62 F64C55-R62 PolarHBondContact N-O 3.34Å; C55-R62 PolarHBondContact O-N 3.3Å; C55-F64 HydrophobicContact CB-CE1 4.27Å
56W64.4Low78.6Confident98 Ų9854.4 Ų54.437%0.37130%0.303SS..EExtended strand (participates in β ladder)trans-97.8102.7167.4-81.674.7000107.6C21 C25 G59C21-W56 HydrophobicContact CB-CH2 4.1Å; C21-W56 HydrophobicContact CB-CZ2 3.38Å; C21-W56 PolarHBondContact O-NE1 3.24Å; C21-W56 VanDerWaalsContact O-NE1 3.09Å; C25-W56 PolarHBondContact SG-NE1 2.9Å; W56-G59 WeakPolarHBondContact CZ3-O 3.24Å
57D65.6Low78.4Confident25 Ų2553.6 Ų53.613%0.13430%0.3CS..EExtended strand (participates in β ladder)trans-114.1123.6177.6-167.915.8000108.6G59 S60 R62D57-G59 PolarHBondContact O-N 3.03Å; D57-G59 VanDerWaalsContact O-N 3.14Å; D57-S60 PolarHBondContact N-O 3.44Å; D57-S60 PolarHBondContact O-N 3.48Å; D57-S60 PolarHBondContact O-OG 3.23Å; D57-R62 IonicContact OD2-CZ 3.62Å; D57-R62 IonicContact OD2-NH1 3.87Å; D57-R62 PolarHBondContact OD2-NH1 3.3Å
58N64Low78.2Confident154 Ų15449.6 Ų49.682%0.82428%0.281SS*.THydrogen-bonded Turntrans49.437.1-176-57.7-44.2000114.7S60N58-S60 VanDerWaalsContact C-N 3.31Å; N58-S60 PolarHBondContact O-N 2.92Å
59G66.1Low78.3Confident61 Ų6148.3 Ų48.363%0.62928%0.275SS*.THydrogen-bonded Turntrans78.810.4179.500000114.7W56 D57W56-G59 WeakPolarHBondContact CZ3-O 3.24Å; D57-G59 PolarHBondContact O-N 3.03Å; D57-G59 VanDerWaalsContact O-N 3.14Å
60S68.7Low78.4Confident62 Ų6247.2 Ų47.243%0.43427%0.271SS..EExtended strand (participates in β ladder)trans-121.1140177.667.50000112.5D57 N58D57-S60 PolarHBondContact N-O 3.44Å; D57-S60 PolarHBondContact O-N 3.48Å; D57-S60 PolarHBondContact O-OG 3.23Å; N58-S60 VanDerWaalsContact C-N 3.31Å; N58-S60 PolarHBondContact O-N 2.92Å
61P74.3Confident78.7Confident75 Ų7544.3 Ų44.349%0.48725%0.249SC..EExtended strand (participates in β ladder)trans-66.5130.2171.824.9-31.5000111.2V53V53-P61 HydrophobicContact CB-CB 4.23Å; V53-P61 HydrophobicContact CG1-CB 3.13Å; V53-P61 HydrophobicContact CG2-CB 4.09Å
62R83.4Confident79.4Confident55 Ų5538 Ų3821%0.20822%0.218CC..EExtended strand (participates in β ladder)trans-138.4149.3177.6-160.2-167.276.9-167.30.7112.8F54 C55 D57 E68F54-R62 PolarHBondContact N-O 3.38Å; C55-R62 PolarHBondContact N-O 3.34Å; C55-R62 PolarHBondContact O-N 3.3Å; D57-R62 IonicContact OD2-CZ 3.62Å; D57-R62 IonicContact OD2-NH1 3.87Å; D57-R62 PolarHBondContact OD2-NH1 3.3Å; R62-E68 IonicContact CZ-OE1 2.65Å; R62-E68 IonicContact NH2-OE1 3.1Å; R62-E68 PolarHBondContact NH2-OE1 3.36Å; R62-E68 IonicContact NH2-OE2 3.22Å; R62-E68 PolarHBondContact NH2-OE2 2.91Å
63A85.8Confident80.5Confident30 Ų3035.4 Ų35.425%0.24821%0.206CC..PPolyproline II helixtrans-64156.9163.700000112.3R49R49-A63 VanDerWaalsContact O-CB 3.29Å; R49-A63 WeakPolarHBondContact O-CB 3.34Å
64F87.1Confident81.9Confident5 Ų532.6 Ų32.62%0.02219%0.189CC..PPolyproline II helixtrans-69.7136172.3-78.3-36.4000110.8A29 F32 R49 F54 C55 E68 Y72 F101A29-F64 HydrophobicContact CB-CE2 4.26Å; A29-F64 HydrophobicContact CB-CZ 3.92Å; F32-F64 AromaticContact CD1-CD2 3.75Å; F32-F64 HydrophobicContact CD1-CD2 3.75Å; F32-F64 AromaticContact CD1-CE2 3.83Å; F32-F64 HydrophobicContact CD1-CE2 3.83Å; F32-F64 AromaticContact CE1-CD2 4Å; F32-F64 HydrophobicContact CE1-CD2 4Å; F32-F64 HydrophobicContact CE1-CE2 4.42Å; F32-F64 HydrophobicContact CG-CD2 4.32Å; F32-F64 HydrophobicContact CG-CE2 4.46Å; R49-F64 HydrophobicContact CG-CB 3.97Å; R49-F64 WeakPolarHBondContact CG-O 3.48Å; R49-F64 PolarHBondContact NH1-O 3.36Å; F54-F64 HydrophobicContact CB-CD1 3.68Å; F54-F64 HydrophobicContact CB-CD2 3.64Å; F54-F64 HydrophobicContact CB-CE1 3.61Å; F54-F64 HydrophobicContact CB-CE2 3.6Å; F54-F64 HydrophobicContact CB-CG 3.68Å; F54-F64 HydrophobicContact CB-CZ 3.59Å; F54-F64 HydrophobicContact CD1-CD2 4Å; F54-F64 AromaticContact CD1-CE2 3.88Å; F54-F64 HydrophobicContact CD1-CE2 3.88Å; F54-F64 HydrophobicContact CD2-CB 4.17Å; F54-F64 AromaticContact CD2-CD2 3.84Å; F54-F64 HydrophobicContact CD2-CD2 3.84Å; F54-F64 HydrophobicContact CD2-CE2 4.47Å; F54-F64 AromaticContact CD2-CG 4Å; F54-F64 HydrophobicContact CD2-CG 4Å; F54-F64 HydrophobicContact CE2-CD2 4.45Å; F54-F64 HydrophobicContact CG-CD1 4.41Å; F54-F64 AromaticContact CG-CD2 3.54Å; F54-F64 HydrophobicContact CG-CD2 3.54Å; F54-F64 AromaticContact CG-CE2 3.73Å; F54-F64 HydrophobicContact CG-CE2 3.73Å; F54-F64 AromaticContact CG-CG 3.91Å; F54-F64 HydrophobicContact CG-CG 3.91Å; F54-F64 HydrophobicContact CG-CZ 4.24Å; C55-F64 HydrophobicContact CB-CE1 4.27Å; F64-E68 WeakPolarHBondContact CA-OE2 3.46Å; F64-E68 HydrophobicContact CB-CB 4.28Å; F64-E68 HydrophobicContact CD1-CB 4.16Å; F64-E68 WeakPolarHBondContact CD1-OE2 3.37Å; F64-E68 HydrophobicContact CG-CB 4.4Å; F64-Y72 AromaticContact CE2-CE2 3.97Å; F64-Y72 HydrophobicContact CE2-CE2 3.97Å; F64-Y72 HydrophobicContact CZ-CE2 4.08Å; F64-F101 HydrophobicContact CD1-CE2 4.3Å; F64-F101 HydrophobicContact CD1-CZ 4.13Å; F64-F101 AromaticContact CE1-CE2 4Å; F64-F101 HydrophobicContact CE1-CE2 4Å; F64-F101 AromaticContact CE1-CZ 3.59Å; F64-F101 HydrophobicContact CE1-CZ 3.59Å; F64-F101 HydrophobicContact CZ-CZ 4.19Å
65Q89.3Confident83.3Confident73 Ų7333.4 Ų33.434%0.34119%0.194SC..PPolyproline II helixtrans-72.3157171.2-74.9178.6-11.100111S67 E68 A69Q65-S67 PolarHBondContact O-N 3.03Å; Q65-E68 HydrophobicContact CB-CG 4.34Å; Q65-E68 PolarHBondContact N-OE2 3.45Å; Q65-E68 WeakPolarHBondContact O-CB 3.24Å; Q65-E68 PolarHBondContact O-N 3.34Å; Q65-A69 PolarHBondContact O-N 3.28Å
66P93.3Very high84.9Confident21 Ų2134.7 Ų34.714%0.13620%0.2CC..Hα-helixtrans-53.9-34.5173.6-2836.2000113.3E68 L70 L85 Y89 A93P66-E68 VanDerWaalsContact C-N 3.35Å; P66-L70 WeakPolarHBondContact O-CB 3.27Å; P66-L70 PolarHBondContact O-N 3.48Å; P66-L85 HydrophobicContact CB-CD2 4.17Å; P66-Y89 HydrophobicContact CB-CD1 4.32Å; P66-Y89 HydrophobicContact CB-CD2 3.64Å; P66-Y89 HydrophobicContact CB-CE2 4.13Å; P66-Y89 HydrophobicContact CB-CG 3.76Å; P66-Y89 HydrophobicContact CG-CD1 3.67Å; P66-Y89 HydrophobicContact CG-CD2 3.75Å; P66-Y89 HydrophobicContact CG-CE1 3.83Å; P66-Y89 HydrophobicContact CG-CE2 3.91Å; P66-Y89 HydrophobicContact CG-CG 3.64Å; P66-A93 HydrophobicContact CB-CB 4.29Å
67S91.3Very high86.4Confident1 Ų132.2 Ų32.21%0.00719%0.193CC..Hα-helixtrans-65.7-34.6175.151.50000113.5Q65 A93 R95 H111Q65-S67 PolarHBondContact O-N 3.03Å; S67-A93 WeakPolarHBondContact CA-O 3.29Å; S67-A93 WeakPolarHBondContact CB-O 3.2Å; S67-R95 WeakPolarHBondContact CB-O 3.25Å; S67-H111 PolarHBondContact O-NE2 3.2Å
68E89.8Confident88Confident0 Ų031.3 Ų31.30%019%0.188CC..Hα-helixtrans-75.6-45.4177.8-66.2164.2166.900110.2R62 F64 Q65 P66 L70 L71 Y72 P97 A98 F101R62-E68 IonicContact CZ-OE1 2.65Å; R62-E68 IonicContact NH2-OE1 3.1Å; R62-E68 PolarHBondContact NH2-OE1 3.36Å; R62-E68 IonicContact NH2-OE2 3.22Å; R62-E68 PolarHBondContact NH2-OE2 2.91Å; F64-E68 WeakPolarHBondContact CA-OE2 3.46Å; F64-E68 HydrophobicContact CB-CB 4.28Å; F64-E68 HydrophobicContact CD1-CB 4.16Å; F64-E68 WeakPolarHBondContact CD1-OE2 3.37Å; F64-E68 HydrophobicContact CG-CB 4.4Å; Q65-E68 HydrophobicContact CB-CG 4.34Å; Q65-E68 PolarHBondContact N-OE2 3.45Å; Q65-E68 WeakPolarHBondContact O-CB 3.24Å; Q65-E68 PolarHBondContact O-N 3.34Å; P66-E68 VanDerWaalsContact C-N 3.35Å; E68-L70 VanDerWaalsContact C-N 3.26Å; E68-L70 PolarHBondContact O-N 2.91Å; E68-L71 WeakPolarHBondContact O-CB 3.4Å; E68-L71 PolarHBondContact O-N 3.17Å; E68-L71 VanDerWaalsContact O-N 3.12Å; E68-Y72 WeakPolarHBondContact O-CD2 3.32Å; E68-P97 HydrophobicContact CG-CB 3.94Å; E68-A98 VanDerWaalsContact OE1-CB 3.31Å; E68-A98 WeakPolarHBondContact OE1-CB 3.28Å; E68-A98 PolarHBondContact OE1-N 3.37Å; E68-F101 HydrophobicContact CB-CE2 3.93Å; E68-F101 HydrophobicContact CB-CZ 4Å; E68-F101 VanDerWaalsContact CD-CE2 3.46Å; E68-F101 HydrophobicContact CG-CD2 3.81Å; E68-F101 HydrophobicContact CG-CE2 3.48Å; E68-F101 VanDerWaalsContact CG-CE2 3.48Å; E68-F101 HydrophobicContact CG-CZ 4.06Å
69A93.7Very high89.6Confident0 Ų026.9 Ų26.90%016%0.163CC..Hα-helixtrans-59.3-37175.100000112.5F32 R49 Q65 L71 Y72 A73 Y81 L85F32-A69 HydrophobicContact CE1-CB 4.3Å; F32-A69 HydrophobicContact CZ-CB 3.95Å; R49-A69 VanDerWaalsContact CD-CB 3.49Å; R49-A69 HydrophobicContact CG-CB 4.44Å; Q65-A69 PolarHBondContact O-N 3.28Å; A69-L71 VanDerWaalsContact C-N 3.27Å; A69-L71 PolarHBondContact O-N 3.49Å; A69-Y72 PolarHBondContact O-N 3Å; A69-Y72 VanDerWaalsContact O-N 3.16Å; A69-A73 PolarHBondContact O-N 2.91Å; A69-Y81 HydrophobicContact CB-CE1 4.12Å; A69-L85 HydrophobicContact CB-CD1 3.92Å; A69-L85 HydrophobicContact CB-CD2 4.38Å
70L95.4Very high91.1Very high0 Ų028.6 Ų28.60%016%0.158CC..Hα-helixtrans-61.2-35.8177.2-177.861.8000111.9P66 E68 Y72 A73 I74 A82 L85 L86 A93 L94P66-L70 WeakPolarHBondContact O-CB 3.27Å; P66-L70 PolarHBondContact O-N 3.48Å; E68-L70 VanDerWaalsContact C-N 3.26Å; E68-L70 PolarHBondContact O-N 2.91Å; L70-Y72 VanDerWaalsContact C-N 3.33Å; L70-Y72 PolarHBondContact O-N 3.31Å; L70-A73 PolarHBondContact O-N 3.44Å; L70-I74 HydrophobicContact CD1-CD1 4.36Å; L70-I74 HydrophobicContact CD1-CG1 4.31Å; L70-I74 HydrophobicContact CD2-CD1 4.48Å; L70-I74 HydrophobicContact CG-CD1 3.85Å; L70-I74 HydrophobicContact CG-CG1 4.31Å; L70-I74 WeakPolarHBondContact O-CD1 3.37Å; L70-I74 WeakPolarHBondContact O-CG1 3.32Å; L70-I74 PolarHBondContact O-N 3.34Å; L70-A82 HydrophobicContact CD1-CB 3.99Å; L70-L85 HydrophobicContact CB-CD1 4.04Å; L70-L85 HydrophobicContact CD1-CD1 4.39Å; L70-L86 HydrophobicContact CD1-CD1 4.38Å; L70-L86 HydrophobicContact CD1-CG 4.23Å; L70-L86 HydrophobicContact CD2-CD2 3.8Å; L70-L86 HydrophobicContact CD2-CG 4.34Å; L70-A93 HydrophobicContact CD2-CB 4.21Å; L70-A93 WeakPolarHBondContact CD2-O 3.44Å; L70-L94 HydrophobicContact CD2-CD2 3.84Å
71L92.4Very high92.6Very high12 Ų1225.7 Ų25.76%0.06314%0.137CC..Hα-helixtrans-61.6-42.5176.1-67.2174.3000111.7E68 A69 I74 V75 P97 F101 P110 V114 L151E68-L71 WeakPolarHBondContact O-CB 3.4Å; E68-L71 PolarHBondContact O-N 3.17Å; E68-L71 VanDerWaalsContact O-N 3.12Å; A69-L71 VanDerWaalsContact C-N 3.27Å; A69-L71 PolarHBondContact O-N 3.49Å; L71-I74 PolarHBondContact O-N 3.36Å; L71-V75 VanDerWaalsContact O-CG2 3.24Å; L71-V75 WeakPolarHBondContact O-CG2 3.48Å; L71-V75 PolarHBondContact O-N 2.85Å; L71-P97 HydrophobicContact CD1-CG 3.79Å; L71-F101 HydrophobicContact CD1-CD1 4.36Å; L71-P110 HydrophobicContact CD2-CB 4.39Å; L71-P110 HydrophobicContact CD2-CG 4.42Å; L71-V114 HydrophobicContact CD2-CB 4.29Å; L71-V114 HydrophobicContact CD2-CG2 4.09Å; L71-L151 HydrophobicContact CD1-CD1 4.37Å
72Y93.1Very high93.7Very high5 Ų522.1 Ų22.12%0.0211%0.114CC..Hα-helixtrans-63.9-43.3175.1-70.3-82.8000111.6F32 Y33 F64 E68 A69 L70 I74 V75 H76 F101F32-Y72 HydrophobicContact CD1-CD2 4.47Å; F32-Y72 HydrophobicContact CE1-CD2 4.12Å; F32-Y72 HydrophobicContact CE1-CG 4.38Å; Y33-Y72 AromaticContact CD2-CD1 3.76Å; Y33-Y72 HydrophobicContact CD2-CD1 3.76Å; Y33-Y72 AromaticContact CD2-CE1 3.71Å; Y33-Y72 HydrophobicContact CD2-CE1 3.71Å; Y33-Y72 HydrophobicContact CG-CE1 4.38Å; F64-Y72 AromaticContact CE2-CE2 3.97Å; F64-Y72 HydrophobicContact CE2-CE2 3.97Å; F64-Y72 HydrophobicContact CZ-CE2 4.08Å; E68-Y72 WeakPolarHBondContact O-CD2 3.32Å; A69-Y72 PolarHBondContact O-N 3Å; A69-Y72 VanDerWaalsContact O-N 3.16Å; L70-Y72 VanDerWaalsContact C-N 3.33Å; L70-Y72 PolarHBondContact O-N 3.31Å; Y72-I74 VanDerWaalsContact C-N 3.32Å; Y72-I74 PolarHBondContact O-N 3.11Å; Y72-V75 PolarHBondContact O-N 3.36Å; Y72-H76 PolarHBondContact O-CD2 2.85Å; Y72-H76 PolarHBondContact O-N 3.45Å; Y72-H76 VanDerWaalsContact O-N 3.12Å; Y72-F101 HydrophobicContact CE2-CE1 4.11Å; Y72-F101 HydrophobicContact CE2-CZ 4.24Å
73A97.4Very high94.4Very high0 Ų024 Ų240%012%0.121CC..Hα-helixtrans-60-42.1176.800000111.8A69 L70 D77 H78 Y81 A82A69-A73 PolarHBondContact O-N 2.91Å; L70-A73 PolarHBondContact O-N 3.44Å; A73-D77 WeakPolarHBondContact O-CA 3.19Å; A73-D77 PolarHBondContact O-N 2.85Å; A73-H78 HydrophobicContact CB-CB 4.39Å; A73-H78 PolarHBondContact O-N 3.2Å; A73-Y81 HydrophobicContact CB-CD1 3.98Å; A73-A82 HydrophobicContact CB-CB 4.13Å
74I96.6Very high95Very high0 Ų026.2 Ų26.20%012%0.123CC..Hα-helixtrans-63.8-50.7176.8-65.5156.9000111.1L70 L71 Y72 H76 D77 H111 V114 V115 R120 I123L70-I74 HydrophobicContact CD1-CD1 4.36Å; L70-I74 HydrophobicContact CD1-CG1 4.31Å; L70-I74 HydrophobicContact CD2-CD1 4.48Å; L70-I74 HydrophobicContact CG-CD1 3.85Å; L70-I74 HydrophobicContact CG-CG1 4.31Å; L70-I74 WeakPolarHBondContact O-CD1 3.37Å; L70-I74 WeakPolarHBondContact O-CG1 3.32Å; L70-I74 PolarHBondContact O-N 3.34Å; L71-I74 PolarHBondContact O-N 3.36Å; Y72-I74 VanDerWaalsContact C-N 3.32Å; Y72-I74 PolarHBondContact O-N 3.11Å; I74-H76 PolarHBondContact O-N 3.41Å; I74-D77 PolarHBondContact O-N 3.44Å; I74-H111 HydrophobicContact CD1-CB 4.02Å; I74-V114 HydrophobicContact CB-CG1 4.23Å; I74-V114 HydrophobicContact CG2-CB 4.42Å; I74-V114 HydrophobicContact CG2-CG1 3.71Å; I74-V115 HydrophobicContact CB-CG2 4.31Å; I74-V115 HydrophobicContact CD1-CG2 3.61Å; I74-V115 HydrophobicContact CG1-CG2 3.7Å; I74-V115 HydrophobicContact CG2-CB 4.16Å; I74-V115 HydrophobicContact CG2-CG2 3.54Å; I74-R120 HydrophobicContact CG2-CB 4.45Å; I74-R120 HydrophobicContact CG2-CG 3.99Å; I74-R120 WeakPolarHBondContact O-CG 3.43Å; I74-R120 PolarHBondContact O-NE 3.44Å; I74-I123 HydrophobicContact CG1-CG2 3.9Å
75V94.1Very high95.5Very high19 Ų1926 Ų2612%0.11512%0.122CC..Hα-helixtrans-55.6-41.7-177.9170.50000110.6W3 L71 Y72 V114 Y118 R120W3-V75 HydrophobicContact CZ2-CG2 4.19Å; L71-V75 VanDerWaalsContact O-CG2 3.24Å; L71-V75 WeakPolarHBondContact O-CG2 3.48Å; L71-V75 PolarHBondContact O-N 2.85Å; Y72-V75 PolarHBondContact O-N 3.36Å; V75-V114 HydrophobicContact CG2-CG1 3.89Å; V75-Y118 HydrophobicContact CB-CE2 4.4Å; V75-Y118 HydrophobicContact CG1-CE1 4.44Å; V75-Y118 HydrophobicContact CG1-CE2 4.41Å; V75-Y118 HydrophobicContact CG2-CD2 4.15Å; V75-Y118 HydrophobicContact CG2-CE2 3.69Å; V75-R120 PolarHBondContact O-NH2 3.38Å
76H96.4Very high95.9Very high33 Ų3322.6 Ų22.615%0.15311%0.107CC..THydrogen-bonded Turntrans-95.96.9-176.6-64.9-61.3000115.4Y33 V36 Y72 I74 H78Y33-H76 AromaticContact CD2-NE2 3.61Å; Y33-H76 AromaticContact CE2-CE1 3.66Å; Y33-H76 AromaticContact CE2-NE2 3.05Å; Y33-H76 WeakPolarHBondContact CE2-NE2 3.43Å; Y33-H76 AromaticContact CZ-CE1 3.81Å; Y33-H76 AromaticContact CZ-NE2 3.64Å; V36-H76 HydrophobicContact CG1-CB 4.31Å; Y72-H76 PolarHBondContact O-CD2 2.85Å; Y72-H76 PolarHBondContact O-N 3.45Å; Y72-H76 VanDerWaalsContact O-N 3.12Å; I74-H76 PolarHBondContact O-N 3.41Å; H76-H78 PolarHBondContact O-N 3.45Å
77D97.4Very high96Very high45 Ų4527.8 Ų27.824%0.24113%0.133CC..THydrogen-bonded Turntrans53.333.6-176.7-144.8-8.7000114.1A73 I74 Q79 R120A73-D77 WeakPolarHBondContact O-CA 3.19Å; A73-D77 PolarHBondContact O-N 2.85Å; I74-D77 PolarHBondContact O-N 3.44Å; D77-Q79 PolarHBondContact O-N 3.14Å; D77-Q79 WeakPolarHBondContact OD1-CG 3.41Å; D77-Q79 PolarHBondContact OD1-NE2 3.37Å; D77-R120 VanDerWaalsContact CB-CZ 3.44Å; D77-R120 VanDerWaalsContact CG-CD 3.5Å; D77-R120 IonicContact OD2-CZ 2.65Å; D77-R120 IonicContact OD2-NE 3.97Å; D77-R120 IonicContact OD2-NH1 3.57Å; D77-R120 PolarHBondContact OD2-NH1 3.01Å
78H98.2Very high96.2Very high6 Ų635.3 Ų35.33%0.02816%0.161CC..  trans-77.879.9177.3-164-28.9000109.2V36 Q39 L40 A73 H76 D80 Y81 A82V36-H78 HydrophobicContact CG1-CB 4.32Å; Q39-H78 VanDerWaalsContact CA-CD2 3.49Å; Q39-H78 WeakPolarHBondContact CA-CD2 3.49Å; Q39-H78 WeakPolarHBondContact CA-NE2 3.39Å; L40-H78 PolarHBondContact O-NE2 3.48Å; A73-H78 HydrophobicContact CB-CB 4.39Å; A73-H78 PolarHBondContact O-N 3.2Å; H76-H78 PolarHBondContact O-N 3.45Å; H78-D80 VanDerWaalsContact C-N 3.31Å; H78-D80 PolarHBondContact O-N 3.34Å; H78-Y81 WeakPolarHBondContact ND1-CB 3.35Å; H78-Y81 PolarHBondContact ND1-N 3.29Å; H78-Y81 VanDerWaalsContact ND1-N 3.19Å; H78-Y81 PolarHBondContact O-N 2.93Å; H78-A82 WeakPolarHBondContact O-CB 3.29Å; H78-A82 PolarHBondContact O-N 2.93Å
79Q98.3Very high96.5Very high62 Ų6238.7 Ų38.729%0.2918%0.175SC..Hα-helixtrans-63-35.7-171.6-67.118024.400112.7D77 R83 I123 M126D77-Q79 PolarHBondContact O-N 3.14Å; D77-Q79 WeakPolarHBondContact OD1-CG 3.41Å; D77-Q79 PolarHBondContact OD1-NE2 3.37Å; Q79-R83 WeakPolarHBondContact O-CB 3.39Å; Q79-R83 PolarHBondContact O-N 2.93Å; Q79-I123 HydrophobicContact CG-CD1 4.36Å; Q79-I123 HydrophobicContact CG-CG1 4.14Å; Q79-M126 HydrophobicContact CB-CE 3.99Å; Q79-M126 HydrophobicContact CG-CE 4.26Å
80D98.3Very high96.4Very high97 Ų9739.8 Ų39.852%0.51918%0.182SC..Hα-helixtrans-68.8-40.7178.8-66.9-27.8000111.4V42 H78 R83 Y84V42-D80 HydrophobicContact CG2-CB 4.21Å; H78-D80 VanDerWaalsContact C-N 3.31Å; H78-D80 PolarHBondContact O-N 3.34Å; D80-R83 PolarHBondContact O-N 3.4Å; D80-R83 IonicContact OD1-CZ 3.71Å; D80-R83 IonicContact OD1-NH1 2.65Å; D80-R83 PolarHBondContact OD1-NH1 3.41Å; D80-Y84 WeakPolarHBondContact O-CB 3.45Å; D80-Y84 PolarHBondContact O-N 3.32Å
81Y98.4Very high96Very high0 Ų042.3 Ų42.30%020%0.198CC..Hα-helixtrans-70.8-41.1176.1-167.9-140.9000112.1F32 V36 V42 L45 E46 R49 A69 A73 H78 R83 Y84 L85F32-Y81 AromaticContact CZ-CE1 3.89Å; F32-Y81 HydrophobicContact CZ-CE1 3.89Å; V36-Y81 HydrophobicContact CG2-CD1 4.34Å; V36-Y81 HydrophobicContact CG2-CE1 4.19Å; V42-Y81 HydrophobicContact CG1-CD2 4.23Å; V42-Y81 HydrophobicContact CG2-CD2 4.41Å; L45-Y81 HydrophobicContact CB-CD2 4.25Å; L45-Y81 HydrophobicContact CB-CE1 4.19Å; L45-Y81 HydrophobicContact CB-CE2 3.91Å; L45-Y81 HydrophobicContact CD1-CD1 3.66Å; L45-Y81 HydrophobicContact CD1-CD2 4.07Å; L45-Y81 HydrophobicContact CD1-CE1 4.07Å; L45-Y81 HydrophobicContact CD1-CE2 4.46Å; L45-Y81 HydrophobicContact CD1-CG 3.67Å; E46-Y81 HydrophobicContact CG-CE2 4.06Å; E46-Y81 VanDerWaalsContact OE1-CE2 3.26Å; E46-Y81 WeakPolarHBondContact OE1-CE2 3.33Å; E46-Y81 PolarHBondContact OE1-OH 3.04Å; R49-Y81 WeakPolarHBondContact CD-OH 3.4Å; A69-Y81 HydrophobicContact CB-CE1 4.12Å; A73-Y81 HydrophobicContact CB-CD1 3.98Å; H78-Y81 WeakPolarHBondContact ND1-CB 3.35Å; H78-Y81 PolarHBondContact ND1-N 3.29Å; H78-Y81 VanDerWaalsContact ND1-N 3.19Å; H78-Y81 PolarHBondContact O-N 2.93Å; Y81-R83 PolarHBondContact O-N 3.4Å; Y81-Y84 HydrophobicContact CD2-CD1 4.34Å; Y81-Y84 HydrophobicContact CE2-CD1 4.28Å; Y81-Y84 PolarHBondContact O-N 2.83Å; Y81-L85 HydrophobicContact CD1-CD1 4.09Å; Y81-L85 HydrophobicContact CD2-CD1 4.36Å; Y81-L85 HydrophobicContact CD2-CG 4.18Å; Y81-L85 HydrophobicContact CE1-CD1 3.88Å; Y81-L85 HydrophobicContact CE2-CD1 4.15Å; Y81-L85 HydrophobicContact CE2-CD2 4Å; Y81-L85 HydrophobicContact CE2-CG 3.93Å; Y81-L85 HydrophobicContact CG-CD1 4.32Å; Y81-L85 VanDerWaalsContact O-CG 3.3Å; Y81-L85 WeakPolarHBondContact O-CG 3.48Å; Y81-L85 PolarHBondContact O-N 2.81Å
82A98.3Very high95.9Very high0 Ų042.6 Ų42.60%020%0.203CC..Hα-helixtrans-58.8-46.4172.900000111.7L70 A73 H78 Y84 L85 L86 I123L70-A82 HydrophobicContact CD1-CB 3.99Å; A73-A82 HydrophobicContact CB-CB 4.13Å; H78-A82 WeakPolarHBondContact O-CB 3.29Å; H78-A82 PolarHBondContact O-N 2.93Å; A82-Y84 PolarHBondContact O-N 3.27Å; A82-L85 PolarHBondContact O-N 3.05Å; A82-L86 WeakPolarHBondContact O-CB 3.45Å; A82-L86 WeakPolarHBondContact O-CD1 3.49Å; A82-L86 VanDerWaalsContact O-CG 3.25Å; A82-L86 WeakPolarHBondContact O-CG 3.49Å; A82-L86 PolarHBondContact O-N 3.16Å; A82-I123 HydrophobicContact CB-CD1 4.05Å; A82-I123 HydrophobicContact CB-CG1 4.15Å; A82-I123 HydrophobicContact CB-CG2 3.99Å
83R98.3Very high95.9Very high94 Ų9442.3 Ų42.336%0.35520%0.202SC..Hα-helixtrans-59.9-45.4176.3-171.5-179-59.7102.10.8111.5Q79 D80 Y81 N87 M126Q79-R83 WeakPolarHBondContact O-CB 3.39Å; Q79-R83 PolarHBondContact O-N 2.93Å; D80-R83 PolarHBondContact O-N 3.4Å; D80-R83 IonicContact OD1-CZ 3.71Å; D80-R83 IonicContact OD1-NH1 2.65Å; D80-R83 PolarHBondContact OD1-NH1 3.41Å; Y81-R83 PolarHBondContact O-N 3.4Å; R83-N87 VanDerWaalsContact O-CB 3.26Å; R83-N87 WeakPolarHBondContact O-CB 3.14Å; R83-N87 VanDerWaalsContact O-CG 3.23Å; R83-N87 PolarHBondContact O-N 2.92Å; R83-M126 HydrophobicContact CB-SD 3.62Å; R83-M126 HydrophobicContact CG-SD 4.15Å
84Y98.3Very high95.6Very high77 Ų7742.6 Ų42.630%0.30220%0.204SC..Hα-helixtrans-59.6-50.1176.7172.1-90.8000111.4V42 E46 D80 Y81 A82 L86 N87 R88 Y89V42-Y84 HydrophobicContact CG1-CD1 3.66Å; V42-Y84 HydrophobicContact CG1-CD2 3.48Å; V42-Y84 VanDerWaalsContact CG1-CD2 3.48Å; V42-Y84 HydrophobicContact CG1-CE1 4.22Å; V42-Y84 HydrophobicContact CG1-CE2 4.02Å; V42-Y84 HydrophobicContact CG1-CG 3.26Å; E46-Y84 HydrophobicContact CG-CD1 4.05Å; E46-Y84 HydrophobicContact CG-CE1 3.31Å; E46-Y84 WeakPolarHBondContact OE2-CE1 2.99Å; D80-Y84 WeakPolarHBondContact O-CB 3.45Å; D80-Y84 PolarHBondContact O-N 3.32Å; Y81-Y84 HydrophobicContact CD2-CD1 4.34Å; Y81-Y84 HydrophobicContact CE2-CD1 4.28Å; Y81-Y84 PolarHBondContact O-N 2.83Å; A82-Y84 PolarHBondContact O-N 3.27Å; Y84-L86 PolarHBondContact O-N 2.76Å; Y84-N87 PolarHBondContact O-N 3.35Å; Y84-R88 HydrophobicContact CE1-CB 4.34Å; Y84-R88 HydrophobicContact CE1-CG 4.47Å; Y84-R88 HydrophobicContact CE2-CB 4.45Å; Y84-R88 WeakPolarHBondContact O-CB 2.89Å; Y84-R88 PolarHBondContact O-N 2.81Å; Y84-Y89 HydrophobicContact CE1-CE2 4.07Å
85L97.7Very high95.1Very high0 Ų050.7 Ų50.70%023%0.234CC..Hα-helixtrans-61.2-44.9-178.6-70.1170.6000111.5P66 A69 L70 Y81 A82 Y89 A93P66-L85 HydrophobicContact CB-CD2 4.17Å; A69-L85 HydrophobicContact CB-CD1 3.92Å; A69-L85 HydrophobicContact CB-CD2 4.38Å; L70-L85 HydrophobicContact CB-CD1 4.04Å; L70-L85 HydrophobicContact CD1-CD1 4.39Å; Y81-L85 HydrophobicContact CD1-CD1 4.09Å; Y81-L85 HydrophobicContact CD2-CD1 4.36Å; Y81-L85 HydrophobicContact CD2-CG 4.18Å; Y81-L85 HydrophobicContact CE1-CD1 3.88Å; Y81-L85 HydrophobicContact CE2-CD1 4.15Å; Y81-L85 HydrophobicContact CE2-CD2 4Å; Y81-L85 HydrophobicContact CE2-CG 3.93Å; Y81-L85 HydrophobicContact CG-CD1 4.32Å; Y81-L85 VanDerWaalsContact O-CG 3.3Å; Y81-L85 WeakPolarHBondContact O-CG 3.48Å; Y81-L85 PolarHBondContact O-N 2.81Å; A82-L85 PolarHBondContact O-N 3.05Å; L85-Y89 HydrophobicContact CD2-CD2 4.09Å; L85-Y89 HydrophobicContact CD2-CE2 3.96Å; L85-Y89 WeakPolarHBondContact O-CB 3.46Å; L85-Y89 WeakPolarHBondContact O-CD2 3.37Å; L85-Y89 PolarHBondContact O-N 3.4Å; L85-A93 HydrophobicContact CB-CB 4.49Å
86L96.9Very high94.5Very high3 Ų352.9 Ų52.92%0.01625%0.254CS..Hα-helixtrans-69.3-40-179.9-69.1167.7000112.1L70 A82 Y84 S90 A93 L94 M126 V127 A130L70-L86 HydrophobicContact CD1-CD1 4.38Å; L70-L86 HydrophobicContact CD1-CG 4.23Å; L70-L86 HydrophobicContact CD2-CD2 3.8Å; L70-L86 HydrophobicContact CD2-CG 4.34Å; A82-L86 WeakPolarHBondContact O-CB 3.45Å; A82-L86 WeakPolarHBondContact O-CD1 3.49Å; A82-L86 VanDerWaalsContact O-CG 3.25Å; A82-L86 WeakPolarHBondContact O-CG 3.49Å; A82-L86 PolarHBondContact O-N 3.16Å; Y84-L86 PolarHBondContact O-N 2.76Å; L86-S90 WeakPolarHBondContact O-CA 3.39Å; L86-S90 PolarHBondContact O-N 2.78Å; L86-A93 HydrophobicContact CD2-CB 4.32Å; L86-L94 HydrophobicContact CD2-CD2 3.63Å; L86-L94 HydrophobicContact CD2-CG 4.21Å; L86-M126 HydrophobicContact CD1-CB 3.49Å; L86-M126 VanDerWaalsContact CD1-CB 3.49Å; L86-V127 HydrophobicContact CD1-CG2 4Å; L86-V127 HydrophobicContact CD2-CG2 4.26Å; L86-A130 HydrophobicContact CB-CB 4.32Å; L86-A130 HydrophobicContact CD2-CB 3.96Å
87N96.3Very high93.6Very high129 Ų12952.3 Ų52.369%0.6925%0.254SS*.Hα-helixtrans-72.7-39.3177.5-72.1-4.4000112.2R83 Y84R83-N87 VanDerWaalsContact O-CB 3.26Å; R83-N87 WeakPolarHBondContact O-CB 3.14Å; R83-N87 VanDerWaalsContact O-CG 3.23Å; R83-N87 PolarHBondContact O-N 2.92Å; Y84-N87 PolarHBondContact O-N 3.35Å
88R96Very high92.4Very high159 Ų15950.9 Ų50.960%0.625%0.248SC*.Hα-helixtrans-78.6-37.7-173.7-177.163.7-177.895.7-4.6112.9Y84Y84-R88 HydrophobicContact CE1-CB 4.34Å; Y84-R88 HydrophobicContact CE1-CG 4.47Å; Y84-R88 HydrophobicContact CE2-CB 4.45Å; Y84-R88 WeakPolarHBondContact O-CB 2.89Å; Y84-R88 PolarHBondContact O-N 2.81Å
89Y94.1Very high90.5Very high71 Ų7155.4 Ų55.428%0.27828%0.279SS..Hα-helixtrans-114.8-10.4-173.8-54.6-79.7000113.3E46 R49 P66 Y84 L85 V91 G92E46-Y89 PolarHBondContact OE2-OH 3.34Å; R49-Y89 PolarHBondContact NH2-OH 3.3Å; P66-Y89 HydrophobicContact CB-CD1 4.32Å; P66-Y89 HydrophobicContact CB-CD2 3.64Å; P66-Y89 HydrophobicContact CB-CE2 4.13Å; P66-Y89 HydrophobicContact CB-CG 3.76Å; P66-Y89 HydrophobicContact CG-CD1 3.67Å; P66-Y89 HydrophobicContact CG-CD2 3.75Å; P66-Y89 HydrophobicContact CG-CE1 3.83Å; P66-Y89 HydrophobicContact CG-CE2 3.91Å; P66-Y89 HydrophobicContact CG-CG 3.64Å; Y84-Y89 HydrophobicContact CE1-CE2 4.07Å; L85-Y89 HydrophobicContact CD2-CD2 4.09Å; L85-Y89 HydrophobicContact CD2-CE2 3.96Å; L85-Y89 WeakPolarHBondContact O-CB 3.46Å; L85-Y89 WeakPolarHBondContact O-CD2 3.37Å; L85-Y89 PolarHBondContact O-N 3.4Å; Y89-V91 PolarHBondContact O-N 3.2Å; Y89-G92 VanDerWaalsContact O-CA 3.31Å; Y89-G92 WeakPolarHBondContact O-CA 3.14Å; Y89-G92 PolarHBondContact O-N 3.28Å
90S91.6Very high88.6Confident23 Ų2354.5 Ų54.516%0.16128%0.28CS..G310 helixtrans47.3-127.7176.7-177.90000111.5L86 G92 A93 D133L86-S90 WeakPolarHBondContact O-CA 3.39Å; L86-S90 PolarHBondContact O-N 2.78Å; S90-G92 PolarHBondContact O-N 2.65Å; S90-A93 WeakPolarHBondContact O-CB 3.42Å; S90-A93 PolarHBondContact O-N 2.67Å; S90-D133 WeakPolarHBondContact OG-CB 3.11Å; S90-D133 PolarHBondContact OG-OD2 3.24Å
91V88.6Confident86.6Confident54 Ų5450.6 Ų50.633%0.32726%0.258SS..G310 helixtrans-52.7-27.5176.9-171.10000112.8Y89 A93 L94 R95 D133 C134Y89-V91 PolarHBondContact O-N 3.2Å; V91-A93 VanDerWaalsContact C-N 3.31Å; V91-A93 PolarHBondContact O-N 3.43Å; V91-L94 PolarHBondContact O-N 3.37Å; V91-R95 PolarHBondContact O-N 2.95Å; V91-D133 HydrophobicContact CG2-CB 4.2Å; V91-C134 VanDerWaalsContact CG1-SG 3.58Å; V91-C134 HydrophobicContact CG2-CB 4.35Å; V91-C134 VanDerWaalsContact CG2-SG 3.56Å
92G89.1Confident84.5Confident17 Ų1751.8 Ų51.818%0.17527%0.266CS..G310 helixtrans-60.7-35.7174.600000113.7Y89 S90 L94Y89-G92 VanDerWaalsContact O-CA 3.31Å; Y89-G92 WeakPolarHBondContact O-CA 3.14Å; Y89-G92 PolarHBondContact O-N 3.28Å; S90-G92 PolarHBondContact O-N 2.65Å; G92-L94 PolarHBondContact O-N 3.29Å
93A92.9Very high82.4Confident0 Ų056.2 Ų56.20%030%0.296CS..G310 helixtrans-74.7-13.4174.900000113P66 S67 L70 L85 L86 S90 V91 H111P66-A93 HydrophobicContact CB-CB 4.29Å; S67-A93 WeakPolarHBondContact CA-O 3.29Å; S67-A93 WeakPolarHBondContact CB-O 3.2Å; L70-A93 HydrophobicContact CD2-CB 4.21Å; L70-A93 WeakPolarHBondContact CD2-O 3.44Å; L85-A93 HydrophobicContact CB-CB 4.49Å; L86-A93 HydrophobicContact CD2-CB 4.32Å; S90-A93 WeakPolarHBondContact O-CB 3.42Å; S90-A93 PolarHBondContact O-N 2.67Å; V91-A93 VanDerWaalsContact C-N 3.31Å; V91-A93 PolarHBondContact O-N 3.43Å; A93-H111 PolarHBondContact O-NE2 3.45Å
94L90.9Very high80.4Confident5 Ų554 Ų543%0.02629%0.294CS..G310 helixtrans-100.2-0.2179.3-57.3-177.6000112.8L70 L86 V91 G92 V127 A130 L131 Y143L70-L94 HydrophobicContact CD2-CD2 3.84Å; L86-L94 HydrophobicContact CD2-CD2 3.63Å; L86-L94 HydrophobicContact CD2-CG 4.21Å; V91-L94 PolarHBondContact O-N 3.37Å; G92-L94 PolarHBondContact O-N 3.29Å; L94-V127 HydrophobicContact CD1-CG1 4.28Å; L94-V127 HydrophobicContact CD2-CG1 3.94Å; L94-V127 HydrophobicContact CD2-CG2 4.18Å; L94-A130 HydrophobicContact CD1-CB 4.27Å; L94-L131 HydrophobicContact CD1-CD2 3.53Å; L94-L131 HydrophobicContact CD1-CG 3.78Å; L94-Y143 HydrophobicContact CB-CE2 3.78Å; L94-Y143 WeakPolarHBondContact O-CE2 3.42Å
95R87.4Confident77.9Confident171 Ų17156.9 Ų56.965%0.64532%0.323SS*.SBendtrans-62.1149178.6-71.3-179-176.8165.22.1111.1S67 V91 P97 H111S67-R95 WeakPolarHBondContact CB-O 3.25Å; V91-R95 PolarHBondContact O-N 2.95Å; R95-P97 WeakPolarHBondContact O-CD 3.49Å; R95-H111 PolarHBondContact O-CE1 3Å
96A81.2Confident75.6Confident64 Ų6460.8 Ų60.853%0.52936%0.363SS..PPolyproline II helixtrans-51.1124.4169.800000109.5
97P77.8Confident73.6Confident22 Ų2262 Ų6214%0.14337%0.372CS..PPolyproline II helixtrans-58.6160.3173.5-23.833.9000112E68 L71 R95 F101 P110E68-P97 HydrophobicContact CG-CB 3.94Å; L71-P97 HydrophobicContact CD1-CG 3.79Å; R95-P97 WeakPolarHBondContact O-CD 3.49Å; P97-F101 HydrophobicContact CB-CB 3.85Å; P97-F101 HydrophobicContact CB-CD2 4.16Å; P97-F101 HydrophobicContact CB-CG 4.15Å; P97-P110 HydrophobicContact CG-CG 3.58Å
98A72.1Confident71.9Confident15 Ų1557 Ų5712%0.12435%0.35CS..PPolyproline II helixtrans-66.4164.1176.100000112.3E68 S100 F101E68-A98 VanDerWaalsContact OE1-CB 3.31Å; E68-A98 WeakPolarHBondContact OE1-CB 3.28Å; E68-A98 PolarHBondContact OE1-N 3.37Å; A98-S100 PolarHBondContact O-N 3.1Å; A98-F101 PolarHBondContact O-N 3.35Å
99C57.2Low70.5Confident101 Ų10150.1 Ų50.168%0.68233%0.327SS*.G310 helixtrans-55.3-21.3-171.3-630000114.9F101 C102C99-F101 PolarHBondContact O-N 3.41Å; C99-F101 VanDerWaalsContact O-N 3.13Å; C99-C102 CarbonylContact O-C 3.54Å; C99-C102 PolarHBondContact O-N 3.17Å; C99-C102 VanDerWaalsContact O-N 3.16Å
100S58.7Low69.9Low43 Ų4346.9 Ų46.930%0.30132%0.315SS..G310 helixtrans-63.1-16.317458.60000113.8A98A98-S100 PolarHBondContact O-N 3.1Å
101F57.5Low69.9Low14 Ų1445.8 Ų45.86%0.06131%0.307CS..G310 helixtrans-105.3-3.7178.5-67.4-89.1000113.2W3 F64 E68 L71 Y72 P97 A98 C99 L151W3-F101 HydrophobicContact CB-CD1 4.48Å; F64-F101 HydrophobicContact CD1-CE2 4.3Å; F64-F101 HydrophobicContact CD1-CZ 4.13Å; F64-F101 AromaticContact CE1-CE2 4Å; F64-F101 HydrophobicContact CE1-CE2 4Å; F64-F101 AromaticContact CE1-CZ 3.59Å; F64-F101 HydrophobicContact CE1-CZ 3.59Å; F64-F101 HydrophobicContact CZ-CZ 4.19Å; E68-F101 HydrophobicContact CB-CE2 3.93Å; E68-F101 HydrophobicContact CB-CZ 4Å; E68-F101 VanDerWaalsContact CD-CE2 3.46Å; E68-F101 HydrophobicContact CG-CD2 3.81Å; E68-F101 HydrophobicContact CG-CE2 3.48Å; E68-F101 VanDerWaalsContact CG-CE2 3.48Å; E68-F101 HydrophobicContact CG-CZ 4.06Å; L71-F101 HydrophobicContact CD1-CD1 4.36Å; Y72-F101 HydrophobicContact CE2-CE1 4.11Å; Y72-F101 HydrophobicContact CE2-CZ 4.24Å; P97-F101 HydrophobicContact CB-CB 3.85Å; P97-F101 HydrophobicContact CB-CD2 4.16Å; P97-F101 HydrophobicContact CB-CG 4.15Å; A98-F101 PolarHBondContact O-N 3.35Å; C99-F101 PolarHBondContact O-N 3.41Å; C99-F101 VanDerWaalsContact O-N 3.13Å; F101-L151 HydrophobicContact CB-CD2 4.43Å; F101-L151 WeakPolarHBondContact O-CD2 3.28Å; F101-L151 WeakPolarHBondContact O-CG 3.5Å
102C54.5Low70Confident26 Ų2643.4 Ų43.418%0.17629%0.293CS..  trans-152.1128179.5-161.70000113C99 C104 S107C99-C102 CarbonylContact O-C 3.54Å; C99-C102 PolarHBondContact O-N 3.17Å; C99-C102 VanDerWaalsContact O-N 3.16Å; C102-C104 PolarHBondContact O-N 3.14Å; C102-C104 VanDerWaalsContact O-N 3.16Å; C102-S107 WeakPolarHBondContact SG-CB 3.47Å
103C54.3Low70.1Confident93 Ų9342.9 Ų42.963%0.62829%0.286SS*.SBendtrans-73.4-0.1176.6-49.10000114.2C150C103-C150 HydrophobicContact CB-CB 4.48Å
104C54.9Low70.1Confident47 Ų4743.1 Ų43.132%0.31829%0.288SS..SBendtrans-134.3106.6-157.9-52.70000110.1C102 G106 S107 C150C102-C104 PolarHBondContact O-N 3.14Å; C102-C104 VanDerWaalsContact O-N 3.16Å; C104-G106 PolarHBondContact O-N 3.18Å; C104-S107 PolarHBondContact O-N 2.89Å; C104-C150 HydrophobicContact CB-CB 4.38Å; C104-C150 WeakPolarHBondContact CB-SG 3.4Å; C104-C150 WeakPolarHBondContact SG-CB 3.48Å; C104-C150 CovalentContact SG-SG 2.08Å; C104-C150 PolarHBondContact SG-SG 3.28Å
105P46.3Very low70.3Confident138 Ų13842.9 Ų42.990%0.89629%0.287SS*.THydrogen-bonded Turntrans-60.4125.4173.2-16.828.5000109.8
106G49.8Very low70.7Confident82 Ų8234.8 Ų34.885%0.84526%0.256SS*.THydrogen-bonded Turntrans93.79.2179.600000115.7C104 G108C104-G106 PolarHBondContact O-N 3.18Å; G106-G108 PolarHBondContact O-N 3.41Å
107S54.9Low71.3Confident29 Ų2934.4 Ų34.420%0.20324%0.241CC..  trans-55.5126.2165165.90000110.5C102 C104 G149C102-S107 WeakPolarHBondContact SG-CB 3.47Å; C104-S107 PolarHBondContact O-N 2.89Å; S107-G149 WeakPolarHBondContact OG-CA 3.48Å; S107-G149 PolarHBondContact OG-N 3.13Å
108G60.8Low72.2Confident22 Ų2236.8 Ų36.823%0.22725%0.248CC..  trans-64.2-178.8173.100000112.8G106 P110 R147G106-G108 PolarHBondContact O-N 3.41Å; G108-P110 WeakPolarHBondContact O-CD 3.29Å; G108-R147 VanDerWaalsContact CA-O 3.31Å; G108-R147 WeakPolarHBondContact CA-O 3.44Å; G108-R147 PolarHBondContact N-O 2.9Å; G108-R147 VanDerWaalsContact N-O 3.1Å
109A66Low73.3Confident15 Ų1539.7 Ų39.712%0.12426%0.261CS..  trans-47.7100.5-178.100000114.5H111 Y143A109-H111 PolarHBondContact O-N 3.35Å; A109-Y143 HydrophobicContact CB-CD1 4.22Å; A109-Y143 HydrophobicContact CB-CD2 3.5Å; A109-Y143 HydrophobicContact CB-CE1 3.92Å; A109-Y143 HydrophobicContact CB-CE2 3.1Å; A109-Y143 HydrophobicContact CB-CG 4.03Å
110P81.4Confident75.3Confident4 Ų437.6 Ų37.63%0.02624%0.239CC..Hα-helixtrans-72.1-20.5-177.728-31.2000112.7L71 P97 G108 L112 S113 V114 L151L71-P110 HydrophobicContact CD2-CB 4.39Å; L71-P110 HydrophobicContact CD2-CG 4.42Å; P97-P110 HydrophobicContact CG-CG 3.58Å; G108-P110 WeakPolarHBondContact O-CD 3.29Å; P110-L112 VanDerWaalsContact C-N 3.32Å; P110-L112 PolarHBondContact O-N 3.07Å; P110-S113 PolarHBondContact O-N 3.44Å; P110-S113 PolarHBondContact O-OG 3.14Å; P110-V114 WeakPolarHBondContact O-CB 3.32Å; P110-V114 VanDerWaalsContact O-CG2 3.23Å; P110-V114 WeakPolarHBondContact O-CG2 3.48Å; P110-V114 PolarHBondContact O-N 3.25Å; P110-L151 HydrophobicContact CB-CD1 3.34Å; P110-L151 HydrophobicContact CG-CD1 4.26Å
111H90.9Very high77.1Confident0 Ų037.8 Ų37.80%024%0.238CC..Hα-helixtrans-61.5-41.2-178.7-51.486.7000111.8S67 I74 A93 R95 A109 V114 V115S67-H111 PolarHBondContact O-NE2 3.2Å; I74-H111 HydrophobicContact CD1-CB 4.02Å; A93-H111 PolarHBondContact O-NE2 3.45Å; R95-H111 PolarHBondContact O-CE1 3Å; A109-H111 PolarHBondContact O-N 3.35Å; H111-V114 PolarHBondContact O-N 2.97Å; H111-V115 VanDerWaalsContact O-CB 3.31Å; H111-V115 WeakPolarHBondContact O-CB 3.47Å; H111-V115 WeakPolarHBondContact O-CG2 3.39Å; H111-V115 PolarHBondContact O-N 3.01Å
112L92.3Very high79Confident3 Ų340.7 Ų40.72%0.01626%0.257CS..Hα-helixtrans-64.1-46.8179.5-71179.9000111.9P110 V114 V115 V116 L124 V127 M128 Y143 L144 A160 L176P110-L112 VanDerWaalsContact C-N 3.32Å; P110-L112 PolarHBondContact O-N 3.07Å; L112-V114 VanDerWaalsContact C-N 3.32Å; L112-V114 PolarHBondContact O-N 2.74Å; L112-V115 PolarHBondContact O-N 3.29Å; L112-V116 WeakPolarHBondContact O-CB 3.13Å; L112-V116 VanDerWaalsContact O-CG2 3.26Å; L112-V116 WeakPolarHBondContact O-CG2 3.29Å; L112-V116 PolarHBondContact O-N 3.01Å; L112-L124 HydrophobicContact CD2-CD1 3.89Å; L112-V127 HydrophobicContact CD2-CG1 3.92Å; L112-M128 HydrophobicContact CD2-CE 3.6Å; L112-Y143 HydrophobicContact CD1-CD1 3.63Å; L112-Y143 HydrophobicContact CD1-CE1 3.51Å; L112-Y143 WeakPolarHBondContact CD1-O 3.21Å; L112-Y143 HydrophobicContact CD2-CE1 3.98Å; L112-Y143 HydrophobicContact CG-CD1 4.17Å; L112-Y143 HydrophobicContact CG-CE1 3.5Å; L112-Y143 VanDerWaalsContact CG-CE1 3.5Å; L112-L144 HydrophobicContact CD1-CD2 4.26Å; L112-A160 HydrophobicContact CB-CB 3.86Å; L112-L176 HydrophobicContact CD2-CD2 4.33Å
113S91.4Very high81.1Confident6 Ų639.5 Ų39.54%0.04225%0.249CC..Hα-helixtrans-64.1-40.1179.2600000111.5P110 V116 R117 L163P110-S113 PolarHBondContact O-N 3.44Å; P110-S113 PolarHBondContact O-OG 3.14Å; S113-V116 PolarHBondContact O-N 3.11Å; S113-R117 VanDerWaalsContact O-CB 3.25Å; S113-R117 WeakPolarHBondContact O-CB 3.42Å; S113-R117 PolarHBondContact O-N 3.04Å; S113-L163 VanDerWaalsContact O-CD2 3.3Å; S113-L163 WeakPolarHBondContact O-CD2 3.31Å
114V92.4Very high83.1Confident6 Ų635 Ų354%0.03622%0.219CC..Hα-helixtrans-67.4-43.4177.41770000111.2L71 I74 V75 P110 H111 L112 V116 R117 Y118 L151L71-V114 HydrophobicContact CD2-CB 4.29Å; L71-V114 HydrophobicContact CD2-CG2 4.09Å; I74-V114 HydrophobicContact CB-CG1 4.23Å; I74-V114 HydrophobicContact CG2-CB 4.42Å; I74-V114 HydrophobicContact CG2-CG1 3.71Å; V75-V114 HydrophobicContact CG2-CG1 3.89Å; P110-V114 WeakPolarHBondContact O-CB 3.32Å; P110-V114 VanDerWaalsContact O-CG2 3.23Å; P110-V114 WeakPolarHBondContact O-CG2 3.48Å; P110-V114 PolarHBondContact O-N 3.25Å; H111-V114 PolarHBondContact O-N 2.97Å; L112-V114 VanDerWaalsContact C-N 3.32Å; L112-V114 PolarHBondContact O-N 2.74Å; V114-V116 VanDerWaalsContact C-N 3.33Å; V114-V116 PolarHBondContact O-N 3.25Å; V114-R117 PolarHBondContact O-N 3.48Å; V114-Y118 HydrophobicContact CG1-CD2 3.74Å; V114-Y118 HydrophobicContact CG1-CE2 3.9Å; V114-Y118 VanDerWaalsContact O-CD2 3.26Å; V114-Y118 WeakPolarHBondContact O-CD2 3.5Å; V114-Y118 PolarHBondContact O-N 2.84Å; V114-L151 HydrophobicContact CG2-CD1 4.34Å
115V95.6Very high85.1Confident0 Ų033.7 Ų33.70%021%0.213CC..Hα-helixtrans-58-46.5175.7165.90000111I74 H111 L112 N119 R120 I123 L124I74-V115 HydrophobicContact CB-CG2 4.31Å; I74-V115 HydrophobicContact CD1-CG2 3.61Å; I74-V115 HydrophobicContact CG1-CG2 3.7Å; I74-V115 HydrophobicContact CG2-CB 4.16Å; I74-V115 HydrophobicContact CG2-CG2 3.54Å; H111-V115 VanDerWaalsContact O-CB 3.31Å; H111-V115 WeakPolarHBondContact O-CB 3.47Å; H111-V115 WeakPolarHBondContact O-CG2 3.39Å; H111-V115 PolarHBondContact O-N 3.01Å; L112-V115 PolarHBondContact O-N 3.29Å; V115-N119 PolarHBondContact O-N 3.49Å; V115-N119 VanDerWaalsContact O-N 3.12Å; V115-R120 HydrophobicContact CG1-CB 4.19Å; V115-R120 WeakPolarHBondContact CG1-O 3.15Å; V115-R120 PolarHBondContact O-N 2.91Å; V115-I123 HydrophobicContact CG2-CG2 4.24Å; V115-L124 HydrophobicContact CB-CD1 4.47Å; V115-L124 HydrophobicContact CG1-CB 3.46Å; V115-L124 VanDerWaalsContact CG1-CB 3.46Å; V115-L124 HydrophobicContact CG1-CD1 3.66Å; V115-L124 HydrophobicContact CG1-CG 4.05Å
116V95.4Very high87.5Confident0 Ų028.5 Ų28.50%018%0.177CC..Hα-helixtrans-65.7-46.6178.6172.10000110.9L112 S113 V114 Y118 N119 A160 L163 A164 H169 C172 L176L112-V116 WeakPolarHBondContact O-CB 3.13Å; L112-V116 VanDerWaalsContact O-CG2 3.26Å; L112-V116 WeakPolarHBondContact O-CG2 3.29Å; L112-V116 PolarHBondContact O-N 3.01Å; S113-V116 PolarHBondContact O-N 3.11Å; V114-V116 VanDerWaalsContact C-N 3.33Å; V114-V116 PolarHBondContact O-N 3.25Å; V116-Y118 VanDerWaalsContact C-N 3.29Å; V116-Y118 PolarHBondContact O-N 3.06Å; V116-N119 PolarHBondContact O-N 3.27Å; V116-A160 HydrophobicContact CG2-CB 4.25Å; V116-L163 HydrophobicContact CB-CD2 4.37Å; V116-L163 HydrophobicContact CG1-CB 4.23Å; V116-L163 HydrophobicContact CG1-CD2 4.27Å; V116-L163 HydrophobicContact CG1-CG 3.98Å; V116-A164 VanDerWaalsContact CG1-CA 3.44Å; V116-A164 HydrophobicContact CG1-CB 3.63Å; V116-H169 PolarHBondContact O-CE1 2.87Å; V116-H169 VanDerWaalsContact O-CE1 3.26Å; V116-H169 PolarHBondContact O-ND1 3.24Å; V116-C172 HydrophobicContact CG2-CB 4.24Å; V116-L176 HydrophobicContact CG2-CD1 3.99Å
117R94.1Very high89.7Confident57 Ų5724.6 Ų24.622%0.21514%0.137CC..Hα-helixtrans-56-43.7-179.9170.3169.1-77-81.8-4.5112.5S113 V114 N119 H152 D155 L163 L167S113-R117 VanDerWaalsContact O-CB 3.25Å; S113-R117 WeakPolarHBondContact O-CB 3.42Å; S113-R117 PolarHBondContact O-N 3.04Å; V114-R117 PolarHBondContact O-N 3.48Å; R117-N119 VanDerWaalsContact C-N 3.3Å; R117-H152 PolarHBondContact NE-CD2 2.85Å; R117-H152 PolarHBondContact NH1-CD2 3.46Å; R117-D155 IonicContact CZ-OD1 2.82Å; R117-D155 IonicContact CZ-OD2 3.44Å; R117-D155 IonicContact NE-OD1 3.96Å; R117-D155 IonicContact NE-OD2 3.68Å; R117-D155 PolarHBondContact NE-OD2 2.94Å; R117-D155 IonicContact NH2-OD1 2.78Å; R117-D155 PolarHBondContact NH2-OD1 3.38Å; R117-D155 IonicContact NH2-OD2 2.77Å; R117-D155 PolarHBondContact NH2-OD2 3.5Å; R117-L163 HydrophobicContact CB-CD2 4.35Å; R117-L167 HydrophobicContact CB-CD1 4.36Å
118Y95.2Very high91.5Very high72 Ų7223.3 Ų23.328%0.28213%0.128SC..THydrogen-bonded Turntrans-9110.3179.4-66.5-76000113.3V75 V114 V116 R120V75-Y118 HydrophobicContact CB-CE2 4.4Å; V75-Y118 HydrophobicContact CG1-CE1 4.44Å; V75-Y118 HydrophobicContact CG1-CE2 4.41Å; V75-Y118 HydrophobicContact CG2-CD2 4.15Å; V75-Y118 HydrophobicContact CG2-CE2 3.69Å; V114-Y118 HydrophobicContact CG1-CD2 3.74Å; V114-Y118 HydrophobicContact CG1-CE2 3.9Å; V114-Y118 VanDerWaalsContact O-CD2 3.26Å; V114-Y118 WeakPolarHBondContact O-CD2 3.5Å; V114-Y118 PolarHBondContact O-N 2.84Å; V116-Y118 VanDerWaalsContact C-N 3.29Å; V116-Y118 PolarHBondContact O-N 3.06Å; Y118-R120 VanDerWaalsContact C-N 3.27Å; Y118-R120 WeakPolarHBondContact O-CD 3.27Å; Y118-R120 PolarHBondContact O-N 3.25Å
119N96.6Very high93.1Very high76 Ų7627 Ų2741%0.40614%0.139SC..THydrogen-bonded Turntrans5141.1178.9-161.826.2000113.9V115 V116 R117 V121 C172V115-N119 PolarHBondContact O-N 3.49Å; V115-N119 VanDerWaalsContact O-N 3.12Å; V116-N119 PolarHBondContact O-N 3.27Å; R117-N119 VanDerWaalsContact C-N 3.3Å; N119-V121 VanDerWaalsContact C-N 3.3Å; N119-V121 PolarHBondContact O-N 3.39Å; N119-C172 PolarHBondContact OD1-SG 3.28Å
120R97.6Very high94.4Very high56 Ų5626.6 Ų26.621%0.21114%0.136CC..  trans-85.965.5-175.2-55.4-58.7-172.9-156.8-9.3111.6I74 V75 D77 V115 Y118 T122 I123 L124I74-R120 HydrophobicContact CG2-CB 4.45Å; I74-R120 HydrophobicContact CG2-CG 3.99Å; I74-R120 WeakPolarHBondContact O-CG 3.43Å; I74-R120 PolarHBondContact O-NE 3.44Å; V75-R120 PolarHBondContact O-NH2 3.38Å; D77-R120 VanDerWaalsContact CB-CZ 3.44Å; D77-R120 VanDerWaalsContact CG-CD 3.5Å; D77-R120 IonicContact OD2-CZ 2.65Å; D77-R120 IonicContact OD2-NE 3.97Å; D77-R120 IonicContact OD2-NH1 3.57Å; D77-R120 PolarHBondContact OD2-NH1 3.01Å; V115-R120 HydrophobicContact CG1-CB 4.19Å; V115-R120 WeakPolarHBondContact CG1-O 3.15Å; V115-R120 PolarHBondContact O-N 2.91Å; Y118-R120 VanDerWaalsContact C-N 3.27Å; Y118-R120 WeakPolarHBondContact O-CD 3.27Å; Y118-R120 PolarHBondContact O-N 3.25Å; R120-T122 VanDerWaalsContact C-N 3.3Å; R120-T122 PolarHBondContact O-N 3.07Å; R120-I123 HydrophobicContact CB-CB 4.07Å; R120-I123 HydrophobicContact CB-CD1 4.21Å; R120-I123 HydrophobicContact CB-CG1 4.35Å; R120-I123 HydrophobicContact CG-CD1 4.48Å; R120-I123 PolarHBondContact O-N 3.15Å; R120-I123 VanDerWaalsContact O-N 3.11Å; R120-L124 PolarHBondContact O-N 2.89Å
121V96.6Very high94.8Very high48 Ų4826.5 Ų26.529%0.29114%0.135SC..Hα-helixtrans-54.7-42.5-173.6-176.50000112.5N119 I123 L124 G125 E171N119-V121 VanDerWaalsContact C-N 3.3Å; N119-V121 PolarHBondContact O-N 3.39Å; V121-I123 PolarHBondContact O-N 2.83Å; V121-L124 VanDerWaalsContact O-CB 3.31Å; V121-L124 WeakPolarHBondContact O-CB 3.46Å; V121-L124 PolarHBondContact O-N 3.44Å; V121-G125 PolarHBondContact O-N 3.34Å; V121-E171 HydrophobicContact CG1-CB 4.24Å; V121-E171 HydrophobicContact CG2-CB 3.9Å
122T97.8Very high94.7Very high75 Ų7531.4 Ų31.446%0.4616%0.157SC..Hα-helixtrans-63.9-44179.1-46.60000111.8R120 L124 G125 M126R120-T122 VanDerWaalsContact C-N 3.3Å; R120-T122 PolarHBondContact O-N 3.07Å; T122-L124 VanDerWaalsContact C-N 3.32Å; T122-G125 PolarHBondContact O-N 3.31Å; T122-M126 HydrophobicContact CG2-CE 3.87Å; T122-M126 WeakPolarHBondContact O-CG 3.49Å; T122-M126 PolarHBondContact O-N 3.48Å; T122-M126 VanDerWaalsContact O-N 3.14Å
123I98.1Very high94.4Very high0 Ų036.7 Ų36.70%019%0.185CC..Hα-helixtrans-68.7-34.8177.2-57.5176.5000110.3I74 Q79 A82 V115 R120 V121 G125 M126 V127I74-I123 HydrophobicContact CG1-CG2 3.9Å; Q79-I123 HydrophobicContact CG-CD1 4.36Å; Q79-I123 HydrophobicContact CG-CG1 4.14Å; A82-I123 HydrophobicContact CB-CD1 4.05Å; A82-I123 HydrophobicContact CB-CG1 4.15Å; A82-I123 HydrophobicContact CB-CG2 3.99Å; V115-I123 HydrophobicContact CG2-CG2 4.24Å; R120-I123 HydrophobicContact CB-CB 4.07Å; R120-I123 HydrophobicContact CB-CD1 4.21Å; R120-I123 HydrophobicContact CB-CG1 4.35Å; R120-I123 HydrophobicContact CG-CD1 4.48Å; R120-I123 PolarHBondContact O-N 3.15Å; R120-I123 VanDerWaalsContact O-N 3.11Å; V121-I123 PolarHBondContact O-N 2.83Å; I123-G125 VanDerWaalsContact C-N 3.32Å; I123-G125 PolarHBondContact O-N 3.04Å; I123-M126 HydrophobicContact CB-CE 4.47Å; I123-M126 HydrophobicContact CG1-CE 3.92Å; I123-M126 WeakPolarHBondContact O-CB 3.38Å; I123-M126 PolarHBondContact O-N 2.88Å; I123-M126 VanDerWaalsContact O-N 3.17Å; I123-V127 HydrophobicContact CG2-CG2 4.41Å; I123-V127 WeakPolarHBondContact O-CG2 3.24Å; I123-V127 PolarHBondContact O-N 3.05Å
124L97.3Very high93.9Very high0 Ų037 Ų370%019%0.187CC..Hα-helixtrans-56.5-48171.9-170.160.3000111L112 V115 R120 V121 T122 M126 V127 M128 C172 Q175 L176L112-L124 HydrophobicContact CD2-CD1 3.89Å; V115-L124 HydrophobicContact CB-CD1 4.47Å; V115-L124 HydrophobicContact CG1-CB 3.46Å; V115-L124 VanDerWaalsContact CG1-CB 3.46Å; V115-L124 HydrophobicContact CG1-CD1 3.66Å; V115-L124 HydrophobicContact CG1-CG 4.05Å; R120-L124 PolarHBondContact O-N 2.89Å; V121-L124 VanDerWaalsContact O-CB 3.31Å; V121-L124 WeakPolarHBondContact O-CB 3.46Å; V121-L124 PolarHBondContact O-N 3.44Å; T122-L124 VanDerWaalsContact C-N 3.32Å; L124-M126 VanDerWaalsContact C-N 3.32Å; L124-M126 PolarHBondContact O-N 3.46Å; L124-V127 WeakPolarHBondContact O-CB 3.42Å; L124-V127 PolarHBondContact O-N 3.23Å; L124-V127 VanDerWaalsContact O-N 3.13Å; L124-M128 HydrophobicContact CD1-CE 3.36Å; L124-M128 HydrophobicContact CG-CE 3.98Å; L124-M128 VanDerWaalsContact O-CG 3.29Å; L124-M128 WeakPolarHBondContact O-CG 3.37Å; L124-M128 PolarHBondContact O-N 3.1Å; L124-C172 HydrophobicContact CD2-CB 3.91Å; L124-Q175 HydrophobicContact CD2-CB 3.7Å; L124-Q175 HydrophobicContact CD2-CG 4.38Å; L124-Q175 HydrophobicContact CG-CB 4.28Å; L124-L176 HydrophobicContact CD1-CD2 4.35Å; L124-L176 HydrophobicContact CD2-CG 4.47Å
125G96.1Very high93.2Very high19 Ų1939.7 Ų39.720%0.19622%0.216CC..Hα-helixtrans-56.6-45.4175.100000112.1V121 T122 I123 V127 M128 E129V121-G125 PolarHBondContact O-N 3.34Å; T122-G125 PolarHBondContact O-N 3.31Å; I123-G125 VanDerWaalsContact C-N 3.32Å; I123-G125 PolarHBondContact O-N 3.04Å; G125-V127 VanDerWaalsContact C-N 3.33Å; G125-V127 PolarHBondContact O-N 3.5Å; G125-M128 PolarHBondContact O-N 2.98Å; G125-E129 WeakPolarHBondContact O-CG 3.44Å; G125-E129 PolarHBondContact O-N 3.28Å
126M97.1Very high92.7Very high28 Ų2841.1 Ų41.114%0.13823%0.231CC..Hα-helixtrans-61.6-39.8175.6-61.3-177.3-122.200112.7Q79 R83 L86 T122 I123 L124 M128 E129 A130Q79-M126 HydrophobicContact CB-CE 3.99Å; Q79-M126 HydrophobicContact CG-CE 4.26Å; R83-M126 HydrophobicContact CB-SD 3.62Å; R83-M126 HydrophobicContact CG-SD 4.15Å; L86-M126 HydrophobicContact CD1-CB 3.49Å; L86-M126 VanDerWaalsContact CD1-CB 3.49Å; T122-M126 HydrophobicContact CG2-CE 3.87Å; T122-M126 WeakPolarHBondContact O-CG 3.49Å; T122-M126 PolarHBondContact O-N 3.48Å; T122-M126 VanDerWaalsContact O-N 3.14Å; I123-M126 HydrophobicContact CB-CE 4.47Å; I123-M126 HydrophobicContact CG1-CE 3.92Å; I123-M126 WeakPolarHBondContact O-CB 3.38Å; I123-M126 PolarHBondContact O-N 2.88Å; I123-M126 VanDerWaalsContact O-N 3.17Å; L124-M126 VanDerWaalsContact C-N 3.32Å; L124-M126 PolarHBondContact O-N 3.46Å; M126-M128 VanDerWaalsContact C-N 3.35Å; M126-E129 PolarHBondContact O-N 2.83Å; M126-A130 PolarHBondContact O-N 3.45Å
127V95.8Very high92.2Very high0 Ų046 Ų460%026%0.263CS..Hα-helixtrans-62.7-44175169.90000110.2L86 L94 L112 I123 L124 G125 E129 A130 L131 Y143L86-V127 HydrophobicContact CD1-CG2 4Å; L86-V127 HydrophobicContact CD2-CG2 4.26Å; L94-V127 HydrophobicContact CD1-CG1 4.28Å; L94-V127 HydrophobicContact CD2-CG1 3.94Å; L94-V127 HydrophobicContact CD2-CG2 4.18Å; L112-V127 HydrophobicContact CD2-CG1 3.92Å; I123-V127 HydrophobicContact CG2-CG2 4.41Å; I123-V127 WeakPolarHBondContact O-CG2 3.24Å; I123-V127 PolarHBondContact O-N 3.05Å; L124-V127 WeakPolarHBondContact O-CB 3.42Å; L124-V127 PolarHBondContact O-N 3.23Å; L124-V127 VanDerWaalsContact O-N 3.13Å; G125-V127 VanDerWaalsContact C-N 3.33Å; G125-V127 PolarHBondContact O-N 3.5Å; V127-E129 VanDerWaalsContact C-N 3.31Å; V127-E129 PolarHBondContact O-N 3.15Å; V127-A130 PolarHBondContact O-N 3.45Å; V127-L131 HydrophobicContact CG1-CD1 4.24Å; V127-L131 HydrophobicContact CG1-CG 4.46Å; V127-L131 VanDerWaalsContact O-CG 3.29Å; V127-L131 WeakPolarHBondContact O-CG 3.34Å; V127-L131 PolarHBondContact O-N 3.07Å; V127-Y143 HydrophobicContact CG1-CE1 4.31Å
128M93.6Very high91.9Very high3 Ų348 Ų482%0.01528%0.281CS..Hα-helixtrans-63.1-37177.8-64.2-56.2146.600112.6L112 L124 G125 M126 L131 L144 L176 H179L112-M128 HydrophobicContact CD2-CE 3.6Å; L124-M128 HydrophobicContact CD1-CE 3.36Å; L124-M128 HydrophobicContact CG-CE 3.98Å; L124-M128 VanDerWaalsContact O-CG 3.29Å; L124-M128 WeakPolarHBondContact O-CG 3.37Å; L124-M128 PolarHBondContact O-N 3.1Å; G125-M128 PolarHBondContact O-N 2.98Å; M126-M128 VanDerWaalsContact C-N 3.35Å; M128-L131 PolarHBondContact O-N 3.24Å; M128-L131 HydrophobicContact SD-CD1 4.02Å; M128-L144 HydrophobicContact CE-CD2 3.78Å; M128-L144 HydrophobicContact SD-CD2 3.72Å; M128-L176 HydrophobicContact CE-CD2 3.64Å; M128-H179 HydrophobicContact CG-CB 4.34Å; M128-H179 VanDerWaalsContact CG-CD2 3.47Å; M128-H179 WeakPolarHBondContact CG-CD2 3.39Å; M128-H179 HydrophobicContact SD-CB 3.73Å
129E93.2Very high91.5Very high98 Ų9850.5 Ų50.546%0.45829%0.293SS..Hα-helixtrans-65.5-47.2173.1-69.9-56.6124.800111.6G125 M126 V127 L131 K132G125-E129 WeakPolarHBondContact O-CG 3.44Å; G125-E129 PolarHBondContact O-N 3.28Å; M126-E129 PolarHBondContact O-N 2.83Å; V127-E129 VanDerWaalsContact C-N 3.31Å; V127-E129 PolarHBondContact O-N 3.15Å; E129-L131 PolarHBondContact O-N 3.39Å; E129-K132 WeakPolarHBondContact O-CB 3.2Å; E129-K132 WeakPolarHBondContact O-CG 3.26Å; E129-K132 PolarHBondContact O-N 2.88Å; E129-K132 WeakPolarHBondContact OE1-CE 3.29Å; E129-K132 IonicContact OE1-NZ 2.78Å; E129-K132 PolarHBondContact OE1-NZ 3.23Å; E129-K132 VanDerWaalsContact OE2-CE 3.29Å; E129-K132 WeakPolarHBondContact OE2-CE 3.16Å; E129-K132 IonicContact OE2-NZ 3.7Å; E129-K132 PolarHBondContact OE2-NZ 3.06Å
130A93.1Very high91.1Very high8 Ų850.6 Ų50.67%0.06629%0.288CS..Hα-helixtrans-62.5-30.6176.800000112.8L86 L94 M126 V127 K132 D133L86-A130 HydrophobicContact CB-CB 4.32Å; L86-A130 HydrophobicContact CD2-CB 3.96Å; L94-A130 HydrophobicContact CD1-CB 4.27Å; M126-A130 PolarHBondContact O-N 3.45Å; V127-A130 PolarHBondContact O-N 3.45Å; A130-K132 PolarHBondContact O-N 2.81Å; A130-D133 PolarHBondContact O-N 2.74Å
131L90.3Very high90.7Very high2 Ų254.6 Ų54.61%0.0130%0.303CS..G310 helixtrans-67.8-11.8173.5-74.5175.2000113.6L94 V127 M128 E129 D133 C134 R140 Y143 L144L94-L131 HydrophobicContact CD1-CD2 3.53Å; L94-L131 HydrophobicContact CD1-CG 3.78Å; V127-L131 HydrophobicContact CG1-CD1 4.24Å; V127-L131 HydrophobicContact CG1-CG 4.46Å; V127-L131 VanDerWaalsContact O-CG 3.29Å; V127-L131 WeakPolarHBondContact O-CG 3.34Å; V127-L131 PolarHBondContact O-N 3.07Å; M128-L131 PolarHBondContact O-N 3.24Å; M128-L131 HydrophobicContact SD-CD1 4.02Å; E129-L131 PolarHBondContact O-N 3.39Å; L131-D133 PolarHBondContact O-N 3.01Å; L131-C134 VanDerWaalsContact CD2-SG 3.5Å; L131-C134 WeakPolarHBondContact O-CB 3.27Å; L131-C134 PolarHBondContact O-N 3.45Å; L131-R140 HydrophobicContact CB-CG 4.29Å; L131-R140 PolarHBondContact O-NE 3.27Å; L131-R140 PolarHBondContact O-NH2 2.98Å; L131-Y143 HydrophobicContact CD1-CD1 3.59Å; L131-Y143 HydrophobicContact CD1-CE1 3.84Å; L131-Y143 HydrophobicContact CD2-CD1 3.51Å; L131-Y143 HydrophobicContact CD2-CD2 4.35Å; L131-Y143 HydrophobicContact CD2-CE1 3.86Å; L131-Y143 HydrophobicContact CD2-CG 3.78Å; L131-Y143 HydrophobicContact CG-CD1 4.14Å; L131-Y143 HydrophobicContact CG-CE1 4.28Å; L131-L144 HydrophobicContact CD1-CD2 4.11Å; L131-L144 HydrophobicContact CD1-CG 4.49Å
132K88.3Confident90.4Very high103 Ų10358.2 Ų58.245%0.44832%0.317SS..G310 helixtrans-63.9-34.2172.1-66.7179.9-177.8170.10111.3E129 A130 C134 R140E129-K132 WeakPolarHBondContact O-CB 3.2Å; E129-K132 WeakPolarHBondContact O-CG 3.26Å; E129-K132 PolarHBondContact O-N 2.88Å; E129-K132 WeakPolarHBondContact OE1-CE 3.29Å; E129-K132 IonicContact OE1-NZ 2.78Å; E129-K132 PolarHBondContact OE1-NZ 3.23Å; E129-K132 VanDerWaalsContact OE2-CE 3.29Å; E129-K132 WeakPolarHBondContact OE2-CE 3.16Å; E129-K132 IonicContact OE2-NZ 3.7Å; E129-K132 PolarHBondContact OE2-NZ 3.06Å; A130-K132 PolarHBondContact O-N 2.81Å; K132-C134 VanDerWaalsContact C-N 3.29Å; K132-C134 PolarHBondContact O-N 3.46Å; K132-R140 PolarHBondContact O-NH2 3.41Å; K132-R140 VanDerWaalsContact O-NH2 3.12Å
133D87.1Confident90Very high114 Ų11456 Ų5661%0.6130%0.3SS*.G310 helixtrans-80-6.8178.9-55.7-27.2000113.5S90 V91 A130 L131 G135S90-D133 WeakPolarHBondContact OG-CB 3.11Å; S90-D133 PolarHBondContact OG-OD2 3.24Å; V91-D133 HydrophobicContact CG2-CB 4.2Å; A130-D133 PolarHBondContact O-N 2.74Å; L131-D133 PolarHBondContact O-N 3.01Å; D133-G135 PolarHBondContact O-N 2.86Å
134C80.8Confident89.7Confident12 Ų1256.1 Ų56.18%0.08130%0.3CS..SBendtrans-61.2129.9173.3-82.50000109.9V91 L131 K132 G136V91-C134 VanDerWaalsContact CG1-SG 3.58Å; V91-C134 HydrophobicContact CG2-CB 4.35Å; V91-C134 VanDerWaalsContact CG2-SG 3.56Å; L131-C134 VanDerWaalsContact CD2-SG 3.5Å; L131-C134 WeakPolarHBondContact O-CB 3.27Å; L131-C134 PolarHBondContact O-N 3.45Å; K132-C134 VanDerWaalsContact C-N 3.29Å; K132-C134 PolarHBondContact O-N 3.46Å; C134-G136 PolarHBondContact O-N 3.44Å
135G77Confident89.4Confident63 Ų6357.7 Ų57.765%0.64931%0.309SS*.SBendtrans-62.564.8-17200000115.9D133D133-G135 PolarHBondContact O-N 2.86Å
136G84.9Confident89Confident30 Ų3057.6 Ų57.631%0.30931%0.308SS..SBendtrans113.2160176.300000114.7C134 V138 K139 R140C134-G136 PolarHBondContact O-N 3.44Å; G136-V138 VanDerWaalsContact C-N 3.26Å; G136-V138 PolarHBondContact O-N 3.12Å; G136-K139 PolarHBondContact O-N 3.43Å; G136-R140 PolarHBondContact O-N 2.94Å
137P85.8Confident88.4Confident103 Ų10363 Ų6367%0.66933%0.327SS*.Hα-helixtrans-64.3-27.7-179.726.2-34.7000113.4R141P137-R141 PolarHBondContact O-N 3.02Å
138V87.3Confident87.2Confident98 Ų9863.4 Ų63.459%0.59433%0.331SS*.Hα-helixtrans-64.9-52.7179.3179.20000110.9G136 R140 R141 E142G136-V138 VanDerWaalsContact C-N 3.26Å; G136-V138 PolarHBondContact O-N 3.12Å; V138-R140 VanDerWaalsContact C-N 3.28Å; V138-R140 PolarHBondContact O-N 3.27Å; V138-R141 PolarHBondContact O-N 3.24Å; V138-R141 VanDerWaalsContact O-N 3.08Å; V138-E142 WeakPolarHBondContact O-CG 3.47Å; V138-E142 PolarHBondContact O-N 2.95Å
139K86.9Confident86Confident124 Ų12463.3 Ų63.354%0.53933%0.331SS..Hα-helixtrans-61.8-36.9178.5-69.1-176.6179.41760112.4G136 E142 Y143G136-K139 PolarHBondContact O-N 3.43Å; K139-E142 PolarHBondContact O-N 2.93Å; K139-Y143 WeakPolarHBondContact O-CB 3.35Å; K139-Y143 PolarHBondContact O-N 2.88Å
140R89.1Confident84.7Confident78 Ų7860.9 Ų60.929%0.29432%0.324SS..Hα-helixtrans-60.9-46174-173.9-177-57.9151.17.9111L131 K132 G136 V138 Y143 L144L131-R140 HydrophobicContact CB-CG 4.29Å; L131-R140 PolarHBondContact O-NE 3.27Å; L131-R140 PolarHBondContact O-NH2 2.98Å; K132-R140 PolarHBondContact O-NH2 3.41Å; K132-R140 VanDerWaalsContact O-NH2 3.12Å; G136-R140 PolarHBondContact O-N 2.94Å; V138-R140 VanDerWaalsContact C-N 3.28Å; V138-R140 PolarHBondContact O-N 3.27Å; R140-Y143 WeakPolarHBondContact O-CB 3.41Å; R140-Y143 PolarHBondContact O-N 3.4Å; R140-L144 HydrophobicContact CG-CD1 4.13Å; R140-L144 WeakPolarHBondContact O-CG 3.5Å; R140-L144 PolarHBondContact O-N 2.95Å
141R88.9Confident83.5Confident140 Ų14061.9 Ų61.953%0.52833%0.328SS..Hα-helixtrans-65.9-42.7177.6180166-93169.3-5112.2P137 V138 Y143 L144 D145 G180P137-R141 PolarHBondContact O-N 3.02Å; V138-R141 PolarHBondContact O-N 3.24Å; V138-R141 VanDerWaalsContact O-N 3.08Å; R141-Y143 PolarHBondContact O-N 2.87Å; R141-L144 PolarHBondContact O-N 3.42Å; R141-D145 WeakPolarHBondContact CG-OD2 3.36Å; R141-D145 WeakPolarHBondContact O-CB 3.25Å; R141-D145 PolarHBondContact O-N 3.28Å; R141-G180 PolarHBondContact NH2-O 3.32Å
142E89.4Confident82.5Confident125 Ų12564.3 Ų64.358%0.58434%0.339SS*.Hα-helixtrans-56.8-38.7173.9-72.8171.2179.900112.2V138 K139 G146V138-E142 WeakPolarHBondContact O-CG 3.47Å; V138-E142 PolarHBondContact O-N 2.95Å; K139-E142 PolarHBondContact O-N 2.93Å; E142-G146 WeakPolarHBondContact O-CA 3.26Å; E142-G146 PolarHBondContact O-N 3.47Å; E142-G146 VanDerWaalsContact O-N 3.1Å
143Y89.6Confident81.7Confident28 Ų2863.9 Ų63.911%0.1136%0.355CS..Hα-helixtrans-68.2-48.4175.8-172.9-88.7000112.3L94 A109 L112 V127 L131 K139 R140 R141 G146L94-Y143 HydrophobicContact CB-CE2 3.78Å; L94-Y143 WeakPolarHBondContact O-CE2 3.42Å; A109-Y143 HydrophobicContact CB-CD1 4.22Å; A109-Y143 HydrophobicContact CB-CD2 3.5Å; A109-Y143 HydrophobicContact CB-CE1 3.92Å; A109-Y143 HydrophobicContact CB-CE2 3.1Å; A109-Y143 HydrophobicContact CB-CG 4.03Å; L112-Y143 HydrophobicContact CD1-CD1 3.63Å; L112-Y143 HydrophobicContact CD1-CE1 3.51Å; L112-Y143 WeakPolarHBondContact CD1-O 3.21Å; L112-Y143 HydrophobicContact CD2-CE1 3.98Å; L112-Y143 HydrophobicContact CG-CD1 4.17Å; L112-Y143 HydrophobicContact CG-CE1 3.5Å; L112-Y143 VanDerWaalsContact CG-CE1 3.5Å; V127-Y143 HydrophobicContact CG1-CE1 4.31Å; L131-Y143 HydrophobicContact CD1-CD1 3.59Å; L131-Y143 HydrophobicContact CD1-CE1 3.84Å; L131-Y143 HydrophobicContact CD2-CD1 3.51Å; L131-Y143 HydrophobicContact CD2-CD2 4.35Å; L131-Y143 HydrophobicContact CD2-CE1 3.86Å; L131-Y143 HydrophobicContact CD2-CG 3.78Å; L131-Y143 HydrophobicContact CG-CD1 4.14Å; L131-Y143 HydrophobicContact CG-CE1 4.28Å; K139-Y143 WeakPolarHBondContact O-CB 3.35Å; K139-Y143 PolarHBondContact O-N 2.88Å; R140-Y143 WeakPolarHBondContact O-CB 3.41Å; R140-Y143 PolarHBondContact O-N 3.4Å; R141-Y143 PolarHBondContact O-N 2.87Å; Y143-G146 PolarHBondContact O-N 2.8Å
144L91.5Very high81.3Confident2 Ų261.3 Ų61.31%0.0135%0.35CS..Hα-helixtrans-64.4-41.5-178.7-72.7171000113.1L112 M128 L131 R140 R141 G146 L176 H179 A181L112-L144 HydrophobicContact CD1-CD2 4.26Å; M128-L144 HydrophobicContact CE-CD2 3.78Å; M128-L144 HydrophobicContact SD-CD2 3.72Å; L131-L144 HydrophobicContact CD1-CD2 4.11Å; L131-L144 HydrophobicContact CD1-CG 4.49Å; R140-L144 HydrophobicContact CG-CD1 4.13Å; R140-L144 WeakPolarHBondContact O-CG 3.5Å; R140-L144 PolarHBondContact O-N 2.95Å; R141-L144 PolarHBondContact O-N 3.42Å; L144-G146 VanDerWaalsContact C-N 3.26Å; L144-L176 HydrophobicContact CD2-CD2 4.26Å; L144-H179 VanDerWaalsContact CD1-O 3.25Å; L144-H179 WeakPolarHBondContact CD1-O 3.31Å; L144-A181 HydrophobicContact CB-CB 4.16Å
145D91.1Very high81.2Confident34 Ų3461 Ų6118%0.18235%0.347CS..THydrogen-bonded Turntrans-89.13.9-179.8-60.8-27.8000112R141 R182R141-D145 WeakPolarHBondContact CG-OD2 3.36Å; R141-D145 WeakPolarHBondContact O-CB 3.25Å; R141-D145 PolarHBondContact O-N 3.28Å; D145-R182 WeakPolarHBondContact OD1-CG 3.19Å; D145-R182 PolarHBondContact OD1-N 3.44Å; D145-R182 WeakPolarHBondContact OD2-CD 3.49Å; D145-R182 VanDerWaalsContact OD2-CG 3.27Å; D145-R182 WeakPolarHBondContact OD2-CG 3.16Å
146G87.6Confident81.4Confident17 Ų1760.3 Ų60.318%0.17534%0.335CS..PPolyproline II helixtrans-60.6136.7176.400000111.3E142 Y143 L144E142-G146 WeakPolarHBondContact O-CA 3.26Å; E142-G146 PolarHBondContact O-N 3.47Å; E142-G146 VanDerWaalsContact O-N 3.1Å; Y143-G146 PolarHBondContact O-N 2.8Å; L144-G146 VanDerWaalsContact C-N 3.26Å
147R84.6Confident81.3Confident142 Ų14260.4 Ų60.454%0.53634%0.336SS..BIsolated β-bridgetrans-80.8136.1176.3-68.3178.7-177.5-88.1-1.6110.3G108 G157 T159G108-R147 VanDerWaalsContact CA-O 3.31Å; G108-R147 WeakPolarHBondContact CA-O 3.44Å; G108-R147 PolarHBondContact N-O 2.9Å; G108-R147 VanDerWaalsContact N-O 3.1Å; R147-G157 VanDerWaalsContact CD-O 3.28Å; R147-G157 WeakPolarHBondContact CD-O 3.47Å; R147-G157 WeakPolarHBondContact CG-O 3.49Å; R147-G157 PolarHBondContact NH1-O 2.88Å; R147-T159 HydrophobicContact CG-CG2 4.3Å
148G72.4Confident81.4Confident7 Ų757.9 Ų57.97%0.07232%0.315CS..PPolyproline II helixtrans-59.9144.8179.100000112.2G157 K158G148-G157 PolarHBondContact O-N 3.19Å; G148-G157 VanDerWaalsContact O-N 3.12Å; G148-K158 PolarHBondContact N-O 2.99Å
149G68.1Low81.6Confident2 Ų253.5 Ų53.52%0.02129%0.288CS..  trans-77.8177.4-179.500000115.5S107 L151S107-G149 WeakPolarHBondContact OG-CA 3.48Å; S107-G149 PolarHBondContact OG-N 3.13Å; G149-L151 PolarHBondContact O-N 3.5Å
150C65.8Low81.9Confident47 Ų4747.7 Ų47.732%0.31826%0.264SS..THydrogen-bonded Turntrans-72.39.5-178.5-56.40000113.9C103 C104C103-C150 HydrophobicContact CB-CB 4.48Å; C104-C150 HydrophobicContact CB-CB 4.38Å; C104-C150 WeakPolarHBondContact CB-SG 3.4Å; C104-C150 WeakPolarHBondContact SG-CB 3.48Å; C104-C150 CovalentContact SG-SG 2.08Å; C104-C150 PolarHBondContact SG-SG 3.28Å
151L66.3Low82.2Confident29 Ų2944 Ų4415%0.15225%0.25CC..THydrogen-bonded Turntrans-60.1-47.8179.9-83.5161.3000111.9W3 L71 F101 P110 V114 G149W3-L151 HydrophobicContact CB-CD2 4.4Å; W3-L151 HydrophobicContact CD2-CD2 3.96Å; W3-L151 HydrophobicContact CE3-CB 4.04Å; W3-L151 HydrophobicContact CE3-CD2 3.39Å; W3-L151 HydrophobicContact CE3-CG 4.32Å; W3-L151 HydrophobicContact CG-CD2 4.41Å; W3-L151 HydrophobicContact CZ3-CB 3.69Å; W3-L151 HydrophobicContact CZ3-CD2 3.87Å; W3-L151 HydrophobicContact CZ3-CG 4.37Å; W3-L151 VanDerWaalsContact CZ3-O 3.26Å; W3-L151 WeakPolarHBondContact CZ3-O 3.38Å; L71-L151 HydrophobicContact CD1-CD1 4.37Å; F101-L151 HydrophobicContact CB-CD2 4.43Å; F101-L151 WeakPolarHBondContact O-CD2 3.28Å; F101-L151 WeakPolarHBondContact O-CG 3.5Å; P110-L151 HydrophobicContact CB-CD1 3.34Å; P110-L151 HydrophobicContact CG-CD1 4.26Å; V114-L151 HydrophobicContact CG2-CD1 4.34Å; G149-L151 PolarHBondContact O-N 3.5Å
152H69.9Low82.5Confident53 Ų5339.2 Ų39.225%0.24523%0.233CC..SBendtrans-113.7117169.1-98.274000107.7W3 R117 A154 D155 A156W3-H152 AromaticContact CH2-CE1 3.3Å; W3-H152 WeakPolarHBondContact CH2-CE1 3.46Å; W3-H152 AromaticContact CH2-ND1 3.19Å; W3-H152 WeakPolarHBondContact CH2-ND1 3.31Å; W3-H152 AromaticContact CZ3-CE1 3.7Å; W3-H152 AromaticContact CZ3-ND1 3.27Å; W3-H152 VanDerWaalsContact CZ3-ND1 3.27Å; W3-H152 WeakPolarHBondContact CZ3-ND1 3.29Å; R117-H152 PolarHBondContact NE-CD2 2.85Å; R117-H152 PolarHBondContact NH1-CD2 3.46Å; H152-A154 PolarHBondContact O-N 3.38Å; H152-A154 VanDerWaalsContact O-N 3.12Å; H152-D155 HydrophobicContact CB-CB 4.1Å; H152-D155 VanDerWaalsContact CB-OD2 3.31Å; H152-D155 WeakPolarHBondContact CB-OD2 3.46Å; H152-D155 IonicContact CG-OD2 3.7Å; H152-D155 PolarHBondContact O-N 3.45Å; H152-A156 PolarHBondContact O-N 3.13Å
153A71.7Confident82.8Confident93 Ų9333.3 Ų33.377%0.76921%0.206SC*.G310 helixtrans-55.6-33.5-179.500000112.5D155 A156A153-D155 VanDerWaalsContact C-N 3.25Å; A153-D155 PolarHBondContact O-N 2.98Å; A153-A156 PolarHBondContact O-N 3.28Å
154A77.9Confident83.1Confident61 Ų6132 Ų3250%0.50420%0.201SC..G310 helixtrans-67.7-21.2176.100000113.9H152 K158H152-A154 PolarHBondContact O-N 3.38Å; H152-A154 VanDerWaalsContact O-N 3.12Å; A154-K158 VanDerWaalsContact O-CE 3.24Å; A154-K158 WeakPolarHBondContact O-CE 3.26Å; A154-K158 PolarHBondContact O-NZ 2.91Å
155D80.6Confident83.4Confident5 Ų532 Ų323%0.02720%0.2CC..G310 helixtrans-99.7-8.7-178.7-62.9-20.2000113.4R117 H152 A153 G157 K158 L163R117-D155 IonicContact CZ-OD1 2.82Å; R117-D155 IonicContact CZ-OD2 3.44Å; R117-D155 IonicContact NE-OD1 3.96Å; R117-D155 IonicContact NE-OD2 3.68Å; R117-D155 PolarHBondContact NE-OD2 2.94Å; R117-D155 IonicContact NH2-OD1 2.78Å; R117-D155 PolarHBondContact NH2-OD1 3.38Å; R117-D155 IonicContact NH2-OD2 2.77Å; R117-D155 PolarHBondContact NH2-OD2 3.5Å; H152-D155 HydrophobicContact CB-CB 4.1Å; H152-D155 VanDerWaalsContact CB-OD2 3.31Å; H152-D155 WeakPolarHBondContact CB-OD2 3.46Å; H152-D155 IonicContact CG-OD2 3.7Å; H152-D155 PolarHBondContact O-N 3.45Å; A153-D155 VanDerWaalsContact C-N 3.25Å; A153-D155 PolarHBondContact O-N 2.98Å; D155-G157 PolarHBondContact O-N 3.3Å; D155-G157 VanDerWaalsContact O-N 3.15Å; D155-K158 WeakPolarHBondContact O-CB 3.41Å; D155-K158 PolarHBondContact O-N 3.36Å; D155-L163 WeakPolarHBondContact OD1-CD1 3.31Å
156A80.6Confident83.6Confident48 Ų4833.3 Ų33.340%0.39721%0.206SC..THydrogen-bonded Turntrans-56123.5-171.800000110.4H152 A153 K158H152-A156 PolarHBondContact O-N 3.13Å; A153-A156 PolarHBondContact O-N 3.28Å; A156-K158 VanDerWaalsContact C-N 3.28Å; A156-K158 PolarHBondContact O-N 2.87Å
157G81.9Confident83.9Confident33 Ų3334.8 Ų34.834%0.3421%0.209SC..THydrogen-bonded Turntrans80-2.5178.200000115.5R147 G148 D155R147-G157 VanDerWaalsContact CD-O 3.28Å; R147-G157 WeakPolarHBondContact CD-O 3.47Å; R147-G157 WeakPolarHBondContact CG-O 3.49Å; R147-G157 PolarHBondContact NH1-O 2.88Å; G148-G157 PolarHBondContact O-N 3.19Å; G148-G157 VanDerWaalsContact O-N 3.12Å; D155-G157 PolarHBondContact O-N 3.3Å; D155-G157 VanDerWaalsContact O-N 3.15Å
158K88.1Confident84.5Confident50 Ų5028.5 Ų28.522%0.21719%0.187CC..  trans-84.1145.3176-62.7178.7-177.1165.30111.2G148 A154 D155 A156 Q162 E166G148-K158 PolarHBondContact N-O 2.99Å; A154-K158 VanDerWaalsContact O-CE 3.24Å; A154-K158 WeakPolarHBondContact O-CE 3.26Å; A154-K158 PolarHBondContact O-NZ 2.91Å; D155-K158 WeakPolarHBondContact O-CB 3.41Å; D155-K158 PolarHBondContact O-N 3.36Å; A156-K158 VanDerWaalsContact C-N 3.28Å; A156-K158 PolarHBondContact O-N 2.87Å; K158-Q162 HydrophobicContact CB-CB 4.32Å; K158-E166 WeakPolarHBondContact CD-OE2 3.36Å; K158-E166 WeakPolarHBondContact CE-OE2 3.39Å; K158-E166 IonicContact NZ-OE1 3.55Å; K158-E166 PolarHBondContact NZ-OE1 3.34Å; K158-E166 IonicContact NZ-OE2 3.76Å; K158-E166 PolarHBondContact NZ-OE2 2.99Å
159T91.9Very high85.6Confident5 Ų529.8 Ų29.83%0.03119%0.191CC..BIsolated β-bridgetrans-74161.2167.564.90000110.2R147 V161 Q162 L163 D184R147-T159 HydrophobicContact CG-CG2 4.3Å; T159-V161 PolarHBondContact O-N 3.23Å; T159-Q162 PolarHBondContact O-N 3.32Å; T159-Q162 WeakPolarHBondContact OG1-CB 3.36Å; T159-Q162 VanDerWaalsContact OG1-CG 3.28Å; T159-Q162 WeakPolarHBondContact OG1-CG 3.46Å; T159-Q162 PolarHBondContact OG1-N 2.86Å; T159-Q162 VanDerWaalsContact OG1-N 3.13Å; T159-L163 PolarHBondContact O-N 2.88Å; T159-D184 VanDerWaalsContact CG2-OD2 3.31Å; T159-D184 WeakPolarHBondContact CG2-OD2 3.24Å; T159-D184 PolarHBondContact OG1-OD1 3.23Å; T159-D184 PolarHBondContact OG1-OD2 2.99Å
160A93.7Very high86.9Confident3 Ų330.2 Ų30.23%0.02519%0.194CC..Hα-helixtrans-60.1-33174.700000112.2L112 V116 L163 A164 L176L112-A160 HydrophobicContact CB-CB 3.86Å; V116-A160 HydrophobicContact CG2-CB 4.25Å; A160-L163 PolarHBondContact O-N 3.05Å; A160-A164 WeakPolarHBondContact O-CB 3.46Å; A160-A164 PolarHBondContact O-N 3.18Å; A160-L176 HydrophobicContact CB-CD1 3.84Å; A160-L176 HydrophobicContact CB-CD2 4.12Å
161V95.6Very high88.4Confident1 Ų132.1 Ų32.11%0.00620%0.198CC..Hα-helixtrans-66.4-50.3175.7173.50000110.6T159 L163 A164 V165 L173 L176 A181 D184 L211T159-V161 PolarHBondContact O-N 3.23Å; V161-L163 VanDerWaalsContact C-N 3.27Å; V161-L163 PolarHBondContact O-N 2.99Å; V161-A164 PolarHBondContact O-N 3.42Å; V161-V165 VanDerWaalsContact O-CG2 3.27Å; V161-V165 WeakPolarHBondContact O-CG2 3.48Å; V161-V165 PolarHBondContact O-N 3.05Å; V161-L173 HydrophobicContact CB-CD1 4.37Å; V161-L173 HydrophobicContact CG1-CD1 3.62Å; V161-L176 HydrophobicContact CG2-CB 4.07Å; V161-L176 HydrophobicContact CG2-CD1 4.14Å; V161-A181 HydrophobicContact CG2-CB 3.72Å; V161-D184 WeakPolarHBondContact CB-OD1 3.08Å; V161-D184 WeakPolarHBondContact CG1-O 3.21Å; V161-D184 WeakPolarHBondContact CG1-OD1 3.34Å; V161-L211 HydrophobicContact CG1-CD2 4.02Å
162Q94.6Very high89.8Confident39 Ų3930.8 Ų30.818%0.18219%0.191CC..Hα-helixtrans-56.7-42.8175.4-74.1175.4-28.900111.9K158 T159 V165 E166K158-Q162 HydrophobicContact CB-CB 4.32Å; T159-Q162 PolarHBondContact O-N 3.32Å; T159-Q162 WeakPolarHBondContact OG1-CB 3.36Å; T159-Q162 VanDerWaalsContact OG1-CG 3.28Å; T159-Q162 WeakPolarHBondContact OG1-CG 3.46Å; T159-Q162 PolarHBondContact OG1-N 2.86Å; T159-Q162 VanDerWaalsContact OG1-N 3.13Å; Q162-V165 PolarHBondContact O-N 3.19Å; Q162-E166 WeakPolarHBondContact O-CB 3.45Å; Q162-E166 PolarHBondContact O-N 3.32Å
163L94.9Very high91.1Very high1 Ų128.2 Ų28.21%0.00518%0.179CC..Hα-helixtrans-65.6-41.9178.1-175.558.5000112.4S113 V116 R117 D155 T159 A160 V161 V165 E166 L167S113-L163 VanDerWaalsContact O-CD2 3.3Å; S113-L163 WeakPolarHBondContact O-CD2 3.31Å; V116-L163 HydrophobicContact CB-CD2 4.37Å; V116-L163 HydrophobicContact CG1-CB 4.23Å; V116-L163 HydrophobicContact CG1-CD2 4.27Å; V116-L163 HydrophobicContact CG1-CG 3.98Å; R117-L163 HydrophobicContact CB-CD2 4.35Å; D155-L163 WeakPolarHBondContact OD1-CD1 3.31Å; T159-L163 PolarHBondContact O-N 2.88Å; A160-L163 PolarHBondContact O-N 3.05Å; V161-L163 VanDerWaalsContact C-N 3.27Å; V161-L163 PolarHBondContact O-N 2.99Å; L163-V165 VanDerWaalsContact C-N 3.26Å; L163-V165 PolarHBondContact O-N 3.01Å; L163-E166 PolarHBondContact O-N 3.26Å; L163-L167 HydrophobicContact CD1-CD1 3.73Å; L163-L167 HydrophobicContact CD1-CG 3.99Å; L163-L167 HydrophobicContact CG-CD1 3.94Å; L163-L167 HydrophobicContact CG-CG 4.48Å; L163-L167 WeakPolarHBondContact O-CB 3.48Å; L163-L167 WeakPolarHBondContact O-CG 3.04Å; L163-L167 PolarHBondContact O-N 2.78Å
164A96.6Very high92.2Very high0 Ų025.6 Ų25.60%015%0.152CC..Hα-helixtrans-63-36.6178.200000111.7V116 A160 V161 S168 H169 C172 L173 L176V116-A164 VanDerWaalsContact CG1-CA 3.44Å; V116-A164 HydrophobicContact CG1-CB 3.63Å; A160-A164 WeakPolarHBondContact O-CB 3.46Å; A160-A164 PolarHBondContact O-N 3.18Å; V161-A164 PolarHBondContact O-N 3.42Å; A164-S168 PolarHBondContact O-N 3.46Å; A164-S168 VanDerWaalsContact O-N 3.15Å; A164-H169 PolarHBondContact O-N 3.12Å; A164-C172 HydrophobicContact CB-CB 4.48Å; A164-L173 HydrophobicContact CB-CB 3.95Å; A164-L173 HydrophobicContact CB-CD1 4.5Å; A164-L176 HydrophobicContact CB-CD1 4.46Å
165V96.8Very high92.9Very high1 Ų125.3 Ų25.31%0.00614%0.14CC..Hα-helixtrans-68.9-48.2176.5172.40000111.2V161 Q162 L163 L167 S168 L173 V188 A189 L211V161-V165 VanDerWaalsContact O-CG2 3.27Å; V161-V165 WeakPolarHBondContact O-CG2 3.48Å; V161-V165 PolarHBondContact O-N 3.05Å; Q162-V165 PolarHBondContact O-N 3.19Å; L163-V165 VanDerWaalsContact C-N 3.26Å; L163-V165 PolarHBondContact O-N 3.01Å; V165-L167 VanDerWaalsContact C-N 3.29Å; V165-L167 PolarHBondContact O-N 3.3Å; V165-S168 PolarHBondContact O-N 3.08Å; V165-S168 VanDerWaalsContact O-N 3.07Å; V165-L173 HydrophobicContact CG2-CD1 4.12Å; V165-L173 HydrophobicContact CG2-CD2 3.98Å; V165-V188 HydrophobicContact CG1-CB 4.16Å; V165-V188 HydrophobicContact CG1-CG1 4.07Å; V165-A189 HydrophobicContact CG1-CB 3.48Å; V165-A189 VanDerWaalsContact CG1-CB 3.48Å; V165-A189 VanDerWaalsContact CG1-N 3.31Å; V165-L211 HydrophobicContact CG1-CD1 4.43Å; V165-L211 HydrophobicContact CG2-CD1 3.74Å; V165-L211 HydrophobicContact CG2-CD2 4.37Å; V165-L211 HydrophobicContact CG2-CG 4.24Å
166E95.1Very high93.6Very high62 Ų6225.1 Ų25.129%0.2914%0.139SC..Hα-helixtrans-58.9-42.1179.4-176.2174.615700112.1K158 Q162 L163 S168 V188 R192K158-E166 WeakPolarHBondContact CD-OE2 3.36Å; K158-E166 WeakPolarHBondContact CE-OE2 3.39Å; K158-E166 IonicContact NZ-OE1 3.55Å; K158-E166 PolarHBondContact NZ-OE1 3.34Å; K158-E166 IonicContact NZ-OE2 3.76Å; K158-E166 PolarHBondContact NZ-OE2 2.99Å; Q162-E166 WeakPolarHBondContact O-CB 3.45Å; Q162-E166 PolarHBondContact O-N 3.32Å; L163-E166 PolarHBondContact O-N 3.26Å; E166-S168 VanDerWaalsContact C-N 3.28Å; E166-S168 PolarHBondContact O-N 3.35Å; E166-V188 HydrophobicContact CB-CG1 3.97Å; E166-R192 WeakPolarHBondContact O-CD 3.45Å; E166-R192 PolarHBondContact O-NE 3.35Å
167L94.9Very high94.2Very high49 Ų4923 Ų2326%0.25712%0.121SC..THydrogen-bonded Turntrans-82.8-1178.6-60.4178.2000113.6R117 L163 V165 H169R117-L167 HydrophobicContact CB-CD1 4.36Å; L163-L167 HydrophobicContact CD1-CD1 3.73Å; L163-L167 HydrophobicContact CD1-CG 3.99Å; L163-L167 HydrophobicContact CG-CD1 3.94Å; L163-L167 HydrophobicContact CG-CG 4.48Å; L163-L167 WeakPolarHBondContact O-CB 3.48Å; L163-L167 WeakPolarHBondContact O-CG 3.04Å; L163-L167 PolarHBondContact O-N 2.78Å; V165-L167 VanDerWaalsContact C-N 3.29Å; V165-L167 PolarHBondContact O-N 3.3Å; L167-H169 PolarHBondContact O-CD2 2.92Å; L167-H169 PolarHBondContact O-N 3.12Å
168S96.3Very high94.6Very high9 Ų926.1 Ų26.16%0.06313%0.129CC..THydrogen-bonded Turntrans54.247.2-175.7-57.40000112.9A164 V165 E166 P170 R192 Q203A164-S168 PolarHBondContact O-N 3.46Å; A164-S168 VanDerWaalsContact O-N 3.15Å; V165-S168 PolarHBondContact O-N 3.08Å; V165-S168 VanDerWaalsContact O-N 3.07Å; E166-S168 VanDerWaalsContact C-N 3.28Å; E166-S168 PolarHBondContact O-N 3.35Å; S168-P170 VanDerWaalsContact C-CD 3.42Å; S168-P170 WeakPolarHBondContact O-CD 3.39Å; S168-R192 PolarHBondContact OG-NE 3.29Å; S168-Q203 WeakPolarHBondContact O-CB 3.35Å
169H96.9Very high94.7Very high35 Ų3526.4 Ų26.416%0.16213%0.131CC..  trans-10379.2177.1-67.2176.9000111.2V116 A164 L167 E171 C172 L173V116-H169 PolarHBondContact O-CE1 2.87Å; V116-H169 VanDerWaalsContact O-CE1 3.26Å; V116-H169 PolarHBondContact O-ND1 3.24Å; A164-H169 PolarHBondContact O-N 3.12Å; L167-H169 PolarHBondContact O-CD2 2.92Å; L167-H169 PolarHBondContact O-N 3.12Å; H169-E171 VanDerWaalsContact C-N 3.35Å; H169-E171 PolarHBondContact O-N 2.84Å; H169-C172 HydrophobicContact CB-CB 4.15Å; H169-C172 PolarHBondContact O-N 2.65Å; H169-L173 PolarHBondContact O-N 3.34Å
170P95.8Very high94.5Very high11 Ų1127.5 Ų27.57%0.07114%0.143CC..Hα-helixtrans-65-33.8-171.425.4-36.1000113.5S168 L173 L174 Q203 R206 F210S168-P170 VanDerWaalsContact C-CD 3.42Å; S168-P170 WeakPolarHBondContact O-CD 3.39Å; P170-L173 PolarHBondContact O-N 2.65Å; P170-L174 WeakPolarHBondContact O-CB 3.41Å; P170-L174 PolarHBondContact O-N 3.36Å; P170-Q203 HydrophobicContact CG-CB 4.27Å; P170-Q203 HydrophobicContact CG-CG 4.37Å; P170-R206 HydrophobicContact CB-CB 3.77Å; P170-R206 HydrophobicContact CG-CB 4.32Å; P170-F210 HydrophobicContact CB-CD2 4.2Å; P170-F210 HydrophobicContact CB-CE2 3.85Å; P170-F210 WeakPolarHBondContact O-CE2 3.28Å
171E95.9Very high94.5Very high87 Ų8727.6 Ų27.641%0.40714%0.144SC..Hα-helixtrans-69.5-41.8-179.9-57.1-52142.400111.8V121 H169 L173 L174 Q175V121-E171 HydrophobicContact CG1-CB 4.24Å; V121-E171 HydrophobicContact CG2-CB 3.9Å; H169-E171 VanDerWaalsContact C-N 3.35Å; H169-E171 PolarHBondContact O-N 2.84Å; E171-L173 VanDerWaalsContact C-N 3.34Å; E171-L174 PolarHBondContact O-N 3.48Å; E171-Q175 WeakPolarHBondContact O-CG 3.42Å; E171-Q175 PolarHBondContact O-N 2.89Å; E171-Q175 VanDerWaalsContact O-N 3.11Å
172C96.9Very high94.3Very high0 Ų034.8 Ų34.80%017%0.171CC..Hα-helixtrans-62.1-43.9172-73.70000111.5V116 N119 L124 A164 H169 Q175 L176V116-C172 HydrophobicContact CG2-CB 4.24Å; N119-C172 PolarHBondContact OD1-SG 3.28Å; L124-C172 HydrophobicContact CD2-CB 3.91Å; A164-C172 HydrophobicContact CB-CB 4.48Å; H169-C172 HydrophobicContact CB-CB 4.15Å; H169-C172 PolarHBondContact O-N 2.65Å; C172-Q175 PolarHBondContact O-N 3.08Å; C172-L176 VanDerWaalsContact O-CG 3.32Å; C172-L176 WeakPolarHBondContact O-CG 3.48Å; C172-L176 PolarHBondContact O-N 2.86Å; C172-L176 VanDerWaalsContact O-N 3.07Å
173L96.6Very high94.2Very high0 Ų034.5 Ų34.50%017%0.172CC..Hα-helixtrans-59.8-48.2177.3176.564000111.5V161 A164 V165 H169 P170 E171 Q175 L176 L177 C207 F210 L211V161-L173 HydrophobicContact CB-CD1 4.37Å; V161-L173 HydrophobicContact CG1-CD1 3.62Å; A164-L173 HydrophobicContact CB-CB 3.95Å; A164-L173 HydrophobicContact CB-CD1 4.5Å; V165-L173 HydrophobicContact CG2-CD1 4.12Å; V165-L173 HydrophobicContact CG2-CD2 3.98Å; H169-L173 PolarHBondContact O-N 3.34Å; P170-L173 PolarHBondContact O-N 2.65Å; E171-L173 VanDerWaalsContact C-N 3.34Å; L173-Q175 VanDerWaalsContact C-N 3.33Å; L173-Q175 PolarHBondContact O-N 3Å; L173-L176 WeakPolarHBondContact O-CB 3.32Å; L173-L176 PolarHBondContact O-N 2.92Å; L173-L177 HydrophobicContact CD1-CD1 3.87Å; L173-L177 HydrophobicContact CD1-CD2 4.47Å; L173-L177 HydrophobicContact CD1-CG 4Å; L173-L177 HydrophobicContact CD2-CD1 4.45Å; L173-L177 HydrophobicContact CG-CD1 3.82Å; L173-L177 HydrophobicContact CG-CG 4.31Å; L173-L177 VanDerWaalsContact O-CG 3.29Å; L173-L177 WeakPolarHBondContact O-CG 3.3Å; L173-L177 PolarHBondContact O-N 2.89Å; L173-C207 HydrophobicContact CD2-CB 3.77Å; L173-C207 WeakPolarHBondContact CD2-O 3.11Å; L173-F210 HydrophobicContact CD2-CB 4.11Å; L173-L211 HydrophobicContact CD1-CD2 4.19Å; L173-L211 HydrophobicContact CD2-CG 4.25Å
174L94Very high93.9Very high37 Ų3736.2 Ų36.219%0.19418%0.182CC..Hα-helixtrans-59.6-45-179.3-178.560.9000111.6P170 E171 L176 L177 I178 F210 F214P170-L174 WeakPolarHBondContact O-CB 3.41Å; P170-L174 PolarHBondContact O-N 3.36Å; E171-L174 PolarHBondContact O-N 3.48Å; L174-L176 PolarHBondContact O-N 3.3Å; L174-L177 PolarHBondContact O-N 3.34Å; L174-I178 HydrophobicContact CD1-CD1 3.72Å; L174-I178 HydrophobicContact CD1-CG1 3.99Å; L174-I178 HydrophobicContact CD2-CD1 4.32Å; L174-I178 HydrophobicContact CG-CD1 3.68Å; L174-I178 HydrophobicContact CG-CG1 4.32Å; L174-I178 WeakPolarHBondContact O-CB 3.26Å; L174-I178 WeakPolarHBondContact O-CG1 3.32Å; L174-I178 PolarHBondContact O-N 3.35Å; L174-F210 HydrophobicContact CB-CD2 3.95Å; L174-F210 HydrophobicContact CB-CE2 3.77Å; L174-F210 HydrophobicContact CB-CZ 4.26Å; L174-F210 HydrophobicContact CD1-CD1 4.1Å; L174-F210 HydrophobicContact CD1-CD2 4.45Å; L174-F210 HydrophobicContact CD1-CE1 4.1Å; L174-F210 HydrophobicContact CD1-CE2 4.44Å; L174-F210 HydrophobicContact CD1-CG 4.29Å; L174-F210 HydrophobicContact CD1-CZ 4.27Å; L174-F210 HydrophobicContact CD2-CE1 4.31Å; L174-F210 HydrophobicContact CD2-CE2 4.18Å; L174-F210 HydrophobicContact CD2-CZ 3.85Å; L174-F210 HydrophobicContact CG-CE2 4.34Å; L174-F210 HydrophobicContact CG-CZ 4.35Å; L174-F214 HydrophobicContact CD1-CE2 4.03Å; L174-F214 HydrophobicContact CD1-CZ 4.42Å
175Q93.4Very high93.6Very high56 Ų5636.7 Ų36.726%0.26219%0.186SC..Hα-helixtrans-57.9-48.9175.5-72.5-70-58.800111.1L124 E171 C172 L173 L177 I178 H179L124-Q175 HydrophobicContact CD2-CB 3.7Å; L124-Q175 HydrophobicContact CD2-CG 4.38Å; L124-Q175 HydrophobicContact CG-CB 4.28Å; E171-Q175 WeakPolarHBondContact O-CG 3.42Å; E171-Q175 PolarHBondContact O-N 2.89Å; E171-Q175 VanDerWaalsContact O-N 3.11Å; C172-Q175 PolarHBondContact O-N 3.08Å; L173-Q175 VanDerWaalsContact C-N 3.33Å; L173-Q175 PolarHBondContact O-N 3Å; Q175-L177 VanDerWaalsContact C-N 3.32Å; Q175-L177 PolarHBondContact O-N 2.84Å; Q175-I178 PolarHBondContact O-N 3.32Å; Q175-H179 WeakPolarHBondContact O-CB 3.36Å; Q175-H179 PolarHBondContact O-CD2 2.89Å; Q175-H179 PolarHBondContact O-N 3.01Å; Q175-H179 VanDerWaalsContact O-N 3.1Å
176L94.8Very high93.4Very high0 Ų036.9 Ų36.90%019%0.187CC..Hα-helixtrans-56.9-45.8177.3-69.4165.4000112L112 V116 L124 M128 L144 A160 V161 A164 C172 L173 L174 H179 G180 A181L112-L176 HydrophobicContact CD2-CD2 4.33Å; V116-L176 HydrophobicContact CG2-CD1 3.99Å; L124-L176 HydrophobicContact CD1-CD2 4.35Å; L124-L176 HydrophobicContact CD2-CG 4.47Å; M128-L176 HydrophobicContact CE-CD2 3.64Å; L144-L176 HydrophobicContact CD2-CD2 4.26Å; A160-L176 HydrophobicContact CB-CD1 3.84Å; A160-L176 HydrophobicContact CB-CD2 4.12Å; V161-L176 HydrophobicContact CG2-CB 4.07Å; V161-L176 HydrophobicContact CG2-CD1 4.14Å; A164-L176 HydrophobicContact CB-CD1 4.46Å; C172-L176 VanDerWaalsContact O-CG 3.32Å; C172-L176 WeakPolarHBondContact O-CG 3.48Å; C172-L176 PolarHBondContact O-N 2.86Å; C172-L176 VanDerWaalsContact O-N 3.07Å; L173-L176 WeakPolarHBondContact O-CB 3.32Å; L173-L176 PolarHBondContact O-N 2.92Å; L174-L176 PolarHBondContact O-N 3.3Å; L176-H179 PolarHBondContact O-N 3.46Å; L176-G180 PolarHBondContact O-N 3Å; L176-A181 HydrophobicContact CB-CB 4Å; L176-A181 WeakPolarHBondContact O-CB 3.45Å; L176-A181 PolarHBondContact O-N 3.02Å
177L93.3Very high93.2Very high5 Ų538.3 Ų38.33%0.02619%0.194CC..Hα-helixtrans-68.6-43.2-177.2-67176.6000112.9L173 L174 Q175 H179 G180 P183 F210 F214L173-L177 HydrophobicContact CD1-CD1 3.87Å; L173-L177 HydrophobicContact CD1-CD2 4.47Å; L173-L177 HydrophobicContact CD1-CG 4Å; L173-L177 HydrophobicContact CD2-CD1 4.45Å; L173-L177 HydrophobicContact CG-CD1 3.82Å; L173-L177 HydrophobicContact CG-CG 4.31Å; L173-L177 VanDerWaalsContact O-CG 3.29Å; L173-L177 WeakPolarHBondContact O-CG 3.3Å; L173-L177 PolarHBondContact O-N 2.89Å; L174-L177 PolarHBondContact O-N 3.34Å; Q175-L177 VanDerWaalsContact C-N 3.32Å; Q175-L177 PolarHBondContact O-N 2.84Å; L177-H179 PolarHBondContact O-N 3.24Å; L177-G180 PolarHBondContact O-N 2.91Å; L177-P183 HydrophobicContact CD2-CB 3.75Å; L177-F210 HydrophobicContact CD1-CB 4.01Å; L177-F214 HydrophobicContact CB-CB 4.4Å; L177-F214 HydrophobicContact CB-CD1 3.97Å; L177-F214 HydrophobicContact CB-CD2 3.81Å; L177-F214 HydrophobicContact CB-CE1 4.16Å; L177-F214 HydrophobicContact CB-CE2 4.01Å; L177-F214 HydrophobicContact CB-CG 3.79Å; L177-F214 HydrophobicContact CB-CZ 4.19Å; L177-F214 HydrophobicContact CD1-CB 4.21Å; L177-F214 HydrophobicContact CD1-CD2 3.73Å; L177-F214 HydrophobicContact CD1-CE2 4.39Å; L177-F214 HydrophobicContact CD1-CG 4.1Å; L177-F214 HydrophobicContact CD2-CB 4.23Å; L177-F214 HydrophobicContact CG-CD2 4.35Å; L177-F214 HydrophobicContact CG-CG 4.36Å
178I90.3Very high93.1Very high98 Ų9837.7 Ų37.750%0.50319%0.192SC..Hα-helixtrans-61.6-35.8176.1-70.1171.8000110.7L174 Q175 G180 F214L174-I178 HydrophobicContact CD1-CD1 3.72Å; L174-I178 HydrophobicContact CD1-CG1 3.99Å; L174-I178 HydrophobicContact CD2-CD1 4.32Å; L174-I178 HydrophobicContact CG-CD1 3.68Å; L174-I178 HydrophobicContact CG-CG1 4.32Å; L174-I178 WeakPolarHBondContact O-CB 3.26Å; L174-I178 WeakPolarHBondContact O-CG1 3.32Å; L174-I178 PolarHBondContact O-N 3.35Å; Q175-I178 PolarHBondContact O-N 3.32Å; I178-G180 PolarHBondContact O-N 3.32Å; I178-F214 HydrophobicContact CG1-CE1 4.4Å; I178-F214 HydrophobicContact CG1-CZ 3.79Å
179H89.3Confident93Very high55 Ų5537.4 Ų37.426%0.25519%0.19SC..THydrogen-bonded Turntrans-814.6176.5-74.1-77.9000114.1M128 L144 Q175 L176 L177M128-H179 HydrophobicContact CG-CB 4.34Å; M128-H179 VanDerWaalsContact CG-CD2 3.47Å; M128-H179 WeakPolarHBondContact CG-CD2 3.39Å; M128-H179 HydrophobicContact SD-CB 3.73Å; L144-H179 VanDerWaalsContact CD1-O 3.25Å; L144-H179 WeakPolarHBondContact CD1-O 3.31Å; Q175-H179 WeakPolarHBondContact O-CB 3.36Å; Q175-H179 PolarHBondContact O-CD2 2.89Å; Q175-H179 PolarHBondContact O-N 3.01Å; Q175-H179 VanDerWaalsContact O-N 3.1Å; L176-H179 PolarHBondContact O-N 3.46Å; L177-H179 PolarHBondContact O-N 3.24Å
180G89.5Confident92.8Very high28 Ų2835.8 Ų35.829%0.28918%0.182SC..THydrogen-bonded Turntrans94.214.1167.600000115.6R141 L176 L177 I178R141-G180 PolarHBondContact NH2-O 3.32Å; L176-G180 PolarHBondContact O-N 3Å; L177-G180 PolarHBondContact O-N 2.91Å; I178-G180 PolarHBondContact O-N 3.32Å
181A92.7Very high92.6Very high5 Ų540.4 Ų40.44%0.04120%0.203CC..  trans-60147.7168.700000110.3L144 V161 L176L144-A181 HydrophobicContact CB-CB 4.16Å; V161-A181 HydrophobicContact CG2-CB 3.72Å; L176-A181 HydrophobicContact CB-CB 4Å; L176-A181 WeakPolarHBondContact O-CB 3.45Å; L176-A181 PolarHBondContact O-N 3.02Å
182R92.5Very high92.6Very high152 Ų15238.4 Ų38.457%0.57419%0.192SC*.  trans-66.9133.8178.2-70.6171.864.9172-0.2110D145 D184D145-R182 WeakPolarHBondContact OD1-CG 3.19Å; D145-R182 PolarHBondContact OD1-N 3.44Å; D145-R182 WeakPolarHBondContact OD2-CD 3.49Å; D145-R182 VanDerWaalsContact OD2-CG 3.27Å; D145-R182 WeakPolarHBondContact OD2-CG 3.16Å; R182-D184 PolarHBondContact O-N 2.93Å
183P92.6Very high92.4Very high33 Ų3338.6 Ų38.621%0.21419%0.193CC..  trans-76.456.8175.233.7-37.1000111L177 L211 F214 L215L177-P183 HydrophobicContact CD2-CB 3.75Å; P183-L211 HydrophobicContact CB-CD2 4.08Å; P183-F214 HydrophobicContact CB-CB 4.08Å; P183-F214 HydrophobicContact CG-CB 4.37Å; P183-L215 HydrophobicContact CG-CD1 4.2Å
184D87.7Confident92.1Very high38 Ų3841.2 Ų41.220%0.20321%0.209CC..  trans-79.9168.217165.26.4000111.2T159 V161 R182 L211T159-D184 VanDerWaalsContact CG2-OD2 3.31Å; T159-D184 WeakPolarHBondContact CG2-OD2 3.24Å; T159-D184 PolarHBondContact OG1-OD1 3.23Å; T159-D184 PolarHBondContact OG1-OD2 2.99Å; V161-D184 WeakPolarHBondContact CB-OD1 3.08Å; V161-D184 WeakPolarHBondContact CG1-O 3.21Å; V161-D184 WeakPolarHBondContact CG1-OD1 3.34Å; R182-D184 PolarHBondContact O-N 2.93Å; D184-L211 WeakPolarHBondContact O-CD2 3.43Å
185G89.3Confident92Very high9 Ų943.5 Ų43.59%0.09323%0.228CC..  trans89.214-178.600000115.9E187 V188 A189G185-E187 VanDerWaalsContact C-N 3.28Å; G185-E187 PolarHBondContact O-N 3.26Å; G185-V188 WeakPolarHBondContact O-CB 3.23Å; G185-V188 PolarHBondContact O-N 3.1Å; G185-V188 VanDerWaalsContact O-N 3.1Å; G185-A189 PolarHBondContact O-N 3.45Å
186L92.6Very high91.9Very high6 Ų641.5 Ų41.53%0.03122%0.22CC..Hα-helixtrans-56.3-41.5173.3-177.561.5000112.7V188 A189 L190 L208 L212 L215 P219 L221 L243L186-V188 VanDerWaalsContact C-N 3.33Å; L186-V188 PolarHBondContact O-N 3.15Å; L186-A189 WeakPolarHBondContact O-CB 3.25Å; L186-A189 PolarHBondContact O-N 3.4Å; L186-L190 WeakPolarHBondContact O-CG 3.35Å; L186-L190 PolarHBondContact O-N 2.83Å; L186-L208 HydrophobicContact CD1-CD1 3.43Å; L186-L208 VanDerWaalsContact CD1-CD1 3.43Å; L186-L212 HydrophobicContact CD1-CD2 4.03Å; L186-L215 HydrophobicContact CD2-CD2 3.87Å; L186-P219 HydrophobicContact CD2-CG 3.94Å; L186-L221 HydrophobicContact CD2-CD1 3.6Å; L186-L221 HydrophobicContact CG-CD1 3.91Å; L186-L243 HydrophobicContact CD2-CD1 4.5Å; L186-L243 HydrophobicContact CD2-CD2 3.86Å
187E91.3Very high91.8Very high92 Ų9246.4 Ų46.443%0.4325%0.245SC..Hα-helixtrans-61.6-42.9175.5-172.6171.2-167.100111.8G185 A189 L190 Q191 L221G185-E187 VanDerWaalsContact C-N 3.28Å; G185-E187 PolarHBondContact O-N 3.26Å; E187-A189 VanDerWaalsContact C-N 3.31Å; E187-A189 PolarHBondContact O-N 3.41Å; E187-L190 PolarHBondContact O-N 3.3Å; E187-Q191 WeakPolarHBondContact O-CG 3.45Å; E187-Q191 PolarHBondContact O-N 2.97Å; E187-L221 HydrophobicContact CB-CD2 3.8Å; E187-L221 HydrophobicContact CG-CD2 4.31Å
188V92.6Very high91.6Very high36 Ų3652.6 Ų52.622%0.21828%0.283CS..Hα-helixtrans-62.2-40175.6-176.40000110.6V165 E166 G185 L186 L190 Q191 R192V165-V188 HydrophobicContact CG1-CB 4.16Å; V165-V188 HydrophobicContact CG1-CG1 4.07Å; E166-V188 HydrophobicContact CB-CG1 3.97Å; G185-V188 WeakPolarHBondContact O-CB 3.23Å; G185-V188 PolarHBondContact O-N 3.1Å; G185-V188 VanDerWaalsContact O-N 3.1Å; L186-V188 VanDerWaalsContact C-N 3.33Å; L186-V188 PolarHBondContact O-N 3.15Å; V188-L190 PolarHBondContact O-N 2.78Å; V188-Q191 PolarHBondContact O-N 3.38Å; V188-R192 VanDerWaalsContact O-CB 3.24Å; V188-R192 WeakPolarHBondContact O-CB 3.44Å; V188-R192 PolarHBondContact O-N 3.05Å
189A94.4Very high91.6Very high2 Ų252.2 Ų52.22%0.01729%0.289CS..Hα-helixtrans-63.2-43.2177.600000112.2V165 G185 L186 E187 R192 L193 L208 L211V165-A189 HydrophobicContact CG1-CB 3.48Å; V165-A189 VanDerWaalsContact CG1-CB 3.48Å; V165-A189 VanDerWaalsContact CG1-N 3.31Å; G185-A189 PolarHBondContact O-N 3.45Å; L186-A189 WeakPolarHBondContact O-CB 3.25Å; L186-A189 PolarHBondContact O-N 3.4Å; E187-A189 VanDerWaalsContact C-N 3.31Å; E187-A189 PolarHBondContact O-N 3.41Å; A189-R192 PolarHBondContact O-N 3.41Å; A189-L193 WeakPolarHBondContact O-CB 3.3Å; A189-L193 PolarHBondContact O-N 3.24Å; A189-L208 HydrophobicContact CB-CB 4.39Å; A189-L208 HydrophobicContact CB-CD1 4.19Å; A189-L211 HydrophobicContact CB-CD1 3.67Å
190L93.4Very high91.7Very high1 Ų152.6 Ų52.61%0.00529%0.29CS..Hα-helixtrans-64.6-45.8177.3-68.7173.3000111.4L186 E187 V188 R192 L193 V194 L208 L221 L224 W231 L235L186-L190 WeakPolarHBondContact O-CG 3.35Å; L186-L190 PolarHBondContact O-N 2.83Å; E187-L190 PolarHBondContact O-N 3.3Å; V188-L190 PolarHBondContact O-N 2.78Å; L190-R192 VanDerWaalsContact C-N 3.3Å; L190-R192 PolarHBondContact O-N 3.14Å; L190-L193 PolarHBondContact O-N 3.03Å; L190-V194 PolarHBondContact O-N 2.75Å; L190-L208 HydrophobicContact CD2-CD1 4.27Å; L190-L221 HydrophobicContact CD1-CD1 3.69Å; L190-L224 HydrophobicContact CD1-CD2 3.95Å; L190-L224 HydrophobicContact CD1-CG 4.44Å; L190-W231 HydrophobicContact CB-CH2 3.79Å; L190-W231 HydrophobicContact CB-CZ3 3.81Å; L190-W231 HydrophobicContact CD2-CE3 4.11Å; L190-W231 HydrophobicContact CD2-CZ3 3.83Å; L190-W231 HydrophobicContact CG-CZ3 4.33Å; L190-L235 HydrophobicContact CD2-CD1 4.08Å; L190-L235 HydrophobicContact CD2-CD2 3.73Å; L190-L235 HydrophobicContact CD2-CG 4.38Å
191Q92.4Very high91.9Very high108 Ų10856 Ų5651%0.50530%0.295SS..Hα-helixtrans-61.4-40.6174.4-71.1176.82.600111.5E187 V188 V194 S195E187-Q191 WeakPolarHBondContact O-CG 3.45Å; E187-Q191 PolarHBondContact O-N 2.97Å; V188-Q191 PolarHBondContact O-N 3.38Å; Q191-V194 PolarHBondContact O-N 3.45Å; Q191-S195 WeakPolarHBondContact O-CB 3.47Å; Q191-S195 PolarHBondContact O-N 3.16Å; Q191-S195 PolarHBondContact O-OG 3.34Å
192R94.3Very high91.9Very high46 Ų4661.4 Ų61.417%0.17432%0.319CS..Hα-helixtrans-65.1-43.7178.7-170.456.4166.8124.95.2112E166 S168 V188 A189 L190 V194 S195 C196 E200 A204E166-R192 WeakPolarHBondContact O-CD 3.45Å; E166-R192 PolarHBondContact O-NE 3.35Å; S168-R192 PolarHBondContact OG-NE 3.29Å; V188-R192 VanDerWaalsContact O-CB 3.24Å; V188-R192 WeakPolarHBondContact O-CB 3.44Å; V188-R192 PolarHBondContact O-N 3.05Å; A189-R192 PolarHBondContact O-N 3.41Å; L190-R192 VanDerWaalsContact C-N 3.3Å; L190-R192 PolarHBondContact O-N 3.14Å; R192-V194 PolarHBondContact O-N 2.89Å; R192-S195 PolarHBondContact O-N 3.42Å; R192-S195 PolarHBondContact O-OG 3.38Å; R192-C196 WeakPolarHBondContact O-CB 3.05Å; R192-C196 PolarHBondContact O-N 3.01Å; R192-C196 PolarHBondContact O-SG 3.36Å; R192-C196 VanDerWaalsContact O-SG 3.35Å; R192-E200 IonicContact CZ-OE2 2.84Å; R192-E200 IonicContact NH1-OE2 3.01Å; R192-E200 PolarHBondContact NH1-OE2 2.98Å; R192-E200 IonicContact NH2-OE1 2.62Å; R192-E200 PolarHBondContact NH2-OE1 3.36Å; R192-E200 IonicContact NH2-OE2 3.21Å; R192-E200 PolarHBondContact NH2-OE2 3.08Å; R192-A204 HydrophobicContact CG-CB 4.2Å
193L92.7Very high92Very high4 Ų457.3 Ų57.32%0.02131%0.306CS..Hα-helixtrans-61.4-29.4176-86.8171.8000114.3A189 L190 R201 A204 Q205 L208A189-L193 WeakPolarHBondContact O-CB 3.3Å; A189-L193 PolarHBondContact O-N 3.24Å; L190-L193 PolarHBondContact O-N 3.03Å; L193-R201 PolarHBondContact O-NH1 3.23Å; L193-A204 HydrophobicContact CD2-CB 3.87Å; L193-A204 HydrophobicContact CG-CB 4.22Å; L193-Q205 HydrophobicContact CD2-CB 4.1Å; L193-L208 HydrophobicContact CD1-CB 3.79Å; L193-L208 HydrophobicContact CD1-CD2 3.31Å; L193-L208 HydrophobicContact CD1-CG 4.09Å
194V92.1Very high92.1Very high55 Ų5555.8 Ų55.833%0.33330%0.297SS..Hα-helixtrans-77.2-40.7175.9155.50000111.8L190 Q191 R192 W231 L234L190-V194 PolarHBondContact O-N 2.75Å; Q191-V194 PolarHBondContact O-N 3.45Å; R192-V194 PolarHBondContact O-N 2.89Å; V194-W231 HydrophobicContact CG2-CH2 3.51Å; V194-W231 HydrophobicContact CG2-CZ2 4.35Å; V194-W231 HydrophobicContact CG2-CZ3 3.83Å; V194-L234 HydrophobicContact CG2-CD1 4.03Å
195S91.9Very high92.5Very high84 Ų8456.8 Ų56.859%0.58730%0.3SS*.Hα-helixtrans-95.9-17.4-170.455.10000114.4Q191 R192Q191-S195 WeakPolarHBondContact O-CB 3.47Å; Q191-S195 PolarHBondContact O-N 3.16Å; Q191-S195 PolarHBondContact O-OG 3.34Å; R192-S195 PolarHBondContact O-N 3.42Å; R192-S195 PolarHBondContact O-OG 3.38Å
196C90.6Very high92.7Very high15 Ų1561.3 Ų61.310%0.10132%0.315CS..SBendtrans-68.6147.4-176.168.20000112.5R192 E200R192-C196 WeakPolarHBondContact O-CB 3.05Å; R192-C196 PolarHBondContact O-N 3.01Å; R192-C196 PolarHBondContact O-SG 3.36Å; R192-C196 VanDerWaalsContact O-SG 3.35Å; C196-E200 HydrophobicContact CB-CB 4.12Å
197I92.4Very high92.9Very high103 Ų10361.1 Ų61.153%0.52831%0.313SS..  trans-70.2161.817059.7173.1000110.6S199 E200 R201I197-S199 WeakPolarHBondContact CD1-OG 3.24Å; I197-S199 WeakPolarHBondContact CG1-OG 3.31Å; I197-S199 PolarHBondContact O-N 3.12Å; I197-S199 VanDerWaalsContact O-N 3.16Å; I197-E200 HydrophobicContact CD1-CG 4.26Å; I197-E200 HydrophobicContact CG1-CB 4.29Å; I197-E200 HydrophobicContact CG1-CG 3.75Å; I197-E200 PolarHBondContact O-N 2.99Å; I197-R201 PolarHBondContact O-N 3.45Å
198V89.6Confident93.1Very high135 Ų13556.8 Ų56.882%0.81829%0.293SS*.G310 helixtrans-55.3-37.9-174.7179.40000112.6E200 R201V198-E200 VanDerWaalsContact C-N 3.29Å; V198-E200 PolarHBondContact O-N 3.03Å; V198-R201 WeakPolarHBondContact O-CB 3.3Å; V198-R201 PolarHBondContact O-N 2.96Å
199S90.3Very high93.1Very high89 Ų8958.5 Ų58.562%0.62230%0.301SS*.G310 helixtrans-67.4-24.8-179.152.20000114.3I197 Q203I197-S199 WeakPolarHBondContact CD1-OG 3.24Å; I197-S199 WeakPolarHBondContact CG1-OG 3.31Å; I197-S199 PolarHBondContact O-N 3.12Å; I197-S199 VanDerWaalsContact O-N 3.16Å; S199-Q203 PolarHBondContact O-OE1 3.44Å
200E91.3Very high93Very high63 Ų6360.4 Ų60.429%0.29431%0.309SS..G310 helixtrans-97.2-9.7-179.1-62176.9142.200112.4R192 C196 I197 V198 Q202 Q203 A204R192-E200 IonicContact CZ-OE2 2.84Å; R192-E200 IonicContact NH1-OE2 3.01Å; R192-E200 PolarHBondContact NH1-OE2 2.98Å; R192-E200 IonicContact NH2-OE1 2.62Å; R192-E200 PolarHBondContact NH2-OE1 3.36Å; R192-E200 IonicContact NH2-OE2 3.21Å; R192-E200 PolarHBondContact NH2-OE2 3.08Å; C196-E200 HydrophobicContact CB-CB 4.12Å; I197-E200 HydrophobicContact CD1-CG 4.26Å; I197-E200 HydrophobicContact CG1-CB 4.29Å; I197-E200 HydrophobicContact CG1-CG 3.75Å; I197-E200 PolarHBondContact O-N 2.99Å; V198-E200 VanDerWaalsContact C-N 3.29Å; V198-E200 PolarHBondContact O-N 3.03Å; E200-Q202 VanDerWaalsContact C-N 3.28Å; E200-Q202 PolarHBondContact O-N 3.42Å; E200-Q203 PolarHBondContact O-N 2.93Å; E200-Q203 PolarHBondContact O-OE1 3.33Å; E200-A204 WeakPolarHBondContact O-CB 3.32Å; E200-A204 PolarHBondContact O-N 3.01Å
201R92.6Very high93.1Very high101 Ų10160.5 Ų60.538%0.38131%0.31SS..Hα-helixtrans-60.9-37.7-171.6-171.8174.1-173.678.32.9112.4L193 I197 V198 Q205L193-R201 PolarHBondContact O-NH1 3.23Å; I197-R201 PolarHBondContact O-N 3.45Å; V198-R201 WeakPolarHBondContact O-CB 3.3Å; V198-R201 PolarHBondContact O-N 2.96Å; R201-Q205 VanDerWaalsContact O-CB 3.28Å; R201-Q205 WeakPolarHBondContact O-CB 3.31Å; R201-Q205 PolarHBondContact O-N 2.65Å
202Q93.9Very high93Very high118 Ų11855.7 Ų55.755%0.55129%0.287SS*.Hα-helixtrans-65.2-43.4178.9-171.3-17722.500111.4E200 Q205 R206E200-Q202 VanDerWaalsContact C-N 3.28Å; E200-Q202 PolarHBondContact O-N 3.42Å; Q202-Q205 PolarHBondContact O-N 3.42Å; Q202-R206 WeakPolarHBondContact O-CG 3.39Å; Q202-R206 PolarHBondContact O-N 2.73Å
203Q94.4Very high92.8Very high65 Ų6555 Ų5530%0.30429%0.287SS..Hα-helixtrans-70-42.3179.5-67.475.77.900111S168 P170 S199 E200 Q205 R206 C207S168-Q203 WeakPolarHBondContact O-CB 3.35Å; P170-Q203 HydrophobicContact CG-CB 4.27Å; P170-Q203 HydrophobicContact CG-CG 4.37Å; S199-Q203 PolarHBondContact O-OE1 3.44Å; E200-Q203 PolarHBondContact O-N 2.93Å; E200-Q203 PolarHBondContact O-OE1 3.33Å; Q203-Q205 VanDerWaalsContact C-N 3.3Å; Q203-Q205 PolarHBondContact O-N 2.62Å; Q203-R206 PolarHBondContact O-N 3.36Å; Q203-C207 PolarHBondContact O-N 2.84Å; Q203-C207 PolarHBondContact O-SG 3.07Å; Q203-C207 VanDerWaalsContact O-SG 3.4Å
204A95.4Very high92.7Very high2 Ų257.3 Ų57.32%0.01730%0.297CS..Hα-helixtrans-60.2-40.4173.600000111.8R192 L193 E200 C207 L208R192-A204 HydrophobicContact CG-CB 4.2Å; L193-A204 HydrophobicContact CD2-CB 3.87Å; L193-A204 HydrophobicContact CG-CB 4.22Å; E200-A204 WeakPolarHBondContact O-CB 3.32Å; E200-A204 PolarHBondContact O-N 3.01Å; A204-C207 WeakPolarHBondContact O-CB 3.47Å; A204-C207 PolarHBondContact O-N 3.35Å; A204-L208 PolarHBondContact O-N 3.42Å
205Q94.7Very high92.5Very high59 Ų5955.4 Ų55.428%0.27629%0.285SS..Hα-helixtrans-63.8-45.9175-174.563.443.600111.4L193 R201 Q202 Q203 C207 L208 D209L193-Q205 HydrophobicContact CD2-CB 4.1Å; R201-Q205 VanDerWaalsContact O-CB 3.28Å; R201-Q205 WeakPolarHBondContact O-CB 3.31Å; R201-Q205 PolarHBondContact O-N 2.65Å; Q202-Q205 PolarHBondContact O-N 3.42Å; Q203-Q205 VanDerWaalsContact C-N 3.3Å; Q203-Q205 PolarHBondContact O-N 2.62Å; Q205-C207 VanDerWaalsContact C-N 3.27Å; Q205-C207 PolarHBondContact O-N 3.46Å; Q205-L208 WeakPolarHBondContact O-CB 3.14Å; Q205-L208 PolarHBondContact O-N 3.41Å; Q205-L208 VanDerWaalsContact O-N 3.12Å; Q205-D209 PolarHBondContact NE2-OD1 2.77Å; Q205-D209 PolarHBondContact O-N 3.44Å
206R94.9Very high92Very high104 Ų10455.6 Ų55.639%0.39229%0.292SS..Hα-helixtrans-58.9-39.5174.8-73.9-179.2-177.4-1753.5112.1P170 Q202 Q203 D209 F210P170-R206 HydrophobicContact CB-CB 3.77Å; P170-R206 HydrophobicContact CG-CB 4.32Å; Q202-R206 WeakPolarHBondContact O-CG 3.39Å; Q202-R206 PolarHBondContact O-N 2.73Å; Q203-R206 PolarHBondContact O-N 3.36Å; R206-D209 PolarHBondContact O-N 2.85Å; R206-F210 WeakPolarHBondContact O-CD2 3.48Å; R206-F210 WeakPolarHBondContact O-CG 3.31Å; R206-F210 PolarHBondContact O-N 2.95Å
207C96.1Very high91.7Very high1 Ų163.1 Ų63.11%0.00732%0.322CS..Hα-helixtrans-60.5-45.9175-71.30000111.8L173 Q203 A204 Q205 F210 L211L173-C207 HydrophobicContact CD2-CB 3.77Å; L173-C207 WeakPolarHBondContact CD2-O 3.11Å; Q203-C207 PolarHBondContact O-N 2.84Å; Q203-C207 PolarHBondContact O-SG 3.07Å; Q203-C207 VanDerWaalsContact O-SG 3.4Å; A204-C207 WeakPolarHBondContact O-CB 3.47Å; A204-C207 PolarHBondContact O-N 3.35Å; Q205-C207 VanDerWaalsContact C-N 3.27Å; Q205-C207 PolarHBondContact O-N 3.46Å; C207-F210 PolarHBondContact O-N 3.37Å; C207-L211 WeakPolarHBondContact O-CG 3.35Å; C207-L211 PolarHBondContact O-N 3.45Å
208L94.8Very high91.2Very high1 Ų159.4 Ų59.41%0.00531%0.305CS..Hα-helixtrans-59.8-48.8174.2176.167000111.1L186 A189 L190 L193 A204 Q205 F210 L211 L212 L235L186-L208 HydrophobicContact CD1-CD1 3.43Å; L186-L208 VanDerWaalsContact CD1-CD1 3.43Å; A189-L208 HydrophobicContact CB-CB 4.39Å; A189-L208 HydrophobicContact CB-CD1 4.19Å; L190-L208 HydrophobicContact CD2-CD1 4.27Å; L193-L208 HydrophobicContact CD1-CB 3.79Å; L193-L208 HydrophobicContact CD1-CD2 3.31Å; L193-L208 HydrophobicContact CD1-CG 4.09Å; A204-L208 PolarHBondContact O-N 3.42Å; Q205-L208 WeakPolarHBondContact O-CB 3.14Å; Q205-L208 PolarHBondContact O-N 3.41Å; Q205-L208 VanDerWaalsContact O-N 3.12Å; L208-F210 VanDerWaalsContact C-N 3.3Å; L208-F210 PolarHBondContact O-N 3.43Å; L208-L211 PolarHBondContact O-N 2.99Å; L208-L211 VanDerWaalsContact O-N 3.14Å; L208-L212 HydrophobicContact CD1-CD1 4.09Å; L208-L212 HydrophobicContact CD1-CD2 4.3Å; L208-L212 HydrophobicContact CD1-CG 3.97Å; L208-L212 HydrophobicContact CD2-CD1 4.27Å; L208-L212 HydrophobicContact CG-CD1 3.84Å; L208-L212 HydrophobicContact CG-CG 4.15Å; L208-L212 VanDerWaalsContact O-CG 3.29Å; L208-L212 WeakPolarHBondContact O-CG 3.21Å; L208-L212 PolarHBondContact O-N 3.45Å; L208-L235 HydrophobicContact CD2-CD2 3.43Å; L208-L235 VanDerWaalsContact CD2-CD2 3.43Å
209D92.6Very high90.9Very high72 Ų7255.7 Ų55.739%0.38528%0.284SS..Hα-helixtrans-59.6-41.7-177.4-63.9-22.5000111.3Q205 R206 L212 L213Q205-D209 PolarHBondContact NE2-OD1 2.77Å; Q205-D209 PolarHBondContact O-N 3.44Å; R206-D209 PolarHBondContact O-N 2.85Å; D209-L212 PolarHBondContact O-N 2.87Å; D209-L213 WeakPolarHBondContact O-CB 3.24Å; D209-L213 PolarHBondContact O-N 2.73Å
210F93.4Very high90.6Very high43 Ų4358.8 Ų58.819%0.18929%0.293CS..Hα-helixtrans-65.4-44.1174-67.3-27.7000112.5P170 L173 L174 L177 R206 C207 L208 L212 L213 F214P170-F210 HydrophobicContact CB-CD2 4.2Å; P170-F210 HydrophobicContact CB-CE2 3.85Å; P170-F210 WeakPolarHBondContact O-CE2 3.28Å; L173-F210 HydrophobicContact CD2-CB 4.11Å; L174-F210 HydrophobicContact CB-CD2 3.95Å; L174-F210 HydrophobicContact CB-CE2 3.77Å; L174-F210 HydrophobicContact CB-CZ 4.26Å; L174-F210 HydrophobicContact CD1-CD1 4.1Å; L174-F210 HydrophobicContact CD1-CD2 4.45Å; L174-F210 HydrophobicContact CD1-CE1 4.1Å; L174-F210 HydrophobicContact CD1-CE2 4.44Å; L174-F210 HydrophobicContact CD1-CG 4.29Å; L174-F210 HydrophobicContact CD1-CZ 4.27Å; L174-F210 HydrophobicContact CD2-CE1 4.31Å; L174-F210 HydrophobicContact CD2-CE2 4.18Å; L174-F210 HydrophobicContact CD2-CZ 3.85Å; L174-F210 HydrophobicContact CG-CE2 4.34Å; L174-F210 HydrophobicContact CG-CZ 4.35Å; L177-F210 HydrophobicContact CD1-CB 4.01Å; R206-F210 WeakPolarHBondContact O-CD2 3.48Å; R206-F210 WeakPolarHBondContact O-CG 3.31Å; R206-F210 PolarHBondContact O-N 2.95Å; C207-F210 PolarHBondContact O-N 3.37Å; L208-F210 VanDerWaalsContact C-N 3.3Å; L208-F210 PolarHBondContact O-N 3.43Å; F210-L212 PolarHBondContact O-N 3.29Å; F210-L213 WeakPolarHBondContact O-CB 3.47Å; F210-L213 PolarHBondContact O-N 2.98Å; F210-F214 VanDerWaalsContact O-CD2 3.32Å; F210-F214 WeakPolarHBondContact O-CD2 3.15Å; F210-F214 PolarHBondContact O-N 3.44Å
211L94Very high90.4Very high2 Ų256.6 Ų56.61%0.0128%0.283CS..Hα-helixtrans-59-48.5174.5-71.9174.7000111.4V161 V165 L173 P183 D184 A189 C207 L208 L213 F214 L215V161-L211 HydrophobicContact CG1-CD2 4.02Å; V165-L211 HydrophobicContact CG1-CD1 4.43Å; V165-L211 HydrophobicContact CG2-CD1 3.74Å; V165-L211 HydrophobicContact CG2-CD2 4.37Å; V165-L211 HydrophobicContact CG2-CG 4.24Å; L173-L211 HydrophobicContact CD1-CD2 4.19Å; L173-L211 HydrophobicContact CD2-CG 4.25Å; P183-L211 HydrophobicContact CB-CD2 4.08Å; D184-L211 WeakPolarHBondContact O-CD2 3.43Å; A189-L211 HydrophobicContact CB-CD1 3.67Å; C207-L211 WeakPolarHBondContact O-CG 3.35Å; C207-L211 PolarHBondContact O-N 3.45Å; L208-L211 PolarHBondContact O-N 2.99Å; L208-L211 VanDerWaalsContact O-N 3.14Å; L211-L213 VanDerWaalsContact C-N 3.25Å; L211-L213 PolarHBondContact O-N 3.48Å; L211-F214 PolarHBondContact O-N 2.66Å; L211-F214 VanDerWaalsContact O-N 3.17Å; L211-L215 WeakPolarHBondContact O-CB 3.48Å; L211-L215 PolarHBondContact O-N 2.94Å
212L91.8Very high90Very high7 Ų755.9 Ų55.94%0.03729%0.291CS..Hα-helixtrans-59.6-39.7177.9-65.4175.1000110.9L186 L208 D209 F210 V239 W242 L243 L253 R257L186-L212 HydrophobicContact CD1-CD2 4.03Å; L208-L212 HydrophobicContact CD1-CD1 4.09Å; L208-L212 HydrophobicContact CD1-CD2 4.3Å; L208-L212 HydrophobicContact CD1-CG 3.97Å; L208-L212 HydrophobicContact CD2-CD1 4.27Å; L208-L212 HydrophobicContact CG-CD1 3.84Å; L208-L212 HydrophobicContact CG-CG 4.15Å; L208-L212 VanDerWaalsContact O-CG 3.29Å; L208-L212 WeakPolarHBondContact O-CG 3.21Å; L208-L212 PolarHBondContact O-N 3.45Å; D209-L212 PolarHBondContact O-N 2.87Å; F210-L212 PolarHBondContact O-N 3.29Å; L212-V239 HydrophobicContact CD1-CG1 3.74Å; L212-V239 HydrophobicContact CD2-CG1 4.24Å; L212-W242 HydrophobicContact CB-CZ3 4.4Å; L212-W242 HydrophobicContact CD2-CH2 4.48Å; L212-W242 HydrophobicContact CD2-CZ3 3.8Å; L212-L243 HydrophobicContact CD2-CD1 4.15Å; L212-L243 HydrophobicContact CD2-CD2 3.85Å; L212-L243 HydrophobicContact CD2-CG 4.38Å; L212-L253 HydrophobicContact CB-CD1 4.35Å; L212-R257 PolarHBondContact O-NE 2.57Å; L212-R257 PolarHBondContact O-NH2 2.98Å
213L89.8Confident89.6Confident32 Ų3251.7 Ų51.717%0.16827%0.274CS..Hα-helixtrans-60.1-48.3175.5-179.961.6000111D209 F210 L211 L215 L256 R257D209-L213 WeakPolarHBondContact O-CB 3.24Å; D209-L213 PolarHBondContact O-N 2.73Å; F210-L213 WeakPolarHBondContact O-CB 3.47Å; F210-L213 PolarHBondContact O-N 2.98Å; L211-L213 VanDerWaalsContact C-N 3.25Å; L211-L213 PolarHBondContact O-N 3.48Å; L213-L215 PolarHBondContact O-N 3.33Å; L213-L256 HydrophobicContact CD1-CB 3.38Å; L213-R257 HydrophobicContact CD1-CG 4.16Å; L213-R257 WeakPolarHBondContact O-CD 3.31Å; L213-R257 WeakPolarHBondContact O-CG 3.36Å; L213-R257 PolarHBondContact O-NE 3.16Å
214F89.4Confident89.3Confident52 Ų5248.7 Ų48.723%0.22826%0.26CS..Hα-helixtrans-84.8-8.2-175.8-73.9-96.3000114.5L174 L177 I178 P183 F210 L211 A216L174-F214 HydrophobicContact CD1-CE2 4.03Å; L174-F214 HydrophobicContact CD1-CZ 4.42Å; L177-F214 HydrophobicContact CB-CB 4.4Å; L177-F214 HydrophobicContact CB-CD1 3.97Å; L177-F214 HydrophobicContact CB-CD2 3.81Å; L177-F214 HydrophobicContact CB-CE1 4.16Å; L177-F214 HydrophobicContact CB-CE2 4.01Å; L177-F214 HydrophobicContact CB-CG 3.79Å; L177-F214 HydrophobicContact CB-CZ 4.19Å; L177-F214 HydrophobicContact CD1-CB 4.21Å; L177-F214 HydrophobicContact CD1-CD2 3.73Å; L177-F214 HydrophobicContact CD1-CE2 4.39Å; L177-F214 HydrophobicContact CD1-CG 4.1Å; L177-F214 HydrophobicContact CD2-CB 4.23Å; L177-F214 HydrophobicContact CG-CD2 4.35Å; L177-F214 HydrophobicContact CG-CG 4.36Å; I178-F214 HydrophobicContact CG1-CE1 4.4Å; I178-F214 HydrophobicContact CG1-CZ 3.79Å; P183-F214 HydrophobicContact CB-CB 4.08Å; P183-F214 HydrophobicContact CG-CB 4.37Å; F210-F214 VanDerWaalsContact O-CD2 3.32Å; F210-F214 WeakPolarHBondContact O-CD2 3.15Å; F210-F214 PolarHBondContact O-N 3.44Å; L211-F214 PolarHBondContact O-N 2.66Å; L211-F214 VanDerWaalsContact O-N 3.17Å; F214-A216 PolarHBondContact O-N 2.82Å
215L89.1Confident88.8Confident16 Ų1657.1 Ų57.18%0.08429%0.292CS..  trans-77.4112.2-178.5-169.171.7000112.7P183 L186 L211 L213 K217 W242 L243 R257P183-L215 HydrophobicContact CG-CD1 4.2Å; L186-L215 HydrophobicContact CD2-CD2 3.87Å; L211-L215 WeakPolarHBondContact O-CB 3.48Å; L211-L215 PolarHBondContact O-N 2.94Å; L213-L215 PolarHBondContact O-N 3.33Å; L215-K217 WeakPolarHBondContact CD1-O 3.42Å; L215-K217 WeakPolarHBondContact CG-O 3.28Å; L215-W242 HydrophobicContact CB-CH2 4.3Å; L215-W242 HydrophobicContact CD2-CH2 3.97Å; L215-W242 HydrophobicContact CD2-CZ2 4.44Å; L215-W242 HydrophobicContact CG-CH2 4.45Å; L215-L243 HydrophobicContact CD2-CD2 4.37Å; L215-R257 PolarHBondContact O-NE 2.65Å; L215-R257 VanDerWaalsContact O-NE 3.17Å; L215-R257 PolarHBondContact O-NH2 3.14Å; L215-R257 VanDerWaalsContact O-NH2 3.16Å
216A81.3Confident88.5Confident88 Ų8860.2 Ų60.273%0.72731%0.311SS*.SBendtrans-69.2-41.717700000113F214F214-A216 PolarHBondContact O-N 2.82Å
217K83.4Confident88.1Confident172 Ų17259.8 Ų59.875%0.74831%0.313SS*.SBendtrans-140.8136.9-179.5-172.7179.4179.2177.40110L215L215-K217 WeakPolarHBondContact CD1-O 3.42Å; L215-K217 WeakPolarHBondContact CG-O 3.28Å
218P81.9Confident87.8Confident26 Ų2662.3 Ų62.317%0.16933%0.329CS..PPolyproline II helixtrans-66.8134.6179.327-33.9000111.3W242 L243P218-W242 WeakPolarHBondContact CG-O 3.29Å; P218-L243 HydrophobicContact CB-CD2 3.77Å
219P84.5Confident87.6Confident56 Ų5670.1 Ų70.136%0.36437%0.366SS..PPolyproline II helixtrans-69157166.431.1-33.1000109.9L186 L221L186-P219 HydrophobicContact CD2-CG 3.94Å; P219-L221 HydrophobicContact CG-CD1 4.49Å; P219-L221 HydrophobicContact CG-CD2 4.38Å; P219-L221 HydrophobicContact CG-CG 4.23Å; P219-L221 PolarHBondContact O-N 3Å
220L83.1Confident87.6Confident155 Ų15571.9 Ų71.981%0.81237%0.367SS*.PPolyproline II helixtrans-70.2117.2171.2-68.1171.2000108.7
221L86.7Confident87.5Confident17 Ų1770.7 Ų70.79%0.08936%0.361CS..  trans-116.299.4-179.9-68.3170.4000109.4L186 E187 L190 P219 C223 L224L186-L221 HydrophobicContact CD2-CD1 3.6Å; L186-L221 HydrophobicContact CG-CD1 3.91Å; E187-L221 HydrophobicContact CB-CD2 3.8Å; E187-L221 HydrophobicContact CG-CD2 4.31Å; L190-L221 HydrophobicContact CD1-CD1 3.69Å; P219-L221 HydrophobicContact CG-CD1 4.49Å; P219-L221 HydrophobicContact CG-CD2 4.38Å; P219-L221 HydrophobicContact CG-CG 4.23Å; P219-L221 PolarHBondContact O-N 3Å; L221-C223 PolarHBondContact O-N 2.96Å; L221-L224 HydrophobicContact CB-CD1 3.93Å; L221-L224 HydrophobicContact CB-CG 3.92Å; L221-L224 HydrophobicContact CD1-CD1 3.89Å; L221-L224 HydrophobicContact CD1-CG 4.35Å; L221-L224 PolarHBondContact O-N 3.17Å
222P84.7Confident87.5Confident85 Ų8573.9 Ų73.955%0.55238%0.376SS*.THydrogen-bonded Turntrans-56.3-38.4179.8-25.835.1000112.7L224 R225P222-L224 PolarHBondContact O-N 2.75Å; P222-R225 WeakPolarHBondContact O-CB 3.31Å; P222-R225 PolarHBondContact O-N 3.1Å
223C85.3Confident87.4Confident30 Ų3076.8 Ų76.820%0.20341%0.408CS..Hα-helixtrans-57.7-25-178.462.20000114.4L221 R225 W231L221-C223 PolarHBondContact O-N 2.96Å; C223-R225 VanDerWaalsContact C-N 3.27Å; C223-R225 PolarHBondContact O-N 2.91Å; C223-W231 PolarHBondContact O-NE1 2.92Å
224L87.8Confident87.4Confident2 Ų277.7 Ų77.71%0.0141%0.413CS..Hα-helixtrans-71.1-23176.1-66.4-177.6000112.8L190 L221 P222 W231 L235 F240 L243L190-L224 HydrophobicContact CD1-CD2 3.95Å; L190-L224 HydrophobicContact CD1-CG 4.44Å; L221-L224 HydrophobicContact CB-CD1 3.93Å; L221-L224 HydrophobicContact CB-CG 3.92Å; L221-L224 HydrophobicContact CD1-CD1 3.89Å; L221-L224 HydrophobicContact CD1-CG 4.35Å; L221-L224 PolarHBondContact O-N 3.17Å; P222-L224 PolarHBondContact O-N 2.75Å; L224-W231 HydrophobicContact CD2-CB 3.89Å; L224-W231 HydrophobicContact CD2-CD2 3.73Å; L224-W231 HydrophobicContact CD2-CE3 4.24Å; L224-W231 HydrophobicContact CD2-CG 3.56Å; L224-L235 HydrophobicContact CD2-CD1 4.05Å; L224-F240 HydrophobicContact CB-CE2 4.24Å; L224-F240 WeakPolarHBondContact O-CE2 3.26Å; L224-L243 HydrophobicContact CD1-CB 3.58Å; L224-L243 HydrophobicContact CD1-CD1 4.15Å
225R85.4Confident87.4Confident179 Ų17976.2 Ų76.268%0.67541%0.407SS*.Hα-helixtrans-85.1-27.9-179.8-61.3-175.6176.1-166.3-2.1112.7P222 C223P222-R225 WeakPolarHBondContact O-CB 3.31Å; P222-R225 PolarHBondContact O-N 3.1Å; C223-R225 VanDerWaalsContact C-N 3.27Å; C223-R225 PolarHBondContact O-N 2.91Å
226D87.6Confident87.6Confident125 Ų12577 Ų7767%0.66842%0.419SS*.Hα-helixtrans-70.8-39.4-175-58.3-30.8000111.7
227E87.3Confident88.1Confident95 Ų9577.8 Ų77.844%0.44441%0.411SS..SBendtrans-132.467.4-178.6-66.9-178.5-156.600112.5Q229 R230 W231E227-Q229 PolarHBondContact O-N 3.03Å; E227-R230 HydrophobicContact CB-CB 4.11Å; E227-R230 PolarHBondContact O-N 3.12Å; E227-R230 IonicContact OE1-NH1 2.76Å; E227-R230 WeakPolarHBondContact OE2-CD 3.33Å; E227-R230 IonicContact OE2-CZ 3.17Å; E227-R230 IonicContact OE2-NE 3.63Å; E227-R230 IonicContact OE2-NH1 2.81Å; E227-R230 PolarHBondContact OE2-NH1 3.44Å; E227-W231 PolarHBondContact O-N 3.28Å
228P89.4Confident88.5Confident54 Ų5479.5 Ų79.535%0.35141%0.413SS..Hα-helixtrans-62-39.8-16923.6-33.7000113.3R230 W231 Q232 F240P228-R230 VanDerWaalsContact C-N 3.34Å; P228-R230 PolarHBondContact O-N 3.15Å; P228-W231 PolarHBondContact O-N 2.85Å; P228-Q232 WeakPolarHBondContact O-CB 3.41Å; P228-Q232 VanDerWaalsContact O-CG 3.24Å; P228-Q232 WeakPolarHBondContact O-CG 3.21Å; P228-Q232 PolarHBondContact O-N 3.49Å; P228-F240 HydrophobicContact CB-CE2 4.48Å; P228-F240 HydrophobicContact CB-CZ 3.82Å
229Q91.7Very high88.9Confident165 Ų16579.5 Ų79.577%0.77141%0.413SS*.Hα-helixtrans-64.3-39-179.5-67-168.3-2.400112.3E227 Q232 G233E227-Q229 PolarHBondContact O-N 3.03Å; Q229-Q232 PolarHBondContact O-N 3.26Å; Q229-G233 PolarHBondContact O-N 3.01Å
230R91.6Very high89.4Confident109 Ų10977.5 Ų77.541%0.41140%0.398SS..Hα-helixtrans-63.5-47.8177.7179.7-177.5-177.7178.27.6111.1E227 P228 G233 L234E227-R230 HydrophobicContact CB-CB 4.11Å; E227-R230 PolarHBondContact O-N 3.12Å; E227-R230 IonicContact OE1-NH1 2.76Å; E227-R230 WeakPolarHBondContact OE2-CD 3.33Å; E227-R230 IonicContact OE2-CZ 3.17Å; E227-R230 IonicContact OE2-NE 3.63Å; E227-R230 IonicContact OE2-NH1 2.81Å; E227-R230 PolarHBondContact OE2-NH1 3.44Å; P228-R230 VanDerWaalsContact C-N 3.34Å; P228-R230 PolarHBondContact O-N 3.15Å; R230-G233 PolarHBondContact O-N 3.37Å; R230-L234 HydrophobicContact CG-CD1 4.2Å; R230-L234 WeakPolarHBondContact O-CG 3.36Å; R230-L234 PolarHBondContact O-N 3.43Å
231W92.1Very high89.8Confident17 Ų1771.8 Ų71.86%0.06437%0.371CS..Hα-helixtrans-69.7-33.4-179.6-64.8118.2000112.7L190 V194 C223 L224 E227 P228 G233 L234 L235 F240L190-W231 HydrophobicContact CB-CH2 3.79Å; L190-W231 HydrophobicContact CB-CZ3 3.81Å; L190-W231 HydrophobicContact CD2-CE3 4.11Å; L190-W231 HydrophobicContact CD2-CZ3 3.83Å; L190-W231 HydrophobicContact CG-CZ3 4.33Å; V194-W231 HydrophobicContact CG2-CH2 3.51Å; V194-W231 HydrophobicContact CG2-CZ2 4.35Å; V194-W231 HydrophobicContact CG2-CZ3 3.83Å; C223-W231 PolarHBondContact O-NE1 2.92Å; L224-W231 HydrophobicContact CD2-CB 3.89Å; L224-W231 HydrophobicContact CD2-CD2 3.73Å; L224-W231 HydrophobicContact CD2-CE3 4.24Å; L224-W231 HydrophobicContact CD2-CG 3.56Å; E227-W231 PolarHBondContact O-N 3.28Å; P228-W231 PolarHBondContact O-N 2.85Å; W231-G233 VanDerWaalsContact C-N 3.34Å; W231-L234 HydrophobicContact CE3-CD1 3.98Å; W231-L234 HydrophobicContact CZ3-CD1 4Å; W231-L234 PolarHBondContact O-N 3.24Å; W231-L235 HydrophobicContact CB-CD1 4.28Å; W231-L235 HydrophobicContact CE3-CD1 4.48Å; W231-L235 VanDerWaalsContact O-CB 3.24Å; W231-L235 WeakPolarHBondContact O-CB 3.45Å; W231-L235 WeakPolarHBondContact O-CG 3.33Å; W231-L235 PolarHBondContact O-N 2.88Å; W231-F240 HydrophobicContact CB-CD2 3.69Å; W231-F240 HydrophobicContact CB-CE2 3.78Å
232Q92.9Very high90Very high69 Ų6971.4 Ų71.432%0.32237%0.369SS..Hα-helixtrans-61.5-41.9170.1-76.6172.8-4.700112P228 Q229 G236 F240P228-Q232 WeakPolarHBondContact O-CB 3.41Å; P228-Q232 VanDerWaalsContact O-CG 3.24Å; P228-Q232 WeakPolarHBondContact O-CG 3.21Å; P228-Q232 PolarHBondContact O-N 3.49Å; Q229-Q232 PolarHBondContact O-N 3.26Å; Q232-G236 CarbonylContact O-C 3.59Å; Q232-G236 WeakPolarHBondContact O-CA 3.38Å; Q232-G236 PolarHBondContact O-N 3.12Å; Q232-F240 HydrophobicContact CG-CB 4.17Å; Q232-F240 HydrophobicContact CG-CD1 3.49Å; Q232-F240 VanDerWaalsContact CG-CD1 3.49Å; Q232-F240 HydrophobicContact CG-CD2 4.16Å; Q232-F240 HydrophobicContact CG-CE1 3.86Å; Q232-F240 HydrophobicContact CG-CE2 4.47Å; Q232-F240 HydrophobicContact CG-CG 3.65Å; Q232-F240 HydrophobicContact CG-CZ 4.33Å
233G90.7Very high90.4Very high69 Ų6967.7 Ų67.771%0.71134%0.344SS*.Hα-helixtrans-64.6-36.9175.600000113.4Q229 R230 W231Q229-G233 PolarHBondContact O-N 3.01Å; R230-G233 PolarHBondContact O-N 3.37Å; W231-G233 VanDerWaalsContact C-N 3.34Å
234L89.1Confident90.6Very high50 Ų5067.6 Ų67.626%0.26234%0.343SS..Hα-helixtrans-80.9-41.4-179-71.1173.8000113.8V194 R230 W231V194-L234 HydrophobicContact CG2-CD1 4.03Å; R230-L234 HydrophobicContact CG-CD1 4.2Å; R230-L234 WeakPolarHBondContact O-CG 3.36Å; R230-L234 PolarHBondContact O-N 3.43Å; W231-L234 HydrophobicContact CE3-CD1 3.98Å; W231-L234 HydrophobicContact CZ3-CD1 4Å; W231-L234 PolarHBondContact O-N 3.24Å
235L90.8Very high90.7Very high21 Ų2170.3 Ų70.311%0.1137%0.372CS..Hα-helixtrans-98.2-19.3-172.3-58.1173.1000112.9L190 L208 L224 W231 V239 L243L190-L235 HydrophobicContact CD2-CD1 4.08Å; L190-L235 HydrophobicContact CD2-CD2 3.73Å; L190-L235 HydrophobicContact CD2-CG 4.38Å; L208-L235 HydrophobicContact CD2-CD2 3.43Å; L208-L235 VanDerWaalsContact CD2-CD2 3.43Å; L224-L235 HydrophobicContact CD2-CD1 4.05Å; W231-L235 HydrophobicContact CB-CD1 4.28Å; W231-L235 HydrophobicContact CE3-CD1 4.48Å; W231-L235 VanDerWaalsContact O-CB 3.24Å; W231-L235 WeakPolarHBondContact O-CB 3.45Å; W231-L235 WeakPolarHBondContact O-CG 3.33Å; W231-L235 PolarHBondContact O-N 2.88Å; L235-V239 HydrophobicContact CB-CB 4.31Å; L235-V239 HydrophobicContact CB-CG1 4.29Å; L235-V239 WeakPolarHBondContact O-CB 3.48Å; L235-L243 HydrophobicContact CD1-CD1 3.97Å
236G92.1Very high90.9Very high33 Ų3368.2 Ų68.234%0.3437%0.373SS..  trans75.9152.3-164.100000112.5Q232 R238 V239 F240Q232-G236 CarbonylContact O-C 3.59Å; Q232-G236 WeakPolarHBondContact O-CA 3.38Å; Q232-G236 PolarHBondContact O-N 3.12Å; G236-R238 VanDerWaalsContact C-N 3.32Å; G236-R238 PolarHBondContact O-N 3.38Å; G236-V239 PolarHBondContact O-N 2.96Å; G236-F240 WeakPolarHBondContact O-CB 3.19Å; G236-F240 PolarHBondContact O-N 2.95Å
237N92.3Very high91.1Very high104 Ų10464.1 Ų64.156%0.55636%0.357SS*.Hα-helixtrans-57.8-40-172.5-67.3-25.2000113.6S241N237-S241 WeakPolarHBondContact O-CB 3.42Å; N237-S241 PolarHBondContact O-N 3.4Å; N237-S241 PolarHBondContact O-OG 3.2Å
238R91.6Very high91.1Very high208 Ų20864.8 Ų64.879%0.78537%0.37SS*.Hα-helixtrans-66.8-46.7-176.2-63.9-174.6-178.8-162.80.3112.3G236 W242 P250G236-R238 VanDerWaalsContact C-N 3.32Å; G236-R238 PolarHBondContact O-N 3.38Å; R238-W242 WeakPolarHBondContact O-CB 3.32Å; R238-W242 PolarHBondContact O-N 3.26Å; R238-W242 VanDerWaalsContact O-N 3.11Å; R238-P250 HydrophobicContact CB-CG 4.28Å
239V91.2Very high91Very high27 Ų2762.9 Ų62.916%0.16436%0.357CS..Hα-helixtrans-69.1-43.6179.3177.70000109.7L212 L235 G236 W242 L243 P250L212-V239 HydrophobicContact CD1-CG1 3.74Å; L212-V239 HydrophobicContact CD2-CG1 4.24Å; L235-V239 HydrophobicContact CB-CB 4.31Å; L235-V239 HydrophobicContact CB-CG1 4.29Å; L235-V239 WeakPolarHBondContact O-CB 3.48Å; G236-V239 PolarHBondContact O-N 2.96Å; V239-W242 PolarHBondContact O-N 3.19Å; V239-L243 HydrophobicContact CG1-CD1 4.12Å; V239-L243 HydrophobicContact CG1-CG 4.23Å; V239-L243 WeakPolarHBondContact O-CG 3.27Å; V239-L243 PolarHBondContact O-N 3.31Å; V239-P250 HydrophobicContact CG2-CG 4.37Å
240F93.2Very high90.9Very high13 Ų1356.1 Ų56.16%0.05733%0.328CS..Hα-helixtrans-56.3-52.5175.2175.1-95.1000112.3L224 P228 W231 Q232 G236 W242 L243 C244L224-F240 HydrophobicContact CB-CE2 4.24Å; L224-F240 WeakPolarHBondContact O-CE2 3.26Å; P228-F240 HydrophobicContact CB-CE2 4.48Å; P228-F240 HydrophobicContact CB-CZ 3.82Å; W231-F240 HydrophobicContact CB-CD2 3.69Å; W231-F240 HydrophobicContact CB-CE2 3.78Å; Q232-F240 HydrophobicContact CG-CB 4.17Å; Q232-F240 HydrophobicContact CG-CD1 3.49Å; Q232-F240 VanDerWaalsContact CG-CD1 3.49Å; Q232-F240 HydrophobicContact CG-CD2 4.16Å; Q232-F240 HydrophobicContact CG-CE1 3.86Å; Q232-F240 HydrophobicContact CG-CE2 4.47Å; Q232-F240 HydrophobicContact CG-CG 3.65Å; Q232-F240 HydrophobicContact CG-CZ 4.33Å; G236-F240 WeakPolarHBondContact O-CB 3.19Å; G236-F240 PolarHBondContact O-N 2.95Å; F240-W242 VanDerWaalsContact C-N 3.26Å; F240-W242 PolarHBondContact O-N 3.42Å; F240-L243 PolarHBondContact O-N 2.78Å; F240-C244 VanDerWaalsContact CZ-SG 3.52Å; F240-C244 WeakPolarHBondContact O-CB 3.33Å; F240-C244 PolarHBondContact O-N 3.22Å; F240-C244 PolarHBondContact O-SG 2.74Å
241S91.9Very high90.7Very high35 Ų3557.4 Ų57.425%0.24534%0.342CS..Hα-helixtrans-59.9-37.7178.9-67.10000112.2N237 G245 L246 A247N237-S241 WeakPolarHBondContact O-CB 3.42Å; N237-S241 PolarHBondContact O-N 3.4Å; N237-S241 PolarHBondContact O-OG 3.2Å; S241-G245 PolarHBondContact O-N 3.37Å; S241-L246 WeakPolarHBondContact O-CA 3.5Å; S241-L246 WeakPolarHBondContact O-CB 3.31Å; S241-L246 PolarHBondContact O-N 3.05Å; S241-A247 PolarHBondContact O-N 3.16Å
242W92.1Very high90.4Very high10 Ų1062.4 Ų62.44%0.03837%0.37CS..Hα-helixtrans-64.8-50.1174170.649.8000112.3L212 L215 P218 R238 V239 F240 C244 G245 A247 S249 L253L212-W242 HydrophobicContact CB-CZ3 4.4Å; L212-W242 HydrophobicContact CD2-CH2 4.48Å; L212-W242 HydrophobicContact CD2-CZ3 3.8Å; L215-W242 HydrophobicContact CB-CH2 4.3Å; L215-W242 HydrophobicContact CD2-CH2 3.97Å; L215-W242 HydrophobicContact CD2-CZ2 4.44Å; L215-W242 HydrophobicContact CG-CH2 4.45Å; P218-W242 WeakPolarHBondContact CG-O 3.29Å; R238-W242 WeakPolarHBondContact O-CB 3.32Å; R238-W242 PolarHBondContact O-N 3.26Å; R238-W242 VanDerWaalsContact O-N 3.11Å; V239-W242 PolarHBondContact O-N 3.19Å; F240-W242 VanDerWaalsContact C-N 3.26Å; F240-W242 PolarHBondContact O-N 3.42Å; W242-C244 VanDerWaalsContact C-N 3.25Å; W242-C244 PolarHBondContact O-N 2.82Å; W242-G245 WeakPolarHBondContact O-CA 3.46Å; W242-G245 PolarHBondContact O-N 2.81Å; W242-A247 WeakPolarHBondContact CA-O 3.33Å; W242-S249 VanDerWaalsContact CD1-N 3.31Å; W242-L253 HydrophobicContact CE3-CD1 4.15Å; W242-L253 HydrophobicContact CZ3-CD1 3.79Å
243L91.6Very high90.1Very high6 Ų660.4 Ų60.43%0.03136%0.361CS..Hα-helixtrans-61.8-33.2179.5-68.6-176000112.7L186 L212 L215 P218 L224 L235 V239 F240 G245L186-L243 HydrophobicContact CD2-CD1 4.5Å; L186-L243 HydrophobicContact CD2-CD2 3.86Å; L212-L243 HydrophobicContact CD2-CD1 4.15Å; L212-L243 HydrophobicContact CD2-CD2 3.85Å; L212-L243 HydrophobicContact CD2-CG 4.38Å; L215-L243 HydrophobicContact CD2-CD2 4.37Å; P218-L243 HydrophobicContact CB-CD2 3.77Å; L224-L243 HydrophobicContact CD1-CB 3.58Å; L224-L243 HydrophobicContact CD1-CD1 4.15Å; L235-L243 HydrophobicContact CD1-CD1 3.97Å; V239-L243 HydrophobicContact CG1-CD1 4.12Å; V239-L243 HydrophobicContact CG1-CG 4.23Å; V239-L243 WeakPolarHBondContact O-CG 3.27Å; V239-L243 PolarHBondContact O-N 3.31Å; F240-L243 PolarHBondContact O-N 2.78Å; L243-G245 PolarHBondContact O-N 3.34Å
244C90.6Very high89.8Confident28 Ų2860.9 Ų60.919%0.18935%0.345CS..THydrogen-bonded Turntrans-75.4-4.9173.6-71.10000113.9F240 W242 L246F240-C244 VanDerWaalsContact CZ-SG 3.52Å; F240-C244 WeakPolarHBondContact O-CB 3.33Å; F240-C244 PolarHBondContact O-N 3.22Å; F240-C244 PolarHBondContact O-SG 2.74Å; W242-C244 VanDerWaalsContact C-N 3.25Å; W242-C244 PolarHBondContact O-N 2.82Å; C244-L246 VanDerWaalsContact C-N 3.26Å; C244-L246 HydrophobicContact CB-CD1 3.96Å; C244-L246 HydrophobicContact CB-CG 3.91Å; C244-L246 PolarHBondContact O-N 3.13Å
245G89.4Confident89.7Confident60 Ų6060.8 Ų60.862%0.61935%0.351SS*.THydrogen-bonded Turntrans73.415-176.800000114.3S241 W242 L243S241-G245 PolarHBondContact O-N 3.37Å; W242-G245 WeakPolarHBondContact O-CA 3.46Å; W242-G245 PolarHBondContact O-N 2.81Å; L243-G245 PolarHBondContact O-N 3.34Å
246L90.1Very high89.4Confident134 Ų13463.2 Ų63.270%0.70236%0.364SS*.SBendtrans-88.3-15.2-179.1-58.7175.3000112.7S241 C244S241-L246 WeakPolarHBondContact O-CA 3.5Å; S241-L246 WeakPolarHBondContact O-CB 3.31Å; S241-L246 PolarHBondContact O-N 3.05Å; C244-L246 VanDerWaalsContact C-N 3.26Å; C244-L246 HydrophobicContact CB-CD1 3.96Å; C244-L246 HydrophobicContact CB-CG 3.91Å; C244-L246 PolarHBondContact O-N 3.13Å
247A90.7Very high89Confident40 Ų4062.6 Ų62.633%0.33135%0.351SS..SBendtrans-145.2157.518000000110.9S241 W242S241-A247 PolarHBondContact O-N 3.16Å; W242-A247 WeakPolarHBondContact CA-O 3.33Å
248P88.8Confident88.4Confident109 Ų10961.2 Ų61.271%0.70835%0.349SS*.PPolyproline II helixtrans-65.5166.1169.229.4-35.5000111.6
249S87.3Confident87.9Confident13 Ų1354.4 Ų54.49%0.09133%0.328CS..PPolyproline II helixtrans-60.7138.6177.3-163.90000111.2W242 L251 Q254 R257W242-S249 VanDerWaalsContact CD1-N 3.31Å; S249-L251 PolarHBondContact O-N 2.08Å; S249-Q254 PolarHBondContact O-NE2 3.27Å; S249-R257 PolarHBondContact OG-NH1 3.1Å; S249-R257 PolarHBondContact OG-NH2 3.03Å
250P88.5Confident87Confident23 Ų2355.6 Ų55.615%0.14934%0.341CS..PPolyproline II helixtrans-52.2134.7176.7-26.732.6000112.3R238 V239 L252 L253 Q254R238-P250 HydrophobicContact CB-CG 4.28Å; V239-P250 HydrophobicContact CG2-CG 4.37Å; P250-L252 PolarHBondContact O-N 3.33Å; P250-L252 VanDerWaalsContact O-N 3.13Å; P250-L253 HydrophobicContact CB-CD1 4.47Å; P250-L253 HydrophobicContact CB-CG 4.42Å; P250-L253 HydrophobicContact CG-CD1 4.13Å; P250-L253 WeakPolarHBondContact O-CB 2.84Å; P250-L253 PolarHBondContact O-N 2.96Å; P250-Q254 PolarHBondContact O-N 3.01Å
251L88.6Confident85.9Confident136 Ų13662.3 Ų62.371%0.71237%0.372SS*.Hα-helixtrans-53.1-38.6-177.3-176.168.2000112.7S249 L253 Q254 A255S249-L251 PolarHBondContact O-N 2.08Å; L251-L253 PolarHBondContact O-N 2.93Å; L251-Q254 WeakPolarHBondContact O-CB 3.37Å; L251-Q254 PolarHBondContact O-N 3.34Å; L251-A255 WeakPolarHBondContact O-CB 3.14Å; L251-A255 PolarHBondContact O-N 3.03Å
252L85.6Confident84.7Confident123 Ų12362.9 Ų62.964%0.64438%0.376SS*.Hα-helixtrans-60.2-45.8176.2178.862.8000111.9P250 Q254 A255 L256P250-L252 PolarHBondContact O-N 3.33Å; P250-L252 VanDerWaalsContact O-N 3.13Å; L252-Q254 VanDerWaalsContact C-N 3.3Å; L252-Q254 PolarHBondContact O-N 3.1Å; L252-A255 PolarHBondContact O-N 2.96Å; L252-L256 HydrophobicContact CD1-CD1 4.07Å; L252-L256 HydrophobicContact CD1-CG 4.14Å; L252-L256 HydrophobicContact CG-CD1 3.98Å; L252-L256 HydrophobicContact CG-CG 4.44Å; L252-L256 WeakPolarHBondContact O-CB 3.16Å; L252-L256 VanDerWaalsContact O-CG 3.27Å; L252-L256 WeakPolarHBondContact O-CG 3.45Å; L252-L256 PolarHBondContact O-N 2.89Å
253L85.3Confident83.1Confident26 Ų2664.2 Ų64.214%0.13639%0.393CS..Hα-helixtrans-65.3-37.5177.1-70.8-179.8000111.2L212 W242 P250 L251 R257L212-L253 HydrophobicContact CB-CD1 4.35Å; W242-L253 HydrophobicContact CE3-CD1 4.15Å; W242-L253 HydrophobicContact CZ3-CD1 3.79Å; P250-L253 HydrophobicContact CB-CD1 4.47Å; P250-L253 HydrophobicContact CB-CG 4.42Å; P250-L253 HydrophobicContact CG-CD1 4.13Å; P250-L253 WeakPolarHBondContact O-CB 2.84Å; P250-L253 PolarHBondContact O-N 2.96Å; L251-L253 PolarHBondContact O-N 2.93Å; L253-R257 VanDerWaalsContact O-CB 3.32Å; L253-R257 WeakPolarHBondContact O-CB 3.37Å; L253-R257 VanDerWaalsContact O-CG 3.24Å; L253-R257 WeakPolarHBondContact O-CG 3.14Å; L253-R257 PolarHBondContact O-N 3.07Å
254Q85.4Confident81.2Confident79 Ų7968 Ų6837%0.36942%0.42SS..Hα-helixtrans-63-45.7174.1-65.4177.2-30.700111.6S249 P250 L251 L252 R257 C258S249-Q254 PolarHBondContact O-NE2 3.27Å; P250-Q254 PolarHBondContact O-N 3.01Å; L251-Q254 WeakPolarHBondContact O-CB 3.37Å; L251-Q254 PolarHBondContact O-N 3.34Å; L252-Q254 VanDerWaalsContact C-N 3.3Å; L252-Q254 PolarHBondContact O-N 3.1Å; Q254-R257 WeakPolarHBondContact O-CB 3.41Å; Q254-R257 PolarHBondContact O-N 2.84Å; Q254-C258 PolarHBondContact O-N 2.93Å; Q254-C258 PolarHBondContact O-SG 3.48Å
255A86.6Confident79.4Confident48 Ų4873 Ų7340%0.39745%0.445SS..Hα-helixtrans-62.9-47.6178.100000111.5L251 L252 R257 C258 L259L251-A255 WeakPolarHBondContact O-CB 3.14Å; L251-A255 PolarHBondContact O-N 3.03Å; L252-A255 PolarHBondContact O-N 2.96Å; A255-R257 VanDerWaalsContact C-N 3.31Å; A255-R257 PolarHBondContact O-N 2.96Å; A255-C258 WeakPolarHBondContact O-CB 3.2Å; A255-C258 PolarHBondContact O-N 3.31Å; A255-L259 WeakPolarHBondContact O-CG 3.28Å; A255-L259 PolarHBondContact O-N 3.39Å
256L84.3Confident77.5Confident72 Ų7277.7 Ų77.738%0.37744%0.444SS..Hα-helixtrans-63.2-36.7177.5-67.7172.9000112.1L213 L252 L259 A260L213-L256 HydrophobicContact CD1-CB 3.38Å; L252-L256 HydrophobicContact CD1-CD1 4.07Å; L252-L256 HydrophobicContact CD1-CG 4.14Å; L252-L256 HydrophobicContact CG-CD1 3.98Å; L252-L256 HydrophobicContact CG-CG 4.44Å; L252-L256 WeakPolarHBondContact O-CB 3.16Å; L252-L256 VanDerWaalsContact O-CG 3.27Å; L252-L256 WeakPolarHBondContact O-CG 3.45Å; L252-L256 PolarHBondContact O-N 2.89Å; L256-L259 HydrophobicContact CD2-CD1 4.4Å; L256-L259 PolarHBondContact O-N 3.09Å; L256-A260 WeakPolarHBondContact O-CB 3.28Å; L256-A260 PolarHBondContact O-N 3.16Å
257R83.5Confident75.7Confident21 Ų2174.7 Ų74.78%0.07943%0.428CS..Hα-helixtrans-61.2-48.6171.7-83.9176.5-155.1137.68.5112.3L212 L213 L215 S249 L253 Q254 A255 L259 A260 Q261L212-R257 PolarHBondContact O-NE 2.57Å; L212-R257 PolarHBondContact O-NH2 2.98Å; L213-R257 HydrophobicContact CD1-CG 4.16Å; L213-R257 WeakPolarHBondContact O-CD 3.31Å; L213-R257 WeakPolarHBondContact O-CG 3.36Å; L213-R257 PolarHBondContact O-NE 3.16Å; L215-R257 PolarHBondContact O-NE 2.65Å; L215-R257 VanDerWaalsContact O-NE 3.17Å; L215-R257 PolarHBondContact O-NH2 3.14Å; L215-R257 VanDerWaalsContact O-NH2 3.16Å; S249-R257 PolarHBondContact OG-NH1 3.1Å; S249-R257 PolarHBondContact OG-NH2 3.03Å; L253-R257 VanDerWaalsContact O-CB 3.32Å; L253-R257 WeakPolarHBondContact O-CB 3.37Å; L253-R257 VanDerWaalsContact O-CG 3.24Å; L253-R257 WeakPolarHBondContact O-CG 3.14Å; L253-R257 PolarHBondContact O-N 3.07Å; Q254-R257 WeakPolarHBondContact O-CB 3.41Å; Q254-R257 PolarHBondContact O-N 2.84Å; A255-R257 VanDerWaalsContact C-N 3.31Å; A255-R257 PolarHBondContact O-N 2.96Å; R257-L259 PolarHBondContact O-N 3.48Å; R257-A260 PolarHBondContact O-N 3.33Å; R257-Q261 WeakPolarHBondContact O-CB 3.43Å; R257-Q261 VanDerWaalsContact O-CG 3.27Å; R257-Q261 WeakPolarHBondContact O-CG 3.49Å; R257-Q261 PolarHBondContact O-N 2.98Å
258C81.2Confident73.8Confident75 Ų7578 Ų7851%0.50744%0.444SS..Hα-helixtrans-57.4-41.8177.5-710000110.6Q254 A255 S262Q254-C258 PolarHBondContact O-N 2.93Å; Q254-C258 PolarHBondContact O-SG 3.48Å; A255-C258 WeakPolarHBondContact O-CB 3.2Å; A255-C258 PolarHBondContact O-N 3.31Å; C258-S262 WeakPolarHBondContact O-CB 3.14Å; C258-S262 PolarHBondContact O-N 3.09Å; C258-S262 PolarHBondContact O-OG 3.03Å
259L79.2Confident72.1Confident64 Ų6476.9 Ų76.934%0.33544%0.439SS..Hα-helixtrans-63.2-49.7175.1-68.3173.9000112.2A255 L256 R257 Q261 S262 L270A255-L259 WeakPolarHBondContact O-CG 3.28Å; A255-L259 PolarHBondContact O-N 3.39Å; L256-L259 HydrophobicContact CD2-CD1 4.4Å; L256-L259 PolarHBondContact O-N 3.09Å; R257-L259 PolarHBondContact O-N 3.48Å; L259-Q261 VanDerWaalsContact C-N 3.26Å; L259-Q261 PolarHBondContact O-N 3.44Å; L259-S262 PolarHBondContact O-N 3.13Å; L259-S262 VanDerWaalsContact O-N 3.14Å; L259-L270 HydrophobicContact CD2-CD1 3.8Å; L259-L270 HydrophobicContact CD2-CD2 3.59Å; L259-L270 HydrophobicContact CD2-CG 4.24Å
260A73.3Confident70.5Confident53 Ų5377.9 Ų77.944%0.43844%0.443SS..Hα-helixtrans-61.1-34.9-179.900000112.7L256 R257L256-A260 WeakPolarHBondContact O-CB 3.28Å; L256-A260 PolarHBondContact O-N 3.16Å; R257-A260 PolarHBondContact O-N 3.33Å
261Q70Confident69.1Low153 Ų15380 Ų8072%0.71546%0.457SS*.Hα-helixtrans-81.2-20.1178.4-68.91731.400113.5R257 L259 G263R257-Q261 WeakPolarHBondContact O-CB 3.43Å; R257-Q261 VanDerWaalsContact O-CG 3.27Å; R257-Q261 WeakPolarHBondContact O-CG 3.49Å; R257-Q261 PolarHBondContact O-N 2.98Å; L259-Q261 VanDerWaalsContact C-N 3.26Å; L259-Q261 PolarHBondContact O-N 3.44Å; Q261-G263 VanDerWaalsContact C-N 3.32Å; Q261-G263 PolarHBondContact O-N 3.06Å
262S66.4Low67.6Low47 Ų4779.4 Ų79.433%0.32945%0.454SS..Hα-helixtrans-80.7-9.2-175.3-70.10000114.2C258 L259 R266C258-S262 WeakPolarHBondContact O-CB 3.14Å; C258-S262 PolarHBondContact O-N 3.09Å; C258-S262 PolarHBondContact O-OG 3.03Å; L259-S262 PolarHBondContact O-N 3.13Å; L259-S262 VanDerWaalsContact O-N 3.14Å; S262-R266 WeakPolarHBondContact O-CD 3.25Å
263G57.9Low66.4Low38 Ų3880.9 Ų80.939%0.39246%0.456SS..  trans72.2165.5-179.300000114Q261 D265 R266Q261-G263 VanDerWaalsContact C-N 3.32Å; Q261-G263 PolarHBondContact O-N 3.06Å; G263-D265 PolarHBondContact O-N 3.02Å; G263-R266 PolarHBondContact O-N 2.96Å
264S53.1Low64.5Low85 Ų8584.2 Ų84.259%0.59447%0.473SS*.Hα-helixtrans-55.4-34.9-179.350.60000113.3R266 I267S264-R266 PolarHBondContact O-N 2.88Å; S264-R266 VanDerWaalsContact O-N 3.16Å; S264-I267 PolarHBondContact O-N 2.89Å; S264-I267 VanDerWaalsContact O-N 3.15Å
265D52.2Low63Low135 Ų13583.6 Ų83.672%0.72247%0.47SS*.Hα-helixtrans-72.9-11.7-169.9-56-12.4000113G263 T268G263-D265 PolarHBondContact O-N 3.02Å; D265-T268 PolarHBondContact O-OG1 3.06Å; D265-T268 VanDerWaalsContact O-OG1 3.05Å
266R49.8Very low61.1Low157 Ų15786.3 Ų86.359%0.59248%0.484SS*.Hα-helixtrans-103.6-12.8174.8-68.4-173.3176.9-1641.4113.6S262 G263 S264 T268 S269 L270S262-R266 WeakPolarHBondContact O-CD 3.25Å; G263-R266 PolarHBondContact O-N 2.96Å; S264-R266 PolarHBondContact O-N 2.88Å; S264-R266 VanDerWaalsContact O-N 3.16Å; R266-T268 PolarHBondContact O-N 3.14Å; R266-S269 WeakPolarHBondContact CA-OG 3.43Å; R266-S269 CarbonylContact O-C 3.58Å; R266-S269 WeakPolarHBondContact O-CA 3.44Å; R266-S269 WeakPolarHBondContact O-CB 3.39Å; R266-S269 PolarHBondContact O-N 3.34Å; R266-S269 PolarHBondContact O-OG 2.97Å; R266-L270 PolarHBondContact O-N 3.49Å
267I52.2Low59.2Low72 Ų7289.9 Ų89.937%0.36950%0.498SS..Hα-helixtrans-66.3-34.4173.3-63.9174.1000109.9S264 S269 L270S264-I267 PolarHBondContact O-N 2.89Å; S264-I267 VanDerWaalsContact O-N 3.15Å; I267-S269 PolarHBondContact O-N 3.26Å; I267-L270 HydrophobicContact CB-CD1 4.32Å; I267-L270 HydrophobicContact CG2-CD1 4Å; I267-L270 WeakPolarHBondContact O-CB 3.42Å; I267-L270 WeakPolarHBondContact O-CG 3.4Å; I267-L270 PolarHBondContact O-N 3.41Å
268T51.5Low57.2Low109 Ų10994.5 Ų94.567%0.66953%0.534SS*.THydrogen-bonded Turntrans-69.8-13.5170.652.30000113.8D265 R266 Q275D265-T268 PolarHBondContact O-OG1 3.06Å; D265-T268 VanDerWaalsContact O-OG1 3.05Å; R266-T268 PolarHBondContact O-N 3.14Å; T268-Q275 PolarHBondContact O-NE2 3.21Å
269S52.7Low55.3Low86 Ų8699.3 Ų99.360%0.60155%0.549SS*.THydrogen-bonded Turntrans-97.92.9174.574.90000113.2R266 I267R266-S269 WeakPolarHBondContact CA-OG 3.43Å; R266-S269 CarbonylContact O-C 3.58Å; R266-S269 WeakPolarHBondContact O-CA 3.44Å; R266-S269 WeakPolarHBondContact O-CB 3.39Å; R266-S269 PolarHBondContact O-N 3.34Å; R266-S269 PolarHBondContact O-OG 2.97Å; I267-S269 PolarHBondContact O-N 3.26Å
270L53.9Low53.2Low33 Ų33103.5 Ų103.517%0.17357%0.572CS.*SBendtrans-68.3146.1174.4-68.5169.3000109.9L259 R266 I267 D272 L274 Q275L259-L270 HydrophobicContact CD2-CD1 3.8Å; L259-L270 HydrophobicContact CD2-CD2 3.59Å; L259-L270 HydrophobicContact CD2-CG 4.24Å; R266-L270 PolarHBondContact O-N 3.49Å; I267-L270 HydrophobicContact CB-CD1 4.32Å; I267-L270 HydrophobicContact CG2-CD1 4Å; I267-L270 WeakPolarHBondContact O-CB 3.42Å; I267-L270 WeakPolarHBondContact O-CG 3.4Å; I267-L270 PolarHBondContact O-N 3.41Å; L270-D272 PolarHBondContact O-N 3.44Å; L270-L274 HydrophobicContact CB-CB 4.18Å; L270-L274 HydrophobicContact CD1-CB 4.44Å; L270-Q275 HydrophobicContact CB-CG 4.35Å; L270-Q275 WeakPolarHBondContact O-CG 3.34Å; L270-Q275 PolarHBondContact O-NE2 3.33Å
271P58.5Low51.6Low68 Ų68109.3 Ų109.344%0.44259%0.587SS.*  trans-49.8142.2170.2-25.433.7000111.2F273 L274P271-F273 HydrophobicContact CB-CD1 3.6Å; P271-F273 HydrophobicContact CB-CE1 3.25Å; P271-F273 HydrophobicContact CB-CZ 4.01Å; P271-F273 HydrophobicContact CG-CE1 3.97Å; P271-F273 HydrophobicContact CG-CZ 4.34Å; P271-F273 PolarHBondContact O-N 3.17Å; P271-L274 PolarHBondContact O-N 3.09Å
272D58.1Low50Low123 Ų123112.4 Ų112.466%0.65859%0.592SS**G310 helixtrans-47.9-35.3-170.9-59.7-18.4000114L270 L274 Q275 H277L270-D272 PolarHBondContact O-N 3.44Å; D272-L274 VanDerWaalsContact C-N 3.27Å; D272-L274 PolarHBondContact O-N 3.39Å; D272-Q275 PolarHBondContact O-N 3.37Å; D272-H277 PolarHBondContact O-CE1 3.37Å; D272-H277 VanDerWaalsContact O-CE1 3.23Å
273F58.5Low48.9Very low154 Ų154115 Ų11568%0.67562%0.617SS**G310 helixtrans-69.2-16.9179.869.7-91.9000115.2P271P271-F273 HydrophobicContact CB-CD1 3.6Å; P271-F273 HydrophobicContact CB-CE1 3.25Å; P271-F273 HydrophobicContact CB-CZ 4.01Å; P271-F273 HydrophobicContact CG-CE1 3.97Å; P271-F273 HydrophobicContact CG-CZ 4.34Å; P271-F273 PolarHBondContact O-N 3.17Å
274L45.5Very low48Very low97 Ų97118.5 Ų118.551%0.50863%0.634SS.*G310 helixtrans-104.1-6.2175.7-64.6177.7000112.8L270 P271 D272L270-L274 HydrophobicContact CB-CB 4.18Å; L270-L274 HydrophobicContact CD1-CB 4.44Å; P271-L274 PolarHBondContact O-N 3.09Å; D272-L274 VanDerWaalsContact C-N 3.27Å; D272-L274 PolarHBondContact O-N 3.39Å
275Q53.9Low47.4Very low66 Ų66121.9 Ų121.931%0.30868%0.682SS.*SBendtrans-71.8137.8173.7-63.7-174.4-1.100108.9T268 L270 D272 H277T268-Q275 PolarHBondContact O-NE2 3.21Å; L270-Q275 HydrophobicContact CB-CG 4.35Å; L270-Q275 WeakPolarHBondContact O-CG 3.34Å; L270-Q275 PolarHBondContact O-NE2 3.33Å; D272-Q275 PolarHBondContact O-N 3.37Å; Q275-H277 PolarHBondContact O-N 3.47Å; Q275-H277 PolarHBondContact O-ND1 3.12Å
276P47.7Very low47.1Very low105 Ų105121.3 Ų121.368%0.68268%0.681SS**  trans-61.6106172.923.7-29.8000107.8S278P276-S278 PolarHBondContact O-N 3.45Å
277H44.8Very low47Very low146 Ų146119.4 Ų119.468%0.67669%0.685SS**  trans-64.6106.8176.5-68.458.3000106.1D272 Q275 E279D272-H277 PolarHBondContact O-CE1 3.37Å; D272-H277 VanDerWaalsContact O-CE1 3.23Å; Q275-H277 PolarHBondContact O-N 3.47Å; Q275-H277 PolarHBondContact O-ND1 3.12Å; H277-E279 PolarHBondContact O-N 3.05Å
278S40.7Very low46.7Very low118 Ų118122 Ų12283%0.82570%0.703SS**  trans-7086168.816.70000106.1P276 N280P276-S278 PolarHBondContact O-N 3.45Å; S278-N280 PolarHBondContact O-N 3.01Å
279E41.7Very low46.4Very low177 Ų177122.8 Ų122.883%0.82771%0.705SS**  trans-64.191.9160.2-76.6-162153.900107.1H277H277-E279 PolarHBondContact O-N 3.05Å
280N34Very low46Very low151 Ų151125.1 Ų125.181%0.80771%0.711SS**  trans-124.796.1151-136.8-5.6000109S278 R282S278-N280 PolarHBondContact O-N 3.01Å; N280-R282 PolarHBondContact O-N 2.99Å
281K41.3Very low45.5Very low176 Ų176131.2 Ų131.277%0.76575%0.747SS**  trans-49129.4160.4-73.6171.4175.2171.20109.3
282R35.8Very low44.5Very low217 Ų217135.7 Ų135.782%0.81977%0.769SS**  -165.394.3115.4-106177.8-94.1-173.5-5.4110.9N280N280-R282 PolarHBondContact O-N 2.99Å
283A42.3Very low43.5Very low103 Ų103136.7 Ų136.785%0.85178%0.777SS**  trans-65.2115.7134.100000107.3
284C39.9Very low42.3Very low110 Ų110135.3 Ų135.374%0.74379%0.786SS**  trans-139.6129.3150-86.30000104.9
285G39.5Very low42Very low157 Ų157138.7 Ų138.7100%1.61981%0.811SS**  trans-71.20-176.400000114.6

Retrieved 285 of 285 residues in 283.2 ms (Link to these results)