A0A096NDJ2_PAPAN Loading...

Transmembrane protein 127

AlphaFold DB (O75204), UniProt , Accession A0A096NDJ2, Species PAPAN (Papio anubis, Olive baboon), Gene TMEM127, Length 238 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
1M33.6Very low35.7Very low246 Ų246128.2 Ų128.2100%1.21286%0.862SS**  0140.30-92.1172.5170.700108.2
2Y32.6Very low35.6Very low241 Ų241123.8 Ų123.895%0.94585%0.854SS**  trans-61.2154-160.4-96.9-104.1000116.1
3A34.9Very low35.4Very low92 Ų92134.2 Ų134.276%0.7686%0.864SS**  trans-69.3173.5179.900000114.1
4P46.2Very low35.7Very low126 Ų126141.9 Ų141.982%0.81887%0.867SS**  trans-104.7177.6-141.941.2-36.8000114.8
5G31.1Very low35.9Very low79 Ų79148.9 Ų148.981%0.81487%0.872SS**  trans-64156.5170.300000114.6
6G35.2Very low36.3Very low78 Ų78154.9 Ų154.980%0.80488%0.875SS**  trans-133.3106.6165.700000108.1
7A37.5Very low36.2Very low101 Ų101152.3 Ų152.384%0.83587%0.869SS**PPolyproline II helixtrans-66.9128.6177.600000110.5L9A7-L9 PolarHBondContact O-N 3.23Å
8G34.3Very low36.7Very low79 Ų79151.3 Ų151.381%0.81487%0.869SS**PPolyproline II helixtrans-67.7119.4172.700000111
9L35Very low36.7Very low170 Ų170146.8 Ų146.889%0.8986%0.859SS**PPolyproline II helixtrans-92.9129167.1-86.9158.2000109.3A7A7-L9 PolarHBondContact O-N 3.23Å
10P39.5Very low36.8Very low120 Ų120143.4 Ų143.478%0.77986%0.856SS**PPolyproline II helixtrans-92.8146.5-169.534.9-33000113.4
11G33.1Very low36.9Very low78 Ų78142 Ų14280%0.80485%0.853SS**  79.747.3129.500000118.2R13G11-R13 PolarHBondContact O-N 3.4Å; G11-R13 VanDerWaalsContact O-N 3.11Å
12G33.7Very low37.5Very low75 Ų75134.4 Ų134.477%0.77383%0.83SS**  trans-75.488.7164.300000112R14G12-R14 VanDerWaalsContact C-N 3.31Å; G12-R14 PolarHBondContact O-N 3.38Å
13R34.2Very low37.9Very low260 Ų260130.5 Ų130.598%0.98183%0.825SS**  trans-61.385.5168.3-112.5-179.8178.2179.80.1109.6G11G11-R13 PolarHBondContact O-N 3.4Å; G11-R13 VanDerWaalsContact O-N 3.11Å
14R39.2Very low38.1Very low242 Ų242131 Ų13191%0.91382%0.82SS**  trans-88.2123.2172.8-90.2-173.7176.5-169.60.3110.9G12 R16G12-R14 VanDerWaalsContact C-N 3.31Å; G12-R14 PolarHBondContact O-N 3.38Å; R14-R16 PolarHBondContact O-N 2.85Å
15R38.4Very low38Very low247 Ų247134.9 Ų134.993%0.93282%0.824SS**  trans-53.3123.4178.9-133.9171.5-179.9-169-0.6110.1S17R15-S17 PolarHBondContact O-N 3.11Å; R15-S17 VanDerWaalsContact O-N 3.15Å
16R42Very low38.6Very low245 Ų245138.8 Ų138.893%0.92582%0.821SS**  trans-50.7114.3170-90.7176.5167.9167.6-5.3109.6R14R14-R16 PolarHBondContact O-N 2.85Å
17S35.5Very low39.3Very low110 Ų110139.4 Ų139.477%0.76981%0.811SS**  trans-86.6119.8164.1-160.60000107.7R15 G19R15-S17 PolarHBondContact O-N 3.11Å; R15-S17 VanDerWaalsContact O-N 3.15Å; S17-G19 PolarHBondContact O-N 3.34Å; S17-G19 VanDerWaalsContact O-N 3.13Å
18P45.1Very low40Very low135 Ų135140.6 Ų140.688%0.87780%0.799SS**  trans-82.691-17931.6-28.3000108.6
19G36.2Very low41.2Very low65 Ų65145.4 Ų145.467%0.6779%0.793SS**  trans-139.98.6-174.900000115.4S17 S21S17-G19 PolarHBondContact O-N 3.34Å; S17-G19 VanDerWaalsContact O-N 3.13Å; G19-S21 PolarHBondContact O-N 3.48Å; G19-S21 VanDerWaalsContact O-N 3.11Å
20G39Very low42.6Very low78 Ų78137.5 Ų137.580%0.80475%0.752SS**  trans-75.996.6170.100000108.9A22G20-A22 PolarHBondContact O-N 3.15Å
21S39.7Very low44Very low114 Ų114137.8 Ų137.880%0.79775%0.746SS**  trans-64.772.2166.451.90000109.2G19 L23G19-S21 PolarHBondContact O-N 3.48Å; G19-S21 VanDerWaalsContact O-N 3.11Å; S21-L23 VanDerWaalsContact C-N 3.35Å; S21-L23 PolarHBondContact O-N 3.44Å
22A46Very low46.2Very low87 Ų87137.2 Ų137.272%0.71973%0.734SS**  trans-57.9107.116000000105.3G20G20-A22 PolarHBondContact O-N 3.15Å
23L40.5Very low48.4Very low160 Ų160133.6 Ų133.684%0.83870%0.697SS**  trans-38.4119165.3-90.9151.5000106.2S21 K25S21-L23 VanDerWaalsContact C-N 3.35Å; S21-L23 PolarHBondContact O-N 3.44Å; L23-K25 PolarHBondContact O-N 3.13Å
24P39.8Very low50.8Low102 Ų102121.7 Ų121.766%0.66265%0.654SS**  trans-56.8114.2-176.121.9-30.7000105.2Q26P24-Q26 PolarHBondContact O-N 3.12Å
25K42.6Very low53.2Low207 Ų207115.8 Ų115.890%0.964%0.64SS**  trans-5982.4177.8-166.3168-174165.40105L23 P27L23-K25 PolarHBondContact O-N 3.13Å; K25-P27 VanDerWaalsContact O-CD 3.28Å; K25-P27 WeakPolarHBondContact O-CD 3.12Å
26Q44.3Very low55.7Low161 Ų161105 Ų10575%0.75260%0.602SS**  trans-60.4116.5-173.1-83.3-162.6-10.700103.2P24 E28P24-Q26 PolarHBondContact O-N 3.12Å; Q26-E28 PolarHBondContact O-N 3.11Å
27P49.2Very low58Low92 Ų9293.4 Ų93.460%0.59756%0.558SS**  trans-57.5116.3178.623.6-30.3000104.4K25 R29K25-P27 VanDerWaalsContact O-CD 3.28Å; K25-P27 WeakPolarHBondContact O-CD 3.12Å; P27-R29 WeakPolarHBondContact O-CG 3.25Å; P27-R29 PolarHBondContact O-N 2.82Å
28E53.7Low60.8Low126 Ų12689.7 Ų89.759%0.58953%0.534SS*.  trans-55.775.5-175.8-66.5177.5144.600109.7Q26 S30 R127Q26-E28 PolarHBondContact O-N 3.11Å; E28-S30 PolarHBondContact O-N 3.04Å; E28-R127 IonicContact OE2-NH2 2.64Å
29R58.4Low63.1Low179 Ų17988.4 Ų88.468%0.67552%0.519SS*.  trans-83.3114.5179.9-78.9-178.1179.1176.61.6105.8P27 L31P27-R29 WeakPolarHBondContact O-CG 3.25Å; P27-R29 PolarHBondContact O-N 2.82Å; R29-L31 PolarHBondContact O-N 3.46Å
30S64.5Low66Low4 Ų485.3 Ų85.33%0.02849%0.487CS..  trans-75.350.8-172.662.50000113.3E28 A32 S33 A34 D114 R197E28-S30 PolarHBondContact O-N 3.04Å; S30-A32 PolarHBondContact O-N 2.78Å; S30-S33 VanDerWaalsContact CB-OG 3.31Å; S30-S33 WeakPolarHBondContact CB-OG 3.35Å; S30-S33 PolarHBondContact O-N 3.15Å; S30-S33 PolarHBondContact O-OG 2.84Å; S30-S33 VanDerWaalsContact O-OG 3.1Å; S30-S33 PolarHBondContact OG-OG 3.09Å; S30-A34 WeakPolarHBondContact O-CB 3.47Å; S30-A34 PolarHBondContact O-N 2.95Å; S30-D114 WeakPolarHBondContact OG-CA 3.49Å; S30-D114 WeakPolarHBondContact OG-CB 3.41Å; S30-D114 PolarHBondContact OG-O 3.04Å; S30-R197 VanDerWaalsContact C-NH2 3.34Å; S30-R197 VanDerWaalsContact CA-NH2 3.26Å; S30-R197 PolarHBondContact O-NH2 2.87Å
31L69Low68.7Low127 Ų12782.6 Ų82.667%0.66545%0.454SS*.Hα-helixtrans-51.7-34.9-174-67.2175.9000112.9R29 S33 L35R29-L31 PolarHBondContact O-N 3.46Å; L31-S33 PolarHBondContact O-N 2.89Å; L31-L35 WeakPolarHBondContact O-CG 3.4Å; L31-L35 PolarHBondContact O-N 2.84Å
32A79Confident71.4Confident65 Ų6580.9 Ų80.954%0.53744%0.439SS..Hα-helixtrans-66.1-28.7178.900000115S30 P36S30-A32 PolarHBondContact O-N 2.78Å; A32-P36 WeakPolarHBondContact O-CD 3.47Å
33S81Confident73.8Confident0 Ų077.5 Ų77.50%041%0.411CS..Hα-helixtrans-97.6-31175.755.60000111.9S30 L31 L35 P36 G37 D114 N194 R197S30-S33 VanDerWaalsContact CB-OG 3.31Å; S30-S33 WeakPolarHBondContact CB-OG 3.35Å; S30-S33 PolarHBondContact O-N 3.15Å; S30-S33 PolarHBondContact O-OG 2.84Å; S30-S33 VanDerWaalsContact O-OG 3.1Å; S30-S33 PolarHBondContact OG-OG 3.09Å; L31-S33 PolarHBondContact O-N 2.89Å; S33-L35 VanDerWaalsContact C-N 3.29Å; S33-L35 PolarHBondContact O-N 3.41Å; S33-P36 WeakPolarHBondContact O-CD 3.36Å; S33-G37 PolarHBondContact O-N 3.15Å; S33-D114 PolarHBondContact OG-OD2 3.09Å; S33-N194 WeakPolarHBondContact CB-OD1 3.39Å; S33-N194 PolarHBondContact OG-OD1 3.36Å; S33-R197 PolarHBondContact OG-NH1 2.88Å; S33-R197 PolarHBondContact OG-NH2 2.8Å; S33-R197 VanDerWaalsContact OG-NH2 3.11Å
34A84.5Confident76.5Confident9 Ų970 Ų707%0.07437%0.372CS..Hα-helixtrans-59.8-38.3176.400000112.2S30 G37 A38 F111 V115S30-A34 WeakPolarHBondContact O-CB 3.47Å; S30-A34 PolarHBondContact O-N 2.95Å; A34-G37 PolarHBondContact O-N 2.71Å; A34-A38 VanDerWaalsContact O-CB 3.31Å; A34-A38 WeakPolarHBondContact O-CB 3.28Å; A34-A38 PolarHBondContact O-N 3.23Å; A34-F111 HydrophobicContact CB-CD2 4.26Å; A34-F111 HydrophobicContact CB-CE2 3.91Å; A34-F111 WeakPolarHBondContact O-CD2 3.33Å; A34-F111 WeakPolarHBondContact O-CE2 3.43Å; A34-V115 HydrophobicContact CB-CG2 4.4Å
35L89.3Confident79.2Confident119 Ų11967.9 Ų67.962%0.62336%0.358SS*.Hα-helixtrans-64.1-56.1178.6-76.9174.6000112.8L31 S33 G37 A38 L39L31-L35 WeakPolarHBondContact O-CG 3.4Å; L31-L35 PolarHBondContact O-N 2.84Å; S33-L35 VanDerWaalsContact C-N 3.29Å; S33-L35 PolarHBondContact O-N 3.41Å; L35-G37 VanDerWaalsContact C-N 3.28Å; L35-G37 PolarHBondContact O-N 3.4Å; L35-A38 PolarHBondContact O-N 3.38Å; L35-L39 WeakPolarHBondContact O-CG 3.42Å; L35-L39 PolarHBondContact O-N 2.8Å
36P89.5Confident81.7Confident21 Ų2160.9 Ų60.914%0.13633%0.333CS..Hα-helixtrans-59.7-36.1173.3-2331.2000113.4A32 S33 L39 S40 A186 L189 A190A32-P36 WeakPolarHBondContact O-CD 3.47Å; S33-P36 WeakPolarHBondContact O-CD 3.36Å; P36-L39 PolarHBondContact O-N 3.48Å; P36-S40 PolarHBondContact O-N 2.92Å; P36-A186 VanDerWaalsContact CB-O 3.26Å; P36-A186 WeakPolarHBondContact CB-O 3.5Å; P36-L189 HydrophobicContact CB-CB 4.18Å; P36-L189 HydrophobicContact CG-CB 4.33Å; P36-A190 HydrophobicContact CB-CB 4.05Å
37G91.2Very high84.1Confident0 Ų053.2 Ų53.20%030%0.298CS..Hα-helixtrans-61.7-45.4174.700000112.8S33 A34 L35 L39 S40 I41S33-G37 PolarHBondContact O-N 3.15Å; A34-G37 PolarHBondContact O-N 2.71Å; L35-G37 VanDerWaalsContact C-N 3.28Å; L35-G37 PolarHBondContact O-N 3.4Å; G37-L39 PolarHBondContact O-N 3.29Å; G37-S40 WeakPolarHBondContact O-CB 3.28Å; G37-S40 PolarHBondContact O-N 2.89Å; G37-I41 WeakPolarHBondContact O-CG1 3.38Å; G37-I41 PolarHBondContact O-N 2.76Å
38A93.3Very high86.3Confident33 Ų3349.6 Ų49.627%0.27327%0.273SS..Hα-helixtrans-61.5-43.1174.900000111.7A34 L35 S40 I41 T42 F111A34-A38 VanDerWaalsContact O-CB 3.31Å; A34-A38 WeakPolarHBondContact O-CB 3.28Å; A34-A38 PolarHBondContact O-N 3.23Å; L35-A38 PolarHBondContact O-N 3.38Å; A38-S40 VanDerWaalsContact C-N 3.34Å; A38-S40 PolarHBondContact O-N 2.84Å; A38-I41 PolarHBondContact O-N 2.87Å; A38-T42 WeakPolarHBondContact O-CG2 3.18Å; A38-T42 PolarHBondContact O-N 2.72Å; A38-T42 PolarHBondContact O-OG1 2.99Å; A38-F111 HydrophobicContact CB-CD2 4.26Å; A38-F111 HydrophobicContact CB-CE2 3.87Å
39L94.9Very high88.1Confident108 Ų10847.3 Ų47.357%0.56528%0.276SS*.Hα-helixtrans-60.2-43.6175.8-71.3174000111.6L35 P36 G37 I41 T42 A43 A186L35-L39 WeakPolarHBondContact O-CG 3.42Å; L35-L39 PolarHBondContact O-N 2.8Å; P36-L39 PolarHBondContact O-N 3.48Å; G37-L39 PolarHBondContact O-N 3.29Å; L39-I41 PolarHBondContact O-N 2.6Å; L39-T42 WeakPolarHBondContact CA-OG1 3.29Å; L39-T42 PolarHBondContact O-N 3Å; L39-T42 PolarHBondContact O-OG1 3.41Å; L39-A43 VanDerWaalsContact O-CB 3.32Å; L39-A43 WeakPolarHBondContact O-CB 3.25Å; L39-A43 PolarHBondContact O-N 2.61Å; L39-A186 HydrophobicContact CB-CB 4.42Å
40S96.1Very high89.6Confident0 Ų043.2 Ų43.20%026%0.264CS..Hα-helixtrans-58.1-48175.5-179.30000112.2P36 G37 A38 T42 A43 L44 A183 S187P36-S40 PolarHBondContact O-N 2.92Å; G37-S40 WeakPolarHBondContact O-CB 3.28Å; G37-S40 PolarHBondContact O-N 2.89Å; A38-S40 VanDerWaalsContact C-N 3.34Å; A38-S40 PolarHBondContact O-N 2.84Å; S40-T42 PolarHBondContact O-N 3.44Å; S40-A43 PolarHBondContact O-N 2.85Å; S40-L44 WeakPolarHBondContact O-CG 3.3Å; S40-L44 PolarHBondContact O-N 3.38Å; S40-A183 PolarHBondContact OG-O 3.44Å; S40-S187 WeakPolarHBondContact CB-OG 3.49Å; S40-S187 PolarHBondContact OG-OG 2.93Å
41I96Very high90.6Very high20 Ų2044.8 Ų44.810%0.10328%0.275CS..Hα-helixtrans-59.1-49.3176.8-63.8158.1000110.3G37 A38 L39 A43 L44 C45 S107 L108 F111G37-I41 WeakPolarHBondContact O-CG1 3.38Å; G37-I41 PolarHBondContact O-N 2.76Å; A38-I41 PolarHBondContact O-N 2.87Å; L39-I41 PolarHBondContact O-N 2.6Å; I41-A43 VanDerWaalsContact C-N 3.3Å; I41-A43 PolarHBondContact O-N 3.44Å; I41-L44 PolarHBondContact O-N 2.64Å; I41-C45 WeakPolarHBondContact O-CB 3.37Å; I41-C45 PolarHBondContact O-N 2.8Å; I41-C45 PolarHBondContact O-SG 3.2Å; I41-S107 VanDerWaalsContact CG1-CB 3.5Å; I41-L108 HydrophobicContact CD1-CD2 3.95Å; I41-L108 HydrophobicContact CD1-CG 4.36Å; I41-L108 HydrophobicContact CG1-CD2 4.49Å; I41-L108 HydrophobicContact CG2-CD2 4.05Å; I41-L108 HydrophobicContact CG2-CG 4.32Å; I41-F111 HydrophobicContact CD1-CB 3.67Å; I41-F111 HydrophobicContact CD1-CG 4.03Å
42T96.3Very high91.6Very high79 Ų7939 Ų3949%0.48525%0.245SC..Hα-helixtrans-60.6-42.1-179.754.10000111.7A38 L39 S40 C45 T46A38-T42 WeakPolarHBondContact O-CG2 3.18Å; A38-T42 PolarHBondContact O-N 2.72Å; A38-T42 PolarHBondContact O-OG1 2.99Å; L39-T42 WeakPolarHBondContact CA-OG1 3.29Å; L39-T42 PolarHBondContact O-N 3Å; L39-T42 PolarHBondContact O-OG1 3.41Å; S40-T42 PolarHBondContact O-N 3.44Å; T42-C45 PolarHBondContact O-N 3.13Å; T42-T46 WeakPolarHBondContact O-CG2 3.25Å; T42-T46 PolarHBondContact O-N 2.89Å; T42-T46 PolarHBondContact O-OG1 2.6Å; T42-T46 VanDerWaalsContact O-OG1 3.06Å
43A96.7Very high92.4Very high15 Ų1536.1 Ų36.112%0.12422%0.22CC..Hα-helixtrans-67.8-38.1-179.700000112.7L39 S40 I41 T46 A47 L179 A183L39-A43 VanDerWaalsContact O-CB 3.32Å; L39-A43 WeakPolarHBondContact O-CB 3.25Å; L39-A43 PolarHBondContact O-N 2.61Å; S40-A43 PolarHBondContact O-N 2.85Å; I41-A43 VanDerWaalsContact C-N 3.3Å; I41-A43 PolarHBondContact O-N 3.44Å; A43-T46 WeakPolarHBondContact CA-OG1 3.3Å; A43-T46 PolarHBondContact O-OG1 3.36Å; A43-A47 VanDerWaalsContact O-CB 3.28Å; A43-A47 WeakPolarHBondContact O-CB 3.47Å; A43-A47 PolarHBondContact O-N 2.85Å; A43-L179 HydrophobicContact CB-CD2 4.49Å; A43-A183 HydrophobicContact CB-CB 3.87Å
44L96.7Very high93Very high3 Ų336.3 Ų36.32%0.01622%0.221CC..Hα-helixtrans-68-41.6173.9-71172.6000111.8S40 I41 A47 L48 I104 T136 V180 A183S40-L44 WeakPolarHBondContact O-CG 3.3Å; S40-L44 PolarHBondContact O-N 3.38Å; I41-L44 PolarHBondContact O-N 2.64Å; L44-A47 PolarHBondContact O-N 2.82Å; L44-L48 PolarHBondContact O-N 3.35Å; L44-L48 VanDerWaalsContact O-N 3.09Å; L44-I104 HydrophobicContact CB-CD1 4.18Å; L44-I104 HydrophobicContact CB-CG1 3.59Å; L44-I104 HydrophobicContact CD1-CG1 4.27Å; L44-T136 HydrophobicContact CD1-CG2 4.26Å; L44-V180 HydrophobicContact CD2-CG2 4.38Å; L44-A183 HydrophobicContact CD2-CB 3.96Å; L44-A183 HydrophobicContact CG-CB 3.77Å
45C96.3Very high93.4Very high57 Ų5738 Ų3839%0.38523%0.228SC..Hα-helixtrans-62.6-44.4175.4-720000111.6I41 T42 L48 A49I41-C45 WeakPolarHBondContact O-CB 3.37Å; I41-C45 PolarHBondContact O-N 2.8Å; I41-C45 PolarHBondContact O-SG 3.2Å; T42-C45 PolarHBondContact O-N 3.13Å; C45-L48 PolarHBondContact O-N 3.01Å; C45-A49 PolarHBondContact O-N 3.42Å; C45-A49 VanDerWaalsContact O-N 3.1Å
46T95.8Very high93.5Very high61 Ų6132.6 Ų32.637%0.37420%0.199SC..Hα-helixtrans-66.6-38.2176.752.80000111.6T42 A43 L48 A49 E50 L179T42-T46 WeakPolarHBondContact O-CG2 3.25Å; T42-T46 PolarHBondContact O-N 2.89Å; T42-T46 PolarHBondContact O-OG1 2.6Å; T42-T46 VanDerWaalsContact O-OG1 3.06Å; A43-T46 WeakPolarHBondContact CA-OG1 3.3Å; A43-T46 PolarHBondContact O-OG1 3.36Å; T46-L48 VanDerWaalsContact C-N 3.27Å; T46-L48 PolarHBondContact O-N 3.45Å; T46-A49 PolarHBondContact O-N 3.01Å; T46-A49 VanDerWaalsContact O-N 3.17Å; T46-E50 WeakPolarHBondContact O-CB 3.46Å; T46-E50 WeakPolarHBondContact O-CG 3.23Å; T46-E50 PolarHBondContact O-N 2.88Å; T46-L179 WeakPolarHBondContact OG1-CD1 3.35Å
47A95.6Very high93.5Very high0 Ų034.4 Ų34.40%021%0.206CC..Hα-helixtrans-61.7-33.7175.200000113.1A43 L44 W53 S176 L179 V180A43-A47 VanDerWaalsContact O-CB 3.28Å; A43-A47 WeakPolarHBondContact O-CB 3.47Å; A43-A47 PolarHBondContact O-N 2.85Å; L44-A47 PolarHBondContact O-N 2.82Å; A47-W53 HydrophobicContact CB-CZ2 4.19Å; A47-W53 WeakPolarHBondContact O-CZ2 3.35Å; A47-W53 PolarHBondContact O-NE1 3.19Å; A47-S176 PolarHBondContact O-OG 3.14Å; A47-L179 HydrophobicContact CB-CB 3.9Å; A47-L179 HydrophobicContact CB-CD1 4.37Å; A47-V180 HydrophobicContact CB-CG2 3.82Å
48L93.7Very high93.2Very high16 Ų1636.6 Ų36.68%0.08423%0.228CC..Hα-helixtrans-75.5-32.1174.6-79.4-178.9000113.5L44 C45 T46 V68 C100 F101 I104L44-L48 PolarHBondContact O-N 3.35Å; L44-L48 VanDerWaalsContact O-N 3.09Å; C45-L48 PolarHBondContact O-N 3.01Å; T46-L48 VanDerWaalsContact C-N 3.27Å; T46-L48 PolarHBondContact O-N 3.45Å; L48-V68 HydrophobicContact CD2-CG1 3.95Å; L48-C100 HydrophobicContact CD1-CB 3.95Å; L48-C100 HydrophobicContact CD2-CB 3.55Å; L48-C100 HydrophobicContact CG-CB 3.76Å; L48-F101 HydrophobicContact CD1-CD1 3.67Å; L48-F101 HydrophobicContact CD1-CD2 4.39Å; L48-F101 HydrophobicContact CD1-CE1 3.58Å; L48-F101 HydrophobicContact CD1-CE2 4.31Å; L48-F101 HydrophobicContact CD1-CG 4.08Å; L48-F101 HydrophobicContact CD1-CZ 3.92Å; L48-I104 HydrophobicContact CD1-CD1 3.43Å; L48-I104 VanDerWaalsContact CD1-CD1 3.43Å; L48-I104 HydrophobicContact CG-CD1 4.44Å
49A92.7Very high92.6Very high78 Ų7835.5 Ų35.565%0.64522%0.22SC*.Hα-helixtrans-76.7-33.6179.700000112.3C45 T46C45-A49 PolarHBondContact O-N 3.42Å; C45-A49 VanDerWaalsContact O-N 3.1Å; T46-A49 PolarHBondContact O-N 3.01Å; T46-A49 VanDerWaalsContact O-N 3.17Å
50E90.2Very high92Very high92 Ų9232.8 Ų32.843%0.4321%0.208SC..  trans-76.2130-178.6-76.1-67.3163.300112T46 A52 W53 S176T46-E50 WeakPolarHBondContact O-CB 3.46Å; T46-E50 WeakPolarHBondContact O-CG 3.23Å; T46-E50 PolarHBondContact O-N 2.88Å; E50-A52 VanDerWaalsContact C-N 3.27Å; E50-A52 PolarHBondContact O-N 3.05Å; E50-W53 PolarHBondContact O-NE1 3.36Å; E50-S176 VanDerWaalsContact CB-OG 3.3Å; E50-S176 WeakPolarHBondContact CB-OG 3.49Å; E50-S176 PolarHBondContact O-OG 3.13Å
51P84.3Confident91.5Very high38 Ų3833.5 Ų33.525%0.24721%0.213CC..SBendtrans-72.7-21.9175.830.7-35.4000112.9W53 L66 G67 S69P51-W53 PolarHBondContact O-N 2.99Å; P51-L66 CarbonylContact O-C 3.51Å; P51-L66 VanDerWaalsContact O-C 3.26Å; P51-G67 VanDerWaalsContact O-CA 3.31Å; P51-G67 WeakPolarHBondContact O-CA 3.23Å; P51-G67 PolarHBondContact O-N 2.89Å; P51-S69 WeakPolarHBondContact CA-OG 3.42Å; P51-S69 WeakPolarHBondContact CB-OG 3.17Å
52A90.8Very high90.9Very high6 Ų637.2 Ų37.25%0.0524%0.241CC..  trans-82.688.8-172.300000111E50 E65 A174 S176E50-A52 VanDerWaalsContact C-N 3.27Å; E50-A52 PolarHBondContact O-N 3.05Å; A52-E65 HydrophobicContact CB-CG 4.26Å; A52-A174 VanDerWaalsContact C-CB 3.42Å; A52-A174 HydrophobicContact CB-CB 3.85Å; A52-A174 WeakPolarHBondContact O-CB 3.39Å; A52-S176 VanDerWaalsContact O-CB 3.25Å; A52-S176 WeakPolarHBondContact O-CB 3.38Å; A52-S176 PolarHBondContact O-N 3.06Å; A52-S176 PolarHBondContact O-OG 3.07Å
53W94.7Very high90.4Very high4 Ų437.6 Ų37.62%0.01523%0.233CC..SBendtrans-100.5-42168.4-76.165.6000111.7A47 E50 P51 L66 V68 I96 V143 A174 S176 V180A47-W53 HydrophobicContact CB-CZ2 4.19Å; A47-W53 WeakPolarHBondContact O-CZ2 3.35Å; A47-W53 PolarHBondContact O-NE1 3.19Å; E50-W53 PolarHBondContact O-NE1 3.36Å; P51-W53 PolarHBondContact O-N 2.99Å; W53-L66 PolarHBondContact N-O 2.96Å; W53-V68 HydrophobicContact CD2-CG2 3.9Å; W53-V68 VanDerWaalsContact CE2-CG2 3.49Å; W53-V68 HydrophobicContact CE3-CG2 4.46Å; W53-V68 HydrophobicContact CG-CG2 4.35Å; W53-V68 HydrophobicContact CH2-CG2 4.3Å; W53-V68 HydrophobicContact CZ2-CB 4.42Å; W53-V68 HydrophobicContact CZ2-CG2 3.72Å; W53-I96 HydrophobicContact CE3-CG2 4.26Å; W53-I96 HydrophobicContact CH2-CG2 3.61Å; W53-I96 HydrophobicContact CZ2-CG2 4.38Å; W53-I96 HydrophobicContact CZ3-CG2 3.55Å; W53-V143 HydrophobicContact CH2-CG1 3.97Å; W53-V143 HydrophobicContact CZ3-CG1 3.79Å; W53-A174 WeakPolarHBondContact O-CB 3.4Å; W53-A174 PolarHBondContact O-N 3.39Å; W53-S176 VanDerWaalsContact CD1-CB 3.48Å; W53-S176 VanDerWaalsContact CE2-CB 3.45Å; W53-S176 VanDerWaalsContact NE1-CB 3.32Å; W53-S176 PolarHBondContact NE1-OG 3.49Å; W53-V180 HydrophobicContact CH2-CG2 3.71Å; W53-V180 HydrophobicContact CZ3-CG2 4.19Å
54L94.2Very high89.9Confident3 Ų343.1 Ų43.12%0.01626%0.256CS..EExtended strand (participates in β ladder)trans-132.8133.1-178.8-60.9172.3000109L66 A150 I154 V171 F173L54-L66 PolarHBondContact N-O 3.47Å; L54-L66 PolarHBondContact O-N 3.29Å; L54-A150 HydrophobicContact CD1-CB 4.25Å; L54-I154 HydrophobicContact CD1-CD1 3.47Å; L54-I154 VanDerWaalsContact CD1-CD1 3.47Å; L54-V171 HydrophobicContact CB-CG1 4.16Å; L54-V171 HydrophobicContact CD2-CG1 4.21Å; L54-F173 HydrophobicContact CD2-CD1 3.61Å; L54-F173 HydrophobicContact CD2-CE1 3.75Å
55H93.6Very high89.7Confident46 Ų4646.9 Ų46.921%0.21327%0.274CS..EExtended strand (participates in β ladder)trans-103.6123.8169.8-78.4-76.6000109.9Q64 E65 V171 T172 A174H55-Q64 CarbonylContact C-O 3.56Å; H55-Q64 WeakPolarHBondContact CA-O 3.46Å; H55-E65 WeakPolarHBondContact CE1-CG 3.47Å; H55-E65 IonicContact CE1-OE1 3.31Å; H55-E65 PolarHBondContact CE1-OE1 3.4Å; H55-E65 VanDerWaalsContact CE1-OE1 3.31Å; H55-E65 WeakPolarHBondContact ND1-CG 3.39Å; H55-V171 CarbonylContact O-C 3.56Å; H55-V171 WeakPolarHBondContact O-CA 3.4Å; H55-T172 WeakPolarHBondContact CB-OG1 3.18Å; H55-T172 PolarHBondContact N-O 2.73Å; H55-T172 PolarHBondContact O-N 2.71Å; H55-A174 WeakPolarHBondContact CD2-CB 3.43Å
56I91.4Very high89.5Confident4 Ų444.1 Ų44.12%0.02126%0.255CS..EExtended strand (participates in β ladder)trans-94.1125.1172.2-57.2180000108.8Q64 L66 I154 Q158 V171I56-Q64 PolarHBondContact N-O 2.97Å; I56-L66 HydrophobicContact CD1-CD1 3.3Å; I56-L66 HydrophobicContact CD1-CG 4.08Å; I56-L66 HydrophobicContact CG1-CD1 4.1Å; I56-I154 HydrophobicContact CD1-CG2 3.52Å; I56-I154 HydrophobicContact CG1-CG2 3.93Å; I56-Q158 HydrophobicContact CG2-CG 4.33Å; I56-V171 HydrophobicContact CG1-CG2 4.43Å
57H89.2Confident89.3Confident60 Ų6041.2 Ų41.228%0.27824%0.238SC..EExtended strand (participates in β ladder)trans-108.3124.6172.4-62.5-84.3000110V169 Y170 T172H57-V169 WeakPolarHBondContact O-CA 3.29Å; H57-Y170 HydrophobicContact CB-CD1 4.04Å; H57-Y170 HydrophobicContact CB-CD2 4.03Å; H57-Y170 HydrophobicContact CB-CE1 3.64Å; H57-Y170 HydrophobicContact CB-CE2 3.64Å; H57-Y170 HydrophobicContact CB-CG 4.21Å; H57-Y170 VanDerWaalsContact CB-CZ 3.43Å; H57-Y170 AromaticContact CD2-CD2 3.79Å; H57-Y170 AromaticContact CD2-CE2 3.3Å; H57-Y170 WeakPolarHBondContact CD2-CE2 3.22Å; H57-Y170 AromaticContact CD2-CZ 3.9Å; H57-Y170 AromaticContact CG-CE2 3.48Å; H57-Y170 VanDerWaalsContact CG-CE2 3.48Å; H57-Y170 AromaticContact CG-CZ 3.57Å; H57-Y170 PolarHBondContact N-O 3.41Å; H57-Y170 PolarHBondContact O-N 3.13Å; H57-T172 PolarHBondContact NE2-OG1 3.23Å; H57-T172 VanDerWaalsContact NE2-OG1 3.17Å
58G85.1Confident89.1Confident45 Ų4541.2 Ų41.246%0.46424%0.238SC..SBendtrans77.1-158.6-175.600000112.8
59G80.5Confident88.9Confident10 Ų1042.6 Ų42.610%0.10325%0.249CC..SBendtrans79.9-163.5179.900000113.9K163G59-K163 WeakPolarHBondContact O-CB 3.19Å
60T82.4Confident88.7Confident51 Ų5139.6 Ų39.631%0.31322%0.222SC..SBendtrans-96.4-18.4-178.339.10000112.8S62 H161 K163T60-S62 PolarHBondContact O-N 3.16Å; T60-H161 WeakPolarHBondContact CG2-O 3.35Å; T60-H161 PolarHBondContact OG1-O 2.72Å; T60-H161 VanDerWaalsContact OG1-O 3.13Å; T60-K163 HydrophobicContact CG2-CB 3.85Å; T60-K163 HydrophobicContact CG2-CG 4.41Å
61C86.3Confident88.8Confident15 Ų1535.4 Ų35.410%0.10120%0.202CC..  trans-67.2127.3-178.4-166.30000111.9R63 C84C61-R63 VanDerWaalsContact C-N 3.35Å; C61-R63 PolarHBondContact SG-O 2.97Å; C61-C84 WeakPolarHBondContact CA-SG 3.47Å; C61-C84 HydrophobicContact CB-CB 3.88Å; C61-C84 WeakPolarHBondContact CB-SG 3.31Å; C61-C84 WeakPolarHBondContact SG-CB 3.46Å; C61-C84 CovalentContact SG-SG 2.02Å; C61-C84 PolarHBondContact SG-SG 3.49Å
62S82.9Confident88.9Confident99 Ų9937.8 Ų37.869%0.69221%0.213SC*.SBendtrans-73.6-29.417558.20000112.5T60T60-S62 PolarHBondContact O-N 3.16Å
63R84.6Confident88.7Confident87 Ų8739.7 Ų39.733%0.32823%0.232SC..  trans-91.3122.1-178.5-163.8178.5177.1173.7-8.2110.6C61 E65 D70C61-R63 VanDerWaalsContact C-N 3.35Å; C61-R63 PolarHBondContact SG-O 2.97Å; R63-E65 WeakPolarHBondContact CD-O 3.44Å; R63-E65 WeakPolarHBondContact CG-O 3.34Å; R63-E65 PolarHBondContact NE-O 3.24Å; R63-D70 IonicContact CZ-OD1 2.99Å; R63-D70 IonicContact CZ-OD2 3.9Å; R63-D70 IonicContact NH1-OD1 2.71Å; R63-D70 PolarHBondContact NH1-OD1 3.47Å; R63-D70 IonicContact NH2-OD1 2.73Å; R63-D70 PolarHBondContact NH2-OD1 3.43Å; R63-D70 IonicContact NH2-OD2 3.67Å
64Q87.4Confident88.3Confident130 Ų13048 Ų4861%0.60727%0.265SS*.  trans-85.5-29.4-177.5-66.9176.8-9.800112.5H55 I56H55-Q64 CarbonylContact C-O 3.56Å; H55-Q64 WeakPolarHBondContact CA-O 3.46Å; I56-Q64 PolarHBondContact N-O 2.97Å
65E91.4Very high88.1Confident82 Ų8248.9 Ų48.938%0.38327%0.27SS..EExtended strand (participates in β ladder)trans-103.5123.2-178.7-75.3171.9-161.600111.2A52 H55 R63A52-E65 HydrophobicContact CB-CG 4.26Å; H55-E65 WeakPolarHBondContact CE1-CG 3.47Å; H55-E65 IonicContact CE1-OE1 3.31Å; H55-E65 PolarHBondContact CE1-OE1 3.4Å; H55-E65 VanDerWaalsContact CE1-OE1 3.31Å; H55-E65 WeakPolarHBondContact ND1-CG 3.39Å; R63-E65 WeakPolarHBondContact CD-O 3.44Å; R63-E65 WeakPolarHBondContact CG-O 3.34Å; R63-E65 PolarHBondContact NE-O 3.24Å
66L91.9Very high87.7Confident0 Ų051.8 Ų51.80%028%0.284CS..EExtended strand (participates in β ladder)trans-126.9142.6176.7-63.7-172.9000110P51 W53 L54 I56 D70 L79 C84 M85 I154P51-L66 CarbonylContact O-C 3.51Å; P51-L66 VanDerWaalsContact O-C 3.26Å; W53-L66 PolarHBondContact N-O 2.96Å; L54-L66 PolarHBondContact N-O 3.47Å; L54-L66 PolarHBondContact O-N 3.29Å; I56-L66 HydrophobicContact CD1-CD1 3.3Å; I56-L66 HydrophobicContact CD1-CG 4.08Å; I56-L66 HydrophobicContact CG1-CD1 4.1Å; L66-D70 WeakPolarHBondContact CA-OD2 3.34Å; L66-L79 HydrophobicContact CD2-CD2 3.4Å; L66-C84 HydrophobicContact CD1-CB 4.5Å; L66-M85 HydrophobicContact CB-CE 3.59Å; L66-M85 HydrophobicContact CD1-CE 3.77Å; L66-M85 HydrophobicContact CD1-CG 3.89Å; L66-M85 HydrophobicContact CD2-CE 3.97Å; L66-M85 HydrophobicContact CG-CE 3.98Å; L66-I154 HydrophobicContact CD1-CD1 4.31Å
67G91.6Very high87.5Confident0 Ų054.8 Ų54.80%030%0.304CS..  trans-173.5-160.6173.900000115.6P51 S69 D70P51-G67 VanDerWaalsContact O-CA 3.31Å; P51-G67 WeakPolarHBondContact O-CA 3.23Å; P51-G67 PolarHBondContact O-N 2.89Å; G67-S69 VanDerWaalsContact C-N 3.29Å; G67-S69 PolarHBondContact O-N 2.89Å; G67-D70 PolarHBondContact N-OD2 3.1Å; G67-D70 WeakPolarHBondContact O-CB 3.45Å; G67-D70 PolarHBondContact O-N 3.04Å
68V92.3Very high87.4Confident0 Ų056.3 Ų56.30%031%0.314CS..G310 helixtrans-64.2-35.1-173.3169.70000112.1L48 W53 D70 V71 L72 L93 I96 A97L48-V68 HydrophobicContact CD2-CG1 3.95Å; W53-V68 HydrophobicContact CD2-CG2 3.9Å; W53-V68 VanDerWaalsContact CE2-CG2 3.49Å; W53-V68 HydrophobicContact CE3-CG2 4.46Å; W53-V68 HydrophobicContact CG-CG2 4.35Å; W53-V68 HydrophobicContact CH2-CG2 4.3Å; W53-V68 HydrophobicContact CZ2-CB 4.42Å; W53-V68 HydrophobicContact CZ2-CG2 3.72Å; V68-D70 PolarHBondContact O-N 3.26Å; V68-V71 WeakPolarHBondContact O-CG2 3.39Å; V68-V71 PolarHBondContact O-N 3.42Å; V68-L72 HydrophobicContact CG1-CD1 3.89Å; V68-L72 HydrophobicContact CG1-CD2 4.16Å; V68-L72 HydrophobicContact CG1-CG 3.75Å; V68-L72 WeakPolarHBondContact O-CG 3.17Å; V68-L72 PolarHBondContact O-N 2.91Å; V68-L93 HydrophobicContact CG2-CD2 4.5Å; V68-I96 HydrophobicContact CG2-CG2 3.92Å; V68-A97 HydrophobicContact CG1-CB 3.35Å
69S89.5Confident87.5Confident45 Ų4554.6 Ų54.632%0.31529%0.294SS..G310 helixtrans-57.3-30.3177.459.40000113.2P51 G67 V71P51-S69 WeakPolarHBondContact CA-OG 3.42Å; P51-S69 WeakPolarHBondContact CB-OG 3.17Å; G67-S69 VanDerWaalsContact C-N 3.29Å; G67-S69 PolarHBondContact O-N 2.89Å; S69-V71 VanDerWaalsContact C-N 3.25Å; S69-V71 PolarHBondContact O-N 3.41Å
70D89.1Confident87.8Confident15 Ų1557.4 Ų57.48%0.0831%0.306CS..G310 helixtrans-73.5-16.6178.8-60.8-49.9000113.4R63 L66 G67 V68 L79R63-D70 IonicContact CZ-OD1 2.99Å; R63-D70 IonicContact CZ-OD2 3.9Å; R63-D70 IonicContact NH1-OD1 2.71Å; R63-D70 PolarHBondContact NH1-OD1 3.47Å; R63-D70 IonicContact NH2-OD1 2.73Å; R63-D70 PolarHBondContact NH2-OD1 3.43Å; R63-D70 IonicContact NH2-OD2 3.67Å; L66-D70 WeakPolarHBondContact CA-OD2 3.34Å; G67-D70 PolarHBondContact N-OD2 3.1Å; G67-D70 WeakPolarHBondContact O-CB 3.45Å; G67-D70 PolarHBondContact O-N 3.04Å; V68-D70 PolarHBondContact O-N 3.26Å; D70-L79 HydrophobicContact CB-CD1 4.3Å
71V91Very high88Confident3 Ų362.4 Ų62.42%0.01832%0.324CS..THydrogen-bonded Turntrans-118.6-11.7-174.5-54.50000114.4V68 S69 G73 V90 L93 R94V68-V71 WeakPolarHBondContact O-CG2 3.39Å; V68-V71 PolarHBondContact O-N 3.42Å; S69-V71 VanDerWaalsContact C-N 3.25Å; S69-V71 PolarHBondContact O-N 3.41Å; V71-G73 PolarHBondContact O-N 2.84Å; V71-V90 HydrophobicContact CB-CG1 4.31Å; V71-V90 HydrophobicContact CG1-CB 4.33Å; V71-V90 HydrophobicContact CG1-CG1 3.89Å; V71-V90 HydrophobicContact CG1-CG2 4.36Å; V71-L93 HydrophobicContact CB-CB 4.38Å; V71-L93 HydrophobicContact CG1-CB 4.02Å; V71-L93 HydrophobicContact CG1-CD1 4.01Å; V71-L93 HydrophobicContact CG2-CB 3.55Å; V71-R94 HydrophobicContact CB-CG 3.86Å; V71-R94 HydrophobicContact CG2-CG 3.77Å; V71-R94 PolarHBondContact O-NE 2.87Å; V71-R94 VanDerWaalsContact O-NE 3.11Å
72L87.9Confident88Confident89 Ų8964.5 Ų64.547%0.46633%0.334SS..SBendtrans-64.3-27.5174.9-80175000112.5V68 A97 F101V68-L72 HydrophobicContact CG1-CD1 3.89Å; V68-L72 HydrophobicContact CG1-CD2 4.16Å; V68-L72 HydrophobicContact CG1-CG 3.75Å; V68-L72 WeakPolarHBondContact O-CG 3.17Å; V68-L72 PolarHBondContact O-N 2.91Å; L72-A97 HydrophobicContact CD2-CB 3.9Å; L72-F101 HydrophobicContact CD2-CE2 3.77Å; L72-F101 HydrophobicContact CD2-CZ 4.23Å
73G86.2Confident88Confident45 Ų4564 Ų6446%0.46432%0.32SS..SBendtrans-123.6-139.6179.300000113V71 V75V71-G73 PolarHBondContact O-N 2.84Å; G73-V75 PolarHBondContact O-N 3.35Å
74Y86.6Confident88.3Confident178 Ų17860 Ų6070%0.69831%0.305SS*.PPolyproline II helixtrans-70.4121173.9-178.8-100.4000109.9H76Y74-H76 PolarHBondContact O-N 2.83Å
75V89Confident88.4Confident22 Ų2253.9 Ų53.913%0.13328%0.276CS..PPolyproline II helixtrans-76.4117.2175.1-175.90000107.7G73 L80 V90G73-V75 PolarHBondContact O-N 3.35Å; V75-L80 HydrophobicContact CG1-CD1 3.47Å; V75-L80 VanDerWaalsContact CG1-CD1 3.47Å; V75-V90 HydrophobicContact CG1-CG2 4.42Å; V75-V90 HydrophobicContact CG2-CG1 3.93Å
76H86.6Confident88.4Confident108 Ų10853 Ų5350%0.527%0.274SS..PPolyproline II helixtrans-57.8129.8177.8-82.8-64.1000110.5Y74 D78 L79Y74-H76 PolarHBondContact O-N 2.83Å; H76-D78 PolarHBondContact O-N 3.45Å; H76-D78 VanDerWaalsContact O-N 3.16Å; H76-L79 HydrophobicContact CB-CD1 4Å; H76-L79 WeakPolarHBondContact O-CB 3.21Å; H76-L79 PolarHBondContact O-N 2.95Å; H76-L79 VanDerWaalsContact O-N 3.09Å
77P86.4Confident88.4Confident67 Ų6757.2 Ų57.244%0.43530%0.301SS..Hα-helixtrans-62.3-27.2-175.825.3-35.1000112.2L79 L80 K81P77-L79 VanDerWaalsContact C-N 3.28Å; P77-L79 PolarHBondContact O-N 3.11Å; P77-L80 PolarHBondContact O-N 3.29Å; P77-K81 WeakPolarHBondContact O-CB 3.13Å; P77-K81 PolarHBondContact O-N 3.42Å
78D86.2Confident88.5Confident92 Ų9261.8 Ų61.849%0.49232%0.323SS..Hα-helixtrans-63.5-32178.5-57.9-31.9000112H76 L80 K81 D82H76-D78 PolarHBondContact O-N 3.45Å; H76-D78 VanDerWaalsContact O-N 3.16Å; D78-L80 VanDerWaalsContact C-N 3.31Å; D78-L80 PolarHBondContact O-N 2.92Å; D78-K81 PolarHBondContact O-N 2.97Å; D78-D82 WeakPolarHBondContact O-CB 3.41Å; D78-D82 PolarHBondContact O-N 3.1Å
79L86.9Confident88.6Confident8 Ų861.8 Ų61.84%0.04232%0.323CS..Hα-helixtrans-63.5-36.3175.9-75.4154.6000112.5L66 D70 H76 P77 C84 M85L66-L79 HydrophobicContact CD2-CD2 3.4Å; D70-L79 HydrophobicContact CB-CD1 4.3Å; H76-L79 HydrophobicContact CB-CD1 4Å; H76-L79 WeakPolarHBondContact O-CB 3.21Å; H76-L79 PolarHBondContact O-N 2.95Å; H76-L79 VanDerWaalsContact O-N 3.09Å; P77-L79 VanDerWaalsContact C-N 3.28Å; P77-L79 PolarHBondContact O-N 3.11Å; L79-C84 HydrophobicContact CD2-CB 4.02Å; L79-C84 VanDerWaalsContact O-CB 3.26Å; L79-C84 WeakPolarHBondContact O-CB 3.31Å; L79-C84 PolarHBondContact O-N 3.15Å; L79-M85 PolarHBondContact O-N 2.67Å; L79-M85 VanDerWaalsContact O-N 3.11Å
80L88.3Confident88.8Confident69 Ų6960.3 Ų60.336%0.36131%0.312SS..Hα-helixtrans-82.3-38.3177.4-84.572.5000110.9V75 P77 D78 F83 P87 V90V75-L80 HydrophobicContact CG1-CD1 3.47Å; V75-L80 VanDerWaalsContact CG1-CD1 3.47Å; P77-L80 PolarHBondContact O-N 3.29Å; D78-L80 VanDerWaalsContact C-N 3.31Å; D78-L80 PolarHBondContact O-N 2.92Å; L80-F83 PolarHBondContact O-N 3.23Å; L80-P87 HydrophobicContact CD2-CG 4.34Å; L80-V90 HydrophobicContact CD1-CG2 4.38Å
81K86.1Confident89.1Confident156 Ų15665 Ų6568%0.67834%0.336SS*.Hα-helixtrans-70.2-38.3-177.7-170.6-179.4176.9-173.90112.6P77 D78 F83P77-K81 WeakPolarHBondContact O-CB 3.13Å; P77-K81 PolarHBondContact O-N 3.42Å; D78-K81 PolarHBondContact O-N 2.97Å; K81-F83 WeakPolarHBondContact O-CD2 3.35Å; K81-F83 WeakPolarHBondContact O-CE2 3.43Å; K81-F83 PolarHBondContact O-N 3.2Å
82D86Confident89.3Confident60 Ų6065.5 Ų65.532%0.32134%0.339SS..THydrogen-bonded Turntrans-83.211.4176.4-65.7-11.4000112.2D78 C84D78-D82 WeakPolarHBondContact O-CB 3.41Å; D78-D82 PolarHBondContact O-N 3.1Å; D82-C84 PolarHBondContact O-N 2.96Å
83F84.3Confident89.6Confident89 Ų8961.4 Ų61.439%0.3932%0.317SS..THydrogen-bonded Turntrans55.822-179.5-53.2-81.8000114.1L80 K81 M85 Q157 Q158 H161L80-F83 PolarHBondContact O-N 3.23Å; K81-F83 WeakPolarHBondContact O-CD2 3.35Å; K81-F83 WeakPolarHBondContact O-CE2 3.43Å; K81-F83 PolarHBondContact O-N 3.2Å; F83-M85 VanDerWaalsContact C-N 3.3Å; F83-M85 PolarHBondContact O-N 3.37Å; F83-Q157 HydrophobicContact CB-CG 4.42Å; F83-Q157 VanDerWaalsContact O-CD 3.25Å; F83-Q157 PolarHBondContact O-NE2 3.37Å; F83-Q157 VanDerWaalsContact O-NE2 3.17Å; F83-Q158 PolarHBondContact O-NE2 3.03Å; F83-H161 HydrophobicContact CB-CB 4.33Å; F83-H161 AromaticContact CD1-CD2 3.99Å; F83-H161 AromaticContact CD1-CE1 3.83Å; F83-H161 AromaticContact CD1-NE2 3.68Å; F83-H161 AromaticContact CD2-ND1 3.86Å; F83-H161 AromaticContact CE1-CE1 3.7Å; F83-H161 AromaticContact CE1-NE2 3.87Å; F83-H161 AromaticContact CE2-ND1 3.97Å; F83-H161 AromaticContact CG-CD2 3.99Å; F83-H161 AromaticContact CG-CG 3.93Å; F83-H161 AromaticContact CG-ND1 3.98Å; F83-H161 AromaticContact CZ-CE1 3.82Å
84C89Confident90.1Very high2 Ų265.1 Ų65.11%0.01432%0.317CS..SBendtrans-64.3-38175.9-59.20000111.6C61 L66 L79 D82C61-C84 WeakPolarHBondContact CA-SG 3.47Å; C61-C84 HydrophobicContact CB-CB 3.88Å; C61-C84 WeakPolarHBondContact CB-SG 3.31Å; C61-C84 WeakPolarHBondContact SG-CB 3.46Å; C61-C84 CovalentContact SG-SG 2.02Å; C61-C84 PolarHBondContact SG-SG 3.49Å; L66-C84 HydrophobicContact CD1-CB 4.5Å; L79-C84 HydrophobicContact CD2-CB 4.02Å; L79-C84 VanDerWaalsContact O-CB 3.26Å; L79-C84 WeakPolarHBondContact O-CB 3.31Å; L79-C84 PolarHBondContact O-N 3.15Å; D82-C84 PolarHBondContact O-N 2.96Å
85M89.8Confident90.5Very high1 Ų159.1 Ų59.11%0.00530%0.299CS..  trans-135.5155.7179.1-69.9-170.7172.500111.8L66 L79 F83 V90 L93 Q157L66-M85 HydrophobicContact CB-CE 3.59Å; L66-M85 HydrophobicContact CD1-CE 3.77Å; L66-M85 HydrophobicContact CD1-CG 3.89Å; L66-M85 HydrophobicContact CD2-CE 3.97Å; L66-M85 HydrophobicContact CG-CE 3.98Å; L79-M85 PolarHBondContact O-N 2.67Å; L79-M85 VanDerWaalsContact O-N 3.11Å; F83-M85 VanDerWaalsContact C-N 3.3Å; F83-M85 PolarHBondContact O-N 3.37Å; M85-V90 HydrophobicContact CB-CG2 4.24Å; M85-V90 HydrophobicContact SD-CG2 4.05Å; M85-L93 HydrophobicContact CE-CD1 3.35Å; M85-L93 HydrophobicContact SD-CD1 4.03Å; M85-Q157 PolarHBondContact O-NE2 3.28Å; M85-Q157 VanDerWaalsContact O-NE2 3.15Å
86N91.4Very high90.9Very high65 Ų6558 Ų5835%0.34829%0.293SS..  trans-103147.8169.8-174.7-39.4000109Q88 T89 V90 Q157N86-Q88 PolarHBondContact O-N 3.41Å; N86-Q88 VanDerWaalsContact O-N 3.08Å; N86-Q88 PolarHBondContact OD1-N 3.15Å; N86-T89 WeakPolarHBondContact O-CA 3.49Å; N86-T89 WeakPolarHBondContact O-CB 3.12Å; N86-T89 PolarHBondContact O-N 3.11Å; N86-V90 PolarHBondContact O-N 3.29Å; N86-Q157 VanDerWaalsContact CB-OE1 3.31Å
87P92.3Very high91.3Very high87 Ų8753.1 Ų53.157%0.56527%0.27SS*.Hα-helixtrans-40.9-39.5164.8-31.631.5000115.1L80 V90 L91L80-P87 HydrophobicContact CD2-CG 4.34Å; P87-V90 PolarHBondContact O-N 3.37Å; P87-L91 PolarHBondContact O-N 3.49Å
88Q94.3Very high91.8Very high97 Ų9752.3 Ų52.345%0.45327%0.269SS..Hα-helixtrans-66.5-43177-172.1176.6-25.700112.3N86 V90 L91 L92 L153N86-Q88 PolarHBondContact O-N 3.41Å; N86-Q88 VanDerWaalsContact O-N 3.08Å; N86-Q88 PolarHBondContact OD1-N 3.15Å; Q88-V90 VanDerWaalsContact C-N 3.34Å; Q88-L91 WeakPolarHBondContact O-CB 3.31Å; Q88-L91 PolarHBondContact O-N 3.35Å; Q88-L92 WeakPolarHBondContact O-CB 3.45Å; Q88-L92 PolarHBondContact O-N 3.27Å; Q88-L153 HydrophobicContact CB-CD2 3.94Å; Q88-L153 HydrophobicContact CG-CD2 3.65Å
89T93.7Very high92.2Very high0 Ų051 Ų510%026%0.26CS..Hα-helixtrans-62.7-41.5174.9-51.80000111.3N86 L91 L92 L93 A150 I154N86-T89 WeakPolarHBondContact O-CA 3.49Å; N86-T89 WeakPolarHBondContact O-CB 3.12Å; N86-T89 PolarHBondContact O-N 3.11Å; T89-L91 VanDerWaalsContact C-N 3.34Å; T89-L91 PolarHBondContact O-N 3.29Å; T89-L92 WeakPolarHBondContact O-CB 3.24Å; T89-L92 PolarHBondContact O-N 2.94Å; T89-L92 VanDerWaalsContact O-N 3.13Å; T89-L93 HydrophobicContact CG2-CD1 4.31Å; T89-L93 WeakPolarHBondContact O-CG 3.48Å; T89-L93 PolarHBondContact O-N 3.43Å; T89-A150 HydrophobicContact CG2-CB 4.29Å; T89-I154 HydrophobicContact CG2-CD1 3.66Å; T89-I154 HydrophobicContact CG2-CG1 3.63Å
90V94.1Very high92.6Very high13 Ų1350.8 Ų50.88%0.07926%0.258CS..Hα-helixtrans-59.4-45.9176.8171.10000110.8V71 V75 L80 M85 N86 P87 Q88 L92 L93 R94V71-V90 HydrophobicContact CB-CG1 4.31Å; V71-V90 HydrophobicContact CG1-CB 4.33Å; V71-V90 HydrophobicContact CG1-CG1 3.89Å; V71-V90 HydrophobicContact CG1-CG2 4.36Å; V75-V90 HydrophobicContact CG1-CG2 4.42Å; V75-V90 HydrophobicContact CG2-CG1 3.93Å; L80-V90 HydrophobicContact CD1-CG2 4.38Å; M85-V90 HydrophobicContact CB-CG2 4.24Å; M85-V90 HydrophobicContact SD-CG2 4.05Å; N86-V90 PolarHBondContact O-N 3.29Å; P87-V90 PolarHBondContact O-N 3.37Å; Q88-V90 VanDerWaalsContact C-N 3.34Å; V90-L92 VanDerWaalsContact C-N 3.3Å; V90-L92 PolarHBondContact O-N 3.3Å; V90-L93 PolarHBondContact O-N 2.79Å; V90-R94 WeakPolarHBondContact O-CG 3.44Å; V90-R94 PolarHBondContact O-N 3.32Å; V90-R94 VanDerWaalsContact O-N 3.07Å
91L94.7Very high93Very high115 Ų11552.1 Ų52.160%0.60226%0.262SS*.Hα-helixtrans-58.2-45.3174.5-172.293.9000110.9P87 Q88 T89 L93 R94 V95P87-L91 PolarHBondContact O-N 3.49Å; Q88-L91 WeakPolarHBondContact O-CB 3.31Å; Q88-L91 PolarHBondContact O-N 3.35Å; T89-L91 VanDerWaalsContact C-N 3.34Å; T89-L91 PolarHBondContact O-N 3.29Å; L91-L93 PolarHBondContact O-N 2.83Å; L91-R94 WeakPolarHBondContact O-CB 3.35Å; L91-R94 PolarHBondContact O-N 2.84Å; L91-R94 VanDerWaalsContact O-N 3.14Å; L91-V95 WeakPolarHBondContact O-CG2 3.47Å; L91-V95 PolarHBondContact O-N 3.4Å
92L95.7Very high93.5Very high13 Ų1348.8 Ų48.87%0.06825%0.25CS..Hα-helixtrans-65.4-40-176.6-146.2145.6000112Q88 T89 V90 R94 V95 I96 F146 W149 A150Q88-L92 WeakPolarHBondContact O-CB 3.45Å; Q88-L92 PolarHBondContact O-N 3.27Å; T89-L92 WeakPolarHBondContact O-CB 3.24Å; T89-L92 PolarHBondContact O-N 2.94Å; T89-L92 VanDerWaalsContact O-N 3.13Å; V90-L92 VanDerWaalsContact C-N 3.3Å; V90-L92 PolarHBondContact O-N 3.3Å; L92-R94 VanDerWaalsContact C-N 3.35Å; L92-R94 PolarHBondContact O-N 3.29Å; L92-V95 WeakPolarHBondContact O-CB 3.39Å; L92-V95 PolarHBondContact O-N 3.06Å; L92-I96 HydrophobicContact CD2-CD1 3.96Å; L92-I96 WeakPolarHBondContact O-CG1 3.28Å; L92-I96 PolarHBondContact O-N 3.25Å; L92-F146 HydrophobicContact CD2-CB 3.63Å; L92-F146 HydrophobicContact CD2-CD1 4.4Å; L92-F146 HydrophobicContact CD2-CG 4.28Å; L92-F146 WeakPolarHBondContact CD2-O 3.46Å; L92-W149 HydrophobicContact CD1-CB 4.31Å; L92-W149 HydrophobicContact CD1-CD2 3.69Å; L92-W149 HydrophobicContact CD1-CE3 3.87Å; L92-W149 HydrophobicContact CD1-CG 3.92Å; L92-W149 HydrophobicContact CD1-CZ3 4.44Å; L92-A150 HydrophobicContact CD2-CB 3.98Å
93L94.4Very high93.9Very high2 Ų246 Ų461%0.0124%0.236CC..Hα-helixtrans-64.7-35.7172.4-72.1171.5000112.5V68 V71 M85 T89 V90 L91 I96 A97V68-L93 HydrophobicContact CG2-CD2 4.5Å; V71-L93 HydrophobicContact CB-CB 4.38Å; V71-L93 HydrophobicContact CG1-CB 4.02Å; V71-L93 HydrophobicContact CG1-CD1 4.01Å; V71-L93 HydrophobicContact CG2-CB 3.55Å; M85-L93 HydrophobicContact CE-CD1 3.35Å; M85-L93 HydrophobicContact SD-CD1 4.03Å; T89-L93 HydrophobicContact CG2-CD1 4.31Å; T89-L93 WeakPolarHBondContact O-CG 3.48Å; T89-L93 PolarHBondContact O-N 3.43Å; V90-L93 PolarHBondContact O-N 2.79Å; L91-L93 PolarHBondContact O-N 2.83Å; L93-I96 HydrophobicContact CD2-CD1 4.21Å; L93-I96 WeakPolarHBondContact O-CB 3.38Å; L93-I96 PolarHBondContact O-N 3.28Å; L93-A97 PolarHBondContact O-N 3.36Å
94R95.8Very high94.4Very high123 Ų12342.7 Ų42.746%0.46422%0.222SC..Hα-helixtrans-67.1-38.9173.7-71.8177.3172.5179.21112.1V71 V90 L91 L92 A97 A98V71-R94 HydrophobicContact CB-CG 3.86Å; V71-R94 HydrophobicContact CG2-CG 3.77Å; V71-R94 PolarHBondContact O-NE 2.87Å; V71-R94 VanDerWaalsContact O-NE 3.11Å; V90-R94 WeakPolarHBondContact O-CG 3.44Å; V90-R94 PolarHBondContact O-N 3.32Å; V90-R94 VanDerWaalsContact O-N 3.07Å; L91-R94 WeakPolarHBondContact O-CB 3.35Å; L91-R94 PolarHBondContact O-N 2.84Å; L91-R94 VanDerWaalsContact O-N 3.14Å; L92-R94 VanDerWaalsContact C-N 3.35Å; L92-R94 PolarHBondContact O-N 3.29Å; R94-A97 WeakPolarHBondContact O-CB 3.18Å; R94-A97 PolarHBondContact O-N 3.49Å; R94-A98 PolarHBondContact O-N 3.29Å
95V96.6Very high94.7Very high52 Ų5247.9 Ų47.932%0.31525%0.249SC..Hα-helixtrans-62.2-47.2173.8172.10000109.8L91 L92 A97 A98 F99 F146L91-V95 WeakPolarHBondContact O-CG2 3.47Å; L91-V95 PolarHBondContact O-N 3.4Å; L92-V95 WeakPolarHBondContact O-CB 3.39Å; L92-V95 PolarHBondContact O-N 3.06Å; V95-A97 VanDerWaalsContact C-N 3.31Å; V95-A97 PolarHBondContact O-N 2.98Å; V95-A98 WeakPolarHBondContact O-CB 3.35Å; V95-A98 PolarHBondContact O-N 2.86Å; V95-F99 HydrophobicContact CG1-CD2 3.63Å; V95-F99 HydrophobicContact CG1-CE2 3.56Å; V95-F99 VanDerWaalsContact O-CD2 3.26Å; V95-F99 WeakPolarHBondContact O-CD2 3.32Å; V95-F99 PolarHBondContact O-N 3.37Å; V95-F146 HydrophobicContact CG1-CD2 4.17Å; V95-F146 HydrophobicContact CG1-CE2 3.95Å
96I96.4Very high94.8Very high0 Ų049 Ų490%026%0.257CS..Hα-helixtrans-53.8-48.7173.6-72.6162.7000111W53 V68 L92 L93 A98 F99 C100 V143 F146W53-I96 HydrophobicContact CE3-CG2 4.26Å; W53-I96 HydrophobicContact CH2-CG2 3.61Å; W53-I96 HydrophobicContact CZ2-CG2 4.38Å; W53-I96 HydrophobicContact CZ3-CG2 3.55Å; V68-I96 HydrophobicContact CG2-CG2 3.92Å; L92-I96 HydrophobicContact CD2-CD1 3.96Å; L92-I96 WeakPolarHBondContact O-CG1 3.28Å; L92-I96 PolarHBondContact O-N 3.25Å; L93-I96 HydrophobicContact CD2-CD1 4.21Å; L93-I96 WeakPolarHBondContact O-CB 3.38Å; L93-I96 PolarHBondContact O-N 3.28Å; I96-A98 VanDerWaalsContact C-N 3.33Å; I96-A98 PolarHBondContact O-N 3.47Å; I96-F99 PolarHBondContact O-N 3.14Å; I96-C100 PolarHBondContact O-N 2.93Å; I96-C100 PolarHBondContact O-SG 3.49Å; I96-V143 HydrophobicContact CG2-CG1 3.77Å; I96-F146 HydrophobicContact CD1-CB 3.87Å; I96-F146 HydrophobicContact CG1-CB 3.58Å
97A95.4Very high94.9Very high4 Ų445.9 Ų45.93%0.03324%0.24CC..Hα-helixtrans-56.2-47.417800000112.2V68 L72 L93 R94 V95 F99 C100 F101V68-A97 HydrophobicContact CG1-CB 3.35Å; L72-A97 HydrophobicContact CD2-CB 3.9Å; L93-A97 PolarHBondContact O-N 3.36Å; R94-A97 WeakPolarHBondContact O-CB 3.18Å; R94-A97 PolarHBondContact O-N 3.49Å; V95-A97 VanDerWaalsContact C-N 3.31Å; V95-A97 PolarHBondContact O-N 2.98Å; A97-F99 PolarHBondContact O-N 3.4Å; A97-C100 WeakPolarHBondContact O-CB 3.27Å; A97-C100 PolarHBondContact O-N 3.34Å; A97-F101 WeakPolarHBondContact O-CD2 3.32Å; A97-F101 PolarHBondContact O-N 3.44Å
98A96Very high94.9Very high50 Ų5045 Ų4541%0.41323%0.23SC..Hα-helixtrans-60.6-43.9178.100000111.8R94 V95 I96 C100 F101 L102R94-A98 PolarHBondContact O-N 3.29Å; V95-A98 WeakPolarHBondContact O-CB 3.35Å; V95-A98 PolarHBondContact O-N 2.86Å; I96-A98 VanDerWaalsContact C-N 3.33Å; I96-A98 PolarHBondContact O-N 3.47Å; A98-C100 PolarHBondContact O-N 3.45Å; A98-F101 PolarHBondContact O-N 2.85Å; A98-L102 WeakPolarHBondContact O-CG 3.26Å; A98-L102 PolarHBondContact O-N 2.76Å
99F96.3Very high94.6Very high66 Ų6642.9 Ų42.929%0.28923%0.226SC..Hα-helixtrans-64.2-37.5175.5-84.4-76.7000112.6V95 I96 A97 L102 G103 Q139 V143 F146V95-F99 HydrophobicContact CG1-CD2 3.63Å; V95-F99 HydrophobicContact CG1-CE2 3.56Å; V95-F99 VanDerWaalsContact O-CD2 3.26Å; V95-F99 WeakPolarHBondContact O-CD2 3.32Å; V95-F99 PolarHBondContact O-N 3.37Å; I96-F99 PolarHBondContact O-N 3.14Å; A97-F99 PolarHBondContact O-N 3.4Å; F99-L102 PolarHBondContact O-N 3.24Å; F99-G103 PolarHBondContact O-N 3.3Å; F99-Q139 HydrophobicContact CD1-CG 4.31Å; F99-V143 HydrophobicContact CB-CG2 3.65Å; F99-F146 HydrophobicContact CD2-CD2 4.39Å; F99-F146 HydrophobicContact CD2-CE2 4.05Å; F99-F146 AromaticContact CE2-CE2 3.74Å; F99-F146 HydrophobicContact CE2-CE2 3.74Å; F99-F146 HydrophobicContact CZ-CE2 4.41Å
100C95.3Very high94.3Very high2 Ų243.1 Ų43.11%0.01423%0.228CC..Hα-helixtrans-64.1-43.6173.6-73.70000112.2L48 I96 A97 A98 G103 I104L48-C100 HydrophobicContact CD1-CB 3.95Å; L48-C100 HydrophobicContact CD2-CB 3.55Å; L48-C100 HydrophobicContact CG-CB 3.76Å; I96-C100 PolarHBondContact O-N 2.93Å; I96-C100 PolarHBondContact O-SG 3.49Å; A97-C100 WeakPolarHBondContact O-CB 3.27Å; A97-C100 PolarHBondContact O-N 3.34Å; A98-C100 PolarHBondContact O-N 3.45Å; C100-G103 PolarHBondContact O-N 2.93Å; C100-I104 WeakPolarHBondContact O-CG1 3.43Å; C100-I104 PolarHBondContact O-N 2.93Å
101F95.9Very high93.9Very high98 Ų9845.2 Ų45.243%0.4324%0.236SC..Hα-helixtrans-61.7-43.6174.2-74.7-63.3000112.1L48 L72 A97 A98 G103 I104 L105L48-F101 HydrophobicContact CD1-CD1 3.67Å; L48-F101 HydrophobicContact CD1-CD2 4.39Å; L48-F101 HydrophobicContact CD1-CE1 3.58Å; L48-F101 HydrophobicContact CD1-CE2 4.31Å; L48-F101 HydrophobicContact CD1-CG 4.08Å; L48-F101 HydrophobicContact CD1-CZ 3.92Å; L72-F101 HydrophobicContact CD2-CE2 3.77Å; L72-F101 HydrophobicContact CD2-CZ 4.23Å; A97-F101 WeakPolarHBondContact O-CD2 3.32Å; A97-F101 PolarHBondContact O-N 3.44Å; A98-F101 PolarHBondContact O-N 2.85Å; F101-G103 VanDerWaalsContact C-N 3.29Å; F101-G103 PolarHBondContact O-N 3.36Å; F101-I104 PolarHBondContact O-N 3.47Å; F101-L105 WeakPolarHBondContact O-CG 3.43Å; F101-L105 PolarHBondContact O-N 2.89Å
102L95.6Very high93.5Very high85 Ų8543.7 Ų43.745%0.44523%0.228SC..Hα-helixtrans-61.3-39174.1-69.7173.5000111.5A98 F99 L105 C106A98-L102 WeakPolarHBondContact O-CG 3.26Å; A98-L102 PolarHBondContact O-N 2.76Å; F99-L102 PolarHBondContact O-N 3.24Å; L102-L105 PolarHBondContact O-N 3.12Å; L102-C106 WeakPolarHBondContact O-CB 3.46Å; L102-C106 PolarHBondContact O-N 3.36Å; L102-C106 PolarHBondContact O-SG 3.44Å
103G94.9Very high92.8Very high2 Ų244.1 Ų44.12%0.02123%0.23CC..Hα-helixtrans-60.9-44.1173.800000113.4F99 C100 F101 C106 S107F99-G103 PolarHBondContact O-N 3.3Å; C100-G103 PolarHBondContact O-N 2.93Å; F101-G103 VanDerWaalsContact C-N 3.29Å; F101-G103 PolarHBondContact O-N 3.36Å; G103-C106 PolarHBondContact O-N 3Å; G103-S107 VanDerWaalsContact O-CB 3.3Å; G103-S107 WeakPolarHBondContact O-CB 3.37Å; G103-S107 PolarHBondContact O-N 2.88Å; G103-S107 PolarHBondContact O-OG 3.46Å; G103-S107 VanDerWaalsContact O-OG 3.08Å
104I96Very high92.1Very high19 Ų1944.1 Ų44.110%0.09723%0.231CC..Hα-helixtrans-62.1-46.3175.1-68.1163.7000110.4L44 L48 C100 F101 C106 S107 L108L44-I104 HydrophobicContact CB-CD1 4.18Å; L44-I104 HydrophobicContact CB-CG1 3.59Å; L44-I104 HydrophobicContact CD1-CG1 4.27Å; L48-I104 HydrophobicContact CD1-CD1 3.43Å; L48-I104 VanDerWaalsContact CD1-CD1 3.43Å; L48-I104 HydrophobicContact CG-CD1 4.44Å; C100-I104 WeakPolarHBondContact O-CG1 3.43Å; C100-I104 PolarHBondContact O-N 2.93Å; F101-I104 PolarHBondContact O-N 3.47Å; I104-C106 PolarHBondContact O-N 3.34Å; I104-S107 PolarHBondContact O-N 3.02Å; I104-L108 HydrophobicContact CG2-CD1 3.71Å; I104-L108 HydrophobicContact CG2-CG 4.19Å; I104-L108 VanDerWaalsContact O-CB 3.28Å; I104-L108 WeakPolarHBondContact O-CB 3.42Å; I104-L108 VanDerWaalsContact O-CG 3.24Å; I104-L108 WeakPolarHBondContact O-CG 3.37Å; I104-L108 PolarHBondContact O-N 3Å
105L95.2Very high91.3Very high112 Ų11240.7 Ų40.759%0.58622%0.223SC*.Hα-helixtrans-62-44.2177.9-68.3173.6000111.8F101 L102 S109F101-L105 WeakPolarHBondContact O-CG 3.43Å; F101-L105 PolarHBondContact O-N 2.89Å; L102-L105 PolarHBondContact O-N 3.12Å; L105-S109 WeakPolarHBondContact O-CB 3.41Å; L105-S109 PolarHBondContact O-N 3.17Å; L105-S109 PolarHBondContact O-OG 2.88Å
106C91.6Very high90.4Very high24 Ų2445.5 Ų45.516%0.16224%0.24CC..Hα-helixtrans-62.1-46.7176.4-670000111L102 G103 I104 S109 A110L102-C106 WeakPolarHBondContact O-CB 3.46Å; L102-C106 PolarHBondContact O-N 3.36Å; L102-C106 PolarHBondContact O-SG 3.44Å; G103-C106 PolarHBondContact O-N 3Å; I104-C106 PolarHBondContact O-N 3.34Å; C106-S109 PolarHBondContact O-N 3.28Å; C106-S109 PolarHBondContact O-OG 2.87Å; C106-A110 PolarHBondContact O-N 3.33Å
107S92.6Very high89Confident0 Ų046.8 Ų46.80%025%0.254CS..Hα-helixtrans-67.4-39.3179.5-68.60000113I41 G103 I104 A110 F111 T136I41-S107 VanDerWaalsContact CG1-CB 3.5Å; G103-S107 VanDerWaalsContact O-CB 3.3Å; G103-S107 WeakPolarHBondContact O-CB 3.37Å; G103-S107 PolarHBondContact O-N 2.88Å; G103-S107 PolarHBondContact O-OG 3.46Å; G103-S107 VanDerWaalsContact O-OG 3.08Å; I104-S107 PolarHBondContact O-N 3.02Å; S107-A110 WeakPolarHBondContact O-CB 3.15Å; S107-A110 PolarHBondContact O-N 2.91Å; S107-F111 WeakPolarHBondContact O-CB 3.21Å; S107-F111 PolarHBondContact O-N 2.8Å; S107-T136 WeakPolarHBondContact OG-CG2 3.3Å; S107-T136 PolarHBondContact OG-OG1 2.84Å
108L92.1Very high87.5Confident68 Ų6848.1 Ų48.136%0.35626%0.262SS..Hα-helixtrans-60.6-46.9172.9-78.6170.8000110.4I41 I104 A110 F111 L112I41-L108 HydrophobicContact CD1-CD2 3.95Å; I41-L108 HydrophobicContact CD1-CG 4.36Å; I41-L108 HydrophobicContact CG1-CD2 4.49Å; I41-L108 HydrophobicContact CG2-CD2 4.05Å; I41-L108 HydrophobicContact CG2-CG 4.32Å; I104-L108 HydrophobicContact CG2-CD1 3.71Å; I104-L108 HydrophobicContact CG2-CG 4.19Å; I104-L108 VanDerWaalsContact O-CB 3.28Å; I104-L108 WeakPolarHBondContact O-CB 3.42Å; I104-L108 VanDerWaalsContact O-CG 3.24Å; I104-L108 WeakPolarHBondContact O-CG 3.37Å; I104-L108 PolarHBondContact O-N 3Å; L108-A110 VanDerWaalsContact C-N 3.31Å; L108-A110 PolarHBondContact O-N 3.08Å; L108-F111 PolarHBondContact O-N 3.15Å; L108-L112 WeakPolarHBondContact O-CB 3.43Å; L108-L112 WeakPolarHBondContact O-CG 3.47Å; L108-L112 PolarHBondContact O-N 3.05Å
109S88Confident85.8Confident53 Ų5355.8 Ų55.837%0.37129%0.286SS..Hα-helixtrans-59.7-42.7176.1760000111.6L105 C106 L112 L113L105-S109 WeakPolarHBondContact O-CB 3.41Å; L105-S109 PolarHBondContact O-N 3.17Å; L105-S109 PolarHBondContact O-OG 2.88Å; C106-S109 PolarHBondContact O-N 3.28Å; C106-S109 PolarHBondContact O-OG 2.87Å; S109-L112 PolarHBondContact O-N 3.38Å; S109-L113 VanDerWaalsContact O-CG 3.23Å; S109-L113 WeakPolarHBondContact O-CG 3.42Å; S109-L113 PolarHBondContact O-N 3.44Å
110A87.3Confident84.5Confident4 Ų459 Ų593%0.03330%0.301CS..Hα-helixtrans-61.5-47176.500000112C106 S107 L108 L112 L113 D114 A132C106-A110 PolarHBondContact O-N 3.33Å; S107-A110 WeakPolarHBondContact O-CB 3.15Å; S107-A110 PolarHBondContact O-N 2.91Å; L108-A110 VanDerWaalsContact C-N 3.31Å; L108-A110 PolarHBondContact O-N 3.08Å; A110-L112 PolarHBondContact O-N 2.96Å; A110-L113 WeakPolarHBondContact O-CB 3.44Å; A110-L113 PolarHBondContact O-N 3.15Å; A110-D114 WeakPolarHBondContact O-CB 3.4Å; A110-D114 PolarHBondContact O-N 2.83Å; A110-A132 HydrophobicContact CB-CB 3.6Å
111F87.1Confident82.8Confident57 Ų5762.8 Ų62.825%0.2533%0.326CS..Hα-helixtrans-62.7-41.2178.2177.9-96.6000112.1A34 A38 I41 S107 L108 D114 V115A34-F111 HydrophobicContact CB-CD2 4.26Å; A34-F111 HydrophobicContact CB-CE2 3.91Å; A34-F111 WeakPolarHBondContact O-CD2 3.33Å; A34-F111 WeakPolarHBondContact O-CE2 3.43Å; A38-F111 HydrophobicContact CB-CD2 4.26Å; A38-F111 HydrophobicContact CB-CE2 3.87Å; I41-F111 HydrophobicContact CD1-CB 3.67Å; I41-F111 HydrophobicContact CD1-CG 4.03Å; S107-F111 WeakPolarHBondContact O-CB 3.21Å; S107-F111 PolarHBondContact O-N 2.8Å; L108-F111 PolarHBondContact O-N 3.15Å; F111-D114 WeakPolarHBondContact O-CB 3.5Å; F111-D114 PolarHBondContact O-N 3.03Å; F111-V115 HydrophobicContact CD1-CG2 4.21Å; F111-V115 HydrophobicContact CD2-CG2 4.4Å; F111-V115 HydrophobicContact CE1-CG2 3.76Å; F111-V115 HydrophobicContact CE2-CG2 3.98Å; F111-V115 HydrophobicContact CZ-CG2 3.64Å; F111-V115 WeakPolarHBondContact O-CG2 3.36Å; F111-V115 PolarHBondContact O-N 3.39Å
112L85Confident81.3Confident84 Ų8461 Ų6144%0.4433%0.329SS..Hα-helixtrans-66.5-38.1176.4-64.6168.8000111.4L108 S109 A110 D114 V115 F116L108-L112 WeakPolarHBondContact O-CB 3.43Å; L108-L112 WeakPolarHBondContact O-CG 3.47Å; L108-L112 PolarHBondContact O-N 3.05Å; S109-L112 PolarHBondContact O-N 3.38Å; A110-L112 PolarHBondContact O-N 2.96Å; L112-D114 VanDerWaalsContact C-N 3.32Å; L112-V115 PolarHBondContact O-N 2.94Å; L112-F116 HydrophobicContact CB-CD2 4.12Å; L112-F116 HydrophobicContact CB-CE2 4.38Å; L112-F116 HydrophobicContact CD2-CD2 4.15Å; L112-F116 HydrophobicContact CD2-CE2 3.55Å; L112-F116 WeakPolarHBondContact O-CB 3.43Å; L112-F116 WeakPolarHBondContact O-CD2 3.34Å; L112-F116 PolarHBondContact O-N 3.28Å
113L81.9Confident79.8Confident21 Ų2160.4 Ų60.411%0.1133%0.326CS..Hα-helixtrans-62.8-40.4172.7-71176.2000111.9S109 A110 G117 P118 L123 T126S109-L113 VanDerWaalsContact O-CG 3.23Å; S109-L113 WeakPolarHBondContact O-CG 3.42Å; S109-L113 PolarHBondContact O-N 3.44Å; A110-L113 WeakPolarHBondContact O-CB 3.44Å; A110-L113 PolarHBondContact O-N 3.15Å; L113-G117 PolarHBondContact O-N 3.46Å; L113-P118 HydrophobicContact CD2-CG 3.54Å; L113-L123 HydrophobicContact CD2-CB 3.85Å; L113-L123 HydrophobicContact CD2-CD2 3.85Å; L113-L123 HydrophobicContact CD2-CG 4.29Å; L113-T126 HydrophobicContact CD1-CG2 3.92Å
114D80.3Confident78.4Confident3 Ų363.1 Ų63.12%0.01634%0.337CS..Hα-helixtrans-65.1-44.8177.3-80.2-21.2000111S30 S33 A110 F111 L112 H133 N194S30-D114 WeakPolarHBondContact OG-CA 3.49Å; S30-D114 WeakPolarHBondContact OG-CB 3.41Å; S30-D114 PolarHBondContact OG-O 3.04Å; S33-D114 PolarHBondContact OG-OD2 3.09Å; A110-D114 WeakPolarHBondContact O-CB 3.4Å; A110-D114 PolarHBondContact O-N 2.83Å; F111-D114 WeakPolarHBondContact O-CB 3.5Å; F111-D114 PolarHBondContact O-N 3.03Å; L112-D114 VanDerWaalsContact C-N 3.32Å; D114-H133 IonicContact OD2-CD2 3.99Å; D114-H133 IonicContact OD2-NE2 3.04Å; D114-H133 PolarHBondContact OD2-NE2 3.38Å; D114-N194 PolarHBondContact OD1-ND2 3.37Å; D114-N194 VanDerWaalsContact OD1-ND2 3.1Å; D114-N194 PolarHBondContact OD1-OD1 2.95Å; D114-N194 PolarHBondContact OD2-ND2 3.33Å
115V78.1Confident77.1Confident51 Ų5166.2 Ų66.231%0.30935%0.353SS..Hα-helixtrans-77.2-45.8-177.4172.10000113.2A34 F111 L112A34-V115 HydrophobicContact CB-CG2 4.4Å; F111-V115 HydrophobicContact CD1-CG2 4.21Å; F111-V115 HydrophobicContact CD2-CG2 4.4Å; F111-V115 HydrophobicContact CE1-CG2 3.76Å; F111-V115 HydrophobicContact CE2-CG2 3.98Å; F111-V115 HydrophobicContact CZ-CG2 3.64Å; F111-V115 WeakPolarHBondContact O-CG2 3.36Å; F111-V115 PolarHBondContact O-N 3.39Å; L112-V115 PolarHBondContact O-N 2.94Å
116F77.6Confident75.8Confident153 Ų15363.1 Ų63.167%0.67134%0.339SS*.Hα-helixtrans-87.4-19.8-171.7-67.4-56.3000114.1L112L112-F116 HydrophobicContact CB-CD2 4.12Å; L112-F116 HydrophobicContact CB-CE2 4.38Å; L112-F116 HydrophobicContact CD2-CD2 4.15Å; L112-F116 HydrophobicContact CD2-CE2 3.55Å; L112-F116 WeakPolarHBondContact O-CB 3.43Å; L112-F116 WeakPolarHBondContact O-CD2 3.34Å; L112-F116 PolarHBondContact O-N 3.28Å
117G67.1Low74.8Confident27 Ų2762.9 Ų62.928%0.27834%0.335SS..  trans48.858.6-178.800000112.7L113L113-G117 PolarHBondContact O-N 3.46Å
118P63.3Low73.7Confident32 Ų3265.1 Ų65.121%0.20834%0.343CS..  trans-58.6142.8-169.721.8-33.3000113.3L113 H120 L123L113-P118 HydrophobicContact CD2-CG 3.54Å; P118-H120 VanDerWaalsContact C-N 3.33Å; P118-H120 PolarHBondContact O-N 2.81Å; P118-L123 HydrophobicContact CB-CB 3.94Å; P118-L123 HydrophobicContact CB-CD1 3.57Å; P118-L123 HydrophobicContact CB-CG 4.42Å; P118-L123 HydrophobicContact CG-CB 3.43Å; P118-L123 VanDerWaalsContact CG-CB 3.43Å; P118-L123 HydrophobicContact CG-CD1 3.79Å; P118-L123 HydrophobicContact CG-CG 4.21Å
119K61.7Low72.8Confident211 Ų21169.6 Ų69.692%0.91736%0.357SS*.SBendtrans-72.5-20.1-177.8-64.3-174.4177.6-175.50114.3
120H67.1Low72.5Confident133 Ų13367.3 Ų67.362%0.61634%0.341SS*.SBendtrans-72.4130.8-174.4-139.3-73.5000110.3P118 A122 L123 K124P118-H120 VanDerWaalsContact C-N 3.33Å; P118-H120 PolarHBondContact O-N 2.81Å; H120-A122 VanDerWaalsContact C-N 3.28Å; H120-A122 PolarHBondContact O-N 3.22Å; H120-L123 HydrophobicContact CB-CD1 4.23Å; H120-L123 HydrophobicContact CB-CG 4.48Å; H120-L123 PolarHBondContact O-N 3.2Å; H120-K124 PolarHBondContact O-N 2.77Å; H120-K124 VanDerWaalsContact O-N 3.13Å
121P60.8Low72.5Confident81 Ų8173 Ų7353%0.52637%0.365SS..Hα-helixtrans-55.7-40.2-173.817.7-32.5000113.2L123 K124 I125P121-L123 VanDerWaalsContact C-N 3.35Å; P121-L123 PolarHBondContact O-N 2.73Å; P121-K124 WeakPolarHBondContact O-CB 3.45Å; P121-K124 PolarHBondContact O-N 3.41Å; P121-K124 VanDerWaalsContact O-N 3.13Å; P121-I125 WeakPolarHBondContact O-CG1 3.35Å; P121-I125 PolarHBondContact O-N 3.17Å
122A64Low72.5Confident60 Ų6070.9 Ų70.950%0.49636%0.358SS..Hα-helixtrans-58-43.2177.600000113.1H120 K124 I125 T126H120-A122 VanDerWaalsContact C-N 3.28Å; H120-A122 PolarHBondContact O-N 3.22Å; A122-K124 VanDerWaalsContact C-N 3.34Å; A122-I125 PolarHBondContact O-N 3.17Å; A122-T126 PolarHBondContact O-N 2.97Å; A122-T126 VanDerWaalsContact O-N 3.15Å; A122-T126 PolarHBondContact O-OG1 3.1Å
123L63.3Low72.8Confident74 Ų7467 Ų6739%0.38734%0.337SS..Hα-helixtrans-74-29.2179.2-61.6170.5000111.6L113 P118 H120 P121 T126 R127L113-L123 HydrophobicContact CD2-CB 3.85Å; L113-L123 HydrophobicContact CD2-CD2 3.85Å; L113-L123 HydrophobicContact CD2-CG 4.29Å; P118-L123 HydrophobicContact CB-CB 3.94Å; P118-L123 HydrophobicContact CB-CD1 3.57Å; P118-L123 HydrophobicContact CB-CG 4.42Å; P118-L123 HydrophobicContact CG-CB 3.43Å; P118-L123 VanDerWaalsContact CG-CB 3.43Å; P118-L123 HydrophobicContact CG-CD1 3.79Å; P118-L123 HydrophobicContact CG-CG 4.21Å; H120-L123 HydrophobicContact CB-CD1 4.23Å; H120-L123 HydrophobicContact CB-CG 4.48Å; H120-L123 PolarHBondContact O-N 3.2Å; P121-L123 VanDerWaalsContact C-N 3.35Å; P121-L123 PolarHBondContact O-N 2.73Å; L123-T126 PolarHBondContact O-N 2.89Å; L123-R127 WeakPolarHBondContact O-CB 3.4Å; L123-R127 PolarHBondContact O-N 3.21Å
124K67.5Low73.3Confident59 Ų5969.4 Ų69.426%0.25735%0.349SS..Hα-helixtrans-64.2-41.5173.4-154.2178.6-178.5-173.40111H120 P121 A122 R127 R128 E205H120-K124 PolarHBondContact O-N 2.77Å; H120-K124 VanDerWaalsContact O-N 3.13Å; P121-K124 WeakPolarHBondContact O-CB 3.45Å; P121-K124 PolarHBondContact O-N 3.41Å; P121-K124 VanDerWaalsContact O-N 3.13Å; A122-K124 VanDerWaalsContact C-N 3.34Å; K124-R127 PolarHBondContact O-N 2.88Å; K124-R128 PolarHBondContact O-N 2.83Å; K124-E205 WeakPolarHBondContact CE-OE1 3.28Å; K124-E205 IonicContact NZ-OE1 3Å; K124-E205 PolarHBondContact NZ-OE1 3.4Å; K124-E205 IonicContact NZ-OE2 3.87Å; K124-E205 PolarHBondContact NZ-OE2 3.03Å
125I67.9Low73.9Confident83 Ų8372 Ų7243%0.42636%0.363SS..Hα-helixtrans-62.3-49173.5-68165.8000110.8P121 A122 R127 R128 Y129P121-I125 WeakPolarHBondContact O-CG1 3.35Å; P121-I125 PolarHBondContact O-N 3.17Å; A122-I125 PolarHBondContact O-N 3.17Å; I125-R127 VanDerWaalsContact C-N 3.25Å; I125-R127 PolarHBondContact O-N 2.92Å; I125-R128 PolarHBondContact O-N 2.98Å; I125-R128 VanDerWaalsContact O-N 3.11Å; I125-Y129 HydrophobicContact CG2-CD2 3.78Å; I125-Y129 HydrophobicContact CG2-CE2 3.8Å; I125-Y129 VanDerWaalsContact O-CD2 3.31Å; I125-Y129 WeakPolarHBondContact O-CD2 3.46Å; I125-Y129 PolarHBondContact O-N 3.34Å; I125-Y129 VanDerWaalsContact O-N 3.15Å
126T68.4Low74.7Confident48 Ų4869.6 Ų69.629%0.29435%0.348SS..Hα-helixtrans-59-38.8179-44.90000111.9L113 A122 L123 A130 F131L113-T126 HydrophobicContact CD1-CG2 3.92Å; A122-T126 PolarHBondContact O-N 2.97Å; A122-T126 VanDerWaalsContact O-N 3.15Å; A122-T126 PolarHBondContact O-OG1 3.1Å; L123-T126 PolarHBondContact O-N 2.89Å; T126-A130 PolarHBondContact O-N 2.88Å; T126-F131 HydrophobicContact CG2-CB 4.37Å
127R69.9Low75.6Confident18 Ų1864 Ų647%0.06833%0.326CS..Hα-helixtrans-65.7-43.9174.9-169.1179.373.6160.15.5111.9E28 L123 K124 I125 Y129 A130E28-R127 IonicContact OE2-NH2 2.64Å; L123-R127 WeakPolarHBondContact O-CB 3.4Å; L123-R127 PolarHBondContact O-N 3.21Å; K124-R127 PolarHBondContact O-N 2.88Å; I125-R127 VanDerWaalsContact C-N 3.25Å; I125-R127 PolarHBondContact O-N 2.92Å; R127-Y129 VanDerWaalsContact C-N 3.34Å; R127-Y129 PolarHBondContact O-N 2.95Å; R127-A130 PolarHBondContact O-N 3.32Å
128R68.8Low77.1Confident48 Ų4867.6 Ų67.618%0.18134%0.339CS..Hα-helixtrans-60.3-39.9-179.9-83.1-176179.3-1751.3112.8K124 I125 Y199 P200 E205K124-R128 PolarHBondContact O-N 2.83Å; I125-R128 PolarHBondContact O-N 2.98Å; I125-R128 VanDerWaalsContact O-N 3.11Å; R128-Y199 HydrophobicContact CG-CD1 4.28Å; R128-Y199 HydrophobicContact CG-CD2 4.06Å; R128-Y199 HydrophobicContact CG-CE2 4.47Å; R128-Y199 HydrophobicContact CG-CG 3.94Å; R128-P200 PolarHBondContact NH2-O 3.06Å; R128-E205 IonicContact NH2-OE1 3.53Å; R128-E205 PolarHBondContact NH2-OE1 3.11Å; R128-E205 IonicContact NH2-OE2 2.72Å
129Y73.4Confident78.6Confident162 Ų16267.1 Ų67.164%0.63533%0.334SS*.THydrogen-bonded Turntrans-88.4-0.9-178.5-68.5-69.2000114.7I125 R127 F131 I134I125-Y129 HydrophobicContact CG2-CD2 3.78Å; I125-Y129 HydrophobicContact CG2-CE2 3.8Å; I125-Y129 VanDerWaalsContact O-CD2 3.31Å; I125-Y129 WeakPolarHBondContact O-CD2 3.46Å; I125-Y129 PolarHBondContact O-N 3.34Å; I125-Y129 VanDerWaalsContact O-N 3.15Å; R127-Y129 VanDerWaalsContact C-N 3.34Å; R127-Y129 PolarHBondContact O-N 2.95Å; Y129-F131 PolarHBondContact O-N 3.5Å; Y129-I134 WeakPolarHBondContact O-CD1 3.44Å
130A83Confident80.3Confident4 Ų457.3 Ų57.33%0.03329%0.292CS..THydrogen-bonded Turntrans49.330-174.600000113.4T126 R127 A132 H133 I134 T191 N194T126-A130 PolarHBondContact O-N 2.88Å; R127-A130 PolarHBondContact O-N 3.32Å; A130-A132 VanDerWaalsContact C-N 3.27Å; A130-A132 PolarHBondContact O-N 2.84Å; A130-H133 PolarHBondContact O-N 3.04Å; A130-I134 WeakPolarHBondContact O-CG1 3.4Å; A130-I134 PolarHBondContact O-N 2.96Å; A130-T191 HydrophobicContact CB-CG2 3.97Å; A130-N194 HydrophobicContact CB-CB 3.98Å
131F86Confident81.8Confident125 Ų12553.8 Ų53.855%0.54829%0.286SS..Hα-helixtrans-58-39.5-167.9-179.7-99.1000112.5T126 Y129 I134 L135T126-F131 HydrophobicContact CG2-CB 4.37Å; Y129-F131 PolarHBondContact O-N 3.5Å; F131-I134 PolarHBondContact O-N 3.34Å; F131-L135 HydrophobicContact CE1-CD2 4.49Å; F131-L135 WeakPolarHBondContact O-CB 3.32Å; F131-L135 PolarHBondContact O-N 3.27Å
132A88.1Confident83.5Confident11 Ų1152.5 Ų52.59%0.09128%0.277CS..Hα-helixtrans-68-35.4-18000000113.1A110 A130 T136A110-A132 HydrophobicContact CB-CB 3.6Å; A130-A132 VanDerWaalsContact C-N 3.27Å; A130-A132 PolarHBondContact O-N 2.84Å; A132-T136 PolarHBondContact O-N 3.27Å; A132-T136 PolarHBondContact O-OG1 3.25Å
133H90.9Very high85.1Confident3 Ų349.8 Ų49.81%0.01425%0.254CS..Hα-helixtrans-70.5-41.4173.5-72.6-60.8000110.9D114 A130 L135 T136 V137 T191D114-H133 IonicContact OD2-CD2 3.99Å; D114-H133 IonicContact OD2-NE2 3.04Å; D114-H133 PolarHBondContact OD2-NE2 3.38Å; A130-H133 PolarHBondContact O-N 3.04Å; H133-L135 VanDerWaalsContact C-N 3.34Å; H133-L135 PolarHBondContact O-N 2.95Å; H133-T136 WeakPolarHBondContact O-CB 3.48Å; H133-T136 PolarHBondContact O-N 3.39Å; H133-T136 VanDerWaalsContact O-N 3.15Å; H133-V137 WeakPolarHBondContact O-CG2 3.48Å; H133-V137 PolarHBondContact O-N 3.32Å; H133-T191 WeakPolarHBondContact CB-OG1 3.08Å
134I92.6Very high86.7Confident71 Ų7148.8 Ų48.836%0.36425%0.248SC..Hα-helixtrans-59.2-46174.5-63.7169.4000110.7Y129 A130 F131 T136 V137 L138 T191Y129-I134 WeakPolarHBondContact O-CD1 3.44Å; A130-I134 WeakPolarHBondContact O-CG1 3.4Å; A130-I134 PolarHBondContact O-N 2.96Å; F131-I134 PolarHBondContact O-N 3.34Å; I134-T136 VanDerWaalsContact C-N 3.28Å; I134-T136 PolarHBondContact O-N 3.21Å; I134-V137 WeakPolarHBondContact O-CB 3.37Å; I134-V137 PolarHBondContact O-N 2.91Å; I134-V137 VanDerWaalsContact O-N 3.16Å; I134-L138 WeakPolarHBondContact O-CG 3.33Å; I134-L138 PolarHBondContact O-N 3.18Å; I134-T191 HydrophobicContact CD1-CG2 4.35Å; I134-T191 HydrophobicContact CG1-CG2 3.84Å
135L93.2Very high88.1Confident58 Ų5847.9 Ų47.930%0.30426%0.255SS..Hα-helixtrans-61-39.3176.9-174.262.9000111.7F131 H133 L138 Q139F131-L135 HydrophobicContact CE1-CD2 4.49Å; F131-L135 WeakPolarHBondContact O-CB 3.32Å; F131-L135 PolarHBondContact O-N 3.27Å; H133-L135 VanDerWaalsContact C-N 3.34Å; H133-L135 PolarHBondContact O-N 2.95Å; L135-L138 PolarHBondContact O-N 3.49Å; L135-Q139 WeakPolarHBondContact O-CG 3.39Å; L135-Q139 PolarHBondContact O-N 3.39Å
136T95.1Very high89.5Confident0 Ų046.6 Ų46.60%025%0.247CC..Hα-helixtrans-62.2-42.3175.1-57.90000111.3L44 S107 A132 H133 I134 L138 Q139 C140 S187L44-T136 HydrophobicContact CD1-CG2 4.26Å; S107-T136 WeakPolarHBondContact OG-CG2 3.3Å; S107-T136 PolarHBondContact OG-OG1 2.84Å; A132-T136 PolarHBondContact O-N 3.27Å; A132-T136 PolarHBondContact O-OG1 3.25Å; H133-T136 WeakPolarHBondContact O-CB 3.48Å; H133-T136 PolarHBondContact O-N 3.39Å; H133-T136 VanDerWaalsContact O-N 3.15Å; I134-T136 VanDerWaalsContact C-N 3.28Å; I134-T136 PolarHBondContact O-N 3.21Å; T136-L138 PolarHBondContact O-N 2.9Å; T136-Q139 PolarHBondContact O-N 3.32Å; T136-C140 PolarHBondContact O-N 3.46Å; T136-C140 PolarHBondContact O-SG 3.19Å; T136-S187 WeakPolarHBondContact CG2-OG 3.47Å
137V96.7Very high90.8Very high35 Ų3544.6 Ų44.621%0.21224%0.235CC..Hα-helixtrans-61.4-45.1176.3175.10000111H133 I134 Q139 C140 A141 I188H133-V137 WeakPolarHBondContact O-CG2 3.48Å; H133-V137 PolarHBondContact O-N 3.32Å; I134-V137 WeakPolarHBondContact O-CB 3.37Å; I134-V137 PolarHBondContact O-N 2.91Å; I134-V137 VanDerWaalsContact O-N 3.16Å; V137-Q139 VanDerWaalsContact C-N 3.33Å; V137-Q139 PolarHBondContact O-N 3.03Å; V137-C140 PolarHBondContact O-N 2.95Å; V137-A141 PolarHBondContact O-N 3.46Å; V137-I188 HydrophobicContact CB-CG1 4.47Å; V137-I188 HydrophobicContact CG1-CD1 4.17Å; V137-I188 HydrophobicContact CG1-CG1 3.95Å; V137-I188 HydrophobicContact CG2-CG1 3.61Å
138L96.5Very high92.1Very high104 Ų10449.9 Ų49.955%0.54526%0.256SS..Hα-helixtrans-60.8-43.2176-66.8176.1000111.3I134 L135 T136 A141 T142I134-L138 WeakPolarHBondContact O-CG 3.33Å; I134-L138 PolarHBondContact O-N 3.18Å; L135-L138 PolarHBondContact O-N 3.49Å; T136-L138 PolarHBondContact O-N 2.9Å; L138-A141 PolarHBondContact O-N 2.85Å; L138-T142 WeakPolarHBondContact O-CG2 3.46Å; L138-T142 PolarHBondContact O-N 3.49Å; L138-T142 PolarHBondContact O-OG1 3.47Å
139Q95.9Very high93.4Very high21 Ų2153.7 Ų53.710%0.09827%0.27CS..Hα-helixtrans-63.4-43.5176.4-73.5172.2-2000111.8F99 L135 T136 V137 A141 T142 V143F99-Q139 HydrophobicContact CD1-CG 4.31Å; L135-Q139 WeakPolarHBondContact O-CG 3.39Å; L135-Q139 PolarHBondContact O-N 3.39Å; T136-Q139 PolarHBondContact O-N 3.32Å; V137-Q139 VanDerWaalsContact C-N 3.33Å; V137-Q139 PolarHBondContact O-N 3.03Å; Q139-A141 VanDerWaalsContact C-N 3.32Å; Q139-A141 PolarHBondContact O-N 3.16Å; Q139-T142 WeakPolarHBondContact CA-OG1 3.3Å; Q139-T142 PolarHBondContact O-N 3.29Å; Q139-T142 PolarHBondContact O-OG1 3.48Å; Q139-V143 WeakPolarHBondContact O-CG2 3.49Å; Q139-V143 PolarHBondContact O-N 3.5Å
140C97.4Very high94.5Very high5 Ų546 Ų463%0.03424%0.24CC..Hα-helixtrans-59-43.8174.8-66.60000111.3T136 V137 T142 V143 I144 V180T136-C140 PolarHBondContact O-N 3.46Å; T136-C140 PolarHBondContact O-SG 3.19Å; V137-C140 PolarHBondContact O-N 2.95Å; C140-T142 PolarHBondContact O-N 3.46Å; C140-V143 PolarHBondContact O-N 3.46Å; C140-I144 VanDerWaalsContact O-CG1 3.27Å; C140-I144 WeakPolarHBondContact O-CG1 3.38Å; C140-I144 PolarHBondContact O-N 2.91Å; C140-V180 HydrophobicContact CB-CG1 4.04Å
141A97.9Very high95Very high59 Ų5946.3 Ų46.349%0.48824%0.242SC..Hα-helixtrans-61.7-42.4175.800000112.1V137 L138 Q139 I144 G145V137-A141 PolarHBondContact O-N 3.46Å; L138-A141 PolarHBondContact O-N 2.85Å; Q139-A141 VanDerWaalsContact C-N 3.32Å; Q139-A141 PolarHBondContact O-N 3.16Å; A141-I144 PolarHBondContact O-N 3.03Å; A141-G145 PolarHBondContact O-N 3.36Å
142T97.1Very high95.5Very high55 Ų5544.1 Ų44.134%0.33723%0.233SC..Hα-helixtrans-64.7-40.6175.559.40000112.5L138 Q139 C140 G145 F146L138-T142 WeakPolarHBondContact O-CG2 3.46Å; L138-T142 PolarHBondContact O-N 3.49Å; L138-T142 PolarHBondContact O-OG1 3.47Å; Q139-T142 WeakPolarHBondContact CA-OG1 3.3Å; Q139-T142 PolarHBondContact O-N 3.29Å; Q139-T142 PolarHBondContact O-OG1 3.48Å; C140-T142 PolarHBondContact O-N 3.46Å; T142-G145 PolarHBondContact O-N 3.46Å; T142-F146 WeakPolarHBondContact O-CB 3.34Å; T142-F146 VanDerWaalsContact O-CD2 3.3Å; T142-F146 WeakPolarHBondContact O-CD2 3.49Å; T142-F146 WeakPolarHBondContact O-CG 3.44Å; T142-F146 PolarHBondContact O-N 3.33Å
143V97.7Very high95.8Very high3 Ų345 Ų452%0.01824%0.236CC..Hα-helixtrans-62.8-43.1176.1167.60000110.9W53 I96 F99 Q139 C140 F146 S147 V180W53-V143 HydrophobicContact CH2-CG1 3.97Å; W53-V143 HydrophobicContact CZ3-CG1 3.79Å; I96-V143 HydrophobicContact CG2-CG1 3.77Å; F99-V143 HydrophobicContact CB-CG2 3.65Å; Q139-V143 WeakPolarHBondContact O-CG2 3.49Å; Q139-V143 PolarHBondContact O-N 3.5Å; C140-V143 PolarHBondContact O-N 3.46Å; V143-F146 PolarHBondContact O-N 3.49Å; V143-S147 VanDerWaalsContact O-CB 3.32Å; V143-S147 WeakPolarHBondContact O-CB 3.25Å; V143-S147 PolarHBondContact O-N 3.49Å; V143-S147 PolarHBondContact O-OG 2.8Å; V143-V180 HydrophobicContact CB-CG1 4.12Å; V143-V180 HydrophobicContact CG1-CB 4.49Å; V143-V180 HydrophobicContact CG1-CG1 3.82Å; V143-V180 HydrophobicContact CG1-CG2 4.17Å
144I96.7Very high95.9Very high53 Ų5344.8 Ų44.827%0.27224%0.236SC..Hα-helixtrans-61.2-47.2175.4-71.7165.8000110.4C140 A141 F146 S147 Y148 F177 V180 A181C140-I144 VanDerWaalsContact O-CG1 3.27Å; C140-I144 WeakPolarHBondContact O-CG1 3.38Å; C140-I144 PolarHBondContact O-N 2.91Å; A141-I144 PolarHBondContact O-N 3.03Å; I144-F146 PolarHBondContact O-N 3.32Å; I144-S147 WeakPolarHBondContact O-CB 3.4Å; I144-S147 PolarHBondContact O-N 2.82Å; I144-Y148 PolarHBondContact O-N 3.38Å; I144-F177 HydrophobicContact CB-CE2 4.29Å; I144-F177 HydrophobicContact CG1-CE2 4.25Å; I144-F177 HydrophobicContact CG2-CE2 3.77Å; I144-F177 HydrophobicContact CG2-CZ 3.9Å; I144-V180 HydrophobicContact CG1-CG1 4.32Å; I144-A181 HydrophobicContact CD1-CB 4.05Å
145G97.5Very high95.9Very high39 Ų3943.1 Ų43.140%0.40223%0.227SC..Hα-helixtrans-61.2-43.9177.900000112.8A141 T142 Y148 W149A141-G145 PolarHBondContact O-N 3.36Å; T142-G145 PolarHBondContact O-N 3.46Å; G145-Y148 PolarHBondContact O-N 2.83Å; G145-W149 PolarHBondContact O-N 3.05Å
146F97Very high95.8Very high56 Ų5642.5 Ų42.525%0.24623%0.231CC..Hα-helixtrans-66.1-37.8174.2-72-33.1000112.3L92 V95 I96 F99 T142 V143 I144 Y148 W149 A150L92-F146 HydrophobicContact CD2-CB 3.63Å; L92-F146 HydrophobicContact CD2-CD1 4.4Å; L92-F146 HydrophobicContact CD2-CG 4.28Å; L92-F146 WeakPolarHBondContact CD2-O 3.46Å; V95-F146 HydrophobicContact CG1-CD2 4.17Å; V95-F146 HydrophobicContact CG1-CE2 3.95Å; I96-F146 HydrophobicContact CD1-CB 3.87Å; I96-F146 HydrophobicContact CG1-CB 3.58Å; F99-F146 HydrophobicContact CD2-CD2 4.39Å; F99-F146 HydrophobicContact CD2-CE2 4.05Å; F99-F146 AromaticContact CE2-CE2 3.74Å; F99-F146 HydrophobicContact CE2-CE2 3.74Å; F99-F146 HydrophobicContact CZ-CE2 4.41Å; T142-F146 WeakPolarHBondContact O-CB 3.34Å; T142-F146 VanDerWaalsContact O-CD2 3.3Å; T142-F146 WeakPolarHBondContact O-CD2 3.49Å; T142-F146 WeakPolarHBondContact O-CG 3.44Å; T142-F146 PolarHBondContact O-N 3.33Å; V143-F146 PolarHBondContact O-N 3.49Å; I144-F146 PolarHBondContact O-N 3.32Å; F146-Y148 VanDerWaalsContact C-N 3.32Å; F146-Y148 PolarHBondContact O-N 3.33Å; F146-W149 HydrophobicContact CD1-CE3 4.06Å; F146-W149 HydrophobicContact CE1-CE3 4.3Å; F146-W149 HydrophobicContact CE1-CZ3 4.39Å; F146-W149 WeakPolarHBondContact O-CB 3.41Å; F146-W149 PolarHBondContact O-N 2.92Å; F146-W149 VanDerWaalsContact O-N 3.16Å; F146-A150 PolarHBondContact O-N 3.27Å
147S95.6Very high95.6Very high6 Ų643.5 Ų43.54%0.04224%0.235CC..Hα-helixtrans-63.1-41.2176.3-58.80000111.3V143 I144 A150 S151V143-S147 VanDerWaalsContact O-CB 3.32Å; V143-S147 WeakPolarHBondContact O-CB 3.25Å; V143-S147 PolarHBondContact O-N 3.49Å; V143-S147 PolarHBondContact O-OG 2.8Å; I144-S147 WeakPolarHBondContact O-CB 3.4Å; I144-S147 PolarHBondContact O-N 2.82Å; S147-A150 PolarHBondContact O-N 3.07Å; S147-S151 PolarHBondContact O-N 2.95Å
148Y96.7Very high95.2Very high129 Ų12941.8 Ų41.851%0.50623%0.225SC..Hα-helixtrans-60.3-46.9172177.4-103.2000111.2I144 G145 F146 A150 S151 E152 F173I144-Y148 PolarHBondContact O-N 3.38Å; G145-Y148 PolarHBondContact O-N 2.83Å; F146-Y148 VanDerWaalsContact C-N 3.32Å; F146-Y148 PolarHBondContact O-N 3.33Å; Y148-A150 PolarHBondContact O-N 3.29Å; Y148-S151 WeakPolarHBondContact O-CB 3.38Å; Y148-S151 PolarHBondContact O-N 3.42Å; Y148-S151 VanDerWaalsContact O-N 3.11Å; Y148-S151 PolarHBondContact O-OG 3.19Å; Y148-E152 HydrophobicContact CE1-CG 4.01Å; Y148-E152 HydrophobicContact CE2-CG 4.18Å; Y148-E152 VanDerWaalsContact CZ-OE1 3.32Å; Y148-E152 PolarHBondContact O-N 2.97Å; Y148-E152 VanDerWaalsContact O-N 3.12Å; Y148-E152 PolarHBondContact OH-OE1 3.17Å; Y148-F173 HydrophobicContact CD2-CZ 4.03Å
149W97.1Very high94.8Very high129 Ų12941.7 Ų41.749%0.48922%0.221SC..Hα-helixtrans-60.1-44.7177.2-168.25.7000112.4L92 G145 F146 S151 E152 L153L92-W149 HydrophobicContact CD1-CB 4.31Å; L92-W149 HydrophobicContact CD1-CD2 3.69Å; L92-W149 HydrophobicContact CD1-CE3 3.87Å; L92-W149 HydrophobicContact CD1-CG 3.92Å; L92-W149 HydrophobicContact CD1-CZ3 4.44Å; G145-W149 PolarHBondContact O-N 3.05Å; F146-W149 HydrophobicContact CD1-CE3 4.06Å; F146-W149 HydrophobicContact CE1-CE3 4.3Å; F146-W149 HydrophobicContact CE1-CZ3 4.39Å; F146-W149 WeakPolarHBondContact O-CB 3.41Å; F146-W149 PolarHBondContact O-N 2.92Å; F146-W149 VanDerWaalsContact O-N 3.16Å; W149-S151 VanDerWaalsContact C-N 3.29Å; W149-S151 PolarHBondContact O-N 3.06Å; W149-E152 PolarHBondContact O-N 3.18Å; W149-L153 HydrophobicContact CG-CD1 4.21Å; W149-L153 WeakPolarHBondContact O-CD1 3.26Å; W149-L153 PolarHBondContact O-N 2.89Å; W149-L153 VanDerWaalsContact O-N 3.14Å
150A95.5Very high94.5Very high0 Ų048.2 Ų48.20%025%0.252CS..Hα-helixtrans-57.8-41.4174.300000112.2L54 T89 L92 F146 S147 Y148 E152 L153 I154L54-A150 HydrophobicContact CD1-CB 4.25Å; T89-A150 HydrophobicContact CG2-CB 4.29Å; L92-A150 HydrophobicContact CD2-CB 3.98Å; F146-A150 PolarHBondContact O-N 3.27Å; S147-A150 PolarHBondContact O-N 3.07Å; Y148-A150 PolarHBondContact O-N 3.29Å; A150-E152 PolarHBondContact O-N 3.38Å; A150-L153 PolarHBondContact O-N 3.39Å; A150-I154 WeakPolarHBondContact O-CG1 3.27Å; A150-I154 PolarHBondContact O-N 3.11Å
151S94.6Very high93.9Very high10 Ų1051.3 Ų51.37%0.0727%0.266CS..Hα-helixtrans-63.4-40.9-179.777.10000112.4S147 Y148 W149 I154 L155S147-S151 PolarHBondContact O-N 2.95Å; Y148-S151 WeakPolarHBondContact O-CB 3.38Å; Y148-S151 PolarHBondContact O-N 3.42Å; Y148-S151 VanDerWaalsContact O-N 3.11Å; Y148-S151 PolarHBondContact O-OG 3.19Å; W149-S151 VanDerWaalsContact C-N 3.29Å; W149-S151 PolarHBondContact O-N 3.06Å; S151-I154 PolarHBondContact O-N 3Å; S151-L155 WeakPolarHBondContact O-CB 3.4Å; S151-L155 PolarHBondContact O-N 3.32Å
152E95.6Very high93.1Very high79 Ų7953.1 Ų53.137%0.36926%0.263SS..Hα-helixtrans-66.3-39.3176.6-70.7-65.5159.500111.5Y148 W149 A150 L155 A156Y148-E152 HydrophobicContact CE1-CG 4.01Å; Y148-E152 HydrophobicContact CE2-CG 4.18Å; Y148-E152 VanDerWaalsContact CZ-OE1 3.32Å; Y148-E152 PolarHBondContact O-N 2.97Å; Y148-E152 VanDerWaalsContact O-N 3.12Å; Y148-E152 PolarHBondContact OH-OE1 3.17Å; W149-E152 PolarHBondContact O-N 3.18Å; A150-E152 PolarHBondContact O-N 3.38Å; E152-L155 PolarHBondContact O-N 2.92Å; E152-A156 WeakPolarHBondContact O-CB 3.35Å; E152-A156 PolarHBondContact O-N 2.7Å
153L94.2Very high92.2Very high29 Ų2956.5 Ų56.515%0.15227%0.273CS..Hα-helixtrans-62.5-46.2175.4-94.176.8000112.2Q88 W149 A150 L155 A156 Q157Q88-L153 HydrophobicContact CB-CD2 3.94Å; Q88-L153 HydrophobicContact CG-CD2 3.65Å; W149-L153 HydrophobicContact CG-CD1 4.21Å; W149-L153 WeakPolarHBondContact O-CD1 3.26Å; W149-L153 PolarHBondContact O-N 2.89Å; W149-L153 VanDerWaalsContact O-N 3.14Å; A150-L153 PolarHBondContact O-N 3.39Å; L153-L155 VanDerWaalsContact C-N 3.35Å; L153-A156 PolarHBondContact O-N 3.37Å; L153-Q157 WeakPolarHBondContact O-CB 3.2Å; L153-Q157 PolarHBondContact O-N 3.4Å
154I92.7Very high91.4Very high0 Ų063.8 Ų63.80%030%0.301CS..Hα-helixtrans-64.4-43.9178.5-70.2163000110L54 I56 L66 T89 A150 S151 A156 Q157 Q158 V171L54-I154 HydrophobicContact CD1-CD1 3.47Å; L54-I154 VanDerWaalsContact CD1-CD1 3.47Å; I56-I154 HydrophobicContact CD1-CG2 3.52Å; I56-I154 HydrophobicContact CG1-CG2 3.93Å; L66-I154 HydrophobicContact CD1-CD1 4.31Å; T89-I154 HydrophobicContact CG2-CD1 3.66Å; T89-I154 HydrophobicContact CG2-CG1 3.63Å; A150-I154 WeakPolarHBondContact O-CG1 3.27Å; A150-I154 PolarHBondContact O-N 3.11Å; S151-I154 PolarHBondContact O-N 3Å; I154-A156 PolarHBondContact O-N 2.93Å; I154-Q157 PolarHBondContact O-N 2.87Å; I154-Q158 HydrophobicContact CG2-CG 4.28Å; I154-Q158 WeakPolarHBondContact O-CB 3.48Å; I154-Q158 WeakPolarHBondContact O-CG 3.22Å; I154-Q158 PolarHBondContact O-N 3.46Å; I154-V171 HydrophobicContact CB-CG2 4.46Å; I154-V171 HydrophobicContact CG2-CG2 3.88Å
155L92.7Very high90.5Very high35 Ų3571.1 Ų71.118%0.18333%0.334CS..Hα-helixtrans-60.4-47.8178-178.462.8000111.1S151 E152 L153 Q157 Q158 Q159 V169 V171S151-L155 WeakPolarHBondContact O-CB 3.4Å; S151-L155 PolarHBondContact O-N 3.32Å; E152-L155 PolarHBondContact O-N 2.92Å; L153-L155 VanDerWaalsContact C-N 3.35Å; L155-Q157 VanDerWaalsContact C-N 3.3Å; L155-Q157 PolarHBondContact O-N 2.94Å; L155-Q158 PolarHBondContact O-N 3Å; L155-Q159 HydrophobicContact CD1-CG 4.29Å; L155-Q159 HydrophobicContact CG-CG 4.43Å; L155-Q159 WeakPolarHBondContact O-CB 3.47Å; L155-Q159 VanDerWaalsContact O-CG 3.26Å; L155-Q159 WeakPolarHBondContact O-CG 3.46Å; L155-Q159 PolarHBondContact O-N 3.39Å; L155-V169 HydrophobicContact CD1-CG1 4.28Å; L155-V171 HydrophobicContact CB-CG2 4.07Å; L155-V171 HydrophobicContact CD1-CG2 4.3Å
156A92.3Very high89.6Confident46 Ų4672.8 Ų72.838%0.3835%0.351SS..Hα-helixtrans-58.7-42.4177.700000111.8E152 L153 I154 Q159 Q160E152-A156 WeakPolarHBondContact O-CB 3.35Å; E152-A156 PolarHBondContact O-N 2.7Å; L153-A156 PolarHBondContact O-N 3.37Å; I154-A156 PolarHBondContact O-N 2.93Å; A156-Q159 PolarHBondContact O-N 3.49Å; A156-Q160 WeakPolarHBondContact O-CG 3.2Å; A156-Q160 PolarHBondContact O-N 3.17Å
157Q90Very high89Confident20 Ų2072 Ų729%0.09335%0.352CS..Hα-helixtrans-65.5-45.7177.2-174.1173.22.200112.2F83 M85 N86 L153 I154 L155 Q159 Q160 H161F83-Q157 HydrophobicContact CB-CG 4.42Å; F83-Q157 VanDerWaalsContact O-CD 3.25Å; F83-Q157 PolarHBondContact O-NE2 3.37Å; F83-Q157 VanDerWaalsContact O-NE2 3.17Å; M85-Q157 PolarHBondContact O-NE2 3.28Å; M85-Q157 VanDerWaalsContact O-NE2 3.15Å; N86-Q157 VanDerWaalsContact CB-OE1 3.31Å; L153-Q157 WeakPolarHBondContact O-CB 3.2Å; L153-Q157 PolarHBondContact O-N 3.4Å; I154-Q157 PolarHBondContact O-N 2.87Å; L155-Q157 VanDerWaalsContact C-N 3.3Å; L155-Q157 PolarHBondContact O-N 2.94Å; Q157-Q159 VanDerWaalsContact C-N 3.29Å; Q157-Q159 PolarHBondContact O-N 3.28Å; Q157-Q160 PolarHBondContact O-N 3.36Å; Q157-H161 PolarHBondContact O-N 3.04Å; Q157-H161 VanDerWaalsContact O-N 3.08Å
158Q89.4Confident88.5Confident0 Ų079.4 Ų79.40%039%0.386CS..Hα-helixtrans-70.2-26.7179.2-68.4-67.7-47.400112.5I56 F83 I154 L155 H161 K162 V169I56-Q158 HydrophobicContact CG2-CG 4.33Å; F83-Q158 PolarHBondContact O-NE2 3.03Å; I154-Q158 HydrophobicContact CG2-CG 4.28Å; I154-Q158 WeakPolarHBondContact O-CB 3.48Å; I154-Q158 WeakPolarHBondContact O-CG 3.22Å; I154-Q158 PolarHBondContact O-N 3.46Å; L155-Q158 PolarHBondContact O-N 3Å; Q158-H161 CarbonylContact O-C 3.38Å; Q158-H161 PolarHBondContact O-N 3.17Å; Q158-K162 PolarHBondContact O-N 3.38Å; Q158-V169 HydrophobicContact CB-CG1 3.49Å; Q158-V169 VanDerWaalsContact CB-CG1 3.49Å; Q158-V169 HydrophobicContact CG-CG1 4.45Å
159Q88.6Confident88.2Confident101 Ų10174 Ų7447%0.47237%0.367SS..Hα-helixtrans-69.5-31.6171.4-77.1-179.10.500113L155 A156 Q157 K162L155-Q159 HydrophobicContact CD1-CG 4.29Å; L155-Q159 HydrophobicContact CG-CG 4.43Å; L155-Q159 WeakPolarHBondContact O-CB 3.47Å; L155-Q159 VanDerWaalsContact O-CG 3.26Å; L155-Q159 WeakPolarHBondContact O-CG 3.46Å; L155-Q159 PolarHBondContact O-N 3.39Å; A156-Q159 PolarHBondContact O-N 3.49Å; Q157-Q159 VanDerWaalsContact C-N 3.29Å; Q157-Q159 PolarHBondContact O-N 3.28Å; Q159-K162 WeakPolarHBondContact O-CE 3.31Å; Q159-K162 WeakPolarHBondContact O-CG 3.2Å
160Q87.6Confident87.9Confident159 Ų15973.4 Ų73.474%0.74337%0.365SS*.Hα-helixtrans-73.7-36.8173.3-70.7177.1-8.700111.6A156 Q157A156-Q160 WeakPolarHBondContact O-CG 3.2Å; A156-Q160 PolarHBondContact O-N 3.17Å; Q157-Q160 PolarHBondContact O-N 3.36Å
161H85.3Confident87.8Confident69 Ų6974.6 Ų74.632%0.31937%0.372SS..SBendtrans-108.555.8-177.1-66.5-85.6000112.7T60 F83 Q157 Q158T60-H161 WeakPolarHBondContact CG2-O 3.35Å; T60-H161 PolarHBondContact OG1-O 2.72Å; T60-H161 VanDerWaalsContact OG1-O 3.13Å; F83-H161 HydrophobicContact CB-CB 4.33Å; F83-H161 AromaticContact CD1-CD2 3.99Å; F83-H161 AromaticContact CD1-CE1 3.83Å; F83-H161 AromaticContact CD1-NE2 3.68Å; F83-H161 AromaticContact CD2-ND1 3.86Å; F83-H161 AromaticContact CE1-CE1 3.7Å; F83-H161 AromaticContact CE1-NE2 3.87Å; F83-H161 AromaticContact CE2-ND1 3.97Å; F83-H161 AromaticContact CG-CD2 3.99Å; F83-H161 AromaticContact CG-CG 3.93Å; F83-H161 AromaticContact CG-ND1 3.98Å; F83-H161 AromaticContact CZ-CE1 3.82Å; Q157-H161 PolarHBondContact O-N 3.04Å; Q157-H161 VanDerWaalsContact O-N 3.08Å; Q158-H161 CarbonylContact O-C 3.38Å; Q158-H161 PolarHBondContact O-N 3.17Å
162K82.1Confident87.8Confident97 Ų9776.5 Ų76.542%0.42238%0.384SS..  trans-70.7132.6176.8-67-177.5-177.1-170.90111.2Q158 Q159 Y164 V169Q158-K162 PolarHBondContact O-N 3.38Å; Q159-K162 WeakPolarHBondContact O-CE 3.31Å; Q159-K162 WeakPolarHBondContact O-CG 3.2Å; K162-Y164 PolarHBondContact O-N 2.93Å; K162-V169 HydrophobicContact CG-CG2 4.22Å
163K77.8Confident87.8Confident127 Ų12775.2 Ų75.255%0.55238%0.377SS*.SBendtrans-66.4-35.9178.5-170.6173.9-179170.10113.3G59 T60G59-K163 WeakPolarHBondContact O-CB 3.19Å; T60-K163 HydrophobicContact CG2-CB 3.85Å; T60-K163 HydrophobicContact CG2-CG 4.41Å
164Y80.2Confident87.9Confident156 Ų15674 Ų7461%0.61237%0.371SS*.SBendtrans-134.6138.4177.1-58.9-77.4000110.2K162 G166 S167K162-Y164 PolarHBondContact O-N 2.93Å; Y164-G166 PolarHBondContact O-N 3.3Å; Y164-S167 VanDerWaalsContact O-CB 3.31Å; Y164-S167 WeakPolarHBondContact O-CB 3.48Å; Y164-S167 PolarHBondContact O-N 3.48Å
165H77.5Confident88Confident207 Ų20778.1 Ų78.196%0.95840%0.396SS*.THydrogen-bonded Turntrans-58.7124173.3-77.7-82.6000109.9
166G79.2Confident88.1Confident74 Ų7476.5 Ų76.576%0.76339%0.387SS*.THydrogen-bonded Turntrans88.6-5.7-177.300000115.6Y164 Q168Y164-G166 PolarHBondContact O-N 3.3Å; G166-Q168 PolarHBondContact O-N 3Å
167S84.4Confident88.3Confident39 Ų3975.7 Ų75.727%0.27338%0.375SS..  trans-65.5134.6174.4-175.30000111Y164Y164-S167 VanDerWaalsContact O-CB 3.31Å; Y164-S167 WeakPolarHBondContact O-CB 3.48Å; Y164-S167 PolarHBondContact O-N 3.48Å
168Q85.4Confident88.6Confident162 Ų16281.4 Ų81.476%0.75740%0.397SS*.  trans-79.3135.1174.2-67.9-173-0.300109.8G166G166-Q168 PolarHBondContact O-N 3Å
169V89.9Confident89Confident15 Ų1583.6 Ų83.69%0.09141%0.409CS..  trans-127.8128.6176.6177.90000106.5H57 L155 Q158 K162H57-V169 WeakPolarHBondContact O-CA 3.29Å; L155-V169 HydrophobicContact CD1-CG1 4.28Å; Q158-V169 HydrophobicContact CB-CG1 3.49Å; Q158-V169 VanDerWaalsContact CB-CG1 3.49Å; Q158-V169 HydrophobicContact CG-CG1 4.45Å; K162-V169 HydrophobicContact CG-CG2 4.22Å
170Y91.5Very high89.4Confident116 Ų11678.8 Ų78.846%0.45539%0.386SS..EExtended strand (participates in β ladder)trans-146.3152.8173.760.8-85.4000109.8H57 T172H57-Y170 HydrophobicContact CB-CD1 4.04Å; H57-Y170 HydrophobicContact CB-CD2 4.03Å; H57-Y170 HydrophobicContact CB-CE1 3.64Å; H57-Y170 HydrophobicContact CB-CE2 3.64Å; H57-Y170 HydrophobicContact CB-CG 4.21Å; H57-Y170 VanDerWaalsContact CB-CZ 3.43Å; H57-Y170 AromaticContact CD2-CD2 3.79Å; H57-Y170 AromaticContact CD2-CE2 3.3Å; H57-Y170 WeakPolarHBondContact CD2-CE2 3.22Å; H57-Y170 AromaticContact CD2-CZ 3.9Å; H57-Y170 AromaticContact CG-CE2 3.48Å; H57-Y170 VanDerWaalsContact CG-CE2 3.48Å; H57-Y170 AromaticContact CG-CZ 3.57Å; H57-Y170 PolarHBondContact N-O 3.41Å; H57-Y170 PolarHBondContact O-N 3.13Å; Y170-T172 HydrophobicContact CD2-CG2 3.69Å; Y170-T172 HydrophobicContact CE2-CG2 3.77Å
171V93.7Very high89.9Confident26 Ų2673.1 Ų73.116%0.15837%0.367CS..EExtended strand (participates in β ladder)trans-114.4129.5179.1-179.30000107.5L54 H55 I56 I154 L155L54-V171 HydrophobicContact CB-CG1 4.16Å; L54-V171 HydrophobicContact CD2-CG1 4.21Å; H55-V171 CarbonylContact O-C 3.56Å; H55-V171 WeakPolarHBondContact O-CA 3.4Å; I56-V171 HydrophobicContact CG1-CG2 4.43Å; I154-V171 HydrophobicContact CB-CG2 4.46Å; I154-V171 HydrophobicContact CG2-CG2 3.88Å; L155-V171 HydrophobicContact CB-CG2 4.07Å; L155-V171 HydrophobicContact CD1-CG2 4.3Å
172T94.6Very high90.5Very high50 Ų5071.9 Ų71.931%0.30737%0.372SS..EExtended strand (participates in β ladder)trans-115.3146.8177.258.70000110.7H55 H57 Y170H55-T172 WeakPolarHBondContact CB-OG1 3.18Å; H55-T172 PolarHBondContact N-O 2.73Å; H55-T172 PolarHBondContact O-N 2.71Å; H57-T172 PolarHBondContact NE2-OG1 3.23Å; H57-T172 VanDerWaalsContact NE2-OG1 3.17Å; Y170-T172 HydrophobicContact CD2-CG2 3.69Å; Y170-T172 HydrophobicContact CE2-CG2 3.77Å
173F95.5Very high91.2Very high52 Ų5267.2 Ų67.223%0.22835%0.352CS..EExtended strand (participates in β ladder)trans-69.9144.1171.9-62.9-68.2000111L54 Y148 F177 Y178L54-F173 HydrophobicContact CD2-CD1 3.61Å; L54-F173 HydrophobicContact CD2-CE1 3.75Å; Y148-F173 HydrophobicContact CD2-CZ 4.03Å; F173-F177 HydrophobicContact CB-CB 3.94Å; F173-F177 HydrophobicContact CB-CD1 3.74Å; F173-F177 HydrophobicContact CB-CD2 4.39Å; F173-F177 HydrophobicContact CB-CE1 4.35Å; F173-F177 HydrophobicContact CB-CG 3.77Å; F173-F177 HydrophobicContact CD1-CB 4.23Å; F173-F177 HydrophobicContact CD1-CD1 4.36Å; F173-F177 AromaticContact CD1-CD2 3.54Å; F173-F177 HydrophobicContact CD1-CD2 3.54Å; F173-F177 AromaticContact CD1-CE2 3.89Å; F173-F177 HydrophobicContact CD1-CE2 3.89Å; F173-F177 AromaticContact CD1-CG 3.79Å; F173-F177 HydrophobicContact CD1-CG 3.79Å; F173-F177 HydrophobicContact CD1-CZ 4.45Å; F173-F177 HydrophobicContact CD2-CE1 4.37Å; F173-F177 HydrophobicContact CD2-CZ 4.35Å; F173-F177 HydrophobicContact CE1-CD2 4.03Å; F173-F177 HydrophobicContact CE1-CE2 4.02Å; F173-F177 HydrophobicContact CG-CB 4.4Å; F173-F177 AromaticContact CG-CD1 3.96Å; F173-F177 HydrophobicContact CG-CD1 3.96Å; F173-F177 AromaticContact CG-CD2 3.97Å; F173-F177 HydrophobicContact CG-CD2 3.97Å; F173-F177 HydrophobicContact CG-CE1 4.2Å; F173-F177 HydrophobicContact CG-CE2 4.18Å; F173-F177 AromaticContact CG-CG 3.85Å; F173-F177 HydrophobicContact CG-CG 3.85Å; F173-F177 HydrophobicContact CG-CZ 4.3Å; F173-F177 HydrophobicContact CZ-CE2 4.42Å; F173-Y178 HydrophobicContact CB-CE2 4.35Å
174A95.1Very high92.1Very high4 Ų461.5 Ų61.53%0.03333%0.329CS..  trans-111.3-174.5-178.400000111.5A52 W53 H55 S176 F177 Y178A52-A174 VanDerWaalsContact C-CB 3.42Å; A52-A174 HydrophobicContact CB-CB 3.85Å; A52-A174 WeakPolarHBondContact O-CB 3.39Å; W53-A174 WeakPolarHBondContact O-CB 3.4Å; W53-A174 PolarHBondContact O-N 3.39Å; H55-A174 WeakPolarHBondContact CD2-CB 3.43Å; A174-S176 VanDerWaalsContact C-N 3.28Å; A174-S176 PolarHBondContact O-N 2.94Å; A174-F177 WeakPolarHBondContact O-CB 3.36Å; A174-F177 PolarHBondContact O-N 3.44Å; A174-F177 VanDerWaalsContact O-N 3.13Å; A174-Y178 VanDerWaalsContact O-CD2 3.22Å; A174-Y178 WeakPolarHBondContact O-CD2 3.3Å
175V94.9Very high92.9Very high86 Ų8655.6 Ų55.652%0.52132%0.316SS..Hα-helixtrans-53.4-42.5-170.8-179.10000112.7F177 Y178 L179V175-F177 VanDerWaalsContact C-N 3.29Å; V175-F177 PolarHBondContact O-N 3.26Å; V175-Y178 PolarHBondContact O-N 3.06Å; V175-L179 HydrophobicContact CG1-CD1 3.88Å; V175-L179 HydrophobicContact CG1-CG 4.05Å; V175-L179 WeakPolarHBondContact O-CG 3.37Å; V175-L179 PolarHBondContact O-N 3.03Å
176S95.6Very high93.8Very high0 Ų046.4 Ų46.40%028%0.276CS..Hα-helixtrans-61.9-35.8-176.4-51.30000113.1A47 E50 A52 W53 A174 Y178 L179 V180A47-S176 PolarHBondContact O-OG 3.14Å; E50-S176 VanDerWaalsContact CB-OG 3.3Å; E50-S176 WeakPolarHBondContact CB-OG 3.49Å; E50-S176 PolarHBondContact O-OG 3.13Å; A52-S176 VanDerWaalsContact O-CB 3.25Å; A52-S176 WeakPolarHBondContact O-CB 3.38Å; A52-S176 PolarHBondContact O-N 3.06Å; A52-S176 PolarHBondContact O-OG 3.07Å; W53-S176 VanDerWaalsContact CD1-CB 3.48Å; W53-S176 VanDerWaalsContact CE2-CB 3.45Å; W53-S176 VanDerWaalsContact NE1-CB 3.32Å; W53-S176 PolarHBondContact NE1-OG 3.49Å; A174-S176 VanDerWaalsContact C-N 3.28Å; A174-S176 PolarHBondContact O-N 2.94Å; S176-Y178 PolarHBondContact O-N 3.13Å; S176-L179 PolarHBondContact O-N 3.31Å; S176-V180 WeakPolarHBondContact O-CG2 3.42Å; S176-V180 PolarHBondContact O-N 2.94Å
177F95.7Very high94.6Very high29 Ų2942.9 Ų42.913%0.12724%0.239CC..Hα-helixtrans-61-46174.5174.1-90.9000111.3I144 F173 A174 V175 L179 V180 A181I144-F177 HydrophobicContact CB-CE2 4.29Å; I144-F177 HydrophobicContact CG1-CE2 4.25Å; I144-F177 HydrophobicContact CG2-CE2 3.77Å; I144-F177 HydrophobicContact CG2-CZ 3.9Å; F173-F177 HydrophobicContact CB-CB 3.94Å; F173-F177 HydrophobicContact CB-CD1 3.74Å; F173-F177 HydrophobicContact CB-CD2 4.39Å; F173-F177 HydrophobicContact CB-CE1 4.35Å; F173-F177 HydrophobicContact CB-CG 3.77Å; F173-F177 HydrophobicContact CD1-CB 4.23Å; F173-F177 HydrophobicContact CD1-CD1 4.36Å; F173-F177 AromaticContact CD1-CD2 3.54Å; F173-F177 HydrophobicContact CD1-CD2 3.54Å; F173-F177 AromaticContact CD1-CE2 3.89Å; F173-F177 HydrophobicContact CD1-CE2 3.89Å; F173-F177 AromaticContact CD1-CG 3.79Å; F173-F177 HydrophobicContact CD1-CG 3.79Å; F173-F177 HydrophobicContact CD1-CZ 4.45Å; F173-F177 HydrophobicContact CD2-CE1 4.37Å; F173-F177 HydrophobicContact CD2-CZ 4.35Å; F173-F177 HydrophobicContact CE1-CD2 4.03Å; F173-F177 HydrophobicContact CE1-CE2 4.02Å; F173-F177 HydrophobicContact CG-CB 4.4Å; F173-F177 AromaticContact CG-CD1 3.96Å; F173-F177 HydrophobicContact CG-CD1 3.96Å; F173-F177 AromaticContact CG-CD2 3.97Å; F173-F177 HydrophobicContact CG-CD2 3.97Å; F173-F177 HydrophobicContact CG-CE1 4.2Å; F173-F177 HydrophobicContact CG-CE2 4.18Å; F173-F177 AromaticContact CG-CG 3.85Å; F173-F177 HydrophobicContact CG-CG 3.85Å; F173-F177 HydrophobicContact CG-CZ 4.3Å; F173-F177 HydrophobicContact CZ-CE2 4.42Å; A174-F177 WeakPolarHBondContact O-CB 3.36Å; A174-F177 PolarHBondContact O-N 3.44Å; A174-F177 VanDerWaalsContact O-N 3.13Å; V175-F177 VanDerWaalsContact C-N 3.29Å; V175-F177 PolarHBondContact O-N 3.26Å; F177-L179 VanDerWaalsContact C-N 3.35Å; F177-V180 PolarHBondContact O-N 3.34Å; F177-A181 PolarHBondContact O-N 3.04Å
178Y97Very high95.1Very high141 Ų14145.6 Ų45.655%0.55325%0.25SC*.Hα-helixtrans-70.7-31.3179-61.6-68.5000112.4F173 A174 V175 S176 A181 G182F173-Y178 HydrophobicContact CB-CE2 4.35Å; A174-Y178 VanDerWaalsContact O-CD2 3.22Å; A174-Y178 WeakPolarHBondContact O-CD2 3.3Å; V175-Y178 PolarHBondContact O-N 3.06Å; S176-Y178 PolarHBondContact O-N 3.13Å; Y178-A181 PolarHBondContact O-N 3.46Å; Y178-G182 PolarHBondContact O-N 3.27Å
179L97.2Very high95.5Very high45 Ų4543.2 Ų43.224%0.23624%0.242CC..Hα-helixtrans-63.3-44.3172.2-74171.6000111.5A43 T46 A47 V175 S176 F177 G182 A183A43-L179 HydrophobicContact CB-CD2 4.49Å; T46-L179 WeakPolarHBondContact OG1-CD1 3.35Å; A47-L179 HydrophobicContact CB-CB 3.9Å; A47-L179 HydrophobicContact CB-CD1 4.37Å; V175-L179 HydrophobicContact CG1-CD1 3.88Å; V175-L179 HydrophobicContact CG1-CG 4.05Å; V175-L179 WeakPolarHBondContact O-CG 3.37Å; V175-L179 PolarHBondContact O-N 3.03Å; S176-L179 PolarHBondContact O-N 3.31Å; F177-L179 VanDerWaalsContact C-N 3.35Å; L179-G182 PolarHBondContact O-N 3.13Å; L179-A183 WeakPolarHBondContact O-CB 3.49Å; L179-A183 PolarHBondContact O-N 3.48Å
180V97.5Very high95.5Very high1 Ų142.5 Ų42.51%0.00624%0.237CC..Hα-helixtrans-63.3-42.6174.7175.80000111.2L44 A47 W53 C140 V143 I144 S176 F177 G182 A183 G184L44-V180 HydrophobicContact CD2-CG2 4.38Å; A47-V180 HydrophobicContact CB-CG2 3.82Å; W53-V180 HydrophobicContact CH2-CG2 3.71Å; W53-V180 HydrophobicContact CZ3-CG2 4.19Å; C140-V180 HydrophobicContact CB-CG1 4.04Å; V143-V180 HydrophobicContact CB-CG1 4.12Å; V143-V180 HydrophobicContact CG1-CB 4.49Å; V143-V180 HydrophobicContact CG1-CG1 3.82Å; V143-V180 HydrophobicContact CG1-CG2 4.17Å; I144-V180 HydrophobicContact CG1-CG1 4.32Å; S176-V180 WeakPolarHBondContact O-CG2 3.42Å; S176-V180 PolarHBondContact O-N 2.94Å; F177-V180 PolarHBondContact O-N 3.34Å; V180-G182 PolarHBondContact O-N 3.09Å; V180-A183 WeakPolarHBondContact O-CB 2.97Å; V180-A183 PolarHBondContact O-N 2.81Å; V180-G184 PolarHBondContact O-N 3.45Å
181A97.5Very high95.4Very high40 Ų4037.8 Ų37.833%0.33122%0.22SC..Hα-helixtrans-62.4-42.917600000112I144 F177 Y178 G184 G185I144-A181 HydrophobicContact CD1-CB 4.05Å; F177-A181 PolarHBondContact O-N 3.04Å; Y178-A181 PolarHBondContact O-N 3.46Å; A181-G184 PolarHBondContact O-N 2.82Å; A181-G185 PolarHBondContact O-N 3.44Å
182G97.2Very high95.2Very high42 Ų4238.5 Ų38.543%0.43323%0.229SC..Hα-helixtrans-62.5-39.717400000112.6Y178 L179 V180 G185 A186Y178-G182 PolarHBondContact O-N 3.27Å; L179-G182 PolarHBondContact O-N 3.13Å; V180-G182 PolarHBondContact O-N 3.09Å; G182-G185 PolarHBondContact O-N 3.16Å; G182-A186 WeakPolarHBondContact O-CB 3.49Å; G182-A186 PolarHBondContact O-N 2.89Å
183A97.6Very high94.7Very high0 Ų037.3 Ų37.30%022%0.224CC..Hα-helixtrans-63.1-43.8174.500000112.1S40 A43 L44 L179 V180 G185 A186 S187S40-A183 PolarHBondContact OG-O 3.44Å; A43-A183 HydrophobicContact CB-CB 3.87Å; L44-A183 HydrophobicContact CD2-CB 3.96Å; L44-A183 HydrophobicContact CG-CB 3.77Å; L179-A183 WeakPolarHBondContact O-CB 3.49Å; L179-A183 PolarHBondContact O-N 3.48Å; V180-A183 WeakPolarHBondContact O-CB 2.97Å; V180-A183 PolarHBondContact O-N 2.81Å; A183-G185 PolarHBondContact O-N 3.21Å; A183-A186 PolarHBondContact O-N 3.16Å; A183-S187 WeakPolarHBondContact O-CB 3.42Å; A183-S187 PolarHBondContact O-N 2.69Å; A183-S187 PolarHBondContact O-OG 3.01Å
184G97.3Very high94.2Very high7 Ų734.9 Ų34.97%0.07221%0.214CC..Hα-helixtrans-56.9-48.1171.500000111.6V180 A181 A186 S187 I188V180-G184 PolarHBondContact O-N 3.45Å; A181-G184 PolarHBondContact O-N 2.82Å; G184-A186 PolarHBondContact O-N 3.43Å; G184-S187 WeakPolarHBondContact O-CB 3.32Å; G184-S187 PolarHBondContact O-N 3.3Å; G184-I188 WeakPolarHBondContact O-CG1 3.37Å; G184-I188 PolarHBondContact O-N 3.15Å
185G97.4Very high93.5Very high32 Ų3239.6 Ų39.633%0.3324%0.238SC..Hα-helixtrans-60.2-45.2175.900000113.4A181 G182 A183 S187 I188 L189A181-G185 PolarHBondContact O-N 3.44Å; G182-G185 PolarHBondContact O-N 3.16Å; A183-G185 PolarHBondContact O-N 3.21Å; G185-S187 VanDerWaalsContact C-N 3.29Å; G185-S187 PolarHBondContact O-N 2.94Å; G185-I188 WeakPolarHBondContact O-CB 3.21Å; G185-I188 PolarHBondContact O-N 2.95Å; G185-L189 PolarHBondContact O-N 2.86Å
186A95.8Very high92.7Very high14 Ų1442.6 Ų42.612%0.11625%0.25CS..Hα-helixtrans-62.9-36.5175.900000112.1P36 L39 G182 A183 G184 L189 A190P36-A186 VanDerWaalsContact CB-O 3.26Å; P36-A186 WeakPolarHBondContact CB-O 3.5Å; L39-A186 HydrophobicContact CB-CB 4.42Å; G182-A186 WeakPolarHBondContact O-CB 3.49Å; G182-A186 PolarHBondContact O-N 2.89Å; A183-A186 PolarHBondContact O-N 3.16Å; G184-A186 PolarHBondContact O-N 3.43Å; A186-L189 PolarHBondContact O-N 3.48Å; A186-A190 PolarHBondContact O-N 3.17Å
187S95.2Very high91.5Very high0 Ų045.8 Ų45.80%026%0.262CS..Hα-helixtrans-68.7-34.2175.6-54.70000112.2S40 T136 A183 G184 G185 A190 T191S40-S187 WeakPolarHBondContact CB-OG 3.49Å; S40-S187 PolarHBondContact OG-OG 2.93Å; T136-S187 WeakPolarHBondContact CG2-OG 3.47Å; A183-S187 WeakPolarHBondContact O-CB 3.42Å; A183-S187 PolarHBondContact O-N 2.69Å; A183-S187 PolarHBondContact O-OG 3.01Å; G184-S187 WeakPolarHBondContact O-CB 3.32Å; G184-S187 PolarHBondContact O-N 3.3Å; G185-S187 VanDerWaalsContact C-N 3.29Å; G185-S187 PolarHBondContact O-N 2.94Å; S187-A190 PolarHBondContact O-N 2.96Å; S187-T191 WeakPolarHBondContact O-CB 3.49Å; S187-T191 PolarHBondContact O-N 2.91Å; S187-T191 PolarHBondContact O-OG1 3.2Å
188I95.4Very high89.7Confident95 Ų9551.9 Ų51.949%0.48729%0.291SS..Hα-helixtrans-63.7-45.1170.9-66.1167.8000110V137 G184 G185 A190 T191 A192V137-I188 HydrophobicContact CB-CG1 4.47Å; V137-I188 HydrophobicContact CG1-CD1 4.17Å; V137-I188 HydrophobicContact CG1-CG1 3.95Å; V137-I188 HydrophobicContact CG2-CG1 3.61Å; G184-I188 WeakPolarHBondContact O-CG1 3.37Å; G184-I188 PolarHBondContact O-N 3.15Å; G185-I188 WeakPolarHBondContact O-CB 3.21Å; G185-I188 PolarHBondContact O-N 2.95Å; I188-A190 VanDerWaalsContact C-N 3.33Å; I188-A190 PolarHBondContact O-N 3.08Å; I188-T191 WeakPolarHBondContact O-CB 3.46Å; I188-T191 PolarHBondContact O-N 3.42Å; I188-A192 PolarHBondContact O-N 3.15Å
189L93Very high87.9Confident113 Ų11346.8 Ų46.859%0.59227%0.271SS*.Hα-helixtrans-62.7-40.4176.1-67175.4000111.9P36 G185 A186 T191 A192 A193P36-L189 HydrophobicContact CB-CB 4.18Å; P36-L189 HydrophobicContact CG-CB 4.33Å; G185-L189 PolarHBondContact O-N 2.86Å; A186-L189 PolarHBondContact O-N 3.48Å; L189-T191 VanDerWaalsContact C-N 3.31Å; L189-T191 PolarHBondContact O-N 2.85Å; L189-A192 PolarHBondContact O-N 2.8Å; L189-A193 VanDerWaalsContact O-CB 3.32Å; L189-A193 WeakPolarHBondContact O-CB 3.48Å; L189-A193 PolarHBondContact O-N 2.96Å
190A90.7Very high85.9Confident0 Ų046 Ų460%027%0.268CS..Hα-helixtrans-60.8-42.4173.600000111.4P36 A186 S187 I188 A193 N194P36-A190 HydrophobicContact CB-CB 4.05Å; A186-A190 PolarHBondContact O-N 3.17Å; S187-A190 PolarHBondContact O-N 2.96Å; I188-A190 VanDerWaalsContact C-N 3.33Å; I188-A190 PolarHBondContact O-N 3.08Å; A190-A193 PolarHBondContact O-N 2.93Å; A190-N194 WeakPolarHBondContact O-CB 3.5Å; A190-N194 PolarHBondContact O-N 3.4Å
191T89.9Confident83.8Confident16 Ų1649 Ų4910%0.09829%0.287CS..Hα-helixtrans-62-49.8176-55.80000110.6A130 H133 I134 S187 I188 L189 A193 N194 L195A130-T191 HydrophobicContact CB-CG2 3.97Å; H133-T191 WeakPolarHBondContact CB-OG1 3.08Å; I134-T191 HydrophobicContact CD1-CG2 4.35Å; I134-T191 HydrophobicContact CG1-CG2 3.84Å; S187-T191 WeakPolarHBondContact O-CB 3.49Å; S187-T191 PolarHBondContact O-N 2.91Å; S187-T191 PolarHBondContact O-OG1 3.2Å; I188-T191 WeakPolarHBondContact O-CB 3.46Å; I188-T191 PolarHBondContact O-N 3.42Å; L189-T191 VanDerWaalsContact C-N 3.31Å; L189-T191 PolarHBondContact O-N 2.85Å; T191-A193 PolarHBondContact O-N 3.42Å; T191-N194 PolarHBondContact O-N 3.14Å; T191-N194 VanDerWaalsContact O-N 3.14Å; T191-L195 HydrophobicContact CG2-CD1 3.8Å; T191-L195 HydrophobicContact CG2-CG 4.23Å; T191-L195 WeakPolarHBondContact O-CB 3.48Å; T191-L195 WeakPolarHBondContact O-CG 3.14Å; T191-L195 PolarHBondContact O-N 3.39Å
192A89Confident82Confident42 Ų4253.2 Ų53.235%0.34730%0.3SS..Hα-helixtrans-59.9-45.2177.400000111.5I188 L189 N194 L195 L196I188-A192 PolarHBondContact O-N 3.15Å; L189-A192 PolarHBondContact O-N 2.8Å; A192-N194 VanDerWaalsContact C-N 3.27Å; A192-N194 PolarHBondContact O-N 3.3Å; A192-L195 PolarHBondContact O-N 3.35Å; A192-L196 VanDerWaalsContact O-CB 3.27Å; A192-L196 WeakPolarHBondContact O-CB 3.22Å; A192-L196 WeakPolarHBondContact O-CG 3.34Å; A192-L196 PolarHBondContact O-N 3.37Å
193A85.2Confident79.9Confident24 Ų2458.7 Ų58.720%0.19831%0.314CS..Hα-helixtrans-62.5-33.5176.500000112.6L189 A190 T191 R197L189-A193 VanDerWaalsContact O-CB 3.32Å; L189-A193 WeakPolarHBondContact O-CB 3.48Å; L189-A193 PolarHBondContact O-N 2.96Å; A190-A193 PolarHBondContact O-N 2.93Å; T191-A193 PolarHBondContact O-N 3.42Å; A193-R197 WeakPolarHBondContact O-CG 3.26Å
194N83.3Confident78.1Confident2 Ų262.5 Ų62.51%0.01133%0.332CS..Hα-helixtrans-76.4-40175.9-83.3-22.3000112.7S33 D114 A130 A190 T191 A192 R197 Y199S33-N194 WeakPolarHBondContact CB-OD1 3.39Å; S33-N194 PolarHBondContact OG-OD1 3.36Å; D114-N194 PolarHBondContact OD1-ND2 3.37Å; D114-N194 VanDerWaalsContact OD1-ND2 3.1Å; D114-N194 PolarHBondContact OD1-OD1 2.95Å; D114-N194 PolarHBondContact OD2-ND2 3.33Å; A130-N194 HydrophobicContact CB-CB 3.98Å; A190-N194 WeakPolarHBondContact O-CB 3.5Å; A190-N194 PolarHBondContact O-N 3.4Å; T191-N194 PolarHBondContact O-N 3.14Å; T191-N194 VanDerWaalsContact O-N 3.14Å; A192-N194 VanDerWaalsContact C-N 3.27Å; A192-N194 PolarHBondContact O-N 3.3Å; N194-R197 PolarHBondContact OD1-NH1 2.99Å; N194-Y199 WeakPolarHBondContact O-CE2 3.39Å
195L82.2Confident76.4Confident102 Ų10265 Ų6553%0.53434%0.342SS..Hα-helixtrans-74.9-31.4180-67.8177.3000113.3T191 A192 R197T191-L195 HydrophobicContact CG2-CD1 3.8Å; T191-L195 HydrophobicContact CG2-CG 4.23Å; T191-L195 WeakPolarHBondContact O-CB 3.48Å; T191-L195 WeakPolarHBondContact O-CG 3.14Å; T191-L195 PolarHBondContact O-N 3.39Å; A192-L195 PolarHBondContact O-N 3.35Å; L195-R197 PolarHBondContact O-N 2.92Å
196L78.2Confident74.9Confident149 Ų14969.5 Ų69.578%0.7835%0.354SS*.THydrogen-bonded Turntrans-76.1-10.9177.4-69.4172.6000113.1A192 H198A192-L196 VanDerWaalsContact O-CB 3.27Å; A192-L196 WeakPolarHBondContact O-CB 3.22Å; A192-L196 WeakPolarHBondContact O-CG 3.34Å; A192-L196 PolarHBondContact O-N 3.37Å; L196-H198 PolarHBondContact O-N 3.37Å
197R68.9Low73.6Confident67 Ų6770.9 Ų70.925%0.25337%0.366SS..SBendtrans-73.4121.7170.3-74.6-171.1-162.6120.27.7109.1S30 S33 A193 N194 L195 Y199S30-R197 VanDerWaalsContact C-NH2 3.34Å; S30-R197 VanDerWaalsContact CA-NH2 3.26Å; S30-R197 PolarHBondContact O-NH2 2.87Å; S33-R197 PolarHBondContact OG-NH1 2.88Å; S33-R197 PolarHBondContact OG-NH2 2.8Å; S33-R197 VanDerWaalsContact OG-NH2 3.11Å; A193-R197 WeakPolarHBondContact O-CG 3.26Å; N194-R197 PolarHBondContact OD1-NH1 2.99Å; L195-R197 PolarHBondContact O-N 2.92Å; R197-Y199 VanDerWaalsContact C-N 3.33Å; R197-Y199 HydrophobicContact CB-CD2 4.41Å; R197-Y199 HydrophobicContact CB-CE2 4.02Å; R197-Y199 WeakPolarHBondContact O-CD2 2.96Å; R197-Y199 PolarHBondContact O-N 3.19Å
198H58.9Low72.6Confident158 Ų15875.7 Ų75.773%0.73139%0.391SS*.  trans-6698.1167.8-156.4-25.1000107.8L196 E204L196-H198 PolarHBondContact O-N 3.37Å; H198-E204 IonicContact CE1-OE2 3.93Å
199Y59.3Low71.7Confident34 Ų3476.9 Ų76.913%0.13339%0.394CS..PPolyproline II helixtrans-79.5123.8163.8-70.3-77.1000106.4R128 N194 R197 T201R128-Y199 HydrophobicContact CG-CD1 4.28Å; R128-Y199 HydrophobicContact CG-CD2 4.06Å; R128-Y199 HydrophobicContact CG-CE2 4.47Å; R128-Y199 HydrophobicContact CG-CG 3.94Å; N194-Y199 WeakPolarHBondContact O-CE2 3.39Å; R197-Y199 VanDerWaalsContact C-N 3.33Å; R197-Y199 HydrophobicContact CB-CD2 4.41Å; R197-Y199 HydrophobicContact CB-CE2 4.02Å; R197-Y199 WeakPolarHBondContact O-CD2 2.96Å; R197-Y199 PolarHBondContact O-N 3.19Å; Y199-T201 PolarHBondContact O-N 2.83Å
200P53.9Low70.9Confident28 Ų2876.1 Ų76.118%0.18239%0.39CS..PPolyproline II helixtrans-56.7131.8168.621.7-29.5000107.9R128 E204 E205 L208R128-P200 PolarHBondContact NH2-O 3.06Å; P200-E204 WeakPolarHBondContact CA-OE2 3.32Å; P200-E204 HydrophobicContact CB-CB 3.75Å; P200-E205 HydrophobicContact CB-CG 4Å; P200-E205 HydrophobicContact CG-CG 3.76Å; P200-L208 HydrophobicContact CB-CD1 4.19Å
201T54.7Low70.1Confident65 Ų6581.2 Ų81.240%0.39942%0.417SS..PPolyproline II helixtrans-58.2162.7176.563.40000110.1Y199 E203 E204 E205Y199-T201 PolarHBondContact O-N 2.83Å; T201-E203 PolarHBondContact O-N 3.49Å; T201-E203 VanDerWaalsContact O-N 3.16Å; T201-E204 PolarHBondContact N-OE2 3.11Å; T201-E204 PolarHBondContact O-N 3Å; T201-E204 WeakPolarHBondContact OG1-CG 3.48Å; T201-E204 PolarHBondContact OG1-N 3.05Å; T201-E204 VanDerWaalsContact OG1-N 3.13Å; T201-E205 PolarHBondContact O-N 3.12Å
202E59Low69.6Low127 Ų12783 Ų8359%0.59343%0.43SS*.Hα-helixtrans-56.7-32.6176.8-63.7-174.6136.800111.1Q206E202-Q206 VanDerWaalsContact O-CB 3.3Å; E202-Q206 WeakPolarHBondContact O-CB 3.3Å; E202-Q206 PolarHBondContact O-N 3.31Å
203E53.8Low69Low158 Ų15885.5 Ų85.574%0.73843%0.434SS*.Hα-helixtrans-66.3-43173-57.2179170.100112.4T201 Q206 A207T201-E203 PolarHBondContact O-N 3.49Å; T201-E203 VanDerWaalsContact O-N 3.16Å; E203-Q206 PolarHBondContact O-N 2.65Å; E203-A207 VanDerWaalsContact O-CB 3.3Å; E203-A207 WeakPolarHBondContact O-CB 3.48Å; E203-A207 PolarHBondContact O-N 2.94Å
204E58.3Low68.4Low80 Ų8090.3 Ų90.337%0.37445%0.454SS..Hα-helixtrans-70.6-36.2175.9-73.4176.2144.800112.4H198 P200 T201 Q206 A207 L208H198-E204 IonicContact CE1-OE2 3.93Å; P200-E204 WeakPolarHBondContact CA-OE2 3.32Å; P200-E204 HydrophobicContact CB-CB 3.75Å; T201-E204 PolarHBondContact N-OE2 3.11Å; T201-E204 PolarHBondContact O-N 3Å; T201-E204 WeakPolarHBondContact OG1-CG 3.48Å; T201-E204 PolarHBondContact OG1-N 3.05Å; T201-E204 VanDerWaalsContact OG1-N 3.13Å; E204-Q206 VanDerWaalsContact C-N 3.31Å; E204-A207 PolarHBondContact O-N 3.5Å; E204-L208 VanDerWaalsContact O-CB 3.25Å; E204-L208 WeakPolarHBondContact O-CB 2.99Å; E204-L208 WeakPolarHBondContact O-CD1 3.34Å; E204-L208 VanDerWaalsContact O-CG 3.23Å; E204-L208 WeakPolarHBondContact O-CG 3.5Å; E204-L208 PolarHBondContact O-N 2.86Å
205E62.1Low67.9Low59 Ų5997.7 Ų97.728%0.27649%0.489SS..Hα-helixtrans-61.8-43.4172.4-73.9-176.1175.800110.4K124 R128 P200 T201 L208 E209K124-E205 WeakPolarHBondContact CE-OE1 3.28Å; K124-E205 IonicContact NZ-OE1 3Å; K124-E205 PolarHBondContact NZ-OE1 3.4Å; K124-E205 IonicContact NZ-OE2 3.87Å; K124-E205 PolarHBondContact NZ-OE2 3.03Å; R128-E205 IonicContact NH2-OE1 3.53Å; R128-E205 PolarHBondContact NH2-OE1 3.11Å; R128-E205 IonicContact NH2-OE2 2.72Å; P200-E205 HydrophobicContact CB-CG 4Å; P200-E205 HydrophobicContact CG-CG 3.76Å; T201-E205 PolarHBondContact O-N 3.12Å; E205-L208 PolarHBondContact O-N 2.89Å; E205-E209 WeakPolarHBondContact O-CB 3.49Å; E205-E209 PolarHBondContact O-N 3.3Å
206Q65.3Low67.3Low126 Ų126101.1 Ų101.159%0.58950%0.502SS*.Hα-helixtrans-69.1-36.7177-161.1169.42.400111.7E202 E203 E204 E209 L210E202-Q206 VanDerWaalsContact O-CB 3.3Å; E202-Q206 WeakPolarHBondContact O-CB 3.3Å; E202-Q206 PolarHBondContact O-N 3.31Å; E203-Q206 PolarHBondContact O-N 2.65Å; E204-Q206 VanDerWaalsContact C-N 3.31Å; Q206-E209 PolarHBondContact O-N 3.43Å; Q206-L210 WeakPolarHBondContact O-CB 3.46Å; Q206-L210 VanDerWaalsContact O-CG 3.25Å; Q206-L210 WeakPolarHBondContact O-CG 3.47Å; Q206-L210 PolarHBondContact O-N 2.02Å
207A69.2Low66.6Low44 Ų44100.2 Ų100.236%0.36450%0.498SS..Hα-helixtrans-66.7-40.6172.800000111.9E203 E204 L210 L211E203-A207 VanDerWaalsContact O-CB 3.3Å; E203-A207 WeakPolarHBondContact O-CB 3.48Å; E203-A207 PolarHBondContact O-N 2.94Å; E204-A207 PolarHBondContact O-N 3.5Å; A207-L210 PolarHBondContact O-N 3.28Å; A207-L211 VanDerWaalsContact O-CB 3.29Å; A207-L211 WeakPolarHBondContact O-CB 3.33Å; A207-L211 WeakPolarHBondContact O-CG 3.26Å; A207-L211 PolarHBondContact O-N 3.04Å
208L74.1Confident65.8Low101 Ų101103.4 Ų103.453%0.52952%0.516SS..Hα-helixtrans-65.9-39.1174.8-79.5163.3000111.4P200 E204 E205 L211 S212P200-L208 HydrophobicContact CB-CD1 4.19Å; E204-L208 VanDerWaalsContact O-CB 3.25Å; E204-L208 WeakPolarHBondContact O-CB 2.99Å; E204-L208 WeakPolarHBondContact O-CD1 3.34Å; E204-L208 VanDerWaalsContact O-CG 3.23Å; E204-L208 WeakPolarHBondContact O-CG 3.5Å; E204-L208 PolarHBondContact O-N 2.86Å; E205-L208 PolarHBondContact O-N 2.89Å; L208-L211 PolarHBondContact O-N 3.38Å; L208-S212 VanDerWaalsContact O-CB 3.28Å; L208-S212 WeakPolarHBondContact O-CB 3.38Å; L208-S212 PolarHBondContact O-N 2.89Å; L208-S212 PolarHBondContact O-OG 3.5Å
209E76Confident65.6Low120 Ų120100.9 Ų100.956%0.56151%0.514SS*.Hα-helixtrans-63-50.1174.1-169.4165.4-15200110.2E205 Q206 L211 S212 E213E205-E209 WeakPolarHBondContact O-CB 3.49Å; E205-E209 PolarHBondContact O-N 3.3Å; Q206-E209 PolarHBondContact O-N 3.43Å; E209-L211 PolarHBondContact O-N 3.29Å; E209-S212 WeakPolarHBondContact CA-OG 3.39Å; E209-S212 PolarHBondContact O-N 3.17Å; E209-S212 VanDerWaalsContact O-N 3.15Å; E209-S212 PolarHBondContact O-OG 3.46Å; E209-E213 WeakPolarHBondContact O-CG 3.41Å; E209-E213 PolarHBondContact O-N 2.75Å
210L75.9Confident65.2Low97 Ų97109 Ų10951%0.50855%0.545SS..Hα-helixtrans-59.1-42.4174.9-73.2166.7000113Q206 A207 E213 M214Q206-L210 WeakPolarHBondContact O-CB 3.46Å; Q206-L210 VanDerWaalsContact O-CG 3.25Å; Q206-L210 WeakPolarHBondContact O-CG 3.47Å; Q206-L210 PolarHBondContact O-N 2.02Å; A207-L210 PolarHBondContact O-N 3.28Å; L210-E213 PolarHBondContact O-N 2.89Å; L210-M214 WeakPolarHBondContact O-CB 3.36Å; L210-M214 WeakPolarHBondContact O-CG 3.43Å; L210-M214 PolarHBondContact O-N 2.77Å
211L75.7Confident65Low106 Ų106111.3 Ų111.356%0.55556%0.56SS**Hα-helixtrans-64.6-41.1176-76171000111.2A207 L208 E209 M214 E215A207-L211 VanDerWaalsContact O-CB 3.29Å; A207-L211 WeakPolarHBondContact O-CB 3.33Å; A207-L211 WeakPolarHBondContact O-CG 3.26Å; A207-L211 PolarHBondContact O-N 3.04Å; L208-L211 PolarHBondContact O-N 3.38Å; E209-L211 PolarHBondContact O-N 3.29Å; L211-M214 PolarHBondContact O-N 3.13Å; L211-E215 WeakPolarHBondContact O-CB 3.19Å; L211-E215 PolarHBondContact O-N 3.29Å
212S79.1Confident64.9Low53 Ų53111.5 Ų111.537%0.37157%0.568SS.*Hα-helixtrans-67.4-36.6176.671.60000112.2L208 E209 E215 E216L208-S212 VanDerWaalsContact O-CB 3.28Å; L208-S212 WeakPolarHBondContact O-CB 3.38Å; L208-S212 PolarHBondContact O-N 2.89Å; L208-S212 PolarHBondContact O-OG 3.5Å; E209-S212 WeakPolarHBondContact CA-OG 3.39Å; E209-S212 PolarHBondContact O-N 3.17Å; E209-S212 VanDerWaalsContact O-N 3.15Å; E209-S212 PolarHBondContact O-OG 3.46Å; S212-E215 PolarHBondContact O-N 2.85Å; S212-E216 WeakPolarHBondContact O-CB 3.47Å; S212-E216 PolarHBondContact O-N 3.25Å
213E75.5Confident64.4Low95 Ų95112.6 Ų112.644%0.44457%0.573SS.*Hα-helixtrans-67.2-36.6173-72.4-178.4166.600111.5E209 L210 N217E209-E213 WeakPolarHBondContact O-CG 3.41Å; E209-E213 PolarHBondContact O-N 2.75Å; L210-E213 PolarHBondContact O-N 2.89Å; E213-N217 VanDerWaalsContact O-CB 3.25Å; E213-N217 WeakPolarHBondContact O-CB 3.45Å; E213-N217 VanDerWaalsContact O-CG 3.24Å; E213-N217 PolarHBondContact O-N 3.41Å; E213-N217 VanDerWaalsContact O-N 3.09Å; E213-N217 PolarHBondContact O-ND2 3.08Å
214M71.9Confident64.2Low125 Ų125113.2 Ų113.262%0.61657%0.57SS**Hα-helixtrans-68-42.9172.9-76.2-179.363.300111.8L210 L211 N217 E218L210-M214 WeakPolarHBondContact O-CB 3.36Å; L210-M214 WeakPolarHBondContact O-CG 3.43Å; L210-M214 PolarHBondContact O-N 2.77Å; L211-M214 PolarHBondContact O-N 3.13Å; M214-N217 CarbonylContact O-C 3.26Å; M214-N217 PolarHBondContact O-N 3.18Å; M214-N217 VanDerWaalsContact O-N 3.15Å; M214-E218 PolarHBondContact O-N 3.19Å
215E74.5Confident63.8Low158 Ų158116.1 Ų116.174%0.73858%0.584SS**Hα-helixtrans-65-39.4177.4-172.5176.9-176.600111.7L211 S212 N217L211-E215 WeakPolarHBondContact O-CB 3.19Å; L211-E215 PolarHBondContact O-N 3.29Å; S212-E215 PolarHBondContact O-N 2.85Å; E215-N217 VanDerWaalsContact C-N 3.28Å; E215-N217 PolarHBondContact O-N 3.41Å
216E68.2Low63.3Low173 Ų173118.6 Ų118.681%0.80860%0.603SS**Hα-helixtrans-67.5-28172.4-81.4-167.6150.900112.9S212S212-E216 WeakPolarHBondContact O-CB 3.47Å; S212-E216 PolarHBondContact O-N 3.25Å
217N64Low62.6Low130 Ų130119.5 Ų119.570%0.69561%0.61SS**Hα-helixtrans-90.8-17.7-178.8-78.7-42.8000114.6E213 M214 E215 P219E213-N217 VanDerWaalsContact O-CB 3.25Å; E213-N217 WeakPolarHBondContact O-CB 3.45Å; E213-N217 VanDerWaalsContact O-CG 3.24Å; E213-N217 PolarHBondContact O-N 3.41Å; E213-N217 VanDerWaalsContact O-N 3.09Å; E213-N217 PolarHBondContact O-ND2 3.08Å; M214-N217 CarbonylContact O-C 3.26Å; M214-N217 PolarHBondContact O-N 3.18Å; M214-N217 VanDerWaalsContact O-N 3.15Å; E215-N217 VanDerWaalsContact C-N 3.28Å; E215-N217 PolarHBondContact O-N 3.41Å; N217-P219 WeakPolarHBondContact O-CD 3.31Å
218E53.1Low61.6Low135 Ų135124.7 Ų124.763%0.63163%0.632SS**SBendtrans-71.2107.2174.8-94.8-77.2127.300109.8M214 Y220M214-E218 PolarHBondContact O-N 3.19Å; E218-Y220 PolarHBondContact O-N 3.44Å
219P54.2Low60.6Low105 Ų105126.9 Ų126.968%0.68264%0.639SS**  trans-71.9107175.629.6-27.5000108.2N217 P221N217-P219 WeakPolarHBondContact O-CD 3.31Å; P219-P221 VanDerWaalsContact O-N 3.08Å
220Y50.8Low59.4Low204 Ų204129.2 Ų129.280%0.865%0.648SS**  trans-37.4114.4177.6-136.9-92.4000111.5E218 A222E218-Y220 PolarHBondContact O-N 3.44Å; Y220-A222 PolarHBondContact O-N 3.41Å; Y220-A222 VanDerWaalsContact O-N 3.12Å
221P48.9Very low58.2Low76 Ų76133.7 Ų133.749%0.49467%0.666SS.*  trans-67.8117.5-174.423.1-30.4000109.5P219 E223P219-P221 VanDerWaalsContact O-N 3.08Å; P221-E223 HydrophobicContact CB-CG 4.28Å; P221-E223 PolarHBondContact O-N 3.25Å
222A52.8Low57.4Low69 Ų69134.2 Ų134.257%0.5768%0.676SS**  trans-7038.1174.600000112.7Y220 Y224Y220-A222 PolarHBondContact O-N 3.41Å; Y220-A222 VanDerWaalsContact O-N 3.12Å; A222-Y224 VanDerWaalsContact C-N 3.32Å; A222-Y224 PolarHBondContact O-N 3.47Å
223E48Very low56.4Low150 Ų150137.3 Ų137.370%0.70170%0.695SS**Hα-helixtrans-77.9-13.5-173.6-81.5-170.115200113.7P221P221-E223 HydrophobicContact CB-CG 4.28Å; P221-E223 PolarHBondContact O-N 3.25Å
224Y50.2Low56Low172 Ų172138.2 Ų138.268%0.67571%0.709SS**Hα-helixtrans-85.8-13177.662.3-91.8000114.7A222A222-Y224 VanDerWaalsContact C-N 3.32Å; A222-Y224 PolarHBondContact O-N 3.47Å
225E49.8Very low56Low140 Ų140136.7 Ų136.765%0.65472%0.716SS**Hα-helixtrans-96.3-21.1-179.3-72.3-164.2158.300114.6
226V53.1Low55.1Low111 Ų111140.2 Ų140.267%0.67372%0.724SS**Hα-helixtrans-91.5-29.9-170.2-1790000114
227I49.4Very low54.2Low145 Ų145138 Ų13874%0.74472%0.723SS**THydrogen-bonded Turntrans-90-16.4-169.9-62.4172.1000112.7Q229I227-Q229 VanDerWaalsContact C-N 3.34Å; I227-Q229 PolarHBondContact O-N 3.05Å
228N48.7Very low54.1Low154 Ų154141.4 Ų141.482%0.82475%0.752SS**THydrogen-bonded Turntrans-86.27.7-174.6-125.3-7.1000115.4
229Q52Low54.2Low146 Ų146141.8 Ų141.868%0.68276%0.758SS**SBendtrans-119.5-8.6-172.5-80-167.3-14.100118.2I227I227-Q229 VanDerWaalsContact C-N 3.34Å; I227-Q229 PolarHBondContact O-N 3.05Å
230F52.3Low54.2Low170 Ų170143.7 Ų143.775%0.74676%0.762SS**SBendtrans-139.536.2-165.6-72.7-73.3000118.3
231Q50.1Low54.4Low191 Ų191140.3 Ų140.389%0.89376%0.76SS**  trans-148.791160.7-118.9167.9-9.100114.2
232P58.2Low54.7Low116 Ų116144.1 Ų144.175%0.75378%0.776SS**PPolyproline II helixtrans-68.4142.4161.527.9-30.9000110.2
233P59.7Low54.8Low119 Ų119148.8 Ų148.877%0.77379%0.789SS**PPolyproline II helixtrans-68.2149.4-173.826.4-33.6000112.5
234P66.7Low55.3Low114 Ų114148.7 Ų148.774%0.7480%0.795SS**PPolyproline II helixtrans-61.1135.9-176.423.8-32.7000111.9Y236P234-Y236 PolarHBondContact O-N 3.5Å
235A70.5Confident55.6Low93 Ų93147.1 Ų147.177%0.76980%0.803SS**PPolyproline II helixtrans-66.7124.6176.300000110.5T237A235-T237 PolarHBondContact O-N 3.48Å
236Y57.2Low56.1Low231 Ų231147.6 Ų147.691%0.90682%0.815SS**  trans-67.9110.3170.7-68.6-90.9000109.3P234P234-Y236 PolarHBondContact O-N 3.5Å
237T48.6Very low56.3Low127 Ų127150.7 Ų150.778%0.77983%0.827SS**  trans-90135.216050.10000108.7A235A235-T237 PolarHBondContact O-N 3.48Å
238P62.9Low57Low202 Ų202151.2 Ų151.2100%1.31283%0.834SS**  trans-62.10-171.726.1-34.9000114.1

Retrieved 238 of 238 residues in 123 ms (Link to these results)