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Solute carrier family 22 member 16

Facilitative organic cation transporter that mediates the transport of carnitine as well as the polyamine spermidine. Mediates the partially Na(+)-dependent bidirectional transport of carnitine. May mediate L-carnitine secretion from testis epididymal epithelium into the lumen which is involved in the maturation of spermatozoa.

AlphaFold DB , UniProt , Accession X6RE50, Species HUMAN (Homo sapiens, Human), Gene SLC22A16, Length 432 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
1D61.2Low79.1Confident171 Ų17192.8 Ų92.891%0.91449%0.492SS*.  010.60-64.6-6.7000115.9
2Y69.5Low79.5Confident72 Ų7285.3 Ų85.328%0.28245%0.452SS..  trans-136.5150.7173.259.9-87.7000110E14 L15 Y31Y2-E14 HydrophobicContact CD2-CB 3.98Å; Y2-E14 HydrophobicContact CD2-CG 3.92Å; Y2-E14 HydrophobicContact CE2-CG 4.08Å; Y2-L15 CarbonylContact C-O 3.55Å; Y2-L15 WeakPolarHBondContact CA-O 3.47Å; Y2-L15 WeakPolarHBondContact CB-O 3.46Å; Y2-Y31 PolarHBondContact OH-O 3.32Å; Y2-Y31 VanDerWaalsContact OH-O 3.12Å
3V80.1Confident79.9Confident96 Ų9681.3 Ų81.358%0.58243%0.427SS*.EExtended strand (participates in β ladder)trans-106.2128.5175.6179.80000107.8V5 L15V3-V5 HydrophobicContact CG1-CG2 4.05Å; V3-L15 PolarHBondContact N-O 3.35Å; V3-L15 PolarHBondContact O-N 3.31Å
4T82.1Confident80.2Confident26 Ų2675.9 Ų75.916%0.1640%0.398CS..EExtended strand (participates in β ladder)trans-93.1128.2176.8-50.40000109.1I12 W13T4-I12 HydrophobicContact CG2-CG2 3.59Å; T4-W13 CarbonylContact C-O 3.58Å; T4-W13 WeakPolarHBondContact CA-O 3.31Å
5V84.1Confident80.4Confident56 Ų5675.8 Ų75.834%0.33940%0.398SS..EExtended strand (participates in β ladder)trans-128.8136.3-177.5-171.10000109.1V3 W13 L15V3-V5 HydrophobicContact CG1-CG2 4.05Å; V5-W13 PolarHBondContact N-O 2.63Å; V5-W13 PolarHBondContact O-N 3.47Å; V5-L15 HydrophobicContact CG2-CD1 3.72Å; V5-L15 HydrophobicContact CG2-CG 4.28Å
6Q84.4Confident80.6Confident98 Ų9873.6 Ų73.646%0.45839%0.391SS..EExtended strand (participates in β ladder)trans-107.4126.7170.9-178.6177.925.300109.7E11 I12 L29Q6-E11 WeakPolarHBondContact CA-O 3.41Å; Q6-I12 HydrophobicContact CB-CG1 4.37Å; Q6-I12 HydrophobicContact CG-CG1 4.22Å; Q6-L29 HydrophobicContact CB-CD1 3.37Å; Q6-L29 HydrophobicContact CG-CD1 4.18Å
7L82.9Confident80.7Confident82 Ų8281.4 Ų81.443%0.42941%0.413SS..  trans-82.1160.5176.5-66.6178.7000110.6N9 G10 E11L7-N9 WeakPolarHBondContact CB-OD1 3.36Å; L7-N9 PolarHBondContact O-N 2.95Å; L7-N9 VanDerWaalsContact O-N 3.14Å; L7-G10 PolarHBondContact O-N 3.44Å; L7-E11 HydrophobicContact CD1-CB 4.48Å; L7-E11 PolarHBondContact N-O 3.33Å
8Q81.5Confident80.9Confident216 Ų21680.1 Ų80.1100%1.00941%0.412SS*.THydrogen-bonded Turntrans-61.3-23.1180-68.6-179.1-10.100113.6G10Q8-G10 PolarHBondContact O-N 2.97Å
9N81.4Confident81.1Confident105 Ų10576.7 Ų76.756%0.56140%0.396SS*.THydrogen-bonded Turntrans-792.8174.165.3-2.2000113.4L7 E11L7-N9 WeakPolarHBondContact CB-OD1 3.36Å; L7-N9 PolarHBondContact O-N 2.95Å; L7-N9 VanDerWaalsContact O-N 3.14Å; N9-E11 VanDerWaalsContact C-N 3.35Å; N9-E11 VanDerWaalsContact ND2-CD 3.34Å; N9-E11 WeakPolarHBondContact OD1-CB 3.38Å; N9-E11 WeakPolarHBondContact OD1-CG 3.48Å; N9-E11 PolarHBondContact OD1-N 3.38Å; N9-E11 VanDerWaalsContact OD1-N 3.1Å
10G79.8Confident81.3Confident37 Ų3775.5 Ų75.538%0.38139%0.386SS..SBendtrans87-4.1179.900000114.8L7 Q8L7-G10 PolarHBondContact O-N 3.44Å; Q8-G10 PolarHBondContact O-N 2.97Å
11E83.2Confident81.5Confident62 Ų6273.3 Ų73.329%0.2938%0.376SS..  trans-73.1138.2179.8-63.9-174.7164.400112.2Q6 L7 N9 W13 K22Q6-E11 WeakPolarHBondContact CA-O 3.41Å; L7-E11 HydrophobicContact CD1-CB 4.48Å; L7-E11 PolarHBondContact N-O 3.33Å; N9-E11 VanDerWaalsContact C-N 3.35Å; N9-E11 VanDerWaalsContact ND2-CD 3.34Å; N9-E11 WeakPolarHBondContact OD1-CB 3.38Å; N9-E11 WeakPolarHBondContact OD1-CG 3.48Å; N9-E11 PolarHBondContact OD1-N 3.38Å; N9-E11 VanDerWaalsContact OD1-N 3.1Å; E11-W13 PolarHBondContact OE2-NE1 2.92Å; E11-K22 VanDerWaalsContact CD-CE 3.48Å; E11-K22 WeakPolarHBondContact OE1-CE 3.28Å; E11-K22 IonicContact OE1-NZ 2.74Å; E11-K22 PolarHBondContact OE1-NZ 3.49Å; E11-K22 IonicContact OE2-NZ 3.15Å; E11-K22 PolarHBondContact OE2-NZ 3.3Å
12I83.6Confident82.6Confident3 Ų367.9 Ų67.92%0.01534%0.344CS..EExtended strand (participates in β ladder)trans-109.1126.9179.9-55.8169.6000109.8T4 Q6 R23 S28T4-I12 HydrophobicContact CG2-CG2 3.59Å; Q6-I12 HydrophobicContact CB-CG1 4.37Å; Q6-I12 HydrophobicContact CG-CG1 4.22Å; I12-R23 HydrophobicContact CB-CB 4.49Å; I12-R23 HydrophobicContact CG2-CG 4.45Å; I12-R23 PolarHBondContact O-N 3.26Å; I12-S28 WeakPolarHBondContact CD1-O 3.08Å
13W84.3Confident83.3Confident33 Ų3365 Ų6513%0.12533%0.332CS..EExtended strand (participates in β ladder)trans-122139.6-178.4-68.281000110.8T4 V5 E11 R20 N21 K22 F40T4-W13 CarbonylContact C-O 3.58Å; T4-W13 WeakPolarHBondContact CA-O 3.31Å; V5-W13 PolarHBondContact N-O 2.63Å; V5-W13 PolarHBondContact O-N 3.47Å; E11-W13 PolarHBondContact OE2-NE1 2.92Å; W13-R20 HydrophobicContact CE3-CB 4.14Å; W13-R20 HydrophobicContact CE3-CG 4.12Å; W13-R20 HydrophobicContact CZ3-CB 4.38Å; W13-R20 HydrophobicContact CZ3-CG 3.85Å; W13-N21 CarbonylContact C-O 3.56Å; W13-N21 WeakPolarHBondContact CA-O 3.5Å; W13-K22 HydrophobicContact CD2-CB 4.14Å; W13-K22 HydrophobicContact CD2-CG 4.32Å; W13-K22 HydrophobicContact CE3-CB 3.88Å; W13-K22 HydrophobicContact CH2-CB 3.87Å; W13-K22 HydrophobicContact CH2-CD 4.05Å; W13-K22 HydrophobicContact CH2-CG 4.26Å; W13-K22 HydrophobicContact CZ2-CB 4.11Å; W13-K22 HydrophobicContact CZ2-CD 3.73Å; W13-K22 HydrophobicContact CZ2-CG 4Å; W13-K22 HydrophobicContact CZ3-CB 3.73Å; W13-F40 AromaticContact CH2-CD2 3.93Å; W13-F40 HydrophobicContact CH2-CD2 3.93Å; W13-F40 HydrophobicContact CH2-CE2 4.02Å; W13-F40 AromaticContact CZ3-CD2 3.69Å; W13-F40 HydrophobicContact CZ3-CD2 3.69Å; W13-F40 HydrophobicContact CZ3-CE2 4.16Å; W13-F40 HydrophobicContact CZ3-CG 4.42Å
14E84.6Confident83.2Confident5 Ų562.9 Ų62.92%0.02332%0.316CS..EExtended strand (participates in β ladder)trans-103.7115.9167.3-64.4175.1-174.900108.8Y2 R20 N21 R23 K37Y2-E14 HydrophobicContact CD2-CB 3.98Å; Y2-E14 HydrophobicContact CD2-CG 3.92Å; Y2-E14 HydrophobicContact CE2-CG 4.08Å; E14-R20 WeakPolarHBondContact O-CA 3.41Å; E14-N21 HydrophobicContact CB-CB 4.21Å; E14-N21 PolarHBondContact N-O 3.18Å; E14-N21 PolarHBondContact O-N 2.96Å; E14-R23 HydrophobicContact CG-CG 4.48Å; E14-R23 IonicContact OE1-CZ 3.93Å; E14-R23 IonicContact OE1-NE 3.81Å; E14-R23 PolarHBondContact OE1-NE 3.16Å; E14-R23 IonicContact OE1-NH2 2.95Å; E14-R23 PolarHBondContact OE1-NH2 3.48Å; E14-K37 VanDerWaalsContact OE1-CE 3.25Å; E14-K37 WeakPolarHBondContact OE1-CE 3.39Å; E14-K37 IonicContact OE1-NZ 2.97Å; E14-K37 PolarHBondContact OE1-NZ 3.49Å; E14-K37 WeakPolarHBondContact OE2-CE 3.33Å; E14-K37 IonicContact OE2-NZ 2.75Å; E14-K37 PolarHBondContact OE2-NZ 2.91Å
15L83.4Confident82.5Confident75 Ų7569.9 Ų69.939%0.39335%0.353SS..EExtended strand (participates in β ladder)trans-95.4112.2178.9-56.7178.9000108.9Y2 V3 V5 R20Y2-L15 CarbonylContact C-O 3.55Å; Y2-L15 WeakPolarHBondContact CA-O 3.47Å; Y2-L15 WeakPolarHBondContact CB-O 3.46Å; V3-L15 PolarHBondContact N-O 3.35Å; V3-L15 PolarHBondContact O-N 3.31Å; V5-L15 HydrophobicContact CG2-CD1 3.72Å; V5-L15 HydrophobicContact CG2-CG 4.28Å; L15-R20 HydrophobicContact CD2-CB 3.76Å
16S83.3Confident81.5Confident41 Ų4169.2 Ų69.229%0.28735%0.349SS..  trans-92.5176167.4900000109.9C18 S19S16-C18 PolarHBondContact O-N 2.81Å; S16-C18 PolarHBondContact OG-N 3.27Å; S16-S19 WeakPolarHBondContact CA-O 3.44Å; S16-S19 WeakPolarHBondContact CB-O 3.23Å; S16-S19 PolarHBondContact N-O 3.4Å; S16-S19 PolarHBondContact OG-N 2.94Å; S16-S19 PolarHBondContact OG-O 3.23Å; S16-S19 PolarHBondContact OG-OG 3.13Å
17R82.4Confident80.3Confident205 Ų20570.2 Ų70.277%0.77437%0.367SS*.SBendtrans-64-25.8176.9-66.4-175.7-175.4178.52.8113.4
18C84.6Confident79.4Confident59 Ų5969.8 Ų69.840%0.39937%0.371SS..SBendtrans-129.7-8.2-171.6-72.50000115.2S16 C65S16-C18 PolarHBondContact O-N 2.81Å; S16-C18 PolarHBondContact OG-N 3.27Å; C18-C65 WeakPolarHBondContact CA-SG 3.47Å; C18-C65 HydrophobicContact CB-CB 3.66Å; C18-C65 WeakPolarHBondContact CB-SG 3.46Å; C18-C65 VanDerWaalsContact SG-CA 3.56Å; C18-C65 WeakPolarHBondContact SG-CB 3.37Å; C18-C65 CovalentContact SG-SG 2.04Å; C18-C65 PolarHBondContact SG-SG 3.48Å
19S84.4Confident78.7Confident15 Ų1564.2 Ų64.211%0.10535%0.347CS..EExtended strand (participates in β ladder)trans-147.9157.5179.361.60000111.4S16 E39S16-S19 WeakPolarHBondContact CA-O 3.44Å; S16-S19 WeakPolarHBondContact CB-O 3.23Å; S16-S19 PolarHBondContact N-O 3.4Å; S16-S19 PolarHBondContact OG-N 2.94Å; S16-S19 PolarHBondContact OG-O 3.23Å; S16-S19 PolarHBondContact OG-OG 3.13Å; S19-E39 WeakPolarHBondContact CB-OE1 3.4Å; S19-E39 PolarHBondContact OG-OE1 3.4Å
20R85.5Confident78Confident53 Ų5360.7 Ų60.720%0.234%0.335CS..EExtended strand (participates in β ladder)trans-118.2125.9172.364.7-176.7-174.5176.45.4108.7W13 E14 L15 F40 P41 D44W13-R20 HydrophobicContact CE3-CB 4.14Å; W13-R20 HydrophobicContact CE3-CG 4.12Å; W13-R20 HydrophobicContact CZ3-CB 4.38Å; W13-R20 HydrophobicContact CZ3-CG 3.85Å; E14-R20 WeakPolarHBondContact O-CA 3.41Å; L15-R20 HydrophobicContact CD2-CB 3.76Å; R20-F40 HydrophobicContact CG-CB 3.74Å; R20-F40 WeakPolarHBondContact CG-O 3.41Å; R20-F40 PolarHBondContact N-O 3.49Å; R20-F40 PolarHBondContact O-N 3.46Å; R20-P41 PolarHBondContact NE-O 2.85Å; R20-D44 IonicContact CZ-OD2 2.7Å; R20-D44 IonicContact NH1-OD2 2.67Å; R20-D44 PolarHBondContact NH1-OD2 3.39Å
21N85.3Confident77.3Confident30 Ų3066.1 Ų66.116%0.1635%0.345CS..EExtended strand (participates in β ladder)trans-109.5118-177.3-66-27.6000109.3W13 E14 K37 K38 E39W13-N21 CarbonylContact C-O 3.56Å; W13-N21 WeakPolarHBondContact CA-O 3.5Å; E14-N21 HydrophobicContact CB-CB 4.21Å; E14-N21 PolarHBondContact N-O 3.18Å; E14-N21 PolarHBondContact O-N 2.96Å; N21-K37 HydrophobicContact CB-CB 4.4Å; N21-K37 HydrophobicContact CB-CD 4.43Å; N21-K38 CarbonylContact C-O 3.6Å; N21-K38 WeakPolarHBondContact CA-O 3.14Å; N21-E39 WeakPolarHBondContact OD1-CA 3.46Å; N21-E39 WeakPolarHBondContact OD1-CB 3.36Å; N21-E39 WeakPolarHBondContact OD1-CG 3.5Å
22K84.8Confident76.4Confident56 Ų5671.9 Ų71.924%0.24337%0.372CS..EExtended strand (participates in β ladder)trans-82.3127.7172.9-171.7175.8-176.81670109.2E11 W13 K37 K38 F40E11-K22 VanDerWaalsContact CD-CE 3.48Å; E11-K22 WeakPolarHBondContact OE1-CE 3.28Å; E11-K22 IonicContact OE1-NZ 2.74Å; E11-K22 PolarHBondContact OE1-NZ 3.49Å; E11-K22 IonicContact OE2-NZ 3.15Å; E11-K22 PolarHBondContact OE2-NZ 3.3Å; W13-K22 HydrophobicContact CD2-CB 4.14Å; W13-K22 HydrophobicContact CD2-CG 4.32Å; W13-K22 HydrophobicContact CE3-CB 3.88Å; W13-K22 HydrophobicContact CH2-CB 3.87Å; W13-K22 HydrophobicContact CH2-CD 4.05Å; W13-K22 HydrophobicContact CH2-CG 4.26Å; W13-K22 HydrophobicContact CZ2-CB 4.11Å; W13-K22 HydrophobicContact CZ2-CD 3.73Å; W13-K22 HydrophobicContact CZ2-CG 4Å; W13-K22 HydrophobicContact CZ3-CB 3.73Å; K22-K37 CarbonylContact O-C 3.49Å; K22-K37 VanDerWaalsContact O-CA 3.31Å; K22-K37 WeakPolarHBondContact O-CA 3.18Å; K22-K38 PolarHBondContact N-O 2.96Å; K22-K38 PolarHBondContact O-N 3.33Å; K22-F40 HydrophobicContact CB-CE2 4.1Å
23R83.1Confident75.8Confident11 Ų1173.8 Ų73.84%0.04238%0.38CS..EExtended strand (participates in β ladder)trans-79.3130.7171.3-62.1-174.4176.8178.8-3.9109.6I12 E14 T26 G30 Y31 Y33I12-R23 HydrophobicContact CB-CB 4.49Å; I12-R23 HydrophobicContact CG2-CG 4.45Å; I12-R23 PolarHBondContact O-N 3.26Å; E14-R23 HydrophobicContact CG-CG 4.48Å; E14-R23 IonicContact OE1-CZ 3.93Å; E14-R23 IonicContact OE1-NE 3.81Å; E14-R23 PolarHBondContact OE1-NE 3.16Å; E14-R23 IonicContact OE1-NH2 2.95Å; E14-R23 PolarHBondContact OE1-NH2 3.48Å; R23-T26 WeakPolarHBondContact CB-OG1 3.32Å; R23-G30 PolarHBondContact NH1-O 2.9Å; R23-G30 PolarHBondContact NH2-O 2.9Å; R23-Y31 PolarHBondContact NH2-O 3.09Å; R23-Y33 HydrophobicContact CB-CD1 4.24Å; R23-Y33 HydrophobicContact CB-CE1 3.92Å; R23-Y33 HydrophobicContact CG-CD1 3.74Å; R23-Y33 HydrophobicContact CG-CE1 3.89Å; R23-Y33 HydrophobicContact CG-CG 4.25Å; R23-Y33 VanDerWaalsContact CZ-CB 3.48Å
24E79.4Confident75Confident53 Ų5379.6 Ų79.625%0.24842%0.419CS..SBendtrans-89.2148.1174.8-62.7-169.4135.300110.8T26 Y33 S36 K38E24-T26 PolarHBondContact O-N 3.24Å; E24-T26 PolarHBondContact O-OG1 3.16Å; E24-Y33 PolarHBondContact O-OH 3.25Å; E24-S36 PolarHBondContact N-O 3.11Å; E24-S36 VanDerWaalsContact N-O 3.14Å; E24-S36 WeakPolarHBondContact OE2-CB 3.43Å; E24-S36 PolarHBondContact OE2-OG 3.38Å; E24-K38 WeakPolarHBondContact OE1-CD 3.49Å; E24-K38 WeakPolarHBondContact OE1-CE 3.48Å; E24-K38 IonicContact OE1-NZ 3.27Å; E24-K38 PolarHBondContact OE1-NZ 3.35Å
25N66.3Low74.5Confident173 Ų17381.1 Ų81.193%0.92544%0.435SS*.SBendtrans47.950.3171.1-73-13.3000116.1
26T64.2Low74.2Confident41 Ų4180.8 Ų80.825%0.25244%0.44SS..  trans-132.2137.9177.39.50000113R23 E24 Y33R23-T26 WeakPolarHBondContact CB-OG1 3.32Å; E24-T26 PolarHBondContact O-N 3.24Å; E24-T26 PolarHBondContact O-OG1 3.16Å; T26-Y33 HydrophobicContact CG2-CD2 3.6Å; T26-Y33 HydrophobicContact CG2-CE2 3.39Å
27S59Low74.2Confident120 Ų12082.8 Ų82.884%0.83944%0.443SS*.  trans-111.3-5.3175.6510000113.4
28S62.5Low74.2Confident73 Ų7378.4 Ų78.451%0.5143%0.43SS..  trans-116.3137.5-175.7610000113I12 G30I12-S28 WeakPolarHBondContact CD1-O 3.08Å; S28-G30 PolarHBondContact O-N 3.4Å; S28-G30 VanDerWaalsContact O-N 3.09Å
29L67.3Low74.1Confident99 Ų9982.1 Ų82.152%0.51844%0.441SS..  trans-86.749.3-179.6-145.5133000111.4Q6Q6-L29 HydrophobicContact CB-CD1 3.37Å; Q6-L29 HydrophobicContact CG-CD1 4.18Å
30G66.8Low74Confident30 Ų3085 Ų8531%0.30945%0.452SS..  trans-75.3143.7177.200000111.6R23 S28 E32R23-G30 PolarHBondContact NH1-O 2.9Å; R23-G30 PolarHBondContact NH2-O 2.9Å; S28-G30 PolarHBondContact O-N 3.4Å; S28-G30 VanDerWaalsContact O-N 3.09Å; G30-E32 VanDerWaalsContact C-N 3.35Å
31Y65.4Low73.9Confident152 Ų15286.5 Ų86.560%0.59647%0.469SS*.SBendtrans-67.6-39.5175.9-149.8-97.5000110.9Y2 R23Y2-Y31 PolarHBondContact OH-O 3.32Å; Y2-Y31 VanDerWaalsContact OH-O 3.12Å; R23-Y31 PolarHBondContact NH2-O 3.09Å
32E64.7Low73.7Confident183 Ų18386.8 Ų86.886%0.85547%0.472SS*.  trans-88.4129.9173.7-68.5-178.7168.700111.5G30G30-E32 VanDerWaalsContact C-N 3.35Å
33Y70Confident73.4Confident43 Ų4389 Ų8917%0.16949%0.491CS..  trans-140.5123.8175.9172.4-107.8000110.3R23 E24 T26 G35 S36 K37R23-Y33 HydrophobicContact CB-CD1 4.24Å; R23-Y33 HydrophobicContact CB-CE1 3.92Å; R23-Y33 HydrophobicContact CG-CD1 3.74Å; R23-Y33 HydrophobicContact CG-CE1 3.89Å; R23-Y33 HydrophobicContact CG-CG 4.25Å; R23-Y33 VanDerWaalsContact CZ-CB 3.48Å; E24-Y33 PolarHBondContact O-OH 3.25Å; T26-Y33 HydrophobicContact CG2-CD2 3.6Å; T26-Y33 HydrophobicContact CG2-CE2 3.39Å; Y33-G35 WeakPolarHBondContact CE1-O 3.45Å; Y33-G35 VanDerWaalsContact CZ-C 3.42Å; Y33-G35 WeakPolarHBondContact OH-CA 3.34Å; Y33-S36 WeakPolarHBondContact CE1-O 3.42Å; Y33-S36 PolarHBondContact OH-N 3.33Å; Y33-S36 PolarHBondContact OH-O 2.66Å; Y33-K37 HydrophobicContact CD1-CD 4.46Å; Y33-K37 HydrophobicContact CD1-CG 4.04Å; Y33-K37 HydrophobicContact CE1-CG 3.82Å
34T68.1Low73.2Confident155 Ų15595.2 Ų95.295%0.95153%0.525SS*.  trans-103.84.6-174.545.40000114
35G73.6Confident73.4Confident36 Ų3694.5 Ų94.537%0.37153%0.531SS..SBendtrans-92.6-176179.500000114.5Y33Y33-G35 WeakPolarHBondContact CE1-O 3.45Å; Y33-G35 VanDerWaalsContact CZ-C 3.42Å; Y33-G35 WeakPolarHBondContact OH-CA 3.34Å
36S77.4Confident74.3Confident69 Ų6989.3 Ų89.348%0.48350%0.499SS..  trans-63.8136.5179176.20000111.8E24 Y33E24-S36 PolarHBondContact N-O 3.11Å; E24-S36 VanDerWaalsContact N-O 3.14Å; E24-S36 WeakPolarHBondContact OE2-CB 3.43Å; E24-S36 PolarHBondContact OE2-OG 3.38Å; Y33-S36 WeakPolarHBondContact CE1-O 3.42Å; Y33-S36 PolarHBondContact OH-N 3.33Å; Y33-S36 PolarHBondContact OH-O 2.66Å
37K82.9Confident75.3Confident82 Ų8295.8 Ų95.836%0.35753%0.53SS..EExtended strand (participates in β ladder)trans-122.3135176.2-62.7178.4-176.4-177.50109.1E14 N21 K22 Y33E14-K37 VanDerWaalsContact OE1-CE 3.25Å; E14-K37 WeakPolarHBondContact OE1-CE 3.39Å; E14-K37 IonicContact OE1-NZ 2.97Å; E14-K37 PolarHBondContact OE1-NZ 3.49Å; E14-K37 WeakPolarHBondContact OE2-CE 3.33Å; E14-K37 IonicContact OE2-NZ 2.75Å; E14-K37 PolarHBondContact OE2-NZ 2.91Å; N21-K37 HydrophobicContact CB-CB 4.4Å; N21-K37 HydrophobicContact CB-CD 4.43Å; K22-K37 CarbonylContact O-C 3.49Å; K22-K37 VanDerWaalsContact O-CA 3.31Å; K22-K37 WeakPolarHBondContact O-CA 3.18Å; Y33-K37 HydrophobicContact CD1-CD 4.46Å; Y33-K37 HydrophobicContact CD1-CG 4.04Å; Y33-K37 HydrophobicContact CE1-CG 3.82Å
38K82.4Confident76.6Confident113 Ų11393.2 Ų93.249%0.49150%0.503SS..EExtended strand (participates in β ladder)trans-99.7120.7169.1-81.4-179.8173144.80110.3N21 K22 E24 F40N21-K38 CarbonylContact C-O 3.6Å; N21-K38 WeakPolarHBondContact CA-O 3.14Å; K22-K38 PolarHBondContact N-O 2.96Å; K22-K38 PolarHBondContact O-N 3.33Å; E24-K38 WeakPolarHBondContact OE1-CD 3.49Å; E24-K38 WeakPolarHBondContact OE1-CE 3.48Å; E24-K38 IonicContact OE1-NZ 3.27Å; E24-K38 PolarHBondContact OE1-NZ 3.35Å; K38-F40 HydrophobicContact CB-CD2 4.48Å; K38-F40 HydrophobicContact CB-CE2 3.71Å; K38-F40 HydrophobicContact CB-CZ 4.28Å; K38-F40 WeakPolarHBondContact O-CD2 3.47Å
39E82.9Confident77.7Confident137 Ų13794.8 Ų94.864%0.6451%0.505SS*.EExtended strand (participates in β ladder)trans-85.9134.5178.5-176.7163.2-145.600111.2S19 N21S19-E39 WeakPolarHBondContact CB-OE1 3.4Å; S19-E39 PolarHBondContact OG-OE1 3.4Å; N21-E39 WeakPolarHBondContact OD1-CA 3.46Å; N21-E39 WeakPolarHBondContact OD1-CB 3.36Å; N21-E39 WeakPolarHBondContact OD1-CG 3.5Å
40F82.6Confident78.5Confident76 Ų7696.6 Ų96.633%0.33351%0.511SS..EExtended strand (participates in β ladder)trans-130.2148.9173.7-62-94.9000110.3W13 R20 K22 K38W13-F40 AromaticContact CH2-CD2 3.93Å; W13-F40 HydrophobicContact CH2-CD2 3.93Å; W13-F40 HydrophobicContact CH2-CE2 4.02Å; W13-F40 AromaticContact CZ3-CD2 3.69Å; W13-F40 HydrophobicContact CZ3-CD2 3.69Å; W13-F40 HydrophobicContact CZ3-CE2 4.16Å; W13-F40 HydrophobicContact CZ3-CG 4.42Å; R20-F40 HydrophobicContact CG-CB 3.74Å; R20-F40 WeakPolarHBondContact CG-O 3.41Å; R20-F40 PolarHBondContact N-O 3.49Å; R20-F40 PolarHBondContact O-N 3.46Å; K22-F40 HydrophobicContact CB-CE2 4.1Å; K38-F40 HydrophobicContact CB-CD2 4.48Å; K38-F40 HydrophobicContact CB-CE2 3.71Å; K38-F40 HydrophobicContact CB-CZ 4.28Å; K38-F40 WeakPolarHBondContact O-CD2 3.47Å
41P82.8Confident79.2Confident85 Ų85101.1 Ų101.155%0.55253%0.528SS*.EExtended strand (participates in β ladder)trans-69.5157.9171.529.7-34.6000111.5R20 V43R20-P41 PolarHBondContact NE-O 2.85Å; P41-V43 WeakPolarHBondContact O-CG2 3.27Å; P41-V43 PolarHBondContact O-N 3.39Å
42C81.6Confident79.7Confident35 Ų3596.9 Ų96.924%0.23652%0.519CS..  trans-73.686.3175-62.80000111Y46C42-Y46 HydrophobicContact CB-CE1 4.01Å
43V79.1Confident80.6Confident104 Ų10493 Ų9363%0.6350%0.496SS*.THydrogen-bonded Turntrans-78.8-26178.4-113.60000113.4P41 G45P41-V43 WeakPolarHBondContact O-CG2 3.27Å; P41-V43 PolarHBondContact O-N 3.39Å; V43-G45 PolarHBondContact O-N 3.38Å
44D78.9Confident81.2Confident141 Ų14198 Ų9875%0.75452%0.518SS*.THydrogen-bonded Turntrans-86.28.8-175-53.6-51.8000113.3R20R20-D44 IonicContact CZ-OD2 2.7Å; R20-D44 IonicContact NH1-OD2 2.67Å; R20-D44 PolarHBondContact NH1-OD2 3.39Å
45G82.6Confident82.2Confident37 Ų3791.9 Ų91.938%0.38148%0.482SS..  trans88.9-168.9-179.900000114.4V43V43-G45 PolarHBondContact O-N 3.38Å
46Y85.8Confident83Confident65 Ų6592 Ų9226%0.25548%0.476SS..  trans-124140.4-177.3-60.6-84.3000110.5C42 N62 V64C42-Y46 HydrophobicContact CB-CE1 4.01Å; Y46-N62 HydrophobicContact CD2-CB 3.83Å; Y46-N62 HydrophobicContact CE2-CB 4.03Å; Y46-V64 HydrophobicContact CD1-CG2 3.85Å; Y46-V64 HydrophobicContact CD2-CG2 3.79Å; Y46-V64 HydrophobicContact CE1-CG2 3.65Å; Y46-V64 HydrophobicContact CE2-CG2 3.59Å; Y46-V64 HydrophobicContact CG-CG2 3.91Å
47I85Confident83.6Confident177 Ų17789.4 Ų89.491%0.90846%0.459SS*.  trans-101.6121.8172.2-58.4174.1000107.4
48Y86.1Confident83.9Confident65 Ų6587.9 Ų87.926%0.25546%0.456SS..  trans-105.8143.3-178.6-62.9-73.5000111Q50 T59 N62 V64Y48-Q50 PolarHBondContact O-N 2.97Å; Y48-T59 HydrophobicContact CD1-CG2 3.68Å; Y48-T59 HydrophobicContact CD2-CG2 3.71Å; Y48-T59 HydrophobicContact CE1-CG2 4.02Å; Y48-T59 HydrophobicContact CE2-CG2 4.03Å; Y48-T59 HydrophobicContact CG-CG2 3.51Å; Y48-N62 WeakPolarHBondContact CE2-OD1 3.48Å; Y48-N62 PolarHBondContact OH-OD1 3.42Å; Y48-V64 HydrophobicContact CE1-CG1 4.08Å; Y48-V64 WeakPolarHBondContact OH-CG2 3.31Å
49D85.1Confident84.2Confident106 Ų10684.3 Ų84.357%0.56744%0.444SS*.  trans-67.2125.8169.7-1766.5000110N51D49-N51 VanDerWaalsContact OD1-CB 3.32Å; D49-N51 WeakPolarHBondContact OD1-CB 3.3Å; D49-N51 PolarHBondContact OD1-N 3.23Å; D49-N51 PolarHBondContact OD1-ND2 3.19Å; D49-N51 PolarHBondContact OD2-ND2 3.35Å
50Q83.8Confident84.5Confident137 Ų13781.6 Ų81.664%0.6443%0.431SS*.  trans-102.74.8-178.2-64.2-172.3-4.400113.8Y48 T52 W53Y48-Q50 PolarHBondContact O-N 2.97Å; Q50-T52 PolarHBondContact O-N 2.69Å; Q50-W53 VanDerWaalsContact CA-O 3.31Å; Q50-W53 WeakPolarHBondContact CA-O 3.25Å
51N82.6Confident84.9Confident125 Ų12579.5 Ų79.567%0.66842%0.421SS*.SBendtrans-62.6-43.9-178.7-70.5-34.8000112.4D49 R182D49-N51 VanDerWaalsContact OD1-CB 3.32Å; D49-N51 WeakPolarHBondContact OD1-CB 3.3Å; D49-N51 PolarHBondContact OD1-N 3.23Å; D49-N51 PolarHBondContact OD1-ND2 3.19Å; D49-N51 PolarHBondContact OD2-ND2 3.35Å; N51-R182 PolarHBondContact O-NH1 3.34Å
52T76.1Confident85.2Confident64 Ų6478.2 Ų78.239%0.39341%0.41SS..SBendtrans-91.5-47.4-177.8-49.20000111.8Q50 R182Q50-T52 PolarHBondContact O-N 2.69Å; T52-R182 WeakPolarHBondContact O-CD 3.24Å
53W82.4Confident85.6Confident102 Ų10276.7 Ų76.739%0.38640%0.399SS..  trans-125.1135-178.7-49.3-76.9000110.8Q50 T56 E304Q50-W53 VanDerWaalsContact CA-O 3.31Å; Q50-W53 WeakPolarHBondContact CA-O 3.25Å; W53-T56 HydrophobicContact CB-CG2 3.78Å; W53-T56 HydrophobicContact CG-CG2 3.96Å; W53-E304 VanDerWaalsContact CZ2-OE2 3.3Å; W53-E304 WeakPolarHBondContact CZ2-OE2 3.3Å; W53-E304 PolarHBondContact NE1-OE1 2.93Å
54K84.4Confident86Confident146 Ų14673.2 Ų73.264%0.63538%0.378SS*.SBendtrans-78.9-38.7175.5-68.7-174176-176.80111.7R182K54-R182 PolarHBondContact N-O 3.46Å; K54-R182 VanDerWaalsContact N-O 3.1Å
55S88.1Confident86.3Confident28 Ų2868 Ų6820%0.19635%0.352CS..BIsolated β-bridgetrans-159.3134.5177.91790000110.6R182 W184S55-R182 PolarHBondContact N-O 3.45Å; S55-W184 PolarHBondContact O-N 3.48Å; S55-W184 VanDerWaalsContact O-N 3.17Å
56T90.6Very high86.4Confident37 Ų3772.7 Ų72.723%0.22737%0.369CS..  trans-125162.1172.872.50000111W53 V58 T59 Q60W53-T56 HydrophobicContact CB-CG2 3.78Å; W53-T56 HydrophobicContact CG-CG2 3.96Å; T56-V58 PolarHBondContact O-N 3.06Å; T56-V58 PolarHBondContact OG1-N 3.09Å; T56-T59 PolarHBondContact N-OG1 3.37Å; T56-T59 PolarHBondContact O-N 3.12Å; T56-T59 PolarHBondContact O-OG1 3.21Å; T56-T59 WeakPolarHBondContact OG1-CG2 3.36Å; T56-T59 PolarHBondContact OG1-N 2.67Å; T56-T59 VanDerWaalsContact OG1-N 3.15Å; T56-T59 PolarHBondContact OG1-OG1 3.12Å; T56-T59 VanDerWaalsContact OG1-OG1 3.13Å; T56-Q60 WeakPolarHBondContact O-CB 3.22Å; T56-Q60 PolarHBondContact O-N 2.96Å
57A89.2Confident86.5Confident16 Ų1676.8 Ų76.813%0.13238%0.384CS..Hα-helixtrans-55.4-37.5172.500000112.2W61 F125A57-W61 HydrophobicContact CB-CE3 4.28Å; A57-W61 HydrophobicContact CB-CZ3 3.79Å; A57-W61 PolarHBondContact O-N 2.97Å; A57-F125 HydrophobicContact CB-CE1 4.27Å; A57-F125 HydrophobicContact CB-CZ 4.13Å
58V89.1Confident86.5Confident50 Ų5073.2 Ų73.230%0.30336%0.361SS..Hα-helixtrans-65.9-44.8178.2176.30000111.1T56 N62 L63 V64 A71T56-V58 PolarHBondContact O-N 3.06Å; T56-V58 PolarHBondContact OG1-N 3.09Å; V58-N62 WeakPolarHBondContact O-CA 3.2Å; V58-N62 PolarHBondContact O-N 3.09Å; V58-N62 VanDerWaalsContact O-N 3.08Å; V58-L63 HydrophobicContact CG1-CB 4.16Å; V58-L63 PolarHBondContact O-N 2.77Å; V58-V64 HydrophobicContact CG1-CG1 4.04Å; V58-A71 HydrophobicContact CG2-CB 4.05Å
59T88.9Confident86.5Confident38 Ų3877.5 Ų77.523%0.23338%0.377CS..Hα-helixtrans-72.9-28.3-179.655.60000112.9Y48 T56 N62Y48-T59 HydrophobicContact CD1-CG2 3.68Å; Y48-T59 HydrophobicContact CD2-CG2 3.71Å; Y48-T59 HydrophobicContact CE1-CG2 4.02Å; Y48-T59 HydrophobicContact CE2-CG2 4.03Å; Y48-T59 HydrophobicContact CG-CG2 3.51Å; T56-T59 PolarHBondContact N-OG1 3.37Å; T56-T59 PolarHBondContact O-N 3.12Å; T56-T59 PolarHBondContact O-OG1 3.21Å; T56-T59 WeakPolarHBondContact OG1-CG2 3.36Å; T56-T59 PolarHBondContact OG1-N 2.67Å; T56-T59 VanDerWaalsContact OG1-N 3.15Å; T56-T59 PolarHBondContact OG1-OG1 3.12Å; T56-T59 VanDerWaalsContact OG1-OG1 3.13Å; T59-N62 PolarHBondContact O-OD1 2.86Å
60Q89.4Confident86.7Confident80 Ų8073.1 Ų73.137%0.37435%0.354SS..Hα-helixtrans-71.7-39.3-178.9179.1160.3-25.100112.7T56T56-Q60 WeakPolarHBondContact O-CB 3.22Å; T56-Q60 PolarHBondContact O-N 2.96Å
61W90.7Very high86.8Confident31 Ų3167.9 Ų67.912%0.11733%0.334CS..THydrogen-bonded Turntrans-107.213.5-180-60.4-63.5000113.7A57 L63 A119 V120 Y122 F125 W184A57-W61 HydrophobicContact CB-CE3 4.28Å; A57-W61 HydrophobicContact CB-CZ3 3.79Å; A57-W61 PolarHBondContact O-N 2.97Å; W61-L63 VanDerWaalsContact C-N 3.34Å; W61-L63 HydrophobicContact CB-CD2 3.92Å; W61-L63 HydrophobicContact CB-CG 4.06Å; W61-L63 PolarHBondContact O-N 2.97Å; W61-A119 HydrophobicContact CZ2-CB 4.41Å; W61-V120 PolarHBondContact NE1-O 2.74Å; W61-Y122 HydrophobicContact CE3-CD2 4.4Å; W61-F125 HydrophobicContact CH2-CB 3.42Å; W61-F125 VanDerWaalsContact CH2-CB 3.42Å; W61-F125 AromaticContact CH2-CD1 4Å; W61-F125 HydrophobicContact CH2-CD1 4Å; W61-F125 AromaticContact CH2-CD2 3.65Å; W61-F125 HydrophobicContact CH2-CD2 3.65Å; W61-F125 HydrophobicContact CH2-CE2 4.4Å; W61-F125 AromaticContact CH2-CG 3.41Å; W61-F125 HydrophobicContact CH2-CG 3.41Å; W61-F125 VanDerWaalsContact CH2-CG 3.41Å; W61-F125 HydrophobicContact CZ2-CB 3.98Å; W61-F125 HydrophobicContact CZ2-CG 4.42Å; W61-F125 HydrophobicContact CZ3-CB 3.91Å; W61-F125 AromaticContact CZ3-CD1 3.65Å; W61-F125 HydrophobicContact CZ3-CD1 3.65Å; W61-F125 HydrophobicContact CZ3-CD2 4.02Å; W61-F125 HydrophobicContact CZ3-CE1 4.13Å; W61-F125 HydrophobicContact CZ3-CE2 4.46Å; W61-F125 AromaticContact CZ3-CG 3.58Å; W61-F125 HydrophobicContact CZ3-CG 3.58Å; W61-W184 AromaticContact CH2-CH2 3.72Å; W61-W184 HydrophobicContact CH2-CH2 3.72Å; W61-W184 AromaticContact CH2-CZ2 3.78Å; W61-W184 HydrophobicContact CH2-CZ2 3.78Å; W61-W184 HydrophobicContact CZ2-CH2 4.42Å; W61-W184 HydrophobicContact CZ2-CZ2 4.31Å; W61-W184 HydrophobicContact CZ3-CZ2 4.42Å
62N90Very high86.9Confident58 Ų5864 Ų6431%0.3131%0.312SS..THydrogen-bonded Turntrans49.151.1-179.5-63-42000112.6Y46 Y48 V58 T59 V64Y46-N62 HydrophobicContact CD2-CB 3.83Å; Y46-N62 HydrophobicContact CE2-CB 4.03Å; Y48-N62 WeakPolarHBondContact CE2-OD1 3.48Å; Y48-N62 PolarHBondContact OH-OD1 3.42Å; V58-N62 WeakPolarHBondContact O-CA 3.2Å; V58-N62 PolarHBondContact O-N 3.09Å; V58-N62 VanDerWaalsContact O-N 3.08Å; T59-N62 PolarHBondContact O-OD1 2.86Å; N62-V64 PolarHBondContact O-N 3.42Å
63L89.1Confident87.5Confident4 Ų464 Ų642%0.02131%0.31CS..  trans-80.251.3-177.8-51.7177.2000111.8V58 W61 L70 A71 I74 Y122V58-L63 HydrophobicContact CG1-CB 4.16Å; V58-L63 PolarHBondContact O-N 2.77Å; W61-L63 VanDerWaalsContact C-N 3.34Å; W61-L63 HydrophobicContact CB-CD2 3.92Å; W61-L63 HydrophobicContact CB-CG 4.06Å; W61-L63 PolarHBondContact O-N 2.97Å; L63-L70 HydrophobicContact CD2-CB 3.99Å; L63-L70 HydrophobicContact CD2-CD1 4.12Å; L63-A71 HydrophobicContact CB-CB 3.9Å; L63-A71 HydrophobicContact CD1-CB 4.29Å; L63-I74 HydrophobicContact CD1-CD1 4.25Å; L63-Y122 HydrophobicContact CD1-CD2 3.7Å; L63-Y122 HydrophobicContact CD1-CE2 3.71Å; L63-Y122 HydrophobicContact CD2-CD2 3.9Å; L63-Y122 HydrophobicContact CD2-CE2 4.2Å; L63-Y122 HydrophobicContact CD2-CG 4.39Å; L63-Y122 HydrophobicContact CG-CD2 4.43Å
64V87.9Confident87.8Confident31 Ų3160.2 Ų60.219%0.18830%0.296CS..  trans-120.8168.1-178.1-640000110.5Y46 Y48 V58 N62 D66 R67Y46-V64 HydrophobicContact CD1-CG2 3.85Å; Y46-V64 HydrophobicContact CD2-CG2 3.79Å; Y46-V64 HydrophobicContact CE1-CG2 3.65Å; Y46-V64 HydrophobicContact CE2-CG2 3.59Å; Y46-V64 HydrophobicContact CG-CG2 3.91Å; Y48-V64 HydrophobicContact CE1-CG1 4.08Å; Y48-V64 WeakPolarHBondContact OH-CG2 3.31Å; V58-V64 HydrophobicContact CG1-CG1 4.04Å; N62-V64 PolarHBondContact O-N 3.42Å; V64-D66 PolarHBondContact O-N 2.85Å; V64-R67 PolarHBondContact O-N 3.03Å
65C85.7Confident88Confident30 Ų3056 Ų5620%0.20328%0.279CS..G310 helixtrans53.6-119.9176.7-51.50000111.8C18 R67 K68C18-C65 WeakPolarHBondContact CA-SG 3.47Å; C18-C65 HydrophobicContact CB-CB 3.66Å; C18-C65 WeakPolarHBondContact CB-SG 3.46Å; C18-C65 VanDerWaalsContact SG-CA 3.56Å; C18-C65 WeakPolarHBondContact SG-CB 3.37Å; C18-C65 CovalentContact SG-SG 2.04Å; C18-C65 PolarHBondContact SG-SG 3.48Å; C65-R67 PolarHBondContact O-N 3.49Å; C65-R67 VanDerWaalsContact O-N 3.09Å; C65-K68 WeakPolarHBondContact O-CB 3.23Å; C65-K68 PolarHBondContact O-N 3.12Å
66D85.2Confident88Confident137 Ų13754.9 Ų54.973%0.73327%0.271SS*.G310 helixtrans-59.3-23179.4-59-30.3000113.5V64 W69V64-D66 PolarHBondContact O-N 2.85Å; D66-W69 PolarHBondContact O-NE1 3.35Å
67R87.1Confident88Confident150 Ų15055.6 Ų55.657%0.56627%0.273SS*.G310 helixtrans-99.97.4178.8-64.9-174.2-179.7-168.20.1113.5V64 C65 W69 L70V64-R67 PolarHBondContact O-N 3.03Å; C65-R67 PolarHBondContact O-N 3.49Å; C65-R67 VanDerWaalsContact O-N 3.09Å; R67-W69 PolarHBondContact O-N 3.32Å; R67-L70 HydrophobicContact CB-CD1 4.23Å; R67-L70 HydrophobicContact CG-CD1 4.39Å; R67-L70 WeakPolarHBondContact O-CB 3.01Å; R67-L70 PolarHBondContact O-N 3.17Å; R67-L70 VanDerWaalsContact O-N 3.12Å
68K85.8Confident88.1Confident102 Ų10256.9 Ų56.944%0.44328%0.276SS..Hα-helixtrans-58.1-36179.6-173.1-174.9-176.7-167.20112.8C65 L70 A71 M72C65-K68 WeakPolarHBondContact O-CB 3.23Å; C65-K68 PolarHBondContact O-N 3.12Å; K68-L70 PolarHBondContact O-N 3.28Å; K68-A71 WeakPolarHBondContact O-CB 3.42Å; K68-A71 PolarHBondContact O-N 3.25Å; K68-A71 VanDerWaalsContact O-N 3.1Å; K68-M72 HydrophobicContact CD-CE 4.03Å; K68-M72 VanDerWaalsContact CE-CE 3.46Å; K68-M72 HydrophobicContact CG-CE 4.22Å; K68-M72 HydrophobicContact CG-SD 4.34Å; K68-M72 PolarHBondContact O-N 3.27Å
69W84.7Confident88.1Confident155 Ų15555 Ų5559%0.58726%0.264SS*.Hα-helixtrans-61.9-27.7179.571.6-86.9000113.1D66 R67 M72 L73D66-W69 PolarHBondContact O-NE1 3.35Å; R67-W69 PolarHBondContact O-N 3.32Å; W69-M72 PolarHBondContact O-N 3.34Å; W69-L73 HydrophobicContact CZ3-CD2 4.26Å; W69-L73 PolarHBondContact O-N 3.09Å
70L89.5Confident88.2Confident15 Ų1557.9 Ų57.98%0.07927%0.274CS..Hα-helixtrans-67.2-43.1174.3-67.1175.3000111L63 R67 K68 M72 L73 Y122L63-L70 HydrophobicContact CD2-CB 3.99Å; L63-L70 HydrophobicContact CD2-CD1 4.12Å; R67-L70 HydrophobicContact CB-CD1 4.23Å; R67-L70 HydrophobicContact CG-CD1 4.39Å; R67-L70 WeakPolarHBondContact O-CB 3.01Å; R67-L70 PolarHBondContact O-N 3.17Å; R67-L70 VanDerWaalsContact O-N 3.12Å; K68-L70 PolarHBondContact O-N 3.28Å; L70-M72 VanDerWaalsContact C-N 3.29Å; L70-M72 PolarHBondContact O-N 3.3Å; L70-L73 PolarHBondContact O-N 3.4Å; L70-L73 VanDerWaalsContact O-N 3.16Å; L70-Y122 WeakPolarHBondContact CA-OH 3.28Å; L70-Y122 HydrophobicContact CB-CE1 4.24Å; L70-Y122 HydrophobicContact CB-CE2 4.08Å; L70-Y122 WeakPolarHBondContact CB-OH 3.3Å; L70-Y122 HydrophobicContact CD1-CE1 4.4Å; L70-Y122 HydrophobicContact CD2-CE1 3.75Å; L70-Y122 HydrophobicContact CG-CE1 4.36Å; L70-Y122 PolarHBondContact O-OH 3.42Å
71A87.3Confident88.4Confident26 Ų2654.1 Ų54.122%0.21526%0.256CS..Hα-helixtrans-60.8-40.717400000111.8V58 L63 K68 L73 I74V58-A71 HydrophobicContact CG2-CB 4.05Å; L63-A71 HydrophobicContact CB-CB 3.9Å; L63-A71 HydrophobicContact CD1-CB 4.29Å; K68-A71 WeakPolarHBondContact O-CB 3.42Å; K68-A71 PolarHBondContact O-N 3.25Å; K68-A71 VanDerWaalsContact O-N 3.1Å; A71-L73 VanDerWaalsContact C-N 3.26Å; A71-L73 PolarHBondContact O-N 3.49Å; A71-I74 PolarHBondContact O-N 3.36Å
72M83.6Confident88.4Confident45 Ų4553.3 Ų53.322%0.22225%0.254CS..Hα-helixtrans-64.9-28.1177.1-68.9166.4157.700113K68 W69 L70 I74 P76 D414K68-M72 HydrophobicContact CD-CE 4.03Å; K68-M72 VanDerWaalsContact CE-CE 3.46Å; K68-M72 HydrophobicContact CG-CE 4.22Å; K68-M72 HydrophobicContact CG-SD 4.34Å; K68-M72 PolarHBondContact O-N 3.27Å; W69-M72 PolarHBondContact O-N 3.34Å; L70-M72 VanDerWaalsContact C-N 3.29Å; L70-M72 PolarHBondContact O-N 3.3Å; M72-I74 VanDerWaalsContact C-N 3.35Å; M72-P76 WeakPolarHBondContact O-CD 3.44Å; M72-D414 HydrophobicContact CE-CB 4.22Å
73L88.4Confident88.3Confident64 Ų6451.8 Ų51.834%0.33525%0.246SC..Hα-helixtrans-76.4-19.1-178.9-170.362.6000113.6W69 L70 A71 Q75 P76 L77W69-L73 HydrophobicContact CZ3-CD2 4.26Å; W69-L73 PolarHBondContact O-N 3.09Å; L70-L73 PolarHBondContact O-N 3.4Å; L70-L73 VanDerWaalsContact O-N 3.16Å; A71-L73 VanDerWaalsContact C-N 3.26Å; A71-L73 PolarHBondContact O-N 3.49Å; L73-Q75 PolarHBondContact O-N 3.16Å; L73-P76 WeakPolarHBondContact O-CD 3.49Å; L73-L77 VanDerWaalsContact O-CB 3.32Å; L73-L77 WeakPolarHBondContact O-CB 3.42Å; L73-L77 PolarHBondContact O-N 3.05Å; L73-L77 VanDerWaalsContact O-N 3.12Å
74I89.8Confident88.5Confident21 Ų2154.9 Ų54.911%0.10826%0.262CS..Hα-helixtrans-57.2-51.6-175.9-63.3167.8000111.6L63 A71 M72 F78 Y122 F125 M126L63-I74 HydrophobicContact CD1-CD1 4.25Å; A71-I74 PolarHBondContact O-N 3.36Å; M72-I74 VanDerWaalsContact C-N 3.35Å; I74-F78 WeakPolarHBondContact O-CB 3.45Å; I74-F78 PolarHBondContact O-N 3.12Å; I74-Y122 HydrophobicContact CD1-CE2 4.45Å; I74-Y122 HydrophobicContact CG1-CE2 4.25Å; I74-F125 HydrophobicContact CD1-CE1 4.39Å; I74-F125 HydrophobicContact CG2-CE1 4.48Å; I74-M126 HydrophobicContact CB-CE 4.09Å; I74-M126 HydrophobicContact CB-SD 4.5Å; I74-M126 HydrophobicContact CG1-CE 3.45Å; I74-M126 VanDerWaalsContact CG1-CE 3.45Å; I74-M126 HydrophobicContact CG1-SD 4.37Å
75Q87.3Confident88.6Confident57 Ų5753.4 Ų53.427%0.26625%0.253SS..Hα-helixtrans-72.8-44.2-173.6-170.870.67.100113.3L73 L77 F78 M79 L295 P410L73-Q75 PolarHBondContact O-N 3.16Å; Q75-L77 PolarHBondContact O-N 3.12Å; Q75-F78 WeakPolarHBondContact O-CB 3.3Å; Q75-F78 PolarHBondContact O-N 3.04Å; Q75-M79 WeakPolarHBondContact O-CG 3.42Å; Q75-M79 PolarHBondContact O-N 3.38Å; Q75-L295 HydrophobicContact CG-CD2 4.26Å; Q75-P410 HydrophobicContact CB-CB 4Å; Q75-P410 HydrophobicContact CB-CG 3.93Å; Q75-P410 HydrophobicContact CG-CB 3.87Å; Q75-P410 HydrophobicContact CG-CG 3.37Å
76P88.3Confident88.6Confident6 Ų652.6 Ų52.64%0.03925%0.248CC..Hα-helixtrans-60.1-42.2174-2635.4000113.4M72 L73 F78 M79 F80 I407 P410 F411M72-P76 WeakPolarHBondContact O-CD 3.44Å; L73-P76 WeakPolarHBondContact O-CD 3.49Å; P76-F78 VanDerWaalsContact C-N 3.34Å; P76-M79 PolarHBondContact O-N 3.3Å; P76-F80 PolarHBondContact O-N 3.22Å; P76-I407 HydrophobicContact CB-CG2 4.38Å; P76-P410 HydrophobicContact CG-CB 4.26Å; P76-P410 HydrophobicContact CG-CG 4.4Å; P76-F411 HydrophobicContact CB-CD2 4.34Å; P76-F411 HydrophobicContact CB-CE2 3.43Å; P76-F411 VanDerWaalsContact CB-CE2 3.43Å; P76-F411 HydrophobicContact CB-CZ 3.6Å; P76-F411 HydrophobicContact CG-CD1 4.42Å; P76-F411 HydrophobicContact CG-CD2 3.94Å; P76-F411 HydrophobicContact CG-CE1 3.87Å; P76-F411 HydrophobicContact CG-CE2 3.34Å; P76-F411 HydrophobicContact CG-CG 4.45Å; P76-F411 HydrophobicContact CG-CZ 3.31Å
77L91.7Very high88.7Confident51 Ų5149.7 Ų49.727%0.26724%0.235SC..Hα-helixtrans-68-37.3178.3-174.153.9000111.3L73 Q75 M79 F80 G81 M126 F130L73-L77 VanDerWaalsContact O-CB 3.32Å; L73-L77 WeakPolarHBondContact O-CB 3.42Å; L73-L77 PolarHBondContact O-N 3.05Å; L73-L77 VanDerWaalsContact O-N 3.12Å; Q75-L77 PolarHBondContact O-N 3.12Å; L77-M79 PolarHBondContact O-N 2.96Å; L77-F80 HydrophobicContact CD1-CD1 4.13Å; L77-F80 PolarHBondContact O-N 3.3Å; L77-G81 PolarHBondContact O-N 3.14Å; L77-M126 HydrophobicContact CB-SD 4.25Å; L77-M126 HydrophobicContact CD2-CG 3.35Å; L77-M126 HydrophobicContact CD2-SD 3.69Å; L77-M126 HydrophobicContact CG-CG 4.41Å; L77-M126 HydrophobicContact CG-SD 4.3Å; L77-F130 HydrophobicContact CD1-CD2 3.78Å; L77-F130 HydrophobicContact CD1-CE2 4.14Å; L77-F130 HydrophobicContact CG-CD2 4.08Å; L77-F130 WeakPolarHBondContact O-CD2 3.44Å
78F91.5Very high88.8Confident44 Ų4444.4 Ų44.419%0.19322%0.22CC..Hα-helixtrans-57.4-48.1169.8-172.8-84.8000111.5I74 Q75 P76 F80 G81 V82 A133I74-F78 WeakPolarHBondContact O-CB 3.45Å; I74-F78 PolarHBondContact O-N 3.12Å; Q75-F78 WeakPolarHBondContact O-CB 3.3Å; Q75-F78 PolarHBondContact O-N 3.04Å; P76-F78 VanDerWaalsContact C-N 3.34Å; F78-F80 VanDerWaalsContact C-N 3.32Å; F78-F80 PolarHBondContact O-N 3.11Å; F78-G81 WeakPolarHBondContact O-CA 3.42Å; F78-G81 PolarHBondContact O-N 3.41Å; F78-G81 VanDerWaalsContact O-N 3.14Å; F78-V82 HydrophobicContact CD1-CG2 4.17Å; F78-V82 HydrophobicContact CE1-CG2 3.99Å; F78-V82 WeakPolarHBondContact O-CG2 3.35Å; F78-V82 PolarHBondContact O-N 3.31Å; F78-A133 HydrophobicContact CD1-CB 3.91Å; F78-A133 HydrophobicContact CD2-CB 3.52Å; F78-A133 HydrophobicContact CE1-CB 3.89Å; F78-A133 HydrophobicContact CE2-CB 3.49Å; F78-A133 VanDerWaalsContact CE2-CB 3.49Å; F78-A133 HydrophobicContact CG-CB 3.73Å; F78-A133 HydrophobicContact CZ-CB 3.68Å; F78-A133 VanDerWaalsContact O-CB 3.22Å; F78-A133 WeakPolarHBondContact O-CB 3.45Å
79M88.9Confident89Confident11 Ų1141.3 Ų41.35%0.05421%0.206CC..Hα-helixtrans-65.4-33.4177.8-70.8-65.8173.400113.2Q75 P76 L77 G81 V82 L83 Y291 I407Q75-M79 WeakPolarHBondContact O-CG 3.42Å; Q75-M79 PolarHBondContact O-N 3.38Å; P76-M79 PolarHBondContact O-N 3.3Å; L77-M79 PolarHBondContact O-N 2.96Å; M79-G81 VanDerWaalsContact C-N 3.34Å; M79-V82 WeakPolarHBondContact O-CB 3.32Å; M79-V82 PolarHBondContact O-N 3.4Å; M79-L83 PolarHBondContact O-N 2.98Å; M79-Y291 HydrophobicContact CE-CD1 3.64Å; M79-Y291 HydrophobicContact CE-CE1 3.38Å; M79-Y291 HydrophobicContact CE-CG 4.48Å; M79-Y291 HydrophobicContact SD-CE1 4.28Å; M79-I407 HydrophobicContact CB-CB 4.31Å; M79-I407 HydrophobicContact CB-CG1 3.61Å
80F90.8Very high89Confident98 Ų9834.8 Ų34.843%0.4319%0.187SC..Hα-helixtrans-64.8-40.1172-178.5-117.1000111.6P76 L77 F78 V82 L83 L84 F130 I407P76-F80 PolarHBondContact O-N 3.22Å; L77-F80 HydrophobicContact CD1-CD1 4.13Å; L77-F80 PolarHBondContact O-N 3.3Å; F78-F80 VanDerWaalsContact C-N 3.32Å; F78-F80 PolarHBondContact O-N 3.11Å; F80-V82 VanDerWaalsContact C-N 3.34Å; F80-V82 PolarHBondContact O-N 2.81Å; F80-L83 HydrophobicContact CD2-CD2 4.34Å; F80-L83 HydrophobicContact CE2-CD2 4.5Å; F80-L83 WeakPolarHBondContact O-CB 3.36Å; F80-L83 PolarHBondContact O-N 3.48Å; F80-L84 PolarHBondContact O-N 3.34Å; F80-F130 AromaticContact CD1-CE2 3.65Å; F80-F130 HydrophobicContact CD1-CE2 3.65Å; F80-F130 HydrophobicContact CD1-CZ 4.3Å; F80-F130 HydrophobicContact CE1-CE2 4.2Å; F80-F130 HydrophobicContact CE1-CZ 4.41Å; F80-I407 HydrophobicContact CB-CD1 4.29Å; F80-I407 HydrophobicContact CD2-CD1 4.25Å
81G94Very high88.8Confident0 Ų039.6 Ų39.60%021%0.205CC..Hα-helixtrans-57.1-46.5169.700000111.8L77 F78 M79 L83 L84 G85 M134L77-G81 PolarHBondContact O-N 3.14Å; F78-G81 WeakPolarHBondContact O-CA 3.42Å; F78-G81 PolarHBondContact O-N 3.41Å; F78-G81 VanDerWaalsContact O-N 3.14Å; M79-G81 VanDerWaalsContact C-N 3.34Å; G81-L83 VanDerWaalsContact C-N 3.33Å; G81-L83 PolarHBondContact O-N 2.92Å; G81-L84 PolarHBondContact O-N 3.48Å; G81-G85 PolarHBondContact O-N 3.17Å; G81-M134 VanDerWaalsContact O-CA 3.22Å; G81-M134 WeakPolarHBondContact O-CA 3.07Å
82V90.1Very high88.9Confident14 Ų1442.7 Ų42.79%0.08521%0.214CC..Hα-helixtrans-57.1-44.1176.51730000112.1F78 M79 F80 S86 A133 S137 R403F78-V82 HydrophobicContact CD1-CG2 4.17Å; F78-V82 HydrophobicContact CE1-CG2 3.99Å; F78-V82 WeakPolarHBondContact O-CG2 3.35Å; F78-V82 PolarHBondContact O-N 3.31Å; M79-V82 WeakPolarHBondContact O-CB 3.32Å; M79-V82 PolarHBondContact O-N 3.4Å; F80-V82 VanDerWaalsContact C-N 3.34Å; F80-V82 PolarHBondContact O-N 2.81Å; V82-S86 PolarHBondContact O-N 3.34Å; V82-S86 VanDerWaalsContact O-N 3.13Å; V82-A133 HydrophobicContact CG2-CB 4.02Å; V82-S137 WeakPolarHBondContact CG1-OG 3.31Å; V82-S137 WeakPolarHBondContact O-CB 3.44Å; V82-S137 PolarHBondContact O-OG 3.22Å; V82-R403 VanDerWaalsContact CG1-NH1 3.27Å
83L88.5Confident89.2Confident27 Ų2740.7 Ų40.714%0.14120%0.204CC..Hα-helixtrans-58.7-56175.8170.866.1000110.7M79 F80 G81 G85 S86 V87 M400 R403 I407M79-L83 PolarHBondContact O-N 2.98Å; F80-L83 HydrophobicContact CD2-CD2 4.34Å; F80-L83 HydrophobicContact CE2-CD2 4.5Å; F80-L83 WeakPolarHBondContact O-CB 3.36Å; F80-L83 PolarHBondContact O-N 3.48Å; G81-L83 VanDerWaalsContact C-N 3.33Å; G81-L83 PolarHBondContact O-N 2.92Å; L83-G85 VanDerWaalsContact C-N 3.28Å; L83-G85 PolarHBondContact O-N 3.41Å; L83-S86 PolarHBondContact O-N 2.98Å; L83-S86 PolarHBondContact O-OG 3.46Å; L83-V87 PolarHBondContact O-N 2.51Å; L83-M400 HydrophobicContact CD1-CE 4.28Å; L83-M400 HydrophobicContact CD1-SD 3.63Å; L83-R403 HydrophobicContact CB-CB 4.18Å; L83-R403 HydrophobicContact CD1-CB 3.63Å; L83-R403 HydrophobicContact CD1-CG 4.07Å; L83-R403 HydrophobicContact CG-CB 4.43Å; L83-I407 HydrophobicContact CB-CD1 4.45Å; L83-I407 HydrophobicContact CD2-CD1 4.09Å
84L91.8Very high89.1Confident68 Ų6842 Ų4236%0.35621%0.211SC..Hα-helixtrans-60.1-41.8-176.6-173.657.1000111.3F80 G81 S86 V87 T88 F130 M134F80-L84 PolarHBondContact O-N 3.34Å; G81-L84 PolarHBondContact O-N 3.48Å; L84-S86 PolarHBondContact O-N 2.92Å; L84-V87 PolarHBondContact O-N 2.88Å; L84-T88 HydrophobicContact CD1-CG2 3.88Å; L84-T88 HydrophobicContact CG-CG2 4.13Å; L84-T88 WeakPolarHBondContact O-CG2 3.48Å; L84-T88 PolarHBondContact O-N 3.09Å; L84-T88 PolarHBondContact O-OG1 3.13Å; L84-F130 HydrophobicContact CD2-CZ 4.2Å; L84-M134 HydrophobicContact CB-CE 4.48Å; L84-M134 HydrophobicContact CD2-CE 3.66Å; L84-M134 HydrophobicContact CD2-SD 4.32Å; L84-M134 HydrophobicContact CG-CE 4.21Å; L84-M134 HydrophobicContact CG-SD 4.36Å
85G91Very high88.9Confident0 Ų048.6 Ų48.60%024%0.235CC..Hα-helixtrans-61.9-39.5179.200000114.2G81 L83 V87 T88 F89 M134G81-G85 PolarHBondContact O-N 3.17Å; L83-G85 VanDerWaalsContact C-N 3.28Å; L83-G85 PolarHBondContact O-N 3.41Å; G85-V87 VanDerWaalsContact C-N 3.29Å; G85-V87 PolarHBondContact O-N 3.46Å; G85-T88 PolarHBondContact O-OG1 3Å; G85-F89 WeakPolarHBondContact O-CB 3.3Å; G85-F89 WeakPolarHBondContact O-CD2 3.43Å; G85-F89 PolarHBondContact O-N 3.37Å; G85-M134 VanDerWaalsContact CA-O 3.23Å; G85-M134 WeakPolarHBondContact CA-O 3.5Å
86S86.3Confident89.1Confident14 Ų1450.4 Ų50.410%0.09825%0.246CC..Hα-helixtrans-63.9-35.7177.965.10000112.7V82 L83 L84 G90V82-S86 PolarHBondContact O-N 3.34Å; V82-S86 VanDerWaalsContact O-N 3.13Å; L83-S86 PolarHBondContact O-N 2.98Å; L83-S86 PolarHBondContact O-OG 3.46Å; L84-S86 PolarHBondContact O-N 2.92Å; S86-G90 PolarHBondContact O-N 3.16Å
87V86.3Confident89.1Confident75 Ų7550.1 Ų50.146%0.45524%0.244SC..Hα-helixtrans-78-48.6179.8178.70000110.9L83 L84 G85 Y91 M400L83-V87 PolarHBondContact O-N 2.51Å; L84-V87 PolarHBondContact O-N 2.88Å; G85-V87 VanDerWaalsContact C-N 3.29Å; G85-V87 PolarHBondContact O-N 3.46Å; V87-Y91 PolarHBondContact O-N 2.78Å; V87-M400 HydrophobicContact CG2-CE 3.61Å; V87-M400 HydrophobicContact CG2-SD 3.72Å
88T90Very high89.1Confident39 Ų3948.8 Ų48.824%0.23924%0.235CC..Hα-helixtrans-67.6-51-174.754.20000111.8L84 G85 Y91 F92L84-T88 HydrophobicContact CD1-CG2 3.88Å; L84-T88 HydrophobicContact CG-CG2 4.13Å; L84-T88 WeakPolarHBondContact O-CG2 3.48Å; L84-T88 PolarHBondContact O-N 3.09Å; L84-T88 PolarHBondContact O-OG1 3.13Å; G85-T88 PolarHBondContact O-OG1 3Å; T88-Y91 WeakPolarHBondContact O-CB 3.39Å; T88-Y91 PolarHBondContact O-N 3.15Å; T88-F92 WeakPolarHBondContact O-CD2 3.46Å; T88-F92 PolarHBondContact O-N 2.73Å
89F90.4Very high89.1Confident38 Ų3851.3 Ų51.317%0.16724%0.244CC..Hα-helixtrans-76.9-25.2-177.1-70.5-71.5000113.1G85 F92 S93 V101 T105 M134 V135 G138G85-F89 WeakPolarHBondContact O-CB 3.3Å; G85-F89 WeakPolarHBondContact O-CD2 3.43Å; G85-F89 PolarHBondContact O-N 3.37Å; F89-F92 HydrophobicContact CD1-CD2 4.41Å; F89-F92 PolarHBondContact O-N 2.81Å; F89-S93 VanDerWaalsContact O-CB 3.24Å; F89-S93 WeakPolarHBondContact O-CB 3.26Å; F89-S93 PolarHBondContact O-N 3.06Å; F89-V101 HydrophobicContact CB-CG1 4.28Å; F89-V101 HydrophobicContact CD1-CG1 3.9Å; F89-T105 HydrophobicContact CD1-CG2 3.51Å; F89-T105 HydrophobicContact CD2-CG2 4.32Å; F89-T105 HydrophobicContact CE1-CG2 3.62Å; F89-T105 HydrophobicContact CE2-CG2 4.41Å; F89-T105 HydrophobicContact CG-CG2 3.88Å; F89-T105 HydrophobicContact CZ-CG2 4.09Å; F89-M134 HydrophobicContact CE2-CG 4.18Å; F89-V135 HydrophobicContact CE2-CG2 4.13Å; F89-V135 HydrophobicContact CZ-CG2 4.07Å; F89-G138 VanDerWaalsContact CB-CA 3.49Å
90G83.8Confident89.3Confident17 Ų1754.4 Ų54.418%0.17526%0.263CS..Hα-helixtrans-58.8-50.5166.500000111S86 F92 S93 D94S86-G90 PolarHBondContact O-N 3.16Å; G90-F92 PolarHBondContact O-N 3.03Å; G90-S93 PolarHBondContact O-N 3.09Å; G90-D94 PolarHBondContact O-N 3.24Å
91Y85.3Confident89.4Confident116 Ų11650 Ų5046%0.45524%0.244SC..Hα-helixtrans-61.7-43.9176.4174.3-99.3000113.4V87 T88 S93 D94 R95V87-Y91 PolarHBondContact O-N 2.78Å; T88-Y91 WeakPolarHBondContact O-CB 3.39Å; T88-Y91 PolarHBondContact O-N 3.15Å; Y91-S93 VanDerWaalsContact C-N 3.31Å; Y91-S93 PolarHBondContact O-N 3.13Å; Y91-D94 PolarHBondContact O-N 3.41Å; Y91-R95 PolarHBondContact OH-NE 3.24Å; Y91-R95 PolarHBondContact OH-NH1 2.64Å; Y91-R95 VanDerWaalsContact OH-NH1 3.15Å; Y91-R95 PolarHBondContact OH-NH2 2.68Å; Y91-R95 VanDerWaalsContact OH-NH2 3.07Å
92F89.1Confident89.4Confident91 Ų9150.1 Ų50.140%0.39925%0.245SC..Hα-helixtrans-65.2-35.7177.4-74.6-57.1000112.4T88 F89 G90 D94 R95 L96 V101T88-F92 WeakPolarHBondContact O-CD2 3.46Å; T88-F92 PolarHBondContact O-N 2.73Å; F89-F92 HydrophobicContact CD1-CD2 4.41Å; F89-F92 PolarHBondContact O-N 2.81Å; G90-F92 PolarHBondContact O-N 3.03Å; F92-D94 VanDerWaalsContact C-N 3.26Å; F92-D94 PolarHBondContact O-N 3.41Å; F92-R95 PolarHBondContact O-N 3.11Å; F92-L96 HydrophobicContact CB-CD1 4.37Å; F92-L96 HydrophobicContact CD1-CD1 4.15Å; F92-L96 WeakPolarHBondContact O-CB 3.32Å; F92-L96 PolarHBondContact O-N 3.09Å; F92-V101 HydrophobicContact CB-CG2 4.12Å
93S89.7Confident89.5Confident3 Ų354.6 Ų54.62%0.02126%0.26CS..Hα-helixtrans-65-31.7179.3177.80000113.1F89 G90 Y91 R95 G97 R98 V142F89-S93 VanDerWaalsContact O-CB 3.24Å; F89-S93 WeakPolarHBondContact O-CB 3.26Å; F89-S93 PolarHBondContact O-N 3.06Å; G90-S93 PolarHBondContact O-N 3.09Å; Y91-S93 VanDerWaalsContact C-N 3.31Å; Y91-S93 PolarHBondContact O-N 3.13Å; S93-R95 VanDerWaalsContact C-N 3.32Å; S93-G97 CarbonylContact O-C 3.6Å; S93-G97 VanDerWaalsContact O-C 3.31Å; S93-G97 WeakPolarHBondContact O-CA 3.35Å; S93-G97 PolarHBondContact O-N 3.12Å; S93-R98 PolarHBondContact O-NE 3.28Å; S93-R98 WeakPolarHBondContact OG-CG 3.43Å; S93-R98 PolarHBondContact OG-NE 2.84Å; S93-V142 WeakPolarHBondContact OG-CG1 3.3Å
94D86.3Confident89.8Confident91 Ų9155.1 Ų55.149%0.48727%0.268SS..Hα-helixtrans-72.7-30.2177.8-66.9-19.2000111.3G90 Y91 F92 R98 W211G90-D94 PolarHBondContact O-N 3.24Å; Y91-D94 PolarHBondContact O-N 3.41Å; F92-D94 VanDerWaalsContact C-N 3.26Å; F92-D94 PolarHBondContact O-N 3.41Å; D94-R98 IonicContact OD1-CZ 3.2Å; D94-R98 IonicContact OD1-NE 3.56Å; D94-R98 IonicContact OD1-NH2 2.85Å; D94-R98 PolarHBondContact OD1-NH2 3.27Å; D94-W211 PolarHBondContact O-NE1 3.44Å
95R86Confident89.9Confident160 Ų16051.9 Ų51.960%0.60425%0.251SS*.Hα-helixtrans-92.7-42.6-177.5-72.2-169.8167.6-156.5-3.3115.2Y91 F92 S93Y91-R95 PolarHBondContact OH-NE 3.24Å; Y91-R95 PolarHBondContact OH-NH1 2.64Å; Y91-R95 VanDerWaalsContact OH-NH1 3.15Å; Y91-R95 PolarHBondContact OH-NH2 2.68Å; Y91-R95 VanDerWaalsContact OH-NH2 3.07Å; F92-R95 PolarHBondContact O-N 3.11Å; S93-R95 VanDerWaalsContact C-N 3.32Å
96L90.7Very high90Very high96 Ų9652 Ų5250%0.50325%0.253SS..Hα-helixtrans-94.9-6.9-173.3-61.2177.1000112.6F92 V101F92-L96 HydrophobicContact CB-CD1 4.37Å; F92-L96 HydrophobicContact CD1-CD1 4.15Å; F92-L96 WeakPolarHBondContact O-CB 3.32Å; F92-L96 PolarHBondContact O-N 3.09Å; L96-V101 HydrophobicContact CB-CG2 4.18Å
97G88.3Confident90.4Very high0 Ų052.6 Ų52.60%026%0.256CS..  trans92157.3-170.800000112.5S93 V101S93-G97 CarbonylContact O-C 3.6Å; S93-G97 VanDerWaalsContact O-C 3.31Å; S93-G97 WeakPolarHBondContact O-CA 3.35Å; S93-G97 PolarHBondContact O-N 3.12Å; G97-V101 WeakPolarHBondContact O-CG2 3.49Å
98R91.8Very high90.9Very high22 Ų2250.8 Ų50.88%0.08325%0.247CC..Hα-helixtrans-77-39.7-174.1-75.264.6-161.3-144.517.8109.4S93 D94 L102 V142 V145 Y146 E149 E207 T208 W211S93-R98 PolarHBondContact O-NE 3.28Å; S93-R98 WeakPolarHBondContact OG-CG 3.43Å; S93-R98 PolarHBondContact OG-NE 2.84Å; D94-R98 IonicContact OD1-CZ 3.2Å; D94-R98 IonicContact OD1-NE 3.56Å; D94-R98 IonicContact OD1-NH2 2.85Å; D94-R98 PolarHBondContact OD1-NH2 3.27Å; R98-L102 WeakPolarHBondContact O-CB 3.37Å; R98-L102 WeakPolarHBondContact O-CG 3.36Å; R98-L102 PolarHBondContact O-N 3.45Å; R98-V142 HydrophobicContact CB-CG1 4.14Å; R98-V142 HydrophobicContact CG-CG1 4.34Å; R98-V145 HydrophobicContact CG-CG1 4.39Å; R98-Y146 HydrophobicContact CB-CD2 3.87Å; R98-E149 IonicContact CZ-OE1 2.66Å; R98-E149 VanDerWaalsContact CZ-OE1 3.27Å; R98-E149 IonicContact CZ-OE2 3.9Å; R98-E149 IonicContact NE-OE1 3.23Å; R98-E149 IonicContact NH1-OE1 2.69Å; R98-E149 PolarHBondContact NH1-OE1 2.67Å; R98-E149 IonicContact NH1-OE2 3.24Å; R98-E149 PolarHBondContact NH1-OE2 3.38Å; R98-E149 VanDerWaalsContact NH1-OE2 3.13Å; R98-E149 IonicContact NH2-OE1 2.97Å; R98-E207 WeakPolarHBondContact CA-OE1 3.28Å; R98-E207 WeakPolarHBondContact CB-OE1 3.42Å; R98-E207 PolarHBondContact N-OE1 3.38Å; R98-E207 PolarHBondContact N-OE2 3.34Å; R98-T208 HydrophobicContact CB-CG2 4.13Å; R98-T208 HydrophobicContact CG-CG2 4.22Å; R98-W211 VanDerWaalsContact NH1-CB 3.32Å
99R92.4Very high91.1Very high98 Ų9850.5 Ų50.537%0.3724%0.244SC..Hα-helixtrans-61.3-48.7-179.8-176.8-168.1174.1-179.44112.4V101 L102 W103 W203 L205 E207R99-V101 VanDerWaalsContact C-N 3.35Å; R99-V101 PolarHBondContact O-N 3.12Å; R99-L102 PolarHBondContact O-N 3.03Å; R99-W103 PolarHBondContact O-N 3.37Å; R99-W203 PolarHBondContact NH2-O 3.42Å; R99-L205 WeakPolarHBondContact CD-O 3.38Å; R99-L205 PolarHBondContact NE-O 2.96Å; R99-E207 WeakPolarHBondContact CB-OE2 3.47Å; R99-E207 PolarHBondContact N-OE1 3.43Å; R99-E207 PolarHBondContact N-OE2 2.87Å
100V92.4Very high91.3Very high75 Ų7551.5 Ų51.546%0.45525%0.248SC..Hα-helixtrans-62.7-45-177.5177.70000110.4W103 A104V100-W103 PolarHBondContact O-N 3.34Å; V100-A104 WeakPolarHBondContact O-CB 3.5Å; V100-A104 PolarHBondContact O-N 3.36Å
101V93.9Very high91.9Very high5 Ų555.8 Ų55.83%0.0327%0.266CS..Hα-helixtrans-68.7-37.8179.4179.40000111.7F89 F92 L96 G97 R99 W103 A104 T105 V142F89-V101 HydrophobicContact CB-CG1 4.28Å; F89-V101 HydrophobicContact CD1-CG1 3.9Å; F92-V101 HydrophobicContact CB-CG2 4.12Å; L96-V101 HydrophobicContact CB-CG2 4.18Å; G97-V101 WeakPolarHBondContact O-CG2 3.49Å; R99-V101 VanDerWaalsContact C-N 3.35Å; R99-V101 PolarHBondContact O-N 3.12Å; V101-W103 PolarHBondContact O-N 3.47Å; V101-A104 PolarHBondContact O-N 2.95Å; V101-T105 HydrophobicContact CG1-CG2 4.02Å; V101-T105 WeakPolarHBondContact O-CB 3.35Å; V101-T105 VanDerWaalsContact O-CG2 3.28Å; V101-T105 WeakPolarHBondContact O-CG2 3.33Å; V101-T105 PolarHBondContact O-N 3.05Å; V101-T105 PolarHBondContact O-OG1 3.35Å; V101-V142 HydrophobicContact CB-CG1 4.42Å; V101-V142 HydrophobicContact CG1-CG1 4.46Å; V101-V142 HydrophobicContact CG1-CG2 3.85Å
102L92.6Very high92.5Very high4 Ų453.3 Ų53.32%0.02126%0.258CS..Hα-helixtrans-59.9-44.7172.5-84.3169.3000112.4R98 R99 T105 S106 Y139 V142 Y146R98-L102 WeakPolarHBondContact O-CB 3.37Å; R98-L102 WeakPolarHBondContact O-CG 3.36Å; R98-L102 PolarHBondContact O-N 3.45Å; R99-L102 PolarHBondContact O-N 3.03Å; L102-T105 PolarHBondContact O-OG1 3.45Å; L102-S106 VanDerWaalsContact O-CB 3.26Å; L102-S106 WeakPolarHBondContact O-CB 3.28Å; L102-S106 PolarHBondContact O-N 3.32Å; L102-S106 PolarHBondContact O-OG 3.35Å; L102-Y139 HydrophobicContact CD2-CD2 3.94Å; L102-Y139 HydrophobicContact CD2-CE2 4.05Å; L102-V142 HydrophobicContact CD1-CG1 4.35Å; L102-V142 HydrophobicContact CD2-CB 4.33Å; L102-V142 HydrophobicContact CD2-CG1 4.24Å; L102-V142 HydrophobicContact CG-CB 4.36Å; L102-V142 HydrophobicContact CG-CG1 3.74Å; L102-Y146 HydrophobicContact CD1-CD1 4.32Å; L102-Y146 HydrophobicContact CD1-CD2 3.75Å; L102-Y146 HydrophobicContact CD1-CE2 4.42Å; L102-Y146 HydrophobicContact CD1-CG 3.7Å
103W93.2Very high92.8Very high107 Ų10749 Ų4941%0.40524%0.239SC..Hα-helixtrans-66-46178.5-177.572.6000111.9R99 V100 V101 S106 S107 C202 W203R99-W103 PolarHBondContact O-N 3.37Å; V100-W103 PolarHBondContact O-N 3.34Å; V101-W103 PolarHBondContact O-N 3.47Å; W103-S106 PolarHBondContact O-N 2.96Å; W103-S107 WeakPolarHBondContact O-CB 3.48Å; W103-S107 PolarHBondContact O-N 3.2Å; W103-S107 PolarHBondContact O-OG 2.75Å; W103-C202 HydrophobicContact CB-CB 4.28Å; W103-C202 HydrophobicContact CG-CB 4.38Å; W103-W203 AromaticContact CD1-CD1 3.76Å; W103-W203 AromaticContact CD1-NE1 3.88Å; W103-W203 AromaticContact CE2-NE1 3.59Å; W103-W203 AromaticContact CZ2-NE1 3.91Å; W103-W203 AromaticContact NE1-CD1 3.45Å; W103-W203 AromaticContact NE1-NE1 3.11Å; W103-W203 VanDerWaalsContact NE1-NE1 3.11Å
104A94.1Very high93.1Very high38 Ų3850.4 Ų50.431%0.31425%0.246SC..Hα-helixtrans-62.8-44.2178.600000112V100 V101 S108V100-A104 WeakPolarHBondContact O-CB 3.5Å; V100-A104 PolarHBondContact O-N 3.36Å; V101-A104 PolarHBondContact O-N 2.95Å; A104-S108 VanDerWaalsContact O-CB 3.24Å; A104-S108 WeakPolarHBondContact O-CB 2.88Å; A104-S108 PolarHBondContact O-N 3.17Å; A104-S108 PolarHBondContact O-OG 3.37Å
105T94.6Very high93.6Very high0 Ų048.2 Ų48.20%024%0.241CC..Hα-helixtrans-69.7-42.9178.852.70000111.9F89 V101 L102 S107 S108 M109 V135F89-T105 HydrophobicContact CD1-CG2 3.51Å; F89-T105 HydrophobicContact CD2-CG2 4.32Å; F89-T105 HydrophobicContact CE1-CG2 3.62Å; F89-T105 HydrophobicContact CE2-CG2 4.41Å; F89-T105 HydrophobicContact CG-CG2 3.88Å; F89-T105 HydrophobicContact CZ-CG2 4.09Å; V101-T105 HydrophobicContact CG1-CG2 4.02Å; V101-T105 WeakPolarHBondContact O-CB 3.35Å; V101-T105 VanDerWaalsContact O-CG2 3.28Å; V101-T105 WeakPolarHBondContact O-CG2 3.33Å; V101-T105 PolarHBondContact O-N 3.05Å; V101-T105 PolarHBondContact O-OG1 3.35Å; L102-T105 PolarHBondContact O-OG1 3.45Å; T105-S107 PolarHBondContact O-N 3.5Å; T105-S108 PolarHBondContact O-N 2.7Å; T105-M109 WeakPolarHBondContact O-CB 3.24Å; T105-M109 PolarHBondContact O-N 3.34Å; T105-V135 HydrophobicContact CG2-CG1 4.26Å; T105-V135 WeakPolarHBondContact O-CG1 3.32Å
106S93.6Very high94Very high4 Ų440.6 Ų40.63%0.02821%0.212CC..Hα-helixtrans-61.5-44.5176.9-54.80000111.7L102 W103 M109 F110 Y139L102-S106 VanDerWaalsContact O-CB 3.26Å; L102-S106 WeakPolarHBondContact O-CB 3.28Å; L102-S106 PolarHBondContact O-N 3.32Å; L102-S106 PolarHBondContact O-OG 3.35Å; W103-S106 PolarHBondContact O-N 2.96Å; S106-M109 PolarHBondContact O-N 3.44Å; S106-F110 PolarHBondContact O-N 3Å; S106-Y139 WeakPolarHBondContact OG-CD2 3.39Å; S106-Y139 WeakPolarHBondContact OG-CE2 3.41Å
107S94.7Very high94.2Very high25 Ų2536.4 Ų36.418%0.17519%0.191CC..Hα-helixtrans-64.2-44.2177.3-55.30000111.6W103 T105 M109 F110 L111W103-S107 WeakPolarHBondContact O-CB 3.48Å; W103-S107 PolarHBondContact O-N 3.2Å; W103-S107 PolarHBondContact O-OG 2.75Å; T105-S107 PolarHBondContact O-N 3.5Å; S107-M109 VanDerWaalsContact C-N 3.33Å; S107-M109 PolarHBondContact O-N 2.92Å; S107-F110 PolarHBondContact O-N 2.83Å; S107-L111 WeakPolarHBondContact O-CG 3.1Å; S107-L111 PolarHBondContact O-N 2.85Å
108S95.5Very high94.5Very high37 Ų3743.3 Ų43.326%0.25922%0.221SC..Hα-helixtrans-66.5-34.1178.1-59.30000112.2A104 T105 L111 F112A104-S108 VanDerWaalsContact O-CB 3.24Å; A104-S108 WeakPolarHBondContact O-CB 2.88Å; A104-S108 PolarHBondContact O-N 3.17Å; A104-S108 PolarHBondContact O-OG 3.37Å; T105-S108 PolarHBondContact O-N 2.7Å; S108-L111 PolarHBondContact O-N 3.44Å; S108-F112 WeakPolarHBondContact O-CB 3.45Å; S108-F112 WeakPolarHBondContact O-CD2 3.41Å; S108-F112 PolarHBondContact O-N 3.47Å
109M94.8Very high94.6Very high34 Ų3442.5 Ų42.517%0.16722%0.219CC..Hα-helixtrans-62-46175.7-178.5-169.5-76.100110.7T105 S106 S107 G113 L132 V135 A136 Y139 T195T105-M109 WeakPolarHBondContact O-CB 3.24Å; T105-M109 PolarHBondContact O-N 3.34Å; S106-M109 PolarHBondContact O-N 3.44Å; S107-M109 VanDerWaalsContact C-N 3.33Å; S107-M109 PolarHBondContact O-N 2.92Å; M109-G113 PolarHBondContact O-N 2.89Å; M109-L132 HydrophobicContact CB-CD1 4.4Å; M109-L132 HydrophobicContact CG-CD1 3.71Å; M109-L132 VanDerWaalsContact O-CD1 3.24Å; M109-L132 WeakPolarHBondContact O-CD1 3.33Å; M109-V135 HydrophobicContact CB-CG1 4.05Å; M109-A136 VanDerWaalsContact CE-CA 3.41Å; M109-A136 HydrophobicContact CE-CB 3.58Å; M109-Y139 HydrophobicContact CE-CD1 3.96Å; M109-Y139 HydrophobicContact CE-CG 4.03Å; M109-T195 HydrophobicContact SD-CG2 3.94Å
110F95.4Very high94.5Very high59 Ų5943.8 Ų43.826%0.25924%0.238SC..Hα-helixtrans-59.3-51.7173.5174.9-99.9000111.1S106 S107 F112 G113 I114 S192 V196 I199S106-F110 PolarHBondContact O-N 3Å; S107-F110 PolarHBondContact O-N 2.83Å; F110-F112 PolarHBondContact O-N 2.95Å; F110-G113 PolarHBondContact O-N 3.27Å; F110-I114 HydrophobicContact CD1-CG1 4.43Å; F110-I114 HydrophobicContact CD2-CG1 4.23Å; F110-I114 HydrophobicContact CE1-CG1 4.1Å; F110-I114 HydrophobicContact CE2-CD1 3.95Å; F110-I114 HydrophobicContact CE2-CG1 3.87Å; F110-I114 HydrophobicContact CG-CG1 4.5Å; F110-I114 HydrophobicContact CZ-CD1 4.13Å; F110-I114 HydrophobicContact CZ-CG1 3.8Å; F110-I114 VanDerWaalsContact O-CG1 3.3Å; F110-I114 WeakPolarHBondContact O-CG1 3.44Å; F110-I114 PolarHBondContact O-N 3.46Å; F110-S192 WeakPolarHBondContact CD2-O 3.24Å; F110-V196 HydrophobicContact CD2-CG2 3.71Å; F110-V196 HydrophobicContact CE2-CG2 3.5Å; F110-V196 HydrophobicContact CZ-CG2 4.19Å; F110-I199 HydrophobicContact CB-CD1 3.67Å; F110-I199 HydrophobicContact CG-CD1 4.26Å
111L96.1Very high94.5Very high107 Ų10743.1 Ų43.156%0.5623%0.232SC*.Hα-helixtrans-59.2-50.9-177.6-68.6172.7000112.9S107 S108 G113 I114 A115S107-L111 WeakPolarHBondContact O-CG 3.1Å; S107-L111 PolarHBondContact O-N 2.85Å; S108-L111 PolarHBondContact O-N 3.44Å; L111-G113 VanDerWaalsContact C-N 3.29Å; L111-G113 PolarHBondContact O-N 3.48Å; L111-I114 PolarHBondContact O-N 2.83Å; L111-A115 WeakPolarHBondContact O-CB 3.42Å; L111-A115 PolarHBondContact O-N 3.31Å
112F97.1Very high94.5Very high64 Ų6443.7 Ų43.728%0.28123%0.233SC..Hα-helixtrans-68.7-29.9178.7-68.7-55.8000112.4S108 F110 A115 A116 F131 L132 V135S108-F112 WeakPolarHBondContact O-CB 3.45Å; S108-F112 WeakPolarHBondContact O-CD2 3.41Å; S108-F112 PolarHBondContact O-N 3.47Å; F110-F112 PolarHBondContact O-N 2.95Å; F112-A115 PolarHBondContact O-N 3.38Å; F112-A116 WeakPolarHBondContact O-CB 3.36Å; F112-A116 PolarHBondContact O-N 3.06Å; F112-F131 HydrophobicContact CD1-CB 3.9Å; F112-F131 HydrophobicContact CD2-CB 3.89Å; F112-F131 HydrophobicContact CE1-CB 3.84Å; F112-F131 HydrophobicContact CE1-CD2 4.4Å; F112-F131 HydrophobicContact CE1-CG 4.28Å; F112-F131 HydrophobicContact CE2-CB 3.84Å; F112-F131 HydrophobicContact CG-CB 3.94Å; F112-F131 HydrophobicContact CZ-CB 3.81Å; F112-F131 HydrophobicContact CZ-CG 4.23Å; F112-L132 HydrophobicContact CB-CB 3.93Å; F112-L132 HydrophobicContact CB-CD1 4.39Å; F112-V135 HydrophobicContact CD2-CG2 4.06Å; F112-V135 HydrophobicContact CE2-CG2 4.01Å
113G95.6Very high94.6Very high0 Ų051.4 Ų51.40%026%0.263CS..Hα-helixtrans-64.4-46.4173.700000112.5M109 F110 L111 A116 A117 Q188 S192M109-G113 PolarHBondContact O-N 2.89Å; F110-G113 PolarHBondContact O-N 3.27Å; L111-G113 VanDerWaalsContact C-N 3.29Å; L111-G113 PolarHBondContact O-N 3.48Å; G113-A116 PolarHBondContact O-N 2.65Å; G113-A117 PolarHBondContact O-N 3.18Å; G113-Q188 VanDerWaalsContact O-CG 3.25Å; G113-Q188 WeakPolarHBondContact O-CG 3.02Å; G113-Q188 PolarHBondContact O-NE2 3.4Å; G113-S192 VanDerWaalsContact C-OG 3.26Å; G113-S192 VanDerWaalsContact CA-OG 3.27Å; G113-S192 WeakPolarHBondContact CA-OG 3.39Å
114I96Very high94.7Very high33 Ų3349.7 Ų49.717%0.16927%0.265CS..Hα-helixtrans-65.5-44.8174-60.7-63.2000110.5F110 L111 A116 A117 F118 M189F110-I114 HydrophobicContact CD1-CG1 4.43Å; F110-I114 HydrophobicContact CD2-CG1 4.23Å; F110-I114 HydrophobicContact CE1-CG1 4.1Å; F110-I114 HydrophobicContact CE2-CD1 3.95Å; F110-I114 HydrophobicContact CE2-CG1 3.87Å; F110-I114 HydrophobicContact CG-CG1 4.5Å; F110-I114 HydrophobicContact CZ-CD1 4.13Å; F110-I114 HydrophobicContact CZ-CG1 3.8Å; F110-I114 VanDerWaalsContact O-CG1 3.3Å; F110-I114 WeakPolarHBondContact O-CG1 3.44Å; F110-I114 PolarHBondContact O-N 3.46Å; L111-I114 PolarHBondContact O-N 2.83Å; I114-A116 VanDerWaalsContact C-N 3.28Å; I114-A116 PolarHBondContact O-N 3.19Å; I114-A117 WeakPolarHBondContact O-CB 3.38Å; I114-A117 PolarHBondContact O-N 3.38Å; I114-F118 HydrophobicContact CG2-CD2 3.78Å; I114-F118 HydrophobicContact CG2-CE2 3.78Å; I114-F118 WeakPolarHBondContact O-CD2 3.31Å; I114-F118 PolarHBondContact O-N 2.69Å; I114-M189 HydrophobicContact CB-SD 4.41Å; I114-M189 HydrophobicContact CD1-CE 3.54Å; I114-M189 HydrophobicContact CD1-SD 3.37Å; I114-M189 WeakPolarHBondContact CD1-SD 3.31Å; I114-M189 HydrophobicContact CG1-SD 4.44Å; I114-M189 HydrophobicContact CG2-CE 4.42Å; I114-M189 HydrophobicContact CG2-SD 4.02Å
115A96.1Very high94.7Very high45 Ų4547.9 Ų47.937%0.37225%0.25SS..Hα-helixtrans-58.3-39.2177.500000112.4L111 F112 A117 F118 A119 A128L111-A115 WeakPolarHBondContact O-CB 3.42Å; L111-A115 PolarHBondContact O-N 3.31Å; F112-A115 PolarHBondContact O-N 3.38Å; A115-A117 VanDerWaalsContact C-N 3.29Å; A115-A117 PolarHBondContact O-N 3.07Å; A115-F118 PolarHBondContact O-N 3.15Å; A115-A119 PolarHBondContact O-N 2.68Å; A115-A128 HydrophobicContact CB-CB 4.39Å
116A95.3Very high94.8Very high0 Ų048.4 Ų48.40%025%0.253CS..Hα-helixtrans-64.5-32.7175.800000112.6F112 G113 I114 A128 W184 Q188F112-A116 WeakPolarHBondContact O-CB 3.36Å; F112-A116 PolarHBondContact O-N 3.06Å; G113-A116 PolarHBondContact O-N 2.65Å; I114-A116 VanDerWaalsContact C-N 3.28Å; I114-A116 PolarHBondContact O-N 3.19Å; A116-A128 HydrophobicContact CB-CB 3.86Å; A116-W184 WeakPolarHBondContact O-CZ3 3.48Å; A116-Q188 HydrophobicContact CB-CG 4.32Å
117A94.8Very high94.9Very high8 Ų850.3 Ų50.37%0.06627%0.269CS..Hα-helixtrans-72.1-32.9177.300000113G113 I114 A115 W185 Q188 M189G113-A117 PolarHBondContact O-N 3.18Å; I114-A117 WeakPolarHBondContact O-CB 3.38Å; I114-A117 PolarHBondContact O-N 3.38Å; A115-A117 VanDerWaalsContact C-N 3.29Å; A115-A117 PolarHBondContact O-N 3.07Å; A117-W185 HydrophobicContact CB-CB 4.41Å; A117-W185 WeakPolarHBondContact O-CB 3.44Å; A117-Q188 HydrophobicContact CB-CB 4.05Å; A117-Q188 HydrophobicContact CB-CG 3.95Å; A117-M189 HydrophobicContact CB-CG 3.6Å; A117-M189 HydrophobicContact CB-SD 3.64Å
118F94.2Very high95Very high144 Ų14449.6 Ų49.663%0.63226%0.264SS*.THydrogen-bonded Turntrans-92.28.2178.6-72.8-75.9000113.9I114 A115 V120 M189I114-F118 HydrophobicContact CG2-CD2 3.78Å; I114-F118 HydrophobicContact CG2-CE2 3.78Å; I114-F118 WeakPolarHBondContact O-CD2 3.31Å; I114-F118 PolarHBondContact O-N 2.69Å; A115-F118 PolarHBondContact O-N 3.15Å; F118-V120 PolarHBondContact O-N 3.17Å; F118-M189 HydrophobicContact CD2-SD 4.23Å; F118-M189 HydrophobicContact CE2-CE 3.87Å; F118-M189 HydrophobicContact CE2-SD 3.63Å; F118-M189 HydrophobicContact CZ-CE 4.29Å; F118-M189 HydrophobicContact CZ-SD 4.36Å
119A93.9Very high95Very high5 Ų550.8 Ų50.84%0.04126%0.263CS..  trans-62.2125.2179.900000111.2W61 A115 T124 F125W61-A119 HydrophobicContact CZ2-CB 4.41Å; A115-A119 PolarHBondContact O-N 2.68Å; A119-T124 HydrophobicContact CB-CG2 4.3Å; A119-F125 VanDerWaalsContact CB-CA 3.49Å; A119-F125 HydrophobicContact CB-CB 3.58Å; A119-F125 HydrophobicContact CB-CD2 4.32Å; A119-F125 HydrophobicContact CB-CG 4.47Å
120V90.6Very high95.1Very high125 Ų12550.7 Ų50.776%0.75826%0.261SS*.  trans-85.3-41-179.6-178.30000110.4W61 F118W61-V120 PolarHBondContact NE1-O 2.74Å; F118-V120 PolarHBondContact O-N 3.17Å
121D93.4Very high95.2Very high61 Ų6152.1 Ų52.133%0.32627%0.268SS..SBendtrans-112.8157.5179.769.9-80.6000112.5Y123 T124 F125D121-Y123 VanDerWaalsContact C-N 3.3Å; D121-Y123 PolarHBondContact O-N 2.99Å; D121-Y123 WeakPolarHBondContact OD2-CA 3.42Å; D121-Y123 WeakPolarHBondContact OD2-CB 3.37Å; D121-Y123 PolarHBondContact OD2-N 3.07Å; D121-T124 WeakPolarHBondContact OD1-CB 3.47Å; D121-T124 PolarHBondContact OD1-OG1 3.18Å; D121-T124 PolarHBondContact OD2-N 3.28Å; D121-T124 PolarHBondContact OD2-OG1 3.37Å; D121-F125 PolarHBondContact O-N 3.15Å
122Y92.8Very high95.2Very high17 Ų1748 Ų487%0.06725%0.246CC..Hα-helixtrans-60-36-179.6166.8-94.5000113.2W61 L63 L70 I74 F125 M126W61-Y122 HydrophobicContact CE3-CD2 4.4Å; L63-Y122 HydrophobicContact CD1-CD2 3.7Å; L63-Y122 HydrophobicContact CD1-CE2 3.71Å; L63-Y122 HydrophobicContact CD2-CD2 3.9Å; L63-Y122 HydrophobicContact CD2-CE2 4.2Å; L63-Y122 HydrophobicContact CD2-CG 4.39Å; L63-Y122 HydrophobicContact CG-CD2 4.43Å; L70-Y122 WeakPolarHBondContact CA-OH 3.28Å; L70-Y122 HydrophobicContact CB-CE1 4.24Å; L70-Y122 HydrophobicContact CB-CE2 4.08Å; L70-Y122 WeakPolarHBondContact CB-OH 3.3Å; L70-Y122 HydrophobicContact CD1-CE1 4.4Å; L70-Y122 HydrophobicContact CD2-CE1 3.75Å; L70-Y122 HydrophobicContact CG-CE1 4.36Å; L70-Y122 PolarHBondContact O-OH 3.42Å; I74-Y122 HydrophobicContact CD1-CE2 4.45Å; I74-Y122 HydrophobicContact CG1-CE2 4.25Å; Y122-F125 WeakPolarHBondContact O-CB 3.36Å; Y122-F125 PolarHBondContact O-N 3.22Å; Y122-M126 HydrophobicContact CE1-CE 4.12Å; Y122-M126 HydrophobicContact CE2-CE 3.61Å; Y122-M126 WeakPolarHBondContact O-CB 3.23Å; Y122-M126 PolarHBondContact O-N 3.02Å; Y122-M126 WeakPolarHBondContact OH-CE 3.27Å
123Y94.7Very high95.1Very high166 Ų16644.9 Ų44.965%0.65123%0.232SC*.Hα-helixtrans-74.1-41.7-175.6-62.6-75.8000111.4D121 F125 M126 A127D121-Y123 VanDerWaalsContact C-N 3.3Å; D121-Y123 PolarHBondContact O-N 2.99Å; D121-Y123 WeakPolarHBondContact OD2-CA 3.42Å; D121-Y123 WeakPolarHBondContact OD2-CB 3.37Å; D121-Y123 PolarHBondContact OD2-N 3.07Å; Y123-F125 VanDerWaalsContact C-N 3.34Å; Y123-M126 PolarHBondContact O-N 3.46Å; Y123-A127 WeakPolarHBondContact O-CB 3.39Å; Y123-A127 PolarHBondContact O-N 3.32Å
124T95.3Very high95.1Very high71 Ų7146 Ų4644%0.43624%0.238SC..Hα-helixtrans-61.7-42.4170.7-62.80000111A119 D121 M126 A127 A128A119-T124 HydrophobicContact CB-CG2 4.3Å; D121-T124 WeakPolarHBondContact OD1-CB 3.47Å; D121-T124 PolarHBondContact OD1-OG1 3.18Å; D121-T124 PolarHBondContact OD2-N 3.28Å; D121-T124 PolarHBondContact OD2-OG1 3.37Å; T124-M126 VanDerWaalsContact C-N 3.33Å; T124-M126 PolarHBondContact O-N 3.05Å; T124-A127 PolarHBondContact O-N 3.46Å; T124-A128 WeakPolarHBondContact O-CB 3.24Å; T124-A128 PolarHBondContact O-N 3.46Å
125F95Very high95.1Very high1 Ų144.7 Ų44.70%0.00423%0.231CC..Hα-helixtrans-57.9-47.2173.8171.7-103.7000111.6A57 W61 I74 A119 D121 Y122 Y123 A128 R129 W184A57-F125 HydrophobicContact CB-CE1 4.27Å; A57-F125 HydrophobicContact CB-CZ 4.13Å; W61-F125 HydrophobicContact CH2-CB 3.42Å; W61-F125 VanDerWaalsContact CH2-CB 3.42Å; W61-F125 AromaticContact CH2-CD1 4Å; W61-F125 HydrophobicContact CH2-CD1 4Å; W61-F125 AromaticContact CH2-CD2 3.65Å; W61-F125 HydrophobicContact CH2-CD2 3.65Å; W61-F125 HydrophobicContact CH2-CE2 4.4Å; W61-F125 AromaticContact CH2-CG 3.41Å; W61-F125 HydrophobicContact CH2-CG 3.41Å; W61-F125 VanDerWaalsContact CH2-CG 3.41Å; W61-F125 HydrophobicContact CZ2-CB 3.98Å; W61-F125 HydrophobicContact CZ2-CG 4.42Å; W61-F125 HydrophobicContact CZ3-CB 3.91Å; W61-F125 AromaticContact CZ3-CD1 3.65Å; W61-F125 HydrophobicContact CZ3-CD1 3.65Å; W61-F125 HydrophobicContact CZ3-CD2 4.02Å; W61-F125 HydrophobicContact CZ3-CE1 4.13Å; W61-F125 HydrophobicContact CZ3-CE2 4.46Å; W61-F125 AromaticContact CZ3-CG 3.58Å; W61-F125 HydrophobicContact CZ3-CG 3.58Å; I74-F125 HydrophobicContact CD1-CE1 4.39Å; I74-F125 HydrophobicContact CG2-CE1 4.48Å; A119-F125 VanDerWaalsContact CB-CA 3.49Å; A119-F125 HydrophobicContact CB-CB 3.58Å; A119-F125 HydrophobicContact CB-CD2 4.32Å; A119-F125 HydrophobicContact CB-CG 4.47Å; D121-F125 PolarHBondContact O-N 3.15Å; Y122-F125 WeakPolarHBondContact O-CB 3.36Å; Y122-F125 PolarHBondContact O-N 3.22Å; Y123-F125 VanDerWaalsContact C-N 3.34Å; F125-A128 PolarHBondContact O-N 3.25Å; F125-R129 HydrophobicContact CD1-CG 4.39Å; F125-R129 HydrophobicContact CD2-CG 4.26Å; F125-R129 HydrophobicContact CE1-CG 3.99Å; F125-R129 HydrophobicContact CE2-CG 3.85Å; F125-R129 HydrophobicContact CZ-CG 3.71Å; F125-R129 WeakPolarHBondContact O-CB 3.12Å; F125-R129 WeakPolarHBondContact O-CG 3.27Å; F125-R129 PolarHBondContact O-N 3.25Å; F125-W184 HydrophobicContact CD2-CH2 4.09Å; F125-W184 AromaticContact CD2-CZ3 3.91Å; F125-W184 HydrophobicContact CD2-CZ3 3.91Å; F125-W184 HydrophobicContact CE2-CE3 4.18Å; F125-W184 HydrophobicContact CE2-CH2 4.2Å; F125-W184 AromaticContact CE2-CZ3 3.6Å; F125-W184 HydrophobicContact CE2-CZ3 3.6Å
126M95.3Very high94.9Very high11 Ų1143.7 Ų43.75%0.05422%0.223CC..Hα-helixtrans-64.6-44.8-179.6-170.766.673.100112.1I74 L77 Y122 Y123 T124 R129 F130I74-M126 HydrophobicContact CB-CE 4.09Å; I74-M126 HydrophobicContact CB-SD 4.5Å; I74-M126 HydrophobicContact CG1-CE 3.45Å; I74-M126 VanDerWaalsContact CG1-CE 3.45Å; I74-M126 HydrophobicContact CG1-SD 4.37Å; L77-M126 HydrophobicContact CB-SD 4.25Å; L77-M126 HydrophobicContact CD2-CG 3.35Å; L77-M126 HydrophobicContact CD2-SD 3.69Å; L77-M126 HydrophobicContact CG-CG 4.41Å; L77-M126 HydrophobicContact CG-SD 4.3Å; Y122-M126 HydrophobicContact CE1-CE 4.12Å; Y122-M126 HydrophobicContact CE2-CE 3.61Å; Y122-M126 WeakPolarHBondContact O-CB 3.23Å; Y122-M126 PolarHBondContact O-N 3.02Å; Y122-M126 WeakPolarHBondContact OH-CE 3.27Å; Y123-M126 PolarHBondContact O-N 3.46Å; T124-M126 VanDerWaalsContact C-N 3.33Å; T124-M126 PolarHBondContact O-N 3.05Å; M126-R129 PolarHBondContact O-N 2.75Å; M126-F130 WeakPolarHBondContact O-CB 3.36Å; M126-F130 PolarHBondContact O-N 3.11Å
127A96.6Very high94.7Very high44 Ų4443.9 Ų43.936%0.36423%0.225SC..Hα-helixtrans-61.1-47177.200000111Y123 T124 R129 F130 F131Y123-A127 WeakPolarHBondContact O-CB 3.39Å; Y123-A127 PolarHBondContact O-N 3.32Å; T124-A127 PolarHBondContact O-N 3.46Å; A127-R129 PolarHBondContact O-N 3.12Å; A127-F130 WeakPolarHBondContact O-CB 3.34Å; A127-F130 PolarHBondContact O-N 2.97Å; A127-F131 WeakPolarHBondContact O-CD2 3.47Å; A127-F131 PolarHBondContact O-N 3.42Å
128A96.6Very high94.4Very high9 Ų943.5 Ų43.57%0.07422%0.222CC..Hα-helixtrans-60.7-44.2176.500000111.8A115 A116 T124 F125 F130 F131 L132A115-A128 HydrophobicContact CB-CB 4.39Å; A116-A128 HydrophobicContact CB-CB 3.86Å; T124-A128 WeakPolarHBondContact O-CB 3.24Å; T124-A128 PolarHBondContact O-N 3.46Å; F125-A128 PolarHBondContact O-N 3.25Å; A128-F130 PolarHBondContact O-N 3.13Å; A128-F131 PolarHBondContact O-N 3.35Å; A128-L132 WeakPolarHBondContact O-CB 3.29Å; A128-L132 PolarHBondContact O-N 3.5Å
129R95Very high94.3Very high62 Ų6239.9 Ų39.923%0.23420%0.204CC..Hα-helixtrans-61.7-40.2174.8-80.1-67.8-146.9111.23112.7F125 M126 A127 A133F125-R129 HydrophobicContact CD1-CG 4.39Å; F125-R129 HydrophobicContact CD2-CG 4.26Å; F125-R129 HydrophobicContact CE1-CG 3.99Å; F125-R129 HydrophobicContact CE2-CG 3.85Å; F125-R129 HydrophobicContact CZ-CG 3.71Å; F125-R129 WeakPolarHBondContact O-CB 3.12Å; F125-R129 WeakPolarHBondContact O-CG 3.27Å; F125-R129 PolarHBondContact O-N 3.25Å; M126-R129 PolarHBondContact O-N 2.75Å; A127-R129 PolarHBondContact O-N 3.12Å; R129-A133 WeakPolarHBondContact O-CB 3.41Å; R129-A133 PolarHBondContact O-N 3.39Å
130F96.5Very high94.1Very high32 Ų3244 Ų4414%0.1423%0.225CC..Hα-helixtrans-64.2-49.6178172.1-101.6000111.6L77 F80 L84 M126 A127 A128 A133 M134L77-F130 HydrophobicContact CD1-CD2 3.78Å; L77-F130 HydrophobicContact CD1-CE2 4.14Å; L77-F130 HydrophobicContact CG-CD2 4.08Å; L77-F130 WeakPolarHBondContact O-CD2 3.44Å; F80-F130 AromaticContact CD1-CE2 3.65Å; F80-F130 HydrophobicContact CD1-CE2 3.65Å; F80-F130 HydrophobicContact CD1-CZ 4.3Å; F80-F130 HydrophobicContact CE1-CE2 4.2Å; F80-F130 HydrophobicContact CE1-CZ 4.41Å; L84-F130 HydrophobicContact CD2-CZ 4.2Å; M126-F130 WeakPolarHBondContact O-CB 3.36Å; M126-F130 PolarHBondContact O-N 3.11Å; A127-F130 WeakPolarHBondContact O-CB 3.34Å; A127-F130 PolarHBondContact O-N 2.97Å; A128-F130 PolarHBondContact O-N 3.13Å; F130-A133 WeakPolarHBondContact O-CB 3.41Å; F130-A133 PolarHBondContact O-N 2.98Å; F130-M134 HydrophobicContact CD1-CE 4Å; F130-M134 HydrophobicContact CE1-CE 3.18Å; F130-M134 HydrophobicContact CE2-CE 4.37Å; F130-M134 HydrophobicContact CZ-CE 3.41Å; F130-M134 VanDerWaalsContact CZ-CE 3.41Å; F130-M134 PolarHBondContact O-N 3.34Å
131F97.5Very high93.8Very high90 Ų9040.3 Ų40.340%0.39520%0.203SC..Hα-helixtrans-67.1-38.1177.1-71.1-62.5000112.2F112 A127 A128 A133 M134 V135F112-F131 HydrophobicContact CD1-CB 3.9Å; F112-F131 HydrophobicContact CD2-CB 3.89Å; F112-F131 HydrophobicContact CE1-CB 3.84Å; F112-F131 HydrophobicContact CE1-CD2 4.4Å; F112-F131 HydrophobicContact CE1-CG 4.28Å; F112-F131 HydrophobicContact CE2-CB 3.84Å; F112-F131 HydrophobicContact CG-CB 3.94Å; F112-F131 HydrophobicContact CZ-CB 3.81Å; F112-F131 HydrophobicContact CZ-CG 4.23Å; A127-F131 WeakPolarHBondContact O-CD2 3.47Å; A127-F131 PolarHBondContact O-N 3.42Å; A128-F131 PolarHBondContact O-N 3.35Å; F131-A133 VanDerWaalsContact C-N 3.31Å; F131-A133 PolarHBondContact O-N 2.92Å; F131-M134 HydrophobicContact CD1-CE 4.04Å; F131-M134 HydrophobicContact CE1-CE 4.21Å; F131-M134 PolarHBondContact O-N 3.33Å; F131-V135 WeakPolarHBondContact O-CB 3.36Å; F131-V135 VanDerWaalsContact O-CG2 3.29Å; F131-V135 WeakPolarHBondContact O-CG2 3.4Å; F131-V135 PolarHBondContact O-N 3.01Å
132L96.6Very high93.7Very high19 Ų1937.4 Ų37.410%0.09919%0.187CC..Hα-helixtrans-55.7-47.1171.317763.5000111.1M109 F112 A128 V135 A136M109-L132 HydrophobicContact CB-CD1 4.4Å; M109-L132 HydrophobicContact CG-CD1 3.71Å; M109-L132 VanDerWaalsContact O-CD1 3.24Å; M109-L132 WeakPolarHBondContact O-CD1 3.33Å; F112-L132 HydrophobicContact CB-CB 3.93Å; F112-L132 HydrophobicContact CB-CD1 4.39Å; A128-L132 WeakPolarHBondContact O-CB 3.29Å; A128-L132 PolarHBondContact O-N 3.5Å; L132-V135 PolarHBondContact O-N 3.15Å; L132-A136 WeakPolarHBondContact O-CB 3.37Å; L132-A136 PolarHBondContact O-N 3.34Å
133A95.4Very high93.5Very high0 Ų037.4 Ų37.40%019%0.192CC..Hα-helixtrans-64.2-42179.300000112.6F78 V82 R129 F130 F131 A136 S137F78-A133 HydrophobicContact CD1-CB 3.91Å; F78-A133 HydrophobicContact CD2-CB 3.52Å; F78-A133 HydrophobicContact CE1-CB 3.89Å; F78-A133 HydrophobicContact CE2-CB 3.49Å; F78-A133 VanDerWaalsContact CE2-CB 3.49Å; F78-A133 HydrophobicContact CG-CB 3.73Å; F78-A133 HydrophobicContact CZ-CB 3.68Å; F78-A133 VanDerWaalsContact O-CB 3.22Å; F78-A133 WeakPolarHBondContact O-CB 3.45Å; V82-A133 HydrophobicContact CG2-CB 4.02Å; R129-A133 WeakPolarHBondContact O-CB 3.41Å; R129-A133 PolarHBondContact O-N 3.39Å; F130-A133 WeakPolarHBondContact O-CB 3.41Å; F130-A133 PolarHBondContact O-N 2.98Å; F131-A133 VanDerWaalsContact C-N 3.31Å; F131-A133 PolarHBondContact O-N 2.92Å; A133-A136 PolarHBondContact O-N 3.03Å; A133-S137 WeakPolarHBondContact O-CB 3.32Å; A133-S137 PolarHBondContact O-N 3.38Å
134M95.4Very high93.1Very high22 Ų2233.3 Ų33.311%0.10818%0.178CC..Hα-helixtrans-60.1-50.3177-169.2-172.7-5300111.3G81 L84 G85 F89 F130 F131 S137 G138G81-M134 VanDerWaalsContact O-CA 3.22Å; G81-M134 WeakPolarHBondContact O-CA 3.07Å; L84-M134 HydrophobicContact CB-CE 4.48Å; L84-M134 HydrophobicContact CD2-CE 3.66Å; L84-M134 HydrophobicContact CD2-SD 4.32Å; L84-M134 HydrophobicContact CG-CE 4.21Å; L84-M134 HydrophobicContact CG-SD 4.36Å; G85-M134 VanDerWaalsContact CA-O 3.23Å; G85-M134 WeakPolarHBondContact CA-O 3.5Å; F89-M134 HydrophobicContact CE2-CG 4.18Å; F130-M134 HydrophobicContact CD1-CE 4Å; F130-M134 HydrophobicContact CE1-CE 3.18Å; F130-M134 HydrophobicContact CE2-CE 4.37Å; F130-M134 HydrophobicContact CZ-CE 3.41Å; F130-M134 VanDerWaalsContact CZ-CE 3.41Å; F130-M134 PolarHBondContact O-N 3.34Å; F131-M134 HydrophobicContact CD1-CE 4.04Å; F131-M134 HydrophobicContact CE1-CE 4.21Å; F131-M134 PolarHBondContact O-N 3.33Å; M134-S137 PolarHBondContact O-N 2.83Å; M134-G138 PolarHBondContact O-N 3.39Å; M134-G138 VanDerWaalsContact O-N 3.09Å
135V96Very high92.7Very high6 Ų632 Ų324%0.03617%0.17CC..Hα-helixtrans-66.4-40.1178.6172.60000111.4F89 T105 M109 F112 F131 L132 S137 G138 Y139F89-V135 HydrophobicContact CE2-CG2 4.13Å; F89-V135 HydrophobicContact CZ-CG2 4.07Å; T105-V135 HydrophobicContact CG2-CG1 4.26Å; T105-V135 WeakPolarHBondContact O-CG1 3.32Å; M109-V135 HydrophobicContact CB-CG1 4.05Å; F112-V135 HydrophobicContact CD2-CG2 4.06Å; F112-V135 HydrophobicContact CE2-CG2 4.01Å; F131-V135 WeakPolarHBondContact O-CB 3.36Å; F131-V135 VanDerWaalsContact O-CG2 3.29Å; F131-V135 WeakPolarHBondContact O-CG2 3.4Å; F131-V135 PolarHBondContact O-N 3.01Å; L132-V135 PolarHBondContact O-N 3.15Å; V135-S137 VanDerWaalsContact C-N 3.34Å; V135-S137 PolarHBondContact O-N 3.47Å; V135-G138 PolarHBondContact O-N 2.7Å; V135-Y139 WeakPolarHBondContact O-CB 3.41Å; V135-Y139 PolarHBondContact O-N 3.06Å
136A93Very high92.5Very high25 Ų2533 Ų3321%0.20717%0.174CC..Hα-helixtrans-63.2-40.2179.200000113.1M109 L132 A133 Y139 L140M109-A136 VanDerWaalsContact CE-CA 3.41Å; M109-A136 HydrophobicContact CE-CB 3.58Å; L132-A136 WeakPolarHBondContact O-CB 3.37Å; L132-A136 PolarHBondContact O-N 3.34Å; A133-A136 PolarHBondContact O-N 3.03Å; A136-Y139 PolarHBondContact O-N 3.1Å; A136-L140 PolarHBondContact O-N 3.5Å
137S90.3Very high92.3Very high4 Ų434.6 Ų34.63%0.02818%0.184CC..Hα-helixtrans-65.7-43.7174.1-171.40000111.8V82 A133 M134 V135 Y139 L140 V141V82-S137 WeakPolarHBondContact CG1-OG 3.31Å; V82-S137 WeakPolarHBondContact O-CB 3.44Å; V82-S137 PolarHBondContact O-OG 3.22Å; A133-S137 WeakPolarHBondContact O-CB 3.32Å; A133-S137 PolarHBondContact O-N 3.38Å; M134-S137 PolarHBondContact O-N 2.83Å; V135-S137 VanDerWaalsContact C-N 3.34Å; V135-S137 PolarHBondContact O-N 3.47Å; S137-Y139 PolarHBondContact O-N 2.88Å; S137-L140 PolarHBondContact O-N 3.02Å; S137-V141 WeakPolarHBondContact O-CG2 3.41Å; S137-V141 PolarHBondContact O-N 3.2Å
138G89.2Confident91.7Very high0 Ų033.2 Ų33.20%017%0.17CC..Hα-helixtrans-57.7-47.9174.500000112.3F89 M134 V135 L140 V141 V142F89-G138 VanDerWaalsContact CB-CA 3.49Å; M134-G138 PolarHBondContact O-N 3.39Å; M134-G138 VanDerWaalsContact O-N 3.09Å; V135-G138 PolarHBondContact O-N 2.7Å; G138-L140 VanDerWaalsContact C-N 3.34Å; G138-L140 PolarHBondContact O-N 3.31Å; G138-V141 PolarHBondContact O-N 3.39Å; G138-V142 WeakPolarHBondContact O-CB 3.43Å; G138-V142 VanDerWaalsContact O-CG2 3.27Å; G138-V142 WeakPolarHBondContact O-CG2 3.19Å; G138-V142 PolarHBondContact O-N 2.94Å
139Y91.8Very high91.2Very high67 Ų6734.2 Ų34.226%0.26317%0.173SC..Hα-helixtrans-53.7-48.2173.9170.4-95.3000112.2L102 S106 M109 V135 A136 S137 G143 F198L102-Y139 HydrophobicContact CD2-CD2 3.94Å; L102-Y139 HydrophobicContact CD2-CE2 4.05Å; S106-Y139 WeakPolarHBondContact OG-CD2 3.39Å; S106-Y139 WeakPolarHBondContact OG-CE2 3.41Å; M109-Y139 HydrophobicContact CE-CD1 3.96Å; M109-Y139 HydrophobicContact CE-CG 4.03Å; V135-Y139 WeakPolarHBondContact O-CB 3.41Å; V135-Y139 PolarHBondContact O-N 3.06Å; A136-Y139 PolarHBondContact O-N 3.1Å; S137-Y139 PolarHBondContact O-N 2.88Å; Y139-G143 WeakPolarHBondContact O-CA 3.43Å; Y139-G143 PolarHBondContact O-N 3.48Å; Y139-F198 HydrophobicContact CE2-CD1 4.05Å; Y139-F198 AromaticContact CE2-CE1 3.52Å; Y139-F198 HydrophobicContact CE2-CE1 3.52Å; Y139-F198 HydrophobicContact CE2-CZ 4.13Å
140L88.4Confident90.9Very high92 Ų9233.6 Ų33.648%0.48217%0.172SC..Hα-helixtrans-61.4-46.5-180-111.4169.1000112.2A136 S137 G138 F144 F167A136-L140 PolarHBondContact O-N 3.5Å; S137-L140 PolarHBondContact O-N 3.02Å; G138-L140 VanDerWaalsContact C-N 3.34Å; G138-L140 PolarHBondContact O-N 3.31Å; L140-F144 WeakPolarHBondContact O-CB 3.25Å; L140-F144 PolarHBondContact O-N 2.86Å; L140-F167 HydrophobicContact CD1-CD2 4.49Å; L140-F167 HydrophobicContact CD1-CE2 4.48Å
141V86.1Confident90.5Very high47 Ų4734.3 Ų34.329%0.28518%0.177SC..Hα-helixtrans-65-49.4-179.41720000110.8S137 G138 F144 V145S137-V141 WeakPolarHBondContact O-CG2 3.41Å; S137-V141 PolarHBondContact O-N 3.2Å; G138-V141 PolarHBondContact O-N 3.39Å; V141-F144 PolarHBondContact O-N 3.5Å; V141-V145 WeakPolarHBondContact O-CG2 3.25Å; V141-V145 PolarHBondContact O-N 3.48Å; V141-V145 VanDerWaalsContact O-N 3.1Å
142V89.9Confident89.6Confident1 Ų132.4 Ų32.41%0.00618%0.183CC..Hα-helixtrans-69.5-38.7-177.5-177.80000111.1S93 R98 V101 L102 G138 F144 V145 Y146S93-V142 WeakPolarHBondContact OG-CG1 3.3Å; R98-V142 HydrophobicContact CB-CG1 4.14Å; R98-V142 HydrophobicContact CG-CG1 4.34Å; V101-V142 HydrophobicContact CB-CG1 4.42Å; V101-V142 HydrophobicContact CG1-CG1 4.46Å; V101-V142 HydrophobicContact CG1-CG2 3.85Å; L102-V142 HydrophobicContact CD1-CG1 4.35Å; L102-V142 HydrophobicContact CD2-CB 4.33Å; L102-V142 HydrophobicContact CD2-CG1 4.24Å; L102-V142 HydrophobicContact CG-CB 4.36Å; L102-V142 HydrophobicContact CG-CG1 3.74Å; G138-V142 WeakPolarHBondContact O-CB 3.43Å; G138-V142 VanDerWaalsContact O-CG2 3.27Å; G138-V142 WeakPolarHBondContact O-CG2 3.19Å; G138-V142 PolarHBondContact O-N 2.94Å; V142-F144 VanDerWaalsContact C-N 3.33Å; V142-F144 PolarHBondContact O-N 3.44Å; V142-V145 PolarHBondContact O-N 3.21Å; V142-Y146 VanDerWaalsContact O-CB 3.28Å; V142-Y146 WeakPolarHBondContact O-CB 3.4Å; V142-Y146 PolarHBondContact O-N 2.94Å
143G90.1Very high88.6Confident16 Ų1639 Ų3917%0.16522%0.215CC..Hα-helixtrans-62.4-40.417600000112.3Y139 V147Y139-G143 WeakPolarHBondContact O-CA 3.43Å; Y139-G143 PolarHBondContact O-N 3.48Å; G143-V147 WeakPolarHBondContact O-CG2 3.32Å; G143-V147 PolarHBondContact O-N 2.88Å; G143-V147 VanDerWaalsContact O-N 3.12Å
144F85.9Confident87.9Confident80 Ų8048.9 Ų48.935%0.35126%0.258SS..Hα-helixtrans-61-50.4173.3179.6-90.8000111.7L140 V141 V142 Y146 V147 M148 L163L140-F144 WeakPolarHBondContact O-CB 3.25Å; L140-F144 PolarHBondContact O-N 2.86Å; V141-F144 PolarHBondContact O-N 3.5Å; V142-F144 VanDerWaalsContact C-N 3.33Å; V142-F144 PolarHBondContact O-N 3.44Å; F144-Y146 PolarHBondContact O-N 3.45Å; F144-V147 PolarHBondContact O-N 3.31Å; F144-M148 HydrophobicContact CD1-CG 4.1Å; F144-M148 HydrophobicContact CD2-CE 4.15Å; F144-M148 HydrophobicContact CE1-CE 4.4Å; F144-M148 HydrophobicContact CE1-CG 3.74Å; F144-M148 HydrophobicContact CE2-CE 3.41Å; F144-M148 VanDerWaalsContact CE2-CE 3.41Å; F144-M148 HydrophobicContact CE2-CG 4.29Å; F144-M148 HydrophobicContact CZ-CE 3.56Å; F144-M148 HydrophobicContact CZ-CG 3.85Å; F144-M148 HydrophobicContact CZ-SD 4.37Å; F144-M148 WeakPolarHBondContact O-CB 3.36Å; F144-M148 VanDerWaalsContact O-CG 3.23Å; F144-M148 WeakPolarHBondContact O-CG 3.5Å; F144-M148 PolarHBondContact O-N 3.17Å; F144-L163 HydrophobicContact CD2-CD1 3.71Å; F144-L163 HydrophobicContact CE2-CD1 4.26Å; F144-L163 HydrophobicContact CG-CD1 4.5Å
145V87.1Confident87.2Confident45 Ų4551.2 Ų51.227%0.27328%0.277SS..Hα-helixtrans-61-46179.4173.50000111.1R98 V141 V142 V147 M148 E149R98-V145 HydrophobicContact CG-CG1 4.39Å; V141-V145 WeakPolarHBondContact O-CG2 3.25Å; V141-V145 PolarHBondContact O-N 3.48Å; V141-V145 VanDerWaalsContact O-N 3.1Å; V142-V145 PolarHBondContact O-N 3.21Å; V145-V147 VanDerWaalsContact C-N 3.35Å; V145-V147 PolarHBondContact O-N 3Å; V145-M148 PolarHBondContact O-N 3.32Å; V145-M148 VanDerWaalsContact O-N 3.12Å; V145-E149 HydrophobicContact CG1-CG 4.26Å; V145-E149 WeakPolarHBondContact CG1-OE1 3.41Å; V145-E149 WeakPolarHBondContact O-CG 3.46Å; V145-E149 PolarHBondContact O-N 3.24Å
146Y90.9Very high86.4Confident22 Ų2255.8 Ų55.89%0.08629%0.293CS..Hα-helixtrans-52.9-51.7177.9-179.2-87.4000111.2R98 L102 V142 F144 M148 E149 F150 P206 T208R98-Y146 HydrophobicContact CB-CD2 3.87Å; L102-Y146 HydrophobicContact CD1-CD1 4.32Å; L102-Y146 HydrophobicContact CD1-CD2 3.75Å; L102-Y146 HydrophobicContact CD1-CE2 4.42Å; L102-Y146 HydrophobicContact CD1-CG 3.7Å; V142-Y146 VanDerWaalsContact O-CB 3.28Å; V142-Y146 WeakPolarHBondContact O-CB 3.4Å; V142-Y146 PolarHBondContact O-N 2.94Å; F144-Y146 PolarHBondContact O-N 3.45Å; Y146-M148 PolarHBondContact O-N 3.48Å; Y146-E149 PolarHBondContact O-N 2.94Å; Y146-F150 HydrophobicContact CD1-CD2 4.13Å; Y146-F150 HydrophobicContact CD1-CE2 4.16Å; Y146-F150 HydrophobicContact CD2-CE2 4.18Å; Y146-F150 AromaticContact CE1-CD2 3.83Å; Y146-F150 HydrophobicContact CE1-CD2 3.83Å; Y146-F150 AromaticContact CE1-CE2 3.61Å; Y146-F150 HydrophobicContact CE1-CE2 3.61Å; Y146-F150 AromaticContact CE2-CE2 3.66Å; Y146-F150 HydrophobicContact CE2-CE2 3.66Å; Y146-F150 HydrophobicContact CE2-CZ 4.48Å; Y146-F150 HydrophobicContact CG-CE2 4.4Å; Y146-F150 AromaticContact CZ-CE2 3.33Å; Y146-F150 VanDerWaalsContact O-CD2 3.25Å; Y146-F150 WeakPolarHBondContact O-CD2 3.16Å; Y146-F150 PolarHBondContact O-N 2.85Å; Y146-F150 WeakPolarHBondContact OH-CE2 3.44Å; Y146-P206 WeakPolarHBondContact CE2-O 3.28Å; Y146-P206 PolarHBondContact OH-O 3.35Å; Y146-T208 HydrophobicContact CD2-CG2 3.52Å; Y146-T208 HydrophobicContact CE2-CG2 3.96Å; Y146-T208 HydrophobicContact CG-CG2 4.14Å
147V89.9Confident85.6Confident43 Ų4357.4 Ų57.426%0.26130%0.301SS..Hα-helixtrans-64.4-39.4179.4172.30000111.9G143 F144 V145 E149 F150 I151 L163G143-V147 WeakPolarHBondContact O-CG2 3.32Å; G143-V147 PolarHBondContact O-N 2.88Å; G143-V147 VanDerWaalsContact O-N 3.12Å; F144-V147 PolarHBondContact O-N 3.31Å; V145-V147 VanDerWaalsContact C-N 3.35Å; V145-V147 PolarHBondContact O-N 3Å; V147-E149 VanDerWaalsContact C-N 3.3Å; V147-E149 PolarHBondContact O-N 3.36Å; V147-F150 PolarHBondContact O-N 3.5Å; V147-I151 HydrophobicContact CG1-CD1 3.51Å; V147-I151 HydrophobicContact CG1-CG1 4.47Å; V147-I151 VanDerWaalsContact O-CG1 3.3Å; V147-I151 WeakPolarHBondContact O-CG1 3.19Å; V147-I151 PolarHBondContact O-N 3.05Å; V147-L163 HydrophobicContact CB-CD1 4.06Å; V147-L163 HydrophobicContact CG1-CD1 3.93Å; V147-L163 HydrophobicContact CG1-CG 4.45Å; V147-L163 HydrophobicContact CG2-CD2 4.28Å
148M83.9Confident85.1Confident16 Ų1664.1 Ų64.18%0.07933%0.325CS..Hα-helixtrans-69.6-25.7-179.6-69.7-59.2167.700114.2F144 V145 Y146 R156 A159 S160 L163F144-M148 HydrophobicContact CD1-CG 4.1Å; F144-M148 HydrophobicContact CD2-CE 4.15Å; F144-M148 HydrophobicContact CE1-CE 4.4Å; F144-M148 HydrophobicContact CE1-CG 3.74Å; F144-M148 HydrophobicContact CE2-CE 3.41Å; F144-M148 VanDerWaalsContact CE2-CE 3.41Å; F144-M148 HydrophobicContact CE2-CG 4.29Å; F144-M148 HydrophobicContact CZ-CE 3.56Å; F144-M148 HydrophobicContact CZ-CG 3.85Å; F144-M148 HydrophobicContact CZ-SD 4.37Å; F144-M148 WeakPolarHBondContact O-CB 3.36Å; F144-M148 VanDerWaalsContact O-CG 3.23Å; F144-M148 WeakPolarHBondContact O-CG 3.5Å; F144-M148 PolarHBondContact O-N 3.17Å; V145-M148 PolarHBondContact O-N 3.32Å; V145-M148 VanDerWaalsContact O-N 3.12Å; Y146-M148 PolarHBondContact O-N 3.48Å; M148-R156 PolarHBondContact O-NH2 2.96Å; M148-R156 HydrophobicContact SD-CG 3.42Å; M148-R156 WeakPolarHBondContact SD-CG 3.43Å; M148-A159 HydrophobicContact CE-CB 4.41Å; M148-S160 VanDerWaalsContact CE-CA 3.44Å; M148-S160 VanDerWaalsContact CE-CB 3.49Å; M148-L163 HydrophobicContact CE-CD1 4.1Å
149E87.3Confident84.8Confident30 Ų3064.7 Ų64.714%0.1433%0.33CS..Hα-helixtrans-77.1-25.8175-76.2-175.6-175.700112.4R98 V145 Y146 V147 T208 F210R98-E149 IonicContact CZ-OE1 2.66Å; R98-E149 VanDerWaalsContact CZ-OE1 3.27Å; R98-E149 IonicContact CZ-OE2 3.9Å; R98-E149 IonicContact NE-OE1 3.23Å; R98-E149 IonicContact NH1-OE1 2.69Å; R98-E149 PolarHBondContact NH1-OE1 2.67Å; R98-E149 IonicContact NH1-OE2 3.24Å; R98-E149 PolarHBondContact NH1-OE2 3.38Å; R98-E149 VanDerWaalsContact NH1-OE2 3.13Å; R98-E149 IonicContact NH2-OE1 2.97Å; V145-E149 HydrophobicContact CG1-CG 4.26Å; V145-E149 WeakPolarHBondContact CG1-OE1 3.41Å; V145-E149 WeakPolarHBondContact O-CG 3.46Å; V145-E149 PolarHBondContact O-N 3.24Å; Y146-E149 PolarHBondContact O-N 2.94Å; V147-E149 VanDerWaalsContact C-N 3.3Å; V147-E149 PolarHBondContact O-N 3.36Å; E149-T208 HydrophobicContact CB-CG2 3.96Å; E149-T208 WeakPolarHBondContact OE2-CB 3.35Å; E149-T208 VanDerWaalsContact OE2-CG2 3.31Å; E149-T208 WeakPolarHBondContact OE2-CG2 3.48Å; E149-T208 PolarHBondContact OE2-OG1 3.37Å; E149-F210 HydrophobicContact CB-CD2 3.87Å; E149-F210 HydrophobicContact CG-CB 4.33Å; E149-F210 HydrophobicContact CG-CD2 4.07Å; E149-F210 VanDerWaalsContact O-CD2 3.3Å; E149-F210 WeakPolarHBondContact O-CD2 3.48Å; E149-F210 WeakPolarHBondContact O-CE2 3.15Å
150F87.8Confident84.2Confident48 Ų4863.1 Ų63.121%0.21133%0.329CS..Hα-helixtrans-82.2-22.5172.1-79.9-75.8000113.6Y146 V147 P206 T208 I224 M228Y146-F150 HydrophobicContact CD1-CD2 4.13Å; Y146-F150 HydrophobicContact CD1-CE2 4.16Å; Y146-F150 HydrophobicContact CD2-CE2 4.18Å; Y146-F150 AromaticContact CE1-CD2 3.83Å; Y146-F150 HydrophobicContact CE1-CD2 3.83Å; Y146-F150 AromaticContact CE1-CE2 3.61Å; Y146-F150 HydrophobicContact CE1-CE2 3.61Å; Y146-F150 AromaticContact CE2-CE2 3.66Å; Y146-F150 HydrophobicContact CE2-CE2 3.66Å; Y146-F150 HydrophobicContact CE2-CZ 4.48Å; Y146-F150 HydrophobicContact CG-CE2 4.4Å; Y146-F150 AromaticContact CZ-CE2 3.33Å; Y146-F150 VanDerWaalsContact O-CD2 3.25Å; Y146-F150 WeakPolarHBondContact O-CD2 3.16Å; Y146-F150 PolarHBondContact O-N 2.85Å; Y146-F150 WeakPolarHBondContact OH-CE2 3.44Å; V147-F150 PolarHBondContact O-N 3.5Å; F150-P206 HydrophobicContact CE1-CG 4.38Å; F150-P206 HydrophobicContact CZ-CG 3.97Å; F150-T208 HydrophobicContact CD2-CG2 4.3Å; F150-T208 HydrophobicContact CE2-CG2 3.73Å; F150-T208 HydrophobicContact CZ-CG2 4.45Å; F150-I224 HydrophobicContact CE1-CG2 3.89Å; F150-M228 HydrophobicContact CD1-CE 4.06Å; F150-M228 HydrophobicContact CD1-SD 3.86Å; F150-M228 HydrophobicContact CE1-SD 4.21Å; F150-M228 WeakPolarHBondContact O-CE 3.49Å
151I87.6Confident83.8Confident47 Ų4759.4 Ų59.424%0.24131%0.31CS..SBendtrans-100.7126.5-170.1-65.1174.7000111.3V147 A159V147-I151 HydrophobicContact CG1-CD1 3.51Å; V147-I151 HydrophobicContact CG1-CG1 4.47Å; V147-I151 VanDerWaalsContact O-CG1 3.3Å; V147-I151 WeakPolarHBondContact O-CG1 3.19Å; V147-I151 PolarHBondContact O-N 3.05Å; I151-A159 HydrophobicContact CD1-CB 3.24Å; I151-A159 HydrophobicContact CG1-CB 4.42Å; I151-A159 HydrophobicContact CG2-CB 4.06Å
152G80.3Confident83.7Confident50 Ų5062.2 Ų62.252%0.51532%0.32SS..  trans-64.1156.9176.200000113.2K154 S155 R156G152-K154 PolarHBondContact O-N 2.74Å; G152-K154 VanDerWaalsContact O-N 3.09Å; G152-S155 PolarHBondContact O-N 3.48Å; G152-S155 VanDerWaalsContact O-N 3.11Å; G152-R156 PolarHBondContact O-N 2.87Å
153M75.4Confident83.3Confident159 Ų15964.7 Ų64.778%0.78333%0.333SS*.G310 helixtrans-53.3-36.3-173.8-65.8-174.3-74.900114.2S155 R156M153-S155 VanDerWaalsContact C-N 3.34Å; M153-S155 PolarHBondContact O-N 2.69Å; M153-R156 PolarHBondContact O-N 3.41Å
154K78.9Confident82.8Confident207 Ų20766.2 Ų66.290%0.934%0.335SS*.G310 helixtrans-63.6-35.5-178.4-66.1-176179.3179.90113.5G152G152-K154 PolarHBondContact O-N 2.74Å; G152-K154 VanDerWaalsContact O-N 3.09Å
155S81.4Confident82.8Confident71 Ų7163.5 Ų63.550%0.49733%0.327SS..G310 helixtrans-103.8-0.1-174.9-55.20000113.1G152 M153 T157 W158 A159G152-S155 PolarHBondContact O-N 3.48Å; G152-S155 VanDerWaalsContact O-N 3.11Å; M153-S155 VanDerWaalsContact C-N 3.34Å; M153-S155 PolarHBondContact O-N 2.69Å; S155-T157 VanDerWaalsContact C-N 3.33Å; S155-T157 PolarHBondContact O-N 2.89Å; S155-W158 PolarHBondContact O-N 3.2Å; S155-A159 PolarHBondContact O-N 3.11Å
156R79.3Confident82.8Confident102 Ų10268.3 Ų68.339%0.38534%0.344SS..Hα-helixtrans-59.5-41.2-174.6-170.3172.9-81170.3-7.1112.9M148 G152 M153 A159 S160M148-R156 PolarHBondContact O-NH2 2.96Å; M148-R156 HydrophobicContact SD-CG 3.42Å; M148-R156 WeakPolarHBondContact SD-CG 3.43Å; G152-R156 PolarHBondContact O-N 2.87Å; M153-R156 PolarHBondContact O-N 3.41Å; R156-A159 PolarHBondContact O-N 3Å; R156-S160 PolarHBondContact O-N 3.09Å
157T76.3Confident82.6Confident59 Ų5971.4 Ų71.436%0.36236%0.358SS..Hα-helixtrans-62.2-48.9177.9-53.20000111.2S155 A159 S160 V161S155-T157 VanDerWaalsContact C-N 3.33Å; S155-T157 PolarHBondContact O-N 2.89Å; T157-A159 PolarHBondContact O-N 3.41Å; T157-S160 WeakPolarHBondContact O-CB 3.19Å; T157-S160 PolarHBondContact O-N 2.9Å; T157-V161 WeakPolarHBondContact O-CG2 3.42Å; T157-V161 PolarHBondContact O-N 3.45Å; T157-V161 VanDerWaalsContact O-N 3.13Å
158W79.2Confident82.6Confident144 Ų14469.4 Ų69.455%0.54535%0.346SS..Hα-helixtrans-62.1-42.9177.7-77.2103.7000112.1S155 S160 V161 H162S155-W158 PolarHBondContact O-N 3.2Å; W158-S160 VanDerWaalsContact C-N 3.29Å; W158-S160 PolarHBondContact O-N 2.98Å; W158-V161 WeakPolarHBondContact O-CB 3.41Å; W158-V161 PolarHBondContact O-N 3.44Å; W158-H162 PolarHBondContact O-N 3.46Å; W158-H162 PolarHBondContact O-ND1 3.37Å
159A83.6Confident82.9Confident13 Ų1371.4 Ų71.411%0.10736%0.359CS..Hα-helixtrans-59.3-40.617600000113M148 I151 S155 R156 T157 V161 H162 L163M148-A159 HydrophobicContact CE-CB 4.41Å; I151-A159 HydrophobicContact CD1-CB 3.24Å; I151-A159 HydrophobicContact CG1-CB 4.42Å; I151-A159 HydrophobicContact CG2-CB 4.06Å; S155-A159 PolarHBondContact O-N 3.11Å; R156-A159 PolarHBondContact O-N 3Å; T157-A159 PolarHBondContact O-N 3.41Å; A159-V161 VanDerWaalsContact C-N 3.32Å; A159-V161 PolarHBondContact O-N 3.16Å; A159-H162 PolarHBondContact O-N 3.39Å; A159-L163 PolarHBondContact O-N 3.42Å
160S78.4Confident83.1Confident33 Ų3371.3 Ų71.323%0.23137%0.366CS..Hα-helixtrans-60.8-43.9176.4-169.70000111.2M148 R156 T157 W158 H162 L163 H164M148-S160 VanDerWaalsContact CE-CA 3.44Å; M148-S160 VanDerWaalsContact CE-CB 3.49Å; R156-S160 PolarHBondContact O-N 3.09Å; T157-S160 WeakPolarHBondContact O-CB 3.19Å; T157-S160 PolarHBondContact O-N 2.9Å; W158-S160 VanDerWaalsContact C-N 3.29Å; W158-S160 PolarHBondContact O-N 2.98Å; S160-H162 VanDerWaalsContact C-N 3.34Å; S160-H162 PolarHBondContact O-N 2.96Å; S160-L163 PolarHBondContact O-N 3.14Å; S160-H164 PolarHBondContact O-N 3.45Å; S160-H164 VanDerWaalsContact O-N 3.11Å; S160-H164 PolarHBondContact O-ND1 3.43Å
161V80.3Confident83.3Confident15 Ų1570.2 Ų70.29%0.09136%0.363CS..Hα-helixtrans-61.7-42.6177.7174.10000111.5T157 W158 A159 H164 S165 C323T157-V161 WeakPolarHBondContact O-CG2 3.42Å; T157-V161 PolarHBondContact O-N 3.45Å; T157-V161 VanDerWaalsContact O-N 3.13Å; W158-V161 WeakPolarHBondContact O-CB 3.41Å; W158-V161 PolarHBondContact O-N 3.44Å; A159-V161 VanDerWaalsContact C-N 3.32Å; A159-V161 PolarHBondContact O-N 3.16Å; V161-H164 PolarHBondContact O-N 3.37Å; V161-S165 WeakPolarHBondContact O-CB 3.35Å; V161-S165 PolarHBondContact O-N 2.86Å; V161-S165 PolarHBondContact O-OG 3.35Å; V161-C323 WeakPolarHBondContact CG2-SG 3.24Å
162H83.6Confident83.5Confident106 Ų10669.3 Ų69.349%0.49136%0.359SS..Hα-helixtrans-63.7-43.4178.6-73.573.4000111.2W158 A159 S160 H164 S165 F166W158-H162 PolarHBondContact O-N 3.46Å; W158-H162 PolarHBondContact O-ND1 3.37Å; A159-H162 PolarHBondContact O-N 3.39Å; S160-H162 VanDerWaalsContact C-N 3.34Å; S160-H162 PolarHBondContact O-N 2.96Å; H162-H164 PolarHBondContact O-N 3.18Å; H162-S165 WeakPolarHBondContact O-CB 3.42Å; H162-S165 PolarHBondContact O-N 3.2Å; H162-S165 VanDerWaalsContact O-N 3.15Å; H162-F166 WeakPolarHBondContact O-CD2 3.5Å; H162-F166 PolarHBondContact O-N 3.33Å
163L82.7Confident84.2Confident52 Ų5271.2 Ų71.227%0.27236%0.357SS..Hα-helixtrans-58.1-45175.7-75.2168.9000112.4F144 V147 M148 A159 S160 S165 F166 F167F144-L163 HydrophobicContact CD2-CD1 3.71Å; F144-L163 HydrophobicContact CE2-CD1 4.26Å; F144-L163 HydrophobicContact CG-CD1 4.5Å; V147-L163 HydrophobicContact CB-CD1 4.06Å; V147-L163 HydrophobicContact CG1-CD1 3.93Å; V147-L163 HydrophobicContact CG1-CG 4.45Å; V147-L163 HydrophobicContact CG2-CD2 4.28Å; M148-L163 HydrophobicContact CE-CD1 4.1Å; A159-L163 PolarHBondContact O-N 3.42Å; S160-L163 PolarHBondContact O-N 3.14Å; L163-S165 VanDerWaalsContact C-N 3.35Å; L163-F166 PolarHBondContact O-N 3.11Å; L163-F167 PolarHBondContact O-N 2.79Å
164H79.8Confident85Confident48 Ų4865.9 Ų65.922%0.22233%0.333CS..Hα-helixtrans-69.2-33.3176.4-7084.5000112.3S160 V161 H162 F166 F167 A168 Y319S160-H164 PolarHBondContact O-N 3.45Å; S160-H164 VanDerWaalsContact O-N 3.11Å; S160-H164 PolarHBondContact O-ND1 3.43Å; V161-H164 PolarHBondContact O-N 3.37Å; H162-H164 PolarHBondContact O-N 3.18Å; H164-F166 VanDerWaalsContact C-N 3.31Å; H164-F166 PolarHBondContact O-N 2.79Å; H164-F167 VanDerWaalsContact O-CB 3.3Å; H164-F167 WeakPolarHBondContact O-CB 3.17Å; H164-F167 PolarHBondContact O-N 3.33Å; H164-F167 VanDerWaalsContact O-N 3.14Å; H164-A168 PolarHBondContact O-N 3.46Å; H164-Y319 HydrophobicContact CB-CD2 4.02Å; H164-Y319 HydrophobicContact CB-CE1 4.43Å; H164-Y319 HydrophobicContact CB-CE2 3.77Å; H164-Y319 HydrophobicContact CB-CG 4.45Å
165S84.7Confident85.7Confident24 Ų2456 Ų5617%0.16829%0.291CS..Hα-helixtrans-64.5-37175.2-56.90000111.6V161 H162 L163 F167 A168 V169V161-S165 WeakPolarHBondContact O-CB 3.35Å; V161-S165 PolarHBondContact O-N 2.86Å; V161-S165 PolarHBondContact O-OG 3.35Å; H162-S165 WeakPolarHBondContact O-CB 3.42Å; H162-S165 PolarHBondContact O-N 3.2Å; H162-S165 VanDerWaalsContact O-N 3.15Å; L163-S165 VanDerWaalsContact C-N 3.35Å; S165-F167 VanDerWaalsContact C-N 3.29Å; S165-F167 PolarHBondContact O-N 2.94Å; S165-A168 WeakPolarHBondContact O-CB 3.13Å; S165-A168 PolarHBondContact O-N 3.47Å; S165-V169 WeakPolarHBondContact O-CG2 3.23Å; S165-V169 PolarHBondContact O-N 2.96Å
166F88.2Confident86.2Confident145 Ų14556.6 Ų56.664%0.63629%0.287SS*.Hα-helixtrans-64.8-31.3173.1-76-64.6000113H162 L163 H164 V169 G170H162-F166 WeakPolarHBondContact O-CD2 3.5Å; H162-F166 PolarHBondContact O-N 3.33Å; L163-F166 PolarHBondContact O-N 3.11Å; H164-F166 VanDerWaalsContact C-N 3.31Å; H164-F166 PolarHBondContact O-N 2.79Å; F166-V169 PolarHBondContact O-N 3.28Å; F166-G170 PolarHBondContact O-N 3.47Å
167F86.1Confident86.9Confident88 Ų8852.8 Ų52.839%0.38628%0.276SS..Hα-helixtrans-62.7-44.8171.2-176.6-90.3000111.2L140 L163 H164 S165 V169 G170 T171L140-F167 HydrophobicContact CD1-CD2 4.49Å; L140-F167 HydrophobicContact CD1-CE2 4.48Å; L163-F167 PolarHBondContact O-N 2.79Å; H164-F167 VanDerWaalsContact O-CB 3.3Å; H164-F167 WeakPolarHBondContact O-CB 3.17Å; H164-F167 PolarHBondContact O-N 3.33Å; H164-F167 VanDerWaalsContact O-N 3.14Å; S165-F167 VanDerWaalsContact C-N 3.29Å; S165-F167 PolarHBondContact O-N 2.94Å; F167-V169 PolarHBondContact O-N 2.65Å; F167-G170 WeakPolarHBondContact O-CA 3.22Å; F167-G170 PolarHBondContact O-N 3.46Å; F167-G170 VanDerWaalsContact O-N 3.09Å; F167-T171 PolarHBondContact O-N 3.26Å; F167-T171 PolarHBondContact O-OG1 3.29Å
168A89Confident87.6Confident0 Ų050.1 Ų50.10%026%0.259CS..Hα-helixtrans-61.7-41.4175.200000112.1H164 S165 G170 T171 L172 E315 I316H164-A168 PolarHBondContact O-N 3.46Å; S165-A168 WeakPolarHBondContact O-CB 3.13Å; S165-A168 PolarHBondContact O-N 3.47Å; A168-G170 VanDerWaalsContact C-N 3.3Å; A168-G170 PolarHBondContact O-N 2.71Å; A168-T171 VanDerWaalsContact O-CB 3.32Å; A168-T171 WeakPolarHBondContact O-CB 3.41Å; A168-T171 PolarHBondContact O-N 3.33Å; A168-T171 VanDerWaalsContact O-N 3.11Å; A168-L172 WeakPolarHBondContact O-CG 3.47Å; A168-L172 PolarHBondContact O-N 3.33Å; A168-E315 HydrophobicContact CB-CB 3.78Å; A168-I316 HydrophobicContact CB-CD1 4.48Å; A168-I316 HydrophobicContact CB-CG1 3.71Å
169V91.3Very high88.2Confident58 Ų5848.7 Ų48.735%0.35226%0.255SS..Hα-helixtrans-60.3-40.1172174.70000111.3S165 F166 F167 T171 L172 L173 I316S165-V169 WeakPolarHBondContact O-CG2 3.23Å; S165-V169 PolarHBondContact O-N 2.96Å; F166-V169 PolarHBondContact O-N 3.28Å; F167-V169 PolarHBondContact O-N 2.65Å; V169-T171 VanDerWaalsContact C-N 3.32Å; V169-T171 PolarHBondContact O-N 3.42Å; V169-L172 WeakPolarHBondContact O-CB 3Å; V169-L172 PolarHBondContact O-N 2.94Å; V169-L172 VanDerWaalsContact O-N 3.16Å; V169-L173 HydrophobicContact CG1-CD1 4.25Å; V169-L173 HydrophobicContact CG1-CG 4.48Å; V169-L173 WeakPolarHBondContact O-CG 3.31Å; V169-L173 PolarHBondContact O-N 2.91Å; V169-I316 HydrophobicContact CG2-CD1 4.27Å
170G92Very high88.6Confident29 Ų2954 Ų5430%0.29928%0.28SS..Hα-helixtrans-56.5-45.1171.800000112.3F166 F167 A168 L172 L173 V174F166-G170 PolarHBondContact O-N 3.47Å; F167-G170 WeakPolarHBondContact O-CA 3.22Å; F167-G170 PolarHBondContact O-N 3.46Å; F167-G170 VanDerWaalsContact O-N 3.09Å; A168-G170 VanDerWaalsContact C-N 3.3Å; A168-G170 PolarHBondContact O-N 2.71Å; G170-L172 VanDerWaalsContact C-N 3.32Å; G170-L172 PolarHBondContact O-N 3.2Å; G170-L173 PolarHBondContact O-N 3.42Å; G170-V174 WeakPolarHBondContact O-CB 3.36Å; G170-V174 VanDerWaalsContact O-CG2 3.25Å; G170-V174 WeakPolarHBondContact O-CG2 3.47Å; G170-V174 PolarHBondContact O-N 3.26Å
171T90.5Very high89.3Confident24 Ų2453.5 Ų53.515%0.14728%0.276CS..Hα-helixtrans-58.9-41.4174.7-55.90000112.1F167 A168 V169 V174 A175 L308F167-T171 PolarHBondContact O-N 3.26Å; F167-T171 PolarHBondContact O-OG1 3.29Å; A168-T171 VanDerWaalsContact O-CB 3.32Å; A168-T171 WeakPolarHBondContact O-CB 3.41Å; A168-T171 PolarHBondContact O-N 3.33Å; A168-T171 VanDerWaalsContact O-N 3.11Å; V169-T171 VanDerWaalsContact C-N 3.32Å; V169-T171 PolarHBondContact O-N 3.42Å; T171-V174 PolarHBondContact O-N 2.94Å; T171-A175 WeakPolarHBondContact O-CB 3.47Å; T171-A175 PolarHBondContact O-N 2.84Å; T171-L308 HydrophobicContact CG2-CD1 3.94Å; T171-L308 HydrophobicContact CG2-CG 4.24Å
172L93.5Very high89.6Confident28 Ų2857.6 Ų57.615%0.14729%0.29CS..Hα-helixtrans-61.6-45.2174.9-61.5177.4000112.1A168 V169 G170 A175 L176 F309 V313 I316A168-L172 WeakPolarHBondContact O-CG 3.47Å; A168-L172 PolarHBondContact O-N 3.33Å; V169-L172 WeakPolarHBondContact O-CB 3Å; V169-L172 PolarHBondContact O-N 2.94Å; V169-L172 VanDerWaalsContact O-N 3.16Å; G170-L172 VanDerWaalsContact C-N 3.32Å; G170-L172 PolarHBondContact O-N 3.2Å; L172-A175 PolarHBondContact O-N 3.44Å; L172-L176 WeakPolarHBondContact O-CB 2.9Å; L172-L176 PolarHBondContact O-N 3.09Å; L172-F309 HydrophobicContact CB-CD2 4.22Å; L172-F309 HydrophobicContact CB-CE2 4.11Å; L172-F309 HydrophobicContact CD2-CD1 4.29Å; L172-F309 HydrophobicContact CD2-CD2 3.7Å; L172-F309 HydrophobicContact CD2-CE1 4.37Å; L172-F309 HydrophobicContact CD2-CE2 3.79Å; L172-F309 HydrophobicContact CD2-CG 3.96Å; L172-F309 HydrophobicContact CD2-CZ 4.13Å; L172-F309 WeakPolarHBondContact CD2-O 3.34Å; L172-F309 HydrophobicContact CG-CE2 4.45Å; L172-V313 HydrophobicContact CD2-CG2 3.63Å; L172-I316 HydrophobicContact CD1-CD1 4.17Å
173L93.2Very high90Very high91 Ų9153.9 Ų53.948%0.47628%0.275SS..Hα-helixtrans-66.1-39.9179.7-69.4173.5000111.8V169 G170 L176 T177V169-L173 HydrophobicContact CG1-CD1 4.25Å; V169-L173 HydrophobicContact CG1-CG 4.48Å; V169-L173 WeakPolarHBondContact O-CG 3.31Å; V169-L173 PolarHBondContact O-N 2.91Å; G170-L173 PolarHBondContact O-N 3.42Å; L173-L176 PolarHBondContact O-N 2.98Å; L173-T177 VanDerWaalsContact O-CB 3.31Å; L173-T177 WeakPolarHBondContact O-CB 3.34Å; L173-T177 PolarHBondContact O-N 2.67Å; L173-T177 PolarHBondContact O-OG1 3.01Å
174V92.8Very high90.5Very high46 Ų4652.8 Ų52.828%0.27927%0.267SS..Hα-helixtrans-60.1-48.5173.6162.10000110.2G170 T171 T177 G178 Y187 L191 L308G170-V174 WeakPolarHBondContact O-CB 3.36Å; G170-V174 VanDerWaalsContact O-CG2 3.25Å; G170-V174 WeakPolarHBondContact O-CG2 3.47Å; G170-V174 PolarHBondContact O-N 3.26Å; T171-V174 PolarHBondContact O-N 2.94Å; V174-T177 PolarHBondContact O-N 3.48Å; V174-G178 PolarHBondContact O-N 3.23Å; V174-Y187 WeakPolarHBondContact CG1-OH 3.35Å; V174-Y187 PolarHBondContact O-OH 3.46Å; V174-L191 HydrophobicContact CG2-CD1 4.28Å; V174-L191 HydrophobicContact CG2-CD2 4.13Å; V174-L308 HydrophobicContact CG1-CD2 4.17Å
175A93.1Very high91.1Very high1 Ų156.1 Ų56.11%0.00828%0.278CS..Hα-helixtrans-61-46.7177.400000112.6T171 L172 G178 Y179 L308 F309T171-A175 WeakPolarHBondContact O-CB 3.47Å; T171-A175 PolarHBondContact O-N 2.84Å; L172-A175 PolarHBondContact O-N 3.44Å; A175-G178 PolarHBondContact O-N 3.38Å; A175-Y179 PolarHBondContact O-N 3.43Å; A175-L308 HydrophobicContact CB-CB 4Å; A175-L308 HydrophobicContact CB-CD2 4.01Å; A175-L308 HydrophobicContact CB-CG 3.92Å; A175-F309 HydrophobicContact CB-CB 3.89Å; A175-F309 HydrophobicContact CB-CD2 4.5Å
176L93.5Very high91.6Very high82 Ų8258.4 Ų58.443%0.42929%0.288SS..Hα-helixtrans-62.6-45.3178.2178.961.4000111.7L172 L173 G178 Y179 L180L172-L176 WeakPolarHBondContact O-CB 2.9Å; L172-L176 PolarHBondContact O-N 3.09Å; L173-L176 PolarHBondContact O-N 2.98Å; L176-G178 VanDerWaalsContact C-N 3.26Å; L176-G178 PolarHBondContact O-N 3.48Å; L176-Y179 PolarHBondContact O-N 3.4Å; L176-L180 HydrophobicContact CD1-CD1 4.18Å; L176-L180 HydrophobicContact CD1-CG 4.34Å; L176-L180 HydrophobicContact CG-CD1 4.15Å; L176-L180 WeakPolarHBondContact O-CG 3.2Å; L176-L180 PolarHBondContact O-N 3.05Å; L176-L180 VanDerWaalsContact O-N 3.07Å
177T93.6Very high91.8Very high23 Ų2354 Ų5414%0.14127%0.268CS..Hα-helixtrans-62.1-38.7178.5-53.70000110.5L173 V174 L180 V181 Y187 I190 L191L173-T177 VanDerWaalsContact O-CB 3.31Å; L173-T177 WeakPolarHBondContact O-CB 3.34Å; L173-T177 PolarHBondContact O-N 2.67Å; L173-T177 PolarHBondContact O-OG1 3.01Å; V174-T177 PolarHBondContact O-N 3.48Å; T177-L180 PolarHBondContact O-N 3.02Å; T177-V181 WeakPolarHBondContact O-CA 3.07Å; T177-V181 VanDerWaalsContact O-CB 3.32Å; T177-V181 WeakPolarHBondContact O-CB 3.22Å; T177-V181 PolarHBondContact O-N 3.41Å; T177-Y187 HydrophobicContact CG2-CD2 3.72Å; T177-Y187 HydrophobicContact CG2-CE2 3.96Å; T177-I190 HydrophobicContact CG2-CB 4.3Å; T177-I190 HydrophobicContact CG2-CG2 3.82Å; T177-L191 HydrophobicContact CG2-CD2 4.4Å
178G91.4Very high92.2Very high2 Ų250.7 Ų50.72%0.02125%0.253CS..Hα-helixtrans-66.7-38.8177.400000112.7V174 A175 L176 L180 V181 Y305V174-G178 PolarHBondContact O-N 3.23Å; A175-G178 PolarHBondContact O-N 3.38Å; L176-G178 VanDerWaalsContact C-N 3.26Å; L176-G178 PolarHBondContact O-N 3.48Å; G178-L180 PolarHBondContact O-N 3.45Å; G178-V181 CarbonylContact O-C 3.57Å; G178-Y305 VanDerWaalsContact C-CD1 3.47Å; G178-Y305 VanDerWaalsContact C-CZ 3.47Å; G178-Y305 WeakPolarHBondContact O-CE1 3.38Å; G178-Y305 PolarHBondContact O-OH 3.01Å
179Y91.1Very high92.5Very high115 Ų11552.7 Ų52.745%0.45126%0.263SS..Hα-helixtrans-62.8-42175.4-178.2-99.8000112.4A175 L176 Y305A175-Y179 PolarHBondContact O-N 3.43Å; L176-Y179 PolarHBondContact O-N 3.4Å; Y179-Y305 HydrophobicContact CD2-CD2 4.21Å
180L92.2Very high92.7Very high123 Ų12352.8 Ų52.864%0.64426%0.261SS*.Hα-helixtrans-76.6-35.6179.8-64.2175000112.6L176 T177 G178L176-L180 HydrophobicContact CD1-CD1 4.18Å; L176-L180 HydrophobicContact CD1-CG 4.34Å; L176-L180 HydrophobicContact CG-CD1 4.15Å; L176-L180 WeakPolarHBondContact O-CG 3.2Å; L176-L180 PolarHBondContact O-N 3.05Å; L176-L180 VanDerWaalsContact O-N 3.07Å; T177-L180 PolarHBondContact O-N 3.02Å; G178-L180 PolarHBondContact O-N 3.45Å
181V92.4Very high92.7Very high24 Ų2453.7 Ų53.715%0.14526%0.258CS..  trans-122.198.4-171.1-175.90000110.4T177 G178 T183 L186 I190T177-V181 WeakPolarHBondContact O-CA 3.07Å; T177-V181 VanDerWaalsContact O-CB 3.32Å; T177-V181 WeakPolarHBondContact O-CB 3.22Å; T177-V181 PolarHBondContact O-N 3.41Å; G178-V181 CarbonylContact O-C 3.57Å; V181-T183 VanDerWaalsContact C-N 3.27Å; V181-T183 PolarHBondContact O-N 2.93Å; V181-L186 HydrophobicContact CG1-CB 3.91Å; V181-L186 HydrophobicContact CG1-CD2 3.81Å; V181-L186 HydrophobicContact CG1-CG 3.78Å; V181-I190 HydrophobicContact CB-CD1 4.47Å; V181-I190 HydrophobicContact CG1-CD1 4.33Å; V181-I190 HydrophobicContact CG2-CD1 3.68Å
182R87.8Confident92.9Very high101 Ų10152.9 Ų52.938%0.38125%0.254SS..  trans-89.719.1-176.6-59.4175.3-178.7-167.16.9114.3N51 T52 K54 S55N51-R182 PolarHBondContact O-NH1 3.34Å; T52-R182 WeakPolarHBondContact O-CD 3.24Å; K54-R182 PolarHBondContact N-O 3.46Å; K54-R182 VanDerWaalsContact N-O 3.1Å; S55-R182 PolarHBondContact N-O 3.45Å
183T91.7Very high92.8Very high27 Ų2755 Ų5517%0.16627%0.268CS..BIsolated β-bridgetrans-123116180-590000108.6V181 W185 L186 Y187V181-T183 VanDerWaalsContact C-N 3.27Å; V181-T183 PolarHBondContact O-N 2.93Å; T183-W185 HydrophobicContact CG2-CD2 4.19Å; T183-W185 HydrophobicContact CG2-CG 4.15Å; T183-W185 HydrophobicContact CG2-CZ2 4.1Å; T183-W185 PolarHBondContact O-N 2.91Å; T183-L186 HydrophobicContact CG2-CB 4.42Å; T183-L186 PolarHBondContact O-N 3.48Å; T183-Y187 WeakPolarHBondContact O-CB 3.1Å; T183-Y187 PolarHBondContact O-N 3.23Å
184W92.3Very high92.7Very high29 Ų2955.4 Ų55.411%0.1127%0.274CS..Hα-helixtrans-62.1-38.3-166.475.2-88.5000115.2S55 W61 A116 F125 Y187 Q188S55-W184 PolarHBondContact O-N 3.48Å; S55-W184 VanDerWaalsContact O-N 3.17Å; W61-W184 AromaticContact CH2-CH2 3.72Å; W61-W184 HydrophobicContact CH2-CH2 3.72Å; W61-W184 AromaticContact CH2-CZ2 3.78Å; W61-W184 HydrophobicContact CH2-CZ2 3.78Å; W61-W184 HydrophobicContact CZ2-CH2 4.42Å; W61-W184 HydrophobicContact CZ2-CZ2 4.31Å; W61-W184 HydrophobicContact CZ3-CZ2 4.42Å; A116-W184 WeakPolarHBondContact O-CZ3 3.48Å; F125-W184 HydrophobicContact CD2-CH2 4.09Å; F125-W184 AromaticContact CD2-CZ3 3.91Å; F125-W184 HydrophobicContact CD2-CZ3 3.91Å; F125-W184 HydrophobicContact CE2-CE3 4.18Å; F125-W184 HydrophobicContact CE2-CH2 4.2Å; F125-W184 AromaticContact CE2-CZ3 3.6Å; F125-W184 HydrophobicContact CE2-CZ3 3.6Å; W184-Y187 WeakPolarHBondContact O-CB 3.32Å; W184-Y187 PolarHBondContact O-N 2.99Å; W184-Q188 WeakPolarHBondContact O-CB 3.42Å; W184-Q188 PolarHBondContact O-N 3.29Å
185W93Very high92.5Very high118 Ų11854.8 Ų54.845%0.44727%0.27SS..Hα-helixtrans-72.6-39.6-178.558.7-98000111.3A117 T183 Y187 Q188 M189A117-W185 HydrophobicContact CB-CB 4.41Å; A117-W185 WeakPolarHBondContact O-CB 3.44Å; T183-W185 HydrophobicContact CG2-CD2 4.19Å; T183-W185 HydrophobicContact CG2-CG 4.15Å; T183-W185 HydrophobicContact CG2-CZ2 4.1Å; T183-W185 PolarHBondContact O-N 2.91Å; W185-Y187 VanDerWaalsContact C-N 3.33Å; W185-Q188 PolarHBondContact O-N 2.98Å; W185-M189 VanDerWaalsContact O-CG 3.28Å; W185-M189 WeakPolarHBondContact O-CG 3.41Å; W185-M189 PolarHBondContact O-N 2.85Å
186L94.2Very high92.4Very high72 Ų7257 Ų5738%0.37728%0.284SS..Hα-helixtrans-65.6-40.5174.4-177.261.4000110.7V181 T183 M189 I190V181-L186 HydrophobicContact CG1-CB 3.91Å; V181-L186 HydrophobicContact CG1-CD2 3.81Å; V181-L186 HydrophobicContact CG1-CG 3.78Å; T183-L186 HydrophobicContact CG2-CB 4.42Å; T183-L186 PolarHBondContact O-N 3.48Å; L186-M189 WeakPolarHBondContact O-CB 3.45Å; L186-M189 PolarHBondContact O-N 3.44Å; L186-I190 HydrophobicContact CD1-CD1 4.31Å; L186-I190 HydrophobicContact CG-CD1 4.02Å; L186-I190 VanDerWaalsContact O-CG1 3.31Å; L186-I190 WeakPolarHBondContact O-CG1 3.39Å; L186-I190 PolarHBondContact O-N 3.33Å
187Y93.9Very high92.3Very high54 Ų5457 Ų5721%0.21229%0.288CS..Hα-helixtrans-57.3-47.9172.7172.8-95.3000111.7V174 T177 T183 W184 W185 M189 I190 L191V174-Y187 WeakPolarHBondContact CG1-OH 3.35Å; V174-Y187 PolarHBondContact O-OH 3.46Å; T177-Y187 HydrophobicContact CG2-CD2 3.72Å; T177-Y187 HydrophobicContact CG2-CE2 3.96Å; T183-Y187 WeakPolarHBondContact O-CB 3.1Å; T183-Y187 PolarHBondContact O-N 3.23Å; W184-Y187 WeakPolarHBondContact O-CB 3.32Å; W184-Y187 PolarHBondContact O-N 2.99Å; W185-Y187 VanDerWaalsContact C-N 3.33Å; Y187-M189 PolarHBondContact O-N 2.93Å; Y187-I190 PolarHBondContact O-N 2.96Å; Y187-L191 HydrophobicContact CD1-CD1 4.07Å; Y187-L191 HydrophobicContact CE1-CD1 3.44Å; Y187-L191 VanDerWaalsContact CE1-CD1 3.44Å; Y187-L191 HydrophobicContact CE1-CG 4.46Å; Y187-L191 HydrophobicContact CE2-CD1 4.07Å; Y187-L191 HydrophobicContact CE2-CG 4.49Å; Y187-L191 VanDerWaalsContact CZ-CD1 3.45Å; Y187-L191 WeakPolarHBondContact O-CG 3.25Å; Y187-L191 PolarHBondContact O-N 2.72Å; Y187-L191 VanDerWaalsContact O-N 3.12Å
188Q94.3Very high92Very high18 Ų1859.5 Ų59.58%0.08430%0.298CS..Hα-helixtrans-62-41176.4-177.666.444.300112.3G113 A116 A117 W184 W185 S192G113-Q188 VanDerWaalsContact O-CG 3.25Å; G113-Q188 WeakPolarHBondContact O-CG 3.02Å; G113-Q188 PolarHBondContact O-NE2 3.4Å; A116-Q188 HydrophobicContact CB-CG 4.32Å; A117-Q188 HydrophobicContact CB-CB 4.05Å; A117-Q188 HydrophobicContact CB-CG 3.95Å; W184-Q188 WeakPolarHBondContact O-CB 3.42Å; W184-Q188 PolarHBondContact O-N 3.29Å; W185-Q188 PolarHBondContact O-N 2.98Å; Q188-S192 PolarHBondContact NE2-OG 3.3Å; Q188-S192 WeakPolarHBondContact O-CB 3.32Å; Q188-S192 PolarHBondContact O-N 3.43Å; Q188-S192 PolarHBondContact O-OG 3.23Å
189M94.4Very high91.9Very high42 Ų4260.6 Ų60.621%0.20730%0.303CS..Hα-helixtrans-62-46.4177.1-73.8-66.8-67.100112.2I114 A117 F118 W185 L186 Y187 S192 T193I114-M189 HydrophobicContact CB-SD 4.41Å; I114-M189 HydrophobicContact CD1-CE 3.54Å; I114-M189 HydrophobicContact CD1-SD 3.37Å; I114-M189 WeakPolarHBondContact CD1-SD 3.31Å; I114-M189 HydrophobicContact CG1-SD 4.44Å; I114-M189 HydrophobicContact CG2-CE 4.42Å; I114-M189 HydrophobicContact CG2-SD 4.02Å; A117-M189 HydrophobicContact CB-CG 3.6Å; A117-M189 HydrophobicContact CB-SD 3.64Å; F118-M189 HydrophobicContact CD2-SD 4.23Å; F118-M189 HydrophobicContact CE2-CE 3.87Å; F118-M189 HydrophobicContact CE2-SD 3.63Å; F118-M189 HydrophobicContact CZ-CE 4.29Å; F118-M189 HydrophobicContact CZ-SD 4.36Å; W185-M189 VanDerWaalsContact O-CG 3.28Å; W185-M189 WeakPolarHBondContact O-CG 3.41Å; W185-M189 PolarHBondContact O-N 2.85Å; L186-M189 WeakPolarHBondContact O-CB 3.45Å; L186-M189 PolarHBondContact O-N 3.44Å; Y187-M189 PolarHBondContact O-N 2.93Å; M189-S192 PolarHBondContact O-N 3Å; M189-T193 WeakPolarHBondContact O-CB 3.3Å; M189-T193 PolarHBondContact O-N 2.87Å; M189-T193 PolarHBondContact O-OG1 3.29Å
190I95.3Very high91.7Very high60 Ų6061 Ų6131%0.30831%0.312SS..Hα-helixtrans-61.8-49.8-179.9-69.9165000110T177 V181 L186 Y187 S192 T193 V194T177-I190 HydrophobicContact CG2-CB 4.3Å; T177-I190 HydrophobicContact CG2-CG2 3.82Å; V181-I190 HydrophobicContact CB-CD1 4.47Å; V181-I190 HydrophobicContact CG1-CD1 4.33Å; V181-I190 HydrophobicContact CG2-CD1 3.68Å; L186-I190 HydrophobicContact CD1-CD1 4.31Å; L186-I190 HydrophobicContact CG-CD1 4.02Å; L186-I190 VanDerWaalsContact O-CG1 3.31Å; L186-I190 WeakPolarHBondContact O-CG1 3.39Å; L186-I190 PolarHBondContact O-N 3.33Å; Y187-I190 PolarHBondContact O-N 2.96Å; I190-S192 VanDerWaalsContact C-N 3.29Å; I190-S192 PolarHBondContact O-N 3.4Å; I190-T193 PolarHBondContact O-N 3.24Å; I190-T193 VanDerWaalsContact O-N 3.15Å; I190-V194 WeakPolarHBondContact O-CG2 3.33Å; I190-V194 PolarHBondContact O-N 3.44Å; I190-V194 VanDerWaalsContact O-N 3.11Å
191L93.1Very high91.5Very high47 Ų4758.7 Ų58.725%0.24631%0.305CS..Hα-helixtrans-60.6-39.2178.9-69.4-176.9000112.5V174 T177 Y187V174-L191 HydrophobicContact CG2-CD1 4.28Å; V174-L191 HydrophobicContact CG2-CD2 4.13Å; T177-L191 HydrophobicContact CG2-CD2 4.4Å; Y187-L191 HydrophobicContact CD1-CD1 4.07Å; Y187-L191 HydrophobicContact CE1-CD1 3.44Å; Y187-L191 VanDerWaalsContact CE1-CD1 3.44Å; Y187-L191 HydrophobicContact CE1-CG 4.46Å; Y187-L191 HydrophobicContact CE2-CD1 4.07Å; Y187-L191 HydrophobicContact CE2-CG 4.49Å; Y187-L191 VanDerWaalsContact CZ-CD1 3.45Å; Y187-L191 WeakPolarHBondContact O-CG 3.25Å; Y187-L191 PolarHBondContact O-N 2.72Å; Y187-L191 VanDerWaalsContact O-N 3.12Å
192S93.9Very high91.1Very high8 Ų857.7 Ų57.76%0.05630%0.3CS..Hα-helixtrans-65.8-43.1177.3-53.90000110.5F110 G113 Q188 M189 I190 V194 T195F110-S192 WeakPolarHBondContact CD2-O 3.24Å; G113-S192 VanDerWaalsContact C-OG 3.26Å; G113-S192 VanDerWaalsContact CA-OG 3.27Å; G113-S192 WeakPolarHBondContact CA-OG 3.39Å; Q188-S192 PolarHBondContact NE2-OG 3.3Å; Q188-S192 WeakPolarHBondContact O-CB 3.32Å; Q188-S192 PolarHBondContact O-N 3.43Å; Q188-S192 PolarHBondContact O-OG 3.23Å; M189-S192 PolarHBondContact O-N 3Å; I190-S192 VanDerWaalsContact C-N 3.29Å; I190-S192 PolarHBondContact O-N 3.4Å; S192-V194 VanDerWaalsContact C-N 3.3Å; S192-V194 PolarHBondContact O-N 2.68Å; S192-T195 WeakPolarHBondContact O-CB 3.35Å; S192-T195 PolarHBondContact O-N 2.88Å; S192-T195 VanDerWaalsContact O-N 3.13Å; S192-T195 PolarHBondContact O-OG1 3.39Å
193T92.3Very high90.8Very high73 Ų7361.8 Ų61.845%0.44832%0.315SS..Hα-helixtrans-65.3-30.6-178.4-54.10000113M189 I190 T195 V196M189-T193 WeakPolarHBondContact O-CB 3.3Å; M189-T193 PolarHBondContact O-N 2.87Å; M189-T193 PolarHBondContact O-OG1 3.29Å; I190-T193 PolarHBondContact O-N 3.24Å; I190-T193 VanDerWaalsContact O-N 3.15Å; T193-T195 PolarHBondContact O-N 3.07Å; T193-T195 VanDerWaalsContact O-N 3.09Å; T193-V196 HydrophobicContact CG2-CG2 4.49Å; T193-V196 WeakPolarHBondContact O-CB 3.37Å; T193-V196 VanDerWaalsContact O-CG2 3.32Å; T193-V196 WeakPolarHBondContact O-CG2 3.32Å; T193-V196 PolarHBondContact O-N 3.23Å
194V91Very high90.5Very high98 Ų9866.5 Ų66.559%0.59434%0.344SS*.THydrogen-bonded Turntrans-59.6-21.4175.6170.50000112.7I190 S192 P197I190-V194 WeakPolarHBondContact O-CG2 3.33Å; I190-V194 PolarHBondContact O-N 3.44Å; I190-V194 VanDerWaalsContact O-N 3.11Å; S192-V194 VanDerWaalsContact C-N 3.3Å; S192-V194 PolarHBondContact O-N 2.68Å; V194-P197 WeakPolarHBondContact O-CD 3.22Å
195T88.3Confident90.4Very high33 Ų3367.3 Ų67.320%0.20235%0.35CS..THydrogen-bonded Turntrans-78.5-17.5177.868.70000114.1M109 S192 T193 F198 I199M109-T195 HydrophobicContact SD-CG2 3.94Å; S192-T195 WeakPolarHBondContact O-CB 3.35Å; S192-T195 PolarHBondContact O-N 2.88Å; S192-T195 VanDerWaalsContact O-N 3.13Å; S192-T195 PolarHBondContact O-OG1 3.39Å; T193-T195 PolarHBondContact O-N 3.07Å; T193-T195 VanDerWaalsContact O-N 3.09Å; T195-F198 WeakPolarHBondContact O-CB 3.47Å; T195-F198 PolarHBondContact O-N 3.34Å; T195-F198 VanDerWaalsContact O-N 3.11Å; T195-I199 PolarHBondContact O-N 3.49Å
196V91.1Very high90.3Very high49 Ų4963.9 Ų63.930%0.29734%0.343SS..Hα-helixtrans-57.9-45.2-173.7174.10000113.5F110 T193 F198 I199 L200F110-V196 HydrophobicContact CD2-CG2 3.71Å; F110-V196 HydrophobicContact CE2-CG2 3.5Å; F110-V196 HydrophobicContact CZ-CG2 4.19Å; T193-V196 HydrophobicContact CG2-CG2 4.49Å; T193-V196 WeakPolarHBondContact O-CB 3.37Å; T193-V196 VanDerWaalsContact O-CG2 3.32Å; T193-V196 WeakPolarHBondContact O-CG2 3.32Å; T193-V196 PolarHBondContact O-N 3.23Å; V196-F198 PolarHBondContact O-N 3.38Å; V196-I199 WeakPolarHBondContact O-CB 3.38Å; V196-I199 PolarHBondContact O-N 3.47Å; V196-I199 VanDerWaalsContact O-N 3.12Å; V196-L200 HydrophobicContact CG1-CD1 4.34Å; V196-L200 WeakPolarHBondContact O-CG 3.49Å; V196-L200 PolarHBondContact O-N 2.92Å; V196-L200 VanDerWaalsContact O-N 3.16Å
197P90.5Very high90.3Very high80 Ų8061.4 Ų61.452%0.51933%0.329SS..Hα-helixtrans-57-37.1177.9-25.335.4000112.8V194 L200 C201V194-P197 WeakPolarHBondContact O-CD 3.22Å; P197-L200 PolarHBondContact O-N 3.12Å; P197-C201 PolarHBondContact O-N 3.4Å; P197-C201 VanDerWaalsContact O-N 3.14Å; P197-C201 PolarHBondContact O-SG 3.4Å
198F87.9Confident90.1Very high76 Ų7658.8 Ų58.833%0.33332%0.319SS..Hα-helixtrans-69-40.8178.4-174.3-95.2000112Y139 T195 V196 L200 C201 C202 L205Y139-F198 HydrophobicContact CE2-CD1 4.05Å; Y139-F198 AromaticContact CE2-CE1 3.52Å; Y139-F198 HydrophobicContact CE2-CE1 3.52Å; Y139-F198 HydrophobicContact CE2-CZ 4.13Å; T195-F198 WeakPolarHBondContact O-CB 3.47Å; T195-F198 PolarHBondContact O-N 3.34Å; T195-F198 VanDerWaalsContact O-N 3.11Å; V196-F198 PolarHBondContact O-N 3.38Å; F198-L200 PolarHBondContact O-N 3.4Å; F198-C201 WeakPolarHBondContact O-CA 3.41Å; F198-C201 WeakPolarHBondContact O-CB 3.35Å; F198-C201 PolarHBondContact O-N 3.11Å; F198-C202 WeakPolarHBondContact CE1-SG 3.41Å; F198-C202 PolarHBondContact O-N 3.03Å; F198-C202 PolarHBondContact O-SG 3.36Å; F198-L205 HydrophobicContact CZ-CD1 4.44Å
199I88.9Confident89.9Confident26 Ų2658.4 Ų58.413%0.13332%0.318CS..Hα-helixtrans-57-41.5175.9-63.6168.6000110.7F110 T195 V196 C202F110-I199 HydrophobicContact CB-CD1 3.67Å; F110-I199 HydrophobicContact CG-CD1 4.26Å; T195-I199 PolarHBondContact O-N 3.49Å; V196-I199 WeakPolarHBondContact O-CB 3.38Å; V196-I199 PolarHBondContact O-N 3.47Å; V196-I199 VanDerWaalsContact O-N 3.12Å; I199-C202 WeakPolarHBondContact O-CB 3.47Å; I199-C202 PolarHBondContact O-N 3.21Å
200L88Confident89.4Confident124 Ų12462 Ų6265%0.64933%0.333SS*.Hα-helixtrans-65.9-38.3176.6-61.7175.4000111.8V196 P197 F198V196-L200 HydrophobicContact CG1-CD1 4.34Å; V196-L200 WeakPolarHBondContact O-CG 3.49Å; V196-L200 PolarHBondContact O-N 2.92Å; V196-L200 VanDerWaalsContact O-N 3.16Å; P197-L200 PolarHBondContact O-N 3.12Å; F198-L200 PolarHBondContact O-N 3.4Å
201C87.6Confident89.1Confident74 Ų7460.1 Ų60.150%0.532%0.322SS..Hα-helixtrans-70.4-27.3177.1-69.60000113.6P197 F198 W203 V204P197-C201 PolarHBondContact O-N 3.4Å; P197-C201 VanDerWaalsContact O-N 3.14Å; P197-C201 PolarHBondContact O-SG 3.4Å; F198-C201 WeakPolarHBondContact O-CA 3.41Å; F198-C201 WeakPolarHBondContact O-CB 3.35Å; F198-C201 PolarHBondContact O-N 3.11Å; C201-W203 PolarHBondContact O-N 3.23Å; C201-W203 VanDerWaalsContact O-N 3.09Å; C201-V204 PolarHBondContact O-N 3.2Å
202C84.3Confident88.8Confident3 Ų358 Ų582%0.0231%0.31CS..THydrogen-bonded Turntrans-57.7-26.2-178.7-74.20000113.8W103 F198 I199 V204 L205W103-C202 HydrophobicContact CB-CB 4.28Å; W103-C202 HydrophobicContact CG-CB 4.38Å; F198-C202 WeakPolarHBondContact CE1-SG 3.41Å; F198-C202 PolarHBondContact O-N 3.03Å; F198-C202 PolarHBondContact O-SG 3.36Å; I199-C202 WeakPolarHBondContact O-CB 3.47Å; I199-C202 PolarHBondContact O-N 3.21Å; C202-V204 VanDerWaalsContact C-N 3.26Å; C202-V204 PolarHBondContact O-N 3.49Å; C202-L205 PolarHBondContact O-N 3.36Å
203W80.4Confident88.4Confident186 Ų18659.8 Ų59.871%0.70532%0.319SS*.THydrogen-bonded Turntrans-67-28.1176.5-79.115.7000113.1R99 W103 C201R99-W203 PolarHBondContact NH2-O 3.42Å; W103-W203 AromaticContact CD1-CD1 3.76Å; W103-W203 AromaticContact CD1-NE1 3.88Å; W103-W203 AromaticContact CE2-NE1 3.59Å; W103-W203 AromaticContact CZ2-NE1 3.91Å; W103-W203 AromaticContact NE1-CD1 3.45Å; W103-W203 AromaticContact NE1-NE1 3.11Å; W103-W203 VanDerWaalsContact NE1-NE1 3.11Å; C201-W203 PolarHBondContact O-N 3.23Å; C201-W203 VanDerWaalsContact O-N 3.09Å
204V86.9Confident87.8Confident127 Ų12760.4 Ų60.477%0.7733%0.327SS*.THydrogen-bonded Turntrans-85.1-19.4-178.3-173.90000111.8C201 C202C201-V204 PolarHBondContact O-N 3.2Å; C202-V204 VanDerWaalsContact C-N 3.26Å; C202-V204 PolarHBondContact O-N 3.49Å
205L88.8Confident87.4Confident46 Ų4660.8 Ų60.824%0.24132%0.322CS..PPolyproline II helixtrans-66.8128.8-176.4-67179.6000111.3R99 F198 C202R99-L205 WeakPolarHBondContact CD-O 3.38Å; R99-L205 PolarHBondContact NE-O 2.96Å; F198-L205 HydrophobicContact CZ-CD1 4.44Å; C202-L205 PolarHBondContact O-N 3.36Å
206P91.9Very high87.2Confident46 Ų4660.8 Ų60.830%0.29933%0.329SS..PPolyproline II helixtrans-71.2165.5170.330.1-33.8000111.2Y146 F150 I224Y146-P206 WeakPolarHBondContact CE2-O 3.28Å; Y146-P206 PolarHBondContact OH-O 3.35Å; F150-P206 HydrophobicContact CE1-CG 4.38Å; F150-P206 HydrophobicContact CZ-CG 3.97Å; P206-I224 HydrophobicContact CB-CD1 3.45Å; P206-I224 VanDerWaalsContact CB-CD1 3.45Å; P206-I224 HydrophobicContact CB-CG1 4.34Å; P206-I224 HydrophobicContact CG-CD1 4.28Å
207E93.1Very high86.9Confident19 Ų1963.2 Ų63.29%0.08933%0.333CS..PPolyproline II helixtrans-77.3157.4166.9-16658-92.900110.2R98 R99 W211 L212R98-E207 WeakPolarHBondContact CA-OE1 3.28Å; R98-E207 WeakPolarHBondContact CB-OE1 3.42Å; R98-E207 PolarHBondContact N-OE1 3.38Å; R98-E207 PolarHBondContact N-OE2 3.34Å; R99-E207 WeakPolarHBondContact CB-OE2 3.47Å; R99-E207 PolarHBondContact N-OE1 3.43Å; R99-E207 PolarHBondContact N-OE2 2.87Å; E207-W211 HydrophobicContact CG-CD2 4.18Å; E207-W211 HydrophobicContact CG-CE3 3.38Å; E207-W211 HydrophobicContact CG-CZ3 3.84Å; E207-L212 HydrophobicContact CB-CD1 4.32Å; E207-L212 HydrophobicContact CB-CD2 4.28Å; E207-L212 HydrophobicContact CB-CG 4.24Å; E207-L212 HydrophobicContact CG-CD2 4.31Å; E207-L212 HydrophobicContact CG-CG 4.28Å
208T90.7Very high86.8Confident0 Ų064.7 Ų64.70%033%0.329CS..PPolyproline II helixtrans-71.3142.1-177.163.70000112R98 Y146 E149 F150 F210 W211 L212R98-T208 HydrophobicContact CB-CG2 4.13Å; R98-T208 HydrophobicContact CG-CG2 4.22Å; Y146-T208 HydrophobicContact CD2-CG2 3.52Å; Y146-T208 HydrophobicContact CE2-CG2 3.96Å; Y146-T208 HydrophobicContact CG-CG2 4.14Å; E149-T208 HydrophobicContact CB-CG2 3.96Å; E149-T208 WeakPolarHBondContact OE2-CB 3.35Å; E149-T208 VanDerWaalsContact OE2-CG2 3.31Å; E149-T208 WeakPolarHBondContact OE2-CG2 3.48Å; E149-T208 PolarHBondContact OE2-OG1 3.37Å; F150-T208 HydrophobicContact CD2-CG2 4.3Å; F150-T208 HydrophobicContact CE2-CG2 3.73Å; F150-T208 HydrophobicContact CZ-CG2 4.45Å; T208-F210 VanDerWaalsContact C-N 3.28Å; T208-F210 PolarHBondContact O-N 3.41Å; T208-W211 PolarHBondContact O-N 3.36Å; T208-W211 VanDerWaalsContact OG1-CB 3.23Å; T208-W211 WeakPolarHBondContact OG1-CB 3.4Å; T208-W211 PolarHBondContact OG1-N 3.45Å; T208-L212 WeakPolarHBondContact O-CG 3.49Å; T208-L212 PolarHBondContact O-N 2.87Å; T208-L212 VanDerWaalsContact O-N 3.12Å
209P88.8Confident86.8Confident10 Ų1068.4 Ų68.47%0.06535%0.347CS..Hα-helixtrans-64.1-34-177.725-33.7000112.2L212 L213 I224 V225 M228P209-L212 PolarHBondContact O-N 3.35Å; P209-L213 WeakPolarHBondContact O-CB 3.35Å; P209-L213 WeakPolarHBondContact O-CG 3.45Å; P209-L213 PolarHBondContact O-N 3.5Å; P209-I224 HydrophobicContact CB-CG2 4.4Å; P209-V225 HydrophobicContact CB-CG2 4.36Å; P209-M228 HydrophobicContact CG-SD 4.34Å
210F85.7Confident86.8Confident118 Ų11870.8 Ų70.852%0.51836%0.358SS..Hα-helixtrans-66.7-39.9177.7-74.7-74.8000112.9E149 T208 L213 S214E149-F210 HydrophobicContact CB-CD2 3.87Å; E149-F210 HydrophobicContact CG-CB 4.33Å; E149-F210 HydrophobicContact CG-CD2 4.07Å; E149-F210 VanDerWaalsContact O-CD2 3.3Å; E149-F210 WeakPolarHBondContact O-CD2 3.48Å; E149-F210 WeakPolarHBondContact O-CE2 3.15Å; T208-F210 VanDerWaalsContact C-N 3.28Å; T208-F210 PolarHBondContact O-N 3.41Å; F210-L213 PolarHBondContact O-N 3.41Å; F210-S214 PolarHBondContact O-N 2.84Å; F210-S214 VanDerWaalsContact O-N 3.09Å; F210-S214 PolarHBondContact O-OG 3.27Å
211W87.6Confident86.8Confident19 Ų1964.9 Ų64.97%0.07233%0.327CS..Hα-helixtrans-68.4-42.5176-170.978.7000111.9D94 R98 E207 T208 L213 S214 E215D94-W211 PolarHBondContact O-NE1 3.44Å; R98-W211 VanDerWaalsContact NH1-CB 3.32Å; E207-W211 HydrophobicContact CG-CD2 4.18Å; E207-W211 HydrophobicContact CG-CE3 3.38Å; E207-W211 HydrophobicContact CG-CZ3 3.84Å; T208-W211 PolarHBondContact O-N 3.36Å; T208-W211 VanDerWaalsContact OG1-CB 3.23Å; T208-W211 WeakPolarHBondContact OG1-CB 3.4Å; T208-W211 PolarHBondContact OG1-N 3.45Å; W211-L213 VanDerWaalsContact C-N 3.25Å; W211-L213 PolarHBondContact O-N 3.29Å; W211-S214 WeakPolarHBondContact CA-OG 3.45Å; W211-S214 PolarHBondContact O-N 3.34Å; W211-S214 VanDerWaalsContact O-N 3.16Å; W211-S214 PolarHBondContact O-OG 3.33Å; W211-E215 HydrophobicContact CD2-CG 4.05Å; W211-E215 HydrophobicContact CE3-CG 4.27Å; W211-E215 HydrophobicContact CH2-CG 3.9Å; W211-E215 HydrophobicContact CZ2-CG 3.6Å; W211-E215 HydrophobicContact CZ3-CG 4.22Å; W211-E215 PolarHBondContact O-N 2.81Å
212L87.1Confident86.9Confident2 Ų263.1 Ų63.11%0.0131%0.311CS..Hα-helixtrans-60.4-38.2176.8-69.7170.3000111.7E207 T208 P209 G216 R217 E220 A221 I224E207-L212 HydrophobicContact CB-CD1 4.32Å; E207-L212 HydrophobicContact CB-CD2 4.28Å; E207-L212 HydrophobicContact CB-CG 4.24Å; E207-L212 HydrophobicContact CG-CD2 4.31Å; E207-L212 HydrophobicContact CG-CG 4.28Å; T208-L212 WeakPolarHBondContact O-CG 3.49Å; T208-L212 PolarHBondContact O-N 2.87Å; T208-L212 VanDerWaalsContact O-N 3.12Å; P209-L212 PolarHBondContact O-N 3.35Å; L212-G216 PolarHBondContact O-N 3.37Å; L212-R217 HydrophobicContact CB-CB 4.43Å; L212-R217 HydrophobicContact CD2-CB 4.09Å; L212-R217 PolarHBondContact O-N 2.99Å; L212-E220 HydrophobicContact CD1-CB 4.08Å; L212-E220 HydrophobicContact CD2-CB 4.22Å; L212-A221 HydrophobicContact CB-CB 3.87Å; L212-I224 HydrophobicContact CD1-CG1 4.22Å
213L84.8Confident87.3Confident46 Ų4669 Ų6924%0.24134%0.337CS..Hα-helixtrans-63.5-45.8173-81.9171.3000112.7P209 F210 W211 E215 G216 Y218 A221 L239P209-L213 WeakPolarHBondContact O-CB 3.35Å; P209-L213 WeakPolarHBondContact O-CG 3.45Å; P209-L213 PolarHBondContact O-N 3.5Å; F210-L213 PolarHBondContact O-N 3.41Å; W211-L213 VanDerWaalsContact C-N 3.25Å; W211-L213 PolarHBondContact O-N 3.29Å; L213-E215 VanDerWaalsContact C-N 3.25Å; L213-E215 PolarHBondContact O-N 3.02Å; L213-G216 PolarHBondContact O-N 3.29Å; L213-G216 VanDerWaalsContact O-N 3.09Å; L213-Y218 HydrophobicContact CD2-CD1 3.78Å; L213-Y218 HydrophobicContact CD2-CE1 3.98Å; L213-A221 HydrophobicContact CD2-CB 4.36Å; L213-A221 HydrophobicContact CG-CB 4.14Å; L213-L239 HydrophobicContact CD1-CD1 4.19Å; L213-L239 HydrophobicContact CD1-CD2 4.29Å; L213-L239 HydrophobicContact CD2-CD1 4.26Å; L213-L239 HydrophobicContact CD2-CD2 3.38Å; L213-L239 HydrophobicContact CD2-CG 3.86Å; L213-L239 HydrophobicContact CG-CD2 4.01Å
214S80.3Confident87.8Confident86 Ų8661.4 Ų61.460%0.60131%0.309SS*.Hα-helixtrans-65.3-29.7179.956.70000113.2F210 W211 G216F210-S214 PolarHBondContact O-N 2.84Å; F210-S214 VanDerWaalsContact O-N 3.09Å; F210-S214 PolarHBondContact O-OG 3.27Å; W211-S214 WeakPolarHBondContact CA-OG 3.45Å; W211-S214 PolarHBondContact O-N 3.34Å; W211-S214 VanDerWaalsContact O-N 3.16Å; W211-S214 PolarHBondContact O-OG 3.33Å; S214-G216 VanDerWaalsContact C-N 3.31Å
215E83.3Confident87.9Confident106 Ų10657 Ų5750%0.49528%0.282SS..THydrogen-bonded Turntrans-86.22.6175.7-68.8-64.9137.300113.4W211 L213 R217W211-E215 HydrophobicContact CD2-CG 4.05Å; W211-E215 HydrophobicContact CE3-CG 4.27Å; W211-E215 HydrophobicContact CH2-CG 3.9Å; W211-E215 HydrophobicContact CZ2-CG 3.6Å; W211-E215 HydrophobicContact CZ3-CG 4.22Å; W211-E215 PolarHBondContact O-N 2.81Å; L213-E215 VanDerWaalsContact C-N 3.25Å; L213-E215 PolarHBondContact O-N 3.02Å; E215-R217 VanDerWaalsContact C-N 3.29Å; E215-R217 HydrophobicContact CB-CG 4.42Å; E215-R217 PolarHBondContact O-N 2.98Å
216G82.7Confident87.9Confident34 Ų3457.6 Ų57.635%0.35129%0.286SS..THydrogen-bonded Turntrans72.715.2179.700000115L212 L213 S214 Y218L212-G216 PolarHBondContact O-N 3.37Å; L213-G216 PolarHBondContact O-N 3.29Å; L213-G216 VanDerWaalsContact O-N 3.09Å; S214-G216 VanDerWaalsContact C-N 3.31Å; G216-Y218 VanDerWaalsContact C-N 3.28Å; G216-Y218 WeakPolarHBondContact O-CD2 3.34Å; G216-Y218 WeakPolarHBondContact O-CE2 3.42Å; G216-Y218 PolarHBondContact O-N 3.39Å; G216-Y218 VanDerWaalsContact O-N 3.09Å
217R86.8Confident87.8Confident100 Ų10059.3 Ų59.338%0.37729%0.292SS..  trans-86.662.9179.1-65.4173.370-171.66.7111.3L212 E215 E219 E220 A221L212-R217 HydrophobicContact CB-CB 4.43Å; L212-R217 HydrophobicContact CD2-CB 4.09Å; L212-R217 PolarHBondContact O-N 2.99Å; E215-R217 VanDerWaalsContact C-N 3.29Å; E215-R217 HydrophobicContact CB-CG 4.42Å; E215-R217 PolarHBondContact O-N 2.98Å; R217-E219 PolarHBondContact O-N 3.05Å; R217-E220 IonicContact CZ-OE1 2.79Å; R217-E220 VanDerWaalsContact CZ-OE1 3.23Å; R217-E220 IonicContact CZ-OE2 3.72Å; R217-E220 IonicContact NE-OE1 2.65Å; R217-E220 PolarHBondContact NE-OE1 3.17Å; R217-E220 IonicContact NE-OE2 3.6Å; R217-E220 IonicContact NH2-OE1 2.92Å; R217-E220 PolarHBondContact NH2-OE1 3.33Å; R217-E220 IonicContact NH2-OE2 2.69Å; R217-E220 PolarHBondContact NH2-OE2 3.28Å; R217-E220 PolarHBondContact O-N 3.26Å; R217-A221 PolarHBondContact O-N 2.89Å; R217-A221 VanDerWaalsContact O-N 3.11Å
218Y87Confident87.6Confident111 Ų11160.7 Ų60.744%0.43530%0.299SS..Hα-helixtrans-62.2-38.7-171-58-70.9000114.6L213 G216 E220 A221 Q222 L243L213-Y218 HydrophobicContact CD2-CD1 3.78Å; L213-Y218 HydrophobicContact CD2-CE1 3.98Å; G216-Y218 VanDerWaalsContact C-N 3.28Å; G216-Y218 WeakPolarHBondContact O-CD2 3.34Å; G216-Y218 WeakPolarHBondContact O-CE2 3.42Å; G216-Y218 PolarHBondContact O-N 3.39Å; G216-Y218 VanDerWaalsContact O-N 3.09Å; Y218-E220 VanDerWaalsContact C-N 3.35Å; Y218-E220 PolarHBondContact O-N 3.24Å; Y218-A221 PolarHBondContact O-N 3.24Å; Y218-Q222 WeakPolarHBondContact O-CB 3.49Å; Y218-Q222 PolarHBondContact O-N 3.47Å; Y218-L243 HydrophobicContact CD1-CD2 4.4Å; Y218-L243 HydrophobicContact CE1-CD1 3.85Å; Y218-L243 HydrophobicContact CE1-CD2 3.64Å; Y218-L243 HydrophobicContact CE1-CG 4.4Å
219E87.9Confident87.5Confident153 Ų15361.3 Ų61.372%0.71530%0.304SS*.Hα-helixtrans-65-39.4-179.4-65.9-171.1176.900112.5R217 K223R217-E219 PolarHBondContact O-N 3.05Å; E219-K223 WeakPolarHBondContact O-CG 3.34Å; E219-K223 PolarHBondContact O-N 3.25Å; E219-K223 VanDerWaalsContact O-N 3.16Å
220E88.8Confident87.5Confident76 Ų7669 Ų6936%0.35534%0.336SS..Hα-helixtrans-71.4-41.7177.2-68.5-176-136.800111.2L212 R217 Y218 Q222 K223 I224L212-E220 HydrophobicContact CD1-CB 4.08Å; L212-E220 HydrophobicContact CD2-CB 4.22Å; R217-E220 IonicContact CZ-OE1 2.79Å; R217-E220 VanDerWaalsContact CZ-OE1 3.23Å; R217-E220 IonicContact CZ-OE2 3.72Å; R217-E220 IonicContact NE-OE1 2.65Å; R217-E220 PolarHBondContact NE-OE1 3.17Å; R217-E220 IonicContact NE-OE2 3.6Å; R217-E220 IonicContact NH2-OE1 2.92Å; R217-E220 PolarHBondContact NH2-OE1 3.33Å; R217-E220 IonicContact NH2-OE2 2.69Å; R217-E220 PolarHBondContact NH2-OE2 3.28Å; R217-E220 PolarHBondContact O-N 3.26Å; Y218-E220 VanDerWaalsContact C-N 3.35Å; Y218-E220 PolarHBondContact O-N 3.24Å; E220-Q222 VanDerWaalsContact C-N 3.29Å; E220-Q222 PolarHBondContact O-N 3.09Å; E220-K223 PolarHBondContact O-N 3.45Å; E220-I224 WeakPolarHBondContact O-CG1 3.46Å; E220-I224 PolarHBondContact O-N 2.69Å; E220-I224 VanDerWaalsContact O-N 3.16Å
221A89.2Confident87.6Confident0 Ų073.4 Ų73.40%035%0.35CS..Hα-helixtrans-57.6-43.7173.600000111.3L212 L213 R217 Y218 K223 I224 V225 L239L212-A221 HydrophobicContact CB-CB 3.87Å; L213-A221 HydrophobicContact CD2-CB 4.36Å; L213-A221 HydrophobicContact CG-CB 4.14Å; R217-A221 PolarHBondContact O-N 2.89Å; R217-A221 VanDerWaalsContact O-N 3.11Å; Y218-A221 PolarHBondContact O-N 3.24Å; A221-K223 PolarHBondContact O-N 3.4Å; A221-I224 PolarHBondContact O-N 2.73Å; A221-V225 WeakPolarHBondContact O-CG2 3.44Å; A221-V225 PolarHBondContact O-N 3.49Å; A221-L239 HydrophobicContact CB-CD2 3.62Å
222Q89.6Confident87.6Confident37 Ų3778.4 Ų78.417%0.17338%0.378CS..Hα-helixtrans-60-45.7177-174.965.15400111.9Y218 E220 I224 V225 D226 C237Y218-Q222 WeakPolarHBondContact O-CB 3.49Å; Y218-Q222 PolarHBondContact O-N 3.47Å; E220-Q222 VanDerWaalsContact C-N 3.29Å; E220-Q222 PolarHBondContact O-N 3.09Å; Q222-I224 VanDerWaalsContact C-N 3.29Å; Q222-I224 PolarHBondContact O-N 2.91Å; Q222-V225 PolarHBondContact O-N 3.15Å; Q222-D226 PolarHBondContact NE2-OD1 3.32Å; Q222-D226 PolarHBondContact NE2-OD2 3.43Å; Q222-D226 WeakPolarHBondContact O-CB 3.48Å; Q222-D226 VanDerWaalsContact O-CG 3.28Å; Q222-D226 PolarHBondContact O-N 3.05Å; Q222-C237 PolarHBondContact NE2-O 2.85Å
223K91.8Very high87.6Confident128 Ų12889.6 Ų89.656%0.55742%0.42SS*.Hα-helixtrans-56.8-43.2177.2-72.3169.8-174.8168.10111.9E219 E220 A221 D226 I227E219-K223 WeakPolarHBondContact O-CG 3.34Å; E219-K223 PolarHBondContact O-N 3.25Å; E219-K223 VanDerWaalsContact O-N 3.16Å; E220-K223 PolarHBondContact O-N 3.45Å; A221-K223 PolarHBondContact O-N 3.4Å; K223-D226 PolarHBondContact O-N 3.41Å; K223-I227 WeakPolarHBondContact O-CD1 3.46Å; K223-I227 VanDerWaalsContact O-CG1 3.28Å; K223-I227 WeakPolarHBondContact O-CG1 3.21Å; K223-I227 PolarHBondContact O-N 3.42Å; K223-I227 VanDerWaalsContact O-N 3.13Å
224I90.9Very high87.6Confident25 Ų2590.3 Ų90.313%0.12843%0.432CS..Hα-helixtrans-67-44.7178-60.7-51.8000111F150 P206 P209 L212 E220 A221 Q222 D226 I227 M228F150-I224 HydrophobicContact CE1-CG2 3.89Å; P206-I224 HydrophobicContact CB-CD1 3.45Å; P206-I224 VanDerWaalsContact CB-CD1 3.45Å; P206-I224 HydrophobicContact CB-CG1 4.34Å; P206-I224 HydrophobicContact CG-CD1 4.28Å; P209-I224 HydrophobicContact CB-CG2 4.4Å; L212-I224 HydrophobicContact CD1-CG1 4.22Å; E220-I224 WeakPolarHBondContact O-CG1 3.46Å; E220-I224 PolarHBondContact O-N 2.69Å; E220-I224 VanDerWaalsContact O-N 3.16Å; A221-I224 PolarHBondContact O-N 2.73Å; Q222-I224 VanDerWaalsContact C-N 3.29Å; Q222-I224 PolarHBondContact O-N 2.91Å; I224-D226 VanDerWaalsContact C-N 3.3Å; I224-D226 PolarHBondContact O-N 2.99Å; I224-I227 HydrophobicContact CD1-CD1 4.41Å; I224-I227 PolarHBondContact O-N 3Å; I224-M228 HydrophobicContact CG2-CG 4.47Å; I224-M228 HydrophobicContact CG2-SD 4.1Å; I224-M228 VanDerWaalsContact O-CG 3.31Å; I224-M228 WeakPolarHBondContact O-CG 3.43Å; I224-M228 PolarHBondContact O-N 3.13Å
225V89.1Confident87.5Confident34 Ų3491.4 Ų91.421%0.20644%0.44CS..Hα-helixtrans-60.8-39.4177.2171.60000111.5P209 A221 Q222 M228 A229P209-V225 HydrophobicContact CB-CG2 4.36Å; A221-V225 WeakPolarHBondContact O-CG2 3.44Å; A221-V225 PolarHBondContact O-N 3.49Å; Q222-V225 PolarHBondContact O-N 3.15Å; V225-M228 PolarHBondContact O-N 3.29Å; V225-A229 WeakPolarHBondContact O-CB 3.49Å; V225-A229 PolarHBondContact O-N 3.01Å
226D89.5Confident87.1Confident60 Ų6089.9 Ų89.932%0.32144%0.441SS..Hα-helixtrans-66-39.6176.9-70.9-28.8000112.2Q222 K223 I224 A229 K230 S236Q222-D226 PolarHBondContact NE2-OD1 3.32Å; Q222-D226 PolarHBondContact NE2-OD2 3.43Å; Q222-D226 WeakPolarHBondContact O-CB 3.48Å; Q222-D226 VanDerWaalsContact O-CG 3.28Å; Q222-D226 PolarHBondContact O-N 3.05Å; K223-D226 PolarHBondContact O-N 3.41Å; I224-D226 VanDerWaalsContact C-N 3.3Å; I224-D226 PolarHBondContact O-N 2.99Å; D226-A229 PolarHBondContact O-N 2.94Å; D226-K230 WeakPolarHBondContact O-CB 3.42Å; D226-K230 PolarHBondContact O-N 3.26Å; D226-S236 PolarHBondContact OD1-OG 3.02Å
227I88.8Confident86.7Confident82 Ų8291 Ų9142%0.42144%0.443SS..Hα-helixtrans-61.6-46.2172.8-67.4163.7000110K223 I224 A229 K230 W231K223-I227 WeakPolarHBondContact O-CD1 3.46Å; K223-I227 VanDerWaalsContact O-CG1 3.28Å; K223-I227 WeakPolarHBondContact O-CG1 3.21Å; K223-I227 PolarHBondContact O-N 3.42Å; K223-I227 VanDerWaalsContact O-N 3.13Å; I224-I227 HydrophobicContact CD1-CD1 4.41Å; I224-I227 PolarHBondContact O-N 3Å; I227-A229 PolarHBondContact O-N 3.14Å; I227-K230 PolarHBondContact O-N 3.49Å; I227-W231 HydrophobicContact CG2-CD2 4.44Å; I227-W231 HydrophobicContact CG2-CZ2 4.38Å; I227-W231 PolarHBondContact O-N 2.93Å
228M88.6Confident86.3Confident48 Ų4892.1 Ų92.124%0.23645%0.45CS..Hα-helixtrans-62.3-42.4177.5-68.2175.272.500111.8F150 P209 I224 V225 W231 N232F150-M228 HydrophobicContact CD1-CE 4.06Å; F150-M228 HydrophobicContact CD1-SD 3.86Å; F150-M228 HydrophobicContact CE1-SD 4.21Å; F150-M228 WeakPolarHBondContact O-CE 3.49Å; P209-M228 HydrophobicContact CG-SD 4.34Å; I224-M228 HydrophobicContact CG2-CG 4.47Å; I224-M228 HydrophobicContact CG2-SD 4.1Å; I224-M228 VanDerWaalsContact O-CG 3.31Å; I224-M228 WeakPolarHBondContact O-CG 3.43Å; I224-M228 PolarHBondContact O-N 3.13Å; V225-M228 PolarHBondContact O-N 3.29Å; M228-W231 PolarHBondContact O-N 3.07Å; M228-N232 WeakPolarHBondContact O-CB 3.49Å; M228-N232 PolarHBondContact O-N 3.04Å; M228-N232 PolarHBondContact O-ND2 3.27Å; M228-N232 VanDerWaalsContact O-ND2 3.12Å
229A88.6Confident85.8Confident12 Ų1287.9 Ų87.910%0.09944%0.435CS..Hα-helixtrans-63-42.9176.600000111.3V225 D226 I227 W231 N232 R233 A234V225-A229 WeakPolarHBondContact O-CB 3.49Å; V225-A229 PolarHBondContact O-N 3.01Å; D226-A229 PolarHBondContact O-N 2.94Å; I227-A229 PolarHBondContact O-N 3.14Å; A229-W231 PolarHBondContact O-N 2.91Å; A229-N232 CarbonylContact O-C 3.58Å; A229-N232 PolarHBondContact O-N 3.45Å; A229-R233 PolarHBondContact O-N 2.89Å; A229-A234 PolarHBondContact O-N 2.8Å
230K89.5Confident84.9Confident172 Ų17284.5 Ų84.575%0.74843%0.428SS*.Hα-helixtrans-61.6-43.6176-171.9177-177.7178.30112.1D226 I227 R233D226-K230 WeakPolarHBondContact O-CB 3.42Å; D226-K230 PolarHBondContact O-N 3.26Å; I227-K230 PolarHBondContact O-N 3.49Å; K230-R233 PolarHBondContact O-N 2.98Å
231W88.1Confident83.7Confident211 Ų21186.1 Ų86.180%0.79944%0.436SS*.Hα-helixtrans-66.6-38.6177.3-74.711.7000112.4I227 M228 A229 R233I227-W231 HydrophobicContact CG2-CD2 4.44Å; I227-W231 HydrophobicContact CG2-CZ2 4.38Å; I227-W231 PolarHBondContact O-N 2.93Å; M228-W231 PolarHBondContact O-N 3.07Å; A229-W231 PolarHBondContact O-N 2.91Å; W231-R233 VanDerWaalsContact C-N 3.27Å; W231-R233 PolarHBondContact O-N 3.43Å
232N87.4Confident82.7Confident124 Ų12490.4 Ų90.466%0.66346%0.458SS*.THydrogen-bonded Turntrans-82.90.3178.1-68.7-37.3000113.8M228 A229 A234M228-N232 WeakPolarHBondContact O-CB 3.49Å; M228-N232 PolarHBondContact O-N 3.04Å; M228-N232 PolarHBondContact O-ND2 3.27Å; M228-N232 VanDerWaalsContact O-ND2 3.12Å; A229-N232 CarbonylContact O-C 3.58Å; A229-N232 PolarHBondContact O-N 3.45Å; N232-A234 HydrophobicContact CB-CB 4.46Å; N232-A234 PolarHBondContact O-N 3.35Å
233R87.4Confident81.7Confident237 Ų23791.6 Ų91.689%0.89447%0.465SS*.THydrogen-bonded Turntrans51.635.9-173.9-55.1-179.6-178.1-179-0.1112.8A229 K230 W231A229-R233 PolarHBondContact O-N 2.89Å; K230-R233 PolarHBondContact O-N 2.98Å; W231-R233 VanDerWaalsContact C-N 3.27Å; W231-R233 PolarHBondContact O-N 3.43Å
234A83.8Confident80.1Confident60 Ų6087.8 Ų87.850%0.49646%0.455SS..PPolyproline II helixtrans-99.7160.7177.500000110.7A229 N232A229-A234 PolarHBondContact O-N 2.8Å; N232-A234 HydrophobicContact CB-CB 4.46Å; N232-A234 PolarHBondContact O-N 3.35Å
235S79.5Confident78.5Confident110 Ų11092 Ų9277%0.76948%0.477SS*.PPolyproline II helixtrans-63.4138.1171.345.90000110.5C237S235-C237 PolarHBondContact O-N 2.86Å
236S73.1Confident77Confident74 Ų7497.1 Ų97.152%0.51750%0.504SS..PPolyproline II helixtrans-60.4130.2171.3167.30000108.7D226D226-S236 PolarHBondContact OD1-OG 3.02Å
237C74.3Confident75.3Confident58 Ų58100.2 Ų100.239%0.39252%0.52SS..PPolyproline II helixtrans-102.2124.1176.1-175.30000107.9Q222 S235 L239 L242Q222-C237 PolarHBondContact NE2-O 2.85Å; S235-C237 PolarHBondContact O-N 2.86Å; C237-L239 PolarHBondContact O-N 3.29Å; C237-L242 WeakPolarHBondContact SG-CD1 3.4Å
238K79.1Confident73Confident123 Ų123103.8 Ų103.854%0.53553%0.534SS..  trans-76.5113173.8-73.2-176.5-177.8173.10109.3S240 E241K238-S240 PolarHBondContact O-N 2.96Å; K238-E241 HydrophobicContact CB-CG 4.19Å; K238-E241 PolarHBondContact O-N 3.27Å; K238-E241 VanDerWaalsContact O-N 3.09Å
239L76.8Confident70.7Confident21 Ų21103 Ų10311%0.1154%0.538CS..Hα-helixtrans-63.1-28.6-178.6-161.361.2000112.1L213 A221 C237 E241 L242 L243L213-L239 HydrophobicContact CD1-CD1 4.19Å; L213-L239 HydrophobicContact CD1-CD2 4.29Å; L213-L239 HydrophobicContact CD2-CD1 4.26Å; L213-L239 HydrophobicContact CD2-CD2 3.38Å; L213-L239 HydrophobicContact CD2-CG 3.86Å; L213-L239 HydrophobicContact CG-CD2 4.01Å; A221-L239 HydrophobicContact CB-CD2 3.62Å; C237-L239 PolarHBondContact O-N 3.29Å; L239-E241 VanDerWaalsContact C-N 3.29Å; L239-E241 PolarHBondContact O-N 3.01Å; L239-L242 HydrophobicContact CD1-CD1 4.38Å; L239-L242 PolarHBondContact O-N 3.25Å; L239-L243 PolarHBondContact O-N 3.05Å
240S68.4Low68.2Low82 Ų82109 Ų10957%0.57358%0.576SS**Hα-helixtrans-60.4-34.8173.957.50000113.3K238 S244K238-S240 PolarHBondContact O-N 2.96Å; S240-S244 WeakPolarHBondContact O-CB 3.33Å; S240-S244 PolarHBondContact O-N 3.38Å; S240-S244 PolarHBondContact O-OG 3.28Å
241E64.8Low65.8Low111 Ų111105.3 Ų105.352%0.51957%0.568SS.*Hα-helixtrans-75.2-40.1178.8-68.7173.4-171.800110.7K238 L239 S244 L245K238-E241 HydrophobicContact CB-CG 4.19Å; K238-E241 PolarHBondContact O-N 3.27Å; K238-E241 VanDerWaalsContact O-N 3.09Å; L239-E241 VanDerWaalsContact C-N 3.29Å; L239-E241 PolarHBondContact O-N 3.01Å; E241-S244 WeakPolarHBondContact CA-OG 2.83Å; E241-S244 PolarHBondContact O-N 3.22Å; E241-S244 PolarHBondContact O-OG 2.92Å; E241-L245 WeakPolarHBondContact O-CG 3.49Å; E241-L245 PolarHBondContact O-N 3.48Å; E241-L245 VanDerWaalsContact O-N 3.12Å
242L68.3Low62.9Low90 Ų9099.9 Ų99.947%0.47156%0.562SS.*Hα-helixtrans-63.5-43.1174.3-77.6170.5000112.8C237 L239 S244 L245 D246C237-L242 WeakPolarHBondContact SG-CD1 3.4Å; L239-L242 HydrophobicContact CD1-CD1 4.38Å; L239-L242 PolarHBondContact O-N 3.25Å; L242-S244 VanDerWaalsContact C-N 3.29Å; L242-S244 PolarHBondContact O-N 3.03Å; L242-L245 PolarHBondContact O-N 2.91Å; L242-D246 PolarHBondContact O-N 3.26Å
243L66.8Low60.1Low61 Ų61101.5 Ų101.532%0.31957%0.571SS.*Hα-helixtrans-65.1-36.8178.2-152.988.8000111.4Y218 L239 L245 D246 L247Y218-L243 HydrophobicContact CD1-CD2 4.4Å; Y218-L243 HydrophobicContact CE1-CD1 3.85Å; Y218-L243 HydrophobicContact CE1-CD2 3.64Å; Y218-L243 HydrophobicContact CE1-CG 4.4Å; L239-L243 PolarHBondContact O-N 3.05Å; L243-L245 VanDerWaalsContact C-N 3.32Å; L243-L245 PolarHBondContact O-N 2.92Å; L243-D246 PolarHBondContact O-N 3.1Å; L243-L247 HydrophobicContact CD2-CD1 4.46Å; L243-L247 WeakPolarHBondContact O-CG 3.45Å; L243-L247 PolarHBondContact O-N 3.42Å; L243-L247 VanDerWaalsContact O-N 3.12Å
244S59.2Low57.3Low49 Ų4993.8 Ų93.834%0.34355%0.553SS.*Hα-helixtrans-68.1-30176.5710000113.3S240 E241 L242 Q248S240-S244 WeakPolarHBondContact O-CB 3.33Å; S240-S244 PolarHBondContact O-N 3.38Å; S240-S244 PolarHBondContact O-OG 3.28Å; E241-S244 WeakPolarHBondContact CA-OG 2.83Å; E241-S244 PolarHBondContact O-N 3.22Å; E241-S244 PolarHBondContact O-OG 2.92Å; L242-S244 VanDerWaalsContact C-N 3.29Å; L242-S244 PolarHBondContact O-N 3.03Å; S244-Q248 WeakPolarHBondContact O-CB 3.44Å; S244-Q248 VanDerWaalsContact O-CG 3.23Å; S244-Q248 WeakPolarHBondContact O-CG 3.2Å; S244-Q248 PolarHBondContact O-N 3.18Å
245L57.8Low54.9Low113 Ų11396.2 Ų96.259%0.59256%0.564SS**Hα-helixtrans-72.8-37174.6-75.3161.2000112.3E241 L242 L243 Q248 G249E241-L245 WeakPolarHBondContact O-CG 3.49Å; E241-L245 PolarHBondContact O-N 3.48Å; E241-L245 VanDerWaalsContact O-N 3.12Å; L242-L245 PolarHBondContact O-N 2.91Å; L243-L245 VanDerWaalsContact C-N 3.32Å; L243-L245 PolarHBondContact O-N 2.92Å; L245-Q248 PolarHBondContact O-N 2.92Å; L245-G249 PolarHBondContact O-N 2.97Å
246D57.6Low52.7Low142 Ų14297.6 Ų97.676%0.75957%0.568SS**Hα-helixtrans-72.2-33.2178.2-144.922.6000111.6L242 L243 Q248L242-D246 PolarHBondContact O-N 3.26Å; L243-D246 PolarHBondContact O-N 3.1Å; D246-Q248 VanDerWaalsContact C-N 3.34Å
247L54.1Low50.7Low125 Ų125101.4 Ų101.465%0.65458%0.578SS**Hα-helixtrans-73.7-19.7172.5-74.7164.3000113.9L243L243-L247 HydrophobicContact CD2-CD1 4.46Å; L243-L247 WeakPolarHBondContact O-CG 3.45Å; L243-L247 PolarHBondContact O-N 3.42Å; L243-L247 VanDerWaalsContact O-N 3.12Å
248Q40.5Very low49.1Very low157 Ų157105.1 Ų105.173%0.73460%0.598SS**Hα-helixtrans-97.2-6.1178.8-75.2178.38.700114S244 L245 D246S244-Q248 WeakPolarHBondContact O-CB 3.44Å; S244-Q248 VanDerWaalsContact O-CG 3.23Å; S244-Q248 WeakPolarHBondContact O-CG 3.2Å; S244-Q248 PolarHBondContact O-N 3.18Å; L245-Q248 PolarHBondContact O-N 2.92Å; D246-Q248 VanDerWaalsContact C-N 3.34Å
249G40.3Very low47.2Very low31 Ų31105 Ų10532%0.3260%0.6SS.*SBendtrans-62.7157.8165.500000111L245 V251L245-G249 PolarHBondContact O-N 2.97Å; G249-V251 WeakPolarHBondContact O-CG2 3.21Å; G249-V251 PolarHBondContact O-N 3.3Å
250P35.8Very low45.6Very low137 Ų137113.1 Ų113.189%0.8963%0.634SS**  trans-57.7103.8-178.723.4-31.4000109.8S252P250-S252 PolarHBondContact O-N 3.17Å
251V38.5Very low44.9Very low96 Ų96112.4 Ų112.458%0.58262%0.621SS**  trans-64103.5-179-178.80000107.8G249 N253G249-V251 WeakPolarHBondContact O-CG2 3.21Å; G249-V251 PolarHBondContact O-N 3.3Å; V251-N253 VanDerWaalsContact CG1-OD1 3.3Å; V251-N253 WeakPolarHBondContact CG1-OD1 3.25Å; V251-N253 PolarHBondContact O-N 3.18Å; V251-N253 VanDerWaalsContact O-N 3.15Å
252S28.5Very low45.2Very low96 Ų96112.6 Ų112.667%0.67163%0.626SS**  trans-68.4107.6153.366.70000106P250 S254P250-S252 PolarHBondContact O-N 3.17Å; S252-S254 PolarHBondContact O-N 3.29Å
253N27.8Very low45.4Very low159 Ų159112.9 Ų112.985%0.8563%0.627SS**SBendtrans-62.372.3175.6-76.9-29.7000111.8V251V251-N253 VanDerWaalsContact CG1-OD1 3.3Å; V251-N253 WeakPolarHBondContact CG1-OD1 3.25Å; V251-N253 PolarHBondContact O-N 3.18Å; V251-N253 VanDerWaalsContact O-N 3.15Å
254S28.3Very low45.6Very low75 Ų75114.2 Ų114.252%0.52464%0.642SS.*SBendtrans-133.6130.7155.854.20000106.3S252 T256S252-S254 PolarHBondContact O-N 3.29Å; S254-T256 PolarHBondContact O-N 3.2Å
255P32.5Very low46.3Very low110 Ų110117.6 Ų117.671%0.71465%0.648SS**  trans-50.3132.9161.824.5-30.4000105.9E257P255-E257 PolarHBondContact O-N 3.46Å
256T34.2Very low47.2Very low139 Ų139112.2 Ų112.285%0.85362%0.62SS**  trans-64.564.3162.823.10000107.7S254 V258S254-T256 PolarHBondContact O-N 3.2Å; T256-V258 PolarHBondContact O-N 2.95Å
257E32.2Very low48.3Very low155 Ų155110.1 Ų110.172%0.72460%0.604SS**  trans-49.3116.6143.3-81-165.9150.100104.1P255 Q259P255-E257 PolarHBondContact O-N 3.46Å; E257-Q259 PolarHBondContact O-N 2.88Å
258V39.3Very low49.6Very low135 Ų135113.5 Ų113.582%0.81861%0.609SS**  trans-55.488.1159.8178.40000104.5T256 K260T256-V258 PolarHBondContact O-N 2.95Å; V258-K260 PolarHBondContact O-N 3.34Å
259Q39Very low51.6Low122 Ų122109.8 Ų109.857%0.5760%0.595SS**  trans-58.2110.4-178.9-138.1178.831.600103.2E257 H261E257-Q259 PolarHBondContact O-N 2.88Å; Q259-H261 PolarHBondContact O-CD2 3.24Å; Q259-H261 PolarHBondContact O-N 2.88Å
260K43.3Very low53.7Low191 Ų191116.9 Ų116.983%0.8361%0.612SS**  trans-60.693.2177.5-79.5-179.8178.51750105.9V258 N262V258-K260 PolarHBondContact O-N 3.34Å; K260-N262 PolarHBondContact O-N 3.05Å
261H55Low56Low66 Ų66113.1 Ų113.131%0.30659%0.589SS.*  trans-67.5102.3-179.8-69.4-59000106.6Q259 L393Q259-H261 PolarHBondContact O-CD2 3.24Å; Q259-H261 PolarHBondContact O-N 2.88Å; H261-L393 HydrophobicContact CB-CD2 4.26Å
262N70.1Confident58.2Low115 Ų115110.8 Ų110.862%0.61557%0.573SS**  trans-59.1142.5175.6-89.8-27.6000109.6K260 S264 Y265K260-N262 PolarHBondContact O-N 3.05Å; N262-S264 PolarHBondContact O-N 3.39Å; N262-Y265 HydrophobicContact CB-CD2 4.5Å; N262-Y265 WeakPolarHBondContact O-CD2 3.35Å; N262-Y265 PolarHBondContact O-N 3Å
263L72.8Confident60.9Low97 Ų97107.3 Ų107.351%0.50855%0.547SS..G310 helixtrans-50.6-25.2175.3-80.5161.8000113Y265 L266 L393L263-Y265 PolarHBondContact O-N 3.46Å; L263-L266 HydrophobicContact CD2-CD1 3.91Å; L263-L266 WeakPolarHBondContact O-CB 3.43Å; L263-L266 PolarHBondContact O-N 3.42Å; L263-L266 VanDerWaalsContact O-N 3.1Å; L263-L393 HydrophobicContact CD2-CD1 3.84Å; L263-L393 HydrophobicContact CD2-CG 4.32Å; L263-L393 HydrophobicContact CG-CD1 4.17Å
264S71.7Confident63.8Low88 Ų88105.4 Ų105.462%0.61553%0.532SS*.G310 helixtrans-55.1-28.1174.9-1780000114.1N262 L266 F267 Y268N262-S264 PolarHBondContact O-N 3.39Å; S264-L266 PolarHBondContact O-N 3.31Å; S264-F267 PolarHBondContact O-N 3.37Å; S264-Y268 PolarHBondContact O-N 3.36Å
265Y73.4Confident66.7Low121 Ų121107.8 Ų107.848%0.47553%0.529SS..G310 helixtrans-64.5-25.6177-81.7-82.3000113.7N262 L263 F267 Y268N262-Y265 HydrophobicContact CB-CD2 4.5Å; N262-Y265 WeakPolarHBondContact O-CD2 3.35Å; N262-Y265 PolarHBondContact O-N 3Å; L263-Y265 PolarHBondContact O-N 3.46Å; Y265-F267 PolarHBondContact O-N 3.39Å; Y265-Y268 WeakPolarHBondContact O-CB 3.42Å; Y265-Y268 PolarHBondContact O-N 3Å
266L76.3Confident69.3Low0 Ų0102.6 Ų102.60%050%0.495CS..G310 helixtrans-68-18.5173.1-74.3158.4000112.8L263 S264 T276 Y386 L393 A394L263-L266 HydrophobicContact CD2-CD1 3.91Å; L263-L266 WeakPolarHBondContact O-CB 3.43Å; L263-L266 PolarHBondContact O-N 3.42Å; L263-L266 VanDerWaalsContact O-N 3.1Å; S264-L266 PolarHBondContact O-N 3.31Å; L266-T276 HydrophobicContact CB-CG2 4.26Å; L266-T276 HydrophobicContact CD1-CG2 4.48Å; L266-T276 HydrophobicContact CD2-CG2 4.09Å; L266-Y386 HydrophobicContact CD2-CD1 4.44Å; L266-Y386 HydrophobicContact CD2-CE1 3.85Å; L266-L393 HydrophobicContact CD1-CD2 4.03Å; L266-L393 HydrophobicContact CD1-CG 3.82Å; L266-L393 HydrophobicContact CG-CD2 3.99Å; L266-L393 HydrophobicContact CG-CG 4.22Å; L266-A394 HydrophobicContact CD2-CB 3.97Å
267F81.6Confident72Confident98 Ų98100.8 Ų100.843%0.4348%0.48SS..G310 helixtrans-108.44.7-177.3-61.8-81.7000113.2S264 Y265 N269 T273 W280S264-F267 PolarHBondContact O-N 3.37Å; Y265-F267 PolarHBondContact O-N 3.39Å; F267-N269 VanDerWaalsContact C-N 3.34Å; F267-N269 PolarHBondContact O-N 2.93Å; F267-T273 WeakPolarHBondContact CA-OG1 3.41Å; F267-T273 HydrophobicContact CD1-CG2 3.68Å; F267-T273 HydrophobicContact CE1-CG2 4.13Å; F267-W280 HydrophobicContact CE2-CH2 4.16Å; F267-W280 AromaticContact CZ-CH2 3.68Å; F267-W280 HydrophobicContact CZ-CH2 3.68Å; F267-W280 HydrophobicContact CZ-CZ2 4.28Å; F267-W280 HydrophobicContact CZ-CZ3 4.11Å
268Y79.9Confident74.8Confident195 Ų19597.2 Ų97.277%0.76547%0.469SS*.SBendtrans-64.4-36.1-176178.2-101.5000113.2S264 Y265S264-Y268 PolarHBondContact O-N 3.36Å; Y265-Y268 WeakPolarHBondContact O-CB 3.42Å; Y265-Y268 PolarHBondContact O-N 3Å
269N83.2Confident77.2Confident80 Ų8091 Ų9143%0.42843%0.431SS..SBendtrans-126.7131.1-179.1-176.9-25000110F267 S271 I272 T273F267-N269 VanDerWaalsContact C-N 3.34Å; F267-N269 PolarHBondContact O-N 2.93Å; N269-S271 PolarHBondContact O-N 2.98Å; N269-S271 VanDerWaalsContact O-N 3.09Å; N269-S271 PolarHBondContact OD1-N 3.5Å; N269-I272 HydrophobicContact CB-CB 4.48Å; N269-I272 HydrophobicContact CB-CD1 4.26Å; N269-I272 HydrophobicContact CB-CG1 4.27Å; N269-I272 CarbonylContact O-C 3.51Å; N269-I272 WeakPolarHBondContact O-CA 3.28Å; N269-I272 PolarHBondContact O-N 2.89Å; N269-T273 PolarHBondContact O-N 3.01Å; N269-T273 PolarHBondContact O-OG1 2.71Å; N269-T273 VanDerWaalsContact O-OG1 3.09Å
270W85.1Confident79.8Confident179 Ų17988.1 Ų88.168%0.67842%0.415SS*.Hα-helixtrans-50.8-35179-172.6-118.6000114.4T273 K274W270-T273 PolarHBondContact O-N 3.38Å; W270-K274 WeakPolarHBondContact O-CB 3.38Å; W270-K274 WeakPolarHBondContact O-CG 3.38Å; W270-K274 PolarHBondContact O-N 3.43Å
271S84.3Confident82.1Confident59 Ų5983.9 Ų83.941%0.41340%0.401SS..Hα-helixtrans-66.7-42.1175.6-175.60000112.2N269 R275N269-S271 PolarHBondContact O-N 2.98Å; N269-S271 VanDerWaalsContact O-N 3.09Å; N269-S271 PolarHBondContact OD1-N 3.5Å; S271-R275 VanDerWaalsContact O-CG 3.32Å; S271-R275 WeakPolarHBondContact O-CG 3.47Å; S271-R275 PolarHBondContact O-N 3.06Å
272I83.4Confident83.8Confident46 Ų4682.3 Ų82.324%0.23639%0.394CS..Hα-helixtrans-70.7-41175.9-60.4178.6000109.6N269 K274 R275 T276 Y386N269-I272 HydrophobicContact CB-CB 4.48Å; N269-I272 HydrophobicContact CB-CD1 4.26Å; N269-I272 HydrophobicContact CB-CG1 4.27Å; N269-I272 CarbonylContact O-C 3.51Å; N269-I272 WeakPolarHBondContact O-CA 3.28Å; N269-I272 PolarHBondContact O-N 2.89Å; I272-K274 PolarHBondContact O-N 2.85Å; I272-R275 WeakPolarHBondContact O-CB 3.41Å; I272-R275 PolarHBondContact O-N 3.49Å; I272-R275 VanDerWaalsContact O-N 3.17Å; I272-T276 WeakPolarHBondContact O-CB 3.03Å; I272-T276 PolarHBondContact O-N 3.26Å; I272-T276 PolarHBondContact O-OG1 3.47Å; I272-Y386 HydrophobicContact CG2-CE1 4.05Å
273T85.7Confident84.8Confident23 Ų2376.8 Ų76.814%0.14137%0.365CS..Hα-helixtrans-57-48.7175.7-55.70000111.8F267 N269 W270 R275 T276 L277F267-T273 WeakPolarHBondContact CA-OG1 3.41Å; F267-T273 HydrophobicContact CD1-CG2 3.68Å; F267-T273 HydrophobicContact CE1-CG2 4.13Å; N269-T273 PolarHBondContact O-N 3.01Å; N269-T273 PolarHBondContact O-OG1 2.71Å; N269-T273 VanDerWaalsContact O-OG1 3.09Å; W270-T273 PolarHBondContact O-N 3.38Å; T273-R275 VanDerWaalsContact C-N 3.33Å; T273-R275 PolarHBondContact O-N 3.04Å; T273-T276 PolarHBondContact O-N 3.24Å; T273-L277 PolarHBondContact O-N 2.96Å
274K89.3Confident85.7Confident120 Ų12075.1 Ų75.152%0.52235%0.354SS..Hα-helixtrans-58.7-45176.1-80.8-178.3169.11770111.6W270 I272 L277 T278W270-K274 WeakPolarHBondContact O-CB 3.38Å; W270-K274 WeakPolarHBondContact O-CG 3.38Å; W270-K274 PolarHBondContact O-N 3.43Å; I272-K274 PolarHBondContact O-N 2.85Å; K274-L277 PolarHBondContact O-N 3.37Å; K274-T278 PolarHBondContact O-N 3.39Å; K274-T278 PolarHBondContact O-OG1 3.4Å
275R88.6Confident86.6Confident125 Ų12574.2 Ų74.247%0.47235%0.345SS..Hα-helixtrans-60.9-44.6176.1-70.7172.7-177.2-158.70.9111.6S271 I272 T273 T278 V279S271-R275 VanDerWaalsContact O-CG 3.32Å; S271-R275 WeakPolarHBondContact O-CG 3.47Å; S271-R275 PolarHBondContact O-N 3.06Å; I272-R275 WeakPolarHBondContact O-CB 3.41Å; I272-R275 PolarHBondContact O-N 3.49Å; I272-R275 VanDerWaalsContact O-N 3.17Å; T273-R275 VanDerWaalsContact C-N 3.33Å; T273-R275 PolarHBondContact O-N 3.04Å; R275-T278 PolarHBondContact O-N 3.49Å; R275-V279 WeakPolarHBondContact O-CB 3.38Å; R275-V279 VanDerWaalsContact O-CG2 3.28Å; R275-V279 WeakPolarHBondContact O-CG2 3.46Å; R275-V279 PolarHBondContact O-N 3.43Å
276T88.2Confident87.3Confident0 Ų068.6 Ų68.60%032%0.323CS..Hα-helixtrans-63.2-45.5179.1-560000111.7L266 I272 T273 T278 V279 W280 Y386L266-T276 HydrophobicContact CB-CG2 4.26Å; L266-T276 HydrophobicContact CD1-CG2 4.48Å; L266-T276 HydrophobicContact CD2-CG2 4.09Å; I272-T276 WeakPolarHBondContact O-CB 3.03Å; I272-T276 PolarHBondContact O-N 3.26Å; I272-T276 PolarHBondContact O-OG1 3.47Å; T273-T276 PolarHBondContact O-N 3.24Å; T276-T278 PolarHBondContact O-N 3.43Å; T276-V279 PolarHBondContact O-N 3.21Å; T276-W280 HydrophobicContact CG2-CD2 4.16Å; T276-W280 HydrophobicContact CG2-CG 4.37Å; T276-W280 HydrophobicContact CG2-CZ2 3.99Å; T276-W280 WeakPolarHBondContact O-CB 3.26Å; T276-W280 VanDerWaalsContact O-CG 3.25Å; T276-W280 PolarHBondContact O-N 3.44Å; T276-Y386 WeakPolarHBondContact CA-OH 3.24Å; T276-Y386 WeakPolarHBondContact CB-OH 3.41Å; T276-Y386 PolarHBondContact N-OH 2.9Å; T276-Y386 PolarHBondContact OG1-OH 3.29Å
277L90Very high87.9Confident101 Ų10168.6 Ų68.653%0.52932%0.323SS..Hα-helixtrans-63.2-43.6177.2-171.166.4000111.7T273 K274 W280 L281T273-L277 PolarHBondContact O-N 2.96Å; K274-L277 PolarHBondContact O-N 3.37Å; L277-W280 PolarHBondContact O-N 3.1Å; L277-L281 WeakPolarHBondContact O-CG 3.32Å; L277-L281 PolarHBondContact O-N 3.13Å
278T90.8Very high88.3Confident80 Ų8066.1 Ų66.149%0.49131%0.314SS..Hα-helixtrans-61.2-46.3175.3-57.50000111.5K274 R275 T276 L281 I282K274-T278 PolarHBondContact O-N 3.39Å; K274-T278 PolarHBondContact O-OG1 3.4Å; R275-T278 PolarHBondContact O-N 3.49Å; T276-T278 PolarHBondContact O-N 3.43Å; T278-L281 PolarHBondContact O-N 2.83Å; T278-I282 HydrophobicContact CG2-CD1 4.02Å; T278-I282 VanDerWaalsContact O-CG1 3.26Å; T278-I282 WeakPolarHBondContact O-CG1 3.4Å; T278-I282 PolarHBondContact O-N 3.04Å
279V90.3Very high88.7Confident5 Ų557.6 Ų57.63%0.0329%0.286CS..Hα-helixtrans-63.1-44.1178.6167.80000110.8R275 T276 L281 I282 W283 T382 L385 Y386R275-V279 WeakPolarHBondContact O-CB 3.38Å; R275-V279 VanDerWaalsContact O-CG2 3.28Å; R275-V279 WeakPolarHBondContact O-CG2 3.46Å; R275-V279 PolarHBondContact O-N 3.43Å; T276-V279 PolarHBondContact O-N 3.21Å; V279-L281 VanDerWaalsContact C-N 3.32Å; V279-L281 PolarHBondContact O-N 3.42Å; V279-I282 PolarHBondContact O-N 2.95Å; V279-I282 VanDerWaalsContact O-N 3.13Å; V279-W283 VanDerWaalsContact CG1-CD1 3.42Å; V279-W283 PolarHBondContact O-N 3.13Å; V279-T382 HydrophobicContact CG1-CG2 3.91Å; V279-L385 HydrophobicContact CG2-CD2 3.71Å; V279-Y386 HydrophobicContact CG2-CE2 4.35Å
280W92.3Very high88.9Confident62 Ų6254.1 Ų54.124%0.23527%0.267CS..Hα-helixtrans-58.9-41175.5-75.39.2000112.6F267 T276 L277 W283 F284 S397 V401F267-W280 HydrophobicContact CE2-CH2 4.16Å; F267-W280 AromaticContact CZ-CH2 3.68Å; F267-W280 HydrophobicContact CZ-CH2 3.68Å; F267-W280 HydrophobicContact CZ-CZ2 4.28Å; F267-W280 HydrophobicContact CZ-CZ3 4.11Å; T276-W280 HydrophobicContact CG2-CD2 4.16Å; T276-W280 HydrophobicContact CG2-CG 4.37Å; T276-W280 HydrophobicContact CG2-CZ2 3.99Å; T276-W280 WeakPolarHBondContact O-CB 3.26Å; T276-W280 VanDerWaalsContact O-CG 3.25Å; T276-W280 PolarHBondContact O-N 3.44Å; L277-W280 PolarHBondContact O-N 3.1Å; W280-W283 PolarHBondContact O-N 2.85Å; W280-F284 VanDerWaalsContact O-CB 3.31Å; W280-F284 WeakPolarHBondContact O-CB 3.24Å; W280-F284 PolarHBondContact O-N 3.44Å; W280-S397 PolarHBondContact NE1-OG 3.3Å; W280-V401 HydrophobicContact CB-CG1 4.35Å; W280-V401 HydrophobicContact CB-CG2 4.33Å; W280-V401 HydrophobicContact CD2-CG2 3.81Å; W280-V401 HydrophobicContact CE3-CG2 4.02Å; W280-V401 HydrophobicContact CG-CG2 3.96Å
281L91.7Very high89Confident101 Ų10147.4 Ų47.453%0.52924%0.242SC..Hα-helixtrans-63.7-40.2174.6-72.7170.8000112.2L277 T278 V279 F284 T285L277-L281 WeakPolarHBondContact O-CG 3.32Å; L277-L281 PolarHBondContact O-N 3.13Å; T278-L281 PolarHBondContact O-N 2.83Å; V279-L281 VanDerWaalsContact C-N 3.32Å; V279-L281 PolarHBondContact O-N 3.42Å; L281-F284 PolarHBondContact O-N 2.88Å; L281-T285 WeakPolarHBondContact O-CB 3.42Å; L281-T285 WeakPolarHBondContact O-CG2 3.34Å; L281-T285 PolarHBondContact O-N 3.28Å; L281-T285 PolarHBondContact O-OG1 3.15Å
282I91.8Very high89.1Confident33 Ų3345.8 Ų45.817%0.16923%0.231CC..Hα-helixtrans-65.7-40.9175.5-61.7166.9000110.4T278 V279 T285 G286 L335 L339 I378T278-I282 HydrophobicContact CG2-CD1 4.02Å; T278-I282 VanDerWaalsContact O-CG1 3.26Å; T278-I282 WeakPolarHBondContact O-CG1 3.4Å; T278-I282 PolarHBondContact O-N 3.04Å; V279-I282 PolarHBondContact O-N 2.95Å; V279-I282 VanDerWaalsContact O-N 3.13Å; I282-T285 PolarHBondContact O-OG1 3.19Å; I282-G286 WeakPolarHBondContact O-CA 3.42Å; I282-G286 PolarHBondContact O-N 2.84Å; I282-L335 HydrophobicContact CG2-CD1 4.45Å; I282-L335 HydrophobicContact CG2-CD2 4.05Å; I282-L335 HydrophobicContact CG2-CG 4.49Å; I282-L339 HydrophobicContact CG2-CD1 3.82Å; I282-I378 VanDerWaalsContact C-CD1 3.47Å; I282-I378 HydrophobicContact CB-CD1 3.9Å; I282-I378 HydrophobicContact CG2-CD1 3.3Å; I282-I378 HydrophobicContact CG2-CG1 3.98Å
283W91.4Very high89.3Confident0 Ų044.3 Ų44.30%022%0.222CC..Hα-helixtrans-62.5-44.1174.2-83.7104.8000112.3V279 W280 S287 I378 Y379 T382 C402V279-W283 VanDerWaalsContact CG1-CD1 3.42Å; V279-W283 PolarHBondContact O-N 3.13Å; W280-W283 PolarHBondContact O-N 2.85Å; W283-S287 VanDerWaalsContact O-CB 3.26Å; W283-S287 WeakPolarHBondContact O-CB 3.42Å; W283-S287 PolarHBondContact O-N 2.88Å; W283-S287 VanDerWaalsContact O-N 3.08Å; W283-I378 VanDerWaalsContact CA-CD1 3.48Å; W283-I378 HydrophobicContact CB-CD1 4.05Å; W283-I378 HydrophobicContact CD2-CD1 3.57Å; W283-I378 HydrophobicContact CD2-CG1 4.08Å; W283-I378 HydrophobicContact CD2-CG2 4.08Å; W283-I378 HydrophobicContact CE3-CD1 4.12Å; W283-I378 HydrophobicContact CE3-CG2 3.83Å; W283-I378 HydrophobicContact CG-CD1 3.49Å; W283-I378 VanDerWaalsContact CG-CD1 3.49Å; W283-I378 HydrophobicContact CG-CG1 4.32Å; W283-I378 HydrophobicContact CH2-CG2 3.74Å; W283-I378 HydrophobicContact CZ2-CG1 4.28Å; W283-I378 HydrophobicContact CZ2-CG2 3.93Å; W283-I378 HydrophobicContact CZ3-CG2 3.68Å; W283-I378 VanDerWaalsContact N-CD1 3.3Å; W283-Y379 AromaticContact CH2-CD1 3.5Å; W283-Y379 HydrophobicContact CH2-CD1 3.5Å; W283-Y379 AromaticContact CH2-CD2 3.48Å; W283-Y379 HydrophobicContact CH2-CD2 3.48Å; W283-Y379 VanDerWaalsContact CH2-CD2 3.48Å; W283-Y379 AromaticContact CH2-CE1 3.46Å; W283-Y379 HydrophobicContact CH2-CE1 3.46Å; W283-Y379 VanDerWaalsContact CH2-CE1 3.46Å; W283-Y379 AromaticContact CH2-CE2 3.43Å; W283-Y379 HydrophobicContact CH2-CE2 3.43Å; W283-Y379 VanDerWaalsContact CH2-CE2 3.43Å; W283-Y379 AromaticContact CH2-CG 3.49Å; W283-Y379 HydrophobicContact CH2-CG 3.49Å; W283-Y379 VanDerWaalsContact CH2-CG 3.49Å; W283-Y379 AromaticContact CH2-CZ 3.41Å; W283-Y379 VanDerWaalsContact CH2-CZ 3.41Å; W283-Y379 HydrophobicContact CZ2-CD1 4.32Å; W283-Y379 HydrophobicContact CZ2-CG 4.28Å; W283-Y379 HydrophobicContact CZ3-CD1 4.4Å; W283-Y379 AromaticContact CZ3-CD2 3.88Å; W283-Y379 HydrophobicContact CZ3-CD2 3.88Å; W283-Y379 AromaticContact CZ3-CE1 3.99Å; W283-Y379 HydrophobicContact CZ3-CE1 3.99Å; W283-Y379 AromaticContact CZ3-CE2 3.41Å; W283-Y379 HydrophobicContact CZ3-CE2 3.41Å; W283-Y379 VanDerWaalsContact CZ3-CE2 3.41Å; W283-Y379 HydrophobicContact CZ3-CG 4.33Å; W283-Y379 AromaticContact CZ3-CZ 3.45Å; W283-Y379 VanDerWaalsContact CZ3-CZ 3.45Å; W283-T382 PolarHBondContact NE1-OG1 3.09Å; W283-C402 HydrophobicContact CB-CB 4.33Å; W283-C402 HydrophobicContact CD2-CB 4.42Å; W283-C402 HydrophobicContact CE3-CB 3.62Å; W283-C402 HydrophobicContact CZ3-CB 4.28Å
284F90.8Very high89.4Confident62 Ų6244.6 Ų44.627%0.27223%0.225SC..Hα-helixtrans-62.2-55.9178.6-174.7-90000111W280 L281 S287 L288 V401 A405 L408W280-F284 VanDerWaalsContact O-CB 3.31Å; W280-F284 WeakPolarHBondContact O-CB 3.24Å; W280-F284 PolarHBondContact O-N 3.44Å; L281-F284 PolarHBondContact O-N 2.88Å; F284-S287 PolarHBondContact O-N 2.69Å; F284-L288 HydrophobicContact CE1-CD2 4.02Å; F284-L288 VanDerWaalsContact O-CB 3.27Å; F284-L288 WeakPolarHBondContact O-CB 2.95Å; F284-L288 PolarHBondContact O-N 3.43Å; F284-V401 HydrophobicContact CB-CG1 3.87Å; F284-V401 HydrophobicContact CD2-CG1 4.11Å; F284-V401 HydrophobicContact CG-CG1 4.5Å; F284-A405 HydrophobicContact CD2-CB 3.58Å; F284-A405 HydrophobicContact CE2-CB 3.78Å; F284-A405 HydrophobicContact CG-CB 3.98Å; F284-A405 HydrophobicContact CZ-CB 4.34Å; F284-A405 VanDerWaalsContact O-CB 3.24Å; F284-A405 WeakPolarHBondContact O-CB 3.44Å; F284-L408 HydrophobicContact CE2-CD1 4.01Å; F284-L408 HydrophobicContact CZ-CD1 4Å
285T90Very high89.1Confident69 Ų6941 Ų4142%0.42321%0.212SC..Hα-helixtrans-66.4-39.1-177.851.50000112.6L281 I282 L288 G289L281-T285 WeakPolarHBondContact O-CB 3.42Å; L281-T285 WeakPolarHBondContact O-CG2 3.34Å; L281-T285 PolarHBondContact O-N 3.28Å; L281-T285 PolarHBondContact O-OG1 3.15Å; I282-T285 PolarHBondContact O-OG1 3.19Å; T285-L288 PolarHBondContact O-N 3.03Å; T285-G289 PolarHBondContact O-N 2.95Å
286G89.4Confident88.9Confident3 Ų337.3 Ų37.33%0.03120%0.201CC..Hα-helixtrans-60.3-47.3175.800000112.2I282 F290I282-G286 WeakPolarHBondContact O-CA 3.42Å; I282-G286 PolarHBondContact O-N 2.84Å; G286-F290 VanDerWaalsContact O-CB 3.28Å; G286-F290 WeakPolarHBondContact O-CB 3.37Å; G286-F290 PolarHBondContact O-N 3.5Å
287S89Confident88.6Confident0 Ų037.3 Ų37.30%020%0.201CC..Hα-helixtrans-68-46.9177.2-178.40000112.3W283 F284 G289 F290 Y291 C402 S406W283-S287 VanDerWaalsContact O-CB 3.26Å; W283-S287 WeakPolarHBondContact O-CB 3.42Å; W283-S287 PolarHBondContact O-N 2.88Å; W283-S287 VanDerWaalsContact O-N 3.08Å; F284-S287 PolarHBondContact O-N 2.69Å; S287-G289 VanDerWaalsContact C-N 3.32Å; S287-G289 PolarHBondContact O-N 3.23Å; S287-F290 PolarHBondContact O-N 3.32Å; S287-Y291 WeakPolarHBondContact O-CD2 3.41Å; S287-Y291 PolarHBondContact O-N 3.48Å; S287-C402 WeakPolarHBondContact CB-O 3.48Å; S287-C402 WeakPolarHBondContact CB-SG 3.35Å; S287-C402 PolarHBondContact OG-O 3.42Å; S287-C402 PolarHBondContact OG-SG 3.08Å; S287-C402 VanDerWaalsContact OG-SG 3.42Å; S287-S406 PolarHBondContact OG-OG 3.41Å
288L88.6Confident88.2Confident45 Ų4535.7 Ų35.724%0.23620%0.195CC..Hα-helixtrans-56-49.5177.6-175.366.6000110.3F284 T285 S292 A405 A409F284-L288 HydrophobicContact CE1-CD2 4.02Å; F284-L288 VanDerWaalsContact O-CB 3.27Å; F284-L288 WeakPolarHBondContact O-CB 2.95Å; F284-L288 PolarHBondContact O-N 3.43Å; T285-L288 PolarHBondContact O-N 3.03Å; L288-S292 WeakPolarHBondContact O-CB 3.44Å; L288-S292 PolarHBondContact O-N 3.2Å; L288-S292 PolarHBondContact O-OG 3.36Å; L288-A405 HydrophobicContact CB-CB 4.24Å; L288-A409 HydrophobicContact CD1-CB 3.85Å
289G89Confident87.7Confident16 Ų1636 Ų3617%0.16519%0.194CC..Hα-helixtrans-61.6-46.6176.800000112.5T285 S287 Y291 S292 F293T285-G289 PolarHBondContact O-N 2.95Å; S287-G289 VanDerWaalsContact C-N 3.32Å; S287-G289 PolarHBondContact O-N 3.23Å; G289-Y291 PolarHBondContact O-N 3.44Å; G289-S292 PolarHBondContact O-N 3.1Å; G289-F293 VanDerWaalsContact O-CD2 3.25Å; G289-F293 WeakPolarHBondContact O-CD2 3.32Å; G289-F293 PolarHBondContact O-N 2.96Å
290F88.4Confident87.1Confident8 Ų836.4 Ų36.44%0.03520%0.196CC..Hα-helixtrans-57.1-49.4-179.5-179.3-88.1000112G286 S287 S294 E315 K368 I371G286-F290 VanDerWaalsContact O-CB 3.28Å; G286-F290 WeakPolarHBondContact O-CB 3.37Å; G286-F290 PolarHBondContact O-N 3.5Å; S287-F290 PolarHBondContact O-N 3.32Å; F290-S294 PolarHBondContact O-N 3.18Å; F290-S294 PolarHBondContact O-OG 3.41Å; F290-S294 VanDerWaalsContact O-OG 3.13Å; F290-E315 VanDerWaalsContact CE2-OE1 3.25Å; F290-E315 WeakPolarHBondContact CE2-OE1 3.28Å; F290-E315 WeakPolarHBondContact CZ-OE1 3.09Å; F290-K368 VanDerWaalsContact CD2-NZ 3.33Å; F290-K368 PolarHBondContact O-NZ 3.37Å; F290-I371 HydrophobicContact CB-CG1 4.33Å; F290-I371 HydrophobicContact CB-CG2 4.42Å; F290-I371 HydrophobicContact CD2-CG2 4.38Å
291Y86.8Confident86.5Confident37 Ų3734.5 Ų34.515%0.14520%0.196CC..Hα-helixtrans-74.5-32.3178.6-74.7-73.6000112.6M79 S287 G289 S294 L295 S406M79-Y291 HydrophobicContact CE-CD1 3.64Å; M79-Y291 HydrophobicContact CE-CE1 3.38Å; M79-Y291 HydrophobicContact CE-CG 4.48Å; M79-Y291 HydrophobicContact SD-CE1 4.28Å; S287-Y291 WeakPolarHBondContact O-CD2 3.41Å; S287-Y291 PolarHBondContact O-N 3.48Å; G289-Y291 PolarHBondContact O-N 3.44Å; Y291-S294 PolarHBondContact O-N 3.08Å; Y291-L295 VanDerWaalsContact O-CB 3.28Å; Y291-L295 WeakPolarHBondContact O-CB 3.47Å; Y291-L295 VanDerWaalsContact O-CG 3.22Å; Y291-L295 WeakPolarHBondContact O-CG 3.28Å; Y291-L295 PolarHBondContact O-N 3.15Å; Y291-S406 WeakPolarHBondContact CD2-OG 3.46Å; Y291-S406 WeakPolarHBondContact CE2-OG 3.44Å
292S86.6Confident86.2Confident26 Ų2632.5 Ų32.518%0.18220%0.199CC..Hα-helixtrans-64-45.6175.9-61.20000111.5L288 G289 L295 N296L288-S292 WeakPolarHBondContact O-CB 3.44Å; L288-S292 PolarHBondContact O-N 3.2Å; L288-S292 PolarHBondContact O-OG 3.36Å; G289-S292 PolarHBondContact O-N 3.1Å; S292-L295 PolarHBondContact O-N 3.41Å; S292-N296 WeakPolarHBondContact O-CB 2.92Å; S292-N296 PolarHBondContact O-N 3.31Å
293F87.8Confident86Confident15 Ų1534 Ų347%0.06621%0.207CC..Hα-helixtrans-63.6-41.4173.9-81.3-71.4000111.9G289 S297 S342 C346 A364 K368 I371G289-F293 VanDerWaalsContact O-CD2 3.25Å; G289-F293 WeakPolarHBondContact O-CD2 3.32Å; G289-F293 PolarHBondContact O-N 2.96Å; F293-S297 PolarHBondContact O-N 2.91Å; F293-S297 VanDerWaalsContact O-N 3.14Å; F293-S342 WeakPolarHBondContact CE2-OG 3.34Å; F293-C346 HydrophobicContact CE2-CB 4.43Å; F293-C346 HydrophobicContact CZ-CB 3.85Å; F293-A364 HydrophobicContact CD1-CB 4.35Å; F293-K368 HydrophobicContact CB-CD 4Å; F293-I371 HydrophobicContact CD2-CG2 4.1Å
294S87.3Confident85.9Confident29 Ų2936 Ų3620%0.20322%0.217CC..Hα-helixtrans-61.9-48.7177.2-69.60000112.3F290 Y291 S297 K368F290-S294 PolarHBondContact O-N 3.18Å; F290-S294 PolarHBondContact O-OG 3.41Å; F290-S294 VanDerWaalsContact O-OG 3.13Å; Y291-S294 PolarHBondContact O-N 3.08Å; S294-S297 WeakPolarHBondContact O-CB 3.45Å; S294-S297 PolarHBondContact O-N 3.44Å; S294-S297 PolarHBondContact O-OG 3.29Å; S294-K368 PolarHBondContact OG-NZ 3.48Å
295L83.5Confident85.8Confident44 Ų4435 Ų3523%0.2321%0.212CC..Hα-helixtrans-72.9-34.1-178.1-68.8170.1000112.2Q75 Y291 S292 S297 V298 A409 P410 V413Q75-L295 HydrophobicContact CG-CD2 4.26Å; Y291-L295 VanDerWaalsContact O-CB 3.28Å; Y291-L295 WeakPolarHBondContact O-CB 3.47Å; Y291-L295 VanDerWaalsContact O-CG 3.22Å; Y291-L295 WeakPolarHBondContact O-CG 3.28Å; Y291-L295 PolarHBondContact O-N 3.15Å; S292-L295 PolarHBondContact O-N 3.41Å; L295-S297 VanDerWaalsContact C-N 3.27Å; L295-S297 PolarHBondContact O-N 3.07Å; L295-V298 VanDerWaalsContact O-CG2 3.32Å; L295-V298 WeakPolarHBondContact O-CG2 3.37Å; L295-A409 HydrophobicContact CD1-CB 4.49Å; L295-P410 HydrophobicContact CD1-CB 4Å; L295-P410 HydrophobicContact CD1-CG 3.75Å; L295-V413 HydrophobicContact CB-CG2 4.22Å
296N83.4Confident85.9Confident47 Ų4736.1 Ų36.125%0.25122%0.215SC..Hα-helixtrans-75.9-16.1178.1-164.946.8000112.8S292 V298 N299 L300S292-N296 WeakPolarHBondContact O-CB 2.92Å; S292-N296 PolarHBondContact O-N 3.31Å; N296-V298 PolarHBondContact O-N 3.47Å; N296-N299 WeakPolarHBondContact O-CA 3.47Å; N296-N299 WeakPolarHBondContact O-CB 3.41Å; N296-N299 PolarHBondContact O-N 3.05Å; N296-L300 PolarHBondContact O-N 2.78Å
297S82.8Confident86.1Confident1 Ų136.3 Ų36.31%0.00722%0.215CC..G310 helixtrans-59.6-30-177.568.40000114.6F293 S294 L295 N299 N307 L311F293-S297 PolarHBondContact O-N 2.91Å; F293-S297 VanDerWaalsContact O-N 3.14Å; S294-S297 WeakPolarHBondContact O-CB 3.45Å; S294-S297 PolarHBondContact O-N 3.44Å; S294-S297 PolarHBondContact O-OG 3.29Å; L295-S297 VanDerWaalsContact C-N 3.27Å; L295-S297 PolarHBondContact O-N 3.07Å; S297-N299 VanDerWaalsContact C-N 3.25Å; S297-N299 PolarHBondContact O-N 3.26Å; S297-N307 VanDerWaalsContact O-CB 3.3Å; S297-N307 WeakPolarHBondContact O-CB 3.19Å; S297-N307 PolarHBondContact O-ND2 2.99Å; S297-L311 WeakPolarHBondContact OG-CD1 3.49Å
298V80.1Confident86.2Confident66 Ų6638.1 Ų38.140%0.423%0.225SC..G310 helixtrans-73.1-19.9175-60.60000112.3L295 N296 E304L295-V298 VanDerWaalsContact O-CG2 3.32Å; L295-V298 WeakPolarHBondContact O-CG2 3.37Å; N296-V298 PolarHBondContact O-N 3.47Å; V298-E304 HydrophobicContact CB-CB 4.17Å; V298-E304 HydrophobicContact CG1-CB 4.21Å
299N80.3Confident86.4Confident88 Ų8839.8 Ų39.847%0.47123%0.23SC..G310 helixtrans-98.70.1-178.1-62.6-34.1000113.9N296 S297 G301N296-N299 WeakPolarHBondContact O-CA 3.47Å; N296-N299 WeakPolarHBondContact O-CB 3.41Å; N296-N299 PolarHBondContact O-N 3.05Å; S297-N299 VanDerWaalsContact C-N 3.25Å; S297-N299 PolarHBondContact O-N 3.26Å; N299-G301 PolarHBondContact O-N 2.84Å
300L79.2Confident86.6Confident12 Ų1241.8 Ų41.86%0.06324%0.236CC..SBendtrans-74.3-2.8-177.4-68171.2000114.2N296 V349 Y357 V361 A364N296-L300 PolarHBondContact O-N 2.78Å; L300-V349 HydrophobicContact CD2-CG1 3.96Å; L300-Y357 WeakPolarHBondContact O-CB 3.35Å; L300-V361 HydrophobicContact CB-CG2 3.91Å; L300-V361 HydrophobicContact CD1-CG2 4.43Å; L300-A364 HydrophobicContact CD1-CB 3.39Å; L300-A364 HydrophobicContact CD2-CB 4.15Å; L300-A364 HydrophobicContact CG-CB 4.43Å
301G77.9Confident86.7Confident23 Ų2341.5 Ų41.524%0.23724%0.236CC..SBendtrans84.5168.8-174.200000113.1N299 N307N299-G301 PolarHBondContact O-N 2.84Å; G301-N307 PolarHBondContact O-ND2 2.88Å
302G85.6Confident86.8Confident58 Ų5839.8 Ų39.860%0.59823%0.229SC*.SBendtrans76-138.8-173.800000112.7
303N87.9Confident87.1Confident64 Ų6441.5 Ų41.534%0.34224%0.238SC..  trans-98.3116.1-179.9-174-48.4000110.6Y305 L306 N307N303-Y305 VanDerWaalsContact C-N 3.34Å; N303-Y305 PolarHBondContact O-N 3.12Å; N303-Y305 WeakPolarHBondContact OD1-CB 3.48Å; N303-Y305 PolarHBondContact OD1-N 3.08Å; N303-L306 HydrophobicContact CB-CB 3.97Å; N303-L306 PolarHBondContact O-N 3.36Å; N303-L306 PolarHBondContact OD1-N 3.41Å; N303-N307 PolarHBondContact O-N 3.36Å; N303-N307 PolarHBondContact O-OD1 2.85Å
304E89.1Confident87.4Confident43 Ų4342 Ų4220%0.20124%0.243CC..Hα-helixtrans-58.8-38.2-179.157.6178.1-153.300114.2W53 V298 N307 L308W53-E304 VanDerWaalsContact CZ2-OE2 3.3Å; W53-E304 WeakPolarHBondContact CZ2-OE2 3.3Å; W53-E304 PolarHBondContact NE1-OE1 2.93Å; V298-E304 HydrophobicContact CB-CB 4.17Å; V298-E304 HydrophobicContact CG1-CB 4.21Å; E304-N307 PolarHBondContact O-N 3.48Å; E304-L308 WeakPolarHBondContact O-CB 3.3Å; E304-L308 PolarHBondContact O-N 3.12Å
305Y90.3Very high87.4Confident40 Ų4040.8 Ų40.816%0.15723%0.234CC..Hα-helixtrans-71.4-36.9179.3-58.6-68.2000110.9G178 Y179 N303 L308 F309G178-Y305 VanDerWaalsContact C-CD1 3.47Å; G178-Y305 VanDerWaalsContact C-CZ 3.47Å; G178-Y305 WeakPolarHBondContact O-CE1 3.38Å; G178-Y305 PolarHBondContact O-OH 3.01Å; Y179-Y305 HydrophobicContact CD2-CD2 4.21Å; N303-Y305 VanDerWaalsContact C-N 3.34Å; N303-Y305 PolarHBondContact O-N 3.12Å; N303-Y305 WeakPolarHBondContact OD1-CB 3.48Å; N303-Y305 PolarHBondContact OD1-N 3.08Å; Y305-L308 PolarHBondContact O-N 3.44Å; Y305-F309 VanDerWaalsContact O-CB 3.31Å; Y305-F309 WeakPolarHBondContact O-CB 3.3Å; Y305-F309 PolarHBondContact O-N 2.9Å
306L91.6Very high87.7Confident94 Ų9441.3 Ų41.349%0.49224%0.236SC..Hα-helixtrans-65-43.7173.7-178.963.2000110.9N303 L308 F309 L310N303-L306 HydrophobicContact CB-CB 3.97Å; N303-L306 PolarHBondContact O-N 3.36Å; N303-L306 PolarHBondContact OD1-N 3.41Å; L306-L308 VanDerWaalsContact C-N 3.34Å; L306-L308 PolarHBondContact O-N 2.96Å; L306-F309 WeakPolarHBondContact O-CB 3.48Å; L306-F309 PolarHBondContact O-N 3.46Å; L306-L310 HydrophobicContact CD1-CG 4.44Å; L306-L310 HydrophobicContact CG-CD1 4.28Å; L306-L310 WeakPolarHBondContact O-CG 3.41Å; L306-L310 PolarHBondContact O-N 3.4Å
307N92.1Very high87.9Confident6 Ų642.1 Ų42.13%0.03224%0.244CC..Hα-helixtrans-60.7-44.3177.3-66-12.5000111.1S297 G301 N303 E304 L310 L311S297-N307 VanDerWaalsContact O-CB 3.3Å; S297-N307 WeakPolarHBondContact O-CB 3.19Å; S297-N307 PolarHBondContact O-ND2 2.99Å; G301-N307 PolarHBondContact O-ND2 2.88Å; N303-N307 PolarHBondContact O-N 3.36Å; N303-N307 PolarHBondContact O-OD1 2.85Å; E304-N307 PolarHBondContact O-N 3.48Å; N307-L310 PolarHBondContact O-N 2.87Å; N307-L311 WeakPolarHBondContact O-CG 3.32Å; N307-L311 PolarHBondContact O-N 3.04Å
308L91.4Very high88.2Confident39 Ų3942.1 Ų42.120%0.20424%0.243CC..Hα-helixtrans-65.1-38.2176.1-173.862.9000112.5T171 V174 A175 E304 Y305 L306 L311 G312T171-L308 HydrophobicContact CG2-CD1 3.94Å; T171-L308 HydrophobicContact CG2-CG 4.24Å; V174-L308 HydrophobicContact CG1-CD2 4.17Å; A175-L308 HydrophobicContact CB-CB 4Å; A175-L308 HydrophobicContact CB-CD2 4.01Å; A175-L308 HydrophobicContact CB-CG 3.92Å; E304-L308 WeakPolarHBondContact O-CB 3.3Å; E304-L308 PolarHBondContact O-N 3.12Å; Y305-L308 PolarHBondContact O-N 3.44Å; L306-L308 VanDerWaalsContact C-N 3.34Å; L306-L308 PolarHBondContact O-N 2.96Å; L308-L311 HydrophobicContact CD1-CD1 4.01Å; L308-L311 WeakPolarHBondContact O-CB 3.31Å; L308-L311 PolarHBondContact O-N 3.5Å; L308-G312 PolarHBondContact O-N 2.94Å
309F93.5Very high88.3Confident80 Ų8039.6 Ų39.635%0.35123%0.227SC..Hα-helixtrans-62.4-46.7174.1-175.8-90.7000110.9L172 A175 Y305 L306 L311 G312 V313L172-F309 HydrophobicContact CB-CD2 4.22Å; L172-F309 HydrophobicContact CB-CE2 4.11Å; L172-F309 HydrophobicContact CD2-CD1 4.29Å; L172-F309 HydrophobicContact CD2-CD2 3.7Å; L172-F309 HydrophobicContact CD2-CE1 4.37Å; L172-F309 HydrophobicContact CD2-CE2 3.79Å; L172-F309 HydrophobicContact CD2-CG 3.96Å; L172-F309 HydrophobicContact CD2-CZ 4.13Å; L172-F309 WeakPolarHBondContact CD2-O 3.34Å; L172-F309 HydrophobicContact CG-CE2 4.45Å; A175-F309 HydrophobicContact CB-CB 3.89Å; A175-F309 HydrophobicContact CB-CD2 4.5Å; Y305-F309 VanDerWaalsContact O-CB 3.31Å; Y305-F309 WeakPolarHBondContact O-CB 3.3Å; Y305-F309 PolarHBondContact O-N 2.9Å; L306-F309 WeakPolarHBondContact O-CB 3.48Å; L306-F309 PolarHBondContact O-N 3.46Å; F309-L311 VanDerWaalsContact C-N 3.29Å; F309-L311 PolarHBondContact O-N 3.22Å; F309-G312 PolarHBondContact O-N 3.23Å; F309-G312 VanDerWaalsContact O-N 3.12Å; F309-V313 HydrophobicContact CD1-CG2 3.87Å; F309-V313 HydrophobicContact CE1-CG2 3.56Å; F309-V313 HydrophobicContact CZ-CG2 4.19Å; F309-V313 WeakPolarHBondContact O-CG2 3.4Å; F309-V313 PolarHBondContact O-N 3.39Å
310L92.7Very high88.5Confident57 Ų5738 Ų3830%0.29822%0.221SC..Hα-helixtrans-61.1-36.6177.3-69.8173.6000112.3L306 N307 G312 V313 V314 V361 M365L306-L310 HydrophobicContact CD1-CG 4.44Å; L306-L310 HydrophobicContact CG-CD1 4.28Å; L306-L310 WeakPolarHBondContact O-CG 3.41Å; L306-L310 PolarHBondContact O-N 3.4Å; N307-L310 PolarHBondContact O-N 2.87Å; L310-G312 VanDerWaalsContact C-N 3.33Å; L310-G312 PolarHBondContact O-N 3.34Å; L310-V313 PolarHBondContact O-N 3.26Å; L310-V314 WeakPolarHBondContact O-CB 3.39Å; L310-V314 WeakPolarHBondContact O-CG2 3.39Å; L310-V314 PolarHBondContact O-N 3.03Å; L310-V361 HydrophobicContact CD1-CG1 4.19Å; L310-M365 HydrophobicContact CB-CE 4.36Å; L310-M365 HydrophobicContact CB-CG 4.38Å; L310-M365 HydrophobicContact CB-SD 3.71Å
311L90.3Very high88.7Confident3 Ų342.8 Ų42.82%0.01624%0.241CC..Hα-helixtrans-56.8-46.7173.2-71.4176.9000111.8S297 N307 L308 F309 V314 E315 M365 K368S297-L311 WeakPolarHBondContact OG-CD1 3.49Å; N307-L311 WeakPolarHBondContact O-CG 3.32Å; N307-L311 PolarHBondContact O-N 3.04Å; L308-L311 HydrophobicContact CD1-CD1 4.01Å; L308-L311 WeakPolarHBondContact O-CB 3.31Å; L308-L311 PolarHBondContact O-N 3.5Å; F309-L311 VanDerWaalsContact C-N 3.29Å; F309-L311 PolarHBondContact O-N 3.22Å; L311-V314 PolarHBondContact O-N 3.26Å; L311-E315 PolarHBondContact O-N 2.96Å; L311-M365 HydrophobicContact CD2-CE 3.63Å; L311-M365 HydrophobicContact CD2-SD 3.92Å; L311-M365 HydrophobicContact CG-CE 3.97Å; L311-M365 HydrophobicContact CG-SD 4.3Å; L311-K368 HydrophobicContact CD2-CB 3.78Å; L311-K368 HydrophobicContact CD2-CD 3.82Å; L311-K368 HydrophobicContact CD2-CG 3.47Å; L311-K368 VanDerWaalsContact CD2-CG 3.47Å
312G90.3Very high88.9Confident0 Ų042.2 Ų42.20%023%0.233CC..Hα-helixtrans-64.4-39.4177.800000112.3L308 F309 L310 V314 E315L308-G312 PolarHBondContact O-N 2.94Å; F309-G312 PolarHBondContact O-N 3.23Å; F309-G312 VanDerWaalsContact O-N 3.12Å; L310-G312 VanDerWaalsContact C-N 3.33Å; L310-G312 PolarHBondContact O-N 3.34Å; G312-V314 VanDerWaalsContact C-N 3.29Å; G312-V314 PolarHBondContact O-N 3.49Å; G312-E315 PolarHBondContact O-N 3.09Å
313V92.7Very high88.6Confident62 Ų6240.2 Ų40.238%0.37621%0.21SC..Hα-helixtrans-63.5-39.1179.1172.40000110.7L172 F309 L310 P317L172-V313 HydrophobicContact CD2-CG2 3.63Å; F309-V313 HydrophobicContact CD1-CG2 3.87Å; F309-V313 HydrophobicContact CE1-CG2 3.56Å; F309-V313 HydrophobicContact CZ-CG2 4.19Å; F309-V313 WeakPolarHBondContact O-CG2 3.4Å; F309-V313 PolarHBondContact O-N 3.39Å; L310-V313 PolarHBondContact O-N 3.26Å; V313-P317 WeakPolarHBondContact O-CD 3.39Å
314V92.6Very high88.3Confident27 Ų2741.3 Ų41.316%0.16422%0.215CC..Hα-helixtrans-75.6-28.4-176.4171.70000112.5L310 L311 G312 P317 A318 M365 F369L310-V314 WeakPolarHBondContact O-CB 3.39Å; L310-V314 WeakPolarHBondContact O-CG2 3.39Å; L310-V314 PolarHBondContact O-N 3.03Å; L311-V314 PolarHBondContact O-N 3.26Å; G312-V314 VanDerWaalsContact C-N 3.29Å; G312-V314 PolarHBondContact O-N 3.49Å; V314-P317 WeakPolarHBondContact O-CD 3.49Å; V314-P317 WeakPolarHBondContact O-CG 3.25Å; V314-A318 WeakPolarHBondContact O-CB 3.36Å; V314-A318 PolarHBondContact O-N 2.67Å; V314-M365 WeakPolarHBondContact CG1-O 3.22Å; V314-M365 HydrophobicContact CG2-CB 4.14Å; V314-M365 HydrophobicContact CG2-CG 4.34Å; V314-M365 HydrophobicContact CG2-SD 4.21Å; V314-F369 HydrophobicContact CG1-CB 3.51Å; V314-F369 HydrophobicContact CG1-CD2 3.97Å; V314-F369 HydrophobicContact CG1-CG 4.24Å
315E88.3Confident88.1Confident3 Ų339.9 Ų39.91%0.01421%0.21CC..Hα-helixtrans-66.3-38.8177.6-79.9-176.5-177.800112.9A168 F290 L311 G312 A318 Y319 K368A168-E315 HydrophobicContact CB-CB 3.78Å; F290-E315 VanDerWaalsContact CE2-OE1 3.25Å; F290-E315 WeakPolarHBondContact CE2-OE1 3.28Å; F290-E315 WeakPolarHBondContact CZ-OE1 3.09Å; L311-E315 PolarHBondContact O-N 2.96Å; G312-E315 PolarHBondContact O-N 3.09Å; E315-A318 WeakPolarHBondContact O-CB 3.41Å; E315-A318 PolarHBondContact O-N 3.49Å; E315-Y319 HydrophobicContact CB-CE2 4.11Å; E315-Y319 WeakPolarHBondContact O-CD2 3.32Å; E315-Y319 PolarHBondContact O-N 3.42Å; E315-Y319 VanDerWaalsContact O-N 3.11Å; E315-K368 WeakPolarHBondContact OE1-CE 3.46Å; E315-K368 IonicContact OE1-NZ 2.64Å; E315-K368 PolarHBondContact OE1-NZ 2.88Å
316I88.7Confident87.6Confident55 Ų5538.5 Ų38.528%0.28221%0.205SC..Hα-helixtrans-57.3-57.2-178.9-61.5169.8000112.5A168 V169 L172 A318 Y319 T320A168-I316 HydrophobicContact CB-CD1 4.48Å; A168-I316 HydrophobicContact CB-CG1 3.71Å; V169-I316 HydrophobicContact CG2-CD1 4.27Å; L172-I316 HydrophobicContact CD1-CD1 4.17Å; I316-A318 VanDerWaalsContact C-N 3.26Å; I316-A318 PolarHBondContact O-N 3.46Å; I316-Y319 PolarHBondContact O-N 3.14Å; I316-T320 PolarHBondContact O-N 2.89Å; I316-T320 PolarHBondContact O-OG1 3.48Å
317P89.1Confident86.9Confident64 Ų6440.2 Ų40.242%0.41622%0.215SC..Hα-helixtrans-67.7-2717828.4-34.7000112.2V313 V314 Y319 T320 F321V313-P317 WeakPolarHBondContact O-CD 3.39Å; V314-P317 WeakPolarHBondContact O-CD 3.49Å; V314-P317 WeakPolarHBondContact O-CG 3.25Å; P317-Y319 PolarHBondContact O-N 2.8Å; P317-T320 PolarHBondContact O-N 3.31Å; P317-F321 VanDerWaalsContact O-CB 3.22Å; P317-F321 WeakPolarHBondContact O-CB 3.22Å; P317-F321 PolarHBondContact O-N 3.18Å
318A88.4Confident86.5Confident0 Ų048.3 Ų48.30%025%0.25CC..Hα-helixtrans-60-46175.500000111.2V314 E315 I316 F321 V322 F369V314-A318 WeakPolarHBondContact O-CB 3.36Å; V314-A318 PolarHBondContact O-N 2.67Å; E315-A318 WeakPolarHBondContact O-CB 3.41Å; E315-A318 PolarHBondContact O-N 3.49Å; I316-A318 VanDerWaalsContact C-N 3.26Å; I316-A318 PolarHBondContact O-N 3.46Å; A318-F321 PolarHBondContact O-N 3.44Å; A318-V322 WeakPolarHBondContact O-CG2 3.27Å; A318-V322 PolarHBondContact O-N 3.44Å; A318-F369 HydrophobicContact CB-CD2 3.52Å; A318-F369 HydrophobicContact CB-CE2 3.68Å; A318-F369 HydrophobicContact CB-CG 4.11Å; A318-F369 HydrophobicContact CB-CZ 4.34Å
319Y83.3Confident86.2Confident13 Ų1350.6 Ų50.65%0.05127%0.265CS..Hα-helixtrans-65.7-40.3179.3-62.6-45.4000112.9H164 E315 I316 P317 C323H164-Y319 HydrophobicContact CB-CD2 4.02Å; H164-Y319 HydrophobicContact CB-CE1 4.43Å; H164-Y319 HydrophobicContact CB-CE2 3.77Å; H164-Y319 HydrophobicContact CB-CG 4.45Å; E315-Y319 HydrophobicContact CB-CE2 4.11Å; E315-Y319 WeakPolarHBondContact O-CD2 3.32Å; E315-Y319 PolarHBondContact O-N 3.42Å; E315-Y319 VanDerWaalsContact O-N 3.11Å; I316-Y319 PolarHBondContact O-N 3.14Å; P317-Y319 PolarHBondContact O-N 2.8Å; Y319-C323 PolarHBondContact O-N 3.41Å
320T82.9Confident85.7Confident56 Ų5648.3 Ų48.334%0.34426%0.264SS..Hα-helixtrans-65-43.8175-50.40000111.6I316 P317 V322 C323 I324I316-T320 PolarHBondContact O-N 2.89Å; I316-T320 PolarHBondContact O-OG1 3.48Å; P317-T320 PolarHBondContact O-N 3.31Å; T320-V322 VanDerWaalsContact C-N 3.35Å; T320-V322 PolarHBondContact O-N 2.99Å; T320-C323 PolarHBondContact O-N 3.49Å; T320-I324 HydrophobicContact CG2-CD1 4.29Å; T320-I324 PolarHBondContact O-N 3.03Å
321F84.3Confident85.3Confident112 Ų11248 Ų4849%0.49126%0.259SS..Hα-helixtrans-60.6-43.6178.8177.5-98.9000111.9P317 A318 C323 I324 A325 F369P317-F321 VanDerWaalsContact O-CB 3.22Å; P317-F321 WeakPolarHBondContact O-CB 3.22Å; P317-F321 PolarHBondContact O-N 3.18Å; A318-F321 PolarHBondContact O-N 3.44Å; F321-C323 VanDerWaalsContact C-N 3.34Å; F321-C323 PolarHBondContact O-N 2.96Å; F321-I324 PolarHBondContact O-N 3.45Å; F321-A325 HydrophobicContact CD1-CB 4.41Å; F321-A325 HydrophobicContact CE1-CB 4.08Å; F321-A325 HydrophobicContact CZ-CB 4.26Å; F321-A325 VanDerWaalsContact O-CB 3.24Å; F321-A325 WeakPolarHBondContact O-CB 3.49Å; F321-A325 PolarHBondContact O-N 2.67Å; F321-F369 HydrophobicContact CB-CZ 3.96Å; F321-F369 HydrophobicContact CD1-CE1 4.03Å; F321-F369 AromaticContact CD1-CZ 3.86Å; F321-F369 HydrophobicContact CD1-CZ 3.86Å; F321-F369 HydrophobicContact CE1-CE1 4.41Å; F321-F369 AromaticContact CG-CZ 3.92Å; F321-F369 HydrophobicContact CG-CZ 3.92Å
322V81.9Confident85.2Confident10 Ų1057 Ų576%0.06129%0.292CS..Hα-helixtrans-58.3-45.7178.8171.80000111.7A318 T320 I324 A325 M326 A373 L377A318-V322 WeakPolarHBondContact O-CG2 3.27Å; A318-V322 PolarHBondContact O-N 3.44Å; T320-V322 VanDerWaalsContact C-N 3.35Å; T320-V322 PolarHBondContact O-N 2.99Å; V322-I324 VanDerWaalsContact C-N 3.32Å; V322-I324 PolarHBondContact O-N 3Å; V322-A325 PolarHBondContact O-N 3.01Å; V322-M326 WeakPolarHBondContact O-CB 3.43Å; V322-M326 PolarHBondContact O-N 3.49Å; V322-A373 HydrophobicContact CG2-CB 3.19Å; V322-L377 HydrophobicContact CG1-CB 4.1Å; V322-L377 HydrophobicContact CG1-CD1 4.41Å
323C78.3Confident85.2Confident17 Ų1759.8 Ų59.812%0.11531%0.31CS..Hα-helixtrans-60.2-44.3-179.8-72.50000111.9V161 Y319 T320 F321V161-C323 WeakPolarHBondContact CG2-SG 3.24Å; Y319-C323 PolarHBondContact O-N 3.41Å; T320-C323 PolarHBondContact O-N 3.49Å; F321-C323 VanDerWaalsContact C-N 3.34Å; F321-C323 PolarHBondContact O-N 2.96Å
324I82.6Confident85Confident87 Ų8757.4 Ų57.445%0.44630%0.296SS..Hα-helixtrans-69.7-42.9179.2-60.3169.9000111.2T320 F321 V322 K328T320-I324 HydrophobicContact CG2-CD1 4.29Å; T320-I324 PolarHBondContact O-N 3.03Å; F321-I324 PolarHBondContact O-N 3.45Å; V322-I324 VanDerWaalsContact C-N 3.32Å; V322-I324 PolarHBondContact O-N 3Å; I324-K328 PolarHBondContact O-N 3.29Å
325A84.1Confident84.9Confident13 Ų1356.4 Ų56.411%0.10729%0.289CS..Hα-helixtrans-67.7-37.2-177.600000112F321 V322 D327 K328 V329 V334F321-A325 HydrophobicContact CD1-CB 4.41Å; F321-A325 HydrophobicContact CE1-CB 4.08Å; F321-A325 HydrophobicContact CZ-CB 4.26Å; F321-A325 VanDerWaalsContact O-CB 3.24Å; F321-A325 WeakPolarHBondContact O-CB 3.49Å; F321-A325 PolarHBondContact O-N 2.67Å; V322-A325 PolarHBondContact O-N 3.01Å; A325-D327 VanDerWaalsContact C-N 3.33Å; A325-D327 PolarHBondContact O-N 3.33Å; A325-K328 PolarHBondContact O-N 3.17Å; A325-V329 PolarHBondContact O-N 2.84Å; A325-V334 HydrophobicContact CB-CG1 4.39Å; A325-V334 HydrophobicContact CB-CG2 4.06Å
326M79.7Confident85Confident11 Ų1159 Ų595%0.05431%0.311CS..Hα-helixtrans-62-39.3-179.5-175.9-17865.800112.4V322 G330 R331 L377 L380V322-M326 WeakPolarHBondContact O-CB 3.43Å; V322-M326 PolarHBondContact O-N 3.49Å; M326-G330 PolarHBondContact O-N 2.92Å; M326-R331 HydrophobicContact CG-CB 4.18Å; M326-R331 HydrophobicContact CG-CG 3.5Å; M326-R331 VanDerWaalsContact CG-CG 3.5Å; M326-R331 HydrophobicContact SD-CG 4.09Å; M326-R331 PolarHBondContact SD-NE 2.81Å; M326-L377 HydrophobicContact CB-CD1 4.38Å; M326-L377 HydrophobicContact CG-CD1 3.78Å; M326-L377 HydrophobicContact SD-CD1 3.25Å; M326-L377 WeakPolarHBondContact SD-CD1 3.04Å; M326-L380 HydrophobicContact CE-CD2 3.66Å; M326-L380 HydrophobicContact SD-CD2 3.68Å
327D78.2Confident85.1Confident129 Ų12963.9 Ų63.969%0.6933%0.327SS*.Hα-helixtrans-73.4-29.2179.9-69.1-15.9000112.4A325A325-D327 VanDerWaalsContact C-N 3.33Å; A325-D327 PolarHBondContact O-N 3.33Å
328K83.7Confident85.3Confident176 Ų17661.5 Ų61.577%0.76531%0.312SS*.Hα-helixtrans-91.6-44.6-176.8-69.7-175.4178.9-179.70114.6I324 A325I324-K328 PolarHBondContact O-N 3.29Å; A325-K328 PolarHBondContact O-N 3.17Å
329V84.9Confident85.5Confident88 Ų8863.4 Ų63.453%0.53332%0.322SS..Hα-helixtrans-103.2-14.4-168-175.30000112A325 T333 V334A325-V329 PolarHBondContact O-N 2.84Å; V329-T333 HydrophobicContact CG1-CG2 3.78Å; V329-V334 HydrophobicContact CB-CG2 4.02Å; V329-V334 HydrophobicContact CG1-CG2 4.39Å
330G83.3Confident86Confident31 Ų3169.3 Ų69.332%0.3235%0.348SS..  trans85.9146.1-175.300000112.6M326 T333 V334M326-G330 PolarHBondContact O-N 2.92Å; G330-T333 PolarHBondContact O-N 2.85Å; G330-V334 WeakPolarHBondContact O-CG2 3.26Å; G330-V334 PolarHBondContact O-N 3.24Å
331R84.4Confident86.5Confident51 Ų5169.5 Ų69.519%0.19235%0.351CS..Hα-helixtrans-67.5-44.1-164.6-42.2-156.5163.6-172.20.5113.9M326 T333 V334 L335 L377 Y381 E384M326-R331 HydrophobicContact CG-CB 4.18Å; M326-R331 HydrophobicContact CG-CG 3.5Å; M326-R331 VanDerWaalsContact CG-CG 3.5Å; M326-R331 HydrophobicContact SD-CG 4.09Å; M326-R331 PolarHBondContact SD-NE 2.81Å; R331-T333 VanDerWaalsContact C-N 3.29Å; R331-T333 PolarHBondContact O-N 3.4Å; R331-V334 PolarHBondContact O-N 3Å; R331-L335 WeakPolarHBondContact O-CB 3.37Å; R331-L335 PolarHBondContact O-N 3.24Å; R331-L377 HydrophobicContact CB-CD1 4.26Å; R331-L377 WeakPolarHBondContact O-CD2 3.45Å; R331-Y381 HydrophobicContact CB-CD2 4.03Å; R331-E384 VanDerWaalsContact CD-OE2 3.32Å; R331-E384 WeakPolarHBondContact CD-OE2 3.46Å; R331-E384 IonicContact CZ-OE1 3.94Å; R331-E384 IonicContact CZ-OE2 3.19Å; R331-E384 IonicContact NE-OE1 3.84Å; R331-E384 IonicContact NE-OE2 3.13Å; R331-E384 PolarHBondContact NE-OE2 3.23Å; R331-E384 IonicContact NH1-OE1 2.73Å; R331-E384 PolarHBondContact NH1-OE1 3.33Å; R331-E384 IonicContact NH1-OE2 3.69Å; R331-E384 PolarHBondContact NH1-OE2 2.94Å; R331-E384 IonicContact NH2-OE1 3.06Å; R331-E384 PolarHBondContact NH2-OE1 3.45Å; R331-E384 IonicContact NH2-OE2 2.67Å
332R87.9Confident86.9Confident191 Ų19164.4 Ų64.472%0.72133%0.33SS*.Hα-helixtrans-60.4-43-178.9-179.3179.6175-172.9-1.9111.3L335 A336 Y381R332-L335 PolarHBondContact O-N 2.64Å; R332-A336 WeakPolarHBondContact O-CB 3.46Å; R332-A336 PolarHBondContact O-N 3.39Å; R332-Y381 HydrophobicContact CB-CE2 4.2Å
333T89.1Confident87.4Confident59 Ų5966.9 Ų66.936%0.36235%0.351SS..Hα-helixtrans-65.7-49.8-178.9-500000110.5V329 G330 R331 L335 A336 Y337V329-T333 HydrophobicContact CG1-CG2 3.78Å; G330-T333 PolarHBondContact O-N 2.85Å; R331-T333 VanDerWaalsContact C-N 3.29Å; R331-T333 PolarHBondContact O-N 3.4Å; T333-L335 VanDerWaalsContact C-N 3.33Å; T333-L335 PolarHBondContact O-N 3.08Å; T333-A336 PolarHBondContact O-N 3.4Å; T333-Y337 HydrophobicContact CG2-CD2 3.62Å; T333-Y337 HydrophobicContact CG2-CE2 3.4Å; T333-Y337 WeakPolarHBondContact O-CD2 3.45Å; T333-Y337 PolarHBondContact O-N 2.88Å
334V89.8Confident88.1Confident13 Ų1371 Ų718%0.07937%0.371CS..Hα-helixtrans-59.4-43.1177.3176.90000111.4A325 V329 G330 R331 S338 L377A325-V334 HydrophobicContact CB-CG1 4.39Å; A325-V334 HydrophobicContact CB-CG2 4.06Å; V329-V334 HydrophobicContact CB-CG2 4.02Å; V329-V334 HydrophobicContact CG1-CG2 4.39Å; G330-V334 WeakPolarHBondContact O-CG2 3.26Å; G330-V334 PolarHBondContact O-N 3.24Å; R331-V334 PolarHBondContact O-N 3Å; V334-S338 WeakPolarHBondContact O-CB 3.04Å; V334-S338 PolarHBondContact O-N 2.62Å; V334-S338 PolarHBondContact O-OG 2.87Å; V334-L377 HydrophobicContact CB-CD2 3.89Å; V334-L377 HydrophobicContact CG1-CD2 3.78Å
335L89.1Confident88.5Confident6 Ų667.1 Ų67.13%0.03135%0.352CS..Hα-helixtrans-62.4-46.9178.2-175.363.2000111.9I282 R331 R332 T333 S338 L339 A374 L377 Y381I282-L335 HydrophobicContact CG2-CD1 4.45Å; I282-L335 HydrophobicContact CG2-CD2 4.05Å; I282-L335 HydrophobicContact CG2-CG 4.49Å; R331-L335 WeakPolarHBondContact O-CB 3.37Å; R331-L335 PolarHBondContact O-N 3.24Å; R332-L335 PolarHBondContact O-N 2.64Å; T333-L335 VanDerWaalsContact C-N 3.33Å; T333-L335 PolarHBondContact O-N 3.08Å; L335-S338 PolarHBondContact O-N 3.49Å; L335-L339 HydrophobicContact CD1-CD1 4.27Å; L335-L339 HydrophobicContact CG-CD1 4.17Å; L335-L339 WeakPolarHBondContact O-CG 3.4Å; L335-L339 PolarHBondContact O-N 2.9Å; L335-A374 HydrophobicContact CD1-CB 3.89Å; L335-L377 HydrophobicContact CB-CD2 3.83Å; L335-L377 HydrophobicContact CD1-CB 4.5Å; L335-Y381 HydrophobicContact CD2-CD1 4Å; L335-Y381 HydrophobicContact CD2-CE1 4.41Å; L335-Y381 HydrophobicContact CD2-CG 4.38Å
336A91.1Very high88.8Confident58 Ų5869.2 Ų69.248%0.47937%0.366SS..Hα-helixtrans-63.8-47.2-179.300000112.2R332 T333 S338 L339 F340R332-A336 WeakPolarHBondContact O-CB 3.46Å; R332-A336 PolarHBondContact O-N 3.39Å; T333-A336 PolarHBondContact O-N 3.4Å; A336-S338 PolarHBondContact O-N 2.87Å; A336-L339 PolarHBondContact O-N 3.31Å; A336-F340 WeakPolarHBondContact O-CB 3.43Å; A336-F340 PolarHBondContact O-N 3.31Å
337Y92.1Very high89.1Confident157 Ų15770.4 Ų70.462%0.61638%0.381SS*.Hα-helixtrans-63-41.7176.6-79.3-65.7000112T333 L339 F340 C341T333-Y337 HydrophobicContact CG2-CD2 3.62Å; T333-Y337 HydrophobicContact CG2-CE2 3.4Å; T333-Y337 WeakPolarHBondContact O-CD2 3.45Å; T333-Y337 PolarHBondContact O-N 2.88Å; Y337-L339 PolarHBondContact O-N 2.76Å; Y337-F340 PolarHBondContact O-N 2.87Å; Y337-C341 VanDerWaalsContact O-CB 3.31Å; Y337-C341 WeakPolarHBondContact O-CB 3.46Å; Y337-C341 PolarHBondContact O-N 3.04Å; Y337-C341 PolarHBondContact O-SG 3.2Å
338S92Very high89.6Confident14 Ų1467.3 Ų67.310%0.09837%0.366CS..Hα-helixtrans-62.4-43.9179.3-60.80000112V334 L335 A336 S342 A370V334-S338 WeakPolarHBondContact O-CB 3.04Å; V334-S338 PolarHBondContact O-N 2.62Å; V334-S338 PolarHBondContact O-OG 2.87Å; L335-S338 PolarHBondContact O-N 3.49Å; A336-S338 PolarHBondContact O-N 2.87Å; S338-S342 WeakPolarHBondContact O-CB 3.31Å; S338-S342 PolarHBondContact O-N 3.4Å; S338-A370 WeakPolarHBondContact CB-O 3.39Å; S338-A370 WeakPolarHBondContact O-CB 3.47Å
339L92.1Very high89.7Confident39 Ų3960 Ų6020%0.20434%0.336CS..Hα-helixtrans-65.8-42.3175.7-71.2170.1000112.1I282 L335 A336 Y337 S342 A343 I371 A374I282-L339 HydrophobicContact CG2-CD1 3.82Å; L335-L339 HydrophobicContact CD1-CD1 4.27Å; L335-L339 HydrophobicContact CG-CD1 4.17Å; L335-L339 WeakPolarHBondContact O-CG 3.4Å; L335-L339 PolarHBondContact O-N 2.9Å; A336-L339 PolarHBondContact O-N 3.31Å; Y337-L339 PolarHBondContact O-N 2.76Å; L339-S342 PolarHBondContact O-N 3.08Å; L339-A343 WeakPolarHBondContact O-CB 3.44Å; L339-A343 PolarHBondContact O-N 3.35Å; L339-I371 HydrophobicContact CD2-CD1 3.91Å; L339-A374 HydrophobicContact CD2-CB 3.83Å; L339-A374 HydrophobicContact CG-CB 3.99Å
340F93.8Very high89.5Confident138 Ų13861.7 Ų61.761%0.60534%0.34SS*.Hα-helixtrans-64.1-47.4177.8-178.5-98.1000112A336 Y337 S342 A343 L344A336-F340 WeakPolarHBondContact O-CB 3.43Å; A336-F340 PolarHBondContact O-N 3.31Å; Y337-F340 PolarHBondContact O-N 2.87Å; F340-S342 VanDerWaalsContact C-N 3.3Å; F340-S342 PolarHBondContact O-N 2.95Å; F340-A343 PolarHBondContact O-N 2.89Å; F340-L344 WeakPolarHBondContact O-CB 3.41Å; F340-L344 PolarHBondContact O-N 3.13Å
341C93.8Very high89.6Confident59 Ų5965.4 Ų65.440%0.39936%0.356SS..Hα-helixtrans-59.7-40.9175.7-720000111.7Y337 L344 A345 A370Y337-C341 VanDerWaalsContact O-CB 3.31Å; Y337-C341 WeakPolarHBondContact O-CB 3.46Å; Y337-C341 PolarHBondContact O-N 3.04Å; Y337-C341 PolarHBondContact O-SG 3.2Å; C341-L344 PolarHBondContact O-N 3.4Å; C341-A345 WeakPolarHBondContact O-CB 3.35Å; C341-A345 PolarHBondContact O-N 3.1Å; C341-A370 HydrophobicContact CB-CB 3.95Å
342S93.1Very high89.5Confident6 Ų664.4 Ų64.44%0.04235%0.354CS..Hα-helixtrans-63.5-42174.7176.60000112.5F293 S338 L339 F340 C346 I371F293-S342 WeakPolarHBondContact CE2-OG 3.34Å; S338-S342 WeakPolarHBondContact O-CB 3.31Å; S338-S342 PolarHBondContact O-N 3.4Å; L339-S342 PolarHBondContact O-N 3.08Å; F340-S342 VanDerWaalsContact C-N 3.3Å; F340-S342 PolarHBondContact O-N 2.95Å; S342-C346 WeakPolarHBondContact O-CB 3.35Å; S342-C346 PolarHBondContact O-N 3.38Å; S342-I371 WeakPolarHBondContact OG-CB 3.32Å
343A91.3Very high89.2Confident61 Ų6159.2 Ų59.250%0.50435%0.345SS..Hα-helixtrans-66.7-42.7178.700000111.4L339 F340 C346 G347L339-A343 WeakPolarHBondContact O-CB 3.44Å; L339-A343 PolarHBondContact O-N 3.35Å; F340-A343 PolarHBondContact O-N 2.89Å; A343-C346 WeakPolarHBondContact O-CB 3.5Å; A343-C346 PolarHBondContact O-N 3.18Å; A343-G347 PolarHBondContact O-N 3.36Å
344L93.7Very high88.5Confident103 Ų10362.9 Ų62.954%0.53936%0.358SS..Hα-helixtrans-60.8-47.6174.9-178.862.6000111.2F340 C341 C346 G347 V348F340-L344 WeakPolarHBondContact O-CB 3.41Å; F340-L344 PolarHBondContact O-N 3.13Å; C341-L344 PolarHBondContact O-N 3.4Å; L344-C346 VanDerWaalsContact C-N 3.29Å; L344-C346 PolarHBondContact O-N 3.4Å; L344-G347 PolarHBondContact O-N 2.92Å; L344-V348 HydrophobicContact CD1-CG2 4.4Å; L344-V348 WeakPolarHBondContact O-CG2 3.35Å; L344-V348 PolarHBondContact O-N 3.2Å
345A92.1Very high88Confident7 Ų770.8 Ų70.86%0.05839%0.392CS..Hα-helixtrans-59.2-41176.800000111.9C341 V348 V349 T363 G367C341-A345 WeakPolarHBondContact O-CB 3.35Å; C341-A345 PolarHBondContact O-N 3.1Å; A345-V348 PolarHBondContact O-N 3.14Å; A345-V349 VanDerWaalsContact O-CG2 3.28Å; A345-V349 WeakPolarHBondContact O-CG2 3.43Å; A345-V349 PolarHBondContact O-N 3.4Å; A345-T363 HydrophobicContact CB-CG2 4.25Å; A345-G367 VanDerWaalsContact CB-CA 3.47Å
346C88.6Confident87.8Confident57 Ų5775.7 Ų75.739%0.38541%0.414SS..Hα-helixtrans-60.1-48.2175-169.90000111.6F293 S342 A343 L344 V348 V349 M350F293-C346 HydrophobicContact CE2-CB 4.43Å; F293-C346 HydrophobicContact CZ-CB 3.85Å; S342-C346 WeakPolarHBondContact O-CB 3.35Å; S342-C346 PolarHBondContact O-N 3.38Å; A343-C346 WeakPolarHBondContact O-CB 3.5Å; A343-C346 PolarHBondContact O-N 3.18Å; L344-C346 VanDerWaalsContact C-N 3.29Å; L344-C346 PolarHBondContact O-N 3.4Å; C346-V348 VanDerWaalsContact C-N 3.34Å; C346-V348 PolarHBondContact O-N 2.84Å; C346-V349 PolarHBondContact O-N 2.82Å; C346-M350 WeakPolarHBondContact O-CG 3.47Å; C346-M350 PolarHBondContact O-N 2.87Å
347G86.9Confident87.6Confident36 Ų3678 Ų7837%0.37141%0.411SS..Hα-helixtrans-60.7-40.6177.100000113A343 L344 M350A343-G347 PolarHBondContact O-N 3.36Å; L344-G347 PolarHBondContact O-N 2.92Å; G347-M350 PolarHBondContact O-N 3Å
348V88.2Confident87.4Confident63 Ų6375.8 Ų75.838%0.38241%0.409SS..Hα-helixtrans-66.4-42.2177175.60000111.3L344 A345 C346 M350 V351 I352 T363L344-V348 HydrophobicContact CD1-CG2 4.4Å; L344-V348 WeakPolarHBondContact O-CG2 3.35Å; L344-V348 PolarHBondContact O-N 3.2Å; A345-V348 PolarHBondContact O-N 3.14Å; C346-V348 VanDerWaalsContact C-N 3.34Å; C346-V348 PolarHBondContact O-N 2.84Å; V348-M350 PolarHBondContact O-N 3.39Å; V348-V351 PolarHBondContact O-N 3.28Å; V348-V351 VanDerWaalsContact O-N 3.1Å; V348-I352 HydrophobicContact CG1-CD1 3.92Å; V348-I352 HydrophobicContact CG1-CG1 4.42Å; V348-I352 WeakPolarHBondContact O-CG1 3.39Å; V348-I352 PolarHBondContact O-N 2.99Å; V348-T363 HydrophobicContact CB-CG2 3.88Å; V348-T363 HydrophobicContact CG1-CG2 3.75Å
349V85.8Confident87.3Confident23 Ų2379.9 Ų79.914%0.13943%0.429CS..Hα-helixtrans-57.8-35.8176.3169.30000111.8L300 A345 C346 V351 I352 T363 A364L300-V349 HydrophobicContact CD2-CG1 3.96Å; A345-V349 VanDerWaalsContact O-CG2 3.28Å; A345-V349 WeakPolarHBondContact O-CG2 3.43Å; A345-V349 PolarHBondContact O-N 3.4Å; C346-V349 PolarHBondContact O-N 2.82Å; V349-V351 VanDerWaalsContact C-N 3.28Å; V349-V351 PolarHBondContact O-N 3.31Å; V349-I352 PolarHBondContact O-N 3.48Å; V349-T363 HydrophobicContact CG2-CG2 3.73Å; V349-A364 HydrophobicContact CG2-CB 4.17Å
350M82Confident87.1Confident124 Ų12478.2 Ų78.261%0.61142%0.422SS*.Hα-helixtrans-66.6-26.4178.7-67.9179.970.900114C346 G347 V348C346-M350 WeakPolarHBondContact O-CG 3.47Å; C346-M350 PolarHBondContact O-N 2.87Å; G347-M350 PolarHBondContact O-N 3Å; V348-M350 PolarHBondContact O-N 3.39Å
351V85.5Confident86.9Confident109 Ų10972.3 Ų72.366%0.66140%0.397SS*.Hα-helixtrans-90.7-21.4-176.8-179.10000111.9V348 V349 P353V348-V351 PolarHBondContact O-N 3.28Å; V348-V351 VanDerWaalsContact O-N 3.1Å; V349-V351 VanDerWaalsContact C-N 3.28Å; V349-V351 PolarHBondContact O-N 3.31Å; V351-P353 VanDerWaalsContact O-CD 3.31Å; V351-P353 WeakPolarHBondContact O-CD 3.45Å
352I82.3Confident86.9Confident30 Ų3073.3 Ų73.315%0.15440%0.401CS..SBendtrans-71.1121.7-176.2-67.8164000110.4V348 V349 H356 L359V348-I352 HydrophobicContact CG1-CD1 3.92Å; V348-I352 HydrophobicContact CG1-CG1 4.42Å; V348-I352 WeakPolarHBondContact O-CG1 3.39Å; V348-I352 PolarHBondContact O-N 2.99Å; V349-I352 PolarHBondContact O-N 3.48Å; I352-H356 HydrophobicContact CG2-CB 4.23Å; I352-L359 HydrophobicContact CD1-CB 4.43Å; I352-L359 HydrophobicContact CD1-CD2 4.08Å; I352-L359 HydrophobicContact CD1-CG 3.8Å; I352-L359 HydrophobicContact CG1-CD2 4.2Å; I352-L359 HydrophobicContact CG1-CG 4.44Å; I352-L359 HydrophobicContact CG2-CB 4.48Å
353P80.4Confident86.8Confident82 Ų8274.1 Ų74.153%0.53241%0.405SS..  trans-65.8146.3175-18.931.6000111.8V351 K355 H356V351-P353 VanDerWaalsContact O-CD 3.31Å; V351-P353 WeakPolarHBondContact O-CD 3.45Å; P353-K355 PolarHBondContact O-N 3.36Å; P353-H356 PolarHBondContact O-N 3.23Å
354Q75.6Confident86.8Confident135 Ų13571.3 Ų71.363%0.63138%0.383SS*.G310 helixtrans-54.9-23.7178.5-71.3-69.9-23.100114H356 Y357Q354-H356 PolarHBondContact O-N 2.82Å; Q354-Y357 PolarHBondContact O-N 3.01Å
355K79.4Confident86.8Confident180 Ų18067.2 Ų67.278%0.78336%0.361SS*.G310 helixtrans-60.7-29.7174.3-168.6178-179.7-177.90112.8P353P353-K355 PolarHBondContact O-N 3.36Å
356H84.4Confident86.9Confident109 Ų10971 Ų7151%0.50538%0.383SS..G310 helixtrans-107.247.8179.7-63.2-65.5000111.8I352 P353 Q354 I358 L359 G360I352-H356 HydrophobicContact CG2-CB 4.23Å; P353-H356 PolarHBondContact O-N 3.23Å; Q354-H356 PolarHBondContact O-N 2.82Å; H356-I358 PolarHBondContact O-N 3.2Å; H356-I358 VanDerWaalsContact O-N 3.16Å; H356-L359 HydrophobicContact CB-CB 4.49Å; H356-L359 WeakPolarHBondContact O-CB 3.28Å; H356-L359 PolarHBondContact O-N 3.12Å; H356-G360 PolarHBondContact O-N 3.43Å
357Y85.6Confident87.1Confident107 Ų10768.2 Ų68.242%0.4236%0.364SS..Hα-helixtrans-55.7-33.7-175.773.3-91000114L300 Q354 L359 G360 V361L300-Y357 WeakPolarHBondContact O-CB 3.35Å; Q354-Y357 PolarHBondContact O-N 3.01Å; Y357-L359 VanDerWaalsContact C-N 3.31Å; Y357-L359 PolarHBondContact O-N 3.06Å; Y357-G360 CarbonylContact O-C 3.52Å; Y357-G360 WeakPolarHBondContact O-CA 3.31Å; Y357-G360 PolarHBondContact O-N 3.17Å; Y357-G360 VanDerWaalsContact O-N 3.1Å; Y357-V361 WeakPolarHBondContact O-CG2 3.34Å; Y357-V361 PolarHBondContact O-N 2.88Å
358I89.1Confident87.3Confident110 Ų11066.5 Ų66.556%0.56435%0.347SS*.Hα-helixtrans-58.9-43177.3-59.6174000111H356 G360 V361 V362H356-I358 PolarHBondContact O-N 3.2Å; H356-I358 VanDerWaalsContact O-N 3.16Å; I358-G360 VanDerWaalsContact C-N 3.32Å; I358-V361 PolarHBondContact O-N 3.45Å; I358-V362 WeakPolarHBondContact O-CG2 3.45Å; I358-V362 PolarHBondContact O-N 3.16Å
359L89Confident87.5Confident99 Ų9966.7 Ų66.752%0.51834%0.342SS..Hα-helixtrans-66.8-37.9177.5-174.964.9000111.1I352 H356 Y357 T363I352-L359 HydrophobicContact CD1-CB 4.43Å; I352-L359 HydrophobicContact CD1-CD2 4.08Å; I352-L359 HydrophobicContact CD1-CG 3.8Å; I352-L359 HydrophobicContact CG1-CD2 4.2Å; I352-L359 HydrophobicContact CG1-CG 4.44Å; I352-L359 HydrophobicContact CG2-CB 4.48Å; H356-L359 HydrophobicContact CB-CB 4.49Å; H356-L359 WeakPolarHBondContact O-CB 3.28Å; H356-L359 PolarHBondContact O-N 3.12Å; Y357-L359 VanDerWaalsContact C-N 3.31Å; Y357-L359 PolarHBondContact O-N 3.06Å; L359-T363 WeakPolarHBondContact O-CB 3.47Å; L359-T363 PolarHBondContact O-N 2.84Å; L359-T363 PolarHBondContact O-OG1 3.09Å
360G88.5Confident87.8Confident5 Ų565.9 Ų65.95%0.05234%0.338CS..Hα-helixtrans-60.1-46.717300000112.1H356 Y357 I358 T363 A364H356-G360 PolarHBondContact O-N 3.43Å; Y357-G360 CarbonylContact O-C 3.52Å; Y357-G360 WeakPolarHBondContact O-CA 3.31Å; Y357-G360 PolarHBondContact O-N 3.17Å; Y357-G360 VanDerWaalsContact O-N 3.1Å; I358-G360 VanDerWaalsContact C-N 3.32Å; G360-T363 PolarHBondContact O-N 3.03Å; G360-A364 VanDerWaalsContact O-CB 3.28Å; G360-A364 WeakPolarHBondContact O-CB 3.28Å; G360-A364 PolarHBondContact O-N 3.09Å
361V90.5Very high88.2Confident13 Ų1360.2 Ų60.28%0.07931%0.31CS..Hα-helixtrans-61.5-50.7176.71740000111.1L300 L310 Y357 I358 T363 A364 M365L300-V361 HydrophobicContact CB-CG2 3.91Å; L300-V361 HydrophobicContact CD1-CG2 4.43Å; L310-V361 HydrophobicContact CD1-CG1 4.19Å; Y357-V361 WeakPolarHBondContact O-CG2 3.34Å; Y357-V361 PolarHBondContact O-N 2.88Å; I358-V361 PolarHBondContact O-N 3.45Å; V361-T363 VanDerWaalsContact C-N 3.34Å; V361-T363 PolarHBondContact O-N 2.95Å; V361-A364 PolarHBondContact O-N 3.49Å; V361-M365 HydrophobicContact CG1-CE 4.21Å; V361-M365 HydrophobicContact CG1-CG 4.42Å; V361-M365 VanDerWaalsContact O-CG 3.3Å; V361-M365 WeakPolarHBondContact O-CG 3.48Å; V361-M365 PolarHBondContact O-N 3.36Å
362V92.3Very high88.3Confident81 Ų8155 Ų5549%0.49128%0.279SS..Hα-helixtrans-59.1-45.3179.3172.10000111.3I358 A364 M365 V366I358-V362 WeakPolarHBondContact O-CG2 3.45Å; I358-V362 PolarHBondContact O-N 3.16Å; V362-A364 PolarHBondContact O-N 3.05Å; V362-M365 WeakPolarHBondContact O-CB 3.47Å; V362-M365 PolarHBondContact O-N 3.34Å; V362-V366 WeakPolarHBondContact O-CG2 3.39Å; V362-V366 PolarHBondContact O-N 2.85Å
363T91.3Very high88.5Confident22 Ų2253.6 Ų53.614%0.13527%0.272CS..Hα-helixtrans-64.7-41.4179-52.20000111.3A345 V348 V349 L359 G360 V361 M365 V366 G367A345-T363 HydrophobicContact CB-CG2 4.25Å; V348-T363 HydrophobicContact CB-CG2 3.88Å; V348-T363 HydrophobicContact CG1-CG2 3.75Å; V349-T363 HydrophobicContact CG2-CG2 3.73Å; L359-T363 WeakPolarHBondContact O-CB 3.47Å; L359-T363 PolarHBondContact O-N 2.84Å; L359-T363 PolarHBondContact O-OG1 3.09Å; G360-T363 PolarHBondContact O-N 3.03Å; V361-T363 VanDerWaalsContact C-N 3.34Å; V361-T363 PolarHBondContact O-N 2.95Å; T363-M365 VanDerWaalsContact C-N 3.32Å; T363-M365 PolarHBondContact O-N 2.95Å; T363-V366 PolarHBondContact O-N 3.1Å; T363-G367 PolarHBondContact O-N 2.73Å
364A91.4Very high88.9Confident3 Ų349.9 Ų49.93%0.02525%0.248CC..Hα-helixtrans-64.1-36.2175.100000112.3F293 L300 V349 G360 V361 V362 G367 K368F293-A364 HydrophobicContact CD1-CB 4.35Å; L300-A364 HydrophobicContact CD1-CB 3.39Å; L300-A364 HydrophobicContact CD2-CB 4.15Å; L300-A364 HydrophobicContact CG-CB 4.43Å; V349-A364 HydrophobicContact CG2-CB 4.17Å; G360-A364 VanDerWaalsContact O-CB 3.28Å; G360-A364 WeakPolarHBondContact O-CB 3.28Å; G360-A364 PolarHBondContact O-N 3.09Å; V361-A364 PolarHBondContact O-N 3.49Å; V362-A364 PolarHBondContact O-N 3.05Å; A364-G367 PolarHBondContact O-N 3.45Å; A364-K368 WeakPolarHBondContact O-CB 3.46Å; A364-K368 PolarHBondContact O-N 3.22Å
365M93.6Very high89.2Confident17 Ų1744.5 Ų44.58%0.08422%0.222CC..Hα-helixtrans-64.6-41.8173.5-68.3-47.6118.200111.7L310 L311 V314 V361 V362 T363 G367 K368 F369L310-M365 HydrophobicContact CB-CE 4.36Å; L310-M365 HydrophobicContact CB-CG 4.38Å; L310-M365 HydrophobicContact CB-SD 3.71Å; L311-M365 HydrophobicContact CD2-CE 3.63Å; L311-M365 HydrophobicContact CD2-SD 3.92Å; L311-M365 HydrophobicContact CG-CE 3.97Å; L311-M365 HydrophobicContact CG-SD 4.3Å; V314-M365 WeakPolarHBondContact CG1-O 3.22Å; V314-M365 HydrophobicContact CG2-CB 4.14Å; V314-M365 HydrophobicContact CG2-CG 4.34Å; V314-M365 HydrophobicContact CG2-SD 4.21Å; V361-M365 HydrophobicContact CG1-CE 4.21Å; V361-M365 HydrophobicContact CG1-CG 4.42Å; V361-M365 VanDerWaalsContact O-CG 3.3Å; V361-M365 WeakPolarHBondContact O-CG 3.48Å; V361-M365 PolarHBondContact O-N 3.36Å; V362-M365 WeakPolarHBondContact O-CB 3.47Å; V362-M365 PolarHBondContact O-N 3.34Å; T363-M365 VanDerWaalsContact C-N 3.32Å; T363-M365 PolarHBondContact O-N 2.95Å; M365-G367 VanDerWaalsContact C-N 3.34Å; M365-G367 PolarHBondContact O-N 2.97Å; M365-K368 PolarHBondContact O-N 3.16Å; M365-F369 WeakPolarHBondContact O-CB 3.18Å; M365-F369 PolarHBondContact O-N 3.28Å
366V93.7Very high89Confident85 Ų8537.1 Ų37.152%0.51520%0.197SC..Hα-helixtrans-61.9-43.8173.7174.40000111V362 T363 K368 F369 A370V362-V366 WeakPolarHBondContact O-CG2 3.39Å; V362-V366 PolarHBondContact O-N 2.85Å; T363-V366 PolarHBondContact O-N 3.1Å; V366-K368 VanDerWaalsContact C-N 3.34Å; V366-K368 PolarHBondContact O-N 2.89Å; V366-F369 WeakPolarHBondContact O-CB 3.27Å; V366-F369 PolarHBondContact O-N 3.01Å; V366-A370 PolarHBondContact O-N 3.48Å; V366-A370 VanDerWaalsContact O-N 3.09Å
367G92.7Very high88.9Confident0 Ų032 Ų320%017%0.174CC..Hα-helixtrans-60.4-43.4174.200000112.4A345 T363 A364 M365 A370 I371A345-G367 VanDerWaalsContact CB-CA 3.47Å; T363-G367 PolarHBondContact O-N 2.73Å; A364-G367 PolarHBondContact O-N 3.45Å; M365-G367 VanDerWaalsContact C-N 3.34Å; M365-G367 PolarHBondContact O-N 2.97Å; G367-A370 PolarHBondContact O-N 3.25Å; G367-I371 PolarHBondContact O-N 3.41Å
368K91.2Very high88.9Confident0 Ų027.1 Ų27.10%016%0.155CC..Hα-helixtrans-63.8-42.8177.7-174.667.5174168.50112.4F290 F293 S294 L311 E315 A364 M365 V366 A370 I371 G372F290-K368 VanDerWaalsContact CD2-NZ 3.33Å; F290-K368 PolarHBondContact O-NZ 3.37Å; F293-K368 HydrophobicContact CB-CD 4Å; S294-K368 PolarHBondContact OG-NZ 3.48Å; L311-K368 HydrophobicContact CD2-CB 3.78Å; L311-K368 HydrophobicContact CD2-CD 3.82Å; L311-K368 HydrophobicContact CD2-CG 3.47Å; L311-K368 VanDerWaalsContact CD2-CG 3.47Å; E315-K368 WeakPolarHBondContact OE1-CE 3.46Å; E315-K368 IonicContact OE1-NZ 2.64Å; E315-K368 PolarHBondContact OE1-NZ 2.88Å; A364-K368 WeakPolarHBondContact O-CB 3.46Å; A364-K368 PolarHBondContact O-N 3.22Å; M365-K368 PolarHBondContact O-N 3.16Å; V366-K368 VanDerWaalsContact C-N 3.34Å; V366-K368 PolarHBondContact O-N 2.89Å; K368-A370 VanDerWaalsContact C-N 3.35Å; K368-A370 PolarHBondContact O-N 2.87Å; K368-I371 HydrophobicContact CD-CG2 4.22Å; K368-I371 WeakPolarHBondContact O-CG2 3.16Å; K368-G372 PolarHBondContact O-N 3.38Å
369F92.8Very high88.4Confident66 Ų6625.3 Ų25.329%0.28914%0.142SC..Hα-helixtrans-56.2-50.9174-179.2-91.6000110.8V314 A318 F321 M365 V366 G372 A373V314-F369 HydrophobicContact CG1-CB 3.51Å; V314-F369 HydrophobicContact CG1-CD2 3.97Å; V314-F369 HydrophobicContact CG1-CG 4.24Å; A318-F369 HydrophobicContact CB-CD2 3.52Å; A318-F369 HydrophobicContact CB-CE2 3.68Å; A318-F369 HydrophobicContact CB-CG 4.11Å; A318-F369 HydrophobicContact CB-CZ 4.34Å; F321-F369 HydrophobicContact CB-CZ 3.96Å; F321-F369 HydrophobicContact CD1-CE1 4.03Å; F321-F369 AromaticContact CD1-CZ 3.86Å; F321-F369 HydrophobicContact CD1-CZ 3.86Å; F321-F369 HydrophobicContact CE1-CE1 4.41Å; F321-F369 AromaticContact CG-CZ 3.92Å; F321-F369 HydrophobicContact CG-CZ 3.92Å; M365-F369 WeakPolarHBondContact O-CB 3.18Å; M365-F369 PolarHBondContact O-N 3.28Å; V366-F369 WeakPolarHBondContact O-CB 3.27Å; V366-F369 PolarHBondContact O-N 3.01Å; F369-G372 PolarHBondContact O-N 2.93Å; F369-A373 WeakPolarHBondContact O-CB 3.33Å; F369-A373 PolarHBondContact O-N 3.4Å
370A92.8Very high87.9Confident7 Ų723.3 Ų23.36%0.05813%0.131CC..Hα-helixtrans-66.1-43.2-177.400000112.3S338 C341 V366 G367 K368 A373 A374S338-A370 WeakPolarHBondContact CB-O 3.39Å; S338-A370 WeakPolarHBondContact O-CB 3.47Å; C341-A370 HydrophobicContact CB-CB 3.95Å; V366-A370 PolarHBondContact O-N 3.48Å; V366-A370 VanDerWaalsContact O-N 3.09Å; G367-A370 PolarHBondContact O-N 3.25Å; K368-A370 VanDerWaalsContact C-N 3.35Å; K368-A370 PolarHBondContact O-N 2.87Å; A370-A373 WeakPolarHBondContact O-CB 3.47Å; A370-A373 PolarHBondContact O-N 3.38Å; A370-A374 PolarHBondContact O-N 3.3Å
371I91.1Very high87.7Confident4 Ų425.3 Ų25.32%0.02114%0.137CC..Hα-helixtrans-71.7-36.9179.1-156.858.6000112.3F290 F293 L339 S342 G367 K368 A373 A374 F375F290-I371 HydrophobicContact CB-CG1 4.33Å; F290-I371 HydrophobicContact CB-CG2 4.42Å; F290-I371 HydrophobicContact CD2-CG2 4.38Å; F293-I371 HydrophobicContact CD2-CG2 4.1Å; L339-I371 HydrophobicContact CD2-CD1 3.91Å; S342-I371 WeakPolarHBondContact OG-CB 3.32Å; G367-I371 PolarHBondContact O-N 3.41Å; K368-I371 HydrophobicContact CD-CG2 4.22Å; K368-I371 WeakPolarHBondContact O-CG2 3.16Å; I371-A373 VanDerWaalsContact C-N 3.26Å; I371-A373 PolarHBondContact O-N 3.49Å; I371-A374 PolarHBondContact O-N 2.98Å; I371-F375 WeakPolarHBondContact O-CB 3.35Å; I371-F375 PolarHBondContact O-N 2.97Å
372G86.8Confident87.3Confident0 Ų024.7 Ų24.70%013%0.133CC..Hα-helixtrans-60.7-40.5173.800000111.2K368 F369 F375 G376K368-G372 PolarHBondContact O-N 3.38Å; F369-G372 PolarHBondContact O-N 2.93Å; G372-F375 PolarHBondContact O-N 3.17Å; G372-G376 PolarHBondContact O-N 2.94Å
373A86.1Confident86.6Confident1 Ų122 Ų221%0.00812%0.12CC..Hα-helixtrans-61.4-47.3173.700000113.1V322 F369 A370 I371 F375 L377V322-A373 HydrophobicContact CG2-CB 3.19Å; F369-A373 WeakPolarHBondContact O-CB 3.33Å; F369-A373 PolarHBondContact O-N 3.4Å; A370-A373 WeakPolarHBondContact O-CB 3.47Å; A370-A373 PolarHBondContact O-N 3.38Å; I371-A373 VanDerWaalsContact C-N 3.26Å; I371-A373 PolarHBondContact O-N 3.49Å; A373-F375 VanDerWaalsContact C-N 3.34Å; A373-F375 PolarHBondContact O-N 2.82Å; A373-L377 WeakPolarHBondContact O-CB 3.43Å; A373-L377 PolarHBondContact O-N 2.9Å
374A88.3Confident86.2Confident3 Ų325.9 Ų25.93%0.02514%0.137CC..Hα-helixtrans-61.3-42.2175.700000112.3L335 L339 A370 I371 L377 I378L335-A374 HydrophobicContact CD1-CB 3.89Å; L339-A374 HydrophobicContact CD2-CB 3.83Å; L339-A374 HydrophobicContact CG-CB 3.99Å; A370-A374 PolarHBondContact O-N 3.3Å; I371-A374 PolarHBondContact O-N 2.98Å; A374-L377 PolarHBondContact O-N 3.41Å; A374-I378 PolarHBondContact O-N 3.26Å
375F82.2Confident85.9Confident22 Ų2228 Ų2810%0.09615%0.147CC..Hα-helixtrans-68.4-35.8-177.6-164.6-100.7000113I371 G372 A373 I378 Y379 C402I371-F375 WeakPolarHBondContact O-CB 3.35Å; I371-F375 PolarHBondContact O-N 2.97Å; G372-F375 PolarHBondContact O-N 3.17Å; A373-F375 VanDerWaalsContact C-N 3.34Å; A373-F375 PolarHBondContact O-N 2.82Å; F375-I378 VanDerWaalsContact O-CG2 3.31Å; F375-I378 WeakPolarHBondContact O-CG2 3.39Å; F375-Y379 HydrophobicContact CD1-CE2 4.37Å; F375-Y379 AromaticContact CE1-CE2 3.86Å; F375-Y379 HydrophobicContact CE1-CE2 3.86Å; F375-Y379 HydrophobicContact CZ-CE2 4.03Å; F375-Y379 WeakPolarHBondContact O-CD2 3.3Å; F375-C402 VanDerWaalsContact CE2-SG 3.57Å
376G76.4Confident85.3Confident25 Ų2527.6 Ų27.626%0.25815%0.145SC..Hα-helixtrans-67.8-37.9172.400000112.7G372G372-G376 PolarHBondContact O-N 2.94Å
377L81.4Confident84.5Confident2 Ų227.1 Ų27.11%0.0114%0.144CC..Hα-helixtrans-75.7-30.7-174.9-174.756.8000113.6V322 M326 R331 V334 L335 A373 A374 Y379 L380 Y381V322-L377 HydrophobicContact CG1-CB 4.1Å; V322-L377 HydrophobicContact CG1-CD1 4.41Å; M326-L377 HydrophobicContact CB-CD1 4.38Å; M326-L377 HydrophobicContact CG-CD1 3.78Å; M326-L377 HydrophobicContact SD-CD1 3.25Å; M326-L377 WeakPolarHBondContact SD-CD1 3.04Å; R331-L377 HydrophobicContact CB-CD1 4.26Å; R331-L377 WeakPolarHBondContact O-CD2 3.45Å; V334-L377 HydrophobicContact CB-CD2 3.89Å; V334-L377 HydrophobicContact CG1-CD2 3.78Å; L335-L377 HydrophobicContact CB-CD2 3.83Å; L335-L377 HydrophobicContact CD1-CB 4.5Å; A373-L377 WeakPolarHBondContact O-CB 3.43Å; A373-L377 PolarHBondContact O-N 2.9Å; A374-L377 PolarHBondContact O-N 3.41Å; L377-Y379 PolarHBondContact O-N 2.81Å; L377-L380 PolarHBondContact O-N 3.44Å; L377-Y381 WeakPolarHBondContact O-CB 2.96Å; L377-Y381 PolarHBondContact O-N 2.82Å
378I85.9Confident83.5Confident5 Ų531.9 Ų31.93%0.02617%0.173CC..Hα-helixtrans-65.5-35-173.9-161.9177.4000113.5I282 W283 A374 F375 L380 T382I282-I378 VanDerWaalsContact C-CD1 3.47Å; I282-I378 HydrophobicContact CB-CD1 3.9Å; I282-I378 HydrophobicContact CG2-CD1 3.3Å; I282-I378 HydrophobicContact CG2-CG1 3.98Å; W283-I378 VanDerWaalsContact CA-CD1 3.48Å; W283-I378 HydrophobicContact CB-CD1 4.05Å; W283-I378 HydrophobicContact CD2-CD1 3.57Å; W283-I378 HydrophobicContact CD2-CG1 4.08Å; W283-I378 HydrophobicContact CD2-CG2 4.08Å; W283-I378 HydrophobicContact CE3-CD1 4.12Å; W283-I378 HydrophobicContact CE3-CG2 3.83Å; W283-I378 HydrophobicContact CG-CD1 3.49Å; W283-I378 VanDerWaalsContact CG-CD1 3.49Å; W283-I378 HydrophobicContact CG-CG1 4.32Å; W283-I378 HydrophobicContact CH2-CG2 3.74Å; W283-I378 HydrophobicContact CZ2-CG1 4.28Å; W283-I378 HydrophobicContact CZ2-CG2 3.93Å; W283-I378 HydrophobicContact CZ3-CG2 3.68Å; W283-I378 VanDerWaalsContact N-CD1 3.3Å; A374-I378 PolarHBondContact O-N 3.26Å; F375-I378 VanDerWaalsContact O-CG2 3.31Å; F375-I378 WeakPolarHBondContact O-CG2 3.39Å; I378-L380 VanDerWaalsContact C-N 3.31Å; I378-L380 PolarHBondContact O-N 3.34Å; I378-T382 VanDerWaalsContact O-CB 3.3Å; I378-T382 WeakPolarHBondContact O-CB 3.31Å; I378-T382 PolarHBondContact O-N 3.31Å; I378-T382 PolarHBondContact O-OG1 3.21Å
379Y78.9Confident82.6Confident72 Ų7237.5 Ų37.528%0.28220%0.202SC..Hα-helixtrans-57.1-49.1175-80.6-92.8000110.4W283 F375 L377 A383W283-Y379 AromaticContact CH2-CD1 3.5Å; W283-Y379 HydrophobicContact CH2-CD1 3.5Å; W283-Y379 AromaticContact CH2-CD2 3.48Å; W283-Y379 HydrophobicContact CH2-CD2 3.48Å; W283-Y379 VanDerWaalsContact CH2-CD2 3.48Å; W283-Y379 AromaticContact CH2-CE1 3.46Å; W283-Y379 HydrophobicContact CH2-CE1 3.46Å; W283-Y379 VanDerWaalsContact CH2-CE1 3.46Å; W283-Y379 AromaticContact CH2-CE2 3.43Å; W283-Y379 HydrophobicContact CH2-CE2 3.43Å; W283-Y379 VanDerWaalsContact CH2-CE2 3.43Å; W283-Y379 AromaticContact CH2-CG 3.49Å; W283-Y379 HydrophobicContact CH2-CG 3.49Å; W283-Y379 VanDerWaalsContact CH2-CG 3.49Å; W283-Y379 AromaticContact CH2-CZ 3.41Å; W283-Y379 VanDerWaalsContact CH2-CZ 3.41Å; W283-Y379 HydrophobicContact CZ2-CD1 4.32Å; W283-Y379 HydrophobicContact CZ2-CG 4.28Å; W283-Y379 HydrophobicContact CZ3-CD1 4.4Å; W283-Y379 AromaticContact CZ3-CD2 3.88Å; W283-Y379 HydrophobicContact CZ3-CD2 3.88Å; W283-Y379 AromaticContact CZ3-CE1 3.99Å; W283-Y379 HydrophobicContact CZ3-CE1 3.99Å; W283-Y379 AromaticContact CZ3-CE2 3.41Å; W283-Y379 HydrophobicContact CZ3-CE2 3.41Å; W283-Y379 VanDerWaalsContact CZ3-CE2 3.41Å; W283-Y379 HydrophobicContact CZ3-CG 4.33Å; W283-Y379 AromaticContact CZ3-CZ 3.45Å; W283-Y379 VanDerWaalsContact CZ3-CZ 3.45Å; F375-Y379 HydrophobicContact CD1-CE2 4.37Å; F375-Y379 AromaticContact CE1-CE2 3.86Å; F375-Y379 HydrophobicContact CE1-CE2 3.86Å; F375-Y379 HydrophobicContact CZ-CE2 4.03Å; F375-Y379 WeakPolarHBondContact O-CD2 3.3Å; L377-Y379 PolarHBondContact O-N 2.81Å; Y379-A383 PolarHBondContact O-N 3.27Å; Y379-A383 VanDerWaalsContact O-N 3.15Å
380L78.3Confident81.8Confident56 Ų5635.2 Ų35.229%0.29319%0.193SC..Hα-helixtrans-75.5-40-175.5-161.569.8000111.9M326 L377 I378 T382 A383 E384M326-L380 HydrophobicContact CE-CD2 3.66Å; M326-L380 HydrophobicContact SD-CD2 3.68Å; L377-L380 PolarHBondContact O-N 3.44Å; I378-L380 VanDerWaalsContact C-N 3.31Å; I378-L380 PolarHBondContact O-N 3.34Å; L380-T382 VanDerWaalsContact C-N 3.34Å; L380-T382 PolarHBondContact O-N 3.2Å; L380-A383 PolarHBondContact O-N 2.96Å; L380-E384 PolarHBondContact O-N 3.24Å; L380-E384 VanDerWaalsContact O-N 3.09Å
381Y83.9Confident81Confident47 Ų4739.1 Ų39.118%0.18421%0.206CC..Hα-helixtrans-61.7-41.7174.7-176.5-107.1000112R331 R332 L335 L377 A383 E384 L385R331-Y381 HydrophobicContact CB-CD2 4.03Å; R332-Y381 HydrophobicContact CB-CE2 4.2Å; L335-Y381 HydrophobicContact CD2-CD1 4Å; L335-Y381 HydrophobicContact CD2-CE1 4.41Å; L335-Y381 HydrophobicContact CD2-CG 4.38Å; L377-Y381 WeakPolarHBondContact O-CB 2.96Å; L377-Y381 PolarHBondContact O-N 2.82Å; Y381-A383 VanDerWaalsContact C-N 3.34Å; Y381-A383 PolarHBondContact O-N 2.99Å; Y381-E384 PolarHBondContact O-N 3.25Å; Y381-L385 HydrophobicContact CE1-CD2 4.2Å; Y381-L385 WeakPolarHBondContact O-CB 3.39Å; Y381-L385 PolarHBondContact O-N 3.11Å
382T83.1Confident79.9Confident0 Ų043.8 Ų43.80%024%0.239CC..Hα-helixtrans-64-40.6175.8-54.70000111V279 W283 I378 L380 E384 Y386 A394 V395V279-T382 HydrophobicContact CG1-CG2 3.91Å; W283-T382 PolarHBondContact NE1-OG1 3.09Å; I378-T382 VanDerWaalsContact O-CB 3.3Å; I378-T382 WeakPolarHBondContact O-CB 3.31Å; I378-T382 PolarHBondContact O-N 3.31Å; I378-T382 PolarHBondContact O-OG1 3.21Å; L380-T382 VanDerWaalsContact C-N 3.34Å; L380-T382 PolarHBondContact O-N 3.2Å; T382-E384 VanDerWaalsContact C-N 3.32Å; T382-E384 PolarHBondContact O-N 2.98Å; T382-Y386 HydrophobicContact CG2-CD2 4.31Å; T382-Y386 HydrophobicContact CG2-CE2 4.29Å; T382-Y386 WeakPolarHBondContact O-CD2 3.38Å; T382-A394 HydrophobicContact CG2-CB 4.21Å; T382-V395 HydrophobicContact CG2-CB 4.44Å; T382-V395 HydrophobicContact CG2-CG2 3.76Å
383A77.1Confident79.5Confident25 Ų2545.4 Ų45.421%0.20725%0.248CC..Hα-helixtrans-63.2-37.5177.600000112.5Y379 L380 Y381 R391 V395Y379-A383 PolarHBondContact O-N 3.27Å; Y379-A383 VanDerWaalsContact O-N 3.15Å; L380-A383 PolarHBondContact O-N 2.96Å; Y381-A383 VanDerWaalsContact C-N 3.34Å; Y381-A383 PolarHBondContact O-N 2.99Å; A383-R391 HydrophobicContact CB-CG 4.25Å; A383-R391 WeakPolarHBondContact O-CD 3.15Å; A383-R391 VanDerWaalsContact O-CG 3.32Å; A383-R391 WeakPolarHBondContact O-CG 3.37Å; A383-R391 PolarHBondContact O-NE 3.37Å; A383-V395 HydrophobicContact CB-CG2 4.21Å
384E83.1Confident79.1Confident104 Ų10445.4 Ų45.449%0.48625%0.248SC..Hα-helixtrans-83.3-27.5-177.9-73.5178.1-175.600114.5R331 L380 Y381 T382 Y386R331-E384 VanDerWaalsContact CD-OE2 3.32Å; R331-E384 WeakPolarHBondContact CD-OE2 3.46Å; R331-E384 IonicContact CZ-OE1 3.94Å; R331-E384 IonicContact CZ-OE2 3.19Å; R331-E384 IonicContact NE-OE1 3.84Å; R331-E384 IonicContact NE-OE2 3.13Å; R331-E384 PolarHBondContact NE-OE2 3.23Å; R331-E384 IonicContact NH1-OE1 2.73Å; R331-E384 PolarHBondContact NH1-OE1 3.33Å; R331-E384 IonicContact NH1-OE2 3.69Å; R331-E384 PolarHBondContact NH1-OE2 2.94Å; R331-E384 IonicContact NH2-OE1 3.06Å; R331-E384 PolarHBondContact NH2-OE1 3.45Å; R331-E384 IonicContact NH2-OE2 2.67Å; L380-E384 PolarHBondContact O-N 3.24Å; L380-E384 VanDerWaalsContact O-N 3.09Å; Y381-E384 PolarHBondContact O-N 3.25Å; T382-E384 VanDerWaalsContact C-N 3.32Å; T382-E384 PolarHBondContact O-N 2.98Å; E384-Y386 VanDerWaalsContact C-N 3.29Å; E384-Y386 PolarHBondContact O-N 3.43Å
385L85.1Confident78.7Confident48 Ų4846.9 Ų46.925%0.25126%0.256SS..Hα-helixtrans-69.6-28.3-178.8-174.565.4000112.8V279 Y381V279-L385 HydrophobicContact CG2-CD2 3.71Å; Y381-L385 HydrophobicContact CE1-CD2 4.2Å; Y381-L385 WeakPolarHBondContact O-CB 3.39Å; Y381-L385 PolarHBondContact O-N 3.11Å
386Y80.7Confident78.4Confident7 Ų747.5 Ų47.53%0.02727%0.269CS..SBendtrans-101.4141.4-174.6-74.8-97000112.2L266 I272 T276 V279 T382 E384 V390 R391 A394L266-Y386 HydrophobicContact CD2-CD1 4.44Å; L266-Y386 HydrophobicContact CD2-CE1 3.85Å; I272-Y386 HydrophobicContact CG2-CE1 4.05Å; T276-Y386 WeakPolarHBondContact CA-OH 3.24Å; T276-Y386 WeakPolarHBondContact CB-OH 3.41Å; T276-Y386 PolarHBondContact N-OH 2.9Å; T276-Y386 PolarHBondContact OG1-OH 3.29Å; V279-Y386 HydrophobicContact CG2-CE2 4.35Å; T382-Y386 HydrophobicContact CG2-CD2 4.31Å; T382-Y386 HydrophobicContact CG2-CE2 4.29Å; T382-Y386 WeakPolarHBondContact O-CD2 3.38Å; E384-Y386 VanDerWaalsContact C-N 3.29Å; E384-Y386 PolarHBondContact O-N 3.43Å; Y386-V390 HydrophobicContact CD1-CG2 3.89Å; Y386-R391 PolarHBondContact O-NH2 3.27Å; Y386-A394 HydrophobicContact CD1-CB 3.62Å; Y386-A394 HydrophobicContact CD2-CB 3.57Å; Y386-A394 HydrophobicContact CE1-CB 3.76Å; Y386-A394 HydrophobicContact CE2-CB 3.72Å; Y386-A394 HydrophobicContact CG-CB 3.52Å
387P76.1Confident78.8Confident76 Ų7646.8 Ų46.849%0.49426%0.259SS..  trans-63.5153.3173.123-25.8000110.4I389 V390 R391P387-I389 PolarHBondContact O-N 3.42Å; P387-V390 HydrophobicContact CG-CG2 3.75Å; P387-V390 PolarHBondContact O-N 2.97Å; P387-R391 PolarHBondContact O-N 3.1Å
388T73.3Confident78.9Confident99 Ų9946.7 Ų46.761%0.60726%0.259SS*.Hα-helixtrans-46.1-40.8-173.2390000113.7V390T388-V390 PolarHBondContact O-N 3.33Å
389I71.8Confident78.7Confident119 Ų11947.5 Ų47.561%0.6127%0.265SS*.Hα-helixtrans-63.5-38.3-175.7-53.6169.5000112.5P387P387-I389 PolarHBondContact O-N 3.42Å
390V74.8Confident78.9Confident17 Ų1747.2 Ų47.210%0.10327%0.267CS..Hα-helixtrans-109.9-0.4-176.2-65.80000113.3Y386 P387 T388 S392 L393 A394Y386-V390 HydrophobicContact CD1-CG2 3.89Å; P387-V390 HydrophobicContact CG-CG2 3.75Å; P387-V390 PolarHBondContact O-N 2.97Å; T388-V390 PolarHBondContact O-N 3.33Å; V390-S392 PolarHBondContact O-N 2.96Å; V390-L393 PolarHBondContact O-N 3.42Å; V390-A394 WeakPolarHBondContact O-CB 3.09Å; V390-A394 PolarHBondContact O-N 3.37Å
391R75.8Confident79.4Confident90 Ų9045.8 Ų45.834%0.3426%0.261SS..Hα-helixtrans-56-53.6-176.3-179.8-179-64.5149.21112.9A383 Y386 P387 L393 A394 V395A383-R391 HydrophobicContact CB-CG 4.25Å; A383-R391 WeakPolarHBondContact O-CD 3.15Å; A383-R391 VanDerWaalsContact O-CG 3.32Å; A383-R391 WeakPolarHBondContact O-CG 3.37Å; A383-R391 PolarHBondContact O-NE 3.37Å; Y386-R391 PolarHBondContact O-NH2 3.27Å; P387-R391 PolarHBondContact O-N 3.1Å; R391-L393 VanDerWaalsContact C-N 3.28Å; R391-L393 PolarHBondContact O-N 3.27Å; R391-A394 PolarHBondContact O-N 3.34Å; R391-V395 WeakPolarHBondContact O-CG2 3.36Å; R391-V395 PolarHBondContact O-N 3.21Å
392S68.8Low79.5Confident101 Ų10143.6 Ų43.671%0.70625%0.252SS*.Hα-helixtrans-64.4-35.6-177.5-53.80000111.7V390 G396V390-S392 PolarHBondContact O-N 2.96Å; S392-G396 PolarHBondContact O-N 3.19Å
393L78.1Confident79.6Confident35 Ų3545.3 Ų45.318%0.18326%0.259CS..Hα-helixtrans-68.3-40.3175.9-172.767.5000112.1H261 L263 L266 V390 R391 S397H261-L393 HydrophobicContact CB-CD2 4.26Å; L263-L393 HydrophobicContact CD2-CD1 3.84Å; L263-L393 HydrophobicContact CD2-CG 4.32Å; L263-L393 HydrophobicContact CG-CD1 4.17Å; L266-L393 HydrophobicContact CD1-CD2 4.03Å; L266-L393 HydrophobicContact CD1-CG 3.82Å; L266-L393 HydrophobicContact CG-CD2 3.99Å; L266-L393 HydrophobicContact CG-CG 4.22Å; V390-L393 PolarHBondContact O-N 3.42Å; R391-L393 VanDerWaalsContact C-N 3.28Å; R391-L393 PolarHBondContact O-N 3.27Å; L393-S397 WeakPolarHBondContact O-CB 3.45Å; L393-S397 PolarHBondContact O-N 3Å; L393-S397 PolarHBondContact O-OG 2.61Å
394A79.1Confident80.1Confident1 Ų148.6 Ų48.61%0.00827%0.272CS..Hα-helixtrans-65.6-46.3176.600000112L266 T382 Y386 V390 R391 S397 G398L266-A394 HydrophobicContact CD2-CB 3.97Å; T382-A394 HydrophobicContact CG2-CB 4.21Å; Y386-A394 HydrophobicContact CD1-CB 3.62Å; Y386-A394 HydrophobicContact CD2-CB 3.57Å; Y386-A394 HydrophobicContact CE1-CB 3.76Å; Y386-A394 HydrophobicContact CE2-CB 3.72Å; Y386-A394 HydrophobicContact CG-CB 3.52Å; V390-A394 WeakPolarHBondContact O-CB 3.09Å; V390-A394 PolarHBondContact O-N 3.37Å; R391-A394 PolarHBondContact O-N 3.34Å; A394-S397 PolarHBondContact O-OG 2.93Å; A394-S397 VanDerWaalsContact O-OG 3.07Å; A394-G398 PolarHBondContact O-N 2.98Å
395V78.7Confident80.3Confident34 Ų3443.7 Ų43.721%0.20625%0.249CC..Hα-helixtrans-63.7-44.5176.2176.70000110.8T382 A383 R391 G398 S399T382-V395 HydrophobicContact CG2-CB 4.44Å; T382-V395 HydrophobicContact CG2-CG2 3.76Å; A383-V395 HydrophobicContact CB-CG2 4.21Å; R391-V395 WeakPolarHBondContact O-CG2 3.36Å; R391-V395 PolarHBondContact O-N 3.21Å; V395-G398 PolarHBondContact O-N 3.27Å; V395-S399 WeakPolarHBondContact O-CB 3.47Å; V395-S399 PolarHBondContact O-N 2.78Å
396G77.2Confident80.4Confident35 Ų3541.4 Ų41.436%0.36124%0.238SC..Hα-helixtrans-61.9-48.5178.200000113S392 S399 M400S392-G396 PolarHBondContact O-N 3.19Å; G396-S399 PolarHBondContact O-N 2.73Å; G396-M400 WeakPolarHBondContact O-CG 3.49Å; G396-M400 PolarHBondContact O-N 3.48Å
397S82.8Confident80.7Confident9 Ų942.4 Ų42.46%0.06324%0.243CC..Hα-helixtrans-64.6-41.2177.761.10000112.9W280 L393 A394 S399 M400 V401W280-S397 PolarHBondContact NE1-OG 3.3Å; L393-S397 WeakPolarHBondContact O-CB 3.45Å; L393-S397 PolarHBondContact O-N 3Å; L393-S397 PolarHBondContact O-OG 2.61Å; A394-S397 PolarHBondContact O-OG 2.93Å; A394-S397 VanDerWaalsContact O-OG 3.07Å; S397-S399 VanDerWaalsContact C-N 3.32Å; S397-S399 PolarHBondContact O-N 3.28Å; S397-M400 WeakPolarHBondContact O-CB 3.02Å; S397-M400 PolarHBondContact O-N 3.38Å; S397-V401 PolarHBondContact O-N 2.9Å; S397-V401 VanDerWaalsContact O-N 3.12Å
398G84.1Confident81.2Confident0 Ų043 Ų430%024%0.241CC..Hα-helixtrans-60.4-41173.200000112.4A394 V395 M400 V401 C402A394-G398 PolarHBondContact O-N 2.98Å; V395-G398 PolarHBondContact O-N 3.27Å; G398-M400 PolarHBondContact O-N 3Å; G398-V401 PolarHBondContact O-N 3.26Å; G398-C402 WeakPolarHBondContact O-CB 3.34Å; G398-C402 PolarHBondContact O-N 2.85Å
399S81.9Confident81.7Confident22 Ų2238.2 Ų38.215%0.15421%0.212CC..Hα-helixtrans-63.9-38175.2-168.50000112.7V395 G396 S397 C402 R403V395-S399 WeakPolarHBondContact O-CB 3.47Å; V395-S399 PolarHBondContact O-N 2.78Å; G396-S399 PolarHBondContact O-N 2.73Å; S397-S399 VanDerWaalsContact C-N 3.32Å; S397-S399 PolarHBondContact O-N 3.28Å; S399-C402 VanDerWaalsContact O-CB 3.28Å; S399-C402 WeakPolarHBondContact O-CB 3.44Å; S399-C402 PolarHBondContact O-N 2.04Å; S399-R403 WeakPolarHBondContact O-CG 3.49Å; S399-R403 PolarHBondContact O-N 3.42Å
400M83.8Confident82.1Confident67 Ų6732.9 Ų32.933%0.3319%0.186SC..Hα-helixtrans-61.5-45.6173.8-67.7-64.4113.200111.7L83 V87 G396 S397 G398 C402 R403 L404L83-M400 HydrophobicContact CD1-CE 4.28Å; L83-M400 HydrophobicContact CD1-SD 3.63Å; V87-M400 HydrophobicContact CG2-CE 3.61Å; V87-M400 HydrophobicContact CG2-SD 3.72Å; G396-M400 WeakPolarHBondContact O-CG 3.49Å; G396-M400 PolarHBondContact O-N 3.48Å; S397-M400 WeakPolarHBondContact O-CB 3.02Å; S397-M400 PolarHBondContact O-N 3.38Å; G398-M400 PolarHBondContact O-N 3Å; M400-C402 VanDerWaalsContact C-N 3.31Å; M400-C402 PolarHBondContact O-N 2.83Å; M400-R403 PolarHBondContact O-N 2.8Å; M400-R403 VanDerWaalsContact O-N 3.15Å; M400-L404 PolarHBondContact O-N 3.01Å; M400-L404 VanDerWaalsContact O-N 3.08Å
401V88Confident82.3Confident25 Ų2536.5 Ų36.515%0.15220%0.2CC..Hα-helixtrans-62.4-39.9176175.80000111.4W280 F284 S397 G398 R403 L404 A405W280-V401 HydrophobicContact CB-CG1 4.35Å; W280-V401 HydrophobicContact CB-CG2 4.33Å; W280-V401 HydrophobicContact CD2-CG2 3.81Å; W280-V401 HydrophobicContact CE3-CG2 4.02Å; W280-V401 HydrophobicContact CG-CG2 3.96Å; F284-V401 HydrophobicContact CB-CG1 3.87Å; F284-V401 HydrophobicContact CD2-CG1 4.11Å; F284-V401 HydrophobicContact CG-CG1 4.5Å; S397-V401 PolarHBondContact O-N 2.9Å; S397-V401 VanDerWaalsContact O-N 3.12Å; G398-V401 PolarHBondContact O-N 3.26Å; V401-R403 VanDerWaalsContact C-N 3.32Å; V401-R403 PolarHBondContact O-N 2.86Å; V401-L404 WeakPolarHBondContact O-CB 3.42Å; V401-L404 PolarHBondContact O-N 3.14Å; V401-A405 PolarHBondContact O-N 2.88Å
402C86.8Confident82.1Confident1 Ų134.7 Ų34.71%0.00720%0.201CC..Hα-helixtrans-56.9-43172.8165.50000112.3W283 S287 F375 G398 S399 M400 A405 S406W283-C402 HydrophobicContact CB-CB 4.33Å; W283-C402 HydrophobicContact CD2-CB 4.42Å; W283-C402 HydrophobicContact CE3-CB 3.62Å; W283-C402 HydrophobicContact CZ3-CB 4.28Å; S287-C402 WeakPolarHBondContact CB-O 3.48Å; S287-C402 WeakPolarHBondContact CB-SG 3.35Å; S287-C402 PolarHBondContact OG-O 3.42Å; S287-C402 PolarHBondContact OG-SG 3.08Å; S287-C402 VanDerWaalsContact OG-SG 3.42Å; F375-C402 VanDerWaalsContact CE2-SG 3.57Å; G398-C402 WeakPolarHBondContact O-CB 3.34Å; G398-C402 PolarHBondContact O-N 2.85Å; S399-C402 VanDerWaalsContact O-CB 3.28Å; S399-C402 WeakPolarHBondContact O-CB 3.44Å; S399-C402 PolarHBondContact O-N 2.04Å; M400-C402 VanDerWaalsContact C-N 3.31Å; M400-C402 PolarHBondContact O-N 2.83Å; C402-A405 WeakPolarHBondContact O-CB 3.35Å; C402-A405 PolarHBondContact O-N 2.9Å; C402-S406 PolarHBondContact O-N 3.1Å; C402-S406 VanDerWaalsContact O-N 3.08Å; C402-S406 PolarHBondContact O-OG 2.96Å
403R84.3Confident82.2Confident37 Ų3730.7 Ų30.714%0.1417%0.172CC..Hα-helixtrans-68.7-36178.2-66.5-61.8-177.5-170.80.7112.5V82 L83 S399 M400 V401 A405 S406 I407V82-R403 VanDerWaalsContact CG1-NH1 3.27Å; L83-R403 HydrophobicContact CB-CB 4.18Å; L83-R403 HydrophobicContact CD1-CB 3.63Å; L83-R403 HydrophobicContact CD1-CG 4.07Å; L83-R403 HydrophobicContact CG-CB 4.43Å; S399-R403 WeakPolarHBondContact O-CG 3.49Å; S399-R403 PolarHBondContact O-N 3.42Å; M400-R403 PolarHBondContact O-N 2.8Å; M400-R403 VanDerWaalsContact O-N 3.15Å; V401-R403 VanDerWaalsContact C-N 3.32Å; V401-R403 PolarHBondContact O-N 2.86Å; R403-A405 VanDerWaalsContact C-N 3.32Å; R403-A405 PolarHBondContact O-N 3.13Å; R403-S406 WeakPolarHBondContact O-CB 3.37Å; R403-S406 PolarHBondContact O-N 3.29Å; R403-I407 WeakPolarHBondContact O-CG1 3.5Å; R403-I407 PolarHBondContact O-N 2.99Å; R403-I407 VanDerWaalsContact O-N 3.1Å
404L87.6Confident81.6Confident94 Ų9431.7 Ų31.749%0.49218%0.178SC..Hα-helixtrans-59.6-43.9171.4-68.1173.9000111.3M400 V401 S406 I407 L408M400-L404 PolarHBondContact O-N 3.01Å; M400-L404 VanDerWaalsContact O-N 3.08Å; V401-L404 WeakPolarHBondContact O-CB 3.42Å; V401-L404 PolarHBondContact O-N 3.14Å; L404-S406 VanDerWaalsContact C-N 3.31Å; L404-S406 PolarHBondContact O-N 2.82Å; L404-I407 PolarHBondContact O-N 2.85Å; L404-L408 WeakPolarHBondContact O-CG 3.44Å; L404-L408 PolarHBondContact O-N 2.88Å; L404-L408 VanDerWaalsContact O-N 3.14Å
405A87.7Confident80.8Confident0 Ų035.8 Ų35.80%020%0.199CC..Hα-helixtrans-61-38.4174.600000112.6F284 L288 V401 C402 R403 I407 L408 A409F284-A405 HydrophobicContact CD2-CB 3.58Å; F284-A405 HydrophobicContact CE2-CB 3.78Å; F284-A405 HydrophobicContact CG-CB 3.98Å; F284-A405 HydrophobicContact CZ-CB 4.34Å; F284-A405 VanDerWaalsContact O-CB 3.24Å; F284-A405 WeakPolarHBondContact O-CB 3.44Å; L288-A405 HydrophobicContact CB-CB 4.24Å; V401-A405 PolarHBondContact O-N 2.88Å; C402-A405 WeakPolarHBondContact O-CB 3.35Å; C402-A405 PolarHBondContact O-N 2.9Å; R403-A405 VanDerWaalsContact C-N 3.32Å; R403-A405 PolarHBondContact O-N 3.13Å; A405-I407 VanDerWaalsContact C-N 3.31Å; A405-I407 PolarHBondContact O-N 2.93Å; A405-L408 PolarHBondContact O-N 3.19Å; A405-A409 PolarHBondContact O-N 2.64Å
406S86.3Confident79.7Confident1 Ų137.7 Ų37.71%0.00721%0.214CC..Hα-helixtrans-64.6-33.8176.3-43.70000112.8S287 Y291 C402 R403 L404 L408 P410S287-S406 PolarHBondContact OG-OG 3.41Å; Y291-S406 WeakPolarHBondContact CD2-OG 3.46Å; Y291-S406 WeakPolarHBondContact CE2-OG 3.44Å; C402-S406 PolarHBondContact O-N 3.1Å; C402-S406 VanDerWaalsContact O-N 3.08Å; C402-S406 PolarHBondContact O-OG 2.96Å; R403-S406 WeakPolarHBondContact O-CB 3.37Å; R403-S406 PolarHBondContact O-N 3.29Å; L404-S406 VanDerWaalsContact C-N 3.31Å; L404-S406 PolarHBondContact O-N 2.82Å; S406-L408 VanDerWaalsContact C-N 3.35Å; S406-P410 VanDerWaalsContact O-CD 3.24Å; S406-P410 WeakPolarHBondContact O-CD 3.33Å
407I87.7Confident78.6Confident28 Ų2838.6 Ų38.614%0.14422%0.215CC..Hα-helixtrans-69.4-35.7174.9-65165.2000110.8P76 M79 F80 L83 R403 L404 A405 P410 F411P76-I407 HydrophobicContact CB-CG2 4.38Å; M79-I407 HydrophobicContact CB-CB 4.31Å; M79-I407 HydrophobicContact CB-CG1 3.61Å; F80-I407 HydrophobicContact CB-CD1 4.29Å; F80-I407 HydrophobicContact CD2-CD1 4.25Å; L83-I407 HydrophobicContact CB-CD1 4.45Å; L83-I407 HydrophobicContact CD2-CD1 4.09Å; R403-I407 WeakPolarHBondContact O-CG1 3.5Å; R403-I407 PolarHBondContact O-N 2.99Å; R403-I407 VanDerWaalsContact O-N 3.1Å; L404-I407 PolarHBondContact O-N 2.85Å; A405-I407 VanDerWaalsContact C-N 3.31Å; A405-I407 PolarHBondContact O-N 2.93Å; I407-P410 WeakPolarHBondContact O-CD 2.97Å; I407-F411 WeakPolarHBondContact O-CD2 3.31Å
408L86.6Confident77.1Confident87 Ų8743.7 Ų43.746%0.45524%0.24SC..Hα-helixtrans-79.6-24.5179.3-66175000113.6F284 L404 A405 S406 F411 S412F284-L408 HydrophobicContact CE2-CD1 4.01Å; F284-L408 HydrophobicContact CZ-CD1 4Å; L404-L408 WeakPolarHBondContact O-CG 3.44Å; L404-L408 PolarHBondContact O-N 2.88Å; L404-L408 VanDerWaalsContact O-N 3.14Å; A405-L408 PolarHBondContact O-N 3.19Å; S406-L408 VanDerWaalsContact C-N 3.35Å; L408-F411 PolarHBondContact O-N 3.06Å; L408-S412 PolarHBondContact O-N 2.97Å; L408-S412 VanDerWaalsContact O-N 3.11Å
409A84.5Confident75.4Confident0 Ų051.3 Ų51.30%027%0.269CS..Hα-helixtrans-57.1-46.7-175.900000114.6L288 L295 A405 F411 S412 V413L288-A409 HydrophobicContact CD1-CB 3.85Å; L295-A409 HydrophobicContact CD1-CB 4.49Å; A405-A409 PolarHBondContact O-N 2.64Å; A409-F411 VanDerWaalsContact C-N 3.32Å; A409-F411 PolarHBondContact O-N 2.84Å; A409-S412 WeakPolarHBondContact O-CB 3.32Å; A409-S412 PolarHBondContact O-N 3.41Å; A409-S412 VanDerWaalsContact O-N 3.08Å; A409-S412 PolarHBondContact O-OG 2.81Å; A409-V413 PolarHBondContact O-N 3.45Å
410P79.7Confident74Confident7 Ų754.7 Ų54.75%0.04528%0.284CS..Hα-helixtrans-59.9-42.7177.8-19.330.3000112.3Q75 P76 L295 S406 I407 S412 V413 D414Q75-P410 HydrophobicContact CB-CB 4Å; Q75-P410 HydrophobicContact CB-CG 3.93Å; Q75-P410 HydrophobicContact CG-CB 3.87Å; Q75-P410 HydrophobicContact CG-CG 3.37Å; P76-P410 HydrophobicContact CG-CB 4.26Å; P76-P410 HydrophobicContact CG-CG 4.4Å; L295-P410 HydrophobicContact CD1-CB 4Å; L295-P410 HydrophobicContact CD1-CG 3.75Å; S406-P410 VanDerWaalsContact O-CD 3.24Å; S406-P410 WeakPolarHBondContact O-CD 3.33Å; I407-P410 WeakPolarHBondContact O-CD 2.97Å; P410-S412 VanDerWaalsContact C-N 3.25Å; P410-S412 PolarHBondContact O-N 3.34Å; P410-V413 PolarHBondContact O-N 3.48Å; P410-D414 PolarHBondContact O-N 2.7Å
411F78.7Confident72.1Confident93 Ų9358.4 Ų58.441%0.40830%0.299SS..Hα-helixtrans-60.5-36.5176-65.4-67.9000111.9P76 I407 L408 A409 D414 L415P76-F411 HydrophobicContact CB-CD2 4.34Å; P76-F411 HydrophobicContact CB-CE2 3.43Å; P76-F411 VanDerWaalsContact CB-CE2 3.43Å; P76-F411 HydrophobicContact CB-CZ 3.6Å; P76-F411 HydrophobicContact CG-CD1 4.42Å; P76-F411 HydrophobicContact CG-CD2 3.94Å; P76-F411 HydrophobicContact CG-CE1 3.87Å; P76-F411 HydrophobicContact CG-CE2 3.34Å; P76-F411 HydrophobicContact CG-CG 4.45Å; P76-F411 HydrophobicContact CG-CZ 3.31Å; I407-F411 WeakPolarHBondContact O-CD2 3.31Å; L408-F411 PolarHBondContact O-N 3.06Å; A409-F411 VanDerWaalsContact C-N 3.32Å; A409-F411 PolarHBondContact O-N 2.84Å; F411-D414 PolarHBondContact O-N 2.94Å; F411-L415 VanDerWaalsContact O-CB 3.27Å; F411-L415 WeakPolarHBondContact O-CB 3.19Å; F411-L415 PolarHBondContact O-N 3.3Å
412S72.9Confident70.3Confident51 Ų5160.7 Ų60.736%0.35731%0.309SS..Hα-helixtrans-66.6-36.3178.774.60000113.3L408 A409 P410 S416L408-S412 PolarHBondContact O-N 2.97Å; L408-S412 VanDerWaalsContact O-N 3.11Å; A409-S412 WeakPolarHBondContact O-CB 3.32Å; A409-S412 PolarHBondContact O-N 3.41Å; A409-S412 VanDerWaalsContact O-N 3.08Å; A409-S412 PolarHBondContact O-OG 2.81Å; P410-S412 VanDerWaalsContact C-N 3.25Å; P410-S412 PolarHBondContact O-N 3.34Å; S412-S416 PolarHBondContact O-N 3Å
413V69.4Low68.3Low18 Ų1864.3 Ų64.311%0.10933%0.333CS..Hα-helixtrans-72.9-40.5175.7178.30000110.2L295 A409 P410 S416L295-V413 HydrophobicContact CB-CG2 4.22Å; A409-V413 PolarHBondContact O-N 3.45Å; P410-V413 PolarHBondContact O-N 3.48Å; V413-S416 WeakPolarHBondContact O-CB 3.47Å; V413-S416 PolarHBondContact O-N 2.83Å; V413-S416 PolarHBondContact O-OG 2.8Å
414D65.6Low66.3Low55 Ų5567.5 Ų67.529%0.29435%0.349SS..Hα-helixtrans-69.8-34.2177-74.1-32.7000112.3M72 P410 F411 S416 S417M72-D414 HydrophobicContact CE-CB 4.22Å; P410-D414 PolarHBondContact O-N 2.7Å; F411-D414 PolarHBondContact O-N 2.94Å; D414-S416 PolarHBondContact O-N 3.46Å; D414-S417 WeakPolarHBondContact O-CB 3.41Å; D414-S417 PolarHBondContact O-N 3.39Å; D414-S417 PolarHBondContact O-OG 3.09Å
415L62.2Low63.9Low88 Ų8868.4 Ų68.446%0.46135%0.354SS..Hα-helixtrans-62.3-28.1175.5-14676.8000111.4F411 S417 I418 W419F411-L415 VanDerWaalsContact O-CB 3.27Å; F411-L415 WeakPolarHBondContact O-CB 3.19Å; F411-L415 PolarHBondContact O-N 3.3Å; L415-S417 PolarHBondContact O-N 3.03Å; L415-I418 CarbonylContact O-C 3.31Å; L415-I418 PolarHBondContact O-N 2.7Å; L415-W419 WeakPolarHBondContact O-CB 3.42Å; L415-W419 PolarHBondContact O-N 2.67Å
416S56.1Low61.6Low74 Ų7473.9 Ų73.952%0.51738%0.383SS..THydrogen-bonded Turntrans-65.1-23174.785.80000112.7S412 V413 D414 I418S412-S416 PolarHBondContact O-N 3Å; V413-S416 WeakPolarHBondContact O-CB 3.47Å; V413-S416 PolarHBondContact O-N 2.83Å; V413-S416 PolarHBondContact O-OG 2.8Å; D414-S416 PolarHBondContact O-N 3.46Å; S416-I418 VanDerWaalsContact C-N 3.29Å
417S53.6Low59.2Low54 Ų5475.6 Ų75.638%0.37840%0.401SS..THydrogen-bonded Turntrans-75.3-17.7172.176.40000113.4D414 L415 I420D414-S417 WeakPolarHBondContact O-CB 3.41Å; D414-S417 PolarHBondContact O-N 3.39Å; D414-S417 PolarHBondContact O-OG 3.09Å; L415-S417 PolarHBondContact O-N 3.03Å; S417-I420 VanDerWaalsContact O-CD1 3.24Å; S417-I420 WeakPolarHBondContact O-CD1 3.25Å
418I52Low56.6Low116 Ų11681.7 Ų81.760%0.59543%0.428SS*.THydrogen-bonded Turntrans-99.5-35.9176.9-57172.7000110L415 S416 I420L415-I418 CarbonylContact O-C 3.31Å; L415-I418 PolarHBondContact O-N 2.7Å; S416-I418 VanDerWaalsContact C-N 3.29Å; I418-I420 PolarHBondContact O-N 2.74Å; I418-I420 VanDerWaalsContact O-N 3.13Å
419W49.1Very low54.1Low160 Ų16085.7 Ų85.761%0.60644%0.444SS*.  trans-85.744.9177.7-82.761.3000112.8L415 F421 I422L415-W419 WeakPolarHBondContact O-CB 3.42Å; L415-W419 PolarHBondContact O-N 2.67Å; W419-F421 PolarHBondContact O-N 3.25Å; W419-I422 HydrophobicContact CE3-CD1 4.22Å; W419-I422 HydrophobicContact CZ3-CD1 4.41Å
420I51.7Low51.7Low92 Ų9293 Ų9347%0.47248%0.483SS..THydrogen-bonded Turntrans-60.3-11.1173-67.7165.6000112.2S417 I418 I422 P423 Q424S417-I420 VanDerWaalsContact O-CD1 3.24Å; S417-I420 WeakPolarHBondContact O-CD1 3.25Å; I418-I420 PolarHBondContact O-N 2.74Å; I418-I420 VanDerWaalsContact O-N 3.13Å; I420-I422 PolarHBondContact O-N 3.19Å; I420-P423 WeakPolarHBondContact O-CD 3.43Å; I420-Q424 HydrophobicContact CG2-CG 4.44Å
421F44.2Very low49.3Very low145 Ų145101.3 Ų101.364%0.63652%0.521SS*.Hα-helixtrans-71.6-25.7-174.3-95.9-85.6000115.8W419 Q424 L425W419-F421 PolarHBondContact O-N 3.25Å; F421-Q424 PolarHBondContact O-N 3.12Å; F421-L425 WeakPolarHBondContact O-CB 3.18Å; F421-L425 WeakPolarHBondContact O-CD1 3.37Å; F421-L425 WeakPolarHBondContact O-CG 3.22Å; F421-L425 PolarHBondContact O-N 2.97Å
422I49.2Very low47.1Very low73 Ų73109.1 Ų109.137%0.37456%0.559SS.*Hα-helixtrans-71.8-45.3-179.5-68.4-176.7000112.6W419 I420 Q424 L425 L426W419-I422 HydrophobicContact CE3-CD1 4.22Å; W419-I422 HydrophobicContact CZ3-CD1 4.41Å; I420-I422 PolarHBondContact O-N 3.19Å; I422-Q424 PolarHBondContact O-N 2.75Å; I422-L425 PolarHBondContact O-N 3.22Å; I422-L426 HydrophobicContact CG2-CD1 4.08Å; I422-L426 PolarHBondContact O-N 2.72Å
423P45.8Very low45.8Very low77 Ų77112.1 Ų112.150%0.557%0.569SS.*Hα-helixtrans-61.7-30.8172.5-23.932.4000113.6I420 G427I420-P423 WeakPolarHBondContact O-CD 3.43Å; P423-G427 WeakPolarHBondContact O-CA 3.36Å; P423-G427 PolarHBondContact O-N 2.9Å
424Q42.1Very low44.5Very low104 Ų104117 Ų11749%0.48659%0.593SS.*Hα-helixtrans-74.3-37.3176.7-71.5177.9-28.200112.4I420 F421 I422 L426 G427 Q428I420-Q424 HydrophobicContact CG2-CG 4.44Å; F421-Q424 PolarHBondContact O-N 3.12Å; I422-Q424 PolarHBondContact O-N 2.75Å; Q424-L426 VanDerWaalsContact C-N 3.34Å; Q424-G427 PolarHBondContact O-N 3.21Å; Q424-Q428 PolarHBondContact O-N 2.76Å
425L37.3Very low43.3Very low114 Ų114120.4 Ų120.460%0.59761%0.61SS**Hα-helixtrans-64.5-35.8172.1-86.7157.9000112.5F421 I422F421-L425 WeakPolarHBondContact O-CB 3.18Å; F421-L425 WeakPolarHBondContact O-CD1 3.37Å; F421-L425 WeakPolarHBondContact O-CG 3.22Å; F421-L425 PolarHBondContact O-N 2.97Å; I422-L425 PolarHBondContact O-N 3.22Å
426L38.4Very low42.2Very low115 Ų115122.4 Ų122.460%0.60262%0.619SS**Hα-helixtrans-80.9-32174.8-77.9159.8000112.7I422 Q424I422-L426 HydrophobicContact CG2-CD1 4.08Å; I422-L426 PolarHBondContact O-N 2.72Å; Q424-L426 VanDerWaalsContact C-N 3.34Å
427G37.7Very low41.4Very low37 Ų37125.4 Ų125.438%0.38163%0.625SS.*Hα-helixtrans-74.6-24.4178.700000114.4P423 Q424 H429 L430P423-G427 WeakPolarHBondContact O-CA 3.36Å; P423-G427 PolarHBondContact O-N 2.9Å; Q424-G427 PolarHBondContact O-N 3.21Å; G427-H429 VanDerWaalsContact C-N 3.25Å; G427-H429 PolarHBondContact O-N 3.16Å; G427-L430 PolarHBondContact O-N 3.14Å
428Q33.1Very low40.6Very low155 Ų155130.1 Ų130.172%0.72464%0.642SS**THydrogen-bonded Turntrans-72.6-13174.6-86.7-171.8-29.600114Q424Q424-Q428 PolarHBondContact O-N 2.76Å
429H33.8Very low39.7Very low171 Ų171131.1 Ų131.179%0.79265%0.645SS**THydrogen-bonded Turntrans-96.63.6175.6-98.2-38000114.8G427G427-H429 VanDerWaalsContact C-N 3.25Å; G427-H429 PolarHBondContact O-N 3.16Å
430L32.6Very low39Very low154 Ų154128.9 Ų128.981%0.80665%0.648SS**SBendtrans-114.917177.4-84.1161.5000113.3G427G427-L430 PolarHBondContact O-N 3.14Å
431Q30.5Very low38Very low182 Ų182132 Ų13285%0.8566%0.663SS**  trans-130.722.6177.8-103-173.5-23.100115
432E31.2Very low37.4Very low257 Ų257130.8 Ų130.8100%1.20167%0.665SS**  trans-108.40158.3-75.1-170.5162.900111.2

Retrieved 432 of 432 residues in 130.9 ms (Link to these results)

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