A0A077Z5I5_TRITR Loading...

TWiK family of potassium channels protein 7

AlphaFold DB , UniProt , Accession A0A077Z5I5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 784 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
1M68.7Low81.9Confident212 Ų212138.3 Ų138.3100%1.04466%0.66SS**  0-53.90-85.7-164.3-174.900114.1T3 A4 R5M1-T3 VanDerWaalsContact C-N 3.3Å; M1-T3 PolarHBondContact O-N 3.34Å; M1-A4 PolarHBondContact O-N 3.41Å; M1-A4 VanDerWaalsContact O-N 3.14Å; M1-R5 PolarHBondContact O-N 3.47Å
2L80.5Confident82Confident143 Ų143134.7 Ų134.775%0.74965%0.646SS**Hα-helixtrans-55.5-40.2-177.6-79.2162.3000114R5 R6L2-R5 PolarHBondContact O-N 3.46Å; L2-R6 PolarHBondContact O-N 3.03Å
3T83.2Confident81.8Confident101 Ų101130.2 Ų130.262%0.6263%0.632SS**Hα-helixtrans-63.3-44.11764.10000112.6M1 R5 R6 M7M1-T3 VanDerWaalsContact C-N 3.3Å; M1-T3 PolarHBondContact O-N 3.34Å; T3-R5 VanDerWaalsContact C-N 3.34Å; T3-R5 PolarHBondContact O-N 3.33Å; T3-R6 PolarHBondContact O-N 3.22Å; T3-M7 PolarHBondContact O-N 3.41Å
4A81.7Confident82Confident64 Ų64132.5 Ų132.553%0.52963%0.633SS.*Hα-helixtrans-63.9-39.7176.700000111.7M1 M7 R8M1-A4 PolarHBondContact O-N 3.41Å; M1-A4 VanDerWaalsContact O-N 3.14Å; A4-M7 PolarHBondContact O-N 2.98Å; A4-R8 WeakPolarHBondContact O-CB 3.43Å; A4-R8 PolarHBondContact O-N 3.04Å
5R84.5Confident82Confident173 Ų173132 Ų13265%0.65363%0.629SS**Hα-helixtrans-62.7-45.7174.8-170.6177177.2163.65.3111.8M1 L2 T3 M7 R8 E9M1-R5 PolarHBondContact O-N 3.47Å; L2-R5 PolarHBondContact O-N 3.46Å; T3-R5 VanDerWaalsContact C-N 3.34Å; T3-R5 PolarHBondContact O-N 3.33Å; R5-M7 PolarHBondContact O-N 3.08Å; R5-R8 PolarHBondContact O-N 3.49Å; R5-E9 IonicContact NE-OE1 2.66Å; R5-E9 PolarHBondContact NE-OE1 3.48Å; R5-E9 WeakPolarHBondContact O-CG 3.46Å; R5-E9 PolarHBondContact O-N 3.18Å
6R83.3Confident81.9Confident181 Ų181128.9 Ų128.968%0.68363%0.625SS**Hα-helixtrans-61.9-40.7175.1-82.9-173.8-174.4170.92.6113L2 T3 K10L2-R6 PolarHBondContact O-N 3.03Å; T3-R6 PolarHBondContact O-N 3.22Å; R6-K10 WeakPolarHBondContact O-CB 3.4Å; R6-K10 WeakPolarHBondContact O-CG 3.47Å; R6-K10 PolarHBondContact O-N 3.22Å
7M83Confident82.1Confident133 Ų133127.4 Ų127.466%0.65562%0.621SS**Hα-helixtrans-65-41.5176.4-81.1-162.5-107.900111.8T3 A4 R5 K10 S11T3-M7 PolarHBondContact O-N 3.41Å; A4-M7 PolarHBondContact O-N 2.98Å; R5-M7 PolarHBondContact O-N 3.08Å; M7-K10 PolarHBondContact O-N 3.16Å; M7-S11 WeakPolarHBondContact O-CB 3.43Å; M7-S11 PolarHBondContact O-N 2.87Å
8R83.8Confident82.2Confident193 Ų193123.1 Ų123.173%0.72860%0.603SS**Hα-helixtrans-65.1-43176.9-145.1179.2-160-176.85.4111.8A4 R5 S11 I12A4-R8 WeakPolarHBondContact O-CB 3.43Å; A4-R8 PolarHBondContact O-N 3.04Å; R5-R8 PolarHBondContact O-N 3.49Å; R8-S11 PolarHBondContact O-N 2.95Å; R8-I12 HydrophobicContact CG-CD1 4.4Å; R8-I12 WeakPolarHBondContact O-CB 3.29Å; R8-I12 WeakPolarHBondContact O-CD1 2.91Å; R8-I12 VanDerWaalsContact O-CG1 3.24Å; R8-I12 WeakPolarHBondContact O-CG1 2.98Å; R8-I12 PolarHBondContact O-N 3.13Å
9E84.2Confident82.2Confident101 Ų101122.2 Ų122.247%0.47260%0.601SS.*Hα-helixtrans-59.9-44.7173.8-77.3170.2-170.800111.2R5 I12 T13R5-E9 IonicContact NE-OE1 2.66Å; R5-E9 PolarHBondContact NE-OE1 3.48Å; R5-E9 WeakPolarHBondContact O-CG 3.46Å; R5-E9 PolarHBondContact O-N 3.18Å; E9-I12 PolarHBondContact O-N 3.19Å; E9-T13 PolarHBondContact O-N 2.8Å; E9-T13 PolarHBondContact O-OG1 3.47Å; E9-T13 VanDerWaalsContact O-OG1 3.07Å
10K84.2Confident82.1Confident155 Ų155117 Ų11767%0.67458%0.579SS**Hα-helixtrans-63.3-41.3175.7-78.4-173176.4-170.80113.6R6 M7 T13 Y14R6-K10 WeakPolarHBondContact O-CB 3.4Å; R6-K10 WeakPolarHBondContact O-CG 3.47Å; R6-K10 PolarHBondContact O-N 3.22Å; M7-K10 PolarHBondContact O-N 3.16Å; K10-T13 VanDerWaalsContact C-OG1 3.28Å; K10-T13 VanDerWaalsContact CA-OG1 3.25Å; K10-T13 WeakPolarHBondContact CA-OG1 3.13Å; K10-T13 PolarHBondContact O-N 2.96Å; K10-T13 PolarHBondContact O-OG1 3.45Å; K10-Y14 WeakPolarHBondContact O-CB 3.4Å; K10-Y14 PolarHBondContact O-N 2.89Å
11S84.2Confident82.2Confident65 Ų65116.5 Ų116.546%0.45558%0.576SS.*Hα-helixtrans-64.2-44.8177.8-170.30000111.4M7 R8 T13 Y14 E15M7-S11 WeakPolarHBondContact O-CB 3.43Å; M7-S11 PolarHBondContact O-N 2.87Å; R8-S11 PolarHBondContact O-N 2.95Å; S11-T13 VanDerWaalsContact C-N 3.35Å; S11-T13 PolarHBondContact O-N 3.03Å; S11-Y14 PolarHBondContact O-N 3.18Å; S11-E15 PolarHBondContact O-N 3.34Å
12I82.2Confident82.9Confident95 Ų95113.8 Ų113.849%0.48756%0.558SS.*Hα-helixtrans-63.9-41.6177.7-67.7165.3000110.4R8 E9 Y14 C16R8-I12 HydrophobicContact CG-CD1 4.4Å; R8-I12 WeakPolarHBondContact O-CB 3.29Å; R8-I12 WeakPolarHBondContact O-CD1 2.91Å; R8-I12 VanDerWaalsContact O-CG1 3.24Å; R8-I12 WeakPolarHBondContact O-CG1 2.98Å; R8-I12 PolarHBondContact O-N 3.13Å; E9-I12 PolarHBondContact O-N 3.19Å; I12-Y14 VanDerWaalsContact C-N 3.34Å; I12-Y14 PolarHBondContact O-N 2.87Å; I12-C16 WeakPolarHBondContact O-CB 3.46Å; I12-C16 PolarHBondContact O-N 3.47Å
13T80.3Confident82.8Confident77 Ų77112.8 Ų112.847%0.47255%0.549SS..Hα-helixtrans-62.3-41.1175.145.60000112E9 K10 S11 C16 D17E9-T13 PolarHBondContact O-N 2.8Å; E9-T13 PolarHBondContact O-OG1 3.47Å; E9-T13 VanDerWaalsContact O-OG1 3.07Å; K10-T13 VanDerWaalsContact C-OG1 3.28Å; K10-T13 VanDerWaalsContact CA-OG1 3.25Å; K10-T13 WeakPolarHBondContact CA-OG1 3.13Å; K10-T13 PolarHBondContact O-N 2.96Å; K10-T13 PolarHBondContact O-OG1 3.45Å; S11-T13 VanDerWaalsContact C-N 3.35Å; S11-T13 PolarHBondContact O-N 3.03Å; T13-C16 PolarHBondContact O-N 3.31Å; T13-D17 WeakPolarHBondContact O-CB 3.27Å; T13-D17 VanDerWaalsContact O-CG 3.23Å; T13-D17 PolarHBondContact O-N 3.26Å
14Y84.1Confident82.8Confident162 Ų162114.9 Ų114.964%0.63555%0.546SS*.Hα-helixtrans-67.1-42.4179.4-176.6-98.4000113.1K10 S11 I12 D17 T18K10-Y14 WeakPolarHBondContact O-CB 3.4Å; K10-Y14 PolarHBondContact O-N 2.89Å; S11-Y14 PolarHBondContact O-N 3.18Å; I12-Y14 VanDerWaalsContact C-N 3.34Å; I12-Y14 PolarHBondContact O-N 2.87Å; Y14-D17 PolarHBondContact O-N 2.82Å; Y14-T18 HydrophobicContact CD1-CG2 4.37Å; Y14-T18 HydrophobicContact CE1-CG2 3.91Å; Y14-T18 HydrophobicContact CE2-CG2 4.29Å; Y14-T18 WeakPolarHBondContact O-CG2 3.32Å; Y14-T18 PolarHBondContact O-N 3.15Å; Y14-T18 PolarHBondContact O-OG1 3.33Å
15E82.4Confident82.9Confident125 Ų125115.8 Ų115.858%0.58454%0.542SS*.Hα-helixtrans-64.4-40.9173.7-80.6-177.6162.900112.1S11 D17 T18 L19S11-E15 PolarHBondContact O-N 3.34Å; E15-D17 PolarHBondContact O-N 3.21Å; E15-T18 WeakPolarHBondContact CA-OG1 3.38Å; E15-T18 PolarHBondContact O-OG1 2.91Å; E15-T18 VanDerWaalsContact O-OG1 3.05Å; E15-L19 VanDerWaalsContact O-CB 3.29Å; E15-L19 WeakPolarHBondContact O-CB 3.45Å; E15-L19 PolarHBondContact O-N 2.93Å
16C80.7Confident82.6Confident82 Ų82114.4 Ų114.455%0.55454%0.543SS*.Hα-helixtrans-61.6-42.1173.7-86.20000112.2I12 T13 G20I12-C16 WeakPolarHBondContact O-CB 3.46Å; I12-C16 PolarHBondContact O-N 3.47Å; T13-C16 PolarHBondContact O-N 3.31Å; C16-G20 PolarHBondContact O-N 2.99Å
17D83.8Confident82.5Confident104 Ų104111.1 Ų111.156%0.55654%0.538SS*.Hα-helixtrans-67.3-44.6-179.5-73.5-22.5000111.7T13 Y14 E15 G20 E21T13-D17 WeakPolarHBondContact O-CB 3.27Å; T13-D17 VanDerWaalsContact O-CG 3.23Å; T13-D17 PolarHBondContact O-N 3.26Å; Y14-D17 PolarHBondContact O-N 2.82Å; E15-D17 PolarHBondContact O-N 3.21Å; D17-G20 PolarHBondContact O-N 3.27Å; D17-E21 WeakPolarHBondContact O-CB 3.35Å; D17-E21 PolarHBondContact O-N 2.82Å
18T84.5Confident82.3Confident50 Ų50111.3 Ų111.331%0.30754%0.535SS..Hα-helixtrans-67.3-39.4178.148.40000112.7Y14 E15 E21 K22Y14-T18 HydrophobicContact CD1-CG2 4.37Å; Y14-T18 HydrophobicContact CE1-CG2 3.91Å; Y14-T18 HydrophobicContact CE2-CG2 4.29Å; Y14-T18 WeakPolarHBondContact O-CG2 3.32Å; Y14-T18 PolarHBondContact O-N 3.15Å; Y14-T18 PolarHBondContact O-OG1 3.33Å; E15-T18 WeakPolarHBondContact CA-OG1 3.38Å; E15-T18 PolarHBondContact O-OG1 2.91Å; E15-T18 VanDerWaalsContact O-OG1 3.05Å; T18-E21 PolarHBondContact O-N 3.49Å; T18-K22 PolarHBondContact O-N 3.4Å; T18-K22 VanDerWaalsContact O-N 3.07Å
19L82.6Confident82.1Confident106 Ų106106.5 Ų106.556%0.55553%0.527SS*.Hα-helixtrans-65.8-42.7173.6-168.472.3000111E15 E21 K22 Q23E15-L19 VanDerWaalsContact O-CB 3.29Å; E15-L19 WeakPolarHBondContact O-CB 3.45Å; E15-L19 PolarHBondContact O-N 2.93Å; L19-E21 VanDerWaalsContact C-N 3.3Å; L19-E21 PolarHBondContact O-N 3.24Å; L19-K22 PolarHBondContact O-N 3.25Å; L19-Q23 WeakPolarHBondContact O-CG 3.22Å; L19-Q23 PolarHBondContact O-N 3.34Å
20G80.9Confident81.6Confident17 Ų17104.2 Ų104.218%0.17553%0.526CS..Hα-helixtrans-61.8-35.7175.100000112.9C16 D17 R24C16-G20 PolarHBondContact O-N 2.99Å; D17-G20 PolarHBondContact O-N 3.27Å; G20-R24 WeakPolarHBondContact O-CG 2.8Å; G20-R24 PolarHBondContact O-N 3.41Å
21E84.2Confident81.2Confident108 Ų108100.6 Ų100.651%0.50551%0.514SS..Hα-helixtrans-70.7-42.1176.2-166.5169.8-158.900112.8D17 T18 L19 Q23 R24 N25D17-E21 WeakPolarHBondContact O-CB 3.35Å; D17-E21 PolarHBondContact O-N 2.82Å; T18-E21 PolarHBondContact O-N 3.49Å; L19-E21 VanDerWaalsContact C-N 3.3Å; L19-E21 PolarHBondContact O-N 3.24Å; E21-Q23 PolarHBondContact O-N 3.26Å; E21-R24 PolarHBondContact O-N 2.78Å; E21-N25 PolarHBondContact O-N 2.97Å
22K81.8Confident80.8Confident154 Ų154103.5 Ų103.567%0.6752%0.52SS*.Hα-helixtrans-59.3-45.2172.2-82.3-176.4177.2177.70112.1T18 L19 N25 Q26T18-K22 PolarHBondContact O-N 3.4Å; T18-K22 VanDerWaalsContact O-N 3.07Å; L19-K22 PolarHBondContact O-N 3.25Å; K22-N25 PolarHBondContact O-N 3Å; K22-Q26 PolarHBondContact O-N 3.29Å
23Q80.2Confident80.3Confident122 Ų122103.6 Ų103.657%0.5753%0.525SS*.Hα-helixtrans-62.4-42.2176.8-74.8-177-26.100111.8L19 E21 N25 Q26 L27L19-Q23 WeakPolarHBondContact O-CG 3.22Å; L19-Q23 PolarHBondContact O-N 3.34Å; E21-Q23 PolarHBondContact O-N 3.26Å; Q23-N25 VanDerWaalsContact C-N 3.33Å; Q23-N25 PolarHBondContact O-N 3.48Å; Q23-Q26 PolarHBondContact O-N 2.91Å; Q23-L27 WeakPolarHBondContact O-CB 3.47Å; Q23-L27 PolarHBondContact O-N 3.34Å
24R82.1Confident79.8Confident146 Ų146106.5 Ų106.555%0.55153%0.533SS*.Hα-helixtrans-60.4-40.2174.5-80.1-172.4-69.3-991.1112.5G20 E21 K28G20-R24 WeakPolarHBondContact O-CG 2.8Å; G20-R24 PolarHBondContact O-N 3.41Å; E21-R24 PolarHBondContact O-N 2.78Å; R24-K28 WeakPolarHBondContact O-CG 3.43Å; R24-K28 PolarHBondContact O-N 3.28Å; R24-K28 VanDerWaalsContact O-N 3.08Å
25N84.6Confident79.2Confident83 Ų83104.8 Ų104.844%0.44453%0.531SS..Hα-helixtrans-71.2-39.3180-71.9-18.6000112.6E21 K22 Q23 K28 V29E21-N25 PolarHBondContact O-N 2.97Å; K22-N25 PolarHBondContact O-N 3Å; Q23-N25 VanDerWaalsContact C-N 3.33Å; Q23-N25 PolarHBondContact O-N 3.48Å; N25-K28 PolarHBondContact O-N 3.22Å; N25-V29 PolarHBondContact O-N 3.2Å; N25-V29 VanDerWaalsContact O-N 3.16Å
26Q77.6Confident78.6Confident144 Ų144103 Ų10367%0.67353%0.529SS*.Hα-helixtrans-63.9-41.9173.8-74.1-177.4-26.500112K22 Q23 K28 V29 A30K22-Q26 PolarHBondContact O-N 3.29Å; Q23-Q26 PolarHBondContact O-N 2.91Å; Q26-K28 VanDerWaalsContact C-N 3.31Å; Q26-K28 PolarHBondContact O-N 3.1Å; Q26-V29 PolarHBondContact O-N 3.01Å; Q26-A30 PolarHBondContact O-N 2.65Å
27L80.4Confident77.8Confident111 Ų111102.1 Ų102.158%0.58153%0.527SS*.Hα-helixtrans-61.6-39.5175.7-163.678.5000111.6Q23 A30 N31Q23-L27 WeakPolarHBondContact O-CB 3.47Å; Q23-L27 PolarHBondContact O-N 3.34Å; L27-A30 PolarHBondContact O-N 2.79Å; L27-N31 WeakPolarHBondContact O-CB 3.19Å; L27-N31 PolarHBondContact O-N 3.01Å; L27-N31 PolarHBondContact O-OD1 3.21Å
28K79.5Confident77.1Confident137 Ų137100.3 Ų100.360%0.59652%0.517SS*.Hα-helixtrans-61.6-44.9175.5-76.7175.7-178.7177.50112.7R24 N25 Q26 N31 Q32R24-K28 WeakPolarHBondContact O-CG 3.43Å; R24-K28 PolarHBondContact O-N 3.28Å; R24-K28 VanDerWaalsContact O-N 3.08Å; N25-K28 PolarHBondContact O-N 3.22Å; Q26-K28 VanDerWaalsContact C-N 3.31Å; Q26-K28 PolarHBondContact O-N 3.1Å; K28-N31 PolarHBondContact O-N 3.39Å; K28-Q32 WeakPolarHBondContact O-CB 3.4Å; K28-Q32 PolarHBondContact O-N 2.99Å
29V78.7Confident76.4Confident92 Ų92103.5 Ų103.556%0.55853%0.529SS*.Hα-helixtrans-66.2-43179.3175.50000110.9N25 Q26 Q32 V33N25-V29 PolarHBondContact O-N 3.2Å; N25-V29 VanDerWaalsContact O-N 3.16Å; Q26-V29 PolarHBondContact O-N 3.01Å; V29-Q32 PolarHBondContact O-N 3.31Å; V29-V33 WeakPolarHBondContact O-CG2 3.47Å; V29-V33 PolarHBondContact O-N 3.15Å
30A74Confident75.6Confident54 Ų54102.1 Ų102.145%0.44652%0.522SS..Hα-helixtrans-59-48.5175.700000111.5Q26 L27 Q32 V33 E34Q26-A30 PolarHBondContact O-N 2.65Å; L27-A30 PolarHBondContact O-N 2.79Å; A30-Q32 VanDerWaalsContact C-N 3.28Å; A30-Q32 PolarHBondContact O-N 3.34Å; A30-V33 PolarHBondContact O-N 2.93Å; A30-E34 WeakPolarHBondContact O-CB 3.42Å; A30-E34 PolarHBondContact O-N 3.27Å
31N77.3Confident74.8Confident79 Ų79107 Ų10742%0.42254%0.536SS..Hα-helixtrans-60.3-36.7176.9-69.50000112.4L27 K28 E34 E35L27-N31 WeakPolarHBondContact O-CB 3.19Å; L27-N31 PolarHBondContact O-N 3.01Å; L27-N31 PolarHBondContact O-OD1 3.21Å; K28-N31 PolarHBondContact O-N 3.39Å; N31-E34 PolarHBondContact O-N 2.85Å; N31-E35 WeakPolarHBondContact O-CB 3.46Å; N31-E35 WeakPolarHBondContact O-CG 3.45Å; N31-E35 PolarHBondContact O-N 3.35Å
32Q74.9Confident74Confident126 Ų126107.8 Ų107.859%0.58953%0.534SS*.Hα-helixtrans-72.1-37.8-179.4-168.3170.9-5.200112.6K28 V29 A30 E34 E35 V36K28-Q32 WeakPolarHBondContact O-CB 3.4Å; K28-Q32 PolarHBondContact O-N 2.99Å; V29-Q32 PolarHBondContact O-N 3.31Å; A30-Q32 VanDerWaalsContact C-N 3.28Å; A30-Q32 PolarHBondContact O-N 3.34Å; Q32-E34 VanDerWaalsContact C-N 3.34Å; Q32-E35 PolarHBondContact O-N 3.37Å; Q32-V36 WeakPolarHBondContact O-CG2 3.31Å; Q32-V36 PolarHBondContact O-N 2.95Å; Q32-V36 VanDerWaalsContact O-N 3.1Å
33V72Confident73.4Confident96 Ų96105 Ų10558%0.58252%0.524SS*.Hα-helixtrans-65.5-41.4173.61740000110.5V29 A30 V36 A37V29-V33 WeakPolarHBondContact O-CG2 3.47Å; V29-V33 PolarHBondContact O-N 3.15Å; A30-V33 PolarHBondContact O-N 2.93Å; V33-V36 PolarHBondContact O-N 2.88Å; V33-A37 PolarHBondContact O-N 2.96Å
34E68.7Low72.6Confident138 Ų138105.2 Ų105.265%0.64552%0.523SS*.Hα-helixtrans-64.9-40.6176.9-154169.8-160.300111.4A30 N31 Q32 A37 D38A30-E34 WeakPolarHBondContact O-CB 3.42Å; A30-E34 PolarHBondContact O-N 3.27Å; N31-E34 PolarHBondContact O-N 2.85Å; Q32-E34 VanDerWaalsContact C-N 3.34Å; E34-A37 PolarHBondContact O-N 3.49Å; E34-D38 WeakPolarHBondContact O-CB 3.47Å; E34-D38 PolarHBondContact O-N 3Å
35E71.6Confident71.7Confident127 Ų127100.6 Ų100.659%0.59351%0.509SS*.Hα-helixtrans-62.1-40.9173.5-87-174.2163.600113.4N31 Q32 D38 Q39N31-E35 WeakPolarHBondContact O-CB 3.46Å; N31-E35 WeakPolarHBondContact O-CG 3.45Å; N31-E35 PolarHBondContact O-N 3.35Å; Q32-E35 PolarHBondContact O-N 3.37Å; E35-D38 PolarHBondContact O-N 3.49Å; E35-Q39 WeakPolarHBondContact O-CB 3.39Å; E35-Q39 WeakPolarHBondContact O-CG 3.3Å; E35-Q39 PolarHBondContact O-N 3.42Å
36V70.7Confident70.9Confident88 Ų88103.8 Ų103.853%0.53351%0.514SS..Hα-helixtrans-69.6-43179.3172.70000111.1Q32 V33 D38 Q39 D40Q32-V36 WeakPolarHBondContact O-CG2 3.31Å; Q32-V36 PolarHBondContact O-N 2.95Å; Q32-V36 VanDerWaalsContact O-N 3.1Å; V33-V36 PolarHBondContact O-N 2.88Å; V36-D38 VanDerWaalsContact C-N 3.32Å; V36-D38 PolarHBondContact O-N 3.31Å; V36-Q39 PolarHBondContact O-N 2.91Å; V36-D40 PolarHBondContact O-N 3.45Å
37A64.2Low70.3Confident62 Ų62103.5 Ų103.551%0.51251%0.513SS..Hα-helixtrans-62.6-41.4175.300000111.3V33 E34 Q39 D40 Y41V33-A37 PolarHBondContact O-N 2.96Å; E34-A37 PolarHBondContact O-N 3.49Å; A37-Q39 VanDerWaalsContact C-N 3.35Å; A37-D40 PolarHBondContact O-N 3.47Å; A37-Y41 WeakPolarHBondContact O-CB 3.34Å; A37-Y41 PolarHBondContact O-N 3.46Å
38D68.9Low69.4Low67 Ų67102.9 Ų102.936%0.35851%0.509SS..Hα-helixtrans-68.5-31.7175.8-174.249.3000112.3E34 E35 V36 R42E34-D38 WeakPolarHBondContact O-CB 3.47Å; E34-D38 PolarHBondContact O-N 3Å; E35-D38 PolarHBondContact O-N 3.49Å; V36-D38 VanDerWaalsContact C-N 3.32Å; V36-D38 PolarHBondContact O-N 3.31Å; D38-R42 WeakPolarHBondContact O-CB 3.25Å; D38-R42 WeakPolarHBondContact O-CG 3.27Å; D38-R42 PolarHBondContact O-N 2.9Å; D38-R42 PolarHBondContact O-NE 3.28Å; D38-R42 IonicContact OD1-NE 3.09Å; D38-R42 IonicContact OD2-CZ 3.97Å; D38-R42 IonicContact OD2-NE 2.72Å; D38-R42 PolarHBondContact OD2-NE 3.38Å; D38-R42 IonicContact OD2-NH1 3.35Å; D38-R42 IonicContact OD2-NH2 3.9Å; D38-R42 PolarHBondContact OD2-NH2 3.44Å
39Q68.7Low68.4Low117 Ų117100.2 Ų100.255%0.54750%0.502SS..Hα-helixtrans-66.1-47.6171.3-87.9-171.8-22.800112.8E35 V36 A37 Y41 R42 E43E35-Q39 WeakPolarHBondContact O-CB 3.39Å; E35-Q39 WeakPolarHBondContact O-CG 3.3Å; E35-Q39 PolarHBondContact O-N 3.42Å; V36-Q39 PolarHBondContact O-N 2.91Å; A37-Q39 VanDerWaalsContact C-N 3.35Å; Q39-Y41 VanDerWaalsContact C-N 3.35Å; Q39-R42 PolarHBondContact O-N 2.96Å; Q39-E43 PolarHBondContact O-N 3.08Å
40D66.4Low67.6Low76 Ų7698.1 Ų98.141%0.40649%0.494SS..Hα-helixtrans-63.2-42178.4-177.449.2000111.2V36 A37 E43 K44V36-D40 PolarHBondContact O-N 3.45Å; A37-D40 PolarHBondContact O-N 3.47Å; D40-E43 PolarHBondContact O-N 2.92Å; D40-K44 PolarHBondContact O-N 3.01Å; D40-K44 IonicContact OD1-NZ 3.69Å; D40-K44 WeakPolarHBondContact OD2-CE 3.32Å; D40-K44 IonicContact OD2-NZ 3.25Å; D40-K44 PolarHBondContact OD2-NZ 3.46Å
41Y64.9Low66.7Low119 Ų119101 Ų10147%0.46750%0.501SS..Hα-helixtrans-61.5-47.3173.3-176.7-104.2000111.8A37 Q39 E43 K44 L45A37-Y41 WeakPolarHBondContact O-CB 3.34Å; A37-Y41 PolarHBondContact O-N 3.46Å; Q39-Y41 VanDerWaalsContact C-N 3.35Å; Y41-E43 VanDerWaalsContact C-N 3.25Å; Y41-E43 PolarHBondContact O-N 3.26Å; Y41-K44 PolarHBondContact O-N 3.37Å; Y41-L45 HydrophobicContact CE1-CD2 4.24Å; Y41-L45 VanDerWaalsContact O-CB 3.26Å; Y41-L45 WeakPolarHBondContact O-CB 3.33Å; Y41-L45 PolarHBondContact O-N 3.45Å
42R66.5Low65.7Low125 Ų125101.2 Ų101.247%0.47250%0.502SS..Hα-helixtrans-62.1-29.3175.2-78.6-170.6-83.2-175.2-4.5112.8D38 Q39 R46D38-R42 WeakPolarHBondContact O-CB 3.25Å; D38-R42 WeakPolarHBondContact O-CG 3.27Å; D38-R42 PolarHBondContact O-N 2.9Å; D38-R42 PolarHBondContact O-NE 3.28Å; D38-R42 IonicContact OD1-NE 3.09Å; D38-R42 IonicContact OD2-CZ 3.97Å; D38-R42 IonicContact OD2-NE 2.72Å; D38-R42 PolarHBondContact OD2-NE 3.38Å; D38-R42 IonicContact OD2-NH1 3.35Å; D38-R42 IonicContact OD2-NH2 3.9Å; D38-R42 PolarHBondContact OD2-NH2 3.44Å; Q39-R42 PolarHBondContact O-N 2.96Å; R42-R46 VanDerWaalsContact O-CB 3.31Å; R42-R46 WeakPolarHBondContact O-CB 3.31Å; R42-R46 WeakPolarHBondContact O-CG 3.32Å; R42-R46 PolarHBondContact O-N 3.22Å; R42-R46 PolarHBondContact O-NE 2.92Å; R42-R46 VanDerWaalsContact O-NE 3.11Å
43E68.6Low64.9Low97 Ų97101 Ų10145%0.45350%0.501SS..Hα-helixtrans-71.4-51.5173.3-81.5-171.9175.400112.5Q39 D40 Y41 L45 R46 H47Q39-E43 PolarHBondContact O-N 3.08Å; D40-E43 PolarHBondContact O-N 2.92Å; Y41-E43 VanDerWaalsContact C-N 3.25Å; Y41-E43 PolarHBondContact O-N 3.26Å; E43-L45 VanDerWaalsContact C-N 3.27Å; E43-L45 PolarHBondContact O-N 3.22Å; E43-R46 WeakPolarHBondContact O-CB 3.46Å; E43-R46 PolarHBondContact O-N 2.96Å; E43-R46 VanDerWaalsContact O-N 3.12Å; E43-R46 IonicContact OE1-NH2 2.95Å; E43-H47 PolarHBondContact O-CD2 3.2Å; E43-H47 PolarHBondContact O-N 2.85Å
44K64.8Low64.1Low126 Ų126101.2 Ų101.255%0.54850%0.497SS..Hα-helixtrans-58-42.4176.1-73.8169.4180157.60111.6D40 Y41 H47 L48D40-K44 PolarHBondContact O-N 3.01Å; D40-K44 IonicContact OD1-NZ 3.69Å; D40-K44 WeakPolarHBondContact OD2-CE 3.32Å; D40-K44 IonicContact OD2-NZ 3.25Å; D40-K44 PolarHBondContact OD2-NZ 3.46Å; Y41-K44 PolarHBondContact O-N 3.37Å; K44-H47 PolarHBondContact O-N 3.17Å; K44-L48 WeakPolarHBondContact O-CB 3.49Å; K44-L48 PolarHBondContact O-N 3.26Å
45L61.8Low63.4Low49 Ų4998.2 Ų98.226%0.25749%0.485SS..Hα-helixtrans-65.7-39.4176.7-170.366.5000112Y41 E43 H47 L48 N49Y41-L45 HydrophobicContact CE1-CD2 4.24Å; Y41-L45 VanDerWaalsContact O-CB 3.26Å; Y41-L45 WeakPolarHBondContact O-CB 3.33Å; Y41-L45 PolarHBondContact O-N 3.45Å; E43-L45 VanDerWaalsContact C-N 3.27Å; E43-L45 PolarHBondContact O-N 3.22Å; L45-H47 VanDerWaalsContact C-N 3.35Å; L45-L48 PolarHBondContact O-N 3.49Å; L45-N49 VanDerWaalsContact O-CB 3.25Å; L45-N49 WeakPolarHBondContact O-CB 3.29Å; L45-N49 VanDerWaalsContact O-CG 3.28Å; L45-N49 PolarHBondContact O-N 2.86Å; L45-N49 PolarHBondContact O-ND2 2.77Å
46R67.7Low62.5Low150 Ų15095.8 Ų95.857%0.56647%0.472SS*.Hα-helixtrans-61.6-42.3172.5-82.5-178.4-72.5163.6-7111.7R42 E43 A50R42-R46 VanDerWaalsContact O-CB 3.31Å; R42-R46 WeakPolarHBondContact O-CB 3.31Å; R42-R46 WeakPolarHBondContact O-CG 3.32Å; R42-R46 PolarHBondContact O-N 3.22Å; R42-R46 PolarHBondContact O-NE 2.92Å; R42-R46 VanDerWaalsContact O-NE 3.11Å; E43-R46 WeakPolarHBondContact O-CB 3.46Å; E43-R46 PolarHBondContact O-N 2.96Å; E43-R46 VanDerWaalsContact O-N 3.12Å; E43-R46 IonicContact OE1-NH2 2.95Å; R46-A50 VanDerWaalsContact O-CB 3.25Å; R46-A50 WeakPolarHBondContact O-CB 3.45Å; R46-A50 PolarHBondContact O-N 3.44Å
47H65.6Low62.1Low137 Ų13795.4 Ų95.463%0.63447%0.466SS*.Hα-helixtrans-64.8-44.9176.3-79.7-70000112.2E43 K44 L45 A50 L51E43-H47 PolarHBondContact O-CD2 3.2Å; E43-H47 PolarHBondContact O-N 2.85Å; K44-H47 PolarHBondContact O-N 3.17Å; L45-H47 VanDerWaalsContact C-N 3.35Å; H47-A50 PolarHBondContact O-N 3.3Å; H47-L51 WeakPolarHBondContact O-CB 3.38Å; H47-L51 PolarHBondContact O-N 3.42Å
48L61.6Low62Low98 Ų9894.2 Ų94.251%0.51345%0.453SS..Hα-helixtrans-63.2-47.1177-169.777.5000111.5K44 L45 A50 L51 L52K44-L48 WeakPolarHBondContact O-CB 3.49Å; K44-L48 PolarHBondContact O-N 3.26Å; L45-L48 PolarHBondContact O-N 3.49Å; L48-A50 VanDerWaalsContact C-N 3.33Å; L48-A50 PolarHBondContact O-N 2.79Å; L48-L51 WeakPolarHBondContact O-CB 3.41Å; L48-L51 PolarHBondContact O-N 2.89Å; L48-L52 HydrophobicContact CD2-CD1 4.41Å; L48-L52 HydrophobicContact CG-CD1 4.09Å; L48-L52 WeakPolarHBondContact O-CB 3.32Å; L48-L52 WeakPolarHBondContact O-CG 3.39Å; L48-L52 PolarHBondContact O-N 3.4Å
49N59Low61.9Low82 Ų8295.6 Ų95.644%0.43946%0.458SS..Hα-helixtrans-63.9-38.4177.7-76.3-17.7000111.9L45 Q53L45-N49 VanDerWaalsContact O-CB 3.25Å; L45-N49 WeakPolarHBondContact O-CB 3.29Å; L45-N49 VanDerWaalsContact O-CG 3.28Å; L45-N49 PolarHBondContact O-N 2.86Å; L45-N49 PolarHBondContact O-ND2 2.77Å; N49-Q53 WeakPolarHBondContact O-CB 3.43Å; N49-Q53 PolarHBondContact O-N 3.02Å
50A62.1Low61.9Low47 Ų4793.9 Ų93.939%0.38846%0.457SS..Hα-helixtrans-64.2-43.8173.500000111.6R46 H47 L48 Q53 M54R46-A50 VanDerWaalsContact O-CB 3.25Å; R46-A50 WeakPolarHBondContact O-CB 3.45Å; R46-A50 PolarHBondContact O-N 3.44Å; H47-A50 PolarHBondContact O-N 3.3Å; L48-A50 VanDerWaalsContact C-N 3.33Å; L48-A50 PolarHBondContact O-N 2.79Å; A50-Q53 PolarHBondContact O-N 3.12Å; A50-M54 VanDerWaalsContact O-CG 3.3Å; A50-M54 WeakPolarHBondContact O-CG 3.16Å; A50-M54 PolarHBondContact O-N 3.38Å
51L54.7Low62.4Low115 Ų11591.7 Ų91.760%0.60244%0.444SS*.Hα-helixtrans-61.7-48.5175.5-109.8166.5000111.8H47 L48 Q53 M54 L55H47-L51 WeakPolarHBondContact O-CB 3.38Å; H47-L51 PolarHBondContact O-N 3.42Å; L48-L51 WeakPolarHBondContact O-CB 3.41Å; L48-L51 PolarHBondContact O-N 2.89Å; L51-Q53 VanDerWaalsContact C-N 3.31Å; L51-Q53 PolarHBondContact O-N 2.98Å; L51-M54 PolarHBondContact O-N 3.33Å; L51-L55 WeakPolarHBondContact O-CB 3.26Å; L51-L55 PolarHBondContact O-N 3.43Å
52L56Low63.1Low83 Ų8390.2 Ų90.244%0.43545%0.448SS..Hα-helixtrans-59.3-43.3176.1-76.1168.3000110.9L48 L55 K56L48-L52 HydrophobicContact CD2-CD1 4.41Å; L48-L52 HydrophobicContact CG-CD1 4.09Å; L48-L52 WeakPolarHBondContact O-CB 3.32Å; L48-L52 WeakPolarHBondContact O-CG 3.39Å; L48-L52 PolarHBondContact O-N 3.4Å; L52-L55 CarbonylContact O-C 3.47Å; L52-L55 WeakPolarHBondContact O-CB 3.34Å; L52-L55 PolarHBondContact O-N 3.27Å; L52-K56 WeakPolarHBondContact O-CG 3.2Å; L52-K56 PolarHBondContact O-N 2.91Å
53Q57.5Low63.8Low123 Ų12386.2 Ų86.258%0.57545%0.445SS*.Hα-helixtrans-63.1-42.5177.2-173177.66.400112.2N49 A50 L51 L55 K56 I57N49-Q53 WeakPolarHBondContact O-CB 3.43Å; N49-Q53 PolarHBondContact O-N 3.02Å; A50-Q53 PolarHBondContact O-N 3.12Å; L51-Q53 VanDerWaalsContact C-N 3.31Å; L51-Q53 PolarHBondContact O-N 2.98Å; Q53-L55 VanDerWaalsContact C-N 3.3Å; Q53-L55 PolarHBondContact O-N 3Å; Q53-K56 WeakPolarHBondContact O-CB 3.32Å; Q53-K56 PolarHBondContact O-N 3.26Å; Q53-I57 HydrophobicContact CG-CD1 4.39Å; Q53-I57 WeakPolarHBondContact O-CG1 3.44Å; Q53-I57 PolarHBondContact O-N 3.11Å; Q53-I57 VanDerWaalsContact O-N 3.08Å
54M56.3Low64.6Low99 Ų9982.3 Ų82.349%0.48843%0.428SS..Hα-helixtrans-59.2-45.5172.4-70.1-60.2-62.300110.6A50 L51 K56 I57 T58A50-M54 VanDerWaalsContact O-CG 3.3Å; A50-M54 WeakPolarHBondContact O-CG 3.16Å; A50-M54 PolarHBondContact O-N 3.38Å; L51-M54 PolarHBondContact O-N 3.33Å; M54-K56 VanDerWaalsContact C-N 3.31Å; M54-K56 PolarHBondContact O-N 3.37Å; M54-I57 PolarHBondContact O-N 3.11Å; M54-T58 WeakPolarHBondContact O-CG2 3.42Å; M54-T58 PolarHBondContact O-N 3.26Å; M54-T58 PolarHBondContact O-OG1 2.71Å
55L53.1Low65.7Low76 Ų7679.4 Ų79.440%0.39842%0.42SS..Hα-helixtrans-62.7-35.1176.4-131.9128000112.4L51 L52 Q53 T58 M59L51-L55 WeakPolarHBondContact O-CB 3.26Å; L51-L55 PolarHBondContact O-N 3.43Å; L52-L55 CarbonylContact O-C 3.47Å; L52-L55 WeakPolarHBondContact O-CB 3.34Å; L52-L55 PolarHBondContact O-N 3.27Å; Q53-L55 VanDerWaalsContact C-N 3.3Å; Q53-L55 PolarHBondContact O-N 3Å; L55-T58 WeakPolarHBondContact CA-OG1 3.39Å; L55-T58 PolarHBondContact O-OG1 3.01Å; L55-M59 HydrophobicContact CD2-CE 3.35Å; L55-M59 HydrophobicContact CD2-CG 4.01Å; L55-M59 HydrophobicContact CG-CE 4.24Å; L55-M59 WeakPolarHBondContact O-CB 3.47Å; L55-M59 WeakPolarHBondContact O-CG 3.33Å; L55-M59 PolarHBondContact O-N 3.41Å; L55-M59 VanDerWaalsContact O-N 3.12Å
56K53.6Low67Low76 Ų7679.2 Ų79.233%0.3343%0.426SS..Hα-helixtrans-62.5-43.3174.4-60.4-152.4173-167.80111.3L52 Q53 M54 P60 D622L52-K56 WeakPolarHBondContact O-CG 3.2Å; L52-K56 PolarHBondContact O-N 2.91Å; Q53-K56 WeakPolarHBondContact O-CB 3.32Å; Q53-K56 PolarHBondContact O-N 3.26Å; M54-K56 VanDerWaalsContact C-N 3.31Å; M54-K56 PolarHBondContact O-N 3.37Å; K56-P60 VanDerWaalsContact O-CD 3.32Å; K56-P60 WeakPolarHBondContact O-CD 3.47Å; K56-D622 IonicContact NZ-OD1 3.08Å; K56-D622 PolarHBondContact NZ-OD1 2.89Å; K56-D622 IonicContact NZ-OD2 3.25Å
57I61.6Low68.1Low79 Ų7976.5 Ų76.541%0.40542%0.422SS..Hα-helixtrans-71.2-42.8-179.4-63.4165.3000110.2Q53 M54 H61Q53-I57 HydrophobicContact CG-CD1 4.39Å; Q53-I57 WeakPolarHBondContact O-CG1 3.44Å; Q53-I57 PolarHBondContact O-N 3.11Å; Q53-I57 VanDerWaalsContact O-N 3.08Å; M54-I57 PolarHBondContact O-N 3.11Å; I57-H61 PolarHBondContact O-CD2 3.47Å; I57-H61 PolarHBondContact O-NE2 3.43Å
58T63Low69.4Low37 Ų3771 Ų7123%0.22740%0.397CS..Hα-helixtrans-75.1-30.9-174.755.90000114.7M54 L55 H61 V62 F214M54-T58 WeakPolarHBondContact O-CG2 3.42Å; M54-T58 PolarHBondContact O-N 3.26Å; M54-T58 PolarHBondContact O-OG1 2.71Å; L55-T58 WeakPolarHBondContact CA-OG1 3.39Å; L55-T58 PolarHBondContact O-OG1 3.01Å; T58-H61 WeakPolarHBondContact O-CB 3.44Å; T58-H61 PolarHBondContact O-N 2.88Å; T58-V62 WeakPolarHBondContact O-CG2 3.45Å; T58-V62 PolarHBondContact O-N 3.32Å; T58-F214 HydrophobicContact CG2-CE2 3.81Å; T58-F214 HydrophobicContact CG2-CZ 4.5Å
59M65.8Low71Confident97 Ų9768.7 Ų68.748%0.47839%0.392SS..Hα-helixtrans-61.6-44.6-169.6-83.9-70.6177.200115.1L55 H61 V62 G63L55-M59 HydrophobicContact CD2-CE 3.35Å; L55-M59 HydrophobicContact CD2-CG 4.01Å; L55-M59 HydrophobicContact CG-CE 4.24Å; L55-M59 WeakPolarHBondContact O-CB 3.47Å; L55-M59 WeakPolarHBondContact O-CG 3.33Å; L55-M59 PolarHBondContact O-N 3.41Å; L55-M59 VanDerWaalsContact O-N 3.12Å; M59-H61 VanDerWaalsContact C-N 3.28Å; M59-H61 PolarHBondContact O-N 3.19Å; M59-V62 PolarHBondContact O-N 3.22Å; M59-G63 PolarHBondContact O-N 2.62Å
60P69.5Low72.7Confident80 Ų8069.8 Ų69.852%0.51940%0.397SS..Hα-helixtrans-59.6-39.3175-23.434.1000112.5K56 G63 L64K56-P60 VanDerWaalsContact O-CD 3.32Å; K56-P60 WeakPolarHBondContact O-CD 3.47Å; P60-G63 PolarHBondContact O-N 3.09Å; P60-L64 PolarHBondContact O-N 3.21Å; P60-L64 VanDerWaalsContact O-N 3.07Å
61H76.9Confident74.3Confident30 Ų3070.1 Ų70.114%0.13939%0.388CS..Hα-helixtrans-63.6-46178.4-52.7-48.7000111.4I57 T58 M59 G63 L64 V65 D210I57-H61 PolarHBondContact O-CD2 3.47Å; I57-H61 PolarHBondContact O-NE2 3.43Å; T58-H61 WeakPolarHBondContact O-CB 3.44Å; T58-H61 PolarHBondContact O-N 2.88Å; M59-H61 VanDerWaalsContact C-N 3.28Å; M59-H61 PolarHBondContact O-N 3.19Å; H61-G63 VanDerWaalsContact C-N 3.35Å; H61-G63 PolarHBondContact O-N 3.38Å; H61-L64 PolarHBondContact O-N 3.48Å; H61-V65 WeakPolarHBondContact O-CG2 3.41Å; H61-V65 PolarHBondContact O-N 2.91Å; H61-V65 VanDerWaalsContact O-N 3.14Å; H61-D210 VanDerWaalsContact CA-OD2 3.3Å; H61-D210 WeakPolarHBondContact CA-OD2 3.22Å; H61-D210 WeakPolarHBondContact CB-OD2 3.2Å; H61-D210 IonicContact CE1-OD1 2.81Å; H61-D210 PolarHBondContact CE1-OD1 3.04Å; H61-D210 IonicContact CE1-OD2 3.96Å; H61-D210 IonicContact CG-OD2 2.83Å; H61-D210 IonicContact ND1-OD1 2.63Å; H61-D210 PolarHBondContact ND1-OD1 2.88Å; H61-D210 IonicContact ND1-OD2 2.87Å; H61-D210 PolarHBondContact ND1-OD2 2.88Å
62V79.5Confident76.3Confident88 Ų8865.3 Ų65.353%0.53336%0.364SS..Hα-helixtrans-63.6-40.8176.9175.40000111.4T58 M59 L64 V65 A66T58-V62 WeakPolarHBondContact O-CG2 3.45Å; T58-V62 PolarHBondContact O-N 3.32Å; M59-V62 PolarHBondContact O-N 3.22Å; V62-L64 VanDerWaalsContact C-N 3.33Å; V62-L64 PolarHBondContact O-N 3.37Å; V62-V65 PolarHBondContact O-N 3.04Å; V62-A66 WeakPolarHBondContact O-CB 3.47Å; V62-A66 PolarHBondContact O-N 2.81Å
63G81.6Confident78.3Confident41 Ų4164.9 Ų64.942%0.42336%0.364SS..Hα-helixtrans-61.9-39.6177.600000112.9M59 P60 H61 A66 L67M59-G63 PolarHBondContact O-N 2.62Å; P60-G63 PolarHBondContact O-N 3.09Å; H61-G63 VanDerWaalsContact C-N 3.35Å; H61-G63 PolarHBondContact O-N 3.38Å; G63-A66 PolarHBondContact O-N 2.86Å; G63-L67 WeakPolarHBondContact O-CB 3.48Å; G63-L67 PolarHBondContact O-N 3.37Å
64L84.1Confident80.1Confident16 Ų1662.2 Ų62.28%0.08436%0.358CS..Hα-helixtrans-67.6-41.8177.8-175.562.7000112P60 H61 V62 L67 L68 L203 I206 T207 D210 L610P60-L64 PolarHBondContact O-N 3.21Å; P60-L64 VanDerWaalsContact O-N 3.07Å; H61-L64 PolarHBondContact O-N 3.48Å; V62-L64 VanDerWaalsContact C-N 3.33Å; V62-L64 PolarHBondContact O-N 3.37Å; L64-L67 PolarHBondContact O-N 2.99Å; L64-L68 PolarHBondContact O-N 2.91Å; L64-L203 HydrophobicContact CD1-CD1 3.98Å; L64-I206 HydrophobicContact CD2-CG2 4.13Å; L64-T207 HydrophobicContact CD1-CG2 3.89Å; L64-T207 HydrophobicContact CD2-CG2 3.98Å; L64-T207 HydrophobicContact CG-CG2 3.52Å; L64-D210 HydrophobicContact CD2-CB 3.87Å; L64-L610 HydrophobicContact CD2-CD2 4.46Å
65V89Confident82Confident64 Ų6457.7 Ų57.739%0.38834%0.337SS..Hα-helixtrans-64.8-41.9174.1175.50000111.4H61 V62 L67 L68 A69 I211H61-V65 WeakPolarHBondContact O-CG2 3.41Å; H61-V65 PolarHBondContact O-N 2.91Å; H61-V65 VanDerWaalsContact O-N 3.14Å; V62-V65 PolarHBondContact O-N 3.04Å; V65-L67 VanDerWaalsContact C-N 3.35Å; V65-L67 PolarHBondContact O-N 3.4Å; V65-L68 PolarHBondContact O-N 2.94Å; V65-A69 WeakPolarHBondContact O-CB 3.49Å; V65-A69 PolarHBondContact O-N 3.3Å; V65-I211 HydrophobicContact CG2-CD1 3.93Å; V65-I211 HydrophobicContact CG2-CG1 4.1Å
66A89Confident84.1Confident45 Ų4554 Ų5437%0.37232%0.318SS..Hα-helixtrans-63.4-40.6176.400000111.9V62 G63 A69 I70V62-A66 WeakPolarHBondContact O-CB 3.47Å; V62-A66 PolarHBondContact O-N 2.81Å; G63-A66 PolarHBondContact O-N 2.86Å; A66-A69 PolarHBondContact O-N 3.43Å; A66-I70 VanDerWaalsContact O-CG1 3.27Å; A66-I70 WeakPolarHBondContact O-CG1 3.32Å; A66-I70 PolarHBondContact O-N 3.46Å
67L90.2Very high86.2Confident94 Ų9452 Ų5249%0.49232%0.316SS..Hα-helixtrans-60.5-46.2174.9178.165.3000111.4G63 L64 V65 I70 Y71 L203G63-L67 WeakPolarHBondContact O-CB 3.48Å; G63-L67 PolarHBondContact O-N 3.37Å; L64-L67 PolarHBondContact O-N 2.99Å; V65-L67 VanDerWaalsContact C-N 3.35Å; V65-L67 PolarHBondContact O-N 3.4Å; L67-I70 PolarHBondContact O-N 3.22Å; L67-Y71 VanDerWaalsContact O-CB 3.32Å; L67-Y71 WeakPolarHBondContact O-CB 3.43Å; L67-Y71 PolarHBondContact O-N 3.44Å; L67-L203 HydrophobicContact CD2-CD1 4.24Å
68L93Very high87.8Confident22 Ų2252 Ų5212%0.11532%0.315CS..Hα-helixtrans-61.2-45.2175.8-176.673.2000111.4L64 V65 I70 Y71 T72 I174 L203 L204 T207L64-L68 PolarHBondContact O-N 2.91Å; V65-L68 PolarHBondContact O-N 2.94Å; L68-I70 PolarHBondContact O-N 3.34Å; L68-Y71 WeakPolarHBondContact O-CB 3.39Å; L68-Y71 PolarHBondContact O-N 3.33Å; L68-T72 WeakPolarHBondContact O-CG2 3.46Å; L68-T72 PolarHBondContact O-N 3.01Å; L68-T72 PolarHBondContact O-OG1 2.91Å; L68-I174 HydrophobicContact CD1-CD1 3.68Å; L68-I174 HydrophobicContact CD2-CD1 4.39Å; L68-I174 HydrophobicContact CG-CD1 4.13Å; L68-L203 HydrophobicContact CD1-CD2 3.96Å; L68-L203 HydrophobicContact CD1-CG 3.95Å; L68-L204 HydrophobicContact CD1-CB 4.32Å; L68-L204 HydrophobicContact CD2-CD1 3.57Å; L68-T207 HydrophobicContact CB-CG2 4Å; L68-T207 HydrophobicContact CD1-CG2 4.44Å; L68-T207 HydrophobicContact CD2-CG2 4.04Å; L68-T207 HydrophobicContact CG-CG2 4.4Å
69A94.6Very high89.5Confident48 Ų4850.2 Ų50.240%0.39731%0.305SS..Hα-helixtrans-60.2-47.1178.400000111.5V65 A66 Y71 T72 V73V65-A69 WeakPolarHBondContact O-CB 3.49Å; V65-A69 PolarHBondContact O-N 3.3Å; A66-A69 PolarHBondContact O-N 3.43Å; A69-Y71 VanDerWaalsContact C-N 3.33Å; A69-Y71 PolarHBondContact O-N 3.08Å; A69-T72 PolarHBondContact O-N 3.49Å; A69-T72 PolarHBondContact O-OG1 3.33Å; A69-V73 WeakPolarHBondContact O-CG2 3.35Å; A69-V73 PolarHBondContact O-N 3.27Å
70I95.6Very high90.9Very high106 Ų10648.1 Ų48.154%0.54429%0.294SS..Hα-helixtrans-60.5-44.8175.8-67.4164.7000110.5A66 L67 L68 T72 V73 C74A66-I70 VanDerWaalsContact O-CG1 3.27Å; A66-I70 WeakPolarHBondContact O-CG1 3.32Å; A66-I70 PolarHBondContact O-N 3.46Å; L67-I70 PolarHBondContact O-N 3.22Å; L68-I70 PolarHBondContact O-N 3.34Å; I70-T72 VanDerWaalsContact C-N 3.34Å; I70-T72 PolarHBondContact O-N 2.9Å; I70-V73 PolarHBondContact O-N 2.81Å; I70-C74 WeakPolarHBondContact O-CB 3.35Å; I70-C74 PolarHBondContact O-N 2.77Å; I70-C74 PolarHBondContact O-SG 2.9Å
71Y95.9Very high92.1Very high53 Ų5350.2 Ų50.221%0.20830%0.3CS..Hα-helixtrans-57.6-44.9177.2-178.6-100.1000112.1L67 L68 A69 G75 I174 F196 G200 L203L67-Y71 VanDerWaalsContact O-CB 3.32Å; L67-Y71 WeakPolarHBondContact O-CB 3.43Å; L67-Y71 PolarHBondContact O-N 3.44Å; L68-Y71 WeakPolarHBondContact O-CB 3.39Å; L68-Y71 PolarHBondContact O-N 3.33Å; A69-Y71 VanDerWaalsContact C-N 3.33Å; A69-Y71 PolarHBondContact O-N 3.08Å; Y71-G75 PolarHBondContact O-N 3Å; Y71-I174 HydrophobicContact CD1-CG2 4.42Å; Y71-I174 HydrophobicContact CE1-CG2 3.99Å; Y71-F196 HydrophobicContact CD1-CD2 4.49Å; Y71-F196 AromaticContact CD1-CE2 3.66Å; Y71-F196 HydrophobicContact CD1-CE2 3.66Å; Y71-F196 AromaticContact CD1-CZ 3.94Å; Y71-F196 HydrophobicContact CD1-CZ 3.94Å; Y71-F196 AromaticContact CE1-CD2 3.59Å; Y71-F196 HydrophobicContact CE1-CD2 3.59Å; Y71-F196 HydrophobicContact CE1-CE1 4.28Å; Y71-F196 AromaticContact CE1-CE2 3.13Å; Y71-F196 HydrophobicContact CE1-CE2 3.13Å; Y71-F196 HydrophobicContact CE1-CG 4.31Å; Y71-F196 AromaticContact CE1-CZ 3.53Å; Y71-F196 HydrophobicContact CE1-CZ 3.53Å; Y71-F196 HydrophobicContact CE2-CD2 4.18Å; Y71-F196 HydrophobicContact CE2-CE2 4.12Å; Y71-F196 HydrophobicContact CG-CE2 4.33Å; Y71-F196 AromaticContact CZ-CD2 3.41Å; Y71-F196 VanDerWaalsContact CZ-CD2 3.41Å; Y71-F196 AromaticContact CZ-CE2 3.41Å; Y71-F196 VanDerWaalsContact CZ-CE2 3.41Å; Y71-F196 WeakPolarHBondContact OH-CA 3.36Å; Y71-F196 VanDerWaalsContact OH-CD2 3.22Å; Y71-F196 WeakPolarHBondContact OH-CD2 3.46Å; Y71-F196 PolarHBondContact OH-O 2.91Å; Y71-G200 VanDerWaalsContact CE1-CA 3.48Å; Y71-G200 PolarHBondContact OH-N 3.38Å; Y71-L203 HydrophobicContact CD1-CD2 4.45Å; Y71-L203 HydrophobicContact CG-CD2 4.33Å
72T96.6Very high92.8Very high15 Ų1551.2 Ų51.29%0.09231%0.306CS..Hα-helixtrans-65.6-41.9177.457.90000113.4L68 A69 I70 G75 G76 I174L68-T72 WeakPolarHBondContact O-CG2 3.46Å; L68-T72 PolarHBondContact O-N 3.01Å; L68-T72 PolarHBondContact O-OG1 2.91Å; A69-T72 PolarHBondContact O-N 3.49Å; A69-T72 PolarHBondContact O-OG1 3.33Å; I70-T72 VanDerWaalsContact C-N 3.34Å; I70-T72 PolarHBondContact O-N 2.9Å; T72-G75 PolarHBondContact O-N 3.28Å; T72-G76 PolarHBondContact O-N 3.4Å; T72-I174 HydrophobicContact CG2-CD1 3.23Å; T72-I174 HydrophobicContact CG2-CG1 4.08Å
73V97.3Very high93.5Very high73 Ų7347.2 Ų47.244%0.44228%0.281SS..Hα-helixtrans-66.8-44.11791730000110.6A69 I70 G76 A77 I167A69-V73 WeakPolarHBondContact O-CG2 3.35Å; A69-V73 PolarHBondContact O-N 3.27Å; I70-V73 PolarHBondContact O-N 2.81Å; V73-G76 PolarHBondContact O-N 2.63Å; V73-A77 WeakPolarHBondContact O-CB 3.17Å; V73-A77 PolarHBondContact O-N 2.9Å; V73-I167 HydrophobicContact CG1-CD1 4.46Å
74C96.5Very high93.9Very high67 Ų6746.6 Ų46.645%0.45327%0.27SS..Hα-helixtrans-61.1-46.3174.6-71.40000111.5I70 A77 I78I70-C74 WeakPolarHBondContact O-CB 3.35Å; I70-C74 PolarHBondContact O-N 2.77Å; I70-C74 PolarHBondContact O-SG 2.9Å; C74-A77 PolarHBondContact O-N 3.19Å; C74-I78 VanDerWaalsContact O-CG1 3.29Å; C74-I78 WeakPolarHBondContact O-CG1 3Å; C74-I78 PolarHBondContact O-N 3.25Å
75G96.3Very high94.2Very high4 Ų449.9 Ų49.94%0.04130%0.295CS..Hα-helixtrans-57.6-49.8175.700000112.1Y71 T72 A77 I78 F79Y71-G75 PolarHBondContact O-N 3Å; T72-G75 PolarHBondContact O-N 3.28Å; G75-A77 VanDerWaalsContact C-N 3.34Å; G75-A77 PolarHBondContact O-N 3.02Å; G75-I78 PolarHBondContact O-N 3.32Å; G75-F79 WeakPolarHBondContact O-CD2 3.45Å; G75-F79 PolarHBondContact O-N 3.22Å
76G96.9Very high94.2Very high0 Ų049.6 Ų49.60%029%0.289CS..Hα-helixtrans-59.6-41177.200000113.2T72 V73 I78 F79 H80 S166T72-G76 PolarHBondContact O-N 3.4Å; V73-G76 PolarHBondContact O-N 2.63Å; G76-I78 PolarHBondContact O-N 3.44Å; G76-F79 PolarHBondContact O-N 2.84Å; G76-H80 WeakPolarHBondContact O-CB 3.41Å; G76-H80 PolarHBondContact O-N 3.32Å; G76-S166 WeakPolarHBondContact CA-O 3.43Å; G76-S166 WeakPolarHBondContact O-CB 3.5Å
77A97.2Very high94.1Very high34 Ų3448.1 Ų48.128%0.28127%0.274SS..Hα-helixtrans-62.9-41.6175.400000112.2V73 C74 G75 H80 L81 L163V73-A77 WeakPolarHBondContact O-CB 3.17Å; V73-A77 PolarHBondContact O-N 2.9Å; C74-A77 PolarHBondContact O-N 3.19Å; G75-A77 VanDerWaalsContact C-N 3.34Å; G75-A77 PolarHBondContact O-N 3.02Å; A77-H80 WeakPolarHBondContact O-CB 3.31Å; A77-H80 PolarHBondContact O-N 3.39Å; A77-L81 VanDerWaalsContact O-CG 3.28Å; A77-L81 WeakPolarHBondContact O-CG 3.42Å; A77-L81 PolarHBondContact O-N 3.04Å; A77-L163 HydrophobicContact CB-CD1 4.25Å
78I96.3Very high93.9Very high77 Ų7749.2 Ų49.240%0.39528%0.277SS..Hα-helixtrans-68.2-43.9178.4-60.5164.9000110.8C74 G75 G76 H80 L81 I82 L192C74-I78 VanDerWaalsContact O-CG1 3.29Å; C74-I78 WeakPolarHBondContact O-CG1 3Å; C74-I78 PolarHBondContact O-N 3.25Å; G75-I78 PolarHBondContact O-N 3.32Å; G76-I78 PolarHBondContact O-N 3.44Å; I78-H80 VanDerWaalsContact C-N 3.32Å; I78-H80 PolarHBondContact O-N 3.28Å; I78-L81 PolarHBondContact O-N 3.4Å; I78-I82 HydrophobicContact CG2-CD1 3.93Å; I78-I82 WeakPolarHBondContact O-CG1 3.24Å; I78-I82 PolarHBondContact O-N 3.09Å; I78-I82 VanDerWaalsContact O-N 3.14Å; I78-L192 HydrophobicContact CB-CD2 4.13Å; I78-L192 HydrophobicContact CG2-CD1 4.32Å; I78-L192 HydrophobicContact CG2-CD2 3.43Å; I78-L192 VanDerWaalsContact CG2-CD2 3.43Å
79F96.7Very high93.6Very high0 Ų055.7 Ų55.70%030%0.304CS..Hα-helixtrans-59.9-42.7174.8-79.6-64.8000112G75 G76 L81 I82 E83 W161 F169 L192 C193 F196G75-F79 WeakPolarHBondContact O-CD2 3.45Å; G75-F79 PolarHBondContact O-N 3.22Å; G76-F79 PolarHBondContact O-N 2.84Å; F79-L81 VanDerWaalsContact C-N 3.34Å; F79-L81 PolarHBondContact O-N 2.87Å; F79-I82 PolarHBondContact O-N 3.22Å; F79-E83 PolarHBondContact O-N 2.9Å; F79-W161 HydrophobicContact CB-CZ3 3.93Å; F79-F169 HydrophobicContact CD1-CD1 4.38Å; F79-F169 AromaticContact CD1-CE1 3.86Å; F79-F169 HydrophobicContact CD1-CE1 3.86Å; F79-F169 AromaticContact CD2-CD1 3.91Å; F79-F169 HydrophobicContact CD2-CD1 3.91Å; F79-F169 AromaticContact CD2-CE1 3.85Å; F79-F169 HydrophobicContact CD2-CE1 3.85Å; F79-F169 AromaticContact CE1-CE1 3.78Å; F79-F169 HydrophobicContact CE1-CE1 3.78Å; F79-F169 HydrophobicContact CE2-CD1 4.22Å; F79-F169 AromaticContact CE2-CE1 3.78Å; F79-F169 HydrophobicContact CE2-CE1 3.78Å; F79-F169 HydrophobicContact CG-CD1 4.02Å; F79-F169 AromaticContact CG-CE1 3.92Å; F79-F169 HydrophobicContact CG-CE1 3.92Å; F79-F169 AromaticContact CZ-CE1 3.75Å; F79-F169 HydrophobicContact CZ-CE1 3.75Å; F79-L192 HydrophobicContact CD1-CD2 3.83Å; F79-L192 HydrophobicContact CD2-CD2 4.37Å; F79-L192 HydrophobicContact CE1-CB 4.21Å; F79-L192 HydrophobicContact CE1-CD2 3.66Å; F79-L192 HydrophobicContact CE1-CG 3.92Å; F79-L192 HydrophobicContact CE2-CD2 4.22Å; F79-L192 HydrophobicContact CE2-CG 4.35Å; F79-L192 HydrophobicContact CG-CD2 4.16Å; F79-L192 HydrophobicContact CZ-CB 4.37Å; F79-L192 HydrophobicContact CZ-CD2 3.85Å; F79-L192 HydrophobicContact CZ-CG 3.78Å; F79-C193 HydrophobicContact CE1-CB 4.23Å; F79-C193 HydrophobicContact CZ-CB 4.06Å; F79-F196 HydrophobicContact CE2-CD1 4.06Å; F79-F196 HydrophobicContact CE2-CE1 4.48Å; F79-F196 HydrophobicContact CE2-CG 4.21Å
80H95.7Very high93.1Very high54 Ų5455 Ų5525%0.2529%0.294CS..Hα-helixtrans-56.5-48.6174.617957.4000111.3G76 A77 I78 I82 S84 W161 L163 S166G76-H80 WeakPolarHBondContact O-CB 3.41Å; G76-H80 PolarHBondContact O-N 3.32Å; A77-H80 WeakPolarHBondContact O-CB 3.31Å; A77-H80 PolarHBondContact O-N 3.39Å; I78-H80 VanDerWaalsContact C-N 3.32Å; I78-H80 PolarHBondContact O-N 3.28Å; H80-I82 VanDerWaalsContact C-N 3.33Å; H80-I82 PolarHBondContact O-N 3.46Å; H80-S84 WeakPolarHBondContact O-CB 3.22Å; H80-S84 PolarHBondContact O-N 3.19Å; H80-S84 VanDerWaalsContact O-N 3.13Å; H80-S84 PolarHBondContact O-OG 2.85Å; H80-W161 PolarHBondContact CE1-O 3.25Å; H80-W161 PolarHBondContact ND1-O 3.44Å; H80-L163 HydrophobicContact CB-CD1 4.31Å; H80-S166 WeakPolarHBondContact CA-OG 3.34Å; H80-S166 WeakPolarHBondContact CB-OG 3.45Å
81L94.4Very high92.5Very high124 Ų12450.3 Ų50.365%0.64927%0.269SS*.Hα-helixtrans-62.6-37.5-177.7-70170.3000113.1A77 I78 F79A77-L81 VanDerWaalsContact O-CG 3.28Å; A77-L81 WeakPolarHBondContact O-CG 3.42Å; A77-L81 PolarHBondContact O-N 3.04Å; I78-L81 PolarHBondContact O-N 3.4Å; F79-L81 VanDerWaalsContact C-N 3.34Å; F79-L81 PolarHBondContact O-N 2.87Å
82I93.4Very high91.9Very high51 Ų5150.6 Ų50.626%0.26228%0.276SS..Hα-helixtrans-80.6-55.7-177.2-64173000111.2I78 F79 H80 T186 S188 L192I78-I82 HydrophobicContact CG2-CD1 3.93Å; I78-I82 WeakPolarHBondContact O-CG1 3.24Å; I78-I82 PolarHBondContact O-N 3.09Å; I78-I82 VanDerWaalsContact O-N 3.14Å; F79-I82 PolarHBondContact O-N 3.22Å; H80-I82 VanDerWaalsContact C-N 3.33Å; H80-I82 PolarHBondContact O-N 3.46Å; I82-T186 HydrophobicContact CG2-CG2 4.38Å; I82-T186 VanDerWaalsContact CG2-OG1 3.32Å; I82-T186 WeakPolarHBondContact CG2-OG1 3.43Å; I82-S188 WeakPolarHBondContact CG2-OG 3.39Å; I82-L192 HydrophobicContact CD1-CD2 4Å
83E93Very high91.3Very high3 Ų353.5 Ų53.51%0.01430%0.298CS..Hα-helixtrans-82.3-28.5-168-65.2-65.8144.900112.8F79 S85 H86 E87 W161 P184 R185 T186F79-E83 PolarHBondContact O-N 2.9Å; E83-S85 PolarHBondContact O-N 3.22Å; E83-H86 PolarHBondContact O-N 3.08Å; E83-E87 WeakPolarHBondContact O-CB 3.47Å; E83-E87 PolarHBondContact O-N 3.44Å; E83-W161 HydrophobicContact CB-CD2 3.68Å; E83-W161 VanDerWaalsContact CB-CE2 3.5Å; E83-W161 HydrophobicContact CB-CE3 4.35Å; E83-W161 HydrophobicContact CB-CG 3.83Å; E83-W161 HydrophobicContact CB-CZ2 3.99Å; E83-W161 HydrophobicContact CG-CD2 4.44Å; E83-W161 HydrophobicContact CG-CH2 4.36Å; E83-W161 HydrophobicContact CG-CZ2 3.89Å; E83-P184 HydrophobicContact CG-CB 4.44Å; E83-R185 PolarHBondContact OE2-N 3.3Å; E83-R185 VanDerWaalsContact OE2-N 3.12Å; E83-T186 VanDerWaalsContact OE1-CB 3.29Å; E83-T186 WeakPolarHBondContact OE1-CB 3.11Å; E83-T186 WeakPolarHBondContact OE1-CG2 3.5Å; E83-T186 PolarHBondContact OE1-N 3.24Å; E83-T186 PolarHBondContact OE1-OG1 2.84Å
84S91Very high90.6Very high28 Ų2851.2 Ų51.220%0.19628%0.284CS..Hα-helixtrans-63.7-40.6-178.665.90000113.1H80 H86 H88H80-S84 WeakPolarHBondContact O-CB 3.22Å; H80-S84 PolarHBondContact O-N 3.19Å; H80-S84 VanDerWaalsContact O-N 3.13Å; H80-S84 PolarHBondContact O-OG 2.85Å; S84-H86 VanDerWaalsContact C-N 3.32Å; S84-H88 PolarHBondContact O-N 3.47Å; S84-H88 VanDerWaalsContact O-N 3.13Å
85S89.5Confident90Very high86 Ų8650.4 Ų50.460%0.60128%0.275SS*.Hα-helixtrans-67.1-37.8177.5-62.80000111.2E83 K89E83-S85 PolarHBondContact O-N 3.22Å; S85-K89 PolarHBondContact O-N 3.06Å
86H89.3Confident89.5Confident58 Ų5855.8 Ų55.827%0.26930%0.299SS..Hα-helixtrans-69.4-45177.8-174.869.7000111.9E83 S84 H88 K89 I90 T186E83-H86 PolarHBondContact O-N 3.08Å; S84-H86 VanDerWaalsContact C-N 3.32Å; H86-H88 PolarHBondContact O-N 3.2Å; H86-K89 PolarHBondContact O-N 3.27Å; H86-I90 VanDerWaalsContact CE1-CD1 3.42Å; H86-I90 WeakPolarHBondContact CE1-CD1 3.25Å; H86-I90 WeakPolarHBondContact NE2-CD1 3.48Å; H86-I90 PolarHBondContact O-N 3Å; H86-T186 HydrophobicContact CB-CG2 3.7Å; H86-T186 VanDerWaalsContact CD2-CG2 3.44Å; H86-T186 WeakPolarHBondContact CD2-CG2 3.44Å
87E87.5Confident89.1Confident13 Ų1357.5 Ų57.56%0.06131%0.313CS..Hα-helixtrans-55.4-50.5176.1-173.9-166.8165.900110.8E83 K89 I90 K91 Q160 W161E83-E87 WeakPolarHBondContact O-CB 3.47Å; E83-E87 PolarHBondContact O-N 3.44Å; E87-K89 VanDerWaalsContact C-N 3.29Å; E87-K89 PolarHBondContact O-N 2.91Å; E87-I90 PolarHBondContact O-N 2.61Å; E87-K91 WeakPolarHBondContact O-CB 3.14Å; E87-K91 PolarHBondContact O-N 3.3Å; E87-Q160 PolarHBondContact OE1-N 3.14Å; E87-Q160 PolarHBondContact OE2-N 3.1Å; E87-W161 WeakPolarHBondContact OE2-CB 3.31Å; E87-W161 PolarHBondContact OE2-N 2.73Å
88H85.3Confident88.6Confident117 Ų11756.3 Ų56.354%0.54230%0.302SS..Hα-helixtrans-58.4-42.3-179.7-179-84.7000112.2S84 H86 T92S84-H88 PolarHBondContact O-N 3.47Å; S84-H88 VanDerWaalsContact O-N 3.13Å; H86-H88 PolarHBondContact O-N 3.2Å; H88-T92 WeakPolarHBondContact O-CB 3.23Å; H88-T92 PolarHBondContact O-N 2.84Å; H88-T92 VanDerWaalsContact O-N 3.07Å; H88-T92 PolarHBondContact O-OG1 3.39Å
89K86.9Confident88.2Confident158 Ų15856.3 Ų56.369%0.68730%0.3SS*.Hα-helixtrans-64.6-48.1179.4-174.8179.7178.5-177.60111.6S85 H86 E87 S93S85-K89 PolarHBondContact O-N 3.06Å; H86-K89 PolarHBondContact O-N 3.27Å; E87-K89 VanDerWaalsContact C-N 3.29Å; E87-K89 PolarHBondContact O-N 2.91Å; K89-S93 WeakPolarHBondContact O-CB 3.32Å; K89-S93 PolarHBondContact O-N 3.2Å; K89-S93 VanDerWaalsContact O-N 3.08Å
90I84.2Confident88Confident35 Ų3560.9 Ų60.918%0.17932%0.324CS..Hα-helixtrans-68.1-46.8-178.9-63.9179.8000110.6H86 E87 T92 S93 S94 Y146H86-I90 VanDerWaalsContact CE1-CD1 3.42Å; H86-I90 WeakPolarHBondContact CE1-CD1 3.25Å; H86-I90 WeakPolarHBondContact NE2-CD1 3.48Å; H86-I90 PolarHBondContact O-N 3Å; E87-I90 PolarHBondContact O-N 2.61Å; I90-T92 VanDerWaalsContact C-N 3.32Å; I90-T92 PolarHBondContact O-N 3.33Å; I90-S93 WeakPolarHBondContact O-CB 3.48Å; I90-S93 PolarHBondContact O-N 2.86Å; I90-S93 VanDerWaalsContact O-N 3.09Å; I90-S94 PolarHBondContact O-N 2.84Å; I90-S94 PolarHBondContact O-OG 3.07Å; I90-S94 VanDerWaalsContact O-OG 3.1Å; I90-Y146 HydrophobicContact CB-CD1 3.97Å; I90-Y146 HydrophobicContact CB-CE1 3.83Å; I90-Y146 HydrophobicContact CD1-CE1 3.65Å; I90-Y146 WeakPolarHBondContact CD1-OH 3.28Å; I90-Y146 HydrophobicContact CG1-CE1 4.34Å; I90-Y146 HydrophobicContact CG2-CD1 3.48Å; I90-Y146 VanDerWaalsContact CG2-CD1 3.48Å; I90-Y146 HydrophobicContact CG2-CD2 3.71Å; I90-Y146 HydrophobicContact CG2-CE1 3.44Å; I90-Y146 VanDerWaalsContact CG2-CE1 3.44Å; I90-Y146 HydrophobicContact CG2-CE2 3.65Å; I90-Y146 HydrophobicContact CG2-CG 3.64Å
91K81.9Confident87.8Confident6 Ų660.2 Ų60.23%0.02632%0.324CS..Hα-helixtrans-56.8-45.2179.6-171.4167.2-175.4160.70112E87 I95 D151 R158E87-K91 WeakPolarHBondContact O-CB 3.14Å; E87-K91 PolarHBondContact O-N 3.3Å; K91-I95 HydrophobicContact CG-CD1 3.96Å; K91-I95 WeakPolarHBondContact O-CB 2.87Å; K91-I95 WeakPolarHBondContact O-CD1 3.4Å; K91-I95 WeakPolarHBondContact O-CG1 3.39Å; K91-I95 PolarHBondContact O-N 3.37Å; K91-D151 VanDerWaalsContact CE-CG 3.44Å; K91-D151 WeakPolarHBondContact CE-OD1 3.48Å; K91-D151 IonicContact NZ-OD1 2.94Å; K91-D151 PolarHBondContact NZ-OD1 3.28Å; K91-D151 IonicContact NZ-OD2 3.86Å; K91-D151 PolarHBondContact NZ-OD2 3.42Å; K91-D151 VanDerWaalsContact NZ-OD2 3.09Å; K91-R158 PolarHBondContact NZ-O 3.08Å; K91-R158 VanDerWaalsContact NZ-O 3.09Å
92T83.3Confident87.7Confident59 Ų5954.8 Ų54.836%0.36230%0.295SS..Hα-helixtrans-64.1-43.3176.6-55.40000111.7H88 I90 H96H88-T92 WeakPolarHBondContact O-CB 3.23Å; H88-T92 PolarHBondContact O-N 2.84Å; H88-T92 VanDerWaalsContact O-N 3.07Å; H88-T92 PolarHBondContact O-OG1 3.39Å; I90-T92 VanDerWaalsContact C-N 3.32Å; I90-T92 PolarHBondContact O-N 3.33Å; T92-H96 WeakPolarHBondContact O-CB 3.42Å; T92-H96 PolarHBondContact O-N 3.35Å
93S85.3Confident87.7Confident77 Ų7755.5 Ų55.554%0.53830%0.3SS..Hα-helixtrans-62.7-45.6178.5-170.90000112.2K89 I90 H96 A97K89-S93 WeakPolarHBondContact O-CB 3.32Å; K89-S93 PolarHBondContact O-N 3.2Å; K89-S93 VanDerWaalsContact O-N 3.08Å; I90-S93 WeakPolarHBondContact O-CB 3.48Å; I90-S93 PolarHBondContact O-N 2.86Å; I90-S93 VanDerWaalsContact O-N 3.09Å; S93-H96 PolarHBondContact O-N 2.94Å; S93-A97 WeakPolarHBondContact O-CB 3.4Å; S93-A97 PolarHBondContact O-N 3.24Å
94S83.1Confident87.8Confident24 Ų2458.8 Ų58.817%0.16832%0.323CS..Hα-helixtrans-68.8-40.6-178.7-57.90000112I90 H96 A97 L98I90-S94 PolarHBondContact O-N 2.84Å; I90-S94 PolarHBondContact O-OG 3.07Å; I90-S94 VanDerWaalsContact O-OG 3.1Å; S94-H96 VanDerWaalsContact C-N 3.32Å; S94-H96 PolarHBondContact O-N 2.54Å; S94-A97 PolarHBondContact O-N 2.83Å; S94-L98 VanDerWaalsContact O-CB 3.27Å; S94-L98 WeakPolarHBondContact O-CB 3.02Å; S94-L98 PolarHBondContact O-N 3.28Å
95I82.5Confident88Confident51 Ų5157.8 Ų57.826%0.26232%0.315SS..Hα-helixtrans-61.5-43173.9-69.9167.2000110.6K91 L98 E99 I147 Q157K91-I95 HydrophobicContact CG-CD1 3.96Å; K91-I95 WeakPolarHBondContact O-CB 2.87Å; K91-I95 WeakPolarHBondContact O-CD1 3.4Å; K91-I95 WeakPolarHBondContact O-CG1 3.39Å; K91-I95 PolarHBondContact O-N 3.37Å; I95-L98 WeakPolarHBondContact O-CB 3.32Å; I95-L98 PolarHBondContact O-N 2.97Å; I95-E99 WeakPolarHBondContact O-CB 3.29Å; I95-E99 PolarHBondContact O-N 3.39Å; I95-I147 HydrophobicContact CG1-CD1 4.13Å; I95-Q157 HydrophobicContact CD1-CG 4.37Å
96H85.8Confident88.3Confident117 Ų11753.7 Ų53.754%0.54229%0.287SS..Hα-helixtrans-65.9-43.6178.3-174-92.9000112.1T92 S93 S94 L98 E99 L100T92-H96 WeakPolarHBondContact O-CB 3.42Å; T92-H96 PolarHBondContact O-N 3.35Å; S93-H96 PolarHBondContact O-N 2.94Å; S94-H96 VanDerWaalsContact C-N 3.32Å; S94-H96 PolarHBondContact O-N 2.54Å; H96-L98 VanDerWaalsContact C-N 3.26Å; H96-L98 PolarHBondContact O-N 2.99Å; H96-E99 PolarHBondContact O-N 2.78Å; H96-L100 VanDerWaalsContact CE1-CD1 3.43Å; H96-L100 WeakPolarHBondContact CE1-CD1 3.38Å; H96-L100 WeakPolarHBondContact O-CG 3.43Å; H96-L100 PolarHBondContact O-N 2.92Å
97A89.3Confident88.5Confident36 Ų3657.2 Ų57.230%0.29830%0.301SS..Hα-helixtrans-60.1-38.8174.500000111.8S93 S94 T101 L137S93-A97 WeakPolarHBondContact O-CB 3.4Å; S93-A97 PolarHBondContact O-N 3.24Å; S94-A97 PolarHBondContact O-N 2.83Å; A97-T101 WeakPolarHBondContact O-CB 3.48Å; A97-T101 PolarHBondContact O-N 3.34Å; A97-T101 PolarHBondContact O-OG1 3.33Å; A97-L137 HydrophobicContact CB-CD2 4.06Å
98L87Confident88.7Confident8 Ų858.8 Ų58.84%0.04231%0.312CS..Hα-helixtrans-65-47.6177.9-178.364.8000111S94 I95 H96 L100 T101 K102 L134 L137 L138S94-L98 VanDerWaalsContact O-CB 3.27Å; S94-L98 WeakPolarHBondContact O-CB 3.02Å; S94-L98 PolarHBondContact O-N 3.28Å; I95-L98 WeakPolarHBondContact O-CB 3.32Å; I95-L98 PolarHBondContact O-N 2.97Å; H96-L98 VanDerWaalsContact C-N 3.26Å; H96-L98 PolarHBondContact O-N 2.99Å; L98-L100 PolarHBondContact O-N 3.37Å; L98-T101 PolarHBondContact O-N 3.43Å; L98-K102 WeakPolarHBondContact O-CG 3.19Å; L98-K102 PolarHBondContact O-N 2.91Å; L98-L134 HydrophobicContact CD1-CD1 3.4Å; L98-L137 VanDerWaalsContact CA-CD2 3.45Å; L98-L137 HydrophobicContact CB-CD2 4.04Å; L98-L137 HydrophobicContact CD1-CD2 4.16Å; L98-L137 HydrophobicContact CD1-CG 4.27Å; L98-L138 HydrophobicContact CD1-CD2 3.74Å; L98-L138 HydrophobicContact CD1-CG 3.98Å; L98-L138 HydrophobicContact CD2-CD2 3.89Å; L98-L138 HydrophobicContact CG-CD2 4.48Å
99E87.5Confident89.2Confident77 Ų7753.3 Ų53.336%0.3629%0.286SS..Hα-helixtrans-63.5-40.9178.1-169.460.5-153.700112.3I95 H96 K102 N103 M379I95-E99 WeakPolarHBondContact O-CB 3.29Å; I95-E99 PolarHBondContact O-N 3.39Å; H96-E99 PolarHBondContact O-N 2.78Å; E99-K102 PolarHBondContact O-N 2.88Å; E99-N103 WeakPolarHBondContact O-CB 3.49Å; E99-N103 PolarHBondContact O-N 3.25Å; E99-N103 PolarHBondContact O-ND2 3.34Å; E99-N103 PolarHBondContact OE1-ND2 3.04Å; E99-M379 WeakPolarHBondContact OE1-CE 3.44Å
100L91.8Very high89.5Confident97 Ų9747.4 Ų47.451%0.50826%0.26SS..Hα-helixtrans-62.3-43.8174.6-73.3179.1000112H96 L98 N103 S104H96-L100 VanDerWaalsContact CE1-CD1 3.43Å; H96-L100 WeakPolarHBondContact CE1-CD1 3.38Å; H96-L100 WeakPolarHBondContact O-CG 3.43Å; H96-L100 PolarHBondContact O-N 2.92Å; L98-L100 PolarHBondContact O-N 3.37Å; L100-N103 PolarHBondContact O-N 2.95Å; L100-S104 WeakPolarHBondContact O-CB 3.49Å; L100-S104 PolarHBondContact O-N 2.85Å
101T92.4Very high89.9Confident40 Ų4050 Ų5025%0.24527%0.274CS..Hα-helixtrans-63.9-43.8179-56.20000111A97 L98 S104 F105 P133 L134A97-T101 WeakPolarHBondContact O-CB 3.48Å; A97-T101 PolarHBondContact O-N 3.34Å; A97-T101 PolarHBondContact O-OG1 3.33Å; L98-T101 PolarHBondContact O-N 3.43Å; T101-S104 PolarHBondContact O-N 2.95Å; T101-F105 WeakPolarHBondContact O-CB 3.31Å; T101-F105 PolarHBondContact O-N 3.18Å; T101-P133 HydrophobicContact CG2-CB 4.2Å; T101-L134 HydrophobicContact CG2-CB 4.3Å
102K92.6Very high90.4Very high9 Ų952 Ų524%0.03929%0.285CS..Hα-helixtrans-58.1-50.1174.4-71.5177.5-173.7-177.40111.8L98 E99 S104 F105 L106 L134 M379 L382 E386L98-K102 WeakPolarHBondContact O-CG 3.19Å; L98-K102 PolarHBondContact O-N 2.91Å; E99-K102 PolarHBondContact O-N 2.88Å; K102-S104 VanDerWaalsContact C-N 3.31Å; K102-S104 PolarHBondContact O-N 3.15Å; K102-F105 WeakPolarHBondContact O-CB 3.11Å; K102-F105 PolarHBondContact O-N 2.87Å; K102-L106 WeakPolarHBondContact O-CB 3.49Å; K102-L106 VanDerWaalsContact O-CG 3.32Å; K102-L106 WeakPolarHBondContact O-CG 3.47Å; K102-L106 PolarHBondContact O-N 2.89Å; K102-L134 HydrophobicContact CD-CD1 4.45Å; K102-L134 HydrophobicContact CG-CD1 3.59Å; K102-L134 HydrophobicContact CG-CD2 4.37Å; K102-M379 HydrophobicContact CB-SD 4.14Å; K102-M379 HydrophobicContact CD-CE 4.12Å; K102-M379 HydrophobicContact CD-SD 4.28Å; K102-L382 HydrophobicContact CB-CD2 4.32Å; K102-L382 HydrophobicContact CD-CD2 4.08Å; K102-L382 HydrophobicContact CG-CD2 3.87Å; K102-E386 WeakPolarHBondContact CE-OE1 3.33Å; K102-E386 IonicContact NZ-OE1 2.71Å; K102-E386 PolarHBondContact NZ-OE1 2.87Å; K102-E386 IonicContact NZ-OE2 2.78Å; K102-E386 PolarHBondContact NZ-OE2 2.9Å
103N93.1Very high90.7Very high67 Ų6749.5 Ų49.536%0.35827%0.27SS..Hα-helixtrans-63.8-37.9-179.8-74.4-50.7000112.2E99 L100 K107E99-N103 WeakPolarHBondContact O-CB 3.49Å; E99-N103 PolarHBondContact O-N 3.25Å; E99-N103 PolarHBondContact O-ND2 3.34Å; E99-N103 PolarHBondContact OE1-ND2 3.04Å; L100-N103 PolarHBondContact O-N 2.95Å; N103-K107 VanDerWaalsContact O-CB 3.25Å; N103-K107 WeakPolarHBondContact O-CB 3.27Å; N103-K107 PolarHBondContact O-N 3.14Å
104S94.3Very high90.9Very high72 Ų7250.7 Ų50.750%0.50327%0.267SS..Hα-helixtrans-64-46.7174.8-172.30000112L100 T101 K102 T108L100-S104 WeakPolarHBondContact O-CB 3.49Å; L100-S104 PolarHBondContact O-N 2.85Å; T101-S104 PolarHBondContact O-N 2.95Å; K102-S104 VanDerWaalsContact C-N 3.31Å; K102-S104 PolarHBondContact O-N 3.15Å; S104-T108 WeakPolarHBondContact O-CB 3.18Å; S104-T108 PolarHBondContact O-N 3.31Å; S104-T108 PolarHBondContact O-OG1 3.49Å
105F95.3Very high91.1Very high7 Ų753.2 Ų53.23%0.03128%0.281CS..Hα-helixtrans-56.9-55.1174.9165.9-105.4000110.9T101 K102 K107 T108 M109 Q130 M131 F356 L357T101-F105 WeakPolarHBondContact O-CB 3.31Å; T101-F105 PolarHBondContact O-N 3.18Å; K102-F105 WeakPolarHBondContact O-CB 3.11Å; K102-F105 PolarHBondContact O-N 2.87Å; F105-K107 PolarHBondContact O-N 2.85Å; F105-T108 WeakPolarHBondContact O-CB 3.42Å; F105-T108 PolarHBondContact O-N 3.33Å; F105-T108 VanDerWaalsContact O-N 3.12Å; F105-M109 HydrophobicContact CD2-CG 3.86Å; F105-M109 HydrophobicContact CE1-CG 4.23Å; F105-M109 HydrophobicContact CE2-CG 3.46Å; F105-M109 VanDerWaalsContact CE2-CG 3.46Å; F105-M109 HydrophobicContact CE2-SD 3.94Å; F105-M109 HydrophobicContact CG-CG 4.4Å; F105-M109 HydrophobicContact CZ-CG 3.66Å; F105-M109 WeakPolarHBondContact O-CG 3.5Å; F105-M109 PolarHBondContact O-N 2.9Å; F105-Q130 HydrophobicContact CD2-CB 3.75Å; F105-Q130 WeakPolarHBondContact CD2-O 3.32Å; F105-Q130 HydrophobicContact CE2-CB 3.92Å; F105-M131 HydrophobicContact CE1-CE 4.36Å; F105-M131 HydrophobicContact CE2-CB 4.2Å; F105-M131 HydrophobicContact CE2-CE 4.49Å; F105-M131 HydrophobicContact CZ-CE 3.78Å; F105-F356 AromaticContact CE1-CE1 3.8Å; F105-F356 HydrophobicContact CE1-CE1 3.8Å; F105-F356 HydrophobicContact CE1-CZ 4.11Å; F105-F356 HydrophobicContact CZ-CE1 4.02Å; F105-L357 HydrophobicContact CZ-CD2 4.29Å
106L95.1Very high90.9Very high0 Ų059.3 Ų59.30%031%0.309CS..Hα-helixtrans-58.8-45.1-178.6-71.5-175000112.5K102 T108 M109 W110 F356 W374 A378 M379K102-L106 WeakPolarHBondContact O-CB 3.49Å; K102-L106 VanDerWaalsContact O-CG 3.32Å; K102-L106 WeakPolarHBondContact O-CG 3.47Å; K102-L106 PolarHBondContact O-N 2.89Å; L106-T108 VanDerWaalsContact C-N 3.31Å; L106-T108 PolarHBondContact O-N 3.42Å; L106-M109 PolarHBondContact O-N 3.45Å; L106-W110 WeakPolarHBondContact O-CB 3.37Å; L106-W110 PolarHBondContact O-N 2.94Å; L106-F356 HydrophobicContact CD2-CZ 4.3Å; L106-W374 HydrophobicContact CB-CH2 4.48Å; L106-W374 HydrophobicContact CB-CZ3 3.91Å; L106-W374 HydrophobicContact CD2-CH2 3.94Å; L106-W374 HydrophobicContact CD2-CZ3 3.94Å; L106-W374 HydrophobicContact CG-CZ3 4.44Å; L106-W374 WeakPolarHBondContact O-CZ3 3.28Å; L106-A378 HydrophobicContact CD1-CB 4.02Å; L106-A378 HydrophobicContact CD2-CB 3.55Å; L106-A378 HydrophobicContact CG-CB 4.42Å; L106-M379 HydrophobicContact CD1-CG 3.68Å; L106-M379 HydrophobicContact CD1-SD 3.65Å
107K93.3Very high90.8Very high131 Ų13161.3 Ų61.357%0.5732%0.323SS*.Hα-helixtrans-61.5-39.8176.7-174.2176.6-178.6179.20112.3N103 F105 N111N103-K107 VanDerWaalsContact O-CB 3.25Å; N103-K107 WeakPolarHBondContact O-CB 3.27Å; N103-K107 PolarHBondContact O-N 3.14Å; F105-K107 PolarHBondContact O-N 2.85Å; K107-N111 PolarHBondContact O-N 2.96Å; K107-N111 VanDerWaalsContact O-N 3.11Å; K107-N111 PolarHBondContact O-ND2 3.47Å
108T93.6Very high90.6Very high47 Ų4762 Ų6229%0.28832%0.32SS..Hα-helixtrans-66.8-46.9177.6-56.20000110.7S104 F105 L106 W110 N111 L112S104-T108 WeakPolarHBondContact O-CB 3.18Å; S104-T108 PolarHBondContact O-N 3.31Å; S104-T108 PolarHBondContact O-OG1 3.49Å; F105-T108 WeakPolarHBondContact O-CB 3.42Å; F105-T108 PolarHBondContact O-N 3.33Å; F105-T108 VanDerWaalsContact O-N 3.12Å; L106-T108 VanDerWaalsContact C-N 3.31Å; L106-T108 PolarHBondContact O-N 3.42Å; T108-W110 VanDerWaalsContact C-N 3.34Å; T108-W110 PolarHBondContact O-N 3.28Å; T108-N111 PolarHBondContact O-N 3.45Å; T108-L112 HydrophobicContact CG2-CD1 4.3Å; T108-L112 WeakPolarHBondContact O-CG 3.48Å; T108-L112 PolarHBondContact O-N 3.41Å
109M94.7Very high90.8Very high2 Ų264.5 Ų64.51%0.0134%0.336CS..Hα-helixtrans-64.2-36.6178.8-66.6-49-63.900112.9F105 L106 L112 S113 W123 Q130 L357 W374F105-M109 HydrophobicContact CD2-CG 3.86Å; F105-M109 HydrophobicContact CE1-CG 4.23Å; F105-M109 HydrophobicContact CE2-CG 3.46Å; F105-M109 VanDerWaalsContact CE2-CG 3.46Å; F105-M109 HydrophobicContact CE2-SD 3.94Å; F105-M109 HydrophobicContact CG-CG 4.4Å; F105-M109 HydrophobicContact CZ-CG 3.66Å; F105-M109 WeakPolarHBondContact O-CG 3.5Å; F105-M109 PolarHBondContact O-N 2.9Å; L106-M109 PolarHBondContact O-N 3.45Å; M109-L112 HydrophobicContact SD-CD1 4.28Å; M109-S113 WeakPolarHBondContact O-CB 3.41Å; M109-S113 PolarHBondContact O-N 3.19Å; M109-W123 HydrophobicContact CB-CZ2 4.37Å; M109-W123 HydrophobicContact CE-CD2 3.79Å; M109-W123 HydrophobicContact CE-CE3 4.44Å; M109-W123 HydrophobicContact CE-CG 4.2Å; M109-W123 HydrophobicContact CE-CH2 4.17Å; M109-W123 HydrophobicContact CE-CZ2 3.5Å; M109-W123 VanDerWaalsContact CE-CZ2 3.5Å; M109-W123 PolarHBondContact O-NE1 3.2Å; M109-Q130 HydrophobicContact SD-CB 4.23Å; M109-Q130 HydrophobicContact SD-CG 4.36Å; M109-L357 HydrophobicContact CE-CD2 4.25Å; M109-W374 HydrophobicContact CB-CH2 4.13Å
110W93Very high91.1Very high33 Ų3363.9 Ų63.913%0.12533%0.334CS..Hα-helixtrans-61.5-52.5172174.9-97.1000111.1L106 T108 L112 S113 Q114 I371 W374L106-W110 WeakPolarHBondContact O-CB 3.37Å; L106-W110 PolarHBondContact O-N 2.94Å; T108-W110 VanDerWaalsContact C-N 3.34Å; T108-W110 PolarHBondContact O-N 3.28Å; W110-L112 VanDerWaalsContact C-N 3.29Å; W110-L112 PolarHBondContact O-N 2.77Å; W110-S113 WeakPolarHBondContact O-CB 3.31Å; W110-S113 PolarHBondContact O-N 3Å; W110-S113 PolarHBondContact O-OG 3.49Å; W110-Q114 HydrophobicContact CD2-CG 4.46Å; W110-Q114 HydrophobicContact CZ2-CG 4.2Å; W110-Q114 WeakPolarHBondContact O-CG 3.49Å; W110-Q114 PolarHBondContact O-N 3.09Å; W110-I371 HydrophobicContact CD2-CB 4.48Å; W110-I371 HydrophobicContact CD2-CG1 4.12Å; W110-I371 HydrophobicContact CG-CD1 3.99Å; W110-I371 HydrophobicContact CG-CG1 4.03Å; W110-I371 HydrophobicContact CZ2-CB 4.32Å; W110-W374 HydrophobicContact CB-CE3 4.35Å; W110-W374 HydrophobicContact CB-CH2 4.44Å; W110-W374 HydrophobicContact CB-CZ3 4.1Å; W110-W374 HydrophobicContact CE3-CB 4.02Å; W110-W374 AromaticContact CE3-CD1 3.99Å; W110-W374 AromaticContact CE3-CD2 3.7Å; W110-W374 HydrophobicContact CE3-CD2 3.7Å; W110-W374 HydrophobicContact CE3-CE3 4.09Å; W110-W374 AromaticContact CE3-CG 3.64Å; W110-W374 HydrophobicContact CE3-CG 3.64Å; W110-W374 HydrophobicContact CZ3-CB 3.79Å; W110-W374 AromaticContact CZ3-CD1 3.81Å; W110-W374 HydrophobicContact CZ3-CD2 4.23Å; W110-W374 AromaticContact CZ3-CG 3.67Å; W110-W374 HydrophobicContact CZ3-CG 3.67Å
111N92.1Very high91.1Very high89 Ų8962.8 Ų62.848%0.47634%0.335SS..Hα-helixtrans-58.7-40.7-179.9-69.4-15.7000112.2K107 T108 S113 Q114 T115K107-N111 PolarHBondContact O-N 2.96Å; K107-N111 VanDerWaalsContact O-N 3.11Å; K107-N111 PolarHBondContact O-ND2 3.47Å; T108-N111 PolarHBondContact O-N 3.45Å; N111-S113 VanDerWaalsContact C-N 3.34Å; N111-Q114 PolarHBondContact O-N 3.35Å; N111-T115 PolarHBondContact O-OG1 2.9Å
112L92.5Very high91.1Very high48 Ų4865.3 Ų65.325%0.25134%0.344SS..Hα-helixtrans-63.7-39.2174.7-71.2174.3000112T108 M109 W110 Q114 T115 F118 A126T108-L112 HydrophobicContact CG2-CD1 4.3Å; T108-L112 WeakPolarHBondContact O-CG 3.48Å; T108-L112 PolarHBondContact O-N 3.41Å; M109-L112 HydrophobicContact SD-CD1 4.28Å; W110-L112 VanDerWaalsContact C-N 3.29Å; W110-L112 PolarHBondContact O-N 2.77Å; L112-Q114 PolarHBondContact O-N 3.31Å; L112-T115 WeakPolarHBondContact O-CB 3.36Å; L112-T115 PolarHBondContact O-N 2.94Å; L112-T115 VanDerWaalsContact O-N 3.15Å; L112-T115 PolarHBondContact O-OG1 3.33Å; L112-F118 HydrophobicContact CB-CD1 4.48Å; L112-F118 HydrophobicContact CB-CE1 4.11Å; L112-A126 HydrophobicContact CD1-CB 4.23Å
113S90.3Very high91.2Very high7 Ų765 Ų655%0.04934%0.342CS..Hα-helixtrans-65.9-23.717976.50000114.3M109 W110 N111 T115 S364M109-S113 WeakPolarHBondContact O-CB 3.41Å; M109-S113 PolarHBondContact O-N 3.19Å; W110-S113 WeakPolarHBondContact O-CB 3.31Å; W110-S113 PolarHBondContact O-N 3Å; W110-S113 PolarHBondContact O-OG 3.49Å; N111-S113 VanDerWaalsContact C-N 3.34Å; S113-T115 VanDerWaalsContact C-N 3.34Å; S113-S364 WeakPolarHBondContact CB-OG 3.45Å
114Q88.6Confident91.3Very high102 Ų10263 Ų6348%0.47733%0.332SS..THydrogen-bonded Turntrans-88.8-1.3178-58.5-56.9-56.200112.8W110 N111 L112 E116W110-Q114 HydrophobicContact CD2-CG 4.46Å; W110-Q114 HydrophobicContact CZ2-CG 4.2Å; W110-Q114 WeakPolarHBondContact O-CG 3.49Å; W110-Q114 PolarHBondContact O-N 3.09Å; N111-Q114 PolarHBondContact O-N 3.35Å; L112-Q114 PolarHBondContact O-N 3.31Å; Q114-E116 PolarHBondContact O-N 2.82Å
115T88.3Confident91.3Very high77 Ų7764.9 Ų64.947%0.47234%0.336SS..SBendtrans-79.2122-178.4-56.90000110.4N111 L112 S113 N117 F118N111-T115 PolarHBondContact O-OG1 2.9Å; L112-T115 WeakPolarHBondContact O-CB 3.36Å; L112-T115 PolarHBondContact O-N 2.94Å; L112-T115 VanDerWaalsContact O-N 3.15Å; L112-T115 PolarHBondContact O-OG1 3.33Å; S113-T115 VanDerWaalsContact C-N 3.34Å; T115-N117 PolarHBondContact O-N 2.92Å; T115-F118 PolarHBondContact O-N 3.28Å
116E77.4Confident91.2Very high179 Ų17965.5 Ų65.584%0.83634%0.342SS*.THydrogen-bonded Turntrans-59.9121.3177.8-63.1179178.300110.1Q114Q114-E116 PolarHBondContact O-N 2.82Å
117N83.6Confident91.2Very high159 Ų15965.5 Ų65.585%0.8534%0.342SS*.THydrogen-bonded Turntrans88.28.5-175.9-47.6-49.3000117.9T115T115-N117 PolarHBondContact O-N 2.92Å
118F86.8Confident91.2Very high50 Ų5062 Ų6222%0.21933%0.329CS..  trans-76.3127.6172.7-151.1-122.2000110.9L112 T115 Q122 W123 A126 W361L112-F118 HydrophobicContact CB-CD1 4.48Å; L112-F118 HydrophobicContact CB-CE1 4.11Å; T115-F118 PolarHBondContact O-N 3.28Å; F118-Q122 HydrophobicContact CD2-CB 4.21Å; F118-Q122 HydrophobicContact CE1-CB 4.43Å; F118-Q122 HydrophobicContact CE2-CB 3.77Å; F118-Q122 HydrophobicContact CZ-CB 3.89Å; F118-Q122 WeakPolarHBondContact CZ-O 3.48Å; F118-W123 HydrophobicContact CD1-CB 3.57Å; F118-W123 AromaticContact CD1-CD1 3.7Å; F118-W123 HydrophobicContact CD1-CG 4.01Å; F118-W123 HydrophobicContact CE1-CB 3.33Å; F118-W123 AromaticContact CE1-CD1 3.56Å; F118-W123 AromaticContact CE1-CG 3.76Å; F118-W123 HydrophobicContact CE1-CG 3.76Å; F118-W123 HydrophobicContact CZ-CB 4.39Å; F118-A126 HydrophobicContact CZ-CB 4.08Å; F118-W361 HydrophobicContact CD1-CZ3 4.32Å; F118-W361 VanDerWaalsContact O-CH2 3.27Å; F118-W361 WeakPolarHBondContact O-CH2 3.49Å
119T91.4Very high91.1Very high62 Ų6265.6 Ų65.638%0.3834%0.343SS..  trans-92156.4-179.260.30000111.6S121 Q122 W123T119-S121 VanDerWaalsContact C-N 3.29Å; T119-S121 PolarHBondContact O-N 2.87Å; T119-S121 PolarHBondContact OG1-OG 3.35Å; T119-Q122 VanDerWaalsContact N-OE1 3.14Å; T119-Q122 PolarHBondContact O-N 3.33Å; T119-Q122 WeakPolarHBondContact OG1-CB 3.37Å; T119-Q122 WeakPolarHBondContact OG1-CG 3.44Å; T119-Q122 PolarHBondContact OG1-N 3.13Å; T119-Q122 PolarHBondContact OG1-OE1 3.04Å; T119-W123 WeakPolarHBondContact O-CB 3.41Å; T119-W123 PolarHBondContact O-N 3.02Å
120L92.1Very high91Very high64 Ų6469.3 Ų69.334%0.33536%0.36SS..Hα-helixtrans-54-45.4175.5173.361.8000111.7Q122 W123 L124 W361L120-Q122 PolarHBondContact O-N 3.37Å; L120-W123 CarbonylContact O-C 3.57Å; L120-W123 PolarHBondContact O-N 3.1Å; L120-W123 VanDerWaalsContact O-N 3.15Å; L120-L124 HydrophobicContact CD1-CD1 4.37Å; L120-L124 HydrophobicContact CD1-CD2 4.22Å; L120-L124 HydrophobicContact CD1-CG 4.03Å; L120-L124 HydrophobicContact CG-CD1 4.27Å; L120-L124 HydrophobicContact CG-CG 4.33Å; L120-L124 WeakPolarHBondContact O-CG 3.34Å; L120-L124 PolarHBondContact O-N 3.31Å; L120-W361 HydrophobicContact CD1-CB 3.9Å; L120-W361 HydrophobicContact CD1-CD2 4.18Å; L120-W361 HydrophobicContact CD1-CG 3.61Å
121S92.3Very high91Very high73 Ų7367.8 Ų67.851%0.5135%0.354SS..Hα-helixtrans-62.6-44.7-179.752.70000112.6T119 W123 L124 D125T119-S121 VanDerWaalsContact C-N 3.29Å; T119-S121 PolarHBondContact O-N 2.87Å; T119-S121 PolarHBondContact OG1-OG 3.35Å; S121-W123 PolarHBondContact O-N 2.96Å; S121-L124 PolarHBondContact O-N 2.92Å; S121-D125 PolarHBondContact O-N 3.42Å
122Q93.3Very high90.9Very high94 Ų9467 Ų6744%0.43935%0.348SS..Hα-helixtrans-62.9-34.5175.1-72.2167.1-29.600111.7F118 T119 L120 A126F118-Q122 HydrophobicContact CD2-CB 4.21Å; F118-Q122 HydrophobicContact CE1-CB 4.43Å; F118-Q122 HydrophobicContact CE2-CB 3.77Å; F118-Q122 HydrophobicContact CZ-CB 3.89Å; F118-Q122 WeakPolarHBondContact CZ-O 3.48Å; T119-Q122 VanDerWaalsContact N-OE1 3.14Å; T119-Q122 PolarHBondContact O-N 3.33Å; T119-Q122 WeakPolarHBondContact OG1-CB 3.37Å; T119-Q122 WeakPolarHBondContact OG1-CG 3.44Å; T119-Q122 PolarHBondContact OG1-N 3.13Å; T119-Q122 PolarHBondContact OG1-OE1 3.04Å; L120-Q122 PolarHBondContact O-N 3.37Å; Q122-A126 VanDerWaalsContact O-CB 3.27Å; Q122-A126 WeakPolarHBondContact O-CB 3.47Å; Q122-A126 PolarHBondContact O-N 2.72Å
123W93.9Very high90.8Very high1 Ų167.8 Ų67.80%0.00436%0.356CS..Hα-helixtrans-72.5-36.6177.5-170.396.9000112.9M109 F118 T119 L120 S121 G127 L357 M360 W361M109-W123 HydrophobicContact CB-CZ2 4.37Å; M109-W123 HydrophobicContact CE-CD2 3.79Å; M109-W123 HydrophobicContact CE-CE3 4.44Å; M109-W123 HydrophobicContact CE-CG 4.2Å; M109-W123 HydrophobicContact CE-CH2 4.17Å; M109-W123 HydrophobicContact CE-CZ2 3.5Å; M109-W123 VanDerWaalsContact CE-CZ2 3.5Å; M109-W123 PolarHBondContact O-NE1 3.2Å; F118-W123 HydrophobicContact CD1-CB 3.57Å; F118-W123 AromaticContact CD1-CD1 3.7Å; F118-W123 HydrophobicContact CD1-CG 4.01Å; F118-W123 HydrophobicContact CE1-CB 3.33Å; F118-W123 AromaticContact CE1-CD1 3.56Å; F118-W123 AromaticContact CE1-CG 3.76Å; F118-W123 HydrophobicContact CE1-CG 3.76Å; F118-W123 HydrophobicContact CZ-CB 4.39Å; T119-W123 WeakPolarHBondContact O-CB 3.41Å; T119-W123 PolarHBondContact O-N 3.02Å; L120-W123 CarbonylContact O-C 3.57Å; L120-W123 PolarHBondContact O-N 3.1Å; L120-W123 VanDerWaalsContact O-N 3.15Å; S121-W123 PolarHBondContact O-N 2.96Å; W123-G127 PolarHBondContact O-N 3.38Å; W123-L357 HydrophobicContact CE3-CB 4.35Å; W123-L357 HydrophobicContact CH2-CB 3.84Å; W123-L357 HydrophobicContact CH2-CD2 3.49Å; W123-L357 VanDerWaalsContact CH2-CD2 3.49Å; W123-L357 HydrophobicContact CH2-CG 4.27Å; W123-L357 WeakPolarHBondContact CH2-O 3.47Å; W123-L357 HydrophobicContact CZ2-CD2 4.28Å; W123-L357 HydrophobicContact CZ3-CB 3.37Å; W123-L357 HydrophobicContact CZ3-CD2 3.71Å; W123-L357 HydrophobicContact CZ3-CG 4.09Å; W123-L357 WeakPolarHBondContact CZ3-O 3.38Å; W123-M360 HydrophobicContact CH2-CB 3.93Å; W123-M360 HydrophobicContact CZ2-CB 4.32Å; W123-W361 HydrophobicContact CB-CE3 3.85Å; W123-W361 HydrophobicContact CB-CZ3 3.92Å; W123-W361 AromaticContact CD1-CE3 3.59Å; W123-W361 AromaticContact CD1-CZ3 3.67Å; W123-W361 HydrophobicContact CD2-CB 4.34Å; W123-W361 AromaticContact CD2-CE3 3.71Å; W123-W361 HydrophobicContact CD2-CE3 3.71Å; W123-W361 HydrophobicContact CD2-CZ3 4.46Å; W123-W361 HydrophobicContact CE3-CB 3.95Å; W123-W361 HydrophobicContact CE3-CE3 4.29Å; W123-W361 HydrophobicContact CG-CD2 4.48Å; W123-W361 AromaticContact CG-CE3 3.44Å; W123-W361 HydrophobicContact CG-CE3 3.44Å; W123-W361 VanDerWaalsContact CG-CE3 3.44Å; W123-W361 AromaticContact CG-CZ3 3.75Å; W123-W361 HydrophobicContact CG-CZ3 3.75Å; W123-W361 HydrophobicContact CH2-CB 4.25Å; W123-W361 HydrophobicContact CZ3-CB 3.85Å; W123-W361 AromaticContact NE1-CE3 3.96Å
124L95.7Very high90.8Very high27 Ų2767.6 Ų67.614%0.14136%0.355CS..Hα-helixtrans-62.2-49.2170.4-67.8179.2000111L120 S121 G127 L128 V354 L357 E358L120-L124 HydrophobicContact CD1-CD1 4.37Å; L120-L124 HydrophobicContact CD1-CD2 4.22Å; L120-L124 HydrophobicContact CD1-CG 4.03Å; L120-L124 HydrophobicContact CG-CD1 4.27Å; L120-L124 HydrophobicContact CG-CG 4.33Å; L120-L124 WeakPolarHBondContact O-CG 3.34Å; L120-L124 PolarHBondContact O-N 3.31Å; S121-L124 PolarHBondContact O-N 2.92Å; L124-G127 PolarHBondContact O-N 3.09Å; L124-L128 VanDerWaalsContact O-CG 3.31Å; L124-L128 WeakPolarHBondContact O-CG 3.11Å; L124-L128 PolarHBondContact O-N 3.22Å; L124-V354 HydrophobicContact CD1-CG1 4.47Å; L124-L357 HydrophobicContact CD2-CB 3.54Å; L124-L357 HydrophobicContact CD2-CD1 4.3Å; L124-E358 HydrophobicContact CD1-CG 4.48Å; L124-E358 HydrophobicContact CD2-CG 4Å
125D93.7Very high90.8Very high111 Ų11162.9 Ų62.959%0.59433%0.332SS*.Hα-helixtrans-61.4-48.2-179.8-69.6-26.7000111.6S121 G127 L128 E129S121-D125 PolarHBondContact O-N 3.42Å; D125-G127 VanDerWaalsContact C-N 3.32Å; D125-G127 PolarHBondContact O-N 3.43Å; D125-L128 PolarHBondContact O-N 3.32Å; D125-E129 PolarHBondContact O-N 2.92Å; D125-E129 VanDerWaalsContact O-N 3.09Å
126A94.1Very high90.7Very high19 Ų1962 Ų6216%0.15732%0.324CS..Hα-helixtrans-62.2-39.7175.500000111.8L112 F118 Q122 E129 Q130L112-A126 HydrophobicContact CD1-CB 4.23Å; F118-A126 HydrophobicContact CZ-CB 4.08Å; Q122-A126 VanDerWaalsContact O-CB 3.27Å; Q122-A126 WeakPolarHBondContact O-CB 3.47Å; Q122-A126 PolarHBondContact O-N 2.72Å; A126-E129 PolarHBondContact O-N 3.37Å; A126-Q130 WeakPolarHBondContact O-CB 3.43Å; A126-Q130 WeakPolarHBondContact O-CG 3.34Å; A126-Q130 PolarHBondContact O-N 3.48Å
127G94.7Very high91.1Very high0 Ų055 Ų550%029%0.293CS..Hα-helixtrans-63.7-43.2177.900000113W123 L124 D125 E129 Q130 M131W123-G127 PolarHBondContact O-N 3.38Å; L124-G127 PolarHBondContact O-N 3.09Å; D125-G127 VanDerWaalsContact C-N 3.32Å; D125-G127 PolarHBondContact O-N 3.43Å; G127-E129 VanDerWaalsContact C-N 3.34Å; G127-Q130 PolarHBondContact O-N 3.45Å; G127-M131 VanDerWaalsContact O-CB 3.32Å; G127-M131 WeakPolarHBondContact O-CB 3.46Å; G127-M131 PolarHBondContact O-N 2.79Å
128L93.3Very high91.1Very high57 Ų5747.5 Ų47.530%0.29825%0.252SS..Hα-helixtrans-64.7-38.5176.1-69.5172.2000111.8L124 D125 K353 L357L124-L128 VanDerWaalsContact O-CG 3.31Å; L124-L128 WeakPolarHBondContact O-CG 3.11Å; L124-L128 PolarHBondContact O-N 3.22Å; D125-L128 PolarHBondContact O-N 3.32Å; L128-K353 HydrophobicContact CD2-CB 3.73Å; L128-K353 HydrophobicContact CD2-CD 3.9Å; L128-K353 HydrophobicContact CD2-CG 4.45Å; L128-L357 HydrophobicContact CD2-CD1 4Å; L128-L357 HydrophobicContact CG-CD1 3.92Å
129E91.9Very high90.9Very high124 Ų12447.5 Ų47.558%0.57925%0.251SS*.Hα-helixtrans-68-47175.5-171.9-179.8-177.800111.9D125 A126 G127 M131 Q132D125-E129 PolarHBondContact O-N 2.92Å; D125-E129 VanDerWaalsContact O-N 3.09Å; A126-E129 PolarHBondContact O-N 3.37Å; G127-E129 VanDerWaalsContact C-N 3.34Å; E129-M131 PolarHBondContact O-N 2.8Å; E129-Q132 WeakPolarHBondContact O-CB 3.49Å; E129-Q132 VanDerWaalsContact O-CG 3.31Å; E129-Q132 WeakPolarHBondContact O-CG 3.47Å; E129-Q132 PolarHBondContact O-N 3.3Å
130Q92.9Very high90.4Very high79 Ų7949.4 Ų49.437%0.36926%0.256SS..Hα-helixtrans-69.4-17-179.3-66.6-63.7-33.800113.3F105 M109 A126 G127 P133F105-Q130 HydrophobicContact CD2-CB 3.75Å; F105-Q130 WeakPolarHBondContact CD2-O 3.32Å; F105-Q130 HydrophobicContact CE2-CB 3.92Å; M109-Q130 HydrophobicContact SD-CB 4.23Å; M109-Q130 HydrophobicContact SD-CG 4.36Å; A126-Q130 WeakPolarHBondContact O-CB 3.43Å; A126-Q130 WeakPolarHBondContact O-CG 3.34Å; A126-Q130 PolarHBondContact O-N 3.48Å; G127-Q130 PolarHBondContact O-N 3.45Å; Q130-P133 WeakPolarHBondContact O-CD 3.36Å
131M92Very high89.6Confident1 Ų146.6 Ų46.61%0.00524%0.242CC..THydrogen-bonded Turntrans-80.7-16.8175.9-160.4176.6-6500112.8F105 G127 E129 L134 E135 K353 F356 L357 V385F105-M131 HydrophobicContact CE1-CE 4.36Å; F105-M131 HydrophobicContact CE2-CB 4.2Å; F105-M131 HydrophobicContact CE2-CE 4.49Å; F105-M131 HydrophobicContact CZ-CE 3.78Å; G127-M131 VanDerWaalsContact O-CB 3.32Å; G127-M131 WeakPolarHBondContact O-CB 3.46Å; G127-M131 PolarHBondContact O-N 2.79Å; E129-M131 PolarHBondContact O-N 2.8Å; M131-L134 HydrophobicContact CG-CD2 4.29Å; M131-L134 WeakPolarHBondContact O-CA 3.02Å; M131-L134 VanDerWaalsContact O-CB 3.29Å; M131-L134 WeakPolarHBondContact O-CB 3.38Å; M131-L134 PolarHBondContact O-N 3.2Å; M131-E135 HydrophobicContact CG-CG 4.33Å; M131-E135 WeakPolarHBondContact CG-OE1 3.34Å; M131-E135 WeakPolarHBondContact O-CG 3.29Å; M131-E135 PolarHBondContact O-N 3.46Å; M131-K353 HydrophobicContact SD-CB 4.46Å; M131-K353 HydrophobicContact SD-CD 4.09Å; M131-K353 HydrophobicContact SD-CG 3.79Å; M131-F356 HydrophobicContact CE-CD1 3.75Å; M131-F356 HydrophobicContact CE-CE1 3.92Å; M131-L357 HydrophobicContact CE-CD2 4.31Å; M131-L357 HydrophobicContact CE-CG 4.33Å; M131-V385 HydrophobicContact SD-CG1 4.18Å
132Q91.1Very high88.7Confident72 Ų7245.6 Ų45.634%0.33623%0.228SC..Hα-helixtrans-57.2-43.5-177.3-62.8-179.8-10.900114.4E129 L134 E135 I136 L404E129-Q132 WeakPolarHBondContact O-CB 3.49Å; E129-Q132 VanDerWaalsContact O-CG 3.31Å; E129-Q132 WeakPolarHBondContact O-CG 3.47Å; E129-Q132 PolarHBondContact O-N 3.3Å; Q132-L134 VanDerWaalsContact C-N 3.26Å; Q132-L134 PolarHBondContact O-N 2.68Å; Q132-E135 WeakPolarHBondContact O-CB 3.25Å; Q132-E135 PolarHBondContact O-N 2.87Å; Q132-I136 VanDerWaalsContact O-CG1 3.3Å; Q132-I136 WeakPolarHBondContact O-CG1 3.37Å; Q132-I136 PolarHBondContact O-N 2.97Å; Q132-L404 HydrophobicContact CB-CD2 4.07Å; Q132-L404 VanDerWaalsContact CD-CD2 3.49Å; Q132-L404 HydrophobicContact CG-CD2 3.55Å
133P90.6Very high87.6Confident66 Ų6644.2 Ų44.243%0.42923%0.225SC..Hα-helixtrans-61.8-34.7176.1-22.935.3000112.8T101 Q130 L137T101-P133 HydrophobicContact CG2-CB 4.2Å; Q130-P133 WeakPolarHBondContact O-CD 3.36Å; P133-L137 WeakPolarHBondContact O-CB 3.24Å; P133-L137 PolarHBondContact O-N 3.15Å; P133-L137 VanDerWaalsContact O-N 3.09Å
134L88.9Confident86.3Confident3 Ų347.8 Ų47.82%0.01624%0.242CC..Hα-helixtrans-66-44.3175.317865000110.6L98 T101 K102 M131 Q132 L137 L138 L382L98-L134 HydrophobicContact CD1-CD1 3.4Å; T101-L134 HydrophobicContact CG2-CB 4.3Å; K102-L134 HydrophobicContact CD-CD1 4.45Å; K102-L134 HydrophobicContact CG-CD1 3.59Å; K102-L134 HydrophobicContact CG-CD2 4.37Å; M131-L134 HydrophobicContact CG-CD2 4.29Å; M131-L134 WeakPolarHBondContact O-CA 3.02Å; M131-L134 VanDerWaalsContact O-CB 3.29Å; M131-L134 WeakPolarHBondContact O-CB 3.38Å; M131-L134 PolarHBondContact O-N 3.2Å; Q132-L134 VanDerWaalsContact C-N 3.26Å; Q132-L134 PolarHBondContact O-N 2.68Å; L134-L137 PolarHBondContact O-N 3.07Å; L134-L138 HydrophobicContact CD1-CD1 4.3Å; L134-L138 HydrophobicContact CD1-CG 4.34Å; L134-L138 HydrophobicContact CG-CD1 3.99Å; L134-L138 HydrophobicContact CG-CG 4.45Å; L134-L138 WeakPolarHBondContact O-CB 3.42Å; L134-L138 VanDerWaalsContact O-CG 3.24Å; L134-L138 WeakPolarHBondContact O-CG 3.28Å; L134-L138 PolarHBondContact O-N 3.38Å; L134-L382 HydrophobicContact CD2-CD1 3.92Å; L134-L382 HydrophobicContact CD2-CD2 3.94Å; L134-L382 HydrophobicContact CD2-CG 4.28Å
135E88.4Confident84.8Confident2 Ų250 Ų501%0.00925%0.248CC..Hα-helixtrans-63.1-42.7177.7-66.1163-155.500112.3M131 Q132 L137 L138 Y139 K353 L389 I403M131-E135 HydrophobicContact CG-CG 4.33Å; M131-E135 WeakPolarHBondContact CG-OE1 3.34Å; M131-E135 WeakPolarHBondContact O-CG 3.29Å; M131-E135 PolarHBondContact O-N 3.46Å; Q132-E135 WeakPolarHBondContact O-CB 3.25Å; Q132-E135 PolarHBondContact O-N 2.87Å; E135-L137 VanDerWaalsContact C-N 3.34Å; E135-L137 PolarHBondContact O-N 3.49Å; E135-L138 PolarHBondContact O-N 3.34Å; E135-Y139 WeakPolarHBondContact O-CB 3.14Å; E135-Y139 PolarHBondContact O-N 3.14Å; E135-K353 WeakPolarHBondContact OE1-CE 3.22Å; E135-K353 IonicContact OE1-NZ 2.79Å; E135-K353 PolarHBondContact OE1-NZ 2.91Å; E135-K353 IonicContact OE2-NZ 3.83Å; E135-K353 PolarHBondContact OE2-NZ 3.4Å; E135-L389 HydrophobicContact CG-CD1 4.2Å; E135-I403 WeakPolarHBondContact OE2-CG2 3.27Å
136I87.1Confident83.1Confident58 Ų5846.8 Ų46.830%0.29723%0.228SC..Hα-helixtrans-58.2-49.9175.3-69.2162.6000109.8Q132 L138 Y139 E140 I400Q132-I136 VanDerWaalsContact O-CG1 3.3Å; Q132-I136 WeakPolarHBondContact O-CG1 3.37Å; Q132-I136 PolarHBondContact O-N 2.97Å; I136-L138 PolarHBondContact O-N 2.93Å; I136-Y139 PolarHBondContact O-N 2.78Å; I136-E140 HydrophobicContact CG2-CG 4.32Å; I136-E140 WeakPolarHBondContact O-CB 3.42Å; I136-E140 WeakPolarHBondContact O-CG 3.2Å; I136-E140 PolarHBondContact O-N 3.4Å; I136-I400 HydrophobicContact CB-CD1 4.25Å; I136-I400 HydrophobicContact CG1-CD1 4.2Å; I136-I400 HydrophobicContact CG1-CG2 3.86Å; I136-I400 HydrophobicContact CG2-CD1 4.19Å
137L85.6Confident81.6Confident33 Ų3346.1 Ų46.117%0.17322%0.222CC..Hα-helixtrans-69-34.2-177-171.958.9000112.9A97 L98 P133 L134 E135 G141A97-L137 HydrophobicContact CB-CD2 4.06Å; L98-L137 VanDerWaalsContact CA-CD2 3.45Å; L98-L137 HydrophobicContact CB-CD2 4.04Å; L98-L137 HydrophobicContact CD1-CD2 4.16Å; L98-L137 HydrophobicContact CD1-CG 4.27Å; P133-L137 WeakPolarHBondContact O-CB 3.24Å; P133-L137 PolarHBondContact O-N 3.15Å; P133-L137 VanDerWaalsContact O-N 3.09Å; L134-L137 PolarHBondContact O-N 3.07Å; E135-L137 VanDerWaalsContact C-N 3.34Å; E135-L137 PolarHBondContact O-N 3.49Å; L137-G141 PolarHBondContact O-N 3.1Å
138L83.9Confident80.1Confident1 Ų148.6 Ų48.61%0.00524%0.237CC..Hα-helixtrans-65.3-45.1173.2-74.6170.7000111.3L98 L134 E135 I136 G141 Y142 E386 L389 Y390 Y393L98-L138 HydrophobicContact CD1-CD2 3.74Å; L98-L138 HydrophobicContact CD1-CG 3.98Å; L98-L138 HydrophobicContact CD2-CD2 3.89Å; L98-L138 HydrophobicContact CG-CD2 4.48Å; L134-L138 HydrophobicContact CD1-CD1 4.3Å; L134-L138 HydrophobicContact CD1-CG 4.34Å; L134-L138 HydrophobicContact CG-CD1 3.99Å; L134-L138 HydrophobicContact CG-CG 4.45Å; L134-L138 WeakPolarHBondContact O-CB 3.42Å; L134-L138 VanDerWaalsContact O-CG 3.24Å; L134-L138 WeakPolarHBondContact O-CG 3.28Å; L134-L138 PolarHBondContact O-N 3.38Å; E135-L138 PolarHBondContact O-N 3.34Å; I136-L138 PolarHBondContact O-N 2.93Å; L138-G141 PolarHBondContact O-N 3.45Å; L138-Y142 WeakPolarHBondContact O-CB 3.41Å; L138-Y142 PolarHBondContact O-N 3.32Å; L138-E386 HydrophobicContact CD1-CG 3.98Å; L138-E386 HydrophobicContact CD2-CG 4.31Å; L138-L389 HydrophobicContact CD1-CD1 3.82Å; L138-Y390 HydrophobicContact CD2-CE2 3.86Å; L138-Y390 WeakPolarHBondContact CD2-OH 3.36Å; L138-Y393 HydrophobicContact CB-CE2 4.45Å
139Y82.7Confident78.5Confident51 Ų5147.4 Ų47.420%0.224%0.236CC..Hα-helixtrans-66.6-45.1176.1174.8-89.5000112.2E135 I136 G141 Y142 V143 Y393 I400E135-Y139 WeakPolarHBondContact O-CB 3.14Å; E135-Y139 PolarHBondContact O-N 3.14Å; I136-Y139 PolarHBondContact O-N 2.78Å; Y139-G141 VanDerWaalsContact C-N 3.3Å; Y139-G141 PolarHBondContact O-N 3.05Å; Y139-Y142 PolarHBondContact O-N 3.46Å; Y139-Y142 VanDerWaalsContact O-N 3.13Å; Y139-V143 HydrophobicContact CD1-CB 4.36Å; Y139-V143 HydrophobicContact CD1-CG2 3.86Å; Y139-V143 HydrophobicContact CD2-CG2 3.77Å; Y139-V143 HydrophobicContact CE1-CB 4.15Å; Y139-V143 HydrophobicContact CE1-CG2 3.58Å; Y139-V143 HydrophobicContact CE2-CG2 3.46Å; Y139-V143 VanDerWaalsContact CE2-CG2 3.46Å; Y139-V143 HydrophobicContact CG-CG2 4Å; Y139-V143 WeakPolarHBondContact O-CB 3.34Å; Y139-V143 WeakPolarHBondContact O-CG2 3.42Å; Y139-V143 PolarHBondContact O-N 3.09Å; Y139-Y393 AromaticContact CD2-CD1 3.71Å; Y139-Y393 HydrophobicContact CD2-CD1 3.71Å; Y139-Y393 AromaticContact CD2-CE1 3.59Å; Y139-Y393 HydrophobicContact CD2-CE1 3.59Å; Y139-Y393 HydrophobicContact CD2-CG 4.23Å; Y139-Y393 HydrophobicContact CE2-CD1 4.36Å; Y139-Y393 HydrophobicContact CE2-CE1 4.44Å; Y139-Y393 HydrophobicContact CG-CE1 4.41Å; Y139-I400 HydrophobicContact CD1-CD1 3.1Å; Y139-I400 HydrophobicContact CD1-CG1 3.36Å; Y139-I400 HydrophobicContact CD2-CD1 4.48Å; Y139-I400 HydrophobicContact CD2-CG1 3.82Å; Y139-I400 HydrophobicContact CE1-CD1 3.77Å; Y139-I400 HydrophobicContact CE1-CG1 3.96Å; Y139-I400 HydrophobicContact CE2-CG1 4.38Å; Y139-I400 HydrophobicContact CG-CD1 3.51Å; Y139-I400 HydrophobicContact CG-CG1 3.23Å
140E80.3Confident77.1Confident102 Ų10246 Ų4648%0.47723%0.232SC..Hα-helixtrans-58.4-44.7174.8-76178.317800110.5I136 Y142 E144I136-E140 HydrophobicContact CG2-CG 4.32Å; I136-E140 WeakPolarHBondContact O-CB 3.42Å; I136-E140 WeakPolarHBondContact O-CG 3.2Å; I136-E140 PolarHBondContact O-N 3.4Å; E140-Y142 VanDerWaalsContact C-N 3.28Å; E140-Y142 PolarHBondContact O-N 3.32Å; E140-E144 WeakPolarHBondContact O-CB 3.35Å; E140-E144 VanDerWaalsContact O-CG 3.28Å; E140-E144 WeakPolarHBondContact O-CG 3.43Å; E140-E144 PolarHBondContact O-N 2.72Å
141G75.1Confident75.7Confident4 Ų442.7 Ų42.74%0.04122%0.217CC..Hα-helixtrans-60.8-35.3175.500000113.8L137 L138 Y139 Y146 I147L137-G141 PolarHBondContact O-N 3.1Å; L138-G141 PolarHBondContact O-N 3.45Å; Y139-G141 VanDerWaalsContact C-N 3.3Å; Y139-G141 PolarHBondContact O-N 3.05Å; G141-Y146 PolarHBondContact O-N 3.36Å; G141-I147 PolarHBondContact O-N 3.38Å; G141-I147 VanDerWaalsContact O-N 3.16Å
142Y73.8Confident74.3Confident53 Ų5344 Ų4421%0.20823%0.225CC..Hα-helixtrans-77.9-54.3178.1177.8-96.5000112.9L138 Y139 E140 E144 R145 Y390 Y393 E394L138-Y142 WeakPolarHBondContact O-CB 3.41Å; L138-Y142 PolarHBondContact O-N 3.32Å; Y139-Y142 PolarHBondContact O-N 3.46Å; Y139-Y142 VanDerWaalsContact O-N 3.13Å; E140-Y142 VanDerWaalsContact C-N 3.28Å; E140-Y142 PolarHBondContact O-N 3.32Å; Y142-E144 PolarHBondContact O-N 3.39Å; Y142-R145 VanDerWaalsContact O-CA 3.27Å; Y142-R145 WeakPolarHBondContact O-CA 3.36Å; Y142-R145 PolarHBondContact O-N 2.69Å; Y142-Y390 AromaticContact CD2-CD1 3.99Å; Y142-Y390 HydrophobicContact CD2-CD1 3.99Å; Y142-Y390 HydrophobicContact CD2-CE1 4.32Å; Y142-Y390 HydrophobicContact CG-CD1 4.49Å; Y142-Y393 VanDerWaalsContact CD1-CB 3.5Å; Y142-Y393 HydrophobicContact CD1-CG 4.38Å; Y142-Y393 WeakPolarHBondContact CE1-O 3.3Å; Y142-E394 VanDerWaalsContact OH-CA 3.28Å; Y142-E394 WeakPolarHBondContact OH-CA 3.41Å
143V69.6Low72.9Confident64 Ų6443.3 Ų43.339%0.38822%0.223SC..Hα-helixtrans-65.9-38.7-176.8170.70000111.4Y139 R145Y139-V143 HydrophobicContact CD1-CB 4.36Å; Y139-V143 HydrophobicContact CD1-CG2 3.86Å; Y139-V143 HydrophobicContact CD2-CG2 3.77Å; Y139-V143 HydrophobicContact CE1-CB 4.15Å; Y139-V143 HydrophobicContact CE1-CG2 3.58Å; Y139-V143 HydrophobicContact CE2-CG2 3.46Å; Y139-V143 VanDerWaalsContact CE2-CG2 3.46Å; Y139-V143 HydrophobicContact CG-CG2 4Å; Y139-V143 WeakPolarHBondContact O-CB 3.34Å; Y139-V143 WeakPolarHBondContact O-CG2 3.42Å; Y139-V143 PolarHBondContact O-N 3.09Å; V143-R145 PolarHBondContact O-N 2.88Å
144E66.7Low71.6Confident77 Ų7745 Ų4536%0.3623%0.229SC..THydrogen-bonded Turntrans-72.6-4.2173.1-63.2-66170.100112.9E140 Y142 Y146 R185E140-E144 WeakPolarHBondContact O-CB 3.35Å; E140-E144 VanDerWaalsContact O-CG 3.28Å; E140-E144 WeakPolarHBondContact O-CG 3.43Å; E140-E144 PolarHBondContact O-N 2.72Å; Y142-E144 PolarHBondContact O-N 3.39Å; E144-Y146 HydrophobicContact CB-CD2 3.44Å; E144-Y146 VanDerWaalsContact CB-CD2 3.44Å; E144-Y146 HydrophobicContact CB-CE2 3.32Å; E144-Y146 HydrophobicContact CG-CD2 4.5Å; E144-Y146 HydrophobicContact CG-CE2 4.11Å; E144-Y146 PolarHBondContact O-N 2.9Å; E144-R185 PolarHBondContact O-NH2 3.26Å; E144-R185 IonicContact OE2-CZ 2.77Å; E144-R185 VanDerWaalsContact OE2-CZ 3.25Å; E144-R185 IonicContact OE2-NH1 3.62Å; E144-R185 PolarHBondContact OE2-NH1 3.09Å; E144-R185 IonicContact OE2-NH2 2.62Å; E144-R185 PolarHBondContact OE2-NH2 2.79Å; E144-R185 VanDerWaalsContact OE2-NH2 3.08Å
145R64Low70.3Confident72 Ų7253 Ų5327%0.27226%0.263SS..THydrogen-bonded Turntrans62.818.3176.5-62.5-179.1171.8153.72.9115.4Y142 V143 Q160 G180Y142-R145 VanDerWaalsContact O-CA 3.27Å; Y142-R145 WeakPolarHBondContact O-CA 3.36Å; Y142-R145 PolarHBondContact O-N 2.69Å; V143-R145 PolarHBondContact O-N 2.88Å; R145-Q160 PolarHBondContact O-NE2 3.31Å; R145-Q160 VanDerWaalsContact O-NE2 3.12Å; R145-G180 PolarHBondContact NH1-O 3.32Å
146Y59Low68.8Low44 Ų4455.9 Ų55.917%0.17328%0.281CS..SBendtrans-72.9-29.9176-64.8-62.4000113.2I90 G141 E144I90-Y146 HydrophobicContact CB-CD1 3.97Å; I90-Y146 HydrophobicContact CB-CE1 3.83Å; I90-Y146 HydrophobicContact CD1-CE1 3.65Å; I90-Y146 WeakPolarHBondContact CD1-OH 3.28Å; I90-Y146 HydrophobicContact CG1-CE1 4.34Å; I90-Y146 HydrophobicContact CG2-CD1 3.48Å; I90-Y146 VanDerWaalsContact CG2-CD1 3.48Å; I90-Y146 HydrophobicContact CG2-CD2 3.71Å; I90-Y146 HydrophobicContact CG2-CE1 3.44Å; I90-Y146 VanDerWaalsContact CG2-CE1 3.44Å; I90-Y146 HydrophobicContact CG2-CE2 3.65Å; I90-Y146 HydrophobicContact CG2-CG 3.64Å; G141-Y146 PolarHBondContact O-N 3.36Å; E144-Y146 HydrophobicContact CB-CD2 3.44Å; E144-Y146 VanDerWaalsContact CB-CD2 3.44Å; E144-Y146 HydrophobicContact CB-CE2 3.32Å; E144-Y146 HydrophobicContact CG-CD2 4.5Å; E144-Y146 HydrophobicContact CG-CE2 4.11Å; E144-Y146 PolarHBondContact O-N 2.9Å
147I62.2Low67.6Low5 Ų557.3 Ų57.33%0.02629%0.287CS..  trans-131.4112.3-168.2-60.3178.4000108.5I95 G141 D151 V152I95-I147 HydrophobicContact CG1-CD1 4.13Å; G141-I147 PolarHBondContact O-N 3.38Å; G141-I147 VanDerWaalsContact O-N 3.16Å; I147-D151 HydrophobicContact CG2-CB 4.17Å; I147-V152 HydrophobicContact CG2-CG2 3.18Å
148T62.5Low66.9Low53 Ų5364.8 Ų64.833%0.32531%0.313SS..  trans-80.3158.5167.164.20000110.3N150 D151 V152T148-N150 PolarHBondContact O-N 3.03Å; T148-N150 VanDerWaalsContact O-N 3.14Å; T148-D151 WeakPolarHBondContact CB-OD2 3.33Å; T148-D151 PolarHBondContact N-OD2 2.91Å; T148-D151 WeakPolarHBondContact O-CB 3.38Å; T148-D151 PolarHBondContact O-N 3.16Å; T148-D151 PolarHBondContact OG1-N 3.35Å; T148-D151 PolarHBondContact OG1-OD2 2.91Å; T148-V152 PolarHBondContact O-N 3.18Å
149A59.6Low66.6Low32 Ų3268.3 Ų68.326%0.26434%0.336SS..Hα-helixtrans-51-38.8171.100000111.3D151 V152 L153 Y390A149-D151 PolarHBondContact O-N 3.13Å; A149-V152 PolarHBondContact O-N 2.9Å; A149-L153 HydrophobicContact CB-CD1 4.22Å; A149-L153 VanDerWaalsContact O-CB 3.23Å; A149-L153 WeakPolarHBondContact O-CB 3.38Å; A149-L153 WeakPolarHBondContact O-CD1 3.11Å; A149-L153 WeakPolarHBondContact O-CG 3.43Å; A149-L153 PolarHBondContact O-N 3.48Å; A149-Y390 HydrophobicContact CB-CD2 4.4Å; A149-Y390 HydrophobicContact CB-CG 4.1Å
150N62.7Low66.6Low95 Ų9568.2 Ų68.251%0.50834%0.337SS..Hα-helixtrans-64.8-33.1175.9-72.4-41000113.9T148 V152 N154T148-N150 PolarHBondContact O-N 3.03Å; T148-N150 VanDerWaalsContact O-N 3.14Å; N150-V152 VanDerWaalsContact C-N 3.32Å; N150-N154 WeakPolarHBondContact O-CB 3.09Å; N150-N154 PolarHBondContact O-N 2.97Å
151D63.8Low67Low9 Ų963.9 Ų63.95%0.04832%0.316CS..Hα-helixtrans-67.1-36.8177.8-67-54.9000111.4K91 I147 T148 A149 K155K91-D151 VanDerWaalsContact CE-CG 3.44Å; K91-D151 WeakPolarHBondContact CE-OD1 3.48Å; K91-D151 IonicContact NZ-OD1 2.94Å; K91-D151 PolarHBondContact NZ-OD1 3.28Å; K91-D151 IonicContact NZ-OD2 3.86Å; K91-D151 PolarHBondContact NZ-OD2 3.42Å; K91-D151 VanDerWaalsContact NZ-OD2 3.09Å; I147-D151 HydrophobicContact CG2-CB 4.17Å; T148-D151 WeakPolarHBondContact CB-OD2 3.33Å; T148-D151 PolarHBondContact N-OD2 2.91Å; T148-D151 WeakPolarHBondContact O-CB 3.38Å; T148-D151 PolarHBondContact O-N 3.16Å; T148-D151 PolarHBondContact OG1-N 3.35Å; T148-D151 PolarHBondContact OG1-OD2 2.91Å; A149-D151 PolarHBondContact O-N 3.13Å; D151-K155 WeakPolarHBondContact O-CA 3.24Å
152V62.5Low67.9Low28 Ų2866.2 Ų66.217%0.1733%0.329CS..Hα-helixtrans-75.8-47.9174.2-174.10000111.5I147 T148 A149 N150 E386 Y390I147-V152 HydrophobicContact CG2-CG2 3.18Å; T148-V152 PolarHBondContact O-N 3.18Å; A149-V152 PolarHBondContact O-N 2.9Å; N150-V152 VanDerWaalsContact C-N 3.32Å; V152-E386 WeakPolarHBondContact CG1-OE2 3.18Å; V152-Y390 HydrophobicContact CB-CE2 4.18Å; V152-Y390 HydrophobicContact CG1-CE2 4.4Å; V152-Y390 HydrophobicContact CG2-CE2 3.88Å; V152-Y390 VanDerWaalsContact CG2-OH 3.25Å; V152-Y390 WeakPolarHBondContact CG2-OH 3.26Å
153L61.6Low68.8Low58 Ų5867.8 Ų67.830%0.30434%0.341SS..Hα-helixtrans-74.4-44.5-171.1-67.6170.4000112.9A149A149-L153 HydrophobicContact CB-CD1 4.22Å; A149-L153 VanDerWaalsContact O-CB 3.23Å; A149-L153 WeakPolarHBondContact O-CB 3.38Å; A149-L153 WeakPolarHBondContact O-CD1 3.11Å; A149-L153 WeakPolarHBondContact O-CG 3.43Å; A149-L153 PolarHBondContact O-N 3.48Å
154N62.7Low70Confident101 Ų10168.1 Ų68.154%0.5435%0.351SS..SBendtrans-97.7-5-174.7-68.8-27.9000113.5N150 T156N150-N154 WeakPolarHBondContact O-CB 3.09Å; N150-N154 PolarHBondContact O-N 2.97Å; N154-T156 HydrophobicContact CB-CG2 4.17Å; N154-T156 PolarHBondContact O-N 2.76Å
155K61.6Low71.3Confident170 Ų17068.5 Ų68.574%0.73935%0.352SS*.  trans51.710.2-169.1-61.4-175.1175.5-173.60114.1D151 Q157D151-K155 WeakPolarHBondContact O-CA 3.24Å; K155-Q157 PolarHBondContact O-N 3.48Å; K155-Q157 VanDerWaalsContact O-N 3.1Å
156T57Low72.8Confident63 Ų6365 Ų6539%0.38734%0.339SS..  trans-82.393.6177.154.90000107.1N154 R158N154-T156 HydrophobicContact CB-CG2 4.17Å; N154-T156 PolarHBondContact O-N 2.76Å; T156-R158 PolarHBondContact O-N 2.97Å
157Q61.9Low74.6Confident88 Ų8865.1 Ų65.141%0.41134%0.342SS..  trans-67.478.7170-64.5-179.8-11.400108.6I95 K155 P159I95-Q157 HydrophobicContact CD1-CG 4.37Å; K155-Q157 PolarHBondContact O-N 3.48Å; K155-Q157 VanDerWaalsContact O-N 3.1Å; Q157-P159 VanDerWaalsContact O-CD 3.28Å; Q157-P159 WeakPolarHBondContact O-CD 3.36Å
158R70.9Confident76.2Confident191 Ų19169.5 Ų69.572%0.72136%0.361SS*.  trans-74.2118.8169.8-68.5-171.3-179.3-170.81.3106.4K91 T156 Q160K91-R158 PolarHBondContact NZ-O 3.08Å; K91-R158 VanDerWaalsContact NZ-O 3.09Å; T156-R158 PolarHBondContact O-N 2.97Å; R158-Q160 PolarHBondContact O-N 2.71Å
159P78.2Confident77.9Confident75 Ų7567 Ų6749%0.48735%0.346SS..  trans-66.4134173.927.1-32.2000108.6Q157 T162Q157-P159 VanDerWaalsContact O-CD 3.28Å; Q157-P159 WeakPolarHBondContact O-CD 3.36Å; P159-T162 HydrophobicContact CG-CG2 3.99Å
160Q82.1Confident79.6Confident49 Ų4965.5 Ų65.523%0.22933%0.334CS..SBendtrans-70.5-43.9171.4-66-177.9-200109.4E87 R145 R158 T162 Q165 M182E87-Q160 PolarHBondContact OE1-N 3.14Å; E87-Q160 PolarHBondContact OE2-N 3.1Å; R145-Q160 PolarHBondContact O-NE2 3.31Å; R145-Q160 VanDerWaalsContact O-NE2 3.12Å; R158-Q160 PolarHBondContact O-N 2.71Å; Q160-T162 PolarHBondContact O-N 3.23Å; Q160-Q165 WeakPolarHBondContact O-CB 3.33Å; Q160-M182 HydrophobicContact CB-CG 4.33Å; Q160-M182 HydrophobicContact CB-SD 4.45Å
161W89.8Confident81.2Confident11 Ų1163.4 Ų63.44%0.04232%0.324CS..  trans-79.960179.1-68.7105.7000113.2F79 H80 E83 E87 F169 M182F79-W161 HydrophobicContact CB-CZ3 3.93Å; H80-W161 PolarHBondContact CE1-O 3.25Å; H80-W161 PolarHBondContact ND1-O 3.44Å; E83-W161 HydrophobicContact CB-CD2 3.68Å; E83-W161 VanDerWaalsContact CB-CE2 3.5Å; E83-W161 HydrophobicContact CB-CE3 4.35Å; E83-W161 HydrophobicContact CB-CG 3.83Å; E83-W161 HydrophobicContact CB-CZ2 3.99Å; E83-W161 HydrophobicContact CG-CD2 4.44Å; E83-W161 HydrophobicContact CG-CH2 4.36Å; E83-W161 HydrophobicContact CG-CZ2 3.89Å; E87-W161 WeakPolarHBondContact OE2-CB 3.31Å; E87-W161 PolarHBondContact OE2-N 2.73Å; W161-F169 HydrophobicContact CH2-CB 4.38Å; W161-F169 AromaticContact CH2-CD1 3.62Å; W161-F169 HydrophobicContact CH2-CD1 3.62Å; W161-F169 HydrophobicContact CH2-CD2 4Å; W161-F169 AromaticContact CH2-CE1 3.85Å; W161-F169 HydrophobicContact CH2-CE1 3.85Å; W161-F169 HydrophobicContact CH2-CE2 4.21Å; W161-F169 AromaticContact CH2-CG 3.71Å; W161-F169 HydrophobicContact CH2-CG 3.71Å; W161-F169 HydrophobicContact CH2-CZ 4.15Å; W161-F169 HydrophobicContact CZ3-CB 4.01Å; W161-F169 AromaticContact CZ3-CD1 3.67Å; W161-F169 HydrophobicContact CZ3-CD1 3.67Å; W161-F169 HydrophobicContact CZ3-CD2 4.47Å; W161-F169 HydrophobicContact CZ3-CE1 4.31Å; W161-F169 AromaticContact CZ3-CG 3.77Å; W161-F169 HydrophobicContact CZ3-CG 3.77Å; W161-M182 HydrophobicContact CH2-CB 4.45Å; W161-M182 HydrophobicContact CZ2-CB 4.29Å
162T92.6Very high82.7Confident52 Ų5263.3 Ų63.332%0.31932%0.324SS..  trans-75.5154.8162.9650000110.6P159 Q160 A164 Q165 S166P159-T162 HydrophobicContact CG-CG2 3.99Å; Q160-T162 PolarHBondContact O-N 3.23Å; T162-A164 PolarHBondContact O-N 3.46Å; T162-A164 VanDerWaalsContact O-N 3.15Å; T162-Q165 CarbonylContact O-C 3.59Å; T162-Q165 PolarHBondContact O-N 3.47Å; T162-Q165 VanDerWaalsContact OG1-CB 3.32Å; T162-Q165 WeakPolarHBondContact OG1-CB 3.45Å; T162-Q165 WeakPolarHBondContact OG1-CG 3.38Å; T162-Q165 PolarHBondContact OG1-N 3.32Å; T162-S166 PolarHBondContact O-N 2.63Å; T162-S166 PolarHBondContact O-OG 3.36Å
163L94.4Very high84.3Confident87 Ų8762 Ų6246%0.45532%0.316SS..Hα-helixtrans-51.9-42.3178.4179.862.6000113A77 H80 S166 I167A77-L163 HydrophobicContact CB-CD1 4.25Å; H80-L163 HydrophobicContact CB-CD1 4.31Å; L163-S166 PolarHBondContact O-N 3.08Å; L163-I167 HydrophobicContact CD1-CD1 4.38Å; L163-I167 HydrophobicContact CG-CD1 4.24Å; L163-I167 VanDerWaalsContact O-CG1 3.29Å; L163-I167 WeakPolarHBondContact O-CG1 3.34Å; L163-I167 PolarHBondContact O-N 3.46Å
164A94.9Very high85.9Confident71 Ų7159.4 Ų59.459%0.58730%0.302SS*.Hα-helixtrans-65.8-43.1178.300000112.2T162 S166 I167 F168T162-A164 PolarHBondContact O-N 3.46Å; T162-A164 VanDerWaalsContact O-N 3.15Å; A164-S166 VanDerWaalsContact C-N 3.35Å; A164-I167 PolarHBondContact O-N 3.48Å; A164-F168 PolarHBondContact O-N 2.88Å
165Q93.4Very high87.4Confident84 Ų8456.4 Ų56.439%0.39329%0.288SS..Hα-helixtrans-68.3-33.9176.5-72-64.2-11.700112.1Q160 T162 F168 F169 M182Q160-Q165 WeakPolarHBondContact O-CB 3.33Å; T162-Q165 CarbonylContact O-C 3.59Å; T162-Q165 PolarHBondContact O-N 3.47Å; T162-Q165 VanDerWaalsContact OG1-CB 3.32Å; T162-Q165 WeakPolarHBondContact OG1-CB 3.45Å; T162-Q165 WeakPolarHBondContact OG1-CG 3.38Å; T162-Q165 PolarHBondContact OG1-N 3.32Å; Q165-F168 WeakPolarHBondContact O-CB 3.22Å; Q165-F168 PolarHBondContact O-N 3.47Å; Q165-F169 WeakPolarHBondContact O-CB 3.44Å; Q165-F169 PolarHBondContact O-N 3.48Å; Q165-M182 HydrophobicContact CB-CE 3.84Å; Q165-M182 HydrophobicContact CB-SD 3.71Å; Q165-M182 HydrophobicContact CG-SD 4.46Å; Q165-M182 WeakPolarHBondContact O-CE 3.3Å; Q165-M182 VanDerWaalsContact OE1-CE 3.3Å
166S96.2Very high88.9Confident0 Ų049.9 Ų49.90%026%0.262CS..Hα-helixtrans-66.8-37.5173.1-52.40000112.3G76 H80 T162 L163 A164 F169 A170G76-S166 WeakPolarHBondContact CA-O 3.43Å; G76-S166 WeakPolarHBondContact O-CB 3.5Å; H80-S166 WeakPolarHBondContact CA-OG 3.34Å; H80-S166 WeakPolarHBondContact CB-OG 3.45Å; T162-S166 PolarHBondContact O-N 2.63Å; T162-S166 PolarHBondContact O-OG 3.36Å; L163-S166 PolarHBondContact O-N 3.08Å; A164-S166 VanDerWaalsContact C-N 3.35Å; S166-F169 PolarHBondContact O-N 3.5Å; S166-A170 WeakPolarHBondContact O-CB 3.15Å; S166-A170 PolarHBondContact O-N 2.87Å
167I96.4Very high90.6Very high46 Ų4650.9 Ų50.924%0.23626%0.264CS..Hα-helixtrans-66.4-42.2172.7-67166.4000110.5V73 L163 A164 A170 T171V73-I167 HydrophobicContact CG1-CD1 4.46Å; L163-I167 HydrophobicContact CD1-CD1 4.38Å; L163-I167 HydrophobicContact CG-CD1 4.24Å; L163-I167 VanDerWaalsContact O-CG1 3.29Å; L163-I167 WeakPolarHBondContact O-CG1 3.34Å; L163-I167 PolarHBondContact O-N 3.46Å; A164-I167 PolarHBondContact O-N 3.48Å; I167-A170 PolarHBondContact O-N 2.7Å; I167-T171 PolarHBondContact O-N 2.83Å; I167-T171 PolarHBondContact O-OG1 3.3Å
168F96.2Very high91.9Very high96 Ų9646.8 Ų46.842%0.42125%0.245SC..Hα-helixtrans-60.5-46.7174179.8-105.7000111.4A164 Q165 A170 T171 T172 Y179 M182A164-F168 PolarHBondContact O-N 2.88Å; Q165-F168 WeakPolarHBondContact O-CB 3.22Å; Q165-F168 PolarHBondContact O-N 3.47Å; F168-A170 PolarHBondContact O-N 2.79Å; F168-T171 WeakPolarHBondContact O-CA 3.45Å; F168-T171 WeakPolarHBondContact O-CB 3.27Å; F168-T171 PolarHBondContact O-N 3.24Å; F168-T171 VanDerWaalsContact O-N 3.11Å; F168-T172 HydrophobicContact CD1-CG2 4.26Å; F168-T172 HydrophobicContact CE1-CG2 3.95Å; F168-T172 HydrophobicContact CE2-CG2 4.45Å; F168-T172 HydrophobicContact CZ-CG2 4.06Å; F168-T172 WeakPolarHBondContact O-CG2 3.12Å; F168-T172 PolarHBondContact O-N 3.32Å; F168-Y179 AromaticContact CE1-CD2 3.93Å; F168-Y179 HydrophobicContact CE1-CD2 3.93Å; F168-Y179 HydrophobicContact CE1-CE2 4.12Å; F168-Y179 AromaticContact CZ-CD2 3.88Å; F168-Y179 HydrophobicContact CZ-CD2 3.88Å; F168-Y179 AromaticContact CZ-CE2 3.57Å; F168-Y179 HydrophobicContact CZ-CE2 3.57Å; F168-M182 HydrophobicContact CD1-CE 4.2Å
169F96.3Very high92.6Very high2 Ų244.2 Ų44.21%0.00924%0.237CC..Hα-helixtrans-54.7-52.2172.9171.2-98.6000111.1F79 W161 Q165 S166 T171 T172 V173 M182 P184 F570F79-F169 HydrophobicContact CD1-CD1 4.38Å; F79-F169 AromaticContact CD1-CE1 3.86Å; F79-F169 HydrophobicContact CD1-CE1 3.86Å; F79-F169 AromaticContact CD2-CD1 3.91Å; F79-F169 HydrophobicContact CD2-CD1 3.91Å; F79-F169 AromaticContact CD2-CE1 3.85Å; F79-F169 HydrophobicContact CD2-CE1 3.85Å; F79-F169 AromaticContact CE1-CE1 3.78Å; F79-F169 HydrophobicContact CE1-CE1 3.78Å; F79-F169 HydrophobicContact CE2-CD1 4.22Å; F79-F169 AromaticContact CE2-CE1 3.78Å; F79-F169 HydrophobicContact CE2-CE1 3.78Å; F79-F169 HydrophobicContact CG-CD1 4.02Å; F79-F169 AromaticContact CG-CE1 3.92Å; F79-F169 HydrophobicContact CG-CE1 3.92Å; F79-F169 AromaticContact CZ-CE1 3.75Å; F79-F169 HydrophobicContact CZ-CE1 3.75Å; W161-F169 HydrophobicContact CH2-CB 4.38Å; W161-F169 AromaticContact CH2-CD1 3.62Å; W161-F169 HydrophobicContact CH2-CD1 3.62Å; W161-F169 HydrophobicContact CH2-CD2 4Å; W161-F169 AromaticContact CH2-CE1 3.85Å; W161-F169 HydrophobicContact CH2-CE1 3.85Å; W161-F169 HydrophobicContact CH2-CE2 4.21Å; W161-F169 AromaticContact CH2-CG 3.71Å; W161-F169 HydrophobicContact CH2-CG 3.71Å; W161-F169 HydrophobicContact CH2-CZ 4.15Å; W161-F169 HydrophobicContact CZ3-CB 4.01Å; W161-F169 AromaticContact CZ3-CD1 3.67Å; W161-F169 HydrophobicContact CZ3-CD1 3.67Å; W161-F169 HydrophobicContact CZ3-CD2 4.47Å; W161-F169 HydrophobicContact CZ3-CE1 4.31Å; W161-F169 AromaticContact CZ3-CG 3.77Å; W161-F169 HydrophobicContact CZ3-CG 3.77Å; Q165-F169 WeakPolarHBondContact O-CB 3.44Å; Q165-F169 PolarHBondContact O-N 3.48Å; S166-F169 PolarHBondContact O-N 3.5Å; F169-T171 PolarHBondContact O-N 3.4Å; F169-T172 WeakPolarHBondContact CA-OG1 3.06Å; F169-T172 WeakPolarHBondContact O-CA 3.4Å; F169-T172 PolarHBondContact O-N 3.33Å; F169-T172 PolarHBondContact O-OG1 3.1Å; F169-V173 HydrophobicContact CD1-CG2 4.14Å; F169-V173 HydrophobicContact CD2-CG2 4.42Å; F169-V173 HydrophobicContact CE1-CG2 3.65Å; F169-V173 HydrophobicContact CE2-CG2 3.96Å; F169-V173 HydrophobicContact CG-CG2 4.49Å; F169-V173 HydrophobicContact CZ-CG2 3.53Å; F169-V173 WeakPolarHBondContact O-CG2 3.43Å; F169-V173 PolarHBondContact O-N 3.35Å; F169-M182 HydrophobicContact CB-CE 4.15Å; F169-M182 HydrophobicContact CD2-CB 4.25Å; F169-M182 VanDerWaalsContact CD2-O 3.29Å; F169-M182 WeakPolarHBondContact CD2-O 3.28Å; F169-M182 WeakPolarHBondContact CE2-O 3.49Å; F169-P184 HydrophobicContact CZ-CG 4.34Å; F169-F570 HydrophobicContact CD2-CE1 4.4Å; F169-F570 HydrophobicContact CE2-CD1 4.34Å; F169-F570 AromaticContact CE2-CE1 3.48Å; F169-F570 HydrophobicContact CE2-CE1 3.48Å; F169-F570 VanDerWaalsContact CE2-CE1 3.48Å; F169-F570 AromaticContact CE2-CZ 3.62Å; F169-F570 HydrophobicContact CE2-CZ 3.62Å; F169-F570 HydrophobicContact CZ-CE1 4.02Å; F169-F570 HydrophobicContact CZ-CE2 4.46Å; F169-F570 AromaticContact CZ-CZ 3.64Å; F169-F570 HydrophobicContact CZ-CZ 3.64Å
170A96.7Very high92.9Very high0 Ų040.8 Ų40.80%022%0.215CC..Hα-helixtrans-56.2-38.4177.800000112.1S166 I167 F168 V173 I174 F196S166-A170 WeakPolarHBondContact O-CB 3.15Å; S166-A170 PolarHBondContact O-N 2.87Å; I167-A170 PolarHBondContact O-N 2.7Å; F168-A170 PolarHBondContact O-N 2.79Å; A170-V173 PolarHBondContact O-N 2.86Å; A170-I174 WeakPolarHBondContact O-CG1 3.48Å; A170-I174 PolarHBondContact O-N 3.5Å; A170-F196 HydrophobicContact CB-CE1 3.91Å; A170-F196 HydrophobicContact CB-CZ 3.85Å; A170-F196 WeakPolarHBondContact O-CE1 3.39Å
171T96Very high92.8Very high51 Ų5143.6 Ų43.631%0.31323%0.232SC..Hα-helixtrans-63.3-45.9172.8-57.90000111.3I167 F168 F169 V173 I174 T175I167-T171 PolarHBondContact O-N 2.83Å; I167-T171 PolarHBondContact O-OG1 3.3Å; F168-T171 WeakPolarHBondContact O-CA 3.45Å; F168-T171 WeakPolarHBondContact O-CB 3.27Å; F168-T171 PolarHBondContact O-N 3.24Å; F168-T171 VanDerWaalsContact O-N 3.11Å; F169-T171 PolarHBondContact O-N 3.4Å; T171-V173 PolarHBondContact O-N 2.93Å; T171-I174 VanDerWaalsContact O-CG1 3.25Å; T171-I174 WeakPolarHBondContact O-CG1 2.93Å; T171-I174 PolarHBondContact O-N 2.8Å; T171-T175 HydrophobicContact CG2-CG2 4.06Å; T171-T175 WeakPolarHBondContact O-CB 3.39Å; T171-T175 VanDerWaalsContact O-CG2 3.31Å; T171-T175 WeakPolarHBondContact O-CG2 3.16Å; T171-T175 PolarHBondContact O-N 3.3Å; T171-T175 PolarHBondContact O-OG1 3.41Å
172T95.1Very high92.6Very high7 Ų744.1 Ų44.14%0.04324%0.235CC..Hα-helixtrans-63.1-28.7178.666.30000113.5F168 F169 T175 T176 I177 G178 Y179F168-T172 HydrophobicContact CD1-CG2 4.26Å; F168-T172 HydrophobicContact CE1-CG2 3.95Å; F168-T172 HydrophobicContact CE2-CG2 4.45Å; F168-T172 HydrophobicContact CZ-CG2 4.06Å; F168-T172 WeakPolarHBondContact O-CG2 3.12Å; F168-T172 PolarHBondContact O-N 3.32Å; F169-T172 WeakPolarHBondContact CA-OG1 3.06Å; F169-T172 WeakPolarHBondContact O-CA 3.4Å; F169-T172 PolarHBondContact O-N 3.33Å; F169-T172 PolarHBondContact O-OG1 3.1Å; T172-T175 WeakPolarHBondContact CA-OG1 3.35Å; T172-T175 PolarHBondContact O-OG1 3.05Å; T172-T176 PolarHBondContact O-N 3.45Å; T172-T176 VanDerWaalsContact O-N 3.16Å; T172-I177 PolarHBondContact O-N 3.27Å; T172-G178 PolarHBondContact O-N 3.43Å; T172-Y179 HydrophobicContact CG2-CD2 3.71Å; T172-Y179 HydrophobicContact CG2-CE2 3.99Å
173V96.3Very high92.5Very high0 Ų042.2 Ų42.20%022%0.223CC..Hα-helixtrans-70.5-52.8174.7-176.70000111F169 A170 T171 T175 T176 F196 I568 F570F169-V173 HydrophobicContact CD1-CG2 4.14Å; F169-V173 HydrophobicContact CD2-CG2 4.42Å; F169-V173 HydrophobicContact CE1-CG2 3.65Å; F169-V173 HydrophobicContact CE2-CG2 3.96Å; F169-V173 HydrophobicContact CG-CG2 4.49Å; F169-V173 HydrophobicContact CZ-CG2 3.53Å; F169-V173 WeakPolarHBondContact O-CG2 3.43Å; F169-V173 PolarHBondContact O-N 3.35Å; A170-V173 PolarHBondContact O-N 2.86Å; T171-V173 PolarHBondContact O-N 2.93Å; V173-T175 VanDerWaalsContact C-N 3.27Å; V173-T175 PolarHBondContact O-N 2.9Å; V173-T176 PolarHBondContact O-N 3.35Å; V173-T176 VanDerWaalsContact O-N 3.15Å; V173-F196 HydrophobicContact CB-CD1 4.2Å; V173-F196 HydrophobicContact CB-CE1 4.23Å; V173-F196 HydrophobicContact CG1-CD1 3.99Å; V173-F196 HydrophobicContact CG1-CE1 4.48Å; V173-I568 HydrophobicContact CG1-CD1 3.9Å; V173-I568 HydrophobicContact CG1-CG1 4.48Å; V173-F570 HydrophobicContact CG2-CE1 4.1Å; V173-F570 HydrophobicContact CG2-CZ 3.68Å
174I95.2Very high92.4Very high4 Ų438 Ų382%0.02120%0.201CC..Hα-helixtrans-67.9-30.5-178.260.3155.5000112.4L68 Y71 T72 A170 T171 T176 F196 L204L68-I174 HydrophobicContact CD1-CD1 3.68Å; L68-I174 HydrophobicContact CD2-CD1 4.39Å; L68-I174 HydrophobicContact CG-CD1 4.13Å; Y71-I174 HydrophobicContact CD1-CG2 4.42Å; Y71-I174 HydrophobicContact CE1-CG2 3.99Å; T72-I174 HydrophobicContact CG2-CD1 3.23Å; T72-I174 HydrophobicContact CG2-CG1 4.08Å; A170-I174 WeakPolarHBondContact O-CG1 3.48Å; A170-I174 PolarHBondContact O-N 3.5Å; T171-I174 VanDerWaalsContact O-CG1 3.25Å; T171-I174 WeakPolarHBondContact O-CG1 2.93Å; T171-I174 PolarHBondContact O-N 2.8Å; I174-T176 VanDerWaalsContact C-N 3.28Å; I174-F196 HydrophobicContact CG2-CD1 4.22Å; I174-F196 HydrophobicContact CG2-CE1 3.5Å; I174-F196 VanDerWaalsContact CG2-CE1 3.5Å; I174-F196 HydrophobicContact CG2-CZ 3.8Å; I174-L204 HydrophobicContact CD1-CD1 4.37Å; I174-L204 WeakPolarHBondContact O-CD2 3.24Å
175T93.8Very high92Very high37 Ų3737.9 Ų37.923%0.22719%0.185CC..THydrogen-bonded Turntrans-84.5-1.117756.50000113.5T171 T172 V173 I177 L204T171-T175 HydrophobicContact CG2-CG2 4.06Å; T171-T175 WeakPolarHBondContact O-CB 3.39Å; T171-T175 VanDerWaalsContact O-CG2 3.31Å; T171-T175 WeakPolarHBondContact O-CG2 3.16Å; T171-T175 PolarHBondContact O-N 3.3Å; T171-T175 PolarHBondContact O-OG1 3.41Å; T172-T175 WeakPolarHBondContact CA-OG1 3.35Å; T172-T175 PolarHBondContact O-OG1 3.05Å; V173-T175 VanDerWaalsContact C-N 3.27Å; V173-T175 PolarHBondContact O-N 2.9Å; T175-I177 PolarHBondContact O-N 3.05Å; T175-I177 VanDerWaalsContact O-N 3.13Å; T175-I177 WeakPolarHBondContact OG1-CD1 3.37Å; T175-I177 WeakPolarHBondContact OG1-CG1 3.28Å; T175-L204 HydrophobicContact CG2-CD2 3.66Å
176T93.9Very high91.9Very high34 Ų3434.8 Ų34.821%0.20917%0.172CC..THydrogen-bonded Turntrans52.434179.669.70000112.7T172 V173 I174 I201 A566 T567 I568T172-T176 PolarHBondContact O-N 3.45Å; T172-T176 VanDerWaalsContact O-N 3.16Å; V173-T176 PolarHBondContact O-N 3.35Å; V173-T176 VanDerWaalsContact O-N 3.15Å; I174-T176 VanDerWaalsContact C-N 3.28Å; T176-I201 HydrophobicContact CG2-CD1 3.62Å; T176-I201 HydrophobicContact CG2-CG1 3.71Å; T176-I201 HydrophobicContact CG2-CG2 3.99Å; T176-A566 WeakPolarHBondContact CG2-O 2.86Å; T176-T567 WeakPolarHBondContact CB-O 3.17Å; T176-T567 VanDerWaalsContact O-O 3.09Å; T176-I568 HydrophobicContact CG2-CG1 4.39Å
177I93.2Very high91.8Very high84 Ų8439.7 Ų39.743%0.43120%0.198SC..  trans-87.3-42.9177.3-65173.4000110.3T172 T175 Y179T172-I177 PolarHBondContact O-N 3.27Å; T175-I177 PolarHBondContact O-N 3.05Å; T175-I177 VanDerWaalsContact O-N 3.13Å; T175-I177 WeakPolarHBondContact OG1-CD1 3.37Å; T175-I177 WeakPolarHBondContact OG1-CG1 3.28Å; I177-Y179 HydrophobicContact CG2-CD1 4.27Å; I177-Y179 HydrophobicContact CG2-CD2 4.02Å; I177-Y179 HydrophobicContact CG2-CE1 3.96Å; I177-Y179 HydrophobicContact CG2-CE2 3.67Å; I177-Y179 HydrophobicContact CG2-CG 4.29Å; I177-Y179 PolarHBondContact O-N 2.79Å
178G88.5Confident91.7Very high1 Ų140.5 Ų40.51%0.0121%0.207CC..  trans40.965175.800000117T172 G180 I568T172-G178 PolarHBondContact O-N 3.43Å; G178-G180 PolarHBondContact O-N 3.07Å; G178-I568 VanDerWaalsContact CA-O 3.29Å; G178-I568 WeakPolarHBondContact CA-O 3.32Å
179Y86.1Confident91.6Very high138 Ų13835.9 Ų35.954%0.54119%0.187SC..  trans-53.7-15.3178.4-70.8-66.5000116.1F168 T172 I177 N181F168-Y179 AromaticContact CE1-CD2 3.93Å; F168-Y179 HydrophobicContact CE1-CD2 3.93Å; F168-Y179 HydrophobicContact CE1-CE2 4.12Å; F168-Y179 AromaticContact CZ-CD2 3.88Å; F168-Y179 HydrophobicContact CZ-CD2 3.88Å; F168-Y179 AromaticContact CZ-CE2 3.57Å; F168-Y179 HydrophobicContact CZ-CE2 3.57Å; T172-Y179 HydrophobicContact CG2-CD2 3.71Å; T172-Y179 HydrophobicContact CG2-CE2 3.99Å; I177-Y179 HydrophobicContact CG2-CD1 4.27Å; I177-Y179 HydrophobicContact CG2-CD2 4.02Å; I177-Y179 HydrophobicContact CG2-CE1 3.96Å; I177-Y179 HydrophobicContact CG2-CE2 3.67Å; I177-Y179 HydrophobicContact CG2-CG 4.29Å; I177-Y179 PolarHBondContact O-N 2.79Å; Y179-N181 PolarHBondContact O-N 3.08Å
180G83.3Confident91.6Very high3 Ų336.5 Ų36.53%0.03119%0.19CC..SBendtrans74.9-18.6-17900000115.2R145 G178 M182 V183 F570R145-G180 PolarHBondContact NH1-O 3.32Å; G178-G180 PolarHBondContact O-N 3.07Å; G180-M182 PolarHBondContact O-N 3.09Å; G180-V183 WeakPolarHBondContact O-CG1 3.37Å; G180-F570 WeakPolarHBondContact CA-O 3.31Å
181N81.1Confident91.5Very high108 Ų10840.3 Ų40.358%0.57821%0.209SC*.SBendtrans-57.5-26.5-178.9-67.4-17.1000114.1Y179Y179-N181 PolarHBondContact O-N 3.08Å
182M84.8Confident91.5Very high22 Ų2239.7 Ų39.711%0.10820%0.204CC..SBendtrans-133.8130172-66.4-179.8-70.100108.8Q160 W161 Q165 F168 F169 G180Q160-M182 HydrophobicContact CB-CG 4.33Å; Q160-M182 HydrophobicContact CB-SD 4.45Å; W161-M182 HydrophobicContact CH2-CB 4.45Å; W161-M182 HydrophobicContact CZ2-CB 4.29Å; Q165-M182 HydrophobicContact CB-CE 3.84Å; Q165-M182 HydrophobicContact CB-SD 3.71Å; Q165-M182 HydrophobicContact CG-SD 4.46Å; Q165-M182 WeakPolarHBondContact O-CE 3.3Å; Q165-M182 VanDerWaalsContact OE1-CE 3.3Å; F168-M182 HydrophobicContact CD1-CE 4.2Å; F169-M182 HydrophobicContact CB-CE 4.15Å; F169-M182 HydrophobicContact CD2-CB 4.25Å; F169-M182 VanDerWaalsContact CD2-O 3.29Å; F169-M182 WeakPolarHBondContact CD2-O 3.28Å; F169-M182 WeakPolarHBondContact CE2-O 3.49Å; G180-M182 PolarHBondContact O-N 3.09Å
183V90.1Very high91.6Very high11 Ų1139.3 Ų39.37%0.06720%0.202CC..  trans-142.9143.5-177.5-630000110.3G180 R185 F570 D572G180-V183 WeakPolarHBondContact O-CG1 3.37Å; V183-R185 PolarHBondContact O-N 3.48Å; V183-F570 HydrophobicContact CG1-CB 3.6Å; V183-F570 HydrophobicContact CG1-CD1 4.16Å; V183-F570 HydrophobicContact CG1-CG 3.89Å; V183-D572 HydrophobicContact CB-CB 4.34Å; V183-D572 HydrophobicContact CG1-CB 4.25Å; V183-D572 HydrophobicContact CG2-CB 4.04Å
184P92.2Very high91.5Very high0 Ų040.4 Ų40.40%021%0.207CC..  trans-72.6122.2178.129.2-31.7000109.6E83 F169 G189 Q190 C193E83-P184 HydrophobicContact CG-CB 4.44Å; F169-P184 HydrophobicContact CZ-CG 4.34Å; P184-G189 VanDerWaalsContact CB-C 3.43Å; P184-Q190 HydrophobicContact CB-CG 4.49Å; P184-Q190 HydrophobicContact CG-CG 4.34Å; P184-Q190 VanDerWaalsContact O-CG 3.28Å; P184-Q190 WeakPolarHBondContact O-CG 3.3Å; P184-C193 HydrophobicContact CG-CB 3.99Å
185R86.3Confident91.5Very high68 Ų6844 Ų4426%0.25723%0.229SC..  trans-100.6-22.2178.4-63.9-61.6-167.2133.611.9112.2E83 E144 V183E83-R185 PolarHBondContact OE2-N 3.3Å; E83-R185 VanDerWaalsContact OE2-N 3.12Å; E144-R185 PolarHBondContact O-NH2 3.26Å; E144-R185 IonicContact OE2-CZ 2.77Å; E144-R185 VanDerWaalsContact OE2-CZ 3.25Å; E144-R185 IonicContact OE2-NH1 3.62Å; E144-R185 PolarHBondContact OE2-NH1 3.09Å; E144-R185 IonicContact OE2-NH2 2.62Å; E144-R185 PolarHBondContact OE2-NH2 2.79Å; E144-R185 VanDerWaalsContact OE2-NH2 3.08Å; V183-R185 PolarHBondContact O-N 3.48Å
186T92.4Very high91.6Very high19 Ų1942.7 Ų42.712%0.11722%0.22CC..SBendtrans-72.5143.9174.372.60000110.4I82 E83 H86 S188 G189 Q190I82-T186 HydrophobicContact CG2-CG2 4.38Å; I82-T186 VanDerWaalsContact CG2-OG1 3.32Å; I82-T186 WeakPolarHBondContact CG2-OG1 3.43Å; E83-T186 VanDerWaalsContact OE1-CB 3.29Å; E83-T186 WeakPolarHBondContact OE1-CB 3.11Å; E83-T186 WeakPolarHBondContact OE1-CG2 3.5Å; E83-T186 PolarHBondContact OE1-N 3.24Å; E83-T186 PolarHBondContact OE1-OG1 2.84Å; H86-T186 HydrophobicContact CB-CG2 3.7Å; H86-T186 VanDerWaalsContact CD2-CG2 3.44Å; H86-T186 WeakPolarHBondContact CD2-CG2 3.44Å; T186-S188 PolarHBondContact O-N 2.87Å; T186-S188 PolarHBondContact OG1-OG 3.12Å; T186-G189 WeakPolarHBondContact O-CA 3.36Å; T186-G189 PolarHBondContact O-N 3.05Å; T186-G189 PolarHBondContact OG1-N 3.29Å; T186-Q190 WeakPolarHBondContact O-CG 3.33Å; T186-Q190 PolarHBondContact O-N 3.1Å
187L93.7Very high91.6Very high103 Ų10341 Ų4154%0.53921%0.211SC..Hα-helixtrans-52.6-41.8171.6178.764.1000111.3G189 Q190 I191 F555L187-G189 PolarHBondContact O-N 3Å; L187-Q190 PolarHBondContact O-N 2.65Å; L187-I191 HydrophobicContact CD1-CD1 4.16Å; L187-I191 HydrophobicContact CD1-CG1 4.44Å; L187-I191 HydrophobicContact CG-CD1 4Å; L187-I191 VanDerWaalsContact O-CG1 3.24Å; L187-I191 WeakPolarHBondContact O-CG1 3.4Å; L187-I191 PolarHBondContact O-N 3.02Å; L187-F555 HydrophobicContact CD1-CD1 3.48Å; L187-F555 VanDerWaalsContact CD1-CD1 3.48Å; L187-F555 HydrophobicContact CD1-CD2 4.22Å; L187-F555 HydrophobicContact CD1-CE1 3.39Å; L187-F555 HydrophobicContact CD1-CE2 4.13Å; L187-F555 HydrophobicContact CD1-CG 3.92Å; L187-F555 HydrophobicContact CD1-CZ 3.74Å
188S94Very high91.5Very high62 Ų6239.4 Ų39.443%0.43421%0.209SC..Hα-helixtrans-61-4217540.80000113.1I82 T186 L192I82-S188 WeakPolarHBondContact CG2-OG 3.39Å; T186-S188 PolarHBondContact O-N 2.87Å; T186-S188 PolarHBondContact OG1-OG 3.12Å; S188-L192 VanDerWaalsContact O-CB 3.24Å; S188-L192 WeakPolarHBondContact O-CB 3.44Å; S188-L192 PolarHBondContact O-N 2.84Å
189G94.8Very high91.5Very high0 Ų044.1 Ų44.10%023%0.234CC..Hα-helixtrans-69-39.6178.300000112.2P184 T186 L187 L192 C193P184-G189 VanDerWaalsContact CB-C 3.43Å; T186-G189 WeakPolarHBondContact O-CA 3.36Å; T186-G189 PolarHBondContact O-N 3.05Å; T186-G189 PolarHBondContact OG1-N 3.29Å; L187-G189 PolarHBondContact O-N 3Å; G189-L192 PolarHBondContact O-N 3.38Å; G189-C193 VanDerWaalsContact O-CB 3.3Å; G189-C193 WeakPolarHBondContact O-CB 3.25Å; G189-C193 PolarHBondContact O-N 2.94Å
190Q95.4Very high91.9Very high15 Ų1537.6 Ų37.67%0.0721%0.208CC..Hα-helixtrans-64.9-45.7175.5-70.1173.2-24.300111.3P184 T186 L187 L192 C193 I194 F555 Y559P184-Q190 HydrophobicContact CB-CG 4.49Å; P184-Q190 HydrophobicContact CG-CG 4.34Å; P184-Q190 VanDerWaalsContact O-CG 3.28Å; P184-Q190 WeakPolarHBondContact O-CG 3.3Å; T186-Q190 WeakPolarHBondContact O-CG 3.33Å; T186-Q190 PolarHBondContact O-N 3.1Å; L187-Q190 PolarHBondContact O-N 2.65Å; Q190-L192 PolarHBondContact O-N 3.31Å; Q190-C193 WeakPolarHBondContact O-CB 3.43Å; Q190-C193 PolarHBondContact O-N 2.81Å; Q190-I194 WeakPolarHBondContact O-CG1 3.47Å; Q190-I194 PolarHBondContact O-N 2.91Å; Q190-F555 HydrophobicContact CB-CE1 3.82Å; Q190-F555 HydrophobicContact CB-CZ 4.2Å; Q190-F555 VanDerWaalsContact OE1-CE1 3.31Å; Q190-Y559 HydrophobicContact CB-CD2 3.8Å; Q190-Y559 HydrophobicContact CB-CE2 3.86Å; Q190-Y559 HydrophobicContact CB-CG 4.49Å; Q190-Y559 HydrophobicContact CG-CD2 4.14Å; Q190-Y559 HydrophobicContact CG-CE2 3.92Å
191I95.9Very high92.3Very high79 Ų7938.1 Ų38.141%0.40521%0.21SC..Hα-helixtrans-60.3-46.3173.7-67.2169.1000110.6L187 C193 I194 V195 F555L187-I191 HydrophobicContact CD1-CD1 4.16Å; L187-I191 HydrophobicContact CD1-CG1 4.44Å; L187-I191 HydrophobicContact CG-CD1 4Å; L187-I191 VanDerWaalsContact O-CG1 3.24Å; L187-I191 WeakPolarHBondContact O-CG1 3.4Å; L187-I191 PolarHBondContact O-N 3.02Å; I191-C193 VanDerWaalsContact C-N 3.28Å; I191-C193 PolarHBondContact O-N 2.94Å; I191-I194 PolarHBondContact O-N 3.08Å; I191-V195 PolarHBondContact O-N 2.76Å; I191-F555 HydrophobicContact CD1-CE2 4.41Å; I191-F555 HydrophobicContact CD1-CZ 4.38Å; I191-F555 HydrophobicContact CG1-CE2 3.77Å; I191-F555 HydrophobicContact CG1-CZ 3.49Å; I191-F555 VanDerWaalsContact CG1-CZ 3.49Å
192L95.8Very high92.6Very high38 Ų3834.4 Ų34.420%0.19919%0.192CC..Hα-helixtrans-58.7-42.5176.6178.566.1000110.9I78 F79 I82 S188 G189 Q190 I194 V195 F196I78-L192 HydrophobicContact CB-CD2 4.13Å; I78-L192 HydrophobicContact CG2-CD1 4.32Å; I78-L192 HydrophobicContact CG2-CD2 3.43Å; I78-L192 VanDerWaalsContact CG2-CD2 3.43Å; F79-L192 HydrophobicContact CD1-CD2 3.83Å; F79-L192 HydrophobicContact CD2-CD2 4.37Å; F79-L192 HydrophobicContact CE1-CB 4.21Å; F79-L192 HydrophobicContact CE1-CD2 3.66Å; F79-L192 HydrophobicContact CE1-CG 3.92Å; F79-L192 HydrophobicContact CE2-CD2 4.22Å; F79-L192 HydrophobicContact CE2-CG 4.35Å; F79-L192 HydrophobicContact CG-CD2 4.16Å; F79-L192 HydrophobicContact CZ-CB 4.37Å; F79-L192 HydrophobicContact CZ-CD2 3.85Å; F79-L192 HydrophobicContact CZ-CG 3.78Å; I82-L192 HydrophobicContact CD1-CD2 4Å; S188-L192 VanDerWaalsContact O-CB 3.24Å; S188-L192 WeakPolarHBondContact O-CB 3.44Å; S188-L192 PolarHBondContact O-N 2.84Å; G189-L192 PolarHBondContact O-N 3.38Å; Q190-L192 PolarHBondContact O-N 3.31Å; L192-I194 VanDerWaalsContact C-N 3.35Å; L192-I194 PolarHBondContact O-N 2.93Å; L192-V195 PolarHBondContact O-N 3.43Å; L192-F196 WeakPolarHBondContact O-CA 3.17Å; L192-F196 WeakPolarHBondContact O-CB 3.21Å; L192-F196 PolarHBondContact O-N 2.96Å
193C96.6Very high92.8Very high0 Ų035 Ų350%020%0.196CC..Hα-helixtrans-63-39177.6-169.10000112.8F79 P184 G189 Q190 I191 G197 F570F79-C193 HydrophobicContact CE1-CB 4.23Å; F79-C193 HydrophobicContact CZ-CB 4.06Å; P184-C193 HydrophobicContact CG-CB 3.99Å; G189-C193 VanDerWaalsContact O-CB 3.3Å; G189-C193 WeakPolarHBondContact O-CB 3.25Å; G189-C193 PolarHBondContact O-N 2.94Å; Q190-C193 WeakPolarHBondContact O-CB 3.43Å; Q190-C193 PolarHBondContact O-N 2.81Å; I191-C193 VanDerWaalsContact C-N 3.28Å; I191-C193 PolarHBondContact O-N 2.94Å; C193-G197 PolarHBondContact O-N 3.46Å; C193-F570 VanDerWaalsContact SG-CE2 3.51Å
194I95Very high92.8Very high22 Ų2235.7 Ų35.711%0.11320%0.199CC..Hα-helixtrans-62.3-51.9174.7-66.8165.3000110.2Q190 I191 L192 F196 G197 A198 F555 F558 Y559 F562Q190-I194 WeakPolarHBondContact O-CG1 3.47Å; Q190-I194 PolarHBondContact O-N 2.91Å; I191-I194 PolarHBondContact O-N 3.08Å; L192-I194 VanDerWaalsContact C-N 3.35Å; L192-I194 PolarHBondContact O-N 2.93Å; I194-F196 PolarHBondContact O-N 2.69Å; I194-G197 PolarHBondContact O-N 3.26Å; I194-A198 WeakPolarHBondContact O-CB 3.32Å; I194-A198 PolarHBondContact O-N 3.18Å; I194-F555 HydrophobicContact CD1-CZ 4.18Å; I194-F558 HydrophobicContact CD1-CD1 4.23Å; I194-F558 HydrophobicContact CD1-CE1 4.09Å; I194-Y559 HydrophobicContact CD1-CD2 4.05Å; I194-Y559 HydrophobicContact CG1-CD2 4.08Å; I194-F562 HydrophobicContact CB-CD1 4.09Å; I194-F562 HydrophobicContact CB-CE1 4.19Å; I194-F562 HydrophobicContact CB-CG 4.48Å; I194-F562 HydrophobicContact CG1-CB 4.43Å; I194-F562 HydrophobicContact CG1-CD1 3.76Å; I194-F562 HydrophobicContact CG1-CE1 4.33Å; I194-F562 HydrophobicContact CG1-CG 4.14Å; I194-F562 HydrophobicContact CG2-CD1 3.97Å; I194-F562 HydrophobicContact CG2-CD2 3.98Å; I194-F562 HydrophobicContact CG2-CE1 4.06Å; I194-F562 HydrophobicContact CG2-CE2 4.04Å; I194-F562 HydrophobicContact CG2-CG 3.94Å; I194-F562 HydrophobicContact CG2-CZ 4.09Å; I194-F562 VanDerWaalsContact O-CZ 3.28Å; I194-F562 WeakPolarHBondContact O-CZ 3.32Å
195V94.5Very high92.7Very high79 Ų7939.5 Ų39.548%0.47922%0.219SC..Hα-helixtrans-64.9-41.3-178.7176.20000111.4I191 L192 A198 L199I191-V195 PolarHBondContact O-N 2.76Å; L192-V195 PolarHBondContact O-N 3.43Å; V195-A198 PolarHBondContact O-N 2.88Å; V195-L199 HydrophobicContact CG1-CD1 4.21Å; V195-L199 WeakPolarHBondContact O-CG 3.28Å; V195-L199 PolarHBondContact O-N 3.09Å
196F95.8Very high92.6Very high10 Ų1037.4 Ų37.44%0.04421%0.212CC..Hα-helixtrans-67.5-43.9179.5-175.5-99.6000111.7Y71 F79 A170 V173 I174 L192 I194 G200Y71-F196 HydrophobicContact CD1-CD2 4.49Å; Y71-F196 AromaticContact CD1-CE2 3.66Å; Y71-F196 HydrophobicContact CD1-CE2 3.66Å; Y71-F196 AromaticContact CD1-CZ 3.94Å; Y71-F196 HydrophobicContact CD1-CZ 3.94Å; Y71-F196 AromaticContact CE1-CD2 3.59Å; Y71-F196 HydrophobicContact CE1-CD2 3.59Å; Y71-F196 HydrophobicContact CE1-CE1 4.28Å; Y71-F196 AromaticContact CE1-CE2 3.13Å; Y71-F196 HydrophobicContact CE1-CE2 3.13Å; Y71-F196 HydrophobicContact CE1-CG 4.31Å; Y71-F196 AromaticContact CE1-CZ 3.53Å; Y71-F196 HydrophobicContact CE1-CZ 3.53Å; Y71-F196 HydrophobicContact CE2-CD2 4.18Å; Y71-F196 HydrophobicContact CE2-CE2 4.12Å; Y71-F196 HydrophobicContact CG-CE2 4.33Å; Y71-F196 AromaticContact CZ-CD2 3.41Å; Y71-F196 VanDerWaalsContact CZ-CD2 3.41Å; Y71-F196 AromaticContact CZ-CE2 3.41Å; Y71-F196 VanDerWaalsContact CZ-CE2 3.41Å; Y71-F196 WeakPolarHBondContact OH-CA 3.36Å; Y71-F196 VanDerWaalsContact OH-CD2 3.22Å; Y71-F196 WeakPolarHBondContact OH-CD2 3.46Å; Y71-F196 PolarHBondContact OH-O 2.91Å; F79-F196 HydrophobicContact CE2-CD1 4.06Å; F79-F196 HydrophobicContact CE2-CE1 4.48Å; F79-F196 HydrophobicContact CE2-CG 4.21Å; A170-F196 HydrophobicContact CB-CE1 3.91Å; A170-F196 HydrophobicContact CB-CZ 3.85Å; A170-F196 WeakPolarHBondContact O-CE1 3.39Å; V173-F196 HydrophobicContact CB-CD1 4.2Å; V173-F196 HydrophobicContact CB-CE1 4.23Å; V173-F196 HydrophobicContact CG1-CD1 3.99Å; V173-F196 HydrophobicContact CG1-CE1 4.48Å; I174-F196 HydrophobicContact CG2-CD1 4.22Å; I174-F196 HydrophobicContact CG2-CE1 3.5Å; I174-F196 VanDerWaalsContact CG2-CE1 3.5Å; I174-F196 HydrophobicContact CG2-CZ 3.8Å; L192-F196 WeakPolarHBondContact O-CA 3.17Å; L192-F196 WeakPolarHBondContact O-CB 3.21Å; L192-F196 PolarHBondContact O-N 2.96Å; I194-F196 PolarHBondContact O-N 2.69Å; F196-G200 WeakPolarHBondContact O-CA 3.21Å; F196-G200 PolarHBondContact O-N 3.17Å
197G94.5Very high92.4Very high0 Ų036.6 Ų36.60%021%0.207CC..Hα-helixtrans-62.9-46.7172.900000112.1C193 I194 L199 G200 I201C193-G197 PolarHBondContact O-N 3.46Å; I194-G197 PolarHBondContact O-N 3.26Å; G197-L199 VanDerWaalsContact C-N 3.26Å; G197-L199 PolarHBondContact O-N 3.05Å; G197-G200 PolarHBondContact O-N 3.33Å; G197-I201 WeakPolarHBondContact O-CB 3.38Å; G197-I201 WeakPolarHBondContact O-CD1 3.09Å; G197-I201 VanDerWaalsContact O-CG1 3.24Å; G197-I201 WeakPolarHBondContact O-CG1 3.48Å; G197-I201 PolarHBondContact O-N 3.42Å
198A90.7Very high92.2Very high49 Ų4935.4 Ų35.441%0.40520%0.204SC..Hα-helixtrans-60.6-32.8-17700000113.4I194 V195 P202 F562I194-A198 WeakPolarHBondContact O-CB 3.32Å; I194-A198 PolarHBondContact O-N 3.18Å; V195-A198 PolarHBondContact O-N 2.88Å; A198-P202 VanDerWaalsContact O-CD 3.29Å; A198-P202 WeakPolarHBondContact O-CD 3.32Å; A198-P202 WeakPolarHBondContact O-CG 3.17Å; A198-F562 HydrophobicContact CB-CE2 4.12Å; A198-F562 HydrophobicContact CB-CZ 3.87Å
199L89.6Confident91.7Very high101 Ų10135.5 Ų35.553%0.52921%0.208SC..Hα-helixtrans-92.8-39.3177.1-64.3176.1000112.5V195 G197 L203V195-L199 HydrophobicContact CG1-CD1 4.21Å; V195-L199 WeakPolarHBondContact O-CG 3.28Å; V195-L199 PolarHBondContact O-N 3.09Å; G197-L199 VanDerWaalsContact C-N 3.26Å; G197-L199 PolarHBondContact O-N 3.05Å; L199-L203 WeakPolarHBondContact O-CB 3.32Å; L199-L203 PolarHBondContact O-N 3.42Å
200G92.6Very high91.1Very high0 Ų037.1 Ų37.10%022%0.217CC..Hα-helixtrans-74.7-37.4-173.500000114.4Y71 F196 G197 L203 L204Y71-G200 VanDerWaalsContact CE1-CA 3.48Å; Y71-G200 PolarHBondContact OH-N 3.38Å; F196-G200 WeakPolarHBondContact O-CA 3.21Å; F196-G200 PolarHBondContact O-N 3.17Å; G197-G200 PolarHBondContact O-N 3.33Å; G200-L203 PolarHBondContact O-N 3.48Å; G200-L204 WeakPolarHBondContact O-CB 3.35Å; G200-L204 PolarHBondContact O-N 2.98Å
201I92.4Very high90.6Very high15 Ų1540 Ų408%0.07723%0.233CC..Hα-helixtrans-64.7-50.4-179.4-63.4164.6000111T176 G197 L203 L204 L205 A566 I568T176-I201 HydrophobicContact CG2-CD1 3.62Å; T176-I201 HydrophobicContact CG2-CG1 3.71Å; T176-I201 HydrophobicContact CG2-CG2 3.99Å; G197-I201 WeakPolarHBondContact O-CB 3.38Å; G197-I201 WeakPolarHBondContact O-CD1 3.09Å; G197-I201 VanDerWaalsContact O-CG1 3.24Å; G197-I201 WeakPolarHBondContact O-CG1 3.48Å; G197-I201 PolarHBondContact O-N 3.42Å; I201-L203 VanDerWaalsContact C-N 3.29Å; I201-L203 PolarHBondContact O-N 3.24Å; I201-L204 PolarHBondContact O-N 3.38Å; I201-L205 HydrophobicContact CG2-CD1 4.2Å; I201-L205 WeakPolarHBondContact O-CG 3.34Å; I201-L205 PolarHBondContact O-N 3.38Å; I201-A566 HydrophobicContact CD1-CB 3.77Å; I201-I568 HydrophobicContact CD1-CD1 4.04Å; I201-I568 HydrophobicContact CD1-CG1 4.04Å
202P87.6Confident90.1Very high30 Ų3038.1 Ų38.120%0.19523%0.232CC..Hα-helixtrans-59.9-39.3174.7-24.335000112.7A198 L205 I206A198-P202 VanDerWaalsContact O-CD 3.29Å; A198-P202 WeakPolarHBondContact O-CD 3.32Å; A198-P202 WeakPolarHBondContact O-CG 3.17Å; P202-L205 PolarHBondContact O-N 3.28Å; P202-I206 WeakPolarHBondContact O-CD1 3.36Å; P202-I206 VanDerWaalsContact O-CG1 3.26Å; P202-I206 WeakPolarHBondContact O-CG1 3.45Å; P202-I206 PolarHBondContact O-N 3.36Å
203L88.4Confident89.4Confident34 Ų3442.1 Ų42.118%0.17825%0.248CC..Hα-helixtrans-60.7-48.1176.7179.262.5000110.7L64 L67 L68 Y71 L199 G200 I201 L205 I206 T207L64-L203 HydrophobicContact CD1-CD1 3.98Å; L67-L203 HydrophobicContact CD2-CD1 4.24Å; L68-L203 HydrophobicContact CD1-CD2 3.96Å; L68-L203 HydrophobicContact CD1-CG 3.95Å; Y71-L203 HydrophobicContact CD1-CD2 4.45Å; Y71-L203 HydrophobicContact CG-CD2 4.33Å; L199-L203 WeakPolarHBondContact O-CB 3.32Å; L199-L203 PolarHBondContact O-N 3.42Å; G200-L203 PolarHBondContact O-N 3.48Å; I201-L203 VanDerWaalsContact C-N 3.29Å; I201-L203 PolarHBondContact O-N 3.24Å; L203-L205 PolarHBondContact O-N 3.24Å; L203-I206 PolarHBondContact O-N 3.03Å; L203-T207 HydrophobicContact CD1-CG2 4.34Å; L203-T207 HydrophobicContact CG-CG2 4.38Å; L203-T207 WeakPolarHBondContact O-CG2 3.35Å; L203-T207 PolarHBondContact O-N 2.97Å
204L91.8Very high88.6Confident26 Ų2645.9 Ų45.914%0.13627%0.265CS..Hα-helixtrans-58.8-49.1176.4177.772.6000111L68 I174 T175 G200 I201 I206 T207 V208L68-L204 HydrophobicContact CD1-CB 4.32Å; L68-L204 HydrophobicContact CD2-CD1 3.57Å; I174-L204 HydrophobicContact CD1-CD1 4.37Å; I174-L204 WeakPolarHBondContact O-CD2 3.24Å; T175-L204 HydrophobicContact CG2-CD2 3.66Å; G200-L204 WeakPolarHBondContact O-CB 3.35Å; G200-L204 PolarHBondContact O-N 2.98Å; I201-L204 PolarHBondContact O-N 3.38Å; L204-I206 VanDerWaalsContact C-N 3.27Å; L204-I206 PolarHBondContact O-N 3.27Å; L204-T207 WeakPolarHBondContact CA-OG1 3.15Å; L204-T207 CarbonylContact O-C 3.52Å; L204-T207 WeakPolarHBondContact O-CA 3.36Å; L204-T207 PolarHBondContact O-N 3.08Å; L204-T207 PolarHBondContact O-OG1 2.94Å; L204-V208 HydrophobicContact CD1-CG2 3.91Å; L204-V208 HydrophobicContact CG-CG2 4.02Å; L204-V208 WeakPolarHBondContact O-CG2 3.27Å; L204-V208 PolarHBondContact O-N 3.23Å
205L88.9Confident88Confident80 Ų8049.2 Ų49.242%0.41928%0.282SS..Hα-helixtrans-59-39.8-178.4-70.6175.8000112.2I201 P202 L203 V208 A209 I599I201-L205 HydrophobicContact CG2-CD1 4.2Å; I201-L205 WeakPolarHBondContact O-CG 3.34Å; I201-L205 PolarHBondContact O-N 3.38Å; P202-L205 PolarHBondContact O-N 3.28Å; L203-L205 PolarHBondContact O-N 3.24Å; L205-V208 PolarHBondContact O-N 2.87Å; L205-A209 WeakPolarHBondContact O-CB 3.4Å; L205-A209 PolarHBondContact O-N 3.44Å; L205-I599 HydrophobicContact CD1-CD1 4.01Å; L205-I599 HydrophobicContact CD1-CG2 3.5Å
206I85.1Confident87.3Confident23 Ų2348.8 Ų48.812%0.11828%0.283CS..Hα-helixtrans-64.7-44.6173.6-64.6164.3000110.4L64 P202 L203 L204 V208 A209 D210 Y606 L610L64-I206 HydrophobicContact CD2-CG2 4.13Å; P202-I206 WeakPolarHBondContact O-CD1 3.36Å; P202-I206 VanDerWaalsContact O-CG1 3.26Å; P202-I206 WeakPolarHBondContact O-CG1 3.45Å; P202-I206 PolarHBondContact O-N 3.36Å; L203-I206 PolarHBondContact O-N 3.03Å; L204-I206 VanDerWaalsContact C-N 3.27Å; L204-I206 PolarHBondContact O-N 3.27Å; I206-V208 VanDerWaalsContact C-N 3.33Å; I206-V208 PolarHBondContact O-N 3.12Å; I206-A209 PolarHBondContact O-N 3.3Å; I206-D210 VanDerWaalsContact O-CB 3.31Å; I206-D210 WeakPolarHBondContact O-CB 3.32Å; I206-D210 PolarHBondContact O-N 3.26Å; I206-Y606 HydrophobicContact CD1-CD2 4.37Å; I206-Y606 HydrophobicContact CD1-CG 4.07Å; I206-L610 HydrophobicContact CG2-CD2 4.46Å
207T86.5Confident86.5Confident2 Ų252 Ų521%0.01230%0.3CS..Hα-helixtrans-62-39.7177.772.80000112.2L64 L68 L203 L204 D210 I211L64-T207 HydrophobicContact CD1-CG2 3.89Å; L64-T207 HydrophobicContact CD2-CG2 3.98Å; L64-T207 HydrophobicContact CG-CG2 3.52Å; L68-T207 HydrophobicContact CB-CG2 4Å; L68-T207 HydrophobicContact CD1-CG2 4.44Å; L68-T207 HydrophobicContact CD2-CG2 4.04Å; L68-T207 HydrophobicContact CG-CG2 4.4Å; L203-T207 HydrophobicContact CD1-CG2 4.34Å; L203-T207 HydrophobicContact CG-CG2 4.38Å; L203-T207 WeakPolarHBondContact O-CG2 3.35Å; L203-T207 PolarHBondContact O-N 2.97Å; L204-T207 WeakPolarHBondContact CA-OG1 3.15Å; L204-T207 CarbonylContact O-C 3.52Å; L204-T207 WeakPolarHBondContact O-CA 3.36Å; L204-T207 PolarHBondContact O-N 3.08Å; L204-T207 PolarHBondContact O-OG1 2.94Å; T207-D210 PolarHBondContact O-N 2.85Å; T207-I211 WeakPolarHBondContact O-CB 3.29Å; T207-I211 WeakPolarHBondContact O-CD1 3.29Å; T207-I211 WeakPolarHBondContact O-CG1 3.45Å; T207-I211 PolarHBondContact O-N 2.63Å
208V89.3Confident85.9Confident79 Ų7956.7 Ų56.748%0.47932%0.321SS..Hα-helixtrans-69.7-42.1179.51710000110.4L204 L205 I206 D210 I211 G212L204-V208 HydrophobicContact CD1-CG2 3.91Å; L204-V208 HydrophobicContact CG-CG2 4.02Å; L204-V208 WeakPolarHBondContact O-CG2 3.27Å; L204-V208 PolarHBondContact O-N 3.23Å; L205-V208 PolarHBondContact O-N 2.87Å; I206-V208 VanDerWaalsContact C-N 3.33Å; I206-V208 PolarHBondContact O-N 3.12Å; V208-D210 VanDerWaalsContact C-N 3.29Å; V208-D210 PolarHBondContact O-N 2.95Å; V208-I211 PolarHBondContact O-N 3.38Å; V208-G212 PolarHBondContact O-N 2.91Å
209A84Confident85.3Confident63 Ų6359.1 Ų59.152%0.52133%0.325SS..Hα-helixtrans-60.6-41174.800000111.7L205 I206 G212 K213L205-A209 WeakPolarHBondContact O-CB 3.4Å; L205-A209 PolarHBondContact O-N 3.44Å; I206-A209 PolarHBondContact O-N 3.3Å; A209-G212 PolarHBondContact O-N 3.4Å; A209-K213 PolarHBondContact O-N 3.38Å
210D82.4Confident84.9Confident35 Ų3557.1 Ų57.119%0.18732%0.317CS..Hα-helixtrans-67.4-46.1177.6-171.463.3000112.4H61 L64 I206 T207 V208 G212 K213 F214H61-D210 VanDerWaalsContact CA-OD2 3.3Å; H61-D210 WeakPolarHBondContact CA-OD2 3.22Å; H61-D210 WeakPolarHBondContact CB-OD2 3.2Å; H61-D210 IonicContact CE1-OD1 2.81Å; H61-D210 PolarHBondContact CE1-OD1 3.04Å; H61-D210 IonicContact CE1-OD2 3.96Å; H61-D210 IonicContact CG-OD2 2.83Å; H61-D210 IonicContact ND1-OD1 2.63Å; H61-D210 PolarHBondContact ND1-OD1 2.88Å; H61-D210 IonicContact ND1-OD2 2.87Å; H61-D210 PolarHBondContact ND1-OD2 2.88Å; L64-D210 HydrophobicContact CD2-CB 3.87Å; I206-D210 VanDerWaalsContact O-CB 3.31Å; I206-D210 WeakPolarHBondContact O-CB 3.32Å; I206-D210 PolarHBondContact O-N 3.26Å; T207-D210 PolarHBondContact O-N 2.85Å; V208-D210 VanDerWaalsContact C-N 3.29Å; V208-D210 PolarHBondContact O-N 2.95Å; D210-G212 VanDerWaalsContact C-N 3.29Å; D210-G212 PolarHBondContact O-N 2.8Å; D210-K213 WeakPolarHBondContact O-CB 3.34Å; D210-K213 PolarHBondContact O-N 3.36Å; D210-F214 PolarHBondContact O-N 2.95Å
211I85.5Confident84.2Confident76 Ų7662.9 Ų62.939%0.3934%0.34SS..Hα-helixtrans-59.4-40.8172.3-69163.3000110.8V65 T207 V208 K213 F214 L215V65-I211 HydrophobicContact CG2-CD1 3.93Å; V65-I211 HydrophobicContact CG2-CG1 4.1Å; T207-I211 WeakPolarHBondContact O-CB 3.29Å; T207-I211 WeakPolarHBondContact O-CD1 3.29Å; T207-I211 WeakPolarHBondContact O-CG1 3.45Å; T207-I211 PolarHBondContact O-N 2.63Å; V208-I211 PolarHBondContact O-N 3.38Å; I211-K213 VanDerWaalsContact C-N 3.34Å; I211-K213 PolarHBondContact O-N 3.4Å; I211-F214 PolarHBondContact O-N 3.43Å; I211-L215 WeakPolarHBondContact O-CB 3.48Å; I211-L215 PolarHBondContact O-N 3.45Å
212G84.7Confident83.6Confident39 Ų3966.8 Ų66.840%0.40236%0.356SS..Hα-helixtrans-61.5-41.5177.300000112.4V208 A209 D210 L215 S216V208-G212 PolarHBondContact O-N 2.91Å; A209-G212 PolarHBondContact O-N 3.4Å; D210-G212 VanDerWaalsContact C-N 3.29Å; D210-G212 PolarHBondContact O-N 2.8Å; G212-L215 PolarHBondContact O-N 3.46Å; G212-S216 PolarHBondContact O-N 2.92Å
213K81.4Confident83.3Confident121 Ų12172.4 Ų72.453%0.52638%0.375SS..Hα-helixtrans-64.6-46.5173.8-175.2175.4-179.3175.50111.6A209 D210 I211 L215 S216 D217A209-K213 PolarHBondContact O-N 3.38Å; D210-K213 WeakPolarHBondContact O-CB 3.34Å; D210-K213 PolarHBondContact O-N 3.36Å; I211-K213 VanDerWaalsContact C-N 3.34Å; I211-K213 PolarHBondContact O-N 3.4Å; K213-L215 VanDerWaalsContact C-N 3.31Å; K213-L215 PolarHBondContact O-N 2.9Å; K213-S216 WeakPolarHBondContact O-CB 3.45Å; K213-S216 PolarHBondContact O-N 2.94Å; K213-D217 PolarHBondContact O-N 3.35Å
214F81Confident82.9Confident80 Ų8077.8 Ų77.835%0.35139%0.393SS..Hα-helixtrans-57.9-43.9175.5173.7-103.4000111.9T58 D210 I211 S216 D217 F218T58-F214 HydrophobicContact CG2-CE2 3.81Å; T58-F214 HydrophobicContact CG2-CZ 4.5Å; D210-F214 PolarHBondContact O-N 2.95Å; I211-F214 PolarHBondContact O-N 3.43Å; F214-S216 PolarHBondContact O-N 3.24Å; F214-D217 PolarHBondContact O-N 3.31Å; F214-F218 WeakPolarHBondContact O-CB 3.36Å; F214-F218 PolarHBondContact O-N 3.22Å
215L82Confident82.3Confident91 Ų9180.4 Ų80.448%0.47640%0.404SS..Hα-helixtrans-62.7-41.5176.9-174.364.8000111.4I211 G212 K213 F218 M219I211-L215 WeakPolarHBondContact O-CB 3.48Å; I211-L215 PolarHBondContact O-N 3.45Å; G212-L215 PolarHBondContact O-N 3.46Å; K213-L215 VanDerWaalsContact C-N 3.31Å; K213-L215 PolarHBondContact O-N 2.9Å; L215-F218 PolarHBondContact O-N 3.29Å; L215-M219 HydrophobicContact CD1-CE 3.72Å; L215-M219 HydrophobicContact CG-CE 4.38Å; L215-M219 WeakPolarHBondContact O-CB 3.43Å; L215-M219 WeakPolarHBondContact O-CG 3.37Å; L215-M219 PolarHBondContact O-N 3.26Å
216S80.1Confident81.7Confident70 Ų7081.4 Ų81.449%0.4941%0.408SS..Hα-helixtrans-61.9-45.3175.9-175.60000112.4G212 K213 F214 M219 T220G212-S216 PolarHBondContact O-N 2.92Å; K213-S216 WeakPolarHBondContact O-CB 3.45Å; K213-S216 PolarHBondContact O-N 2.94Å; F214-S216 PolarHBondContact O-N 3.24Å; S216-M219 PolarHBondContact O-N 3.02Å; S216-T220 WeakPolarHBondContact O-CB 3.42Å; S216-T220 PolarHBondContact O-N 2.97Å; S216-T220 PolarHBondContact O-OG1 3.28Å
217D79Confident81.2Confident77 Ų7786.8 Ų86.841%0.41243%0.43SS..Hα-helixtrans-64.9-41.3177.1-74.8-23.9000111.4K213 F214 T220 Y221K213-D217 PolarHBondContact O-N 3.35Å; F214-D217 PolarHBondContact O-N 3.31Å; D217-T220 PolarHBondContact O-N 2.8Å; D217-Y221 WeakPolarHBondContact O-CB 3.45Å; D217-Y221 PolarHBondContact O-N 2.93Å
218F80.2Confident80.4Confident100 Ų10093.1 Ų93.144%0.43946%0.458SS..Hα-helixtrans-61.6-47173.8176.4-98.1000111.8F214 L215 T220 Y221 F222F214-F218 WeakPolarHBondContact O-CB 3.36Å; F214-F218 PolarHBondContact O-N 3.22Å; L215-F218 PolarHBondContact O-N 3.29Å; F218-T220 VanDerWaalsContact C-N 3.28Å; F218-T220 PolarHBondContact O-N 2.9Å; F218-Y221 WeakPolarHBondContact O-CB 3.34Å; F218-Y221 PolarHBondContact O-N 3.15Å; F218-Y221 VanDerWaalsContact O-N 3.16Å; F218-F222 WeakPolarHBondContact O-CB 3.31Å; F218-F222 PolarHBondContact O-N 3.13Å
219M79Confident79.2Confident99 Ų9995.2 Ų95.249%0.48846%0.46SS..Hα-helixtrans-61.8-38.4176.3-71.2-60.516700111.3L215 S216 F222 Y223L215-M219 HydrophobicContact CD1-CE 3.72Å; L215-M219 HydrophobicContact CG-CE 4.38Å; L215-M219 WeakPolarHBondContact O-CB 3.43Å; L215-M219 WeakPolarHBondContact O-CG 3.37Å; L215-M219 PolarHBondContact O-N 3.26Å; S216-M219 PolarHBondContact O-N 3.02Å; M219-F222 PolarHBondContact O-N 3.44Å; M219-Y223 WeakPolarHBondContact O-CB 3.2Å; M219-Y223 PolarHBondContact O-N 2.8Å
220T80.8Confident78.1Confident60 Ų60100.4 Ų100.437%0.36847%0.472SS..Hα-helixtrans-67.9-37.3175.9-55.80000111.8S216 D217 F218 R224S216-T220 WeakPolarHBondContact O-CB 3.42Å; S216-T220 PolarHBondContact O-N 2.97Å; S216-T220 PolarHBondContact O-OG1 3.28Å; D217-T220 PolarHBondContact O-N 2.8Å; F218-T220 VanDerWaalsContact C-N 3.28Å; F218-T220 PolarHBondContact O-N 2.9Å; T220-R224 WeakPolarHBondContact O-CB 3.18Å; T220-R224 VanDerWaalsContact O-CG 3.3Å; T220-R224 WeakPolarHBondContact O-CG 3.31Å; T220-R224 PolarHBondContact O-N 3.03Å; T220-R224 VanDerWaalsContact O-N 3.13Å; T220-R224 PolarHBondContact O-NE 2.77Å; T220-R224 VanDerWaalsContact O-NE 3.14Å
221Y78.7Confident76.9Confident121 Ų121109 Ų10948%0.47550%0.501SS..Hα-helixtrans-65.5-49.8172.1173.9-90.4000111.1D217 F218 Y223 R224 H225D217-Y221 WeakPolarHBondContact O-CB 3.45Å; D217-Y221 PolarHBondContact O-N 2.93Å; F218-Y221 WeakPolarHBondContact O-CB 3.34Å; F218-Y221 PolarHBondContact O-N 3.15Å; F218-Y221 VanDerWaalsContact O-N 3.16Å; Y221-Y223 PolarHBondContact O-N 3.3Å; Y221-R224 WeakPolarHBondContact O-CB 3.25Å; Y221-R224 PolarHBondContact O-N 2.96Å; Y221-H225 HydrophobicContact CE1-CB 4.47Å; Y221-H225 WeakPolarHBondContact O-CB 3.36Å; Y221-H225 PolarHBondContact O-N 3.33Å
222F79.5Confident75.3Confident97 Ų97113.8 Ų113.843%0.42552%0.519SS..Hα-helixtrans-60.8-45.6-180-178.2-103.3000111.3F218 M219 R224 H225 M226F218-F222 WeakPolarHBondContact O-CB 3.31Å; F218-F222 PolarHBondContact O-N 3.13Å; M219-F222 PolarHBondContact O-N 3.44Å; F222-R224 PolarHBondContact O-N 3.31Å; F222-H225 CarbonylContact O-C 3.56Å; F222-H225 PolarHBondContact O-N 2.77Å; F222-H225 VanDerWaalsContact O-N 3.13Å; F222-M226 HydrophobicContact CD1-CE 4.29Å; F222-M226 HydrophobicContact CD1-CG 4.03Å; F222-M226 HydrophobicContact CD1-SD 4.45Å; F222-M226 HydrophobicContact CE1-CE 3.64Å; F222-M226 HydrophobicContact CE1-CG 3.64Å; F222-M226 HydrophobicContact CE1-SD 3.55Å; F222-M226 VanDerWaalsContact CE1-SD 3.55Å; F222-M226 HydrophobicContact CE2-CG 4.18Å; F222-M226 HydrophobicContact CG-CG 4.47Å; F222-M226 HydrophobicContact CZ-CE 4.35Å; F222-M226 HydrophobicContact CZ-CG 3.71Å; F222-M226 HydrophobicContact CZ-SD 3.65Å; F222-M226 WeakPolarHBondContact O-CB 3.47Å; F222-M226 WeakPolarHBondContact O-CG 3.33Å; F222-M226 PolarHBondContact O-N 2.9Å
223Y81Confident73.2Confident147 Ų147119.6 Ų119.658%0.57653%0.529SS*.Hα-helixtrans-58.6-44.9174.2176.6-108.5000112.1M219 Y221 H225 M226 K227M219-Y223 WeakPolarHBondContact O-CB 3.2Å; M219-Y223 PolarHBondContact O-N 2.8Å; Y221-Y223 PolarHBondContact O-N 3.3Å; Y223-H225 VanDerWaalsContact C-N 3.33Å; Y223-H225 PolarHBondContact O-N 3.46Å; Y223-M226 PolarHBondContact O-N 3.11Å; Y223-K227 WeakPolarHBondContact O-CB 3.32Å; Y223-K227 PolarHBondContact O-N 2.66Å
224R80Confident71.7Confident147 Ų147117.6 Ų117.656%0.55553%0.529SS*.Hα-helixtrans-63.3-38.7174.7-78.6-177.2-81.6175.5-9.4112T220 Y221 F222 K227 K228T220-R224 WeakPolarHBondContact O-CB 3.18Å; T220-R224 VanDerWaalsContact O-CG 3.3Å; T220-R224 WeakPolarHBondContact O-CG 3.31Å; T220-R224 PolarHBondContact O-N 3.03Å; T220-R224 VanDerWaalsContact O-N 3.13Å; T220-R224 PolarHBondContact O-NE 2.77Å; T220-R224 VanDerWaalsContact O-NE 3.14Å; Y221-R224 WeakPolarHBondContact O-CB 3.25Å; Y221-R224 PolarHBondContact O-N 2.96Å; F222-R224 PolarHBondContact O-N 3.31Å; R224-K227 PolarHBondContact O-N 3.37Å; R224-K228 WeakPolarHBondContact O-CG 3.38Å; R224-K228 PolarHBondContact O-N 3.13Å
225H78.5Confident70.2Confident82 Ų82121.6 Ų121.638%0.3855%0.546SS..Hα-helixtrans-67.6-47.1177.3-160.698.6000111.2Y221 F222 Y223 K227 K228 F229Y221-H225 HydrophobicContact CE1-CB 4.47Å; Y221-H225 WeakPolarHBondContact O-CB 3.36Å; Y221-H225 PolarHBondContact O-N 3.33Å; F222-H225 CarbonylContact O-C 3.56Å; F222-H225 PolarHBondContact O-N 2.77Å; F222-H225 VanDerWaalsContact O-N 3.13Å; Y223-H225 VanDerWaalsContact C-N 3.33Å; Y223-H225 PolarHBondContact O-N 3.46Å; H225-K227 VanDerWaalsContact C-N 3.3Å; H225-K227 PolarHBondContact O-N 2.97Å; H225-K228 CarbonylContact O-C 3.58Å; H225-K228 WeakPolarHBondContact O-CB 3.45Å; H225-K228 PolarHBondContact O-N 3.39Å; H225-K228 VanDerWaalsContact O-N 3.11Å; H225-F229 AromaticContact CD2-CD2 3.91Å; H225-F229 AromaticContact NE2-CD2 3.69Å; H225-F229 AromaticContact NE2-CE2 3.98Å; H225-F229 PolarHBondContact O-N 3.33Å
226M76.5Confident68.6Low101 Ų101124.9 Ų124.950%0.49856%0.556SS.*Hα-helixtrans-57.2-42172.7-73.8-131.9-66.900111.6F222 Y223 F229 K230F222-M226 HydrophobicContact CD1-CE 4.29Å; F222-M226 HydrophobicContact CD1-CG 4.03Å; F222-M226 HydrophobicContact CD1-SD 4.45Å; F222-M226 HydrophobicContact CE1-CE 3.64Å; F222-M226 HydrophobicContact CE1-CG 3.64Å; F222-M226 HydrophobicContact CE1-SD 3.55Å; F222-M226 VanDerWaalsContact CE1-SD 3.55Å; F222-M226 HydrophobicContact CE2-CG 4.18Å; F222-M226 HydrophobicContact CG-CG 4.47Å; F222-M226 HydrophobicContact CZ-CE 4.35Å; F222-M226 HydrophobicContact CZ-CG 3.71Å; F222-M226 HydrophobicContact CZ-SD 3.65Å; F222-M226 WeakPolarHBondContact O-CB 3.47Å; F222-M226 WeakPolarHBondContact O-CG 3.33Å; F222-M226 PolarHBondContact O-N 2.9Å; Y223-M226 PolarHBondContact O-N 3.11Å; M226-F229 PolarHBondContact O-N 3.46Å; M226-K230 WeakPolarHBondContact O-CB 3.42Å; M226-K230 PolarHBondContact O-N 2.78Å
227K75.8Confident67.3Low135 Ų135124.6 Ų124.659%0.58755%0.552SS**Hα-helixtrans-65-39.2175.3-168.4174.2-178175.70112.3Y223 R224 H225 R231Y223-K227 WeakPolarHBondContact O-CB 3.32Å; Y223-K227 PolarHBondContact O-N 2.66Å; R224-K227 PolarHBondContact O-N 3.37Å; H225-K227 VanDerWaalsContact C-N 3.3Å; H225-K227 PolarHBondContact O-N 2.97Å; K227-R231 WeakPolarHBondContact O-CB 3.37Å; K227-R231 PolarHBondContact O-N 3.29Å
228K69Low65.9Low136 Ų136126.4 Ų126.459%0.59156%0.557SS**Hα-helixtrans-65.6-40.3172.6-77.2179.8-178.9179.60111.8R224 H225 R231 K232R224-K228 WeakPolarHBondContact O-CG 3.38Å; R224-K228 PolarHBondContact O-N 3.13Å; H225-K228 CarbonylContact O-C 3.58Å; H225-K228 WeakPolarHBondContact O-CB 3.45Å; H225-K228 PolarHBondContact O-N 3.39Å; H225-K228 VanDerWaalsContact O-N 3.11Å; K228-R231 PolarHBondContact O-N 3.28Å; K228-K232 WeakPolarHBondContact O-CB 3.36Å; K228-K232 PolarHBondContact O-N 2.79Å
229F64.2Low64.6Low122 Ų122125 Ų12554%0.53556%0.557SS.*Hα-helixtrans-65.5-46.5176.6-127.4-89.9000111H225 M226 R231 K232 W233H225-F229 AromaticContact CD2-CD2 3.91Å; H225-F229 AromaticContact NE2-CD2 3.69Å; H225-F229 AromaticContact NE2-CE2 3.98Å; H225-F229 PolarHBondContact O-N 3.33Å; M226-F229 PolarHBondContact O-N 3.46Å; F229-R231 PolarHBondContact O-N 3Å; F229-K232 CarbonylContact O-C 3.58Å; F229-K232 WeakPolarHBondContact O-CA 3.13Å; F229-K232 PolarHBondContact O-N 3.02Å; F229-W233 PolarHBondContact O-N 3.04Å
230K61.1Low63.1Low173 Ų173127 Ų12775%0.75257%0.567SS**Hα-helixtrans-59.8-32172.8-167.3176.2-177.51790112.5M226 W233M226-K230 WeakPolarHBondContact O-CB 3.42Å; M226-K230 PolarHBondContact O-N 2.78Å; K230-W233 WeakPolarHBondContact O-CB 3.34Å
231R57Low61.7Low215 Ų215130.4 Ų130.481%0.81158%0.583SS**Hα-helixtrans-78.1-26.6174-163.7172.873.6115.60.7113.5K227 K228 F229K227-R231 WeakPolarHBondContact O-CB 3.37Å; K227-R231 PolarHBondContact O-N 3.29Å; K228-R231 PolarHBondContact O-N 3.28Å; F229-R231 PolarHBondContact O-N 3Å
232K51.8Low60.3Low177 Ų177130 Ų13077%0.7759%0.585SS**Hα-helixtrans-87-16.1174.1-81.8-170.5175.7-172.50113.3K228 F229 P234K228-K232 WeakPolarHBondContact O-CB 3.36Å; K228-K232 PolarHBondContact O-N 2.79Å; F229-K232 CarbonylContact O-C 3.58Å; F229-K232 WeakPolarHBondContact O-CA 3.13Å; F229-K232 PolarHBondContact O-N 3.02Å; K232-P234 VanDerWaalsContact O-N 3.11Å
233W40.1Very low59Low160 Ų160128 Ų12861%0.60659%0.586SS**SBendtrans-50121.1166.7-101.461.5000107.1F229 K230 K235 V237F229-W233 PolarHBondContact O-N 3.04Å; K230-W233 WeakPolarHBondContact O-CB 3.34Å; W233-K235 PolarHBondContact O-N 3.28Å; W233-V237 HydrophobicContact CZ3-CG1 4.39Å
234P49.9Very low57.3Low80 Ų80123.8 Ų123.852%0.51959%0.587SS.*  trans-60.1121.9-170.820.4-29.8000107.9K232 K236 V237K232-P234 VanDerWaalsContact O-N 3.11Å; P234-K236 HydrophobicContact CB-CB 4.13Å; P234-K236 PolarHBondContact O-N 3.49Å; P234-V237 HydrophobicContact CG-CG2 4.28Å; P234-V237 PolarHBondContact O-N 3.41Å
235K50.4Low55.7Low164 Ų164118.4 Ų118.471%0.71358%0.578SS**Hα-helixtrans-46.2-18.8165.6-73.5-176.1175.4-177.30111.9W233 V237 E238 T239W233-K235 PolarHBondContact O-N 3.28Å; K235-V237 VanDerWaalsContact C-N 3.35Å; K235-V237 PolarHBondContact O-N 3.06Å; K235-E238 CarbonylContact O-C 3.58Å; K235-E238 PolarHBondContact O-N 3.41Å; K235-T239 WeakPolarHBondContact O-CB 3.39Å; K235-T239 VanDerWaalsContact O-CG2 3.24Å; K235-T239 WeakPolarHBondContact O-CG2 3.44Å; K235-T239 PolarHBondContact O-N 2.89Å; K235-T239 PolarHBondContact O-OG1 3.26Å
236K47.5Very low54.1Low159 Ų159116.3 Ų116.369%0.69157%0.574SS**Hα-helixtrans-56.1-38.8172.1-142.4174.7-173.7-179.30114.1P234 T239 M240P234-K236 HydrophobicContact CB-CB 4.13Å; P234-K236 PolarHBondContact O-N 3.49Å; K236-T239 WeakPolarHBondContact CA-OG1 3.48Å; K236-T239 PolarHBondContact O-OG1 3.18Å; K236-M240 WeakPolarHBondContact O-CG 3.32Å; K236-M240 PolarHBondContact O-N 3.34Å
237V53.1Low52.8Low65 Ų65117.9 Ų117.939%0.39458%0.584SS.*Hα-helixtrans-74.2-42.7176.7175.70000110.5W233 P234 K235 T239 M240 L241W233-V237 HydrophobicContact CZ3-CG1 4.39Å; P234-V237 HydrophobicContact CG-CG2 4.28Å; P234-V237 PolarHBondContact O-N 3.41Å; K235-V237 VanDerWaalsContact C-N 3.35Å; K235-V237 PolarHBondContact O-N 3.06Å; V237-T239 VanDerWaalsContact C-N 3.33Å; V237-T239 PolarHBondContact O-N 3Å; V237-M240 PolarHBondContact O-N 3.09Å; V237-M240 VanDerWaalsContact O-N 3.14Å; V237-L241 HydrophobicContact CG1-CD1 4.32Å; V237-L241 PolarHBondContact O-N 2.9Å
238E49.1Very low51.4Low114 Ų114114.7 Ų114.753%0.53358%0.583SS.*Hα-helixtrans-66.7-34.9176-157.4161.1-156.100111.3K235 Q242K235-E238 CarbonylContact O-C 3.58Å; K235-E238 PolarHBondContact O-N 3.41Å; E238-Q242 WeakPolarHBondContact O-CA 3.48Å; E238-Q242 WeakPolarHBondContact O-CB 3.29Å; E238-Q242 WeakPolarHBondContact O-CG 3.22Å; E238-Q242 PolarHBondContact O-N 3.44Å
239T53.8Low50.3Low71 Ų71112.3 Ų112.344%0.43658%0.58SS.*Hα-helixtrans-75.3-21.6171560000113.1K235 K236 V237 A243K235-T239 WeakPolarHBondContact O-CB 3.39Å; K235-T239 VanDerWaalsContact O-CG2 3.24Å; K235-T239 WeakPolarHBondContact O-CG2 3.44Å; K235-T239 PolarHBondContact O-N 2.89Å; K235-T239 PolarHBondContact O-OG1 3.26Å; K236-T239 WeakPolarHBondContact CA-OG1 3.48Å; K236-T239 PolarHBondContact O-OG1 3.18Å; V237-T239 VanDerWaalsContact C-N 3.33Å; V237-T239 PolarHBondContact O-N 3Å; T239-A243 WeakPolarHBondContact O-CA 3.29Å; T239-A243 WeakPolarHBondContact O-CB 3.25Å; T239-A243 PolarHBondContact O-N 2.89Å
240M47.3Very low49.3Very low140 Ų140116 Ų11669%0.6959%0.59SS**Hα-helixtrans-74.5-45.6169.5-80.9-152.4-153.500110.6K236 V237 A243 G244K236-M240 WeakPolarHBondContact O-CG 3.32Å; K236-M240 PolarHBondContact O-N 3.34Å; V237-M240 PolarHBondContact O-N 3.09Å; V237-M240 VanDerWaalsContact O-N 3.14Å; M240-A243 PolarHBondContact O-N 2.91Å; M240-G244 PolarHBondContact O-N 3.06Å; M240-G244 VanDerWaalsContact O-N 3.13Å
241L51.7Low48.5Very low133 Ų133117.6 Ų117.670%0.69659%0.591SS**Hα-helixtrans-63.3-43.1173.5-73.6165.4000111.2V237 G245V237-L241 HydrophobicContact CG1-CD1 4.32Å; V237-L241 PolarHBondContact O-N 2.9Å; L241-G245 PolarHBondContact O-N 3.24Å
242Q49.4Very low47.7Very low113 Ų113110 Ų11053%0.52857%0.574SS.*Hα-helixtrans-75.3-25.1174.5-70.9177.4-5.500112.8E238 G245 A246E238-Q242 WeakPolarHBondContact O-CA 3.48Å; E238-Q242 WeakPolarHBondContact O-CB 3.29Å; E238-Q242 WeakPolarHBondContact O-CG 3.22Å; E238-Q242 PolarHBondContact O-N 3.44Å; Q242-G245 CarbonylContact O-C 3.56Å; Q242-G245 PolarHBondContact O-N 3.34Å; Q242-A246 VanDerWaalsContact O-CA 3.28Å; Q242-A246 WeakPolarHBondContact O-CA 3.34Å; Q242-A246 WeakPolarHBondContact O-CB 3.38Å; Q242-A246 PolarHBondContact O-N 3.01Å
243A52Low47.4Very low55 Ų55104 Ų10446%0.45556%0.555SS.*Hα-helixtrans-69.9-37.8172.900000110.6T239 M240 L247T239-A243 WeakPolarHBondContact O-CA 3.29Å; T239-A243 WeakPolarHBondContact O-CB 3.25Å; T239-A243 PolarHBondContact O-N 2.89Å; M240-A243 PolarHBondContact O-N 2.91Å; A243-L247 PolarHBondContact O-N 3.46Å
244G45.2Very low47.4Very low58 Ų58104.3 Ų104.360%0.59856%0.563SS**Hα-helixtrans-61.8-44.7168.900000112.2M240M240-G244 PolarHBondContact O-N 3.06Å; M240-G244 VanDerWaalsContact O-N 3.13Å
245G46.4Very low46.8Very low34 Ų34106.9 Ų106.935%0.35157%0.573SS.*Hα-helixtrans-77.1-29.8178.700000115.7L241 Q242 A248 T249L241-G245 PolarHBondContact O-N 3.24Å; Q242-G245 CarbonylContact O-C 3.56Å; Q242-G245 PolarHBondContact O-N 3.34Å; G245-A248 WeakPolarHBondContact O-CB 3.48Å; G245-A248 PolarHBondContact O-N 3.49Å; G245-T249 PolarHBondContact O-N 3.01Å; G245-T249 PolarHBondContact O-OG1 3.39Å
246A45.8Very low46.4Very low37 Ų37104.6 Ų104.631%0.30657%0.567SS.*Hα-helixtrans-81.7-22.8-174.300000112.8Q242 A248 T249 R250Q242-A246 VanDerWaalsContact O-CA 3.28Å; Q242-A246 WeakPolarHBondContact O-CA 3.34Å; Q242-A246 WeakPolarHBondContact O-CB 3.38Å; Q242-A246 PolarHBondContact O-N 3.01Å; A246-A248 VanDerWaalsContact C-N 3.28Å; A246-T249 WeakPolarHBondContact CA-OG1 3.5Å; A246-R250 WeakPolarHBondContact O-CB 3.45Å; A246-R250 WeakPolarHBondContact O-CG 3.12Å; A246-R250 PolarHBondContact O-N 3.19Å
247L48.3Very low45.8Very low135 Ų135104.7 Ų104.771%0.70757%0.568SS**Hα-helixtrans-65.4-35.3165-109.5147.6000111A243A243-L247 PolarHBondContact O-N 3.46Å
248A45.9Very low45.1Very low68 Ų68105.9 Ų105.956%0.56258%0.584SS**Hα-helixtrans-75.4-43.4174.700000112.5G245 A246G245-A248 WeakPolarHBondContact O-CB 3.48Å; G245-A248 PolarHBondContact O-N 3.49Å; A246-A248 VanDerWaalsContact C-N 3.28Å
249T45.3Very low44.7Very low86 Ų86108.4 Ų108.453%0.52860%0.596SS.*Hα-helixtrans-81.6-22.1-178.156.20000114.5G245 A246 R251 A252 S253G245-T249 PolarHBondContact O-N 3.01Å; G245-T249 PolarHBondContact O-OG1 3.39Å; A246-T249 WeakPolarHBondContact CA-OG1 3.5Å; T249-R251 VanDerWaalsContact C-N 3.31Å; T249-R251 PolarHBondContact O-N 3.38Å; T249-A252 PolarHBondContact O-N 2.99Å; T249-A252 VanDerWaalsContact O-N 3.14Å; T249-S253 VanDerWaalsContact O-CB 3.32Å; T249-S253 WeakPolarHBondContact O-CB 3.42Å; T249-S253 PolarHBondContact O-N 2.95Å
250R44.5Very low44Very low198 Ų198109.1 Ų109.175%0.74761%0.609SS**Hα-helixtrans-63.8-35.3170.7-93.2-176.3167.1-179.3-3.4112.4A246 A252 Q254A246-R250 WeakPolarHBondContact O-CB 3.45Å; A246-R250 WeakPolarHBondContact O-CG 3.12Å; A246-R250 PolarHBondContact O-N 3.19Å; R250-A252 VanDerWaalsContact C-N 3.31Å; R250-Q254 PolarHBondContact O-N 3.34Å
251R43.1Very low43.7Very low207 Ų207108.6 Ų108.678%0.78161%0.613SS**Hα-helixtrans-66.8-32.9172.2-87.3-177.3-179.41520.6112.2T249T249-R251 VanDerWaalsContact C-N 3.31Å; T249-R251 PolarHBondContact O-N 3.38Å
252A40.9Very low43Very low55 Ų55109.5 Ų109.546%0.45562%0.617SS.*Hα-helixtrans-80.7-37.7178.400000113.4T249 R250 N255T249-A252 PolarHBondContact O-N 2.99Å; T249-A252 VanDerWaalsContact O-N 3.14Å; R250-A252 VanDerWaalsContact C-N 3.31Å; A252-N255 PolarHBondContact O-N 3.29Å
253S45.8Very low42.4Very low52 Ų52111.3 Ų111.336%0.36463%0.63SS.*Hα-helixtrans-77.9-20.9-173.5176.90000114.1T249 N255 I256T249-S253 VanDerWaalsContact O-CB 3.32Å; T249-S253 WeakPolarHBondContact O-CB 3.42Å; T249-S253 PolarHBondContact O-N 2.95Å; S253-N255 PolarHBondContact O-N 3.47Å; S253-I256 PolarHBondContact O-N 3.22Å
254Q40.3Very low41.8Very low166 Ų166117.7 Ų117.778%0.77665%0.651SS**THydrogen-bonded Turntrans-64.7-24.8170.9-81.1-171.7-32.800112.3R250R250-Q254 PolarHBondContact O-N 3.34Å
255N37.2Very low41.2Very low134 Ų134122.8 Ų122.872%0.71767%0.665SS**THydrogen-bonded Turntrans-83.7-20.6179.8-72.1-4.1000114.1A252 S253A252-N255 PolarHBondContact O-N 3.29Å; S253-N255 PolarHBondContact O-N 3.47Å
256I41.4Very low40.6Very low117 Ų117128 Ų12860%0.668%0.683SS**THydrogen-bonded Turntrans-99.6-17.4-171.6-58.7174.3000112.5S253 A258 E259S253-I256 PolarHBondContact O-N 3.22Å; I256-A258 PolarHBondContact O-N 3.02Å; I256-E259 PolarHBondContact O-N 3.36Å
257K35.2Very low39.9Very low161 Ų161136.1 Ų136.170%0.771%0.712SS**THydrogen-bonded Turntrans-69.2-3.5-179.6-74.4-175.3179.5-172.80114.8
258A38.7Very low39.1Very low89 Ų89134.6 Ų134.674%0.73672%0.719SS**THydrogen-bonded Turntrans-78.9-21.817400000113.6I256I256-A258 PolarHBondContact O-N 3.02Å
259E40.8Very low38.3Very low168 Ų168140.5 Ų140.579%0.78574%0.737SS**THydrogen-bonded Turntrans-107.1-15.1-169.3-76.4-178.4153.400115.7I256 V261I256-E259 PolarHBondContact O-N 3.36Å; E259-V261 VanDerWaalsContact C-N 3.34Å; E259-V261 PolarHBondContact O-N 3.41Å
260A38.8Very low37.6Very low85 Ų85145 Ų14570%0.70275%0.753SS**THydrogen-bonded Turntrans-86.410.4-171.400000115.8I262A260-I262 VanDerWaalsContact C-N 3.27Å; A260-I262 PolarHBondContact O-N 2.79Å
261V40.5Very low36.9Very low130 Ų130144.3 Ų144.379%0.78876%0.76SS**THydrogen-bonded Turntrans-79.3-4.3-178.8177.20000112.9E259E259-V261 VanDerWaalsContact C-N 3.34Å; E259-V261 PolarHBondContact O-N 3.41Å
262I37Very low36.6Very low151 Ų151140.3 Ų140.377%0.77476%0.759SS**SBendtrans-100.4-16.2-169.3-63.8178000115.2A260A260-I262 VanDerWaalsContact C-N 3.27Å; A260-I262 PolarHBondContact O-N 2.79Å
263D37.8Very low36.5Very low151 Ų151143.7 Ų143.781%0.80778%0.776SS**  trans-101.813.3-165.3-120.1-0.7000117N265D263-N265 PolarHBondContact O-N 2.92Å
264Q38.3Very low36.5Very low189 Ų189147.1 Ų147.188%0.88379%0.794SS**THydrogen-bonded Turntrans-878.2-168.7-128.9176.1-2.300116.6
265N33.4Very low36.6Very low166 Ų166145.2 Ų145.289%0.88879%0.79SS**THydrogen-bonded Turntrans-11012.1-173.1-80.5-8.2000117.1D263D263-N265 PolarHBondContact O-N 2.92Å
266L34.3Very low37.3Very low143 Ų143144.9 Ų144.975%0.74979%0.788SS**SBendtrans-1060.4-172.6-156.760.5000117.8
267F30.4Very low37.9Very low208 Ų208147 Ų14791%0.91280%0.795SS**  trans-12574.3-178-75.4-81.6000113.8
268A31.1Very low38.9Very low103 Ų103144.9 Ų144.985%0.85179%0.791SS**  trans-135.983159.900000109.1
269M28.8Very low40.1Very low191 Ų191143.6 Ų143.694%0.94177%0.772SS**  trans-112.8102.2166.2-169.9171.8177.600107.7
270E32.1Very low40.8Very low182 Ų182142.4 Ų142.485%0.8576%0.764SS**  trans-89.9119.1-178.3-161146.9-163.800108.9T272E270-T272 PolarHBondContact O-N 3.15Å
271M29.9Very low42Very low183 Ų183141.9 Ų141.990%0.90175%0.752SS**  trans-74.4113.3174.8-81.5-173.1-102.900109.2
272T36.4Very low43.1Very low123 Ų123141.7 Ų141.776%0.75574%0.741SS**PPolyproline II helixtrans-79.5134.4169.648.80000110.3E270E270-T272 PolarHBondContact O-N 3.15Å
273P39.2Very low44.2Very low125 Ų125142.5 Ų142.581%0.81273%0.734SS**PPolyproline II helixtrans-73.2131.1-176.528.1-32.1000111
274V44.2Very low45.1Very low124 Ų124141.5 Ų141.575%0.75273%0.725SS**PPolyproline II helixtrans-72.8124.8174.5177.10000108.9D276V274-D276 PolarHBondContact O-N 3.36Å
275N43.7Very low46Very low127 Ų127139.8 Ų139.868%0.67972%0.715SS**PPolyproline II helixtrans-68.8124.5177.2-108.1-10.9000110.9E277 D278N275-E277 PolarHBondContact O-N 3.33Å; N275-E277 VanDerWaalsContact O-N 3.1Å; N275-D278 PolarHBondContact O-N 3.47Å
276D52.3Low47.4Very low126 Ų126137.2 Ų137.267%0.67470%0.7SS**Hα-helixtrans-61.6-16.4-174.1-82.9-39.6000115.7V274V274-D276 PolarHBondContact O-N 3.36Å
277E52.3Low48.3Very low162 Ų162134.2 Ų134.276%0.75770%0.696SS**Hα-helixtrans-79.5-31.9-178.9-78.1-16815100113.6N275 T281N275-E277 PolarHBondContact O-N 3.33Å; N275-E277 VanDerWaalsContact O-N 3.1Å; E277-T281 PolarHBondContact O-N 2.98Å; E277-T281 PolarHBondContact O-OG1 3.42Å
278D55.9Low49Very low116 Ų116134.4 Ų134.462%0.6269%0.691SS**Hα-helixtrans-74.8-35-179.2-70.5-35.7000111.6N275 T281 F282N275-D278 PolarHBondContact O-N 3.47Å; D278-T281 PolarHBondContact O-OG1 2.89Å; D278-F282 WeakPolarHBondContact O-CB 3.42Å; D278-F282 PolarHBondContact O-N 3.4Å
279D64.2Low49.8Very low62 Ų62140.6 Ų140.633%0.33269%0.692SS.*Hα-helixtrans-66.5-39.3176.6-170.751.1000111.4F282 R283D279-F282 PolarHBondContact O-N 3.35Å; D279-R283 WeakPolarHBondContact O-CB 3.33Å; D279-R283 VanDerWaalsContact O-CG 3.3Å; D279-R283 WeakPolarHBondContact O-CG 3.35Å; D279-R283 PolarHBondContact O-N 2.58Å; D279-R283 IonicContact OD1-NE 3.75Å; D279-R283 IonicContact OD1-NH2 3.17Å; D279-R283 IonicContact OD2-CZ 3.49Å; D279-R283 IonicContact OD2-NE 3.59Å; D279-R283 PolarHBondContact OD2-NE 3.21Å; D279-R283 IonicContact OD2-NH2 2.72Å; D279-R283 PolarHBondContact OD2-NH2 3.02Å; D279-R283 VanDerWaalsContact OD2-NH2 3.07Å
280K56.1Low50.3Low144 Ų144139.3 Ų139.363%0.62668%0.684SS**Hα-helixtrans-66.6-43.5179.6-73.5177.6-174.7169.70112.5R283 Q284K280-R283 PolarHBondContact O-N 3.4Å; K280-Q284 PolarHBondContact O-N 3.49Å
281T64.1Low50.6Low73 Ų73140.3 Ų140.345%0.44869%0.685SS.*Hα-helixtrans-68.8-36.2177.232.30000111.8E277 D278 Q284 K285E277-T281 PolarHBondContact O-N 2.98Å; E277-T281 PolarHBondContact O-OG1 3.42Å; D278-T281 PolarHBondContact O-OG1 2.89Å; T281-Q284 PolarHBondContact O-N 2.91Å; T281-K285 WeakPolarHBondContact O-CB 3.14Å; T281-K285 PolarHBondContact O-N 3.13Å
282F63.9Low51.1Low127 Ų127135.4 Ų135.456%0.55767%0.667SS**Hα-helixtrans-63.6-47.2173-174.9-102.7000112D278 D279 Q284 K285 L286D278-F282 WeakPolarHBondContact O-CB 3.42Å; D278-F282 PolarHBondContact O-N 3.4Å; D279-F282 PolarHBondContact O-N 3.35Å; F282-Q284 PolarHBondContact O-N 3.37Å; F282-K285 PolarHBondContact O-N 3.44Å; F282-L286 HydrophobicContact CE1-CD1 4.02Å; F282-L286 HydrophobicContact CE2-CD1 4.31Å; F282-L286 HydrophobicContact CZ-CD1 3.78Å; F282-L286 PolarHBondContact O-N 3.45Å
283R59.3Low51.2Low167 Ų167133.8 Ų133.863%0.6366%0.657SS**Hα-helixtrans-60.8-40.9176-73-178.5-168.1-122.74.3112.6D279 K280 L286 A287D279-R283 WeakPolarHBondContact O-CB 3.33Å; D279-R283 VanDerWaalsContact O-CG 3.3Å; D279-R283 WeakPolarHBondContact O-CG 3.35Å; D279-R283 PolarHBondContact O-N 2.58Å; D279-R283 IonicContact OD1-NE 3.75Å; D279-R283 IonicContact OD1-NH2 3.17Å; D279-R283 IonicContact OD2-CZ 3.49Å; D279-R283 IonicContact OD2-NE 3.59Å; D279-R283 PolarHBondContact OD2-NE 3.21Å; D279-R283 IonicContact OD2-NH2 2.72Å; D279-R283 PolarHBondContact OD2-NH2 3.02Å; D279-R283 VanDerWaalsContact OD2-NH2 3.07Å; K280-R283 PolarHBondContact O-N 3.4Å; R283-L286 PolarHBondContact O-N 3.43Å; R283-A287 WeakPolarHBondContact O-CB 3.4Å; R283-A287 PolarHBondContact O-N 3.45Å
284Q56.3Low50.8Low130 Ų130138.2 Ų138.261%0.60766%0.658SS**Hα-helixtrans-65-39174.6-89.1-173.4-1300112.7K280 T281 F282 R288K280-Q284 PolarHBondContact O-N 3.49Å; T281-Q284 PolarHBondContact O-N 2.91Å; F282-Q284 PolarHBondContact O-N 3.37Å; Q284-R288 PolarHBondContact O-N 2.93Å
285K58Low50.5Low154 Ų154136.4 Ų136.467%0.6765%0.651SS**Hα-helixtrans-66.7-38.8175.2-84.2179178.2171.30112.1T281 F282T281-K285 WeakPolarHBondContact O-CB 3.14Å; T281-K285 PolarHBondContact O-N 3.13Å; F282-K285 PolarHBondContact O-N 3.44Å
286L63.4Low50.6Low111 Ų111134.3 Ų134.358%0.58164%0.639SS**Hα-helixtrans-65.6-43.9176.4-132.378.8000111.4F282 R283 R288 R289F282-L286 HydrophobicContact CE1-CD1 4.02Å; F282-L286 HydrophobicContact CE2-CD1 4.31Å; F282-L286 HydrophobicContact CZ-CD1 3.78Å; F282-L286 PolarHBondContact O-N 3.45Å; R283-L286 PolarHBondContact O-N 3.43Å; L286-R288 VanDerWaalsContact C-N 3.28Å; L286-R288 PolarHBondContact O-N 3.21Å; L286-R289 PolarHBondContact O-N 3.36Å
287A52.3Low50.6Low80 Ų80130.2 Ų130.266%0.66162%0.622SS**Hα-helixtrans-63.1-30-179.400000113.5R283R283-A287 WeakPolarHBondContact O-CB 3.4Å; R283-A287 PolarHBondContact O-N 3.45Å
288R46.5Very low50.4Low213 Ų213126.5 Ų126.580%0.80461%0.607SS**Hα-helixtrans-79.5-20.7179.5-75.2-176.4174.8173.10.3114.4Q284 L286Q284-R288 PolarHBondContact O-N 2.93Å; L286-R288 VanDerWaalsContact C-N 3.28Å; L286-R288 PolarHBondContact O-N 3.21Å
289R46.1Very low49.4Very low233 Ų233128.4 Ų128.488%0.87961%0.61SS**Hα-helixtrans-92.5-6.4-170.3-80.8-168.1171.8-162.6-1.4116L286L286-R289 PolarHBondContact O-N 3.36Å
290Q40.1Very low48.7Very low164 Ų164132.4 Ų132.477%0.76662%0.62SS**  trans-129.190.1178.9-103.6176-12.100111.8P292Q290-P292 WeakPolarHBondContact O-CD 3.46Å
291K38.1Very low48.4Very low202 Ų202127.8 Ų127.888%0.87861%0.606SS**  trans-89.6106.9158.8-71.3-173.1177.9-1770107.7
292P41.1Very low47.5Very low80 Ų80133.4 Ų133.452%0.51962%0.619SS.*  trans-69.4135.8179.726.9-32000110.6Q290Q290-P292 WeakPolarHBondContact O-CD 3.46Å
293T38.1Very low47Very low90 Ų90131.9 Ų131.955%0.55262%0.616SS**  trans-63.9140.6172.538.40000110.7S295 I296 A297T293-S295 VanDerWaalsContact C-N 3.27Å; T293-S295 PolarHBondContact O-N 3.4Å; T293-S295 VanDerWaalsContact O-N 3.08Å; T293-I296 PolarHBondContact O-N 3.03Å; T293-I296 WeakPolarHBondContact OG1-CD1 3.21Å; T293-A297 PolarHBondContact O-N 2.93Å; T293-A297 VanDerWaalsContact O-N 3.13Å
294W31Very low46.9Very low217 Ų217129.6 Ų129.682%0.82261%0.613SS**Hα-helixtrans-50.2-36.6-167.8-114.875.3000115.1A297 I298W294-A297 PolarHBondContact O-N 3.32Å; W294-I298 HydrophobicContact CE3-CD1 3.85Å; W294-I298 HydrophobicContact CZ3-CD1 4.08Å; W294-I298 WeakPolarHBondContact O-CG1 3.36Å; W294-I298 PolarHBondContact O-N 2.9Å
295S37.2Very low47.2Very low87 Ų87128.4 Ų128.461%0.60861%0.61SS**Hα-helixtrans-69.9-34.6178.557.60000113.2T293 K299T293-S295 VanDerWaalsContact C-N 3.27Å; T293-S295 PolarHBondContact O-N 3.4Å; T293-S295 VanDerWaalsContact O-N 3.08Å; S295-K299 PolarHBondContact O-N 2.54Å
296I47.2Very low47.2Very low82 Ų82126.3 Ų126.342%0.42161%0.605SS.*Hα-helixtrans-75.3-34175.6-59.2177.3000110.2T293 K299 R300T293-I296 PolarHBondContact O-N 3.03Å; T293-I296 WeakPolarHBondContact OG1-CD1 3.21Å; I296-K299 PolarHBondContact O-N 2.86Å; I296-R300 HydrophobicContact CG2-CG 4.46Å; I296-R300 VanDerWaalsContact O-CB 3.3Å; I296-R300 WeakPolarHBondContact O-CB 3.02Å; I296-R300 PolarHBondContact O-N 2.93Å
297A50.7Low47.3Very low40 Ų40128.2 Ų128.233%0.33161%0.609SS.*Hα-helixtrans-63.4-43.5175.800000112T293 W294 S301T293-A297 PolarHBondContact O-N 2.93Å; T293-A297 VanDerWaalsContact O-N 3.13Å; W294-A297 PolarHBondContact O-N 3.32Å; A297-S301 WeakPolarHBondContact O-CB 3.34Å; A297-S301 PolarHBondContact O-N 3.12Å; A297-S301 PolarHBondContact O-OG 3.19Å
298I48.1Very low48Very low85 Ų85129.5 Ų129.544%0.43660%0.603SS.*Hα-helixtrans-68.7-40.3176.3-64.8167.9000111.7W294 S301 R302W294-I298 HydrophobicContact CE3-CD1 3.85Å; W294-I298 HydrophobicContact CZ3-CD1 4.08Å; W294-I298 WeakPolarHBondContact O-CG1 3.36Å; W294-I298 PolarHBondContact O-N 2.9Å; I298-S301 WeakPolarHBondContact CA-OG 3.36Å; I298-S301 PolarHBondContact O-OG 2.92Å; I298-R302 WeakPolarHBondContact O-CB 3.28Å; I298-R302 WeakPolarHBondContact O-CG 3.46Å; I298-R302 PolarHBondContact O-N 3.2Å
299K35.7Very low49.1Very low155 Ų155121.6 Ų121.667%0.67458%0.579SS**Hα-helixtrans-66.5-41.7176.3-118.6177.2-180179.10111.6S295 I296 L303S295-K299 PolarHBondContact O-N 2.54Å; I296-K299 PolarHBondContact O-N 2.86Å; K299-L303 WeakPolarHBondContact O-CB 3.49Å; K299-L303 WeakPolarHBondContact O-CD1 3.29Å; K299-L303 PolarHBondContact O-N 3.2Å
300R48.8Very low50.5Low146 Ų146116 Ų11655%0.55157%0.565SS**Hα-helixtrans-67.2-40.9175-89-176.6173.3165.9-2112.2I296 L303 Q304I296-R300 HydrophobicContact CG2-CG 4.46Å; I296-R300 VanDerWaalsContact O-CB 3.3Å; I296-R300 WeakPolarHBondContact O-CB 3.02Å; I296-R300 PolarHBondContact O-N 2.93Å; R300-L303 PolarHBondContact O-N 3.39Å; R300-Q304 VanDerWaalsContact O-CB 3.24Å; R300-Q304 WeakPolarHBondContact O-CB 3.39Å; R300-Q304 VanDerWaalsContact O-CG 3.23Å; R300-Q304 WeakPolarHBondContact O-CG 2.98Å; R300-Q304 PolarHBondContact O-N 2.97Å
301S51.4Low52.2Low48 Ų48111.8 Ų111.834%0.33655%0.553SS.*Hα-helixtrans-65.9-41.7177.759.60000111.3A297 I298 Q304 I305A297-S301 WeakPolarHBondContact O-CB 3.34Å; A297-S301 PolarHBondContact O-N 3.12Å; A297-S301 PolarHBondContact O-OG 3.19Å; I298-S301 WeakPolarHBondContact CA-OG 3.36Å; I298-S301 PolarHBondContact O-OG 2.92Å; S301-Q304 PolarHBondContact O-N 2.89Å; S301-I305 WeakPolarHBondContact O-CB 3.41Å; S301-I305 WeakPolarHBondContact O-CD1 3.47Å; S301-I305 WeakPolarHBondContact O-CG1 3.43Å; S301-I305 PolarHBondContact O-N 3.23Å
302R44.9Very low54.3Low191 Ų191104.4 Ų104.472%0.72152%0.521SS*.Hα-helixtrans-64.5-43172.6-74.7-164.8167.5-164-2.9113.2I298 Q304 L306I298-R302 WeakPolarHBondContact O-CB 3.28Å; I298-R302 WeakPolarHBondContact O-CG 3.46Å; I298-R302 PolarHBondContact O-N 3.2Å; R302-Q304 VanDerWaalsContact C-N 3.35Å; R302-L306 WeakPolarHBondContact O-CB 3.46Å; R302-L306 PolarHBondContact O-N 3.15Å
303L53.7Low56.4Low95 Ų95104.7 Ų104.750%0.49752%0.521SS..Hα-helixtrans-67.6-32.5174.7-96.796.6000112.8K299 R300 K307K299-L303 WeakPolarHBondContact O-CB 3.49Å; K299-L303 WeakPolarHBondContact O-CD1 3.29Å; K299-L303 PolarHBondContact O-N 3.2Å; R300-L303 PolarHBondContact O-N 3.39Å; L303-K307 WeakPolarHBondContact O-CB 3.36Å; L303-K307 WeakPolarHBondContact O-CG 3.29Å; L303-K307 PolarHBondContact O-N 2.61Å
304Q56.7Low58.8Low118 Ų118102.3 Ų102.355%0.55151%0.514SS*.Hα-helixtrans-70-45.5175.8-81.2174.7-32.100111.1R300 S301 R302 L306 K307 I308R300-Q304 VanDerWaalsContact O-CB 3.24Å; R300-Q304 WeakPolarHBondContact O-CB 3.39Å; R300-Q304 VanDerWaalsContact O-CG 3.23Å; R300-Q304 WeakPolarHBondContact O-CG 2.98Å; R300-Q304 PolarHBondContact O-N 2.97Å; S301-Q304 PolarHBondContact O-N 2.89Å; R302-Q304 VanDerWaalsContact C-N 3.35Å; Q304-L306 VanDerWaalsContact C-N 3.32Å; Q304-L306 PolarHBondContact O-N 3.47Å; Q304-K307 PolarHBondContact O-N 2.94Å; Q304-I308 WeakPolarHBondContact O-CD1 3.41Å; Q304-I308 WeakPolarHBondContact O-CG1 3.34Å; Q304-I308 PolarHBondContact O-N 3.38Å
305I61.2Low61.6Low106 Ų10693.6 Ų93.654%0.54448%0.484SS..Hα-helixtrans-58.2-48.2172.8-66.1162000109.3S301 K307 I308 T309S301-I305 WeakPolarHBondContact O-CB 3.41Å; S301-I305 WeakPolarHBondContact O-CD1 3.47Å; S301-I305 WeakPolarHBondContact O-CG1 3.43Å; S301-I305 PolarHBondContact O-N 3.23Å; I305-K307 PolarHBondContact O-N 3.16Å; I305-I308 PolarHBondContact O-N 3.34Å; I305-I308 VanDerWaalsContact O-N 3.16Å; I305-T309 WeakPolarHBondContact O-CB 3.05Å; I305-T309 PolarHBondContact O-N 2.92Å; I305-T309 PolarHBondContact O-OG1 3.11Å
306L59.6Low64.2Low109 Ų10992 Ų9257%0.57147%0.47SS*.Hα-helixtrans-59.2-43.6177.5-175.165000112.5R302 Q304 I308 T309 L310R302-L306 WeakPolarHBondContact O-CB 3.46Å; R302-L306 PolarHBondContact O-N 3.15Å; Q304-L306 VanDerWaalsContact C-N 3.32Å; Q304-L306 PolarHBondContact O-N 3.47Å; L306-I308 VanDerWaalsContact C-N 3.31Å; L306-I308 PolarHBondContact O-N 3.29Å; L306-T309 PolarHBondContact O-N 2.81Å; L306-L310 WeakPolarHBondContact O-CB 3.35Å; L306-L310 PolarHBondContact O-N 2.95Å
307K64.6Low66.3Low152 Ų15290.2 Ų90.266%0.66147%0.468SS*.Hα-helixtrans-66.3-30.5177.7-78.3177.7179.3-168.20113.5L303 Q304 I305 P311L303-K307 WeakPolarHBondContact O-CB 3.36Å; L303-K307 WeakPolarHBondContact O-CG 3.29Å; L303-K307 PolarHBondContact O-N 2.61Å; Q304-K307 PolarHBondContact O-N 2.94Å; I305-K307 PolarHBondContact O-N 3.16Å; K307-P311 WeakPolarHBondContact O-CD 3.35Å
308I66.8Low68.3Low106 Ų10692.8 Ų92.854%0.54448%0.475SS..Hα-helixtrans-78.9-43.5176.6-66.1163.4000109.8Q304 I305 L306 P311 H312Q304-I308 WeakPolarHBondContact O-CD1 3.41Å; Q304-I308 WeakPolarHBondContact O-CG1 3.34Å; Q304-I308 PolarHBondContact O-N 3.38Å; I305-I308 PolarHBondContact O-N 3.34Å; I305-I308 VanDerWaalsContact O-N 3.16Å; L306-I308 VanDerWaalsContact C-N 3.31Å; L306-I308 PolarHBondContact O-N 3.29Å; I308-P311 VanDerWaalsContact O-CD 3.22Å; I308-P311 WeakPolarHBondContact O-CD 3.08Å; I308-P311 WeakPolarHBondContact O-CG 3.48Å; I308-H312 PolarHBondContact O-CD2 2.88Å; I308-H312 PolarHBondContact O-NE2 3.44Å
309T69.5Low70.5Confident48 Ų4889.1 Ų89.129%0.29446%0.456SS..Hα-helixtrans-73.8-30.4-178.4-500000113.6I305 L306 H312 V313I305-T309 WeakPolarHBondContact O-CB 3.05Å; I305-T309 PolarHBondContact O-N 2.92Å; I305-T309 PolarHBondContact O-OG1 3.11Å; L306-T309 PolarHBondContact O-N 2.81Å; T309-H312 WeakPolarHBondContact O-CB 3.43Å; T309-H312 PolarHBondContact O-N 3.38Å; T309-H312 VanDerWaalsContact O-N 3.16Å; T309-V313 HydrophobicContact CG2-CG2 3.95Å; T309-V313 WeakPolarHBondContact O-CG2 3.35Å; T309-V313 PolarHBondContact O-N 2.76Å
310L75.3Confident73.2Confident114 Ų11485.1 Ų85.160%0.59745%0.445SS*.Hα-helixtrans-57-47.8-178.3-169.173000114.4L306 H312 V313 G314L306-L310 WeakPolarHBondContact O-CB 3.35Å; L306-L310 PolarHBondContact O-N 2.95Å; L310-H312 VanDerWaalsContact C-N 3.31Å; L310-H312 PolarHBondContact O-N 3.46Å; L310-V313 PolarHBondContact O-N 3.46Å; L310-G314 PolarHBondContact O-N 3.13Å
311P76.4Confident75.4Confident77 Ų7783.2 Ų83.250%0.545%0.445SS..Hα-helixtrans-63.4-35.9175.223.8-34.2000112.5K307 I308 G314 L315K307-P311 WeakPolarHBondContact O-CD 3.35Å; I308-P311 VanDerWaalsContact O-CD 3.22Å; I308-P311 WeakPolarHBondContact O-CD 3.08Å; I308-P311 WeakPolarHBondContact O-CG 3.48Å; P311-G314 PolarHBondContact O-N 2.82Å; P311-L315 WeakPolarHBondContact O-CB 3.32Å; P311-L315 PolarHBondContact O-N 3.13Å
312H82.5Confident77.6Confident47 Ų4783.6 Ų83.622%0.21844%0.439CS..Hα-helixtrans-62.1-48.1176.9-52.8-43.5000111.3I308 T309 L310 G314 L315 V316 D461I308-H312 PolarHBondContact O-CD2 2.88Å; I308-H312 PolarHBondContact O-NE2 3.44Å; T309-H312 WeakPolarHBondContact O-CB 3.43Å; T309-H312 PolarHBondContact O-N 3.38Å; T309-H312 VanDerWaalsContact O-N 3.16Å; L310-H312 VanDerWaalsContact C-N 3.31Å; L310-H312 PolarHBondContact O-N 3.46Å; H312-G314 PolarHBondContact O-N 3.43Å; H312-L315 PolarHBondContact O-N 3.48Å; H312-V316 WeakPolarHBondContact O-CG2 3.4Å; H312-V316 PolarHBondContact O-N 2.77Å; H312-V316 VanDerWaalsContact O-N 3.15Å; H312-D461 VanDerWaalsContact CA-OD2 3.31Å; H312-D461 WeakPolarHBondContact CA-OD2 3.21Å; H312-D461 WeakPolarHBondContact CB-OD2 3.49Å; H312-D461 IonicContact CE1-OD1 2.76Å; H312-D461 PolarHBondContact CE1-OD1 2.92Å; H312-D461 IonicContact CE1-OD2 3.97Å; H312-D461 IonicContact CG-OD1 3.53Å; H312-D461 IonicContact CG-OD2 3.07Å; H312-D461 IonicContact ND1-OD1 3.97Å; H312-D461 PolarHBondContact ND1-OD1 3.28Å; H312-D461 IonicContact ND1-OD2 3.34Å; H312-D461 PolarHBondContact ND1-OD2 3.12Å
313V85.4Confident79.9Confident86 Ų8675.1 Ų75.152%0.52141%0.409SS..Hα-helixtrans-65.5-39.9177.1175.70000111.4T309 L310 L315 V316 A317T309-V313 HydrophobicContact CG2-CG2 3.95Å; T309-V313 WeakPolarHBondContact O-CG2 3.35Å; T309-V313 PolarHBondContact O-N 2.76Å; L310-V313 PolarHBondContact O-N 3.46Å; V313-L315 VanDerWaalsContact C-N 3.29Å; V313-L315 PolarHBondContact O-N 2.8Å; V313-V316 PolarHBondContact O-N 3.38Å; V313-A317 WeakPolarHBondContact O-CB 3.29Å; V313-A317 PolarHBondContact O-N 3.3Å
314G88.4Confident81.9Confident39 Ų3973.2 Ų73.240%0.40240%0.401SS..Hα-helixtrans-60.7-39.2176.800000112.6L310 P311 H312 A317 L318L310-G314 PolarHBondContact O-N 3.13Å; P311-G314 PolarHBondContact O-N 2.82Å; H312-G314 PolarHBondContact O-N 3.43Å; G314-A317 PolarHBondContact O-N 3.19Å; G314-L318 WeakPolarHBondContact O-CB 3.44Å; G314-L318 PolarHBondContact O-N 2.89Å
315L90Very high83.8Confident35 Ų3571.1 Ų71.118%0.18340%0.399CS..Hα-helixtrans-69.1-41.5178.5-172.266.4000112P311 H312 V313 L318 L319 L454 I457 T458 D461P311-L315 WeakPolarHBondContact O-CB 3.32Å; P311-L315 PolarHBondContact O-N 3.13Å; H312-L315 PolarHBondContact O-N 3.48Å; V313-L315 VanDerWaalsContact C-N 3.29Å; V313-L315 PolarHBondContact O-N 2.8Å; L315-L318 PolarHBondContact O-N 3.41Å; L315-L319 PolarHBondContact O-N 3.38Å; L315-L454 HydrophobicContact CD1-CD1 4.02Å; L315-I457 HydrophobicContact CD2-CG2 3.95Å; L315-T458 HydrophobicContact CD1-CG2 3.96Å; L315-T458 HydrophobicContact CD2-CG2 3.94Å; L315-T458 HydrophobicContact CG-CG2 3.5Å; L315-T458 VanDerWaalsContact CG-CG2 3.5Å; L315-D461 HydrophobicContact CD2-CB 4.05Å
316V90.2Very high85.5Confident52 Ų5266.3 Ų66.332%0.31538%0.375SS..Hα-helixtrans-65.1-42.1173.9175.60000111.5H312 V313 L319 T320 I462H312-V316 WeakPolarHBondContact O-CG2 3.4Å; H312-V316 PolarHBondContact O-N 2.77Å; H312-V316 VanDerWaalsContact O-N 3.15Å; V313-V316 PolarHBondContact O-N 3.38Å; V316-L319 PolarHBondContact O-N 3.09Å; V316-T320 WeakPolarHBondContact O-CB 3.5Å; V316-T320 PolarHBondContact O-N 2.89Å; V316-T320 PolarHBondContact O-OG1 3.41Å; V316-I462 HydrophobicContact CG2-CD1 3.94Å; V316-I462 HydrophobicContact CG2-CG1 4.12Å
317A91.6Very high87.2Confident45 Ų4561.1 Ų61.137%0.37235%0.348SS..Hα-helixtrans-62.5-43.117600000111.8V313 G314 T320 I321V313-A317 WeakPolarHBondContact O-CB 3.29Å; V313-A317 PolarHBondContact O-N 3.3Å; G314-A317 PolarHBondContact O-N 3.19Å; A317-T320 PolarHBondContact O-N 3.27Å; A317-I321 VanDerWaalsContact O-CG1 3.31Å; A317-I321 WeakPolarHBondContact O-CG1 3.32Å; A317-I321 PolarHBondContact O-N 2.91Å
318L93.9Very high88.7Confident95 Ų9554.6 Ų54.650%0.49732%0.324SS..Hα-helixtrans-59.5-46.7175.317964.1000111.6G314 L315 T320 I321 Y322 L454G314-L318 WeakPolarHBondContact O-CB 3.44Å; G314-L318 PolarHBondContact O-N 2.89Å; L315-L318 PolarHBondContact O-N 3.41Å; L318-T320 VanDerWaalsContact C-N 3.32Å; L318-T320 PolarHBondContact O-N 3.34Å; L318-I321 PolarHBondContact O-N 2.82Å; L318-Y322 VanDerWaalsContact O-CB 3.31Å; L318-Y322 WeakPolarHBondContact O-CB 3.45Å; L318-Y322 PolarHBondContact O-N 3.16Å; L318-L454 HydrophobicContact CD2-CD1 3.89Å; L318-L454 HydrophobicContact CG-CD1 4.34Å; L318-L454 HydrophobicContact CG-CD2 4.38Å
319L93.5Very high90.1Very high7 Ų753.4 Ų53.44%0.03732%0.318CS..Hα-helixtrans-59.3-43.4175.5-179.573.2000111.8L315 V316 Y322 T323 I425 L454 L455 T458L315-L319 PolarHBondContact O-N 3.38Å; V316-L319 PolarHBondContact O-N 3.09Å; L319-Y322 WeakPolarHBondContact O-CB 3.49Å; L319-Y322 PolarHBondContact O-N 3.38Å; L319-T323 HydrophobicContact CG-CG2 4.45Å; L319-T323 WeakPolarHBondContact O-CG2 3.28Å; L319-T323 PolarHBondContact O-N 3.4Å; L319-T323 PolarHBondContact O-OG1 2.85Å; L319-I425 HydrophobicContact CD1-CD1 3.64Å; L319-I425 HydrophobicContact CG-CD1 4.44Å; L319-L454 HydrophobicContact CD1-CD2 4.2Å; L319-L454 HydrophobicContact CD1-CG 4.09Å; L319-L455 HydrophobicContact CD1-CB 4.17Å; L319-L455 HydrophobicContact CD1-CD1 3.98Å; L319-L455 HydrophobicContact CD2-CD1 3.59Å; L319-L455 HydrophobicContact CG-CD1 4.41Å; L319-T458 HydrophobicContact CB-CG2 3.94Å; L319-T458 HydrophobicContact CD1-CG2 4.34Å; L319-T458 HydrophobicContact CD2-CG2 4.07Å; L319-T458 HydrophobicContact CG-CG2 4.34Å
320T93.2Very high91.4Very high71 Ų7151.1 Ų51.144%0.43630%0.304SS..Hα-helixtrans-67-41.8-178.1-550000111.3V316 A317 L318 Y322 T323 V324V316-T320 WeakPolarHBondContact O-CB 3.5Å; V316-T320 PolarHBondContact O-N 2.89Å; V316-T320 PolarHBondContact O-OG1 3.41Å; A317-T320 PolarHBondContact O-N 3.27Å; L318-T320 VanDerWaalsContact C-N 3.32Å; L318-T320 PolarHBondContact O-N 3.34Å; T320-Y322 VanDerWaalsContact C-N 3.33Å; T320-T323 PolarHBondContact O-N 2.7Å; T320-T323 PolarHBondContact O-OG1 3.2Å; T320-V324 WeakPolarHBondContact O-CB 3.49Å; T320-V324 VanDerWaalsContact O-CG2 3.25Å; T320-V324 WeakPolarHBondContact O-CG2 3.42Å; T320-V324 PolarHBondContact O-N 3.4Å
321I95.4Very high92.3Very high107 Ų10747.7 Ų47.755%0.54929%0.285SS..Hα-helixtrans-63.9-44174.7-67.8165.7000109.7A317 L318 T323 V324 C325A317-I321 VanDerWaalsContact O-CG1 3.31Å; A317-I321 WeakPolarHBondContact O-CG1 3.32Å; A317-I321 PolarHBondContact O-N 2.91Å; L318-I321 PolarHBondContact O-N 2.82Å; I321-T323 PolarHBondContact O-N 3.34Å; I321-V324 PolarHBondContact O-N 3.14Å; I321-C325 WeakPolarHBondContact O-CB 3.49Å; I321-C325 PolarHBondContact O-N 2.97Å; I321-C325 PolarHBondContact O-SG 2.95Å
322Y95.9Very high93.2Very high56 Ų5650 Ų5022%0.2229%0.292CS..Hα-helixtrans-59.6-44178.3-175.7-98000112.3L318 L319 T320 G326 I425 F447 G451 L454L318-Y322 VanDerWaalsContact O-CB 3.31Å; L318-Y322 WeakPolarHBondContact O-CB 3.45Å; L318-Y322 PolarHBondContact O-N 3.16Å; L319-Y322 WeakPolarHBondContact O-CB 3.49Å; L319-Y322 PolarHBondContact O-N 3.38Å; T320-Y322 VanDerWaalsContact C-N 3.33Å; Y322-G326 PolarHBondContact O-N 3.4Å; Y322-I425 HydrophobicContact CE1-CG2 4.18Å; Y322-F447 HydrophobicContact CD1-CD2 4.45Å; Y322-F447 AromaticContact CD1-CE2 3.59Å; Y322-F447 HydrophobicContact CD1-CE2 3.59Å; Y322-F447 AromaticContact CD1-CZ 3.8Å; Y322-F447 HydrophobicContact CD1-CZ 3.8Å; Y322-F447 AromaticContact CE1-CD2 3.55Å; Y322-F447 HydrophobicContact CE1-CD2 3.55Å; Y322-F447 HydrophobicContact CE1-CE1 4.16Å; Y322-F447 AromaticContact CE1-CE2 3.07Å; Y322-F447 HydrophobicContact CE1-CE2 3.07Å; Y322-F447 HydrophobicContact CE1-CG 4.24Å; Y322-F447 AromaticContact CE1-CZ 3.42Å; Y322-F447 HydrophobicContact CE1-CZ 3.42Å; Y322-F447 VanDerWaalsContact CE1-CZ 3.42Å; Y322-F447 HydrophobicContact CE2-CD2 4.24Å; Y322-F447 HydrophobicContact CE2-CE2 4.14Å; Y322-F447 HydrophobicContact CG-CE2 4.29Å; Y322-F447 AromaticContact CZ-CD2 3.43Å; Y322-F447 VanDerWaalsContact CZ-CD2 3.43Å; Y322-F447 AromaticContact CZ-CE2 3.4Å; Y322-F447 VanDerWaalsContact CZ-CE2 3.4Å; Y322-F447 WeakPolarHBondContact OH-CA 3Å; Y322-F447 VanDerWaalsContact OH-CD2 3.25Å; Y322-F447 WeakPolarHBondContact OH-CD2 3.48Å; Y322-F447 PolarHBondContact OH-O 3.35Å; Y322-G451 PolarHBondContact OH-N 2.9Å; Y322-L454 HydrophobicContact CD1-CD2 4.28Å; Y322-L454 HydrophobicContact CG-CD2 4.07Å
323T94.9Very high93.7Very high12 Ų1250.1 Ų50.17%0.07429%0.294CS..Hα-helixtrans-68-43178.760.30000112.5L319 T320 I321 G326 G327 I425L319-T323 HydrophobicContact CG-CG2 4.45Å; L319-T323 WeakPolarHBondContact O-CG2 3.28Å; L319-T323 PolarHBondContact O-N 3.4Å; L319-T323 PolarHBondContact O-OG1 2.85Å; T320-T323 PolarHBondContact O-N 2.7Å; T320-T323 PolarHBondContact O-OG1 3.2Å; I321-T323 PolarHBondContact O-N 3.34Å; T323-G326 PolarHBondContact O-N 3.11Å; T323-G327 PolarHBondContact O-N 3.43Å; T323-I425 HydrophobicContact CG2-CD1 3.21Å; T323-I425 HydrophobicContact CG2-CG1 4.43Å
324V95.7Very high94.1Very high56 Ų5646 Ų4634%0.33927%0.269SS..Hα-helixtrans-65.6-44.1178.4173.10000110.9T320 I321 G327 G328 F414 I418T320-V324 WeakPolarHBondContact O-CB 3.49Å; T320-V324 VanDerWaalsContact O-CG2 3.25Å; T320-V324 WeakPolarHBondContact O-CG2 3.42Å; T320-V324 PolarHBondContact O-N 3.4Å; I321-V324 PolarHBondContact O-N 3.14Å; V324-G327 PolarHBondContact O-N 3.26Å; V324-G328 PolarHBondContact O-N 3.04Å; V324-F414 HydrophobicContact CG1-CZ 4.29Å; V324-I418 HydrophobicContact CG1-CD1 4.41Å; V324-I418 HydrophobicContact CG2-CD1 4.28Å
325C95.9Very high94.3Very high74 Ų7445.8 Ų45.850%0.526%0.258SS..Hα-helixtrans-62.1-46.1174.7-72.50000111.6I321 G328 I329I321-C325 WeakPolarHBondContact O-CB 3.49Å; I321-C325 PolarHBondContact O-N 2.97Å; I321-C325 PolarHBondContact O-SG 2.95Å; C325-G328 PolarHBondContact O-N 3.47Å; C325-I329 WeakPolarHBondContact O-CG1 3.45Å; C325-I329 PolarHBondContact O-N 2.89Å
326G96Very high94.4Very high5 Ų547.7 Ų47.75%0.05227%0.274CS..Hα-helixtrans-58.5-50.8176.300000112.3Y322 T323 G328 I329 F330Y322-G326 PolarHBondContact O-N 3.4Å; T323-G326 PolarHBondContact O-N 3.11Å; G326-G328 VanDerWaalsContact C-N 3.31Å; G326-G328 PolarHBondContact O-N 3.19Å; G326-I329 PolarHBondContact O-N 3.47Å; G326-I329 VanDerWaalsContact O-N 3.15Å; G326-F330 WeakPolarHBondContact O-CD2 3.02Å; G326-F330 PolarHBondContact O-N 3.11Å
327G96Very high94.4Very high0 Ų047.8 Ų47.80%027%0.272CS..Hα-helixtrans-59.1-40.4177.300000112.8T323 V324 I329 F330 H331 A417T323-G327 PolarHBondContact O-N 3.43Å; V324-G327 PolarHBondContact O-N 3.26Å; G327-I329 PolarHBondContact O-N 3.46Å; G327-F330 PolarHBondContact O-N 3.07Å; G327-H331 VanDerWaalsContact O-CB 3.31Å; G327-H331 WeakPolarHBondContact O-CB 3.31Å; G327-H331 PolarHBondContact O-N 3.01Å; G327-A417 WeakPolarHBondContact CA-O 3.36Å; G327-A417 VanDerWaalsContact O-CB 3.24Å; G327-A417 WeakPolarHBondContact O-CB 3.46Å
328G96.2Very high94.4Very high15 Ų1545.7 Ų45.716%0.15525%0.254CS..Hα-helixtrans-60.8-42.9174.100000113.2V324 C325 G326 L332V324-G328 PolarHBondContact O-N 3.04Å; C325-G328 PolarHBondContact O-N 3.47Å; G326-G328 VanDerWaalsContact C-N 3.31Å; G326-G328 PolarHBondContact O-N 3.19Å; G328-L332 VanDerWaalsContact O-CG 3.29Å; G328-L332 WeakPolarHBondContact O-CG 3.25Å; G328-L332 PolarHBondContact O-N 3.34Å; G328-L332 VanDerWaalsContact O-N 3.15Å
329I95.9Very high94.2Very high81 Ų8145.9 Ų45.942%0.41525%0.252SS..Hα-helixtrans-68.5-42.9178.1-60.3165.3000110.7C325 G326 G327 H331 L332 I333 L443C325-I329 WeakPolarHBondContact O-CG1 3.45Å; C325-I329 PolarHBondContact O-N 2.89Å; G326-I329 PolarHBondContact O-N 3.47Å; G326-I329 VanDerWaalsContact O-N 3.15Å; G327-I329 PolarHBondContact O-N 3.46Å; I329-H331 PolarHBondContact O-N 3.44Å; I329-L332 PolarHBondContact O-N 3.44Å; I329-I333 HydrophobicContact CG2-CD1 3.9Å; I329-I333 WeakPolarHBondContact O-CG1 3.41Å; I329-I333 PolarHBondContact O-N 3.43Å; I329-L443 HydrophobicContact CB-CD2 4.12Å; I329-L443 HydrophobicContact CG2-CD1 4.29Å; I329-L443 HydrophobicContact CG2-CD2 3.4Å
330F96.6Very high94Very high0 Ų051.4 Ų51.40%028%0.278CS..Hα-helixtrans-60.9-44.5176.5-77.1-63.8000112.3G326 G327 L332 I333 E334 W412 F420 A421 L443 C444 F447G326-F330 WeakPolarHBondContact O-CD2 3.02Å; G326-F330 PolarHBondContact O-N 3.11Å; G327-F330 PolarHBondContact O-N 3.07Å; F330-L332 PolarHBondContact O-N 3.5Å; F330-I333 PolarHBondContact O-N 2.86Å; F330-E334 WeakPolarHBondContact O-CB 3.2Å; F330-E334 PolarHBondContact O-N 2.88Å; F330-W412 HydrophobicContact CB-CE3 4.31Å; F330-W412 HydrophobicContact CB-CZ3 3.73Å; F330-W412 HydrophobicContact CG-CZ3 4.4Å; F330-F420 AromaticContact CD1-CE1 3.92Å; F330-F420 HydrophobicContact CD1-CE1 3.92Å; F330-F420 AromaticContact CD2-CD1 3.99Å; F330-F420 HydrophobicContact CD2-CD1 3.99Å; F330-F420 AromaticContact CD2-CE1 3.89Å; F330-F420 HydrophobicContact CD2-CE1 3.89Å; F330-F420 AromaticContact CE1-CE1 3.9Å; F330-F420 HydrophobicContact CE1-CE1 3.9Å; F330-F420 HydrophobicContact CE2-CD1 4.35Å; F330-F420 AromaticContact CE2-CE1 3.89Å; F330-F420 HydrophobicContact CE2-CE1 3.89Å; F330-F420 HydrophobicContact CG-CD1 4.11Å; F330-F420 AromaticContact CG-CE1 3.94Å; F330-F420 HydrophobicContact CG-CE1 3.94Å; F330-F420 AromaticContact CZ-CE1 3.9Å; F330-F420 HydrophobicContact CZ-CE1 3.9Å; F330-A421 HydrophobicContact CD2-CB 4.45Å; F330-L443 HydrophobicContact CD1-CD2 3.81Å; F330-L443 HydrophobicContact CE1-CB 4.17Å; F330-L443 HydrophobicContact CE1-CD2 3.66Å; F330-L443 HydrophobicContact CE1-CG 3.92Å; F330-L443 HydrophobicContact CE2-CD2 4.45Å; F330-L443 HydrophobicContact CG-CD2 4.26Å; F330-L443 HydrophobicContact CZ-CB 4.5Å; F330-L443 HydrophobicContact CZ-CD2 3.98Å; F330-L443 HydrophobicContact CZ-CG 3.95Å; F330-C444 HydrophobicContact CE1-CB 4.15Å; F330-C444 HydrophobicContact CZ-CB 4.09Å; F330-F447 HydrophobicContact CE2-CD1 4.06Å; F330-F447 HydrophobicContact CE2-CE1 4.41Å; F330-F447 HydrophobicContact CE2-CG 4.23Å; F330-F447 HydrophobicContact CZ-CB 4.45Å
331H95.6Very high93.8Very high42 Ų4249.3 Ų49.319%0.19427%0.265CS..Hα-helixtrans-54.7-50.1175.3172.169000111.6G327 I329 I333 L335 W412 A417G327-H331 VanDerWaalsContact O-CB 3.31Å; G327-H331 WeakPolarHBondContact O-CB 3.31Å; G327-H331 PolarHBondContact O-N 3.01Å; I329-H331 PolarHBondContact O-N 3.44Å; H331-I333 VanDerWaalsContact C-N 3.33Å; H331-I333 PolarHBondContact O-N 3.28Å; H331-L335 WeakPolarHBondContact O-CB 3.32Å; H331-L335 PolarHBondContact O-N 3.46Å; H331-W412 PolarHBondContact CE1-O 3.48Å; H331-W412 VanDerWaalsContact CE1-O 3.3Å; H331-W412 PolarHBondContact ND1-O 3.44Å; H331-A417 HydrophobicContact CB-CB 3.77Å
332L94.6Very high93.4Very high126 Ų12645.6 Ų45.666%0.6624%0.244SC*.Hα-helixtrans-63-37.5-177.5-69.5171.8000113.1G328 I329 F330G328-L332 VanDerWaalsContact O-CG 3.29Å; G328-L332 WeakPolarHBondContact O-CG 3.25Å; G328-L332 PolarHBondContact O-N 3.34Å; G328-L332 VanDerWaalsContact O-N 3.15Å; I329-L332 PolarHBondContact O-N 3.44Å; F330-L332 PolarHBondContact O-N 3.5Å
333I93.9Very high93.1Very high49 Ų4946.6 Ų46.625%0.25126%0.259SS..Hα-helixtrans-78.5-54.9-177.9-65.1173.2000110.6I329 F330 H331 S336 L443I329-I333 HydrophobicContact CG2-CD1 3.9Å; I329-I333 WeakPolarHBondContact O-CG1 3.41Å; I329-I333 PolarHBondContact O-N 3.43Å; F330-I333 PolarHBondContact O-N 2.86Å; H331-I333 VanDerWaalsContact C-N 3.33Å; H331-I333 PolarHBondContact O-N 3.28Å; I333-S336 PolarHBondContact O-OG 2.86Å; I333-L443 HydrophobicContact CD1-CD2 4.04Å
334E93.8Very high92.9Very high0 Ų050.5 Ų50.50%028%0.28CS..Hα-helixtrans-79.7-28.8-169.2-65.7-68.7143.500113F330 S336 H337 E338 W412 P435 R436 T437F330-E334 WeakPolarHBondContact O-CB 3.2Å; F330-E334 PolarHBondContact O-N 2.88Å; E334-S336 VanDerWaalsContact C-N 3.34Å; E334-S336 PolarHBondContact O-N 3.45Å; E334-H337 PolarHBondContact O-N 3.29Å; E334-E338 WeakPolarHBondContact O-CB 3.3Å; E334-E338 PolarHBondContact O-N 3Å; E334-W412 HydrophobicContact CB-CD2 3.42Å; E334-W412 VanDerWaalsContact CB-CD2 3.42Å; E334-W412 VanDerWaalsContact CB-CE2 3.48Å; E334-W412 HydrophobicContact CB-CE3 3.93Å; E334-W412 HydrophobicContact CB-CG 3.66Å; E334-W412 HydrophobicContact CB-CZ2 4.07Å; E334-W412 HydrophobicContact CB-CZ3 4.48Å; E334-W412 HydrophobicContact CG-CD2 4.14Å; E334-W412 HydrophobicContact CG-CE3 4.38Å; E334-W412 HydrophobicContact CG-CH2 4.22Å; E334-W412 HydrophobicContact CG-CZ2 3.92Å; E334-W412 HydrophobicContact CG-CZ3 4.44Å; E334-P435 HydrophobicContact CG-CB 4.19Å; E334-P435 WeakPolarHBondContact OE1-CB 3.45Å; E334-R436 PolarHBondContact OE2-N 3.35Å; E334-T437 VanDerWaalsContact OE1-CB 3.31Å; E334-T437 WeakPolarHBondContact OE1-CB 3.36Å; E334-T437 WeakPolarHBondContact OE1-CG2 3.37Å; E334-T437 PolarHBondContact OE1-N 3.47Å; E334-T437 PolarHBondContact OE1-OG1 3.05Å
335L92.4Very high92.6Very high33 Ų3349 Ų4917%0.17327%0.272CS..Hα-helixtrans-61-44.8177.3-179.670.3000111.4H331 H337 E338 E339 T410 W412H331-L335 WeakPolarHBondContact O-CB 3.32Å; H331-L335 PolarHBondContact O-N 3.46Å; L335-H337 VanDerWaalsContact C-N 3.25Å; L335-H337 PolarHBondContact O-N 3.04Å; L335-E338 PolarHBondContact O-N 3.08Å; L335-E339 WeakPolarHBondContact O-CG 3.21Å; L335-E339 PolarHBondContact O-N 2.91Å; L335-T410 HydrophobicContact CD1-CG2 3.94Å; L335-W412 HydrophobicContact CB-CB 4.17Å; L335-W412 HydrophobicContact CD1-CB 4.33Å
336S91.5Very high92.3Very high75 Ų7547.7 Ų47.752%0.52426%0.26SS..Hα-helixtrans-61.7-36.6179.268.70000112.2I333 E334 Q340I333-S336 PolarHBondContact O-OG 2.86Å; E334-S336 VanDerWaalsContact C-N 3.34Å; E334-S336 PolarHBondContact O-N 3.45Å; S336-Q340 PolarHBondContact O-N 2.83Å
337H90.9Very high92Very high55 Ų5553.6 Ų53.626%0.25528%0.284SS..Hα-helixtrans-72.6-43.6176.9-177.161000111.9E334 L335 E339 Q340 V341 T437E334-H337 PolarHBondContact O-N 3.29Å; L335-H337 VanDerWaalsContact C-N 3.25Å; L335-H337 PolarHBondContact O-N 3.04Å; H337-E339 PolarHBondContact O-N 2.79Å; H337-Q340 PolarHBondContact O-N 2.64Å; H337-V341 WeakPolarHBondContact O-CG2 3.2Å; H337-V341 PolarHBondContact O-N 3.35Å; H337-T437 HydrophobicContact CB-CG2 3.61Å; H337-T437 VanDerWaalsContact CG-CG2 3.46Å
338E90.9Very high91.8Very high1 Ų156.1 Ų56.11%0.00530%0.301CS..Hα-helixtrans-55.4-49.7175.6168176.2-17400111E334 L335 Q340 V341 R342 Y397 T410 I411 W412E334-E338 WeakPolarHBondContact O-CB 3.3Å; E334-E338 PolarHBondContact O-N 3Å; L335-E338 PolarHBondContact O-N 3.08Å; E338-Q340 VanDerWaalsContact C-N 3.29Å; E338-Q340 PolarHBondContact O-N 3.32Å; E338-V341 PolarHBondContact O-N 2.92Å; E338-R342 WeakPolarHBondContact O-CB 3.43Å; E338-R342 PolarHBondContact O-N 3.43Å; E338-Y397 HydrophobicContact CB-CD1 3.88Å; E338-Y397 HydrophobicContact CB-CE1 3.7Å; E338-Y397 HydrophobicContact CG-CD1 3.48Å; E338-Y397 VanDerWaalsContact CG-CD1 3.48Å; E338-Y397 HydrophobicContact CG-CE1 3.84Å; E338-Y397 HydrophobicContact CG-CG 4.1Å; E338-T410 WeakPolarHBondContact OE1-CA 3.4Å; E338-T410 WeakPolarHBondContact OE1-CB 3.43Å; E338-I411 WeakPolarHBondContact OE1-CG1 3.36Å; E338-I411 PolarHBondContact OE1-N 3.41Å; E338-I411 WeakPolarHBondContact OE2-CG1 3.36Å; E338-I411 PolarHBondContact OE2-N 2.93Å; E338-W412 WeakPolarHBondContact OE2-CB 3.5Å; E338-W412 PolarHBondContact OE2-N 3.14Å
339E89.3Confident91.6Very high98 Ų9855.6 Ų55.646%0.45830%0.295SS..Hα-helixtrans-59.9-40-179.1-73.8-177.8169.900112.4L335 H337 S343L335-E339 WeakPolarHBondContact O-CG 3.21Å; L335-E339 PolarHBondContact O-N 2.91Å; H337-E339 PolarHBondContact O-N 2.79Å; E339-S343 WeakPolarHBondContact O-CB 3.45Å; E339-S343 PolarHBondContact O-N 3.16Å; E339-S343 VanDerWaalsContact O-N 3.08Å
340Q89.5Confident91.4Very high124 Ų12454.1 Ų54.158%0.57930%0.295SS*.Hα-helixtrans-68.3-48.6178.8-172.9178.87.600112.1S336 H337 E338 S343 N344S336-Q340 PolarHBondContact O-N 2.83Å; H337-Q340 PolarHBondContact O-N 2.64Å; E338-Q340 VanDerWaalsContact C-N 3.29Å; E338-Q340 PolarHBondContact O-N 3.32Å; Q340-S343 PolarHBondContact O-N 3.49Å; Q340-N344 VanDerWaalsContact O-CG 3.32Å; Q340-N344 PolarHBondContact O-N 3.45Å; Q340-N344 VanDerWaalsContact O-N 3.17Å; Q340-N344 PolarHBondContact O-ND2 3.18Å
341V88.8Confident91.3Very high27 Ų2759.2 Ų59.216%0.16432%0.319CS..Hα-helixtrans-64.7-43.9179.7175.50000110.3H337 E338 S343 N344 S345 Y397H337-V341 WeakPolarHBondContact O-CG2 3.2Å; H337-V341 PolarHBondContact O-N 3.35Å; E338-V341 PolarHBondContact O-N 2.92Å; V341-S343 PolarHBondContact O-N 2.97Å; V341-N344 PolarHBondContact O-N 3.4Å; V341-S345 WeakPolarHBondContact O-CB 3.35Å; V341-S345 PolarHBondContact O-N 3.04Å; V341-S345 PolarHBondContact O-OG 3.4Å; V341-Y397 HydrophobicContact CB-CD2 4.03Å; V341-Y397 HydrophobicContact CB-CE2 4.21Å; V341-Y397 HydrophobicContact CG1-CD2 3.74Å; V341-Y397 HydrophobicContact CG1-CE2 4.12Å
342R87.7Confident91.2Very high28 Ų2857.5 Ų57.511%0.10631%0.312CS..Hα-helixtrans-57.7-47.6177.4-174.6176.766.8126.6-0.3111.9E338 N344 S345 L346 I398 D402E338-R342 WeakPolarHBondContact O-CB 3.43Å; E338-R342 PolarHBondContact O-N 3.43Å; R342-N344 PolarHBondContact O-N 2.92Å; R342-S345 PolarHBondContact O-N 3.06Å; R342-L346 HydrophobicContact CG-CD1 4.06Å; R342-L346 HydrophobicContact CG-CG 4.48Å; R342-L346 WeakPolarHBondContact O-CB 3.21Å; R342-L346 VanDerWaalsContact O-CG 3.31Å; R342-L346 WeakPolarHBondContact O-CG 3.49Å; R342-L346 PolarHBondContact O-N 3.31Å; R342-I398 HydrophobicContact CG-CG1 4.14Å; R342-D402 IonicContact NH1-OD1 2.63Å
343S88.5Confident91.2Very high77 Ų7752.2 Ų52.254%0.53828%0.283SS..Hα-helixtrans-60-44.5178.3-175.80000112.2E339 Q340 V341 K347E339-S343 WeakPolarHBondContact O-CB 3.45Å; E339-S343 PolarHBondContact O-N 3.16Å; E339-S343 VanDerWaalsContact O-N 3.08Å; Q340-S343 PolarHBondContact O-N 3.49Å; V341-S343 PolarHBondContact O-N 2.97Å; S343-K347 WeakPolarHBondContact O-CB 3.32Å; S343-K347 PolarHBondContact O-N 3.14Å; S343-K347 VanDerWaalsContact O-N 3.08Å
344N90.7Very high91.3Very high94 Ų9452 Ų5250%0.50329%0.285SS..Hα-helixtrans-65.6-43.9178.8-69.5-20.1000112.3Q340 V341 R342 K347 S348Q340-N344 VanDerWaalsContact O-CG 3.32Å; Q340-N344 PolarHBondContact O-N 3.45Å; Q340-N344 VanDerWaalsContact O-N 3.17Å; Q340-N344 PolarHBondContact O-ND2 3.18Å; V341-N344 PolarHBondContact O-N 3.4Å; R342-N344 PolarHBondContact O-N 2.92Å; N344-K347 PolarHBondContact O-N 3.21Å; N344-S348 WeakPolarHBondContact O-CB 3.47Å; N344-S348 PolarHBondContact O-N 3.38Å
345S89.5Confident91.4Very high25 Ų2553.4 Ų53.418%0.17530%0.296CS..Hα-helixtrans-68.8-40.4-179.8-66.10000112V341 R342 K347 S348 I349V341-S345 WeakPolarHBondContact O-CB 3.35Å; V341-S345 PolarHBondContact O-N 3.04Å; V341-S345 PolarHBondContact O-OG 3.4Å; R342-S345 PolarHBondContact O-N 3.06Å; S345-K347 VanDerWaalsContact C-N 3.32Å; S345-K347 PolarHBondContact O-N 2.7Å; S345-S348 PolarHBondContact O-N 3.44Å; S345-I349 VanDerWaalsContact O-CG1 3.24Å; S345-I349 WeakPolarHBondContact O-CG1 3.34Å; S345-I349 PolarHBondContact O-N 3.27Å
346L89Confident91.6Very high47 Ų4752 Ų5225%0.24629%0.288CS..Hα-helixtrans-61-41.7173.4-73.6173.7000111.9R342 I349 A350 I398 I403R342-L346 HydrophobicContact CG-CD1 4.06Å; R342-L346 HydrophobicContact CG-CG 4.48Å; R342-L346 WeakPolarHBondContact O-CB 3.21Å; R342-L346 VanDerWaalsContact O-CG 3.31Å; R342-L346 WeakPolarHBondContact O-CG 3.49Å; R342-L346 PolarHBondContact O-N 3.31Å; L346-I349 PolarHBondContact O-N 2.91Å; L346-A350 WeakPolarHBondContact O-CB 3.28Å; L346-A350 PolarHBondContact O-N 2.89Å; L346-I398 HydrophobicContact CD2-CD1 4.16Å; L346-I398 HydrophobicContact CD2-CG2 4.34Å; L346-I398 HydrophobicContact CG-CD1 4.08Å; L346-I403 HydrophobicContact CD2-CG1 4.36Å
347K91.4Very high91.8Very high128 Ų12848.4 Ų48.456%0.55726%0.263SS*.Hα-helixtrans-62.6-47.1174.8-178.6176.8171.3-179.70111.6S343 N344 S345 I349 A350 E351S343-K347 WeakPolarHBondContact O-CB 3.32Å; S343-K347 PolarHBondContact O-N 3.14Å; S343-K347 VanDerWaalsContact O-N 3.08Å; N344-K347 PolarHBondContact O-N 3.21Å; S345-K347 VanDerWaalsContact C-N 3.32Å; S345-K347 PolarHBondContact O-N 2.7Å; K347-I349 PolarHBondContact O-N 3.31Å; K347-A350 PolarHBondContact O-N 3.41Å; K347-E351 WeakPolarHBondContact CE-OE1 3.44Å; K347-E351 HydrophobicContact CG-CG 4.45Å; K347-E351 IonicContact NZ-OE1 3.39Å; K347-E351 WeakPolarHBondContact O-CB 3.19Å; K347-E351 WeakPolarHBondContact O-CG 3.41Å; K347-E351 PolarHBondContact O-N 3.41Å
348S91.8Very high92Very high53 Ų5349.6 Ų49.637%0.37127%0.269SS..Hα-helixtrans-59.7-43.4177.8-175.50000112.3N344 S345 E351 A352N344-S348 WeakPolarHBondContact O-CB 3.47Å; N344-S348 PolarHBondContact O-N 3.38Å; S345-S348 PolarHBondContact O-N 3.44Å; S348-E351 PolarHBondContact O-N 3Å; S348-A352 VanDerWaalsContact O-CB 3.3Å; S348-A352 WeakPolarHBondContact O-CB 3.29Å; S348-A352 PolarHBondContact O-N 2.91Å
349I91.4Very high92.2Very high5 Ų553.9 Ų53.93%0.02629%0.285CS..Hα-helixtrans-61.5-49.1175.6-68.7164.1000110.6S345 L346 K347 E351 A352 K353 V388 L389 A392 I398 I403S345-I349 VanDerWaalsContact O-CG1 3.24Å; S345-I349 WeakPolarHBondContact O-CG1 3.34Å; S345-I349 PolarHBondContact O-N 3.27Å; L346-I349 PolarHBondContact O-N 2.91Å; K347-I349 PolarHBondContact O-N 3.31Å; I349-E351 VanDerWaalsContact C-N 3.35Å; I349-E351 PolarHBondContact O-N 2.89Å; I349-A352 PolarHBondContact O-N 2.94Å; I349-K353 HydrophobicContact CG2-CD 4.05Å; I349-K353 VanDerWaalsContact CG2-CE 3.4Å; I349-K353 HydrophobicContact CG2-CG 4.37Å; I349-K353 VanDerWaalsContact O-CG 3.29Å; I349-K353 WeakPolarHBondContact O-CG 3.22Å; I349-K353 PolarHBondContact O-N 3.5Å; I349-V388 HydrophobicContact CG1-CG1 4.08Å; I349-L389 HydrophobicContact CD1-CD2 4.12Å; I349-L389 HydrophobicContact CG1-CD2 4.12Å; I349-L389 HydrophobicContact CG2-CD2 3.78Å; I349-A392 HydrophobicContact CD1-CB 3.63Å; I349-A392 HydrophobicContact CG1-CB 4.16Å; I349-I398 HydrophobicContact CD1-CD1 4.2Å; I349-I403 HydrophobicContact CD1-CD1 4.21Å; I349-I403 HydrophobicContact CD1-CG1 4.4Å
350A91.6Very high92.5Very high49 Ų4949.4 Ų49.441%0.40526%0.264SS..Hα-helixtrans-60.4-45.3-179.700000111.6L346 K347 K353 V354L346-A350 WeakPolarHBondContact O-CB 3.28Å; L346-A350 PolarHBondContact O-N 2.89Å; K347-A350 PolarHBondContact O-N 3.41Å; A350-K353 PolarHBondContact O-N 2.98Å; A350-V354 WeakPolarHBondContact O-CG2 3.42Å; A350-V354 PolarHBondContact O-N 3.22Å
351E94.3Very high92.7Very high108 Ų10845 Ų4551%0.50524%0.242SC..Hα-helixtrans-62-44.3176.1-72.8175.2176.800111.9K347 S348 I349 K353 A355K347-E351 WeakPolarHBondContact CE-OE1 3.44Å; K347-E351 HydrophobicContact CG-CG 4.45Å; K347-E351 IonicContact NZ-OE1 3.39Å; K347-E351 WeakPolarHBondContact O-CB 3.19Å; K347-E351 WeakPolarHBondContact O-CG 3.41Å; K347-E351 PolarHBondContact O-N 3.41Å; S348-E351 PolarHBondContact O-N 3Å; I349-E351 VanDerWaalsContact C-N 3.35Å; I349-E351 PolarHBondContact O-N 2.89Å; E351-K353 PolarHBondContact O-N 3.49Å; E351-A355 WeakPolarHBondContact O-CB 3.37Å; E351-A355 PolarHBondContact O-N 3.48Å
352A94Very high92.9Very high6 Ų648.3 Ų48.35%0.0526%0.259CS..Hα-helixtrans-63.1-42.7178.400000112.3S348 I349 F356 F384 V388S348-A352 VanDerWaalsContact O-CB 3.3Å; S348-A352 WeakPolarHBondContact O-CB 3.29Å; S348-A352 PolarHBondContact O-N 2.91Å; I349-A352 PolarHBondContact O-N 2.94Å; A352-F356 WeakPolarHBondContact O-CB 3.16Å; A352-F356 PolarHBondContact O-N 3.38Å; A352-F384 HydrophobicContact CB-CD1 4.43Å; A352-F384 HydrophobicContact CB-CE1 4.04Å; A352-V388 HydrophobicContact CB-CB 4.29Å; A352-V388 HydrophobicContact CB-CG1 4.19Å; A352-V388 HydrophobicContact CB-CG2 4.16Å
353K94.6Very high93.2Very high14 Ų1448.8 Ų48.86%0.06126%0.264CS..Hα-helixtrans-63.9-50.6177.2-70.8178.9-176.9-179.10111.6L128 M131 E135 I349 A350 E351 A355 F356 L357 V385 I403L128-K353 HydrophobicContact CD2-CB 3.73Å; L128-K353 HydrophobicContact CD2-CD 3.9Å; L128-K353 HydrophobicContact CD2-CG 4.45Å; M131-K353 HydrophobicContact SD-CB 4.46Å; M131-K353 HydrophobicContact SD-CD 4.09Å; M131-K353 HydrophobicContact SD-CG 3.79Å; E135-K353 WeakPolarHBondContact OE1-CE 3.22Å; E135-K353 IonicContact OE1-NZ 2.79Å; E135-K353 PolarHBondContact OE1-NZ 2.91Å; E135-K353 IonicContact OE2-NZ 3.83Å; E135-K353 PolarHBondContact OE2-NZ 3.4Å; I349-K353 HydrophobicContact CG2-CD 4.05Å; I349-K353 VanDerWaalsContact CG2-CE 3.4Å; I349-K353 HydrophobicContact CG2-CG 4.37Å; I349-K353 VanDerWaalsContact O-CG 3.29Å; I349-K353 WeakPolarHBondContact O-CG 3.22Å; I349-K353 PolarHBondContact O-N 3.5Å; A350-K353 PolarHBondContact O-N 2.98Å; E351-K353 PolarHBondContact O-N 3.49Å; K353-A355 VanDerWaalsContact C-N 3.34Å; K353-A355 PolarHBondContact O-N 2.77Å; K353-F356 PolarHBondContact O-N 2.91Å; K353-L357 WeakPolarHBondContact O-CB 3.23Å; K353-L357 VanDerWaalsContact O-CG 3.25Å; K353-L357 WeakPolarHBondContact O-CG 3.17Å; K353-L357 PolarHBondContact O-N 3.33Å; K353-V385 HydrophobicContact CG-CG1 4.03Å; K353-I403 VanDerWaalsContact NZ-CG2 3.28Å
354V95.3Very high93.3Very high46 Ų4645.6 Ų45.628%0.27924%0.241SC..Hα-helixtrans-61.9-44.6179.4172.50000110.3L124 A350 F356 L357 E358L124-V354 HydrophobicContact CD1-CG1 4.47Å; A350-V354 WeakPolarHBondContact O-CG2 3.42Å; A350-V354 PolarHBondContact O-N 3.22Å; V354-F356 PolarHBondContact O-N 2.82Å; V354-L357 PolarHBondContact O-N 3.35Å; V354-E358 HydrophobicContact CG1-CG 4.23Å; V354-E358 WeakPolarHBondContact O-CG 3.46Å; V354-E358 PolarHBondContact O-N 3.49Å
355A95.9Very high93.3Very high29 Ų2945.7 Ų45.724%0.2424%0.239CC..Hα-helixtrans-67-38-179.600000112.6E351 K353 R359E351-A355 WeakPolarHBondContact O-CB 3.37Å; E351-A355 PolarHBondContact O-N 3.48Å; K353-A355 VanDerWaalsContact C-N 3.34Å; K353-A355 PolarHBondContact O-N 2.77Å; A355-R359 VanDerWaalsContact CB-NH1 3.31Å; A355-R359 WeakPolarHBondContact O-CB 3.46Å; A355-R359 VanDerWaalsContact O-CG 3.29Å; A355-R359 WeakPolarHBondContact O-CG 3.46Å; A355-R359 PolarHBondContact O-N 2.98Å; A355-R359 VanDerWaalsContact O-N 3.13Å; A355-R359 PolarHBondContact O-NH1 2.87Å
356F96.4Very high93.4Very high2 Ų249.2 Ų49.21%0.00925%0.254CS..Hα-helixtrans-58.3-51.4170.8162.1-99.6000110.5F105 L106 M131 A352 K353 V354 R359 M360 E381 L382 V385F105-F356 AromaticContact CE1-CE1 3.8Å; F105-F356 HydrophobicContact CE1-CE1 3.8Å; F105-F356 HydrophobicContact CE1-CZ 4.11Å; F105-F356 HydrophobicContact CZ-CE1 4.02Å; L106-F356 HydrophobicContact CD2-CZ 4.3Å; M131-F356 HydrophobicContact CE-CD1 3.75Å; M131-F356 HydrophobicContact CE-CE1 3.92Å; A352-F356 WeakPolarHBondContact O-CB 3.16Å; A352-F356 PolarHBondContact O-N 3.38Å; K353-F356 PolarHBondContact O-N 2.91Å; V354-F356 PolarHBondContact O-N 2.82Å; F356-R359 PolarHBondContact O-N 3.43Å; F356-M360 HydrophobicContact CD2-CG 4.07Å; F356-M360 HydrophobicContact CE1-CG 4.26Å; F356-M360 HydrophobicContact CE2-CG 3.59Å; F356-M360 HydrophobicContact CE2-SD 4.24Å; F356-M360 HydrophobicContact CZ-CG 3.7Å; F356-M360 WeakPolarHBondContact O-CG 3.44Å; F356-M360 PolarHBondContact O-N 3.23Å; F356-E381 HydrophobicContact CD2-CB 3.67Å; F356-E381 HydrophobicContact CE2-CB 3.93Å; F356-L382 HydrophobicContact CE1-CD1 4.2Å; F356-L382 HydrophobicContact CE2-CB 3.92Å; F356-L382 HydrophobicContact CE2-CD1 4.28Å; F356-L382 HydrophobicContact CZ-CB 4.28Å; F356-L382 HydrophobicContact CZ-CD1 4.02Å; F356-V385 HydrophobicContact CB-CG2 3.52Å; F356-V385 HydrophobicContact CD2-CG2 4.39Å; F356-V385 HydrophobicContact CG-CG2 3.92Å
357L96.4Very high93.2Very high1 Ų154.7 Ų54.71%0.00528%0.284CS..Hα-helixtrans-58.1-56.7-179.1-76.1177.6000109.6F105 M109 W123 L124 L128 M131 K353 V354 R359 M360 W361F105-L357 HydrophobicContact CZ-CD2 4.29Å; M109-L357 HydrophobicContact CE-CD2 4.25Å; W123-L357 HydrophobicContact CE3-CB 4.35Å; W123-L357 HydrophobicContact CH2-CB 3.84Å; W123-L357 HydrophobicContact CH2-CD2 3.49Å; W123-L357 VanDerWaalsContact CH2-CD2 3.49Å; W123-L357 HydrophobicContact CH2-CG 4.27Å; W123-L357 WeakPolarHBondContact CH2-O 3.47Å; W123-L357 HydrophobicContact CZ2-CD2 4.28Å; W123-L357 HydrophobicContact CZ3-CB 3.37Å; W123-L357 HydrophobicContact CZ3-CD2 3.71Å; W123-L357 HydrophobicContact CZ3-CG 4.09Å; W123-L357 WeakPolarHBondContact CZ3-O 3.38Å; L124-L357 HydrophobicContact CD2-CB 3.54Å; L124-L357 HydrophobicContact CD2-CD1 4.3Å; L128-L357 HydrophobicContact CD2-CD1 4Å; L128-L357 HydrophobicContact CG-CD1 3.92Å; M131-L357 HydrophobicContact CE-CD2 4.31Å; M131-L357 HydrophobicContact CE-CG 4.33Å; K353-L357 WeakPolarHBondContact O-CB 3.23Å; K353-L357 VanDerWaalsContact O-CG 3.25Å; K353-L357 WeakPolarHBondContact O-CG 3.17Å; K353-L357 PolarHBondContact O-N 3.33Å; V354-L357 PolarHBondContact O-N 3.35Å; L357-R359 VanDerWaalsContact C-N 3.27Å; L357-R359 PolarHBondContact O-N 2.64Å; L357-M360 PolarHBondContact O-N 2.85Å; L357-W361 PolarHBondContact O-N 3.22Å
358E95.5Very high93.1Very high80 Ų8052.4 Ų52.437%0.37430%0.297SS..Hα-helixtrans-54-40.9-179.9-72.6179.9172.700113.3L124 V354 W361 N362L124-E358 HydrophobicContact CD1-CG 4.48Å; L124-E358 HydrophobicContact CD2-CG 4Å; V354-E358 HydrophobicContact CG1-CG 4.23Å; V354-E358 WeakPolarHBondContact O-CG 3.46Å; V354-E358 PolarHBondContact O-N 3.49Å; E358-W361 PolarHBondContact O-N 3.37Å; E358-N362 WeakPolarHBondContact O-CB 3.49Å; E358-N362 VanDerWaalsContact O-CG 3.25Å; E358-N362 PolarHBondContact O-N 3.46Å; E358-N362 PolarHBondContact O-ND2 2.8Å
359R95Very high93Very high91 Ų9151.4 Ų51.434%0.34329%0.288SS..Hα-helixtrans-63.2-41.5175.7-74.5-168.3-63.5-85.39111.9A355 F356 L357 N362 L363 E381A355-R359 VanDerWaalsContact CB-NH1 3.31Å; A355-R359 WeakPolarHBondContact O-CB 3.46Å; A355-R359 VanDerWaalsContact O-CG 3.29Å; A355-R359 WeakPolarHBondContact O-CG 3.46Å; A355-R359 PolarHBondContact O-N 2.98Å; A355-R359 VanDerWaalsContact O-N 3.13Å; A355-R359 PolarHBondContact O-NH1 2.87Å; F356-R359 PolarHBondContact O-N 3.43Å; L357-R359 VanDerWaalsContact C-N 3.27Å; L357-R359 PolarHBondContact O-N 2.64Å; R359-N362 PolarHBondContact O-N 2.82Å; R359-L363 WeakPolarHBondContact O-CB 3.2Å; R359-L363 PolarHBondContact O-N 3Å; R359-E381 IonicContact CZ-OE2 3.21Å; R359-E381 IonicContact NE-OE2 2.8Å; R359-E381 PolarHBondContact NE-OE2 3.38Å; R359-E381 IonicContact NH2-OE2 3.08Å; R359-E381 PolarHBondContact NH2-OE2 3.21Å
360M95.1Very high93.1Very high4 Ų454.9 Ų54.92%0.0231%0.31CS..Hα-helixtrans-72.1-33.5179.8-68.5-50.593.300112.9W123 F356 L357 L363 S364 W374 Q377 A378 E381W123-M360 HydrophobicContact CH2-CB 3.93Å; W123-M360 HydrophobicContact CZ2-CB 4.32Å; F356-M360 HydrophobicContact CD2-CG 4.07Å; F356-M360 HydrophobicContact CE1-CG 4.26Å; F356-M360 HydrophobicContact CE2-CG 3.59Å; F356-M360 HydrophobicContact CE2-SD 4.24Å; F356-M360 HydrophobicContact CZ-CG 3.7Å; F356-M360 WeakPolarHBondContact O-CG 3.44Å; F356-M360 PolarHBondContact O-N 3.23Å; L357-M360 PolarHBondContact O-N 2.85Å; M360-L363 HydrophobicContact CE-CD2 4.42Å; M360-S364 PolarHBondContact O-N 2.97Å; M360-S364 VanDerWaalsContact O-N 3.08Å; M360-W374 HydrophobicContact CB-CZ2 3.87Å; M360-W374 HydrophobicContact CG-CZ2 4.34Å; M360-W374 PolarHBondContact O-NE1 3.33Å; M360-Q377 HydrophobicContact CE-CG 4.3Å; M360-A378 HydrophobicContact CG-CB 4.32Å; M360-A378 WeakPolarHBondContact SD-CA 3.38Å; M360-A378 HydrophobicContact SD-CB 3.47Å; M360-A378 WeakPolarHBondContact SD-CB 3.37Å; M360-E381 HydrophobicContact CE-CB 4.11Å; M360-E381 HydrophobicContact CE-CG 3.74Å
361W93.6Very high93Very high31 Ų3155.7 Ų55.712%0.11731%0.307CS..Hα-helixtrans-62.5-52.7169.3175-95.6000111F118 L120 W123 L357 E358 L363 S364 Q365F118-W361 HydrophobicContact CD1-CZ3 4.32Å; F118-W361 VanDerWaalsContact O-CH2 3.27Å; F118-W361 WeakPolarHBondContact O-CH2 3.49Å; L120-W361 HydrophobicContact CD1-CB 3.9Å; L120-W361 HydrophobicContact CD1-CD2 4.18Å; L120-W361 HydrophobicContact CD1-CG 3.61Å; W123-W361 HydrophobicContact CB-CE3 3.85Å; W123-W361 HydrophobicContact CB-CZ3 3.92Å; W123-W361 AromaticContact CD1-CE3 3.59Å; W123-W361 AromaticContact CD1-CZ3 3.67Å; W123-W361 HydrophobicContact CD2-CB 4.34Å; W123-W361 AromaticContact CD2-CE3 3.71Å; W123-W361 HydrophobicContact CD2-CE3 3.71Å; W123-W361 HydrophobicContact CD2-CZ3 4.46Å; W123-W361 HydrophobicContact CE3-CB 3.95Å; W123-W361 HydrophobicContact CE3-CE3 4.29Å; W123-W361 HydrophobicContact CG-CD2 4.48Å; W123-W361 AromaticContact CG-CE3 3.44Å; W123-W361 HydrophobicContact CG-CE3 3.44Å; W123-W361 VanDerWaalsContact CG-CE3 3.44Å; W123-W361 AromaticContact CG-CZ3 3.75Å; W123-W361 HydrophobicContact CG-CZ3 3.75Å; W123-W361 HydrophobicContact CH2-CB 4.25Å; W123-W361 HydrophobicContact CZ3-CB 3.85Å; W123-W361 AromaticContact NE1-CE3 3.96Å; L357-W361 PolarHBondContact O-N 3.22Å; E358-W361 PolarHBondContact O-N 3.37Å; W361-L363 PolarHBondContact O-N 2.83Å; W361-S364 PolarHBondContact O-N 2.88Å; W361-S364 PolarHBondContact O-OG 3.36Å; W361-Q365 HydrophobicContact CD2-CG 4.41Å; W361-Q365 HydrophobicContact CZ2-CG 4.21Å; W361-Q365 WeakPolarHBondContact O-CG 3.41Å; W361-Q365 PolarHBondContact O-N 2.98Å; W361-Q365 VanDerWaalsContact O-N 3.16Å
362N93.2Very high92.8Very high97 Ų9757.5 Ų57.552%0.51932%0.315SS..Hα-helixtrans-59.2-37.3-179.3-70.8-26.4000112E358 R359 I366E358-N362 WeakPolarHBondContact O-CB 3.49Å; E358-N362 VanDerWaalsContact O-CG 3.25Å; E358-N362 PolarHBondContact O-N 3.46Å; E358-N362 PolarHBondContact O-ND2 2.8Å; R359-N362 PolarHBondContact O-N 2.82Å; N362-I366 WeakPolarHBondContact O-CG1 3.45Å
363L93.8Very high92.7Very high37 Ų3762.4 Ų62.419%0.19434%0.337CS..Hα-helixtrans-67.7-37.1175.7-174.162.5000112.8R359 M360 W361 Q365 I366 V369 W374 Q377R359-L363 WeakPolarHBondContact O-CB 3.2Å; R359-L363 PolarHBondContact O-N 3Å; M360-L363 HydrophobicContact CE-CD2 4.42Å; W361-L363 PolarHBondContact O-N 2.83Å; L363-Q365 VanDerWaalsContact C-N 3.29Å; L363-Q365 PolarHBondContact O-N 3.14Å; L363-I366 HydrophobicContact CD1-CD1 4.21Å; L363-I366 PolarHBondContact O-N 2.81Å; L363-V369 HydrophobicContact CD1-CG2 4.21Å; L363-V369 HydrophobicContact CG-CG1 4.45Å; L363-W374 HydrophobicContact CD2-CG 4.46Å; L363-Q377 HydrophobicContact CD2-CB 3.85Å; L363-Q377 HydrophobicContact CD2-CG 3.75Å
364S91.6Very high92.7Very high10 Ų1061.8 Ų61.87%0.0733%0.334CS..Hα-helixtrans-72.5-22.5179.569.90000113.4S113 M360 W361 I366S113-S364 WeakPolarHBondContact CB-OG 3.45Å; M360-S364 PolarHBondContact O-N 2.97Å; M360-S364 VanDerWaalsContact O-N 3.08Å; W361-S364 PolarHBondContact O-N 2.88Å; W361-S364 PolarHBondContact O-OG 3.36Å; S364-I366 VanDerWaalsContact C-N 3.33Å
365Q90.4Very high92.7Very high97 Ų9761.6 Ų61.645%0.45333%0.332SS..THydrogen-bonded Turntrans-81-8.8175.2-58.4-50.3-63.600113.5W361 L363 N367W361-Q365 HydrophobicContact CD2-CG 4.41Å; W361-Q365 HydrophobicContact CZ2-CG 4.21Å; W361-Q365 WeakPolarHBondContact O-CG 3.41Å; W361-Q365 PolarHBondContact O-N 2.98Å; W361-Q365 VanDerWaalsContact O-N 3.16Å; L363-Q365 VanDerWaalsContact C-N 3.29Å; L363-Q365 PolarHBondContact O-N 3.14Å; Q365-N367 PolarHBondContact O-N 3.48Å
366I91Very high92.6Very high98 Ų9863.9 Ų63.950%0.50334%0.343SS..SBendtrans-77.6122.6178.1-64172.1000109.7N362 L363 S364 G368 V369N362-I366 WeakPolarHBondContact O-CG1 3.45Å; L363-I366 HydrophobicContact CD1-CD1 4.21Å; L363-I366 PolarHBondContact O-N 2.81Å; S364-I366 VanDerWaalsContact C-N 3.33Å; I366-G368 PolarHBondContact O-N 3.18Å; I366-V369 HydrophobicContact CB-CG2 3.84Å; I366-V369 HydrophobicContact CG2-CG2 3.93Å; I366-V369 PolarHBondContact O-N 3.4Å
367N85.7Confident92.4Very high163 Ų16365.8 Ų65.887%0.87235%0.352SS*.THydrogen-bonded Turntrans-59.5127.4177.8-70.9-24.2000111.9Q365Q365-N367 PolarHBondContact O-N 3.48Å
368G88.4Confident92.3Very high79 Ų7965.8 Ų65.881%0.81435%0.351SS*.THydrogen-bonded Turntrans94.9-2.2175.500000115.6I366 T370I366-G368 PolarHBondContact O-N 3.18Å; G368-T370 PolarHBondContact O-N 2.98Å
369V90.6Very high92.2Very high33 Ų3363.5 Ų63.520%0.234%0.341CS..  trans-69125.6173176.40000109.9L363 I366 E373 W374L363-V369 HydrophobicContact CD1-CG2 4.21Å; L363-V369 HydrophobicContact CG-CG1 4.45Å; I366-V369 HydrophobicContact CB-CG2 3.84Å; I366-V369 HydrophobicContact CG2-CG2 3.93Å; I366-V369 PolarHBondContact O-N 3.4Å; V369-E373 HydrophobicContact CG1-CB 4.49Å; V369-W374 HydrophobicContact CG1-CB 3.94Å
370T91.9Very high91.9Very high77 Ų7766 Ų6647%0.47235%0.351SS..  trans-83155.9174660000110.6G368 E372 E373 W374G368-T370 PolarHBondContact O-N 2.98Å; T370-E372 PolarHBondContact O-N 3.42Å; T370-E373 PolarHBondContact O-N 2.81Å; T370-E373 PolarHBondContact OG1-N 3.29Å; T370-W374 PolarHBondContact O-N 3.21Å
371I90.3Very high91.8Very high66 Ų6667.7 Ų67.734%0.33836%0.359SS..Hα-helixtrans-57.7-31.6174.3-168.5171.2000112.4W110 N375W110-I371 HydrophobicContact CD2-CB 4.48Å; W110-I371 HydrophobicContact CD2-CG1 4.12Å; W110-I371 HydrophobicContact CG-CD1 3.99Å; W110-I371 HydrophobicContact CG-CG1 4.03Å; W110-I371 HydrophobicContact CZ2-CB 4.32Å; I371-N375 WeakPolarHBondContact O-CB 3.37Å; I371-N375 PolarHBondContact O-N 3.39Å; I371-N375 PolarHBondContact O-ND2 3.38Å
372E91.1Very high91.7Very high147 Ų14766.3 Ų66.369%0.68735%0.353SS*.Hα-helixtrans-70.4-43.8179-66.1176.8-17800112.1T370 N375 T376T370-E372 PolarHBondContact O-N 3.42Å; E372-N375 PolarHBondContact O-N 2.83Å; E372-T376 WeakPolarHBondContact O-CB 3.46Å; E372-T376 PolarHBondContact O-N 3.43Å; E372-T376 PolarHBondContact O-OG1 3.43Å
373E91.6Very high91.4Very high108 Ų10867.2 Ų67.251%0.50535%0.35SS..Hα-helixtrans-65.9-45.4175.8-175.458.2-147.600110.5V369 T370 N375 T376 Q377V369-E373 HydrophobicContact CG1-CB 4.49Å; T370-E373 PolarHBondContact O-N 2.81Å; T370-E373 PolarHBondContact OG1-N 3.29Å; E373-N375 PolarHBondContact O-N 2.95Å; E373-T376 PolarHBondContact O-N 3.47Å; E373-Q377 PolarHBondContact O-N 2.8Å
374W94.8Very high91.2Very high2 Ų270.7 Ų70.71%0.00836%0.363CS..Hα-helixtrans-59.7-47.4176-173.193.6000111.5L106 M109 W110 M360 L363 V369 T370 T376 Q377 A378L106-W374 HydrophobicContact CB-CH2 4.48Å; L106-W374 HydrophobicContact CB-CZ3 3.91Å; L106-W374 HydrophobicContact CD2-CH2 3.94Å; L106-W374 HydrophobicContact CD2-CZ3 3.94Å; L106-W374 HydrophobicContact CG-CZ3 4.44Å; L106-W374 WeakPolarHBondContact O-CZ3 3.28Å; M109-W374 HydrophobicContact CB-CH2 4.13Å; W110-W374 HydrophobicContact CB-CE3 4.35Å; W110-W374 HydrophobicContact CB-CH2 4.44Å; W110-W374 HydrophobicContact CB-CZ3 4.1Å; W110-W374 HydrophobicContact CE3-CB 4.02Å; W110-W374 AromaticContact CE3-CD1 3.99Å; W110-W374 AromaticContact CE3-CD2 3.7Å; W110-W374 HydrophobicContact CE3-CD2 3.7Å; W110-W374 HydrophobicContact CE3-CE3 4.09Å; W110-W374 AromaticContact CE3-CG 3.64Å; W110-W374 HydrophobicContact CE3-CG 3.64Å; W110-W374 HydrophobicContact CZ3-CB 3.79Å; W110-W374 AromaticContact CZ3-CD1 3.81Å; W110-W374 HydrophobicContact CZ3-CD2 4.23Å; W110-W374 AromaticContact CZ3-CG 3.67Å; W110-W374 HydrophobicContact CZ3-CG 3.67Å; M360-W374 HydrophobicContact CB-CZ2 3.87Å; M360-W374 HydrophobicContact CG-CZ2 4.34Å; M360-W374 PolarHBondContact O-NE1 3.33Å; L363-W374 HydrophobicContact CD2-CG 4.46Å; V369-W374 HydrophobicContact CG1-CB 3.94Å; T370-W374 PolarHBondContact O-N 3.21Å; W374-T376 VanDerWaalsContact C-N 3.33Å; W374-T376 PolarHBondContact O-N 3.04Å; W374-Q377 PolarHBondContact O-N 3.37Å; W374-A378 HydrophobicContact CD2-CB 4.44Å; W374-A378 HydrophobicContact CE3-CB 4.18Å; W374-A378 HydrophobicContact CH2-CB 4.33Å; W374-A378 HydrophobicContact CZ3-CB 4.12Å; W374-A378 WeakPolarHBondContact O-CB 3.17Å; W374-A378 PolarHBondContact O-N 3.39Å
375N94.7Very high91.2Very high41 Ų4170.3 Ų70.322%0.21936%0.361CS..Hα-helixtrans-61.8-40.2177.5-81.4-26.3000112.1I371 E372 E373 A378 M379I371-N375 WeakPolarHBondContact O-CB 3.37Å; I371-N375 PolarHBondContact O-N 3.39Å; I371-N375 PolarHBondContact O-ND2 3.38Å; E372-N375 PolarHBondContact O-N 2.83Å; E373-N375 PolarHBondContact O-N 2.95Å; N375-A378 PolarHBondContact O-N 3.41Å; N375-M379 WeakPolarHBondContact O-CB 3.44Å; N375-M379 VanDerWaalsContact O-CG 3.26Å; N375-M379 WeakPolarHBondContact O-CG 3.48Å; N375-M379 PolarHBondContact O-N 2.95Å
376T92.7Very high91.1Very high77 Ų7765.9 Ų65.947%0.47234%0.34SS..Hα-helixtrans-65.3-43.1179.8-580000111.1E372 E373 W374 R380E372-T376 WeakPolarHBondContact O-CB 3.46Å; E372-T376 PolarHBondContact O-N 3.43Å; E372-T376 PolarHBondContact O-OG1 3.43Å; E373-T376 PolarHBondContact O-N 3.47Å; W374-T376 VanDerWaalsContact C-N 3.33Å; W374-T376 PolarHBondContact O-N 3.04Å; T376-R380 PolarHBondContact O-N 3.43Å
377Q93.2Very high90.8Very high43 Ų4362.9 Ų62.920%0.20133%0.326CS..Hα-helixtrans-70.6-40.1176-175.359.916.700111.8M360 L363 E373 W374 R380 E381M360-Q377 HydrophobicContact CE-CG 4.3Å; L363-Q377 HydrophobicContact CD2-CB 3.85Å; L363-Q377 HydrophobicContact CD2-CG 3.75Å; E373-Q377 PolarHBondContact O-N 2.8Å; W374-Q377 PolarHBondContact O-N 3.37Å; Q377-R380 WeakPolarHBondContact O-CB 3.13Å; Q377-R380 PolarHBondContact O-N 2.96Å; Q377-R380 VanDerWaalsContact O-N 3.1Å; Q377-E381 HydrophobicContact CG-CG 4.45Å; Q377-E381 PolarHBondContact NE2-OE1 3.25Å; Q377-E381 WeakPolarHBondContact O-CG 3.37Å; Q377-E381 PolarHBondContact O-N 2.92Å
378A94.8Very high90.9Very high0 Ų055.8 Ų55.80%029%0.289CS..Hα-helixtrans-62.9-43.6176.700000111.7L106 M360 W374 N375 R380 E381 L382L106-A378 HydrophobicContact CD1-CB 4.02Å; L106-A378 HydrophobicContact CD2-CB 3.55Å; L106-A378 HydrophobicContact CG-CB 4.42Å; M360-A378 HydrophobicContact CG-CB 4.32Å; M360-A378 WeakPolarHBondContact SD-CA 3.38Å; M360-A378 HydrophobicContact SD-CB 3.47Å; M360-A378 WeakPolarHBondContact SD-CB 3.37Å; W374-A378 HydrophobicContact CD2-CB 4.44Å; W374-A378 HydrophobicContact CE3-CB 4.18Å; W374-A378 HydrophobicContact CH2-CB 4.33Å; W374-A378 HydrophobicContact CZ3-CB 4.12Å; W374-A378 WeakPolarHBondContact O-CB 3.17Å; W374-A378 PolarHBondContact O-N 3.39Å; N375-A378 PolarHBondContact O-N 3.41Å; A378-R380 PolarHBondContact O-N 3.22Å; A378-E381 PolarHBondContact O-N 2.77Å; A378-L382 WeakPolarHBondContact O-CB 3.5Å; A378-L382 PolarHBondContact O-N 3.29Å
379M91.9Very high90.9Very high32 Ų3252.1 Ų52.116%0.15825%0.251CS..Hα-helixtrans-62.4-29.3173.5-76.2-64.7-75.400112.8E99 K102 L106 N375 R383E99-M379 WeakPolarHBondContact OE1-CE 3.44Å; K102-M379 HydrophobicContact CB-SD 4.14Å; K102-M379 HydrophobicContact CD-CE 4.12Å; K102-M379 HydrophobicContact CD-SD 4.28Å; L106-M379 HydrophobicContact CD1-CG 3.68Å; L106-M379 HydrophobicContact CD1-SD 3.65Å; N375-M379 WeakPolarHBondContact O-CB 3.44Å; N375-M379 VanDerWaalsContact O-CG 3.26Å; N375-M379 WeakPolarHBondContact O-CG 3.48Å; N375-M379 PolarHBondContact O-N 2.95Å; M379-R383 WeakPolarHBondContact O-CG 3.3Å
380R90Very high90.5Very high143 Ų14350.8 Ų50.854%0.5424%0.242SC..Hα-helixtrans-74.8-45.3175.3-175.6-175.6-68142.3-3.4111.5T376 Q377 A378 R383T376-R380 PolarHBondContact O-N 3.43Å; Q377-R380 WeakPolarHBondContact O-CB 3.13Å; Q377-R380 PolarHBondContact O-N 2.96Å; Q377-R380 VanDerWaalsContact O-N 3.1Å; A378-R380 PolarHBondContact O-N 3.22Å; R380-R383 WeakPolarHBondContact O-CB 3.42Å; R380-R383 PolarHBondContact O-N 2.84Å
381E91.5Very high90Very high41 Ų4152.8 Ų52.819%0.19225%0.246CC..Hα-helixtrans-71.5-35.1-180-70.1-71.6154.100112.3F356 R359 M360 Q377 A378 R383 F384F356-E381 HydrophobicContact CD2-CB 3.67Å; F356-E381 HydrophobicContact CE2-CB 3.93Å; R359-E381 IonicContact CZ-OE2 3.21Å; R359-E381 IonicContact NE-OE2 2.8Å; R359-E381 PolarHBondContact NE-OE2 3.38Å; R359-E381 IonicContact NH2-OE2 3.08Å; R359-E381 PolarHBondContact NH2-OE2 3.21Å; M360-E381 HydrophobicContact CE-CB 4.11Å; M360-E381 HydrophobicContact CE-CG 3.74Å; Q377-E381 HydrophobicContact CG-CG 4.45Å; Q377-E381 PolarHBondContact NE2-OE1 3.25Å; Q377-E381 WeakPolarHBondContact O-CG 3.37Å; Q377-E381 PolarHBondContact O-N 2.92Å; A378-E381 PolarHBondContact O-N 2.77Å; E381-R383 PolarHBondContact O-N 3.34Å; E381-F384 VanDerWaalsContact O-CB 3.31Å; E381-F384 WeakPolarHBondContact O-CB 3.49Å; E381-F384 PolarHBondContact O-N 3.29Å
382L92.3Very high89.7Confident1 Ų149.9 Ų49.91%0.00523%0.232CC..Hα-helixtrans-62-30.1176.7-171.163.5000111.8K102 L134 F356 A378 F384 V385 E386K102-L382 HydrophobicContact CB-CD2 4.32Å; K102-L382 HydrophobicContact CD-CD2 4.08Å; K102-L382 HydrophobicContact CG-CD2 3.87Å; L134-L382 HydrophobicContact CD2-CD1 3.92Å; L134-L382 HydrophobicContact CD2-CD2 3.94Å; L134-L382 HydrophobicContact CD2-CG 4.28Å; F356-L382 HydrophobicContact CE1-CD1 4.2Å; F356-L382 HydrophobicContact CE2-CB 3.92Å; F356-L382 HydrophobicContact CE2-CD1 4.28Å; F356-L382 HydrophobicContact CZ-CB 4.28Å; F356-L382 HydrophobicContact CZ-CD1 4.02Å; A378-L382 WeakPolarHBondContact O-CB 3.5Å; A378-L382 PolarHBondContact O-N 3.29Å; L382-F384 PolarHBondContact O-N 3.14Å; L382-V385 HydrophobicContact CD1-CB 4.45Å; L382-V385 WeakPolarHBondContact O-CB 3.22Å; L382-V385 PolarHBondContact O-N 2.89Å; L382-V385 VanDerWaalsContact O-N 3.11Å; L382-E386 WeakPolarHBondContact O-CG 3.03Å; L382-E386 PolarHBondContact O-N 2.79Å
383R87.5Confident89.2Confident116 Ų11643 Ų4344%0.43820%0.2SC..Hα-helixtrans-60.1-31.5173.1-69.7173.5-169.8-176.94.1113M379 R380 E381 T387M379-R383 WeakPolarHBondContact O-CG 3.3Å; R380-R383 WeakPolarHBondContact O-CB 3.42Å; R380-R383 PolarHBondContact O-N 2.84Å; E381-R383 PolarHBondContact O-N 3.34Å; R383-T387 WeakPolarHBondContact O-CB 3.45Å; R383-T387 PolarHBondContact O-N 2.92Å; R383-T387 PolarHBondContact O-OG1 2.97Å
384F89.3Confident88.4Confident110 Ų11043.3 Ų43.348%0.48220%0.201SC..Hα-helixtrans-66.9-44.5175.5178.3-101.6000110.5A352 E381 L382 E386 T387 V388A352-F384 HydrophobicContact CB-CD1 4.43Å; A352-F384 HydrophobicContact CB-CE1 4.04Å; E381-F384 VanDerWaalsContact O-CB 3.31Å; E381-F384 WeakPolarHBondContact O-CB 3.49Å; E381-F384 PolarHBondContact O-N 3.29Å; L382-F384 PolarHBondContact O-N 3.14Å; F384-E386 VanDerWaalsContact C-N 3.35Å; F384-E386 PolarHBondContact O-N 3.25Å; F384-T387 WeakPolarHBondContact O-CB 3.44Å; F384-T387 PolarHBondContact O-N 2.86Å; F384-V388 HydrophobicContact CD1-CG2 4.48Å; F384-V388 HydrophobicContact CE1-CG2 4.06Å; F384-V388 HydrophobicContact CE2-CG2 4.38Å; F384-V388 HydrophobicContact CZ-CG2 4Å; F384-V388 WeakPolarHBondContact O-CG2 3.48Å; F384-V388 PolarHBondContact O-N 3.08Å
385V91Very high87.3Confident3 Ų346.7 Ų46.72%0.01822%0.217CC..Hα-helixtrans-61.5-44.2174.8-176.80000110.9M131 K353 F356 L382 T387 V388 L389M131-V385 HydrophobicContact SD-CG1 4.18Å; K353-V385 HydrophobicContact CG-CG1 4.03Å; F356-V385 HydrophobicContact CB-CG2 3.52Å; F356-V385 HydrophobicContact CD2-CG2 4.39Å; F356-V385 HydrophobicContact CG-CG2 3.92Å; L382-V385 HydrophobicContact CD1-CB 4.45Å; L382-V385 WeakPolarHBondContact O-CB 3.22Å; L382-V385 PolarHBondContact O-N 2.89Å; L382-V385 VanDerWaalsContact O-N 3.11Å; V385-T387 VanDerWaalsContact C-N 3.31Å; V385-T387 PolarHBondContact O-N 3.07Å; V385-V388 PolarHBondContact O-N 3.21Å; V385-L389 HydrophobicContact CG1-CD1 4.04Å; V385-L389 HydrophobicContact CG1-CG 4.47Å; V385-L389 WeakPolarHBondContact O-CB 3.24Å; V385-L389 WeakPolarHBondContact O-CG 3.24Å; V385-L389 PolarHBondContact O-N 3.23Å
386E88Confident86.1Confident3 Ų347.7 Ų47.71%0.01422%0.22CC..Hα-helixtrans-57.5-44.2174.4-71.5164.5-149.200111.6K102 L138 V152 L382 F384 L389 Y390K102-E386 WeakPolarHBondContact CE-OE1 3.33Å; K102-E386 IonicContact NZ-OE1 2.71Å; K102-E386 PolarHBondContact NZ-OE1 2.87Å; K102-E386 IonicContact NZ-OE2 2.78Å; K102-E386 PolarHBondContact NZ-OE2 2.9Å; L138-E386 HydrophobicContact CD1-CG 3.98Å; L138-E386 HydrophobicContact CD2-CG 4.31Å; V152-E386 WeakPolarHBondContact CG1-OE2 3.18Å; L382-E386 WeakPolarHBondContact O-CG 3.03Å; L382-E386 PolarHBondContact O-N 2.79Å; F384-E386 VanDerWaalsContact C-N 3.35Å; F384-E386 PolarHBondContact O-N 3.25Å; E386-L389 PolarHBondContact O-N 3.47Å; E386-Y390 HydrophobicContact CB-CD2 4.34Å; E386-Y390 HydrophobicContact CB-CE2 4.32Å; E386-Y390 WeakPolarHBondContact O-CB 3.24Å; E386-Y390 WeakPolarHBondContact O-CD2 3.37Å; E386-Y390 PolarHBondContact O-N 3.02Å
387T86.2Confident85.1Confident36 Ų3644.3 Ų44.322%0.22120%0.199CC..Hα-helixtrans-61.4-47.8178.8-54.90000111R383 F384 V385 L389 Y390 E391R383-T387 WeakPolarHBondContact O-CB 3.45Å; R383-T387 PolarHBondContact O-N 2.92Å; R383-T387 PolarHBondContact O-OG1 2.97Å; F384-T387 WeakPolarHBondContact O-CB 3.44Å; F384-T387 PolarHBondContact O-N 2.86Å; V385-T387 VanDerWaalsContact C-N 3.31Å; V385-T387 PolarHBondContact O-N 3.07Å; T387-L389 VanDerWaalsContact C-N 3.34Å; T387-L389 PolarHBondContact O-N 2.88Å; T387-Y390 PolarHBondContact O-N 3.36Å; T387-E391 WeakPolarHBondContact O-CG 3.44Å; T387-E391 PolarHBondContact O-N 3.35Å
388V88.2Confident84.1Confident13 Ų1342.5 Ų42.58%0.07919%0.191CC..Hα-helixtrans-62.3-40.9177.7174.40000111.5I349 A352 F384 V385 A392I349-V388 HydrophobicContact CG1-CG1 4.08Å; A352-V388 HydrophobicContact CB-CB 4.29Å; A352-V388 HydrophobicContact CB-CG1 4.19Å; A352-V388 HydrophobicContact CB-CG2 4.16Å; F384-V388 HydrophobicContact CD1-CG2 4.48Å; F384-V388 HydrophobicContact CE1-CG2 4.06Å; F384-V388 HydrophobicContact CE2-CG2 4.38Å; F384-V388 HydrophobicContact CZ-CG2 4Å; F384-V388 WeakPolarHBondContact O-CG2 3.48Å; F384-V388 PolarHBondContact O-N 3.08Å; V385-V388 PolarHBondContact O-N 3.21Å; V388-A392 WeakPolarHBondContact O-CB 3.44Å; V388-A392 PolarHBondContact O-N 3.29Å
389L87.7Confident83.2Confident3 Ų344.4 Ų44.42%0.01620%0.202CC..Hα-helixtrans-63.4-44.7174.8-76.6169000111.5E135 L138 I349 V385 E386 T387 A392 Y393 I403E135-L389 HydrophobicContact CG-CD1 4.2Å; L138-L389 HydrophobicContact CD1-CD1 3.82Å; I349-L389 HydrophobicContact CD1-CD2 4.12Å; I349-L389 HydrophobicContact CG1-CD2 4.12Å; I349-L389 HydrophobicContact CG2-CD2 3.78Å; V385-L389 HydrophobicContact CG1-CD1 4.04Å; V385-L389 HydrophobicContact CG1-CG 4.47Å; V385-L389 WeakPolarHBondContact O-CB 3.24Å; V385-L389 WeakPolarHBondContact O-CG 3.24Å; V385-L389 PolarHBondContact O-N 3.23Å; E386-L389 PolarHBondContact O-N 3.47Å; T387-L389 VanDerWaalsContact C-N 3.34Å; T387-L389 PolarHBondContact O-N 2.88Å; L389-A392 PolarHBondContact O-N 3.15Å; L389-Y393 HydrophobicContact CB-CD2 4.5Å; L389-Y393 HydrophobicContact CB-CE2 4.03Å; L389-Y393 HydrophobicContact CD2-CE2 4.47Å; L389-Y393 WeakPolarHBondContact O-CD2 3.45Å; L389-Y393 PolarHBondContact O-N 2.94Å; L389-I403 HydrophobicContact CD2-CD1 3.98Å
390Y80.8Confident82.3Confident4 Ų443.8 Ų43.82%0.01620%0.199CC..Hα-helixtrans-62.8-46.3178.1-83.5-60.2000112.4L138 Y142 A149 V152 E386 T387 A392 Y393 E394L138-Y390 HydrophobicContact CD2-CE2 3.86Å; L138-Y390 WeakPolarHBondContact CD2-OH 3.36Å; Y142-Y390 AromaticContact CD2-CD1 3.99Å; Y142-Y390 HydrophobicContact CD2-CD1 3.99Å; Y142-Y390 HydrophobicContact CD2-CE1 4.32Å; Y142-Y390 HydrophobicContact CG-CD1 4.49Å; A149-Y390 HydrophobicContact CB-CD2 4.4Å; A149-Y390 HydrophobicContact CB-CG 4.1Å; V152-Y390 HydrophobicContact CB-CE2 4.18Å; V152-Y390 HydrophobicContact CG1-CE2 4.4Å; V152-Y390 HydrophobicContact CG2-CE2 3.88Å; V152-Y390 VanDerWaalsContact CG2-OH 3.25Å; V152-Y390 WeakPolarHBondContact CG2-OH 3.26Å; E386-Y390 HydrophobicContact CB-CD2 4.34Å; E386-Y390 HydrophobicContact CB-CE2 4.32Å; E386-Y390 WeakPolarHBondContact O-CB 3.24Å; E386-Y390 WeakPolarHBondContact O-CD2 3.37Å; E386-Y390 PolarHBondContact O-N 3.02Å; T387-Y390 PolarHBondContact O-N 3.36Å; Y390-A392 VanDerWaalsContact C-N 3.27Å; Y390-A392 PolarHBondContact O-N 3.45Å; Y390-Y393 PolarHBondContact O-N 2.99Å; Y390-E394 WeakPolarHBondContact O-CB 3.46Å; Y390-E394 PolarHBondContact O-N 2.76Å
391E82.6Confident81.7Confident120 Ų12040.7 Ų40.756%0.56119%0.193SC*.Hα-helixtrans-58.9-40.9175.2-73.1176.3-179.100111.1T387 E394 E395T387-E391 WeakPolarHBondContact O-CG 3.44Å; T387-E391 PolarHBondContact O-N 3.35Å; E391-E394 PolarHBondContact O-N 3.49Å; E391-E395 PolarHBondContact O-N 3.33Å
392A83.4Confident80.9Confident5 Ų539 Ų394%0.04119%0.186CC..Hα-helixtrans-67.6-37.9176.900000113.3I349 V388 L389 Y390 E394 I398I349-A392 HydrophobicContact CD1-CB 3.63Å; I349-A392 HydrophobicContact CG1-CB 4.16Å; V388-A392 WeakPolarHBondContact O-CB 3.44Å; V388-A392 PolarHBondContact O-N 3.29Å; L389-A392 PolarHBondContact O-N 3.15Å; Y390-A392 VanDerWaalsContact C-N 3.27Å; Y390-A392 PolarHBondContact O-N 3.45Å; A392-E394 VanDerWaalsContact C-N 3.34Å; A392-I398 HydrophobicContact CB-CD1 4.19Å
393Y81.1Confident80.1Confident3 Ų340 Ų401%0.01219%0.191CC..Hα-helixtrans-71.8-28.2174.5-61-39.1000112.5L138 Y139 Y142 L389 Y390 E395 Q396 I398 I403L138-Y393 HydrophobicContact CB-CE2 4.45Å; Y139-Y393 AromaticContact CD2-CD1 3.71Å; Y139-Y393 HydrophobicContact CD2-CD1 3.71Å; Y139-Y393 AromaticContact CD2-CE1 3.59Å; Y139-Y393 HydrophobicContact CD2-CE1 3.59Å; Y139-Y393 HydrophobicContact CD2-CG 4.23Å; Y139-Y393 HydrophobicContact CE2-CD1 4.36Å; Y139-Y393 HydrophobicContact CE2-CE1 4.44Å; Y139-Y393 HydrophobicContact CG-CE1 4.41Å; Y142-Y393 VanDerWaalsContact CD1-CB 3.5Å; Y142-Y393 HydrophobicContact CD1-CG 4.38Å; Y142-Y393 WeakPolarHBondContact CE1-O 3.3Å; L389-Y393 HydrophobicContact CB-CD2 4.5Å; L389-Y393 HydrophobicContact CB-CE2 4.03Å; L389-Y393 HydrophobicContact CD2-CE2 4.47Å; L389-Y393 WeakPolarHBondContact O-CD2 3.45Å; L389-Y393 PolarHBondContact O-N 2.94Å; Y390-Y393 PolarHBondContact O-N 2.99Å; Y393-E395 VanDerWaalsContact C-N 3.28Å; Y393-E395 PolarHBondContact O-N 3.4Å; Y393-Q396 PolarHBondContact O-N 3.39Å; Y393-I398 HydrophobicContact CE1-CG2 4.41Å; Y393-I403 HydrophobicContact CE1-CD1 3.48Å; Y393-I403 VanDerWaalsContact CE1-CD1 3.48Å; Y393-I403 WeakPolarHBondContact OH-CD1 3.4Å
394E74.6Confident79.5Confident114 Ų11435.7 Ų35.753%0.53318%0.177SC..Hα-helixtrans-62.5-34.1176.1-167.7174.3176.400113.5Y142 Y390 E391 A392 Q396 R436Y142-E394 VanDerWaalsContact OH-CA 3.28Å; Y142-E394 WeakPolarHBondContact OH-CA 3.41Å; Y390-E394 WeakPolarHBondContact O-CB 3.46Å; Y390-E394 PolarHBondContact O-N 2.76Å; E391-E394 PolarHBondContact O-N 3.49Å; A392-E394 VanDerWaalsContact C-N 3.34Å; E394-Q396 PolarHBondContact O-N 3.06Å; E394-R436 PolarHBondContact O-NH2 2.88Å
395E71.3Confident78.6Confident73 Ų7337.4 Ų37.434%0.34119%0.19SC..THydrogen-bonded Turntrans-72.8-11.3174.6-64.6-65178.400113.3E391 Y393 Y397 R436E391-E395 PolarHBondContact O-N 3.33Å; Y393-E395 VanDerWaalsContact C-N 3.28Å; Y393-E395 PolarHBondContact O-N 3.4Å; E395-Y397 HydrophobicContact CB-CD2 3.98Å; E395-Y397 WeakPolarHBondContact O-CD2 3.3Å; E395-Y397 PolarHBondContact O-N 2.7Å; E395-R436 IonicContact OE2-CZ 3.73Å; E395-R436 IonicContact OE2-NH1 2.81Å; E395-R436 PolarHBondContact OE2-NH1 3.49Å
396Q69.9Low77.4Confident62 Ų6243.9 Ų43.929%0.2922%0.218SC..SBendtrans58.56.1178.6-63.4178.1-39.700116.3Y393 E394 I398Y393-Q396 PolarHBondContact O-N 3.39Å; E394-Q396 PolarHBondContact O-N 3.06Å; Q396-I398 VanDerWaalsContact C-N 3.35Å
397Y71.6Confident76.5Confident6 Ų646 Ų462%0.02423%0.232CC..  trans-84.7-6.8176.5-62.7-53.1000114.2E338 V341 E395 I411 R436E338-Y397 HydrophobicContact CB-CD1 3.88Å; E338-Y397 HydrophobicContact CB-CE1 3.7Å; E338-Y397 HydrophobicContact CG-CD1 3.48Å; E338-Y397 VanDerWaalsContact CG-CD1 3.48Å; E338-Y397 HydrophobicContact CG-CE1 3.84Å; E338-Y397 HydrophobicContact CG-CG 4.1Å; V341-Y397 HydrophobicContact CB-CD2 4.03Å; V341-Y397 HydrophobicContact CB-CE2 4.21Å; V341-Y397 HydrophobicContact CG1-CD2 3.74Å; V341-Y397 HydrophobicContact CG1-CE2 4.12Å; E395-Y397 HydrophobicContact CB-CD2 3.98Å; E395-Y397 WeakPolarHBondContact O-CD2 3.3Å; E395-Y397 PolarHBondContact O-N 2.7Å; Y397-I411 HydrophobicContact CD1-CD1 3.64Å; Y397-I411 HydrophobicContact CD1-CG1 4.03Å; Y397-I411 HydrophobicContact CE1-CD1 3.7Å; Y397-I411 HydrophobicContact CE1-CG1 4.21Å; Y397-R436 HydrophobicContact CE2-CG 4.4Å; Y397-R436 VanDerWaalsContact OH-CG 3.27Å; Y397-R436 WeakPolarHBondContact OH-CG 3.47Å
398I73.4Confident75.6Confident5 Ų552 Ų523%0.02626%0.257CS..  trans-124.7121.2-174.7-67.3174.8000109.8R342 L346 I349 A392 Y393 Q396 D402 I403R342-I398 HydrophobicContact CG-CG1 4.14Å; L346-I398 HydrophobicContact CD2-CD1 4.16Å; L346-I398 HydrophobicContact CD2-CG2 4.34Å; L346-I398 HydrophobicContact CG-CD1 4.08Å; I349-I398 HydrophobicContact CD1-CD1 4.2Å; A392-I398 HydrophobicContact CB-CD1 4.19Å; Y393-I398 HydrophobicContact CE1-CG2 4.41Å; Q396-I398 VanDerWaalsContact C-N 3.35Å; I398-D402 HydrophobicContact CG2-CB 4.39Å; I398-I403 HydrophobicContact CG2-CD1 3.83Å; I398-I403 HydrophobicContact CG2-CG1 3.56Å
399T74.4Confident75Confident39 Ų3958.6 Ų58.624%0.23928%0.281CS..  trans-96.3164168.370.20000110.9N401 D402 I403T399-N401 PolarHBondContact O-N 2.98Å; T399-N401 PolarHBondContact OG1-N 3.16Å; T399-D402 WeakPolarHBondContact CB-OD2 3.36Å; T399-D402 PolarHBondContact N-OD2 2.83Å; T399-D402 WeakPolarHBondContact O-CB 3.41Å; T399-D402 PolarHBondContact O-N 2.77Å; T399-D402 VanDerWaalsContact O-N 3.08Å; T399-D402 PolarHBondContact OG1-N 2.98Å; T399-D402 PolarHBondContact OG1-OD2 3.45Å; T399-I403 PolarHBondContact O-N 3.16Å
400I73.2Confident74.8Confident20 Ų2059.9 Ų59.910%0.10329%0.289CS..Hα-helixtrans-52.5-40.1169-60.8162.5000110.2I136 Y139 D402 I403 L404I136-I400 HydrophobicContact CB-CD1 4.25Å; I136-I400 HydrophobicContact CG1-CD1 4.2Å; I136-I400 HydrophobicContact CG1-CG2 3.86Å; I136-I400 HydrophobicContact CG2-CD1 4.19Å; Y139-I400 HydrophobicContact CD1-CD1 3.1Å; Y139-I400 HydrophobicContact CD1-CG1 3.36Å; Y139-I400 HydrophobicContact CD2-CD1 4.48Å; Y139-I400 HydrophobicContact CD2-CG1 3.82Å; Y139-I400 HydrophobicContact CE1-CD1 3.77Å; Y139-I400 HydrophobicContact CE1-CG1 3.96Å; Y139-I400 HydrophobicContact CE2-CG1 4.38Å; Y139-I400 HydrophobicContact CG-CD1 3.51Å; Y139-I400 HydrophobicContact CG-CG1 3.23Å; I400-D402 PolarHBondContact O-N 3.08Å; I400-I403 PolarHBondContact O-N 2.96Å; I400-I403 VanDerWaalsContact O-N 3.09Å; I400-L404 HydrophobicContact CG2-CD1 3.56Å; I400-L404 HydrophobicContact CG2-CG 3.83Å; I400-L404 WeakPolarHBondContact O-CB 3.43Å; I400-L404 WeakPolarHBondContact O-CG 3.49Å; I400-L404 PolarHBondContact O-N 2.83Å
401N76.9Confident75Confident77 Ų7761.8 Ų61.841%0.41230%0.299SS..Hα-helixtrans-65.5-29-176.9-65.4-40.5000112.6T399 N405 K406 T407T399-N401 PolarHBondContact O-N 2.98Å; T399-N401 PolarHBondContact OG1-N 3.16Å; N401-N405 PolarHBondContact O-N 3.26Å; N401-K406 HydrophobicContact CB-CB 4.4Å; N401-K406 PolarHBondContact O-N 3.29Å; N401-T407 VanDerWaalsContact CB-OG1 3.28Å; N401-T407 WeakPolarHBondContact CB-OG1 3.37Å; N401-T407 PolarHBondContact O-N 3.19Å
402D76.3Confident75.3Confident5 Ų556 Ų563%0.02727%0.272CS..Hα-helixtrans-70.3-42.9172.1-60.5-70.3000110.7R342 I398 T399 I400 L404 N405R342-D402 IonicContact NH1-OD1 2.63Å; I398-D402 HydrophobicContact CG2-CB 4.39Å; T399-D402 WeakPolarHBondContact CB-OD2 3.36Å; T399-D402 PolarHBondContact N-OD2 2.83Å; T399-D402 WeakPolarHBondContact O-CB 3.41Å; T399-D402 PolarHBondContact O-N 2.77Å; T399-D402 VanDerWaalsContact O-N 3.08Å; T399-D402 PolarHBondContact OG1-N 2.98Å; T399-D402 PolarHBondContact OG1-OD2 3.45Å; I400-D402 PolarHBondContact O-N 3.08Å; D402-L404 VanDerWaalsContact C-N 3.31Å; D402-L404 PolarHBondContact O-N 2.94Å; D402-N405 PolarHBondContact O-N 2.89Å; D402-N405 VanDerWaalsContact O-N 3.07Å; D402-N405 PolarHBondContact O-OD1 2.89Å
403I74.8Confident75.7Confident22 Ų2256.6 Ų56.611%0.11328%0.275CS..Hα-helixtrans-64.2-37.9177.1-62173.8000111.3E135 L346 I349 K353 L389 Y393 I398 T399 I400 N405E135-I403 WeakPolarHBondContact OE2-CG2 3.27Å; L346-I403 HydrophobicContact CD2-CG1 4.36Å; I349-I403 HydrophobicContact CD1-CD1 4.21Å; I349-I403 HydrophobicContact CD1-CG1 4.4Å; K353-I403 VanDerWaalsContact NZ-CG2 3.28Å; L389-I403 HydrophobicContact CD2-CD1 3.98Å; Y393-I403 HydrophobicContact CE1-CD1 3.48Å; Y393-I403 VanDerWaalsContact CE1-CD1 3.48Å; Y393-I403 WeakPolarHBondContact OH-CD1 3.4Å; I398-I403 HydrophobicContact CG2-CD1 3.83Å; I398-I403 HydrophobicContact CG2-CG1 3.56Å; T399-I403 PolarHBondContact O-N 3.16Å; I400-I403 PolarHBondContact O-N 2.96Å; I400-I403 VanDerWaalsContact O-N 3.09Å; I403-N405 PolarHBondContact O-N 3.44Å
404L75.4Confident76.2Confident27 Ų2760.7 Ų60.714%0.14129%0.293CS..THydrogen-bonded Turntrans-78.54.4176.4-62.4-179000113.1Q132 I400 D402 K406Q132-L404 HydrophobicContact CB-CD2 4.07Å; Q132-L404 VanDerWaalsContact CD-CD2 3.49Å; Q132-L404 HydrophobicContact CG-CD2 3.55Å; I400-L404 HydrophobicContact CG2-CD1 3.56Å; I400-L404 HydrophobicContact CG2-CG 3.83Å; I400-L404 WeakPolarHBondContact O-CB 3.43Å; I400-L404 WeakPolarHBondContact O-CG 3.49Å; I400-L404 PolarHBondContact O-N 2.83Å; D402-L404 VanDerWaalsContact C-N 3.31Å; D402-L404 PolarHBondContact O-N 2.94Å; L404-K406 HydrophobicContact CB-CD 3.95Å; L404-K406 HydrophobicContact CB-CG 3.86Å; L404-K406 HydrophobicContact CD1-CD 4.08Å; L404-K406 PolarHBondContact O-N 2.91Å; L404-K406 VanDerWaalsContact O-N 3.08Å
405N70.8Confident77.1Confident145 Ų14556.4 Ų56.478%0.77528%0.275SS*.THydrogen-bonded Turntrans52.127.1-174.9-76.2-25.1000114N401 D402 I403N401-N405 PolarHBondContact O-N 3.26Å; D402-N405 PolarHBondContact O-N 2.89Å; D402-N405 VanDerWaalsContact O-N 3.07Å; D402-N405 PolarHBondContact O-OD1 2.89Å; I403-N405 PolarHBondContact O-N 3.44Å
406K65.4Low78.1Confident139 Ų13954.5 Ų54.560%0.60427%0.266SS*.SBendtrans-85-37.4-176.4-71.9-179.2-180176.40112.2N401 L404N401-K406 HydrophobicContact CB-CB 4.4Å; N401-K406 PolarHBondContact O-N 3.29Å; L404-K406 HydrophobicContact CB-CD 3.95Å; L404-K406 HydrophobicContact CB-CG 3.86Å; L404-K406 HydrophobicContact CD1-CD 4.08Å; L404-K406 PolarHBondContact O-N 2.91Å; L404-K406 VanDerWaalsContact O-N 3.08Å
407T68.4Low79.3Confident49 Ų4951.6 Ų51.630%0.30125%0.253SS..  trans-149.3142.6-179.959.10000110.3N401N401-T407 VanDerWaalsContact CB-OG1 3.28Å; N401-T407 WeakPolarHBondContact CB-OG1 3.37Å; N401-T407 PolarHBondContact O-N 3.19Å
408Q67.9Low80.4Confident160 Ų16051.6 Ų51.675%0.74825%0.253SS*.  trans-105.588.6167.5-66.3-174.8-7.300108.2
409R74.7Confident81.3Confident152 Ų15251.8 Ų51.857%0.57425%0.254SS*.  trans-105.7115.1176.1-70.1-171.7-176.2-161.10.6108.6
410T83Confident82.3Confident31 Ų3150.4 Ų50.419%0.1924%0.244CC..  trans-81.5142.817155.60000110.1L335 E338 T413L335-T410 HydrophobicContact CD1-CG2 3.94Å; E338-T410 WeakPolarHBondContact OE1-CA 3.4Å; E338-T410 WeakPolarHBondContact OE1-CB 3.43Å; T410-T413 WeakPolarHBondContact O-CG2 3.42Å
411I85Confident83.4Confident43 Ų4349.5 Ų49.522%0.22124%0.24CC..SBendtrans-78.5-31.8175.462.9170.7000111.6E338 Y397 T413 Q416 M433E338-I411 WeakPolarHBondContact OE1-CG1 3.36Å; E338-I411 PolarHBondContact OE1-N 3.41Å; E338-I411 WeakPolarHBondContact OE2-CG1 3.36Å; E338-I411 PolarHBondContact OE2-N 2.93Å; Y397-I411 HydrophobicContact CD1-CD1 3.64Å; Y397-I411 HydrophobicContact CD1-CG1 4.03Å; Y397-I411 HydrophobicContact CE1-CD1 3.7Å; Y397-I411 HydrophobicContact CE1-CG1 4.21Å; I411-T413 PolarHBondContact O-N 3.22Å; I411-Q416 PolarHBondContact O-OE1 2.92Å; I411-M433 VanDerWaalsContact O-CE 3.26Å; I411-M433 WeakPolarHBondContact O-CE 3.19Å
412W90.4Very high84.2Confident0 Ų046 Ų460%022%0.221CC..  trans-84.152.5177.9-71.696.8000112.6F330 H331 E334 L335 E338 A417 F420 M433F330-W412 HydrophobicContact CB-CE3 4.31Å; F330-W412 HydrophobicContact CB-CZ3 3.73Å; F330-W412 HydrophobicContact CG-CZ3 4.4Å; H331-W412 PolarHBondContact CE1-O 3.48Å; H331-W412 VanDerWaalsContact CE1-O 3.3Å; H331-W412 PolarHBondContact ND1-O 3.44Å; E334-W412 HydrophobicContact CB-CD2 3.42Å; E334-W412 VanDerWaalsContact CB-CD2 3.42Å; E334-W412 VanDerWaalsContact CB-CE2 3.48Å; E334-W412 HydrophobicContact CB-CE3 3.93Å; E334-W412 HydrophobicContact CB-CG 3.66Å; E334-W412 HydrophobicContact CB-CZ2 4.07Å; E334-W412 HydrophobicContact CB-CZ3 4.48Å; E334-W412 HydrophobicContact CG-CD2 4.14Å; E334-W412 HydrophobicContact CG-CE3 4.38Å; E334-W412 HydrophobicContact CG-CH2 4.22Å; E334-W412 HydrophobicContact CG-CZ2 3.92Å; E334-W412 HydrophobicContact CG-CZ3 4.44Å; L335-W412 HydrophobicContact CB-CB 4.17Å; L335-W412 HydrophobicContact CD1-CB 4.33Å; E338-W412 WeakPolarHBondContact OE2-CB 3.5Å; E338-W412 PolarHBondContact OE2-N 3.14Å; W412-A417 HydrophobicContact CE3-CB 4.11Å; W412-A417 HydrophobicContact CZ3-CB 4.38Å; W412-F420 AromaticContact CH2-CD1 3.66Å; W412-F420 HydrophobicContact CH2-CD1 3.66Å; W412-F420 HydrophobicContact CH2-CD2 4.22Å; W412-F420 AromaticContact CH2-CE1 3.87Å; W412-F420 HydrophobicContact CH2-CE1 3.87Å; W412-F420 HydrophobicContact CH2-CE2 4.4Å; W412-F420 AromaticContact CH2-CG 3.87Å; W412-F420 HydrophobicContact CH2-CG 3.87Å; W412-F420 HydrophobicContact CH2-CZ 4.25Å; W412-F420 HydrophobicContact CZ3-CB 4.42Å; W412-F420 AromaticContact CZ3-CD1 3.74Å; W412-F420 HydrophobicContact CZ3-CD1 3.74Å; W412-F420 HydrophobicContact CZ3-CE1 4.28Å; W412-F420 HydrophobicContact CZ3-CG 4.07Å; W412-M433 HydrophobicContact CB-CE 4.37Å; W412-M433 HydrophobicContact CD2-CE 3.35Å; W412-M433 HydrophobicContact CD2-CG 4.49Å; W412-M433 HydrophobicContact CE3-CE 3.1Å; W412-M433 HydrophobicContact CG-CE 3.95Å; W412-M433 HydrophobicContact CH2-CE 3.93Å; W412-M433 HydrophobicContact CH2-CG 3.86Å; W412-M433 HydrophobicContact CZ2-CE 4.16Å; W412-M433 HydrophobicContact CZ2-CG 3.73Å; W412-M433 HydrophobicContact CZ3-CE 3.4Å; W412-M433 HydrophobicContact CZ3-CG 4.3Å
413T91.1Very high85.1Confident17 Ų1746.1 Ų46.110%0.10422%0.222CC..  trans-72.7156.1168.362.70000111.6T410 I411 Q416 A417T410-T413 WeakPolarHBondContact O-CG2 3.42Å; I411-T413 PolarHBondContact O-N 3.22Å; T413-Q416 PolarHBondContact O-N 3.31Å; T413-Q416 WeakPolarHBondContact OG1-CB 3.34Å; T413-Q416 VanDerWaalsContact OG1-CG 3.3Å; T413-Q416 WeakPolarHBondContact OG1-CG 3.44Å; T413-Q416 PolarHBondContact OG1-N 3.4Å; T413-A417 WeakPolarHBondContact O-CB 3.46Å; T413-A417 PolarHBondContact O-N 3.17Å
414F92.5Very high86.1Confident88 Ų8846.2 Ų46.239%0.38622%0.224SC..Hα-helixtrans-57.2-47.3-178.7179.8-104.2000113.6V324 Q416 A417 I418V324-F414 HydrophobicContact CG1-CZ 4.29Å; F414-Q416 PolarHBondContact O-N 3.2Å; F414-A417 PolarHBondContact O-N 3.15Å; F414-I418 HydrophobicContact CD1-CD1 4.02Å; F414-I418 HydrophobicContact CE1-CD1 3.53Å; F414-I418 HydrophobicContact CE2-CD1 4.33Å; F414-I418 HydrophobicContact CZ-CD1 3.71Å; F414-I418 HydrophobicContact CZ-CG1 4.45Å; F414-I418 WeakPolarHBondContact O-CG1 3.26Å; F414-I418 PolarHBondContact O-N 3.32Å; F414-I418 VanDerWaalsContact O-N 3.1Å
415P92.8Very high87Confident25 Ų2545 Ų4516%0.16222%0.217CC..Hα-helixtrans-63.6-39.2175.3-22.334.9000113.4A417 I418 F419 M581P415-A417 VanDerWaalsContact C-N 3.34Å; P415-I418 PolarHBondContact O-N 3.2Å; P415-F419 PolarHBondContact O-N 3.02Å; P415-M581 HydrophobicContact CB-CB 4.24Å; P415-M581 HydrophobicContact CB-CG 4.21Å
416Q91.7Very high88.1Confident33 Ų3338.3 Ų38.315%0.15418%0.181CC..Hα-helixtrans-69.2-32.7177.4-72.2-174.70.700112I411 T413 F414 F419 F420 M433 M581I411-Q416 PolarHBondContact O-OE1 2.92Å; T413-Q416 PolarHBondContact O-N 3.31Å; T413-Q416 WeakPolarHBondContact OG1-CB 3.34Å; T413-Q416 VanDerWaalsContact OG1-CG 3.3Å; T413-Q416 WeakPolarHBondContact OG1-CG 3.44Å; T413-Q416 PolarHBondContact OG1-N 3.4Å; F414-Q416 PolarHBondContact O-N 3.2Å; Q416-F419 CarbonylContact O-C 3.57Å; Q416-F419 WeakPolarHBondContact O-CB 3.4Å; Q416-F419 PolarHBondContact O-N 2.96Å; Q416-F420 WeakPolarHBondContact O-CB 3.46Å; Q416-F420 PolarHBondContact O-N 3.47Å; Q416-M433 HydrophobicContact CB-CE 4.03Å; Q416-M433 HydrophobicContact CB-SD 4.08Å; Q416-M581 HydrophobicContact CG-CE 3.95Å
417A94.8Very high89.4Confident0 Ų035.3 Ų35.30%018%0.175CC..Hα-helixtrans-68.1-35.7173.800000112.2G327 H331 W412 T413 F414 P415 F420 A421 M433G327-A417 WeakPolarHBondContact CA-O 3.36Å; G327-A417 VanDerWaalsContact O-CB 3.24Å; G327-A417 WeakPolarHBondContact O-CB 3.46Å; H331-A417 HydrophobicContact CB-CB 3.77Å; W412-A417 HydrophobicContact CE3-CB 4.11Å; W412-A417 HydrophobicContact CZ3-CB 4.38Å; T413-A417 WeakPolarHBondContact O-CB 3.46Å; T413-A417 PolarHBondContact O-N 3.17Å; F414-A417 PolarHBondContact O-N 3.15Å; P415-A417 VanDerWaalsContact C-N 3.34Å; A417-F420 PolarHBondContact O-N 3.35Å; A417-A421 WeakPolarHBondContact O-CB 3.41Å; A417-A421 PolarHBondContact O-N 2.97Å; A417-M433 HydrophobicContact CB-CE 4.4Å
418I94.7Very high90.6Very high6 Ų633.1 Ų33.13%0.03116%0.161CC..Hα-helixtrans-66.5-41.4170.6-63.2169.9000110.4V324 F414 P415 A421 T422 I585V324-I418 HydrophobicContact CG1-CD1 4.41Å; V324-I418 HydrophobicContact CG2-CD1 4.28Å; F414-I418 HydrophobicContact CD1-CD1 4.02Å; F414-I418 HydrophobicContact CE1-CD1 3.53Å; F414-I418 HydrophobicContact CE2-CD1 4.33Å; F414-I418 HydrophobicContact CZ-CD1 3.71Å; F414-I418 HydrophobicContact CZ-CG1 4.45Å; F414-I418 WeakPolarHBondContact O-CG1 3.26Å; F414-I418 PolarHBondContact O-N 3.32Å; F414-I418 VanDerWaalsContact O-N 3.1Å; P415-I418 PolarHBondContact O-N 3.2Å; I418-A421 PolarHBondContact O-N 2.9Å; I418-T422 WeakPolarHBondContact O-CB 3.34Å; I418-T422 PolarHBondContact O-N 3.37Å; I418-T422 PolarHBondContact O-OG1 3.39Å; I418-I585 HydrophobicContact CG2-CD1 3.83Å
419F94.1Very high91.7Very high9 Ų927.3 Ų27.34%0.03914%0.144CC..Hα-helixtrans-60.2-46.2174.8-178.2-107.8000111.2P415 Q416 T422 T423 Y430 P575 M581 T584 I585 I588P415-F419 PolarHBondContact O-N 3.02Å; Q416-F419 CarbonylContact O-C 3.57Å; Q416-F419 WeakPolarHBondContact O-CB 3.4Å; Q416-F419 PolarHBondContact O-N 2.96Å; F419-T422 CarbonylContact O-C 3.45Å; F419-T422 WeakPolarHBondContact O-CA 3.42Å; F419-T422 VanDerWaalsContact O-CB 3.29Å; F419-T422 WeakPolarHBondContact O-CB 3.36Å; F419-T422 PolarHBondContact O-N 3.45Å; F419-T422 VanDerWaalsContact O-N 3.12Å; F419-T423 HydrophobicContact CD1-CG2 4.29Å; F419-T423 HydrophobicContact CE1-CG2 4.06Å; F419-T423 HydrophobicContact CE2-CG2 4.49Å; F419-T423 HydrophobicContact CZ-CG2 4.2Å; F419-T423 WeakPolarHBondContact O-CG2 3.22Å; F419-T423 PolarHBondContact O-N 2.92Å; F419-Y430 AromaticContact CE1-CD2 3.89Å; F419-Y430 HydrophobicContact CE1-CD2 3.89Å; F419-Y430 AromaticContact CE1-CE2 3.72Å; F419-Y430 HydrophobicContact CE1-CE2 3.72Å; F419-Y430 HydrophobicContact CE2-CE2 4.43Å; F419-Y430 HydrophobicContact CZ-CD2 4.08Å; F419-Y430 AromaticContact CZ-CE2 3.42Å; F419-Y430 HydrophobicContact CZ-CE2 3.42Å; F419-Y430 VanDerWaalsContact CZ-CE2 3.42Å; F419-P575 HydrophobicContact CE1-CG 4.28Å; F419-P575 HydrophobicContact CE2-CG 4.15Å; F419-P575 HydrophobicContact CZ-CG 3.67Å; F419-M581 HydrophobicContact CB-CG 3.97Å; F419-M581 HydrophobicContact CB-SD 3.55Å; F419-M581 VanDerWaalsContact CB-SD 3.55Å; F419-M581 HydrophobicContact CD1-SD 4.02Å; F419-M581 HydrophobicContact CD2-SD 3.48Å; F419-M581 WeakPolarHBondContact CD2-SD 3.47Å; F419-M581 HydrophobicContact CE2-SD 4.09Å; F419-M581 HydrophobicContact CG-CG 4.43Å; F419-M581 HydrophobicContact CG-SD 3.42Å; F419-M581 WeakPolarHBondContact CG-SD 3.4Å; F419-T584 HydrophobicContact CD2-CG2 4.41Å; F419-T584 HydrophobicContact CE2-CG2 3.67Å; F419-T584 HydrophobicContact CZ-CG2 4.42Å; F419-I585 HydrophobicContact CB-CD1 4.47Å; F419-I585 HydrophobicContact CD2-CG1 3.99Å; F419-I588 HydrophobicContact CE2-CD1 3.67Å; F419-I588 HydrophobicContact CZ-CD1 4.32Å
420F94.8Very high92.5Very high11 Ų1120.3 Ų20.35%0.04812%0.118CC..Hα-helixtrans-57.5-48.9172.2169.6-98.7000112.4F330 W412 Q416 A417 T422 T423 V424 M433 P435F330-F420 AromaticContact CD1-CE1 3.92Å; F330-F420 HydrophobicContact CD1-CE1 3.92Å; F330-F420 AromaticContact CD2-CD1 3.99Å; F330-F420 HydrophobicContact CD2-CD1 3.99Å; F330-F420 AromaticContact CD2-CE1 3.89Å; F330-F420 HydrophobicContact CD2-CE1 3.89Å; F330-F420 AromaticContact CE1-CE1 3.9Å; F330-F420 HydrophobicContact CE1-CE1 3.9Å; F330-F420 HydrophobicContact CE2-CD1 4.35Å; F330-F420 AromaticContact CE2-CE1 3.89Å; F330-F420 HydrophobicContact CE2-CE1 3.89Å; F330-F420 HydrophobicContact CG-CD1 4.11Å; F330-F420 AromaticContact CG-CE1 3.94Å; F330-F420 HydrophobicContact CG-CE1 3.94Å; F330-F420 AromaticContact CZ-CE1 3.9Å; F330-F420 HydrophobicContact CZ-CE1 3.9Å; W412-F420 AromaticContact CH2-CD1 3.66Å; W412-F420 HydrophobicContact CH2-CD1 3.66Å; W412-F420 HydrophobicContact CH2-CD2 4.22Å; W412-F420 AromaticContact CH2-CE1 3.87Å; W412-F420 HydrophobicContact CH2-CE1 3.87Å; W412-F420 HydrophobicContact CH2-CE2 4.4Å; W412-F420 AromaticContact CH2-CG 3.87Å; W412-F420 HydrophobicContact CH2-CG 3.87Å; W412-F420 HydrophobicContact CH2-CZ 4.25Å; W412-F420 HydrophobicContact CZ3-CB 4.42Å; W412-F420 AromaticContact CZ3-CD1 3.74Å; W412-F420 HydrophobicContact CZ3-CD1 3.74Å; W412-F420 HydrophobicContact CZ3-CE1 4.28Å; W412-F420 HydrophobicContact CZ3-CG 4.07Å; Q416-F420 WeakPolarHBondContact O-CB 3.46Å; Q416-F420 PolarHBondContact O-N 3.47Å; A417-F420 PolarHBondContact O-N 3.35Å; F420-T422 PolarHBondContact O-N 3.34Å; F420-T423 WeakPolarHBondContact CA-OG1 3.13Å; F420-T423 PolarHBondContact O-N 3.43Å; F420-T423 VanDerWaalsContact O-N 3.08Å; F420-T423 PolarHBondContact O-OG1 3.44Å; F420-V424 HydrophobicContact CD1-CG2 4.41Å; F420-V424 HydrophobicContact CD2-CG2 4.32Å; F420-V424 HydrophobicContact CE1-CG2 3.86Å; F420-V424 HydrophobicContact CE2-CG2 3.74Å; F420-V424 HydrophobicContact CZ-CG2 3.47Å; F420-V424 VanDerWaalsContact CZ-CG2 3.47Å; F420-V424 WeakPolarHBondContact O-CG2 3.22Å; F420-V424 PolarHBondContact O-N 3.06Å; F420-M433 HydrophobicContact CB-CE 4.27Å; F420-M433 HydrophobicContact CB-CG 4.21Å; F420-M433 HydrophobicContact CB-SD 3.78Å; F420-M433 HydrophobicContact CD2-CB 4.28Å; F420-M433 HydrophobicContact CD2-CG 4.16Å; F420-M433 WeakPolarHBondContact CD2-O 3.49Å; F420-M433 WeakPolarHBondContact CE2-O 3.35Å; F420-M433 HydrophobicContact CG-CG 4.33Å; F420-M433 HydrophobicContact CG-SD 4.5Å; F420-P435 HydrophobicContact CZ-CG 4.25Å
421A95.8Very high92.5Very high0 Ų020.4 Ų20.40%013%0.125CC..Hα-helixtrans-58.4-36.8176.400000111.6F330 A417 I418 I425 F447F330-A421 HydrophobicContact CD2-CB 4.45Å; A417-A421 WeakPolarHBondContact O-CB 3.41Å; A417-A421 PolarHBondContact O-N 2.97Å; I418-A421 PolarHBondContact O-N 2.9Å; A421-I425 PolarHBondContact O-N 2.71Å; A421-F447 HydrophobicContact CB-CE1 3.95Å; A421-F447 HydrophobicContact CB-CZ 3.94Å; A421-F447 WeakPolarHBondContact O-CE1 3.46Å
422T94.8Very high92.3Very high4 Ų421 Ų213%0.02513%0.128CC..Hα-helixtrans-65.5-46.4174.1-54.50000111.2I418 F419 F420 V424 I425 T426 I585I418-T422 WeakPolarHBondContact O-CB 3.34Å; I418-T422 PolarHBondContact O-N 3.37Å; I418-T422 PolarHBondContact O-OG1 3.39Å; F419-T422 CarbonylContact O-C 3.45Å; F419-T422 WeakPolarHBondContact O-CA 3.42Å; F419-T422 VanDerWaalsContact O-CB 3.29Å; F419-T422 WeakPolarHBondContact O-CB 3.36Å; F419-T422 PolarHBondContact O-N 3.45Å; F419-T422 VanDerWaalsContact O-N 3.12Å; F420-T422 PolarHBondContact O-N 3.34Å; T422-V424 VanDerWaalsContact C-N 3.28Å; T422-V424 PolarHBondContact O-N 3.21Å; T422-I425 WeakPolarHBondContact O-CG1 3.42Å; T422-I425 PolarHBondContact O-N 3.08Å; T422-T426 HydrophobicContact CG2-CG2 4.04Å; T422-T426 VanDerWaalsContact O-CB 3.29Å; T422-T426 WeakPolarHBondContact O-CB 3.31Å; T422-T426 WeakPolarHBondContact O-CG2 3.42Å; T422-T426 PolarHBondContact O-N 3.14Å; T422-T426 PolarHBondContact O-OG1 3.33Å; T422-I585 HydrophobicContact CG2-CG2 4.19Å
423T94.4Very high92.1Very high7 Ų721.6 Ų21.64%0.04313%0.131CC..Hα-helixtrans-66.2-28.9-179.561.90000113F419 F420 T426 T427 I428 G429 Y430F419-T423 HydrophobicContact CD1-CG2 4.29Å; F419-T423 HydrophobicContact CE1-CG2 4.06Å; F419-T423 HydrophobicContact CE2-CG2 4.49Å; F419-T423 HydrophobicContact CZ-CG2 4.2Å; F419-T423 WeakPolarHBondContact O-CG2 3.22Å; F419-T423 PolarHBondContact O-N 2.92Å; F420-T423 WeakPolarHBondContact CA-OG1 3.13Å; F420-T423 PolarHBondContact O-N 3.43Å; F420-T423 VanDerWaalsContact O-N 3.08Å; F420-T423 PolarHBondContact O-OG1 3.44Å; T423-T426 VanDerWaalsContact CA-OG1 3.22Å; T423-T426 WeakPolarHBondContact CA-OG1 3.38Å; T423-T426 PolarHBondContact O-OG1 3.05Å; T423-T427 PolarHBondContact O-N 3.07Å; T423-I428 PolarHBondContact O-N 2.86Å; T423-G429 PolarHBondContact O-N 2.95Å; T423-Y430 HydrophobicContact CG2-CD2 3.67Å; T423-Y430 HydrophobicContact CG2-CE2 3.54Å
424V95.3Very high92.1Very high25 Ų2523.4 Ų23.415%0.15214%0.143CC..Hα-helixtrans-67.2-53.4173.41710000111.4F420 T422 T426 T427 F447F420-V424 HydrophobicContact CD1-CG2 4.41Å; F420-V424 HydrophobicContact CD2-CG2 4.32Å; F420-V424 HydrophobicContact CE1-CG2 3.86Å; F420-V424 HydrophobicContact CE2-CG2 3.74Å; F420-V424 HydrophobicContact CZ-CG2 3.47Å; F420-V424 VanDerWaalsContact CZ-CG2 3.47Å; F420-V424 WeakPolarHBondContact O-CG2 3.22Å; F420-V424 PolarHBondContact O-N 3.06Å; T422-V424 VanDerWaalsContact C-N 3.28Å; T422-V424 PolarHBondContact O-N 3.21Å; V424-T426 VanDerWaalsContact C-N 3.31Å; V424-T426 PolarHBondContact O-N 3.23Å; V424-T427 PolarHBondContact O-N 2.94Å; V424-F447 HydrophobicContact CG1-CD1 4.04Å; V424-F447 HydrophobicContact CG1-CE1 4.5Å
425I95.2Very high92.1Very high2 Ų219.9 Ų19.91%0.0113%0.128CC..Hα-helixtrans-71.3-30.9-177.465178.7000112.2L319 Y322 T323 A421 T422 T427 F447 L455L319-I425 HydrophobicContact CD1-CD1 3.64Å; L319-I425 HydrophobicContact CG-CD1 4.44Å; Y322-I425 HydrophobicContact CE1-CG2 4.18Å; T323-I425 HydrophobicContact CG2-CD1 3.21Å; T323-I425 HydrophobicContact CG2-CG1 4.43Å; A421-I425 PolarHBondContact O-N 2.71Å; T422-I425 WeakPolarHBondContact O-CG1 3.42Å; T422-I425 PolarHBondContact O-N 3.08Å; I425-T427 PolarHBondContact O-N 2.78Å; I425-F447 HydrophobicContact CG2-CD1 4.04Å; I425-F447 HydrophobicContact CG2-CE1 3.43Å; I425-F447 VanDerWaalsContact CG2-CE1 3.43Å; I425-F447 HydrophobicContact CG2-CZ 3.94Å; I425-L455 VanDerWaalsContact C-CD2 3.43Å; I425-L455 HydrophobicContact CB-CB 4.45Å; I425-L455 HydrophobicContact CD1-CD1 4.46Å; I425-L455 HydrophobicContact CG1-CD2 4.33Å; I425-L455 WeakPolarHBondContact O-CD2 3.38Å
426T93.2Very high91.9Very high3 Ų322 Ų222%0.01813%0.133CC..THydrogen-bonded Turntrans-77.9-2.5174.657.60000113.6T422 T423 V424 I428 L455 I588 L592T422-T426 HydrophobicContact CG2-CG2 4.04Å; T422-T426 VanDerWaalsContact O-CB 3.29Å; T422-T426 WeakPolarHBondContact O-CB 3.31Å; T422-T426 WeakPolarHBondContact O-CG2 3.42Å; T422-T426 PolarHBondContact O-N 3.14Å; T422-T426 PolarHBondContact O-OG1 3.33Å; T423-T426 VanDerWaalsContact CA-OG1 3.22Å; T423-T426 WeakPolarHBondContact CA-OG1 3.38Å; T423-T426 PolarHBondContact O-OG1 3.05Å; V424-T426 VanDerWaalsContact C-N 3.31Å; V424-T426 PolarHBondContact O-N 3.23Å; T426-I428 PolarHBondContact O-N 3Å; T426-I428 WeakPolarHBondContact OG1-CD1 3.21Å; T426-L455 HydrophobicContact CG2-CD1 4.34Å; T426-L455 HydrophobicContact CG2-CD2 3.6Å; T426-I588 HydrophobicContact CG2-CG2 4.43Å; T426-L592 HydrophobicContact CG2-CD1 3.4Å; T426-L592 VanDerWaalsContact CG2-CD1 3.4Å
427T93.5Very high92Very high76 Ų7621.5 Ų21.547%0.46613%0.132SC..THydrogen-bonded Turntrans57.218.8179.562.20000114.2T423 V424 I425 I452T423-T427 PolarHBondContact O-N 3.07Å; V424-T427 PolarHBondContact O-N 2.94Å; I425-T427 PolarHBondContact O-N 2.78Å; T427-I452 HydrophobicContact CG2-CD1 3.98Å; T427-I452 HydrophobicContact CG2-CG1 4.03Å; T427-I452 HydrophobicContact CG2-CG2 4.17Å
428I93.7Very high92.1Very high3 Ų327 Ų272%0.01517%0.166CC..  trans-75.3-51.5177.6-61.6167.8000109.9T423 T426 Y430 T564 T567 I588 L592T423-I428 PolarHBondContact O-N 2.86Å; T426-I428 PolarHBondContact O-N 3Å; T426-I428 WeakPolarHBondContact OG1-CD1 3.21Å; I428-Y430 HydrophobicContact CG2-CD1 4.05Å; I428-Y430 HydrophobicContact CG2-CD2 4.46Å; I428-Y430 HydrophobicContact CG2-CE1 3.66Å; I428-Y430 HydrophobicContact CG2-CE2 4.07Å; I428-Y430 HydrophobicContact CG2-CG 4.43Å; I428-T564 HydrophobicContact CD1-CG2 4.03Å; I428-T567 HydrophobicContact CG1-CG2 4.13Å; I428-I588 HydrophobicContact CD1-CG2 3.62Å; I428-L592 HydrophobicContact CD1-CD1 4.25Å
429G91.2Very high92.1Very high38 Ų3830 Ų3039%0.39219%0.187SC..  trans49.666.817400000116.9T423 G431T423-G429 PolarHBondContact O-N 2.95Å; G429-G431 PolarHBondContact O-N 3.35Å
430Y89.9Confident92.1Very high6 Ų629.5 Ų29.52%0.02419%0.185CC..  trans-53.9-20.4179-61.1-65.1000116.1F419 T423 I428 N432 F560 T564 G569 G571 V574F419-Y430 AromaticContact CE1-CD2 3.89Å; F419-Y430 HydrophobicContact CE1-CD2 3.89Å; F419-Y430 AromaticContact CE1-CE2 3.72Å; F419-Y430 HydrophobicContact CE1-CE2 3.72Å; F419-Y430 HydrophobicContact CE2-CE2 4.43Å; F419-Y430 HydrophobicContact CZ-CD2 4.08Å; F419-Y430 AromaticContact CZ-CE2 3.42Å; F419-Y430 HydrophobicContact CZ-CE2 3.42Å; F419-Y430 VanDerWaalsContact CZ-CE2 3.42Å; T423-Y430 HydrophobicContact CG2-CD2 3.67Å; T423-Y430 HydrophobicContact CG2-CE2 3.54Å; I428-Y430 HydrophobicContact CG2-CD1 4.05Å; I428-Y430 HydrophobicContact CG2-CD2 4.46Å; I428-Y430 HydrophobicContact CG2-CE1 3.66Å; I428-Y430 HydrophobicContact CG2-CE2 4.07Å; I428-Y430 HydrophobicContact CG2-CG 4.43Å; Y430-N432 VanDerWaalsContact CB-OD1 3.32Å; Y430-N432 WeakPolarHBondContact CB-OD1 3.29Å; Y430-N432 PolarHBondContact O-N 3.42Å; Y430-N432 VanDerWaalsContact O-N 3.1Å; Y430-F560 AromaticContact CE1-CE2 3.95Å; Y430-F560 HydrophobicContact CE1-CE2 3.95Å; Y430-F560 AromaticContact CZ-CE2 3.9Å; Y430-T564 WeakPolarHBondContact OH-CG2 3.33Å; Y430-T564 PolarHBondContact OH-OG1 3.5Å; Y430-G569 WeakPolarHBondContact CA-O 3.33Å; Y430-G571 WeakPolarHBondContact O-CA 3.47Å; Y430-V574 HydrophobicContact CD1-CG1 3.87Å; Y430-V574 HydrophobicContact CD2-CG1 4.1Å; Y430-V574 HydrophobicContact CE1-CG1 4.45Å; Y430-V574 HydrophobicContact CG-CG1 3.67Å
431G84.1Confident92.2Very high32 Ų3235.5 Ų35.533%0.3321%0.207SC..SBendtrans72.70.1177.900000115.4G429 M433G429-G431 PolarHBondContact O-N 3.35Å; G431-M433 VanDerWaalsContact C-N 3.32Å
432N80.8Confident92.3Very high55 Ų5539.4 Ų39.429%0.29423%0.231SC..SBendtrans-74.6-22.5170.967.9-41.2000112.8Y430 V574Y430-N432 VanDerWaalsContact CB-OD1 3.32Å; Y430-N432 WeakPolarHBondContact CB-OD1 3.29Å; Y430-N432 PolarHBondContact O-N 3.42Å; Y430-N432 VanDerWaalsContact O-N 3.1Å; N432-V574 HydrophobicContact CB-CG2 4.48Å
433M85.8Confident92.3Very high13 Ų1341.2 Ų41.26%0.06424%0.24CC..SBendtrans-135.3116.6-178.4-172.4170.8-173.500108.7I411 W412 Q416 A417 F420 G431I411-M433 VanDerWaalsContact O-CE 3.26Å; I411-M433 WeakPolarHBondContact O-CE 3.19Å; W412-M433 HydrophobicContact CB-CE 4.37Å; W412-M433 HydrophobicContact CD2-CE 3.35Å; W412-M433 HydrophobicContact CD2-CG 4.49Å; W412-M433 HydrophobicContact CE3-CE 3.1Å; W412-M433 HydrophobicContact CG-CE 3.95Å; W412-M433 HydrophobicContact CH2-CE 3.93Å; W412-M433 HydrophobicContact CH2-CG 3.86Å; W412-M433 HydrophobicContact CZ2-CE 4.16Å; W412-M433 HydrophobicContact CZ2-CG 3.73Å; W412-M433 HydrophobicContact CZ3-CE 3.4Å; W412-M433 HydrophobicContact CZ3-CG 4.3Å; Q416-M433 HydrophobicContact CB-CE 4.03Å; Q416-M433 HydrophobicContact CB-SD 4.08Å; A417-M433 HydrophobicContact CB-CE 4.4Å; F420-M433 HydrophobicContact CB-CE 4.27Å; F420-M433 HydrophobicContact CB-CG 4.21Å; F420-M433 HydrophobicContact CB-SD 3.78Å; F420-M433 HydrophobicContact CD2-CB 4.28Å; F420-M433 HydrophobicContact CD2-CG 4.16Å; F420-M433 WeakPolarHBondContact CD2-O 3.49Å; F420-M433 WeakPolarHBondContact CE2-O 3.35Å; F420-M433 HydrophobicContact CG-CG 4.33Å; F420-M433 HydrophobicContact CG-SD 4.5Å; G431-M433 VanDerWaalsContact C-N 3.32Å
434V90.5Very high92.5Very high56 Ų5642.3 Ų42.334%0.33925%0.248SC..  trans-145142.2-175.8-64.90000111.2R436V434-R436 PolarHBondContact O-N 3.19Å
435P92.9Very high92.5Very high14 Ų1446.3 Ų46.39%0.09127%0.267CS..  trans-70.3120.2178.727.1-33000110E334 F420 R441 C444E334-P435 HydrophobicContact CG-CB 4.19Å; E334-P435 WeakPolarHBondContact OE1-CB 3.45Å; F420-P435 HydrophobicContact CZ-CG 4.25Å; P435-R441 HydrophobicContact CG-CG 4.44Å; P435-R441 WeakPolarHBondContact O-CG 3.43Å; P435-R441 PolarHBondContact O-NE 3.02Å; P435-C444 HydrophobicContact CG-CB 4.13Å
436R89.1Confident92.6Very high70 Ų7049.6 Ų49.626%0.26429%0.287SS..  trans-87.1-31.5179.1-68.8-69.4-176.9142.2-3.6110.8E334 E394 E395 Y397 V434 R441E334-R436 PolarHBondContact OE2-N 3.35Å; E394-R436 PolarHBondContact O-NH2 2.88Å; E395-R436 IonicContact OE2-CZ 3.73Å; E395-R436 IonicContact OE2-NH1 2.81Å; E395-R436 PolarHBondContact OE2-NH1 3.49Å; Y397-R436 HydrophobicContact CE2-CG 4.4Å; Y397-R436 VanDerWaalsContact OH-CG 3.27Å; Y397-R436 WeakPolarHBondContact OH-CG 3.47Å; V434-R436 PolarHBondContact O-N 3.19Å; R436-R441 PolarHBondContact O-NE 3.32Å; R436-R441 PolarHBondContact O-NH2 2.9Å
437T93.8Very high92.8Very high21 Ų2150 Ų5013%0.12929%0.289CS..SBendtrans-68.1146.618074.10000111.9E334 H337 S439 G440 R441E334-T437 VanDerWaalsContact OE1-CB 3.31Å; E334-T437 WeakPolarHBondContact OE1-CB 3.36Å; E334-T437 WeakPolarHBondContact OE1-CG2 3.37Å; E334-T437 PolarHBondContact OE1-N 3.47Å; E334-T437 PolarHBondContact OE1-OG1 3.05Å; H337-T437 HydrophobicContact CB-CG2 3.61Å; H337-T437 VanDerWaalsContact CG-CG2 3.46Å; T437-S439 WeakPolarHBondContact CB-OG 3.27Å; T437-S439 PolarHBondContact O-N 2.89Å; T437-S439 PolarHBondContact OG1-OG 3.44Å; T437-G440 PolarHBondContact O-N 3.14Å; T437-G440 WeakPolarHBondContact OG1-CA 3.37Å; T437-G440 PolarHBondContact OG1-N 3.47Å; T437-R441 WeakPolarHBondContact O-CG 3.4Å; T437-R441 PolarHBondContact O-N 2.98Å
438V95.6Very high92.9Very high116 Ų11646.9 Ų46.970%0.70327%0.272SS*.Hα-helixtrans-59.5-40.6174.9179.60000110.5R441 V442V438-R441 PolarHBondContact O-N 2.77Å; V438-V442 WeakPolarHBondContact O-CG2 3.41Å; V438-V442 PolarHBondContact O-N 3.25Å
439S94.8Very high93Very high68 Ų6851.8 Ų51.848%0.47630%0.297SS..Hα-helixtrans-58.4-47.5173.937.60000112.5T437 V442 L443T437-S439 WeakPolarHBondContact CB-OG 3.27Å; T437-S439 PolarHBondContact O-N 2.89Å; T437-S439 PolarHBondContact OG1-OG 3.44Å; S439-V442 PolarHBondContact O-N 3.43Å; S439-L443 WeakPolarHBondContact O-CB 3.3Å; S439-L443 PolarHBondContact O-N 2.9Å
440G95.6Very high93.3Very high0 Ų056.4 Ų56.40%031%0.306CS..Hα-helixtrans-64.9-38.1178.200000112.3T437 L443 C444T437-G440 PolarHBondContact O-N 3.14Å; T437-G440 WeakPolarHBondContact OG1-CA 3.37Å; T437-G440 PolarHBondContact OG1-N 3.47Å; G440-L443 PolarHBondContact O-N 2.97Å; G440-C444 WeakPolarHBondContact O-CB 3.32Å; G440-C444 PolarHBondContact O-N 3.39Å
441R96.6Very high93.6Very high136 Ų13656.1 Ų56.151%0.51331%0.305SS..Hα-helixtrans-64.5-44.9174.3-67.4177.4-163.1-170.39112.1P435 R436 T437 V438 C444 I445P435-R441 HydrophobicContact CG-CG 4.44Å; P435-R441 WeakPolarHBondContact O-CG 3.43Å; P435-R441 PolarHBondContact O-NE 3.02Å; R436-R441 PolarHBondContact O-NE 3.32Å; R436-R441 PolarHBondContact O-NH2 2.9Å; T437-R441 WeakPolarHBondContact O-CG 3.4Å; T437-R441 PolarHBondContact O-N 2.98Å; V438-R441 PolarHBondContact O-N 2.77Å; R441-C444 WeakPolarHBondContact O-CB 3.33Å; R441-C444 PolarHBondContact O-N 2.95Å; R441-I445 WeakPolarHBondContact O-CG1 3.42Å; R441-I445 PolarHBondContact O-N 3.01Å; R441-I445 VanDerWaalsContact O-N 3.1Å
442V96.9Very high94.1Very high83 Ų8357.3 Ų57.350%0.50330%0.303SS..Hα-helixtrans-63.4-43.9175.7172.60000110.8V438 S439 C444 I445 V446V438-V442 WeakPolarHBondContact O-CG2 3.41Å; V438-V442 PolarHBondContact O-N 3.25Å; S439-V442 PolarHBondContact O-N 3.43Å; V442-C444 VanDerWaalsContact C-N 3.32Å; V442-C444 PolarHBondContact O-N 2.91Å; V442-I445 PolarHBondContact O-N 3.15Å; V442-V446 PolarHBondContact O-N 3.06Å; V442-V446 VanDerWaalsContact O-N 3.09Å
443L96Very high94.8Very high41 Ų4157.7 Ų57.722%0.21531%0.309CS..Hα-helixtrans-58.9-43.7175.4-178.568.5000111.3I329 F330 I333 S439 G440 I445 V446 F447I329-L443 HydrophobicContact CB-CD2 4.12Å; I329-L443 HydrophobicContact CG2-CD1 4.29Å; I329-L443 HydrophobicContact CG2-CD2 3.4Å; F330-L443 HydrophobicContact CD1-CD2 3.81Å; F330-L443 HydrophobicContact CE1-CB 4.17Å; F330-L443 HydrophobicContact CE1-CD2 3.66Å; F330-L443 HydrophobicContact CE1-CG 3.92Å; F330-L443 HydrophobicContact CE2-CD2 4.45Å; F330-L443 HydrophobicContact CG-CD2 4.26Å; F330-L443 HydrophobicContact CZ-CB 4.5Å; F330-L443 HydrophobicContact CZ-CD2 3.98Å; F330-L443 HydrophobicContact CZ-CG 3.95Å; I333-L443 HydrophobicContact CD1-CD2 4.04Å; S439-L443 WeakPolarHBondContact O-CB 3.3Å; S439-L443 PolarHBondContact O-N 2.9Å; G440-L443 PolarHBondContact O-N 2.97Å; L443-I445 VanDerWaalsContact C-N 3.35Å; L443-I445 PolarHBondContact O-N 3.36Å; L443-V446 PolarHBondContact O-N 3.5Å; L443-F447 WeakPolarHBondContact O-CB 3.41Å; L443-F447 PolarHBondContact O-N 3.37Å
444C97Very high95.2Very high31 Ų3158.4 Ų58.421%0.20931%0.313CS..Hα-helixtrans-59.4-42.1176.5-171.40000112.6F330 P435 G440 R441 V442 F447 G448F330-C444 HydrophobicContact CE1-CB 4.15Å; F330-C444 HydrophobicContact CZ-CB 4.09Å; P435-C444 HydrophobicContact CG-CB 4.13Å; G440-C444 WeakPolarHBondContact O-CB 3.32Å; G440-C444 PolarHBondContact O-N 3.39Å; R441-C444 WeakPolarHBondContact O-CB 3.33Å; R441-C444 PolarHBondContact O-N 2.95Å; V442-C444 VanDerWaalsContact C-N 3.32Å; V442-C444 PolarHBondContact O-N 2.91Å; C444-F447 PolarHBondContact O-N 2.9Å; C444-G448 PolarHBondContact O-N 3.38Å
445I96.5Very high95.3Very high109 Ų10956 Ų5656%0.55930%0.298SS*.Hα-helixtrans-61.6-51.5175.8-65.1164.7000110.7R441 V442 L443 F447 G448 I449R441-I445 WeakPolarHBondContact O-CG1 3.42Å; R441-I445 PolarHBondContact O-N 3.01Å; R441-I445 VanDerWaalsContact O-N 3.1Å; V442-I445 PolarHBondContact O-N 3.15Å; L443-I445 VanDerWaalsContact C-N 3.35Å; L443-I445 PolarHBondContact O-N 3.36Å; I445-F447 VanDerWaalsContact C-N 3.33Å; I445-F447 PolarHBondContact O-N 2.9Å; I445-G448 PolarHBondContact O-N 2.99Å; I445-I449 HydrophobicContact CG2-CD1 4.01Å; I445-I449 VanDerWaalsContact O-CG1 3.32Å; I445-I449 WeakPolarHBondContact O-CG1 3.46Å; I445-I449 PolarHBondContact O-N 3.01Å; I445-I449 VanDerWaalsContact O-N 3.08Å
446V97.1Very high95.2Very high71 Ų7160.6 Ų60.643%0.4332%0.321SS..Hα-helixtrans-62.9-42.9-179.81760000110.8V442 L443 G448 I449 F450V442-V446 PolarHBondContact O-N 3.06Å; V442-V446 VanDerWaalsContact O-N 3.09Å; L443-V446 PolarHBondContact O-N 3.5Å; V446-G448 VanDerWaalsContact C-N 3.34Å; V446-G448 PolarHBondContact O-N 2.95Å; V446-I449 PolarHBondContact O-N 3.4Å; V446-F450 HydrophobicContact CG1-CD2 4.32Å; V446-F450 HydrophobicContact CG1-CE2 4.24Å; V446-F450 WeakPolarHBondContact O-CD2 3.3Å; V446-F450 PolarHBondContact O-N 2.99Å
447F96.9Very high95.3Very high12 Ų1262.4 Ų62.45%0.05334%0.335CS..Hα-helixtrans-63.9-38.1179-174.6-104.2000112.2Y322 F330 A421 V424 I425 L443 C444 I445 G451Y322-F447 HydrophobicContact CD1-CD2 4.45Å; Y322-F447 AromaticContact CD1-CE2 3.59Å; Y322-F447 HydrophobicContact CD1-CE2 3.59Å; Y322-F447 AromaticContact CD1-CZ 3.8Å; Y322-F447 HydrophobicContact CD1-CZ 3.8Å; Y322-F447 AromaticContact CE1-CD2 3.55Å; Y322-F447 HydrophobicContact CE1-CD2 3.55Å; Y322-F447 HydrophobicContact CE1-CE1 4.16Å; Y322-F447 AromaticContact CE1-CE2 3.07Å; Y322-F447 HydrophobicContact CE1-CE2 3.07Å; Y322-F447 HydrophobicContact CE1-CG 4.24Å; Y322-F447 AromaticContact CE1-CZ 3.42Å; Y322-F447 HydrophobicContact CE1-CZ 3.42Å; Y322-F447 VanDerWaalsContact CE1-CZ 3.42Å; Y322-F447 HydrophobicContact CE2-CD2 4.24Å; Y322-F447 HydrophobicContact CE2-CE2 4.14Å; Y322-F447 HydrophobicContact CG-CE2 4.29Å; Y322-F447 AromaticContact CZ-CD2 3.43Å; Y322-F447 VanDerWaalsContact CZ-CD2 3.43Å; Y322-F447 AromaticContact CZ-CE2 3.4Å; Y322-F447 VanDerWaalsContact CZ-CE2 3.4Å; Y322-F447 WeakPolarHBondContact OH-CA 3Å; Y322-F447 VanDerWaalsContact OH-CD2 3.25Å; Y322-F447 WeakPolarHBondContact OH-CD2 3.48Å; Y322-F447 PolarHBondContact OH-O 3.35Å; F330-F447 HydrophobicContact CE2-CD1 4.06Å; F330-F447 HydrophobicContact CE2-CE1 4.41Å; F330-F447 HydrophobicContact CE2-CG 4.23Å; F330-F447 HydrophobicContact CZ-CB 4.45Å; A421-F447 HydrophobicContact CB-CE1 3.95Å; A421-F447 HydrophobicContact CB-CZ 3.94Å; A421-F447 WeakPolarHBondContact O-CE1 3.46Å; V424-F447 HydrophobicContact CG1-CD1 4.04Å; V424-F447 HydrophobicContact CG1-CE1 4.5Å; I425-F447 HydrophobicContact CG2-CD1 4.04Å; I425-F447 HydrophobicContact CG2-CE1 3.43Å; I425-F447 VanDerWaalsContact CG2-CE1 3.43Å; I425-F447 HydrophobicContact CG2-CZ 3.94Å; L443-F447 WeakPolarHBondContact O-CB 3.41Å; L443-F447 PolarHBondContact O-N 3.37Å; C444-F447 PolarHBondContact O-N 2.9Å; I445-F447 VanDerWaalsContact C-N 3.33Å; I445-F447 PolarHBondContact O-N 2.9Å; F447-G451 VanDerWaalsContact O-CA 3.3Å; F447-G451 WeakPolarHBondContact O-CA 3.46Å; F447-G451 PolarHBondContact O-N 3.39Å
448G96.3Very high95.3Very high10 Ų1061.4 Ų61.410%0.10333%0.329CS..Hα-helixtrans-67.6-42.1175.200000113.3C444 I445 V446 F450 G451 I452C444-G448 PolarHBondContact O-N 3.38Å; I445-G448 PolarHBondContact O-N 2.99Å; V446-G448 VanDerWaalsContact C-N 3.34Å; V446-G448 PolarHBondContact O-N 2.95Å; G448-F450 VanDerWaalsContact C-N 3.28Å; G448-F450 PolarHBondContact O-N 2.93Å; G448-G451 PolarHBondContact O-N 3.23Å; G448-I452 WeakPolarHBondContact O-CB 3.28Å; G448-I452 WeakPolarHBondContact O-CG1 3.2Å; G448-I452 PolarHBondContact O-N 3.47Å
449I96.6Very high95Very high106 Ų10656.4 Ų56.454%0.54430%0.298SS..Hα-helixtrans-56.6-41-179.3-72.8166.3000112I445 V446 P453I445-I449 HydrophobicContact CG2-CD1 4.01Å; I445-I449 VanDerWaalsContact O-CG1 3.32Å; I445-I449 WeakPolarHBondContact O-CG1 3.46Å; I445-I449 PolarHBondContact O-N 3.01Å; I445-I449 VanDerWaalsContact O-N 3.08Å; V446-I449 PolarHBondContact O-N 3.4Å; I449-P453 WeakPolarHBondContact O-CD 3.49Å; I449-P453 VanDerWaalsContact O-CG 3.27Å; I449-P453 WeakPolarHBondContact O-CG 3.31Å
450F96Very high94.6Very high135 Ų13555.8 Ų55.859%0.59230%0.297SS*.Hα-helixtrans-92.6-34.6178.2-64.3-73.5000112.9V446 G448 L454V446-F450 HydrophobicContact CG1-CD2 4.32Å; V446-F450 HydrophobicContact CG1-CE2 4.24Å; V446-F450 WeakPolarHBondContact O-CD2 3.3Å; V446-F450 PolarHBondContact O-N 2.99Å; G448-F450 VanDerWaalsContact C-N 3.28Å; G448-F450 PolarHBondContact O-N 2.93Å; F450-L454 WeakPolarHBondContact O-CB 3.26Å; F450-L454 PolarHBondContact O-N 2.91Å
451G96.2Very high94.2Very high0 Ų057.4 Ų57.40%031%0.306CS..Hα-helixtrans-72.1-41.9-174.300000113.9Y322 F447 G448 L454 L455Y322-G451 PolarHBondContact OH-N 2.9Å; F447-G451 VanDerWaalsContact O-CA 3.3Å; F447-G451 WeakPolarHBondContact O-CA 3.46Å; F447-G451 PolarHBondContact O-N 3.39Å; G448-G451 PolarHBondContact O-N 3.23Å; G451-L454 PolarHBondContact O-N 3.45Å; G451-L455 WeakPolarHBondContact O-CB 3.29Å; G451-L455 PolarHBondContact O-N 3.38Å
452I95.2Very high93.9Very high56 Ų5652.3 Ų52.329%0.28729%0.289SS..Hα-helixtrans-64.8-49.5-178.8-61.9165.7000110.8T427 G448 L454 L455 L456T427-I452 HydrophobicContact CG2-CD1 3.98Å; T427-I452 HydrophobicContact CG2-CG1 4.03Å; T427-I452 HydrophobicContact CG2-CG2 4.17Å; G448-I452 WeakPolarHBondContact O-CB 3.28Å; G448-I452 WeakPolarHBondContact O-CG1 3.2Å; G448-I452 PolarHBondContact O-N 3.47Å; I452-L454 VanDerWaalsContact C-N 3.34Å; I452-L454 PolarHBondContact O-N 2.92Å; I452-L455 PolarHBondContact O-N 2.91Å; I452-L456 HydrophobicContact CG2-CD1 4.12Å; I452-L456 HydrophobicContact CG2-CG 4.37Å; I452-L456 WeakPolarHBondContact O-CG 3.41Å; I452-L456 PolarHBondContact O-N 3.35Å
453P95.2Very high93.3Very high63 Ų6348.7 Ų48.741%0.40927%0.268SS..Hα-helixtrans-61.4-40.4175.5-24.535.5000113.1I449 L455 L456 I457I449-P453 WeakPolarHBondContact O-CD 3.49Å; I449-P453 VanDerWaalsContact O-CG 3.27Å; I449-P453 WeakPolarHBondContact O-CG 3.31Å; P453-L455 VanDerWaalsContact C-N 3.34Å; P453-L455 PolarHBondContact O-N 2.77Å; P453-L456 PolarHBondContact O-N 3.39Å; P453-I457 VanDerWaalsContact O-CG1 3.29Å; P453-I457 WeakPolarHBondContact O-CG1 3.34Å; P453-I457 PolarHBondContact O-N 2.94Å
454L94.3Very high92.7Very high29 Ų2953.3 Ų53.315%0.15229%0.286CS..Hα-helixtrans-58.2-49.3176177.261.5000110.2L315 L318 L319 Y322 F450 G451 I452 I457 T458L315-L454 HydrophobicContact CD1-CD1 4.02Å; L318-L454 HydrophobicContact CD2-CD1 3.89Å; L318-L454 HydrophobicContact CG-CD1 4.34Å; L318-L454 HydrophobicContact CG-CD2 4.38Å; L319-L454 HydrophobicContact CD1-CD2 4.2Å; L319-L454 HydrophobicContact CD1-CG 4.09Å; Y322-L454 HydrophobicContact CD1-CD2 4.28Å; Y322-L454 HydrophobicContact CG-CD2 4.07Å; F450-L454 WeakPolarHBondContact O-CB 3.26Å; F450-L454 PolarHBondContact O-N 2.91Å; G451-L454 PolarHBondContact O-N 3.45Å; I452-L454 VanDerWaalsContact C-N 3.34Å; I452-L454 PolarHBondContact O-N 2.92Å; L454-I457 PolarHBondContact O-N 2.71Å; L454-T458 HydrophobicContact CD1-CG2 4.32Å; L454-T458 HydrophobicContact CG-CG2 4.43Å; L454-T458 WeakPolarHBondContact O-CG2 3.19Å; L454-T458 PolarHBondContact O-N 3.5Å
455L92.8Very high92.1Very high6 Ų657 Ų573%0.03130%0.298CS..Hα-helixtrans-60.8-47.6177.1-177.277.6000111.8L319 I425 T426 G451 I452 P453 I457 T458 I459L319-L455 HydrophobicContact CD1-CB 4.17Å; L319-L455 HydrophobicContact CD1-CD1 3.98Å; L319-L455 HydrophobicContact CD2-CD1 3.59Å; L319-L455 HydrophobicContact CG-CD1 4.41Å; I425-L455 VanDerWaalsContact C-CD2 3.43Å; I425-L455 HydrophobicContact CB-CB 4.45Å; I425-L455 HydrophobicContact CD1-CD1 4.46Å; I425-L455 HydrophobicContact CG1-CD2 4.33Å; I425-L455 WeakPolarHBondContact O-CD2 3.38Å; T426-L455 HydrophobicContact CG2-CD1 4.34Å; T426-L455 HydrophobicContact CG2-CD2 3.6Å; G451-L455 WeakPolarHBondContact O-CB 3.29Å; G451-L455 PolarHBondContact O-N 3.38Å; I452-L455 PolarHBondContact O-N 2.91Å; P453-L455 VanDerWaalsContact C-N 3.34Å; P453-L455 PolarHBondContact O-N 2.77Å; L455-I457 VanDerWaalsContact C-N 3.27Å; L455-I457 PolarHBondContact O-N 3.02Å; L455-T458 WeakPolarHBondContact CA-OG1 3.48Å; L455-T458 CarbonylContact O-C 3.56Å; L455-T458 WeakPolarHBondContact O-CA 3.37Å; L455-T458 PolarHBondContact O-N 2.99Å; L455-T458 PolarHBondContact O-OG1 3.35Å; L455-I459 HydrophobicContact CD1-CD1 3.87Å; L455-I459 HydrophobicContact CD1-CG1 3.98Å; L455-I459 HydrophobicContact CD2-CD1 3.68Å; L455-I459 HydrophobicContact CG-CD1 3.54Å; L455-I459 HydrophobicContact CG-CG1 3.95Å; L455-I459 WeakPolarHBondContact O-CB 3.32Å; L455-I459 WeakPolarHBondContact O-CG1 3.21Å; L455-I459 PolarHBondContact O-N 3.25Å
456L91.3Very high91.6Very high110 Ų11053 Ų5358%0.57628%0.278SS*.Hα-helixtrans-57.4-41.4-179.3-72.4175.1000112.1I452 P453 A460I452-L456 HydrophobicContact CG2-CD1 4.12Å; I452-L456 HydrophobicContact CG2-CG 4.37Å; I452-L456 WeakPolarHBondContact O-CG 3.41Å; I452-L456 PolarHBondContact O-N 3.35Å; P453-L456 PolarHBondContact O-N 3.39Å; L456-A460 WeakPolarHBondContact O-CB 3.34Å; L456-A460 PolarHBondContact O-N 3.24Å
457I91.9Very high90.9Very high107 Ų10750.9 Ų50.955%0.54927%0.267SS..Hα-helixtrans-64.9-43.4174.9-62.5167.2000110.1L315 P453 L454 L455 D461L315-I457 HydrophobicContact CD2-CG2 3.95Å; P453-I457 VanDerWaalsContact O-CG1 3.29Å; P453-I457 WeakPolarHBondContact O-CG1 3.34Å; P453-I457 PolarHBondContact O-N 2.94Å; L454-I457 PolarHBondContact O-N 2.71Å; L455-I457 VanDerWaalsContact C-N 3.27Å; L455-I457 PolarHBondContact O-N 3.02Å; I457-D461 WeakPolarHBondContact O-CB 3.24Å; I457-D461 PolarHBondContact O-N 3.23Å; I457-D461 VanDerWaalsContact O-N 3.14Å
458T91.8Very high90.2Very high0 Ų055 Ų550%029%0.29CS..Hα-helixtrans-63-4317872.80000112.6L315 L319 L454 L455 D461 I462L315-T458 HydrophobicContact CD1-CG2 3.96Å; L315-T458 HydrophobicContact CD2-CG2 3.94Å; L315-T458 HydrophobicContact CG-CG2 3.5Å; L315-T458 VanDerWaalsContact CG-CG2 3.5Å; L319-T458 HydrophobicContact CB-CG2 3.94Å; L319-T458 HydrophobicContact CD1-CG2 4.34Å; L319-T458 HydrophobicContact CD2-CG2 4.07Å; L319-T458 HydrophobicContact CG-CG2 4.34Å; L454-T458 HydrophobicContact CD1-CG2 4.32Å; L454-T458 HydrophobicContact CG-CG2 4.43Å; L454-T458 WeakPolarHBondContact O-CG2 3.19Å; L454-T458 PolarHBondContact O-N 3.5Å; L455-T458 WeakPolarHBondContact CA-OG1 3.48Å; L455-T458 CarbonylContact O-C 3.56Å; L455-T458 WeakPolarHBondContact O-CA 3.37Å; L455-T458 PolarHBondContact O-N 2.99Å; L455-T458 PolarHBondContact O-OG1 3.35Å; T458-D461 WeakPolarHBondContact O-CB 3.33Å; T458-D461 PolarHBondContact O-N 3.44Å; T458-I462 WeakPolarHBondContact O-CD1 3.5Å; T458-I462 WeakPolarHBondContact O-CG1 3.32Å; T458-I462 PolarHBondContact O-N 2.88Å
459I90.6Very high89.6Confident11 Ų1159.2 Ų59.26%0.05631%0.305CS..Hα-helixtrans-68.1-43-178.1-76.5-178.7000110.2L455 D461 I462 G463 L592 T596L455-I459 HydrophobicContact CD1-CD1 3.87Å; L455-I459 HydrophobicContact CD1-CG1 3.98Å; L455-I459 HydrophobicContact CD2-CD1 3.68Å; L455-I459 HydrophobicContact CG-CD1 3.54Å; L455-I459 HydrophobicContact CG-CG1 3.95Å; L455-I459 WeakPolarHBondContact O-CB 3.32Å; L455-I459 WeakPolarHBondContact O-CG1 3.21Å; L455-I459 PolarHBondContact O-N 3.25Å; I459-D461 VanDerWaalsContact C-N 3.26Å; I459-D461 PolarHBondContact O-N 2.86Å; I459-I462 PolarHBondContact O-N 3.34Å; I459-G463 PolarHBondContact O-N 3.41Å; I459-L592 HydrophobicContact CD1-CB 4.04Å; I459-L592 HydrophobicContact CD1-CD1 4.42Å; I459-T596 HydrophobicContact CG2-CG2 3.96Å; I459-T596 WeakPolarHBondContact CG2-OG1 3.42Å
460A86.5Confident88.9Confident55 Ų5554.7 Ų54.746%0.45528%0.282SS..Hα-helixtrans-61-39176.400000111.7L456 K464L456-A460 WeakPolarHBondContact O-CB 3.34Å; L456-A460 PolarHBondContact O-N 3.24Å; A460-K464 PolarHBondContact O-N 3.42Å
461D87.5Confident88.1Confident35 Ų3549 Ų4919%0.18726%0.258CS..Hα-helixtrans-68.4-47.4177.8-168.757.8000112.3H312 L315 I457 T458 I459 G463 K464 F465H312-D461 VanDerWaalsContact CA-OD2 3.31Å; H312-D461 WeakPolarHBondContact CA-OD2 3.21Å; H312-D461 WeakPolarHBondContact CB-OD2 3.49Å; H312-D461 IonicContact CE1-OD1 2.76Å; H312-D461 PolarHBondContact CE1-OD1 2.92Å; H312-D461 IonicContact CE1-OD2 3.97Å; H312-D461 IonicContact CG-OD1 3.53Å; H312-D461 IonicContact CG-OD2 3.07Å; H312-D461 IonicContact ND1-OD1 3.97Å; H312-D461 PolarHBondContact ND1-OD1 3.28Å; H312-D461 IonicContact ND1-OD2 3.34Å; H312-D461 PolarHBondContact ND1-OD2 3.12Å; L315-D461 HydrophobicContact CD2-CB 4.05Å; I457-D461 WeakPolarHBondContact O-CB 3.24Å; I457-D461 PolarHBondContact O-N 3.23Å; I457-D461 VanDerWaalsContact O-N 3.14Å; T458-D461 WeakPolarHBondContact O-CB 3.33Å; T458-D461 PolarHBondContact O-N 3.44Å; I459-D461 VanDerWaalsContact C-N 3.26Å; I459-D461 PolarHBondContact O-N 2.86Å; D461-G463 PolarHBondContact O-N 2.92Å; D461-K464 PolarHBondContact O-N 2.93Å; D461-F465 PolarHBondContact O-N 2.87Å; D461-F465 VanDerWaalsContact O-N 3.08Å
462I88.7Confident87.4Confident29 Ų2954.3 Ų54.315%0.14928%0.282CS..Hα-helixtrans-62.8-42.6174.5-62.7163.3000110.6V316 T458 I459 K464 F465 L466 V589 A593V316-I462 HydrophobicContact CG2-CD1 3.94Å; V316-I462 HydrophobicContact CG2-CG1 4.12Å; T458-I462 WeakPolarHBondContact O-CD1 3.5Å; T458-I462 WeakPolarHBondContact O-CG1 3.32Å; T458-I462 PolarHBondContact O-N 2.88Å; I459-I462 PolarHBondContact O-N 3.34Å; I462-K464 VanDerWaalsContact C-N 3.31Å; I462-K464 PolarHBondContact O-N 3.47Å; I462-F465 WeakPolarHBondContact O-CB 3.23Å; I462-F465 PolarHBondContact O-N 3.05Å; I462-F465 VanDerWaalsContact O-N 3.16Å; I462-L466 HydrophobicContact CG2-CD1 3.87Å; I462-L466 HydrophobicContact CG2-CG 4.21Å; I462-L466 WeakPolarHBondContact O-CB 3.19Å; I462-L466 VanDerWaalsContact O-CG 3.32Å; I462-L466 WeakPolarHBondContact O-CG 3.44Å; I462-L466 PolarHBondContact O-N 3.11Å; I462-V589 HydrophobicContact CD1-CG1 4.32Å; I462-A593 HydrophobicContact CB-CB 3.85Å; I462-A593 HydrophobicContact CG2-CB 3.41Å; I462-A593 VanDerWaalsContact CG2-CB 3.41Å
463G85.3Confident86.7Confident6 Ų655.6 Ų55.66%0.06229%0.288CS..Hα-helixtrans-60.3-39.7178.700000112.2I459 D461 L466 S467I459-G463 PolarHBondContact O-N 3.41Å; D461-G463 PolarHBondContact O-N 2.92Å; G463-L466 PolarHBondContact O-N 3.45Å; G463-S467 PolarHBondContact O-N 2.84Å
464K83.7Confident86Confident139 Ų13956 Ų5660%0.60428%0.282SS*.Hα-helixtrans-64-46.4172.6-176.5174-177.8171.30111.9A460 D461 I462 L466 S467 D468A460-K464 PolarHBondContact O-N 3.42Å; D461-K464 PolarHBondContact O-N 2.93Å; I462-K464 VanDerWaalsContact C-N 3.31Å; I462-K464 PolarHBondContact O-N 3.47Å; K464-L466 VanDerWaalsContact C-N 3.29Å; K464-L466 PolarHBondContact O-N 3.26Å; K464-S467 PolarHBondContact O-N 2.84Å; K464-D468 PolarHBondContact O-N 2.91Å
465F84.8Confident85.4Confident107 Ų10760.1 Ų60.147%0.46930%0.296SS..Hα-helixtrans-58.3-42.1175.6174.3-96.6000111.8D461 I462 D468 F469D461-F465 PolarHBondContact O-N 2.87Å; D461-F465 VanDerWaalsContact O-N 3.08Å; I462-F465 WeakPolarHBondContact O-CB 3.23Å; I462-F465 PolarHBondContact O-N 3.05Å; I462-F465 VanDerWaalsContact O-N 3.16Å; F465-D468 PolarHBondContact O-N 3.43Å; F465-F469 VanDerWaalsContact O-CB 3.32Å; F465-F469 WeakPolarHBondContact O-CB 3.24Å; F465-F469 PolarHBondContact O-N 3.35Å
466L85.4Confident84.8Confident26 Ų2664.5 Ų64.514%0.13632%0.316CS..Hα-helixtrans-65.2-41.2176.3-72169.1000112.3I462 G463 K464 F469 I470 A593 L594 M597I462-L466 HydrophobicContact CG2-CD1 3.87Å; I462-L466 HydrophobicContact CG2-CG 4.21Å; I462-L466 WeakPolarHBondContact O-CB 3.19Å; I462-L466 VanDerWaalsContact O-CG 3.32Å; I462-L466 WeakPolarHBondContact O-CG 3.44Å; I462-L466 PolarHBondContact O-N 3.11Å; G463-L466 PolarHBondContact O-N 3.45Å; K464-L466 VanDerWaalsContact C-N 3.29Å; K464-L466 PolarHBondContact O-N 3.26Å; L466-F469 PolarHBondContact O-N 3.22Å; L466-I470 WeakPolarHBondContact O-CB 3.35Å; L466-I470 VanDerWaalsContact O-CG1 3.3Å; L466-I470 WeakPolarHBondContact O-CG1 3.43Å; L466-I470 PolarHBondContact O-N 3.19Å; L466-A593 HydrophobicContact CD1-CB 3.78Å; L466-L594 HydrophobicContact CD1-CD2 3.86Å; L466-L594 HydrophobicContact CD1-CG 3.92Å; L466-L594 HydrophobicContact CD2-CD2 4.36Å; L466-L594 HydrophobicContact CG-CD2 4.49Å; L466-M597 HydrophobicContact CB-SD 4Å
467S81.9Confident84.3Confident27 Ų2765.7 Ų65.719%0.18932%0.317CS..Hα-helixtrans-61.4-45.2175.4179.50000112.2G463 K464 F469 I470 T471G463-S467 PolarHBondContact O-N 2.84Å; K464-S467 PolarHBondContact O-N 2.84Å; S467-F469 VanDerWaalsContact C-N 3.33Å; S467-I470 PolarHBondContact O-N 3.47Å; S467-T471 WeakPolarHBondContact O-CB 3.48Å; S467-T471 PolarHBondContact O-N 3.08Å; S467-T471 PolarHBondContact O-OG1 2.82Å
468D82.5Confident83.7Confident99 Ų9963 Ų6353%0.52930%0.301SS..Hα-helixtrans-64.2-39.9175.5-72.9-18.2000111.3K464 F465 T471 F472K464-D468 PolarHBondContact O-N 2.91Å; F465-D468 PolarHBondContact O-N 3.43Å; D468-T471 PolarHBondContact O-N 2.88Å; D468-F472 WeakPolarHBondContact O-CB 3.46Å; D468-F472 PolarHBondContact O-N 2.94Å
469F82.8Confident83.3Confident97 Ų9768.6 Ų68.643%0.42532%0.322SS..Hα-helixtrans-64.9-45176.1-179.7-110.5000112.3F465 L466 S467 T471 F472 L473F465-F469 VanDerWaalsContact O-CB 3.32Å; F465-F469 WeakPolarHBondContact O-CB 3.24Å; F465-F469 PolarHBondContact O-N 3.35Å; L466-F469 PolarHBondContact O-N 3.22Å; S467-F469 VanDerWaalsContact C-N 3.33Å; F469-T471 VanDerWaalsContact C-N 3.31Å; F469-T471 PolarHBondContact O-N 3.32Å; F469-F472 WeakPolarHBondContact O-CB 3.47Å; F469-F472 PolarHBondContact O-N 2.78Å; F469-L473 HydrophobicContact CD1-CD1 3.99Å; F469-L473 HydrophobicContact CD1-CG 4.44Å; F469-L473 HydrophobicContact CE1-CD1 3.45Å; F469-L473 VanDerWaalsContact CE1-CD1 3.45Å; F469-L473 HydrophobicContact CE1-CG 4.07Å; F469-L473 HydrophobicContact CE2-CD2 4.4Å; F469-L473 HydrophobicContact CE2-CG 4.33Å; F469-L473 HydrophobicContact CZ-CD1 3.77Å; F469-L473 HydrophobicContact CZ-CD2 4.12Å; F469-L473 HydrophobicContact CZ-CG 4Å; F469-L473 WeakPolarHBondContact O-CG 3.31Å; F469-L473 PolarHBondContact O-N 3.19Å
470I81.6Confident82.8Confident12 Ų1271.2 Ų71.26%0.06234%0.341CS..Hα-helixtrans-64.1-39.8176.4-70.7163.6000110.3L466 S467 F472 L473 Y474 L526 M530 V534 L594 M597L466-I470 WeakPolarHBondContact O-CB 3.35Å; L466-I470 VanDerWaalsContact O-CG1 3.3Å; L466-I470 WeakPolarHBondContact O-CG1 3.43Å; L466-I470 PolarHBondContact O-N 3.19Å; S467-I470 PolarHBondContact O-N 3.47Å; I470-F472 VanDerWaalsContact C-N 3.31Å; I470-F472 PolarHBondContact O-N 3.11Å; I470-L473 PolarHBondContact O-N 3.12Å; I470-Y474 WeakPolarHBondContact O-CB 3.16Å; I470-Y474 PolarHBondContact O-N 3.39Å; I470-L526 HydrophobicContact CB-CD2 4.28Å; I470-L526 HydrophobicContact CG2-CD1 3.62Å; I470-L526 HydrophobicContact CG2-CD2 3.65Å; I470-L526 HydrophobicContact CG2-CG 4.32Å; I470-M530 HydrophobicContact CG2-CE 4.05Å; I470-V534 HydrophobicContact CD1-CG1 4.29Å; I470-L594 HydrophobicContact CD1-CD2 4.49Å; I470-M597 HydrophobicContact CD1-CE 3.59Å; I470-M597 HydrophobicContact CD1-SD 3.8Å
471T80.5Confident82.4Confident16 Ų1674.9 Ų74.910%0.09835%0.347CS..Hα-helixtrans-63-40.2174.9-59.20000111.1S467 D468 F469 Y474 R475S467-T471 WeakPolarHBondContact O-CB 3.48Å; S467-T471 PolarHBondContact O-N 3.08Å; S467-T471 PolarHBondContact O-OG1 2.82Å; D468-T471 PolarHBondContact O-N 2.88Å; F469-T471 VanDerWaalsContact C-N 3.31Å; F469-T471 PolarHBondContact O-N 3.32Å; T471-Y474 PolarHBondContact O-N 2.9Å; T471-R475 WeakPolarHBondContact O-CB 3.38Å; T471-R475 VanDerWaalsContact O-CG 3.26Å; T471-R475 WeakPolarHBondContact O-CG 3.49Å; T471-R475 PolarHBondContact O-N 3.37Å
472F81.2Confident82.3Confident111 Ų11175.3 Ų75.349%0.48735%0.349SS..Hα-helixtrans-62.4-48.6173.4171.1-95.4000111.9D468 F469 I470 Y474 R475 Q476D468-F472 WeakPolarHBondContact O-CB 3.46Å; D468-F472 PolarHBondContact O-N 2.94Å; F469-F472 WeakPolarHBondContact O-CB 3.47Å; F469-F472 PolarHBondContact O-N 2.78Å; I470-F472 VanDerWaalsContact C-N 3.31Å; I470-F472 PolarHBondContact O-N 3.11Å; F472-Y474 VanDerWaalsContact C-N 3.3Å; F472-Y474 PolarHBondContact O-N 3.22Å; F472-R475 PolarHBondContact O-N 3.39Å; F472-Q476 WeakPolarHBondContact O-CB 3.44Å; F472-Q476 PolarHBondContact O-N 3.42Å
473L81.1Confident81.8Confident82 Ų8280.3 Ų80.343%0.42937%0.372SS..Hα-helixtrans-60.2-40.8176.4-71.3-179.4000111.7F469 I470 Q476 F477F469-L473 HydrophobicContact CD1-CD1 3.99Å; F469-L473 HydrophobicContact CD1-CG 4.44Å; F469-L473 HydrophobicContact CE1-CD1 3.45Å; F469-L473 VanDerWaalsContact CE1-CD1 3.45Å; F469-L473 HydrophobicContact CE1-CG 4.07Å; F469-L473 HydrophobicContact CE2-CD2 4.4Å; F469-L473 HydrophobicContact CE2-CG 4.33Å; F469-L473 HydrophobicContact CZ-CD1 3.77Å; F469-L473 HydrophobicContact CZ-CD2 4.12Å; F469-L473 HydrophobicContact CZ-CG 4Å; F469-L473 WeakPolarHBondContact O-CG 3.31Å; F469-L473 PolarHBondContact O-N 3.19Å; I470-L473 PolarHBondContact O-N 3.12Å; L473-Q476 PolarHBondContact O-N 3.49Å; L473-F477 WeakPolarHBondContact O-CB 3.45Å; L473-F477 PolarHBondContact O-N 3.5Å
474Y80.3Confident81.3Confident72 Ų7284.4 Ų84.428%0.28240%0.395SS..Hα-helixtrans-64-45.4176.7-179.3-96.9000111.8I470 T471 F472 Q476 F477 K478 V524 M530I470-Y474 WeakPolarHBondContact O-CB 3.16Å; I470-Y474 PolarHBondContact O-N 3.39Å; T471-Y474 PolarHBondContact O-N 2.9Å; F472-Y474 VanDerWaalsContact C-N 3.3Å; F472-Y474 PolarHBondContact O-N 3.22Å; Y474-Q476 VanDerWaalsContact C-N 3.28Å; Y474-Q476 PolarHBondContact O-N 2.74Å; Y474-F477 PolarHBondContact O-N 3.45Å; Y474-K478 WeakPolarHBondContact O-CB 3.48Å; Y474-K478 PolarHBondContact O-N 3.25Å; Y474-V524 HydrophobicContact CD1-CG1 3.65Å; Y474-V524 HydrophobicContact CE1-CG1 3.41Å; Y474-V524 VanDerWaalsContact CE1-CG1 3.41Å; Y474-M530 HydrophobicContact CD2-CE 4.08Å; Y474-M530 HydrophobicContact CD2-SD 3.62Å; Y474-M530 HydrophobicContact CE2-SD 4.33Å; Y474-M530 HydrophobicContact CG-SD 4.32Å
475R80.8Confident80.9Confident115 Ų11584.9 Ų84.943%0.43439%0.393SS..Hα-helixtrans-60-41.3174.4-72.3173.1-172.9161.23.6111T471 F472 K478 R479T471-R475 WeakPolarHBondContact O-CB 3.38Å; T471-R475 VanDerWaalsContact O-CG 3.26Å; T471-R475 WeakPolarHBondContact O-CG 3.49Å; T471-R475 PolarHBondContact O-N 3.37Å; F472-R475 PolarHBondContact O-N 3.39Å; R475-K478 PolarHBondContact O-N 3.46Å; R475-R479 WeakPolarHBondContact O-CB 3.25Å; R475-R479 WeakPolarHBondContact O-CG 3.25Å; R475-R479 PolarHBondContact O-N 3.43Å
476Q80.8Confident80.3Confident99 Ų9984.7 Ų84.746%0.46339%0.392SS..Hα-helixtrans-67.6-40.3178-16967.8-11.200112F472 L473 Y474 R479 C480F472-Q476 WeakPolarHBondContact O-CB 3.44Å; F472-Q476 PolarHBondContact O-N 3.42Å; L473-Q476 PolarHBondContact O-N 3.49Å; Y474-Q476 VanDerWaalsContact C-N 3.28Å; Y474-Q476 PolarHBondContact O-N 2.74Å; Q476-R479 PolarHBondContact O-N 3.46Å; Q476-C480 WeakPolarHBondContact O-CB 3.17Å; Q476-C480 PolarHBondContact O-N 2.94Å
477F81.1Confident79.4Confident134 Ų13490.6 Ų90.659%0.58842%0.419SS*.Hα-helixtrans-63.1-44.5173.4178.9-99.7000111.5L473 Y474 R479 C480 K481L473-F477 WeakPolarHBondContact O-CB 3.45Å; L473-F477 PolarHBondContact O-N 3.5Å; Y474-F477 PolarHBondContact O-N 3.45Å; F477-R479 VanDerWaalsContact C-N 3.34Å; F477-R479 PolarHBondContact O-N 3.48Å; F477-C480 PolarHBondContact O-N 2.98Å; F477-K481 HydrophobicContact CE1-CD 4.25Å; F477-K481 VanDerWaalsContact O-CB 3.25Å; F477-K481 WeakPolarHBondContact O-CB 3.41Å; F477-K481 PolarHBondContact O-N 3.44Å
478K79.4Confident78.7Confident50 Ų5092.8 Ų92.822%0.21743%0.434CS..Hα-helixtrans-60-43.7174.7-170.4-171.8176.2-156.70110.9Y474 R475 K481 N482 D520Y474-K478 WeakPolarHBondContact O-CB 3.48Å; Y474-K478 PolarHBondContact O-N 3.25Å; R475-K478 PolarHBondContact O-N 3.46Å; K478-K481 PolarHBondContact O-N 3.29Å; K478-N482 VanDerWaalsContact O-CB 3.31Å; K478-N482 WeakPolarHBondContact O-CB 3.15Å; K478-N482 PolarHBondContact O-N 2.9Å; K478-N482 PolarHBondContact O-OD1 2.92Å; K478-D520 IonicContact NZ-OD1 2.78Å; K478-D520 PolarHBondContact NZ-OD1 3.05Å
479R82.6Confident77.1Confident118 Ų11894.6 Ų94.645%0.44543%0.434SS..Hα-helixtrans-61.3-48.3174.9-76.5178.4-178.2137.82.1112.3R475 Q476 F477 N482 Q483R475-R479 WeakPolarHBondContact O-CB 3.25Å; R475-R479 WeakPolarHBondContact O-CG 3.25Å; R475-R479 PolarHBondContact O-N 3.43Å; Q476-R479 PolarHBondContact O-N 3.46Å; F477-R479 VanDerWaalsContact C-N 3.34Å; F477-R479 PolarHBondContact O-N 3.48Å; R479-N482 PolarHBondContact O-N 3.16Å; R479-Q483 WeakPolarHBondContact O-CB 3.32Å; R479-Q483 WeakPolarHBondContact O-CG 3.07Å; R479-Q483 PolarHBondContact O-N 3.45Å
480C80.1Confident75.4Confident66 Ų6699.7 Ų99.745%0.44645%0.451SS..Hα-helixtrans-62.2-45.8178-169.70000110.9Q476 F477 N482 Q483 V484Q476-C480 WeakPolarHBondContact O-CB 3.17Å; Q476-C480 PolarHBondContact O-N 2.94Å; F477-C480 PolarHBondContact O-N 2.98Å; C480-N482 VanDerWaalsContact C-N 3.32Å; C480-N482 PolarHBondContact O-N 3.4Å; C480-Q483 PolarHBondContact O-N 3.43Å; C480-Q483 VanDerWaalsContact O-N 3.16Å; C480-V484 VanDerWaalsContact O-CG2 3.31Å; C480-V484 WeakPolarHBondContact O-CG2 3.43Å; C480-V484 PolarHBondContact O-N 3.16Å
481K79.3Confident73.9Confident133 Ų133107.5 Ų107.558%0.57849%0.485SS*.Hα-helixtrans-59.6-41.3175.4-173.9177178.5178.30112F477 K478 R485F477-K481 HydrophobicContact CE1-CD 4.25Å; F477-K481 VanDerWaalsContact O-CB 3.25Å; F477-K481 WeakPolarHBondContact O-CB 3.41Å; F477-K481 PolarHBondContact O-N 3.44Å; K478-K481 PolarHBondContact O-N 3.29Å; K481-R485 VanDerWaalsContact O-CB 3.27Å; K481-R485 WeakPolarHBondContact O-CB 3.37Å; K481-R485 PolarHBondContact O-N 2.96Å
482N83.4Confident72.1Confident44 Ų44112 Ų11224%0.23551%0.512CS..Hα-helixtrans-69.1-38.4176.3-70.7-0.9000111.6K478 R479 C480 R485 K486K478-N482 VanDerWaalsContact O-CB 3.31Å; K478-N482 WeakPolarHBondContact O-CB 3.15Å; K478-N482 PolarHBondContact O-N 2.9Å; K478-N482 PolarHBondContact O-OD1 2.92Å; R479-N482 PolarHBondContact O-N 3.16Å; C480-N482 VanDerWaalsContact C-N 3.32Å; C480-N482 PolarHBondContact O-N 3.4Å; N482-R485 PolarHBondContact O-N 2.87Å; N482-K486 WeakPolarHBondContact O-CG 3.32Å; N482-K486 PolarHBondContact O-N 2.87Å
483Q79.1Confident70.5Confident134 Ų134113.7 Ų113.763%0.62653%0.526SS*.Hα-helixtrans-64.7-44173.8-79.1-176.8-39.700112.1R479 C480 K486 H487R479-Q483 WeakPolarHBondContact O-CB 3.32Å; R479-Q483 WeakPolarHBondContact O-CG 3.07Å; R479-Q483 PolarHBondContact O-N 3.45Å; C480-Q483 PolarHBondContact O-N 3.43Å; C480-Q483 VanDerWaalsContact O-N 3.16Å; Q483-K486 PolarHBondContact O-N 3.18Å; Q483-H487 PolarHBondContact O-N 3.43Å
484V75.3Confident68.7Low91 Ų91115.7 Ų115.755%0.55254%0.543SS*.Hα-helixtrans-64.7-41175.3173.10000110.8C480 K486 H487 S488C480-V484 VanDerWaalsContact O-CG2 3.31Å; C480-V484 WeakPolarHBondContact O-CG2 3.43Å; C480-V484 PolarHBondContact O-N 3.16Å; V484-K486 VanDerWaalsContact C-N 3.32Å; V484-K486 PolarHBondContact O-N 2.81Å; V484-H487 PolarHBondContact O-N 3.26Å; V484-S488 WeakPolarHBondContact O-CB 3.4Å; V484-S488 PolarHBondContact O-N 2.99Å
485R75Confident66.8Low150 Ų150119.9 Ų119.957%0.56657%0.571SS**Hα-helixtrans-63.4-37.1174.7-176.7174.3157.4137.9-6.2112K481 N482 R489K481-R485 VanDerWaalsContact O-CB 3.27Å; K481-R485 WeakPolarHBondContact O-CB 3.37Å; K481-R485 PolarHBondContact O-N 2.96Å; N482-R485 PolarHBondContact O-N 2.87Å; R485-R489 PolarHBondContact O-N 2.79Å
486K71.4Confident64.5Low102 Ų102123.5 Ų123.544%0.44359%0.59SS.*Hα-helixtrans-64.6-49.5171.7-73.9176.5-175.2-178.20110.7N482 Q483 V484 S488 R489 Y490 E516N482-K486 WeakPolarHBondContact O-CG 3.32Å; N482-K486 PolarHBondContact O-N 2.87Å; Q483-K486 PolarHBondContact O-N 3.18Å; V484-K486 VanDerWaalsContact C-N 3.32Å; V484-K486 PolarHBondContact O-N 2.81Å; K486-S488 VanDerWaalsContact C-N 3.33Å; K486-S488 PolarHBondContact O-N 2.96Å; K486-R489 PolarHBondContact O-N 3.04Å; K486-Y490 WeakPolarHBondContact O-CD2 3.27Å; K486-Y490 PolarHBondContact O-N 3.19Å; K486-E516 WeakPolarHBondContact CE-OE2 3.3Å; K486-E516 IonicContact NZ-OE2 3.39Å; K486-E516 PolarHBondContact NZ-OE2 3.31Å
487H67.6Low62.2Low151 Ų151128 Ų12870%0.69961%0.608SS**Hα-helixtrans-60.4-38.7176.7-115.274.4000113.3Q483 V484 R489 Y490 F491Q483-H487 PolarHBondContact O-N 3.43Å; V484-H487 PolarHBondContact O-N 3.26Å; H487-R489 VanDerWaalsContact C-N 3.33Å; H487-R489 PolarHBondContact O-N 2.87Å; H487-Y490 PolarHBondContact O-N 3.45Å; H487-Y490 VanDerWaalsContact O-N 3.15Å; H487-F491 PolarHBondContact O-N 3.36Å; H487-F491 VanDerWaalsContact O-N 3.15Å
488S66.2Low59.9Low73 Ų73127.8 Ų127.851%0.5162%0.618SS.*Hα-helixtrans-65.9-31.6176.9-178.10000112.8V484 K486V484-S488 WeakPolarHBondContact O-CB 3.4Å; V484-S488 PolarHBondContact O-N 2.99Å; K486-S488 VanDerWaalsContact C-N 3.33Å; K486-S488 PolarHBondContact O-N 2.96Å
489R49.1Very low57.9Low137 Ų137131 Ų13152%0.51765%0.646SS.*Hα-helixtrans-70.2-30.4172.3-78.4-168.1-172.9166.10.3112.2R485 K486 H487 E512R485-R489 PolarHBondContact O-N 2.79Å; K486-R489 PolarHBondContact O-N 3.04Å; H487-R489 VanDerWaalsContact C-N 3.33Å; H487-R489 PolarHBondContact O-N 2.87Å; R489-E512 IonicContact CZ-OE1 3.32Å; R489-E512 IonicContact CZ-OE2 3.16Å; R489-E512 IonicContact NH1-OE1 2.7Å; R489-E512 IonicContact NH1-OE2 3.12Å; R489-E512 PolarHBondContact NH1-OE2 2.94Å; R489-E512 IonicContact NH2-OE1 3.71Å; R489-E512 PolarHBondContact NH2-OE1 2.83Å; R489-E512 VanDerWaalsContact NH2-OE1 3.17Å; R489-E512 IonicContact NH2-OE2 3.31Å; R489-E512 PolarHBondContact NH2-OE2 2.91Å
490Y48.5Very low55.6Low203 Ų203131.2 Ų131.280%0.79666%0.661SS**Hα-helixtrans-77.3-22.6175.8-75.8-77.8000113.8K486 H487K486-Y490 WeakPolarHBondContact O-CD2 3.27Å; K486-Y490 PolarHBondContact O-N 3.19Å; H487-Y490 PolarHBondContact O-N 3.45Å; H487-Y490 VanDerWaalsContact O-N 3.15Å
491F49.2Very low53.6Low176 Ų176133.2 Ų133.277%0.77267%0.671SS**Hα-helixtrans-85.1-12.1178.8-166.8-99.2000113.9H487 L493H487-F491 PolarHBondContact O-N 3.36Å; H487-F491 VanDerWaalsContact O-N 3.15Å; F491-L493 PolarHBondContact O-N 3.17Å; F491-L493 VanDerWaalsContact O-N 3.16Å
492V42.8Very low51.8Low110 Ų110131.9 Ų131.967%0.66768%0.679SS**SBendtrans-68.7114.1167.4-179.70000107.5
493L46.7Very low50Low147 Ų147133.3 Ų133.377%0.7769%0.692SS**  trans-51.8137.3-175.1-78.5112.2000112F491 D495F491-L493 PolarHBondContact O-N 3.17Å; F491-L493 VanDerWaalsContact O-N 3.16Å; L493-D495 PolarHBondContact O-N 2.94Å
494P44.1Very low48.5Very low124 Ų124130.8 Ų130.881%0.80569%0.686SS**  trans-68105.3174.626.8-30.3000108.8K496P494-K496 PolarHBondContact O-N 3.23Å
495D39.7Very low47Very low161 Ų161129.7 Ų129.786%0.86168%0.682SS**  trans-71126.4173.1-145.6-3.9000109.1L493 K497L493-D495 PolarHBondContact O-N 2.94Å; D495-K497 PolarHBondContact O-N 3.05Å; D495-K497 VanDerWaalsContact O-N 3.13Å
496K33.4Very low45.5Very low190 Ų190127.5 Ų127.583%0.82668%0.681SS**  trans-7599.7-167.2-170.4-177.8-171.4179.40109P494P494-K496 PolarHBondContact O-N 3.23Å
497K33.2Very low44.3Very low194 Ų194130 Ų13084%0.84369%0.692SS**  trans-159.1110.3159.7-105.4153-166-176.90114.1D495D495-K497 PolarHBondContact O-N 3.05Å; D495-K497 VanDerWaalsContact O-N 3.13Å
498T31Very low43.4Very low130 Ų130129 Ų12980%0.79869%0.688SS**  trans52.2103.9143.636.80000119.4T500T498-T500 PolarHBondContact O-N 3.37Å
499S39.3Very low42.4Very low116 Ų116128.1 Ų128.181%0.81169%0.685SS**  trans-22119.4150.7-48.70000113.9
500T34Very low42.2Very low124 Ų124127.5 Ų127.576%0.76169%0.688SS**  163.887127.4-58.70000108.2T498T498-T500 PolarHBondContact O-N 3.37Å
501T37.5Very low42.4Very low107 Ų107120.6 Ų120.666%0.65667%0.673SS**  trans163.668.5150.5330000110.7S503T501-S503 PolarHBondContact O-N 3.1Å
502S41.5Very low42.4Very low105 Ų105115.9 Ų115.973%0.73465%0.653SS**THydrogen-bonded Turntrans-73.916.3179.3-310000114.6
503S44.7Very low42.6Very low75 Ų75113.1 Ų113.152%0.52464%0.639SS.*THydrogen-bonded Turntrans-115.6-15.3-171.961.20000115T501T501-S503 PolarHBondContact O-N 3.1Å
504V48.3Very low42.8Very low81 Ų81111.2 Ų111.249%0.49163%0.629SS.*Hα-helixtrans-88.2-38.7-179.8-178.40000111D506 K507 E508V504-D506 VanDerWaalsContact C-N 3.3Å; V504-D506 PolarHBondContact O-N 3.06Å; V504-K507 PolarHBondContact O-N 3.31Å; V504-E508 PolarHBondContact O-N 2.93Å; V504-E508 VanDerWaalsContact O-N 3.16Å
505S44.3Very low43.1Very low67 Ų67108.4 Ų108.447%0.46961%0.612SS.*Hα-helixtrans-59.3-39.6177.655.10000113A509S505-A509 WeakPolarHBondContact O-CB 3.12Å; S505-A509 PolarHBondContact O-N 3.49Å; S505-A509 VanDerWaalsContact O-N 3.08Å
506D43.6Very low43.6Very low104 Ų104103.4 Ų103.456%0.55658%0.584SS**Hα-helixtrans-75.3-34.6-173.9-63.8-3.1000111.3V504 A509 E510V504-D506 VanDerWaalsContact C-N 3.3Å; V504-D506 PolarHBondContact O-N 3.06Å; D506-A509 PolarHBondContact O-N 3.01Å; D506-E510 WeakPolarHBondContact O-CB 3.22Å; D506-E510 PolarHBondContact O-N 3.49Å
507K46.5Very low44.2Very low154 Ų15498.1 Ų98.167%0.6757%0.571SS**Hα-helixtrans-72.7-37.3176.9-75-173.5176.9-179.80113V504 E510 A511V504-K507 PolarHBondContact O-N 3.31Å; K507-E510 PolarHBondContact O-N 3.47Å; K507-A511 VanDerWaalsContact O-CB 3.3Å; K507-A511 WeakPolarHBondContact O-CB 3.48Å; K507-A511 PolarHBondContact O-N 2.63Å
508E47.4Very low45Very low131 Ų13192 Ų9261%0.61255%0.552SS**Hα-helixtrans-68.1-38.5173.4-73.4-179.4171.500111.2V504 A511 E512V504-E508 PolarHBondContact O-N 2.93Å; V504-E508 VanDerWaalsContact O-N 3.16Å; E508-A511 PolarHBondContact O-N 2.85Å; E508-E512 WeakPolarHBondContact O-CB 3.43Å; E508-E512 PolarHBondContact O-N 3.46Å
509A46.9Very low45.6Very low55 Ų5588.1 Ų88.146%0.45553%0.53SS..Hα-helixtrans-65.6-40.3173.500000112.6S505 D506 S513S505-A509 WeakPolarHBondContact O-CB 3.12Å; S505-A509 PolarHBondContact O-N 3.49Å; S505-A509 VanDerWaalsContact O-N 3.08Å; D506-A509 PolarHBondContact O-N 3.01Å; A509-S513 WeakPolarHBondContact O-CB 3.49Å; A509-S513 PolarHBondContact O-N 2.77Å
510E44.7Very low46Very low123 Ų12386.4 Ų86.458%0.57551%0.512SS*.Hα-helixtrans-65.4-45.3173.1-96.6-174.7155.400111.7D506 K507 E512 S513 I514D506-E510 WeakPolarHBondContact O-CB 3.22Å; D506-E510 PolarHBondContact O-N 3.49Å; K507-E510 PolarHBondContact O-N 3.47Å; E510-E512 PolarHBondContact O-N 3.3Å; E510-S513 WeakPolarHBondContact CA-OG 3.32Å; E510-S513 PolarHBondContact O-N 3.46Å; E510-S513 VanDerWaalsContact O-N 3.09Å; E510-S513 PolarHBondContact O-OG 2.89Å; E510-I514 WeakPolarHBondContact O-CB 3.36Å; E510-I514 VanDerWaalsContact O-CG1 3.23Å; E510-I514 WeakPolarHBondContact O-CG1 3.39Å; E510-I514 PolarHBondContact O-N 2.9Å
511A51.1Low46.5Very low58 Ų5885 Ų8548%0.47951%0.507SS..Hα-helixtrans-64.2-38.517800000112.7K507 E508 S515K507-A511 VanDerWaalsContact O-CB 3.3Å; K507-A511 WeakPolarHBondContact O-CB 3.48Å; K507-A511 PolarHBondContact O-N 2.63Å; E508-A511 PolarHBondContact O-N 2.85Å; A511-S515 WeakPolarHBondContact O-CB 3.5Å; A511-S515 PolarHBondContact O-N 3.42Å; A511-S515 PolarHBondContact O-OG 2.78Å
512E51Low46.8Very low77 Ų7784.4 Ų84.436%0.3650%0.503SS..Hα-helixtrans-63.8-40.7169.3-82.5-168.315400111R489 E508 E510 S515 E516R489-E512 IonicContact CZ-OE1 3.32Å; R489-E512 IonicContact CZ-OE2 3.16Å; R489-E512 IonicContact NH1-OE1 2.7Å; R489-E512 IonicContact NH1-OE2 3.12Å; R489-E512 PolarHBondContact NH1-OE2 2.94Å; R489-E512 IonicContact NH2-OE1 3.71Å; R489-E512 PolarHBondContact NH2-OE1 2.83Å; R489-E512 VanDerWaalsContact NH2-OE1 3.17Å; R489-E512 IonicContact NH2-OE2 3.31Å; R489-E512 PolarHBondContact NH2-OE2 2.91Å; E508-E512 WeakPolarHBondContact O-CB 3.43Å; E508-E512 PolarHBondContact O-N 3.46Å; E510-E512 PolarHBondContact O-N 3.3Å; E512-S515 WeakPolarHBondContact CA-OG 3.48Å; E512-S515 PolarHBondContact O-OG 3.27Å; E512-S515 VanDerWaalsContact O-OG 3.08Å; E512-E516 VanDerWaalsContact O-CB 3.25Å; E512-E516 WeakPolarHBondContact O-CB 3.34Å; E512-E516 VanDerWaalsContact O-CG 3.26Å; E512-E516 WeakPolarHBondContact O-CG 3.45Å; E512-E516 PolarHBondContact O-N 3.48Å
513S46Very low47.2Very low53 Ų5386 Ų8637%0.37150%0.504SS..Hα-helixtrans-68.4-35.1178.279.40000113.8A509 E510 S517A509-S513 WeakPolarHBondContact O-CB 3.49Å; A509-S513 PolarHBondContact O-N 2.77Å; E510-S513 WeakPolarHBondContact CA-OG 3.32Å; E510-S513 PolarHBondContact O-N 3.46Å; E510-S513 VanDerWaalsContact O-N 3.09Å; E510-S513 PolarHBondContact O-OG 2.89Å; S513-S517 WeakPolarHBondContact O-CB 3.42Å; S513-S517 PolarHBondContact O-N 3.01Å; S513-S517 PolarHBondContact O-OG 3.47Å; S513-S517 VanDerWaalsContact O-OG 3.08Å
514I51.7Low47.6Very low106 Ų10684.1 Ų84.154%0.54449%0.489SS..Hα-helixtrans-76-39.9178.2-65.4163.9000110.4E510 S517 S518E510-I514 WeakPolarHBondContact O-CB 3.36Å; E510-I514 VanDerWaalsContact O-CG1 3.23Å; E510-I514 WeakPolarHBondContact O-CG1 3.39Å; E510-I514 PolarHBondContact O-N 2.9Å; I514-S517 WeakPolarHBondContact CA-OG 3.35Å; I514-S517 PolarHBondContact O-OG 2.84Å; I514-S518 PolarHBondContact O-N 3.38Å; I514-S518 VanDerWaalsContact O-N 3.08Å; I514-S518 PolarHBondContact O-OG 3.28Å
515S49.9Very low48Very low65 Ų6588 Ų8846%0.45550%0.502SS..Hα-helixtrans-68.6-35.1172.958.50000112.5A511 E512 S518 S519A511-S515 WeakPolarHBondContact O-CB 3.5Å; A511-S515 PolarHBondContact O-N 3.42Å; A511-S515 PolarHBondContact O-OG 2.78Å; E512-S515 WeakPolarHBondContact CA-OG 3.48Å; E512-S515 PolarHBondContact O-OG 3.27Å; E512-S515 VanDerWaalsContact O-OG 3.08Å; S515-S518 WeakPolarHBondContact CA-OG 3.45Å; S515-S518 PolarHBondContact O-OG 3.41Å; S515-S518 VanDerWaalsContact O-OG 3.05Å; S515-S519 WeakPolarHBondContact O-CB 3.38Å; S515-S519 PolarHBondContact O-N 2.99Å
516E50.2Low49Very low57 Ų5785.7 Ų85.727%0.26648%0.484SS..Hα-helixtrans-66.2-45.8172.7-80.7-178168.900111.9K486 E512 S518 S519 D520K486-E516 WeakPolarHBondContact CE-OE2 3.3Å; K486-E516 IonicContact NZ-OE2 3.39Å; K486-E516 PolarHBondContact NZ-OE2 3.31Å; E512-E516 VanDerWaalsContact O-CB 3.25Å; E512-E516 WeakPolarHBondContact O-CB 3.34Å; E512-E516 VanDerWaalsContact O-CG 3.26Å; E512-E516 WeakPolarHBondContact O-CG 3.45Å; E512-E516 PolarHBondContact O-N 3.48Å; E516-S518 VanDerWaalsContact C-N 3.34Å; E516-S518 PolarHBondContact O-N 2.8Å; E516-S519 PolarHBondContact O-N 3.4Å; E516-S519 PolarHBondContact O-OG 3.33Å; E516-D520 PolarHBondContact O-N 2.78Å
517S45.9Very low50.3Low79 Ų7983.6 Ų83.655%0.55248%0.476SS*.Hα-helixtrans-67.3-31179.860.10000113.6S513 I514S513-S517 WeakPolarHBondContact O-CB 3.42Å; S513-S517 PolarHBondContact O-N 3.01Å; S513-S517 PolarHBondContact O-OG 3.47Å; S513-S517 VanDerWaalsContact O-OG 3.08Å; I514-S517 WeakPolarHBondContact CA-OG 3.35Å; I514-S517 PolarHBondContact O-OG 2.84Å
518S49Very low51.8Low66 Ų6677.9 Ų77.946%0.46245%0.454SS..Hα-helixtrans-73.9-35.7172.247.20000112.4I514 S515 E516 D520 S521I514-S518 PolarHBondContact O-N 3.38Å; I514-S518 VanDerWaalsContact O-N 3.08Å; I514-S518 PolarHBondContact O-OG 3.28Å; S515-S518 WeakPolarHBondContact CA-OG 3.45Å; S515-S518 PolarHBondContact O-OG 3.41Å; S515-S518 VanDerWaalsContact O-OG 3.05Å; E516-S518 VanDerWaalsContact C-N 3.34Å; E516-S518 PolarHBondContact O-N 2.8Å; S518-D520 VanDerWaalsContact C-N 3.27Å; S518-D520 PolarHBondContact O-N 3.24Å; S518-S521 PolarHBondContact O-N 3.32Å; S518-S521 PolarHBondContact O-OG 3.16Å
519S45.4Very low53.5Low47 Ų4776.9 Ų76.933%0.32946%0.457SS..Hα-helixtrans-70.3-14.4175.179.90000115.3S515 E516 S521 T522S515-S519 WeakPolarHBondContact O-CB 3.38Å; S515-S519 PolarHBondContact O-N 2.99Å; E516-S519 PolarHBondContact O-N 3.4Å; E516-S519 PolarHBondContact O-OG 3.33Å; S519-S521 VanDerWaalsContact C-N 3.3Å; S519-T522 PolarHBondContact O-OG1 3.25Å
520D46.6Very low55.1Low80 Ų8077.1 Ų77.143%0.42845%0.449SS..THydrogen-bonded Turntrans-81.7-12.1174.9-100.89.6000112.5K478 E516 S518K478-D520 IonicContact NZ-OD1 2.78Å; K478-D520 PolarHBondContact NZ-OD1 3.05Å; E516-D520 PolarHBondContact O-N 2.78Å; S518-D520 VanDerWaalsContact C-N 3.27Å; S518-D520 PolarHBondContact O-N 3.24Å
521S44.9Very low57Low95 Ų9571.3 Ų71.366%0.66442%0.422SS*.SBendtrans-94.4-13.2176.470.40000114.6S518 S519 D523S518-S521 PolarHBondContact O-N 3.32Å; S518-S521 PolarHBondContact O-OG 3.16Å; S519-S521 VanDerWaalsContact C-N 3.3Å; S521-D523 PolarHBondContact O-N 2.81Å
522T44.3Very low58.6Low94 Ų9471.9 Ų71.958%0.57742%0.415SS*.SBendtrans-69.3119.4169.332.70000109.1S519 V524S519-T522 PolarHBondContact O-OG1 3.25Å; T522-V524 WeakPolarHBondContact O-CG2 3.43Å; T522-V524 PolarHBondContact O-N 3.46Å
523D49.7Very low60.4Low138 Ų13872.5 Ų72.574%0.73843%0.425SS*.  trans-42.6107175.9-72.6-47000110.4S521 H525S521-D523 PolarHBondContact O-N 2.81Å; D523-H525 PolarHBondContact O-N 3.16Å
524V51.9Low62.5Low37 Ų3771.8 Ų71.822%0.22442%0.418CS..  trans-75.385178.3-170.70000106.6Y474 T522 L526Y474-V524 HydrophobicContact CD1-CG1 3.65Å; Y474-V524 HydrophobicContact CE1-CG1 3.41Å; Y474-V524 VanDerWaalsContact CE1-CG1 3.41Å; T522-V524 WeakPolarHBondContact O-CG2 3.43Å; T522-V524 PolarHBondContact O-N 3.46Å; V524-L526 PolarHBondContact O-N 2.94Å; V524-L526 VanDerWaalsContact O-N 3.16Å
525H57.7Low64.3Low162 Ų16268.1 Ų68.175%0.7540%0.399SS*.PPolyproline II helixtrans-57.4119.6167.8-73.9-83.7000107.8D523 P527D523-H525 PolarHBondContact O-N 3.16Å; H525-P527 WeakPolarHBondContact O-CD 3.34Å; H525-P527 VanDerWaalsContact O-N 3.13Å
526L64.7Low66.4Low19 Ų1969.3 Ų69.310%0.09940%0.404CS..PPolyproline II helixtrans-57.3116.3176179.461.5000108.2I470 V524 V528 M530 M597 L601I470-L526 HydrophobicContact CB-CD2 4.28Å; I470-L526 HydrophobicContact CG2-CD1 3.62Å; I470-L526 HydrophobicContact CG2-CD2 3.65Å; I470-L526 HydrophobicContact CG2-CG 4.32Å; V524-L526 PolarHBondContact O-N 2.94Å; V524-L526 VanDerWaalsContact O-N 3.16Å; L526-V528 PolarHBondContact O-N 3.44Å; L526-M530 HydrophobicContact CD1-CB 4.12Å; L526-M530 HydrophobicContact CD1-CG 4.09Å; L526-M530 HydrophobicContact CD1-SD 3.55Å; L526-M530 VanDerWaalsContact CD1-SD 3.55Å; L526-M597 HydrophobicContact CD2-CE 3.44Å; L526-M597 VanDerWaalsContact CD2-CE 3.44Å; L526-L601 HydrophobicContact CD2-CD1 3.79Å; L526-L601 HydrophobicContact CG-CD1 4.48Å
527P71.7Confident68.4Low60 Ų6069.5 Ų69.539%0.3941%0.411SS..PPolyproline II helixtrans-61.6128.7179.5-23.134.6000109.5H525 V529 M530 A531H525-P527 WeakPolarHBondContact O-CD 3.34Å; H525-P527 VanDerWaalsContact O-N 3.13Å; P527-V529 PolarHBondContact O-N 3.41Å; P527-M530 WeakPolarHBondContact O-CA 3.35Å; P527-M530 VanDerWaalsContact O-CB 3.31Å; P527-M530 WeakPolarHBondContact O-CB 3.3Å; P527-M530 PolarHBondContact O-N 2.78Å; P527-A531 PolarHBondContact O-N 3.27Å
528V77.5Confident70.8Confident33 Ų3367.6 Ų67.620%0.239%0.392CS..Hα-helixtrans-53.1-33.1179.9170.30000112.4L526 M530 A531 M532 L601 A602 E605L526-V528 PolarHBondContact O-N 3.44Å; V528-M530 VanDerWaalsContact C-N 3.26Å; V528-M530 PolarHBondContact O-N 2.83Å; V528-A531 PolarHBondContact O-N 3.3Å; V528-A531 VanDerWaalsContact O-N 3.16Å; V528-M532 HydrophobicContact CG1-CG 4.3Å; V528-M532 WeakPolarHBondContact O-CG 3.45Å; V528-M532 PolarHBondContact O-N 2.88Å; V528-L601 HydrophobicContact CG2-CB 4.24Å; V528-L601 WeakPolarHBondContact CG2-O 3.47Å; V528-A602 HydrophobicContact CG1-CB 4.05Å; V528-E605 HydrophobicContact CB-CG 4.4Å; V528-E605 HydrophobicContact CG2-CB 4.15Å; V528-E605 HydrophobicContact CG2-CG 3.43Å; V528-E605 VanDerWaalsContact CG2-CG 3.43Å
529V82.2Confident72.9Confident111 Ų11164.7 Ų64.767%0.67337%0.371SS*.Hα-helixtrans-56.9-40174.5-178.60000111.7P527 M532 V533P527-V529 PolarHBondContact O-N 3.41Å; V529-M532 PolarHBondContact O-N 3.26Å; V529-V533 VanDerWaalsContact O-CG2 3.28Å; V529-V533 WeakPolarHBondContact O-CG2 3.45Å; V529-V533 PolarHBondContact O-N 3.13Å
530M81.6Confident75.4Confident59 Ų5963.7 Ų63.729%0.29137%0.366SS..Hα-helixtrans-67.8-42177.6-174175.9176.600111.4I470 Y474 L526 P527 V528 M532 V533 V534I470-M530 HydrophobicContact CG2-CE 4.05Å; Y474-M530 HydrophobicContact CD2-CE 4.08Å; Y474-M530 HydrophobicContact CD2-SD 3.62Å; Y474-M530 HydrophobicContact CE2-SD 4.33Å; Y474-M530 HydrophobicContact CG-SD 4.32Å; L526-M530 HydrophobicContact CD1-CB 4.12Å; L526-M530 HydrophobicContact CD1-CG 4.09Å; L526-M530 HydrophobicContact CD1-SD 3.55Å; L526-M530 VanDerWaalsContact CD1-SD 3.55Å; P527-M530 WeakPolarHBondContact O-CA 3.35Å; P527-M530 VanDerWaalsContact O-CB 3.31Å; P527-M530 WeakPolarHBondContact O-CB 3.3Å; P527-M530 PolarHBondContact O-N 2.78Å; V528-M530 VanDerWaalsContact C-N 3.26Å; V528-M530 PolarHBondContact O-N 2.83Å; M530-M532 VanDerWaalsContact C-N 3.34Å; M530-M532 PolarHBondContact O-N 3.46Å; M530-V533 PolarHBondContact O-N 3.4Å; M530-V534 WeakPolarHBondContact O-CG2 3.43Å; M530-V534 PolarHBondContact O-N 2.73Å
531A84Confident77.7Confident1 Ų163.7 Ų63.71%0.00837%0.369CS..Hα-helixtrans-60.7-43.9175.600000111.3P527 V528 V533 V534 L535 C598 L601P527-A531 PolarHBondContact O-N 3.27Å; V528-A531 PolarHBondContact O-N 3.3Å; V528-A531 VanDerWaalsContact O-N 3.16Å; A531-V533 PolarHBondContact O-N 3.08Å; A531-V534 WeakPolarHBondContact O-CB 3.22Å; A531-V534 PolarHBondContact O-N 2.78Å; A531-V534 VanDerWaalsContact O-N 3.16Å; A531-L535 PolarHBondContact O-N 3.16Å; A531-C598 PolarHBondContact O-SG 2.92Å; A531-C598 VanDerWaalsContact O-SG 3.36Å; A531-L601 HydrophobicContact CB-CD1 3.85Å
532M85.5Confident80.1Confident70 Ų7059.2 Ų59.235%0.34534%0.337SS..Hα-helixtrans-61.6-41.1175-70.3-66.614600112.5V528 V529 M530 V534 L535 V536 C598 A602V528-M532 HydrophobicContact CG1-CG 4.3Å; V528-M532 WeakPolarHBondContact O-CG 3.45Å; V528-M532 PolarHBondContact O-N 2.88Å; V529-M532 PolarHBondContact O-N 3.26Å; M530-M532 VanDerWaalsContact C-N 3.34Å; M530-M532 PolarHBondContact O-N 3.46Å; M532-V534 VanDerWaalsContact C-N 3.32Å; M532-V534 PolarHBondContact O-N 3.07Å; M532-L535 PolarHBondContact O-N 2.76Å; M532-V536 WeakPolarHBondContact O-CG2 3.45Å; M532-V536 PolarHBondContact O-N 3.03Å; M532-C598 HydrophobicContact CE-CB 4.04Å; M532-A602 HydrophobicContact CE-CB 3.76Å
533V88.4Confident82.6Confident91 Ų9154.7 Ų54.755%0.55231%0.31SS*.Hα-helixtrans-63.1-38.6174.9169.60000111.5V529 M530 A531 S537V529-V533 VanDerWaalsContact O-CG2 3.28Å; V529-V533 WeakPolarHBondContact O-CG2 3.45Å; V529-V533 PolarHBondContact O-N 3.13Å; M530-V533 PolarHBondContact O-N 3.4Å; A531-V533 PolarHBondContact O-N 3.08Å; V533-S537 WeakPolarHBondContact O-CB 3.2Å; V533-S537 PolarHBondContact O-N 3.32Å; V533-S537 PolarHBondContact O-OG 3.47Å
534V89.8Confident84.9Confident37 Ų3752.1 Ų52.122%0.22430%0.296CS..Hα-helixtrans-65.6-41.1175.7171.80000111.4I470 M530 A531 M532 S537 Y538 L594I470-V534 HydrophobicContact CD1-CG1 4.29Å; M530-V534 WeakPolarHBondContact O-CG2 3.43Å; M530-V534 PolarHBondContact O-N 2.73Å; A531-V534 WeakPolarHBondContact O-CB 3.22Å; A531-V534 PolarHBondContact O-N 2.78Å; A531-V534 VanDerWaalsContact O-N 3.16Å; M532-V534 VanDerWaalsContact C-N 3.32Å; M532-V534 PolarHBondContact O-N 3.07Å; V534-S537 WeakPolarHBondContact CA-OG 3.42Å; V534-S537 PolarHBondContact O-N 2.96Å; V534-S537 PolarHBondContact O-OG 3.17Å; V534-Y538 VanDerWaalsContact O-CB 3.24Å; V534-Y538 WeakPolarHBondContact O-CB 3.26Å; V534-Y538 PolarHBondContact O-N 3.3Å; V534-L594 HydrophobicContact CG1-CD2 4.2Å
535L90.6Very high86.9Confident30 Ų3053 Ų5316%0.15730%0.298CS..Hα-helixtrans-65-44.5177.1-175.663000111.9A531 M532 Y538 T539 T595 C598A531-L535 PolarHBondContact O-N 3.16Å; M532-L535 PolarHBondContact O-N 2.76Å; L535-Y538 PolarHBondContact O-N 3.43Å; L535-T539 WeakPolarHBondContact O-CG2 3.48Å; L535-T539 PolarHBondContact O-N 3.01Å; L535-T539 PolarHBondContact O-OG1 3.43Å; L535-T595 WeakPolarHBondContact CD1-OG1 3.44Å; L535-C598 HydrophobicContact CD2-CB 4.1Å
536V92.5Very high88.7Confident90 Ų9045.3 Ų45.355%0.54526%0.263SS..Hα-helixtrans-66.4-38.9177.6173.70000111.3M532 T539 A540M532-V536 WeakPolarHBondContact O-CG2 3.45Å; M532-V536 PolarHBondContact O-N 3.03Å; V536-T539 WeakPolarHBondContact CA-OG1 3.43Å; V536-T539 PolarHBondContact O-OG1 3.21Å; V536-A540 WeakPolarHBondContact O-CB 3.49Å; V536-A540 PolarHBondContact O-N 2.77Å
537S93.6Very high90.2Very high60 Ų6048 Ų4842%0.4228%0.275SS..Hα-helixtrans-70.1-37.3176.768.50000112V533 V534 A540 V541V533-S537 WeakPolarHBondContact O-CB 3.2Å; V533-S537 PolarHBondContact O-N 3.32Å; V533-S537 PolarHBondContact O-OG 3.47Å; V534-S537 WeakPolarHBondContact CA-OG 3.42Å; V534-S537 PolarHBondContact O-N 2.96Å; V534-S537 PolarHBondContact O-OG 3.17Å; S537-A540 PolarHBondContact O-N 2.64Å; S537-V541 WeakPolarHBondContact O-CG2 3.21Å; S537-V541 PolarHBondContact O-N 3.46Å
538Y95Very high91.2Very high39 Ų3952.2 Ų52.215%0.15329%0.291CS..Hα-helixtrans-64.5-42.4176.4-175.9-94.4000112.6V534 L535 V541 G542 M565 Y587 V590 G591 L594V534-Y538 VanDerWaalsContact O-CB 3.24Å; V534-Y538 WeakPolarHBondContact O-CB 3.26Å; V534-Y538 PolarHBondContact O-N 3.3Å; L535-Y538 PolarHBondContact O-N 3.43Å; Y538-V541 PolarHBondContact O-N 3.26Å; Y538-G542 PolarHBondContact O-N 3.05Å; Y538-M565 HydrophobicContact CE1-SD 4.14Å; Y538-Y587 HydrophobicContact CD1-CE2 4.09Å; Y538-Y587 HydrophobicContact CE1-CD2 4.01Å; Y538-Y587 HydrophobicContact CE1-CE1 4.2Å; Y538-Y587 AromaticContact CE1-CE2 3.34Å; Y538-Y587 HydrophobicContact CE1-CE2 3.34Å; Y538-Y587 AromaticContact CE1-CZ 3.42Å; Y538-Y587 VanDerWaalsContact CE1-CZ 3.42Å; Y538-Y587 WeakPolarHBondContact CE1-OH 3.36Å; Y538-Y587 HydrophobicContact CE2-CD2 4.4Å; Y538-Y587 HydrophobicContact CE2-CE2 4.07Å; Y538-Y587 AromaticContact CZ-CD2 3.62Å; Y538-Y587 AromaticContact CZ-CE2 3.34Å; Y538-Y587 AromaticContact CZ-CZ 3.94Å; Y538-Y587 PolarHBondContact O-OH 3.01Å; Y538-Y587 WeakPolarHBondContact OH-CD2 3.45Å; Y538-Y587 WeakPolarHBondContact OH-CE2 3.38Å; Y538-Y587 PolarHBondContact OH-O 2.81Å; Y538-V590 HydrophobicContact CE2-CG1 4.04Å; Y538-G591 PolarHBondContact OH-N 3.3Å; Y538-L594 HydrophobicContact CD1-CD1 4.02Å; Y538-L594 HydrophobicContact CD2-CD1 3.43Å; Y538-L594 VanDerWaalsContact CD2-CD1 3.43Å; Y538-L594 HydrophobicContact CE1-CD1 4.32Å; Y538-L594 HydrophobicContact CE2-CD1 3.75Å; Y538-L594 HydrophobicContact CG-CD1 3.56Å
539T94.5Very high92Very high5 Ų553.3 Ų53.33%0.03129%0.292CS..Hα-helixtrans-66-38.2174.147.50000111.8L535 V536 G542 G543 M565L535-T539 WeakPolarHBondContact O-CG2 3.48Å; L535-T539 PolarHBondContact O-N 3.01Å; L535-T539 PolarHBondContact O-OG1 3.43Å; V536-T539 WeakPolarHBondContact CA-OG1 3.43Å; V536-T539 PolarHBondContact O-OG1 3.21Å; T539-G542 PolarHBondContact O-N 3.48Å; T539-G543 PolarHBondContact O-N 3.32Å; T539-M565 HydrophobicContact CG2-CB 4.42Å; T539-M565 HydrophobicContact CG2-CG 4Å
540A95.9Very high92.5Very high27 Ų2749.8 Ų49.822%0.22327%0.268CS..Hα-helixtrans-64.4-42.7173.900000113V536 S537 G542 G543 L544 F558V536-A540 WeakPolarHBondContact O-CB 3.49Å; V536-A540 PolarHBondContact O-N 2.77Å; S537-A540 PolarHBondContact O-N 2.64Å; A540-G542 VanDerWaalsContact C-N 3.34Å; A540-G543 PolarHBondContact O-N 2.85Å; A540-L544 PolarHBondContact O-N 2.99Å; A540-L544 VanDerWaalsContact O-N 3.14Å; A540-F558 HydrophobicContact CB-CE2 4.4Å
541V96.5Very high92.9Very high80 Ų8050 Ų5049%0.48529%0.286SS..Hα-helixtrans-63.7-41.3174.2171.10000110.8S537 Y538 G543 L544 L545S537-V541 WeakPolarHBondContact O-CG2 3.21Å; S537-V541 PolarHBondContact O-N 3.46Å; Y538-V541 PolarHBondContact O-N 3.26Å; V541-G543 VanDerWaalsContact C-N 3.33Å; V541-G543 PolarHBondContact O-N 3.36Å; V541-L544 PolarHBondContact O-N 3.08Å; V541-L545 HydrophobicContact CG1-CD1 4.2Å; V541-L545 HydrophobicContact CG1-CG 4.46Å; V541-L545 WeakPolarHBondContact O-CG 3.37Å; V541-L545 PolarHBondContact O-N 2.74Å
542G95.7Very high93.2Very high0 Ų052.4 Ų52.40%030%0.295CS..Hα-helixtrans-56.1-47.3171.700000112.3Y538 T539 A540 L544 L545 F546 Y587Y538-G542 PolarHBondContact O-N 3.05Å; T539-G542 PolarHBondContact O-N 3.48Å; A540-G542 VanDerWaalsContact C-N 3.34Å; G542-L544 VanDerWaalsContact C-N 3.28Å; G542-L544 PolarHBondContact O-N 3.01Å; G542-L545 PolarHBondContact O-N 3.05Å; G542-F546 VanDerWaalsContact O-CD2 3.29Å; G542-F546 WeakPolarHBondContact O-CD2 3.48Å; G542-F546 PolarHBondContact O-N 3.38Å; G542-Y587 WeakPolarHBondContact CA-OH 3.5Å
543G96.2Very high93.7Very high0 Ų050.9 Ų50.90%030%0.297CS..Hα-helixtrans-55-41.9176.400000112.9T539 A540 V541 Q547 A557 C561T539-G543 PolarHBondContact O-N 3.32Å; A540-G543 PolarHBondContact O-N 2.85Å; V541-G543 VanDerWaalsContact C-N 3.33Å; V541-G543 PolarHBondContact O-N 3.36Å; G543-Q547 VanDerWaalsContact O-CB 3.23Å; G543-Q547 WeakPolarHBondContact O-CB 3.5Å; G543-Q547 PolarHBondContact O-N 3.3Å; G543-A557 VanDerWaalsContact O-CB 3.28Å; G543-A557 WeakPolarHBondContact O-CB 3.26Å; G543-C561 PolarHBondContact N-SG 3.46Å
544L96.9Very high94Very high84 Ų8451 Ų5144%0.4429%0.288SS..Hα-helixtrans-66.5-40.6174.1-67.1174.6000112.7A540 V541 G542 M548 Y554A540-L544 PolarHBondContact O-N 2.99Å; A540-L544 VanDerWaalsContact O-N 3.14Å; V541-L544 PolarHBondContact O-N 3.08Å; G542-L544 VanDerWaalsContact C-N 3.28Å; G542-L544 PolarHBondContact O-N 3.01Å; L544-M548 WeakPolarHBondContact O-CG 3.5Å; L544-M548 PolarHBondContact O-N 3.45Å; L544-M548 VanDerWaalsContact O-N 3.11Å; L544-Y554 HydrophobicContact CD2-CD2 3.8Å; L544-Y554 HydrophobicContact CD2-CE2 3.64Å; L544-Y554 HydrophobicContact CG-CD2 4.39Å; L544-Y554 HydrophobicContact CG-CE2 3.85Å
545L95.4Very high94.3Very high54 Ų5452 Ų5228%0.28329%0.29SS..Hα-helixtrans-65.4-48.2178.8-70.7173.4000111.8V541 G542 Q547 M548 W549V541-L545 HydrophobicContact CG1-CD1 4.2Å; V541-L545 HydrophobicContact CG1-CG 4.46Å; V541-L545 WeakPolarHBondContact O-CG 3.37Å; V541-L545 PolarHBondContact O-N 2.74Å; G542-L545 PolarHBondContact O-N 3.05Å; L545-Q547 VanDerWaalsContact C-N 3.34Å; L545-Q547 PolarHBondContact O-N 2.77Å; L545-M548 WeakPolarHBondContact O-CB 3.42Å; L545-M548 PolarHBondContact O-N 3.27Å; L545-M548 VanDerWaalsContact O-N 3.07Å; L545-W549 HydrophobicContact CB-CH2 4.32Å; L545-W549 HydrophobicContact CB-CZ2 4.34Å; L545-W549 HydrophobicContact CB-CZ3 4.43Å; L545-W549 HydrophobicContact CD1-CH2 4.27Å; L545-W549 HydrophobicContact CD2-CZ2 4.05Å; L545-W549 WeakPolarHBondContact O-CB 3.28Å; L545-W549 VanDerWaalsContact O-CG 3.29Å; L545-W549 PolarHBondContact O-N 2.83Å
546F95.3Very high94.5Very high1 Ų153.5 Ų53.50%0.00430%0.298CS..Hα-helixtrans-69.9-31.5179.3-76.9-74.3000112.6G542 M548 W549 E550 W552 A557 F560 C561 P575 T584 Y587G542-F546 VanDerWaalsContact O-CD2 3.29Å; G542-F546 WeakPolarHBondContact O-CD2 3.48Å; G542-F546 PolarHBondContact O-N 3.38Å; F546-M548 VanDerWaalsContact C-N 3.28Å; F546-M548 PolarHBondContact O-N 2.86Å; F546-W549 HydrophobicContact CD1-CE3 4.36Å; F546-W549 HydrophobicContact CE1-CE3 4.23Å; F546-W549 HydrophobicContact CZ-CZ3 4.46Å; F546-W549 PolarHBondContact O-N 3.44Å; F546-E550 HydrophobicContact CD1-CG 4.37Å; F546-E550 WeakPolarHBondContact O-CB 3.31Å; F546-E550 PolarHBondContact O-N 3.39Å; F546-W552 HydrophobicContact CB-CE3 4.15Å; F546-W552 HydrophobicContact CB-CZ3 4.11Å; F546-W552 HydrophobicContact CD1-CZ3 4.15Å; F546-W552 HydrophobicContact CG-CZ3 4.33Å; F546-A557 HydrophobicContact CB-CB 3.97Å; F546-F560 HydrophobicContact CD1-CD1 4.42Å; F546-F560 HydrophobicContact CD1-CE1 4.05Å; F546-F560 HydrophobicContact CD2-CD1 4.17Å; F546-F560 HydrophobicContact CD2-CE1 4.09Å; F546-F560 AromaticContact CE1-CE1 3.82Å; F546-F560 HydrophobicContact CE1-CE1 3.82Å; F546-F560 HydrophobicContact CE2-CD1 4.35Å; F546-F560 AromaticContact CE2-CE1 3.86Å; F546-F560 HydrophobicContact CE2-CE1 3.86Å; F546-F560 HydrophobicContact CG-CD1 4.21Å; F546-F560 HydrophobicContact CG-CE1 4.19Å; F546-F560 AromaticContact CZ-CE1 3.73Å; F546-F560 HydrophobicContact CZ-CE1 3.73Å; F546-C561 WeakPolarHBondContact CD2-SG 3.42Å; F546-P575 HydrophobicContact CE1-CB 4.49Å; F546-T584 HydrophobicContact CE1-CG2 3.93Å; F546-T584 HydrophobicContact CZ-CG2 3.85Å; F546-Y587 AromaticContact CE2-CD1 3.63Å; F546-Y587 HydrophobicContact CE2-CD1 3.63Å; F546-Y587 AromaticContact CE2-CE1 3.77Å; F546-Y587 HydrophobicContact CE2-CE1 3.77Å; F546-Y587 HydrophobicContact CE2-CG 4.23Å; F546-Y587 HydrophobicContact CZ-CD1 4.11Å
547Q95.5Very high94.7Very high75 Ų7549.2 Ų49.235%0.3527%0.272SS..Hα-helixtrans-58.8-41.6167.4173.5175.126.100111.4G543 L545 G551 W552 A557G543-Q547 VanDerWaalsContact O-CB 3.23Å; G543-Q547 WeakPolarHBondContact O-CB 3.5Å; G543-Q547 PolarHBondContact O-N 3.3Å; L545-Q547 VanDerWaalsContact C-N 3.34Å; L545-Q547 PolarHBondContact O-N 2.77Å; Q547-G551 WeakPolarHBondContact O-CA 3.48Å; Q547-G551 PolarHBondContact O-N 3.43Å; Q547-G551 VanDerWaalsContact O-N 3.09Å; Q547-W552 WeakPolarHBondContact CG-O 3.38Å; Q547-A557 HydrophobicContact CB-CB 4.41Å
548M93.7Very high94.8Very high149 Ų14948.2 Ų48.273%0.73426%0.26SS*.Hα-helixtrans-74.1-36.5178.7-71.3-179.2-179.900113.4L544 L545 F546L544-M548 WeakPolarHBondContact O-CG 3.5Å; L544-M548 PolarHBondContact O-N 3.45Å; L544-M548 VanDerWaalsContact O-N 3.11Å; L545-M548 WeakPolarHBondContact O-CB 3.42Å; L545-M548 PolarHBondContact O-N 3.27Å; L545-M548 VanDerWaalsContact O-N 3.07Å; F546-M548 VanDerWaalsContact C-N 3.28Å; F546-M548 PolarHBondContact O-N 2.86Å
549W93.5Very high94.8Very high57 Ų5746.3 Ų46.322%0.21625%0.252CS..Hα-helixtrans-82.9-40.7-175.4-66.3-14.7000113.4L545 F546 Y580 F583L545-W549 HydrophobicContact CB-CH2 4.32Å; L545-W549 HydrophobicContact CB-CZ2 4.34Å; L545-W549 HydrophobicContact CB-CZ3 4.43Å; L545-W549 HydrophobicContact CD1-CH2 4.27Å; L545-W549 HydrophobicContact CD2-CZ2 4.05Å; L545-W549 WeakPolarHBondContact O-CB 3.28Å; L545-W549 VanDerWaalsContact O-CG 3.29Å; L545-W549 PolarHBondContact O-N 2.83Å; F546-W549 HydrophobicContact CD1-CE3 4.36Å; F546-W549 HydrophobicContact CE1-CE3 4.23Å; F546-W549 HydrophobicContact CZ-CZ3 4.46Å; F546-W549 PolarHBondContact O-N 3.44Å; W549-Y580 HydrophobicContact CB-CD1 4.38Å; W549-Y580 HydrophobicContact CB-CD2 3.67Å; W549-Y580 HydrophobicContact CB-CE2 4.14Å; W549-Y580 HydrophobicContact CB-CG 3.81Å; W549-Y580 AromaticContact CD1-CD1 3.93Å; W549-Y580 HydrophobicContact CD2-CD1 4.32Å; W549-Y580 HydrophobicContact CD2-CG 4.25Å; W549-Y580 AromaticContact CG-CD1 3.96Å; W549-Y580 HydrophobicContact CG-CD1 3.96Å; W549-Y580 HydrophobicContact CG-CD2 4.15Å; W549-Y580 HydrophobicContact CG-CE1 4.41Å; W549-Y580 AromaticContact CG-CG 3.82Å; W549-Y580 HydrophobicContact CG-CG 3.82Å; W549-Y580 WeakPolarHBondContact O-CD2 3.35Å; W549-Y580 VanDerWaalsContact O-CE2 3.28Å; W549-Y580 WeakPolarHBondContact O-CE2 3.36Å; W549-F583 HydrophobicContact CH2-CB 3.47Å; W549-F583 VanDerWaalsContact CH2-CB 3.47Å; W549-F583 HydrophobicContact CH2-CG 4.34Å; W549-F583 HydrophobicContact CZ2-CB 4.04Å; W549-F583 HydrophobicContact CZ2-CG 4.47Å; W549-F583 HydrophobicContact CZ3-CB 3.8Å
550E91.6Very high94.9Very high36 Ų3646.3 Ų46.317%0.16825%0.252CS..Hα-helixtrans-108.9-10.5-174.4-63.4-79.7159.300112.7F546 W552 P575 S576 E577F546-E550 HydrophobicContact CD1-CG 4.37Å; F546-E550 WeakPolarHBondContact O-CB 3.31Å; F546-E550 PolarHBondContact O-N 3.39Å; E550-W552 VanDerWaalsContact C-N 3.3Å; E550-W552 HydrophobicContact CB-CD2 3.69Å; E550-W552 HydrophobicContact CB-CE3 4.26Å; E550-W552 HydrophobicContact CB-CG 4.02Å; E550-W552 HydrophobicContact CB-CH2 4.27Å; E550-W552 HydrophobicContact CB-CZ2 3.7Å; E550-W552 HydrophobicContact CG-CD2 4.38Å; E550-W552 HydrophobicContact CG-CH2 3.91Å; E550-W552 HydrophobicContact CG-CZ2 3.62Å; E550-W552 HydrophobicContact CG-CZ3 4.39Å; E550-W552 PolarHBondContact O-N 2.81Å; E550-P575 HydrophobicContact CG-CB 4.46Å; E550-P575 WeakPolarHBondContact OE1-CA 3.37Å; E550-P575 WeakPolarHBondContact OE1-CB 3.3Å; E550-S576 PolarHBondContact OE1-N 2.88Å; E550-S576 PolarHBondContact OE2-N 3.35Å; E550-E577 WeakPolarHBondContact OE1-CB 3.19Å; E550-E577 PolarHBondContact OE1-N 3.35Å; E550-E577 VanDerWaalsContact OE1-N 3.09Å; E550-E577 PolarHBondContact OE2-N 2.66Å
551G90.3Very high94.9Very high65 Ų6545 Ų4567%0.6724%0.241SC*.  trans75.513.8179.200000114.7Q547Q547-G551 WeakPolarHBondContact O-CA 3.48Å; Q547-G551 PolarHBondContact O-N 3.43Å; Q547-G551 VanDerWaalsContact O-N 3.09Å
552W91.8Very high94.8Very high51 Ų5142.6 Ų42.619%0.19322%0.224CC..  trans-69.1160.1179.5-57.3-23.4000112.7F546 Q547 E550 A557 F560 I573 V574 P575F546-W552 HydrophobicContact CB-CE3 4.15Å; F546-W552 HydrophobicContact CB-CZ3 4.11Å; F546-W552 HydrophobicContact CD1-CZ3 4.15Å; F546-W552 HydrophobicContact CG-CZ3 4.33Å; Q547-W552 WeakPolarHBondContact CG-O 3.38Å; E550-W552 VanDerWaalsContact C-N 3.3Å; E550-W552 HydrophobicContact CB-CD2 3.69Å; E550-W552 HydrophobicContact CB-CE3 4.26Å; E550-W552 HydrophobicContact CB-CG 4.02Å; E550-W552 HydrophobicContact CB-CH2 4.27Å; E550-W552 HydrophobicContact CB-CZ2 3.7Å; E550-W552 HydrophobicContact CG-CD2 4.38Å; E550-W552 HydrophobicContact CG-CH2 3.91Å; E550-W552 HydrophobicContact CG-CZ2 3.62Å; E550-W552 HydrophobicContact CG-CZ3 4.39Å; E550-W552 PolarHBondContact O-N 2.81Å; W552-A557 HydrophobicContact CB-CB 4.38Å; W552-A557 HydrophobicContact CE3-CB 4.2Å; W552-F560 HydrophobicContact CH2-CD1 4.39Å; W552-F560 HydrophobicContact CH2-CG 4.42Å; W552-F560 HydrophobicContact CZ3-CB 4.16Å; W552-F560 AromaticContact CZ3-CD1 3.7Å; W552-F560 HydrophobicContact CZ3-CD1 3.7Å; W552-F560 HydrophobicContact CZ3-CD2 4.44Å; W552-F560 HydrophobicContact CZ3-CE1 4.22Å; W552-F560 AromaticContact CZ3-CG 3.82Å; W552-F560 HydrophobicContact CZ3-CG 3.82Å; W552-I573 HydrophobicContact CD2-CG2 3.87Å; W552-I573 HydrophobicContact CE3-CG2 3.69Å; W552-I573 HydrophobicContact CH2-CG2 3.57Å; W552-I573 HydrophobicContact CZ2-CG2 3.74Å; W552-I573 HydrophobicContact CZ3-CG2 3.54Å; W552-V574 WeakPolarHBondContact CZ2-O 3.31Å; W552-P575 HydrophobicContact CH2-CB 4.36Å
553G94.2Very high94.8Very high37 Ų3742.7 Ų42.738%0.38123%0.225SC..  trans-56.7142.2165.500000110.6F555 D556 A557G553-F555 PolarHBondContact O-N 2.92Å; G553-D556 PolarHBondContact O-N 3.29Å; G553-D556 VanDerWaalsContact O-N 3.11Å; G553-A557 PolarHBondContact O-N 3.13Å
554Y96.3Very high94.7Very high95 Ų9542.7 Ų42.737%0.37323%0.225SC..Hα-helixtrans-54.2-40.6-178.6173.5-103.6000112.5L544 F558L544-Y554 HydrophobicContact CD2-CD2 3.8Å; L544-Y554 HydrophobicContact CD2-CE2 3.64Å; L544-Y554 HydrophobicContact CG-CD2 4.39Å; L544-Y554 HydrophobicContact CG-CE2 3.85Å; Y554-F558 WeakPolarHBondContact O-CB 3.49Å; Y554-F558 PolarHBondContact O-N 3.3Å
555F95.6Very high94.6Very high58 Ų5838.9 Ų38.925%0.25421%0.205SC..Hα-helixtrans-66.9-43.5179.3-176.3-92.8000112.1L187 Q190 I191 I194 G553 A557 F558 Y559L187-F555 HydrophobicContact CD1-CD1 3.48Å; L187-F555 VanDerWaalsContact CD1-CD1 3.48Å; L187-F555 HydrophobicContact CD1-CD2 4.22Å; L187-F555 HydrophobicContact CD1-CE1 3.39Å; L187-F555 HydrophobicContact CD1-CE2 4.13Å; L187-F555 HydrophobicContact CD1-CG 3.92Å; L187-F555 HydrophobicContact CD1-CZ 3.74Å; Q190-F555 HydrophobicContact CB-CE1 3.82Å; Q190-F555 HydrophobicContact CB-CZ 4.2Å; Q190-F555 VanDerWaalsContact OE1-CE1 3.31Å; I191-F555 HydrophobicContact CD1-CE2 4.41Å; I191-F555 HydrophobicContact CD1-CZ 4.38Å; I191-F555 HydrophobicContact CG1-CE2 3.77Å; I191-F555 HydrophobicContact CG1-CZ 3.49Å; I191-F555 VanDerWaalsContact CG1-CZ 3.49Å; I194-F555 HydrophobicContact CD1-CZ 4.18Å; G553-F555 PolarHBondContact O-N 2.92Å; F555-A557 VanDerWaalsContact C-N 3.32Å; F555-A557 PolarHBondContact O-N 2.74Å; F555-F558 PolarHBondContact O-N 2.91Å; F555-Y559 VanDerWaalsContact O-CB 3.3Å; F555-Y559 WeakPolarHBondContact O-CB 3.34Å; F555-Y559 PolarHBondContact O-N 2.83Å
556D94.2Very high94.5Very high61 Ų6136.8 Ų36.833%0.32620%0.195SC..Hα-helixtrans-63.3-41.3177.9-59.1-35.6000111G553 Y559 F560 I573G553-D556 PolarHBondContact O-N 3.29Å; G553-D556 VanDerWaalsContact O-N 3.11Å; D556-Y559 PolarHBondContact O-N 3.1Å; D556-F560 WeakPolarHBondContact O-CB 3.43Å; D556-F560 PolarHBondContact O-N 2.92Å; D556-I573 HydrophobicContact CB-CD1 3.89Å
557A96.1Very high94.4Very high0 Ų038.1 Ų38.10%020%0.204CC..Hα-helixtrans-63.8-42173.700000112.5G543 F546 Q547 W552 G553 F555 C561G543-A557 VanDerWaalsContact O-CB 3.28Å; G543-A557 WeakPolarHBondContact O-CB 3.26Å; F546-A557 HydrophobicContact CB-CB 3.97Å; Q547-A557 HydrophobicContact CB-CB 4.41Å; W552-A557 HydrophobicContact CB-CB 4.38Å; W552-A557 HydrophobicContact CE3-CB 4.2Å; G553-A557 PolarHBondContact O-N 3.13Å; F555-A557 VanDerWaalsContact C-N 3.32Å; F555-A557 PolarHBondContact O-N 2.74Å; A557-C561 PolarHBondContact O-N 2.9Å; A557-C561 PolarHBondContact O-SG 2.87Å
558F96.1Very high94.4Very high38 Ų3834.6 Ų34.617%0.16719%0.187CC..Hα-helixtrans-65.3-43.9175177.5-95.4000112I194 A540 Y554 F555 C561 F562I194-F558 HydrophobicContact CD1-CD1 4.23Å; I194-F558 HydrophobicContact CD1-CE1 4.09Å; A540-F558 HydrophobicContact CB-CE2 4.4Å; Y554-F558 WeakPolarHBondContact O-CB 3.49Å; Y554-F558 PolarHBondContact O-N 3.3Å; F555-F558 PolarHBondContact O-N 2.91Å; F558-C561 PolarHBondContact O-N 3.41Å; F558-F562 PolarHBondContact O-N 2.87Å
559Y95.9Very high94.3Very high0 Ų027.5 Ų27.50%015%0.152CC..Hα-helixtrans-58.3-49.6175.3169.2-97.5000110.5Q190 I194 F555 D556 C561 F562 I563 F570 D572 I573Q190-Y559 HydrophobicContact CB-CD2 3.8Å; Q190-Y559 HydrophobicContact CB-CE2 3.86Å; Q190-Y559 HydrophobicContact CB-CG 4.49Å; Q190-Y559 HydrophobicContact CG-CD2 4.14Å; Q190-Y559 HydrophobicContact CG-CE2 3.92Å; I194-Y559 HydrophobicContact CD1-CD2 4.05Å; I194-Y559 HydrophobicContact CG1-CD2 4.08Å; F555-Y559 VanDerWaalsContact O-CB 3.3Å; F555-Y559 WeakPolarHBondContact O-CB 3.34Å; F555-Y559 PolarHBondContact O-N 2.83Å; D556-Y559 PolarHBondContact O-N 3.1Å; Y559-C561 VanDerWaalsContact C-N 3.35Å; Y559-C561 PolarHBondContact O-N 3.28Å; Y559-F562 PolarHBondContact O-N 3.41Å; Y559-I563 HydrophobicContact CD1-CG1 4.32Å; Y559-I563 HydrophobicContact CD2-CG1 4.03Å; Y559-I563 HydrophobicContact CE1-CG1 3.94Å; Y559-I563 HydrophobicContact CE2-CD1 3.93Å; Y559-I563 HydrophobicContact CE2-CG1 3.65Å; Y559-I563 HydrophobicContact CG-CG1 4.36Å; Y559-I563 WeakPolarHBondContact O-CB 3.3Å; Y559-I563 WeakPolarHBondContact O-CG1 3.41Å; Y559-I563 PolarHBondContact O-N 2.99Å; Y559-F570 WeakPolarHBondContact OH-CD2 3.18Å; Y559-F570 WeakPolarHBondContact OH-CE2 3.15Å; Y559-D572 VanDerWaalsContact CE1-OD2 3.25Å; Y559-D572 WeakPolarHBondContact CE1-OD2 3.24Å; Y559-I573 HydrophobicContact CD1-CD1 4.01Å; Y559-I573 HydrophobicContact CE1-CD1 4.43Å
560F95.4Very high94.2Very high4 Ų424.8 Ų24.82%0.01814%0.142CC..Hα-helixtrans-54.5-49.3173.7167.1-102.2000111.8Y430 F546 W552 D556 F562 I563 T564 I573 P575Y430-F560 AromaticContact CE1-CE2 3.95Å; Y430-F560 HydrophobicContact CE1-CE2 3.95Å; Y430-F560 AromaticContact CZ-CE2 3.9Å; F546-F560 HydrophobicContact CD1-CD1 4.42Å; F546-F560 HydrophobicContact CD1-CE1 4.05Å; F546-F560 HydrophobicContact CD2-CD1 4.17Å; F546-F560 HydrophobicContact CD2-CE1 4.09Å; F546-F560 AromaticContact CE1-CE1 3.82Å; F546-F560 HydrophobicContact CE1-CE1 3.82Å; F546-F560 HydrophobicContact CE2-CD1 4.35Å; F546-F560 AromaticContact CE2-CE1 3.86Å; F546-F560 HydrophobicContact CE2-CE1 3.86Å; F546-F560 HydrophobicContact CG-CD1 4.21Å; F546-F560 HydrophobicContact CG-CE1 4.19Å; F546-F560 AromaticContact CZ-CE1 3.73Å; F546-F560 HydrophobicContact CZ-CE1 3.73Å; W552-F560 HydrophobicContact CH2-CD1 4.39Å; W552-F560 HydrophobicContact CH2-CG 4.42Å; W552-F560 HydrophobicContact CZ3-CB 4.16Å; W552-F560 AromaticContact CZ3-CD1 3.7Å; W552-F560 HydrophobicContact CZ3-CD1 3.7Å; W552-F560 HydrophobicContact CZ3-CD2 4.44Å; W552-F560 HydrophobicContact CZ3-CE1 4.22Å; W552-F560 AromaticContact CZ3-CG 3.82Å; W552-F560 HydrophobicContact CZ3-CG 3.82Å; D556-F560 WeakPolarHBondContact O-CB 3.43Å; D556-F560 PolarHBondContact O-N 2.92Å; F560-F562 VanDerWaalsContact C-N 3.33Å; F560-F562 PolarHBondContact O-N 2.8Å; F560-I563 PolarHBondContact O-N 3.48Å; F560-T564 WeakPolarHBondContact CE2-OG1 3.49Å; F560-T564 VanDerWaalsContact O-CB 3.22Å; F560-T564 WeakPolarHBondContact O-CB 3.3Å; F560-T564 PolarHBondContact O-N 3.43Å; F560-T564 PolarHBondContact O-OG1 3.31Å; F560-I573 HydrophobicContact CB-CB 4.43Å; F560-I573 HydrophobicContact CB-CG2 4.07Å; F560-I573 HydrophobicContact CD2-CG2 4.32Å; F560-I573 WeakPolarHBondContact CD2-O 3.43Å; F560-I573 WeakPolarHBondContact CE2-O 3.42Å; F560-I573 HydrophobicContact CG-CG2 4.34Å; F560-P575 HydrophobicContact CZ-CG 4.29Å
561C95.9Very high94Very high0 Ų023.7 Ų23.70%014%0.14CC..Hα-helixtrans-58.2-46.7178.6-69.90000111.2G543 F546 A557 F558 Y559 T564 M565G543-C561 PolarHBondContact N-SG 3.46Å; F546-C561 WeakPolarHBondContact CD2-SG 3.42Å; A557-C561 PolarHBondContact O-N 2.9Å; A557-C561 PolarHBondContact O-SG 2.87Å; F558-C561 PolarHBondContact O-N 3.41Å; Y559-C561 VanDerWaalsContact C-N 3.35Å; Y559-C561 PolarHBondContact O-N 3.28Å; C561-T564 PolarHBondContact O-N 3.23Å; C561-M565 WeakPolarHBondContact O-CB 3.35Å; C561-M565 WeakPolarHBondContact O-CG 3.45Å; C561-M565 PolarHBondContact O-N 2.99Å
562F95.4Very high93.9Very high29 Ų2922.3 Ų22.313%0.12712%0.117CC..Hα-helixtrans-62.5-50.9178.6178.5-90.5000112.3I194 A198 F558 Y559 F560 T564 M565 A566 I568I194-F562 HydrophobicContact CB-CD1 4.09Å; I194-F562 HydrophobicContact CB-CE1 4.19Å; I194-F562 HydrophobicContact CB-CG 4.48Å; I194-F562 HydrophobicContact CG1-CB 4.43Å; I194-F562 HydrophobicContact CG1-CD1 3.76Å; I194-F562 HydrophobicContact CG1-CE1 4.33Å; I194-F562 HydrophobicContact CG1-CG 4.14Å; I194-F562 HydrophobicContact CG2-CD1 3.97Å; I194-F562 HydrophobicContact CG2-CD2 3.98Å; I194-F562 HydrophobicContact CG2-CE1 4.06Å; I194-F562 HydrophobicContact CG2-CE2 4.04Å; I194-F562 HydrophobicContact CG2-CG 3.94Å; I194-F562 HydrophobicContact CG2-CZ 4.09Å; I194-F562 VanDerWaalsContact O-CZ 3.28Å; I194-F562 WeakPolarHBondContact O-CZ 3.32Å; A198-F562 HydrophobicContact CB-CE2 4.12Å; A198-F562 HydrophobicContact CB-CZ 3.87Å; F558-F562 PolarHBondContact O-N 2.87Å; Y559-F562 PolarHBondContact O-N 3.41Å; F560-F562 VanDerWaalsContact C-N 3.33Å; F560-F562 PolarHBondContact O-N 2.8Å; F562-T564 PolarHBondContact O-N 3.05Å; F562-M565 PolarHBondContact O-N 3.37Å; F562-A566 HydrophobicContact CE1-CB 4.13Å; F562-A566 HydrophobicContact CZ-CB 4.29Å; F562-A566 WeakPolarHBondContact O-CB 3.48Å; F562-A566 PolarHBondContact O-N 3.1Å; F562-I568 HydrophobicContact CE1-CD1 4.33Å
563I95.3Very high93.7Very high3 Ų321.3 Ų21.32%0.01512%0.115CC..Hα-helixtrans-58.4-36.5179.5-69.2-55.8000111.3Y559 F560 T567 I568 G569 F570Y559-I563 HydrophobicContact CD1-CG1 4.32Å; Y559-I563 HydrophobicContact CD2-CG1 4.03Å; Y559-I563 HydrophobicContact CE1-CG1 3.94Å; Y559-I563 HydrophobicContact CE2-CD1 3.93Å; Y559-I563 HydrophobicContact CE2-CG1 3.65Å; Y559-I563 HydrophobicContact CG-CG1 4.36Å; Y559-I563 WeakPolarHBondContact O-CB 3.3Å; Y559-I563 WeakPolarHBondContact O-CG1 3.41Å; Y559-I563 PolarHBondContact O-N 2.99Å; F560-I563 PolarHBondContact O-N 3.48Å; I563-T567 PolarHBondContact O-N 2.92Å; I563-I568 HydrophobicContact CD1-CB 4.27Å; I563-I568 HydrophobicContact CD1-CD1 3.65Å; I563-I568 HydrophobicContact CD1-CG2 4.34Å; I563-I568 HydrophobicContact CG2-CB 4.04Å; I563-I568 HydrophobicContact CG2-CG2 4.34Å; I563-I568 PolarHBondContact O-N 2.91Å; I563-G569 PolarHBondContact O-N 2.97Å; I563-F570 HydrophobicContact CD1-CD2 3.93Å; I563-F570 HydrophobicContact CD1-CE2 3.54Å; I563-F570 HydrophobicContact CG1-CD2 4.17Å; I563-F570 HydrophobicContact CG1-CE2 4.27Å; I563-F570 HydrophobicContact CG2-CD2 3.89Å; I563-F570 HydrophobicContact CG2-CG 4.46Å
564T95.3Very high93.5Very high0 Ų020.7 Ų20.70%010%0.104CC..Hα-helixtrans-70-48.6176.5-58.90000112.1I428 Y430 F560 C561 F562 A566 T567 I588I428-T564 HydrophobicContact CD1-CG2 4.03Å; Y430-T564 WeakPolarHBondContact OH-CG2 3.33Å; Y430-T564 PolarHBondContact OH-OG1 3.5Å; F560-T564 WeakPolarHBondContact CE2-OG1 3.49Å; F560-T564 VanDerWaalsContact O-CB 3.22Å; F560-T564 WeakPolarHBondContact O-CB 3.3Å; F560-T564 PolarHBondContact O-N 3.43Å; F560-T564 PolarHBondContact O-OG1 3.31Å; C561-T564 PolarHBondContact O-N 3.23Å; F562-T564 PolarHBondContact O-N 3.05Å; T564-A566 VanDerWaalsContact C-N 3.33Å; T564-A566 PolarHBondContact O-N 3.17Å; T564-T567 PolarHBondContact O-N 3.43Å; T564-I588 HydrophobicContact CG2-CD1 4Å; T564-I588 HydrophobicContact CG2-CG1 3.75Å
565M93.5Very high93.2Very high4 Ų416.4 Ų16.42%0.029%0.088CC..Hα-helixtrans-65.9-37.1179.4-69.1-47.4122.500112.5Y538 T539 C561 F562 T567 Y587 I588 G591 T595Y538-M565 HydrophobicContact CE1-SD 4.14Å; T539-M565 HydrophobicContact CG2-CB 4.42Å; T539-M565 HydrophobicContact CG2-CG 4Å; C561-M565 WeakPolarHBondContact O-CB 3.35Å; C561-M565 WeakPolarHBondContact O-CG 3.45Å; C561-M565 PolarHBondContact O-N 2.99Å; F562-M565 PolarHBondContact O-N 3.37Å; M565-T567 PolarHBondContact O-N 3.5Å; M565-Y587 HydrophobicContact CE-CD1 3.66Å; M565-Y587 HydrophobicContact CE-CE1 3.26Å; M565-I588 HydrophobicContact CE-CG1 4.48Å; M565-G591 WeakPolarHBondContact SD-CA 3.42Å; M565-T595 WeakPolarHBondContact O-CG2 3.48Å
566A92.8Very high92.5Very high10 Ų1016.9 Ų16.98%0.08310%0.099CC..THydrogen-bonded Turntrans-74.30.6173.900000113.1T176 I201 F562 T564 I568T176-A566 WeakPolarHBondContact CG2-O 2.86Å; I201-A566 HydrophobicContact CD1-CB 3.77Å; F562-A566 HydrophobicContact CE1-CB 4.13Å; F562-A566 HydrophobicContact CZ-CB 4.29Å; F562-A566 WeakPolarHBondContact O-CB 3.48Å; F562-A566 PolarHBondContact O-N 3.1Å; T564-A566 VanDerWaalsContact C-N 3.33Å; T564-A566 PolarHBondContact O-N 3.17Å; A566-I568 HydrophobicContact CB-CD1 3.78Å; A566-I568 HydrophobicContact CB-CG1 3.94Å; A566-I568 PolarHBondContact O-N 3.29Å; A566-I568 VanDerWaalsContact O-N 3.09Å
567T94.1Very high92Very high29 Ų2917.5 Ų17.518%0.17810%0.099CC..THydrogen-bonded Turntrans55.921.6-17755.60000114.3T176 I428 I563 T564 M565 L592T176-T567 WeakPolarHBondContact CB-O 3.17Å; T176-T567 VanDerWaalsContact O-O 3.09Å; I428-T567 HydrophobicContact CG1-CG2 4.13Å; I563-T567 PolarHBondContact O-N 2.92Å; T564-T567 PolarHBondContact O-N 3.43Å; M565-T567 PolarHBondContact O-N 3.5Å; T567-L592 HydrophobicContact CG2-CD2 3.32Å
568I94.9Very high91.3Very high0 Ų021 Ų210%012%0.116CC..  trans-73.5-45.8179.2-63161.6000110V173 T176 G178 I201 F562 I563 A566 F570V173-I568 HydrophobicContact CG1-CD1 3.9Å; V173-I568 HydrophobicContact CG1-CG1 4.48Å; T176-I568 HydrophobicContact CG2-CG1 4.39Å; G178-I568 VanDerWaalsContact CA-O 3.29Å; G178-I568 WeakPolarHBondContact CA-O 3.32Å; I201-I568 HydrophobicContact CD1-CD1 4.04Å; I201-I568 HydrophobicContact CD1-CG1 4.04Å; F562-I568 HydrophobicContact CE1-CD1 4.33Å; I563-I568 HydrophobicContact CD1-CB 4.27Å; I563-I568 HydrophobicContact CD1-CD1 3.65Å; I563-I568 HydrophobicContact CD1-CG2 4.34Å; I563-I568 HydrophobicContact CG2-CB 4.04Å; I563-I568 HydrophobicContact CG2-CG2 4.34Å; I563-I568 PolarHBondContact O-N 2.91Å; A566-I568 HydrophobicContact CB-CD1 3.78Å; A566-I568 HydrophobicContact CB-CG1 3.94Å; A566-I568 PolarHBondContact O-N 3.29Å; A566-I568 VanDerWaalsContact O-N 3.09Å; I568-F570 HydrophobicContact CG2-CD1 3.84Å; I568-F570 HydrophobicContact CG2-CD2 4Å; I568-F570 HydrophobicContact CG2-CE1 3.42Å; I568-F570 VanDerWaalsContact CG2-CE1 3.42Å; I568-F570 HydrophobicContact CG2-CE2 3.63Å; I568-F570 HydrophobicContact CG2-CG 4.11Å; I568-F570 HydrophobicContact CG2-CZ 3.32Å; I568-F570 PolarHBondContact O-N 3.31Å
569G93Very high90.8Very high0 Ų023.8 Ų23.80%014%0.136CC..  trans60.247.9167.600000116.7Y430 I563 G571Y430-G569 WeakPolarHBondContact CA-O 3.33Å; I563-G569 PolarHBondContact O-N 2.97Å; G569-G571 PolarHBondContact O-N 3.39Å
570F90.4Very high90.5Very high1 Ų127.4 Ų27.40%0.00415%0.15CC..  trans-61.7-26.2-179.4-64.3-53.9000115.6F169 V173 G180 V183 C193 Y559 I563 I568 D572F169-F570 HydrophobicContact CD2-CE1 4.4Å; F169-F570 HydrophobicContact CE2-CD1 4.34Å; F169-F570 AromaticContact CE2-CE1 3.48Å; F169-F570 HydrophobicContact CE2-CE1 3.48Å; F169-F570 VanDerWaalsContact CE2-CE1 3.48Å; F169-F570 AromaticContact CE2-CZ 3.62Å; F169-F570 HydrophobicContact CE2-CZ 3.62Å; F169-F570 HydrophobicContact CZ-CE1 4.02Å; F169-F570 HydrophobicContact CZ-CE2 4.46Å; F169-F570 AromaticContact CZ-CZ 3.64Å; F169-F570 HydrophobicContact CZ-CZ 3.64Å; V173-F570 HydrophobicContact CG2-CE1 4.1Å; V173-F570 HydrophobicContact CG2-CZ 3.68Å; G180-F570 WeakPolarHBondContact CA-O 3.31Å; V183-F570 HydrophobicContact CG1-CB 3.6Å; V183-F570 HydrophobicContact CG1-CD1 4.16Å; V183-F570 HydrophobicContact CG1-CG 3.89Å; C193-F570 VanDerWaalsContact SG-CE2 3.51Å; Y559-F570 WeakPolarHBondContact OH-CD2 3.18Å; Y559-F570 WeakPolarHBondContact OH-CE2 3.15Å; I563-F570 HydrophobicContact CD1-CD2 3.93Å; I563-F570 HydrophobicContact CD1-CE2 3.54Å; I563-F570 HydrophobicContact CG1-CD2 4.17Å; I563-F570 HydrophobicContact CG1-CE2 4.27Å; I563-F570 HydrophobicContact CG2-CD2 3.89Å; I563-F570 HydrophobicContact CG2-CG 4.46Å; I568-F570 HydrophobicContact CG2-CD1 3.84Å; I568-F570 HydrophobicContact CG2-CD2 4Å; I568-F570 HydrophobicContact CG2-CE1 3.42Å; I568-F570 VanDerWaalsContact CG2-CE1 3.42Å; I568-F570 HydrophobicContact CG2-CE2 3.63Å; I568-F570 HydrophobicContact CG2-CG 4.11Å; I568-F570 HydrophobicContact CG2-CZ 3.32Å; I568-F570 PolarHBondContact O-N 3.31Å; F570-D572 VanDerWaalsContact C-N 3.28Å; F570-D572 PolarHBondContact O-N 3.27Å
571G87.8Confident90.2Very high13 Ų1327.3 Ų27.313%0.13415%0.149CC..  trans69.92018000000115.3Y430 G569Y430-G571 WeakPolarHBondContact O-CA 3.47Å; G569-G571 PolarHBondContact O-N 3.39Å
572D87Confident90Very high35 Ų3532.6 Ų32.619%0.18717%0.173CC..SBendtrans-73.1-36.7170.862.2-40.1000112V183 Y559 F570V183-D572 HydrophobicContact CB-CB 4.34Å; V183-D572 HydrophobicContact CG1-CB 4.25Å; V183-D572 HydrophobicContact CG2-CB 4.04Å; Y559-D572 VanDerWaalsContact CE1-OD2 3.25Å; Y559-D572 WeakPolarHBondContact CE1-OD2 3.24Å; F570-D572 VanDerWaalsContact C-N 3.28Å; F570-D572 PolarHBondContact O-N 3.27Å
573I89.3Confident89.8Confident30 Ų3036.8 Ų36.815%0.15419%0.191CC..SBendtrans-122.8124.8171.7-62159.1000107.7W552 D556 Y559 F560W552-I573 HydrophobicContact CD2-CG2 3.87Å; W552-I573 HydrophobicContact CE3-CG2 3.69Å; W552-I573 HydrophobicContact CH2-CG2 3.57Å; W552-I573 HydrophobicContact CZ2-CG2 3.74Å; W552-I573 HydrophobicContact CZ3-CG2 3.54Å; D556-I573 HydrophobicContact CB-CD1 3.89Å; Y559-I573 HydrophobicContact CD1-CD1 4.01Å; Y559-I573 HydrophobicContact CE1-CD1 4.43Å; F560-I573 HydrophobicContact CB-CB 4.43Å; F560-I573 HydrophobicContact CB-CG2 4.07Å; F560-I573 HydrophobicContact CD2-CG2 4.32Å; F560-I573 WeakPolarHBondContact CD2-O 3.43Å; F560-I573 WeakPolarHBondContact CE2-O 3.42Å; F560-I573 HydrophobicContact CG-CG2 4.34Å
574V89.4Confident89.7Confident24 Ų2436.6 Ų36.615%0.14519%0.19CC..  trans-144141.5-178.6-70.70000110.2Y430 N432 W552 S576Y430-V574 HydrophobicContact CD1-CG1 3.87Å; Y430-V574 HydrophobicContact CD2-CG1 4.1Å; Y430-V574 HydrophobicContact CE1-CG1 4.45Å; Y430-V574 HydrophobicContact CG-CG1 3.67Å; N432-V574 HydrophobicContact CB-CG2 4.48Å; W552-V574 WeakPolarHBondContact CZ2-O 3.31Å; V574-S576 PolarHBondContact O-N 3.47Å; V574-S576 PolarHBondContact O-OG 2.6Å
575P89.6Confident89.6Confident6 Ų637.7 Ų37.74%0.03920%0.196CC..  trans-63.5124.1179.925.4-32.3000109.3F419 F546 E550 W552 F560 T584F419-P575 HydrophobicContact CE1-CG 4.28Å; F419-P575 HydrophobicContact CE2-CG 4.15Å; F419-P575 HydrophobicContact CZ-CG 3.67Å; F546-P575 HydrophobicContact CE1-CB 4.49Å; E550-P575 HydrophobicContact CG-CB 4.46Å; E550-P575 WeakPolarHBondContact OE1-CA 3.37Å; E550-P575 WeakPolarHBondContact OE1-CB 3.3Å; W552-P575 HydrophobicContact CH2-CB 4.36Å; F560-P575 HydrophobicContact CZ-CG 4.29Å; P575-T584 HydrophobicContact CB-CG2 4.42Å; P575-T584 HydrophobicContact CG-CG2 3.82Å
576S80.1Confident89.5Confident68 Ų6842.4 Ų42.448%0.47622%0.22SC..  trans-101.7-24.4-177.2-64.70000111.4E550 V574 Q578E550-S576 PolarHBondContact OE1-N 2.88Å; E550-S576 PolarHBondContact OE2-N 3.35Å; V574-S576 PolarHBondContact O-N 3.47Å; V574-S576 PolarHBondContact O-OG 2.6Å; S576-Q578 PolarHBondContact O-N 3.43Å
577E84.4Confident89.6Confident73 Ų7342.6 Ų42.634%0.34122%0.219SC..  trans-80.5118.5-171.9-162.456.1-135.100111.7E550 V579 Y580E550-E577 WeakPolarHBondContact OE1-CB 3.19Å; E550-E577 PolarHBondContact OE1-N 3.35Å; E550-E577 VanDerWaalsContact OE1-N 3.09Å; E550-E577 PolarHBondContact OE2-N 2.66Å; E577-V579 VanDerWaalsContact C-N 3.27Å; E577-V579 PolarHBondContact O-N 3.24Å; E577-Y580 HydrophobicContact CB-CD2 4.03Å; E577-Y580 HydrophobicContact CG-CD2 3.8Å; E577-Y580 HydrophobicContact CG-CE2 3.99Å; E577-Y580 PolarHBondContact O-N 3.08Å
578Q82Confident89.5Confident74 Ų7441.2 Ų41.235%0.34621%0.21SC..G310 helixtrans-68.5-27.8-173.1-64.218028.300112.8S576 Y580 M581S576-Q578 PolarHBondContact O-N 3.43Å; Q578-Y580 VanDerWaalsContact C-N 3.3Å; Q578-Y580 PolarHBondContact O-N 3.39Å; Q578-M581 WeakPolarHBondContact O-CB 3.44Å; Q578-M581 PolarHBondContact O-N 2.7Å
579V85.8Confident89.4Confident96 Ų9642.5 Ų42.558%0.58222%0.218SC*.G310 helixtrans-64-36.4-177.4-175.80000111.5E577E577-V579 VanDerWaalsContact C-N 3.27Å; E577-V579 PolarHBondContact O-N 3.24Å
580Y88.9Confident89.3Confident77 Ų7745.2 Ų45.230%0.30223%0.234SC..G310 helixtrans-96.84.2-176.1-52.3-62.2000113.6W549 E577 Q578 F582 F583 T584W549-Y580 HydrophobicContact CB-CD1 4.38Å; W549-Y580 HydrophobicContact CB-CD2 3.67Å; W549-Y580 HydrophobicContact CB-CE2 4.14Å; W549-Y580 HydrophobicContact CB-CG 3.81Å; W549-Y580 AromaticContact CD1-CD1 3.93Å; W549-Y580 HydrophobicContact CD2-CD1 4.32Å; W549-Y580 HydrophobicContact CD2-CG 4.25Å; W549-Y580 AromaticContact CG-CD1 3.96Å; W549-Y580 HydrophobicContact CG-CD1 3.96Å; W549-Y580 HydrophobicContact CG-CD2 4.15Å; W549-Y580 HydrophobicContact CG-CE1 4.41Å; W549-Y580 AromaticContact CG-CG 3.82Å; W549-Y580 HydrophobicContact CG-CG 3.82Å; W549-Y580 WeakPolarHBondContact O-CD2 3.35Å; W549-Y580 VanDerWaalsContact O-CE2 3.28Å; W549-Y580 WeakPolarHBondContact O-CE2 3.36Å; E577-Y580 HydrophobicContact CB-CD2 4.03Å; E577-Y580 HydrophobicContact CG-CD2 3.8Å; E577-Y580 HydrophobicContact CG-CE2 3.99Å; E577-Y580 PolarHBondContact O-N 3.08Å; Q578-Y580 VanDerWaalsContact C-N 3.3Å; Q578-Y580 PolarHBondContact O-N 3.39Å; Y580-F582 PolarHBondContact O-N 3.34Å; Y580-F583 HydrophobicContact CD1-CD2 4.48Å; Y580-F583 PolarHBondContact O-N 2.76Å; Y580-T584 PolarHBondContact O-N 3.05Å; Y580-T584 PolarHBondContact O-OG1 3.48Å
581M89.6Confident89.5Confident1 Ų145.1 Ų45.11%0.00523%0.234CC..Hα-helixtrans-62-41.2-175.3-164.361.964.700112.8P415 Q416 F419 Q578 F583 T584 I585P415-M581 HydrophobicContact CB-CB 4.24Å; P415-M581 HydrophobicContact CB-CG 4.21Å; Q416-M581 HydrophobicContact CG-CE 3.95Å; F419-M581 HydrophobicContact CB-CG 3.97Å; F419-M581 HydrophobicContact CB-SD 3.55Å; F419-M581 VanDerWaalsContact CB-SD 3.55Å; F419-M581 HydrophobicContact CD1-SD 4.02Å; F419-M581 HydrophobicContact CD2-SD 3.48Å; F419-M581 WeakPolarHBondContact CD2-SD 3.47Å; F419-M581 HydrophobicContact CE2-SD 4.09Å; F419-M581 HydrophobicContact CG-CG 4.43Å; F419-M581 HydrophobicContact CG-SD 3.42Å; F419-M581 WeakPolarHBondContact CG-SD 3.4Å; Q578-M581 WeakPolarHBondContact O-CB 3.44Å; Q578-M581 PolarHBondContact O-N 2.7Å; M581-F583 PolarHBondContact O-N 2.9Å; M581-T584 WeakPolarHBondContact O-CB 3.44Å; M581-T584 PolarHBondContact O-N 2.98Å; M581-I585 HydrophobicContact CG-CD1 4.49Å; M581-I585 WeakPolarHBondContact O-CG1 3.49Å; M581-I585 PolarHBondContact O-N 3.26Å
582F90.6Very high89.7Confident112 Ų11244.8 Ų44.849%0.49123%0.229SC..Hα-helixtrans-64-40.7177.3-68.2-74.8000112.5Y580 T584 I585 I586Y580-F582 PolarHBondContact O-N 3.34Å; F582-T584 VanDerWaalsContact C-N 3.34Å; F582-I585 PolarHBondContact O-N 3.36Å; F582-I586 WeakPolarHBondContact O-CG1 3.49Å; F582-I586 PolarHBondContact O-N 3.43Å
583F92.5Very high89.9Confident116 Ų11643.1 Ų43.151%0.50922%0.22SC..Hα-helixtrans-67.9-37.1176.7-63.6-68.6000111.7W549 Y580 M581 I586 Y587W549-F583 HydrophobicContact CH2-CB 3.47Å; W549-F583 VanDerWaalsContact CH2-CB 3.47Å; W549-F583 HydrophobicContact CH2-CG 4.34Å; W549-F583 HydrophobicContact CZ2-CB 4.04Å; W549-F583 HydrophobicContact CZ2-CG 4.47Å; W549-F583 HydrophobicContact CZ3-CB 3.8Å; Y580-F583 HydrophobicContact CD1-CD2 4.48Å; Y580-F583 PolarHBondContact O-N 2.76Å; M581-F583 PolarHBondContact O-N 2.9Å; F583-I586 PolarHBondContact O-N 2.6Å; F583-Y587 WeakPolarHBondContact O-CB 3.25Å; F583-Y587 PolarHBondContact O-N 2.71Å
584T92.8Very high90Very high0 Ų042.3 Ų42.30%022%0.216CC..Hα-helixtrans-58.9-46.6173-59.40000111.3F419 F546 P575 Y580 M581 F582 I586 Y587 I588F419-T584 HydrophobicContact CD2-CG2 4.41Å; F419-T584 HydrophobicContact CE2-CG2 3.67Å; F419-T584 HydrophobicContact CZ-CG2 4.42Å; F546-T584 HydrophobicContact CE1-CG2 3.93Å; F546-T584 HydrophobicContact CZ-CG2 3.85Å; P575-T584 HydrophobicContact CB-CG2 4.42Å; P575-T584 HydrophobicContact CG-CG2 3.82Å; Y580-T584 PolarHBondContact O-N 3.05Å; Y580-T584 PolarHBondContact O-OG1 3.48Å; M581-T584 WeakPolarHBondContact O-CB 3.44Å; M581-T584 PolarHBondContact O-N 2.98Å; F582-T584 VanDerWaalsContact C-N 3.34Å; T584-I586 PolarHBondContact O-N 3.39Å; T584-Y587 WeakPolarHBondContact O-CB 3.33Å; T584-Y587 PolarHBondContact O-N 3.07Å; T584-I588 HydrophobicContact CG2-CD1 4.04Å; T584-I588 WeakPolarHBondContact O-CG1 3.4Å; T584-I588 PolarHBondContact O-N 3.03Å
585I92.6Very high90.1Very high22 Ų2241.8 Ų41.811%0.11321%0.213CC..Hα-helixtrans-60-45.8178-69.4162.7000111.1I418 F419 T422 M581 F582 Y587 I588 V589I418-I585 HydrophobicContact CG2-CD1 3.83Å; F419-I585 HydrophobicContact CB-CD1 4.47Å; F419-I585 HydrophobicContact CD2-CG1 3.99Å; T422-I585 HydrophobicContact CG2-CG2 4.19Å; M581-I585 HydrophobicContact CG-CD1 4.49Å; M581-I585 WeakPolarHBondContact O-CG1 3.49Å; M581-I585 PolarHBondContact O-N 3.26Å; F582-I585 PolarHBondContact O-N 3.36Å; I585-Y587 VanDerWaalsContact C-N 3.33Å; I585-Y587 PolarHBondContact O-N 3.42Å; I585-I588 PolarHBondContact O-N 2.88Å; I585-V589 WeakPolarHBondContact O-CG2 3.21Å; I585-V589 PolarHBondContact O-N 3.02Å
586I91.8Very high90Very high104 Ų10443.7 Ų43.753%0.53323%0.225SC..Hα-helixtrans-61.8-43.8178-66.1168000110.7F582 F583 T584 V589 V590F582-I586 WeakPolarHBondContact O-CG1 3.49Å; F582-I586 PolarHBondContact O-N 3.43Å; F583-I586 PolarHBondContact O-N 2.6Å; T584-I586 PolarHBondContact O-N 3.39Å; I586-V589 PolarHBondContact O-N 3.21Å; I586-V590 HydrophobicContact CG2-CG2 4.48Å; I586-V590 WeakPolarHBondContact O-CG2 3.39Å; I586-V590 PolarHBondContact O-N 2.87Å; I586-V590 VanDerWaalsContact O-N 3.08Å
587Y94.5Very high90.3Very high14 Ų1440.8 Ų40.86%0.05520%0.204CC..Hα-helixtrans-59-47.2175.9178.8-95.1000111.4Y538 G542 F546 M565 F583 T584 I585 V589 V590 G591Y538-Y587 HydrophobicContact CD1-CE2 4.09Å; Y538-Y587 HydrophobicContact CE1-CD2 4.01Å; Y538-Y587 HydrophobicContact CE1-CE1 4.2Å; Y538-Y587 AromaticContact CE1-CE2 3.34Å; Y538-Y587 HydrophobicContact CE1-CE2 3.34Å; Y538-Y587 AromaticContact CE1-CZ 3.42Å; Y538-Y587 VanDerWaalsContact CE1-CZ 3.42Å; Y538-Y587 WeakPolarHBondContact CE1-OH 3.36Å; Y538-Y587 HydrophobicContact CE2-CD2 4.4Å; Y538-Y587 HydrophobicContact CE2-CE2 4.07Å; Y538-Y587 AromaticContact CZ-CD2 3.62Å; Y538-Y587 AromaticContact CZ-CE2 3.34Å; Y538-Y587 AromaticContact CZ-CZ 3.94Å; Y538-Y587 PolarHBondContact O-OH 3.01Å; Y538-Y587 WeakPolarHBondContact OH-CD2 3.45Å; Y538-Y587 WeakPolarHBondContact OH-CE2 3.38Å; Y538-Y587 PolarHBondContact OH-O 2.81Å; G542-Y587 WeakPolarHBondContact CA-OH 3.5Å; F546-Y587 AromaticContact CE2-CD1 3.63Å; F546-Y587 HydrophobicContact CE2-CD1 3.63Å; F546-Y587 AromaticContact CE2-CE1 3.77Å; F546-Y587 HydrophobicContact CE2-CE1 3.77Å; F546-Y587 HydrophobicContact CE2-CG 4.23Å; F546-Y587 HydrophobicContact CZ-CD1 4.11Å; M565-Y587 HydrophobicContact CE-CD1 3.66Å; M565-Y587 HydrophobicContact CE-CE1 3.26Å; F583-Y587 WeakPolarHBondContact O-CB 3.25Å; F583-Y587 PolarHBondContact O-N 2.71Å; T584-Y587 WeakPolarHBondContact O-CB 3.33Å; T584-Y587 PolarHBondContact O-N 3.07Å; I585-Y587 VanDerWaalsContact C-N 3.33Å; I585-Y587 PolarHBondContact O-N 3.42Å; Y587-V589 PolarHBondContact O-N 3Å; Y587-V590 PolarHBondContact O-N 2.89Å; Y587-G591 PolarHBondContact O-N 3.28Å
588I93.6Very high90.4Very high0 Ų037.4 Ų37.40%019%0.188CC..Hα-helixtrans-59.7-48.9178.2-68.9174.2000111.1F419 T426 I428 T564 M565 T584 I585 V590 G591 L592F419-I588 HydrophobicContact CE2-CD1 3.67Å; F419-I588 HydrophobicContact CZ-CD1 4.32Å; T426-I588 HydrophobicContact CG2-CG2 4.43Å; I428-I588 HydrophobicContact CD1-CG2 3.62Å; T564-I588 HydrophobicContact CG2-CD1 4Å; T564-I588 HydrophobicContact CG2-CG1 3.75Å; M565-I588 HydrophobicContact CE-CG1 4.48Å; T584-I588 HydrophobicContact CG2-CD1 4.04Å; T584-I588 WeakPolarHBondContact O-CG1 3.4Å; T584-I588 PolarHBondContact O-N 3.03Å; I585-I588 PolarHBondContact O-N 2.88Å; I588-V590 PolarHBondContact O-N 2.98Å; I588-G591 PolarHBondContact O-N 2.87Å; I588-L592 HydrophobicContact CG2-CD1 3.71Å; I588-L592 HydrophobicContact CG2-CG 4.15Å; I588-L592 WeakPolarHBondContact O-CB 3.37Å; I588-L592 VanDerWaalsContact O-CG 3.22Å; I588-L592 WeakPolarHBondContact O-CG 2.83Å; I588-L592 PolarHBondContact O-N 3.33Å
589V91.8Very high90.5Very high27 Ų2736.1 Ų36.116%0.16418%0.183CC..Hα-helixtrans-61.7-45.3-177.8172.90000111.8I462 I585 I586 Y587 A593I462-V589 HydrophobicContact CD1-CG1 4.32Å; I585-V589 WeakPolarHBondContact O-CG2 3.21Å; I585-V589 PolarHBondContact O-N 3.02Å; I586-V589 PolarHBondContact O-N 3.21Å; Y587-V589 PolarHBondContact O-N 3Å; V589-A593 PolarHBondContact O-N 3.35Å
590V91.7Very high90.3Very high56 Ų5636.4 Ų36.434%0.33918%0.181SC..Hα-helixtrans-66.7-43.7178.8172.20000111.1Y538 I586 Y587 I588 A593 L594Y538-V590 HydrophobicContact CE2-CG1 4.04Å; I586-V590 HydrophobicContact CG2-CG2 4.48Å; I586-V590 WeakPolarHBondContact O-CG2 3.39Å; I586-V590 PolarHBondContact O-N 2.87Å; I586-V590 VanDerWaalsContact O-N 3.08Å; Y587-V590 PolarHBondContact O-N 2.89Å; I588-V590 PolarHBondContact O-N 2.98Å; V590-A593 PolarHBondContact O-N 2.86Å; V590-L594 HydrophobicContact CG1-CD1 4.25Å; V590-L594 PolarHBondContact O-N 3.38Å
591G93.2Very high89.9Confident0 Ų034.5 Ų34.50%018%0.176CC..Hα-helixtrans-70.5-34.4-177.400000113.8Y538 M565 Y587 I588 L594 T595Y538-G591 PolarHBondContact OH-N 3.3Å; M565-G591 WeakPolarHBondContact SD-CA 3.42Å; Y587-G591 PolarHBondContact O-N 3.28Å; I588-G591 PolarHBondContact O-N 2.87Å; G591-L594 PolarHBondContact O-N 3.28Å; G591-T595 WeakPolarHBondContact O-CB 3.41Å; G591-T595 PolarHBondContact O-N 2.81Å; G591-T595 PolarHBondContact O-OG1 2.83Å
592L92.8Very high89.4Confident6 Ų634.6 Ų34.63%0.03118%0.177CC..Hα-helixtrans-62.5-45.4169.6-72174.8000110.8T426 I428 I459 T567 I588 L594 T595 T596T426-L592 HydrophobicContact CG2-CD1 3.4Å; T426-L592 VanDerWaalsContact CG2-CD1 3.4Å; I428-L592 HydrophobicContact CD1-CD1 4.25Å; I459-L592 HydrophobicContact CD1-CB 4.04Å; I459-L592 HydrophobicContact CD1-CD1 4.42Å; T567-L592 HydrophobicContact CG2-CD2 3.32Å; I588-L592 HydrophobicContact CG2-CD1 3.71Å; I588-L592 HydrophobicContact CG2-CG 4.15Å; I588-L592 WeakPolarHBondContact O-CB 3.37Å; I588-L592 VanDerWaalsContact O-CG 3.22Å; I588-L592 WeakPolarHBondContact O-CG 2.83Å; I588-L592 PolarHBondContact O-N 3.33Å; L592-L594 VanDerWaalsContact C-N 3.31Å; L592-L594 PolarHBondContact O-N 2.87Å; L592-T595 PolarHBondContact O-N 3.16Å; L592-T595 VanDerWaalsContact O-N 3.07Å; L592-T596 PolarHBondContact O-N 2.92Å; L592-T596 PolarHBondContact O-OG1 3.5Å
593A91.4Very high88.7Confident0 Ų030 Ų300%016%0.162CC..Hα-helixtrans-60.2-39.2175.900000113.1I462 L466 V589 V590 M597I462-A593 HydrophobicContact CB-CB 3.85Å; I462-A593 HydrophobicContact CG2-CB 3.41Å; I462-A593 VanDerWaalsContact CG2-CB 3.41Å; L466-A593 HydrophobicContact CD1-CB 3.78Å; V589-A593 PolarHBondContact O-N 3.35Å; V590-A593 PolarHBondContact O-N 2.86Å; A593-M597 WeakPolarHBondContact O-CB 2.88Å; A593-M597 PolarHBondContact O-N 3.45Å; A593-M597 VanDerWaalsContact O-N 3.08Å
594L91.8Very high87.8Confident12 Ų1227.5 Ų27.56%0.06316%0.158CC..Hα-helixtrans-64-41.7172.3-75.6170.3000112.1L466 I470 V534 Y538 V590 G591 L592 M597 C598L466-L594 HydrophobicContact CD1-CD2 3.86Å; L466-L594 HydrophobicContact CD1-CG 3.92Å; L466-L594 HydrophobicContact CD2-CD2 4.36Å; L466-L594 HydrophobicContact CG-CD2 4.49Å; I470-L594 HydrophobicContact CD1-CD2 4.49Å; V534-L594 HydrophobicContact CG1-CD2 4.2Å; Y538-L594 HydrophobicContact CD1-CD1 4.02Å; Y538-L594 HydrophobicContact CD2-CD1 3.43Å; Y538-L594 VanDerWaalsContact CD2-CD1 3.43Å; Y538-L594 HydrophobicContact CE1-CD1 4.32Å; Y538-L594 HydrophobicContact CE2-CD1 3.75Å; Y538-L594 HydrophobicContact CG-CD1 3.56Å; V590-L594 HydrophobicContact CG1-CD1 4.25Å; V590-L594 PolarHBondContact O-N 3.38Å; G591-L594 PolarHBondContact O-N 3.28Å; L592-L594 VanDerWaalsContact C-N 3.31Å; L592-L594 PolarHBondContact O-N 2.87Å; L594-M597 PolarHBondContact O-N 3.24Å; L594-C598 WeakPolarHBondContact O-CB 2.9Å; L594-C598 PolarHBondContact O-N 2.98Å; L594-C598 PolarHBondContact O-SG 3.35Å
595T90.6Very high86.9Confident14 Ų1431.9 Ų31.99%0.08618%0.178CC..Hα-helixtrans-66.7-45.9-179.5-54.70000111.1L535 M565 G591 L592 M597 C598 I599L535-T595 WeakPolarHBondContact CD1-OG1 3.44Å; M565-T595 WeakPolarHBondContact O-CG2 3.48Å; G591-T595 WeakPolarHBondContact O-CB 3.41Å; G591-T595 PolarHBondContact O-N 2.81Å; G591-T595 PolarHBondContact O-OG1 2.83Å; L592-T595 PolarHBondContact O-N 3.16Å; L592-T595 VanDerWaalsContact O-N 3.07Å; T595-M597 PolarHBondContact O-N 2.77Å; T595-C598 PolarHBondContact O-N 3.25Å; T595-C598 VanDerWaalsContact O-N 3.14Å; T595-I599 HydrophobicContact CG2-CD1 3.96Å; T595-I599 HydrophobicContact CG2-CG1 4.47Å; T595-I599 WeakPolarHBondContact O-CG1 3.03Å; T595-I599 PolarHBondContact O-N 3.5Å
596T87.8Confident85.9Confident46 Ų4636.7 Ų36.728%0.28220%0.196SC..Hα-helixtrans-61.5-44176.8-43.50000111.4I459 L592 C598 I599 D600I459-T596 HydrophobicContact CG2-CG2 3.96Å; I459-T596 WeakPolarHBondContact CG2-OG1 3.42Å; L592-T596 PolarHBondContact O-N 2.92Å; L592-T596 PolarHBondContact O-OG1 3.5Å; T596-C598 VanDerWaalsContact C-N 3.31Å; T596-C598 PolarHBondContact O-N 3.33Å; T596-I599 PolarHBondContact O-N 2.95Å; T596-D600 VanDerWaalsContact O-CG 3.3Å; T596-D600 PolarHBondContact O-N 3.01Å
597M87.3Confident84.8Confident7 Ų735.4 Ų35.43%0.03419%0.19CC..Hα-helixtrans-57-44.3173178.3-160.8152.500111.9L466 I470 L526 A593 L594 T595 D600 L601L466-M597 HydrophobicContact CB-SD 4Å; I470-M597 HydrophobicContact CD1-CE 3.59Å; I470-M597 HydrophobicContact CD1-SD 3.8Å; L526-M597 HydrophobicContact CD2-CE 3.44Å; L526-M597 VanDerWaalsContact CD2-CE 3.44Å; A593-M597 WeakPolarHBondContact O-CB 2.88Å; A593-M597 PolarHBondContact O-N 3.45Å; A593-M597 VanDerWaalsContact O-N 3.08Å; L594-M597 PolarHBondContact O-N 3.24Å; T595-M597 PolarHBondContact O-N 2.77Å; M597-D600 PolarHBondContact O-N 3.36Å; M597-L601 HydrophobicContact CE-CD1 3.49Å; M597-L601 VanDerWaalsContact CE-CD1 3.49Å; M597-L601 HydrophobicContact CG-CD1 4.22Å; M597-L601 WeakPolarHBondContact O-CG 3.1Å; M597-L601 PolarHBondContact O-N 2.98Å
598C86.5Confident83.7Confident2 Ų239.2 Ų39.21%0.01422%0.215CC..Hα-helixtrans-66.5-40.5179.5-70.40000112.2A531 M532 L535 L594 T595 T596 A602A531-C598 PolarHBondContact O-SG 2.92Å; A531-C598 VanDerWaalsContact O-SG 3.36Å; M532-C598 HydrophobicContact CE-CB 4.04Å; L535-C598 HydrophobicContact CD2-CB 4.1Å; L594-C598 WeakPolarHBondContact O-CB 2.9Å; L594-C598 PolarHBondContact O-N 2.98Å; L594-C598 PolarHBondContact O-SG 3.35Å; T595-C598 PolarHBondContact O-N 3.25Å; T595-C598 VanDerWaalsContact O-N 3.14Å; T596-C598 VanDerWaalsContact C-N 3.31Å; T596-C598 PolarHBondContact O-N 3.33Å; C598-A602 WeakPolarHBondContact O-CB 3.3Å; C598-A602 PolarHBondContact O-N 3.38Å
599I83.5Confident82.6Confident46 Ų4645.5 Ų45.524%0.23624%0.242CC..Hα-helixtrans-61.8-45.9175.1-71.9170.1000110.3L205 T595 T596 A602 G603L205-I599 HydrophobicContact CD1-CD1 4.01Å; L205-I599 HydrophobicContact CD1-CG2 3.5Å; T595-I599 HydrophobicContact CG2-CD1 3.96Å; T595-I599 HydrophobicContact CG2-CG1 4.47Å; T595-I599 WeakPolarHBondContact O-CG1 3.03Å; T595-I599 PolarHBondContact O-N 3.5Å; T596-I599 PolarHBondContact O-N 2.95Å; I599-A602 PolarHBondContact O-N 2.75Å; I599-G603 WeakPolarHBondContact O-CA 3.13Å; I599-G603 PolarHBondContact O-N 3.43Å
600D80.9Confident81.4Confident103 Ų10348 Ų4855%0.55125%0.254SS*.Hα-helixtrans-62.2-45.9179.8-72.2-20.8000111.8T596 M597 G603 S604T596-D600 VanDerWaalsContact O-CG 3.3Å; T596-D600 PolarHBondContact O-N 3.01Å; M597-D600 PolarHBondContact O-N 3.36Å; D600-G603 PolarHBondContact O-N 3.06Å; D600-S604 PolarHBondContact O-N 3.43Å; D600-S604 VanDerWaalsContact O-N 3.11Å
601L81.1Confident80Confident37 Ų3750.9 Ų50.919%0.19426%0.263CS..Hα-helixtrans-65.1-47.6177.8-71.3175.6000111.7L526 V528 A531 M597 G603 S604 E605L526-L601 HydrophobicContact CD2-CD1 3.79Å; L526-L601 HydrophobicContact CG-CD1 4.48Å; V528-L601 HydrophobicContact CG2-CB 4.24Å; V528-L601 WeakPolarHBondContact CG2-O 3.47Å; A531-L601 HydrophobicContact CB-CD1 3.85Å; M597-L601 HydrophobicContact CE-CD1 3.49Å; M597-L601 VanDerWaalsContact CE-CD1 3.49Å; M597-L601 HydrophobicContact CG-CD1 4.22Å; M597-L601 WeakPolarHBondContact O-CG 3.1Å; M597-L601 PolarHBondContact O-N 2.98Å; L601-G603 PolarHBondContact O-N 3.24Å; L601-S604 PolarHBondContact O-N 2.79Å; L601-S604 PolarHBondContact O-OG 3.47Å; L601-E605 PolarHBondContact O-N 2.91Å
602A78.8Confident78.6Confident3 Ų357.3 Ų57.33%0.02529%0.288CS..Hα-helixtrans-62.3-44177.600000111.4V528 M532 C598 I599 S604 E605 Y606V528-A602 HydrophobicContact CG1-CB 4.05Å; M532-A602 HydrophobicContact CE-CB 3.76Å; C598-A602 WeakPolarHBondContact O-CB 3.3Å; C598-A602 PolarHBondContact O-N 3.38Å; I599-A602 PolarHBondContact O-N 2.75Å; A602-S604 VanDerWaalsContact C-N 3.31Å; A602-S604 PolarHBondContact O-N 3.38Å; A602-E605 PolarHBondContact O-N 2.77Å; A602-Y606 HydrophobicContact CB-CD2 4.19Å; A602-Y606 HydrophobicContact CB-CE2 4.22Å; A602-Y606 WeakPolarHBondContact O-CD2 3.45Å; A602-Y606 PolarHBondContact O-N 3.45Å
603G75.6Confident77.1Confident16 Ų1662.9 Ų62.917%0.16531%0.313CS..Hα-helixtrans-56.4-43.7178.100000112.3I599 D600 L601 E605 Y606 I607I599-G603 WeakPolarHBondContact O-CA 3.13Å; I599-G603 PolarHBondContact O-N 3.43Å; D600-G603 PolarHBondContact O-N 3.06Å; L601-G603 PolarHBondContact O-N 3.24Å; G603-E605 PolarHBondContact O-N 3.05Å; G603-Y606 PolarHBondContact O-N 2.8Å; G603-I607 WeakPolarHBondContact O-CB 3.38Å; G603-I607 WeakPolarHBondContact O-CD1 3.39Å; G603-I607 VanDerWaalsContact O-CG1 3.22Å; G603-I607 WeakPolarHBondContact O-CG1 3.16Å; G603-I607 PolarHBondContact O-N 3.44Å
604S74.3Confident75.6Confident62 Ų6264.2 Ų64.243%0.43433%0.326SS..Hα-helixtrans-60.6-41.6178.174.50000113.4D600 L601 A602 T608D600-S604 PolarHBondContact O-N 3.43Å; D600-S604 VanDerWaalsContact O-N 3.11Å; L601-S604 PolarHBondContact O-N 2.79Å; L601-S604 PolarHBondContact O-OG 3.47Å; A602-S604 VanDerWaalsContact C-N 3.31Å; A602-S604 PolarHBondContact O-N 3.38Å; S604-T608 WeakPolarHBondContact O-CB 3.08Å; S604-T608 PolarHBondContact O-N 3.03Å; S604-T608 PolarHBondContact O-OG1 3.08Å
605E74.4Confident74.1Confident92 Ų9269.2 Ų69.243%0.4335%0.349SS..Hα-helixtrans-69.8-44.2175.6-82-70.9147.200112V528 L601 A602 G603 T608 K609V528-E605 HydrophobicContact CB-CG 4.4Å; V528-E605 HydrophobicContact CG2-CB 4.15Å; V528-E605 HydrophobicContact CG2-CG 3.43Å; V528-E605 VanDerWaalsContact CG2-CG 3.43Å; L601-E605 PolarHBondContact O-N 2.91Å; A602-E605 PolarHBondContact O-N 2.77Å; G603-E605 PolarHBondContact O-N 3.05Å; E605-T608 PolarHBondContact O-N 3.27Å; E605-K609 WeakPolarHBondContact O-CG 3.31Å; E605-K609 PolarHBondContact O-N 2.99Å; E605-K609 IonicContact OE2-NZ 2.76Å
606Y71.8Confident72.6Confident124 Ų12473.8 Ų73.849%0.48637%0.368SS..Hα-helixtrans-63-45.8179.2-85-68.3000111.8I206 A602 G603 T608 K609 L610I206-Y606 HydrophobicContact CD1-CD2 4.37Å; I206-Y606 HydrophobicContact CD1-CG 4.07Å; A602-Y606 HydrophobicContact CB-CD2 4.19Å; A602-Y606 HydrophobicContact CB-CE2 4.22Å; A602-Y606 WeakPolarHBondContact O-CD2 3.45Å; A602-Y606 PolarHBondContact O-N 3.45Å; G603-Y606 PolarHBondContact O-N 2.8Å; Y606-T608 VanDerWaalsContact C-N 3.29Å; Y606-T608 PolarHBondContact O-N 3.08Å; Y606-K609 PolarHBondContact O-N 2.86Å; Y606-L610 VanDerWaalsContact O-CB 3.27Å; Y606-L610 WeakPolarHBondContact O-CB 3.42Å; Y606-L610 PolarHBondContact O-N 2.83Å
607I68.7Low71.1Confident77 Ų7776 Ų7640%0.39538%0.377SS..Hα-helixtrans-60-42.3177.2-70.1165.9000110.4G603 L610 H611G603-I607 WeakPolarHBondContact O-CB 3.38Å; G603-I607 WeakPolarHBondContact O-CD1 3.39Å; G603-I607 VanDerWaalsContact O-CG1 3.22Å; G603-I607 WeakPolarHBondContact O-CG1 3.16Å; G603-I607 PolarHBondContact O-N 3.44Å; I607-L610 PolarHBondContact O-N 3.27Å; I607-H611 WeakPolarHBondContact O-CB 3.46Å; I607-H611 PolarHBondContact O-N 3.2Å
608T71Confident69.4Low94 Ų9479.7 Ų79.758%0.57739%0.394SS*.Hα-helixtrans-63.6-44.5178.8-56.80000111.5S604 E605 Y606 H611 Y612S604-T608 WeakPolarHBondContact O-CB 3.08Å; S604-T608 PolarHBondContact O-N 3.03Å; S604-T608 PolarHBondContact O-OG1 3.08Å; E605-T608 PolarHBondContact O-N 3.27Å; Y606-T608 VanDerWaalsContact C-N 3.29Å; Y606-T608 PolarHBondContact O-N 3.08Å; T608-H611 PolarHBondContact O-N 3.42Å; T608-Y612 WeakPolarHBondContact O-CB 3.31Å; T608-Y612 PolarHBondContact O-N 3.4Å
609K70.5Confident67.8Low131 Ų13183.9 Ų83.957%0.5742%0.42SS*.Hα-helixtrans-67.6-39.2176.2-71.8175.9-174.9171.50112.5E605 Y606 Y612 F613E605-K609 WeakPolarHBondContact O-CG 3.31Å; E605-K609 PolarHBondContact O-N 2.99Å; E605-K609 IonicContact OE2-NZ 2.76Å; Y606-K609 PolarHBondContact O-N 2.86Å; K609-Y612 WeakPolarHBondContact O-CB 3.27Å; K609-Y612 PolarHBondContact O-N 2.85Å; K609-F613 WeakPolarHBondContact O-CB 3.49Å; K609-F613 PolarHBondContact O-N 3.33Å
610L66.5Low66.3Low80 Ų8084.3 Ų84.342%0.41943%0.43SS..Hα-helixtrans-65.5-42.3176.4-173.667.6000110.8L64 I206 Y606 I607 Y612 F613 G614L64-L610 HydrophobicContact CD2-CD2 4.46Å; I206-L610 HydrophobicContact CG2-CD2 4.46Å; Y606-L610 VanDerWaalsContact O-CB 3.27Å; Y606-L610 WeakPolarHBondContact O-CB 3.42Å; Y606-L610 PolarHBondContact O-N 2.83Å; I607-L610 PolarHBondContact O-N 3.27Å; L610-Y612 VanDerWaalsContact C-N 3.34Å; L610-Y612 PolarHBondContact O-N 2.92Å; L610-F613 PolarHBondContact O-N 2.89Å; L610-G614 PolarHBondContact O-N 3.49Å
611H60.9Low64.8Low116 Ų11683.6 Ų83.654%0.53742%0.42SS..Hα-helixtrans-60.6-42.7172.8-99.3-51.6000112I607 T608 G614 Q615I607-H611 WeakPolarHBondContact O-CB 3.46Å; I607-H611 PolarHBondContact O-N 3.2Å; T608-H611 PolarHBondContact O-N 3.42Å; H611-G614 PolarHBondContact O-N 2.95Å; H611-Q615 WeakPolarHBondContact O-CB 3.4Å; H611-Q615 WeakPolarHBondContact O-CG 3.29Å; H611-Q615 PolarHBondContact O-N 2.97Å
612Y63.6Low63.4Low135 Ų13585.1 Ų85.153%0.52943%0.428SS..Hα-helixtrans-63-41.2175.6-179.7-102.3000112.4T608 K609 L610 K616T608-Y612 WeakPolarHBondContact O-CB 3.31Å; T608-Y612 PolarHBondContact O-N 3.4Å; K609-Y612 WeakPolarHBondContact O-CB 3.27Å; K609-Y612 PolarHBondContact O-N 2.85Å; L610-Y612 VanDerWaalsContact C-N 3.34Å; L610-Y612 PolarHBondContact O-N 2.92Å; Y612-K616 HydrophobicContact CD1-CD 4.47Å; Y612-K616 HydrophobicContact CE1-CD 3.97Å; Y612-K616 PolarHBondContact O-N 3.49Å; Y612-K616 VanDerWaalsContact O-N 3.13Å; Y612-K616 WeakPolarHBondContact OH-CE 3.37Å; Y612-K616 PolarHBondContact OH-NZ 2.96Å
613F61.7Low62.1Low124 Ų12489.3 Ų89.354%0.54445%0.453SS..Hα-helixtrans-68-43.3175.6-175-104.6000112.2K609 L610 Q615 K616 I617K609-F613 WeakPolarHBondContact O-CB 3.49Å; K609-F613 PolarHBondContact O-N 3.33Å; L610-F613 PolarHBondContact O-N 2.89Å; F613-Q615 PolarHBondContact O-N 2.88Å; F613-K616 WeakPolarHBondContact O-CB 3.33Å; F613-K616 PolarHBondContact O-N 3.38Å; F613-K616 VanDerWaalsContact O-N 3.1Å; F613-I617 HydrophobicContact CD1-CD1 3.85Å; F613-I617 HydrophobicContact CD1-CG1 4.42Å; F613-I617 HydrophobicContact CE1-CD1 3.23Å; F613-I617 HydrophobicContact CE1-CG1 4.04Å; F613-I617 HydrophobicContact CZ-CD1 3.69Å; F613-I617 HydrophobicContact CZ-CG1 4.2Å; F613-I617 PolarHBondContact O-N 3.07Å
614G61Low60.5Low27 Ų2793 Ų9328%0.27847%0.472SS..Hα-helixtrans-58.2-44.5174.600000112.2L610 H611 K616 I617 E618L610-G614 PolarHBondContact O-N 3.49Å; H611-G614 PolarHBondContact O-N 2.95Å; G614-K616 VanDerWaalsContact C-N 3.32Å; G614-K616 PolarHBondContact O-N 3.3Å; G614-I617 PolarHBondContact O-N 3.45Å; G614-E618 WeakPolarHBondContact O-CB 3.45Å; G614-E618 PolarHBondContact O-N 2.98Å
615Q59.1Low59Low117 Ų11791.3 Ų91.355%0.54747%0.465SS..Hα-helixtrans-62-36.7173.5-79.6-176.9-4.300112.7H611 F613 E618 T619H611-Q615 WeakPolarHBondContact O-CB 3.4Å; H611-Q615 WeakPolarHBondContact O-CG 3.29Å; H611-Q615 PolarHBondContact O-N 2.97Å; F613-Q615 PolarHBondContact O-N 2.88Å; Q615-E618 PolarHBondContact O-N 3.35Å; Q615-T619 WeakPolarHBondContact O-CB 3.26Å; Q615-T619 PolarHBondContact O-N 3Å; Q615-T619 PolarHBondContact O-OG1 3.32Å
616K60Low57.4Low111 Ų11188.3 Ų88.348%0.48346%0.458SS..Hα-helixtrans-67.9-43174.8-79.6-174.2174.3177.70112.4Y612 F613 G614 E618 T619 A620Y612-K616 HydrophobicContact CD1-CD 4.47Å; Y612-K616 HydrophobicContact CE1-CD 3.97Å; Y612-K616 PolarHBondContact O-N 3.49Å; Y612-K616 VanDerWaalsContact O-N 3.13Å; Y612-K616 WeakPolarHBondContact OH-CE 3.37Å; Y612-K616 PolarHBondContact OH-NZ 2.96Å; F613-K616 WeakPolarHBondContact O-CB 3.33Å; F613-K616 PolarHBondContact O-N 3.38Å; F613-K616 VanDerWaalsContact O-N 3.1Å; G614-K616 VanDerWaalsContact C-N 3.32Å; G614-K616 PolarHBondContact O-N 3.3Å; K616-E618 VanDerWaalsContact C-N 3.31Å; K616-T619 PolarHBondContact O-N 2.92Å; K616-A620 WeakPolarHBondContact O-CB 3.46Å; K616-A620 PolarHBondContact O-N 3.38Å
617I55.6Low55.8Low91 Ų9185.3 Ų85.347%0.46746%0.459SS..Hα-helixtrans-62.2-42.1172.8-73.8-178.1000110.2F613 G614 A620 R621F613-I617 HydrophobicContact CD1-CD1 3.85Å; F613-I617 HydrophobicContact CD1-CG1 4.42Å; F613-I617 HydrophobicContact CE1-CD1 3.23Å; F613-I617 HydrophobicContact CE1-CG1 4.04Å; F613-I617 HydrophobicContact CZ-CD1 3.69Å; F613-I617 HydrophobicContact CZ-CG1 4.2Å; F613-I617 PolarHBondContact O-N 3.07Å; G614-I617 PolarHBondContact O-N 3.45Å; I617-A620 PolarHBondContact O-N 2.94Å; I617-R621 WeakPolarHBondContact O-CB 3.25Å; I617-R621 PolarHBondContact O-N 2.79Å
618E51.9Low54.3Low86 Ų8686 Ų8640%0.40247%0.466SS..Hα-helixtrans-62.4-45.4177.3-173.5170.7-153.500111G614 Q615 K616 A620 R621 D622G614-E618 WeakPolarHBondContact O-CB 3.45Å; G614-E618 PolarHBondContact O-N 2.98Å; Q615-E618 PolarHBondContact O-N 3.35Å; K616-E618 VanDerWaalsContact C-N 3.31Å; E618-A620 VanDerWaalsContact C-N 3.35Å; E618-A620 PolarHBondContact O-N 2.84Å; E618-R621 PolarHBondContact O-N 3.49Å; E618-D622 VanDerWaalsContact O-CB 3.3Å; E618-D622 WeakPolarHBondContact O-CB 3.36Å; E618-D622 PolarHBondContact O-N 3.17Å
619T53.6Low52.6Low90 Ų9085 Ų8555%0.55246%0.46SS*.Hα-helixtrans-60.8-44174.4-52.80000111Q615 K616 D622 V623Q615-T619 WeakPolarHBondContact O-CB 3.26Å; Q615-T619 PolarHBondContact O-N 3Å; Q615-T619 PolarHBondContact O-OG1 3.32Å; K616-T619 PolarHBondContact O-N 2.92Å; T619-D622 PolarHBondContact O-N 3.21Å; T619-V623 WeakPolarHBondContact O-CB 3.34Å; T619-V623 WeakPolarHBondContact O-CG2 3.09Å; T619-V623 PolarHBondContact O-N 3.44Å
620A52.1Low51.1Low54 Ų5480.9 Ų80.945%0.44645%0.448SS..Hα-helixtrans-64.9-41.5177.700000112.2K616 I617 E618 V623 V624K616-A620 WeakPolarHBondContact O-CB 3.46Å; K616-A620 PolarHBondContact O-N 3.38Å; I617-A620 PolarHBondContact O-N 2.94Å; E618-A620 VanDerWaalsContact C-N 3.35Å; E618-A620 PolarHBondContact O-N 2.84Å; A620-V623 PolarHBondContact O-N 3.34Å; A620-V624 VanDerWaalsContact O-CG2 3.31Å; A620-V624 WeakPolarHBondContact O-CG2 3.41Å; A620-V624 PolarHBondContact O-N 3.08Å
621R49.3Very low49.4Very low88 Ų8879.6 Ų79.633%0.33245%0.454SS..Hα-helixtrans-71.7-36.6176.5-170.8-171.465.3-176-15.5111.8I617 E618 V623 V624 G625I617-R621 WeakPolarHBondContact O-CB 3.25Å; I617-R621 PolarHBondContact O-N 2.79Å; E618-R621 PolarHBondContact O-N 3.49Å; R621-V623 VanDerWaalsContact C-N 3.26Å; R621-V624 PolarHBondContact O-N 2.72Å; R621-G625 VanDerWaalsContact O-CA 3.24Å; R621-G625 WeakPolarHBondContact O-CA 3.5Å; R621-G625 PolarHBondContact O-N 3.16Å
622D51.3Low47.9Very low70 Ų7080.8 Ų80.837%0.37446%0.464SS..Hα-helixtrans-70.7-27.8174.5-76.7-6.6000110.6K56 E618 T619 G626K56-D622 IonicContact NZ-OD1 3.08Å; K56-D622 PolarHBondContact NZ-OD1 2.89Å; K56-D622 IonicContact NZ-OD2 3.25Å; E618-D622 VanDerWaalsContact O-CB 3.3Å; E618-D622 WeakPolarHBondContact O-CB 3.36Å; E618-D622 PolarHBondContact O-N 3.17Å; T619-D622 PolarHBondContact O-N 3.21Å; D622-G626 WeakPolarHBondContact O-CA 3.25Å; D622-G626 PolarHBondContact O-N 2.93Å
623V50.8Low46.4Very low90 Ų9077.7 Ų77.755%0.54545%0.454SS..Hα-helixtrans-70.9-46.1168.51700000111.5T619 A620 R621 A627T619-V623 WeakPolarHBondContact O-CB 3.34Å; T619-V623 WeakPolarHBondContact O-CG2 3.09Å; T619-V623 PolarHBondContact O-N 3.44Å; A620-V623 PolarHBondContact O-N 3.34Å; R621-V623 VanDerWaalsContact C-N 3.26Å; V623-A627 WeakPolarHBondContact O-CB 3.42Å; V623-A627 PolarHBondContact O-N 2.83Å
624V42.2Very low45Very low94 Ų9473.8 Ų73.857%0.5744%0.44SS*.Hα-helixtrans-73.6-51.8-179.6172.50000111.7A620 R621 G626 A627 V628A620-V624 VanDerWaalsContact O-CG2 3.31Å; A620-V624 WeakPolarHBondContact O-CG2 3.41Å; A620-V624 PolarHBondContact O-N 3.08Å; R621-V624 PolarHBondContact O-N 2.72Å; V624-G626 VanDerWaalsContact C-N 3.33Å; V624-A627 CarbonylContact O-C 3.44Å; V624-A627 WeakPolarHBondContact O-CA 3.24Å; V624-A627 WeakPolarHBondContact O-CB 3.45Å; V624-A627 PolarHBondContact O-N 3.17Å; V624-V628 VanDerWaalsContact O-CG2 3.3Å; V624-V628 WeakPolarHBondContact O-CG2 3.48Å; V624-V628 PolarHBondContact O-N 3.09Å
625G43.6Very low43.4Very low27 Ų2775.5 Ų75.528%0.27846%0.457SS..Hα-helixtrans-64.2-37.2173.900000111.6R621 A627 V628 V629R621-G625 VanDerWaalsContact O-CA 3.24Å; R621-G625 WeakPolarHBondContact O-CA 3.5Å; R621-G625 PolarHBondContact O-N 3.16Å; G625-A627 VanDerWaalsContact C-N 3.33Å; G625-V628 PolarHBondContact O-N 2.94Å; G625-V629 WeakPolarHBondContact O-CA 3.25Å; G625-V629 WeakPolarHBondContact O-CB 3.36Å; G625-V629 WeakPolarHBondContact O-CG2 3.43Å; G625-V629 PolarHBondContact O-N 3.15Å
626G39.6Very low42Very low28 Ų2878.7 Ų78.729%0.28947%0.472SS..Hα-helixtrans-64.6-35.2167.500000112.1D622 V624 S630D622-G626 WeakPolarHBondContact O-CA 3.25Å; D622-G626 PolarHBondContact O-N 2.93Å; V624-G626 VanDerWaalsContact C-N 3.33Å; G626-S630 VanDerWaalsContact O-CA 3.3Å; G626-S630 WeakPolarHBondContact O-CA 3.36Å; G626-S630 WeakPolarHBondContact O-CB 3.42Å; G626-S630 PolarHBondContact O-N 3.33Å; G626-S630 PolarHBondContact O-OG 3.15Å
627A39.5Very low40.4Very low62 Ų6280.8 Ų80.851%0.51248%0.484SS..Hα-helixtrans-74.6-28.1173.400000113.5V623 V624 G625 G631V623-A627 WeakPolarHBondContact O-CB 3.42Å; V623-A627 PolarHBondContact O-N 2.83Å; V624-A627 CarbonylContact O-C 3.44Å; V624-A627 WeakPolarHBondContact O-CA 3.24Å; V624-A627 WeakPolarHBondContact O-CB 3.45Å; V624-A627 PolarHBondContact O-N 3.17Å; G625-A627 VanDerWaalsContact C-N 3.33Å; A627-G631 WeakPolarHBondContact O-CA 3.47Å; A627-G631 PolarHBondContact O-N 3.17Å
628V36.5Very low39Very low90 Ų9079.4 Ų79.455%0.54548%0.477SS..Hα-helixtrans-81.3-43.8175.6171.20000110.8V624 G625 G631 L632V624-V628 VanDerWaalsContact O-CG2 3.3Å; V624-V628 WeakPolarHBondContact O-CG2 3.48Å; V624-V628 PolarHBondContact O-N 3.09Å; G625-V628 PolarHBondContact O-N 2.94Å; V628-G631 CarbonylContact O-C 3.55Å; V628-G631 WeakPolarHBondContact O-CA 3.44Å; V628-G631 PolarHBondContact O-N 3.48Å; V628-L632 WeakPolarHBondContact O-CB 3.44Å; V628-L632 PolarHBondContact O-N 2.72Å
629V35.5Very low37.9Very low74 Ų7480.9 Ų80.945%0.44848%0.482SS..Hα-helixtrans-71-36.21741750000109.9G625 L632 H633G625-V629 WeakPolarHBondContact O-CA 3.25Å; G625-V629 WeakPolarHBondContact O-CB 3.36Å; G625-V629 WeakPolarHBondContact O-CG2 3.43Å; G625-V629 PolarHBondContact O-N 3.15Å; V629-L632 CarbonylContact O-C 3.58Å; V629-L632 PolarHBondContact O-N 2.98Å; V629-H633 VanDerWaalsContact CG1-ND1 3.31Å; V629-H633 WeakPolarHBondContact CG1-ND1 3.46Å; V629-H633 WeakPolarHBondContact O-CA 3.23Å; V629-H633 WeakPolarHBondContact O-CB 3.18Å; V629-H633 PolarHBondContact O-N 3.24Å; V629-H633 PolarHBondContact O-ND1 3.23Å
630S39Very low36.7Very low45 Ų4584.1 Ų84.132%0.31549%0.489SS..Hα-helixtrans-66.6-44.5164.6-600000108.8G626 L632 H633 V634G626-S630 VanDerWaalsContact O-CA 3.3Å; G626-S630 WeakPolarHBondContact O-CA 3.36Å; G626-S630 WeakPolarHBondContact O-CB 3.42Å; G626-S630 PolarHBondContact O-N 3.33Å; G626-S630 PolarHBondContact O-OG 3.15Å; S630-L632 PolarHBondContact O-N 3.15Å; S630-L632 VanDerWaalsContact O-N 3.08Å; S630-H633 PolarHBondContact O-N 3.49Å; S630-V634 VanDerWaalsContact C-CG2 3.5Å; S630-V634 WeakPolarHBondContact O-CA 3.42Å; S630-V634 WeakPolarHBondContact O-CB 3.32Å; S630-V634 WeakPolarHBondContact O-CG2 3.39Å; S630-V634 PolarHBondContact O-N 2.78Å
631G31.6Very low35.5Very low52 Ų5290.1 Ų90.154%0.53651%0.507SS..Hα-helixtrans-52.6-36.3172.800000113.8A627 V628 G635A627-G631 WeakPolarHBondContact O-CA 3.47Å; A627-G631 PolarHBondContact O-N 3.17Å; V628-G631 CarbonylContact O-C 3.55Å; V628-G631 WeakPolarHBondContact O-CA 3.44Å; V628-G631 PolarHBondContact O-N 3.48Å; G631-G635 PolarHBondContact O-N 3.39Å
632L28.1Very low34.5Very low142 Ų14289 Ų8974%0.74351%0.513SS*.Hα-helixtrans-83.6-40.8176.7-121.882.7000113.9V628 V629 S630V628-L632 WeakPolarHBondContact O-CB 3.44Å; V628-L632 PolarHBondContact O-N 2.72Å; V629-L632 CarbonylContact O-C 3.58Å; V629-L632 PolarHBondContact O-N 2.98Å; S630-L632 PolarHBondContact O-N 3.15Å; S630-L632 VanDerWaalsContact O-N 3.08Å
633H32.5Very low33.8Very low69 Ų6986.8 Ų86.832%0.31950%0.504SS..Hα-helixtrans-80.5-26.3178.4-8464.8000112.4V629 S630 G635 E636 Q637 I638V629-H633 VanDerWaalsContact CG1-ND1 3.31Å; V629-H633 WeakPolarHBondContact CG1-ND1 3.46Å; V629-H633 WeakPolarHBondContact O-CA 3.23Å; V629-H633 WeakPolarHBondContact O-CB 3.18Å; V629-H633 PolarHBondContact O-N 3.24Å; V629-H633 PolarHBondContact O-ND1 3.23Å; S630-H633 PolarHBondContact O-N 3.49Å; H633-G635 VanDerWaalsContact C-N 3.3Å; H633-E636 PolarHBondContact O-N 2.94Å; H633-Q637 PolarHBondContact O-N 3.16Å; H633-I638 HydrophobicContact CB-CD1 3.77Å; H633-I638 HydrophobicContact CB-CG1 4.44Å; H633-I638 PolarHBondContact O-N 3.45Å
634V32.7Very low33Very low43 Ų4387.1 Ų87.126%0.26150%0.498SS..THydrogen-bonded Turntrans-79.3-19.7173.5179.60000109.8S630 E636 I638 F639S630-V634 VanDerWaalsContact C-CG2 3.5Å; S630-V634 WeakPolarHBondContact O-CA 3.42Å; S630-V634 WeakPolarHBondContact O-CB 3.32Å; S630-V634 WeakPolarHBondContact O-CG2 3.39Å; S630-V634 PolarHBondContact O-N 2.78Å; V634-E636 PolarHBondContact O-N 3.08Å; V634-I638 HydrophobicContact CG2-CB 3.86Å; V634-I638 HydrophobicContact CG2-CG2 4.03Å; V634-F639 HydrophobicContact CG1-CD2 4.31Å; V634-F639 HydrophobicContact CG1-CE2 3.98Å; V634-F639 HydrophobicContact CG1-CZ 4.35Å
635G28.2Very low32.7Very low62 Ų6284 Ų8464%0.63948%0.478SS*.THydrogen-bonded Turntrans-57.4-33.716600000113.1G631 H633G631-G635 PolarHBondContact O-N 3.39Å; H633-G635 VanDerWaalsContact C-N 3.3Å
636E27.7Very low32.2Very low185 Ų18591.1 Ų91.186%0.86450%0.496SS*.THydrogen-bonded Turntrans-131.7-24-173.8-100.3-178.6156.300117.6H633 V634H633-E636 PolarHBondContact O-N 2.94Å; V634-E636 PolarHBondContact O-N 3.08Å
637Q28.2Very low32Very low154 Ų15491.4 Ų91.472%0.7249%0.493SS*.THydrogen-bonded Turntrans-133.4-14.6-171.5-77.3-172.4-18.200118.1H633H633-Q637 PolarHBondContact O-N 3.16Å
638I25.2Very low31.7Very low62 Ų6296.2 Ų96.232%0.31852%0.516SS..G310 helixtrans-98.7-0.7-170.9-63.5176.7000115H633 V634 K640H633-I638 HydrophobicContact CB-CD1 3.77Å; H633-I638 HydrophobicContact CB-CG1 4.44Å; H633-I638 PolarHBondContact O-N 3.45Å; V634-I638 HydrophobicContact CG2-CB 3.86Å; V634-I638 HydrophobicContact CG2-CG2 4.03Å; I638-K640 PolarHBondContact O-N 2.88Å
639F29Very low31.5Very low117 Ų11795.2 Ų95.251%0.51352%0.524SS..G310 helixtrans-62.6-5.3168.3-88.7-68000114.6V634 S688V634-F639 HydrophobicContact CG1-CD2 4.31Å; V634-F639 HydrophobicContact CG1-CE2 3.98Å; V634-F639 HydrophobicContact CG1-CZ 4.35Å; F639-S688 WeakPolarHBondContact CE1-OG 3.29Å
640K27.6Very low31.5Very low159 Ų15993.6 Ų93.669%0.69152%0.522SS*.G310 helixtrans-98.6-29.8-174.3-75.7-174.2173.61750118.1I638I638-K640 PolarHBondContact O-N 2.88Å
641H28.1Very low31.2Very low180 Ų18098.1 Ų98.183%0.83354%0.536SS*.THydrogen-bonded Turntrans-146.610.2-167.9-68.898.8000120.7
642S28.2Very low31.2Very low65 Ų65100.7 Ų100.746%0.45554%0.537SS..  trans-156.6114.5168.757.50000113
643A35.3Very low31.7Very low22 Ų2296.5 Ų96.518%0.18252%0.515CS..  trans-96.1140.4179.600000112.6I655 S685 P686A643-I655 HydrophobicContact CB-CD1 4.47Å; A643-I655 PolarHBondContact O-N 3.5Å; A643-S685 VanDerWaalsContact CB-OG 3.25Å; A643-S685 WeakPolarHBondContact CB-OG 3.47Å; A643-P686 HydrophobicContact CB-CG 4.02Å
644F34.9Very low31.8Very low98 Ų9899.7 Ų99.743%0.4353%0.53SS..EExtended strand (participates in β ladder)trans-109.2140171.9-66.6-94.8000109.6L652 I653 Q654F644-L652 HydrophobicContact CB-CD2 4.07Å; F644-L652 HydrophobicContact CG-CD2 4.49Å; F644-I653 WeakPolarHBondContact CA-O 3.48Å; F644-Q654 HydrophobicContact CD1-CB 3.88Å; F644-Q654 HydrophobicContact CD1-CG 4.3Å; F644-Q654 HydrophobicContact CE1-CB 3.58Å; F644-Q654 HydrophobicContact CE1-CG 3.71Å; F644-Q654 HydrophobicContact CZ-CB 4.48Å; F644-Q654 HydrophobicContact CZ-CG 4.13Å
645I36.6Very low32Very low29 Ų29100.5 Ų100.515%0.14953%0.532CS..EExtended strand (participates in β ladder)trans-101.2131.2172.5-66.8167.1000109.1L652 I653 I655 P686 F777I645-L652 CarbonylContact O-C 3.54Å; I645-L652 WeakPolarHBondContact O-CA 3.47Å; I645-I653 PolarHBondContact N-O 3.08Å; I645-I653 PolarHBondContact O-N 2.82Å; I645-I655 HydrophobicContact CD1-CD1 3.54Å; I645-I655 HydrophobicContact CD1-CG1 3.89Å; I645-I655 HydrophobicContact CG1-CD1 3.77Å; I645-I655 HydrophobicContact CG1-CG1 4.18Å; I645-P686 HydrophobicContact CG1-CG 4.32Å; I645-F777 HydrophobicContact CD1-CD2 3.56Å; I645-F777 HydrophobicContact CD1-CE2 3.99Å; I645-F777 HydrophobicContact CD1-CG 4.28Å
646R32.2Very low32.3Very low175 Ų175100.2 Ų100.266%0.6653%0.529SS*.EExtended strand (participates in β ladder)trans-93.1122.6167.1-170176.1-175-176-1108.7K651 L652R646-K651 WeakPolarHBondContact CA-O 3.3Å; R646-L652 HydrophobicContact CB-CD1 4.49Å; R646-L652 HydrophobicContact CG-CD1 4.24Å
647T35.9Very low32.7Very low35 Ų3598.7 Ų98.722%0.21553%0.527CS..PPolyproline II helixtrans-74.7161.8173.268.30000110.9G649 G650 K651 I653T647-G649 PolarHBondContact O-N 3.27Å; T647-G649 VanDerWaalsContact O-N 3.16Å; T647-G649 PolarHBondContact OG1-N 3.05Å; T647-G650 PolarHBondContact O-N 3.02Å; T647-K651 HydrophobicContact CG2-CB 4.45Å; T647-K651 PolarHBondContact N-O 3.14Å; T647-K651 WeakPolarHBondContact OG1-CB 3.37Å; T647-K651 PolarHBondContact OG1-N 3.31Å; T647-I653 HydrophobicContact CG2-CD1 3.99Å
648T31.9Very low33.1Very low162 Ų16295.7 Ų95.799%0.99452%0.521SS*.THydrogen-bonded Turntrans-55-28.817247.80000112.6G650T648-G650 VanDerWaalsContact C-N 3.28Å; T648-G650 PolarHBondContact O-N 3.38Å
649G32.9Very low33.7Very low70 Ų70100.3 Ų100.372%0.72254%0.539SS*.THydrogen-bonded Turntrans-81.710.7172.100000115.6T647 K651T647-G649 PolarHBondContact O-N 3.27Å; T647-G649 VanDerWaalsContact O-N 3.16Å; T647-G649 PolarHBondContact OG1-N 3.05Å; G649-K651 PolarHBondContact O-N 3.42Å
650G35.4Very low34.2Very low39 Ų39101.7 Ų101.740%0.40255%0.547SS..SBendtrans79.96.6175.100000116.1T647 T648T647-G650 PolarHBondContact O-N 3.02Å; T648-G650 VanDerWaalsContact C-N 3.28Å; T648-G650 PolarHBondContact O-N 3.38Å
651K33.1Very low34.9Very low140 Ų14095.2 Ų95.261%0.60952%0.52SS*.  trans-84.9125.2-179.2-168.2176.9-179.4179.80110.7R646 T647 G649 I653R646-K651 WeakPolarHBondContact CA-O 3.3Å; T647-K651 HydrophobicContact CG2-CB 4.45Å; T647-K651 PolarHBondContact N-O 3.14Å; T647-K651 WeakPolarHBondContact OG1-CB 3.37Å; T647-K651 PolarHBondContact OG1-N 3.31Å; G649-K651 PolarHBondContact O-N 3.42Å; K651-I653 HydrophobicContact CG-CG1 4.4Å
652L32.3Very low35.8Very low106 Ų10691.8 Ų91.856%0.55551%0.507SS*.EExtended strand (participates in β ladder)trans-84.1130.8170.1-92.588.9000110.7F644 I645 R646F644-L652 HydrophobicContact CB-CD2 4.07Å; F644-L652 HydrophobicContact CG-CD2 4.49Å; I645-L652 CarbonylContact O-C 3.54Å; I645-L652 WeakPolarHBondContact O-CA 3.47Å; R646-L652 HydrophobicContact CB-CD1 4.49Å; R646-L652 HydrophobicContact CG-CD1 4.24Å
653I36.9Very low37Very low55 Ų5593.6 Ų93.628%0.28252%0.516SS..EExtended strand (participates in β ladder)trans-125.6128177.3-55.5176.2000109.1F644 I645 T647 K651 L718F644-I653 WeakPolarHBondContact CA-O 3.48Å; I645-I653 PolarHBondContact N-O 3.08Å; I645-I653 PolarHBondContact O-N 2.82Å; T647-I653 HydrophobicContact CG2-CD1 3.99Å; K651-I653 HydrophobicContact CG-CG1 4.4Å; I653-L718 HydrophobicContact CD1-CD1 4.38Å
654Q36.5Very low37.7Very low136 Ų136101 Ų10164%0.63654%0.544SS*.EExtended strand (participates in β ladder)trans-73.3124.8173.9-169.7178.24.800109.9F644 G656F644-Q654 HydrophobicContact CD1-CB 3.88Å; F644-Q654 HydrophobicContact CD1-CG 4.3Å; F644-Q654 HydrophobicContact CE1-CB 3.58Å; F644-Q654 HydrophobicContact CE1-CG 3.71Å; F644-Q654 HydrophobicContact CZ-CB 4.48Å; F644-Q654 HydrophobicContact CZ-CG 4.13Å; Q654-G656 PolarHBondContact O-N 2.89Å
655I36.5Very low38.3Very low59 Ų5998.9 Ų98.930%0.30354%0.535SS..  trans-80.9109.5170.1-57.1169000106.8A643 I645 P686A643-I655 HydrophobicContact CB-CD1 4.47Å; A643-I655 PolarHBondContact O-N 3.5Å; I645-I655 HydrophobicContact CD1-CD1 3.54Å; I645-I655 HydrophobicContact CD1-CG1 3.89Å; I645-I655 HydrophobicContact CG1-CD1 3.77Å; I645-I655 HydrophobicContact CG1-CG1 4.18Å; I655-P686 HydrophobicContact CD1-CG 4.19Å
656G33.5Very low39Very low56 Ų5697.7 Ų97.758%0.57753%0.53SS*.  trans-65.4161170.600000112Q654Q654-G656 PolarHBondContact O-N 2.89Å
657D36Very low40Very low153 Ų15391.9 Ų91.982%0.81852%0.516SS*.SBendtrans-42.7147.2-171.9-65.6-42.6000115.7K659D657-K659 PolarHBondContact O-N 3.44Å; D657-K659 VanDerWaalsContact O-N 3.08Å
658P37.6Very low40.8Very low92 Ų9293.1 Ų93.160%0.59753%0.53SS*.  trans-55.4114.5-176.422.1-33.6000111.6T682P658-T682 HydrophobicContact CB-CG2 4.37Å
659K37.3Very low41.6Very low159 Ų15986.1 Ų86.169%0.69149%0.486SS*.PPolyproline II helixtrans-94.6123177.8-134.8176.4-175.7-179.60109.8D657D657-K659 PolarHBondContact O-N 3.44Å; D657-K659 VanDerWaalsContact O-N 3.08Å
660Q40.2Very low42.6Very low146 Ų14684.1 Ų84.168%0.68246%0.457SS*.BIsolated β-bridgetrans-67140.7172.8-70.4-178-11.900110.6
661L42.6Very low43.4Very low23 Ų2390.5 Ų90.512%0.1248%0.476CS..PPolyproline II helixtrans-65.7148174.4-86.580.3000110.8Q665 L669 F681 I683 V711L661-Q665 HydrophobicContact CB-CB 4.43Å; L661-Q665 HydrophobicContact CD2-CB 4Å; L661-L669 HydrophobicContact CD2-CD1 3.7Å; L661-F681 HydrophobicContact CD1-CB 4.22Å; L661-I683 HydrophobicContact CD1-CD1 3.75Å; L661-I683 HydrophobicContact CD1-CG1 3.72Å; L661-V711 HydrophobicContact CD2-CG1 4.08Å
662N46.5Very low44Very low107 Ų10788.2 Ų88.257%0.57247%0.466SS*.PPolyproline II helixtrans-69.5151.9174.7-161.20.7000110.9K664 Q665 A666N662-K664 VanDerWaalsContact C-N 3.3Å; N662-K664 PolarHBondContact O-N 2.9Å; N662-K664 VanDerWaalsContact O-N 3.15Å; N662-Q665 WeakPolarHBondContact O-CA 3.37Å; N662-Q665 WeakPolarHBondContact O-CB 3.49Å; N662-Q665 PolarHBondContact O-N 3.5Å; N662-A666 PolarHBondContact O-N 3.08Å
663T51.9Low44.9Very low104 Ų10487.9 Ų87.964%0.63846%0.46SS*.Hα-helixtrans-55.6-37.4-171.941.80000114.1Q665 S667T663-Q665 VanDerWaalsContact C-N 3.33Å; T663-Q665 PolarHBondContact O-N 3.03Å; T663-S667 WeakPolarHBondContact O-CB 3.48Å; T663-S667 PolarHBondContact O-N 2.87Å; T663-S667 PolarHBondContact O-OG 3.49Å
664K51.5Low45.2Very low176 Ų17688.5 Ų88.577%0.76548%0.48SS*.Hα-helixtrans-64-34.2174.2-80.6-172.7177-178.60113.7N662 S667 A668N662-K664 VanDerWaalsContact C-N 3.3Å; N662-K664 PolarHBondContact O-N 2.9Å; N662-K664 VanDerWaalsContact O-N 3.15Å; K664-S667 PolarHBondContact O-OG 2.9Å; K664-A668 WeakPolarHBondContact O-CB 3.06Å; K664-A668 PolarHBondContact O-N 3.12Å
665Q47.2Very low46Very low55 Ų5583.7 Ų83.726%0.25746%0.458SS..Hα-helixtrans-79.7-39.8-179.2-64.4168.7-2900110.3L661 N662 T663 A668 L669 V711L661-Q665 HydrophobicContact CB-CB 4.43Å; L661-Q665 HydrophobicContact CD2-CB 4Å; N662-Q665 WeakPolarHBondContact O-CA 3.37Å; N662-Q665 WeakPolarHBondContact O-CB 3.49Å; N662-Q665 PolarHBondContact O-N 3.5Å; T663-Q665 VanDerWaalsContact C-N 3.33Å; T663-Q665 PolarHBondContact O-N 3.03Å; Q665-A668 PolarHBondContact O-N 3.29Å; Q665-L669 PolarHBondContact O-N 3.33Å; Q665-V711 HydrophobicContact CB-CG1 4.4Å; Q665-V711 HydrophobicContact CG-CG1 4.3Å
666A51.9Low46.6Very low3 Ų384.4 Ų84.43%0.02547%0.467CS..Hα-helixtrans-62.3-43.2172.400000111.7N662 L669 R670 F681N662-A666 PolarHBondContact O-N 3.08Å; A666-L669 PolarHBondContact O-N 3.46Å; A666-R670 WeakPolarHBondContact O-CG 3.28Å; A666-R670 PolarHBondContact O-N 3.28Å; A666-F681 HydrophobicContact CB-CD2 4.16Å
667S52.6Low47.5Very low54 Ų5488.1 Ų88.138%0.37847%0.474SS..Hα-helixtrans-65.7-39.5178.1670000113.3T663 K664 L669 R670 H671T663-S667 WeakPolarHBondContact O-CB 3.48Å; T663-S667 PolarHBondContact O-N 2.87Å; T663-S667 PolarHBondContact O-OG 3.49Å; K664-S667 PolarHBondContact O-OG 2.9Å; S667-L669 VanDerWaalsContact C-N 3.29Å; S667-L669 PolarHBondContact O-N 3.13Å; S667-R670 PolarHBondContact O-N 3.1Å; S667-H671 PolarHBondContact O-N 3.36Å
668A52.5Low48.1Very low61 Ų6187 Ų8750%0.50447%0.468SS..Hα-helixtrans-60.4-40.817500000111.7K664 Q665 K672K664-A668 WeakPolarHBondContact O-CB 3.06Å; K664-A668 PolarHBondContact O-N 3.12Å; Q665-A668 PolarHBondContact O-N 3.29Å; A668-K672 WeakPolarHBondContact O-CB 3.44Å; A668-K672 PolarHBondContact O-N 3.12Å; A668-K672 VanDerWaalsContact O-N 3.16Å
669L47.7Very low48.5Very low14 Ų1484.8 Ų84.87%0.07345%0.448CS..Hα-helixtrans-67.3-42.8174.8-78.2170.1000112.6L661 Q665 A666 S667 H671 K672 F673 F681 V708 I774L661-L669 HydrophobicContact CD2-CD1 3.7Å; Q665-L669 PolarHBondContact O-N 3.33Å; A666-L669 PolarHBondContact O-N 3.46Å; S667-L669 VanDerWaalsContact C-N 3.29Å; S667-L669 PolarHBondContact O-N 3.13Å; L669-H671 PolarHBondContact O-N 2.99Å; L669-K672 PolarHBondContact O-N 3.08Å; L669-F673 HydrophobicContact CD2-CD2 4.27Å; L669-F673 HydrophobicContact CD2-CE2 3.83Å; L669-F673 WeakPolarHBondContact O-CD2 3.42Å; L669-F673 PolarHBondContact O-N 3.48Å; L669-F673 VanDerWaalsContact O-N 3.14Å; L669-F681 HydrophobicContact CB-CD2 4.1Å; L669-F681 HydrophobicContact CB-CE1 4.24Å; L669-F681 HydrophobicContact CB-CE2 3.41Å; L669-F681 VanDerWaalsContact CB-CE2 3.41Å; L669-F681 HydrophobicContact CB-CZ 3.5Å; L669-F681 HydrophobicContact CD1-CD1 4.33Å; L669-F681 HydrophobicContact CD1-CD2 4.02Å; L669-F681 HydrophobicContact CD1-CE1 4.47Å; L669-F681 HydrophobicContact CD1-CE2 4.17Å; L669-F681 HydrophobicContact CD1-CG 4.11Å; L669-F681 HydrophobicContact CD1-CZ 4.39Å; L669-F681 HydrophobicContact CG-CE2 4.43Å; L669-F681 HydrophobicContact CG-CZ 4.5Å; L669-V708 HydrophobicContact CD2-CG2 3.31Å; L669-I774 HydrophobicContact CD1-CD1 3.98Å
670R54.9Low48.8Very low28 Ų2880.8 Ų80.811%0.10643%0.434CS..Hα-helixtrans-57.8-49.1176.9-75-171.3-81.2-104.98.7111.5A666 S667 K672 G674 L675 P676 D677 Y679 D680 F681A666-R670 WeakPolarHBondContact O-CG 3.28Å; A666-R670 PolarHBondContact O-N 3.28Å; S667-R670 PolarHBondContact O-N 3.1Å; R670-K672 PolarHBondContact O-N 3.17Å; R670-G674 PolarHBondContact O-N 3.01Å; R670-G674 VanDerWaalsContact O-N 3.14Å; R670-L675 HydrophobicContact CB-CB 4.4Å; R670-L675 HydrophobicContact CG-CB 4.39Å; R670-L675 PolarHBondContact O-N 3.34Å; R670-P676 VanDerWaalsContact CD-O 3.29Å; R670-P676 WeakPolarHBondContact CD-O 3.41Å; R670-D677 PolarHBondContact NE-O 3.4Å; R670-Y679 WeakPolarHBondContact CD-O 3.36Å; R670-Y679 PolarHBondContact NH1-O 2.75Å; R670-D680 IonicContact NH1-OD1 3.03Å; R670-D680 PolarHBondContact NH1-OD1 3.42Å; R670-D680 VanDerWaalsContact NH1-OD1 3.16Å; R670-F681 HydrophobicContact CG-CE2 3.99Å; R670-F681 HydrophobicContact CG-CZ 4.49Å
671H52.6Low49.1Very low173 Ų17374.5 Ų74.580%0.80140%0.404SS*.Hα-helixtrans-61.6-42.5179-174.5-90.9000112.5S667 L669 G674S667-H671 PolarHBondContact O-N 3.36Å; L669-H671 PolarHBondContact O-N 2.99Å; H671-G674 PolarHBondContact O-N 3.16Å
672K46.1Very low49Very low92 Ų9274.5 Ų74.540%0.441%0.405SS..Hα-helixtrans-68.8-37.7-177.1-173.2172.3-176.6175.10113.6A668 L669 R670 E707A668-K672 WeakPolarHBondContact O-CB 3.44Å; A668-K672 PolarHBondContact O-N 3.12Å; A668-K672 VanDerWaalsContact O-N 3.16Å; L669-K672 PolarHBondContact O-N 3.08Å; R670-K672 PolarHBondContact O-N 3.17Å; K672-E707 VanDerWaalsContact CD-OE2 3.25Å; K672-E707 WeakPolarHBondContact CD-OE2 3.27Å; K672-E707 WeakPolarHBondContact CE-OE2 3.37Å; K672-E707 IonicContact NZ-OE1 2.71Å; K672-E707 PolarHBondContact NZ-OE1 3.01Å; K672-E707 IonicContact NZ-OE2 3.77Å; K672-E707 PolarHBondContact NZ-OE2 3.37Å
673F49.7Very low48.7Very low99 Ų9971 Ų7143%0.43439%0.386SS..THydrogen-bonded Turntrans-936.2179.4-69.5-72000113.6L669 L675 I730L669-F673 HydrophobicContact CD2-CD2 4.27Å; L669-F673 HydrophobicContact CD2-CE2 3.83Å; L669-F673 WeakPolarHBondContact O-CD2 3.42Å; L669-F673 PolarHBondContact O-N 3.48Å; L669-F673 VanDerWaalsContact O-N 3.14Å; F673-L675 VanDerWaalsContact C-N 3.27Å; F673-L675 HydrophobicContact CB-CD1 3.68Å; F673-L675 HydrophobicContact CB-CG 3.86Å; F673-L675 PolarHBondContact O-N 3.39Å; F673-I730 HydrophobicContact CE2-CD1 4.37Å; F673-I730 HydrophobicContact CZ-CD1 3.86Å
674G44.5Very low48Very low68 Ų6869.2 Ų69.270%0.70137%0.372SS*.THydrogen-bonded Turntrans63.131.8-178.600000113.4R670 H671R670-G674 PolarHBondContact O-N 3.01Å; R670-G674 VanDerWaalsContact O-N 3.14Å; H671-G674 PolarHBondContact O-N 3.16Å
675L52.8Low47.3Very low35 Ų3562.8 Ų62.818%0.18335%0.35CS..  trans-89.8140-176.6-64.6161.6000110.8R670 F673 Y679 F681 F772R670-L675 HydrophobicContact CB-CB 4.4Å; R670-L675 HydrophobicContact CG-CB 4.39Å; R670-L675 PolarHBondContact O-N 3.34Å; F673-L675 VanDerWaalsContact C-N 3.27Å; F673-L675 HydrophobicContact CB-CD1 3.68Å; F673-L675 HydrophobicContact CB-CG 3.86Å; F673-L675 PolarHBondContact O-N 3.39Å; L675-Y679 HydrophobicContact CB-CD2 4.19Å; L675-Y679 HydrophobicContact CB-CG 4.36Å; L675-Y679 HydrophobicContact CD2-CD1 4.45Å; L675-Y679 HydrophobicContact CD2-CD2 4.38Å; L675-Y679 HydrophobicContact CD2-CE1 4.44Å; L675-Y679 HydrophobicContact CD2-CE2 4.39Å; L675-Y679 HydrophobicContact CD2-CG 4.38Å; L675-F681 HydrophobicContact CD1-CE1 4.21Å; L675-F681 HydrophobicContact CD1-CZ 3.74Å; L675-F772 HydrophobicContact CD1-CD2 4.39Å; L675-F772 HydrophobicContact CD1-CE2 4.2Å; L675-F772 HydrophobicContact CD2-CE2 3.65Å; L675-F772 HydrophobicContact CD2-CZ 4.1Å
676P49.4Very low46.8Very low75 Ų7561.8 Ų61.849%0.48735%0.348SS..  trans-53.9154.5170.5-26.231.2000113.9R670 D678 Y679R670-P676 VanDerWaalsContact CD-O 3.29Å; R670-P676 WeakPolarHBondContact CD-O 3.41Å; P676-D678 PolarHBondContact O-N 3.19Å; P676-Y679 HydrophobicContact CB-CD2 3.98Å; P676-Y679 HydrophobicContact CB-CE2 4.13Å; P676-Y679 VanDerWaalsContact CD-CE2 3.48Å; P676-Y679 HydrophobicContact CG-CD2 4.06Å; P676-Y679 HydrophobicContact CG-CE2 3.76Å; P676-Y679 WeakPolarHBondContact O-CD2 3.29Å; P676-Y679 PolarHBondContact O-N 3.19Å
677D52.2Low45.9Very low133 Ų13365.8 Ų65.871%0.71137%0.368SS*.THydrogen-bonded Turntrans-58.9-21.2-179-76.7-33.4000114.4R670 Y679R670-D677 PolarHBondContact NE-O 3.4Å; D677-Y679 VanDerWaalsContact C-N 3.29Å; D677-Y679 PolarHBondContact O-N 3.12Å
678D47.8Very low44.9Very low130 Ų13065 Ų6570%0.69536%0.362SS*.THydrogen-bonded Turntrans-78-2.4-177.6-51.7-15.8000114.5P676P676-D678 PolarHBondContact O-N 3.19Å
679Y45.8Very low43.9Very low45 Ų4570 Ų7018%0.17637%0.368CS..  trans-90.6123.1-176.6-84.1-89.5000113.3R670 L675 P676 D677 K770 F772R670-Y679 WeakPolarHBondContact CD-O 3.36Å; R670-Y679 PolarHBondContact NH1-O 2.75Å; L675-Y679 HydrophobicContact CB-CD2 4.19Å; L675-Y679 HydrophobicContact CB-CG 4.36Å; L675-Y679 HydrophobicContact CD2-CD1 4.45Å; L675-Y679 HydrophobicContact CD2-CD2 4.38Å; L675-Y679 HydrophobicContact CD2-CE1 4.44Å; L675-Y679 HydrophobicContact CD2-CE2 4.39Å; L675-Y679 HydrophobicContact CD2-CG 4.38Å; P676-Y679 HydrophobicContact CB-CD2 3.98Å; P676-Y679 HydrophobicContact CB-CE2 4.13Å; P676-Y679 VanDerWaalsContact CD-CE2 3.48Å; P676-Y679 HydrophobicContact CG-CD2 4.06Å; P676-Y679 HydrophobicContact CG-CE2 3.76Å; P676-Y679 WeakPolarHBondContact O-CD2 3.29Å; P676-Y679 PolarHBondContact O-N 3.19Å; D677-Y679 VanDerWaalsContact C-N 3.29Å; D677-Y679 PolarHBondContact O-N 3.12Å; Y679-K770 HydrophobicContact CD1-CB 3.92Å; Y679-K770 HydrophobicContact CE1-CB 3.65Å; Y679-K770 HydrophobicContact CE1-CD 3.83Å; Y679-K770 HydrophobicContact CE1-CG 4.38Å; Y679-K770 HydrophobicContact CE2-CD 4.33Å; Y679-K770 WeakPolarHBondContact OH-CD 3.19Å; Y679-F772 AromaticContact CD1-CD2 3.56Å; Y679-F772 HydrophobicContact CD1-CD2 3.56Å; Y679-F772 AromaticContact CD1-CE2 3.41Å; Y679-F772 HydrophobicContact CD1-CE2 3.41Å; Y679-F772 VanDerWaalsContact CD1-CE2 3.41Å; Y679-F772 AromaticContact CE1-CD2 3.95Å; Y679-F772 HydrophobicContact CE1-CD2 3.95Å; Y679-F772 AromaticContact CE1-CE2 3.36Å; Y679-F772 HydrophobicContact CE1-CE2 3.36Å; Y679-F772 HydrophobicContact CE1-CZ 4.34Å; Y679-F772 HydrophobicContact CG-CE2 4.4Å
680D44.6Very low43.2Very low75 Ų7575 Ų7540%0.40140%0.395SS..EExtended strand (participates in β ladder)trans-108.1151.4174.5-90.8-16.4000113.4R670 F771 F772R670-D680 IonicContact NH1-OD1 3.03Å; R670-D680 PolarHBondContact NH1-OD1 3.42Å; R670-D680 VanDerWaalsContact NH1-OD1 3.16Å; D680-F771 HydrophobicContact CB-CD1 3.86Å; D680-F771 HydrophobicContact CB-CE1 3.93Å; D680-F771 WeakPolarHBondContact O-CA 3.19Å; D680-F772 PolarHBondContact O-N 3.34Å
681F45.2Very low42.1Very low14 Ų1478.7 Ų78.76%0.06141%0.413CS..EExtended strand (participates in β ladder)trans-109.1132.6-179.2-58.9-85.6000110.5L661 A666 L669 R670 L675 F772 I774L661-F681 HydrophobicContact CD1-CB 4.22Å; A666-F681 HydrophobicContact CB-CD2 4.16Å; L669-F681 HydrophobicContact CB-CD2 4.1Å; L669-F681 HydrophobicContact CB-CE1 4.24Å; L669-F681 HydrophobicContact CB-CE2 3.41Å; L669-F681 VanDerWaalsContact CB-CE2 3.41Å; L669-F681 HydrophobicContact CB-CZ 3.5Å; L669-F681 HydrophobicContact CD1-CD1 4.33Å; L669-F681 HydrophobicContact CD1-CD2 4.02Å; L669-F681 HydrophobicContact CD1-CE1 4.47Å; L669-F681 HydrophobicContact CD1-CE2 4.17Å; L669-F681 HydrophobicContact CD1-CG 4.11Å; L669-F681 HydrophobicContact CD1-CZ 4.39Å; L669-F681 HydrophobicContact CG-CE2 4.43Å; L669-F681 HydrophobicContact CG-CZ 4.5Å; R670-F681 HydrophobicContact CG-CE2 3.99Å; R670-F681 HydrophobicContact CG-CZ 4.49Å; L675-F681 HydrophobicContact CD1-CE1 4.21Å; L675-F681 HydrophobicContact CD1-CZ 3.74Å; F681-F772 WeakPolarHBondContact CA-O 3.5Å; F681-F772 HydrophobicContact CD1-CB 3.7Å; F681-F772 HydrophobicContact CE1-CB 3.89Å; F681-F772 HydrophobicContact CE1-CD2 4.49Å; F681-F772 HydrophobicContact CE1-CG 4.39Å; F681-I774 HydrophobicContact CB-CD1 4.22Å; F681-I774 HydrophobicContact CD1-CD1 4.08Å; F681-I774 HydrophobicContact CD1-CG1 4.37Å; F681-I774 HydrophobicContact CG-CD1 4.39Å
682T40.8Very low41.2Very low23 Ų2371.9 Ų71.914%0.14139%0.387CS..EExtended strand (participates in β ladder)trans-123.6133.1174.8-46.30000110P658 I684 F772 L773 I774P658-T682 HydrophobicContact CB-CG2 4.37Å; T682-I684 HydrophobicContact CG2-CD1 4.49Å; T682-I684 HydrophobicContact CG2-CG1 4.15Å; T682-F772 PolarHBondContact N-O 3.42Å; T682-L773 WeakPolarHBondContact O-CA 3.4Å; T682-I774 PolarHBondContact O-N 3.16Å
683I41.2Very low40.4Very low33 Ų3373.4 Ų73.417%0.16940%0.399CS..EExtended strand (participates in β ladder)trans-87.6120.6174.7-60.2172000107.9L661 I774 P776L661-I683 HydrophobicContact CD1-CD1 3.75Å; L661-I683 HydrophobicContact CD1-CG1 3.72Å; I683-I774 WeakPolarHBondContact CA-O 3.25Å; I683-P776 HydrophobicContact CG2-CG 4.2Å
684I37.7Very low39.4Very low67 Ų6776.5 Ų76.534%0.34442%0.419SS..  trans-120.6146.9-179.2-58.2-162.3000111.1T682 L773T682-I684 HydrophobicContact CG2-CD1 4.49Å; T682-I684 HydrophobicContact CG2-CG1 4.15Å; I684-L773 HydrophobicContact CB-CD2 3.62Å; I684-L773 HydrophobicContact CB-CG 3.95Å; I684-L773 HydrophobicContact CD1-CD1 3.48Å; I684-L773 VanDerWaalsContact CD1-CD1 3.48Å; I684-L773 HydrophobicContact CD1-CD2 3.74Å; I684-L773 HydrophobicContact CD1-CG 3.61Å; I684-L773 HydrophobicContact CG1-CD1 4.07Å; I684-L773 HydrophobicContact CG1-CD2 3.85Å; I684-L773 HydrophobicContact CG1-CG 3.67Å; I684-L773 HydrophobicContact CG2-CD2 4.13Å
685S36.8Very low38.9Very low42 Ų4275.5 Ų75.529%0.29440%0.4SS..PPolyproline II helixtrans-66.2159.4178.1102.10000112.9A643A643-S685 VanDerWaalsContact CB-OG 3.25Å; A643-S685 WeakPolarHBondContact CB-OG 3.47Å
686P36.1Very low37.8Very low33 Ų3377.2 Ų77.221%0.21441%0.412CS..PPolyproline II helixtrans-63.7139.2-174.324.6-31.2000113.1A643 I645 I655A643-P686 HydrophobicContact CB-CG 4.02Å; I645-P686 HydrophobicContact CG1-CG 4.32Å; I655-P686 HydrophobicContact CD1-CG 4.19Å
687I32.3Very low36.9Very low87 Ų8781.7 Ų81.745%0.44643%0.431SS..PPolyproline II helixtrans-85.5132.4179.8-58.4168.7000109E691 L731I687-E691 HydrophobicContact CG2-CB 4.08Å; I687-L731 HydrophobicContact CD1-CD1 4.36Å
688S32.6Very low35.8Very low37 Ų3776.6 Ų76.626%0.25941%0.407SS..PPolyproline II helixtrans-68150.8176.61700000112.9F639 D690 E691 A692F639-S688 WeakPolarHBondContact CE1-OG 3.29Å; S688-D690 PolarHBondContact O-N 3.11Å; S688-D690 PolarHBondContact OG-N 2.9Å; S688-E691 PolarHBondContact O-N 3.03Å; S688-E691 VanDerWaalsContact O-N 3.15Å; S688-A692 PolarHBondContact O-N 2.98Å; S688-A692 VanDerWaalsContact O-N 3.08Å
689R31.1Very low35.1Very low168 Ų16872.3 Ų72.363%0.63438%0.383SS*.Hα-helixtrans-58.3-30.8179.8-144.3-177.3-166.5156.38.6113.1E691 A692 N693 E781R689-E691 VanDerWaalsContact C-N 3.34Å; R689-A692 WeakPolarHBondContact O-CB 3.35Å; R689-A692 PolarHBondContact O-N 3.15Å; R689-N693 PolarHBondContact O-N 3.49Å; R689-E781 IonicContact CZ-OE2 2.98Å; R689-E781 IonicContact NH1-OE1 3.96Å; R689-E781 PolarHBondContact NH1-OE1 2.87Å; R689-E781 IonicContact NH1-OE2 2.77Å; R689-E781 PolarHBondContact NH1-OE2 3.23Å; R689-E781 IonicContact NH2-OE2 3.5Å; R689-E781 PolarHBondContact NH2-OE2 3.33Å; R689-E781 VanDerWaalsContact NH2-OE2 3.12Å
690D32.9Very low34.3Very low118 Ų11874.9 Ų74.963%0.63140%0.399SS*.Hα-helixtrans-73.1-26.9-179.6-70.6-22.7000112.7S688S688-D690 PolarHBondContact O-N 3.11Å; S688-D690 PolarHBondContact OG-N 2.9Å
691E32.6Very low33.7Very low106 Ų10676.2 Ų76.250%0.49540%0.402SS..Hα-helixtrans-88.1-20.7169.8-70.2-171.7159.600112.4I687 S688 R689 N693 L694 V695I687-E691 HydrophobicContact CG2-CB 4.08Å; S688-E691 PolarHBondContact O-N 3.03Å; S688-E691 VanDerWaalsContact O-N 3.15Å; R689-E691 VanDerWaalsContact C-N 3.34Å; E691-N693 PolarHBondContact O-N 3.01Å; E691-L694 PolarHBondContact O-N 2.83Å; E691-V695 VanDerWaalsContact O-CG2 3.28Å; E691-V695 WeakPolarHBondContact O-CG2 3.37Å
692A33Very low33.3Very low30 Ų3078.4 Ų78.425%0.24842%0.416CS..Hα-helixtrans-63.4-40.1177.300000112S688 R689 L694 V695 T696S688-A692 PolarHBondContact O-N 2.98Å; S688-A692 VanDerWaalsContact O-N 3.08Å; R689-A692 WeakPolarHBondContact O-CB 3.35Å; R689-A692 PolarHBondContact O-N 3.15Å; A692-L694 VanDerWaalsContact C-N 3.27Å; A692-L694 PolarHBondContact O-N 3.49Å; A692-V695 PolarHBondContact O-N 3.34Å; A692-T696 HydrophobicContact CB-CG2 4.48Å; A692-T696 WeakPolarHBondContact O-CB 3.4Å; A692-T696 WeakPolarHBondContact O-CG2 3.33Å; A692-T696 PolarHBondContact O-N 3.05Å; A692-T696 PolarHBondContact O-OG1 3.02Å
693N28.5Very low33.2Very low124 Ų12481.9 Ų81.966%0.66344%0.439SS*.Hα-helixtrans-66.7-25.7-179.9-77.7-15.8000113.8R689 E691 V695R689-N693 PolarHBondContact O-N 3.49Å; E691-N693 PolarHBondContact O-N 3.01Å; N693-V695 VanDerWaalsContact C-N 3.29Å
694L29.8Very low33.5Very low163 Ų16380.6 Ų80.685%0.85343%0.433SS*.Hα-helixtrans-78.8-12.9174.2-114.987.3000113.1E691 A692E691-L694 PolarHBondContact O-N 2.83Å; A692-L694 VanDerWaalsContact C-N 3.27Å; A692-L694 PolarHBondContact O-N 3.49Å
695V33.3Very low34Very low48 Ų4878.6 Ų78.629%0.29142%0.424SS..Hα-helixtrans-124.9-18.7-165.1-176.30000113.4E691 A692 N693 N697 S698 M699E691-V695 VanDerWaalsContact O-CG2 3.28Å; E691-V695 WeakPolarHBondContact O-CG2 3.37Å; A692-V695 PolarHBondContact O-N 3.34Å; N693-V695 VanDerWaalsContact C-N 3.29Å; V695-N697 VanDerWaalsContact C-N 3.26Å; V695-N697 PolarHBondContact O-N 2.79Å; V695-N697 VanDerWaalsContact O-N 3.12Å; V695-S698 PolarHBondContact O-N 3.08Å; V695-S698 PolarHBondContact O-OG 2.86Å; V695-M699 HydrophobicContact CG1-CE 3.19Å; V695-M699 HydrophobicContact CG1-CG 4.03Å; V695-M699 HydrophobicContact CG1-SD 3.44Å; V695-M699 WeakPolarHBondContact CG1-SD 3.26Å
696T30.7Very low34.7Very low70 Ų7079.6 Ų79.643%0.42943%0.43SS..G310 helixtrans-56.2-29.6-176.741.70000115A692 S698A692-T696 HydrophobicContact CB-CG2 4.48Å; A692-T696 WeakPolarHBondContact O-CB 3.4Å; A692-T696 WeakPolarHBondContact O-CG2 3.33Å; A692-T696 PolarHBondContact O-N 3.05Å; A692-T696 PolarHBondContact O-OG1 3.02Å; T696-S698 PolarHBondContact O-N 2.8Å
697N29.2Very low35.2Very low169 Ų16983.3 Ų83.390%0.90445%0.445SS*.G310 helixtrans-74.4-4.4-177.9-76.2-15.5000114.7V695V695-N697 VanDerWaalsContact C-N 3.26Å; V695-N697 PolarHBondContact O-N 2.79Å; V695-N697 VanDerWaalsContact O-N 3.12Å
698S29.7Very low35.8Very low27 Ų2779.4 Ų79.419%0.18943%0.425CS..G310 helixtrans-133.311.3-172.969.30000116.4V695 T696 R734V695-S698 PolarHBondContact O-N 3.08Å; V695-S698 PolarHBondContact O-OG 2.86Å; T696-S698 PolarHBondContact O-N 2.8Å; S698-R734 WeakPolarHBondContact O-CB 3.21Å
699M34Very low36.7Very low40 Ų4078.2 Ų78.220%0.19742%0.416CS..EExtended strand (participates in β ladder)trans-119.3135.4-178.3-69.9-172172.100112.3V695 F701 L731 N733V695-M699 HydrophobicContact CG1-CE 3.19Å; V695-M699 HydrophobicContact CG1-CG 4.03Å; V695-M699 HydrophobicContact CG1-SD 3.44Å; V695-M699 WeakPolarHBondContact CG1-SD 3.26Å; M699-F701 HydrophobicContact CB-CE2 4.5Å; M699-L731 HydrophobicContact SD-CD2 3.9Å; M699-N733 HydrophobicContact CE-CB 4.03Å
700L27.7Very low37.7Very low99 Ų9977.6 Ų77.652%0.51842%0.418SS..EExtended strand (participates in β ladder)trans-102.6131.4172.3-151.8100.9000108.6T702L700-T702 HydrophobicContact CD2-CG2 4.18Å
701F32.6Very low38.4Very low103 Ų10373.7 Ų73.745%0.45240%0.398SS..EExtended strand (participates in β ladder)trans-101.7125.4177.6-62.9-95000109.3M699 F729 L731 V778M699-F701 HydrophobicContact CB-CE2 4.5Å; F701-F729 HydrophobicContact CB-CD1 4.2Å; F701-F729 HydrophobicContact CD1-CB 4.39Å; F701-L731 HydrophobicContact CD1-CD2 3.89Å; F701-L731 HydrophobicContact CE1-CD2 3.47Å; F701-L731 VanDerWaalsContact CE1-CD2 3.47Å; F701-L731 HydrophobicContact CZ-CD2 4.01Å; F701-V778 HydrophobicContact CE1-CG2 4.41Å
702T36.6Very low39.2Very low60 Ų6069 Ų6937%0.36838%0.376SS..EExtended strand (participates in β ladder)trans-121137.9170.255.10000110.9L700 F729 I730L700-T702 HydrophobicContact CD2-CG2 4.18Å; T702-F729 WeakPolarHBondContact O-CA 3.42Å; T702-I730 PolarHBondContact O-N 3.27Å
703P39Very low40Very low96 Ų9670.6 Ų70.662%0.62338%0.378SS*.EExtended strand (participates in β ladder)trans-64.9144.117725.5-32.1000111.3
704V47Very low41Very low5 Ų568.5 Ų68.53%0.0338%0.378CS..PPolyproline II helixtrans-78.3132.7-173.3169.40000111.7V708 A728 I730V704-V708 HydrophobicContact CG1-CB 3.61Å; V704-V708 HydrophobicContact CG1-CG1 3.59Å; V704-A728 HydrophobicContact CB-CB 3.85Å; V704-A728 WeakPolarHBondContact CB-O 3.49Å; V704-A728 HydrophobicContact CG1-CB 4.32Å; V704-A728 HydrophobicContact CG2-CB 3.67Å; V704-A728 WeakPolarHBondContact CG2-O 3.5Å; V704-A728 PolarHBondContact N-O 3.5Å; V704-A728 VanDerWaalsContact N-O 3.15Å; V704-I730 HydrophobicContact CG2-CG1 3.96Å
705S48Very low41.6Very low25 Ų2565 Ų6518%0.17536%0.356CS..PPolyproline II helixtrans-69.5152.1176.381.50000112.9E707 V708 L709S705-E707 PolarHBondContact O-N 3.22Å; S705-E707 VanDerWaalsContact O-N 3.11Å; S705-V708 PolarHBondContact O-N 2.75Å; S705-L709 PolarHBondContact O-N 3.02Å; S705-L709 VanDerWaalsContact O-N 3.11Å
706P51.2Low42.1Very low64 Ų6464.7 Ų64.742%0.41635%0.353SS..Hα-helixtrans-59-28.7-175.39.9-21.5000114.9L709 K710 E725P706-L709 WeakPolarHBondContact O-CB 3.45Å; P706-L709 PolarHBondContact O-N 3.03Å; P706-K710 PolarHBondContact O-N 3.13Å; P706-E725 WeakPolarHBondContact CB-OE1 3.43Å; P706-E725 WeakPolarHBondContact CD-OE1 3.5Å; P706-E725 WeakPolarHBondContact CG-OE1 3.39Å
707E47.1Very low42.5Very low111 Ų11171.9 Ų71.952%0.51938%0.378SS..Hα-helixtrans-71.8-37.7177.7-72.7154.7-142.200112.7K672 S705 L709 K710 V711K672-E707 VanDerWaalsContact CD-OE2 3.25Å; K672-E707 WeakPolarHBondContact CD-OE2 3.27Å; K672-E707 WeakPolarHBondContact CE-OE2 3.37Å; K672-E707 IonicContact NZ-OE1 2.71Å; K672-E707 PolarHBondContact NZ-OE1 3.01Å; K672-E707 IonicContact NZ-OE2 3.77Å; K672-E707 PolarHBondContact NZ-OE2 3.37Å; S705-E707 PolarHBondContact O-N 3.22Å; S705-E707 VanDerWaalsContact O-N 3.11Å; E707-L709 VanDerWaalsContact C-N 3.32Å; E707-K710 WeakPolarHBondContact O-CB 3.45Å; E707-K710 PolarHBondContact O-N 3.05Å; E707-V711 PolarHBondContact O-N 2.98Å
708V46.2Very low43.1Very low5 Ų566 Ų663%0.0335%0.347CS..Hα-helixtrans-67.6-39.9173.2176.70000109.5L669 V704 S705 K710 V711 V712 I774L669-V708 HydrophobicContact CD2-CG2 3.31Å; V704-V708 HydrophobicContact CG1-CB 3.61Å; V704-V708 HydrophobicContact CG1-CG1 3.59Å; S705-V708 PolarHBondContact O-N 2.75Å; V708-K710 VanDerWaalsContact C-N 3.28Å; V708-K710 PolarHBondContact O-N 3.25Å; V708-V711 PolarHBondContact O-N 3.37Å; V708-V711 VanDerWaalsContact O-N 3.12Å; V708-V712 HydrophobicContact CG1-CG2 4.25Å; V708-V712 WeakPolarHBondContact O-CG2 3.49Å; V708-V712 PolarHBondContact O-N 3.4Å; V708-I774 HydrophobicContact CG1-CD1 4.26Å; V708-I774 HydrophobicContact CG1-CG2 4.22Å
709L50.9Low43.5Very low12 Ų1273.2 Ų73.26%0.06337%0.37CS..Hα-helixtrans-58.2-40.4174.5-15770.2000111.7S705 P706 E707 V711 V712 K713 I723 E725 A728S705-L709 PolarHBondContact O-N 3.02Å; S705-L709 VanDerWaalsContact O-N 3.11Å; P706-L709 WeakPolarHBondContact O-CB 3.45Å; P706-L709 PolarHBondContact O-N 3.03Å; E707-L709 VanDerWaalsContact C-N 3.32Å; L709-V711 PolarHBondContact O-N 2.87Å; L709-V712 PolarHBondContact O-N 3.15Å; L709-K713 WeakPolarHBondContact O-CB 3.47Å; L709-K713 VanDerWaalsContact O-CG 3.26Å; L709-K713 WeakPolarHBondContact O-CG 3.21Å; L709-K713 PolarHBondContact O-N 3.04Å; L709-I723 HydrophobicContact CD1-CG2 3.62Å; L709-I723 HydrophobicContact CD2-CG2 4.31Å; L709-I723 HydrophobicContact CG-CG2 4.11Å; L709-E725 HydrophobicContact CD2-CG 4.19Å; L709-A728 HydrophobicContact CD1-CB 4.31Å
710K52.2Low43.6Very low155 Ų15575.6 Ų75.667%0.67439%0.388SS*.Hα-helixtrans-61-42.6174.3-76.7179.8-179.2178.20112.7P706 E707 V708 A714P706-K710 PolarHBondContact O-N 3.13Å; E707-K710 WeakPolarHBondContact O-CB 3.45Å; E707-K710 PolarHBondContact O-N 3.05Å; V708-K710 VanDerWaalsContact C-N 3.28Å; V708-K710 PolarHBondContact O-N 3.25Å; K710-A714 PolarHBondContact O-N 3.45Å
711V48.1Very low44.4Very low35 Ų3578.8 Ų78.821%0.21240%0.4CS..Hα-helixtrans-65.9-42.8177.11770000110.5L661 Q665 E707 V708 L709 A714 H715L661-V711 HydrophobicContact CD2-CG1 4.08Å; Q665-V711 HydrophobicContact CB-CG1 4.4Å; Q665-V711 HydrophobicContact CG-CG1 4.3Å; E707-V711 PolarHBondContact O-N 2.98Å; V708-V711 PolarHBondContact O-N 3.37Å; V708-V711 VanDerWaalsContact O-N 3.12Å; L709-V711 PolarHBondContact O-N 2.87Å; V711-A714 PolarHBondContact O-N 3.11Å; V711-H715 PolarHBondContact O-ND1 2.91Å
712V49.5Very low44.8Very low7 Ų779.1 Ų79.14%0.04240%0.403CS..Hα-helixtrans-65.4-43.7178.2172.50000111.6V708 L709 A714 H715 I716 I774 P776V708-V712 HydrophobicContact CG1-CG2 4.25Å; V708-V712 WeakPolarHBondContact O-CG2 3.49Å; V708-V712 PolarHBondContact O-N 3.4Å; L709-V712 PolarHBondContact O-N 3.15Å; V712-A714 PolarHBondContact O-N 3.15Å; V712-H715 PolarHBondContact O-N 3.25Å; V712-I716 HydrophobicContact CG1-CD1 3.49Å; V712-I716 VanDerWaalsContact CG1-CD1 3.49Å; V712-I716 HydrophobicContact CG1-CG1 4.31Å; V712-I716 PolarHBondContact O-N 3.36Å; V712-I774 HydrophobicContact CG2-CG2 4.33Å; V712-P776 HydrophobicContact CG1-CB 3.83Å
713K48.3Very low45.1Very low65 Ų6576.6 Ų76.628%0.28339%0.388SS..Hα-helixtrans-54.6-33.7176.2-79.6-177-172.3-153.70112.8L709 H715 P720 I723L709-K713 WeakPolarHBondContact O-CB 3.47Å; L709-K713 VanDerWaalsContact O-CG 3.26Å; L709-K713 WeakPolarHBondContact O-CG 3.21Å; L709-K713 PolarHBondContact O-N 3.04Å; K713-H715 VanDerWaalsContact C-N 3.32Å; K713-H715 PolarHBondContact O-N 3.12Å; K713-P720 PolarHBondContact NZ-O 3.33Å; K713-I723 HydrophobicContact CG-CD1 4.07Å; K713-I723 PolarHBondContact NZ-O 3.16Å
714A49.9Very low45.4Very low80 Ų8077.9 Ų77.966%0.66139%0.385SS*.Hα-helixtrans-73.3-21.3178.900000114.1K710 V711 V712K710-A714 PolarHBondContact O-N 3.45Å; V711-A714 PolarHBondContact O-N 3.11Å; V712-A714 PolarHBondContact O-N 3.15Å
715H42.1Very low44.9Very low88 Ų8882.4 Ų82.441%0.40741%0.406SS..Hα-helixtrans-103.2-7.1-173.9-66.394.5000113.8V711 V712 K713V711-H715 PolarHBondContact O-ND1 2.91Å; V712-H715 PolarHBondContact O-N 3.25Å; K713-H715 VanDerWaalsContact C-N 3.32Å; K713-H715 PolarHBondContact O-N 3.12Å
716I44.7Very low44.7Very low43 Ų4385.1 Ų85.122%0.22143%0.425CS..SBendtrans-116.9124.2-176.8-58.9-178.5000107.8V712 L718 P776 F777V712-I716 HydrophobicContact CG1-CD1 3.49Å; V712-I716 VanDerWaalsContact CG1-CD1 3.49Å; V712-I716 HydrophobicContact CG1-CG1 4.31Å; V712-I716 PolarHBondContact O-N 3.36Å; I716-L718 HydrophobicContact CG2-CB 4.25Å; I716-L718 HydrophobicContact CG2-CD1 3.29Å; I716-L718 HydrophobicContact CG2-CG 4.37Å; I716-L718 PolarHBondContact O-N 3.06Å; I716-P776 HydrophobicContact CD1-CB 4.23Å; I716-P776 HydrophobicContact CD1-CG 4.09Å; I716-F777 HydrophobicContact CD1-CE2 3.84Å; I716-F777 HydrophobicContact CD1-CZ 4.1Å
717K39.7Very low44.2Very low220 Ų22084.8 Ų84.896%0.95742%0.419SS*.  trans-74.153.2176.7-71.8-176.6177.4178.40111.9
718L40Very low44Very low46 Ų4679.7 Ų79.724%0.24140%0.396CS..SBendtrans-106.3156.6164.9-91.3100.4000109.4I653 I716 E722 I723I653-L718 HydrophobicContact CD1-CD1 4.38Å; I716-L718 HydrophobicContact CG2-CB 4.25Å; I716-L718 HydrophobicContact CG2-CD1 3.29Å; I716-L718 HydrophobicContact CG2-CG 4.37Å; I716-L718 PolarHBondContact O-N 3.06Å; L718-E722 HydrophobicContact CD2-CB 4.29Å; L718-I723 HydrophobicContact CB-CD1 4.17Å
719R38.6Very low43.7Very low179 Ų17982.2 Ų82.268%0.67541%0.407SS*.  trans-69.4141.9175.1-69.1-175.7-176.2-175.72.9109E721 E722R719-E721 PolarHBondContact O-N 3.11Å; R719-E722 HydrophobicContact CB-CG 4.33Å; R719-E722 PolarHBondContact N-OE2 3.25Å; R719-E722 PolarHBondContact O-N 3.34Å; R719-E722 VanDerWaalsContact O-N 3.1Å
720P36.4Very low43Very low89 Ų8982.7 Ų82.758%0.57841%0.409SS*.G310 helixtrans-57.3-23.9-175.5-24.833000114.9K713K713-P720 PolarHBondContact NZ-O 3.33Å
721E44Very low42.3Very low166 Ų16675.9 Ų75.978%0.77638%0.38SS*.G310 helixtrans-77.7-16.2-176.9-64.3159.2-150.700113.3R719R719-E721 PolarHBondContact O-N 3.11Å
722E42.2Very low41.6Very low110 Ų11078.8 Ų78.851%0.51439%0.391SS..G310 helixtrans-92.75.6-172.3-64.9174.7156.800114.2L718 R719L718-E722 HydrophobicContact CD2-CB 4.29Å; R719-E722 HydrophobicContact CB-CG 4.33Å; R719-E722 PolarHBondContact N-OE2 3.25Å; R719-E722 PolarHBondContact O-N 3.34Å; R719-E722 VanDerWaalsContact O-N 3.1Å
723I42.2Very low40.8Very low8 Ų882 Ų824%0.04141%0.409CS..  trans-129117.1-172-58.8169.5000110.9L709 K713 L718L709-I723 HydrophobicContact CD1-CG2 3.62Å; L709-I723 HydrophobicContact CD2-CG2 4.31Å; L709-I723 HydrophobicContact CG-CG2 4.11Å; K713-I723 HydrophobicContact CG-CD1 4.07Å; K713-I723 PolarHBondContact NZ-O 3.16Å; L718-I723 HydrophobicContact CB-CD1 4.17Å
724H45.1Very low39.9Very low122 Ų12287.6 Ų87.657%0.56543%0.428SS*.  trans-106.6161176.2-64.8-74.6000112.8S726 D727H724-S726 PolarHBondContact O-N 2.67Å; H724-D727 PolarHBondContact N-OD2 3.19Å; H724-D727 WeakPolarHBondContact O-CB 3.37Å; H724-D727 PolarHBondContact O-N 2.91Å; H724-D727 VanDerWaalsContact O-N 3.11Å
725E37.4Very low39.1Very low100 Ų10087.5 Ų87.547%0.46742%0.419SS..G310 helixtrans-62.1-25.4179.6-72-178.8173.700113.6P706 L709 D727P706-E725 WeakPolarHBondContact CB-OE1 3.43Å; P706-E725 WeakPolarHBondContact CD-OE1 3.5Å; P706-E725 WeakPolarHBondContact CG-OE1 3.39Å; L709-E725 HydrophobicContact CD2-CG 4.19Å; E725-D727 PolarHBondContact O-N 3.3Å
726S43Very low38.6Very low82 Ų8292 Ų9257%0.57344%0.438SS*.G310 helixtrans-67.8-17.2175.550.30000114.1H724H724-S726 PolarHBondContact O-N 2.67Å
727D41.1Very low37.7Very low58 Ų5896.7 Ų96.731%0.3146%0.463SS..G310 helixtrans-92.4-11.8-165.5-53.2-22.2000112.5H724 E725H724-D727 PolarHBondContact N-OD2 3.19Å; H724-D727 WeakPolarHBondContact O-CB 3.37Å; H724-D727 PolarHBondContact O-N 2.91Å; H724-D727 VanDerWaalsContact O-N 3.11Å; E725-D727 PolarHBondContact O-N 3.3Å
728A43Very low37Very low3 Ų395.5 Ų95.53%0.02545%0.453CS..  trans-127.1140-17300000112.7V704 L709 P776V704-A728 HydrophobicContact CB-CB 3.85Å; V704-A728 WeakPolarHBondContact CB-O 3.49Å; V704-A728 HydrophobicContact CG1-CB 4.32Å; V704-A728 HydrophobicContact CG2-CB 3.67Å; V704-A728 WeakPolarHBondContact CG2-O 3.5Å; V704-A728 PolarHBondContact N-O 3.5Å; V704-A728 VanDerWaalsContact N-O 3.15Å; L709-A728 HydrophobicContact CD1-CB 4.31Å; A728-P776 VanDerWaalsContact CA-O 3.29Å; A728-P776 WeakPolarHBondContact CA-O 3.29Å; A728-P776 VanDerWaalsContact CB-O 3.29Å; A728-P776 WeakPolarHBondContact CB-O 3.41Å
729F39.2Very low36.5Very low58 Ų58101.3 Ų101.325%0.25448%0.484SS..EExtended strand (participates in β ladder)trans-130.5148.9-178.1-62.5-85.7000112.3F701 T702 V778F701-F729 HydrophobicContact CB-CD1 4.2Å; F701-F729 HydrophobicContact CD1-CB 4.39Å; T702-F729 WeakPolarHBondContact O-CA 3.42Å; F729-V778 HydrophobicContact CD2-CB 4.39Å
730I35.8Very low36Very low22 Ų2295.3 Ų95.311%0.11348%0.477CS..EExtended strand (participates in β ladder)trans-93129.7167.5-56.3175.1000108.2F673 T702 V704F673-I730 HydrophobicContact CE2-CD1 4.37Å; F673-I730 HydrophobicContact CZ-CD1 3.86Å; T702-I730 PolarHBondContact O-N 3.27Å; V704-I730 HydrophobicContact CG2-CG1 3.96Å
731L39Very low35.5Very low12 Ų1297.5 Ų97.56%0.06348%0.483CS..EExtended strand (participates in β ladder)trans-105.8126.6179.2-79160.4000110.6I687 M699 F701 L773 A775I687-L731 HydrophobicContact CD1-CD1 4.36Å; M699-L731 HydrophobicContact SD-CD2 3.9Å; F701-L731 HydrophobicContact CD1-CD2 3.89Å; F701-L731 HydrophobicContact CE1-CD2 3.47Å; F701-L731 VanDerWaalsContact CE1-CD2 3.47Å; F701-L731 HydrophobicContact CZ-CD2 4.01Å; L731-L773 HydrophobicContact CB-CB 4.24Å; L731-L773 PolarHBondContact N-O 3.32Å; L731-A775 HydrophobicContact CD1-CB 3.59Å
732Q32.8Very low34.6Very low96 Ų9697.9 Ų97.945%0.44949%0.489SS..EExtended strand (participates in β ladder)trans-113.2117.2172.9-168.4179.21700110.4F772Q732-F772 HydrophobicContact CB-CE1 4.45Å; Q732-F772 HydrophobicContact CG-CE1 3.99Å
733N32.8Very low33.8Very low76 Ų7699 Ų9941%0.40650%0.504SS..EExtended strand (participates in β ladder)trans-88.2115.2177.9-172.3-22.6000110.9M699 T735 F736M699-N733 HydrophobicContact CE-CB 4.03Å; N733-T735 PolarHBondContact OD1-N 2.92Å; N733-T735 PolarHBondContact OD1-OG1 3.47Å; N733-F736 PolarHBondContact OD1-N 3.25Å
734R29.4Very low32.9Very low182 Ų182109 Ų10969%0.68754%0.541SS*.SBendtrans-78.5-24.4175.5-75.1-176.2171.9-176.9-1114S698S698-R734 WeakPolarHBondContact O-CB 3.21Å
735T33.2Very low31.9Very low78 Ų78111.1 Ų111.148%0.47955%0.549SS..THydrogen-bonded Turntrans-84.3-12-170.734.90000116N733 N737N733-T735 PolarHBondContact OD1-N 2.92Å; N733-T735 PolarHBondContact OD1-OG1 3.47Å; T735-N737 PolarHBondContact O-N 3.03Å; T735-N737 VanDerWaalsContact O-N 3.15Å
736F30.7Very low31.4Very low182 Ų182115.7 Ų115.780%0.79857%0.57SS**THydrogen-bonded Turntrans-74.3-0.4176.2-134.8-91.9000113.7N733N733-F736 PolarHBondContact OD1-N 3.25Å
737N26.7Very low30.4Very low141 Ų141116.6 Ų116.675%0.75458%0.576SS**  trans-108.859.8175.5-150.121.9000109.7T735T735-N737 PolarHBondContact O-N 3.03Å; T735-N737 VanDerWaalsContact O-N 3.15Å
738R25.2Very low29.6Very low195 Ų195118.6 Ų118.674%0.73660%0.595SS**  trans-114.862.5178.9-142.2-178-166.8-174.55111.8G740R738-G740 PolarHBondContact O-N 3.27Å
739D27.8Very low28.6Very low169 Ų169130.1 Ų130.190%0.90464%0.637SS**  trans-68.284.4152.1-79.6-26.4000108
740G28.8Very low27.9Very low52 Ų52132.3 Ų132.354%0.53666%0.66SS.*  trans-154.47.6-173.400000117.5R738R738-G740 PolarHBondContact O-N 3.27Å
741I25.9Very low27.6Very low136 Ų136139 Ų13970%0.69770%0.695SS**SBendtrans-120.22.9-177.2-58.7-178.8000113.9
742L26Very low26.9Very low173 Ų173147.2 Ų147.291%0.90673%0.73SS**SBendtrans-116.250175.6-68.1176.8000114
743T25.5Very low26.6Very low134 Ų134148.1 Ų148.182%0.82275%0.746SS**  trans-144.451.4160.653.30000112K745T743-K745 PolarHBondContact O-N 3.41Å
744R23.1Very low26.3Very low219 Ų219152.3 Ų152.383%0.82677%0.766SS**  trans-78.6105162.4-173.9171.3168.4159.8-3.9109.1
745K24.3Very low26.1Very low165 Ų165153.7 Ų153.772%0.71778%0.776SS**  trans56.6101.6155-64.5-179175.5-174.50116.2T743T743-K745 PolarHBondContact O-N 3.41Å
746H25.4Very low26Very low197 Ų197157.3 Ų157.391%0.91279%0.792SS**  -151125.7121.3-101.3-67.1000110.4
747S22.7Very low25.7Very low100 Ų100159.9 Ų159.970%0.69980%0.796SS**  trans-77.4154.4-179.198.90000110.4
748S23.9Very low25.7Very low101 Ų101159.3 Ų159.371%0.70680%0.8SS**  trans60.8102.4144.7-49.30000119
749R23.2Very low25.8Very low244 Ų244161.5 Ų161.592%0.92181%0.808SS**  155.5126.4109.9-88.1174.4175161.4-1.4111.5
750S24.7Very low25.6Very low104 Ų104165.4 Ų165.473%0.72781%0.81SS**  trans-9.7129.5145.7-179.90000115.6
751I29.5Very low25.5Very low164 Ų164172.2 Ų172.284%0.84183%0.825SS**  -160.6129.8127.6-92.4145.8000109.1
752K22.5Very low25.5Very low184 Ų184172.6 Ų172.680%0.883%0.834SS**  trans-65.7155.7171.1-71.2171.41721760111.5
753S26.8Very low25.3Very low114 Ų114172.9 Ų172.980%0.79783%0.83SS**  trans70.6120.6158.777.50000117.5
754M27.6Very low25.3Very low165 Ų165174.4 Ų174.481%0.81383%0.833SS**  178.6133.194.7-159.4151.592.700110.2I756M754-I756 PolarHBondContact O-N 2.66Å
755K23.8Very low25.3Very low210 Ų210174.8 Ų174.891%0.91383%0.834SS**  trans-62.1121.1175.8-68.8170.7174.8174.70110.5
756I31.5Very low25.3Very low155 Ų155176 Ų17680%0.79584%0.843SS**  trans-133.4128.7159.9-61.5-178.8000109.1M754M754-I756 PolarHBondContact O-N 2.66Å
757R24.8Very low25.3Very low235 Ų235170.9 Ų170.989%0.88782%0.822SS**  trans-55.6144.6-174.1-68.1173.6171.4177.8-3.9113.2R759R757-R759 PolarHBondContact O-N 3.03Å
758P27.3Very low25.5Very low129 Ų129174.6 Ų174.684%0.83882%0.82SS**  trans-81111.5-178.132.2-30.5000110.5
759R27.3Very low25.9Very low241 Ų241178.9 Ų178.991%0.90982%0.822SS**  trans-83115.4159.6-105.5-178.5168161.7-3.5108.1R757 K761R757-R759 PolarHBondContact O-N 3.03Å; R759-K761 PolarHBondContact O-N 3.43Å
760R23.9Very low26.5Very low252 Ų252172.8 Ų172.895%0.95180%0.802SS**  trans-38.8103.3171.6-74.6172.8169.1165.6-5111.4
761K26.9Very low27Very low194 Ų194172.5 Ų172.584%0.84379%0.789SS**  trans-110.2116.7146.9-81.6-172.1176.3-176.70106R759 Q763R759-K761 PolarHBondContact O-N 3.43Å; K761-Q763 PolarHBondContact O-N 3.05Å
762T24Very low27.5Very low144 Ų144166.3 Ų166.388%0.88376%0.755SS**  trans-53.281.2171.928.10000110.3L764T762-L764 PolarHBondContact O-N 3.49Å
763Q23.1Very low28.3Very low179 Ų179159.7 Ų159.784%0.83673%0.729SS**  trans-74.2110.1157.3-83179.4-27.600106.3K761 R765K761-Q763 PolarHBondContact O-N 3.05Å; Q763-R765 PolarHBondContact O-N 3.48Å; Q763-R765 VanDerWaalsContact O-N 3.08Å
764L25.1Very low28.9Very low166 Ų166154.6 Ų154.687%0.86969%0.692SS**  trans-41.4115.7163.3-77.5125.5000108.3T762 Q766T762-L764 PolarHBondContact O-N 3.49Å; L764-Q766 VanDerWaalsContact C-N 3.33Å; L764-Q766 PolarHBondContact O-N 3.25Å
765R23.4Very low29.5Very low228 Ų228146.9 Ų146.986%0.8666%0.655SS**  trans-58.698.2171.7-85.3-176.9169.8178.7-4.5108Q763 D767Q763-R765 PolarHBondContact O-N 3.48Å; Q763-R765 VanDerWaalsContact O-N 3.08Å; R765-D767 VanDerWaalsContact C-N 3.31Å; R765-D767 PolarHBondContact O-N 2.97Å
766Q24.4Very low30.2Very low191 Ų191137.4 Ų137.489%0.89362%0.615SS**  trans-69.794.6151.1-74.6178.5-33.200106L764L764-Q766 VanDerWaalsContact C-N 3.33Å; L764-Q766 PolarHBondContact O-N 3.25Å
767D25.8Very low30.7Very low88 Ų88132 Ų13247%0.47159%0.586SS.*  trans-137106169.6-111.8-37000109.2R765R765-D767 VanDerWaalsContact C-N 3.31Å; R765-D767 PolarHBondContact O-N 2.97Å
768R26Very low31Very low179 Ų179124.2 Ų124.268%0.67556%0.564SS**  trans61.495.4141.5-68.8-179.4-96171.9-7119.2
769Y33.2Very low31.1Very low190 Ų190124 Ų12475%0.74556%0.555SS**  trans-108.7104.8153.6-65.3-70.7000110F771Y769-F771 VanDerWaalsContact CB-CE2 3.4Å; Y769-F771 HydrophobicContact CD1-CE1 4.37Å; Y769-F771 AromaticContact CD1-CE2 3.83Å; Y769-F771 HydrophobicContact CD1-CE2 3.83Å; Y769-F771 AromaticContact CD1-CZ 3.47Å; Y769-F771 HydrophobicContact CD1-CZ 3.47Å; Y769-F771 VanDerWaalsContact CD1-CZ 3.47Å; Y769-F771 HydrophobicContact CE1-CZ 4.3Å; Y769-F771 AromaticContact CG-CE2 3.79Å; Y769-F771 HydrophobicContact CG-CE2 3.79Å; Y769-F771 AromaticContact CG-CZ 3.95Å; Y769-F771 HydrophobicContact CG-CZ 3.95Å
770K34.1Very low31Very low116 Ų116122.1 Ų122.150%0.50455%0.554SS.*  trans-104.389.5169.5-69.6-176.3-180179.50108.3Y679Y679-K770 HydrophobicContact CD1-CB 3.92Å; Y679-K770 HydrophobicContact CE1-CB 3.65Å; Y679-K770 HydrophobicContact CE1-CD 3.83Å; Y679-K770 HydrophobicContact CE1-CG 4.38Å; Y679-K770 HydrophobicContact CE2-CD 4.33Å; Y679-K770 WeakPolarHBondContact OH-CD 3.19Å
771F36.3Very low31.1Very low99 Ų99116.6 Ų116.643%0.43454%0.539SS..EExtended strand (participates in β ladder)trans-91.3135.7177.3-61.7-69.3000111.4D680 Y769D680-F771 HydrophobicContact CB-CD1 3.86Å; D680-F771 HydrophobicContact CB-CE1 3.93Å; D680-F771 WeakPolarHBondContact O-CA 3.19Å; Y769-F771 VanDerWaalsContact CB-CE2 3.4Å; Y769-F771 HydrophobicContact CD1-CE1 4.37Å; Y769-F771 AromaticContact CD1-CE2 3.83Å; Y769-F771 HydrophobicContact CD1-CE2 3.83Å; Y769-F771 AromaticContact CD1-CZ 3.47Å; Y769-F771 HydrophobicContact CD1-CZ 3.47Å; Y769-F771 VanDerWaalsContact CD1-CZ 3.47Å; Y769-F771 HydrophobicContact CE1-CZ 4.3Å; Y769-F771 AromaticContact CG-CE2 3.79Å; Y769-F771 HydrophobicContact CG-CE2 3.79Å; Y769-F771 AromaticContact CG-CZ 3.95Å; Y769-F771 HydrophobicContact CG-CZ 3.95Å
772F39.7Very low30.9Very low33 Ų33111 Ų11115%0.14552%0.524CS..EExtended strand (participates in β ladder)trans-94.9129.7162.6-84.6-84.7000109.8L675 Y679 D680 F681 T682 Q732L675-F772 HydrophobicContact CD1-CD2 4.39Å; L675-F772 HydrophobicContact CD1-CE2 4.2Å; L675-F772 HydrophobicContact CD2-CE2 3.65Å; L675-F772 HydrophobicContact CD2-CZ 4.1Å; Y679-F772 AromaticContact CD1-CD2 3.56Å; Y679-F772 HydrophobicContact CD1-CD2 3.56Å; Y679-F772 AromaticContact CD1-CE2 3.41Å; Y679-F772 HydrophobicContact CD1-CE2 3.41Å; Y679-F772 VanDerWaalsContact CD1-CE2 3.41Å; Y679-F772 AromaticContact CE1-CD2 3.95Å; Y679-F772 HydrophobicContact CE1-CD2 3.95Å; Y679-F772 AromaticContact CE1-CE2 3.36Å; Y679-F772 HydrophobicContact CE1-CE2 3.36Å; Y679-F772 HydrophobicContact CE1-CZ 4.34Å; Y679-F772 HydrophobicContact CG-CE2 4.4Å; D680-F772 PolarHBondContact O-N 3.34Å; F681-F772 WeakPolarHBondContact CA-O 3.5Å; F681-F772 HydrophobicContact CD1-CB 3.7Å; F681-F772 HydrophobicContact CE1-CB 3.89Å; F681-F772 HydrophobicContact CE1-CD2 4.49Å; F681-F772 HydrophobicContact CE1-CG 4.39Å; T682-F772 PolarHBondContact N-O 3.42Å; Q732-F772 HydrophobicContact CB-CE1 4.45Å; Q732-F772 HydrophobicContact CG-CE1 3.99Å
773L38.6Very low31.4Very low46 Ų46110.7 Ų110.724%0.24152%0.524CS..EExtended strand (participates in β ladder)trans-86123.6173.8-110.480.4000110T682 I684 L731T682-L773 WeakPolarHBondContact O-CA 3.4Å; I684-L773 HydrophobicContact CB-CD2 3.62Å; I684-L773 HydrophobicContact CB-CG 3.95Å; I684-L773 HydrophobicContact CD1-CD1 3.48Å; I684-L773 VanDerWaalsContact CD1-CD1 3.48Å; I684-L773 HydrophobicContact CD1-CD2 3.74Å; I684-L773 HydrophobicContact CD1-CG 3.61Å; I684-L773 HydrophobicContact CG1-CD1 4.07Å; I684-L773 HydrophobicContact CG1-CD2 3.85Å; I684-L773 HydrophobicContact CG1-CG 3.67Å; I684-L773 HydrophobicContact CG2-CD2 4.13Å; L731-L773 HydrophobicContact CB-CB 4.24Å; L731-L773 PolarHBondContact N-O 3.32Å
774I39.1Very low31.5Very low6 Ų6110.8 Ų110.83%0.03154%0.537CS..EExtended strand (participates in β ladder)trans-10096.5163-56.9174000105.7L669 F681 T682 I683 V708 V712 P776L669-I774 HydrophobicContact CD1-CD1 3.98Å; F681-I774 HydrophobicContact CB-CD1 4.22Å; F681-I774 HydrophobicContact CD1-CD1 4.08Å; F681-I774 HydrophobicContact CD1-CG1 4.37Å; F681-I774 HydrophobicContact CG-CD1 4.39Å; T682-I774 PolarHBondContact O-N 3.16Å; I683-I774 WeakPolarHBondContact CA-O 3.25Å; V708-I774 HydrophobicContact CG1-CD1 4.26Å; V708-I774 HydrophobicContact CG1-CG2 4.22Å; V712-I774 HydrophobicContact CG2-CG2 4.33Å; I774-P776 VanDerWaalsContact O-CD 3.27Å; I774-P776 WeakPolarHBondContact O-CD 3.49Å
775A40.5Very low31.9Very low4 Ų4108.1 Ų108.13%0.03352%0.52CS..EExtended strand (participates in β ladder)trans-91.3107.5173.100000107.7L731 F777L731-A775 HydrophobicContact CD1-CB 3.59Å; A775-F777 PolarHBondContact O-N 3.38Å; A775-F777 VanDerWaalsContact O-N 3.08Å
776P40.1Very low32.3Very low11 Ų11101.7 Ų101.77%0.07150%0.503CS..  trans-68.7-9.9-172.725-32.1000113.5I683 V712 I716 A728 I774I683-P776 HydrophobicContact CG2-CG 4.2Å; V712-P776 HydrophobicContact CG1-CB 3.83Å; I716-P776 HydrophobicContact CD1-CB 4.23Å; I716-P776 HydrophobicContact CD1-CG 4.09Å; A728-P776 VanDerWaalsContact CA-O 3.29Å; A728-P776 WeakPolarHBondContact CA-O 3.29Å; A728-P776 VanDerWaalsContact CB-O 3.29Å; A728-P776 WeakPolarHBondContact CB-O 3.41Å; I774-P776 VanDerWaalsContact O-CD 3.27Å; I774-P776 WeakPolarHBondContact O-CD 3.49Å
777F41.3Very low32.7Very low40 Ų4096.8 Ų96.818%0.17548%0.481CS..  trans-148.1126.4-178.6-49.9-75.9000112.7I645 I716 A775I645-F777 HydrophobicContact CD1-CD2 3.56Å; I645-F777 HydrophobicContact CD1-CE2 3.99Å; I645-F777 HydrophobicContact CD1-CG 4.28Å; I716-F777 HydrophobicContact CD1-CE2 3.84Å; I716-F777 HydrophobicContact CD1-CZ 4.1Å; A775-F777 PolarHBondContact O-N 3.38Å; A775-F777 VanDerWaalsContact O-N 3.08Å
778V31.1Very low33.2Very low73 Ų7397.3 Ų97.344%0.44248%0.482SS..  trans-113.9113.8153.3177.20000105.2F701 F729 K780F701-V778 HydrophobicContact CE1-CG2 4.41Å; F729-V778 HydrophobicContact CD2-CB 4.39Å; V778-K780 PolarHBondContact O-N 2.88Å; V778-K780 VanDerWaalsContact O-N 3.13Å
779L28.5Very low33.6Very low123 Ų12392.2 Ų92.264%0.64447%0.469SS*.  trans-62.1114.8179.2-73.5162.2000109.2
780K25.8Very low33.6Very low202 Ų20285.7 Ų85.788%0.87845%0.451SS*.  trans-79.9114.7162.9-161.5177.6-175.6-177.80106.5V778 S782V778-K780 PolarHBondContact O-N 2.88Å; V778-K780 VanDerWaalsContact O-N 3.13Å; K780-S782 PolarHBondContact O-N 3.14Å; K780-S782 VanDerWaalsContact O-N 3.12Å
781E25.3Very low33.6Very low136 Ų13683.5 Ų83.564%0.63645%0.447SS*.  trans-57119.3167.9-85.4174.816200108R689R689-E781 IonicContact CZ-OE2 2.98Å; R689-E781 IonicContact NH1-OE1 3.96Å; R689-E781 PolarHBondContact NH1-OE1 2.87Å; R689-E781 IonicContact NH1-OE2 2.77Å; R689-E781 PolarHBondContact NH1-OE2 3.23Å; R689-E781 IonicContact NH2-OE2 3.5Å; R689-E781 PolarHBondContact NH2-OE2 3.33Å; R689-E781 VanDerWaalsContact NH2-OE2 3.12Å
782S24.5Very low33.4Very low76 Ų7682.3 Ų82.353%0.53145%0.448SS..  trans-56130.3158.7154.90000107.5K780 V784K780-S782 PolarHBondContact O-N 3.14Å; K780-S782 VanDerWaalsContact O-N 3.12Å; S782-V784 PolarHBondContact O-N 3.43Å; S782-V784 PolarHBondContact OG-N 3.14Å; S782-V784 VanDerWaalsContact OG-N 3.17Å; S782-V784 PolarHBondContact OG-OXT 3.45Å
783P32.7Very low32.9Very low138 Ų13886.4 Ų86.490%0.89647%0.474SS*.  trans-77.333.5172.632.6-33.3000112.6
784V27Very low32.3Very low182 Ų18290.1 Ų90.1100%1.10350%0.495SS*.  trans-1330170.4-168.70000106S782S782-V784 PolarHBondContact O-N 3.43Å; S782-V784 PolarHBondContact OG-N 3.14Å; S782-V784 VanDerWaalsContact OG-N 3.17Å; S782-V784 PolarHBondContact OG-OXT 3.45Å

Retrieved 784 of 784 residues in 766.2 ms (Link to these results)

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