A0A060WER7_ONCMY Loading...

Homeobox-containing protein 1

Binds directly to 5'-TTAGGG-3' repeats in telomeric DNA. Associates with the telomerase complex at sites of active telomere processing and positively regulates telomere elongation. Important for TERT binding to chromatin, indicating a role in recruitment of the telomerase complex to telomeres. Also plays a role in the alternative lengthening of telomeres (ALT) pathway in telomerase-negative cells where it promotes formation and/or maintenance of ALT-associated promyelocytic leukemia bodies (APBs). Enhances formation of telomere C-circles in ALT cells, suggesting a possible role in telomere recombination. Might also be involved in the DNA damage response at telomeres.

AlphaFold DB , UniProt , Accession A0A060WER7, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 550 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
1M38Very low56.7Low231 Ų231149.5 Ų149.5100%1.13875%0.75SS**  0131.20-58.883.583.200108
2S37.8Very low59.1Low108 Ų108149.4 Ų149.476%0.75575%0.751SS**  trans-98.8113.9173.8-59.30000109.4F4S2-F4 VanDerWaalsContact C-N 3.33Å; S2-F4 PolarHBondContact O-N 3.43Å
3Q46.2Very low61.6Low180 Ų180150.2 Ų150.284%0.84175%0.75SS**  trans-76.186.6171.2-71.5178.2-14.100109.1T5Q3-T5 VanDerWaalsContact C-N 3.26Å; Q3-T5 PolarHBondContact O-N 3.11Å
4F40.6Very low63.7Low193 Ų193146.2 Ų146.285%0.84673%0.728SS**  trans-7094155.1-75.9-81.1000107S2 D6S2-F4 VanDerWaalsContact C-N 3.33Å; S2-F4 PolarHBondContact O-N 3.43Å; F4-D6 PolarHBondContact O-N 2.82Å
5T47.4Very low65.6Low118 Ų118141.3 Ų141.372%0.72470%0.704SS**  trans-61.1124171.2500000108.5Q3 E7Q3-T5 VanDerWaalsContact C-N 3.26Å; Q3-T5 PolarHBondContact O-N 3.11Å; T5-E7 PolarHBondContact O-N 3.24Å
6D49.6Very low67.3Low158 Ų158135.8 Ų135.885%0.84568%0.678SS**  trans-59.9105.9-177.2-155.6-5.8000109.5F4F4-D6 PolarHBondContact O-N 2.82Å
7E52Low68.9Low152 Ų152132.9 Ų132.971%0.7167%0.665SS**  trans-67.6127.9-174.8-173.5-179.4-178.100108.3T5 R9T5-E7 PolarHBondContact O-N 3.24Å; E7-R9 WeakPolarHBondContact O-CG 3.01Å; E7-R9 PolarHBondContact O-N 2.88Å
8P60.9Low70.2Confident87 Ų87129.8 Ų129.857%0.56565%0.65SS**  trans-66.894.6-177.326-33.8000110.3F10P8-F10 VanDerWaalsContact C-N 3.26Å; P8-F10 HydrophobicContact CB-CE2 3.96Å; P8-F10 HydrophobicContact CB-CZ 4.03Å; P8-F10 HydrophobicContact CG-CE2 3.91Å; P8-F10 HydrophobicContact CG-CZ 4.27Å; P8-F10 WeakPolarHBondContact O-CD2 3.43Å; P8-F10 WeakPolarHBondContact O-CE2 3.45Å; P8-F10 PolarHBondContact O-N 2.84Å
9R76.1Confident71.4Confident226 Ų226128.5 Ų128.585%0.85364%0.642SS**  trans-71.874.8-175.3-63.7-175.466.4-154.8-0.8111.9E7 T11E7-R9 WeakPolarHBondContact O-CG 3.01Å; E7-R9 PolarHBondContact O-N 2.88Å; R9-T11 PolarHBondContact O-N 3.44Å
10F85.9Confident72.6Confident119 Ų119128.3 Ų128.352%0.52263%0.633SS.*  trans-56.8135.7170.5-58.1-73.1000110.7P8 Q14 I15P8-F10 VanDerWaalsContact C-N 3.26Å; P8-F10 HydrophobicContact CB-CE2 3.96Å; P8-F10 HydrophobicContact CB-CZ 4.03Å; P8-F10 HydrophobicContact CG-CE2 3.91Å; P8-F10 HydrophobicContact CG-CZ 4.27Å; P8-F10 WeakPolarHBondContact O-CD2 3.43Å; P8-F10 WeakPolarHBondContact O-CE2 3.45Å; P8-F10 PolarHBondContact O-N 2.84Å; F10-Q14 HydrophobicContact CB-CB 4.41Å; F10-I15 HydrophobicContact CB-CD1 4.1Å; F10-I15 HydrophobicContact CB-CG1 3.73Å
11T88.8Confident73.6Confident73 Ų73124.7 Ų124.745%0.44862%0.616SS.*  trans-69.2157.4172.362.60000110.9R9 E13 Q14 I15R9-T11 PolarHBondContact O-N 3.44Å; T11-E13 PolarHBondContact O-N 3.16Å; T11-Q14 PolarHBondContact O-N 2.81Å; T11-Q14 VanDerWaalsContact O-N 3.08Å; T11-Q14 VanDerWaalsContact OG1-CD 3.27Å; T11-Q14 VanDerWaalsContact OG1-CG 3.28Å; T11-Q14 WeakPolarHBondContact OG1-CG 3.49Å; T11-Q14 PolarHBondContact OG1-N 3.32Å; T11-Q14 PolarHBondContact OG1-OE1 3.36Å; T11-I15 WeakPolarHBondContact O-CG1 3.39Å; T11-I15 PolarHBondContact O-N 3.02Å
12I85.6Confident76.2Confident148 Ų148123.1 Ų123.176%0.75960%0.598SS**Hα-helixtrans-55.9-36.1177.8-59.3172.9000111.1I15 D16I12-I15 PolarHBondContact O-N 3.41Å; I12-D16 PolarHBondContact O-N 3.33Å
13E91.8Very high78.9Confident159 Ų159125.6 Ų125.674%0.74359%0.59SS**Hα-helixtrans-69.2-40.5177.8-60.5-176.6175.800112.7T11 I15 L17T11-E13 PolarHBondContact O-N 3.16Å; E13-I15 VanDerWaalsContact C-N 3.34Å; E13-L17 WeakPolarHBondContact O-CB 3.41Å; E13-L17 PolarHBondContact O-N 3.28Å
14Q91.3Very high81.1Confident95 Ų95121.8 Ų121.844%0.44458%0.58SS.*Hα-helixtrans-64.9-39173.2-73.5163.3-34.300111.5F10 T11 L17 L18F10-Q14 HydrophobicContact CB-CB 4.41Å; T11-Q14 PolarHBondContact O-N 2.81Å; T11-Q14 VanDerWaalsContact O-N 3.08Å; T11-Q14 VanDerWaalsContact OG1-CD 3.27Å; T11-Q14 VanDerWaalsContact OG1-CG 3.28Å; T11-Q14 WeakPolarHBondContact OG1-CG 3.49Å; T11-Q14 PolarHBondContact OG1-N 3.32Å; T11-Q14 PolarHBondContact OG1-OE1 3.36Å; Q14-L17 PolarHBondContact O-N 3.08Å; Q14-L18 WeakPolarHBondContact O-CG 3.5Å; Q14-L18 PolarHBondContact O-N 3.24Å
15I91.4Very high83.5Confident72 Ų72115.4 Ų115.437%0.36957%0.568SS.*Hα-helixtrans-66-48.1177.3-65.7168.9000110.8F10 T11 I12 E13 L17 L18 Q19F10-I15 HydrophobicContact CB-CD1 4.1Å; F10-I15 HydrophobicContact CB-CG1 3.73Å; T11-I15 WeakPolarHBondContact O-CG1 3.39Å; T11-I15 PolarHBondContact O-N 3.02Å; I12-I15 PolarHBondContact O-N 3.41Å; E13-I15 VanDerWaalsContact C-N 3.34Å; I15-L17 VanDerWaalsContact C-N 3.34Å; I15-L17 PolarHBondContact O-N 3.27Å; I15-L18 PolarHBondContact O-N 2.95Å; I15-Q19 WeakPolarHBondContact O-CG 3.29Å; I15-Q19 PolarHBondContact O-N 3.48Å
16D92.7Very high85.7Confident53 Ų53112.6 Ų112.628%0.28355%0.548SS..Hα-helixtrans-65.6-35.2176.6170.863.3000112.3I12 Q19 R20 R23I12-D16 PolarHBondContact O-N 3.33Å; D16-Q19 CarbonylContact O-C 3.5Å; D16-Q19 PolarHBondContact O-N 2.9Å; D16-R20 WeakPolarHBondContact O-CB 3.38Å; D16-R20 WeakPolarHBondContact O-CG 3.38Å; D16-R20 PolarHBondContact O-N 2.64Å; D16-R20 IonicContact OD1-NE 2.91Å; D16-R20 IonicContact OD2-CZ 3.48Å; D16-R20 IonicContact OD2-NE 2.89Å; D16-R20 PolarHBondContact OD2-NE 2.73Å; D16-R20 IonicContact OD2-NH2 3.35Å; D16-R20 PolarHBondContact OD2-NH2 3.05Å; D16-R23 IonicContact OD1-NH2 3.2Å; D16-R23 PolarHBondContact OD1-NH2 2.72Å
17L95Very high87.7Confident87 Ų87108.4 Ų108.446%0.45553%0.528SS..Hα-helixtrans-60-46.8172.7-179.961.7000111.7E13 Q14 I15 Q19 R20 L21E13-L17 WeakPolarHBondContact O-CB 3.41Å; E13-L17 PolarHBondContact O-N 3.28Å; Q14-L17 PolarHBondContact O-N 3.08Å; I15-L17 VanDerWaalsContact C-N 3.34Å; I15-L17 PolarHBondContact O-N 3.27Å; L17-Q19 VanDerWaalsContact C-N 3.33Å; L17-Q19 PolarHBondContact O-N 3.01Å; L17-R20 WeakPolarHBondContact O-CB 3.36Å; L17-R20 PolarHBondContact O-N 3.28Å; L17-R20 VanDerWaalsContact O-N 3.16Å; L17-L21 WeakPolarHBondContact O-CG 3.23Å; L17-L21 PolarHBondContact O-N 2.85Å
18L93.3Very high89.6Confident77 Ų77109.1 Ų109.140%0.40353%0.529SS..Hα-helixtrans-63.9-37.5174.9-70.7169.4000112Q14 I15 R20 L21 R22Q14-L18 WeakPolarHBondContact O-CG 3.5Å; Q14-L18 PolarHBondContact O-N 3.24Å; I15-L18 PolarHBondContact O-N 2.95Å; L18-R20 VanDerWaalsContact C-N 3.34Å; L18-L21 PolarHBondContact O-N 3.23Å; L18-R22 WeakPolarHBondContact O-CG 3.35Å; L18-R22 PolarHBondContact O-N 2.87Å
19Q91.6Very high91.2Very high105 Ų105109 Ų10949%0.49153%0.528SS..Hα-helixtrans-67-32172.9-70.8176.7800112.6I15 D16 L17 R23I15-Q19 WeakPolarHBondContact O-CG 3.29Å; I15-Q19 PolarHBondContact O-N 3.48Å; D16-Q19 CarbonylContact O-C 3.5Å; D16-Q19 PolarHBondContact O-N 2.9Å; L17-Q19 VanDerWaalsContact C-N 3.33Å; L17-Q19 PolarHBondContact O-N 3.01Å; Q19-R23 WeakPolarHBondContact O-CB 3.36Å; Q19-R23 VanDerWaalsContact O-CG 3.32Å; Q19-R23 WeakPolarHBondContact O-CG 3.16Å; Q19-R23 PolarHBondContact O-N 2.7Å; Q19-R23 VanDerWaalsContact O-N 3.11Å; Q19-R23 PolarHBondContact O-NE 2.88Å
20R95.3Very high91.9Very high125 Ų125102.8 Ų102.847%0.47251%0.509SS..Hα-helixtrans-69.2-44.5173.5-81.2-174.4-94.3144.3-3.9111.2D16 L17 L18 R22 R23 T24D16-R20 WeakPolarHBondContact O-CB 3.38Å; D16-R20 WeakPolarHBondContact O-CG 3.38Å; D16-R20 PolarHBondContact O-N 2.64Å; D16-R20 IonicContact OD1-NE 2.91Å; D16-R20 IonicContact OD2-CZ 3.48Å; D16-R20 IonicContact OD2-NE 2.89Å; D16-R20 PolarHBondContact OD2-NE 2.73Å; D16-R20 IonicContact OD2-NH2 3.35Å; D16-R20 PolarHBondContact OD2-NH2 3.05Å; L17-R20 WeakPolarHBondContact O-CB 3.36Å; L17-R20 PolarHBondContact O-N 3.28Å; L17-R20 VanDerWaalsContact O-N 3.16Å; L18-R20 VanDerWaalsContact C-N 3.34Å; R20-R22 PolarHBondContact O-N 3.43Å; R20-R23 WeakPolarHBondContact O-CB 3.39Å; R20-R23 PolarHBondContact O-N 2.73Å; R20-R23 VanDerWaalsContact O-N 3.08Å; R20-T24 PolarHBondContact O-N 2.84Å
21L94.4Very high92.3Very high53 Ų5398.2 Ų98.228%0.27749%0.489SS..Hα-helixtrans-62.6-40.3175.2-67.9170.3000112.3L17 L18 R23 T24 M26 I31L17-L21 WeakPolarHBondContact O-CG 3.23Å; L17-L21 PolarHBondContact O-N 2.85Å; L18-L21 PolarHBondContact O-N 3.23Å; L21-R23 VanDerWaalsContact C-N 3.29Å; L21-R23 PolarHBondContact O-N 2.69Å; L21-T24 PolarHBondContact O-N 2.91Å; L21-T24 PolarHBondContact O-OG1 2.95Å; L21-M26 HydrophobicContact CD2-SD 4.32Å; L21-M26 PolarHBondContact O-N 3.28Å; L21-I31 HydrophobicContact CB-CD1 3.81Å; L21-I31 HydrophobicContact CB-CG1 4.29Å; L21-I31 HydrophobicContact CD1-CG2 4.2Å
22R92.4Very high92.5Very high197 Ų19799 Ų9974%0.74349%0.491SS*.Hα-helixtrans-65.9-29.4172.5-72.3-171.468.3-170.9-0.9113.3L18 R20 T24 G25L18-R22 WeakPolarHBondContact O-CG 3.35Å; L18-R22 PolarHBondContact O-N 2.87Å; R20-R22 PolarHBondContact O-N 3.43Å; R22-T24 VanDerWaalsContact C-N 3.32Å; R22-G25 PolarHBondContact O-N 3.14Å
23R93.8Very high92.9Very high160 Ų16097.9 Ų97.960%0.60448%0.482SS*.Hα-helixtrans-72.1-20.8175.2-83.4173.7-81.6172.1-10113.3D16 Q19 R20 L21 G25D16-R23 IonicContact OD1-NH2 3.2Å; D16-R23 PolarHBondContact OD1-NH2 2.72Å; Q19-R23 WeakPolarHBondContact O-CB 3.36Å; Q19-R23 VanDerWaalsContact O-CG 3.32Å; Q19-R23 WeakPolarHBondContact O-CG 3.16Å; Q19-R23 PolarHBondContact O-N 2.7Å; Q19-R23 VanDerWaalsContact O-N 3.11Å; Q19-R23 PolarHBondContact O-NE 2.88Å; R20-R23 WeakPolarHBondContact O-CB 3.39Å; R20-R23 PolarHBondContact O-N 2.73Å; R20-R23 VanDerWaalsContact O-N 3.08Å; L21-R23 VanDerWaalsContact C-N 3.29Å; L21-R23 PolarHBondContact O-N 2.69Å; R23-G25 PolarHBondContact O-N 3.44Å
24T92.9Very high92.9Very high100 Ų10092.1 Ų92.161%0.61346%0.461SS*.THydrogen-bonded Turntrans-86.614171.565.20000113.1R20 L21 R22 M26R20-T24 PolarHBondContact O-N 2.84Å; L21-T24 PolarHBondContact O-N 2.91Å; L21-T24 PolarHBondContact O-OG1 2.95Å; R22-T24 VanDerWaalsContact C-N 3.32Å; T24-M26 PolarHBondContact O-N 3.12Å
25G92.1Very high93Very high59 Ų5992.1 Ų92.161%0.60846%0.464SS*.THydrogen-bonded Turntrans78.2-6.1-179.600000115.4R22 R23 T27R22-G25 PolarHBondContact O-N 3.14Å; R23-G25 PolarHBondContact O-N 3.44Å; G25-T27 PolarHBondContact O-N 3.04Å
26M92.5Very high93.1Very high59 Ų5993.4 Ų93.429%0.29147%0.471SS..  trans-65.3124.6-179.4-69.7-174.772.400111.2L21 T24 E30 I31 A34L21-M26 HydrophobicContact CD2-SD 4.32Å; L21-M26 PolarHBondContact O-N 3.28Å; T24-M26 PolarHBondContact O-N 3.12Å; M26-E30 HydrophobicContact CE-CB 4.14Å; M26-I31 HydrophobicContact CB-CD1 4.31Å; M26-I31 HydrophobicContact CB-CG1 3.86Å; M26-I31 HydrophobicContact CE-CG1 4.16Å; M26-A34 HydrophobicContact CE-CB 4.04Å
27T92.9Very high93.1Very high70 Ų7092.8 Ų92.843%0.42947%0.469SS..  trans-77.2163.3175.768.10000111.4G25 P29 E30 I31G25-T27 PolarHBondContact O-N 3.04Å; T27-P29 WeakPolarHBondContact OG1-CD 3.36Å; T27-P29 WeakPolarHBondContact OG1-CG 3.35Å; T27-E30 VanDerWaalsContact CB-OE2 3.25Å; T27-E30 WeakPolarHBondContact CB-OE2 3.29Å; T27-E30 WeakPolarHBondContact CG2-OE2 3.5Å; T27-E30 PolarHBondContact N-OE2 3.31Å; T27-E30 PolarHBondContact O-N 3.39Å; T27-E30 VanDerWaalsContact OG1-CD 3.3Å; T27-E30 WeakPolarHBondContact OG1-CG 3.5Å; T27-E30 PolarHBondContact OG1-OE2 2.99Å; T27-I31 WeakPolarHBondContact O-CG1 3.49Å; T27-I31 PolarHBondContact O-N 3.23Å
28K91.3Very high92.8Very high167 Ų16793.8 Ų93.873%0.72648%0.475SS*.Hα-helixtrans-50.8-48.9176.8-176.3-179.1175.9-175.30113.9I31 L32K28-I31 PolarHBondContact O-N 3.38Å; K28-L32 HydrophobicContact CG-CD1 4.4Å; K28-L32 WeakPolarHBondContact O-CG 3.27Å; K28-L32 PolarHBondContact O-N 3.26Å
29P93.2Very high92.7Very high85 Ų8594 Ų9455%0.55248%0.476SS*.Hα-helixtrans-66.3-34.2178.725.2-34.7000113.3T27 L32 H33T27-P29 WeakPolarHBondContact OG1-CD 3.36Å; T27-P29 WeakPolarHBondContact OG1-CG 3.35Å; P29-L32 PolarHBondContact O-N 3.42Å; P29-H33 WeakPolarHBondContact O-CB 3.36Å; P29-H33 PolarHBondContact O-N 3.29Å
30E92.3Very high92.7Very high96 Ų9695.7 Ų95.745%0.44948%0.478SS..Hα-helixtrans-68.5-37.1177.4-67.1165.6125.500112.1M26 T27 L32 H33 A34M26-E30 HydrophobicContact CE-CB 4.14Å; T27-E30 VanDerWaalsContact CB-OE2 3.25Å; T27-E30 WeakPolarHBondContact CB-OE2 3.29Å; T27-E30 WeakPolarHBondContact CG2-OE2 3.5Å; T27-E30 PolarHBondContact N-OE2 3.31Å; T27-E30 PolarHBondContact O-N 3.39Å; T27-E30 VanDerWaalsContact OG1-CD 3.3Å; T27-E30 WeakPolarHBondContact OG1-CG 3.5Å; T27-E30 PolarHBondContact OG1-OE2 2.99Å; E30-L32 VanDerWaalsContact C-N 3.33Å; E30-H33 PolarHBondContact O-N 3.07Å; E30-A34 VanDerWaalsContact O-CB 3.28Å; E30-A34 WeakPolarHBondContact O-CB 3.17Å; E30-A34 PolarHBondContact O-N 3.39Å
31I92.9Very high92.3Very high22 Ų2293.5 Ų93.511%0.11348%0.475CS..Hα-helixtrans-62.6-41.4173.2-65.8168.8000110.5L21 M26 T27 K28 A34 L35L21-I31 HydrophobicContact CB-CD1 3.81Å; L21-I31 HydrophobicContact CB-CG1 4.29Å; L21-I31 HydrophobicContact CD1-CG2 4.2Å; M26-I31 HydrophobicContact CB-CD1 4.31Å; M26-I31 HydrophobicContact CB-CG1 3.86Å; M26-I31 HydrophobicContact CE-CG1 4.16Å; T27-I31 WeakPolarHBondContact O-CG1 3.49Å; T27-I31 PolarHBondContact O-N 3.23Å; K28-I31 PolarHBondContact O-N 3.38Å; I31-A34 PolarHBondContact O-N 3.01Å; I31-L35 HydrophobicContact CG2-CD1 4.43Å; I31-L35 WeakPolarHBondContact O-CG 3.29Å; I31-L35 PolarHBondContact O-N 3.4Å; I31-L35 VanDerWaalsContact O-N 3.12Å
32L93.2Very high91.6Very high91 Ų9196.5 Ų96.548%0.47649%0.492SS..Hα-helixtrans-66.2-48.7176.2-66.9169.8000111.5K28 P29 E30 A34 L35 D36K28-L32 HydrophobicContact CG-CD1 4.4Å; K28-L32 WeakPolarHBondContact O-CG 3.27Å; K28-L32 PolarHBondContact O-N 3.26Å; P29-L32 PolarHBondContact O-N 3.42Å; E30-L32 VanDerWaalsContact C-N 3.33Å; L32-A34 VanDerWaalsContact C-N 3.26Å; L32-A34 PolarHBondContact O-N 2.87Å; L32-L35 WeakPolarHBondContact O-CA 3.44Å; L32-L35 WeakPolarHBondContact O-CB 3.45Å; L32-L35 PolarHBondContact O-N 2.86Å; L32-D36 PolarHBondContact O-N 2.83Å
33H94.2Very high91.4Very high124 Ų12495.7 Ų95.757%0.57449%0.489SS*.Hα-helixtrans-61.4-32.3177.2179.8-99.1000113.2P29 E30 T37P29-H33 WeakPolarHBondContact O-CB 3.36Å; P29-H33 PolarHBondContact O-N 3.29Å; E30-H33 PolarHBondContact O-N 3.07Å; H33-T37 VanDerWaalsContact O-CB 3.3Å; H33-T37 WeakPolarHBondContact O-CB 3.27Å; H33-T37 PolarHBondContact O-N 3.41Å; H33-T37 PolarHBondContact O-OG1 3.35Å
34A93.1Very high90.5Very high37 Ų3793.6 Ų93.631%0.30649%0.485SS..Hα-helixtrans-67.6-40.4172.200000112.1M26 E30 I31 L32 T37 L38M26-A34 HydrophobicContact CE-CB 4.04Å; E30-A34 VanDerWaalsContact O-CB 3.28Å; E30-A34 WeakPolarHBondContact O-CB 3.17Å; E30-A34 PolarHBondContact O-N 3.39Å; I31-A34 PolarHBondContact O-N 3.01Å; L32-A34 VanDerWaalsContact C-N 3.26Å; L32-A34 PolarHBondContact O-N 2.87Å; A34-T37 PolarHBondContact O-N 3.18Å; A34-L38 WeakPolarHBondContact O-CG 3.43Å; A34-L38 PolarHBondContact O-N 3.46Å
35L93Very high89.2Confident96 Ų9692.5 Ų92.550%0.50347%0.473SS..Hα-helixtrans-64.3-48.3173.6-69.1167000111.2I31 L32 T37 L38 D39I31-L35 HydrophobicContact CG2-CD1 4.43Å; I31-L35 WeakPolarHBondContact O-CG 3.29Å; I31-L35 PolarHBondContact O-N 3.4Å; I31-L35 VanDerWaalsContact O-N 3.12Å; L32-L35 WeakPolarHBondContact O-CA 3.44Å; L32-L35 WeakPolarHBondContact O-CB 3.45Å; L32-L35 PolarHBondContact O-N 2.86Å; L35-T37 PolarHBondContact O-N 3.34Å; L35-L38 WeakPolarHBondContact O-CB 3.34Å; L35-L38 PolarHBondContact O-N 2.69Å; L35-L38 VanDerWaalsContact O-N 3.09Å; L35-D39 PolarHBondContact O-N 2.95Å
36D93.5Very high87.6Confident99 Ų9991.9 Ų91.953%0.52947%0.467SS..Hα-helixtrans-57.6-33.9175.1-68.2-39.5000112.2L32 R40L32-D36 PolarHBondContact O-N 2.83Å; D36-R40 WeakPolarHBondContact O-CB 3.47Å; D36-R40 WeakPolarHBondContact O-CD 3.46Å; D36-R40 WeakPolarHBondContact O-CG 3.42Å; D36-R40 PolarHBondContact O-N 3.27Å
37T91.9Very high86Confident39 Ų3996.8 Ų96.824%0.23949%0.489CS..Hα-helixtrans-73.2-40176.5-63.80000112.4H33 A34 L35 R40 L41H33-T37 VanDerWaalsContact O-CB 3.3Å; H33-T37 WeakPolarHBondContact O-CB 3.27Å; H33-T37 PolarHBondContact O-N 3.41Å; H33-T37 PolarHBondContact O-OG1 3.35Å; A34-T37 PolarHBondContact O-N 3.18Å; L35-T37 PolarHBondContact O-N 3.34Å; T37-R40 PolarHBondContact O-N 3.4Å; T37-R40 PolarHBondContact OG1-NH1 2.83Å; T37-L41 HydrophobicContact CG2-CD1 4.12Å; T37-L41 WeakPolarHBondContact O-CB 3.5Å; T37-L41 VanDerWaalsContact O-CG 3.27Å; T37-L41 WeakPolarHBondContact O-CG 3.33Å; T37-L41 PolarHBondContact O-N 3.18Å
38L89.9Confident84.4Confident109 Ų10999.9 Ų99.957%0.57150%0.496SS*.Hα-helixtrans-62-46.1172-73.1167.3000111.1A34 L35 R40 L41 D42A34-L38 WeakPolarHBondContact O-CG 3.43Å; A34-L38 PolarHBondContact O-N 3.46Å; L35-L38 WeakPolarHBondContact O-CB 3.34Å; L35-L38 PolarHBondContact O-N 2.69Å; L35-L38 VanDerWaalsContact O-N 3.09Å; L38-R40 VanDerWaalsContact C-N 3.32Å; L38-R40 PolarHBondContact O-N 3.46Å; L38-L41 PolarHBondContact O-N 3.3Å; L38-L41 VanDerWaalsContact O-N 3.1Å; L38-D42 PolarHBondContact O-N 3.02Å
39D89.8Confident82.6Confident82 Ų82101.1 Ų101.144%0.43950%0.502SS..Hα-helixtrans-60.1-40.6178.3-115.859.2000112.3L35 R43L35-D39 PolarHBondContact O-N 2.95Å; D39-R43 WeakPolarHBondContact O-CD 3.4Å; D39-R43 WeakPolarHBondContact O-CG 3.33Å; D39-R43 PolarHBondContact O-N 2.65Å; D39-R43 PolarHBondContact O-NE 3.19Å; D39-R43 IonicContact OD2-CZ 2.66Å; D39-R43 IonicContact OD2-NE 2.66Å; D39-R43 PolarHBondContact OD2-NE 2.86Å; D39-R43 IonicContact OD2-NH2 3.49Å; D39-R43 PolarHBondContact OD2-NH2 2.9Å
40R91.4Very high80.4Confident140 Ų14099 Ų9953%0.52850%0.496SS..Hα-helixtrans-66.5-39.7173.4-77.4165.753.8-117.4-4.7112.5D36 T37 L38 Q44D36-R40 WeakPolarHBondContact O-CB 3.47Å; D36-R40 WeakPolarHBondContact O-CD 3.46Å; D36-R40 WeakPolarHBondContact O-CG 3.42Å; D36-R40 PolarHBondContact O-N 3.27Å; T37-R40 PolarHBondContact O-N 3.4Å; T37-R40 PolarHBondContact OG1-NH1 2.83Å; L38-R40 VanDerWaalsContact C-N 3.32Å; L38-R40 PolarHBondContact O-N 3.46Å; R40-Q44 WeakPolarHBondContact O-CG 3.34Å; R40-Q44 PolarHBondContact O-N 2.88Å
41L86.9Confident77.8Confident78 Ų78105.1 Ų105.141%0.40852%0.515SS..Hα-helixtrans-69.1-41.4179.5-75.9169.1000112.1T37 L38 Q44 H45T37-L41 HydrophobicContact CG2-CD1 4.12Å; T37-L41 WeakPolarHBondContact O-CB 3.5Å; T37-L41 VanDerWaalsContact O-CG 3.27Å; T37-L41 WeakPolarHBondContact O-CG 3.33Å; T37-L41 PolarHBondContact O-N 3.18Å; L38-L41 PolarHBondContact O-N 3.3Å; L38-L41 VanDerWaalsContact O-N 3.1Å; L41-Q44 CarbonylContact O-C 3.57Å; L41-Q44 PolarHBondContact O-N 2.86Å; L41-Q44 VanDerWaalsContact O-N 3.11Å; L41-H45 WeakPolarHBondContact O-CB 3.32Å; L41-H45 PolarHBondContact O-N 2.66Å; L41-H45 VanDerWaalsContact O-N 3.07Å; L41-H45 PolarHBondContact O-ND1 3.49Å
42D81.4Confident74.9Confident116 Ų116115.4 Ų115.462%0.6255%0.552SS**Hα-helixtrans-63.6-45.4178.3-170.252.2000111.2L38 Q44 H45 G46L38-D42 PolarHBondContact O-N 3.02Å; D42-Q44 PolarHBondContact O-N 3.41Å; D42-Q44 VanDerWaalsContact O-N 3.11Å; D42-H45 PolarHBondContact O-N 3.16Å; D42-G46 PolarHBondContact O-N 3.35Å
43R86.8Confident72.3Confident181 Ų181116.8 Ų116.868%0.68357%0.567SS**Hα-helixtrans-57-27.7172.8-65.9162.8-160-107.74.9113.1D39D39-R43 WeakPolarHBondContact O-CD 3.4Å; D39-R43 WeakPolarHBondContact O-CG 3.33Å; D39-R43 PolarHBondContact O-N 2.65Å; D39-R43 PolarHBondContact O-NE 3.19Å; D39-R43 IonicContact OD2-CZ 2.66Å; D39-R43 IonicContact OD2-NE 2.66Å; D39-R43 PolarHBondContact OD2-NE 2.86Å; D39-R43 IonicContact OD2-NH2 3.49Å; D39-R43 PolarHBondContact OD2-NH2 2.9Å
44Q75.5Confident69.4Low115 Ų115119.8 Ų119.854%0.53758%0.581SS.*Hα-helixtrans-88.6-14176.1-73.3-179-10.600114.7R40 L41 D42 K48R40-Q44 WeakPolarHBondContact O-CG 3.34Å; R40-Q44 PolarHBondContact O-N 2.88Å; L41-Q44 CarbonylContact O-C 3.57Å; L41-Q44 PolarHBondContact O-N 2.86Å; L41-Q44 VanDerWaalsContact O-N 3.11Å; D42-Q44 PolarHBondContact O-N 3.41Å; D42-Q44 VanDerWaalsContact O-N 3.11Å; Q44-K48 VanDerWaalsContact O-CE 3.23Å; Q44-K48 WeakPolarHBondContact O-CE 3.45Å; Q44-K48 PolarHBondContact O-NZ 2.94Å
45H65.7Low66.5Low78 Ų78124.7 Ų124.736%0.36161%0.607SS.*Hα-helixtrans-121.7-20.1-172.3-67.987.6000114.9L41 D42 H47 K48L41-H45 WeakPolarHBondContact O-CB 3.32Å; L41-H45 PolarHBondContact O-N 2.66Å; L41-H45 VanDerWaalsContact O-N 3.07Å; L41-H45 PolarHBondContact O-ND1 3.49Å; D42-H45 PolarHBondContact O-N 3.16Å; H45-H47 PolarHBondContact O-N 3.25Å; H45-K48 WeakPolarHBondContact O-CB 3.29Å; H45-K48 PolarHBondContact O-N 2.94Å
46G58.8Low63.8Low45 Ų45128.6 Ų128.646%0.46462%0.623SS.*THydrogen-bonded Turntrans-56.6-26.5179.300000114.7D42 K48D42-G46 PolarHBondContact O-N 3.35Å; G46-K48 VanDerWaalsContact C-N 3.34Å; G46-K48 PolarHBondContact O-N 2.85Å
47H58.1Low61.2Low163 Ų163129.2 Ų129.276%0.75563%0.632SS**THydrogen-bonded Turntrans-74.6-16.1173.9-73.7-63.3000114.9H45H45-H47 PolarHBondContact O-N 3.25Å
48K60.5Low58.5Low134 Ų134135.8 Ų135.858%0.58366%0.66SS**THydrogen-bonded Turntrans-94.8-16.3-166.6-57.8-179.7-172.9167.30114.4Q44 H45 G46Q44-K48 VanDerWaalsContact O-CE 3.23Å; Q44-K48 WeakPolarHBondContact O-CE 3.45Å; Q44-K48 PolarHBondContact O-NZ 2.94Å; H45-K48 WeakPolarHBondContact O-CB 3.29Å; H45-K48 PolarHBondContact O-N 2.94Å; G46-K48 VanDerWaalsContact C-N 3.34Å; G46-K48 PolarHBondContact O-N 2.85Å
49F51.9Low56.4Low194 Ų194136.2 Ų136.285%0.85167%0.67SS**SBendtrans-12911.7-179.5-66-77.7000113.8
50G47.9Very low53.7Low41 Ų41139.2 Ų139.242%0.42369%0.691SS.*  trans-121.940.6-161.900000117.6
51R37.3Very low51Low224 Ų224136 Ų13685%0.84570%0.701SS**  trans-142.491.7172-76.8-61.6-171.7-92.16.7113.5
52R32.3Very low48.4Very low237 Ų237142 Ų14289%0.89473%0.727SS**PPolyproline II helixtrans-99.8129.7152.3-171.6176.2-175.3172.21.7106.9Q54R52-Q54 PolarHBondContact O-N 2.9Å
53P38.1Very low45.9Very low121 Ų121140 Ų14079%0.78673%0.734SS**PPolyproline II helixtrans-68.2123.1-173.325.9-33.4000111.1
54Q32.9Very low43.9Very low187 Ų187136.8 Ų136.887%0.87474%0.737SS**PPolyproline II helixtrans-81.7120.4169.8-170.4172.910.500107.9R52 Q56R52-Q54 PolarHBondContact O-N 2.9Å; Q54-Q56 PolarHBondContact O-N 3.2Å; Q54-Q56 VanDerWaalsContact O-N 3.07Å
55T32Very low41.8Very low140 Ų140137.2 Ų137.286%0.85975%0.747SS**  trans-68.9104.7-179.7460000110.4
56Q36.8Very low40.2Very low177 Ų177139.2 Ų139.283%0.82777%0.77SS**PPolyproline II helixtrans-94.4135.9174.5-167.7172.713.200110Q54Q54-Q56 PolarHBondContact O-N 3.2Å; Q54-Q56 VanDerWaalsContact O-N 3.07Å
57P39.9Very low39Very low113 Ų113144.3 Ų144.373%0.73479%0.786SS**PPolyproline II helixtrans-64.5142.3172.3-2032.8000111.8
58Q34.5Very low37.9Very low177 Ų177141.2 Ų141.283%0.82778%0.783SS**PPolyproline II helixtrans-63.4146.5168.4-72.9-81.6-45.200110.6
59P45.4Very low36.6Very low118 Ų118142.3 Ų142.377%0.76680%0.795SS**  -131.2155.1117.737.1-30.8000114.7
60V34.6Very low35.8Very low145 Ų145137.1 Ų137.188%0.87979%0.789SS**  trans-55.6140.8176.6-179.70000112.9
61G33.3Very low35.1Very low73 Ų73141.9 Ų141.975%0.75380%0.804SS**  trans176.6117.3165.900000114.7
62Q33.4Very low35Very low202 Ų202138.8 Ų138.894%0.94480%0.801SS**  trans-79.7150175.2-59.6162.4-2.800111.2
63G28.1Very low34.8Very low74 Ų74134.6 Ų134.676%0.76380%0.802SS**  trans163.6137.2168.600000114.4
64P45.2Very low34.7Very low115 Ų115134.1 Ų134.175%0.74780%0.802SS**  trans-106.9159.8-170.340.6-36.1000115.8
65T31.7Very low34.6Very low123 Ų123130.3 Ų130.376%0.75580%0.796SS**  trans35.1125.5146.757.90000119.3
66S31.2Very low34.4Very low121 Ų121128.9 Ų128.985%0.84679%0.792SS**  -174.8165.591.7-79.90000115.8
67N34.3Very low34.1Very low151 Ų151126 Ų12681%0.80779%0.791SS**  trans-56.8159.8-177.2-69.9-18.6000118.8
68S34.1Very low33.7Very low98 Ų98124.6 Ų124.669%0.68578%0.784SS**  trans88.7146130.766.10000122.3
69N34.7Very low33.7Very low157 Ų157122.3 Ų122.384%0.8478%0.778SS**  trans70.1153.1159.5-61.5-11.4000118.4
70A34.5Very low33Very low86 Ų86122.7 Ų122.771%0.71177%0.773SS**  cis-163.4141.9-32.200000110
71N33.2Very low32.9Very low140 Ų140121.9 Ų121.975%0.74977%0.768SS**  trans43130150.4-147.534.9000122.7
72M34.5Very low32.8Very low159 Ų159124.5 Ų124.578%0.78377%0.769SS**  trans36.9124.6149.9-74.3-178.2175.600121.5
73T29.3Very low32.5Very low149 Ų149119 Ų11991%0.91476%0.758SS**  -158.7158.3102.650000111.5
74S36.1Very low32.5Very low111 Ų111120.6 Ų120.678%0.77676%0.758SS**  trans-121109-176.758.90000112.6
75S29.4Very low31.8Very low108 Ų108120.6 Ų120.676%0.75576%0.76SS**  trans-159.4120.7157.2-29.70000107.1
76S28.6Very low31.8Very low110 Ų110119.4 Ų119.477%0.76976%0.757SS**  86.5138.578.1-62.60000112.8
77S30.7Very low31.9Very low116 Ų116119.6 Ų119.681%0.81175%0.753SS**  trans69.9147.7168.6-60.10000116.4
78S31.1Very low31.7Very low84 Ų84118 Ų11859%0.58775%0.754SS**  cis-176162.3-16.5530000109.4
79N33.6Very low31.8Very low129 Ų129119.4 Ų119.469%0.6976%0.759SS**  trans69.4151.8150-62.2-16.8000116.6
80N31.6Very low31.5Very low125 Ų125116.6 Ų116.667%0.66876%0.758SS**  cis-162.4-167.5-17.2-109.7-21.2000108.5
81V32.7Very low31.3Very low129 Ų129117 Ų11778%0.78276%0.761SS**  trans75.2144.4154.3-47.80000118.6
82V30.6Very low31Very low128 Ų128116.1 Ų116.178%0.77676%0.761SS**  cis-159.5165.1-33.1-90.30000107.6
83A28.1Very low30.7Very low86 Ų86117.4 Ų117.471%0.71177%0.765SS**  trans64.7123.1161.600000116.6
84S27.5Very low31.1Very low108 Ų108116.8 Ų116.876%0.75576%0.761SS**  cis71.8114.146.4-55.20000114.9
85S30.4Very low30.7Very low114 Ų114115 Ų11580%0.79776%0.76SS**  trans66.5143.8146.7-52.70000118.9
86S31.3Very low30.7Very low98 Ų98120.8 Ų120.869%0.68577%0.767SS**  cis-164.1162.9-14.2-98.30000109.2
87T33.8Very low30.6Very low125 Ų125124.9 Ų124.977%0.76777%0.774SS**  trans16.4124.3153.655.40000120.1
88S30.4Very low30.6Very low118 Ų118124.1 Ų124.183%0.82578%0.775SS**  -167.3153.1109.1-84.80000113.6
89T36.9Very low30.6Very low128 Ų128128 Ų12879%0.78579%0.789SS**  trans-88.7141175.147.40000112
90A28Very low30.3Very low98 Ų98124.8 Ų124.881%0.8179%0.787SS**  trans-139.1151.1155.400000109.3
91A29.5Very low30.2Very low95 Ų95124.9 Ų124.979%0.78580%0.797SS**  trans-128.9130.1-176.400000111.6
92T27.5Very low30Very low121 Ų121123 Ų12374%0.74280%0.804SS**  trans-150.8116.2164.420.40000106.4
93Q27.8Very low30Very low186 Ų186120.8 Ų120.887%0.86981%0.807SS**  75.5136.687.5-73.2-170.260.700113.7
94T38.8Very low30.2Very low136 Ų136123.1 Ų123.183%0.83482%0.818SS**  trans-73.9135.4-176.246.50000112.3
95G27.8Very low30.4Very low74 Ų74121.2 Ų121.276%0.76382%0.815SS**  trans-143.986171.600000111.5Q97G95-Q97 PolarHBondContact O-N 2.78Å
96Y28.5Very low30.5Very low228 Ų228124.4 Ų124.489%0.89482%0.822SS**  trans-77.7107.1169.1-82.5-84.2000109.3A98Y96-A98 PolarHBondContact O-N 3.1Å
97Q26Very low30.5Very low196 Ų196125.2 Ų125.292%0.91683%0.828SS**  trans-74.7114161.7-80.5-174.6-34.500109.2G95G95-Q97 PolarHBondContact O-N 2.78Å
98A30.2Very low31.1Very low101 Ų101125.2 Ų125.284%0.83583%0.83SS**  trans-98.5131.5163.600000109.1Y96Y96-A98 PolarHBondContact O-N 3.1Å
99N31.1Very low31.3Very low165 Ų165124.8 Ų124.888%0.88283%0.827SS**  trans-144126.6173.9-173.141.1000108
100G27.7Very low31.9Very low62 Ų62124 Ų12464%0.63983%0.825SS**  cis159.3111-6.100000111.1
101S29.3Very low31.9Very low126 Ų126124.2 Ų124.288%0.88182%0.82SS**  trans-161.9112.5177.941.80000113.8
102G29.5Very low32.1Very low91 Ų91126.7 Ų126.794%0.93882%0.82SS**  trans102.1107.6154.800000117.9
103G29.5Very low32.2Very low80 Ų80126.1 Ų126.183%0.82581%0.812SS**  trans131.5106.9153.400000117
104S32.9Very low32.4Very low136 Ų136126.9 Ų126.995%0.95181%0.809SS**  trans-36.8155.3166.3-42.50000117.1
105G30.9Very low32.1Very low67 Ų67126.9 Ų126.969%0.69180%0.803SS**  cis157.2166-3.400000113.2
106L32.8Very low32.1Very low181 Ų181131.9 Ų131.995%0.94881%0.809SS**  trans72.2133.6169.8-51-179.7000119.7
107S32Very low32.4Very low115 Ų115125.8 Ų125.880%0.80480%0.8SS**  trans-87.9171160.7-70.50000109.9
108P45.4Very low33.6Very low125 Ų125122 Ų12281%0.81279%0.792SS**  cis-146-171.329.142.3-20.2000117.8
109S34.8Very low34.5Very low109 Ų109122.9 Ų122.976%0.76279%0.79SS**  trans-67.3172.8162.5-42.20000112.1
110P49.1Very low35.2Very low113 Ų113120.7 Ų120.773%0.73478%0.784SS**  cis-150.9-169.62345.3-23.8000118.8
111S28.9Very low36.3Very low101 Ų101123.5 Ų123.571%0.70679%0.791SS**  trans74.1133.2147-600000124.5
112N33.1Very low36.7Very low148 Ų148122.1 Ų122.179%0.79179%0.788SS**  trans39152.6138.3-62.716.2000122
113N30.6Very low36.7Very low109 Ų109124.7 Ų124.758%0.58379%0.785SS**  cis-155.7-174.9-0.4-126.445.5000107.6
114Y31.7Very low36.8Very low202 Ų202127.4 Ų127.479%0.79279%0.785SS**  cis-130.3172.810.5-76.7-86.6000108.4
115D31.3Very low36.8Very low135 Ų135126.7 Ų126.772%0.72278%0.78SS**  cis78.199.437.6-168.836.8000117.9
116M29Very low36.7Very low179 Ų179128 Ų12888%0.88279%0.785SS**  -165.6150.5124-147.5177.7-176.600111.6
117S33.8Very low37.7Very low101 Ų101125.2 Ų125.271%0.70678%0.777SS**  trans-121.3-178.1170.5-64.20000109.8
118P52.5Low37.9Very low115 Ų115126.3 Ų126.375%0.74778%0.779SS**  cis-130-172.8-1.233.9-10.6000113.8
119P48.9Very low37.3Very low121 Ų121124.8 Ų124.879%0.78678%0.777SS**  trans-90.7153.1-176.934.5-36.1000116.1
120P44.9Very low37.3Very low119 Ų119128.2 Ų128.277%0.77379%0.786SS**  trans-103.7-177.5174.846.5-39.2000111.5
121P50.4Low36.6Very low120 Ų120127.7 Ų127.778%0.77979%0.79SS**  -126.8179.8-114.127-1.9000115.7
122A38.3Very low36.6Very low98 Ų98127.2 Ų127.281%0.8179%0.793SS**  trans-82.1145.6170.500000112.4
123V29.3Very low36.7Very low145 Ų145127.3 Ų127.388%0.87980%0.798SS**  trans-138.9154170.1-78.30000110.9
124V32.2Very low36.9Very low136 Ų136126 Ų12682%0.82480%0.803SS**  trans-114.6155.4-173.9-67.50000111.6
125S32.2Very low37Very low122 Ų122124.2 Ų124.285%0.85380%0.802SS**  169.1148.7128.2-78.10000114.1
126A30.4Very low37.1Very low95 Ų95124.9 Ų124.979%0.78581%0.805SS**  trans-142.9151.7154.900000108.4
127P52.3Low37.2Very low121 Ų121119.7 Ų119.779%0.78680%0.798SS**  trans-100.5133.8-153.735.7-35.2000118.2
128V37.2Very low37.1Very low139 Ų139121.8 Ų121.884%0.84281%0.811SS**  52.8123.6126.6-176.70000121.5
129A33.1Very low36Very low93 Ų93120 Ų12077%0.76981%0.813SS**  trans-166.299.513300000115.4
130L34.9Very low35.2Very low181 Ų181117.7 Ų117.795%0.94881%0.811SS**  trans56.4166.9152.1-68.9170.2000122
131A32.6Very low34.6Very low101 Ų101119.6 Ų119.684%0.83582%0.82SS**  trans-162.5171.4-159.200000114.5
132A30.1Very low33.6Very low92 Ų92117.4 Ų117.476%0.7682%0.82SS**  trans-160.6133.415700000113.1
133V35.6Very low33.1Very low149 Ų149116.7 Ų116.790%0.90382%0.822SS**  trans42.8149.3142.2158.90000121.6
134A34.5Very low33.2Very low82 Ų82114 Ų11468%0.67882%0.824SS**  cis-179.2175.4-34.600000106.4
135Q34.3Very low33.2Very low165 Ų165111.6 Ų111.677%0.77183%0.826SS**  cis-143.4-160.64.4-56179.87.200109.8
136N33.4Very low33.3Very low149 Ų149114.3 Ų114.380%0.79783%0.825SS**  trans0.2153.5145.4-49-19.9000120.1
137G30.4Very low33.6Very low70 Ų70118 Ų11872%0.72283%0.83SS**  cis147147.30.600000112.3
138C31.2Very low32.7Very low145 Ų145118.4 Ų118.498%0.9883%0.83SS**  trans63.1163.6179.3-69.40000116.9
139G30.4Very low32.5Very low78 Ų78115.4 Ų115.480%0.80482%0.82SS**  cis159.147.1-10.100000119.1
140G31Very low32.4Very low72 Ų72119.7 Ų119.774%0.74283%0.826SS**  trans88.5149.4149.300000121.5
141V32.4Very low32.3Very low159 Ų159116.6 Ų116.696%0.96482%0.815SS**  trans70.4123.3154.6-169.50000119.6
142G29.6Very low32.4Very low74 Ų74119.4 Ų119.476%0.76382%0.816SS**  trans152.6108.5148.900000119.1
143G28.9Very low32.5Very low83 Ų83118.7 Ų118.786%0.85682%0.817SS**  trans92.7123.5139.400000119.7
144G31.7Very low32.5Very low89 Ų89120.7 Ų120.792%0.91881%0.814SS**  trans-68.3174-17700000118.1
145G32.3Very low32.6Very low84 Ų84123.4 Ų123.487%0.86682%0.816SS**  trans179.9116.8177.700000111.8
146E33Very low32.6Very low179 Ų179120.4 Ų120.484%0.83681%0.813SS**  trans-79.3132-176.9173.2-172.2167.200112.9
147I37.8Very low32.8Very low174 Ų174119.5 Ų119.589%0.89282%0.816SS**  trans-158158.7142.922.1175.8000111.2
148V32.4Very low33.3Very low128 Ų128121.8 Ų121.878%0.77682%0.818SS**  trans-115.4137.2-164.6176.70000112
149A32.5Very low33.5Very low77 Ų77126.4 Ų126.464%0.63682%0.815SS**  156.9132.6129.800000113.8
150M30.8Very low33.7Very low182 Ų182132.2 Ų132.290%0.89782%0.818SS**  trans51.1132.8133.8-62.2-179177.700120.2
151T34.3Very low34.2Very low116 Ų116134.6 Ų134.671%0.71282%0.821SS**  cis-143.1166.411.455.80000112
152N34.2Very low34.4Very low160 Ų160134.6 Ų134.686%0.85681%0.813SS**  trans26.6133.6148.8-60.4-32.5000119.9
153G31.6Very low34.4Very low77 Ų77136.8 Ų136.879%0.79482%0.817SS**  cis156.2127.410.200000107.2
154K36.8Very low34.7Very low191 Ų191139.1 Ų139.183%0.8382%0.815SS**  trans-134.2159.3-154.9-164-172.5177.6179.40111.8
155L34.8Very low34.6Very low140 Ų140140.9 Ų140.973%0.73381%0.813SS**  trans94112.6161.8-52.1173.5000118.4
156S35.6Very low34.6Very low101 Ų101141 Ų14171%0.70681%0.806SS**  33.3125122.3-48.40000121.2
157P36.6Very low34.6Very low130 Ų130138.5 Ų138.584%0.84480%0.803SS**  trans-75.2135.9165.4-13.128.9000113.5
158P42.3Very low34.2Very low119 Ų119136.1 Ų136.177%0.77380%0.801SS**  trans-97.1-179.5164.937.3-32.5000113
159R35.2Very low34.1Very low241 Ų241134 Ų13491%0.90981%0.805SS**  trans-73.5148.6-176.4-68.1176.2164.797-4.2113.9
160F34.1Very low34Very low200 Ų200133.8 Ų133.888%0.87781%0.811SS**  trans-87.5151.3163.3-63.7-80.4000112.6
161P41.4Very low34.3Very low123 Ų123131.6 Ų131.680%0.79981%0.807SS**  trans-121157.1139.236.5-28.6000111.9
162I36.7Very low34.5Very low158 Ų158132.6 Ų132.681%0.8181%0.813SS**  trans-99.5140.9178.5-68.5169.7000110.4V164I162-V164 HydrophobicContact CG2-CG1 4.21Å
163S28.6Very low34.4Very low120 Ų120128.4 Ų128.484%0.83981%0.808SS**  trans-142.3148.7148.467.20000110.1
164V36.5Very low34.6Very low133 Ų133136.4 Ų136.481%0.80681%0.814SS**  trans-109.1161.3-171.1-65.40000112.4I162I162-V164 HydrophobicContact CG2-CG1 4.21Å
165S28.9Very low34.7Very low125 Ų125130 Ų13087%0.87480%0.802SS**  trans-147.5165.5158.8-159.30000111.4
166A33Very low35Very low88 Ų88134 Ų13473%0.72781%0.809SS**  trans-82.4-180-166.700000112.7
167V32.5Very low35.1Very low126 Ų126132.2 Ų132.276%0.76481%0.807SS**  cis-167.7152.834.765.90000114.5
168S29.3Very low35Very low124 Ų124135.8 Ų135.887%0.86781%0.809SS**  trans58.7141.2161.9-75.10000120.9
169G29.7Very low34.9Very low83 Ų83138 Ų13886%0.85681%0.809SS**  trans-179.7-43.8166.900000118.6
170G31.1Very low35Very low73 Ų73128.5 Ų128.575%0.75378%0.783SS**  trans82.6153.6174.800000117.7
171V37.8Very low35.4Very low135 Ų135121.7 Ų121.782%0.81876%0.76SS**  trans61.7110.3159.4-172.30000119
172T38.7Very low35.4Very low137 Ų137123.8 Ų123.884%0.8476%0.759SS**  trans59.5122.5158.257.50000121.5
173G31.9Very low36.1Very low72 Ų72121.7 Ų121.774%0.74275%0.746SS**  trans106.3120.8135.800000118.3
174R35.4Very low37.1Very low245 Ų245120.3 Ų120.393%0.92573%0.726SS**  trans57.4154.4171.4-73.2179.6168.3-117.72.9116.4
175G39.7Very low38Very low56 Ų56119.2 Ų119.258%0.57772%0.715SS**  cis123.690.4-5.700000113.4
176Y40.4Very low40Very low225 Ų225116.1 Ų116.188%0.88269%0.689SS**  trans-148.2144.5160.4-92.8-84.2000107.6
177G38.2Very low42.1Very low64 Ų64112.3 Ų112.366%0.6666%0.656SS**  cis150.282.8-2.100000110.8E179G177-E179 PolarHBondContact O-N 3.47Å
178F34.3Very low44.4Very low204 Ų204109.5 Ų109.590%0.89564%0.637SS**  trans-68.7122.7159179-95.4000106.7A180F178-A180 PolarHBondContact O-N 3.01Å
179E38.8Very low47.1Very low165 Ų165109.2 Ų109.277%0.77163%0.626SS**  trans-75.873.9-173.1-163.3-176.3152.300110.9G177 S181G177-E179 PolarHBondContact O-N 3.47Å; E179-S181 PolarHBondContact O-N 2.8Å; E179-S181 VanDerWaalsContact O-N 3.11Å
180A38.1Very low49.7Very low43 Ų43108.5 Ų108.536%0.35560%0.599SS.*  trans-57.2109.1144.700000105.7F178 E182F178-A180 PolarHBondContact O-N 3.01Å; A180-E182 PolarHBondContact O-N 2.93Å
181S41.8Very low52.4Low57 Ų57105.1 Ų105.140%0.39956%0.564SS.*  trans-50.6138.6-171.551.20000110.7E179 E183 E184E179-S181 PolarHBondContact O-N 2.8Å; E179-S181 VanDerWaalsContact O-N 3.11Å; S181-E183 PolarHBondContact O-N 2.73Å; S181-E184 PolarHBondContact O-N 3.15Å
182E42.5Very low54.8Low167 Ų167101.3 Ų101.378%0.7854%0.537SS*.Hα-helixtrans-57.7-19.3-169.4-54.2-172.1135.200113.3A180A180-E182 PolarHBondContact O-N 2.93Å
183E50.9Low57.2Low113 Ų11399.5 Ų99.553%0.52852%0.519SS..Hα-helixtrans-73.8-32.1172.6-170.1175.6-175.900114.8S181 V187S181-E183 PolarHBondContact O-N 2.73Å; E183-V187 WeakPolarHBondContact O-CG2 3.42Å; E183-V187 PolarHBondContact O-N 3.21Å; E183-V187 VanDerWaalsContact O-N 3.08Å
184E50Low59.9Low91 Ų9196.3 Ų96.343%0.42549%0.485SS..Hα-helixtrans-77.6-36.2-177.4-177157.1-146.600112.4S181 V187 D188 R252S181-E184 PolarHBondContact O-N 3.15Å; E184-V187 WeakPolarHBondContact O-CB 3.47Å; E184-V187 PolarHBondContact O-N 2.78Å; E184-D188 PolarHBondContact O-N 3.35Å; E184-R252 IonicContact OE1-CZ 2.68Å; E184-R252 IonicContact OE1-NH1 3.14Å; E184-R252 PolarHBondContact OE1-NH1 3.1Å; E184-R252 IonicContact OE1-NH2 3.93Å; E184-R252 PolarHBondContact OE1-NH2 2.91Å
185L54.3Low62.4Low111 Ų11186.7 Ų86.758%0.58145%0.451SS*.Hα-helixtrans-64.3-42.8173.1-64.7174.4000111V187 D188 D189L185-V187 VanDerWaalsContact C-N 3.31Å; L185-V187 PolarHBondContact O-N 3.04Å; L185-D188 PolarHBondContact O-N 2.99Å; L185-D189 PolarHBondContact O-N 3.14Å
186D71.9Confident64.7Low59 Ų5992.9 Ų92.932%0.31646%0.457SS..Hα-helixtrans-60.5-35.8173.816778.6000112.9K190D186-K190 VanDerWaalsContact O-CB 3.29Å; D186-K190 WeakPolarHBondContact O-CB 3.38Å; D186-K190 WeakPolarHBondContact O-CD 3.2Å; D186-K190 VanDerWaalsContact O-CG 3.23Å; D186-K190 WeakPolarHBondContact O-CG 3.27Å; D186-K190 PolarHBondContact O-N 3.27Å; D186-K190 WeakPolarHBondContact OD1-CE 3.16Å; D186-K190 IonicContact OD1-NZ 2.72Å; D186-K190 PolarHBondContact OD1-NZ 3.23Å; D186-K190 WeakPolarHBondContact OD2-CE 3.32Å; D186-K190 IonicContact OD2-NZ 2.64Å; D186-K190 PolarHBondContact OD2-NZ 3.3Å
187V76.3Confident67Low8 Ų887.7 Ų87.75%0.04844%0.436CS..Hα-helixtrans-62.6-49.7174.5160.10000111.9E183 E184 L185 K190 V191 R252 L256E183-V187 WeakPolarHBondContact O-CG2 3.42Å; E183-V187 PolarHBondContact O-N 3.21Å; E183-V187 VanDerWaalsContact O-N 3.08Å; E184-V187 WeakPolarHBondContact O-CB 3.47Å; E184-V187 PolarHBondContact O-N 2.78Å; L185-V187 VanDerWaalsContact C-N 3.31Å; L185-V187 PolarHBondContact O-N 3.04Å; V187-K190 WeakPolarHBondContact O-CB 3.46Å; V187-K190 PolarHBondContact O-N 3.37Å; V187-V191 WeakPolarHBondContact O-CG2 3.42Å; V187-V191 PolarHBondContact O-N 3.19Å; V187-R252 HydrophobicContact CG1-CG 3.8Å; V187-L256 HydrophobicContact CG1-CD1 3.61Å; V187-L256 HydrophobicContact CG2-CD1 4.17Å
188D80.6Confident69.2Low67 Ų6790 Ų9036%0.35843%0.433SS..Hα-helixtrans-75-30.9-176.9-78.2-35000112.4E184 L185 K190 V191 E192 R252E184-D188 PolarHBondContact O-N 3.35Å; L185-D188 PolarHBondContact O-N 2.99Å; D188-K190 VanDerWaalsContact C-N 3.33Å; D188-K190 PolarHBondContact O-N 3.45Å; D188-V191 PolarHBondContact O-N 3.04Å; D188-E192 WeakPolarHBondContact O-CB 3.07Å; D188-E192 PolarHBondContact O-N 3.34Å; D188-R252 IonicContact OD1-CZ 2.73Å; D188-R252 IonicContact OD1-NE 2.7Å; D188-R252 PolarHBondContact OD1-NE 3.24Å; D188-R252 IonicContact OD1-NH2 3.4Å; D188-R252 IonicContact OD2-CZ 3.35Å; D188-R252 IonicContact OD2-NE 3.73Å; D188-R252 PolarHBondContact OD2-NE 2.89Å; D188-R252 IonicContact OD2-NH2 3.05Å; D188-R252 PolarHBondContact OD2-NH2 3.48Å
189D86.7Confident71.7Confident119 Ų11982.3 Ų82.364%0.63641%0.405SS*.Hα-helixtrans-61.2-39.6166.4-93.6-24.9000111.9L185 E192 Q193L185-D189 PolarHBondContact O-N 3.14Å; D189-E192 PolarHBondContact O-N 3.04Å; D189-Q193 WeakPolarHBondContact O-CB 3.15Å; D189-Q193 PolarHBondContact O-N 2.64Å
190K84.9Confident73.9Confident67 Ų6777.5 Ų77.529%0.29139%0.393SS..Hα-helixtrans-68-35.8173.6-78.7165.9175.9158.80112.4D186 V187 D188 Q193 L194 Q255D186-K190 VanDerWaalsContact O-CB 3.29Å; D186-K190 WeakPolarHBondContact O-CB 3.38Å; D186-K190 WeakPolarHBondContact O-CD 3.2Å; D186-K190 VanDerWaalsContact O-CG 3.23Å; D186-K190 WeakPolarHBondContact O-CG 3.27Å; D186-K190 PolarHBondContact O-N 3.27Å; D186-K190 WeakPolarHBondContact OD1-CE 3.16Å; D186-K190 IonicContact OD1-NZ 2.72Å; D186-K190 PolarHBondContact OD1-NZ 3.23Å; D186-K190 WeakPolarHBondContact OD2-CE 3.32Å; D186-K190 IonicContact OD2-NZ 2.64Å; D186-K190 PolarHBondContact OD2-NZ 3.3Å; V187-K190 WeakPolarHBondContact O-CB 3.46Å; V187-K190 PolarHBondContact O-N 3.37Å; D188-K190 VanDerWaalsContact C-N 3.33Å; D188-K190 PolarHBondContact O-N 3.45Å; K190-Q193 PolarHBondContact O-N 3.33Å; K190-L194 WeakPolarHBondContact O-CB 3.18Å; K190-L194 VanDerWaalsContact O-CG 3.29Å; K190-L194 WeakPolarHBondContact O-CG 3.5Å; K190-L194 PolarHBondContact O-N 2.9Å; K190-Q255 HydrophobicContact CB-CG 3.9Å; K190-Q255 HydrophobicContact CD-CG 4.25Å
191V88Confident76.4Confident2 Ų280.7 Ų80.71%0.01240%0.403CS..Hα-helixtrans-65.2-43.9172.7169.40000111.2V187 D188 Q193 L194 M195 R248 R252V187-V191 WeakPolarHBondContact O-CG2 3.42Å; V187-V191 PolarHBondContact O-N 3.19Å; D188-V191 PolarHBondContact O-N 3.04Å; V191-Q193 VanDerWaalsContact C-N 3.3Å; V191-Q193 PolarHBondContact O-N 3.46Å; V191-L194 CarbonylContact O-C 3.6Å; V191-L194 WeakPolarHBondContact O-CB 3.37Å; V191-L194 PolarHBondContact O-N 3.44Å; V191-M195 WeakPolarHBondContact O-CG 3.34Å; V191-M195 PolarHBondContact O-N 2.99Å; V191-R248 HydrophobicContact CG1-CB 4.17Å; V191-R248 HydrophobicContact CG1-CG 3.95Å; V191-R252 VanDerWaalsContact CG2-CA 3.47Å; V191-R252 HydrophobicContact CG2-CB 3.9Å; V191-R252 HydrophobicContact CG2-CG 4.19Å
192E88.3Confident78.7Confident55 Ų5578 Ų7826%0.25738%0.384SS..Hα-helixtrans-61.2-39.3173.8-175.378.5173.500111D188 D189 M195 R196 R248D188-E192 WeakPolarHBondContact O-CB 3.07Å; D188-E192 PolarHBondContact O-N 3.34Å; D189-E192 PolarHBondContact O-N 3.04Å; E192-M195 WeakPolarHBondContact O-CB 2.95Å; E192-M195 PolarHBondContact O-N 3.09Å; E192-R196 PolarHBondContact O-N 2.91Å; E192-R196 IonicContact OE1-CZ 3.76Å; E192-R196 IonicContact OE1-NH1 2.84Å; E192-R196 IonicContact OE1-NH2 3.28Å; E192-R196 PolarHBondContact OE1-NH2 3.25Å; E192-R248 IonicContact OE2-CZ 2.7Å; E192-R248 IonicContact OE2-NE 2.88Å; E192-R248 IonicContact OE2-NH2 2.75Å; E192-R248 PolarHBondContact OE2-NH2 3.23Å
193Q88.6Confident81Confident99 Ų9971 Ų7146%0.46335%0.351SS..Hα-helixtrans-68-35.3173.5-157.9-168.362.900112.8D189 K190 V191 M195 R196 R197D189-Q193 WeakPolarHBondContact O-CB 3.15Å; D189-Q193 PolarHBondContact O-N 2.64Å; K190-Q193 PolarHBondContact O-N 3.33Å; V191-Q193 VanDerWaalsContact C-N 3.3Å; V191-Q193 PolarHBondContact O-N 3.46Å; Q193-M195 VanDerWaalsContact C-N 3.34Å; Q193-R196 PolarHBondContact O-N 3.42Å; Q193-R197 WeakPolarHBondContact O-CG 3.32Å; Q193-R197 PolarHBondContact O-N 2.91Å
194L88.3Confident82.9Confident5 Ų569.7 Ų69.73%0.02635%0.345CS..Hα-helixtrans-69.5-30.6171.9-72.8167.4000112.2K190 V191 R196 R197 I202 Y251 Y254K190-L194 WeakPolarHBondContact O-CB 3.18Å; K190-L194 VanDerWaalsContact O-CG 3.29Å; K190-L194 WeakPolarHBondContact O-CG 3.5Å; K190-L194 PolarHBondContact O-N 2.9Å; V191-L194 CarbonylContact O-C 3.6Å; V191-L194 WeakPolarHBondContact O-CB 3.37Å; V191-L194 PolarHBondContact O-N 3.44Å; L194-R196 VanDerWaalsContact C-N 3.33Å; L194-R197 PolarHBondContact O-N 3.28Å; L194-I202 HydrophobicContact CD2-CD1 3.58Å; L194-I202 HydrophobicContact CD2-CG1 4.22Å; L194-I202 HydrophobicContact CD2-CG2 4.3Å; L194-Y251 HydrophobicContact CB-CD2 3.58Å; L194-Y251 HydrophobicContact CB-CE2 4Å; L194-Y251 HydrophobicContact CB-CG 4.13Å; L194-Y251 HydrophobicContact CD1-CG 4.4Å; L194-Y251 WeakPolarHBondContact O-CE2 3.49Å; L194-Y254 HydrophobicContact CD1-CD1 4.15Å
195M87.4Confident84.9Confident43 Ų4369.4 Ų69.421%0.21234%0.344CS..Hα-helixtrans-69.2-27.5173.1-76-64.8-58.200113.2V191 E192 Q193 E244 K247 R248 Y251V191-M195 WeakPolarHBondContact O-CG 3.34Å; V191-M195 PolarHBondContact O-N 2.99Å; E192-M195 WeakPolarHBondContact O-CB 2.95Å; E192-M195 PolarHBondContact O-N 3.09Å; Q193-M195 VanDerWaalsContact C-N 3.34Å; M195-E244 HydrophobicContact CE-CG 3.7Å; M195-K247 HydrophobicContact CE-CB 4.43Å; M195-K247 HydrophobicContact CE-CD 4.11Å; M195-K247 HydrophobicContact SD-CB 3.52Å; M195-K247 VanDerWaalsContact SD-CB 3.52Å; M195-K247 HydrophobicContact SD-CD 3.92Å; M195-K247 HydrophobicContact SD-CG 4.4Å; M195-R248 HydrophobicContact CG-CG 4.08Å; M195-R248 HydrophobicContact SD-CG 4.2Å; M195-Y251 HydrophobicContact CG-CD2 4.13Å; M195-Y251 HydrophobicContact CG-CE2 4.29Å; M195-Y251 HydrophobicContact SD-CD2 3.95Å; M195-Y251 HydrophobicContact SD-CE2 3.77Å
196R89.6Confident86.6Confident186 Ų18664.1 Ų64.170%0.70232%0.316SS*.SBendtrans-86-11.1175.5-69.2-175.1179.3101.419.9114.9E192 Q193 L194E192-R196 PolarHBondContact O-N 2.91Å; E192-R196 IonicContact OE1-CZ 3.76Å; E192-R196 IonicContact OE1-NH1 2.84Å; E192-R196 IonicContact OE1-NH2 3.28Å; E192-R196 PolarHBondContact OE1-NH2 3.25Å; Q193-R196 PolarHBondContact O-N 3.42Å; L194-R196 VanDerWaalsContact C-N 3.33Å
197R87.8Confident87.4Confident116 Ų11665.2 Ų65.244%0.43832%0.318SS..SBendtrans-87.2158.3178.5-77.3-179.6-179.7102.3-5.3112.3Q193 L194 S199 I202Q193-R197 WeakPolarHBondContact O-CG 3.32Å; Q193-R197 PolarHBondContact O-N 2.91Å; L194-R197 PolarHBondContact O-N 3.28Å; R197-S199 PolarHBondContact O-N 3.35Å; R197-S199 VanDerWaalsContact O-N 3.14Å; R197-I202 HydrophobicContact CB-CD1 4.03Å; R197-I202 HydrophobicContact CB-CG1 3.93Å
198D85.2Confident88.1Confident113 Ų11368.1 Ų68.160%0.60434%0.336SS*.  trans-55.1116.9173.8-80.1-62.5000112.5A200 I201 I202D198-A200 PolarHBondContact O-N 2.93Å; D198-A200 VanDerWaalsContact O-N 3.07Å; D198-I201 HydrophobicContact CB-CB 4.37Å; D198-I201 HydrophobicContact CB-CD1 3.97Å; D198-I201 HydrophobicContact CB-CG1 3.92Å; D198-I201 PolarHBondContact O-N 2.7Å; D198-I202 PolarHBondContact O-N 3.15Å; D198-I202 VanDerWaalsContact O-N 3.15Å
199S85.8Confident88.5Confident42 Ų4266 Ų6629%0.29432%0.323SS..Hα-helixtrans-59.5-24.7-178.369.80000113.5R197 K203R197-S199 PolarHBondContact O-N 3.35Å; R197-S199 VanDerWaalsContact O-N 3.14Å; S199-K203 VanDerWaalsContact O-CB 3.32Å; S199-K203 WeakPolarHBondContact O-CB 3.43Å; S199-K203 WeakPolarHBondContact O-CD 3.39Å; S199-K203 WeakPolarHBondContact O-CG 3.37Å; S199-K203 PolarHBondContact O-N 3.02Å
200A86.2Confident88.7Confident64 Ų6461 Ų6153%0.52930%0.296SS..Hα-helixtrans-67.8-44.1174.300000112.4D198 K203 E204D198-A200 PolarHBondContact O-N 2.93Å; D198-A200 VanDerWaalsContact O-N 3.07Å; A200-K203 PolarHBondContact O-N 3.07Å; A200-E204 PolarHBondContact O-N 3.02Å
201I88.9Confident88.7Confident110 Ų11060.1 Ų60.156%0.56431%0.306SS*.Hα-helixtrans-64.8-47.5177.1-58.2-178.7000109.3D198 K203 E204 E205D198-I201 HydrophobicContact CB-CB 4.37Å; D198-I201 HydrophobicContact CB-CD1 3.97Å; D198-I201 HydrophobicContact CB-CG1 3.92Å; D198-I201 PolarHBondContact O-N 2.7Å; I201-K203 PolarHBondContact O-N 3.44Å; I201-E204 PolarHBondContact O-N 3.48Å; I201-E205 WeakPolarHBondContact O-CB 3.34Å; I201-E205 PolarHBondContact O-N 2.95Å
202I90.8Very high88.7Confident1 Ų166.2 Ų66.21%0.00534%0.339CS..Hα-helixtrans-65.2-36.4-179.5-57.6-48.6000112.2L194 R197 D198 I206 Y251L194-I202 HydrophobicContact CD2-CD1 3.58Å; L194-I202 HydrophobicContact CD2-CG1 4.22Å; L194-I202 HydrophobicContact CD2-CG2 4.3Å; R197-I202 HydrophobicContact CB-CD1 4.03Å; R197-I202 HydrophobicContact CB-CG1 3.93Å; D198-I202 PolarHBondContact O-N 3.15Å; D198-I202 VanDerWaalsContact O-N 3.15Å; I202-I206 HydrophobicContact CG2-CD1 3.64Å; I202-I206 HydrophobicContact CG2-CG1 4.29Å; I202-I206 WeakPolarHBondContact O-CB 3.5Å; I202-I206 WeakPolarHBondContact O-CD1 3.48Å; I202-I206 WeakPolarHBondContact O-CG1 3.26Å; I202-I206 PolarHBondContact O-N 3.44Å; I202-Y251 HydrophobicContact CG2-CD1 4.32Å; I202-Y251 HydrophobicContact CG2-CE1 3.63Å
203K90.5Very high88.3Confident21 Ų2168.3 Ų68.39%0.09134%0.344CS..Hα-helixtrans-58.9-49.6171.7-83.6165.4177.3173.70112.1S199 A200 I201 I206 K207 W234 S240S199-K203 VanDerWaalsContact O-CB 3.32Å; S199-K203 WeakPolarHBondContact O-CB 3.43Å; S199-K203 WeakPolarHBondContact O-CD 3.39Å; S199-K203 WeakPolarHBondContact O-CG 3.37Å; S199-K203 PolarHBondContact O-N 3.02Å; A200-K203 PolarHBondContact O-N 3.07Å; I201-K203 PolarHBondContact O-N 3.44Å; K203-I206 PolarHBondContact O-N 3.39Å; K203-K207 WeakPolarHBondContact O-CB 3.14Å; K203-K207 PolarHBondContact O-N 2.96Å; K203-W234 HydrophobicContact CD-CZ2 4.34Å; K203-W234 WeakPolarHBondContact CE-O 3.32Å; K203-W234 HydrophobicContact CG-CD2 4.21Å; K203-W234 HydrophobicContact CG-CE3 4.27Å; K203-W234 HydrophobicContact CG-CH2 3.61Å; K203-W234 HydrophobicContact CG-CZ2 3.57Å; K203-W234 HydrophobicContact CG-CZ3 3.96Å; K203-S240 PolarHBondContact NZ-O 3.4Å
204E90.5Very high88.1Confident85 Ų8574.7 Ų74.740%0.39736%0.364SS..Hα-helixtrans-69.8-38.7-177-162.458.2-134.300111.3A200 I201 I206 K207 V208A200-E204 PolarHBondContact O-N 3.02Å; I201-E204 PolarHBondContact O-N 3.48Å; E204-I206 PolarHBondContact O-N 3.34Å; E204-K207 PolarHBondContact O-N 3.17Å; E204-K207 IonicContact OE1-NZ 2.69Å; E204-K207 PolarHBondContact OE1-NZ 3.42Å; E204-K207 IonicContact OE2-NZ 3.77Å; E204-K207 PolarHBondContact OE2-NZ 3.01Å; E204-V208 WeakPolarHBondContact O-CG2 3.12Å; E204-V208 PolarHBondContact O-N 3.32Å
205E91.9Very high87.9Confident85 Ų8575.8 Ų75.840%0.39737%0.37SS..Hα-helixtrans-60.3-44.5174-158.2-162.6172.700111.9I201 F209 Y254 K258I201-E205 WeakPolarHBondContact O-CB 3.34Å; I201-E205 PolarHBondContact O-N 2.95Å; E205-F209 VanDerWaalsContact O-CB 3.29Å; E205-F209 WeakPolarHBondContact O-CB 3.27Å; E205-F209 PolarHBondContact O-N 2.91Å; E205-Y254 VanDerWaalsContact CG-OH 3.27Å; E205-Y254 WeakPolarHBondContact CG-OH 3.36Å; E205-Y254 PolarHBondContact OE1-OH 2.66Å; E205-Y254 PolarHBondContact OE2-OH 2.91Å; E205-K258 VanDerWaalsContact CD-NZ 3.34Å; E205-K258 IonicContact OE1-NZ 3.45Å; E205-K258 PolarHBondContact OE1-NZ 2.89Å; E205-K258 IonicContact OE2-NZ 2.69Å; E205-K258 PolarHBondContact OE2-NZ 3.11Å
206I90.4Very high87.8Confident0 Ų076.9 Ų76.90%038%0.381CS..Hα-helixtrans-70.5-38.3176.4-60.9166.9000111.1I202 K203 E204 F209 L210 W234 F250 Y251 Y254I202-I206 HydrophobicContact CG2-CD1 3.64Å; I202-I206 HydrophobicContact CG2-CG1 4.29Å; I202-I206 WeakPolarHBondContact O-CB 3.5Å; I202-I206 WeakPolarHBondContact O-CD1 3.48Å; I202-I206 WeakPolarHBondContact O-CG1 3.26Å; I202-I206 PolarHBondContact O-N 3.44Å; K203-I206 PolarHBondContact O-N 3.39Å; E204-I206 PolarHBondContact O-N 3.34Å; I206-F209 PolarHBondContact O-N 3.34Å; I206-L210 HydrophobicContact CG2-CD1 4.08Å; I206-L210 HydrophobicContact CG2-CG 4.13Å; I206-L210 WeakPolarHBondContact O-CB 3.39Å; I206-L210 VanDerWaalsContact O-CG 3.26Å; I206-L210 WeakPolarHBondContact O-CG 3.46Å; I206-L210 PolarHBondContact O-N 3.03Å; I206-W234 HydrophobicContact CD1-CH2 4.39Å; I206-F250 HydrophobicContact CB-CE1 4.48Å; I206-F250 HydrophobicContact CD1-CD1 4.01Å; I206-F250 HydrophobicContact CD1-CE1 3.76Å; I206-F250 HydrophobicContact CG2-CE1 3.72Å; I206-F250 HydrophobicContact CG2-CZ 4.06Å; I206-Y251 HydrophobicContact CD1-CD1 4.13Å; I206-Y251 HydrophobicContact CD1-CE1 4.09Å; I206-Y254 HydrophobicContact CB-CE2 4.27Å; I206-Y254 HydrophobicContact CD1-CD1 3.88Å; I206-Y254 HydrophobicContact CD1-CD2 4.48Å; I206-Y254 HydrophobicContact CD1-CE1 4.11Å; I206-Y254 HydrophobicContact CD1-CG 4.05Å; I206-Y254 HydrophobicContact CG1-CD1 3.73Å; I206-Y254 HydrophobicContact CG1-CD2 3.77Å; I206-Y254 HydrophobicContact CG1-CE1 3.56Å; I206-Y254 HydrophobicContact CG1-CE2 3.6Å; I206-Y254 HydrophobicContact CG1-CG 3.79Å; I206-Y254 VanDerWaalsContact CG1-CZ 3.45Å; I206-Y254 HydrophobicContact CG2-CD2 4.29Å; I206-Y254 HydrophobicContact CG2-CE2 4.43Å
207K89.4Confident87.8Confident82 Ų8269.9 Ų69.936%0.35736%0.357SS..Hα-helixtrans-60-45.3176.9173.1165.5160.9-97.50111.6K203 E204 G211 L235K203-K207 WeakPolarHBondContact O-CB 3.14Å; K203-K207 PolarHBondContact O-N 2.96Å; E204-K207 PolarHBondContact O-N 3.17Å; E204-K207 IonicContact OE1-NZ 2.69Å; E204-K207 PolarHBondContact OE1-NZ 3.42Å; E204-K207 IonicContact OE2-NZ 3.77Å; E204-K207 PolarHBondContact OE2-NZ 3.01Å; K207-G211 PolarHBondContact O-N 3.48Å; K207-L235 HydrophobicContact CB-CD2 4.39Å
208V89.9Confident87.6Confident68 Ų6866.4 Ų66.441%0.41235%0.353SS..Hα-helixtrans-65.9-44172.91730000111.3E204 L210 G211 N212E204-V208 WeakPolarHBondContact O-CG2 3.12Å; E204-V208 PolarHBondContact O-N 3.32Å; V208-L210 PolarHBondContact O-N 3.05Å; V208-G211 PolarHBondContact O-N 2.86Å; V208-N212 WeakPolarHBondContact O-CB 3.42Å; V208-N212 VanDerWaalsContact O-CG 3.27Å; V208-N212 PolarHBondContact O-N 3.18Å; V208-N212 PolarHBondContact O-OD1 2.87Å
209F90.4Very high87.7Confident24 Ų2463 Ų6311%0.10534%0.336CS..Hα-helixtrans-58.2-44.7177.2177.2-95.3000113.1E205 I206 N212 R213 I215 W253 Y254 E257 K258E205-F209 VanDerWaalsContact O-CB 3.29Å; E205-F209 WeakPolarHBondContact O-CB 3.27Å; E205-F209 PolarHBondContact O-N 2.91Å; I206-F209 PolarHBondContact O-N 3.34Å; F209-N212 PolarHBondContact O-N 3.19Å; F209-R213 PolarHBondContact O-N 3.41Å; F209-I215 HydrophobicContact CE1-CD1 4.06Å; F209-W253 HydrophobicContact CE1-CH2 4.17Å; F209-Y254 HydrophobicContact CB-CE2 3.93Å; F209-Y254 AromaticContact CD1-CD2 3.89Å; F209-Y254 HydrophobicContact CD1-CD2 3.89Å; F209-Y254 AromaticContact CD1-CE2 3.72Å; F209-Y254 HydrophobicContact CD1-CE2 3.72Å; F209-Y254 HydrophobicContact CD2-CE2 4.05Å; F209-Y254 AromaticContact CE1-CD2 3.98Å; F209-Y254 HydrophobicContact CE1-CD2 3.98Å; F209-Y254 HydrophobicContact CE1-CE2 4.15Å; F209-Y254 HydrophobicContact CE2-CE2 4.44Å; F209-Y254 HydrophobicContact CG-CD2 4.3Å; F209-Y254 AromaticContact CG-CE2 3.66Å; F209-Y254 HydrophobicContact CG-CE2 3.66Å; F209-Y254 HydrophobicContact CZ-CD2 4.46Å; F209-Y254 HydrophobicContact CZ-CE2 4.48Å; F209-E257 HydrophobicContact CE1-CB 4.27Å; F209-E257 HydrophobicContact CE1-CG 3.96Å; F209-E257 HydrophobicContact CZ-CB 4.16Å; F209-E257 HydrophobicContact CZ-CG 3.94Å; F209-K258 HydrophobicContact CD2-CG 4.34Å; F209-K258 HydrophobicContact CE2-CG 3.74Å; F209-K258 HydrophobicContact CZ-CG 4.17Å
210L89.4Confident87.8Confident13 Ų1361 Ų617%0.06832%0.322CS..Hα-helixtrans-61.7-42.4175.6-70.4173.4000111.8I206 V208 R214 I215 V220 L235 W253I206-L210 HydrophobicContact CG2-CD1 4.08Å; I206-L210 HydrophobicContact CG2-CG 4.13Å; I206-L210 WeakPolarHBondContact O-CB 3.39Å; I206-L210 VanDerWaalsContact O-CG 3.26Å; I206-L210 WeakPolarHBondContact O-CG 3.46Å; I206-L210 PolarHBondContact O-N 3.03Å; V208-L210 PolarHBondContact O-N 3.05Å; L210-R214 CarbonylContact O-C 3.59Å; L210-R214 WeakPolarHBondContact O-CA 3.27Å; L210-R214 PolarHBondContact O-N 3.46Å; L210-I215 HydrophobicContact CD2-CB 3.77Å; L210-I215 HydrophobicContact CD2-CG2 3.73Å; L210-I215 PolarHBondContact O-N 2.9Å; L210-V220 HydrophobicContact CD2-CG2 3.75Å; L210-L235 HydrophobicContact CD1-CD1 3.64Å; L210-W253 HydrophobicContact CD2-CH2 3.64Å; L210-W253 HydrophobicContact CD2-CZ3 4.29Å
211G84.7Confident87.9Confident48 Ų4858.8 Ų58.850%0.49530%0.304SS..Hα-helixtrans-62.3-53.9175.100000112.3K207 V208 R213 R214K207-G211 PolarHBondContact O-N 3.48Å; V208-G211 PolarHBondContact O-N 2.86Å; G211-R213 PolarHBondContact O-N 2.97Å; G211-R214 PolarHBondContact O-N 2.84Å
212N89Confident87.6Confident131 Ų13158.7 Ų58.770%0.70130%0.301SS*.Hα-helixtrans-62.5-41.5-175.3-69.36.2000112.3V208 F209 R214V208-N212 WeakPolarHBondContact O-CB 3.42Å; V208-N212 VanDerWaalsContact O-CG 3.27Å; V208-N212 PolarHBondContact O-N 3.18Å; V208-N212 PolarHBondContact O-OD1 2.87Å; F209-N212 PolarHBondContact O-N 3.19Å; N212-R214 VanDerWaalsContact C-N 3.32Å
213R80.3Confident87.1Confident99 Ų9961.5 Ų61.537%0.37432%0.318SS..THydrogen-bonded Turntrans-86.83175.5-66.1-166.8176.5-1729.5114.1F209 G211 I215 E257 K258F209-R213 PolarHBondContact O-N 3.41Å; G211-R213 PolarHBondContact O-N 2.97Å; R213-I215 HydrophobicContact CB-CD1 3.79Å; R213-I215 HydrophobicContact CB-CG1 3.79Å; R213-I215 PolarHBondContact O-N 3.25Å; R213-E257 PolarHBondContact NH1-O 2.82Å; R213-K258 PolarHBondContact NH2-O 2.81Å
214R83.7Confident87Confident233 Ų23361.5 Ų61.588%0.87932%0.32SS*.THydrogen-bonded Turntrans53.629-177.2-56.8-174.5175.9-152.8-2.1114.2L210 G211 N212 S216L210-R214 CarbonylContact O-C 3.59Å; L210-R214 WeakPolarHBondContact O-CA 3.27Å; L210-R214 PolarHBondContact O-N 3.46Å; G211-R214 PolarHBondContact O-N 2.84Å; N212-R214 VanDerWaalsContact C-N 3.32Å; R214-S216 PolarHBondContact O-N 3.02Å
215I83.7Confident86.7Confident28 Ų2860.7 Ų60.714%0.14434%0.335CS..  trans-78.3114.6-178.3-60.8173.3000108.7F209 L210 R213 V219 V220 W253 E257F209-I215 HydrophobicContact CE1-CD1 4.06Å; L210-I215 HydrophobicContact CD2-CB 3.77Å; L210-I215 HydrophobicContact CD2-CG2 3.73Å; L210-I215 PolarHBondContact O-N 2.9Å; R213-I215 HydrophobicContact CB-CD1 3.79Å; R213-I215 HydrophobicContact CB-CG1 3.79Å; R213-I215 PolarHBondContact O-N 3.25Å; I215-V219 HydrophobicContact CG2-CB 4.48Å; I215-V220 HydrophobicContact CG2-CG2 3.76Å; I215-W253 HydrophobicContact CD1-CZ2 4.29Å; I215-W253 HydrophobicContact CG2-CH2 4.47Å; I215-W253 HydrophobicContact CG2-CZ2 4.21Å; I215-E257 HydrophobicContact CD1-CG 3.92Å
216S86.4Confident86.5Confident65 Ų6557 Ų5746%0.45532%0.317SS..  trans-68137.3174.4-177.40000111R214 A218 V219 V220R214-S216 PolarHBondContact O-N 3.02Å; S216-A218 PolarHBondContact O-N 3.26Å; S216-A218 PolarHBondContact OG-N 2.85Å; S216-V219 WeakPolarHBondContact O-CA 3.32Å; S216-V219 WeakPolarHBondContact O-CB 3.35Å; S216-V219 PolarHBondContact O-N 3.23Å; S216-V220 PolarHBondContact O-N 3.47Å
217Q88.3Confident86.6Confident40 Ų4060.2 Ų60.219%0.18734%0.34CS..Hα-helixtrans-51.7-26.9168.7-60.7168.7-1000112.8V219 V220 A221 Q228 I231 S232 L235Q217-V219 VanDerWaalsContact C-N 3.28Å; Q217-V219 PolarHBondContact O-N 3.17Å; Q217-V220 PolarHBondContact O-N 2.87Å; Q217-A221 VanDerWaalsContact O-CB 3.27Å; Q217-A221 WeakPolarHBondContact O-CB 3.48Å; Q217-A221 PolarHBondContact O-N 3Å; Q217-Q228 HydrophobicContact CB-CG 3.82Å; Q217-I231 HydrophobicContact CB-CG2 4.23Å; Q217-I231 HydrophobicContact CG-CG2 4.12Å; Q217-S232 PolarHBondContact OE1-OG 3.25Å; Q217-L235 HydrophobicContact CG-CD1 4.34Å
218A85.4Confident86.5Confident43 Ų4360.2 Ų60.236%0.35534%0.341SS..Hα-helixtrans-70.5-21.117600000113.5S216 Q222 Q228S216-A218 PolarHBondContact O-N 3.26Å; S216-A218 PolarHBondContact OG-N 2.85Å; A218-Q222 WeakPolarHBondContact O-CG 3.32Å; A218-Q222 PolarHBondContact O-NE2 3.23Å; A218-Q228 HydrophobicContact CB-CG 4.31Å
219V85.8Confident86.5Confident41 Ų4160.7 Ų60.725%0.24835%0.348CS..Hα-helixtrans-79-50.5170.4177.70000109.4I215 S216 Q217 A221 Q222 V223 L265I215-V219 HydrophobicContact CG2-CB 4.48Å; S216-V219 WeakPolarHBondContact O-CA 3.32Å; S216-V219 WeakPolarHBondContact O-CB 3.35Å; S216-V219 PolarHBondContact O-N 3.23Å; Q217-V219 VanDerWaalsContact C-N 3.28Å; Q217-V219 PolarHBondContact O-N 3.17Å; V219-A221 PolarHBondContact O-N 2.86Å; V219-Q222 WeakPolarHBondContact O-CB 3.41Å; V219-Q222 PolarHBondContact O-N 3.35Å; V219-V223 PolarHBondContact O-N 2.99Å; V219-L265 HydrophobicContact CG1-CD1 4.32Å; V219-L265 HydrophobicContact CG1-CD2 3.46Å; V219-L265 VanDerWaalsContact CG1-CD2 3.46Å; V219-L265 HydrophobicContact CG1-CG 4.33Å
220V87.8Confident86.6Confident0 Ų064.3 Ų64.30%036%0.361CS..Hα-helixtrans-56.9-38.8178.2-167.90000111.8L210 I215 S216 Q217 Q222 V223 T224 I231 F250 W253L210-V220 HydrophobicContact CD2-CG2 3.75Å; I215-V220 HydrophobicContact CG2-CG2 3.76Å; S216-V220 PolarHBondContact O-N 3.47Å; Q217-V220 PolarHBondContact O-N 2.87Å; V220-Q222 PolarHBondContact O-N 3.43Å; V220-V223 PolarHBondContact O-N 2.94Å; V220-T224 HydrophobicContact CG1-CG2 3.78Å; V220-T224 WeakPolarHBondContact O-CB 3.33Å; V220-T224 WeakPolarHBondContact O-CG2 3.18Å; V220-T224 PolarHBondContact O-N 3.48Å; V220-T224 PolarHBondContact O-OG1 3.16Å; V220-I231 HydrophobicContact CB-CD1 4.2Å; V220-I231 HydrophobicContact CG1-CD1 4.24Å; V220-F250 HydrophobicContact CB-CE2 4.46Å; V220-F250 HydrophobicContact CG1-CD2 3.81Å; V220-F250 HydrophobicContact CG1-CE2 3.42Å; V220-F250 VanDerWaalsContact CG1-CE2 3.42Å; V220-F250 HydrophobicContact CG1-CZ 4.32Å; V220-W253 HydrophobicContact CG1-CD2 3.71Å; V220-W253 HydrophobicContact CG1-CE3 3.47Å; V220-W253 VanDerWaalsContact CG1-CE3 3.47Å; V220-W253 HydrophobicContact CG1-CG 4.47Å; V220-W253 HydrophobicContact CG1-CH2 4.12Å; V220-W253 HydrophobicContact CG1-CZ2 4.3Å; V220-W253 HydrophobicContact CG1-CZ3 3.69Å; V220-W253 HydrophobicContact CG2-CE3 4.49Å; V220-W253 HydrophobicContact CG2-CH2 3.61Å; V220-W253 HydrophobicContact CG2-CZ2 3.74Å; V220-W253 HydrophobicContact CG2-CZ3 4Å
221A89.3Confident86.7Confident17 Ų1763.7 Ų63.714%0.1436%0.357CS..Hα-helixtrans-60.2-28.8174.700000114.5Q217 V219 G225 I226 Q228 I231Q217-A221 VanDerWaalsContact O-CB 3.27Å; Q217-A221 WeakPolarHBondContact O-CB 3.48Å; Q217-A221 PolarHBondContact O-N 3Å; V219-A221 PolarHBondContact O-N 2.86Å; A221-G225 PolarHBondContact O-N 3.48Å; A221-I226 WeakPolarHBondContact CA-O 3.07Å; A221-I226 WeakPolarHBondContact CB-O 3.32Å; A221-Q228 HydrophobicContact CB-CB 3.81Å; A221-I231 HydrophobicContact CB-CD1 3.92Å
222Q81.9Confident87.1Confident108 Ų10862.8 Ų62.851%0.50534%0.343SS..Hα-helixtrans-79.9-33.4177.9-69.3169.165.500112.3A218 V219 V220A218-Q222 WeakPolarHBondContact O-CG 3.32Å; A218-Q222 PolarHBondContact O-NE2 3.23Å; V219-Q222 WeakPolarHBondContact O-CB 3.41Å; V219-Q222 PolarHBondContact O-N 3.35Å; V220-Q222 PolarHBondContact O-N 3.43Å
223V81.4Confident87.1Confident61 Ų6160.5 Ų60.537%0.3733%0.328SS..Hα-helixtrans-84-42.6-178.5-174.20000111.1V219 V220 T264V219-V223 PolarHBondContact O-N 2.99Å; V220-V223 PolarHBondContact O-N 2.94Å; V223-T264 HydrophobicContact CG1-CG2 4.15Å; V223-T264 WeakPolarHBondContact CG2-O 3.46Å
224T87.1Confident87.7Confident20 Ų2055.9 Ų55.912%0.12331%0.311CS..Hα-helixtrans-86-11.5-177.2620000114.4V220 I226 F250 W253V220-T224 HydrophobicContact CG1-CG2 3.78Å; V220-T224 WeakPolarHBondContact O-CB 3.33Å; V220-T224 WeakPolarHBondContact O-CG2 3.18Å; V220-T224 PolarHBondContact O-N 3.48Å; V220-T224 PolarHBondContact O-OG1 3.16Å; T224-I226 PolarHBondContact O-N 3.46Å; T224-I226 VanDerWaalsContact O-N 3.15Å; T224-I226 PolarHBondContact OG1-N 2.69Å; T224-F250 HydrophobicContact CG2-CD2 4.14Å; T224-W253 HydrophobicContact CG2-CB 3.6Å; T224-W253 HydrophobicContact CG2-CD2 4.38Å; T224-W253 HydrophobicContact CG2-CG 3.9Å
225G84.3Confident87.9Confident69 Ų6945.5 Ų45.571%0.71127%0.272SS*.  trans69.10.3-17300000115.2A221A221-G225 PolarHBondContact O-N 3.48Å
226I88.1Confident88.1Confident6 Ų649.6 Ų49.63%0.03129%0.294CS..  trans-81.8135.1179-54165.9000108.9A221 T224 Q228 R230 I231 L242 K246 F250A221-I226 WeakPolarHBondContact CA-O 3.07Å; A221-I226 WeakPolarHBondContact CB-O 3.32Å; T224-I226 PolarHBondContact O-N 3.46Å; T224-I226 VanDerWaalsContact O-N 3.15Å; T224-I226 PolarHBondContact OG1-N 2.69Å; I226-Q228 PolarHBondContact O-N 2.72Å; I226-R230 HydrophobicContact CG2-CB 4.36Å; I226-I231 HydrophobicContact CB-CD1 4.15Å; I226-I231 HydrophobicContact CB-CG1 4.01Å; I226-I231 HydrophobicContact CG2-CD1 4.37Å; I226-I231 HydrophobicContact CG2-CG1 3.69Å; I226-L242 HydrophobicContact CD1-CD1 4.45Å; I226-L242 HydrophobicContact CG2-CD2 4.08Å; I226-K246 HydrophobicContact CD1-CB 3.84Å; I226-K246 HydrophobicContact CD1-CG 4.43Å; I226-K246 WeakPolarHBondContact CD1-O 3.37Å; I226-K246 HydrophobicContact CG1-CB 4.07Å; I226-K246 HydrophobicContact CG1-CD 4.43Å; I226-K246 HydrophobicContact CG1-CG 4.11Å; I226-F250 HydrophobicContact CD1-CB 3.84Å; I226-F250 HydrophobicContact CD1-CD2 3.99Å; I226-F250 HydrophobicContact CD1-CG 4.35Å
227S91.6Very high88.1Confident68 Ų6852 Ų5248%0.47630%0.298SS..  trans-62.5134.8179.557.90000111.7S229 R230 I231S227-S229 PolarHBondContact O-N 3.08Å; S227-S229 VanDerWaalsContact O-N 3.16Å; S227-R230 WeakPolarHBondContact O-CA 3.36Å; S227-R230 PolarHBondContact O-N 3.48Å; S227-R230 WeakPolarHBondContact OG-CB 3.36Å; S227-I231 PolarHBondContact O-N 2.77Å
228Q88Confident87.5Confident83 Ų8357.8 Ų57.839%0.38833%0.325SS..Hα-helixtrans-55.2-37-178.3176.5-83.6-35.100112.5Q217 A218 A221 I226 R230 I231 S232Q217-Q228 HydrophobicContact CB-CG 3.82Å; A218-Q228 HydrophobicContact CB-CG 4.31Å; A221-Q228 HydrophobicContact CB-CB 3.81Å; I226-Q228 PolarHBondContact O-N 2.72Å; Q228-R230 VanDerWaalsContact C-N 3.34Å; Q228-R230 PolarHBondContact O-N 2.8Å; Q228-I231 PolarHBondContact O-N 3.34Å; Q228-S232 WeakPolarHBondContact O-CB 3.47Å; Q228-S232 PolarHBondContact O-N 3.3Å
229S91Very high87Confident78 Ų7859.3 Ų59.355%0.54535%0.346SS..Hα-helixtrans-64.3-34.9174.752.90000113S227 H233S227-S229 PolarHBondContact O-N 3.08Å; S227-S229 VanDerWaalsContact O-N 3.16Å; S229-H233 VanDerWaalsContact O-CB 3.32Å; S229-H233 WeakPolarHBondContact O-CB 3.38Å; S229-H233 PolarHBondContact O-N 3.05Å
230R91.4Very high86.9Confident100 Ų10058.1 Ų58.138%0.37734%0.339SS..Hα-helixtrans-75.3-35.7175-173.556.3174.6-153.9-0.2112.2I226 S227 Q228 W234 D241 L242I226-R230 HydrophobicContact CG2-CB 4.36Å; S227-R230 WeakPolarHBondContact O-CA 3.36Å; S227-R230 PolarHBondContact O-N 3.48Å; S227-R230 WeakPolarHBondContact OG-CB 3.36Å; Q228-R230 VanDerWaalsContact C-N 3.34Å; Q228-R230 PolarHBondContact O-N 2.8Å; R230-W234 VanDerWaalsContact O-CB 3.27Å; R230-W234 WeakPolarHBondContact O-CB 3.28Å; R230-W234 PolarHBondContact O-N 2.93Å; R230-D241 PolarHBondContact NH2-O 3.41Å; R230-L242 HydrophobicContact CG-CD2 3.81Å
231I92Very high86.7Confident0 Ų061 Ų610%035%0.354CS..Hα-helixtrans-60.4-48.8170-61.1172.3000109.6Q217 V220 A221 I226 S227 Q228 H233 W234 L235 F250Q217-I231 HydrophobicContact CB-CG2 4.23Å; Q217-I231 HydrophobicContact CG-CG2 4.12Å; V220-I231 HydrophobicContact CB-CD1 4.2Å; V220-I231 HydrophobicContact CG1-CD1 4.24Å; A221-I231 HydrophobicContact CB-CD1 3.92Å; I226-I231 HydrophobicContact CB-CD1 4.15Å; I226-I231 HydrophobicContact CB-CG1 4.01Å; I226-I231 HydrophobicContact CG2-CD1 4.37Å; I226-I231 HydrophobicContact CG2-CG1 3.69Å; S227-I231 PolarHBondContact O-N 2.77Å; Q228-I231 PolarHBondContact O-N 3.34Å; I231-H233 PolarHBondContact O-N 3.45Å; I231-W234 PolarHBondContact O-N 3.06Å; I231-L235 HydrophobicContact CG2-CD1 3.78Å; I231-L235 HydrophobicContact CG2-CG 4.39Å; I231-L235 WeakPolarHBondContact O-CG 3.33Å; I231-L235 PolarHBondContact O-N 3.07Å; I231-F250 HydrophobicContact CD1-CE2 4.08Å; I231-F250 HydrophobicContact CG1-CE2 4.1Å; I231-F250 HydrophobicContact CG2-CE2 3.76Å; I231-F250 HydrophobicContact CG2-CZ 4Å
232S92.3Very high86.6Confident28 Ų2860.5 Ų60.520%0.19635%0.349CS..Hα-helixtrans-60.5-45.8178.8-162.40000112.3Q217 Q228 W234 L235 L236Q217-S232 PolarHBondContact OE1-OG 3.25Å; Q228-S232 WeakPolarHBondContact O-CB 3.47Å; Q228-S232 PolarHBondContact O-N 3.3Å; S232-W234 VanDerWaalsContact C-N 3.34Å; S232-W234 PolarHBondContact O-N 2.84Å; S232-L235 PolarHBondContact O-N 3.46Å; S232-L236 WeakPolarHBondContact O-CB 3.49Å; S232-L236 WeakPolarHBondContact O-CG 3.34Å; S232-L236 PolarHBondContact O-N 2.96Å
233H90.1Very high86.9Confident84 Ų8458.2 Ų58.239%0.38935%0.345SS..Hα-helixtrans-60.4-44176-173.6-59.8000111.3S229 I231 L235 L236 Q237 S240S229-H233 VanDerWaalsContact O-CB 3.32Å; S229-H233 WeakPolarHBondContact O-CB 3.38Å; S229-H233 PolarHBondContact O-N 3.05Å; I231-H233 PolarHBondContact O-N 3.45Å; H233-L235 PolarHBondContact O-N 2.79Å; H233-L236 PolarHBondContact O-N 2.68Å; H233-Q237 WeakPolarHBondContact O-CA 3.41Å; H233-Q237 WeakPolarHBondContact O-CB 3.28Å; H233-Q237 PolarHBondContact O-N 2.63Å; H233-S240 WeakPolarHBondContact CE1-CB 3.37Å; H233-S240 WeakPolarHBondContact ND1-CB 3.42Å; H233-S240 PolarHBondContact ND1-OG 2.96Å; H233-S240 VanDerWaalsContact ND1-OG 3.08Å; H233-S240 PolarHBondContact O-OG 3.35Å; H233-S240 VanDerWaalsContact O-OG 3.06Å
234W91.4Very high87.2Confident1 Ų160.6 Ų60.60%0.00435%0.352CS..Hα-helixtrans-67.1-33.7-179-178.872.8000114K203 I206 R230 I231 S232 D241 L242 F250 Y251K203-W234 HydrophobicContact CD-CZ2 4.34Å; K203-W234 WeakPolarHBondContact CE-O 3.32Å; K203-W234 HydrophobicContact CG-CD2 4.21Å; K203-W234 HydrophobicContact CG-CE3 4.27Å; K203-W234 HydrophobicContact CG-CH2 3.61Å; K203-W234 HydrophobicContact CG-CZ2 3.57Å; K203-W234 HydrophobicContact CG-CZ3 3.96Å; I206-W234 HydrophobicContact CD1-CH2 4.39Å; R230-W234 VanDerWaalsContact O-CB 3.27Å; R230-W234 WeakPolarHBondContact O-CB 3.28Å; R230-W234 PolarHBondContact O-N 2.93Å; I231-W234 PolarHBondContact O-N 3.06Å; S232-W234 VanDerWaalsContact C-N 3.34Å; S232-W234 PolarHBondContact O-N 2.84Å; W234-D241 VanDerWaalsContact CD1-C 3.48Å; W234-D241 VanDerWaalsContact CD1-CA 3.46Å; W234-D241 PolarHBondContact NE1-OD1 3.46Å; W234-L242 HydrophobicContact CB-CD1 4.48Å; W234-L242 HydrophobicContact CB-CG 4.13Å; W234-L242 VanDerWaalsContact CD1-N 3.29Å; W234-L242 HydrophobicContact CD2-CD1 3.62Å; W234-L242 HydrophobicContact CD2-CG 3.91Å; W234-L242 HydrophobicContact CE3-CD1 3.98Å; W234-L242 HydrophobicContact CG-CD1 3.87Å; W234-L242 HydrophobicContact CG-CG 3.63Å; W234-L242 HydrophobicContact CZ2-CD1 4.38Å; W234-F250 HydrophobicContact CE3-CE1 4.19Å; W234-F250 HydrophobicContact CH2-CD1 4.24Å; W234-F250 HydrophobicContact CH2-CE1 4.12Å; W234-F250 AromaticContact CZ3-CD1 3.91Å; W234-F250 HydrophobicContact CZ3-CD1 3.91Å; W234-F250 AromaticContact CZ3-CE1 3.43Å; W234-F250 HydrophobicContact CZ3-CE1 3.43Å; W234-F250 VanDerWaalsContact CZ3-CE1 3.43Å; W234-F250 HydrophobicContact CZ3-CZ 4.13Å; W234-Y251 HydrophobicContact CH2-CE1 4.07Å; W234-Y251 HydrophobicContact CZ2-CE1 4.39Å
235L89.6Confident87.1Confident15 Ų1567.5 Ų67.58%0.07938%0.383CS..Hα-helixtrans-81.5-24177.8-69.4172.8000114.1K207 L210 Q217 I231 S232 H233K207-L235 HydrophobicContact CB-CD2 4.39Å; L210-L235 HydrophobicContact CD1-CD1 3.64Å; Q217-L235 HydrophobicContact CG-CD1 4.34Å; I231-L235 HydrophobicContact CG2-CD1 3.78Å; I231-L235 HydrophobicContact CG2-CG 4.39Å; I231-L235 WeakPolarHBondContact O-CG 3.33Å; I231-L235 PolarHBondContact O-N 3.07Å; S232-L235 PolarHBondContact O-N 3.46Å; H233-L235 PolarHBondContact O-N 2.79Å
236L86.7Confident87.2Confident115 Ų11568.5 Ų68.560%0.60237%0.368SS*.Hα-helixtrans-111.8-34.7-172.9-60.8177.1000113.8S232 H233 Q238S232-L236 WeakPolarHBondContact O-CB 3.49Å; S232-L236 WeakPolarHBondContact O-CG 3.34Å; S232-L236 PolarHBondContact O-N 2.96Å; H233-L236 PolarHBondContact O-N 2.68Å; L236-Q238 PolarHBondContact O-N 3.29Å
237Q87.8Confident87.3Confident115 Ų11569.9 Ų69.954%0.53737%0.374SS..SBendtrans-88.3110.6-178.5-169.766.138.500110.3H233 S240H233-Q237 WeakPolarHBondContact O-CA 3.41Å; H233-Q237 WeakPolarHBondContact O-CB 3.28Å; H233-Q237 PolarHBondContact O-N 2.63Å; Q237-S240 WeakPolarHBondContact O-CB 3.48Å; Q237-S240 PolarHBondContact O-N 3.19Å; Q237-S240 PolarHBondContact O-OG 3.08Å
238Q74.6Confident87.2Confident161 Ų16171 Ų7175%0.75237%0.368SS*.THydrogen-bonded Turntrans-54.9145.2175-66-64.8200111.7L236 S240L236-Q238 PolarHBondContact O-N 3.29Å; Q238-S240 PolarHBondContact O-N 3.18Å
239G74.3Confident87.2Confident76 Ų7669 Ų6978%0.78437%0.366SS*.THydrogen-bonded Turntrans69.5-11.6-175.800000116.2
240S83.4Confident87.2Confident16 Ų1665.3 Ų65.311%0.11234%0.34CS..  trans-79.6143.7-179.279.60000112.7K203 H233 Q237 Q238K203-S240 PolarHBondContact NZ-O 3.4Å; H233-S240 WeakPolarHBondContact CE1-CB 3.37Å; H233-S240 WeakPolarHBondContact ND1-CB 3.42Å; H233-S240 PolarHBondContact ND1-OG 2.96Å; H233-S240 VanDerWaalsContact ND1-OG 3.08Å; H233-S240 PolarHBondContact O-OG 3.35Å; H233-S240 VanDerWaalsContact O-OG 3.06Å; Q237-S240 WeakPolarHBondContact O-CB 3.48Å; Q237-S240 PolarHBondContact O-N 3.19Å; Q237-S240 PolarHBondContact O-OG 3.08Å; Q238-S240 PolarHBondContact O-N 3.18Å
241D85.4Confident87.2Confident60 Ų6060.7 Ų60.732%0.32132%0.322SS..  trans-131.7158.1-174.8-15311.3000115.5R230 W234 K247R230-D241 PolarHBondContact NH2-O 3.41Å; W234-D241 VanDerWaalsContact CD1-C 3.48Å; W234-D241 VanDerWaalsContact CD1-CA 3.46Å; W234-D241 PolarHBondContact NE1-OD1 3.46Å; D241-K247 WeakPolarHBondContact OD1-CE 3.46Å; D241-K247 IonicContact OD1-NZ 3.64Å; D241-K247 PolarHBondContact OD1-NZ 2.68Å; D241-K247 WeakPolarHBondContact OD2-CE 3.48Å; D241-K247 IonicContact OD2-NZ 3.67Å; D241-K247 PolarHBondContact OD2-NZ 3.41Å
242L87Confident87.1Confident7 Ų764.7 Ų64.74%0.03734%0.337CS..  trans-91.2145.6171.1-78.9170.7000109.8I226 R230 W234 K246 K247I226-L242 HydrophobicContact CD1-CD1 4.45Å; I226-L242 HydrophobicContact CG2-CD2 4.08Å; R230-L242 HydrophobicContact CG-CD2 3.81Å; W234-L242 HydrophobicContact CB-CD1 4.48Å; W234-L242 HydrophobicContact CB-CG 4.13Å; W234-L242 VanDerWaalsContact CD1-N 3.29Å; W234-L242 HydrophobicContact CD2-CD1 3.62Å; W234-L242 HydrophobicContact CD2-CG 3.91Å; W234-L242 HydrophobicContact CE3-CD1 3.98Å; W234-L242 HydrophobicContact CG-CD1 3.87Å; W234-L242 HydrophobicContact CG-CG 3.63Å; W234-L242 HydrophobicContact CZ2-CD1 4.38Å; L242-K246 HydrophobicContact CB-CB 4.27Å; L242-K246 HydrophobicContact CD2-CB 4.11Å; L242-K246 HydrophobicContact CD2-CD 4.41Å; L242-K247 HydrophobicContact CB-CG 3.89Å; L242-K247 WeakPolarHBondContact O-CE 3.32Å
243S87.8Confident86.9Confident60 Ų6063.9 Ų63.942%0.4233%0.33SS..  trans-61145.7168.156.20000109.9Q245 K246 K247S243-Q245 VanDerWaalsContact C-N 3.34Å; S243-Q245 PolarHBondContact O-N 2.96Å; S243-K246 CarbonylContact O-C 3.56Å; S243-K246 WeakPolarHBondContact O-CA 3.33Å; S243-K246 WeakPolarHBondContact O-CB 3.29Å; S243-K246 PolarHBondContact O-N 2.92Å; S243-K246 WeakPolarHBondContact OG-CD 3.31Å; S243-K246 WeakPolarHBondContact OG-CG 3.32Å; S243-K247 PolarHBondContact O-N 3.26Å
244E86.9Confident86.9Confident111 Ų11160 Ų6052%0.51931%0.312SS..Hα-helixtrans-52.1-44.2-171.2175.6159.2-164.300114.7M195 K246 K247 R248M195-E244 HydrophobicContact CE-CG 3.7Å; E244-K246 PolarHBondContact O-N 3.38Å; E244-K247 WeakPolarHBondContact O-CA 3.4Å; E244-K247 WeakPolarHBondContact O-CB 3.37Å; E244-K247 PolarHBondContact O-N 3.03Å; E244-R248 PolarHBondContact O-N 2.86Å; E244-R248 IonicContact OE1-CZ 3.67Å; E244-R248 IonicContact OE1-NH1 3.82Å; E244-R248 PolarHBondContact OE1-NH1 2.95Å; E244-R248 IonicContact OE1-NH2 2.73Å
245Q84.7Confident86.7Confident164 Ų16461 Ų6177%0.76632%0.316SS*.Hα-helixtrans-55.7-35.6173.3-169.9-173.928.200113S243 A249S243-Q245 VanDerWaalsContact C-N 3.34Å; S243-Q245 PolarHBondContact O-N 2.96Å; Q245-A249 WeakPolarHBondContact O-CB 3.45Å; Q245-A249 PolarHBondContact O-N 3.41Å; Q245-A249 VanDerWaalsContact O-N 3.1Å
246K87.3Confident86.3Confident91 Ų9162.8 Ų62.840%0.39633%0.326SS..Hα-helixtrans-80.5-30.2177.4-64.6176.6-172.3153.60111.7I226 L242 S243 E244 F250I226-K246 HydrophobicContact CD1-CB 3.84Å; I226-K246 HydrophobicContact CD1-CG 4.43Å; I226-K246 WeakPolarHBondContact CD1-O 3.37Å; I226-K246 HydrophobicContact CG1-CB 4.07Å; I226-K246 HydrophobicContact CG1-CD 4.43Å; I226-K246 HydrophobicContact CG1-CG 4.11Å; L242-K246 HydrophobicContact CB-CB 4.27Å; L242-K246 HydrophobicContact CD2-CB 4.11Å; L242-K246 HydrophobicContact CD2-CD 4.41Å; S243-K246 CarbonylContact O-C 3.56Å; S243-K246 WeakPolarHBondContact O-CA 3.33Å; S243-K246 WeakPolarHBondContact O-CB 3.29Å; S243-K246 PolarHBondContact O-N 2.92Å; S243-K246 WeakPolarHBondContact OG-CD 3.31Å; S243-K246 WeakPolarHBondContact OG-CG 3.32Å; E244-K246 PolarHBondContact O-N 3.38Å; K246-F250 WeakPolarHBondContact O-CB 3.4Å; K246-F250 PolarHBondContact O-N 2.7Å
247K90.6Very high86.1Confident34 Ų3457.7 Ų57.715%0.14830%0.299CS..Hα-helixtrans-61.9-54.9167.6-67.5-177179.4174.90110.4M195 D241 L242 S243 E244 A249 F250 Y251M195-K247 HydrophobicContact CE-CB 4.43Å; M195-K247 HydrophobicContact CE-CD 4.11Å; M195-K247 HydrophobicContact SD-CB 3.52Å; M195-K247 VanDerWaalsContact SD-CB 3.52Å; M195-K247 HydrophobicContact SD-CD 3.92Å; M195-K247 HydrophobicContact SD-CG 4.4Å; D241-K247 WeakPolarHBondContact OD1-CE 3.46Å; D241-K247 IonicContact OD1-NZ 3.64Å; D241-K247 PolarHBondContact OD1-NZ 2.68Å; D241-K247 WeakPolarHBondContact OD2-CE 3.48Å; D241-K247 IonicContact OD2-NZ 3.67Å; D241-K247 PolarHBondContact OD2-NZ 3.41Å; L242-K247 HydrophobicContact CB-CG 3.89Å; L242-K247 WeakPolarHBondContact O-CE 3.32Å; S243-K247 PolarHBondContact O-N 3.26Å; E244-K247 WeakPolarHBondContact O-CA 3.4Å; E244-K247 WeakPolarHBondContact O-CB 3.37Å; E244-K247 PolarHBondContact O-N 3.03Å; K247-A249 PolarHBondContact O-N 3.28Å; K247-F250 PolarHBondContact O-N 2.75Å; K247-F250 VanDerWaalsContact O-N 3.1Å; K247-Y251 HydrophobicContact CB-CD2 4.49Å; K247-Y251 HydrophobicContact CB-CE2 4.21Å; K247-Y251 WeakPolarHBondContact O-CB 3.5Å; K247-Y251 VanDerWaalsContact O-CG 3.23Å; K247-Y251 PolarHBondContact O-N 2.88Å
248R89.6Confident85.4Confident92 Ų9255.2 Ų55.235%0.34729%0.286SS..Hα-helixtrans-54.6-48177.9-77.3-163.8170.982.82.5111.9V191 E192 M195 E244 F250 Y251 R252V191-R248 HydrophobicContact CG1-CB 4.17Å; V191-R248 HydrophobicContact CG1-CG 3.95Å; E192-R248 IonicContact OE2-CZ 2.7Å; E192-R248 IonicContact OE2-NE 2.88Å; E192-R248 IonicContact OE2-NH2 2.75Å; E192-R248 PolarHBondContact OE2-NH2 3.23Å; M195-R248 HydrophobicContact CG-CG 4.08Å; M195-R248 HydrophobicContact SD-CG 4.2Å; E244-R248 PolarHBondContact O-N 2.86Å; E244-R248 IonicContact OE1-CZ 3.67Å; E244-R248 IonicContact OE1-NH1 3.82Å; E244-R248 PolarHBondContact OE1-NH1 2.95Å; E244-R248 IonicContact OE1-NH2 2.73Å; R248-F250 PolarHBondContact O-N 2.82Å; R248-Y251 PolarHBondContact O-N 3.15Å; R248-R252 WeakPolarHBondContact O-CB 3.46Å; R248-R252 PolarHBondContact O-N 2.96Å
249A88.2Confident85.1Confident42 Ų4250.5 Ų50.535%0.34727%0.269SS..Hα-helixtrans-60.7-40.2176.700000113.9Q245 K247 W253Q245-A249 WeakPolarHBondContact O-CB 3.45Å; Q245-A249 PolarHBondContact O-N 3.41Å; Q245-A249 VanDerWaalsContact O-N 3.1Å; K247-A249 PolarHBondContact O-N 3.28Å; A249-W253 PolarHBondContact O-N 2.69Å
250F90.7Very high84.7Confident0 Ų050 Ų500%025%0.251CS..Hα-helixtrans-73.6-36.6178.9-166-100.6000112.4I206 V220 T224 I226 I231 W234 K246 K247 R248 Y254I206-F250 HydrophobicContact CB-CE1 4.48Å; I206-F250 HydrophobicContact CD1-CD1 4.01Å; I206-F250 HydrophobicContact CD1-CE1 3.76Å; I206-F250 HydrophobicContact CG2-CE1 3.72Å; I206-F250 HydrophobicContact CG2-CZ 4.06Å; V220-F250 HydrophobicContact CB-CE2 4.46Å; V220-F250 HydrophobicContact CG1-CD2 3.81Å; V220-F250 HydrophobicContact CG1-CE2 3.42Å; V220-F250 VanDerWaalsContact CG1-CE2 3.42Å; V220-F250 HydrophobicContact CG1-CZ 4.32Å; T224-F250 HydrophobicContact CG2-CD2 4.14Å; I226-F250 HydrophobicContact CD1-CB 3.84Å; I226-F250 HydrophobicContact CD1-CD2 3.99Å; I226-F250 HydrophobicContact CD1-CG 4.35Å; I231-F250 HydrophobicContact CD1-CE2 4.08Å; I231-F250 HydrophobicContact CG1-CE2 4.1Å; I231-F250 HydrophobicContact CG2-CE2 3.76Å; I231-F250 HydrophobicContact CG2-CZ 4Å; W234-F250 HydrophobicContact CE3-CE1 4.19Å; W234-F250 HydrophobicContact CH2-CD1 4.24Å; W234-F250 HydrophobicContact CH2-CE1 4.12Å; W234-F250 AromaticContact CZ3-CD1 3.91Å; W234-F250 HydrophobicContact CZ3-CD1 3.91Å; W234-F250 AromaticContact CZ3-CE1 3.43Å; W234-F250 HydrophobicContact CZ3-CE1 3.43Å; W234-F250 VanDerWaalsContact CZ3-CE1 3.43Å; W234-F250 HydrophobicContact CZ3-CZ 4.13Å; K246-F250 WeakPolarHBondContact O-CB 3.4Å; K246-F250 PolarHBondContact O-N 2.7Å; K247-F250 PolarHBondContact O-N 2.75Å; K247-F250 VanDerWaalsContact O-N 3.1Å; R248-F250 PolarHBondContact O-N 2.82Å; F250-Y254 VanDerWaalsContact O-CB 3.29Å; F250-Y254 WeakPolarHBondContact O-CB 3.41Å; F250-Y254 PolarHBondContact O-N 3.03Å
251Y91.3Very high83.6Confident3 Ų353.5 Ų53.51%0.01227%0.273CS..Hα-helixtrans-73-38.6176.7-66.5-4.3000111.7L194 M195 I202 I206 W234 K247 R248 Y254 Q255L194-Y251 HydrophobicContact CB-CD2 3.58Å; L194-Y251 HydrophobicContact CB-CE2 4Å; L194-Y251 HydrophobicContact CB-CG 4.13Å; L194-Y251 HydrophobicContact CD1-CG 4.4Å; L194-Y251 WeakPolarHBondContact O-CE2 3.49Å; M195-Y251 HydrophobicContact CG-CD2 4.13Å; M195-Y251 HydrophobicContact CG-CE2 4.29Å; M195-Y251 HydrophobicContact SD-CD2 3.95Å; M195-Y251 HydrophobicContact SD-CE2 3.77Å; I202-Y251 HydrophobicContact CG2-CD1 4.32Å; I202-Y251 HydrophobicContact CG2-CE1 3.63Å; I206-Y251 HydrophobicContact CD1-CD1 4.13Å; I206-Y251 HydrophobicContact CD1-CE1 4.09Å; W234-Y251 HydrophobicContact CH2-CE1 4.07Å; W234-Y251 HydrophobicContact CZ2-CE1 4.39Å; K247-Y251 HydrophobicContact CB-CD2 4.49Å; K247-Y251 HydrophobicContact CB-CE2 4.21Å; K247-Y251 WeakPolarHBondContact O-CB 3.5Å; K247-Y251 VanDerWaalsContact O-CG 3.23Å; K247-Y251 PolarHBondContact O-N 2.88Å; R248-Y251 PolarHBondContact O-N 3.15Å; Y251-Y254 PolarHBondContact O-N 2.78Å; Y251-Q255 WeakPolarHBondContact O-CB 3.41Å; Y251-Q255 PolarHBondContact O-N 3.41Å
252R89Confident82.2Confident84 Ų8451.6 Ų51.632%0.31727%0.268SS..Hα-helixtrans-61.6-48.9173.6-153.9-176.4-154.7-114.76.4110.1E184 V187 D188 V191 R248 Y254 Q255 L256E184-R252 IonicContact OE1-CZ 2.68Å; E184-R252 IonicContact OE1-NH1 3.14Å; E184-R252 PolarHBondContact OE1-NH1 3.1Å; E184-R252 IonicContact OE1-NH2 3.93Å; E184-R252 PolarHBondContact OE1-NH2 2.91Å; V187-R252 HydrophobicContact CG1-CG 3.8Å; D188-R252 IonicContact OD1-CZ 2.73Å; D188-R252 IonicContact OD1-NE 2.7Å; D188-R252 PolarHBondContact OD1-NE 3.24Å; D188-R252 IonicContact OD1-NH2 3.4Å; D188-R252 IonicContact OD2-CZ 3.35Å; D188-R252 IonicContact OD2-NE 3.73Å; D188-R252 PolarHBondContact OD2-NE 2.89Å; D188-R252 IonicContact OD2-NH2 3.05Å; D188-R252 PolarHBondContact OD2-NH2 3.48Å; V191-R252 VanDerWaalsContact CG2-CA 3.47Å; V191-R252 HydrophobicContact CG2-CB 3.9Å; V191-R252 HydrophobicContact CG2-CG 4.19Å; R248-R252 WeakPolarHBondContact O-CB 3.46Å; R248-R252 PolarHBondContact O-N 2.96Å; R252-Y254 PolarHBondContact O-N 3.46Å; R252-Q255 PolarHBondContact O-N 3.47Å; R252-L256 HydrophobicContact CG-CD1 4.1Å; R252-L256 WeakPolarHBondContact O-CD1 3.48Å; R252-L256 PolarHBondContact O-N 3.16Å
253W88.8Confident80.6Confident10 Ų1052.6 Ų52.64%0.03828%0.277CS..Hα-helixtrans-55.2-49171.6166.472000112.1F209 L210 I215 V220 T224 A249 Q255 L256 E257F209-W253 HydrophobicContact CE1-CH2 4.17Å; L210-W253 HydrophobicContact CD2-CH2 3.64Å; L210-W253 HydrophobicContact CD2-CZ3 4.29Å; I215-W253 HydrophobicContact CD1-CZ2 4.29Å; I215-W253 HydrophobicContact CG2-CH2 4.47Å; I215-W253 HydrophobicContact CG2-CZ2 4.21Å; V220-W253 HydrophobicContact CG1-CD2 3.71Å; V220-W253 HydrophobicContact CG1-CE3 3.47Å; V220-W253 VanDerWaalsContact CG1-CE3 3.47Å; V220-W253 HydrophobicContact CG1-CG 4.47Å; V220-W253 HydrophobicContact CG1-CH2 4.12Å; V220-W253 HydrophobicContact CG1-CZ2 4.3Å; V220-W253 HydrophobicContact CG1-CZ3 3.69Å; V220-W253 HydrophobicContact CG2-CE3 4.49Å; V220-W253 HydrophobicContact CG2-CH2 3.61Å; V220-W253 HydrophobicContact CG2-CZ2 3.74Å; V220-W253 HydrophobicContact CG2-CZ3 4Å; T224-W253 HydrophobicContact CG2-CB 3.6Å; T224-W253 HydrophobicContact CG2-CD2 4.38Å; T224-W253 HydrophobicContact CG2-CG 3.9Å; A249-W253 PolarHBondContact O-N 2.69Å; W253-Q255 VanDerWaalsContact C-N 3.28Å; W253-Q255 PolarHBondContact O-N 3.29Å; W253-L256 PolarHBondContact O-N 2.79Å; W253-E257 HydrophobicContact CZ2-CB 3.97Å; W253-E257 HydrophobicContact CZ2-CG 3.71Å; W253-E257 PolarHBondContact NE1-OE2 3.43Å; W253-E257 VanDerWaalsContact O-CB 3.27Å; W253-E257 WeakPolarHBondContact O-CB 3.47Å; W253-E257 PolarHBondContact O-N 3.4Å
254Y89.2Confident79Confident2 Ų250.5 Ų50.51%0.00826%0.262CS..Hα-helixtrans-60.6-38-179.2172.3-124.1000112.6L194 E205 I206 F209 F250 Y251 R252 K258L194-Y254 HydrophobicContact CD1-CD1 4.15Å; E205-Y254 VanDerWaalsContact CG-OH 3.27Å; E205-Y254 WeakPolarHBondContact CG-OH 3.36Å; E205-Y254 PolarHBondContact OE1-OH 2.66Å; E205-Y254 PolarHBondContact OE2-OH 2.91Å; I206-Y254 HydrophobicContact CB-CE2 4.27Å; I206-Y254 HydrophobicContact CD1-CD1 3.88Å; I206-Y254 HydrophobicContact CD1-CD2 4.48Å; I206-Y254 HydrophobicContact CD1-CE1 4.11Å; I206-Y254 HydrophobicContact CD1-CG 4.05Å; I206-Y254 HydrophobicContact CG1-CD1 3.73Å; I206-Y254 HydrophobicContact CG1-CD2 3.77Å; I206-Y254 HydrophobicContact CG1-CE1 3.56Å; I206-Y254 HydrophobicContact CG1-CE2 3.6Å; I206-Y254 HydrophobicContact CG1-CG 3.79Å; I206-Y254 VanDerWaalsContact CG1-CZ 3.45Å; I206-Y254 HydrophobicContact CG2-CD2 4.29Å; I206-Y254 HydrophobicContact CG2-CE2 4.43Å; F209-Y254 HydrophobicContact CB-CE2 3.93Å; F209-Y254 AromaticContact CD1-CD2 3.89Å; F209-Y254 HydrophobicContact CD1-CD2 3.89Å; F209-Y254 AromaticContact CD1-CE2 3.72Å; F209-Y254 HydrophobicContact CD1-CE2 3.72Å; F209-Y254 HydrophobicContact CD2-CE2 4.05Å; F209-Y254 AromaticContact CE1-CD2 3.98Å; F209-Y254 HydrophobicContact CE1-CD2 3.98Å; F209-Y254 HydrophobicContact CE1-CE2 4.15Å; F209-Y254 HydrophobicContact CE2-CE2 4.44Å; F209-Y254 HydrophobicContact CG-CD2 4.3Å; F209-Y254 AromaticContact CG-CE2 3.66Å; F209-Y254 HydrophobicContact CG-CE2 3.66Å; F209-Y254 HydrophobicContact CZ-CD2 4.46Å; F209-Y254 HydrophobicContact CZ-CE2 4.48Å; F250-Y254 VanDerWaalsContact O-CB 3.29Å; F250-Y254 WeakPolarHBondContact O-CB 3.41Å; F250-Y254 PolarHBondContact O-N 3.03Å; Y251-Y254 PolarHBondContact O-N 2.78Å; R252-Y254 PolarHBondContact O-N 3.46Å; Y254-K258 HydrophobicContact CD1-CD 4.34Å; Y254-K258 HydrophobicContact CD2-CD 4.42Å; Y254-K258 HydrophobicContact CD2-CG 4.43Å; Y254-K258 HydrophobicContact CE1-CD 3.88Å; Y254-K258 HydrophobicContact CE2-CD 3.96Å; Y254-K258 HydrophobicContact CE2-CG 4.12Å; Y254-K258 VanDerWaalsContact CZ-NZ 3.33Å; Y254-K258 VanDerWaalsContact O-CB 3.27Å; Y254-K258 WeakPolarHBondContact O-CB 3.44Å; Y254-K258 PolarHBondContact O-N 3.18Å; Y254-K258 WeakPolarHBondContact OH-CE 3.4Å; Y254-K258 PolarHBondContact OH-NZ 2.98Å
255Q88.5Confident77.2Confident22 Ų2250.3 Ų50.310%0.10326%0.264CS..Hα-helixtrans-72.8-43.2-179.6-165.654.956.800111.9K190 Y251 R252 W253 K258 T259K190-Q255 HydrophobicContact CB-CG 3.9Å; K190-Q255 HydrophobicContact CD-CG 4.25Å; Y251-Q255 WeakPolarHBondContact O-CB 3.41Å; Y251-Q255 PolarHBondContact O-N 3.41Å; R252-Q255 PolarHBondContact O-N 3.47Å; W253-Q255 VanDerWaalsContact C-N 3.28Å; W253-Q255 PolarHBondContact O-N 3.29Å; Q255-K258 WeakPolarHBondContact O-CB 3.43Å; Q255-K258 PolarHBondContact O-N 3.17Å; Q255-T259 PolarHBondContact O-N 3.44Å; Q255-T259 PolarHBondContact O-OG1 3.16Å
256L80.9Confident75.3Confident54 Ų5447.9 Ų47.928%0.28326%0.26SS..Hα-helixtrans-61-46.3171-90.479.4000111.8V187 R252 W253 K258 T259 T260 T264V187-L256 HydrophobicContact CG1-CD1 3.61Å; V187-L256 HydrophobicContact CG2-CD1 4.17Å; R252-L256 HydrophobicContact CG-CD1 4.1Å; R252-L256 WeakPolarHBondContact O-CD1 3.48Å; R252-L256 PolarHBondContact O-N 3.16Å; W253-L256 PolarHBondContact O-N 2.79Å; L256-K258 VanDerWaalsContact C-N 3.26Å; L256-K258 PolarHBondContact O-N 3.02Å; L256-T259 PolarHBondContact O-N 2.88Å; L256-T259 PolarHBondContact O-OG1 3.25Å; L256-T260 PolarHBondContact O-N 3.4Å; L256-T264 HydrophobicContact CB-CG2 3.92Å; L256-T264 HydrophobicContact CD2-CG2 3.91Å
257E81.2Confident72.8Confident7 Ų750 Ų503%0.03327%0.273CS..Hα-helixtrans-65.9-32.8179.5-162.877.7-121.500110.5F209 R213 I215 W253 G262 T264F209-E257 HydrophobicContact CE1-CB 4.27Å; F209-E257 HydrophobicContact CE1-CG 3.96Å; F209-E257 HydrophobicContact CZ-CB 4.16Å; F209-E257 HydrophobicContact CZ-CG 3.94Å; R213-E257 PolarHBondContact NH1-O 2.82Å; I215-E257 HydrophobicContact CD1-CG 3.92Å; W253-E257 HydrophobicContact CZ2-CB 3.97Å; W253-E257 HydrophobicContact CZ2-CG 3.71Å; W253-E257 PolarHBondContact NE1-OE2 3.43Å; W253-E257 VanDerWaalsContact O-CB 3.27Å; W253-E257 WeakPolarHBondContact O-CB 3.47Å; W253-E257 PolarHBondContact O-N 3.4Å; E257-G262 PolarHBondContact OE1-N 2.98Å; E257-T264 VanDerWaalsContact CD-OG1 3.27Å; E257-T264 PolarHBondContact OE2-OG1 3.45Å
258K73.8Confident70.3Confident63 Ų6357.6 Ų57.627%0.27430%0.301SS..Hα-helixtrans-61.8-54.2172.7-100.7176.8154.1172.10111.8E205 F209 R213 Y254 Q255 L256E205-K258 VanDerWaalsContact CD-NZ 3.34Å; E205-K258 IonicContact OE1-NZ 3.45Å; E205-K258 PolarHBondContact OE1-NZ 2.89Å; E205-K258 IonicContact OE2-NZ 2.69Å; E205-K258 PolarHBondContact OE2-NZ 3.11Å; F209-K258 HydrophobicContact CD2-CG 4.34Å; F209-K258 HydrophobicContact CE2-CG 3.74Å; F209-K258 HydrophobicContact CZ-CG 4.17Å; R213-K258 PolarHBondContact NH2-O 2.81Å; Y254-K258 HydrophobicContact CD1-CD 4.34Å; Y254-K258 HydrophobicContact CD2-CD 4.42Å; Y254-K258 HydrophobicContact CD2-CG 4.43Å; Y254-K258 HydrophobicContact CE1-CD 3.88Å; Y254-K258 HydrophobicContact CE2-CD 3.96Å; Y254-K258 HydrophobicContact CE2-CG 4.12Å; Y254-K258 VanDerWaalsContact CZ-NZ 3.33Å; Y254-K258 VanDerWaalsContact O-CB 3.27Å; Y254-K258 WeakPolarHBondContact O-CB 3.44Å; Y254-K258 PolarHBondContact O-N 3.18Å; Y254-K258 WeakPolarHBondContact OH-CE 3.4Å; Y254-K258 PolarHBondContact OH-NZ 2.98Å; Q255-K258 WeakPolarHBondContact O-CB 3.43Å; Q255-K258 PolarHBondContact O-N 3.17Å; L256-K258 VanDerWaalsContact C-N 3.26Å; L256-K258 PolarHBondContact O-N 3.02Å
259T68.8Low67.9Low62 Ų6258.1 Ų58.138%0.3832%0.316SS..Hα-helixtrans-70.5-49-176.253.40000112Q255 L256Q255-T259 PolarHBondContact O-N 3.44Å; Q255-T259 PolarHBondContact O-OG1 3.16Å; L256-T259 PolarHBondContact O-N 2.88Å; L256-T259 PolarHBondContact O-OG1 3.25Å
260T65.6Low65.2Low66 Ų6659.8 Ų59.841%0.40533%0.33SS..SBendtrans-127.292.8-174.6-54.70000111L256 G262 A263L256-T260 PolarHBondContact O-N 3.4Å; T260-G262 PolarHBondContact O-N 3.48Å; T260-A263 HydrophobicContact CG2-CB 3.7Å; T260-A263 PolarHBondContact O-N 3.12Å; T260-A263 VanDerWaalsContact O-N 3.16Å
261P61.1Low62.6Low90 Ų9065.6 Ų65.658%0.58437%0.368SS*.THydrogen-bonded Turntrans-54.3121.5-179.5-21.830.1000112.2A263P261-A263 PolarHBondContact O-N 3.08Å
262G56.2Low60.2Low20 Ų2070.8 Ų70.821%0.20640%0.4CS..THydrogen-bonded Turntrans80.3-0177.300000116.7E257 T260 T264 L265 T266E257-G262 PolarHBondContact OE1-N 2.98Å; T260-G262 PolarHBondContact O-N 3.48Å; G262-T264 VanDerWaalsContact C-N 3.27Å; G262-T264 PolarHBondContact O-N 3.3Å; G262-L265 PolarHBondContact O-N 2.91Å; G262-T266 PolarHBondContact O-N 2.66Å; G262-T266 PolarHBondContact O-OG1 3.24Å; G262-T266 VanDerWaalsContact O-OG1 3.04Å
263A52.8Low57.6Low28 Ų2870.2 Ų70.223%0.23141%0.409CS..Hα-helixtrans-57.2-44.7170.500000111.1T260 P261 L265 T266 M267T260-A263 HydrophobicContact CG2-CB 3.7Å; T260-A263 PolarHBondContact O-N 3.12Å; T260-A263 VanDerWaalsContact O-N 3.16Å; P261-A263 PolarHBondContact O-N 3.08Å; A263-L265 PolarHBondContact O-N 3.49Å; A263-L265 VanDerWaalsContact O-N 3.12Å; A263-T266 PolarHBondContact O-N 3.21Å; A263-T266 PolarHBondContact O-OG1 3.07Å; A263-M267 WeakPolarHBondContact O-CB 3.34Å; A263-M267 WeakPolarHBondContact O-CG 3.37Å; A263-M267 PolarHBondContact O-N 3.41Å
264T53.1Low55.5Low16 Ų1676.9 Ų76.910%0.09844%0.444CS..Hα-helixtrans-66.6-4.1174.124.20000115.1V223 L256 E257 G262V223-T264 HydrophobicContact CG1-CG2 4.15Å; V223-T264 WeakPolarHBondContact CG2-O 3.46Å; L256-T264 HydrophobicContact CB-CG2 3.92Å; L256-T264 HydrophobicContact CD2-CG2 3.91Å; E257-T264 VanDerWaalsContact CD-OG1 3.27Å; E257-T264 PolarHBondContact OE2-OG1 3.45Å; G262-T264 VanDerWaalsContact C-N 3.27Å; G262-T264 PolarHBondContact O-N 3.3Å
265L50.7Low53.5Low107 Ų10784.1 Ų84.156%0.5648%0.478SS*.Hα-helixtrans-111.1-27.6172.4-75.4168.1000113.9V219 G262 A263V219-L265 HydrophobicContact CG1-CD1 4.32Å; V219-L265 HydrophobicContact CG1-CD2 3.46Å; V219-L265 VanDerWaalsContact CG1-CD2 3.46Å; V219-L265 HydrophobicContact CG1-CG 4.33Å; G262-L265 PolarHBondContact O-N 2.91Å; A263-L265 PolarHBondContact O-N 3.49Å; A263-L265 VanDerWaalsContact O-N 3.12Å
266T43.8Very low51.2Low112 Ų11290.2 Ų90.269%0.68751%0.511SS*.Hα-helixtrans-82.6-28.8174.449.30000111.9G262 A263 R268G262-T266 PolarHBondContact O-N 2.66Å; G262-T266 PolarHBondContact O-OG1 3.24Å; G262-T266 VanDerWaalsContact O-OG1 3.04Å; A263-T266 PolarHBondContact O-N 3.21Å; A263-T266 PolarHBondContact O-OG1 3.07Å; T266-R268 PolarHBondContact O-N 3.48Å
267M35.2Very low49.4Very low135 Ų13590.8 Ų90.867%0.66552%0.517SS*.SBendtrans-65.197.4166-73.4-74.495.800111.1A263A263-M267 WeakPolarHBondContact O-CB 3.34Å; A263-M267 WeakPolarHBondContact O-CG 3.37Å; A263-M267 PolarHBondContact O-N 3.41Å
268R37.1Very low47.7Very low194 Ų19495.9 Ų95.973%0.73255%0.548SS*.  trans-45.2131.8150.4-179.2179.2-178104.8-7.2107.1T266 A270T266-R268 PolarHBondContact O-N 3.48Å; R268-A270 PolarHBondContact O-N 3.44Å
269P40Very low45.8Very low103 Ų103100.2 Ų100.267%0.66957%0.57SS**  trans-52.7118.8-175.521.6-33.8000108.9
270A31.4Very low44.4Very low77 Ų77107.5 Ų107.564%0.63659%0.59SS**  trans-57.6132.6-174.200000108.6R268 T272R268-A270 PolarHBondContact O-N 3.44Å; A270-T272 PolarHBondContact O-N 2.86Å
271P37.1Very low43.1Very low123 Ų123112.9 Ų112.980%0.79960%0.603SS**  trans-61.6111.5159.428.4-29.7000105.4S273P271-S273 PolarHBondContact O-N 3.36Å; P271-S273 VanDerWaalsContact O-N 3.16Å
272T39.6Very low41.9Very low111 Ų111116.7 Ų116.768%0.68161%0.613SS**  trans-49125.3167.247.50000107.1A270A270-T272 PolarHBondContact O-N 2.86Å
273S34.5Very low40.6Very low73 Ų73121.5 Ų121.551%0.5164%0.639SS.*  trans-51.1148.3172.839.40000109.1P271 E275P271-S273 PolarHBondContact O-N 3.36Å; P271-S273 VanDerWaalsContact O-N 3.16Å; S273-E275 PolarHBondContact O-N 3.39Å
274L46.1Very low39.7Very low149 Ų149126 Ų12678%0.7867%0.665SS**THydrogen-bonded Turntrans-68.85.5-165.5-165.458.8000113.7
275E45.2Very low38.9Very low155 Ų155130 Ų13072%0.72469%0.691SS**THydrogen-bonded Turntrans-109.9-37.6-154-58.9178.9-120.800110.8S273 V277 V278S273-E275 PolarHBondContact O-N 3.39Å; E275-V277 PolarHBondContact O-N 3.22Å; E275-V278 WeakPolarHBondContact O-CG2 3.31Å
276D41.7Very low38.2Very low150 Ų150129.7 Ų129.780%0.80270%0.696SS**THydrogen-bonded Turntrans-72-6.1168.9-84.3-6.6000113.8V278D276-V278 PolarHBondContact O-N 3.44Å
277V43.2Very low38.1Very low66 Ų66131.3 Ų131.340%0.471%0.706SS.*THydrogen-bonded Turntrans-80.3-2.7-175.9-175.90000112.3E275E275-V277 PolarHBondContact O-N 3.22Å
278V44.1Very low38.3Very low113 Ų113130 Ų13069%0.68571%0.71SS**SBendtrans-82.7-37.5-168178.90000114E275 D276E275-V278 WeakPolarHBondContact O-CG2 3.31Å; D276-V278 PolarHBondContact O-N 3.44Å
279E35Very low37.9Very low155 Ų155126.7 Ų126.772%0.72472%0.716SS**THydrogen-bonded Turntrans-72-38-164.7-167.5175.5-145.900114.5R281E279-R281 PolarHBondContact O-N 3.18Å
280W40Very low37.4Very low215 Ų215127.8 Ų127.881%0.81472%0.721SS**THydrogen-bonded Turntrans-100.843.6-170.1-68.596000115
281R36.4Very low37.7Very low179 Ų179130.7 Ų130.768%0.67573%0.733SS**  trans-10682.7165.1-71.7-149.8-173.8-74.9-1.2112.8E279E279-R281 PolarHBondContact O-N 3.18Å
282Q35.8Very low37.8Very low169 Ų169128 Ų12879%0.7973%0.728SS**  trans-103.6132.9152.6-63.6-167.223.400109.4
283T30.7Very low37.4Very low122 Ų122127.9 Ų127.975%0.74873%0.732SS**SBendtrans68.7124.1-16872.50000115.9
284P33.2Very low37.4Very low121 Ų121131.6 Ų131.679%0.78674%0.739SS**PPolyproline II helixtrans-97.1134.7175.734.8-31.1000112.8
285P35.9Very low37.4Very low100 Ų100135.6 Ų135.665%0.64974%0.744SS**PPolyproline II helixtrans-80.6155.2167.733.3-33.6000111.9
286P36Very low37.2Very low101 Ų101135.1 Ų135.166%0.65675%0.746SS**PPolyproline II helixtrans-71.6158-173.829.1-36.1000114.2S288P286-S288 PolarHBondContact O-N 3.32Å
287V42.6Very low37.4Very low147 Ų147136.2 Ų136.289%0.89174%0.739SS**SBendtrans-79.7117.3-174.3-29.40000111.5
288S37.6Very low37.5Very low108 Ų108144.5 Ų144.576%0.75576%0.763SS**  trans17598.3150.252.40000110.5P286P286-S288 PolarHBondContact O-N 3.32Å
289S29.8Very low37.9Very low123 Ų123141.8 Ų141.886%0.8676%0.758SS**  trans-160105.7167.3-78.30000110.2
290T28.5Very low39.5Very low127 Ų127139.2 Ų139.278%0.77976%0.757SS**  trans-59.4136.3179.1-45.70000111.2G292T290-G292 VanDerWaalsContact C-N 3.33Å; T290-G292 PolarHBondContact O-N 3.08Å
291P38.3Very low41Very low137 Ų137138.9 Ų138.989%0.8976%0.755SS**THydrogen-bonded Turntrans-70.786.6178.829.3-35.4000110.9
292G39.4Very low43.3Very low67 Ų67132.8 Ų132.869%0.69173%0.734SS**THydrogen-bonded Turntrans-171.4-7.8-178.600000116T290 F294T290-G292 VanDerWaalsContact C-N 3.33Å; T290-G292 PolarHBondContact O-N 3.08Å; G292-F294 PolarHBondContact O-N 3.44Å
293S30.7Very low45.7Very low109 Ų109130.1 Ų130.176%0.76273%0.729SS**  trans-76.468.4177.8-162.10000112R295S293-R295 PolarHBondContact O-N 3.32Å
294F35Very low48.5Very low151 Ų151127.9 Ų127.966%0.66271%0.707SS**  trans-62.698166.9-163.4-89.6000107.5G292 L296G292-F294 PolarHBondContact O-N 3.44Å; F294-L296 HydrophobicContact CD1-CD2 4.08Å; F294-L296 HydrophobicContact CD1-CG 4.41Å; F294-L296 HydrophobicContact CE1-CD2 4.38Å; F294-L296 PolarHBondContact O-N 3.38Å
295R45.6Very low51.3Low232 Ų232126.3 Ų126.388%0.87569%0.686SS**  trans-63.387.1177.5-74.7-176176.5173.80109.2S293 R297S293-R295 PolarHBondContact O-N 3.32Å; R295-R297 PolarHBondContact O-N 3.03Å; R295-R297 VanDerWaalsContact O-N 3.09Å
296L42.2Very low53.9Low146 Ų146129.7 Ų129.776%0.76469%0.69SS**  trans-51.1119.1179-77.8165.9000109F294 R298F294-L296 HydrophobicContact CD1-CD2 4.08Å; F294-L296 HydrophobicContact CD1-CG 4.41Å; F294-L296 HydrophobicContact CE1-CD2 4.38Å; F294-L296 PolarHBondContact O-N 3.38Å; L296-R298 PolarHBondContact O-N 3.2Å
297R45.4Very low56.7Low173 Ų173129.8 Ų129.865%0.65368%0.682SS**  trans-43.2128.2170.2-83.9170.8146.5-97.40.1108.1R295 G299R295-R297 PolarHBondContact O-N 3.03Å; R295-R297 VanDerWaalsContact O-N 3.09Å; R297-G299 WeakPolarHBondContact O-CA 3.43Å; R297-G299 PolarHBondContact O-N 2.97Å
298R46.1Very low59.2Low239 Ų239122.8 Ų122.890%0.90264%0.64SS**SBendtrans-44.2112.5173.8174-177.8-82.4-96.55107.9L296L296-R298 PolarHBondContact O-N 3.2Å
299G52.2Low62Low57 Ų57120.2 Ų120.259%0.58862%0.617SS**  trans-64.3172.1-157.700000114.9R297 R301R297-G299 WeakPolarHBondContact O-CA 3.43Å; R297-G299 PolarHBondContact O-N 2.97Å; G299-R301 PolarHBondContact O-N 3.24Å
300S67.4Low65.1Low100 Ų100117.2 Ų117.270%0.69960%0.6SS**  trans-49.5110.9177.8-1710000110.5
301R71.4Confident68.4Low208 Ų208112.7 Ų112.779%0.78557%0.572SS**  trans-85.6124.6-173.7-177.4175.2178.5161.80.8109G299 T303G299-R301 PolarHBondContact O-N 3.24Å; R301-T303 PolarHBondContact O-N 2.88Å
302F84.9Confident71.1Confident52 Ų52106.1 Ų106.123%0.22853%0.529CS..  trans-48.7128.8174.1173.5-109.6000111.8W304 L348 E349 V351 K355F302-W304 AromaticContact CE1-CD2 3.62Å; F302-W304 HydrophobicContact CE1-CD2 3.62Å; F302-W304 AromaticContact CE1-CE2 3.59Å; F302-W304 AromaticContact CE1-CE3 3.72Å; F302-W304 HydrophobicContact CE1-CE3 3.72Å; F302-W304 HydrophobicContact CE1-CG 4.32Å; F302-W304 AromaticContact CE1-CH2 3.84Å; F302-W304 HydrophobicContact CE1-CH2 3.84Å; F302-W304 AromaticContact CE1-CZ2 3.7Å; F302-W304 HydrophobicContact CE1-CZ2 3.7Å; F302-W304 AromaticContact CE1-CZ3 3.83Å; F302-W304 HydrophobicContact CE1-CZ3 3.83Å; F302-W304 AromaticContact CZ-CD2 3.93Å; F302-W304 HydrophobicContact CZ-CD2 3.93Å; F302-W304 AromaticContact CZ-CE3 3.59Å; F302-W304 HydrophobicContact CZ-CE3 3.59Å; F302-W304 HydrophobicContact CZ-CH2 4.17Å; F302-W304 HydrophobicContact CZ-CZ2 4.44Å; F302-W304 AromaticContact CZ-CZ3 3.73Å; F302-W304 HydrophobicContact CZ-CZ3 3.73Å; F302-L348 VanDerWaalsContact CD2-O 3.28Å; F302-L348 WeakPolarHBondContact CD2-O 3.29Å; F302-E349 WeakPolarHBondContact CE2-O 3.11Å; F302-V351 HydrophobicContact CZ-CG2 4.17Å; F302-K355 HydrophobicContact CD1-CD 3.71Å; F302-K355 HydrophobicContact CD1-CG 4.17Å; F302-K355 HydrophobicContact CD2-CD 4.35Å; F302-K355 VanDerWaalsContact CD2-NZ 3.27Å; F302-K355 HydrophobicContact CE1-CB 4.28Å; F302-K355 HydrophobicContact CE1-CD 3.65Å; F302-K355 HydrophobicContact CE1-CG 4.14Å; F302-K355 HydrophobicContact CE2-CD 4.29Å; F302-K355 HydrophobicContact CG-CD 4.06Å; F302-K355 HydrophobicContact CZ-CD 3.95Å
303T87.6Confident73.8Confident113 Ų113106.1 Ų106.169%0.69351%0.511SS*.  trans-119.6139.6177.742.50000109.1R301R301-T303 PolarHBondContact O-N 2.88Å
304W89.3Confident76.9Confident75 Ų75104.2 Ų104.228%0.28450%0.498SS..  trans-75.6126.7178.4-67.3108000110.4F302 C308 L309 M312 V351 K355 W359F302-W304 AromaticContact CE1-CD2 3.62Å; F302-W304 HydrophobicContact CE1-CD2 3.62Å; F302-W304 AromaticContact CE1-CE2 3.59Å; F302-W304 AromaticContact CE1-CE3 3.72Å; F302-W304 HydrophobicContact CE1-CE3 3.72Å; F302-W304 HydrophobicContact CE1-CG 4.32Å; F302-W304 AromaticContact CE1-CH2 3.84Å; F302-W304 HydrophobicContact CE1-CH2 3.84Å; F302-W304 AromaticContact CE1-CZ2 3.7Å; F302-W304 HydrophobicContact CE1-CZ2 3.7Å; F302-W304 AromaticContact CE1-CZ3 3.83Å; F302-W304 HydrophobicContact CE1-CZ3 3.83Å; F302-W304 AromaticContact CZ-CD2 3.93Å; F302-W304 HydrophobicContact CZ-CD2 3.93Å; F302-W304 AromaticContact CZ-CE3 3.59Å; F302-W304 HydrophobicContact CZ-CE3 3.59Å; F302-W304 HydrophobicContact CZ-CH2 4.17Å; F302-W304 HydrophobicContact CZ-CZ2 4.44Å; F302-W304 AromaticContact CZ-CZ3 3.73Å; F302-W304 HydrophobicContact CZ-CZ3 3.73Å; W304-C308 HydrophobicContact CE3-CB 4.06Å; W304-C308 HydrophobicContact CZ3-CB 4.47Å; W304-L309 HydrophobicContact CB-CD1 4.36Å; W304-L309 HydrophobicContact CB-CD2 3.73Å; W304-L309 HydrophobicContact CB-CG 3.99Å; W304-L309 HydrophobicContact CG-CD2 4.04Å; W304-M312 HydrophobicContact CD2-CE 3.75Å; W304-M312 HydrophobicContact CE3-CE 3.37Å; W304-M312 HydrophobicContact CE3-SD 4.35Å; W304-M312 HydrophobicContact CH2-CE 3.74Å; W304-M312 HydrophobicContact CH2-SD 3.69Å; W304-M312 HydrophobicContact CZ2-CE 4.11Å; W304-M312 HydrophobicContact CZ2-SD 4.32Å; W304-M312 HydrophobicContact CZ3-CE 3.36Å; W304-M312 HydrophobicContact CZ3-SD 3.71Å; W304-V351 HydrophobicContact CH2-CG1 4.07Å; W304-V351 HydrophobicContact CZ3-CG1 3.8Å; W304-V351 HydrophobicContact CZ3-CG2 4.18Å; W304-K355 HydrophobicContact CH2-CB 3.81Å; W304-K355 HydrophobicContact CZ2-CB 4.05Å; W304-K355 WeakPolarHBondContact CZ2-O 3.41Å; W304-W359 AromaticContact CE2-CD1 3.76Å; W304-W359 HydrophobicContact CH2-CB 4.37Å; W304-W359 HydrophobicContact CZ2-CB 3.74Å; W304-W359 HydrophobicContact CZ2-CG 4.27Å; W304-W359 AromaticContact NE1-CD1 3.66Å
305R91.7Very high79.8Confident88 Ų8899.4 Ų99.433%0.33248%0.476SS..  trans-74.3150.9167.3-55.8-157.8-159.51558.3109.7E307 C308 L309 I338 E349R305-E307 VanDerWaalsContact C-N 3.3Å; R305-E307 PolarHBondContact O-N 2.99Å; R305-C308 PolarHBondContact O-N 3.23Å; R305-L309 PolarHBondContact O-N 2.82Å; R305-I338 HydrophobicContact CB-CG2 4.16Å; R305-I338 HydrophobicContact CG-CG2 4.2Å; R305-I338 VanDerWaalsContact NH1-CB 3.33Å; R305-I338 PolarHBondContact NH1-O 3.15Å; R305-I338 PolarHBondContact NH2-O 2.86Å; R305-E349 IonicContact CZ-OE2 3.82Å; R305-E349 IonicContact NE-OE2 2.66Å; R305-E349 IonicContact NH2-OE2 3.48Å; R305-E349 PolarHBondContact NH2-OE2 3.19Å
306K90.9Very high82.2Confident170 Ų17088.5 Ų88.574%0.73944%0.435SS*.Hα-helixtrans-55.4-43.8-178.6-70.3-174.9176.1-172.80112.3C308 L309 A310K306-C308 VanDerWaalsContact C-N 3.32Å; K306-C308 PolarHBondContact O-N 3.04Å; K306-L309 WeakPolarHBondContact O-CA 3.32Å; K306-L309 WeakPolarHBondContact O-CB 3.27Å; K306-L309 PolarHBondContact O-N 3.12Å; K306-A310 PolarHBondContact O-N 2.89Å
307E93.8Very high84.6Confident103 Ų10387.5 Ų87.548%0.48143%0.43SS..Hα-helixtrans-60.5-39.5-179.4-32.9-38.611400112.5R305 L309 A310 V311 V337R305-E307 VanDerWaalsContact C-N 3.3Å; R305-E307 PolarHBondContact O-N 2.99Å; E307-L309 VanDerWaalsContact C-N 3.3Å; E307-L309 PolarHBondContact O-N 2.79Å; E307-A310 PolarHBondContact O-N 3.25Å; E307-V311 WeakPolarHBondContact O-CG2 3.32Å; E307-V311 PolarHBondContact O-N 3.42Å; E307-V311 VanDerWaalsContact O-N 3.08Å; E307-V337 HydrophobicContact CB-CG1 3.49Å; E307-V337 VanDerWaalsContact CB-CG1 3.49Å; E307-V337 HydrophobicContact CG-CG1 4.11Å
308C95.6Very high86.9Confident1 Ų185.1 Ų85.11%0.00743%0.43CS..Hα-helixtrans-66-33.2174.4-56.80000112.4W304 R305 K306 M312 C334 I338W304-C308 HydrophobicContact CE3-CB 4.06Å; W304-C308 HydrophobicContact CZ3-CB 4.47Å; R305-C308 PolarHBondContact O-N 3.23Å; K306-C308 VanDerWaalsContact C-N 3.32Å; K306-C308 PolarHBondContact O-N 3.04Å; C308-M312 HydrophobicContact CB-CE 4.47Å; C308-M312 WeakPolarHBondContact O-CB 3.47Å; C308-M312 WeakPolarHBondContact O-CE 3.47Å; C308-M312 VanDerWaalsContact O-CG 3.32Å; C308-M312 WeakPolarHBondContact O-CG 3.26Å; C308-M312 PolarHBondContact O-N 2.94Å; C308-C334 HydrophobicContact CB-CB 4.18Å; C308-I338 WeakPolarHBondContact SG-CG2 3.13Å
309L95.7Very high89.1Confident53 Ų5377.1 Ų77.128%0.27741%0.406SS..Hα-helixtrans-66.3-47176.3-64.1172.9000110W304 R305 K306 E307 V311 M312 E313 W359W304-L309 HydrophobicContact CB-CD1 4.36Å; W304-L309 HydrophobicContact CB-CD2 3.73Å; W304-L309 HydrophobicContact CB-CG 3.99Å; W304-L309 HydrophobicContact CG-CD2 4.04Å; R305-L309 PolarHBondContact O-N 2.82Å; K306-L309 WeakPolarHBondContact O-CA 3.32Å; K306-L309 WeakPolarHBondContact O-CB 3.27Å; K306-L309 PolarHBondContact O-N 3.12Å; E307-L309 VanDerWaalsContact C-N 3.3Å; E307-L309 PolarHBondContact O-N 2.79Å; L309-V311 PolarHBondContact O-N 3.25Å; L309-M312 HydrophobicContact CD2-CE 4.06Å; L309-M312 PolarHBondContact O-N 2.9Å; L309-E313 VanDerWaalsContact O-CB 3.32Å; L309-E313 WeakPolarHBondContact O-CB 3.07Å; L309-E313 VanDerWaalsContact O-CG 3.27Å; L309-E313 WeakPolarHBondContact O-CG 3.49Å; L309-E313 PolarHBondContact O-N 2.89Å; L309-W359 HydrophobicContact CD2-CZ2 4.42Å
310A96.1Very high91.1Very high61 Ų6178.4 Ų78.450%0.50440%0.396SS..Hα-helixtrans-58.5-45.3176.700000112.3K306 E307 E313 S314K306-A310 PolarHBondContact O-N 2.89Å; E307-A310 PolarHBondContact O-N 3.25Å; A310-E313 PolarHBondContact O-N 3.35Å; A310-S314 PolarHBondContact O-N 3.38Å
311V96.3Very high92.5Very high31 Ų3181.1 Ų81.119%0.18839%0.392CS..Hα-helixtrans-58.6-53.6174.4172.60000110.9E307 L309 E313 S314 Y315 A333 V337E307-V311 WeakPolarHBondContact O-CG2 3.32Å; E307-V311 PolarHBondContact O-N 3.42Å; E307-V311 VanDerWaalsContact O-N 3.08Å; L309-V311 PolarHBondContact O-N 3.25Å; V311-E313 VanDerWaalsContact C-N 3.3Å; V311-E313 PolarHBondContact O-N 2.77Å; V311-S314 PolarHBondContact O-N 3.04Å; V311-Y315 HydrophobicContact CG1-CD2 3.9Å; V311-Y315 HydrophobicContact CG1-CE2 3.81Å; V311-Y315 VanDerWaalsContact O-CD2 3.31Å; V311-Y315 WeakPolarHBondContact O-CD2 3.4Å; V311-Y315 PolarHBondContact O-N 2.61Å; V311-A333 HydrophobicContact CG1-CB 4.13Å; V311-V337 HydrophobicContact CG2-CG2 4.4Å
312M96.4Very high93.6Very high0 Ų071.4 Ų71.40%036%0.356CS..Hα-helixtrans-65-31.1-179.5-70.7-173.3-63.200113.3W304 C308 L309 F316 I330 V356 W359 F360W304-M312 HydrophobicContact CD2-CE 3.75Å; W304-M312 HydrophobicContact CE3-CE 3.37Å; W304-M312 HydrophobicContact CE3-SD 4.35Å; W304-M312 HydrophobicContact CH2-CE 3.74Å; W304-M312 HydrophobicContact CH2-SD 3.69Å; W304-M312 HydrophobicContact CZ2-CE 4.11Å; W304-M312 HydrophobicContact CZ2-SD 4.32Å; W304-M312 HydrophobicContact CZ3-CE 3.36Å; W304-M312 HydrophobicContact CZ3-SD 3.71Å; C308-M312 HydrophobicContact CB-CE 4.47Å; C308-M312 WeakPolarHBondContact O-CB 3.47Å; C308-M312 WeakPolarHBondContact O-CE 3.47Å; C308-M312 VanDerWaalsContact O-CG 3.32Å; C308-M312 WeakPolarHBondContact O-CG 3.26Å; C308-M312 PolarHBondContact O-N 2.94Å; L309-M312 HydrophobicContact CD2-CE 4.06Å; L309-M312 PolarHBondContact O-N 2.9Å; M312-F316 WeakPolarHBondContact O-CB 3.46Å; M312-F316 PolarHBondContact O-N 3.27Å; M312-I330 HydrophobicContact CG-CG2 3.74Å; M312-V356 HydrophobicContact SD-CG1 4.39Å; M312-V356 HydrophobicContact SD-CG2 4.24Å; M312-W359 HydrophobicContact CB-CD2 4.14Å; M312-W359 HydrophobicContact CB-CE3 3.88Å; M312-W359 HydrophobicContact CB-CH2 3.93Å; M312-W359 HydrophobicContact CB-CZ2 4.17Å; M312-W359 HydrophobicContact CB-CZ3 3.78Å; M312-W359 HydrophobicContact CE-CB 4.25Å; M312-W359 VanDerWaalsContact CE-CD1 3.47Å; M312-W359 HydrophobicContact CE-CD2 3.78Å; M312-W359 HydrophobicContact CE-CG 3.59Å; M312-W359 HydrophobicContact SD-CB 3.94Å; M312-W359 HydrophobicContact SD-CD2 3.87Å; M312-W359 HydrophobicContact SD-CE3 4.15Å; M312-W359 HydrophobicContact SD-CG 3.76Å; M312-F360 HydrophobicContact CB-CE2 4.21Å; M312-F360 HydrophobicContact CG-CE2 4.31Å
313E96.1Very high94.1Very high66 Ų6673 Ų7331%0.30837%0.367SS..Hα-helixtrans-69.9-36.9175.9-75.6179.3137.400112L309 A310 V311 F316 N317 W359 R363L309-E313 VanDerWaalsContact O-CB 3.32Å; L309-E313 WeakPolarHBondContact O-CB 3.07Å; L309-E313 VanDerWaalsContact O-CG 3.27Å; L309-E313 WeakPolarHBondContact O-CG 3.49Å; L309-E313 PolarHBondContact O-N 2.89Å; A310-E313 PolarHBondContact O-N 3.35Å; V311-E313 VanDerWaalsContact C-N 3.3Å; V311-E313 PolarHBondContact O-N 2.77Å; E313-F316 PolarHBondContact O-N 2.93Å; E313-N317 VanDerWaalsContact O-CG 3.27Å; E313-N317 PolarHBondContact O-N 2.97Å; E313-N317 PolarHBondContact O-ND2 3.23Å; E313-N317 PolarHBondContact O-OD1 3.16Å; E313-W359 HydrophobicContact CB-CH2 4.48Å; E313-W359 HydrophobicContact CG-CH2 3.62Å; E313-W359 HydrophobicContact CG-CZ2 3.73Å; E313-R363 IonicContact OE1-CZ 2.74Å; E313-R363 IonicContact OE1-NH1 3.8Å; E313-R363 PolarHBondContact OE1-NH1 3.05Å; E313-R363 IonicContact OE1-NH2 2.65Å; E313-R363 PolarHBondContact OE1-NH2 3.41Å
314S95.8Very high94.4Very high69 Ų6971.6 Ų71.648%0.48335%0.353SS..Hα-helixtrans-59.6-58.9171.3-165.20000110.9A310 V311 F316 N317 D318A310-S314 PolarHBondContact O-N 3.38Å; V311-S314 PolarHBondContact O-N 3.04Å; S314-F316 PolarHBondContact O-N 2.81Å; S314-F316 VanDerWaalsContact O-N 3.1Å; S314-N317 WeakPolarHBondContact O-CB 3.41Å; S314-N317 PolarHBondContact O-N 3.45Å; S314-D318 PolarHBondContact O-N 3.2Å
315Y95.2Very high94.7Very high50 Ų5071 Ų7120%0.19636%0.364CS..Hα-helixtrans-60.2-24.7179-77.8-78.7000113.5V311 N319 K326 E329 I330 A333V311-Y315 HydrophobicContact CG1-CD2 3.9Å; V311-Y315 HydrophobicContact CG1-CE2 3.81Å; V311-Y315 VanDerWaalsContact O-CD2 3.31Å; V311-Y315 WeakPolarHBondContact O-CD2 3.4Å; V311-Y315 PolarHBondContact O-N 2.61Å; Y315-N319 CarbonylContact O-C 3.57Å; Y315-N319 PolarHBondContact O-N 2.87Å; Y315-K326 HydrophobicContact CE1-CD 4.36Å; Y315-E329 VanDerWaalsContact CE1-OE1 3.25Å; Y315-E329 WeakPolarHBondContact CE1-OE1 3.41Å; Y315-E329 VanDerWaalsContact CZ-OE1 3.31Å; Y315-E329 PolarHBondContact OH-OE1 2.94Å; Y315-I330 HydrophobicContact CD1-CD1 4.14Å; Y315-I330 HydrophobicContact CD1-CG1 3.86Å; Y315-I330 HydrophobicContact CD2-CD1 4.4Å; Y315-I330 HydrophobicContact CD2-CG1 3.67Å; Y315-I330 HydrophobicContact CD2-CG2 4.44Å; Y315-I330 HydrophobicContact CE1-CG1 4.08Å; Y315-I330 HydrophobicContact CE2-CG1 3.92Å; Y315-I330 HydrophobicContact CG-CD1 3.9Å; Y315-I330 HydrophobicContact CG-CG1 3.61Å; Y315-A333 HydrophobicContact CE2-CB 4.47Å
316F95.9Very high94.9Very high3 Ų370.2 Ų70.21%0.01336%0.363CS..Hα-helixtrans-72.6-33.2175.6-173.4-83.4000112.9M312 E313 S314 N319 Q320 W359 F360 R363 R364 I367M312-F316 WeakPolarHBondContact O-CB 3.46Å; M312-F316 PolarHBondContact O-N 3.27Å; E313-F316 PolarHBondContact O-N 2.93Å; S314-F316 PolarHBondContact O-N 2.81Å; S314-F316 VanDerWaalsContact O-N 3.1Å; F316-N319 CarbonylContact O-C 3.58Å; F316-Q320 HydrophobicContact CD1-CG 4.08Å; F316-Q320 HydrophobicContact CE1-CB 4.36Å; F316-Q320 HydrophobicContact CE1-CG 3.57Å; F316-Q320 HydrophobicContact CE2-CB 4.06Å; F316-Q320 HydrophobicContact CE2-CG 4.16Å; F316-Q320 HydrophobicContact CZ-CB 3.92Å; F316-Q320 HydrophobicContact CZ-CG 3.61Å; F316-Q320 WeakPolarHBondContact O-CG 3.38Å; F316-Q320 PolarHBondContact O-N 2.88Å; F316-W359 HydrophobicContact CB-CH2 4.36Å; F316-W359 HydrophobicContact CB-CZ3 4.04Å; F316-W359 AromaticContact CD2-CZ3 3.91Å; F316-W359 HydrophobicContact CD2-CZ3 3.91Å; F316-W359 HydrophobicContact CG-CZ3 4.21Å; F316-F360 HydrophobicContact CB-CE1 3.91Å; F316-F360 HydrophobicContact CB-CZ 4.19Å; F316-F360 AromaticContact CD2-CD1 3.55Å; F316-F360 HydrophobicContact CD2-CD1 3.55Å; F316-F360 AromaticContact CD2-CE1 3.73Å; F316-F360 HydrophobicContact CD2-CE1 3.73Å; F316-F360 HydrophobicContact CD2-CG 4.25Å; F316-F360 HydrophobicContact CE2-CD1 4.2Å; F316-F360 HydrophobicContact CG-CE1 4.28Å; F316-R363 HydrophobicContact CD1-CG 4.09Å; F316-R363 HydrophobicContact CD2-CB 4.05Å; F316-R363 HydrophobicContact CD2-CG 3.7Å; F316-R363 HydrophobicContact CE1-CG 3.91Å; F316-R363 HydrophobicContact CE2-CB 3.7Å; F316-R363 HydrophobicContact CE2-CG 3.49Å; F316-R363 VanDerWaalsContact CE2-CG 3.49Å; F316-R363 HydrophobicContact CG-CG 4.02Å; F316-R363 HydrophobicContact CZ-CB 4.19Å; F316-R363 HydrophobicContact CZ-CG 3.62Å; F316-R364 HydrophobicContact CE2-CG 3.74Å; F316-R364 HydrophobicContact CZ-CG 3.81Å; F316-I367 HydrophobicContact CD1-CD1 4.38Å; F316-I367 HydrophobicContact CE1-CD1 3.31Å; F316-I367 HydrophobicContact CZ-CD1 3.61Å
317N93.6Very high95.2Very high125 Ų12564.5 Ų64.567%0.66834%0.337SS*.Hα-helixtrans-68.8-39.4175-61.9-24.6000110.6E313 S314E313-N317 VanDerWaalsContact O-CG 3.27Å; E313-N317 PolarHBondContact O-N 2.97Å; E313-N317 PolarHBondContact O-ND2 3.23Å; E313-N317 PolarHBondContact O-OD1 3.16Å; S314-N317 WeakPolarHBondContact O-CB 3.41Å; S314-N317 PolarHBondContact O-N 3.45Å
318D92.6Very high95.4Very high123 Ų12364.8 Ų64.866%0.65834%0.338SS*.Hα-helixtrans-70.6-47.2177.5-50-37.7000112.1S314S314-D318 PolarHBondContact O-N 3.2Å
319N92.6Very high95.4Very high72 Ų7268.6 Ų68.639%0.38536%0.355SS..  trans-148.2106.8179.5-179.66.4000111.9Y315 F316 Y321 F360Y315-N319 CarbonylContact O-C 3.57Å; Y315-N319 PolarHBondContact O-N 2.87Å; F316-N319 CarbonylContact O-C 3.58Å; N319-Y321 PolarHBondContact ND2-O 2.69Å; N319-Y321 PolarHBondContact O-N 2.91Å; N319-Y321 VanDerWaalsContact O-N 3.14Å; N319-Y321 WeakPolarHBondContact OD1-CA 3.23Å; N319-Y321 PolarHBondContact OD1-N 3.18Å; N319-Y321 PolarHBondContact OD1-O 2.89Å; N319-F360 WeakPolarHBondContact O-CE1 3.36Å
320Q94.7Very high95.5Very high84 Ų8466.1 Ų66.139%0.39334%0.343SS..SBendtrans-66.7-13.1176.3-58.8-166.99.100114.3F316 R364F316-Q320 HydrophobicContact CD1-CG 4.08Å; F316-Q320 HydrophobicContact CE1-CB 4.36Å; F316-Q320 HydrophobicContact CE1-CG 3.57Å; F316-Q320 HydrophobicContact CE2-CB 4.06Å; F316-Q320 HydrophobicContact CE2-CG 4.16Å; F316-Q320 HydrophobicContact CZ-CB 3.92Å; F316-Q320 HydrophobicContact CZ-CG 3.61Å; F316-Q320 WeakPolarHBondContact O-CG 3.38Å; F316-Q320 PolarHBondContact O-N 2.88Å; Q320-R364 HydrophobicContact CB-CG 4.46Å; Q320-R364 WeakPolarHBondContact O-CD 3.5Å; Q320-R364 PolarHBondContact O-NH1 2.87Å
321Y95.7Very high95.5Very high156 Ų15663.3 Ų63.361%0.61232%0.32SS*.SBendtrans-129.766.5-176.5-64.8-97.2000111.6N319 R364N319-Y321 PolarHBondContact ND2-O 2.69Å; N319-Y321 PolarHBondContact O-N 2.91Å; N319-Y321 VanDerWaalsContact O-N 3.14Å; N319-Y321 WeakPolarHBondContact OD1-CA 3.23Å; N319-Y321 PolarHBondContact OD1-N 3.18Å; N319-Y321 PolarHBondContact OD1-O 2.89Å; Y321-R364 VanDerWaalsContact CE1-CZ 3.43Å; Y321-R364 VanDerWaalsContact CE1-NE 3.27Å
322P94.6Very high95.5Very high4 Ų466.8 Ų66.83%0.02634%0.337CS..  trans-62.1142173.628.6-35.5000110.4K326 R327 I330 F360P322-K326 HydrophobicContact CB-CB 3.94Å; P322-K326 HydrophobicContact CB-CG 4.13Å; P322-R327 HydrophobicContact CB-CG 4.18Å; P322-R327 HydrophobicContact CG-CG 4.05Å; P322-R327 PolarHBondContact O-NE 3.27Å; P322-R327 PolarHBondContact O-NH2 3.13Å; P322-I330 HydrophobicContact CB-CD1 4.14Å; P322-I330 HydrophobicContact CG-CD1 4.34Å; P322-F360 HydrophobicContact CG-CD1 3.57Å; P322-F360 HydrophobicContact CG-CD2 4.3Å; P322-F360 HydrophobicContact CG-CE1 3.66Å; P322-F360 HydrophobicContact CG-CE2 4.41Å; P322-F360 HydrophobicContact CG-CG 3.92Å; P322-F360 HydrophobicContact CG-CZ 4.11Å
323D95.2Very high95.5Very high87 Ų8768.2 Ų68.247%0.46535%0.349SS..  trans-74.7-173.7169.977.8-48.3000110.7A325 K326 R327D323-A325 WeakPolarHBondContact OD2-CB 3.48Å; D323-A325 PolarHBondContact OD2-N 2.93Å; D323-K326 WeakPolarHBondContact OD1-CB 3.44Å; D323-K326 PolarHBondContact OD1-N 3.22Å; D323-R327 WeakPolarHBondContact O-CD 3.33Å; D323-R327 WeakPolarHBondContact O-CG 3.43Å; D323-R327 PolarHBondContact O-N 3.27Å; D323-R327 VanDerWaalsContact O-N 3.11Å; D323-R327 PolarHBondContact O-NE 3.44Å
324E95.1Very high95.5Very high83 Ų8365 Ų6539%0.38833%0.334SS..Hα-helixtrans-70.8-38.6-178.4-161.462.8-161.300112.4K326 R327 E328 S353E324-K326 PolarHBondContact O-N 3.47Å; E324-R327 WeakPolarHBondContact O-CB 3.26Å; E324-R327 PolarHBondContact O-N 3.31Å; E324-R327 VanDerWaalsContact OE2-CD 3.32Å; E324-R327 WeakPolarHBondContact OE2-CD 3.25Å; E324-R327 IonicContact OE2-CZ 3.51Å; E324-R327 IonicContact OE2-NE 2.63Å; E324-R327 IonicContact OE2-NH1 3.66Å; E324-R327 PolarHBondContact OE2-NH1 3.03Å; E324-E328 PolarHBondContact O-N 3.17Å; E324-S353 WeakPolarHBondContact OE1-CB 3.21Å; E324-S353 PolarHBondContact OE1-OG 3.06Å
325A96.2Very high95.5Very high63 Ų6362.4 Ų62.452%0.52132%0.315SS..Hα-helixtrans-63.5-44.9178.400000111.4D323 R327 E328 E329D323-A325 WeakPolarHBondContact OD2-CB 3.48Å; D323-A325 PolarHBondContact OD2-N 2.93Å; A325-R327 VanDerWaalsContact C-N 3.32Å; A325-R327 PolarHBondContact O-N 3.24Å; A325-E328 PolarHBondContact O-N 2.6Å; A325-E329 PolarHBondContact O-N 2.79Å
326K95.3Very high95.4Very high71 Ų7163.2 Ų63.231%0.30933%0.331SS..Hα-helixtrans-68.1-29.1176.3-160.656.2149.9179.40112.5Y315 P322 D323 E324 E329 I330Y315-K326 HydrophobicContact CE1-CD 4.36Å; P322-K326 HydrophobicContact CB-CB 3.94Å; P322-K326 HydrophobicContact CB-CG 4.13Å; D323-K326 WeakPolarHBondContact OD1-CB 3.44Å; D323-K326 PolarHBondContact OD1-N 3.22Å; E324-K326 PolarHBondContact O-N 3.47Å; K326-E329 HydrophobicContact CD-CB 4.27Å; K326-E329 WeakPolarHBondContact CD-OE2 3.41Å; K326-E329 IonicContact NZ-OE1 2.71Å; K326-E329 PolarHBondContact NZ-OE1 3.28Å; K326-E329 IonicContact NZ-OE2 2.68Å; K326-E329 PolarHBondContact NZ-OE2 2.89Å; K326-E329 PolarHBondContact O-N 3.02Å; K326-I330 HydrophobicContact CG-CD1 4.19Å; K326-I330 WeakPolarHBondContact O-CB 3.33Å; K326-I330 VanDerWaalsContact O-CD1 3.29Å; K326-I330 WeakPolarHBondContact O-CD1 3.44Å; K326-I330 WeakPolarHBondContact O-CG1 3.32Å; K326-I330 PolarHBondContact O-N 3.46Å
327R97.1Very high95.3Very high50 Ų5067 Ų6719%0.18936%0.355CS..Hα-helixtrans-67.7-36.5171.2-69.3159.3-150.1165.99.3112.5P322 D323 E324 A325 A331 V356P322-R327 HydrophobicContact CB-CG 4.18Å; P322-R327 HydrophobicContact CG-CG 4.05Å; P322-R327 PolarHBondContact O-NE 3.27Å; P322-R327 PolarHBondContact O-NH2 3.13Å; D323-R327 WeakPolarHBondContact O-CD 3.33Å; D323-R327 WeakPolarHBondContact O-CG 3.43Å; D323-R327 PolarHBondContact O-N 3.27Å; D323-R327 VanDerWaalsContact O-N 3.11Å; D323-R327 PolarHBondContact O-NE 3.44Å; E324-R327 WeakPolarHBondContact O-CB 3.26Å; E324-R327 PolarHBondContact O-N 3.31Å; E324-R327 VanDerWaalsContact OE2-CD 3.32Å; E324-R327 WeakPolarHBondContact OE2-CD 3.25Å; E324-R327 IonicContact OE2-CZ 3.51Å; E324-R327 IonicContact OE2-NE 2.63Å; E324-R327 IonicContact OE2-NH1 3.66Å; E324-R327 PolarHBondContact OE2-NH1 3.03Å; A325-R327 VanDerWaalsContact C-N 3.32Å; A325-R327 PolarHBondContact O-N 3.24Å; R327-A331 VanDerWaalsContact O-CB 3.26Å; R327-A331 WeakPolarHBondContact O-CB 3.39Å; R327-A331 PolarHBondContact O-N 2.9Å; R327-V356 HydrophobicContact CB-CG1 4.41Å; R327-V356 HydrophobicContact CG-CG1 4.33Å
328E97.1Very high95.2Very high109 Ų10961.3 Ų61.351%0.50932%0.324SS..Hα-helixtrans-67.7-43.2173.4-72.1-169.7160.900111.3E324 A325 I330 A331 N332E324-E328 PolarHBondContact O-N 3.17Å; A325-E328 PolarHBondContact O-N 2.6Å; E328-I330 PolarHBondContact O-N 2.89Å; E328-A331 PolarHBondContact O-N 2.9Å; E328-N332 WeakPolarHBondContact O-CB 3.28Å; E328-N332 PolarHBondContact O-N 3.1Å; E328-N332 PolarHBondContact O-ND2 3.09Å
329E96.8Very high95.1Very high80 Ų8060.3 Ų60.337%0.37432%0.316SS..Hα-helixtrans-55.8-51.7171.6-169.5-162.2119.200111.4Y315 A325 K326 A331 N332 A333Y315-E329 VanDerWaalsContact CE1-OE1 3.25Å; Y315-E329 WeakPolarHBondContact CE1-OE1 3.41Å; Y315-E329 VanDerWaalsContact CZ-OE1 3.31Å; Y315-E329 PolarHBondContact OH-OE1 2.94Å; A325-E329 PolarHBondContact O-N 2.79Å; K326-E329 HydrophobicContact CD-CB 4.27Å; K326-E329 WeakPolarHBondContact CD-OE2 3.41Å; K326-E329 IonicContact NZ-OE1 2.71Å; K326-E329 PolarHBondContact NZ-OE1 3.28Å; K326-E329 IonicContact NZ-OE2 2.68Å; K326-E329 PolarHBondContact NZ-OE2 2.89Å; K326-E329 PolarHBondContact O-N 3.02Å; E329-A331 VanDerWaalsContact C-N 3.32Å; E329-A331 PolarHBondContact O-N 3.34Å; E329-N332 PolarHBondContact O-N 3.39Å; E329-N332 VanDerWaalsContact O-N 3.15Å; E329-A333 WeakPolarHBondContact O-CB 3.46Å; E329-A333 PolarHBondContact O-N 3.2Å
330I96.6Very high94.6Very high1 Ų163.7 Ų63.71%0.00533%0.327CS..Hα-helixtrans-61.2-40.1178.2-66.9161.9000111.2M312 Y315 P322 K326 E328 C334 V356 F360M312-I330 HydrophobicContact CG-CG2 3.74Å; Y315-I330 HydrophobicContact CD1-CD1 4.14Å; Y315-I330 HydrophobicContact CD1-CG1 3.86Å; Y315-I330 HydrophobicContact CD2-CD1 4.4Å; Y315-I330 HydrophobicContact CD2-CG1 3.67Å; Y315-I330 HydrophobicContact CD2-CG2 4.44Å; Y315-I330 HydrophobicContact CE1-CG1 4.08Å; Y315-I330 HydrophobicContact CE2-CG1 3.92Å; Y315-I330 HydrophobicContact CG-CD1 3.9Å; Y315-I330 HydrophobicContact CG-CG1 3.61Å; P322-I330 HydrophobicContact CB-CD1 4.14Å; P322-I330 HydrophobicContact CG-CD1 4.34Å; K326-I330 HydrophobicContact CG-CD1 4.19Å; K326-I330 WeakPolarHBondContact O-CB 3.33Å; K326-I330 VanDerWaalsContact O-CD1 3.29Å; K326-I330 WeakPolarHBondContact O-CD1 3.44Å; K326-I330 WeakPolarHBondContact O-CG1 3.32Å; K326-I330 PolarHBondContact O-N 3.46Å; E328-I330 PolarHBondContact O-N 2.89Å; I330-C334 VanDerWaalsContact O-CB 3.31Å; I330-C334 WeakPolarHBondContact O-CB 3.43Å; I330-C334 PolarHBondContact O-N 3.04Å; I330-C334 PolarHBondContact O-SG 2.81Å; I330-V356 HydrophobicContact CB-CG1 4.08Å; I330-V356 HydrophobicContact CD1-CG1 4.46Å; I330-V356 HydrophobicContact CG2-CG1 3.65Å; I330-V356 HydrophobicContact CG2-CG2 4.06Å; I330-F360 HydrophobicContact CD1-CE2 4.1Å; I330-F360 HydrophobicContact CD1-CZ 3.85Å; I330-F360 HydrophobicContact CG2-CE2 4.46Å
331A97Very high93.9Very high3 Ų366 Ų663%0.02535%0.349CS..Hα-helixtrans-65.3-39.2176.300000111.8R327 E328 E329 N335 V351 V356R327-A331 VanDerWaalsContact O-CB 3.26Å; R327-A331 WeakPolarHBondContact O-CB 3.39Å; R327-A331 PolarHBondContact O-N 2.9Å; E328-A331 PolarHBondContact O-N 2.9Å; E329-A331 VanDerWaalsContact C-N 3.32Å; E329-A331 PolarHBondContact O-N 3.34Å; A331-N335 VanDerWaalsContact O-CB 3.32Å; A331-N335 WeakPolarHBondContact O-CB 3.49Å; A331-N335 PolarHBondContact O-N 3.28Å; A331-N335 PolarHBondContact O-ND2 3.29Å; A331-V351 HydrophobicContact CB-CG1 4.02Å; A331-V356 HydrophobicContact CB-CG2 3.91Å
332N96.4Very high93Very high104 Ų10462.8 Ų62.856%0.55636%0.364SS*.Hα-helixtrans-69.8-42.9177-70.7-26.8000111.9E328 E329 N335 A336E328-N332 WeakPolarHBondContact O-CB 3.28Å; E328-N332 PolarHBondContact O-N 3.1Å; E328-N332 PolarHBondContact O-ND2 3.09Å; E329-N332 PolarHBondContact O-N 3.39Å; E329-N332 VanDerWaalsContact O-N 3.15Å; N332-N335 PolarHBondContact O-N 3.49Å; N332-A336 WeakPolarHBondContact O-CB 3.22Å; N332-A336 PolarHBondContact O-N 3.11Å
333A96.2Very high92.4Very high29 Ų2969.9 Ų69.924%0.2439%0.394CS..Hα-helixtrans-60-47172.400000111.4V311 Y315 E329 N335 A336 V337V311-A333 HydrophobicContact CG1-CB 4.13Å; Y315-A333 HydrophobicContact CE2-CB 4.47Å; E329-A333 WeakPolarHBondContact O-CB 3.46Å; E329-A333 PolarHBondContact O-N 3.2Å; A333-N335 PolarHBondContact O-N 3Å; A333-A336 PolarHBondContact O-N 3.38Å; A333-V337 WeakPolarHBondContact O-CG2 3.4Å; A333-V337 PolarHBondContact O-N 3.36Å
334C96.3Very high91.9Very high0 Ų075.2 Ų75.20%041%0.413CS..Hα-helixtrans-56.9-48.2172.9-72.30000111.7C308 I330 V337 I338 V351C308-C334 HydrophobicContact CB-CB 4.18Å; I330-C334 VanDerWaalsContact O-CB 3.31Å; I330-C334 WeakPolarHBondContact O-CB 3.43Å; I330-C334 PolarHBondContact O-N 3.04Å; I330-C334 PolarHBondContact O-SG 2.81Å; C334-V337 PolarHBondContact O-N 3.38Å; C334-I338 WeakPolarHBondContact O-CG1 3.3Å; C334-I338 PolarHBondContact O-N 3.22Å; C334-I338 VanDerWaalsContact O-N 3.16Å; C334-V351 HydrophobicContact CB-CB 4.14Å; C334-V351 HydrophobicContact CB-CG1 4.08Å; C334-V351 HydrophobicContact CB-CG2 3.92Å
335N95.4Very high91.3Very high14 Ų1473 Ų738%0.07540%0.404CS..Hα-helixtrans-59.4-45.4179-80.4-38.6000112.1A331 N332 A333 V337 I338 Q339 L345 V351A331-N335 VanDerWaalsContact O-CB 3.32Å; A331-N335 WeakPolarHBondContact O-CB 3.49Å; A331-N335 PolarHBondContact O-N 3.28Å; A331-N335 PolarHBondContact O-ND2 3.29Å; N332-N335 PolarHBondContact O-N 3.49Å; A333-N335 PolarHBondContact O-N 3Å; N335-V337 VanDerWaalsContact C-N 3.34Å; N335-V337 PolarHBondContact O-N 3.07Å; N335-I338 WeakPolarHBondContact O-CG1 3.38Å; N335-I338 PolarHBondContact O-N 2.83Å; N335-Q339 VanDerWaalsContact O-CB 3.31Å; N335-Q339 WeakPolarHBondContact O-CB 3.12Å; N335-Q339 PolarHBondContact O-N 2.66Å; N335-L345 HydrophobicContact CB-CD1 3.95Å; N335-L345 WeakPolarHBondContact OD1-CD1 3.45Å; N335-V351 PolarHBondContact ND2-O 2.96Å; N335-V351 PolarHBondContact OD1-N 2.97Å
336A94.3Very high90.8Very high66 Ų6672.4 Ų72.455%0.54540%0.395SS..Hα-helixtrans-58.3-44.8179.300000111.8N332 A333 I338 Q339N332-A336 WeakPolarHBondContact O-CB 3.22Å; N332-A336 PolarHBondContact O-N 3.11Å; A333-A336 PolarHBondContact O-N 3.38Å; A336-I338 VanDerWaalsContact C-N 3.33Å; A336-I338 PolarHBondContact O-N 3.26Å; A336-Q339 PolarHBondContact O-N 3.04Å
337V93.2Very high90.2Very high84 Ų8475.5 Ų75.551%0.50942%0.415SS..Hα-helixtrans-69.8-28.1179-177.60000112.5E307 V311 A333 C334 N335E307-V337 HydrophobicContact CB-CG1 3.49Å; E307-V337 VanDerWaalsContact CB-CG1 3.49Å; E307-V337 HydrophobicContact CG-CG1 4.11Å; V311-V337 HydrophobicContact CG2-CG2 4.4Å; A333-V337 WeakPolarHBondContact O-CG2 3.4Å; A333-V337 PolarHBondContact O-N 3.36Å; C334-V337 PolarHBondContact O-N 3.38Å; N335-V337 VanDerWaalsContact C-N 3.34Å; N335-V337 PolarHBondContact O-N 3.07Å
338I90.9Very high89.5Confident5 Ų578.3 Ų78.33%0.02643%0.433CS..Hα-helixtrans-89.7-13.5176.964.6162000115R305 C308 C334 N335 A336 L345 V351R305-I338 HydrophobicContact CB-CG2 4.16Å; R305-I338 HydrophobicContact CG-CG2 4.2Å; R305-I338 VanDerWaalsContact NH1-CB 3.33Å; R305-I338 PolarHBondContact NH1-O 3.15Å; R305-I338 PolarHBondContact NH2-O 2.86Å; C308-I338 WeakPolarHBondContact SG-CG2 3.13Å; C334-I338 WeakPolarHBondContact O-CG1 3.3Å; C334-I338 PolarHBondContact O-N 3.22Å; C334-I338 VanDerWaalsContact O-N 3.16Å; N335-I338 WeakPolarHBondContact O-CG1 3.38Å; N335-I338 PolarHBondContact O-N 2.83Å; A336-I338 VanDerWaalsContact C-N 3.33Å; A336-I338 PolarHBondContact O-N 3.26Å; I338-L345 HydrophobicContact CB-CD2 4.49Å; I338-L345 HydrophobicContact CD1-CD1 3.96Å; I338-L345 HydrophobicContact CD1-CD2 3.92Å; I338-L345 HydrophobicContact CG1-CD1 3.82Å; I338-L345 HydrophobicContact CG1-CD2 3.89Å; I338-V351 HydrophobicContact CD1-CG2 4.1Å
339Q90.1Very high89Confident102 Ų10277.3 Ų77.348%0.47743%0.429SS..PPolyproline II helixtrans-77.8127.4-179.9-175.1166.8-10.100110.7N335 A336 L345N335-Q339 VanDerWaalsContact O-CB 3.31Å; N335-Q339 WeakPolarHBondContact O-CB 3.12Å; N335-Q339 PolarHBondContact O-N 2.66Å; A336-Q339 PolarHBondContact O-N 3.04Å; Q339-L345 HydrophobicContact CB-CD1 4.22Å; Q339-L345 HydrophobicContact CB-CG 4.21Å; Q339-L345 HydrophobicContact CG-CG 4.48Å
340K82.8Confident88.8Confident143 Ų14378 Ų7862%0.62243%0.43SS*.BIsolated β-bridgetrans-91.8144176.1-66.4-169.2175.7-1700110G342 K343K340-G342 PolarHBondContact O-N 3.5Å; K340-K343 HydrophobicContact CB-CB 4.5Å; K340-K343 PolarHBondContact O-N 2.92Å
341P80.3Confident88.7Confident132 Ų13278 Ų7886%0.85743%0.431SS*.THydrogen-bonded Turntrans-54.3136.8174.622.9-33.2000110.4K343P341-K343 PolarHBondContact O-N 2.74Å
342G75.6Confident88.7Confident89 Ų8980.6 Ų80.692%0.91845%0.447SS*.THydrogen-bonded Turntrans72.4-0.4-176.600000116.5K340K340-G342 PolarHBondContact O-N 3.5Å
343K83.5Confident88.7Confident153 Ų15376.7 Ų76.767%0.66543%0.427SS*.BIsolated β-bridgetrans-128.9116.6-179.6-61.5-168.2179.9-171.30112.4K340 P341K340-K343 HydrophobicContact CB-CB 4.5Å; K340-K343 PolarHBondContact O-N 2.92Å; P341-K343 PolarHBondContact O-N 2.74Å
344K83.4Confident88.6Confident199 Ų19980.6 Ų80.687%0.86544%0.444SS*.PPolyproline II helixtrans-67.2143.3169.4-64.4-176.8-179.8-179.40109.8
345L83.8Confident88.6Confident37 Ų3782.7 Ų82.719%0.19445%0.453CS..PPolyproline II helixtrans-68.9141.9174.3-65.7167.8000110.6N335 I338 Q339N335-L345 HydrophobicContact CB-CD1 3.95Å; N335-L345 WeakPolarHBondContact OD1-CD1 3.45Å; I338-L345 HydrophobicContact CB-CD2 4.49Å; I338-L345 HydrophobicContact CD1-CD1 3.96Å; I338-L345 HydrophobicContact CD1-CD2 3.92Å; I338-L345 HydrophobicContact CG1-CD1 3.82Å; I338-L345 HydrophobicContact CG1-CD2 3.89Å; Q339-L345 HydrophobicContact CB-CD1 4.22Å; Q339-L345 HydrophobicContact CB-CG 4.21Å; Q339-L345 HydrophobicContact CG-CG 4.48Å
346S85.1Confident88.6Confident49 Ų4982 Ų8234%0.34345%0.449SS..PPolyproline II helixtrans-76.1150.7169.868.30000110.4L348 E349 K350S346-L348 PolarHBondContact O-N 3.48Å; S346-L348 VanDerWaalsContact O-N 3.15Å; S346-E349 CarbonylContact O-C 3.56Å; S346-E349 PolarHBondContact O-N 2.98Å; S346-E349 WeakPolarHBondContact OG-CG 3.31Å; S346-E349 PolarHBondContact OG-N 3.2Å; S346-E349 PolarHBondContact OG-OE1 3.42Å; S346-K350 WeakPolarHBondContact O-CB 3.41Å; S346-K350 PolarHBondContact O-N 3.11Å
347D81.6Confident88.8Confident136 Ų13683.7 Ų83.773%0.72744%0.442SS*.THydrogen-bonded Turntrans-63.6-22.2-179.8-61.7-62.8000113.5
348L83.9Confident88.9Confident109 Ų10983.4 Ų83.457%0.57144%0.437SS*.THydrogen-bonded Turntrans-64.6-43.4170.7-65.6175.3000111.3F302 S346 K355F302-L348 VanDerWaalsContact CD2-O 3.28Å; F302-L348 WeakPolarHBondContact CD2-O 3.29Å; S346-L348 PolarHBondContact O-N 3.48Å; S346-L348 VanDerWaalsContact O-N 3.15Å; L348-K355 PolarHBondContact O-NZ 3.46Å
349E86.4Confident89.2Confident89 Ų8984.4 Ų84.442%0.41644%0.441SS..THydrogen-bonded Turntrans-87.3-26.5-178.3-69.3178.6-119.700114.1F302 R305 S346 V351F302-E349 WeakPolarHBondContact CE2-O 3.11Å; R305-E349 IonicContact CZ-OE2 3.82Å; R305-E349 IonicContact NE-OE2 2.66Å; R305-E349 IonicContact NH2-OE2 3.48Å; R305-E349 PolarHBondContact NH2-OE2 3.19Å; S346-E349 CarbonylContact O-C 3.56Å; S346-E349 PolarHBondContact O-N 2.98Å; S346-E349 WeakPolarHBondContact OG-CG 3.31Å; S346-E349 PolarHBondContact OG-N 3.2Å; S346-E349 PolarHBondContact OG-OE1 3.42Å; E349-V351 PolarHBondContact O-N 3Å
350K92Very high89.6Confident93 Ų9379.7 Ų79.740%0.40442%0.419SS..  trans-58.4128.3-177.2-175.4177.9179.3-177.40111.9S346 K355S346-K350 WeakPolarHBondContact O-CB 3.41Å; S346-K350 PolarHBondContact O-N 3.11Å; K350-K355 PolarHBondContact O-NZ 2.92Å
351V94.9Very high90.1Very high2 Ų273.5 Ų73.51%0.01240%0.395CS..  trans-77.4143.2172.4-171.90000109.4F302 W304 A331 C334 N335 I338 E349 V356F302-V351 HydrophobicContact CZ-CG2 4.17Å; W304-V351 HydrophobicContact CH2-CG1 4.07Å; W304-V351 HydrophobicContact CZ3-CG1 3.8Å; W304-V351 HydrophobicContact CZ3-CG2 4.18Å; A331-V351 HydrophobicContact CB-CG1 4.02Å; C334-V351 HydrophobicContact CB-CB 4.14Å; C334-V351 HydrophobicContact CB-CG1 4.08Å; C334-V351 HydrophobicContact CB-CG2 3.92Å; N335-V351 PolarHBondContact ND2-O 2.96Å; N335-V351 PolarHBondContact OD1-N 2.97Å; I338-V351 HydrophobicContact CD1-CG2 4.1Å; E349-V351 PolarHBondContact O-N 3Å; V351-V356 HydrophobicContact CG1-CG2 3.76Å
352T95.9Very high90.9Very high58 Ų5871.1 Ų71.136%0.35638%0.375SS..  trans-133.3158.1178.662.30000109.8L354 K355 V356T352-L354 PolarHBondContact O-N 3.18Å; T352-K355 WeakPolarHBondContact O-CA 3.43Å; T352-K355 WeakPolarHBondContact O-CB 3.32Å; T352-K355 PolarHBondContact O-N 3.07Å; T352-K355 WeakPolarHBondContact OG1-CG 3.19Å; T352-K355 PolarHBondContact OG1-N 3.25Å; T352-V356 PolarHBondContact O-N 2.86Å
353S96.2Very high91.8Very high21 Ų2170.3 Ų70.315%0.14734%0.344CS..Hα-helixtrans-54.2-40.6178.765.30000112.1E324 K355 V356 Y357E324-S353 WeakPolarHBondContact OE1-CB 3.21Å; E324-S353 PolarHBondContact OE1-OG 3.06Å; S353-K355 PolarHBondContact O-N 3Å; S353-V356 CarbonylContact O-C 3.59Å; S353-V356 WeakPolarHBondContact O-CB 3.48Å; S353-V356 PolarHBondContact O-N 2.65Å; S353-V356 VanDerWaalsContact O-N 3.16Å; S353-Y357 WeakPolarHBondContact O-CB 3.47Å; S353-Y357 PolarHBondContact O-N 2.98Å
354L95.8Very high92.4Very high112 Ų11265.7 Ų65.759%0.58632%0.322SS*.Hα-helixtrans-62.3-37.2174.5-178.162.2000113.2T352 N358T352-L354 PolarHBondContact O-N 3.18Å; L354-N358 PolarHBondContact O-N 3.42Å; L354-N358 PolarHBondContact O-ND2 3.21Å
355K94.9Very high92.9Very high44 Ų4462.3 Ų62.319%0.19131%0.308CS..Hα-helixtrans-64.5-45.7173-74.1171.1171.9-175.60109.7F302 W304 L348 K350 T352 S353 N358 W359F302-K355 HydrophobicContact CD1-CD 3.71Å; F302-K355 HydrophobicContact CD1-CG 4.17Å; F302-K355 HydrophobicContact CD2-CD 4.35Å; F302-K355 VanDerWaalsContact CD2-NZ 3.27Å; F302-K355 HydrophobicContact CE1-CB 4.28Å; F302-K355 HydrophobicContact CE1-CD 3.65Å; F302-K355 HydrophobicContact CE1-CG 4.14Å; F302-K355 HydrophobicContact CE2-CD 4.29Å; F302-K355 HydrophobicContact CG-CD 4.06Å; F302-K355 HydrophobicContact CZ-CD 3.95Å; W304-K355 HydrophobicContact CH2-CB 3.81Å; W304-K355 HydrophobicContact CZ2-CB 4.05Å; W304-K355 WeakPolarHBondContact CZ2-O 3.41Å; L348-K355 PolarHBondContact O-NZ 3.46Å; K350-K355 PolarHBondContact O-NZ 2.92Å; T352-K355 WeakPolarHBondContact O-CA 3.43Å; T352-K355 WeakPolarHBondContact O-CB 3.32Å; T352-K355 PolarHBondContact O-N 3.07Å; T352-K355 WeakPolarHBondContact OG1-CG 3.19Å; T352-K355 PolarHBondContact OG1-N 3.25Å; S353-K355 PolarHBondContact O-N 3Å; K355-N358 PolarHBondContact O-N 3.13Å; K355-W359 PolarHBondContact O-N 3.08Å
356V96.9Very high93.3Very high0 Ų062.9 Ų62.90%031%0.309CS..Hα-helixtrans-61.3-48.8177177.70000111.5M312 R327 I330 A331 V351 T352 S353 N358 W359 F360M312-V356 HydrophobicContact SD-CG1 4.39Å; M312-V356 HydrophobicContact SD-CG2 4.24Å; R327-V356 HydrophobicContact CB-CG1 4.41Å; R327-V356 HydrophobicContact CG-CG1 4.33Å; I330-V356 HydrophobicContact CB-CG1 4.08Å; I330-V356 HydrophobicContact CD1-CG1 4.46Å; I330-V356 HydrophobicContact CG2-CG1 3.65Å; I330-V356 HydrophobicContact CG2-CG2 4.06Å; A331-V356 HydrophobicContact CB-CG2 3.91Å; V351-V356 HydrophobicContact CG1-CG2 3.76Å; T352-V356 PolarHBondContact O-N 2.86Å; S353-V356 CarbonylContact O-C 3.59Å; S353-V356 WeakPolarHBondContact O-CB 3.48Å; S353-V356 PolarHBondContact O-N 2.65Å; S353-V356 VanDerWaalsContact O-N 3.16Å; V356-N358 VanDerWaalsContact C-N 3.29Å; V356-N358 PolarHBondContact O-N 3.3Å; V356-W359 WeakPolarHBondContact O-CA 3.09Å; V356-W359 WeakPolarHBondContact O-CB 3.48Å; V356-W359 PolarHBondContact O-N 3.21Å; V356-F360 HydrophobicContact CG1-CD2 3.63Å; V356-F360 HydrophobicContact CG1-CE2 3.64Å; V356-F360 WeakPolarHBondContact O-CD2 3.45Å; V356-F360 PolarHBondContact O-N 3.31Å
357Y96.9Very high93.6Very high101 Ų10163.9 Ų63.940%0.39631%0.31SS..Hα-helixtrans-50.5-48.6175.2174.4-104000112.1S353 W359 F360 A361S353-Y357 WeakPolarHBondContact O-CB 3.47Å; S353-Y357 PolarHBondContact O-N 2.98Å; Y357-W359 VanDerWaalsContact C-N 3.32Å; Y357-W359 PolarHBondContact O-N 2.79Å; Y357-F360 PolarHBondContact O-N 3.28Å; Y357-A361 VanDerWaalsContact O-CB 3.23Å; Y357-A361 WeakPolarHBondContact O-CB 3.42Å; Y357-A361 PolarHBondContact O-N 2.96Å
358N96.5Very high94.1Very high77 Ų7764.2 Ų64.241%0.41231%0.305SS..Hα-helixtrans-66.8-31.9178.8-82.6-80.4000112.6L354 K355 V356 N362L354-N358 PolarHBondContact O-N 3.42Å; L354-N358 PolarHBondContact O-ND2 3.21Å; K355-N358 PolarHBondContact O-N 3.13Å; V356-N358 VanDerWaalsContact C-N 3.29Å; V356-N358 PolarHBondContact O-N 3.3Å; N358-N362 WeakPolarHBondContact O-CB 3.38Å; N358-N362 VanDerWaalsContact O-CG 3.24Å; N358-N362 PolarHBondContact O-N 3.44Å; N358-N362 PolarHBondContact O-ND2 3.16Å
359W96.8Very high94.3Very high27 Ų2765.3 Ų65.310%0.10230%0.301CS..Hα-helixtrans-66.8-52.8172.6-172.498000111W304 L309 M312 E313 F316 K355 V356 Y357 A361 N362 R363W304-W359 AromaticContact CE2-CD1 3.76Å; W304-W359 HydrophobicContact CH2-CB 4.37Å; W304-W359 HydrophobicContact CZ2-CB 3.74Å; W304-W359 HydrophobicContact CZ2-CG 4.27Å; W304-W359 AromaticContact NE1-CD1 3.66Å; L309-W359 HydrophobicContact CD2-CZ2 4.42Å; M312-W359 HydrophobicContact CB-CD2 4.14Å; M312-W359 HydrophobicContact CB-CE3 3.88Å; M312-W359 HydrophobicContact CB-CH2 3.93Å; M312-W359 HydrophobicContact CB-CZ2 4.17Å; M312-W359 HydrophobicContact CB-CZ3 3.78Å; M312-W359 HydrophobicContact CE-CB 4.25Å; M312-W359 VanDerWaalsContact CE-CD1 3.47Å; M312-W359 HydrophobicContact CE-CD2 3.78Å; M312-W359 HydrophobicContact CE-CG 3.59Å; M312-W359 HydrophobicContact SD-CB 3.94Å; M312-W359 HydrophobicContact SD-CD2 3.87Å; M312-W359 HydrophobicContact SD-CE3 4.15Å; M312-W359 HydrophobicContact SD-CG 3.76Å; E313-W359 HydrophobicContact CB-CH2 4.48Å; E313-W359 HydrophobicContact CG-CH2 3.62Å; E313-W359 HydrophobicContact CG-CZ2 3.73Å; F316-W359 HydrophobicContact CB-CH2 4.36Å; F316-W359 HydrophobicContact CB-CZ3 4.04Å; F316-W359 AromaticContact CD2-CZ3 3.91Å; F316-W359 HydrophobicContact CD2-CZ3 3.91Å; F316-W359 HydrophobicContact CG-CZ3 4.21Å; K355-W359 PolarHBondContact O-N 3.08Å; V356-W359 WeakPolarHBondContact O-CA 3.09Å; V356-W359 WeakPolarHBondContact O-CB 3.48Å; V356-W359 PolarHBondContact O-N 3.21Å; Y357-W359 VanDerWaalsContact C-N 3.32Å; Y357-W359 PolarHBondContact O-N 2.79Å; W359-A361 PolarHBondContact O-N 2.88Å; W359-N362 CarbonylContact O-C 3.59Å; W359-N362 PolarHBondContact O-N 3.1Å; W359-R363 HydrophobicContact CE3-CB 4.19Å; W359-R363 HydrophobicContact CH2-CB 4.22Å; W359-R363 HydrophobicContact CH2-CG 3.93Å; W359-R363 HydrophobicContact CZ3-CB 3.98Å; W359-R363 HydrophobicContact CZ3-CG 4.04Å; W359-R363 PolarHBondContact O-N 2.98Å
360F97.5Very high94.3Very high2 Ų267.4 Ų67.41%0.00931%0.306CS..Hα-helixtrans-58.5-45.7178.7-85.9-106.3000111.8M312 F316 N319 P322 I330 V356 Y357 N362 R363 R364M312-F360 HydrophobicContact CB-CE2 4.21Å; M312-F360 HydrophobicContact CG-CE2 4.31Å; F316-F360 HydrophobicContact CB-CE1 3.91Å; F316-F360 HydrophobicContact CB-CZ 4.19Å; F316-F360 AromaticContact CD2-CD1 3.55Å; F316-F360 HydrophobicContact CD2-CD1 3.55Å; F316-F360 AromaticContact CD2-CE1 3.73Å; F316-F360 HydrophobicContact CD2-CE1 3.73Å; F316-F360 HydrophobicContact CD2-CG 4.25Å; F316-F360 HydrophobicContact CE2-CD1 4.2Å; F316-F360 HydrophobicContact CG-CE1 4.28Å; N319-F360 WeakPolarHBondContact O-CE1 3.36Å; P322-F360 HydrophobicContact CG-CD1 3.57Å; P322-F360 HydrophobicContact CG-CD2 4.3Å; P322-F360 HydrophobicContact CG-CE1 3.66Å; P322-F360 HydrophobicContact CG-CE2 4.41Å; P322-F360 HydrophobicContact CG-CG 3.92Å; P322-F360 HydrophobicContact CG-CZ 4.11Å; I330-F360 HydrophobicContact CD1-CE2 4.1Å; I330-F360 HydrophobicContact CD1-CZ 3.85Å; I330-F360 HydrophobicContact CG2-CE2 4.46Å; V356-F360 HydrophobicContact CG1-CD2 3.63Å; V356-F360 HydrophobicContact CG1-CE2 3.64Å; V356-F360 WeakPolarHBondContact O-CD2 3.45Å; V356-F360 PolarHBondContact O-N 3.31Å; Y357-F360 PolarHBondContact O-N 3.28Å; F360-N362 PolarHBondContact O-N 3.31Å; F360-R363 PolarHBondContact O-N 3.37Å; F360-R364 WeakPolarHBondContact O-CG 3.45Å; F360-R364 PolarHBondContact O-N 2.86Å
361A95.1Very high94Very high14 Ų1464.9 Ų64.912%0.11630%0.302CS..Hα-helixtrans-63.3-25.6177.400000113.6Y357 W359 K365Y357-A361 VanDerWaalsContact O-CB 3.23Å; Y357-A361 WeakPolarHBondContact O-CB 3.42Å; Y357-A361 PolarHBondContact O-N 2.96Å; W359-A361 PolarHBondContact O-N 2.88Å; A361-K365 WeakPolarHBondContact O-CD 3.49Å; A361-K365 WeakPolarHBondContact O-CE 3.44Å; A361-K365 WeakPolarHBondContact O-CG 3.45Å
362N95.4Very high93.3Very high82 Ų8269.7 Ų69.744%0.43933%0.328SS..Hα-helixtrans-89.6-32.8174-70.3-35.3000112.5N358 W359 F360 K365 E366N358-N362 WeakPolarHBondContact O-CB 3.38Å; N358-N362 VanDerWaalsContact O-CG 3.24Å; N358-N362 PolarHBondContact O-N 3.44Å; N358-N362 PolarHBondContact O-ND2 3.16Å; W359-N362 CarbonylContact O-C 3.59Å; W359-N362 PolarHBondContact O-N 3.1Å; F360-N362 PolarHBondContact O-N 3.31Å; N362-K365 WeakPolarHBondContact O-CB 3.38Å; N362-K365 PolarHBondContact O-N 3.16Å; N362-K365 PolarHBondContact OD1-NZ 2.87Å; N362-K365 VanDerWaalsContact OD1-NZ 3.13Å; N362-E366 WeakPolarHBondContact O-CB 3.27Å; N362-E366 PolarHBondContact O-N 3.25Å
363R95.4Very high92.6Very high72 Ų7271.7 Ų71.727%0.27234%0.335SS..Hα-helixtrans-61.8-42.3173.9-175.357.5166.9-129.8-6.4111.9E313 F316 W359 F360 K365 E366 I367E313-R363 IonicContact OE1-CZ 2.74Å; E313-R363 IonicContact OE1-NH1 3.8Å; E313-R363 PolarHBondContact OE1-NH1 3.05Å; E313-R363 IonicContact OE1-NH2 2.65Å; E313-R363 PolarHBondContact OE1-NH2 3.41Å; F316-R363 HydrophobicContact CD1-CG 4.09Å; F316-R363 HydrophobicContact CD2-CB 4.05Å; F316-R363 HydrophobicContact CD2-CG 3.7Å; F316-R363 HydrophobicContact CE1-CG 3.91Å; F316-R363 HydrophobicContact CE2-CB 3.7Å; F316-R363 HydrophobicContact CE2-CG 3.49Å; F316-R363 VanDerWaalsContact CE2-CG 3.49Å; F316-R363 HydrophobicContact CG-CG 4.02Å; F316-R363 HydrophobicContact CZ-CB 4.19Å; F316-R363 HydrophobicContact CZ-CG 3.62Å; W359-R363 HydrophobicContact CE3-CB 4.19Å; W359-R363 HydrophobicContact CH2-CB 4.22Å; W359-R363 HydrophobicContact CH2-CG 3.93Å; W359-R363 HydrophobicContact CZ3-CB 3.98Å; W359-R363 HydrophobicContact CZ3-CG 4.04Å; W359-R363 PolarHBondContact O-N 2.98Å; F360-R363 PolarHBondContact O-N 3.37Å; R363-K365 VanDerWaalsContact C-N 3.34Å; R363-K365 PolarHBondContact O-N 2.89Å; R363-E366 WeakPolarHBondContact O-CB 3.35Å; R363-E366 PolarHBondContact O-N 2.99Å; R363-I367 HydrophobicContact CG-CD1 4.21Å; R363-I367 WeakPolarHBondContact O-CG1 3.45Å; R363-I367 PolarHBondContact O-N 3.46Å
364R95.7Very high91.7Very high55 Ų5576 Ų7621%0.20835%0.353CS..Hα-helixtrans-60.3-39.1172.6-64.6-168.3-59-102.35.6112.9F316 Q320 Y321 F360 K368F316-R364 HydrophobicContact CE2-CG 3.74Å; F316-R364 HydrophobicContact CZ-CG 3.81Å; Q320-R364 HydrophobicContact CB-CG 4.46Å; Q320-R364 WeakPolarHBondContact O-CD 3.5Å; Q320-R364 PolarHBondContact O-NH1 2.87Å; Y321-R364 VanDerWaalsContact CE1-CZ 3.43Å; Y321-R364 VanDerWaalsContact CE1-NE 3.27Å; F360-R364 WeakPolarHBondContact O-CG 3.45Å; F360-R364 PolarHBondContact O-N 2.86Å; R364-K368 PolarHBondContact O-N 3.43Å
365K94.3Very high90.6Very high129 Ų12976.6 Ų76.656%0.56135%0.353SS*.Hα-helixtrans-70.1-36.1175.3-65.9169.8-164.7163.60112.5A361 N362 R363 R369A361-K365 WeakPolarHBondContact O-CD 3.49Å; A361-K365 WeakPolarHBondContact O-CE 3.44Å; A361-K365 WeakPolarHBondContact O-CG 3.45Å; N362-K365 WeakPolarHBondContact O-CB 3.38Å; N362-K365 PolarHBondContact O-N 3.16Å; N362-K365 PolarHBondContact OD1-NZ 2.87Å; N362-K365 VanDerWaalsContact OD1-NZ 3.13Å; R363-K365 VanDerWaalsContact C-N 3.34Å; R363-K365 PolarHBondContact O-N 2.89Å; K365-R369 PolarHBondContact O-N 3.1Å
366E93.1Very high89.5Confident48 Ų4877 Ų7722%0.22436%0.364CS..Hα-helixtrans-65.3-48.4178.4-178.963.4-165.200110.9N362 R363 K368 R369 R370N362-E366 WeakPolarHBondContact O-CB 3.27Å; N362-E366 PolarHBondContact O-N 3.25Å; R363-E366 WeakPolarHBondContact O-CB 3.35Å; R363-E366 PolarHBondContact O-N 2.99Å; E366-K368 PolarHBondContact O-N 2.8Å; E366-R369 PolarHBondContact O-N 3.07Å; E366-R369 VanDerWaalsContact O-N 3.08Å; E366-R369 IonicContact OE1-NH1 3.11Å; E366-R369 IonicContact OE2-CZ 2.69Å; E366-R369 IonicContact OE2-NH1 2.89Å; E366-R369 PolarHBondContact OE2-NH1 3.26Å; E366-R369 IonicContact OE2-NH2 3.75Å; E366-R369 PolarHBondContact OE2-NH2 2.68Å; E366-R370 WeakPolarHBondContact O-CG 3.23Å; E366-R370 PolarHBondContact O-N 3.31Å; E366-R370 IonicContact OE1-CZ 3.44Å; E366-R370 IonicContact OE1-NE 2.66Å; E366-R370 PolarHBondContact OE1-NE 3.11Å; E366-R370 IonicContact OE1-NH2 2.68Å; E366-R370 PolarHBondContact OE1-NH2 3.38Å
367I89.7Confident88.4Confident70 Ų7079.3 Ų79.336%0.35938%0.383SS..Hα-helixtrans-58.9-47.2175.9-68.3166.1000110.6F316 R363 R369 R370 A371F316-I367 HydrophobicContact CD1-CD1 4.38Å; F316-I367 HydrophobicContact CE1-CD1 3.31Å; F316-I367 HydrophobicContact CZ-CD1 3.61Å; R363-I367 HydrophobicContact CG-CD1 4.21Å; R363-I367 WeakPolarHBondContact O-CG1 3.45Å; R363-I367 PolarHBondContact O-N 3.46Å; I367-R369 VanDerWaalsContact C-N 3.28Å; I367-R369 PolarHBondContact O-N 2.99Å; I367-R370 PolarHBondContact O-N 2.71Å; I367-R370 VanDerWaalsContact O-N 3.13Å; I367-A371 PolarHBondContact O-N 2.63Å
368K92.6Very high86.8Confident144 Ų14478.7 Ų78.763%0.62639%0.386SS*.Hα-helixtrans-60.8-34.7175.4-176162.9-176.31640112.8R364 E366 N372R364-K368 PolarHBondContact O-N 3.43Å; E366-K368 PolarHBondContact O-N 2.8Å; K368-N372 WeakPolarHBondContact O-CB 3.17Å; K368-N372 PolarHBondContact O-N 2.96Å; K368-N372 VanDerWaalsContact O-N 3.16Å; K368-N372 PolarHBondContact O-OD1 3.34Å
369R87.9Confident84.9Confident131 Ų13181.3 Ų81.349%0.49440%0.399SS..Hα-helixtrans-69.8-38.3175.1-156-164.8-46.2109.119.8111.9K365 E366 I367 N372 I373K365-R369 PolarHBondContact O-N 3.1Å; E366-R369 PolarHBondContact O-N 3.07Å; E366-R369 VanDerWaalsContact O-N 3.08Å; E366-R369 IonicContact OE1-NH1 3.11Å; E366-R369 IonicContact OE2-CZ 2.69Å; E366-R369 IonicContact OE2-NH1 2.89Å; E366-R369 PolarHBondContact OE2-NH1 3.26Å; E366-R369 IonicContact OE2-NH2 3.75Å; E366-R369 PolarHBondContact OE2-NH2 2.68Å; I367-R369 VanDerWaalsContact C-N 3.28Å; I367-R369 PolarHBondContact O-N 2.99Å; R369-N372 PolarHBondContact O-N 3.48Å; R369-I373 HydrophobicContact CG-CD1 4.05Å; R369-I373 WeakPolarHBondContact O-CD1 3.34Å; R369-I373 VanDerWaalsContact O-CG1 3.26Å; R369-I373 WeakPolarHBondContact O-CG1 3.07Å; R369-I373 PolarHBondContact O-N 3.32Å; R369-I373 VanDerWaalsContact O-N 3.1Å
370R86.6Confident83Confident133 Ų13388 Ų8850%0.50243%0.432SS..Hα-helixtrans-66-50.1178.5-71.7-179.8-170.1-151.8-1.5111.7E366 I367 N372 I373 E374E366-R370 WeakPolarHBondContact O-CG 3.23Å; E366-R370 PolarHBondContact O-N 3.31Å; E366-R370 IonicContact OE1-CZ 3.44Å; E366-R370 IonicContact OE1-NE 2.66Å; E366-R370 PolarHBondContact OE1-NE 3.11Å; E366-R370 IonicContact OE1-NH2 2.68Å; E366-R370 PolarHBondContact OE1-NH2 3.38Å; I367-R370 PolarHBondContact O-N 2.71Å; I367-R370 VanDerWaalsContact O-N 3.13Å; R370-N372 VanDerWaalsContact C-N 3.3Å; R370-N372 PolarHBondContact O-N 3.44Å; R370-I373 CarbonylContact O-C 3.54Å; R370-I373 WeakPolarHBondContact O-CA 3.25Å; R370-I373 PolarHBondContact O-N 3.46Å; R370-E374 WeakPolarHBondContact O-CB 3.4Å; R370-E374 WeakPolarHBondContact O-CG 3.38Å; R370-E374 PolarHBondContact O-N 3.23Å
371A86.4Confident80.9Confident40 Ų4092 Ų9233%0.33146%0.46SS..Hα-helixtrans-52.8-48.5172.500000111.3I367 I373 E374 E375I367-A371 PolarHBondContact O-N 2.63Å; A371-I373 PolarHBondContact O-N 2.95Å; A371-I373 VanDerWaalsContact O-N 3.16Å; A371-E374 PolarHBondContact O-N 3.26Å; A371-E375 VanDerWaalsContact O-CB 3.25Å; A371-E375 WeakPolarHBondContact O-CB 3.48Å; A371-E375 WeakPolarHBondContact O-CG 3.18Å; A371-E375 PolarHBondContact O-N 2.81Å
372N79Confident79Confident103 Ų10397.7 Ų97.755%0.55148%0.484SS*.Hα-helixtrans-60.8-21.9175.5-86.363000115.3K368 R369 R370 A376K368-N372 WeakPolarHBondContact O-CB 3.17Å; K368-N372 PolarHBondContact O-N 2.96Å; K368-N372 VanDerWaalsContact O-N 3.16Å; K368-N372 PolarHBondContact O-OD1 3.34Å; R369-N372 PolarHBondContact O-N 3.48Å; R370-N372 VanDerWaalsContact C-N 3.3Å; R370-N372 PolarHBondContact O-N 3.44Å; N372-A376 WeakPolarHBondContact O-CB 3.44Å
373I81.1Confident76.6Confident100 Ų10096.6 Ų96.651%0.51349%0.492SS..Hα-helixtrans-92.2-39.2177.1-70.6164.4000110.5R369 R370 A371 A376 A377R369-I373 HydrophobicContact CG-CD1 4.05Å; R369-I373 WeakPolarHBondContact O-CD1 3.34Å; R369-I373 VanDerWaalsContact O-CG1 3.26Å; R369-I373 WeakPolarHBondContact O-CG1 3.07Å; R369-I373 PolarHBondContact O-N 3.32Å; R369-I373 VanDerWaalsContact O-N 3.1Å; R370-I373 CarbonylContact O-C 3.54Å; R370-I373 WeakPolarHBondContact O-CA 3.25Å; R370-I373 PolarHBondContact O-N 3.46Å; A371-I373 PolarHBondContact O-N 2.95Å; A371-I373 VanDerWaalsContact O-N 3.16Å; I373-A376 PolarHBondContact O-N 2.75Å; I373-A377 WeakPolarHBondContact O-CB 3.13Å; I373-A377 PolarHBondContact O-N 3.31Å
374E78.1Confident74.4Confident112 Ų112100.4 Ų100.452%0.52352%0.516SS..Hα-helixtrans-65.8-46.3176.1-72.1154-169.500110.3R370 A371 A376 A377 I378R370-E374 WeakPolarHBondContact O-CB 3.4Å; R370-E374 WeakPolarHBondContact O-CG 3.38Å; R370-E374 PolarHBondContact O-N 3.23Å; A371-E374 PolarHBondContact O-N 3.26Å; E374-A376 VanDerWaalsContact C-N 3.32Å; E374-A376 PolarHBondContact O-N 3.14Å; E374-A377 PolarHBondContact O-N 3.39Å; E374-I378 WeakPolarHBondContact O-CB 3.25Å; E374-I378 WeakPolarHBondContact O-CD1 3.44Å; E374-I378 WeakPolarHBondContact O-CG1 3.43Å; E374-I378 PolarHBondContact O-N 3.42Å
375E72.3Confident71.8Confident125 Ų125105.1 Ų105.158%0.58455%0.545SS*.Hα-helixtrans-56.1-42.8170-70.5-78.2165.200112.2A371 I378 L379A371-E375 VanDerWaalsContact O-CB 3.25Å; A371-E375 WeakPolarHBondContact O-CB 3.48Å; A371-E375 WeakPolarHBondContact O-CG 3.18Å; A371-E375 PolarHBondContact O-N 2.81Å; E375-I378 PolarHBondContact O-N 2.83Å; E375-L379 WeakPolarHBondContact O-CB 3.45Å; E375-L379 WeakPolarHBondContact O-CG 3.43Å; E375-L379 PolarHBondContact O-N 3.39Å
376A73.3Confident69.2Low51 Ų51104.1 Ų104.142%0.42155%0.55SS.*Hα-helixtrans-67.8-41.2178.300000112N372 I373 E374 L379 E380N372-A376 WeakPolarHBondContact O-CB 3.44Å; I373-A376 PolarHBondContact O-N 2.75Å; E374-A376 VanDerWaalsContact C-N 3.32Å; E374-A376 PolarHBondContact O-N 3.14Å; A376-L379 PolarHBondContact O-N 2.7Å; A376-E380 WeakPolarHBondContact O-CB 3.41Å; A376-E380 PolarHBondContact O-N 3.08Å
377A71.8Confident66.6Low49 Ų49110.1 Ų110.141%0.40558%0.578SS.*Hα-helixtrans-69.5-31.5175.900000112.5I373 E374 E380 S381I373-A377 WeakPolarHBondContact O-CB 3.13Å; I373-A377 PolarHBondContact O-N 3.31Å; E374-A377 PolarHBondContact O-N 3.39Å; A377-E380 PolarHBondContact O-N 2.84Å; A377-S381 WeakPolarHBondContact O-CB 3.5Å; A377-S381 PolarHBondContact O-N 2.92Å
378I63.3Low64Low88 Ų88111.6 Ų111.645%0.45159%0.594SS.*Hα-helixtrans-71.8-37.7173.6-70.5164.4000110.6E374 E375 E380 S381 H382E374-I378 WeakPolarHBondContact O-CB 3.25Å; E374-I378 WeakPolarHBondContact O-CD1 3.44Å; E374-I378 WeakPolarHBondContact O-CG1 3.43Å; E374-I378 PolarHBondContact O-N 3.42Å; E375-I378 PolarHBondContact O-N 2.83Å; I378-E380 VanDerWaalsContact C-N 3.33Å; I378-S381 PolarHBondContact O-N 3.1Å; I378-S381 PolarHBondContact O-OG 3Å; I378-S381 VanDerWaalsContact O-OG 3.08Å; I378-H382 WeakPolarHBondContact O-CB 3.36Å; I378-H382 PolarHBondContact O-N 3.38Å; I378-H382 PolarHBondContact O-ND1 2.84Å
379L58.4Low61.5Low133 Ų133110.7 Ų110.770%0.69660%0.604SS**Hα-helixtrans-67-32.9170.2-79.6162.4000112.5E375 A376E375-L379 WeakPolarHBondContact O-CB 3.45Å; E375-L379 WeakPolarHBondContact O-CG 3.43Å; E375-L379 PolarHBondContact O-N 3.39Å; A376-L379 PolarHBondContact O-N 2.7Å
380E55.5Low58.9Low167 Ų167107.1 Ų107.178%0.7861%0.607SS**Hα-helixtrans-73.9-31.1173.7-169.4168.4-156.500112.2A376 A377 I378A376-E380 WeakPolarHBondContact O-CB 3.41Å; A376-E380 PolarHBondContact O-N 3.08Å; A377-E380 PolarHBondContact O-N 2.84Å; I378-E380 VanDerWaalsContact C-N 3.33Å
381S53.3Low56.3Low87 Ų87104.6 Ų104.661%0.60862%0.623SS**Hα-helixtrans-81.2-26.6175.876.60000113.9A377 I378 G383A377-S381 WeakPolarHBondContact O-CB 3.5Å; A377-S381 PolarHBondContact O-N 2.92Å; I378-S381 PolarHBondContact O-N 3.1Å; I378-S381 PolarHBondContact O-OG 3Å; I378-S381 VanDerWaalsContact O-OG 3.08Å; S381-G383 PolarHBondContact O-N 2.96Å
382H56.5Low54Low133 Ų133111.1 Ų111.162%0.61665%0.646SS**SBendtrans-8257.4171.8-72.284.2000110.9I378 I384I378-H382 WeakPolarHBondContact O-CB 3.36Å; I378-H382 PolarHBondContact O-N 3.38Å; I378-H382 PolarHBondContact O-ND1 2.84Å; H382-I384 PolarHBondContact O-N 2.79Å; H382-I384 VanDerWaalsContact O-N 3.1Å
383G44.9Very low51.9Low59 Ų59111.6 Ų111.661%0.60866%0.658SS**  trans-56.6114.3169.400000109.9S381 D385S381-G383 PolarHBondContact O-N 2.96Å; G383-D385 PolarHBondContact O-N 2.87Å; G383-D385 VanDerWaalsContact O-N 3.07Å
384I48.1Very low49.8Very low152 Ų152115 Ų11578%0.77968%0.677SS**  trans-74.7101.2176.4-57.7176000107.4H382 V386H382-I384 PolarHBondContact O-N 2.79Å; H382-I384 VanDerWaalsContact O-N 3.1Å; I384-V386 VanDerWaalsContact C-N 3.28Å; I384-V386 HydrophobicContact CG2-CG2 4.04Å; I384-V386 PolarHBondContact O-N 3.07Å
385D42.8Very low47.7Very low153 Ų153113.5 Ų113.582%0.81869%0.691SS**  trans-63.191165.8-110.1-62.7000109.2G383 Q387G383-D385 PolarHBondContact O-N 2.87Å; G383-D385 VanDerWaalsContact O-N 3.07Å; D385-Q387 PolarHBondContact O-N 2.89Å
386V38.2Very low46.4Very low109 Ų109114.8 Ų114.866%0.66170%0.702SS**  trans-71.486.4167.8171.70000107.5I384 S388I384-V386 VanDerWaalsContact C-N 3.28Å; I384-V386 HydrophobicContact CG2-CG2 4.04Å; I384-V386 PolarHBondContact O-N 3.07Å; V386-S388 PolarHBondContact O-N 2.97Å
387Q39.8Very low45Very low173 Ų173119 Ų11981%0.80872%0.717SS**  trans-54.8106.7163.4-159.299.776.500107.4D385 P389D385-Q387 PolarHBondContact O-N 2.89Å; Q387-P389 WeakPolarHBondContact O-CD 3.41Å
388S34.3Very low43.5Very low101 Ų101123.3 Ų123.371%0.70673%0.732SS**PPolyproline II helixtrans-59.7125-179.4-64.80000109.5V386 G390V386-S388 PolarHBondContact O-N 2.97Å; S388-G390 PolarHBondContact O-N 3.28Å
389P40.3Very low42.6Very low126 Ų126127.7 Ų127.782%0.81875%0.751SS**PPolyproline II helixtrans-57.2128.3178.2-26.235.5000110.8Q387 G391Q387-P389 WeakPolarHBondContact O-CD 3.41Å; P389-G391 PolarHBondContact O-N 3.25Å
390G32.8Very low41.5Very low55 Ų55124.7 Ų124.757%0.56775%0.752SS**PPolyproline II helixtrans-61.2126.2-176.100000112S388 H392S388-G390 PolarHBondContact O-N 3.28Å; G390-H392 VanDerWaalsContact C-N 3.32Å; G390-H392 PolarHBondContact O-CD2 3.33Å; G390-H392 VanDerWaalsContact O-CD2 3.25Å; G390-H392 PolarHBondContact O-N 3.27Å
391G33.1Very low40.3Very low81 Ų81123.9 Ų123.984%0.83575%0.753SS**  trans-71.583.617300000111.4P389 S393P389-G391 PolarHBondContact O-N 3.25Å; G391-S393 PolarHBondContact O-N 2.92Å
392H38Very low39.4Very low176 Ų176125.5 Ų125.582%0.81576%0.755SS**  trans-72.9110.5168.5-62.5-85.8000109.2G390G390-H392 VanDerWaalsContact C-N 3.32Å; G390-H392 PolarHBondContact O-CD2 3.33Å; G390-H392 VanDerWaalsContact O-CD2 3.25Å; G390-H392 PolarHBondContact O-N 3.27Å
393S33.9Very low38.4Very low114 Ų114128.4 Ų128.480%0.79777%0.766SS**  trans-151.4116.8168.5-72.50000108.9G391G391-S393 PolarHBondContact O-N 2.92Å
394N37.6Very low38.8Very low172 Ų172130.5 Ų130.592%0.9277%0.769SS**  trans-72.3134.9174.8-61.3-2.7000108.7
395G34.4Very low38Very low80 Ų80129.5 Ų129.583%0.82577%0.765SS**  trans-131.1107.4165.300000107.2
396D44.2Very low37.6Very low152 Ų152130.1 Ų130.181%0.81376%0.763SS**  trans-105178.5176.4-139.5-42.9000109.7
397D43.2Very low37.1Very low138 Ų138128.5 Ų128.574%0.73877%0.768SS**  trans75.7130.6168.6-66.5-56.4000120.6
398I41.8Very low36.8Very low140 Ų140126.7 Ų126.772%0.71877%0.773SS**  trans8485.6145.3-9759.4000121
399E44.4Very low36.4Very low181 Ų181131.3 Ų131.385%0.84678%0.784SS**  33.1132.2104-169173.8-160.900120.3
400G34.2Very low35.9Very low70 Ų70129.9 Ų129.972%0.72278%0.783SS**  trans153.698.1152.500000120.6
401N31.3Very low36.5Very low150 Ų150132.8 Ų132.880%0.80279%0.791SS**  trans60.395.8133-160.399000123
402D34.8Very low36.4Very low121 Ų121136 Ų13665%0.64779%0.789SS**  46.4113.2110.5-138.8-37.1000121.9
403F33.9Very low36Very low194 Ų194135.5 Ų135.585%0.85178%0.784SS**  -175.2159111.7-114.9-114.6000111.6
404P53.1Low35.9Very low102 Ų102135.4 Ų135.466%0.66277%0.771SS**  trans-110.2179.2-168.442.1-34.4000114.7
405D32.3Very low35.7Very low131 Ų131135 Ų13570%0.70176%0.761SS**  -174.7162.2115.4-153.66.3000114.9
406Q34.4Very low35.4Very low167 Ų167142 Ų14278%0.7876%0.763SS**  trans65.9106.5150.7-87.6167.958.400123.7
407G28Very low34.7Very low74 Ų74138.7 Ų138.776%0.76376%0.757SS**  trans89.5135.4135.400000118.1
408C31.9Very low34.5Very low135 Ų135138.5 Ų138.591%0.91276%0.76SS**  cis-141.8169.7-0.6-69.60000110.4
409E26.3Very low33.9Very low199 Ų199137.9 Ų137.993%0.9376%0.763SS**  trans-89.3167.6-162.1-54-166.8145.100116.3
410A31.1Very low33.4Very low96 Ų96140.4 Ų140.479%0.79377%0.765SS**  trans-97.5-148.5-177.900000110.6
411P45.3Very low34.3Very low115 Ų115141.6 Ų141.675%0.74776%0.76SS**  cis-138.8-155.513.344.8-23.9000115.9
412L29.4Very low34.1Very low149 Ų149143.4 Ų143.478%0.7876%0.761SS**  trans88129.9158.7-133.3118.8000115.6
413F31.6Very low33.9Very low165 Ų165142.8 Ų142.872%0.72477%0.766SS**  cis-168163.4-13.6-126.6-150.8000107.5
414E31.4Very low33.6Very low112 Ų112144.6 Ų144.652%0.52377%0.767SS.*  cis-155.4165-17.1-145.9-166-17800108.3
415K33.2Very low32.8Very low164 Ų164146.8 Ų146.871%0.71377%0.773SS**  trans39.6154.7141.7-115.8144.9169.3174.30123.7
416R28.6Very low32.6Very low228 Ų228146.9 Ų146.986%0.8677%0.773SS**  cis175141.2-46.6167.5174.1177.295.6-0.5109
417A27.9Very low32.5Very low82 Ų82145.5 Ų145.568%0.67877%0.77SS**  trans66142.3168.200000116.9
418V40Very low32.4Very low134 Ų134147.3 Ų147.381%0.81277%0.771SS**  cis96.310626175.10000115
419T28.6Very low32.4Very low127 Ų127146.4 Ų146.478%0.77977%0.767SS**  trans-175.4128153.618.50000107.1
420R33.4Very low33.1Very low234 Ų234142.5 Ų142.588%0.88376%0.758SS**  68.715570-71.3-170.1178.2-149.31.7114.6
421P53.3Low33.1Very low95 Ų95143.3 Ų143.362%0.61775%0.753SS**  cis-139.4-154.1-37.942.1-23.9000112.7
422F28.6Very low32.4Very low188 Ų188147 Ų14783%0.82576%0.761SS**  trans129.6168.2152.8-70.1-62.8000118.3
423S29.5Very low32.5Very low108 Ų108145.9 Ų145.976%0.75576%0.76SS**  trans-150.3137-138-44.20000118
424R28.3Very low32.8Very low232 Ų232143.3 Ų143.388%0.87576%0.76SS**  trans69.7153.1139.2-146.3178.6-171.2168.33.7121.8
425L35.1Very low33.3Very low148 Ų148144.8 Ų144.878%0.77578%0.776SS**  trans84.7137.2168.2-58172.6000116.4
426D29.6Very low33.4Very low132 Ų132145 Ų14571%0.70679%0.785SS**  cis-162.3174.7-17-161.411.9000112
427L30.8Very low34.2Very low139 Ų139141.7 Ų141.773%0.72878%0.783SS**  trans82.5112.9155.8-77.5152.8000122.6
428S27.5Very low35.1Very low112 Ų112142.6 Ų142.678%0.78378%0.782SS**  trans109.4107.3133.5-58.50000121.3
429S31Very low35.1Very low116 Ų116141.4 Ų141.481%0.81178%0.78SS**  trans-79.7-174.2158.1-69.60000111
430P42.1Very low36.4Very low116 Ų116145.6 Ų145.675%0.75378%0.781SS**  cis-134.6-164.811.240.7-17.8000113.3
431T30Very low37Very low113 Ų113141.4 Ų141.469%0.69378%0.776SS**  cis-152.1155.57.5-30.20000110.7
432Q31.4Very low36.5Very low192 Ų192141.6 Ų141.690%0.89779%0.785SS**  trans-140.9157.8151.9-73.4-162.63.500110.9
433V30.4Very low36.9Very low126 Ų126136.3 Ų136.376%0.76478%0.776SS**  trans-126.2130.8-170.8-1790000110.7
434P38.1Very low37.1Very low112 Ų112143.2 Ų143.273%0.72779%0.786SS**PPolyproline II helixtrans-86.4133.3172.233.1-31.4000111.9
435T42Very low37.9Very low142 Ų142138.6 Ų138.687%0.87179%0.786SS**PPolyproline II helixtrans-83.1132.9174.646.40000112.2
436L36.1Very low37.8Very low169 Ų169135 Ų13589%0.88578%0.784SS**PPolyproline II helixtrans-79.6151.9-177-61.6168000113.2
437L45.5Very low38.1Very low159 Ų159135.2 Ų135.283%0.83280%0.797SS**PPolyproline II helixtrans-91.9149.7162.5-73.3170.9000110.5
438P45.9Very low38Very low100 Ų100132.3 Ų132.365%0.64980%0.8SS**PPolyproline II helixtrans-74.5142.4-174.729.7-35.3000113.7W440P438-W440 PolarHBondContact O-N 3.38Å
439S39.8Very low38.3Very low109 Ų109139.4 Ų139.476%0.76281%0.81SS**  trans-878.9-152.6-36.60000117.6L441S439-L441 PolarHBondContact O-N 3.3Å
440W55.1Low38.1Very low215 Ų215137.6 Ų137.681%0.81481%0.809SS**THydrogen-bonded Turntrans-86.91.1-159.472.7-85.8000117P438P438-W440 PolarHBondContact O-N 3.38Å
441L47.4Very low37.7Very low147 Ų147135.6 Ų135.677%0.7781%0.81SS**THydrogen-bonded Turntrans-92.14.6173.2-67.5177.9000113.8S439 A443S439-L441 PolarHBondContact O-N 3.3Å; L441-A443 VanDerWaalsContact C-N 3.25Å; L441-A443 PolarHBondContact O-N 3.03Å
442A43.1Very low37.8Very low98 Ų98139.1 Ų139.181%0.8182%0.823SS**  trans-83.453.7-179.700000113.4
443A35.5Very low37.8Very low77 Ų77134.7 Ų134.764%0.63682%0.82SS**  trans-150.7110.7170.800000112.1L441L441-A443 VanDerWaalsContact C-N 3.25Å; L441-A443 PolarHBondContact O-N 3.03Å
444W34.5Very low37.8Very low253 Ų253133.7 Ų133.796%0.95883%0.825SS**  trans-178.2122.8137.3-96.925.1000107.4
445P44.3Very low37.4Very low135 Ų135137.7 Ų137.788%0.87783%0.833SS**  trans-80.6143.4-173.432-34.9000112.4
446G34.1Very low36.7Very low72 Ų72142.5 Ų142.574%0.74284%0.836SS**  trans-102.6131.6177.300000113.5
447S35.2Very low36.3Very low138 Ų138139.1 Ų139.197%0.96583%0.832SS**  trans-169.2154.7157.7-87.70000110.6
448G29.1Very low35.5Very low77 Ų77137 Ų13779%0.79483%0.831SS**  trans125.278.1172.900000114.8G450G448-G450 PolarHBondContact O-N 3.34Å
449R33.8Very low34.7Very low262 Ų262137.9 Ų137.999%0.98984%0.839SS**  trans-81.9100.8172-179179.1-179.2-105.57.8109.8
450G27.5Very low34.5Very low77 Ų77140.7 Ų140.779%0.79485%0.845SS**  trans-155.5121.6175.300000111.6G448G448-G450 PolarHBondContact O-N 3.34Å
451G33.4Very low33.5Very low75 Ų75138.4 Ų138.477%0.77385%0.847SS**  trans-108.4142.3176.700000111.6
452L31.1Very low32.7Very low186 Ų186134.9 Ų134.997%0.97485%0.846SS**  trans-164.7166152.1-105.5169.8000108.9
453A31.6Very low32.1Very low100 Ų100142.3 Ų142.383%0.82685%0.853SS**  trans-89.2146-167.500000114.4
454A30.6Very low31.7Very low105 Ų105144.4 Ų144.487%0.86886%0.863SS**  trans-155.6150154.900000111.7
455Q29.8Very low31.5Very low195 Ų195139 Ų13991%0.91185%0.853SS**  trans-75.7144.1-171.9-61.8167.2-38.200113.4
456R27.8Very low31Very low243 Ų243140 Ų14092%0.91785%0.849SS**  trans-90.8100159-88.7-173.8170.3171-1.1110.5
457A27.7Very low30.9Very low98 Ų98141.6 Ų141.681%0.8185%0.849SS**  trans-74.8126.8163.300000109.9
458S29.1Very low30.5Very low115 Ų115138.1 Ų138.180%0.80484%0.835SS**  trans-112.8104.3174.7-650000109.7
459S29.5Very low30.5Very low119 Ų119147.1 Ų147.183%0.83285%0.845SS**  trans-103.9124.3171.5-81.40000111.5
460L34.9Very low30.1Very low167 Ų167138.1 Ų138.187%0.87483%0.834SS**  trans-72148.4167.2-61.2160.9000109.7
461I34.2Very low30.2Very low168 Ų168142.4 Ų142.486%0.86284%0.838SS**  trans-147.1128.7147.3-96.4132.7000108.2
462G30.4Very low30Very low73 Ų73142.7 Ų142.775%0.75383%0.832SS**  trans-80.8158.7176.800000112.4
463R30.9Very low29.9Very low253 Ų253143.4 Ų143.496%0.95583%0.831SS**  trans-95.4127.9172.2-74.9-179.8163.6-157.4-6.6110.9
464S25.5Very low29.7Very low121 Ų121141.7 Ų141.785%0.84682%0.823SS**  trans-121.8171155.9-162.80000109.3
465L31Very low29.6Very low141 Ų141142.2 Ų142.274%0.73883%0.827SS**  trans-141.2140-158.5-77.4172.8000114.2
466L34Very low29.4Very low155 Ų155136.2 Ų136.281%0.81282%0.818SS**  trans66.4156.3160.3-82.680.9000117.9
467S31.2Very low29.5Very low105 Ų105132.3 Ų132.373%0.73481%0.812SS**  cis-176.5151.7-20.6520000113.7
468G27.5Very low29.6Very low65 Ų65136 Ų13667%0.6781%0.812SS**  trans92.5150.116600000115.7
469W28.7Very low29.6Very low267 Ų267133.8 Ų133.8100%1.01181%0.807SS**  cis-157.8175.5-1.5-67.4-48.1000109
470G26.2Very low29.7Very low72 Ų72133.6 Ų133.674%0.74281%0.806SS**  cis146.764.7-11.200000117.7
471L28.8Very low29.5Very low168 Ų168136.9 Ų136.988%0.8881%0.807SS**  trans-131.3135.7170.9-107.483.3000110.4
472A29.4Very low29.4Very low80 Ų80135.4 Ų135.466%0.66180%0.8SS**  58.7142.1100.900000116.4
473Q29.9Very low29.5Very low202 Ų202138.7 Ų138.794%0.94481%0.806SS**  cis-163.4177.4-0.8-119167.3-68.200107.8
474G26Very low29.5Very low63 Ų63129.9 Ų129.965%0.64979%0.794SS**  cis168.4162.6-2.100000112
475A28.6Very low29.7Very low117 Ų117131.3 Ų131.397%0.96780%0.797SS**  trans66.9152.4-179.300000118
476G26.9Very low29.6Very low69 Ų69129.1 Ų129.171%0.71179%0.794SS**  cis177.8162-10.100000115.2
477M29.9Very low29.2Very low160 Ų160132.9 Ų132.979%0.78880%0.797SS**  trans66.7130.2159-61.6170.77100123.1
478E29.8Very low29.1Very low176 Ų176132.6 Ų132.682%0.82280%0.795SS**  trans54.6150.2140.7-63.3163.6-154.600122
479G28.6Very low30.3Very low68 Ų68134.8 Ų134.870%0.70180%0.798SS**  cis168.8126.8-12.800000116.2
480S31.5Very low30.6Very low116 Ų116127.9 Ų127.981%0.81179%0.787SS**  trans64.2147.7153.2-56.30000124.4
481R30.3Very low30.8Very low235 Ų235129.9 Ų129.989%0.88779%0.79SS**  trans74.6158.4159.6-66.8173.6-172-980.1118.8
482L32.7Very low32Very low137 Ų137127.2 Ų127.272%0.71778%0.782SS**  cis-171.7163.9-40.6-113.7180000109.7
483T33.1Very low31.9Very low142 Ų142132.7 Ų132.787%0.87179%0.794SS**  trans67.6154.517372.30000117.6
484G29.2Very low32Very low68 Ų68130.2 Ų130.270%0.70179%0.788SS**  cis167.8150.3-12.200000114.2
485V31.3Very low32.2Very low152 Ų152135.4 Ų135.492%0.92180%0.8SS**  trans37.3138.5143.7-179.50000120.2
486S28.3Very low32.3Very low95 Ų95136 Ų13666%0.66479%0.787SS**  cis-180-178.8-13.4-174.90000109.7
487W26Very low32.4Very low234 Ų234138.1 Ų138.189%0.88679%0.791SS**  trans86.3156.4160.4-84.493.3000121.9
488S28.9Very low32.6Very low99 Ų99136 Ų13669%0.69279%0.787SS**  trans-142.3-159.6-173.3-46.20000109.3
489P51.8Low32.5Very low111 Ų111135.4 Ų135.472%0.72179%0.79SS**  -106.8-166.7-70.240.2-26.9000111.4
490P36.4Very low32.7Very low122 Ų122140.4 Ų140.479%0.79280%0.795SS**  trans-145.9171.513239-25000116.5
491S29.5Very low32.7Very low114 Ų114140.9 Ų140.980%0.79780%0.798SS**  trans-156.6178.8165.7-50.10000107
492P53.1Low32.8Very low111 Ų111137.7 Ų137.772%0.72180%0.799SS**  cis-124-169.4-17.142.2-27.4000111.8
493Q27.9Very low32.8Very low196 Ų196136.1 Ų136.192%0.91681%0.805SS**  trans-163.1151.6146.3-122171.5-17.600112.5
494D32.5Very low32.7Very low150 Ų150136.5 Ų136.580%0.80280%0.801SS**  trans-110164.4-171-45.8-95.6000112.7
495D29.1Very low33.2Very low172 Ų172140.5 Ų140.592%0.9280%0.802SS**  trans-159.7163.9146.4-132-36.2000112.9
496D31.7Very low33.5Very low129 Ų129142.4 Ų142.469%0.6980%0.8SS**  trans-112.9155-161.2173.358.1000116.1
497S29.4Very low34.1Very low114 Ų114146.7 Ų146.780%0.79781%0.809SS**  trans173.2147.9136.9-83.30000114.6
498T33.2Very low35.1Very low114 Ų114141.4 Ų141.470%0.69980%0.799SS**  trans-99.4153.2-173.454.60000116.2
499N28.4Very low36.2Very low164 Ų164142 Ų14288%0.87780%0.8SS**  trans-168.1156.5130.6-109-60.5000114.2
500H32.6Very low36.3Very low174 Ų174142.5 Ų142.581%0.80680%0.795SS**  trans-100.4150.5-174.9-75.3-101.8000114.4
501S32Very low37.1Very low126 Ų126139.9 Ų139.988%0.88178%0.784SS**  trans-161.6150.7147.8-84.10000111.9
502N31.9Very low38.3Very low168 Ų168140.1 Ų140.190%0.89878%0.776SS**  trans-80144-166.3-55.3-48.9000114.9
503A31.6Very low38.2Very low103 Ų103138 Ų13885%0.85177%0.767SS**  trans-167.7119.1136.500000114.7
504L32.9Very low39.7Very low151 Ų151133.6 Ų133.679%0.79175%0.754SS**  trans-7.1137.8156.6-144.767.7000122.9
505E38.1Very low40.5Very low152 Ų152133.4 Ų133.471%0.7175%0.748SS**  trans37.4103.9148-67.2179.1102.100122.4
506H39.2Very low41.7Very low192 Ų192131.4 Ų131.489%0.88974%0.735SS**  -165.1149.3105.2-106.163.4000110.3
507Q39Very low42.5Very low184 Ų184128.2 Ų128.286%0.8673%0.726SS**  trans-126.3131.2-179.9-164.3173.529.300110.6
508D47.3Very low43.5Very low124 Ų124126.4 Ų126.466%0.66372%0.719SS**  trans-69.3135.9-169.2-80.4-57.4000114I510D508-I510 PolarHBondContact O-N 3.47Å
509P52.9Low44.2Very low110 Ų110124.9 Ų124.971%0.71471%0.709SS**THydrogen-bonded Turntrans-70.74.1-179.730.8-36.9000114.3
510I53.6Low45Very low123 Ų123122.8 Ų122.863%0.63170%0.697SS**THydrogen-bonded Turntrans-87.9-34.5-176.1-60177.4000111.5D508 A513D508-I510 PolarHBondContact O-N 3.47Å; I510-A513 PolarHBondContact O-N 3.1Å
511A52.9Low45.7Very low67 Ų67122.5 Ų122.555%0.55470%0.696SS**Hα-helixtrans-65.9-45.9-176.500000112.5A513 V514A511-A513 PolarHBondContact O-N 3.3Å; A511-V514 PolarHBondContact O-N 3.47Å; A511-V514 VanDerWaalsContact O-N 3.13Å
512L54.2Low46.4Very low118 Ų118120.2 Ų120.262%0.61868%0.681SS**Hα-helixtrans-61.3-30.8-178.2-173.763.7000113M516L512-M516 PolarHBondContact O-N 3.41Å
513A51.1Low47.2Very low66 Ų66117.6 Ų117.655%0.54567%0.665SS.*Hα-helixtrans-71.1-31.5178.600000113I510 A511 A517I510-A513 PolarHBondContact O-N 3.1Å; A511-A513 PolarHBondContact O-N 3.3Å; A513-A517 PolarHBondContact O-N 2.62Å
514V59.6Low47.6Very low105 Ų105119.7 Ų119.764%0.63666%0.661SS**Hα-helixtrans-71.6-39179.3177.70000110.9A511A511-V514 PolarHBondContact O-N 3.47Å; A511-V514 VanDerWaalsContact O-N 3.13Å
515E50.9Low48.2Very low145 Ų145115.8 Ų115.868%0.67865%0.651SS**Hα-helixtrans-69.6-45-179.5-167.3170.8-169.700112.1A517 A518E515-A517 VanDerWaalsContact C-N 3.28Å; E515-A517 PolarHBondContact O-N 3.19Å; E515-A518 PolarHBondContact O-N 3.24Å
516M52.8Low48.6Very low130 Ų130114.7 Ų114.764%0.6465%0.649SS**Hα-helixtrans-66.7-26.5178.2-66.4-142.878.500113.8L512 A518 V519L512-M516 PolarHBondContact O-N 3.41Å; M516-A518 VanDerWaalsContact C-N 3.33Å; M516-A518 PolarHBondContact O-N 3.5Å; M516-V519 PolarHBondContact O-N 3.32Å
517A50.1Low48.8Very low62 Ų62109.3 Ų109.351%0.51264%0.638SS.*Hα-helixtrans-66.7-32.8177.900000113A513 E515A513-A517 PolarHBondContact O-N 2.62Å; E515-A517 VanDerWaalsContact C-N 3.28Å; E515-A517 PolarHBondContact O-N 3.19Å
518A49.6Very low49.2Very low77 Ų77106.8 Ų106.864%0.63664%0.635SS**Hα-helixtrans-70.4-30.6-179.500000113.2E515 M516E515-A518 PolarHBondContact O-N 3.24Å; M516-A518 VanDerWaalsContact C-N 3.33Å; M516-A518 PolarHBondContact O-N 3.5Å
519V48.6Very low49.4Very low82 Ų82109.5 Ų109.550%0.49764%0.644SS.*Hα-helixtrans-71.9-38.3-174-179.60000112.4M516 H521 S522 I523M516-V519 PolarHBondContact O-N 3.32Å; V519-H521 VanDerWaalsContact C-N 3.29Å; V519-H521 PolarHBondContact O-N 3.32Å; V519-S522 PolarHBondContact O-N 3.38Å; V519-I523 HydrophobicContact CG1-CD1 4.47Å
520N45.2Very low49.2Very low119 Ų119108.8 Ų108.864%0.63665%0.648SS**Hα-helixtrans-67.4-23.5-171.5-102-34.5000114.6S522N520-S522 VanDerWaalsContact C-N 3.31Å; N520-S522 PolarHBondContact O-N 3.47Å
521H46.1Very low48.3Very low168 Ų168107 Ų10778%0.77866%0.66SS**Hα-helixtrans-76.4-14.6177.5-84.6-76.3000114.2V519V519-H521 VanDerWaalsContact C-N 3.29Å; V519-H521 PolarHBondContact O-N 3.32Å
522S47.9Very low47.4Very low79 Ų79107.7 Ų107.755%0.55267%0.673SS**Hα-helixtrans-86.5-29.2-178.2-148.30000113.3V519 N520V519-S522 PolarHBondContact O-N 3.38Å; N520-S522 VanDerWaalsContact C-N 3.31Å; N520-S522 PolarHBondContact O-N 3.47Å
523I46.8Very low46.4Very low113 Ų113105.6 Ų105.658%0.57968%0.68SS**Hα-helixtrans-79.1-34.9-169.5-63.1178.3000112.7V519 A525V519-I523 HydrophobicContact CG1-CD1 4.47Å; I523-A525 PolarHBondContact O-N 3.13Å
524L41.7Very low45.5Very low147 Ų147111.1 Ų111.177%0.7770%0.699SS**THydrogen-bonded Turntrans-70.9-14.6177.4-91.7164.3000113.9
525A45.2Very low44.3Very low69 Ų69110.4 Ų110.457%0.5770%0.704SS**THydrogen-bonded Turntrans-80.6-24-179.100000114.1I523I523-A525 PolarHBondContact O-N 3.13Å
526L46.1Very low43.6Very low129 Ų129112.1 Ų112.168%0.67572%0.717SS**THydrogen-bonded Turntrans-95.6-17.6-179.5-81.584.3000114T528 Q529L526-T528 PolarHBondContact O-N 3.36Å; L526-T528 VanDerWaalsContact O-N 3.1Å; L526-Q529 PolarHBondContact O-N 3.24Å
527A43.9Very low42.6Very low78 Ų78109.8 Ų109.865%0.64573%0.727SS**THydrogen-bonded Turntrans-70.6-5.4-172.300000115.3
528T46.3Very low41.7Very low132 Ų132110.2 Ų110.281%0.8174%0.737SS**THydrogen-bonded Turntrans-104.7-3.2-177.151.40000114.4L526L526-T528 PolarHBondContact O-N 3.36Å; L526-T528 VanDerWaalsContact O-N 3.1Å
529Q51.6Low41.1Very low180 Ų180113.7 Ų113.784%0.84175%0.75SS**SBendtrans-110.4-2.9-172.5-149.1172.42700115L526L526-Q529 PolarHBondContact O-N 3.24Å
530A48.4Very low40.5Very low96 Ų96113.2 Ų113.279%0.79376%0.762SS**SBendtrans-134.990-179.100000111.8
531G34.3Very low40Very low86 Ų86113.3 Ų113.389%0.88777%0.772SS**  trans-172.222.8-177.100000116.3
532G34.1Very low39.6Very low81 Ų81112.9 Ų112.984%0.83578%0.776SS**  trans-119110.8-175.400000113.8
533G33.1Very low39.1Very low74 Ų74117.2 Ų117.276%0.76379%0.791SS**  trans83.5105.6156.900000118
534L32.7Very low38.8Very low182 Ų182119.4 Ų119.495%0.95380%0.796SS**  trans-143.1104.3154-81.8-177.1000110.9
535A35Very low38.8Very low89 Ų89118.5 Ų118.574%0.73680%0.797SS**  trans-168.6136.2152.900000109.8
536L35.6Very low38.7Very low181 Ų181121.4 Ų121.495%0.94880%0.799SS**  trans58.2116.3163.8-57.9149.7000116
537G31.8Very low38.5Very low82 Ų82121 Ų12185%0.84580%0.802SS**  cis126.4137.49.300000110.7
538G32.6Very low38.6Very low70 Ų70125.6 Ų125.672%0.72281%0.814SS**  trans102.9101.2167.700000117.1
539T36.5Very low38.6Very low150 Ų150125.8 Ų125.892%0.9281%0.81SS**  trans39.2117.9135.757.80000121.3
540G35.3Very low38.5Very low73 Ų73128.6 Ų128.675%0.75383%0.831SS**  123.3131119.700000119
541S34.7Very low38Very low121 Ų121130.2 Ų130.285%0.84683%0.833SS**  trans72.2112.9151.1-530000119.7
542D38.2Very low38.2Very low158 Ų158132.5 Ų132.585%0.84583%0.83SS**  trans-58149.6158.8-49.4-110.3000112.9
543I37.8Very low38.5Very low171 Ų171135.4 Ų135.488%0.87783%0.83SS**  trans-150.5146.2147.2-98139.7000108.2
544K40.7Very low38.8Very low158 Ų158139 Ų13969%0.68783%0.834SS**  trans-128.5116.4-163.2172.2-178.5177.7-84.90111E546K544-E546 WeakPolarHBondContact CE-OE1 3.49Å; K544-E546 HydrophobicContact CG-CG 4.48Å; K544-E546 IonicContact NZ-OE1 2.62Å; K544-E546 PolarHBondContact NZ-OE1 3.48Å; K544-E546 IonicContact NZ-OE2 3.41Å; K544-E546 PolarHBondContact NZ-OE2 2.96Å
545T41.9Very low39.2Very low128 Ų128136.3 Ų136.379%0.78583%0.826SS**  trans-153.3116.2162.648.80000106.5
546E41.4Very low39.4Very low131 Ų131139.5 Ų139.561%0.61283%0.832SS**  cis69.391.849.3-57.5177.2-99.100113K544K544-E546 WeakPolarHBondContact CE-OE1 3.49Å; K544-E546 HydrophobicContact CG-CG 4.48Å; K544-E546 IonicContact NZ-OE1 2.62Å; K544-E546 PolarHBondContact NZ-OE1 3.48Å; K544-E546 IonicContact NZ-OE2 3.41Å; K544-E546 PolarHBondContact NZ-OE2 2.96Å
547V42Very low39.7Very low121 Ų121136.5 Ų136.573%0.73382%0.824SS**  66.6123.9116.7170.90000118.8
548L46.7Very low40.3Very low173 Ų173140.7 Ų140.791%0.90682%0.822SS**  trans-157.5122.3139.4-117165.5000110.2
549D46.7Very low41Very low136 Ų136146.6 Ų146.673%0.72783%0.831SS**  trans-78.1152-177.8-53-123.8000113.1
550D49.6Very low41.4Very low239 Ų239146.3 Ų146.3100%1.27882%0.823SS**  -153.30104.4-156.6-119000109.4

Retrieved 550 of 550 residues in 1799.3 ms (Link to these results)

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