X5MBH0_CAEEL Loading...

RING-type domain-containing protein

AlphaFold DB , UniProt , Accession X5MBH0, Species CAEEL (Caenorhabditis elegans), Gene grif-1, Length 126 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
1M61.3Low76.1Confident193 Ų193133 Ų13395%0.95160%0.599SS**  0-66.90-67.2-63.9-83.700111.9R3 Q4 E5M1-R3 PolarHBondContact O-N 3.31Å; M1-Q4 PolarHBondContact O-N 3.39Å; M1-Q4 VanDerWaalsContact O-N 3.16Å; M1-E5 PolarHBondContact O-N 2.96Å; M1-E5 VanDerWaalsContact O-N 3.1Å
2Q70.1Confident76.7Confident110 Ų110125.3 Ų125.351%0.51458%0.584SS.*Hα-helixtrans-61-34.1-172.2-154.9159.641.500115.8E5 N6 L102Q2-E5 PolarHBondContact O-N 3.42Å; Q2-N6 WeakPolarHBondContact O-CB 3.39Å; Q2-N6 VanDerWaalsContact O-CG 3.31Å; Q2-N6 PolarHBondContact O-N 2.76Å; Q2-L102 VanDerWaalsContact CD-CD1 3.48Å; Q2-L102 HydrophobicContact CG-CD1 4.39Å
3R72.8Confident76.3Confident221 Ų221124.6 Ų124.683%0.83459%0.586SS**Hα-helixtrans-67.8-39.4177.4-142.8-177.6-166.6-172.94112.7M1 Q7M1-R3 PolarHBondContact O-N 3.31Å; R3-Q7 PolarHBondContact O-N 3.1Å
4Q75.8Confident75.9Confident119 Ų119123.4 Ų123.456%0.55658%0.58SS**Hα-helixtrans-70.6-38.4175.7-85.1177.8-14.500111.6M1 Q7 R8M1-Q4 PolarHBondContact O-N 3.39Å; M1-Q4 VanDerWaalsContact O-N 3.16Å; Q4-Q7 PolarHBondContact O-N 3.41Å; Q4-R8 WeakPolarHBondContact O-CG 3.39Å; Q4-R8 PolarHBondContact O-N 3.25Å
5E77.7Confident76.1Confident112 Ų112121.9 Ų121.952%0.52358%0.578SS.*Hα-helixtrans-61.3-46.5174.9-16070.5-161.900111.2M1 Q2 Q7 R8 R9M1-E5 PolarHBondContact O-N 2.96Å; M1-E5 VanDerWaalsContact O-N 3.1Å; Q2-E5 PolarHBondContact O-N 3.42Å; E5-Q7 VanDerWaalsContact C-N 3.33Å; E5-Q7 PolarHBondContact O-N 3.13Å; E5-R8 PolarHBondContact O-N 3.05Å; E5-R9 WeakPolarHBondContact O-CB 3.44Å; E5-R9 PolarHBondContact O-N 2.99Å
6N78.6Confident76.1Confident81 Ų81118.9 Ų118.943%0.43357%0.566SS.*Hα-helixtrans-62.2-40.4175.8-74.9-11.2000112Q2 R9 I10Q2-N6 WeakPolarHBondContact O-CB 3.39Å; Q2-N6 VanDerWaalsContact O-CG 3.31Å; Q2-N6 PolarHBondContact O-N 2.76Å; N6-R9 PolarHBondContact O-N 3.32Å; N6-I10 VanDerWaalsContact O-CG1 3.29Å; N6-I10 WeakPolarHBondContact O-CG1 3.26Å; N6-I10 PolarHBondContact O-N 3.38Å
7Q79.3Confident75.6Confident129 Ų129117.6 Ų117.660%0.60356%0.562SS**Hα-helixtrans-62.6-46176.5-120.8171.3-20.300111.8R3 Q4 E5 R9 I10 V11R3-Q7 PolarHBondContact O-N 3.1Å; Q4-Q7 PolarHBondContact O-N 3.41Å; E5-Q7 VanDerWaalsContact C-N 3.33Å; E5-Q7 PolarHBondContact O-N 3.13Å; Q7-R9 VanDerWaalsContact C-N 3.27Å; Q7-R9 PolarHBondContact O-N 2.87Å; Q7-I10 PolarHBondContact O-N 3.15Å; Q7-V11 WeakPolarHBondContact O-CG2 3.41Å; Q7-V11 PolarHBondContact O-N 2.98Å
8R82.1Confident75.1Confident179 Ų179116.8 Ų116.868%0.67556%0.558SS**Hα-helixtrans-59.7-39.7175.2-74.5177.3178.6167.4-1.7111.9Q4 E5 V11 G12Q4-R8 WeakPolarHBondContact O-CG 3.39Å; Q4-R8 PolarHBondContact O-N 3.25Å; E5-R8 PolarHBondContact O-N 3.05Å; R8-V11 PolarHBondContact O-N 3.29Å; R8-G12 PolarHBondContact O-N 3.03Å
9R76.6Confident74.9Confident148 Ų148117.2 Ų117.256%0.55856%0.557SS**Hα-helixtrans-66.6-42.4179.1-146.5176-164.5177.94.5112.4E5 N6 Q7 G12 L13E5-R9 WeakPolarHBondContact O-CB 3.44Å; E5-R9 PolarHBondContact O-N 2.99Å; N6-R9 PolarHBondContact O-N 3.32Å; Q7-R9 VanDerWaalsContact C-N 3.27Å; Q7-R9 PolarHBondContact O-N 2.87Å; R9-G12 PolarHBondContact O-N 3.23Å; R9-L13 WeakPolarHBondContact O-CG 3.46Å; R9-L13 PolarHBondContact O-N 3.28Å
10I79.3Confident74.4Confident98 Ų98114.3 Ų114.350%0.50355%0.547SS..Hα-helixtrans-63.5-45.7176.6-70.1164.3000110.6N6 Q7 G12 L13 Q14N6-I10 VanDerWaalsContact O-CG1 3.29Å; N6-I10 WeakPolarHBondContact O-CG1 3.26Å; N6-I10 PolarHBondContact O-N 3.38Å; Q7-I10 PolarHBondContact O-N 3.15Å; I10-G12 PolarHBondContact O-N 2.78Å; I10-L13 PolarHBondContact O-N 3.39Å; I10-Q14 WeakPolarHBondContact O-CG 3.49Å; I10-Q14 PolarHBondContact O-N 2.99Å
11V83.6Confident73.6Confident73 Ų73113.8 Ų113.844%0.44254%0.544SS..Hα-helixtrans-62.2-44.9178.2173.60000110.9Q7 R8 L13 Q14 D15Q7-V11 WeakPolarHBondContact O-CG2 3.41Å; Q7-V11 PolarHBondContact O-N 2.98Å; R8-V11 PolarHBondContact O-N 3.29Å; V11-L13 VanDerWaalsContact C-N 3.33Å; V11-L13 PolarHBondContact O-N 2.71Å; V11-Q14 PolarHBondContact O-N 3.34Å; V11-D15 PolarHBondContact O-N 3.09Å
12G83.1Confident74Confident40 Ų40112.2 Ų112.241%0.41253%0.528SS..Hα-helixtrans-62.7-36.9177.200000113.8R8 R9 I10 N16R8-G12 PolarHBondContact O-N 3.03Å; R9-G12 PolarHBondContact O-N 3.23Å; I10-G12 PolarHBondContact O-N 2.78Å; G12-N16 WeakPolarHBondContact O-CB 3.48Å; G12-N16 PolarHBondContact O-N 3.44Å; G12-N16 VanDerWaalsContact O-N 3.09Å
13L71.4Confident73.7Confident117 Ų117110 Ų11061%0.61352%0.519SS*.Hα-helixtrans-68-40.7174.1-74.1168.2000111.8R9 I10 V11 N16 L17R9-L13 WeakPolarHBondContact O-CG 3.46Å; R9-L13 PolarHBondContact O-N 3.28Å; I10-L13 PolarHBondContact O-N 3.39Å; V11-L13 VanDerWaalsContact C-N 3.33Å; V11-L13 PolarHBondContact O-N 2.71Å; L13-N16 PolarHBondContact O-N 3.47Å; L13-L17 VanDerWaalsContact O-CB 3.3Å; L13-L17 WeakPolarHBondContact O-CB 3.45Å; L13-L17 PolarHBondContact O-N 3.04Å
14Q71.8Confident73Confident107 Ų107103.9 Ų103.950%0.550%0.499SS..Hα-helixtrans-63.4-43.4175.7-78.1-178-4500112I10 V11 N16 L17 H18I10-Q14 WeakPolarHBondContact O-CG 3.49Å; I10-Q14 PolarHBondContact O-N 2.99Å; V11-Q14 PolarHBondContact O-N 3.34Å; Q14-N16 VanDerWaalsContact C-N 3.34Å; Q14-N16 PolarHBondContact O-N 3.29Å; Q14-L17 PolarHBondContact O-N 3.41Å; Q14-H18 WeakPolarHBondContact O-CB 3.47Å; Q14-H18 VanDerWaalsContact O-CG 3.3Å; Q14-H18 PolarHBondContact O-N 3.3Å; Q14-H18 PolarHBondContact O-ND1 3.26Å
15D78.5Confident72.3Confident102 Ų102106.9 Ų106.955%0.54551%0.505SS..Hα-helixtrans-63.3-41.5177.7-74.6-19.2000111.5V11 H18 K19V11-D15 PolarHBondContact O-N 3.09Å; D15-H18 PolarHBondContact O-N 3.17Å; D15-K19 WeakPolarHBondContact O-CB 3.42Å; D15-K19 PolarHBondContact O-N 2.95Å
16N75.2Confident71.8Confident74 Ų74107 Ų10740%0.39651%0.506SS..Hα-helixtrans-66-41.8176.6-161.341.2000111.6G12 L13 Q14 H18 K19 V20G12-N16 WeakPolarHBondContact O-CB 3.48Å; G12-N16 PolarHBondContact O-N 3.44Å; G12-N16 VanDerWaalsContact O-N 3.09Å; L13-N16 PolarHBondContact O-N 3.47Å; Q14-N16 VanDerWaalsContact C-N 3.34Å; Q14-N16 PolarHBondContact O-N 3.29Å; N16-H18 PolarHBondContact O-N 2.8Å; N16-K19 WeakPolarHBondContact O-CB 3.26Å; N16-K19 PolarHBondContact O-N 3.33Å; N16-V20 WeakPolarHBondContact O-CG2 3.5Å; N16-V20 PolarHBondContact O-N 2.91Å
17L68.7Low70.9Confident96 Ų96108 Ų10850%0.50351%0.507SS..Hα-helixtrans-64.2-42178.7-161.2132.2000111.5L13 Q14 K19 V20 Q21L13-L17 VanDerWaalsContact O-CB 3.3Å; L13-L17 WeakPolarHBondContact O-CB 3.45Å; L13-L17 PolarHBondContact O-N 3.04Å; Q14-L17 PolarHBondContact O-N 3.41Å; L17-K19 VanDerWaalsContact C-N 3.33Å; L17-K19 PolarHBondContact O-N 2.92Å; L17-V20 PolarHBondContact O-N 3.43Å; L17-Q21 HydrophobicContact CD2-CG 4.48Å; L17-Q21 WeakPolarHBondContact O-CB 3.29Å; L17-Q21 VanDerWaalsContact O-CG 3.26Å; L17-Q21 WeakPolarHBondContact O-CG 3.29Å; L17-Q21 PolarHBondContact O-N 3.08Å
18H66.8Low69.9Low103 Ų103105.4 Ų105.448%0.47750%0.497SS..Hα-helixtrans-64.5-36.4173.7-71.2158.3000112.9Q14 D15 N16 R22Q14-H18 WeakPolarHBondContact O-CB 3.47Å; Q14-H18 VanDerWaalsContact O-CG 3.3Å; Q14-H18 PolarHBondContact O-N 3.3Å; Q14-H18 PolarHBondContact O-ND1 3.26Å; D15-H18 PolarHBondContact O-N 3.17Å; N16-H18 PolarHBondContact O-N 2.8Å; H18-R22 WeakPolarHBondContact O-CB 3.39Å; H18-R22 PolarHBondContact O-N 3.48Å; H18-R22 VanDerWaalsContact O-N 3.08Å
19K71.6Confident68.8Low125 Ų125101 Ų10154%0.54349%0.487SS..Hα-helixtrans-64.3-51.5175.2-174-173.3173.8-1700110.9D15 N16 L17 Q21 R22 D23D15-K19 WeakPolarHBondContact O-CB 3.42Å; D15-K19 PolarHBondContact O-N 2.95Å; N16-K19 WeakPolarHBondContact O-CB 3.26Å; N16-K19 PolarHBondContact O-N 3.33Å; L17-K19 VanDerWaalsContact C-N 3.33Å; L17-K19 PolarHBondContact O-N 2.92Å; K19-Q21 VanDerWaalsContact C-N 3.31Å; K19-Q21 PolarHBondContact O-N 3.25Å; K19-R22 WeakPolarHBondContact O-CB 3.41Å; K19-R22 PolarHBondContact O-N 3.32Å; K19-R22 VanDerWaalsContact O-N 3.09Å; K19-D23 PolarHBondContact O-N 3.38Å
20V63.3Low68.3Low59 Ų5995.7 Ų95.736%0.35848%0.475SS..Hα-helixtrans-60.1-41.7179.31730000111.4N16 L17 R22 D23 F24N16-V20 WeakPolarHBondContact O-CG2 3.5Å; N16-V20 PolarHBondContact O-N 2.91Å; L17-V20 PolarHBondContact O-N 3.43Å; V20-R22 VanDerWaalsContact C-N 3.32Å; V20-R22 PolarHBondContact O-N 2.89Å; V20-D23 PolarHBondContact O-N 3.1Å; V20-F24 WeakPolarHBondContact O-CB 3.34Å; V20-F24 PolarHBondContact O-N 3.35Å
21Q57.6Low67.3Low104 Ų10493.5 Ų93.549%0.48647%0.466SS..Hα-helixtrans-63.6-35.7175.9-76.8177.8-14.400113.3L17 K19 R25L17-Q21 HydrophobicContact CD2-CG 4.48Å; L17-Q21 WeakPolarHBondContact O-CB 3.29Å; L17-Q21 VanDerWaalsContact O-CG 3.26Å; L17-Q21 WeakPolarHBondContact O-CG 3.29Å; L17-Q21 PolarHBondContact O-N 3.08Å; K19-Q21 VanDerWaalsContact C-N 3.31Å; K19-Q21 PolarHBondContact O-N 3.25Å; Q21-R25 PolarHBondContact O-N 3.26Å; Q21-R25 VanDerWaalsContact O-N 3.11Å
22R71.1Confident66Low160 Ų16094.6 Ų94.660%0.60447%0.468SS*.Hα-helixtrans-68.3-49.3176.4-172.6-175.6-55.1-167.62110.9H18 K19 V20 F24 R25 E26H18-R22 WeakPolarHBondContact O-CB 3.39Å; H18-R22 PolarHBondContact O-N 3.48Å; H18-R22 VanDerWaalsContact O-N 3.08Å; K19-R22 WeakPolarHBondContact O-CB 3.41Å; K19-R22 PolarHBondContact O-N 3.32Å; K19-R22 VanDerWaalsContact O-N 3.09Å; V20-R22 VanDerWaalsContact C-N 3.32Å; V20-R22 PolarHBondContact O-N 2.89Å; R22-F24 PolarHBondContact O-N 3.01Å; R22-R25 PolarHBondContact O-N 3.18Å; R22-E26 PolarHBondContact O-N 3.4Å
23D63Low65.3Low63 Ų6399.7 Ų99.734%0.33748%0.481SS..Hα-helixtrans-58.9-39.4178.8-65.7-9.2000110.6K19 V20 E26 Q27K19-D23 PolarHBondContact O-N 3.38Å; V20-D23 PolarHBondContact O-N 3.1Å; D23-E26 PolarHBondContact O-N 3.38Å; D23-Q27 WeakPolarHBondContact O-CG 3.36Å; D23-Q27 PolarHBondContact O-N 2.81Å
24F58Low65Low92 Ų92102.4 Ų102.440%0.40448%0.483SS..Hα-helixtrans-60.9-48.2173.1173.9-102.7000112.6V20 R22 E26 Q27 L28 W86V20-F24 WeakPolarHBondContact O-CB 3.34Å; V20-F24 PolarHBondContact O-N 3.35Å; R22-F24 PolarHBondContact O-N 3.01Å; F24-E26 VanDerWaalsContact C-N 3.31Å; F24-E26 PolarHBondContact O-N 3.42Å; F24-Q27 PolarHBondContact O-N 3.27Å; F24-L28 HydrophobicContact CE1-CD2 4.11Å; F24-L28 HydrophobicContact CZ-CD2 4.23Å; F24-L28 WeakPolarHBondContact O-CB 3.4Å; F24-L28 PolarHBondContact O-N 2.82Å; F24-W86 HydrophobicContact CD2-CZ3 4.21Å
25R61.3Low64.3Low182 Ų182104.4 Ų104.469%0.68749%0.486SS*.Hα-helixtrans-61-40.8178.9-82-177.5175.8-165.5-0.4112Q21 R22 L28 N29Q21-R25 PolarHBondContact O-N 3.26Å; Q21-R25 VanDerWaalsContact O-N 3.11Å; R22-R25 PolarHBondContact O-N 3.18Å; R25-L28 PolarHBondContact O-N 2.85Å; R25-N29 WeakPolarHBondContact O-CB 3.34Å; R25-N29 VanDerWaalsContact O-CG 3.29Å; R25-N29 PolarHBondContact O-N 3.22Å
26E66.9Low63.4Low116 Ų116102.8 Ų102.854%0.54249%0.487SS..Hα-helixtrans-64.7-44.5178.2-71.5177.3-171.300111.6R22 D23 F24 N29 A30R22-E26 PolarHBondContact O-N 3.4Å; D23-E26 PolarHBondContact O-N 3.38Å; F24-E26 VanDerWaalsContact C-N 3.31Å; F24-E26 PolarHBondContact O-N 3.42Å; E26-N29 PolarHBondContact O-N 2.93Å; E26-A30 WeakPolarHBondContact O-CB 3.43Å; E26-A30 PolarHBondContact O-N 3.41Å
27Q60.3Low62.9Low100 Ų100101.9 Ų101.947%0.46750%0.495SS..Hα-helixtrans-67.7-37.2177.5-70.4-178.12600112.9D23 F24 T31 W86D23-Q27 WeakPolarHBondContact O-CG 3.36Å; D23-Q27 PolarHBondContact O-N 2.81Å; F24-Q27 PolarHBondContact O-N 3.27Å; Q27-T31 VanDerWaalsContact O-CB 3.32Å; Q27-T31 WeakPolarHBondContact O-CB 3.5Å; Q27-T31 PolarHBondContact O-N 3.26Å; Q27-T31 PolarHBondContact O-OG1 3.18Å; Q27-W86 VanDerWaalsContact OE1-CH2 3.3Å
28L57.3Low62.4Low75 Ų75101.4 Ų101.439%0.39349%0.486SS..Hα-helixtrans-65-47.3175.2-179.663000110.7F24 R25 T31 M32F24-L28 HydrophobicContact CE1-CD2 4.11Å; F24-L28 HydrophobicContact CZ-CD2 4.23Å; F24-L28 WeakPolarHBondContact O-CB 3.4Å; F24-L28 PolarHBondContact O-N 2.82Å; R25-L28 PolarHBondContact O-N 2.85Å; L28-T31 WeakPolarHBondContact O-CB 3.35Å; L28-T31 PolarHBondContact O-N 3.1Å; L28-T31 VanDerWaalsContact O-N 3.16Å; L28-M32 HydrophobicContact CD1-CG 4.29Å; L28-M32 HydrophobicContact CG-CG 4.45Å; L28-M32 WeakPolarHBondContact O-CG 3.47Å; L28-M32 PolarHBondContact O-N 3.26Å
29N59.3Low62Low87 Ų87100.9 Ų100.947%0.46549%0.487SS..Hα-helixtrans-61.1-46.6177.5-77.3-13.9000111.7R25 E26 T31 M32 E33R25-N29 WeakPolarHBondContact O-CB 3.34Å; R25-N29 VanDerWaalsContact O-CG 3.29Å; R25-N29 PolarHBondContact O-N 3.22Å; E26-N29 PolarHBondContact O-N 2.93Å; N29-T31 PolarHBondContact O-N 3.15Å; N29-M32 PolarHBondContact O-N 3.41Å; N29-E33 WeakPolarHBondContact O-CB 3.4Å; N29-E33 WeakPolarHBondContact O-CG 3.41Å; N29-E33 PolarHBondContact O-N 3.01Å
30A66.1Low61.4Low36 Ų3697.2 Ų97.230%0.29849%0.485SS..Hα-helixtrans-60.7-34176.200000112.5E26 R34E26-A30 WeakPolarHBondContact O-CB 3.43Å; E26-A30 PolarHBondContact O-N 3.41Å; A30-R34 VanDerWaalsContact O-CG 3.29Å; A30-R34 WeakPolarHBondContact O-CG 3.44Å; A30-R34 PolarHBondContact O-N 2.97Å
31T59.3Low61.5Low52 Ų5297 Ų9732%0.31949%0.486SS..Hα-helixtrans-72-43.3176.2-60.30000111.4Q27 L28 N29 R34 W35 L79Q27-T31 VanDerWaalsContact O-CB 3.32Å; Q27-T31 WeakPolarHBondContact O-CB 3.5Å; Q27-T31 PolarHBondContact O-N 3.26Å; Q27-T31 PolarHBondContact O-OG1 3.18Å; L28-T31 WeakPolarHBondContact O-CB 3.35Å; L28-T31 PolarHBondContact O-N 3.1Å; L28-T31 VanDerWaalsContact O-N 3.16Å; N29-T31 PolarHBondContact O-N 3.15Å; T31-R34 PolarHBondContact O-N 2.78Å; T31-W35 WeakPolarHBondContact O-CB 3.47Å; T31-W35 PolarHBondContact O-N 2.85Å; T31-L79 HydrophobicContact CG2-CD2 4.02Å
32M55.8Low61.7Low97 Ų9795.4 Ų95.448%0.47848%0.478SS..Hα-helixtrans-66.8-39.8177.6-70.9-137.1-63.100112.5L28 N29 W35 A36L28-M32 HydrophobicContact CD1-CG 4.29Å; L28-M32 HydrophobicContact CG-CG 4.45Å; L28-M32 WeakPolarHBondContact O-CG 3.47Å; L28-M32 PolarHBondContact O-N 3.26Å; N29-M32 PolarHBondContact O-N 3.41Å; M32-W35 CarbonylContact O-C 3.59Å; M32-W35 PolarHBondContact O-N 3.4Å; M32-A36 WeakPolarHBondContact O-CB 3.32Å; M32-A36 PolarHBondContact O-N 3.4Å
33E68.6Low61.5Low147 Ų14792.2 Ų92.269%0.68747%0.473SS*.Hα-helixtrans-62.5-43.9174.3-76.6179.2173.500111.7N29 W35 A36 G37N29-E33 WeakPolarHBondContact O-CB 3.4Å; N29-E33 WeakPolarHBondContact O-CG 3.41Å; N29-E33 PolarHBondContact O-N 3.01Å; E33-W35 VanDerWaalsContact C-N 3.28Å; E33-W35 PolarHBondContact O-N 3.49Å; E33-A36 PolarHBondContact O-N 2.82Å; E33-G37 PolarHBondContact O-N 2.98Å
34R64.8Low61.6Low173 Ų17394 Ų9465%0.65348%0.482SS*.Hα-helixtrans-61.1-40.4173.2-75175.1-170.4167.94.9111.1A30 T31 G37 W38A30-R34 VanDerWaalsContact O-CG 3.29Å; A30-R34 WeakPolarHBondContact O-CG 3.44Å; A30-R34 PolarHBondContact O-N 2.97Å; T31-R34 PolarHBondContact O-N 2.78Å; R34-G37 PolarHBondContact O-N 2.93Å; R34-W38 PolarHBondContact O-N 2.95Å; R34-W38 VanDerWaalsContact O-N 3.09Å; R34-W38 PolarHBondContact O-NE1 2.75Å
35W56.8Low61.8Low150 Ų15091.2 Ų91.257%0.56847%0.474SS*.Hα-helixtrans-68.4-39.7178.5-173.954.8000113T31 M32 E33 G37 W38 N39T31-W35 WeakPolarHBondContact O-CB 3.47Å; T31-W35 PolarHBondContact O-N 2.85Å; M32-W35 CarbonylContact O-C 3.59Å; M32-W35 PolarHBondContact O-N 3.4Å; E33-W35 VanDerWaalsContact C-N 3.28Å; E33-W35 PolarHBondContact O-N 3.49Å; W35-G37 VanDerWaalsContact C-N 3.34Å; W35-G37 PolarHBondContact O-N 3.47Å; W35-W38 AromaticContact CD1-CE3 3.92Å; W35-W38 WeakPolarHBondContact O-CA 3.39Å; W35-W38 VanDerWaalsContact O-CB 3.26Å; W35-W38 WeakPolarHBondContact O-CB 3.33Å; W35-W38 PolarHBondContact O-N 3.43Å; W35-N39 PolarHBondContact O-N 3Å
36A60.4Low61.9Low68 Ų6885.6 Ų85.656%0.56246%0.456SS*.Hα-helixtrans-61.9-42.1173.700000111.6M32 E33 W38 N39M32-A36 WeakPolarHBondContact O-CB 3.32Å; M32-A36 PolarHBondContact O-N 3.4Å; E33-A36 PolarHBondContact O-N 2.82Å; A36-W38 PolarHBondContact O-N 2.88Å; A36-N39 PolarHBondContact O-N 3.45Å
37G64Low61.9Low54 Ų5483.9 Ų83.956%0.55745%0.451SS*.Hα-helixtrans-63.8-21.9170.500000114E33 R34 W35E33-G37 PolarHBondContact O-N 2.98Å; R34-G37 PolarHBondContact O-N 2.93Å; W35-G37 VanDerWaalsContact C-N 3.34Å; W35-G37 PolarHBondContact O-N 3.47Å
38W59Low62Low86 Ų8684.8 Ų84.833%0.32645%0.454SS..Hα-helixtrans-77.4-34.9177.2-67.4-0.4000113.8R34 W35 A36 S41 H42 K72R34-W38 PolarHBondContact O-N 2.95Å; R34-W38 VanDerWaalsContact O-N 3.09Å; R34-W38 PolarHBondContact O-NE1 2.75Å; W35-W38 AromaticContact CD1-CE3 3.92Å; W35-W38 WeakPolarHBondContact O-CA 3.39Å; W35-W38 VanDerWaalsContact O-CB 3.26Å; W35-W38 WeakPolarHBondContact O-CB 3.33Å; W35-W38 PolarHBondContact O-N 3.43Å; A36-W38 PolarHBondContact O-N 2.88Å; W38-S41 PolarHBondContact O-N 3.33Å; W38-H42 PolarHBondContact O-N 2.97Å; W38-K72 HydrophobicContact CD2-CD 4.49Å; W38-K72 HydrophobicContact CE3-CD 4.16Å; W38-K72 HydrophobicContact CH2-CG 4.49Å; W38-K72 HydrophobicContact CZ3-CD 4.34Å; W38-K72 HydrophobicContact CZ3-CG 4.33Å
39N56.4Low61.8Low92 Ų9284.2 Ų84.249%0.49245%0.448SS..Hα-helixtrans-65.2-40177.6-91.72.6000111.8W35 A36 S41 H42 D43W35-N39 PolarHBondContact O-N 3Å; A36-N39 PolarHBondContact O-N 3.45Å; N39-S41 PolarHBondContact O-N 3.04Å; N39-H42 WeakPolarHBondContact O-CB 3.29Å; N39-H42 PolarHBondContact O-N 3.16Å; N39-H42 VanDerWaalsContact O-N 3.13Å; N39-D43 PolarHBondContact O-N 3.41Å
40G60.7Low62Low48 Ų4889.5 Ų89.550%0.49546%0.461SS..Hα-helixtrans-61.9-25176.700000114.4
41S64.1Low62Low55 Ų5595.5 Ų95.539%0.38548%0.483SS..Hα-helixtrans-86.4-22.5177.2177.90000113.7W38 N39 S45W38-S41 PolarHBondContact O-N 3.33Å; N39-S41 PolarHBondContact O-N 3.04Å; S41-S45 PolarHBondContact O-N 3.46Å; S41-S45 PolarHBondContact O-OG 3.37Å
42H62.9Low62Low71 Ų7195.5 Ų95.533%0.32948%0.481SS..Hα-helixtrans-70.1-49.8177.2169.9-86.1000110.2W38 N39 L44 S45 M46 F65W38-H42 PolarHBondContact O-N 2.97Å; N39-H42 WeakPolarHBondContact O-CB 3.29Å; N39-H42 PolarHBondContact O-N 3.16Å; N39-H42 VanDerWaalsContact O-N 3.13Å; H42-L44 VanDerWaalsContact C-N 3.31Å; H42-L44 PolarHBondContact O-N 3.2Å; H42-S45 PolarHBondContact O-N 3.49Å; H42-M46 PolarHBondContact O-N 2.82Å; H42-F65 AromaticContact CD2-CE2 3.54Å; H42-F65 AromaticContact CD2-CZ 3.57Å; H42-F65 AromaticContact NE2-CZ 3.69Å
43D65.4Low61.8Low92 Ų9295.1 Ų95.149%0.49250%0.502SS..Hα-helixtrans-62.9-42.1-177.6-62.4-18000110.9N39 S45 M46 D47N39-D43 PolarHBondContact O-N 3.41Å; D43-S45 VanDerWaalsContact C-N 3.26Å; D43-S45 PolarHBondContact O-N 3.08Å; D43-M46 PolarHBondContact O-N 3.04Å; D43-M46 VanDerWaalsContact O-N 3.15Å; D43-D47 VanDerWaalsContact O-CG 3.27Å; D43-D47 PolarHBondContact O-N 3.4Å
44L66.7Low61.4Low101 Ų10191.5 Ų91.553%0.52949%0.487SS..Hα-helixtrans-62.6-29175.3-131.1145.9000113.8H42 K48H42-L44 VanDerWaalsContact C-N 3.31Å; H42-L44 PolarHBondContact O-N 3.2Å; L44-K48 WeakPolarHBondContact O-CG 3.42Å; L44-K48 PolarHBondContact O-N 3.05Å
45S61.8Low61Low34 Ų3488.4 Ų88.424%0.23849%0.488CS..Hα-helixtrans-81.2-35.3175.9-61.70000111.8S41 H42 D43 F49S41-S45 PolarHBondContact O-N 3.46Å; S41-S45 PolarHBondContact O-OG 3.37Å; H42-S45 PolarHBondContact O-N 3.49Å; D43-S45 VanDerWaalsContact C-N 3.26Å; D43-S45 PolarHBondContact O-N 3.08Å; S45-F49 WeakPolarHBondContact O-CB 3.46Å; S45-F49 PolarHBondContact O-N 2.9Å
46M63.3Low61.4Low63 Ų6389.4 Ų89.431%0.3149%0.493SS..Hα-helixtrans-70.2-36.3175.1-74.5-64.6-16700112.1H42 D43 F49 R50 F65H42-M46 PolarHBondContact O-N 2.82Å; D43-M46 PolarHBondContact O-N 3.04Å; D43-M46 VanDerWaalsContact O-N 3.15Å; M46-F49 WeakPolarHBondContact O-CB 3.47Å; M46-F49 PolarHBondContact O-N 3.27Å; M46-R50 WeakPolarHBondContact O-CG 3.5Å; M46-R50 PolarHBondContact O-N 3.43Å; M46-F65 HydrophobicContact CE-CE1 3.94Å; M46-F65 HydrophobicContact CE-CZ 3.94Å
47D67.3Low61.4Low81 Ų8189.3 Ų89.343%0.43348%0.483SS..Hα-helixtrans-64.2-47.4174.1-69.4-22.3000110.9D43 F49 R50 E51D43-D47 VanDerWaalsContact O-CG 3.27Å; D43-D47 PolarHBondContact O-N 3.4Å; D47-F49 VanDerWaalsContact C-N 3.28Å; D47-F49 PolarHBondContact O-N 3.02Å; D47-R50 PolarHBondContact O-N 3.43Å; D47-R50 VanDerWaalsContact O-N 3.1Å; D47-E51 WeakPolarHBondContact O-CG 3.42Å; D47-E51 PolarHBondContact O-N 3.08Å
48K61.2Low60.9Low119 Ų11989.3 Ų89.352%0.51747%0.468SS..Hα-helixtrans-59.6-36.7172.9-76.6177.8-179.9177.40113L44 L52L44-K48 WeakPolarHBondContact O-CG 3.42Å; L44-K48 PolarHBondContact O-N 3.05Å; K48-L52 WeakPolarHBondContact O-CD1 3.44Å; K48-L52 VanDerWaalsContact O-CG 3.26Å; K48-L52 WeakPolarHBondContact O-CG 3.2Å; K48-L52 PolarHBondContact O-N 3.42Å
49F54.3Low61.2Low63 Ų6391.1 Ų91.128%0.27648%0.478SS..Hα-helixtrans-65.4-39.4175.9178.9-91.5000111.9S45 M46 D47 Q58 V61S45-F49 WeakPolarHBondContact O-CB 3.46Å; S45-F49 PolarHBondContact O-N 2.9Å; M46-F49 WeakPolarHBondContact O-CB 3.47Å; M46-F49 PolarHBondContact O-N 3.27Å; D47-F49 VanDerWaalsContact C-N 3.28Å; D47-F49 PolarHBondContact O-N 3.02Å; F49-Q58 HydrophobicContact CD2-CB 4.19Å; F49-Q58 HydrophobicContact CD2-CG 4.49Å; F49-Q58 HydrophobicContact CE2-CB 3.69Å; F49-Q58 HydrophobicContact CE2-CG 4.25Å; F49-Q58 VanDerWaalsContact CE2-O 3.29Å; F49-Q58 WeakPolarHBondContact CE2-O 3.4Å; F49-Q58 HydrophobicContact CZ-CB 4.19Å; F49-V61 HydrophobicContact CB-CG1 4.2Å; F49-V61 HydrophobicContact CD2-CB 4.41Å; F49-V61 HydrophobicContact CD2-CG1 4.34Å
50R62.9Low62Low198 Ų19893.3 Ų93.375%0.74748%0.483SS*.Hα-helixtrans-72.6-31.7177.8-73174.5179.6172.90.8113.5M46 D47 L52M46-R50 WeakPolarHBondContact O-CG 3.5Å; M46-R50 PolarHBondContact O-N 3.43Å; D47-R50 PolarHBondContact O-N 3.43Å; D47-R50 VanDerWaalsContact O-N 3.1Å; R50-L52 VanDerWaalsContact C-N 3.33Å
51E66.3Low62.2Low162 Ų16293.2 Ų93.276%0.75747%0.473SS*.Hα-helixtrans-75.2-19.6178.4-73.7-179.9167.900113.6D47 G53D47-E51 WeakPolarHBondContact O-CG 3.42Å; D47-E51 PolarHBondContact O-N 3.08Å; E51-G53 PolarHBondContact O-N 3.09Å
52L58.6Low62.3Low52 Ų5296.6 Ų96.627%0.27248%0.478SS..  trans-75.9120.6178.2-72.7167.2000110.9K48 R50 N57 Q58 V61K48-L52 WeakPolarHBondContact O-CD1 3.44Å; K48-L52 VanDerWaalsContact O-CG 3.26Å; K48-L52 WeakPolarHBondContact O-CG 3.2Å; K48-L52 PolarHBondContact O-N 3.42Å; R50-L52 VanDerWaalsContact C-N 3.33Å; L52-N57 HydrophobicContact CD1-CB 4.18Å; L52-N57 HydrophobicContact CD2-CB 4.04Å; L52-Q58 HydrophobicContact CB-CG 3.83Å; L52-Q58 PolarHBondContact O-NE2 3.43Å; L52-V61 HydrophobicContact CD1-CB 4.38Å; L52-V61 HydrophobicContact CD1-CG2 3.6Å
53G52Low62.7Low88 Ų8896.8 Ų96.891%0.90748%0.482SS*.  trans-86.4-4.517900000115.7E51E51-G53 PolarHBondContact O-N 3.09Å
54D60.3Low63.1Low71 Ų7195 Ų9538%0.3848%0.48SS..  trans-117.1127.4-177.8147.343.9000111.3Y56 N57 Q58D54-Y56 VanDerWaalsContact C-N 3.28Å; D54-Y56 PolarHBondContact O-N 3.36Å; D54-Y56 VanDerWaalsContact OD1-CB 3.29Å; D54-Y56 WeakPolarHBondContact OD1-CB 3.49Å; D54-Y56 PolarHBondContact OD1-N 2.95Å; D54-N57 PolarHBondContact O-N 3.06Å; D54-N57 PolarHBondContact OD2-N 3.11Å; D54-N57 PolarHBondContact OD2-ND2 2.96Å; D54-Q58 WeakPolarHBondContact O-CG 3.43Å; D54-Q58 PolarHBondContact O-N 3.05Å
55T57.3Low63.3Low109 Ų10992 Ų9267%0.66946%0.462SS*.Hα-helixtrans-59.2-31.1-177.4-31.80000113.8K59T55-K59 WeakPolarHBondContact O-CB 3.42Å; T55-K59 PolarHBondContact O-N 2.97Å
56Y64.3Low63.9Low171 Ų17192.1 Ų92.167%0.67146%0.462SS*.Hα-helixtrans-67.9-47.4177.2177.1-96.6000111.4D54 K59 K60D54-Y56 VanDerWaalsContact C-N 3.28Å; D54-Y56 PolarHBondContact O-N 3.36Å; D54-Y56 VanDerWaalsContact OD1-CB 3.29Å; D54-Y56 WeakPolarHBondContact OD1-CB 3.49Å; D54-Y56 PolarHBondContact OD1-N 2.95Å; Y56-K59 PolarHBondContact O-N 3.03Å; Y56-K60 PolarHBondContact O-N 3.16Å; Y56-K60 VanDerWaalsContact O-N 3.1Å
57N61.6Low64.7Low66 Ų6696.1 Ų96.135%0.35348%0.479SS..Hα-helixtrans-69.8-36.3177.4-77.9-50.9000112.4L52 D54 K59 K60 V61L52-N57 HydrophobicContact CD1-CB 4.18Å; L52-N57 HydrophobicContact CD2-CB 4.04Å; D54-N57 PolarHBondContact O-N 3.06Å; D54-N57 PolarHBondContact OD2-N 3.11Å; D54-N57 PolarHBondContact OD2-ND2 2.96Å; N57-K59 VanDerWaalsContact C-N 3.35Å; N57-K59 PolarHBondContact O-N 3.32Å; N57-K60 PolarHBondContact O-N 3.3Å; N57-V61 WeakPolarHBondContact O-CG2 3.43Å; N57-V61 PolarHBondContact O-N 2.96Å; N57-V61 VanDerWaalsContact O-N 3.08Å
58Q52Low65.2Low54 Ų5497 Ų9725%0.25248%0.481SS..Hα-helixtrans-57.2-47.7170.6-75.1178.7-11.600111.5F49 L52 D54 K60 V61 Y62F49-Q58 HydrophobicContact CD2-CB 4.19Å; F49-Q58 HydrophobicContact CD2-CG 4.49Å; F49-Q58 HydrophobicContact CE2-CB 3.69Å; F49-Q58 HydrophobicContact CE2-CG 4.25Å; F49-Q58 VanDerWaalsContact CE2-O 3.29Å; F49-Q58 WeakPolarHBondContact CE2-O 3.4Å; F49-Q58 HydrophobicContact CZ-CB 4.19Å; L52-Q58 HydrophobicContact CB-CG 3.83Å; L52-Q58 PolarHBondContact O-NE2 3.43Å; D54-Q58 WeakPolarHBondContact O-CG 3.43Å; D54-Q58 PolarHBondContact O-N 3.05Å; Q58-K60 VanDerWaalsContact C-N 3.32Å; Q58-K60 PolarHBondContact O-N 2.9Å; Q58-V61 PolarHBondContact O-N 3.2Å; Q58-Y62 WeakPolarHBondContact O-CB 3.43Å; Q58-Y62 PolarHBondContact O-N 3.36Å
59K66.8Low65.9Low123 Ų12395.1 Ų95.154%0.53548%0.476SS..Hα-helixtrans-59.7-41177.3-179.5172.7-178.1-63.20112.1T55 Y56 N57 Y62 D63T55-K59 WeakPolarHBondContact O-CB 3.42Å; T55-K59 PolarHBondContact O-N 2.97Å; Y56-K59 PolarHBondContact O-N 3.03Å; N57-K59 VanDerWaalsContact C-N 3.35Å; N57-K59 PolarHBondContact O-N 3.32Å; K59-Y62 PolarHBondContact O-N 2.91Å; K59-D63 IonicContact NZ-OD2 2.78Å; K59-D63 PolarHBondContact NZ-OD2 3.08Å; K59-D63 WeakPolarHBondContact O-CB 3.33Å; K59-D63 VanDerWaalsContact O-CG 3.22Å; K59-D63 PolarHBondContact O-N 3.49Å
60K71.6Confident66.9Low138 Ų138101 Ų10160%0.650%0.496SS*.Hα-helixtrans-63-42.4177.7-171.6-179.5178.7-178.90112.4Y56 N57 Q58 A64Y56-K60 PolarHBondContact O-N 3.16Å; Y56-K60 VanDerWaalsContact O-N 3.1Å; N57-K60 PolarHBondContact O-N 3.3Å; Q58-K60 VanDerWaalsContact C-N 3.32Å; Q58-K60 PolarHBondContact O-N 2.9Å; K60-A64 WeakPolarHBondContact O-CB 3.46Å; K60-A64 PolarHBondContact O-N 3.23Å; K60-A64 VanDerWaalsContact O-N 3.1Å
61V65.1Low67.6Low46 Ų4693.3 Ų93.328%0.27948%0.479SS..Hα-helixtrans-66.8-41.5176.1173.70000110.9F49 L52 N57 Q58 A64 F65F49-V61 HydrophobicContact CB-CG1 4.2Å; F49-V61 HydrophobicContact CD2-CB 4.41Å; F49-V61 HydrophobicContact CD2-CG1 4.34Å; L52-V61 HydrophobicContact CD1-CB 4.38Å; L52-V61 HydrophobicContact CD1-CG2 3.6Å; N57-V61 WeakPolarHBondContact O-CG2 3.43Å; N57-V61 PolarHBondContact O-N 2.96Å; N57-V61 VanDerWaalsContact O-N 3.08Å; Q58-V61 PolarHBondContact O-N 3.2Å; V61-A64 PolarHBondContact O-N 3.48Å; V61-F65 WeakPolarHBondContact O-CB 3.34Å; V61-F65 PolarHBondContact O-N 3.14Å
62Y66.9Low67.8Low127 Ų12788.3 Ų88.350%0.49846%0.455SS..Hα-helixtrans-63.8-45.1175.9-177.1-98.5000112.6Q58 K59 A64 F65 V66Q58-Y62 WeakPolarHBondContact O-CB 3.43Å; Q58-Y62 PolarHBondContact O-N 3.36Å; K59-Y62 PolarHBondContact O-N 2.91Å; Y62-A64 VanDerWaalsContact C-N 3.32Å; Y62-A64 PolarHBondContact O-N 3.2Å; Y62-F65 WeakPolarHBondContact O-CB 3.37Å; Y62-F65 PolarHBondContact O-N 3.01Å; Y62-F65 VanDerWaalsContact O-N 3.15Å; Y62-V66 HydrophobicContact CD1-CG2 3.96Å; Y62-V66 HydrophobicContact CE1-CG2 3.55Å; Y62-V66 HydrophobicContact CE2-CG2 4.16Å; Y62-V66 HydrophobicContact CG-CG2 4.43Å; Y62-V66 WeakPolarHBondContact O-CG2 3.43Å; Y62-V66 PolarHBondContact O-N 2.92Å
63D71.6Confident68.5Low75 Ų7588.9 Ų88.940%0.40146%0.46SS..Hα-helixtrans-62.8-40.3178.4-73.2-20.3000111K59 V66 H67K59-D63 IonicContact NZ-OD2 2.78Å; K59-D63 PolarHBondContact NZ-OD2 3.08Å; K59-D63 WeakPolarHBondContact O-CB 3.33Å; K59-D63 VanDerWaalsContact O-CG 3.22Å; K59-D63 PolarHBondContact O-N 3.49Å; D63-V66 PolarHBondContact O-N 3.49Å; D63-H67 WeakPolarHBondContact O-CB 3.43Å; D63-H67 PolarHBondContact O-N 3.46Å
64A74.3Confident69.6Low54 Ų5486.7 Ų86.745%0.44643%0.434SS..Hα-helixtrans-64.3-41.4173.600000112K60 V61 Y62 H67 Q68K60-A64 WeakPolarHBondContact O-CB 3.46Å; K60-A64 PolarHBondContact O-N 3.23Å; K60-A64 VanDerWaalsContact O-N 3.1Å; V61-A64 PolarHBondContact O-N 3.48Å; Y62-A64 VanDerWaalsContact C-N 3.32Å; Y62-A64 PolarHBondContact O-N 3.2Å; A64-H67 PolarHBondContact O-N 3.11Å; A64-Q68 WeakPolarHBondContact O-CG 3.44Å; A64-Q68 PolarHBondContact O-N 3.45Å
65F70Confident70.3Confident38 Ų3889.7 Ų89.717%0.16744%0.444CS..Hα-helixtrans-62.6-48175.8174.7-109.8000112H42 M46 V61 Y62 H67 Q68 L69H42-F65 AromaticContact CD2-CE2 3.54Å; H42-F65 AromaticContact CD2-CZ 3.57Å; H42-F65 AromaticContact NE2-CZ 3.69Å; M46-F65 HydrophobicContact CE-CE1 3.94Å; M46-F65 HydrophobicContact CE-CZ 3.94Å; V61-F65 WeakPolarHBondContact O-CB 3.34Å; V61-F65 PolarHBondContact O-N 3.14Å; Y62-F65 WeakPolarHBondContact O-CB 3.37Å; Y62-F65 PolarHBondContact O-N 3.01Å; Y62-F65 VanDerWaalsContact O-N 3.15Å; F65-H67 VanDerWaalsContact C-N 3.31Å; F65-H67 PolarHBondContact O-N 3.49Å; F65-Q68 PolarHBondContact O-N 2.92Å; F65-L69 HydrophobicContact CD1-CD1 3.88Å; F65-L69 HydrophobicContact CD2-CD1 4.5Å; F65-L69 HydrophobicContact CE1-CD1 3.24Å; F65-L69 HydrophobicContact CE2-CD1 3.94Å; F65-L69 HydrophobicContact CG-CD1 4.47Å; F65-L69 HydrophobicContact CZ-CD1 3.28Å; F65-L69 HydrophobicContact CZ-CG 4.46Å; F65-L69 WeakPolarHBondContact O-CB 3.34Å; F65-L69 PolarHBondContact O-N 3.44Å
66V74.7Confident71.1Confident37 Ų3789.3 Ų89.322%0.22444%0.436CS..Hα-helixtrans-61.2-40.3177170.90000111.1Y62 D63 L69 R70Y62-V66 HydrophobicContact CD1-CG2 3.96Å; Y62-V66 HydrophobicContact CE1-CG2 3.55Å; Y62-V66 HydrophobicContact CE2-CG2 4.16Å; Y62-V66 HydrophobicContact CG-CG2 4.43Å; Y62-V66 WeakPolarHBondContact O-CG2 3.43Å; Y62-V66 PolarHBondContact O-N 2.92Å; D63-V66 PolarHBondContact O-N 3.49Å; V66-L69 WeakPolarHBondContact O-CB 3.26Å; V66-L69 PolarHBondContact O-N 2.93Å; V66-R70 WeakPolarHBondContact O-CG 3.39Å; V66-R70 PolarHBondContact O-N 3.47Å
67H79.7Confident71.6Confident146 Ų14686.6 Ų86.668%0.67643%0.43SS*.Hα-helixtrans-63.3-43.7176.5-170.669.6000111.8D63 A64 F65 L69 R70 G71D63-H67 WeakPolarHBondContact O-CB 3.43Å; D63-H67 PolarHBondContact O-N 3.46Å; A64-H67 PolarHBondContact O-N 3.11Å; F65-H67 VanDerWaalsContact C-N 3.31Å; F65-H67 PolarHBondContact O-N 3.49Å; H67-L69 VanDerWaalsContact C-N 3.34Å; H67-L69 PolarHBondContact O-N 3.31Å; H67-R70 PolarHBondContact O-N 2.93Å; H67-G71 PolarHBondContact O-N 3Å
68Q77.3Confident72.3Confident100 Ų10089.9 Ų89.947%0.46744%0.441SS..Hα-helixtrans-62.5-41173.4-72.5-173.6-1.300111.9A64 F65 G71 K72A64-Q68 WeakPolarHBondContact O-CG 3.44Å; A64-Q68 PolarHBondContact O-N 3.45Å; F65-Q68 PolarHBondContact O-N 2.92Å; Q68-G71 PolarHBondContact O-N 3.48Å; Q68-K72 WeakPolarHBondContact O-CB 3.49Å; Q68-K72 WeakPolarHBondContact O-CG 3.36Å; Q68-K72 PolarHBondContact O-N 3.47Å
69L76Confident73.3Confident80 Ų8091.2 Ų91.242%0.41945%0.449SS..Hα-helixtrans-60.6-49.4177.1-119149.8000111.6F65 V66 H67 G71 K72 T73F65-L69 HydrophobicContact CD1-CD1 3.88Å; F65-L69 HydrophobicContact CD2-CD1 4.5Å; F65-L69 HydrophobicContact CE1-CD1 3.24Å; F65-L69 HydrophobicContact CE2-CD1 3.94Å; F65-L69 HydrophobicContact CG-CD1 4.47Å; F65-L69 HydrophobicContact CZ-CD1 3.28Å; F65-L69 HydrophobicContact CZ-CG 4.46Å; F65-L69 WeakPolarHBondContact O-CB 3.34Å; F65-L69 PolarHBondContact O-N 3.44Å; V66-L69 WeakPolarHBondContact O-CB 3.26Å; V66-L69 PolarHBondContact O-N 2.93Å; H67-L69 VanDerWaalsContact C-N 3.34Å; H67-L69 PolarHBondContact O-N 3.31Å; L69-G71 PolarHBondContact O-N 3.2Å; L69-K72 CarbonylContact O-C 3.56Å; L69-K72 WeakPolarHBondContact O-CA 3.42Å; L69-K72 WeakPolarHBondContact O-CB 3.37Å; L69-K72 PolarHBondContact O-N 2.95Å; L69-T73 PolarHBondContact O-N 2.95Å; L69-T73 PolarHBondContact O-OG1 3.28Å; L69-T73 VanDerWaalsContact O-OG1 3.08Å
70R75.3Confident73.7Confident185 Ų18587.8 Ų87.870%0.69844%0.444SS*.Hα-helixtrans-60-44.4177.2-73-178.3-179.2-159.10.7112.2V66 H67 K72 T73 A74V66-R70 WeakPolarHBondContact O-CG 3.39Å; V66-R70 PolarHBondContact O-N 3.47Å; H67-R70 PolarHBondContact O-N 2.93Å; R70-K72 PolarHBondContact O-N 3.16Å; R70-T73 PolarHBondContact O-N 3.35Å; R70-A74 PolarHBondContact O-N 3.43Å; R70-A74 VanDerWaalsContact O-N 3.11Å
71G78.2Confident74.2Confident38 Ų3886.1 Ų86.139%0.39244%0.438SS..Hα-helixtrans-62.7-29.9175.400000113H67 Q68 L69 K75H67-G71 PolarHBondContact O-N 3Å; Q68-G71 PolarHBondContact O-N 3.48Å; L69-G71 PolarHBondContact O-N 3.2Å; G71-K75 WeakPolarHBondContact O-CG 3.33Å; G71-K75 PolarHBondContact O-N 3.3Å
72K69.7Low74.7Confident57 Ų5788.5 Ų88.525%0.24845%0.446CS..Hα-helixtrans-79-40.9176.1-73.1176.9-176-156.30112.4W38 Q68 L69 R70 A74 K75 I76W38-K72 HydrophobicContact CD2-CD 4.49Å; W38-K72 HydrophobicContact CE3-CD 4.16Å; W38-K72 HydrophobicContact CH2-CG 4.49Å; W38-K72 HydrophobicContact CZ3-CD 4.34Å; W38-K72 HydrophobicContact CZ3-CG 4.33Å; Q68-K72 WeakPolarHBondContact O-CB 3.49Å; Q68-K72 WeakPolarHBondContact O-CG 3.36Å; Q68-K72 PolarHBondContact O-N 3.47Å; L69-K72 CarbonylContact O-C 3.56Å; L69-K72 WeakPolarHBondContact O-CA 3.42Å; L69-K72 WeakPolarHBondContact O-CB 3.37Å; L69-K72 PolarHBondContact O-N 2.95Å; R70-K72 PolarHBondContact O-N 3.16Å; K72-A74 VanDerWaalsContact C-N 3.3Å; K72-A74 PolarHBondContact O-N 3.49Å; K72-K75 WeakPolarHBondContact O-CB 3.44Å; K72-K75 PolarHBondContact O-N 2.93Å; K72-I76 WeakPolarHBondContact O-CG1 3.48Å; K72-I76 PolarHBondContact O-N 3.32Å
73T74.9Confident75Confident63 Ų6386.3 Ų86.339%0.38745%0.446SS..Hα-helixtrans-56.1-46.2173.3-55.40000110.9L69 R70 K75 I76 E77L69-T73 PolarHBondContact O-N 2.95Å; L69-T73 PolarHBondContact O-OG1 3.28Å; L69-T73 VanDerWaalsContact O-OG1 3.08Å; R70-T73 PolarHBondContact O-N 3.35Å; T73-K75 PolarHBondContact O-N 3.04Å; T73-I76 PolarHBondContact O-N 2.92Å; T73-I76 VanDerWaalsContact O-N 3.08Å; T73-E77 WeakPolarHBondContact O-CG 3.47Å; T73-E77 PolarHBondContact O-N 2.99Å
74A74.6Confident75.3Confident42 Ų4288 Ų8835%0.34745%0.454SS..Hα-helixtrans-61.8-30176.800000113.5R70 K72 K78R70-A74 PolarHBondContact O-N 3.43Å; R70-A74 VanDerWaalsContact O-N 3.11Å; K72-A74 VanDerWaalsContact C-N 3.3Å; K72-A74 PolarHBondContact O-N 3.49Å; A74-K78 WeakPolarHBondContact O-CG 3.48Å; A74-K78 PolarHBondContact O-N 3.02Å
75K74.2Confident75.5Confident135 Ų13591.4 Ų91.459%0.58746%0.455SS*.Hα-helixtrans-75.1-36.4174.8-73.1175.9-178.2179.90112G71 K72 T73 L79G71-K75 WeakPolarHBondContact O-CG 3.33Å; G71-K75 PolarHBondContact O-N 3.3Å; K72-K75 WeakPolarHBondContact O-CB 3.44Å; K72-K75 PolarHBondContact O-N 2.93Å; T73-K75 PolarHBondContact O-N 3.04Å; K75-L79 PolarHBondContact O-N 3.45Å
76I74.1Confident75.8Confident101 Ų10194.2 Ų94.252%0.51847%0.465SS..Hα-helixtrans-66.6-43.7175.3-67.1169000110.2K72 T73 K78 L79 A80K72-I76 WeakPolarHBondContact O-CG1 3.48Å; K72-I76 PolarHBondContact O-N 3.32Å; T73-I76 PolarHBondContact O-N 2.92Å; T73-I76 VanDerWaalsContact O-N 3.08Å; I76-K78 PolarHBondContact O-N 2.87Å; I76-L79 WeakPolarHBondContact O-CB 3.29Å; I76-L79 PolarHBondContact O-N 3.49Å; I76-L79 VanDerWaalsContact O-N 3.14Å; I76-A80 PolarHBondContact O-N 3.45Å
77E75.2Confident75.9Confident114 Ų11496.4 Ų96.453%0.53348%0.476SS..Hα-helixtrans-59-46.2175.5-71.9168.8170.200111.4T73 L79 A80 E81T73-E77 WeakPolarHBondContact O-CG 3.47Å; T73-E77 PolarHBondContact O-N 2.99Å; E77-L79 VanDerWaalsContact C-N 3.31Å; E77-L79 PolarHBondContact O-N 3.32Å; E77-A80 WeakPolarHBondContact O-CB 3.3Å; E77-A80 PolarHBondContact O-N 2.97Å; E77-A80 VanDerWaalsContact O-N 3.16Å; E77-E81 WeakPolarHBondContact O-CG 3.31Å; E77-E81 PolarHBondContact O-N 3.19Å
78K76.9Confident75.8Confident134 Ų13493.3 Ų93.358%0.58346%0.464SS*.Hα-helixtrans-60.9-37.3174.1-77.4-177.2178.7-172.20113.5A74 I76 E81 H82A74-K78 WeakPolarHBondContact O-CG 3.48Å; A74-K78 PolarHBondContact O-N 3.02Å; I76-K78 PolarHBondContact O-N 2.87Å; K78-E81 PolarHBondContact O-N 3.39Å; K78-H82 PolarHBondContact O-CD2 3.02Å; K78-H82 PolarHBondContact O-N 2.94Å
79L71.9Confident75.6Confident83 Ų8393.9 Ų93.944%0.43547%0.467SS..Hα-helixtrans-65.8-42.7175.7-17073.8000110.6T31 K75 I76 E77 E81 H82 V83T31-L79 HydrophobicContact CG2-CD2 4.02Å; K75-L79 PolarHBondContact O-N 3.45Å; I76-L79 WeakPolarHBondContact O-CB 3.29Å; I76-L79 PolarHBondContact O-N 3.49Å; I76-L79 VanDerWaalsContact O-N 3.14Å; E77-L79 VanDerWaalsContact C-N 3.31Å; E77-L79 PolarHBondContact O-N 3.32Å; L79-E81 VanDerWaalsContact C-N 3.35Å; L79-E81 PolarHBondContact O-N 3.37Å; L79-H82 WeakPolarHBondContact O-CB 3.49Å; L79-H82 PolarHBondContact O-N 3.04Å; L79-V83 WeakPolarHBondContact O-CG2 3.38Å; L79-V83 PolarHBondContact O-N 3.49Å
80A74.9Confident75.4Confident51 Ų5194.1 Ų94.142%0.42147%0.468SS..Hα-helixtrans-61.1-42.7175.300000111.7I76 E77 H82 V83 L84I76-A80 PolarHBondContact O-N 3.45Å; E77-A80 WeakPolarHBondContact O-CB 3.3Å; E77-A80 PolarHBondContact O-N 2.97Å; E77-A80 VanDerWaalsContact O-N 3.16Å; A80-H82 VanDerWaalsContact C-N 3.33Å; A80-H82 PolarHBondContact O-N 3.29Å; A80-V83 PolarHBondContact O-N 3.28Å; A80-L84 WeakPolarHBondContact O-CG 3.4Å; A80-L84 PolarHBondContact O-N 2.89Å
81E82.8Confident75.2Confident103 Ų10388.7 Ų88.748%0.48145%0.453SS..Hα-helixtrans-61.6-37.6173.9-72.2175.3-175.500113.1E77 K78 L79 R85E77-E81 WeakPolarHBondContact O-CG 3.31Å; E77-E81 PolarHBondContact O-N 3.19Å; K78-E81 PolarHBondContact O-N 3.39Å; L79-E81 VanDerWaalsContact C-N 3.35Å; L79-E81 PolarHBondContact O-N 3.37Å; E81-R85 PolarHBondContact O-N 3.49Å
82H76Confident75Confident96 Ų9695.6 Ų95.644%0.44447%0.467SS..Hα-helixtrans-66.6-43.8175.4-81.8-160.4000111.4K78 L79 A80 L84 R85 W86K78-H82 PolarHBondContact O-CD2 3.02Å; K78-H82 PolarHBondContact O-N 2.94Å; L79-H82 WeakPolarHBondContact O-CB 3.49Å; L79-H82 PolarHBondContact O-N 3.04Å; A80-H82 VanDerWaalsContact C-N 3.33Å; A80-H82 PolarHBondContact O-N 3.29Å; H82-L84 VanDerWaalsContact C-N 3.35Å; H82-L84 PolarHBondContact O-N 3.19Å; H82-R85 PolarHBondContact CD2-NH2 2.98Å; H82-R85 VanDerWaalsContact CD2-NH2 3.3Å; H82-R85 PolarHBondContact O-N 3.4Å; H82-W86 PolarHBondContact O-N 3.09Å
83V73Confident74.9Confident81 Ų8199.3 Ų99.349%0.49149%0.485SS..Hα-helixtrans-62.8-41.9177.2171.70000111.3L79 A80 W86 N87L79-V83 WeakPolarHBondContact O-CG2 3.38Å; L79-V83 PolarHBondContact O-N 3.49Å; A80-V83 PolarHBondContact O-N 3.28Å; V83-W86 PolarHBondContact O-N 3.47Å; V83-N87 PolarHBondContact O-N 3.4Å
84L77.5Confident74.4Confident109 Ų109103 Ų10357%0.57150%0.5SS*.Hα-helixtrans-63.6-45.7176-72.7170.8000111.9A80 H82 W86 N87 D88A80-L84 WeakPolarHBondContact O-CG 3.4Å; A80-L84 PolarHBondContact O-N 2.89Å; H82-L84 VanDerWaalsContact C-N 3.35Å; H82-L84 PolarHBondContact O-N 3.19Å; L84-W86 VanDerWaalsContact C-N 3.29Å; L84-W86 PolarHBondContact O-N 2.99Å; L84-N87 WeakPolarHBondContact O-CB 3.43Å; L84-N87 PolarHBondContact O-N 3.35Å; L84-N87 VanDerWaalsContact O-N 3.16Å; L84-D88 PolarHBondContact O-N 3.35Å
85R78.1Confident73.9Confident126 Ų126108.6 Ų108.648%0.47552%0.519SS..Hα-helixtrans-59.1-40.4174.6-93-176.3-82.3172.6-10112.7E81 H82 D88 E89E81-R85 PolarHBondContact O-N 3.49Å; H82-R85 PolarHBondContact CD2-NH2 2.98Å; H82-R85 VanDerWaalsContact CD2-NH2 3.3Å; H82-R85 PolarHBondContact O-N 3.4Å; R85-D88 PolarHBondContact O-N 2.98Å; R85-E89 WeakPolarHBondContact O-CG 3.44Å; R85-E89 PolarHBondContact O-N 3.37Å
86W77.8Confident72.6Confident98 Ų98112 Ų11237%0.37153%0.528SS..Hα-helixtrans-65.1-40.1176.2-78.414.2000112.1F24 Q27 H82 V83 L84 D88 E89 L90F24-W86 HydrophobicContact CD2-CZ3 4.21Å; Q27-W86 VanDerWaalsContact OE1-CH2 3.3Å; H82-W86 PolarHBondContact O-N 3.09Å; V83-W86 PolarHBondContact O-N 3.47Å; L84-W86 VanDerWaalsContact C-N 3.29Å; L84-W86 PolarHBondContact O-N 2.99Å; W86-D88 VanDerWaalsContact C-N 3.34Å; W86-E89 PolarHBondContact O-N 3.42Å; W86-L90 WeakPolarHBondContact O-CB 3.46Å; W86-L90 PolarHBondContact O-N 3.06Å
87N75.4Confident71.4Confident83 Ų83112 Ų11244%0.44453%0.534SS..Hα-helixtrans-59.5-46.9173.7-173.677.5000111.1V83 L84 E89 L90 D91V83-N87 PolarHBondContact O-N 3.4Å; L84-N87 WeakPolarHBondContact O-CB 3.43Å; L84-N87 PolarHBondContact O-N 3.35Å; L84-N87 VanDerWaalsContact O-N 3.16Å; N87-E89 VanDerWaalsContact C-N 3.33Å; N87-E89 PolarHBondContact O-N 3.16Å; N87-L90 PolarHBondContact O-N 3.32Å; N87-D91 PolarHBondContact ND2-OD2 2.95Å; N87-D91 PolarHBondContact O-N 3Å
88D77.8Confident70.3Confident81 Ų81111.1 Ų111.143%0.43354%0.539SS..Hα-helixtrans-63.3-37178.4-65.9-14.8000112.9L84 R85 W86 R92L84-D88 PolarHBondContact O-N 3.35Å; R85-D88 PolarHBondContact O-N 2.98Å; W86-D88 VanDerWaalsContact C-N 3.34Å; D88-R92 WeakPolarHBondContact O-CB 3.34Å; D88-R92 VanDerWaalsContact O-CG 3.24Å; D88-R92 WeakPolarHBondContact O-CG 3.47Å; D88-R92 PolarHBondContact O-N 2.99Å
89E73.3Confident69.2Low112 Ų112108.2 Ų108.252%0.52354%0.54SS..Hα-helixtrans-65.4-42174.6-78173.3-173.100111.5R85 W86 N87 R92 E93R85-E89 WeakPolarHBondContact O-CG 3.44Å; R85-E89 PolarHBondContact O-N 3.37Å; W86-E89 PolarHBondContact O-N 3.42Å; N87-E89 VanDerWaalsContact C-N 3.33Å; N87-E89 PolarHBondContact O-N 3.16Å; E89-R92 PolarHBondContact O-N 2.95Å; E89-E93 PolarHBondContact O-N 3.29Å
90L71.8Confident68Low84 Ų84112.1 Ų112.144%0.4456%0.555SS.*Hα-helixtrans-67.1-42.7179.1-147.5138.9000111.1W86 N87 R92 E93 M94W86-L90 WeakPolarHBondContact O-CB 3.46Å; W86-L90 PolarHBondContact O-N 3.06Å; N87-L90 PolarHBondContact O-N 3.32Å; L90-R92 VanDerWaalsContact C-N 3.35Å; L90-R92 PolarHBondContact O-N 2.95Å; L90-E93 PolarHBondContact O-N 3.44Å; L90-M94 HydrophobicContact CD2-SD 3.81Å; L90-M94 WeakPolarHBondContact O-CB 3.24Å; L90-M94 VanDerWaalsContact O-CG 3.31Å; L90-M94 WeakPolarHBondContact O-CG 3.44Å; L90-M94 PolarHBondContact O-N 3.31Å
91D71.5Confident66.7Low71 Ų71121.7 Ų121.738%0.3858%0.581SS.*Hα-helixtrans-61.7-41.1174.1-74.4-28.9000111.4N87 M94 E95N87-D91 PolarHBondContact ND2-OD2 2.95Å; N87-D91 PolarHBondContact O-N 3Å; D91-M94 PolarHBondContact O-N 3.23Å; D91-E95 WeakPolarHBondContact O-CB 3.44Å; D91-E95 WeakPolarHBondContact O-CG 3.46Å; D91-E95 PolarHBondContact O-N 3.25Å
92R74.5Confident65Low184 Ų184121.2 Ų121.269%0.69458%0.581SS**Hα-helixtrans-66.3-37.7175.4-76.5174.7-172.7-179.56.2113.6D88 E89 L90 M94 R96D88-R92 WeakPolarHBondContact O-CB 3.34Å; D88-R92 VanDerWaalsContact O-CG 3.24Å; D88-R92 WeakPolarHBondContact O-CG 3.47Å; D88-R92 PolarHBondContact O-N 2.99Å; E89-R92 PolarHBondContact O-N 2.95Å; L90-R92 VanDerWaalsContact C-N 3.35Å; L90-R92 PolarHBondContact O-N 2.95Å; R92-M94 VanDerWaalsContact C-N 3.29Å; R92-R96 PolarHBondContact O-N 2.96Å
93E66.7Low63.5Low134 Ų134122.4 Ų122.463%0.62660%0.597SS**Hα-helixtrans-66.7-34.9174.2-75.4-166.8163.800111.6E89 L90E89-E93 PolarHBondContact O-N 3.29Å; L90-E93 PolarHBondContact O-N 3.44Å
94M63.7Low62.4Low142 Ų142130.1 Ų130.170%0.762%0.617SS**Hα-helixtrans-74.2-34.7176.1-72.4-176.960.500113.5L90 D91 R92 R96L90-M94 HydrophobicContact CD2-SD 3.81Å; L90-M94 WeakPolarHBondContact O-CB 3.24Å; L90-M94 VanDerWaalsContact O-CG 3.31Å; L90-M94 WeakPolarHBondContact O-CG 3.44Å; L90-M94 PolarHBondContact O-N 3.31Å; D91-M94 PolarHBondContact O-N 3.23Å; R92-M94 VanDerWaalsContact C-N 3.29Å; M94-R96 VanDerWaalsContact C-N 3.31Å
95E64Low60.9Low159 Ų159129.9 Ų129.974%0.74362%0.624SS**Hα-helixtrans-77.3-14.1176.7-76.6-166.8160.700113.7D91 P97D91-E95 WeakPolarHBondContact O-CB 3.44Å; D91-E95 WeakPolarHBondContact O-CG 3.46Å; D91-E95 PolarHBondContact O-N 3.25Å; E95-P97 WeakPolarHBondContact O-CD 3.09Å
96R46.8Very low59.5Low206 Ų206129.5 Ų129.578%0.77764%0.641SS**  trans-62.6108.7179.3-157176.3-170.1179.74.2109R92 M94R92-R96 PolarHBondContact O-N 2.96Å; M94-R96 VanDerWaalsContact C-N 3.31Å
97P50.8Low58Low101 Ų101130.9 Ų130.966%0.65666%0.661SS**  trans-63.9140.9-179-12.426.6000107.6E95 A99E95-P97 WeakPolarHBondContact O-CD 3.09Å; P97-A99 VanDerWaalsContact C-N 3.33Å; P97-A99 PolarHBondContact O-N 3.03Å
98P51.6Low56.9Low96 Ų96132.3 Ų132.362%0.62368%0.675SS**  trans-57.9107.4161.923.9-29.4000106.6H100P98-H100 PolarHBondContact O-N 3.33Å; P98-H100 VanDerWaalsContact O-N 3.16Å
99A53.4Low55.7Low73 Ų73132.8 Ų132.860%0.60369%0.689SS**SBendtrans-51.7126.9167.700000106.8P97P97-A99 VanDerWaalsContact C-N 3.33Å; P97-A99 PolarHBondContact O-N 3.03Å
100H47.6Very low54.6Low164 Ų164133.6 Ų133.676%0.75970%0.704SS**  trans95.981.2-167.9-51.8-49.5000115.2P98 L102P98-H100 PolarHBondContact O-N 3.33Å; P98-H100 VanDerWaalsContact O-N 3.16Å; H100-L102 PolarHBondContact O-N 2.84Å
101R45.7Very low53.9Low253 Ų253133.5 Ų133.596%0.95572%0.716SS**  trans-54.596.2136.5-71.6-176.4178.7-173.70.1107.5
102L47.7Very low53.2Low93 Ų93135.4 Ų135.449%0.48773%0.732SS.*  trans-64.5135.9162.4-68.9159.6000107.2Q2 H100 R104Q2-L102 VanDerWaalsContact CD-CD1 3.48Å; Q2-L102 HydrophobicContact CG-CD1 4.39Å; H100-L102 PolarHBondContact O-N 2.84Å; L102-R104 PolarHBondContact O-N 3.27Å
103P44.9Very low52.3Low120 Ų120132.7 Ų132.778%0.77974%0.739SS**  trans-56.3127.8172.623-29.9000107.8S105P103-S105 PolarHBondContact O-N 3.23Å
104R49.3Very low51.2Low243 Ų243135.8 Ų135.892%0.91775%0.75SS**  trans-52.5114.5173.9-77.3177.6166.4172.3-5.2107.5L102 S106L102-R104 PolarHBondContact O-N 3.27Å; R104-S106 PolarHBondContact O-N 3.1Å
105S46.4Very low50.4Low104 Ų104135.1 Ų135.173%0.72775%0.749SS**  trans-63.9123.5168.463.90000107.4P103 T107P103-S105 PolarHBondContact O-N 3.23Å; S105-T107 PolarHBondContact O-N 3.48Å
106S49.8Very low49.7Very low118 Ų118134.5 Ų134.583%0.82575%0.751SS**  trans-51.4105.6171.8-37.60000109.2R104R104-S106 PolarHBondContact O-N 3.1Å
107T46.1Very low49.7Very low127 Ų127128.2 Ų128.278%0.77974%0.739SS**  trans-64.1126.3172-35.70000107.8S105S105-T107 PolarHBondContact O-N 3.48Å
108P51Low49.6Very low114 Ų114129.3 Ų129.374%0.7474%0.743SS**  trans-63.5146.6164.4-9.324.8000108.5
109A53Low49.4Very low90 Ų90128.9 Ų128.974%0.74475%0.748SS**  trans-45148.7-175.400000113.8A111A109-A111 PolarHBondContact O-N 3.16Å
110P51.1Low49Very low129 Ų129135.6 Ų135.684%0.83876%0.759SS**PPolyproline II helixtrans-58.2128.3178.223.5-31.5000110.5
111A57.1Low49Very low82 Ų82137.8 Ų137.868%0.67876%0.762SS**PPolyproline II helixtrans-58.1148.817000000110.2A109A109-A111 PolarHBondContact O-N 3.16Å
112P56.4Low49Very low112 Ų112135.8 Ų135.873%0.72776%0.761SS**PPolyproline II helixtrans-59.6151-178.724.8-33.2000111.3F114P112-F114 PolarHBondContact O-N 2.81Å
113P55.8Low49Very low127 Ų127139.9 Ų139.983%0.82578%0.777SS**PPolyproline II helixtrans-59.6135.8-177.224.5-32.5000110.5D115P113-D115 PolarHBondContact O-N 2.93Å
114F43.3Very low48.8Very low199 Ų199142.8 Ų142.887%0.87378%0.78SS**PPolyproline II helixtrans-55.8134.7177-71.5-90.8000111P112P112-F114 PolarHBondContact O-N 2.81Å
115D45.4Very low48.2Very low127 Ų127140.5 Ų140.568%0.67978%0.78SS**PPolyproline II helixtrans-65.8127174.6-17214.2000110P113 S117P113-D115 PolarHBondContact O-N 2.93Å; D115-S117 PolarHBondContact O-N 2.96Å; D115-S117 PolarHBondContact OD2-OG 3.26Å
116N49.6Very low48Very low147 Ų147149.4 Ų149.479%0.78681%0.806SS**G310 helixtrans-73.813.1-174.1-99.9-12.1000113.6V118N116-V118 VanDerWaalsContact C-N 3.33Å; N116-V118 PolarHBondContact O-N 3.01Å
117S47.8Very low47.9Very low73 Ų73151 Ų15151%0.5181%0.805SS.*G310 helixtrans-81-6.3-175.751.60000114.3D115D115-S117 PolarHBondContact O-N 2.96Å; D115-S117 PolarHBondContact OD2-OG 3.26Å
118V48.6Very low48Very low125 Ų125152.2 Ų152.276%0.75881%0.806SS**G310 helixtrans-95-11.9-177-169.20000113.4N116 Y120N116-V118 VanDerWaalsContact C-N 3.33Å; N116-V118 PolarHBondContact O-N 3.01Å; V118-Y120 VanDerWaalsContact C-N 3.27Å; V118-Y120 PolarHBondContact O-N 3.2Å
119A46.6Very low47.8Very low86 Ų86154.3 Ų154.371%0.71181%0.81SS**THydrogen-bonded Turntrans-77.2-3.1-176.600000115.1
120Y45Very low47.5Very low214 Ų214158.1 Ų158.184%0.83981%0.814SS**THydrogen-bonded Turntrans-105.39.5-169.9-106-81.6000116.5V118V118-Y120 VanDerWaalsContact C-N 3.27Å; V118-Y120 PolarHBondContact O-N 3.2Å
121Y48.4Very low47.3Very low211 Ų211159.9 Ų159.983%0.82781%0.812SS**SBendtrans-109.310.8-176.2-96.5-79.7000116.3
122F46.7Very low46.6Very low210 Ų210165.1 Ų165.192%0.92182%0.821SS**SBendtrans-123.39.7-179.2-96.6-77.4000116.4
123E45.7Very low45.9Very low179 Ų179168.9 Ų168.984%0.83683%0.828SS**SBendtrans-114.42.5-178.6-97.7-171.1165.800117.2
124H42.4Very low45.2Very low181 Ų181172.2 Ų172.284%0.83883%0.828SS**  trans-144.1101.2173-75.4-68.2000112.8
125Q36.8Very low45.3Very low196 Ų196169.9 Ų169.992%0.91683%0.825SS**  -179.984.7125.9-95.2173.120.600110.2
126F40.9Very low45.3Very low290 Ų290173.8 Ų173.8100%1.27284%0.838SS**  -97.10127.8-84.5-79.5000107

Retrieved 126 of 126 residues in 35.9 ms (Link to these results)