A0A5K4FA51_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A5K4FA51, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 97 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
1M56.7Low66.5Low218 Ų218103.9 Ų103.9100%1.07456%0.557SS**  01.80-85.6168.6154.900113.8
2T59Low67.6Low87 Ų87101.1 Ų101.153%0.53454%0.541SS..  trans-84.3-31.2-179.838.30000114.1L4 N5 I6T2-L4 VanDerWaalsContact C-N 3.31Å; T2-L4 PolarHBondContact O-N 2.88Å; T2-N5 PolarHBondContact O-N 3.32Å; T2-I6 PolarHBondContact O-N 3.45Å
3S58Low68.5Low96 Ų9697.8 Ų97.867%0.67152%0.522SS*.Hα-helixtrans-65.6-28.3-179.253.70000114.4I6 G7S3-I6 WeakPolarHBondContact O-CG2 3.5Å; S3-G7 PolarHBondContact O-N 3.29Å
4L59.5Low69.2Low145 Ų145100.2 Ų100.276%0.75953%0.526SS*.Hα-helixtrans-71-34.1179.4-160.675000111.8T2 F8T2-L4 VanDerWaalsContact C-N 3.31Å; T2-L4 PolarHBondContact O-N 2.88Å; L4-F8 PolarHBondContact O-N 3.31Å
5N64.9Low70Confident101 Ų101100.4 Ų100.454%0.5453%0.526SS..Hα-helixtrans-72.2-38.6179.1-83.2-43.8000112.2T2 G7 F8 C9T2-N5 PolarHBondContact O-N 3.32Å; N5-G7 VanDerWaalsContact C-N 3.33Å; N5-G7 PolarHBondContact O-N 2.81Å; N5-F8 PolarHBondContact O-N 3.28Å; N5-C9 PolarHBondContact O-N 2.66Å; N5-C9 VanDerWaalsContact O-N 3.08Å; N5-C9 PolarHBondContact O-SG 3.1Å; N5-C9 VanDerWaalsContact O-SG 3.42Å
6I68Low70.7Confident76 Ų7698.1 Ų98.139%0.3951%0.514SS..Hα-helixtrans-62.4-44.8177.7-140.181.4000110.2T2 S3 F8 C9 F10T2-I6 PolarHBondContact O-N 3.45Å; S3-I6 WeakPolarHBondContact O-CG2 3.5Å; I6-F8 PolarHBondContact O-N 3.39Å; I6-C9 WeakPolarHBondContact O-CB 3.4Å; I6-C9 PolarHBondContact O-N 3.39Å; I6-F10 HydrophobicContact CG1-CE2 3.9Å; I6-F10 HydrophobicContact CG2-CE2 4.32Å; I6-F10 WeakPolarHBondContact O-CD2 3.34Å; I6-F10 PolarHBondContact O-N 2.99Å; I6-F10 VanDerWaalsContact O-N 3.13Å
7G69.8Low71.2Confident29 Ų2998.3 Ų98.330%0.29952%0.515SS..Hα-helixtrans-62.3-42.5179.100000112.5S3 N5 C9 F10 I11S3-G7 PolarHBondContact O-N 3.29Å; N5-G7 VanDerWaalsContact C-N 3.33Å; N5-G7 PolarHBondContact O-N 2.81Å; G7-C9 VanDerWaalsContact C-N 3.32Å; G7-C9 PolarHBondContact O-N 3.48Å; G7-F10 PolarHBondContact O-N 3.16Å; G7-I11 WeakPolarHBondContact O-CG1 3.48Å; G7-I11 PolarHBondContact O-N 3.32Å
8F71.2Confident71.5Confident128 Ų12897.1 Ų97.156%0.56151%0.509SS*.Hα-helixtrans-62.3-38.7176.7-169.9-106.9000112.4L4 N5 I6 I11 I12L4-F8 PolarHBondContact O-N 3.31Å; N5-F8 PolarHBondContact O-N 3.28Å; I6-F8 PolarHBondContact O-N 3.39Å; F8-I11 PolarHBondContact O-N 3.03Å; F8-I12 HydrophobicContact CD1-CD1 3.64Å; F8-I12 HydrophobicContact CD1-CG1 4.45Å; F8-I12 HydrophobicContact CE1-CD1 3.3Å; F8-I12 HydrophobicContact CE1-CG1 4.21Å; F8-I12 HydrophobicContact CZ-CD1 3.93Å; F8-I12 HydrophobicContact CZ-CG1 4.45Å; F8-I12 WeakPolarHBondContact O-CG1 3.29Å; F8-I12 PolarHBondContact O-N 3.25Å
9C70.9Confident71.7Confident31 Ų31101.3 Ų101.321%0.20952%0.517CS..Hα-helixtrans-63.5-43.2174.3-72.30000112.7N5 I6 G7 I11 I12 I13N5-C9 PolarHBondContact O-N 2.66Å; N5-C9 VanDerWaalsContact O-N 3.08Å; N5-C9 PolarHBondContact O-SG 3.1Å; N5-C9 VanDerWaalsContact O-SG 3.42Å; I6-C9 WeakPolarHBondContact O-CB 3.4Å; I6-C9 PolarHBondContact O-N 3.39Å; G7-C9 VanDerWaalsContact C-N 3.32Å; G7-C9 PolarHBondContact O-N 3.48Å; C9-I11 VanDerWaalsContact C-N 3.3Å; C9-I11 PolarHBondContact O-N 3.06Å; C9-I12 PolarHBondContact O-N 2.88Å; C9-I13 VanDerWaalsContact O-CG1 3.26Å; C9-I13 WeakPolarHBondContact O-CG1 3.22Å; C9-I13 PolarHBondContact O-N 3.21Å
10F74.5Confident71.7Confident135 Ų135100.4 Ų100.459%0.59251%0.513SS*.Hα-helixtrans-60.9-39.9175.2-75.7-71.8000112.1I6 G7 I13 F14I6-F10 HydrophobicContact CG1-CE2 3.9Å; I6-F10 HydrophobicContact CG2-CE2 4.32Å; I6-F10 WeakPolarHBondContact O-CD2 3.34Å; I6-F10 PolarHBondContact O-N 2.99Å; I6-F10 VanDerWaalsContact O-N 3.13Å; G7-F10 PolarHBondContact O-N 3.16Å; F10-I13 PolarHBondContact O-N 3.02Å; F10-F14 VanDerWaalsContact O-CB 3.3Å; F10-F14 WeakPolarHBondContact O-CB 3.36Å; F10-F14 PolarHBondContact O-N 3Å
11I78.5Confident71.6Confident97 Ų9799.9 Ų99.950%0.49751%0.511SS..Hα-helixtrans-62.6-46.5177.1-66.4164.9000110.6G7 F8 C9 I13 F14 I15G7-I11 WeakPolarHBondContact O-CG1 3.48Å; G7-I11 PolarHBondContact O-N 3.32Å; F8-I11 PolarHBondContact O-N 3.03Å; C9-I11 VanDerWaalsContact C-N 3.3Å; C9-I11 PolarHBondContact O-N 3.06Å; I11-I13 PolarHBondContact O-N 3.49Å; I11-F14 PolarHBondContact O-N 3.3Å; I11-I15 HydrophobicContact CG2-CD1 3.83Å; I11-I15 HydrophobicContact CG2-CG1 4.49Å; I11-I15 VanDerWaalsContact O-CG1 3.29Å; I11-I15 WeakPolarHBondContact O-CG1 3.47Å; I11-I15 PolarHBondContact O-N 3.36Å
12I79.7Confident71.9Confident70 Ų7092 Ų9236%0.35948%0.481SS..Hα-helixtrans-61.1-46.5177.4-69170.5000111F8 C9 F14 I15 I16F8-I12 HydrophobicContact CD1-CD1 3.64Å; F8-I12 HydrophobicContact CD1-CG1 4.45Å; F8-I12 HydrophobicContact CE1-CD1 3.3Å; F8-I12 HydrophobicContact CE1-CG1 4.21Å; F8-I12 HydrophobicContact CZ-CD1 3.93Å; F8-I12 HydrophobicContact CZ-CG1 4.45Å; F8-I12 WeakPolarHBondContact O-CG1 3.29Å; F8-I12 PolarHBondContact O-N 3.25Å; C9-I12 PolarHBondContact O-N 2.88Å; I12-F14 VanDerWaalsContact C-N 3.31Å; I12-F14 PolarHBondContact O-N 3.14Å; I12-I15 PolarHBondContact O-N 2.81Å; I12-I16 HydrophobicContact CG2-CD1 3.7Å; I12-I16 HydrophobicContact CG2-CG1 4.39Å; I12-I16 VanDerWaalsContact O-CG1 3.32Å; I12-I16 WeakPolarHBondContact O-CG1 2.99Å; I12-I16 PolarHBondContact O-N 3.31Å
13I80.1Confident71.9Confident59 Ų5991.1 Ų91.130%0.30347%0.471SS..Hα-helixtrans-59.8-43.9178.1-68164.7000110.3C9 F10 I11 I15 I16 L17 F90C9-I13 VanDerWaalsContact O-CG1 3.26Å; C9-I13 WeakPolarHBondContact O-CG1 3.22Å; C9-I13 PolarHBondContact O-N 3.21Å; F10-I13 PolarHBondContact O-N 3.02Å; I11-I13 PolarHBondContact O-N 3.49Å; I13-I15 PolarHBondContact O-N 2.7Å; I13-I16 PolarHBondContact O-N 2.95Å; I13-L17 HydrophobicContact CG2-CD1 3.79Å; I13-L17 HydrophobicContact CG2-CG 4.31Å; I13-L17 WeakPolarHBondContact O-CB 3.24Å; I13-L17 VanDerWaalsContact O-CG 3.32Å; I13-L17 WeakPolarHBondContact O-CG 3.48Å; I13-L17 PolarHBondContact O-N 3.35Å; I13-F90 HydrophobicContact CD1-CD2 4.3Å; I13-F90 HydrophobicContact CD1-CE2 4.19Å
14F78.4Confident71.7Confident131 Ų13189.9 Ų89.958%0.57546%0.46SS*.Hα-helixtrans-62.1-42.8177.6-174.2-105.3000112.2F10 I11 I12 L17 N18F10-F14 VanDerWaalsContact O-CB 3.3Å; F10-F14 WeakPolarHBondContact O-CB 3.36Å; F10-F14 PolarHBondContact O-N 3Å; I11-F14 PolarHBondContact O-N 3.3Å; I12-F14 VanDerWaalsContact C-N 3.31Å; I12-F14 PolarHBondContact O-N 3.14Å; F14-L17 PolarHBondContact O-N 2.99Å; F14-N18 WeakPolarHBondContact CD1-ND2 3.31Å; F14-N18 WeakPolarHBondContact CE1-ND2 3.26Å; F14-N18 VanDerWaalsContact CZ-ND2 3.31Å; F14-N18 WeakPolarHBondContact CZ-ND2 3.44Å; F14-N18 WeakPolarHBondContact O-CB 3.44Å; F14-N18 PolarHBondContact O-N 3.43Å; F14-N18 PolarHBondContact O-ND2 3.11Å
15I81.5Confident71.4Confident103 Ų10391.4 Ų91.453%0.52846%0.455SS..Hα-helixtrans-62.6-44.8176-68166.2000110.8I11 I12 I13 N18 R19I11-I15 HydrophobicContact CG2-CD1 3.83Å; I11-I15 HydrophobicContact CG2-CG1 4.49Å; I11-I15 VanDerWaalsContact O-CG1 3.29Å; I11-I15 WeakPolarHBondContact O-CG1 3.47Å; I11-I15 PolarHBondContact O-N 3.36Å; I12-I15 PolarHBondContact O-N 2.81Å; I13-I15 PolarHBondContact O-N 2.7Å; I15-N18 PolarHBondContact O-N 3.49Å; I15-R19 WeakPolarHBondContact O-CB 3.48Å; I15-R19 PolarHBondContact O-N 2.95Å
16I80.7Confident70.9Confident64 Ų6492.5 Ų92.533%0.32846%0.46SS..Hα-helixtrans-64-45.7178.6-66.5167.9000110.7I12 I13 N18 R19 L20I12-I16 HydrophobicContact CG2-CD1 3.7Å; I12-I16 HydrophobicContact CG2-CG1 4.39Å; I12-I16 VanDerWaalsContact O-CG1 3.32Å; I12-I16 WeakPolarHBondContact O-CG1 2.99Å; I12-I16 PolarHBondContact O-N 3.31Å; I13-I16 PolarHBondContact O-N 2.95Å; I16-N18 VanDerWaalsContact C-N 3.34Å; I16-N18 PolarHBondContact O-N 3.38Å; I16-R19 PolarHBondContact O-N 2.98Å; I16-L20 HydrophobicContact CG2-CD1 3.91Å; I16-L20 HydrophobicContact CG2-CG 4.32Å; I16-L20 WeakPolarHBondContact O-CB 3.49Å; I16-L20 WeakPolarHBondContact O-CG 3.31Å; I16-L20 PolarHBondContact O-N 3.4Å
17L79.1Confident70Confident101 Ų10194.4 Ų94.453%0.52947%0.471SS..Hα-helixtrans-60-43.2177.1-75.9169.2000111.9I13 F14 R19 L20 N21I13-L17 HydrophobicContact CG2-CD1 3.79Å; I13-L17 HydrophobicContact CG2-CG 4.31Å; I13-L17 WeakPolarHBondContact O-CB 3.24Å; I13-L17 VanDerWaalsContact O-CG 3.32Å; I13-L17 WeakPolarHBondContact O-CG 3.48Å; I13-L17 PolarHBondContact O-N 3.35Å; F14-L17 PolarHBondContact O-N 2.99Å; L17-R19 VanDerWaalsContact C-N 3.35Å; L17-L20 PolarHBondContact O-N 2.98Å; L17-N21 VanDerWaalsContact O-CB 3.31Å; L17-N21 WeakPolarHBondContact O-CB 3.29Å; L17-N21 PolarHBondContact O-N 3.45Å
18N75.9Confident69Low76 Ų7699.2 Ų99.241%0.40649%0.485SS..Hα-helixtrans-64.2-40176.2-76.2-39.4000112.2F14 I15 I16 N21 A22F14-N18 WeakPolarHBondContact CD1-ND2 3.31Å; F14-N18 WeakPolarHBondContact CE1-ND2 3.26Å; F14-N18 VanDerWaalsContact CZ-ND2 3.31Å; F14-N18 WeakPolarHBondContact CZ-ND2 3.44Å; F14-N18 WeakPolarHBondContact O-CB 3.44Å; F14-N18 PolarHBondContact O-N 3.43Å; F14-N18 PolarHBondContact O-ND2 3.11Å; I15-N18 PolarHBondContact O-N 3.49Å; I16-N18 VanDerWaalsContact C-N 3.34Å; I16-N18 PolarHBondContact O-N 3.38Å; N18-N21 PolarHBondContact O-N 2.71Å; N18-A22 PolarHBondContact O-N 3.1Å
19R76Confident67.9Low177 Ų17799.1 Ų99.167%0.66849%0.491SS*.Hα-helixtrans-67-44177.5-167.9-179.4178.9-175.65.7111.7I15 I16 L17 N21 A22 E23I15-R19 WeakPolarHBondContact O-CB 3.48Å; I15-R19 PolarHBondContact O-N 2.95Å; I16-R19 PolarHBondContact O-N 2.98Å; L17-R19 VanDerWaalsContact C-N 3.35Å; R19-N21 VanDerWaalsContact C-N 3.3Å; R19-N21 PolarHBondContact O-N 3.08Å; R19-A22 WeakPolarHBondContact O-CB 3.32Å; R19-A22 PolarHBondContact O-N 2.85Å; R19-E23 IonicContact NE-OE1 3.48Å; R19-E23 PolarHBondContact NE-OE1 3.48Å; R19-E23 WeakPolarHBondContact O-CG 3.42Å; R19-E23 PolarHBondContact O-N 3.21Å
20L72.5Confident66.9Low83 Ų83103.7 Ų103.744%0.43552%0.518SS..Hα-helixtrans-61.7-40174.3-71.8172.2000111.3I16 L17 A22 E23 T24I16-L20 HydrophobicContact CG2-CD1 3.91Å; I16-L20 HydrophobicContact CG2-CG 4.32Å; I16-L20 WeakPolarHBondContact O-CB 3.49Å; I16-L20 WeakPolarHBondContact O-CG 3.31Å; I16-L20 PolarHBondContact O-N 3.4Å; L17-L20 PolarHBondContact O-N 2.98Å; L20-A22 VanDerWaalsContact C-N 3.33Å; L20-E23 PolarHBondContact O-N 3.38Å; L20-T24 WeakPolarHBondContact O-CG2 3.3Å; L20-T24 PolarHBondContact O-N 2.96Å; L20-T24 PolarHBondContact O-OG1 3.45Å; L20-T24 VanDerWaalsContact O-OG1 3.08Å
21N68.1Low65.6Low90 Ų90102.4 Ų102.448%0.48152%0.521SS..Hα-helixtrans-67.3-33.5176-166.837.9000112.4L17 N18 R19 T24 R25L17-N21 VanDerWaalsContact O-CB 3.31Å; L17-N21 WeakPolarHBondContact O-CB 3.29Å; L17-N21 PolarHBondContact O-N 3.45Å; N18-N21 PolarHBondContact O-N 2.71Å; R19-N21 VanDerWaalsContact C-N 3.3Å; R19-N21 PolarHBondContact O-N 3.08Å; N21-T24 VanDerWaalsContact CA-OG1 3.26Å; N21-T24 WeakPolarHBondContact CA-OG1 3.36Å; N21-T24 PolarHBondContact O-OG1 2.87Å; N21-R25 WeakPolarHBondContact O-CB 3.32Å; N21-R25 VanDerWaalsContact O-CG 3.22Å; N21-R25 WeakPolarHBondContact O-CG 3.46Å; N21-R25 PolarHBondContact O-N 3.45Å; N21-R25 VanDerWaalsContact O-N 3.11Å
22A63Low63.9Low53 Ų53104.8 Ų104.844%0.43853%0.53SS..Hα-helixtrans-68.1-42.117300000111.4N18 R19 L20 R25 L26N18-A22 PolarHBondContact O-N 3.1Å; R19-A22 WeakPolarHBondContact O-CB 3.32Å; R19-A22 PolarHBondContact O-N 2.85Å; L20-A22 VanDerWaalsContact C-N 3.33Å; A22-R25 PolarHBondContact O-N 3.18Å; A22-L26 WeakPolarHBondContact O-CG 3.49Å; A22-L26 PolarHBondContact O-N 2.88Å
23E59.9Low62.3Low69 Ų69106.4 Ų106.432%0.32255%0.545SS..Hα-helixtrans-68.3-37.9177.4-71.2177.9-168.300112.2R19 L20 R25 L26 L27R19-E23 IonicContact NE-OE1 3.48Å; R19-E23 PolarHBondContact NE-OE1 3.48Å; R19-E23 WeakPolarHBondContact O-CG 3.42Å; R19-E23 PolarHBondContact O-N 3.21Å; L20-E23 PolarHBondContact O-N 3.38Å; E23-R25 VanDerWaalsContact C-N 3.34Å; E23-R25 PolarHBondContact O-N 2.92Å; E23-L26 PolarHBondContact O-N 2.91Å; E23-L27 WeakPolarHBondContact O-CG 3.33Å; E23-L27 PolarHBondContact O-N 3.05Å
24T54.5Low60.4Low70 Ų70109.9 Ų109.943%0.42958%0.575SS.*Hα-helixtrans-67.3-33.5173.749.60000112.4L20 N21 L27 Q28L20-T24 WeakPolarHBondContact O-CG2 3.3Å; L20-T24 PolarHBondContact O-N 2.96Å; L20-T24 PolarHBondContact O-OG1 3.45Å; L20-T24 VanDerWaalsContact O-OG1 3.08Å; N21-T24 VanDerWaalsContact CA-OG1 3.26Å; N21-T24 WeakPolarHBondContact CA-OG1 3.36Å; N21-T24 PolarHBondContact O-OG1 2.87Å; T24-L27 PolarHBondContact O-N 3.49Å; T24-Q28 WeakPolarHBondContact O-CB 3.44Å; T24-Q28 PolarHBondContact O-N 3.29Å
25R51.5Low58.9Low176 Ų176114.3 Ų114.366%0.66459%0.587SS**Hα-helixtrans-70.6-34.8173.8-71.4-178.698.1-166.75.6112.4N21 A22 E23 N29N21-R25 WeakPolarHBondContact O-CB 3.32Å; N21-R25 VanDerWaalsContact O-CG 3.22Å; N21-R25 WeakPolarHBondContact O-CG 3.46Å; N21-R25 PolarHBondContact O-N 3.45Å; N21-R25 VanDerWaalsContact O-N 3.11Å; A22-R25 PolarHBondContact O-N 3.18Å; E23-R25 VanDerWaalsContact C-N 3.34Å; E23-R25 PolarHBondContact O-N 2.92Å; R25-N29 WeakPolarHBondContact O-CB 3.23Å; R25-N29 PolarHBondContact O-N 3.44Å
26L54.2Low56.7Low125 Ų125116 Ų11665%0.65460%0.597SS**Hα-helixtrans-68.3-37.6172.5-70.4173.9000112A22 E23 V30A22-L26 WeakPolarHBondContact O-CG 3.49Å; A22-L26 PolarHBondContact O-N 2.88Å; E23-L26 PolarHBondContact O-N 2.91Å; L26-V30 PolarHBondContact O-N 3.42Å
27L50.7Low55.1Low115 Ų115118.7 Ų118.760%0.60262%0.617SS**Hα-helixtrans-74.2-32.9175.5-69.5170.9000112.6E23 T24 V30 T31E23-L27 WeakPolarHBondContact O-CG 3.33Å; E23-L27 PolarHBondContact O-N 3.05Å; T24-L27 PolarHBondContact O-N 3.49Å; L27-V30 PolarHBondContact O-N 3.31Å; L27-T31 VanDerWaalsContact O-CB 3.29Å; L27-T31 WeakPolarHBondContact O-CB 3.26Å; L27-T31 PolarHBondContact O-N 3.39Å; L27-T31 PolarHBondContact O-OG1 2.94Å
28Q47.8Very low53.3Low130 Ų130120 Ų12061%0.60763%0.629SS**Hα-helixtrans-67.5-35172.2-93.3-177.3-33.900112.3T24 V30 T31 E32T24-Q28 WeakPolarHBondContact O-CB 3.44Å; T24-Q28 PolarHBondContact O-N 3.29Å; Q28-V30 PolarHBondContact O-N 3.07Å; Q28-T31 CarbonylContact O-C 3.18Å; Q28-T31 PolarHBondContact O-N 2.88Å; Q28-T31 VanDerWaalsContact O-N 3.14Å; Q28-E32 PolarHBondContact O-N 2.88Å
29N47.6Very low51.9Low127 Ų127122.7 Ų122.768%0.67964%0.642SS**THydrogen-bonded Turntrans-72.9-13.4177.7-143.128.1000113.5R25R25-N29 WeakPolarHBondContact O-CB 3.23Å; R25-N29 PolarHBondContact O-N 3.44Å
30V50.2Low50.4Low127 Ų127119.3 Ų119.377%0.7764%0.643SS**THydrogen-bonded Turntrans-100.5-15.1171.4-179.30000111.6L26 L27 Q28L26-V30 PolarHBondContact O-N 3.42Å; L27-V30 PolarHBondContact O-N 3.31Å; Q28-V30 PolarHBondContact O-N 3.07Å
31T47.1Very low49Very low108 Ų108122.3 Ų122.366%0.66367%0.665SS**SBendtrans-124.542.1-178.1-30.30000109.9L27 Q28L27-T31 VanDerWaalsContact O-CB 3.29Å; L27-T31 WeakPolarHBondContact O-CB 3.26Å; L27-T31 PolarHBondContact O-N 3.39Å; L27-T31 PolarHBondContact O-OG1 2.94Å; Q28-T31 CarbonylContact O-C 3.18Å; Q28-T31 PolarHBondContact O-N 2.88Å; Q28-T31 VanDerWaalsContact O-N 3.14Å
32E44.1Very low47.9Very low147 Ų147122.9 Ų122.969%0.68768%0.676SS**  trans-80.6133.5169-105.8-175.7167.900109.3Q28Q28-E32 PolarHBondContact O-N 2.88Å
33P44.6Very low46.8Very low104 Ų104127 Ų12768%0.67570%0.696SS**  trans-74.4137.1-165.532-33.1000109.2R35P33-R35 PolarHBondContact O-N 3.31Å
34S40.6Very low45.8Very low132 Ų132128 Ų12892%0.92371%0.71SS**  trans-59.784.6165.7171.50000109.2N36S34-N36 PolarHBondContact O-N 2.96Å
35R47Very low45.2Very low224 Ų224131.2 Ų131.285%0.84573%0.725SS**  trans-70.9113.9177.7-176.7178.6179176.4-0.7107.7P33P33-R35 PolarHBondContact O-N 3.31Å
36N36.1Very low44.7Very low138 Ų138133.3 Ų133.374%0.73873%0.733SS**  trans21.8106.9154.1-74.14.4000116.7S34S34-N36 PolarHBondContact O-N 2.96Å
37T46Very low44.3Very low121 Ų121132.9 Ų132.974%0.74274%0.736SS**  trans-119.194.7140.7-52.30000108I39T37-I39 HydrophobicContact CG2-CD1 3.96Å; T37-I39 HydrophobicContact CG2-CG1 3.46Å; T37-I39 VanDerWaalsContact CG2-CG1 3.46Å; T37-I39 PolarHBondContact O-N 3.49Å; T37-I39 VanDerWaalsContact O-N 3.16Å
38T41.6Very low43.6Very low127 Ų127133.7 Ų133.778%0.77975%0.746SS**  trans-68.497.7163.1-49.90000107
39I46.6Very low43.1Very low134 Ų134133 Ų13369%0.68776%0.755SS**  trans-93.9127.2171-54.2-178.4000106.8T37 T41T37-I39 HydrophobicContact CG2-CD1 3.96Å; T37-I39 HydrophobicContact CG2-CG1 3.46Å; T37-I39 VanDerWaalsContact CG2-CG1 3.46Å; T37-I39 PolarHBondContact O-N 3.49Å; T37-I39 VanDerWaalsContact O-N 3.16Å; I39-T41 PolarHBondContact O-N 3.42Å
40P44.8Very low43Very low106 Ų106132.4 Ų132.469%0.68876%0.756SS**  trans-63.4133.2-16823.8-33.7000112.1S42P40-S42 PolarHBondContact O-N 3.25Å
41T42.4Very low42.8Very low145 Ų145133.7 Ų133.789%0.8975%0.754SS**  trans-64.579.2165.9-41.70000109.1I39I39-T41 PolarHBondContact O-N 3.42Å
42S45.2Very low42.5Very low103 Ų103134.7 Ų134.772%0.7276%0.76SS**  trans-98.1104.3157.9-91.30000108.1P40 S44P40-S42 PolarHBondContact O-N 3.25Å; S42-S44 PolarHBondContact O-N 3.15Å; S42-S44 VanDerWaalsContact O-N 3.1Å
43T40.5Very low42.1Very low138 Ų138137.3 Ų137.385%0.84777%0.769SS**  trans-34.5107.7145.8-48.80000109.7
44S38.8Very low42Very low90 Ų90140.6 Ų140.663%0.62978%0.778SS**  trans167.2138.7140.3-150.80000108.6S42S42-S44 PolarHBondContact O-N 3.15Å; S42-S44 VanDerWaalsContact O-N 3.1Å
45D42.3Very low41.7Very low138 Ų138144.3 Ų144.374%0.73878%0.777SS**  trans69.293.6154.1-55.1-43.6000118.7
46R41.3Very low41.4Very low220 Ų220139.9 Ų139.983%0.8378%0.775SS**  61.392112.1-166.5169.4-179.4129.51.1115.8
47T44.4Very low41.6Very low116 Ų116140.1 Ų140.171%0.71278%0.782SS**  trans65.7134.113556.80000120.2
48T36.4Very low41.2Very low133 Ų133137.6 Ų137.682%0.81678%0.78SS**  trans87.1113.8144.9-2.90000118.1
49S37.5Very low41.4Very low114 Ų114140.2 Ų140.280%0.79778%0.783SS**  -173.574127.9177.90000111.7
50T44.8Very low41.7Very low115 Ų115139.9 Ų139.971%0.70679%0.79SS**  trans-83.5105.1135.5-60.50000103.8
51Q46.7Very low42.3Very low155 Ų155140.9 Ų140.972%0.72479%0.794SS**SBend66.7126105.7-61.6168.77.800113.8
52T41.2Very low43Very low128 Ų128140.9 Ų140.979%0.78579%0.787SS**  trans75.6105164.8-39.80000115.5M54T52-M54 PolarHBondContact O-N 3.41Å
53K36.3Very low43.7Very low203 Ų203142.4 Ų142.488%0.88379%0.787SS**SBendtrans-51.298.7154.9-82.3177.1172.4177.20108.9
54M41.3Very low45Very low173 Ų173141.9 Ų141.985%0.85278%0.777SS**  trans-178.1116.9132.2-99.1-179.3-79.600110.1T52 T56T52-M54 PolarHBondContact O-N 3.41Å; M54-T56 PolarHBondContact O-N 3.01Å
55K33.6Very low46.2Very low209 Ų209146 Ų14691%0.90978%0.784SS**  trans-71.6103.5-178.5-179-176.4-176-177.70109.6
56T42.5Very low47.1Very low131 Ų131150 Ų15080%0.80479%0.789SS**  trans-145.5111.9162.2-9.30000111.4M54M54-T56 PolarHBondContact O-N 3.01Å
57T40.2Very low47.7Very low144 Ų144146 Ų14688%0.88378%0.784SS**  trans-24.5127.4169.9-27.40000117.3
58G37.7Very low48Very low68 Ų68147 Ų14770%0.70179%0.785SS**  trans111.5119145.300000117.6
59Q45.9Very low48.7Very low182 Ų182144.2 Ų144.285%0.8577%0.771SS**  trans96.2124160.3-52.2-154.7-3.200118.6T61Q59-T61 PolarHBondContact O-N 3.48Å
60P53.1Low49.3Very low127 Ų127147.5 Ų147.583%0.82577%0.774SS**  trans-73.711317629.9-31.8000110.3I62P60-I62 PolarHBondContact O-N 3.14Å
61T55.7Low49.4Very low126 Ų126147.1 Ų147.177%0.77378%0.776SS**  trans-82112.4171.2-59.20000108.9Q59 L63Q59-T61 PolarHBondContact O-N 3.48Å; T61-L63 PolarHBondContact O-N 3.17Å
62I58.4Low49.6Very low145 Ų145144.6 Ų144.674%0.74478%0.775SS**  trans-75.6108173.5-57.6173.1000107.9P60 I64P60-I62 PolarHBondContact O-N 3.14Å; I62-I64 HydrophobicContact CG2-CG1 4.02Å; I62-I64 PolarHBondContact O-N 3.37Å
63L60.3Low50.1Low136 Ų136142.9 Ų142.971%0.71277%0.769SS**  trans-7999.4170.2-89.8143.9000109.1T61 F65T61-L63 PolarHBondContact O-N 3.17Å; L63-F65 HydrophobicContact CB-CE2 4.22Å; L63-F65 PolarHBondContact O-N 3.25Å
64I67Low51Low126 Ų126143.8 Ų143.865%0.64677%0.766SS**  trans-81.7105169.8-56.6174.4000107.4I62 W66I62-I64 HydrophobicContact CG2-CG1 4.02Å; I62-I64 PolarHBondContact O-N 3.37Å; I64-W66 PolarHBondContact O-N 3.46Å
65F64.6Low51.8Low178 Ų178139 Ų13978%0.78175%0.748SS**  trans-73.8104.8167.4-71.5-86.9000108.5L63 N67L63-F65 HydrophobicContact CB-CE2 4.22Å; L63-F65 PolarHBondContact O-N 3.25Å; F65-N67 VanDerWaalsContact C-N 3.34Å; F65-N67 PolarHBondContact O-N 3.29Å
66W60.4Low52.9Low220 Ų220137.2 Ų137.283%0.83374%0.741SS**  trans-68.397.5163.7-79.276.6000107.6I64 D68I64-W66 PolarHBondContact O-N 3.46Å; W66-D68 VanDerWaalsContact C-N 3.25Å; W66-D68 PolarHBondContact O-N 3.43Å
67N54Low53.7Low137 Ų137139.8 Ų139.873%0.73374%0.741SS**  trans-77.182173.3-164.324.3000107.8F65 S69F65-N67 VanDerWaalsContact C-N 3.34Å; F65-N67 PolarHBondContact O-N 3.29Å; N67-S69 PolarHBondContact ND2-OG 3.04Å; N67-S69 PolarHBondContact O-N 2.96Å; N67-S69 PolarHBondContact O-OG 3.23Å; N67-S69 VanDerWaalsContact O-OG 3.1Å; N67-S69 PolarHBondContact OD1-OG 3.13Å
68D50.7Low54.8Low138 Ų138138.5 Ų138.574%0.73872%0.72SS**  trans-62.875.9168.2-91.2-22.9000109.3W66 E70W66-D68 VanDerWaalsContact C-N 3.25Å; W66-D68 PolarHBondContact O-N 3.43Å; D68-E70 PolarHBondContact O-N 3.08Å
69S50.8Low56.1Low74 Ų74139.8 Ų139.852%0.51771%0.709SS.*  trans-87.414.2-177.3-51.40000112.5N67N67-S69 PolarHBondContact ND2-OG 3.04Å; N67-S69 PolarHBondContact O-N 2.96Å; N67-S69 PolarHBondContact O-OG 3.23Å; N67-S69 VanDerWaalsContact O-OG 3.1Å; N67-S69 PolarHBondContact OD1-OG 3.13Å
70E50.4Low57Low182 Ų182135.3 Ų135.385%0.8570%0.695SS**  trans-99.912.3-172.6-144.7177.6165.600114.4D68D68-E70 PolarHBondContact O-N 3.08Å
71S46.8Very low57.7Low108 Ų108136 Ų13676%0.75569%0.689SS**SBendtrans-96.2-3.7178.6740000115.5
72S51Low58.3Low101 Ų101137.2 Ų137.271%0.70668%0.679SS**THydrogen-bonded Turntrans-91.9-0.7-167.470.90000116.7
73S51.3Low58.9Low92 Ų92133.4 Ų133.464%0.64367%0.665SS**THydrogen-bonded Turntrans-91.73.3-172.8530000115.4
74R56.2Low59.6Low222 Ų222131 Ų13184%0.83866%0.656SS**  trans-115.310.6-164.3-62.4-165.9-178.7-154.43120.7
75P56.9Low60Low73 Ų73128.4 Ų128.447%0.47465%0.646SS.*SBendtrans-98.41.9170.935.3-31.7000115.4W78P75-W78 VanDerWaalsContact C-CD1 3.49Å; P75-W78 PolarHBondContact O-NE1 3.44Å
76K57.8Low60.5Low171 Ų171123.6 Ų123.674%0.74363%0.628SS**Hα-helixtrans-82-34.8-175.6-66.5-174.6-178.8179.80114.3W78 T80K76-W78 PolarHBondContact O-N 2.92Å; K76-T80 PolarHBondContact O-N 3.47Å; K76-T80 PolarHBondContact O-OG1 3.11Å; K76-T80 VanDerWaalsContact O-OG1 3.09Å
77K58.4Low61Low186 Ų186117.1 Ų117.181%0.80961%0.612SS**Hα-helixtrans-69.4-34.9-174-71.7-172.6176.7-176.70113.7M81K77-M81 PolarHBondContact O-N 3.4Å; K77-M81 VanDerWaalsContact O-N 3.14Å
78W62.9Low61.9Low117 Ų117114.8 Ų114.844%0.44360%0.603SS.*Hα-helixtrans-69.9-43.1-178.478.4-78.3000111.6P75 K76 T80 M81 W82P75-W78 VanDerWaalsContact C-CD1 3.49Å; P75-W78 PolarHBondContact O-NE1 3.44Å; K76-W78 PolarHBondContact O-N 2.92Å; W78-T80 VanDerWaalsContact C-N 3.34Å; W78-T80 PolarHBondContact O-N 3.34Å; W78-M81 WeakPolarHBondContact O-CB 3.32Å; W78-M81 PolarHBondContact O-N 3.47Å; W78-M81 VanDerWaalsContact O-N 3.15Å; W78-W82 AromaticContact CE3-CD1 3.48Å; W78-W82 VanDerWaalsContact CE3-CD1 3.48Å; W78-W82 AromaticContact CE3-NE1 3.67Å; W78-W82 PolarHBondContact O-N 2.97Å
79I64.7Low62.9Low94 Ų94112.3 Ų112.348%0.48259%0.593SS.*Hα-helixtrans-60-42.8176.8-72.9156.9000111.4M81 W82 S83I79-M81 VanDerWaalsContact C-N 3.33Å; I79-M81 PolarHBondContact O-N 3.39Å; I79-W82 PolarHBondContact O-N 3.4Å; I79-S83 WeakPolarHBondContact O-CB 3.05Å; I79-S83 PolarHBondContact O-N 3.3Å
80T65.4Low63.8Low88 Ų88113.9 Ų113.954%0.5459%0.591SS.*Hα-helixtrans-63.7-40176.6-48.40000111.6K76 W78 S83 V84K76-T80 PolarHBondContact O-N 3.47Å; K76-T80 PolarHBondContact O-OG1 3.11Å; K76-T80 VanDerWaalsContact O-OG1 3.09Å; W78-T80 VanDerWaalsContact C-N 3.34Å; W78-T80 PolarHBondContact O-N 3.34Å; T80-S83 PolarHBondContact O-N 3.41Å; T80-V84 WeakPolarHBondContact O-CG2 3.4Å; T80-V84 PolarHBondContact O-N 3.09Å; T80-V84 VanDerWaalsContact O-N 3.11Å
81M67.2Low64.8Low142 Ų142113.2 Ų113.270%0.758%0.582SS**Hα-helixtrans-64.4-45.5178.4-165176-177.400111.7K77 W78 I79 V84 V85K77-M81 PolarHBondContact O-N 3.4Å; K77-M81 VanDerWaalsContact O-N 3.14Å; W78-M81 WeakPolarHBondContact O-CB 3.32Å; W78-M81 PolarHBondContact O-N 3.47Å; W78-M81 VanDerWaalsContact O-N 3.15Å; I79-M81 VanDerWaalsContact C-N 3.33Å; I79-M81 PolarHBondContact O-N 3.39Å; M81-V84 PolarHBondContact O-N 3.49Å; M81-V85 WeakPolarHBondContact O-CG2 3.48Å; M81-V85 PolarHBondContact O-N 2.91Å
82W70.2Confident65.9Low152 Ų152114.1 Ų114.158%0.57657%0.572SS**Hα-helixtrans-66.2-37.2176.3-72.1108.8000112.8W78 I79 V84 V85 I86W78-W82 AromaticContact CE3-CD1 3.48Å; W78-W82 VanDerWaalsContact CE3-CD1 3.48Å; W78-W82 AromaticContact CE3-NE1 3.67Å; W78-W82 PolarHBondContact O-N 2.97Å; I79-W82 PolarHBondContact O-N 3.4Å; W82-V84 PolarHBondContact O-N 3.31Å; W82-V85 PolarHBondContact O-N 3.46Å; W82-I86 WeakPolarHBondContact O-CD1 3.44Å; W82-I86 VanDerWaalsContact O-CG1 3.23Å; W82-I86 WeakPolarHBondContact O-CG1 3.34Å; W82-I86 PolarHBondContact O-N 3.42Å
83S69.7Low66.7Low65 Ų65111.3 Ų111.346%0.45555%0.55SS.*Hα-helixtrans-61.4-41.4176.1175.90000112.2I79 T80 T87I79-S83 WeakPolarHBondContact O-CB 3.05Å; I79-S83 PolarHBondContact O-N 3.3Å; T80-S83 PolarHBondContact O-N 3.41Å; S83-T87 WeakPolarHBondContact O-CB 3.37Å; S83-T87 PolarHBondContact O-N 3.39Å; S83-T87 PolarHBondContact O-OG1 2.92Å
84V75Confident67.5Low84 Ų84111 Ų11151%0.50954%0.541SS..Hα-helixtrans-64.7-47.2176.2174.10000110.7T80 M81 W82 I86 T87 T88T80-V84 WeakPolarHBondContact O-CG2 3.4Å; T80-V84 PolarHBondContact O-N 3.09Å; T80-V84 VanDerWaalsContact O-N 3.11Å; M81-V84 PolarHBondContact O-N 3.49Å; W82-V84 PolarHBondContact O-N 3.31Å; V84-I86 VanDerWaalsContact C-N 3.34Å; V84-I86 PolarHBondContact O-N 3.19Å; V84-T87 PolarHBondContact O-N 3.39Å; V84-T88 PolarHBondContact O-N 3.02Å; V84-T88 PolarHBondContact O-OG1 3.38Å
85V76.4Confident68Low73 Ų73103.8 Ų103.844%0.44252%0.524SS..Hα-helixtrans-58.3-46.5179.2174.50000111.1M81 W82 T87 T88 V89M81-V85 WeakPolarHBondContact O-CG2 3.48Å; M81-V85 PolarHBondContact O-N 2.91Å; W82-V85 PolarHBondContact O-N 3.46Å; V85-T87 VanDerWaalsContact C-N 3.35Å; V85-T87 PolarHBondContact O-N 3.04Å; V85-T88 PolarHBondContact O-N 3.39Å; V85-V89 VanDerWaalsContact O-CG2 3.31Å; V85-V89 WeakPolarHBondContact O-CG2 3.37Å; V85-V89 PolarHBondContact O-N 3.46Å
86I73.5Confident68Low77 Ų77108 Ų10840%0.39554%0.535SS..Hα-helixtrans-61.5-44.7178.4-67.2164000110.8W82 V84 T88 V89 F90W82-I86 WeakPolarHBondContact O-CD1 3.44Å; W82-I86 VanDerWaalsContact O-CG1 3.23Å; W82-I86 WeakPolarHBondContact O-CG1 3.34Å; W82-I86 PolarHBondContact O-N 3.42Å; V84-I86 VanDerWaalsContact C-N 3.34Å; V84-I86 PolarHBondContact O-N 3.19Å; I86-T88 PolarHBondContact O-N 2.72Å; I86-V89 PolarHBondContact O-N 3.03Å; I86-F90 WeakPolarHBondContact O-CB 3.31Å; I86-F90 PolarHBondContact O-N 2.96Å
87T71.7Confident67.7Low83 Ų83104.7 Ų104.751%0.50953%0.534SS..Hα-helixtrans-64.9-41-179.2-51.50000111.6S83 V84 V85 F90 Y91S83-T87 WeakPolarHBondContact O-CB 3.37Å; S83-T87 PolarHBondContact O-N 3.39Å; S83-T87 PolarHBondContact O-OG1 2.92Å; V84-T87 PolarHBondContact O-N 3.39Å; V85-T87 VanDerWaalsContact C-N 3.35Å; V85-T87 PolarHBondContact O-N 3.04Å; T87-F90 PolarHBondContact O-N 3.45Å; T87-Y91 WeakPolarHBondContact O-CB 3.5Å; T87-Y91 PolarHBondContact O-N 3.19Å
88T72.7Confident68.1Low88 Ų88100.6 Ų100.654%0.5452%0.52SS..Hα-helixtrans-65.1-43.1177.1-54.40000111.9V84 V85 I86 Y91 F92V84-T88 PolarHBondContact O-N 3.02Å; V84-T88 PolarHBondContact O-OG1 3.38Å; V85-T88 PolarHBondContact O-N 3.39Å; I86-T88 PolarHBondContact O-N 2.72Å; T88-Y91 PolarHBondContact O-N 3.47Å; T88-F92 WeakPolarHBondContact O-CB 3.31Å; T88-F92 PolarHBondContact O-N 2.9Å
89V72.6Confident68.4Low87 Ų8799.7 Ų99.753%0.52752%0.524SS..Hα-helixtrans-63.5-44.8176.4173.50000110.5V85 I86 Y91 F92 V93V85-V89 VanDerWaalsContact O-CG2 3.31Å; V85-V89 WeakPolarHBondContact O-CG2 3.37Å; V85-V89 PolarHBondContact O-N 3.46Å; I86-V89 PolarHBondContact O-N 3.03Å; V89-Y91 PolarHBondContact O-N 2.99Å; V89-F92 PolarHBondContact O-N 3.31Å; V89-V93 HydrophobicContact CG1-CG2 4.49Å; V89-V93 VanDerWaalsContact O-CG2 3.31Å; V89-V93 WeakPolarHBondContact O-CG2 3.42Å; V89-V93 PolarHBondContact O-N 3.49Å
90F69.7Low68.6Low107 Ų107100.1 Ų100.147%0.46953%0.526SS..Hα-helixtrans-60.9-45.7177.8-172.2-107.2000112I13 I86 T87 F92 V93 I94I13-F90 HydrophobicContact CD1-CD2 4.3Å; I13-F90 HydrophobicContact CD1-CE2 4.19Å; I86-F90 WeakPolarHBondContact O-CB 3.31Å; I86-F90 PolarHBondContact O-N 2.96Å; T87-F90 PolarHBondContact O-N 3.45Å; F90-F92 PolarHBondContact O-N 3.24Å; F90-V93 PolarHBondContact O-N 3.43Å; F90-I94 HydrophobicContact CD1-CD1 3.53Å; F90-I94 HydrophobicContact CD2-CD1 4.38Å; F90-I94 HydrophobicContact CE1-CD1 3.14Å; F90-I94 HydrophobicContact CE1-CG1 4.41Å; F90-I94 HydrophobicContact CE2-CD1 4.05Å; F90-I94 HydrophobicContact CG-CD1 4.15Å; F90-I94 HydrophobicContact CZ-CD1 3.44Å; F90-I94 VanDerWaalsContact CZ-CD1 3.44Å; F90-I94 HydrophobicContact CZ-CG1 4.49Å; F90-I94 WeakPolarHBondContact O-CG1 3.39Å; F90-I94 PolarHBondContact O-N 3.42Å
91Y70.7Confident68.8Low168 Ų168100.8 Ų100.866%0.65953%0.525SS*.Hα-helixtrans-60.9-45.3176.4-171.2-96.6000111.6T87 T88 V89 V93 I94 S95T87-Y91 WeakPolarHBondContact O-CB 3.5Å; T87-Y91 PolarHBondContact O-N 3.19Å; T88-Y91 PolarHBondContact O-N 3.47Å; V89-Y91 PolarHBondContact O-N 2.99Å; Y91-V93 VanDerWaalsContact C-N 3.34Å; Y91-V93 PolarHBondContact O-N 2.85Å; Y91-I94 PolarHBondContact O-N 3.35Å; Y91-S95 WeakPolarHBondContact CE1-OG 3.43Å; Y91-S95 WeakPolarHBondContact O-CB 3.37Å; Y91-S95 PolarHBondContact O-N 3.03Å; Y91-S95 PolarHBondContact O-OG 3.3Å
92F71Confident68.9Low126 Ų12698.2 Ų98.255%0.55352%0.515SS*.Hα-helixtrans-63.2-39179.1-172.3-97.6000112.9T88 V89 F90 K96T88-F92 WeakPolarHBondContact O-CB 3.31Å; T88-F92 PolarHBondContact O-N 2.9Å; V89-F92 PolarHBondContact O-N 3.31Å; F90-F92 PolarHBondContact O-N 3.24Å; F92-K96 HydrophobicContact CE1-CD 4.11Å; F92-K96 HydrophobicContact CZ-CD 3.95Å; F92-K96 HydrophobicContact CZ-CG 4.49Å; F92-K96 PolarHBondContact O-N 3.26Å
93V67.2Low68.8Low42 Ų4294.6 Ų94.626%0.25551%0.51SS..Hα-helixtrans-66.1-44.3176.3172.10000111V89 F90 Y91 K96 S97V89-V93 HydrophobicContact CG1-CG2 4.49Å; V89-V93 VanDerWaalsContact O-CG2 3.31Å; V89-V93 WeakPolarHBondContact O-CG2 3.42Å; V89-V93 PolarHBondContact O-N 3.49Å; F90-V93 PolarHBondContact O-N 3.43Å; Y91-V93 VanDerWaalsContact C-N 3.34Å; Y91-V93 PolarHBondContact O-N 2.85Å; V93-K96 PolarHBondContact O-N 3.29Å; V93-S97 PolarHBondContact O-N 3.01Å
94I67Low68.8Low86 Ų8696.7 Ų96.744%0.44151%0.514SS..Hα-helixtrans-66.9-42.5178.5-68.2172000111.1F90 Y91 K96 S97F90-I94 HydrophobicContact CD1-CD1 3.53Å; F90-I94 HydrophobicContact CD2-CD1 4.38Å; F90-I94 HydrophobicContact CE1-CD1 3.14Å; F90-I94 HydrophobicContact CE1-CG1 4.41Å; F90-I94 HydrophobicContact CE2-CD1 4.05Å; F90-I94 HydrophobicContact CG-CD1 4.15Å; F90-I94 HydrophobicContact CZ-CD1 3.44Å; F90-I94 VanDerWaalsContact CZ-CD1 3.44Å; F90-I94 HydrophobicContact CZ-CG1 4.49Å; F90-I94 WeakPolarHBondContact O-CG1 3.39Å; F90-I94 PolarHBondContact O-N 3.42Å; Y91-I94 PolarHBondContact O-N 3.35Å; I94-K96 PolarHBondContact O-N 3.27Å; I94-S97 PolarHBondContact O-N 3.48Å
95S67.6Low68.3Low70 Ų7097.7 Ų97.749%0.4952%0.515SS..Hα-helixtrans-68.2-17.7-179.1-62.70000113.9Y91Y91-S95 WeakPolarHBondContact CE1-OG 3.43Å; Y91-S95 WeakPolarHBondContact O-CB 3.37Å; Y91-S95 PolarHBondContact O-N 3.03Å; Y91-S95 PolarHBondContact O-OG 3.3Å
96K56.6Low67.6Low161 Ų16199.8 Ų99.870%0.752%0.521SS*.THydrogen-bonded Turntrans-103.3-2.8177.2-77.5-146.4173.7179.50114.5F92 V93 I94F92-K96 HydrophobicContact CE1-CD 4.11Å; F92-K96 HydrophobicContact CZ-CD 3.95Å; F92-K96 HydrophobicContact CZ-CG 4.49Å; F92-K96 PolarHBondContact O-N 3.26Å; V93-K96 PolarHBondContact O-N 3.29Å; I94-K96 PolarHBondContact O-N 3.27Å
97S51.1Low67.1Low102 Ų102101.8 Ų101.871%0.71353%0.532SS*.  trans-102.90177.7-165.80000112.2V93 I94V93-S97 PolarHBondContact O-N 3.01Å; I94-S97 PolarHBondContact O-N 3.48Å

Retrieved 97 of 97 residues in 16.1 ms (Link to these results)