A0A077Z487_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z487, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 232 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
1M56.7Low82.5Confident219 Ų219131.5 Ų131.5100%1.07963%0.629SS**  0-30.90-97.3-160.1174.900115.5
2N72.1Confident83.5Confident119 Ų119125.1 Ų125.164%0.63661%0.614SS**Hα-helixtrans-75.6-28.3-171.6-68.4-28.8000115.8R5 V6N2-R5 PolarHBondContact O-N 3.48Å; N2-V6 PolarHBondContact O-N 3.33Å
3T75.9Confident84.2Confident110 Ų110123.9 Ų123.968%0.67561%0.61SS**Hα-helixtrans-65.6-45.5-176.248.20000113.1R5 V6 Q7T3-R5 PolarHBondContact O-N 3.43Å; T3-V6 PolarHBondContact O-N 3Å; T3-V6 VanDerWaalsContact O-N 3.17Å; T3-Q7 PolarHBondContact O-N 2.97Å
4S83.1Confident84.8Confident61 Ų61125.4 Ų125.443%0.42761%0.607SS.*Hα-helixtrans-64.4-26.3178-460000113.1R8S4-R8 WeakPolarHBondContact O-CG 3.36Å; S4-R8 PolarHBondContact O-N 3.41Å; S4-R8 PolarHBondContact O-NE 2.74Å
5R86.1Confident85.5Confident158 Ų158122 Ų12260%0.59660%0.596SS**Hα-helixtrans-74.5-40175.6-161.1174.878.3179.94.5111.2N2 T3 K9N2-R5 PolarHBondContact O-N 3.48Å; T3-R5 PolarHBondContact O-N 3.43Å; R5-K9 WeakPolarHBondContact O-CG 3.49Å; R5-K9 PolarHBondContact O-N 3.43Å; R5-K9 VanDerWaalsContact O-N 3.09Å
6V85.8Confident86.2Confident79 Ų79124.6 Ų124.648%0.47960%0.604SS.*Hα-helixtrans-66.2-42.5175.9175.70000111N2 T3 K9 K10N2-V6 PolarHBondContact O-N 3.33Å; T3-V6 PolarHBondContact O-N 3Å; T3-V6 VanDerWaalsContact O-N 3.17Å; V6-K9 PolarHBondContact O-N 3.46Å; V6-K10 PolarHBondContact O-N 3.27Å
7Q86.1Confident86.6Confident123 Ų123124.9 Ų124.958%0.57560%0.604SS**Hα-helixtrans-64.5-42.1179.4-162.9169.92.200112.1T3 K9 K10 Q11T3-Q7 PolarHBondContact O-N 2.97Å; Q7-K9 PolarHBondContact O-N 3.41Å; Q7-K10 PolarHBondContact O-N 2.92Å; Q7-Q11 WeakPolarHBondContact O-CG 3.29Å; Q7-Q11 PolarHBondContact O-N 3.01Å
8R89.5Confident87Confident175 Ų175121.6 Ų121.666%0.6659%0.589SS**Hα-helixtrans-61.2-40.4172.4-79.1-172.1-88.9-163.5-4.6112.7S4 Q11 A12S4-R8 WeakPolarHBondContact O-CG 3.36Å; S4-R8 PolarHBondContact O-N 3.41Å; S4-R8 PolarHBondContact O-NE 2.74Å; R8-Q11 PolarHBondContact O-N 3.39Å; R8-A12 WeakPolarHBondContact O-CB 3.37Å; R8-A12 PolarHBondContact O-N 3.15Å
9K91Very high87.4Confident133 Ų133122.9 Ų122.958%0.57859%0.592SS**Hα-helixtrans-63-43.7174.2-77-172.7174.9-168.40112.1R5 V6 Q7 A12 I13R5-K9 WeakPolarHBondContact O-CG 3.49Å; R5-K9 PolarHBondContact O-N 3.43Å; R5-K9 VanDerWaalsContact O-N 3.09Å; V6-K9 PolarHBondContact O-N 3.46Å; Q7-K9 PolarHBondContact O-N 3.41Å; K9-A12 PolarHBondContact O-N 3.37Å; K9-I13 VanDerWaalsContact O-CG1 3.31Å; K9-I13 WeakPolarHBondContact O-CG1 3.28Å; K9-I13 PolarHBondContact O-N 3.34Å
10K90.7Very high87.8Confident151 Ų151118.6 Ų118.666%0.65758%0.581SS**Hα-helixtrans-61.8-47176.2-74.6-172.4174.9-172.50112V6 Q7 A12 I13 Y14V6-K10 PolarHBondContact O-N 3.27Å; Q7-K10 PolarHBondContact O-N 2.92Å; K10-A12 VanDerWaalsContact C-N 3.31Å; K10-A12 PolarHBondContact O-N 3.28Å; K10-I13 PolarHBondContact O-N 2.79Å; K10-Y14 PolarHBondContact O-N 3.37Å
11Q90.8Very high88Confident119 Ų119118.3 Ų118.356%0.55658%0.578SS**Hα-helixtrans-60-41.4175.8-75.2177.6-19.500111.8Q7 R8 I13 Y14 V15Q7-Q11 WeakPolarHBondContact O-CG 3.29Å; Q7-Q11 PolarHBondContact O-N 3.01Å; R8-Q11 PolarHBondContact O-N 3.39Å; Q11-I13 PolarHBondContact O-N 2.66Å; Q11-Y14 PolarHBondContact O-N 2.96Å; Q11-V15 WeakPolarHBondContact O-CG2 3.23Å; Q11-V15 PolarHBondContact O-N 3.43Å
12A93.6Very high89.9Confident54 Ų54111.9 Ų111.945%0.44655%0.548SS..Hα-helixtrans-64.7-36.6177.800000113.2R8 K9 K10 K16R8-A12 WeakPolarHBondContact O-CB 3.37Å; R8-A12 PolarHBondContact O-N 3.15Å; K9-A12 PolarHBondContact O-N 3.37Å; K10-A12 VanDerWaalsContact C-N 3.31Å; K10-A12 PolarHBondContact O-N 3.28Å; A12-K16 WeakPolarHBondContact O-CG 3.39Å; A12-K16 PolarHBondContact O-N 2.89Å
13I92.7Very high90.9Very high110 Ų110109 Ų10956%0.56454%0.54SS*.Hα-helixtrans-66.3-48174.7-67.1163.4000110.1K9 K10 Q11 V15 K16 E17K9-I13 VanDerWaalsContact O-CG1 3.31Å; K9-I13 WeakPolarHBondContact O-CG1 3.28Å; K9-I13 PolarHBondContact O-N 3.34Å; K10-I13 PolarHBondContact O-N 2.79Å; Q11-I13 PolarHBondContact O-N 2.66Å; I13-V15 VanDerWaalsContact C-N 3.35Å; I13-V15 PolarHBondContact O-N 2.91Å; I13-K16 WeakPolarHBondContact O-CB 3.5Å; I13-K16 PolarHBondContact O-N 3.17Å; I13-K16 VanDerWaalsContact O-N 3.07Å; I13-E17 PolarHBondContact O-N 3.43Å
14Y93.3Very high91.7Very high144 Ų144107.2 Ų107.257%0.56553%0.529SS*.Hα-helixtrans-60.3-42.1-179.9-171.2-109.9000112.6K10 Q11 K16 E17 L18K10-Y14 PolarHBondContact O-N 3.37Å; Q11-Y14 PolarHBondContact O-N 2.96Å; Y14-K16 VanDerWaalsContact C-N 3.32Å; Y14-K16 PolarHBondContact O-N 3.3Å; Y14-E17 PolarHBondContact O-N 3.27Å; Y14-L18 HydrophobicContact CD1-CD1 3.81Å; Y14-L18 HydrophobicContact CD1-CG 4.41Å; Y14-L18 HydrophobicContact CE1-CD1 3.43Å; Y14-L18 VanDerWaalsContact CE1-CD1 3.43Å; Y14-L18 HydrophobicContact CE1-CG 4.13Å; Y14-L18 WeakPolarHBondContact O-CG 3.5Å; Y14-L18 PolarHBondContact O-N 2.94Å
15V95.6Very high92.1Very high75 Ų75108.8 Ų108.846%0.45553%0.533SS..Hα-helixtrans-64.3-36.7175.2171.30000111.9Q11 I13 K19Q11-V15 WeakPolarHBondContact O-CG2 3.23Å; Q11-V15 PolarHBondContact O-N 3.43Å; I13-V15 VanDerWaalsContact C-N 3.35Å; I13-V15 PolarHBondContact O-N 2.91Å; V15-K19 HydrophobicContact CG1-CD 4.47Å; V15-K19 WeakPolarHBondContact O-CB 3.2Å; V15-K19 WeakPolarHBondContact O-CG 3.49Å; V15-K19 PolarHBondContact O-N 3.12Å; V15-K19 VanDerWaalsContact O-N 3.1Å
16K95.6Very high92.5Very high164 Ų164109.4 Ų109.471%0.71354%0.535SS*.Hα-helixtrans-66.4-42.2175.6-81.2-175.5175.6-172.30111.8A12 I13 Y14 K19 G20A12-K16 WeakPolarHBondContact O-CG 3.39Å; A12-K16 PolarHBondContact O-N 2.89Å; I13-K16 WeakPolarHBondContact O-CB 3.5Å; I13-K16 PolarHBondContact O-N 3.17Å; I13-K16 VanDerWaalsContact O-N 3.07Å; Y14-K16 VanDerWaalsContact C-N 3.32Å; Y14-K16 PolarHBondContact O-N 3.3Å; K16-K19 PolarHBondContact O-N 2.9Å; K16-G20 PolarHBondContact O-N 3.06Å
17E92.8Very high92.7Very high129 Ų129112 Ų11260%0.60354%0.54SS*.Hα-helixtrans-63.1-48.9178-171.4172-164.600111.4I13 Y14 K19 G20 E21I13-E17 PolarHBondContact O-N 3.43Å; Y14-E17 PolarHBondContact O-N 3.27Å; E17-K19 VanDerWaalsContact C-N 3.31Å; E17-K19 PolarHBondContact O-N 3.23Å; E17-G20 WeakPolarHBondContact O-CA 3.39Å; E17-G20 PolarHBondContact O-N 3.09Å; E17-E21 PolarHBondContact O-N 3.41Å
18L93.7Very high92.9Very high66 Ų66114.3 Ų114.335%0.34654%0.543SS..Hα-helixtrans-58.9-39.5175.7-73.3177.6000112.8Y14 G20 E21 I22Y14-L18 HydrophobicContact CD1-CD1 3.81Å; Y14-L18 HydrophobicContact CD1-CG 4.41Å; Y14-L18 HydrophobicContact CE1-CD1 3.43Å; Y14-L18 VanDerWaalsContact CE1-CD1 3.43Å; Y14-L18 HydrophobicContact CE1-CG 4.13Å; Y14-L18 WeakPolarHBondContact O-CG 3.5Å; Y14-L18 PolarHBondContact O-N 2.94Å; L18-G20 VanDerWaalsContact C-N 3.34Å; L18-E21 PolarHBondContact O-N 3.46Å; L18-I22 WeakPolarHBondContact O-CB 3.46Å; L18-I22 VanDerWaalsContact O-CG1 3.26Å; L18-I22 WeakPolarHBondContact O-CG1 3.42Å; L18-I22 PolarHBondContact O-N 2.98Å
19K95.6Very high92.7Very high146 Ų146111.3 Ų111.364%0.63554%0.54SS*.Hα-helixtrans-64.4-39.1174.6-78.9-177.3176.4-172.10112V15 K16 E17 A23V15-K19 HydrophobicContact CG1-CD 4.47Å; V15-K19 WeakPolarHBondContact O-CB 3.2Å; V15-K19 WeakPolarHBondContact O-CG 3.49Å; V15-K19 PolarHBondContact O-N 3.12Å; V15-K19 VanDerWaalsContact O-N 3.1Å; K16-K19 PolarHBondContact O-N 2.9Å; E17-K19 VanDerWaalsContact C-N 3.31Å; E17-K19 PolarHBondContact O-N 3.23Å; K19-A23 WeakPolarHBondContact O-CB 3.38Å; K19-A23 PolarHBondContact O-N 3.5Å
20G94.7Very high92.3Very high37 Ų37110.8 Ų110.838%0.38154%0.539SS..Hα-helixtrans-62.6-45.7174.400000111.8K16 E17 L18 A23 T24K16-G20 PolarHBondContact O-N 3.06Å; E17-G20 WeakPolarHBondContact O-CA 3.39Å; E17-G20 PolarHBondContact O-N 3.09Å; L18-G20 VanDerWaalsContact C-N 3.34Å; G20-A23 PolarHBondContact O-N 3.39Å; G20-T24 WeakPolarHBondContact O-CG2 3.46Å; G20-T24 PolarHBondContact O-N 2.93Å
21E92.9Very high91.9Very high112 Ų112109 Ų10952%0.52353%0.533SS..Hα-helixtrans-63.7-46.4179-166.1169.8-160.900111.9E17 L18 A23 T24 L25E17-E21 PolarHBondContact O-N 3.41Å; L18-E21 PolarHBondContact O-N 3.46Å; E21-A23 VanDerWaalsContact C-N 3.3Å; E21-A23 PolarHBondContact O-N 3.01Å; E21-T24 WeakPolarHBondContact CA-OG1 3.33Å; E21-T24 PolarHBondContact O-N 3.12Å; E21-T24 VanDerWaalsContact O-N 3.14Å; E21-T24 PolarHBondContact O-OG1 3.41Å; E21-L25 HydrophobicContact CG-CD1 4.33Å; E21-L25 WeakPolarHBondContact O-CG 3.49Å; E21-L25 PolarHBondContact O-N 2.99Å
22I95.3Very high91Very high85 Ų85109.1 Ų109.144%0.43653%0.533SS..Hα-helixtrans-57.5-42.3174.1-69.3167000111.3L18 L25 R26L18-I22 WeakPolarHBondContact O-CB 3.46Å; L18-I22 VanDerWaalsContact O-CG1 3.26Å; L18-I22 WeakPolarHBondContact O-CG1 3.42Å; L18-I22 PolarHBondContact O-N 2.98Å; I22-L25 PolarHBondContact O-N 3.39Å; I22-R26 HydrophobicContact CG2-CG 4.49Å; I22-R26 WeakPolarHBondContact O-CB 3.4Å; I22-R26 WeakPolarHBondContact O-CG 3.23Å; I22-R26 PolarHBondContact O-N 2.89Å
23A94.5Very high89.9Confident57 Ų57112.6 Ų112.647%0.47154%0.541SS..Hα-helixtrans-63.9-41.8177.500000111.9K19 G20 E21 R26 K27K19-A23 WeakPolarHBondContact O-CB 3.38Å; K19-A23 PolarHBondContact O-N 3.5Å; G20-A23 PolarHBondContact O-N 3.39Å; E21-A23 VanDerWaalsContact C-N 3.3Å; E21-A23 PolarHBondContact O-N 3.01Å; A23-R26 PolarHBondContact O-N 2.91Å; A23-K27 PolarHBondContact O-N 3.36Å
24T92.2Very high88.6Confident73 Ų73111.7 Ų111.745%0.44854%0.544SS..Hα-helixtrans-66-39.2176.259.50000112.8G20 E21 K27 R28G20-T24 WeakPolarHBondContact O-CG2 3.46Å; G20-T24 PolarHBondContact O-N 2.93Å; E21-T24 WeakPolarHBondContact CA-OG1 3.33Å; E21-T24 PolarHBondContact O-N 3.12Å; E21-T24 VanDerWaalsContact O-N 3.14Å; E21-T24 PolarHBondContact O-OG1 3.41Å; T24-K27 PolarHBondContact O-N 2.89Å; T24-R28 WeakPolarHBondContact O-CG 3.25Å; T24-R28 PolarHBondContact O-N 3.01Å
25L92.2Very high87Confident95 Ų95109 Ų10950%0.49755%0.546SS..Hα-helixtrans-66.9-42.1176.9-72.6172.7000111.6E21 I22 K27 R28 L29E21-L25 HydrophobicContact CG-CD1 4.33Å; E21-L25 WeakPolarHBondContact O-CG 3.49Å; E21-L25 PolarHBondContact O-N 2.99Å; I22-L25 PolarHBondContact O-N 3.39Å; L25-K27 PolarHBondContact O-N 2.92Å; L25-R28 PolarHBondContact O-N 2.91Å; L25-L29 WeakPolarHBondContact O-CB 3.22Å; L25-L29 PolarHBondContact O-N 3.24Å
26R92.8Very high84.8Confident171 Ų171109.6 Ų109.665%0.64555%0.547SS*.Hα-helixtrans-59.2-46173.4-77.4180175.4170.3-2112I22 A23 R28 L29 E30I22-R26 HydrophobicContact CG2-CG 4.49Å; I22-R26 WeakPolarHBondContact O-CB 3.4Å; I22-R26 WeakPolarHBondContact O-CG 3.23Å; I22-R26 PolarHBondContact O-N 2.89Å; A23-R26 PolarHBondContact O-N 2.91Å; R26-R28 VanDerWaalsContact C-N 3.31Å; R26-R28 PolarHBondContact O-N 2.86Å; R26-L29 PolarHBondContact O-N 2.91Å; R26-L29 VanDerWaalsContact O-N 3.12Å; R26-E30 PolarHBondContact O-N 3.29Å
27K91.5Very high82.5Confident133 Ų133106 Ų10658%0.57855%0.548SS*.Hα-helixtrans-60.8-38.6176.4-172.3176.1-178.6176.90112.5A23 T24 L25 Q31A23-K27 PolarHBondContact O-N 3.36Å; T24-K27 PolarHBondContact O-N 2.89Å; L25-K27 PolarHBondContact O-N 2.92Å; K27-Q31 WeakPolarHBondContact O-CG 3.49Å; K27-Q31 PolarHBondContact O-N 3.49Å; K27-Q31 VanDerWaalsContact O-N 3.11Å
28R90.1Very high80.4Confident171 Ų171104.9 Ų104.965%0.64555%0.554SS**Hα-helixtrans-68.1-36.8174.6-76.4-179.9176.2165.81.1112.4T24 L25 R26 Q31 H32T24-R28 WeakPolarHBondContact O-CG 3.25Å; T24-R28 PolarHBondContact O-N 3.01Å; L25-R28 PolarHBondContact O-N 2.91Å; R26-R28 VanDerWaalsContact C-N 3.31Å; R26-R28 PolarHBondContact O-N 2.86Å; R28-Q31 PolarHBondContact O-N 3.19Å; R28-H32 PolarHBondContact O-N 3.4Å
29L84.8Confident78.2Confident113 Ų113109.7 Ų109.759%0.59258%0.575SS**Hα-helixtrans-67.6-44.3177.4-166.2133.2000111.1L25 R26 Q31 H32 E33L25-L29 WeakPolarHBondContact O-CB 3.22Å; L25-L29 PolarHBondContact O-N 3.24Å; R26-L29 PolarHBondContact O-N 2.91Å; R26-L29 VanDerWaalsContact O-N 3.12Å; L29-Q31 VanDerWaalsContact C-N 3.32Å; L29-Q31 PolarHBondContact O-N 3.39Å; L29-H32 PolarHBondContact O-N 2.99Å; L29-H32 VanDerWaalsContact O-N 3.08Å; L29-E33 PolarHBondContact O-N 2.89Å
30E83.8Confident75.4Confident122 Ų122108.4 Ų108.457%0.5758%0.584SS**Hα-helixtrans-59.6-39.5172.9-76.2171.2-173.900112.2R26 H32 E33 S34R26-E30 PolarHBondContact O-N 3.29Å; E30-H32 VanDerWaalsContact C-N 3.34Å; E30-E33 PolarHBondContact O-N 3.08Å; E30-S34 VanDerWaalsContact O-CB 3.31Å; E30-S34 WeakPolarHBondContact O-CB 3.41Å; E30-S34 PolarHBondContact O-N 3.26Å; E30-S34 PolarHBondContact O-OG 2.95Å
31Q80.4Confident73Confident114 Ų114112.5 Ų112.553%0.53361%0.607SS.*Hα-helixtrans-63.9-38173.8-76.9177.2-13.300112.3K27 R28 L29 S35K27-Q31 WeakPolarHBondContact O-CG 3.49Å; K27-Q31 PolarHBondContact O-N 3.49Å; K27-Q31 VanDerWaalsContact O-N 3.11Å; R28-Q31 PolarHBondContact O-N 3.19Å; L29-Q31 VanDerWaalsContact C-N 3.32Å; L29-Q31 PolarHBondContact O-N 3.39Å; Q31-S35 WeakPolarHBondContact O-CB 3.41Å; Q31-S35 PolarHBondContact O-N 3.35Å; Q31-S35 VanDerWaalsContact O-N 3.14Å; Q31-S35 PolarHBondContact O-OG 2.87Å
32H73.9Confident70.7Confident120 Ų120111.1 Ų111.156%0.55662%0.623SS**Hα-helixtrans-72.6-39.2177.9-166.7-84000111.8R28 L29 E30 S35 N36R28-H32 PolarHBondContact O-N 3.4Å; L29-H32 PolarHBondContact O-N 2.99Å; L29-H32 VanDerWaalsContact O-N 3.08Å; E30-H32 VanDerWaalsContact C-N 3.34Å; H32-S35 PolarHBondContact O-N 3Å; H32-N36 PolarHBondContact CE1-ND2 3.49Å; H32-N36 WeakPolarHBondContact O-CB 3.19Å; H32-N36 PolarHBondContact O-N 2.84Å
33E70.2Confident68Low128 Ų128110.7 Ų110.760%0.59864%0.639SS**Hα-helixtrans-64.9-42.2173.1-106.6180132.900112.1L29 E30 S35 N36 A37L29-E33 PolarHBondContact O-N 2.89Å; E30-E33 PolarHBondContact O-N 3.08Å; E33-S35 PolarHBondContact O-N 3.4Å; E33-N36 PolarHBondContact O-N 2.88Å; E33-A37 WeakPolarHBondContact O-CB 3.33Å; E33-A37 PolarHBondContact O-N 3.27Å
34S65Low65.6Low91 Ų91113.6 Ų113.664%0.63666%0.657SS**Hα-helixtrans-64.3-27.3176-550000112.5E30E30-S34 VanDerWaalsContact O-CB 3.31Å; E30-S34 WeakPolarHBondContact O-CB 3.41Å; E30-S34 PolarHBondContact O-N 3.26Å; E30-S34 PolarHBondContact O-OG 2.95Å
35S58.4Low63Low88 Ų88114 Ų11462%0.61567%0.667SS**Hα-helixtrans-85.6-25.3177.1-54.20000112.9Q31 H32 E33Q31-S35 WeakPolarHBondContact O-CB 3.41Å; Q31-S35 PolarHBondContact O-N 3.35Å; Q31-S35 VanDerWaalsContact O-N 3.14Å; Q31-S35 PolarHBondContact O-OG 2.87Å; H32-S35 PolarHBondContact O-N 3Å; E33-S35 PolarHBondContact O-N 3.4Å
36N51.3Low60.8Low87 Ų87117.2 Ų117.247%0.46568%0.684SS.*Hα-helixtrans-94.6-12.9179-90.317.5000114H32 E33 S38 Q39H32-N36 PolarHBondContact CE1-ND2 3.49Å; H32-N36 WeakPolarHBondContact O-CB 3.19Å; H32-N36 PolarHBondContact O-N 2.84Å; E33-N36 PolarHBondContact O-N 2.88Å; N36-S38 PolarHBondContact O-N 2.68Å; N36-Q39 PolarHBondContact O-N 3.37Å
37A46.9Very low58.3Low88 Ų88118 Ų11873%0.72770%0.695SS**THydrogen-bonded Turntrans-65.1-1.4177.200000114.5E33E33-A37 WeakPolarHBondContact O-CB 3.33Å; E33-A37 PolarHBondContact O-N 3.27Å
38S48.3Very low55.7Low106 Ų106115.1 Ų115.174%0.74170%0.703SS**THydrogen-bonded Turntrans-98.42172.6-46.50000114N36N36-S38 PolarHBondContact O-N 2.68Å
39Q46.8Very low53.6Low166 Ų166112 Ų11278%0.77671%0.708SS**SBendtrans-145.575-176.3-64.8-175.88.600112.5N36N36-Q39 PolarHBondContact O-N 3.37Å
40S36.9Very low51.4Low120 Ų120111.5 Ų111.584%0.83971%0.714SS**  trans-178.3104.3147.754.60000112.1
41S44.3Very low49.4Very low122 Ų122117.4 Ų117.485%0.85373%0.731SS**  trans-105.6116.5157.753.20000108.7
42G44.6Very low47.3Very low84 Ų84116.3 Ų116.387%0.86674%0.741SS**  trans79.8133.7164.500000115.3
43G39.4Very low46.1Very low75 Ų75115.8 Ų115.877%0.77375%0.748SS**  cis161.9142.55.400000109.3
44S42.8Very low44.6Very low119 Ų119115 Ų11583%0.83276%0.757SS**  trans67.8116.9156.9-154.60000121
45A39Very low43.8Very low81 Ų81116.3 Ų116.367%0.66976%0.763SS**  trans-43.6153.7152.200000114
46L46.5Very low43.1Very low162 Ų162118.9 Ų118.985%0.84878%0.775SS**  -175159.3114.2-91.5162.6000110.5
47E40.4Very low42.7Very low188 Ų188121 Ų12188%0.87979%0.794SS**  trans-65.4170.3-163-53.4176.1124.400116.1
48G37Very low42.6Very low73 Ų73122.7 Ų122.775%0.75380%0.8SS**  trans135.490.7144.300000117.4
49S44.2Very low42.2Very low106 Ų106123.2 Ų123.274%0.74180%0.804SS**  trans40.8114.3134.7-155.40000121.1
50S40.1Very low42.2Very low102 Ų102120.9 Ų120.971%0.71381%0.806SS**  63.9135.5127.6-47.70000121.7
51R40.5Very low42.5Very low246 Ų246119.7 Ų119.793%0.92880%0.803SS**  trans96.5109154.3-62179.3170.8-162-4.3117.5
52A37.7Very low42.4Very low91 Ų91119.5 Ų119.575%0.75280%0.799SS**  trans-69.2-177.715300000110.5
53P48.2Very low42.7Very low108 Ų108125 Ų12570%0.70180%0.8SS**  cis-144.4174.91.244.8-25.9000117.2
54S38.5Very low42.9Very low113 Ų113127.1 Ų127.179%0.7980%0.799SS**  trans74.8169.3149.1-33.50000120.9
55P47.3Very low42.9Very low118 Ų118127.8 Ų127.877%0.76680%0.803SS**  -125.2163.8-119.325.50.5000114.7
56T44.4Very low42.9Very low141 Ų141128.7 Ų128.787%0.86581%0.81SS**  trans-149.2133.8164.2470000112.3
57P42.5Very low43.1Very low131 Ų131128.8 Ų128.885%0.85181%0.81SS**  trans-98.6130165.634.3-24.2000109.7
58S45.6Very low43.1Very low124 Ų124126.9 Ų126.987%0.86781%0.805SS**  trans-105.1120.7171.853.70000110.8
59S39.1Very low43.3Very low118 Ų118129.4 Ų129.483%0.82581%0.809SS**  trans-77.8137.2168.863.60000111
60S47.5Very low42.8Very low117 Ų117128.6 Ų128.682%0.81881%0.808SS**  trans-157.7109.2148.446.30000110.1
61A43.3Very low43.2Very low94 Ų94130.6 Ų130.678%0.77782%0.816SS**  trans-71.5161.7164.900000110.2
62P42.1Very low43.2Very low118 Ų118126.2 Ų126.277%0.76681%0.806SS**  -149.5140.797.234.5-15.5000117.4
63K50.2Low43Very low201 Ų201126.4 Ų126.487%0.87480%0.801SS**  trans63145.4137.7-70.1-176.7179.1177.40123.9
64P43.7Very low42.7Very low119 Ų119130.2 Ų130.277%0.77380%0.802SS**  trans-102.6147-169.539.2-28.3000113.1
65C42.6Very low42.7Very low133 Ų133130.2 Ų130.290%0.89979%0.79SS**  trans-134.9128.5160.4-84.20000109.6
66A38.9Very low42.7Very low99 Ų99130.1 Ų130.182%0.81878%0.783SS**  trans-69.3138.7178.500000112.3
67I50.8Low43Very low165 Ų165128 Ų12885%0.84677%0.774SS**  trans-145.9139.5154.1-58.4-174.9000108.5
68D42.2Very low43.4Very low147 Ų147127.9 Ų127.979%0.78677%0.771SS**  trans-54160.8-162.4-68-65.8000120.7
69P39.1Very low43.6Very low127 Ų127129.7 Ų129.783%0.82576%0.759SS**  trans-91.797.2173.535.8-26.7000110.6
70A35.3Very low44.3Very low89 Ų89131.1 Ų131.174%0.73675%0.75SS**  trans-162.386.2168.100000111.3
71V48.5Very low44.8Very low143 Ų143129.9 Ų129.987%0.86774%0.738SS**  trans-143.2121.7147.2-173.50000109.3
72E39Very low45.8Very low154 Ų154127 Ų12772%0.7272%0.717SS**  trans-51.8144.1174-62.4164.5137.700112.2
73C34.2Very low47.1Very low96 Ų96125.6 Ų125.665%0.64971%0.709SS**  5.8140125.8-1310000114.7
74Y42Very low48.4Very low187 Ų187122.3 Ų122.373%0.73370%0.696SS**  -160.2132.650.9-18.2-87.8000110.5
75E38.1Very low50.4Low114 Ų114122.2 Ų122.253%0.53369%0.686SS.*  trans-58.3142-174.5-58.5166.1142.200113.7R79E75-R79 VanDerWaalsContact CD-NH1 3.31Å; E75-R79 IonicContact OE1-CZ 3.83Å; E75-R79 IonicContact OE1-NH1 3.02Å; E75-R79 PolarHBondContact OE1-NH1 3.17Å; E75-R79 IonicContact OE1-NH2 2.79Å; E75-R79 PolarHBondContact OE1-NH2 3.38Å; E75-R79 IonicContact OE2-NH1 2.64Å
76N47.2Very low52.6Low116 Ų116120.3 Ų120.362%0.6267%0.666SS**SBendtrans163.4-17.3132.8-80.2-21.2000114.9K80N76-K80 WeakPolarHBondContact O-CG 3.34Å
77S50.7Low55.1Low97 Ų97120 Ų12068%0.67865%0.648SS**Hα-helixtrans-90.8-42.8-178.4-155.30000113.1K80 V81S77-K80 PolarHBondContact O-N 2.87Å; S77-V81 PolarHBondContact O-N 2.81Å
78T50.7Low57.1Low127 Ų127114.8 Ų114.878%0.77963%0.629SS**Hα-helixtrans-74.2-29.7-179.8-4.20000113.5K80 G82T78-K80 VanDerWaalsContact C-N 3.35Å; T78-G82 PolarHBondContact O-N 3.47Å; T78-G82 VanDerWaalsContact O-N 3.12Å
79R50.6Low59.6Low163 Ų163112.2 Ų112.262%0.61561%0.614SS**Hα-helixtrans-68.1-32.9173.2-82.5-170.6-175.4160.210.4112.4E75 C83E75-R79 VanDerWaalsContact CD-NH1 3.31Å; E75-R79 IonicContact OE1-CZ 3.83Å; E75-R79 IonicContact OE1-NH1 3.02Å; E75-R79 PolarHBondContact OE1-NH1 3.17Å; E75-R79 IonicContact OE1-NH2 2.79Å; E75-R79 PolarHBondContact OE1-NH2 3.38Å; E75-R79 IonicContact OE2-NH1 2.64Å; R79-C83 VanDerWaalsContact O-CB 3.28Å; R79-C83 WeakPolarHBondContact O-CB 3.48Å; R79-C83 PolarHBondContact O-N 3.42Å
80K53.4Low62.3Low147 Ų147110.4 Ų110.464%0.63960%0.596SS**Hα-helixtrans-67.3-46.5176.1-78.7-173.5176.2-172.10111.8N76 S77 T78 G82 C83 E84N76-K80 WeakPolarHBondContact O-CG 3.34Å; S77-K80 PolarHBondContact O-N 2.87Å; T78-K80 VanDerWaalsContact C-N 3.35Å; K80-G82 VanDerWaalsContact C-N 3.35Å; K80-G82 PolarHBondContact O-N 3.24Å; K80-C83 WeakPolarHBondContact O-CB 3.4Å; K80-C83 PolarHBondContact O-N 3.48Å; K80-E84 WeakPolarHBondContact O-CG 3.32Å; K80-E84 PolarHBondContact O-N 3.13Å
81V58.4Low65.1Low92 Ų92111.7 Ų111.756%0.55859%0.587SS**Hα-helixtrans-63.6-39.6177.2-177.60000111.7S77 E84 H85S77-V81 PolarHBondContact O-N 2.81Å; V81-E84 PolarHBondContact O-N 2.96Å; V81-H85 WeakPolarHBondContact O-CB 3.46Å; V81-H85 PolarHBondContact O-N 2.95Å
82G64.8Low67.4Low33 Ų33111.8 Ų111.834%0.3458%0.576SS.*Hα-helixtrans-64.9-38.7173.700000113.2T78 K80 N86T78-G82 PolarHBondContact O-N 3.47Å; T78-G82 VanDerWaalsContact O-N 3.12Å; K80-G82 VanDerWaalsContact C-N 3.35Å; K80-G82 PolarHBondContact O-N 3.24Å; G82-N86 WeakPolarHBondContact O-CB 3.26Å; G82-N86 PolarHBondContact O-N 3.48Å; G82-N86 PolarHBondContact O-ND2 3.37Å
83C68Low70.2Confident88 Ų88108.1 Ų108.160%0.59556%0.56SS**Hα-helixtrans-66.6-41.8176.3-1650000111.8R79 K80 Q87R79-C83 VanDerWaalsContact O-CB 3.28Å; R79-C83 WeakPolarHBondContact O-CB 3.48Å; R79-C83 PolarHBondContact O-N 3.42Å; K80-C83 WeakPolarHBondContact O-CB 3.4Å; K80-C83 PolarHBondContact O-N 3.48Å; C83-Q87 VanDerWaalsContact O-CB 3.23Å; C83-Q87 WeakPolarHBondContact O-CB 3.36Å; C83-Q87 PolarHBondContact O-N 3.03Å
84E79.2Confident73.2Confident132 Ų132105.8 Ų105.862%0.61754%0.543SS*.Hα-helixtrans-65.6-42176-72.1172.9-176.300112.1K80 V81 Q87 A88K80-E84 WeakPolarHBondContact O-CG 3.32Å; K80-E84 PolarHBondContact O-N 3.13Å; V81-E84 PolarHBondContact O-N 2.96Å; E84-Q87 PolarHBondContact O-N 3.43Å; E84-A88 WeakPolarHBondContact O-CB 3.48Å; E84-A88 PolarHBondContact O-N 3.08Å
85H85.4Confident75.8Confident118 Ų118104.4 Ų104.455%0.54654%0.541SS..Hα-helixtrans-64.8-44.8176.6-174.678000112.3V81 Q87 A88 M89V81-H85 WeakPolarHBondContact O-CB 3.46Å; V81-H85 PolarHBondContact O-N 2.95Å; H85-Q87 VanDerWaalsContact C-N 3.34Å; H85-Q87 PolarHBondContact O-N 3.21Å; H85-A88 PolarHBondContact O-N 3.38Å; H85-M89 WeakPolarHBondContact NE2-CE 3.48Å; H85-M89 WeakPolarHBondContact O-CB 3.45Å; H85-M89 PolarHBondContact O-N 3.31Å
86N88.8Confident78.7Confident93 Ų93103.8 Ų103.850%0.49754%0.541SS..Hα-helixtrans-62.1-43175.5-72.4-19.2000111G82 M89 I90G82-N86 WeakPolarHBondContact O-CB 3.26Å; G82-N86 PolarHBondContact O-N 3.48Å; G82-N86 PolarHBondContact O-ND2 3.37Å; N86-M89 PolarHBondContact O-N 2.89Å; N86-I90 WeakPolarHBondContact O-CD1 3.27Å; N86-I90 WeakPolarHBondContact O-CG1 3.47Å; N86-I90 PolarHBondContact O-N 2.86Å
87Q91.1Very high81.1Confident93 Ų93104.1 Ų104.144%0.43554%0.538SS..Hα-helixtrans-60.1-46.9175.6-178.459.635.500111.7C83 E84 H85 M89 I90 E91C83-Q87 VanDerWaalsContact O-CB 3.23Å; C83-Q87 WeakPolarHBondContact O-CB 3.36Å; C83-Q87 PolarHBondContact O-N 3.03Å; E84-Q87 PolarHBondContact O-N 3.43Å; H85-Q87 VanDerWaalsContact C-N 3.34Å; H85-Q87 PolarHBondContact O-N 3.21Å; Q87-M89 VanDerWaalsContact C-N 3.31Å; Q87-M89 PolarHBondContact O-N 2.89Å; Q87-I90 PolarHBondContact O-N 3.2Å; Q87-E91 PolarHBondContact NE2-OE1 3.4Å; Q87-E91 WeakPolarHBondContact O-CG 3.49Å; Q87-E91 PolarHBondContact O-N 3.15Å
88A91.9Very high83.3Confident54 Ų54107.1 Ų107.145%0.44654%0.535SS..Hα-helixtrans-62.5-36.8176.600000112.6E84 H85 K92E84-A88 WeakPolarHBondContact O-CB 3.48Å; E84-A88 PolarHBondContact O-N 3.08Å; H85-A88 PolarHBondContact O-N 3.38Å; A88-K92 WeakPolarHBondContact O-CB 3.33Å; A88-K92 PolarHBondContact O-N 3.3Å
89M95.1Very high85.5Confident94 Ų94102.5 Ų102.546%0.46351%0.51SS..Hα-helixtrans-66.8-44.2175.1-167.7-177.5-58.500111.4H85 N86 Q87 E91 K92 I93H85-M89 WeakPolarHBondContact NE2-CE 3.48Å; H85-M89 WeakPolarHBondContact O-CB 3.45Å; H85-M89 PolarHBondContact O-N 3.31Å; N86-M89 PolarHBondContact O-N 2.89Å; Q87-M89 VanDerWaalsContact C-N 3.31Å; Q87-M89 PolarHBondContact O-N 2.89Å; M89-E91 PolarHBondContact O-N 3.28Å; M89-K92 PolarHBondContact O-N 2.8Å; M89-I93 HydrophobicContact CG-CD1 4.14Å; M89-I93 VanDerWaalsContact O-CG1 3.26Å; M89-I93 WeakPolarHBondContact O-CG1 3.45Å; M89-I93 PolarHBondContact O-N 3.4Å
90I95.1Very high87.8Confident89 Ų8997.6 Ų97.646%0.45650%0.497SS..Hα-helixtrans-59.7-46.4175.4-68162.4000110.2N86 Q87 K92 I93 V94N86-I90 WeakPolarHBondContact O-CD1 3.27Å; N86-I90 WeakPolarHBondContact O-CG1 3.47Å; N86-I90 PolarHBondContact O-N 2.86Å; Q87-I90 PolarHBondContact O-N 3.2Å; I90-K92 VanDerWaalsContact C-N 3.32Å; I90-K92 PolarHBondContact O-N 3.37Å; I90-I93 WeakPolarHBondContact O-CB 3.46Å; I90-I93 PolarHBondContact O-N 3.17Å; I90-V94 HydrophobicContact CG2-CG2 4.38Å; I90-V94 WeakPolarHBondContact O-CG2 3.36Å; I90-V94 PolarHBondContact O-N 2.96Å
91E95.3Very high89.9Confident115 Ų11592.7 Ų92.754%0.53749%0.485SS..Hα-helixtrans-60.6-41.1176.8-74.5174.5-162.900112.4Q87 M89 V94 K95Q87-E91 PolarHBondContact NE2-OE1 3.4Å; Q87-E91 WeakPolarHBondContact O-CG 3.49Å; Q87-E91 PolarHBondContact O-N 3.15Å; M89-E91 PolarHBondContact O-N 3.28Å; E91-V94 PolarHBondContact O-N 2.81Å; E91-K95 WeakPolarHBondContact O-CB 3.49Å; E91-K95 PolarHBondContact O-N 3.05Å
92K96.8Very high91.8Very high146 Ų14695.2 Ų95.264%0.63548%0.484SS*.Hα-helixtrans-63.7-43.3174.9-170.6175.7-177.7179.70111.5A88 M89 I90 K95 L96A88-K92 WeakPolarHBondContact O-CB 3.33Å; A88-K92 PolarHBondContact O-N 3.3Å; M89-K92 PolarHBondContact O-N 2.8Å; I90-K92 VanDerWaalsContact C-N 3.32Å; I90-K92 PolarHBondContact O-N 3.37Å; K92-K95 PolarHBondContact O-N 3.08Å; K92-L96 HydrophobicContact CG-CD1 4.35Å; K92-L96 WeakPolarHBondContact O-CB 3.47Å; K92-L96 WeakPolarHBondContact O-CG 3.49Å; K92-L96 PolarHBondContact O-N 2.79Å
93I96.8Very high93.4Very high77 Ų77100.9 Ų100.940%0.39550%0.495SS..Hα-helixtrans-60-50.2175.4-70.1163.2000110M89 I90 K95 L96 Q97M89-I93 HydrophobicContact CG-CD1 4.14Å; M89-I93 VanDerWaalsContact O-CG1 3.26Å; M89-I93 WeakPolarHBondContact O-CG1 3.45Å; M89-I93 PolarHBondContact O-N 3.4Å; I90-I93 WeakPolarHBondContact O-CB 3.46Å; I90-I93 PolarHBondContact O-N 3.17Å; I93-K95 VanDerWaalsContact C-N 3.32Å; I93-K95 PolarHBondContact O-N 2.9Å; I93-L96 PolarHBondContact O-N 3.28Å; I93-L96 VanDerWaalsContact O-N 3.17Å; I93-Q97 HydrophobicContact CG2-CG 4.24Å; I93-Q97 WeakPolarHBondContact O-CB 3.37Å; I93-Q97 WeakPolarHBondContact O-CG 3.46Å; I93-Q97 PolarHBondContact O-N 3.2Å
94V97.5Very high94.8Very high46 Ų46100.6 Ų100.628%0.27949%0.488SS..Hα-helixtrans-60.5-42.2179.2171.40000111I90 E91 L96 Q97 R98I90-V94 HydrophobicContact CG2-CG2 4.38Å; I90-V94 WeakPolarHBondContact O-CG2 3.36Å; I90-V94 PolarHBondContact O-N 2.96Å; E91-V94 PolarHBondContact O-N 2.81Å; V94-L96 PolarHBondContact O-N 2.9Å; V94-Q97 PolarHBondContact O-N 3.43Å; V94-R98 VanDerWaalsContact CG1-NH2 3.35Å; V94-R98 WeakPolarHBondContact O-CG 3.33Å; V94-R98 PolarHBondContact O-N 3.26Å
95K97.1Very high95.7Very high159 Ų159100.2 Ų100.269%0.69149%0.486SS*.Hα-helixtrans-61.7-43.3176.4-173.1176.4-178.5177.10111.8E91 K92 I93 A99E91-K95 WeakPolarHBondContact O-CB 3.49Å; E91-K95 PolarHBondContact O-N 3.05Å; K92-K95 PolarHBondContact O-N 3.08Å; I93-K95 VanDerWaalsContact C-N 3.32Å; I93-K95 PolarHBondContact O-N 2.9Å; K95-A99 WeakPolarHBondContact O-CB 3.49Å; K95-A99 PolarHBondContact O-N 2.7Å; K95-A99 VanDerWaalsContact O-N 3.08Å
96L98.2Very high96.3Very high101 Ų101100 Ų10053%0.52948%0.483SS..Hα-helixtrans-66.7-43.5176.4-73.1172.5000111.7K92 I93 V94 R98 A99 V100K92-L96 HydrophobicContact CG-CD1 4.35Å; K92-L96 WeakPolarHBondContact O-CB 3.47Å; K92-L96 WeakPolarHBondContact O-CG 3.49Å; K92-L96 PolarHBondContact O-N 2.79Å; I93-L96 PolarHBondContact O-N 3.28Å; I93-L96 VanDerWaalsContact O-N 3.17Å; V94-L96 PolarHBondContact O-N 2.9Å; L96-R98 PolarHBondContact O-N 2.94Å; L96-A99 CarbonylContact O-C 3.55Å; L96-A99 WeakPolarHBondContact O-CA 3.42Å; L96-A99 WeakPolarHBondContact O-CB 3.43Å; L96-A99 PolarHBondContact O-N 2.89Å; L96-A99 VanDerWaalsContact O-N 3.08Å; L96-V100 WeakPolarHBondContact O-CG2 3.45Å; L96-V100 PolarHBondContact O-N 3.23Å
97Q98Very high96.7Very high122 Ų12299.6 Ų99.657%0.5748%0.481SS*.Hα-helixtrans-59.8-45.2176.3-75.4175.7-18.400111.6I93 V94 A99 V100 A101I93-Q97 HydrophobicContact CG2-CG 4.24Å; I93-Q97 WeakPolarHBondContact O-CB 3.37Å; I93-Q97 WeakPolarHBondContact O-CG 3.46Å; I93-Q97 PolarHBondContact O-N 3.2Å; V94-Q97 PolarHBondContact O-N 3.43Å; Q97-A99 VanDerWaalsContact C-N 3.29Å; Q97-A99 PolarHBondContact O-N 3.3Å; Q97-V100 PolarHBondContact O-N 3.01Å; Q97-A101 WeakPolarHBondContact O-CB 3.46Å; Q97-A101 PolarHBondContact O-N 3.3Å
98R97.3Very high97Very high160 Ų160101.2 Ų101.260%0.60449%0.488SS*.Hα-helixtrans-61.6-36.7173.5-68.4-178.4-154.81697.1112.4V94 L96 R102V94-R98 VanDerWaalsContact CG1-NH2 3.35Å; V94-R98 WeakPolarHBondContact O-CG 3.33Å; V94-R98 PolarHBondContact O-N 3.26Å; L96-R98 PolarHBondContact O-N 2.94Å; R98-R102 WeakPolarHBondContact O-CG 3.32Å; R98-R102 PolarHBondContact O-N 2.93Å; R98-R102 VanDerWaalsContact O-N 3.13Å; R98-R102 PolarHBondContact O-NH1 3.4Å
99A97.3Very high97.3Very high31 Ų31104.7 Ų104.726%0.25649%0.493SS..Hα-helixtrans-72.1-31.6176.500000112.9K95 L96 Q97 R103K95-A99 WeakPolarHBondContact O-CB 3.49Å; K95-A99 PolarHBondContact O-N 2.7Å; K95-A99 VanDerWaalsContact O-N 3.08Å; L96-A99 CarbonylContact O-C 3.55Å; L96-A99 WeakPolarHBondContact O-CA 3.42Å; L96-A99 WeakPolarHBondContact O-CB 3.43Å; L96-A99 PolarHBondContact O-N 2.89Å; L96-A99 VanDerWaalsContact O-N 3.08Å; Q97-A99 VanDerWaalsContact C-N 3.29Å; Q97-A99 PolarHBondContact O-N 3.3Å; A99-R103 WeakPolarHBondContact O-CG 3.4Å; A99-R103 PolarHBondContact O-N 2.7Å; A99-R103 PolarHBondContact O-NE 3.05Å
100V97.9Very high97.5Very high59 Ų59104.1 Ų104.136%0.35849%0.492SS..Hα-helixtrans-68.6-47.5170.9170.90000110.1L96 Q97 R102 R103 N104L96-V100 WeakPolarHBondContact O-CG2 3.45Å; L96-V100 PolarHBondContact O-N 3.23Å; Q97-V100 PolarHBondContact O-N 3.01Å; V100-R102 PolarHBondContact O-N 3.47Å; V100-R103 PolarHBondContact O-N 3.42Å; V100-N104 PolarHBondContact O-N 3.03Å
101A97.7Very high97.6Very high45 Ų45104.9 Ų104.937%0.37249%0.493SS..Hα-helixtrans-55.1-50.317800000112.2Q97 R103 N104 E105Q97-A101 WeakPolarHBondContact O-CB 3.46Å; Q97-A101 PolarHBondContact O-N 3.3Å; A101-R103 VanDerWaalsContact C-N 3.28Å; A101-R103 PolarHBondContact O-N 2.9Å; A101-N104 PolarHBondContact O-N 3.09Å; A101-N104 VanDerWaalsContact O-N 3.15Å; A101-E105 WeakPolarHBondContact O-CG 3.47Å; A101-E105 PolarHBondContact O-N 3.24Å
102R98.1Very high97.7Very high144 Ų144104.6 Ų104.654%0.54349%0.492SS..Hα-helixtrans-60.3-34.3176.1-72.7-170.7-63.9-88.40.6113.7R98 V100 K106R98-R102 WeakPolarHBondContact O-CG 3.32Å; R98-R102 PolarHBondContact O-N 2.93Å; R98-R102 VanDerWaalsContact O-N 3.13Å; R98-R102 PolarHBondContact O-NH1 3.4Å; V100-R102 PolarHBondContact O-N 3.47Å; R102-K106 WeakPolarHBondContact O-CB 3.41Å; R102-K106 PolarHBondContact O-N 2.9Å; R102-K106 VanDerWaalsContact O-N 3.17Å
103R98Very high97.8Very high152 Ų152101.6 Ų101.657%0.57448%0.483SS*.Hα-helixtrans-71.8-40.1176.6-78.8-175-67.9158.6-1.8111.2A99 V100 A101 K106 I107A99-R103 WeakPolarHBondContact O-CG 3.4Å; A99-R103 PolarHBondContact O-N 2.7Å; A99-R103 PolarHBondContact O-NE 3.05Å; V100-R103 PolarHBondContact O-N 3.42Å; A101-R103 VanDerWaalsContact C-N 3.28Å; A101-R103 PolarHBondContact O-N 2.9Å; R103-K106 PolarHBondContact O-N 3.43Å; R103-I107 VanDerWaalsContact O-CG1 3.29Å; R103-I107 WeakPolarHBondContact O-CG1 3.29Å; R103-I107 PolarHBondContact O-N 3.24Å
104N97.9Very high97.9Very high82 Ų82102.4 Ų102.444%0.43949%0.491SS..Hα-helixtrans-63.4-47.2175.8-72.31000111.3V100 A101 K106 I107 E108V100-N104 PolarHBondContact O-N 3.03Å; A101-N104 PolarHBondContact O-N 3.09Å; A101-N104 VanDerWaalsContact O-N 3.15Å; N104-K106 PolarHBondContact O-N 3.03Å; N104-I107 WeakPolarHBondContact O-CB 3.44Å; N104-I107 PolarHBondContact O-N 2.9Å; N104-E108 WeakPolarHBondContact O-CG 3.41Å; N104-E108 PolarHBondContact O-N 3.12Å
105E97.6Very high97.9Very high124 Ų124105.7 Ų105.758%0.57950%0.502SS*.Hα-helixtrans-55.3-39.7173.4-71169.6-17600111.8A101 F109A101-E105 WeakPolarHBondContact O-CG 3.47Å; A101-E105 PolarHBondContact O-N 3.24Å; E105-F109 WeakPolarHBondContact O-CB 3.44Å; E105-F109 PolarHBondContact O-N 3.37Å
106K98.3Very high97.9Very high113 Ų113103 Ų10349%0.49149%0.492SS..Hα-helixtrans-69.4-38.1177.1-175.658177177.60112.7R102 R103 N104 L110R102-K106 WeakPolarHBondContact O-CB 3.41Å; R102-K106 PolarHBondContact O-N 2.9Å; R102-K106 VanDerWaalsContact O-N 3.17Å; R103-K106 PolarHBondContact O-N 3.43Å; N104-K106 PolarHBondContact O-N 3.03Å; K106-L110 HydrophobicContact CD-CD1 4.45Å; K106-L110 HydrophobicContact CD-CG 4.39Å; K106-L110 HydrophobicContact CG-CD1 4.31Å; K106-L110 WeakPolarHBondContact O-CG 3.47Å; K106-L110 PolarHBondContact O-N 3.05Å; K106-L110 VanDerWaalsContact O-N 3.09Å
107I97.9Very high97.9Very high86 Ų86103 Ų10344%0.44149%0.492SS..Hα-helixtrans-62.6-52.4175.2-71.8163.7000109.1R103 N104 F109 L110 E111R103-I107 VanDerWaalsContact O-CG1 3.29Å; R103-I107 WeakPolarHBondContact O-CG1 3.29Å; R103-I107 PolarHBondContact O-N 3.24Å; N104-I107 WeakPolarHBondContact O-CB 3.44Å; N104-I107 PolarHBondContact O-N 2.9Å; I107-F109 VanDerWaalsContact C-N 3.3Å; I107-F109 PolarHBondContact O-N 2.86Å; I107-L110 PolarHBondContact O-N 3.48Å; I107-E111 HydrophobicContact CG2-CG 4.19Å; I107-E111 WeakPolarHBondContact O-CG 3.31Å; I107-E111 PolarHBondContact O-N 3.4Å
108E97.7Very high97.9Very high127 Ų12799.2 Ų99.259%0.59348%0.481SS*.Hα-helixtrans-55.7-44.4178.7-70.9174.6-165.400111.7N104 L110 E111 E112N104-E108 WeakPolarHBondContact O-CG 3.41Å; N104-E108 PolarHBondContact O-N 3.12Å; E108-L110 PolarHBondContact O-N 3.08Å; E108-E111 PolarHBondContact O-N 3.19Å; E108-E112 PolarHBondContact O-N 2.96Å; E108-E112 VanDerWaalsContact O-N 3.08Å
109F98.4Very high97.9Very high126 Ų12697.4 Ų97.455%0.55348%0.479SS*.Hα-helixtrans-59.7-44.4175.3173.6-93.3000113.1E105 I107 N113E105-F109 WeakPolarHBondContact O-CB 3.44Å; E105-F109 PolarHBondContact O-N 3.37Å; I107-F109 VanDerWaalsContact C-N 3.3Å; I107-F109 PolarHBondContact O-N 2.86Å; F109-N113 PolarHBondContact O-N 2.98Å; F109-N113 VanDerWaalsContact O-N 3.07Å
110L98.5Very high97.9Very high82 Ų8298.6 Ų98.643%0.42948%0.479SS..Hα-helixtrans-71.7-37.3-179.2-71.9175.8000111.9K106 I107 E108 E112 N113 V114K106-L110 HydrophobicContact CD-CD1 4.45Å; K106-L110 HydrophobicContact CD-CG 4.39Å; K106-L110 HydrophobicContact CG-CD1 4.31Å; K106-L110 WeakPolarHBondContact O-CG 3.47Å; K106-L110 PolarHBondContact O-N 3.05Å; K106-L110 VanDerWaalsContact O-N 3.09Å; I107-L110 PolarHBondContact O-N 3.48Å; E108-L110 PolarHBondContact O-N 3.08Å; L110-E112 VanDerWaalsContact C-N 3.33Å; L110-E112 PolarHBondContact O-N 3.28Å; L110-N113 PolarHBondContact O-N 3.25Å; L110-V114 WeakPolarHBondContact O-CG2 3.44Å; L110-V114 PolarHBondContact O-N 3.14Å
111E98.1Very high97.9Very high105 Ų10599 Ų9949%0.49148%0.484SS..Hα-helixtrans-59.9-44.2174.5-73.3-179.8165.100111.3I107 E108 V114 K115I107-E111 HydrophobicContact CG2-CG 4.19Å; I107-E111 WeakPolarHBondContact O-CG 3.31Å; I107-E111 PolarHBondContact O-N 3.4Å; E108-E111 PolarHBondContact O-N 3.19Å; E111-V114 PolarHBondContact O-N 2.98Å; E111-K115 WeakPolarHBondContact O-CG 3.3Å; E111-K115 PolarHBondContact O-N 3.04Å
112E97.8Very high97.9Very high109 Ų109105.8 Ų105.851%0.50950%0.5SS..Hα-helixtrans-65-40.5175.6-167.955.8-14700111.9E108 L110 V114 K115 H116E108-E112 PolarHBondContact O-N 2.96Å; E108-E112 VanDerWaalsContact O-N 3.08Å; L110-E112 VanDerWaalsContact C-N 3.33Å; L110-E112 PolarHBondContact O-N 3.28Å; E112-V114 PolarHBondContact O-N 3.29Å; E112-K115 PolarHBondContact O-N 2.93Å; E112-K115 IonicContact OE2-NZ 3.5Å; E112-H116 PolarHBondContact O-N 3.07Å
113N98.5Very high97.9Very high83 Ų83104.7 Ų104.744%0.44450%0.499SS..Hα-helixtrans-61.8-41.9175.7-173.3-105.5000112.6F109 L110 H116 L117F109-N113 PolarHBondContact O-N 2.98Å; F109-N113 VanDerWaalsContact O-N 3.07Å; L110-N113 PolarHBondContact O-N 3.25Å; N113-H116 PolarHBondContact O-N 2.7Å; N113-L117 WeakPolarHBondContact O-CB 3.35Å; N113-L117 PolarHBondContact O-N 3Å
114V98.3Very high97.9Very high94 Ų94102.7 Ų102.757%0.5750%0.495SS*.Hα-helixtrans-64.6-42.3176170.30000110.8L110 E111 E112 L117 A118L110-V114 WeakPolarHBondContact O-CG2 3.44Å; L110-V114 PolarHBondContact O-N 3.14Å; E111-V114 PolarHBondContact O-N 2.98Å; E112-V114 PolarHBondContact O-N 3.29Å; V114-L117 PolarHBondContact O-N 3.11Å; V114-A118 WeakPolarHBondContact O-CB 3.45Å; V114-A118 PolarHBondContact O-N 3.47Å
115K97.4Very high97.8Very high115 Ų115102 Ų10250%0.549%0.494SS..Hα-helixtrans-59.2-48.3174.5-71.5172.5-165.51650111.5E111 E112 L117 A118 Q119E111-K115 WeakPolarHBondContact O-CG 3.3Å; E111-K115 PolarHBondContact O-N 3.04Å; E112-K115 PolarHBondContact O-N 2.93Å; E112-K115 IonicContact OE2-NZ 3.5Å; K115-L117 PolarHBondContact O-N 3.38Å; K115-A118 PolarHBondContact O-N 3.11Å; K115-Q119 WeakPolarHBondContact O-CG 3.37Å; K115-Q119 PolarHBondContact O-N 2.91Å
116H97.9Very high97.7Very high104 Ų104105.2 Ų105.248%0.48150%0.501SS..Hα-helixtrans-59.8-46.2177178-90.9000111.7E112 N113 A118 Q119 E120E112-H116 PolarHBondContact O-N 3.07Å; N113-H116 PolarHBondContact O-N 2.7Å; H116-A118 VanDerWaalsContact C-N 3.34Å; H116-A118 PolarHBondContact O-N 2.9Å; H116-Q119 PolarHBondContact O-N 3.44Å; H116-E120 PolarHBondContact O-N 2.89Å
117L98.3Very high97.4Very high101 Ų101103.8 Ų103.853%0.52950%0.497SS..Hα-helixtrans-62.7-40.1177.7-175.759.8000112N113 V114 K115 E120 C121N113-L117 WeakPolarHBondContact O-CB 3.35Å; N113-L117 PolarHBondContact O-N 3Å; V114-L117 PolarHBondContact O-N 3.11Å; K115-L117 PolarHBondContact O-N 3.38Å; L117-E120 PolarHBondContact O-N 3.15Å; L117-C121 WeakPolarHBondContact O-CB 3.35Å; L117-C121 PolarHBondContact O-N 3.24Å; L117-C121 PolarHBondContact O-SG 2.92Å
118A97.8Very high97.2Very high41 Ų41104.5 Ų104.534%0.33950%0.501SS..Hα-helixtrans-63.7-40.6176.200000112.3V114 K115 H116 C121 R122V114-A118 WeakPolarHBondContact O-CB 3.45Å; V114-A118 PolarHBondContact O-N 3.47Å; K115-A118 PolarHBondContact O-N 3.11Å; H116-A118 VanDerWaalsContact C-N 3.34Å; H116-A118 PolarHBondContact O-N 2.9Å; A118-C121 PolarHBondContact O-N 2.96Å; A118-R122 WeakPolarHBondContact O-CG 3.47Å; A118-R122 PolarHBondContact O-N 3.26Å
119Q97.3Very high96.8Very high122 Ų122103.7 Ų103.757%0.5750%0.497SS*.Hα-helixtrans-62.7-45.6174.1-71.8176-5.900111.6K115 H116 C121 R122 K123K115-Q119 WeakPolarHBondContact O-CG 3.37Å; K115-Q119 PolarHBondContact O-N 2.91Å; H116-Q119 PolarHBondContact O-N 3.44Å; Q119-C121 PolarHBondContact O-N 2.9Å; Q119-R122 PolarHBondContact O-N 3.38Å; Q119-K123 WeakPolarHBondContact O-CB 3.45Å; Q119-K123 PolarHBondContact O-N 3.48Å
120E97.7Very high96.2Very high56 Ų5699.8 Ų99.826%0.26249%0.488SS..Hα-helixtrans-62.6-39.9177.3-85.9-68.710900112.6H116 L117 K123 K124H116-E120 PolarHBondContact O-N 2.89Å; L117-E120 PolarHBondContact O-N 3.15Å; E120-K123 PolarHBondContact O-N 3.08Å; E120-K123 IonicContact OE1-NZ 3.4Å; E120-K124 WeakPolarHBondContact O-CB 3.47Å; E120-K124 WeakPolarHBondContact O-CG 3.31Å; E120-K124 PolarHBondContact O-N 2.86Å; E120-K124 IonicContact OE2-NZ 2.8Å; E120-K124 PolarHBondContact OE2-NZ 3.45Å
121C97.6Very high95.6Very high68 Ų68103 Ų10346%0.45950%0.496SS..Hα-helixtrans-61.3-48.6172.3-77.30000111.4L117 A118 Q119 K123 K124 T125L117-C121 WeakPolarHBondContact O-CB 3.35Å; L117-C121 PolarHBondContact O-N 3.24Å; L117-C121 PolarHBondContact O-SG 2.92Å; A118-C121 PolarHBondContact O-N 2.96Å; Q119-C121 PolarHBondContact O-N 2.9Å; C121-K123 VanDerWaalsContact C-N 3.33Å; C121-K123 PolarHBondContact O-N 3.42Å; C121-K124 PolarHBondContact O-N 2.91Å; C121-T125 PolarHBondContact O-N 3.04Å; C121-T125 PolarHBondContact O-OG1 3.07Å; C121-T125 VanDerWaalsContact O-OG1 3.09Å
122R96.7Very high94.7Very high187 Ų187101.7 Ų101.771%0.70649%0.491SS*.Hα-helixtrans-59.5-42.2177.4-71.6174.1-171.81743.4112.3A118 Q119 T125 R126A118-R122 WeakPolarHBondContact O-CG 3.47Å; A118-R122 PolarHBondContact O-N 3.26Å; Q119-R122 PolarHBondContact O-N 3.38Å; R122-T125 PolarHBondContact O-N 3.44Å; R122-R126 PolarHBondContact O-N 3.02Å
123K97.7Very high93.7Very high122 Ų122100 Ų10053%0.5349%0.49SS..Hα-helixtrans-61-45.9176.7-175.1179.5176.3-176.50111.2Q119 E120 C121 R126 I127Q119-K123 WeakPolarHBondContact O-CB 3.45Å; Q119-K123 PolarHBondContact O-N 3.48Å; E120-K123 PolarHBondContact O-N 3.08Å; E120-K123 IonicContact OE1-NZ 3.4Å; C121-K123 VanDerWaalsContact C-N 3.33Å; C121-K123 PolarHBondContact O-N 3.42Å; K123-R126 PolarHBondContact O-N 3.32Å; K123-I127 HydrophobicContact CG-CD1 4.3Å; K123-I127 WeakPolarHBondContact O-CG1 3.42Å; K123-I127 PolarHBondContact O-N 3.39Å
124K97.7Very high92.4Very high109 Ų109102 Ų10247%0.47450%0.497SS..Hα-helixtrans-64.5-42.6176.4-72.8172.8-176.7111.60112.1E120 C121 R126 I127 I128E120-K124 WeakPolarHBondContact O-CB 3.47Å; E120-K124 WeakPolarHBondContact O-CG 3.31Å; E120-K124 PolarHBondContact O-N 2.86Å; E120-K124 IonicContact OE2-NZ 2.8Å; E120-K124 PolarHBondContact OE2-NZ 3.45Å; C121-K124 PolarHBondContact O-N 2.91Å; K124-R126 VanDerWaalsContact C-N 3.33Å; K124-R126 PolarHBondContact O-N 2.91Å; K124-I127 PolarHBondContact O-N 3.33Å; K124-I128 WeakPolarHBondContact O-CG1 3.45Å; K124-I128 PolarHBondContact O-N 3.04Å
125T96.7Very high90.7Very high69 Ų69101.6 Ų101.642%0.42350%0.495SS..Hα-helixtrans-57.2-45.6173-600000111.5C121 R122 I127 I128 Q129C121-T125 PolarHBondContact O-N 3.04Å; C121-T125 PolarHBondContact O-OG1 3.07Å; C121-T125 VanDerWaalsContact O-OG1 3.09Å; R122-T125 PolarHBondContact O-N 3.44Å; T125-I127 PolarHBondContact O-N 3.14Å; T125-I128 PolarHBondContact O-N 3.35Å; T125-Q129 HydrophobicContact CG2-CG 4.39Å; T125-Q129 WeakPolarHBondContact O-CB 3.35Å; T125-Q129 VanDerWaalsContact O-CG 3.29Å; T125-Q129 WeakPolarHBondContact O-CG 3.49Å; T125-Q129 PolarHBondContact O-N 2.97Å
126R94.6Very high88.8Confident191 Ų191102.4 Ų102.472%0.72150%0.501SS*.Hα-helixtrans-62.4-40.9178-172.7-180-72.9163.5-4.4112.2R122 K123 K124 A130R122-R126 PolarHBondContact O-N 3.02Å; K123-R126 PolarHBondContact O-N 3.32Å; K124-R126 VanDerWaalsContact C-N 3.33Å; K124-R126 PolarHBondContact O-N 2.91Å; R126-A130 WeakPolarHBondContact O-CB 3.42Å; R126-A130 PolarHBondContact O-N 2.95Å
127I94Very high86.6Confident82 Ų82101 Ų10142%0.42150%0.499SS..Hα-helixtrans-63.3-47.9175.6-68.2165.7000110.4K123 K124 T125 Q129 A130 Y131K123-I127 HydrophobicContact CG-CD1 4.3Å; K123-I127 WeakPolarHBondContact O-CG1 3.42Å; K123-I127 PolarHBondContact O-N 3.39Å; K124-I127 PolarHBondContact O-N 3.33Å; T125-I127 PolarHBondContact O-N 3.14Å; I127-Q129 PolarHBondContact O-N 3.49Å; I127-A130 PolarHBondContact O-N 3.38Å; I127-Y131 HydrophobicContact CG2-CD2 3.65Å; I127-Y131 HydrophobicContact CG2-CE2 3.66Å; I127-Y131 VanDerWaalsContact O-CD2 3.31Å; I127-Y131 WeakPolarHBondContact O-CD2 3.37Å; I127-Y131 PolarHBondContact O-N 3.32Å
128I92.2Very high84.3Confident101 Ų10198.4 Ų98.452%0.51850%0.497SS..Hα-helixtrans-60-46.8178.7-68.4165.8000110.7K124 T125 A130 Y131 I132K124-I128 WeakPolarHBondContact O-CG1 3.45Å; K124-I128 PolarHBondContact O-N 3.04Å; T125-I128 PolarHBondContact O-N 3.35Å; I128-A130 VanDerWaalsContact C-N 3.33Å; I128-A130 PolarHBondContact O-N 2.96Å; I128-Y131 PolarHBondContact O-N 3.46Å; I128-I132 HydrophobicContact CG2-CD1 3.74Å; I128-I132 HydrophobicContact CG2-CG1 4.36Å; I128-I132 WeakPolarHBondContact O-CG1 3.43Å; I128-I132 PolarHBondContact O-N 3.44Å
129Q89.8Confident82.2Confident111 Ų111100.7 Ų100.752%0.51952%0.516SS..Hα-helixtrans-58-45.6175.7-73.8171.8-1500111.6T125 I127 Y131 I132 C133T125-Q129 HydrophobicContact CG2-CG 4.39Å; T125-Q129 WeakPolarHBondContact O-CB 3.35Å; T125-Q129 VanDerWaalsContact O-CG 3.29Å; T125-Q129 WeakPolarHBondContact O-CG 3.49Å; T125-Q129 PolarHBondContact O-N 2.97Å; I127-Q129 PolarHBondContact O-N 3.49Å; Q129-Y131 VanDerWaalsContact C-N 3.31Å; Q129-Y131 PolarHBondContact O-N 3.25Å; Q129-I132 PolarHBondContact O-N 3.1Å; Q129-C133 PolarHBondContact O-N 3.03Å; Q129-C133 PolarHBondContact O-SG 2.93Å
130A85.8Confident80.2Confident43 Ų43100.4 Ų100.436%0.35552%0.522SS..Hα-helixtrans-61.6-38.817700000112.3R126 I127 I128 Q134R126-A130 WeakPolarHBondContact O-CB 3.42Å; R126-A130 PolarHBondContact O-N 2.95Å; I127-A130 PolarHBondContact O-N 3.38Å; I128-A130 VanDerWaalsContact C-N 3.33Å; I128-A130 PolarHBondContact O-N 2.96Å; A130-Q134 VanDerWaalsContact O-CB 3.29Å; A130-Q134 WeakPolarHBondContact O-CB 3.37Å; A130-Q134 VanDerWaalsContact O-CG 3.22Å; A130-Q134 WeakPolarHBondContact O-CG 3.4Å; A130-Q134 PolarHBondContact O-N 3.07Å; A130-Q134 PolarHBondContact O-NE2 3.3Å
131Y85.5Confident78Confident150 Ų15098.5 Ų98.559%0.58852%0.517SS*.Hα-helixtrans-67.3-45.3174.8-89.5-73.8000112.1I127 I128 Q129 C133 Q134 T135I127-Y131 HydrophobicContact CG2-CD2 3.65Å; I127-Y131 HydrophobicContact CG2-CE2 3.66Å; I127-Y131 VanDerWaalsContact O-CD2 3.31Å; I127-Y131 WeakPolarHBondContact O-CD2 3.37Å; I127-Y131 PolarHBondContact O-N 3.32Å; I128-Y131 PolarHBondContact O-N 3.46Å; Q129-Y131 VanDerWaalsContact C-N 3.31Å; Q129-Y131 PolarHBondContact O-N 3.25Å; Y131-C133 PolarHBondContact O-N 3.19Å; Y131-Q134 CarbonylContact O-C 3.54Å; Y131-Q134 PolarHBondContact O-N 3.31Å; Y131-T135 WeakPolarHBondContact O-CB 3.26Å; Y131-T135 WeakPolarHBondContact O-CG2 3.49Å; Y131-T135 PolarHBondContact O-N 3.03Å; Y131-T135 PolarHBondContact O-OG1 3.39Å
132I80.2Confident76.2Confident78 Ų7899.2 Ų99.240%0.452%0.522SS..Hα-helixtrans-58.3-50.6178-67.9166.7000110.1I128 Q129 Q134 T135 E136I128-I132 HydrophobicContact CG2-CD1 3.74Å; I128-I132 HydrophobicContact CG2-CG1 4.36Å; I128-I132 WeakPolarHBondContact O-CG1 3.43Å; I128-I132 PolarHBondContact O-N 3.44Å; Q129-I132 PolarHBondContact O-N 3.1Å; I132-Q134 VanDerWaalsContact C-N 3.31Å; I132-Q134 PolarHBondContact O-N 3.38Å; I132-T135 WeakPolarHBondContact CA-OG1 3.46Å; I132-T135 PolarHBondContact O-N 2.99Å; I132-T135 VanDerWaalsContact O-N 3.14Å; I132-T135 PolarHBondContact O-OG1 3.06Å; I132-E136 HydrophobicContact CG2-CG 4.4Å; I132-E136 WeakPolarHBondContact O-CB 3.46Å; I132-E136 WeakPolarHBondContact O-CG 3.39Å; I132-E136 PolarHBondContact O-N 3.46Å
133C75.3Confident74.4Confident72 Ų7298.2 Ų98.249%0.48653%0.526SS..Hα-helixtrans-60.8-39177.3-63.90000112.3Q129 Y131 T137Q129-C133 PolarHBondContact O-N 3.03Å; Q129-C133 PolarHBondContact O-SG 2.93Å; Y131-C133 PolarHBondContact O-N 3.19Å; C133-T137 WeakPolarHBondContact O-CB 3.34Å; C133-T137 PolarHBondContact O-N 3.21Å; C133-T137 PolarHBondContact O-OG1 2.95Å
134Q71.6Confident72.8Confident126 Ų12699.4 Ų99.459%0.58953%0.528SS*.Hα-helixtrans-69.6-35.2175.3-78.8175.264.400112.9A130 Y131 I132 G138A130-Q134 VanDerWaalsContact O-CB 3.29Å; A130-Q134 WeakPolarHBondContact O-CB 3.37Å; A130-Q134 VanDerWaalsContact O-CG 3.22Å; A130-Q134 WeakPolarHBondContact O-CG 3.4Å; A130-Q134 PolarHBondContact O-N 3.07Å; A130-Q134 PolarHBondContact O-NE2 3.3Å; Y131-Q134 CarbonylContact O-C 3.54Å; Y131-Q134 PolarHBondContact O-N 3.31Å; I132-Q134 VanDerWaalsContact C-N 3.31Å; I132-Q134 PolarHBondContact O-N 3.38Å; Q134-G138 VanDerWaalsContact O-CA 3.27Å; Q134-G138 WeakPolarHBondContact O-CA 3.36Å; Q134-G138 PolarHBondContact O-N 3.47Å
135T63.5Low71.2Confident86 Ų8698 Ų9853%0.52853%0.525SS..Hα-helixtrans-72.1-40.117747.70000111.8Y131 I132 A139Y131-T135 WeakPolarHBondContact O-CB 3.26Å; Y131-T135 WeakPolarHBondContact O-CG2 3.49Å; Y131-T135 PolarHBondContact O-N 3.03Å; Y131-T135 PolarHBondContact O-OG1 3.39Å; I132-T135 WeakPolarHBondContact CA-OG1 3.46Å; I132-T135 PolarHBondContact O-N 2.99Å; I132-T135 VanDerWaalsContact O-N 3.14Å; I132-T135 PolarHBondContact O-OG1 3.06Å; T135-A139 PolarHBondContact O-N 3.49Å
136E56.9Low69.6Low132 Ų13298.2 Ų98.262%0.61753%0.53SS*.Hα-helixtrans-69.4-35.6176.2-69.6177.4173.100111.6I132 T140I132-E136 HydrophobicContact CG2-CG 4.4Å; I132-E136 WeakPolarHBondContact O-CB 3.46Å; I132-E136 WeakPolarHBondContact O-CG 3.39Å; I132-E136 PolarHBondContact O-N 3.46Å; E136-T140 PolarHBondContact O-OG1 2.91Å
137T51.5Low68.4Low74 Ų7492.6 Ų92.645%0.45452%0.519SS..Hα-helixtrans-82-29.9176.6-52.20000112.2C133 A141 S142 L145C133-T137 WeakPolarHBondContact O-CB 3.34Å; C133-T137 PolarHBondContact O-N 3.21Å; C133-T137 PolarHBondContact O-OG1 2.95Å; T137-A141 HydrophobicContact CG2-CB 3.93Å; T137-A141 WeakPolarHBondContact O-CA 3.4Å; T137-A141 WeakPolarHBondContact O-CB 3.43Å; T137-A141 PolarHBondContact O-N 3.5Å; T137-A141 VanDerWaalsContact O-N 3.11Å; T137-S142 PolarHBondContact O-N 2.99Å; T137-L145 HydrophobicContact CG2-CD1 4.09Å
138G50.2Low67.1Low46 Ų4693.2 Ų93.247%0.47452%0.519SS..Hα-helixtrans-80.4-34.9-172.600000114.3Q134Q134-G138 VanDerWaalsContact O-CA 3.27Å; Q134-G138 WeakPolarHBondContact O-CA 3.36Å; Q134-G138 PolarHBondContact O-N 3.47Å
139A53.9Low65.9Low89 Ų8995.7 Ų95.774%0.73653%0.526SS*.Hα-helixtrans-82.4-26.3-174.700000114.2T135T135-A139 PolarHBondContact O-N 3.49Å
140T54.4Low65Low116 Ų11692.6 Ų92.671%0.71252%0.52SS*.Hα-helixtrans-126.5-20.1-176.857.70000113.9E136E136-T140 PolarHBondContact O-OG1 2.91Å
141A52.5Low64.1Low17 Ų1795 Ų9514%0.1452%0.524CS..Hα-helixtrans-100.2-18.2-173.800000113.4T137 E143 Y144 L145T137-A141 HydrophobicContact CG2-CB 3.93Å; T137-A141 WeakPolarHBondContact O-CA 3.4Å; T137-A141 WeakPolarHBondContact O-CB 3.43Å; T137-A141 PolarHBondContact O-N 3.5Å; T137-A141 VanDerWaalsContact O-N 3.11Å; A141-E143 PolarHBondContact O-N 3.36Å; A141-Y144 PolarHBondContact O-N 2.89Å; A141-L145 HydrophobicContact CB-CD1 3.4Å; A141-L145 VanDerWaalsContact CB-CD1 3.4Å; A141-L145 HydrophobicContact CB-CG 3.74Å; A141-L145 WeakPolarHBondContact O-CA 3.34Å; A141-L145 WeakPolarHBondContact O-CB 3.49Å; A141-L145 WeakPolarHBondContact O-CG 3.33Å; A141-L145 PolarHBondContact O-N 3.27Å
142S58.8Low63.2Low83 Ų8392.1 Ų92.158%0.5852%0.517SS*.Hα-helixtrans-59.4-45.9-177-171.10000112.9T137 S146T137-S142 PolarHBondContact O-N 2.99Å; S142-S146 WeakPolarHBondContact O-CB 3.45Å; S142-S146 PolarHBondContact O-N 3.43Å
143E60.3Low62.7Low166 Ų16692.1 Ų92.178%0.77653%0.529SS*.Hα-helixtrans-79.1-38.9-177.9-146.3173-164.600112.3A141 S147A141-E143 PolarHBondContact O-N 3.36Å; E143-S147 VanDerWaalsContact O-CB 3.31Å; E143-S147 WeakPolarHBondContact O-CB 3.49Å; E143-S147 PolarHBondContact O-N 3.29Å; E143-S147 PolarHBondContact O-OG 2.99Å
144Y62.9Low62.3Low146 Ų14697 Ų9757%0.57354%0.542SS*.Hα-helixtrans-69.3-44.6176.7-175.7-96.9000112.5A141 S147 K148A141-Y144 PolarHBondContact O-N 2.89Å; Y144-S147 PolarHBondContact O-N 3.4Å; Y144-K148 HydrophobicContact CD1-CG 4.09Å; Y144-K148 HydrophobicContact CE1-CD 4.5Å; Y144-K148 HydrophobicContact CE1-CG 3.76Å; Y144-K148 VanDerWaalsContact CZ-CE 3.43Å; Y144-K148 VanDerWaalsContact O-CB 3.31Å; Y144-K148 WeakPolarHBondContact O-CB 3.49Å; Y144-K148 VanDerWaalsContact O-CG 3.28Å; Y144-K148 WeakPolarHBondContact O-CG 3.36Å; Y144-K148 PolarHBondContact O-N 2.89Å; Y144-K148 WeakPolarHBondContact OH-CE 3.4Å
145L63.9Low62Low79 Ų7998.2 Ų98.241%0.41454%0.541SS..Hα-helixtrans-71.9-33.2177.7-63.3174.5000111.6T137 A141 K149T137-L145 HydrophobicContact CG2-CD1 4.09Å; A141-L145 HydrophobicContact CB-CD1 3.4Å; A141-L145 VanDerWaalsContact CB-CD1 3.4Å; A141-L145 HydrophobicContact CB-CG 3.74Å; A141-L145 WeakPolarHBondContact O-CA 3.34Å; A141-L145 WeakPolarHBondContact O-CB 3.49Å; A141-L145 WeakPolarHBondContact O-CG 3.33Å; A141-L145 PolarHBondContact O-N 3.27Å; L145-K149 WeakPolarHBondContact O-CB 3.28Å; L145-K149 VanDerWaalsContact O-CG 3.3Å; L145-K149 WeakPolarHBondContact O-CG 3.37Å; L145-K149 PolarHBondContact O-N 3.37Å
146S63.8Low61.8Low75 Ų7596.9 Ų96.952%0.52454%0.544SS..Hα-helixtrans-64.9-46.6171.6-173.90000110.9S142 K148 K149 A150S142-S146 WeakPolarHBondContact O-CB 3.45Å; S142-S146 PolarHBondContact O-N 3.43Å; S146-K148 PolarHBondContact O-N 3Å; S146-K149 PolarHBondContact O-N 2.79Å; S146-A150 WeakPolarHBondContact O-CB 3.47Å; S146-A150 PolarHBondContact O-N 3.33Å
147S69.3Low62.1Low72 Ų7296 Ų9650%0.50354%0.535SS..Hα-helixtrans-61.3-42.7174.7-61.80000112.3E143 Y144 A150 E151E143-S147 VanDerWaalsContact O-CB 3.31Å; E143-S147 WeakPolarHBondContact O-CB 3.49Å; E143-S147 PolarHBondContact O-N 3.29Å; E143-S147 PolarHBondContact O-OG 2.99Å; Y144-S147 PolarHBondContact O-N 3.4Å; S147-A150 PolarHBondContact O-N 3.28Å; S147-E151 WeakPolarHBondContact O-CB 3.34Å; S147-E151 PolarHBondContact O-N 3.23Å
148K65.9Low62.9Low96 Ų9696.5 Ų96.542%0.41754%0.538SS..Hα-helixtrans-68.8-38.5175.8-75.9-72.2-172.5-179.70112.7Y144 S146 A150 E151 I152Y144-K148 HydrophobicContact CD1-CG 4.09Å; Y144-K148 HydrophobicContact CE1-CD 4.5Å; Y144-K148 HydrophobicContact CE1-CG 3.76Å; Y144-K148 VanDerWaalsContact CZ-CE 3.43Å; Y144-K148 VanDerWaalsContact O-CB 3.31Å; Y144-K148 WeakPolarHBondContact O-CB 3.49Å; Y144-K148 VanDerWaalsContact O-CG 3.28Å; Y144-K148 WeakPolarHBondContact O-CG 3.36Å; Y144-K148 PolarHBondContact O-N 2.89Å; Y144-K148 WeakPolarHBondContact OH-CE 3.4Å; S146-K148 PolarHBondContact O-N 3Å; K148-A150 VanDerWaalsContact C-N 3.34Å; K148-E151 WeakPolarHBondContact O-CB 3.34Å; K148-E151 PolarHBondContact O-N 3.01Å; K148-I152 WeakPolarHBondContact O-CB 3.49Å; K148-I152 WeakPolarHBondContact O-CD1 3.42Å; K148-I152 WeakPolarHBondContact O-CG1 3.5Å; K148-I152 PolarHBondContact O-N 2.93Å
149K68.5Low63.7Low153 Ų153100.1 Ų100.167%0.66555%0.546SS*.Hα-helixtrans-62.4-42.1172.7-85.5171.7174.5-86.90111L145 S146 I152 A153L145-K149 WeakPolarHBondContact O-CB 3.28Å; L145-K149 VanDerWaalsContact O-CG 3.3Å; L145-K149 WeakPolarHBondContact O-CG 3.37Å; L145-K149 PolarHBondContact O-N 3.37Å; S146-K149 PolarHBondContact O-N 2.79Å; K149-I152 PolarHBondContact O-N 3.21Å; K149-A153 WeakPolarHBondContact O-CB 3.29Å; K149-A153 PolarHBondContact O-N 3.17Å
150A69.6Low64.2Low46 Ų46101.3 Ų101.338%0.3854%0.538SS..Hα-helixtrans-64.7-41.7175.100000112S146 S147 K148 A153 K154S146-A150 WeakPolarHBondContact O-CB 3.47Å; S146-A150 PolarHBondContact O-N 3.33Å; S147-A150 PolarHBondContact O-N 3.28Å; K148-A150 VanDerWaalsContact C-N 3.34Å; A150-A153 PolarHBondContact O-N 3.48Å; A150-K154 WeakPolarHBondContact O-CB 3.4Å; A150-K154 VanDerWaalsContact O-CG 3.26Å; A150-K154 WeakPolarHBondContact O-CG 3.33Å; A150-K154 PolarHBondContact O-N 2.94Å
151E68.2Low64.8Low94 Ų9498.3 Ų98.344%0.43952%0.521SS..Hα-helixtrans-60.1-46.2171.8-89.1-81.8132.300112.5S147 K148 K154 R155S147-E151 WeakPolarHBondContact O-CB 3.34Å; S147-E151 PolarHBondContact O-N 3.23Å; K148-E151 WeakPolarHBondContact O-CB 3.34Å; K148-E151 PolarHBondContact O-N 3.01Å; E151-K154 PolarHBondContact O-N 3.42Å; E151-R155 PolarHBondContact O-N 3.27Å; E151-R155 IonicContact OE2-NH1 2.79Å
152I66Low65.4Low89 Ų89100.6 Ų100.646%0.45653%0.532SS..Hα-helixtrans-63.8-42.9178.9-70.1164.4000110.6K148 K149 R155 G156 R157K148-I152 WeakPolarHBondContact O-CB 3.49Å; K148-I152 WeakPolarHBondContact O-CD1 3.42Å; K148-I152 WeakPolarHBondContact O-CG1 3.5Å; K148-I152 PolarHBondContact O-N 2.93Å; K149-I152 PolarHBondContact O-N 3.21Å; I152-R155 PolarHBondContact O-N 3.47Å; I152-G156 PolarHBondContact O-N 2.94Å; I152-R157 WeakPolarHBondContact CG2-O 3.43Å; I152-R157 PolarHBondContact O-N 3.05Å
153A68.8Low65.5Low77 Ų7797.9 Ų97.964%0.63651%0.51SS*.Hα-helixtrans-63.3-44.7175.100000111.9K149 A150 R155 G156K149-A153 WeakPolarHBondContact O-CB 3.29Å; K149-A153 PolarHBondContact O-N 3.17Å; A150-A153 PolarHBondContact O-N 3.48Å; A153-R155 VanDerWaalsContact C-N 3.27Å; A153-R155 PolarHBondContact O-N 3.09Å; A153-G156 PolarHBondContact O-N 2.99Å; A153-G156 VanDerWaalsContact O-N 3.15Å
154K67Low65.9Low176 Ų17697.8 Ų97.877%0.76551%0.508SS*.Hα-helixtrans-61.5-33.6176.2-78.9176.5-178.9-178.50113A150 E151 G156A150-K154 WeakPolarHBondContact O-CB 3.4Å; A150-K154 VanDerWaalsContact O-CG 3.26Å; A150-K154 WeakPolarHBondContact O-CG 3.33Å; A150-K154 PolarHBondContact O-N 2.94Å; E151-K154 PolarHBondContact O-N 3.42Å; K154-G156 PolarHBondContact O-N 3.44Å
155R65.1Low65.9Low150 Ų15092.6 Ų92.657%0.56650%0.499SS*.THydrogen-bonded Turntrans-79.2-5.5179.6-128.9134.5-179.4151.32.5113.7E151 I152 A153 R157E151-R155 PolarHBondContact O-N 3.27Å; E151-R155 IonicContact OE2-NH1 2.79Å; I152-R155 PolarHBondContact O-N 3.47Å; A153-R155 VanDerWaalsContact C-N 3.27Å; A153-R155 PolarHBondContact O-N 3.09Å; R155-R157 HydrophobicContact CB-CB 4.48Å; R155-R157 HydrophobicContact CB-CG 4.26Å; R155-R157 VanDerWaalsContact CD-NH2 3.25Å; R155-R157 VanDerWaalsContact NE-NH2 3.15Å; R155-R157 WeakPolarHBondContact O-CG 3.4Å; R155-R157 PolarHBondContact O-N 2.91Å; R155-R157 VanDerWaalsContact O-N 3.08Å
156G60.4Low65.5Low58 Ų5894.7 Ų94.760%0.59852%0.52SS*.THydrogen-bonded Turntrans63.98.9-175.600000113.9I152 A153 K154 T158I152-G156 PolarHBondContact O-N 2.94Å; A153-G156 PolarHBondContact O-N 2.99Å; A153-G156 VanDerWaalsContact O-N 3.15Å; K154-G156 PolarHBondContact O-N 3.44Å; G156-T158 PolarHBondContact O-N 3.26Å
157R63.9Low65.2Low114 Ų11493.3 Ų93.343%0.4352%0.518SS..  trans-92.891.1-173.9-67.1-165.1-70-145.85.5109.4I152 R155 N162I152-R157 WeakPolarHBondContact CG2-O 3.43Å; I152-R157 PolarHBondContact O-N 3.05Å; R155-R157 HydrophobicContact CB-CB 4.48Å; R155-R157 HydrophobicContact CB-CG 4.26Å; R155-R157 VanDerWaalsContact CD-NH2 3.25Å; R155-R157 VanDerWaalsContact NE-NH2 3.15Å; R155-R157 WeakPolarHBondContact O-CG 3.4Å; R155-R157 PolarHBondContact O-N 2.91Å; R155-R157 VanDerWaalsContact O-N 3.08Å; R157-N162 WeakPolarHBondContact CD-OD1 3.37Å
158T68.1Low64.4Low85 Ų8596.1 Ų96.152%0.52153%0.526SS..  trans-61.1159.8167.162.90000110.1G156 M160 S161 N162G156-T158 PolarHBondContact O-N 3.26Å; T158-M160 PolarHBondContact O-N 2.96Å; T158-M160 VanDerWaalsContact O-N 3.17Å; T158-S161 WeakPolarHBondContact O-CB 3.33Å; T158-S161 PolarHBondContact O-N 3.39Å; T158-S161 WeakPolarHBondContact OG1-CB 3.36Å; T158-S161 PolarHBondContact OG1-N 3.44Å; T158-S161 VanDerWaalsContact OG1-N 3.14Å; T158-N162 PolarHBondContact O-N 3.48Å; T158-N162 VanDerWaalsContact O-N 3.14Å; T158-N162 PolarHBondContact O-ND2 3.25Å
159L65.4Low64.1Low122 Ų12296.3 Ų96.364%0.63954%0.54SS*.Hα-helixtrans-54.1-36.6176.1-163.674000111.2N162 L163L159-N162 PolarHBondContact O-N 3.47Å; L159-L163 PolarHBondContact O-N 3.02Å
160M66Low63.7Low114 Ų11492.9 Ų92.956%0.56253%0.529SS*.Hα-helixtrans-68.5-40.2174-69.5-154.6-71.800113.2T158 N162 L163 F164T158-M160 PolarHBondContact O-N 2.96Å; T158-M160 VanDerWaalsContact O-N 3.17Å; M160-N162 VanDerWaalsContact C-N 3.26Å; M160-N162 PolarHBondContact O-N 2.99Å; M160-L163 PolarHBondContact O-N 3.41Å; M160-L163 VanDerWaalsContact O-N 3.07Å; M160-F164 HydrophobicContact CB-CD2 4.17Å; M160-F164 HydrophobicContact CB-CE2 4.34Å; M160-F164 HydrophobicContact CG-CE2 4.45Å; M160-F164 VanDerWaalsContact O-CD2 3.27Å; M160-F164 WeakPolarHBondContact O-CD2 3.31Å; M160-F164 PolarHBondContact O-N 2.91Å; M160-F164 HydrophobicContact SD-CE2 4.34Å
161S66.5Low63.4Low52 Ų5297.5 Ų97.536%0.36454%0.54SS..Hα-helixtrans-62-32.9177.1171.50000112.5T158 G165T158-S161 WeakPolarHBondContact O-CB 3.33Å; T158-S161 PolarHBondContact O-N 3.39Å; T158-S161 WeakPolarHBondContact OG1-CB 3.36Å; T158-S161 PolarHBondContact OG1-N 3.44Å; T158-S161 VanDerWaalsContact OG1-N 3.14Å; S161-G165 WeakPolarHBondContact O-CA 3.37Å; S161-G165 PolarHBondContact O-N 3.34Å
162N64.5Low63.2Low66 Ų66101.1 Ų101.135%0.35356%0.557SS.*Hα-helixtrans-75.1-27.1174.3-66.6-50.8000113.1R157 T158 L159 M160R157-N162 WeakPolarHBondContact CD-OD1 3.37Å; T158-N162 PolarHBondContact O-N 3.48Å; T158-N162 VanDerWaalsContact O-N 3.14Å; T158-N162 PolarHBondContact O-ND2 3.25Å; L159-N162 PolarHBondContact O-N 3.47Å; M160-N162 VanDerWaalsContact C-N 3.26Å; M160-N162 PolarHBondContact O-N 2.99Å
163L62.1Low63.3Low26 Ų26102.1 Ų102.114%0.13656%0.562CS.*Hα-helixtrans-82-41.9-178.1-143.377.4000112.4L159 M160 L177 A178 M181L159-L163 PolarHBondContact O-N 3.02Å; M160-L163 PolarHBondContact O-N 3.41Å; M160-L163 VanDerWaalsContact O-N 3.07Å; L163-L177 HydrophobicContact CD1-CB 4.12Å; L163-L177 HydrophobicContact CD1-CD2 3.46Å; L163-L177 VanDerWaalsContact CD1-CD2 3.46Å; L163-L177 HydrophobicContact CD1-CG 3.67Å; L163-A178 HydrophobicContact CD2-CB 4.14Å; L163-A178 HydrophobicContact CG-CB 4.38Å; L163-M181 HydrophobicContact CD1-SD 4.47Å; L163-M181 HydrophobicContact CD2-CE 3.98Å; L163-M181 HydrophobicContact CD2-SD 3.41Å; L163-M181 WeakPolarHBondContact CD2-SD 3.25Å
164F67.9Low63.5Low164 Ų164100.3 Ų100.372%0.71954%0.542SS*.Hα-helixtrans-95.3-11.4178.5-62.2-70.1000113.1M160M160-F164 HydrophobicContact CB-CD2 4.17Å; M160-F164 HydrophobicContact CB-CE2 4.34Å; M160-F164 HydrophobicContact CG-CE2 4.45Å; M160-F164 VanDerWaalsContact O-CD2 3.27Å; M160-F164 WeakPolarHBondContact O-CD2 3.31Å; M160-F164 PolarHBondContact O-N 2.91Å; M160-F164 HydrophobicContact SD-CE2 4.34Å
165G63.6Low64.2Low37 Ų3796.9 Ų96.938%0.38153%0.531SS..SBendtrans-73.8126.4178.300000111.7S161 G167S161-G165 WeakPolarHBondContact O-CA 3.37Å; S161-G165 PolarHBondContact O-N 3.34Å; G165-G167 PolarHBondContact O-N 3.47Å
166S54.8Low65Low122 Ų12296.6 Ų96.685%0.85354%0.536SS*.  trans-68.563.3178.6177.30000113.1
167G57.4Low66.1Low47 Ų4796.8 Ų96.849%0.48552%0.523SS..  trans-111.8104175.100000111.5G165 S169G165-G167 PolarHBondContact O-N 3.47Å; G167-S169 VanDerWaalsContact C-N 3.27Å; G167-S169 PolarHBondContact O-N 3.02Å
168L52.7Low66.9Low130 Ų13092.7 Ų92.768%0.68151%0.514SS*.THydrogen-bonded Turntrans-68.612.9-160.6-64.3166.9000118
169S58.9Low67.9Low101 Ų10193.5 Ų93.571%0.70652%0.515SS*.THydrogen-bonded Turntrans-96.5-19.8-170.969.10000116.2G167G167-S169 VanDerWaalsContact C-N 3.27Å; G167-S169 PolarHBondContact O-N 3.02Å
170N60.6Low69Low81 Ų8192.1 Ų92.143%0.43351%0.505SS..  trans-130.537.7-173.4-68.7-27.4000112.6E172 I173 N174N170-E172 VanDerWaalsContact C-N 3.32Å; N170-E172 PolarHBondContact O-N 3.22Å; N170-I173 HydrophobicContact CB-CB 4.45Å; N170-I173 PolarHBondContact O-N 3.43Å; N170-N174 WeakPolarHBondContact O-CB 3.44Å; N170-N174 VanDerWaalsContact O-CG 3.27Å; N170-N174 PolarHBondContact O-N 2.9Å
171K63.8Low70.1Confident142 Ų14288.3 Ų88.362%0.61749%0.486SS*.Hα-helixtrans-55.3-42.7-172.2-71.3-175179-179.90113.6L175K171-L175 VanDerWaalsContact O-CB 3.31Å; K171-L175 WeakPolarHBondContact O-CB 3.32Å; K171-L175 PolarHBondContact O-N 3.38Å
172E64.5Low71.2Confident170 Ų17092 Ų9279%0.79450%0.499SS*.Hα-helixtrans-69.4-47.5-179.7-69.9178.8173.300112N170 N174 L175 E176N170-E172 VanDerWaalsContact C-N 3.32Å; N170-E172 PolarHBondContact O-N 3.22Å; E172-N174 VanDerWaalsContact C-N 3.32Å; E172-N174 PolarHBondContact O-N 3.25Å; E172-L175 PolarHBondContact O-N 3.49Å; E172-E176 PolarHBondContact O-N 2.73Å
173I67.4Low72.7Confident110 Ų11097.9 Ų97.956%0.56452%0.516SS*.Hα-helixtrans-64-38.7177.2-59.4171.1000110.9N170 L177N170-I173 HydrophobicContact CB-CB 4.45Å; N170-I173 PolarHBondContact O-N 3.43Å; I173-L177 WeakPolarHBondContact O-CB 3.36Å; I173-L177 PolarHBondContact O-N 3.42Å; I173-L177 VanDerWaalsContact O-N 3.09Å
174N73.1Confident74.3Confident39 Ų39102.1 Ų102.121%0.20953%0.534CS..Hα-helixtrans-67.8-35176-77-13.6000111.9N170 E172 A178N170-N174 WeakPolarHBondContact O-CB 3.44Å; N170-N174 VanDerWaalsContact O-CG 3.27Å; N170-N174 PolarHBondContact O-N 2.9Å; E172-N174 VanDerWaalsContact C-N 3.32Å; E172-N174 PolarHBondContact O-N 3.25Å; N174-A178 WeakPolarHBondContact O-CB 3.22Å; N174-A178 PolarHBondContact O-N 2.96Å
175L82.1Confident75.6Confident104 Ų10499.8 Ų99.855%0.54552%0.524SS..Hα-helixtrans-68.3-47.3176.5179.165.3000111.3K171 E172 L177 A178 L179K171-L175 VanDerWaalsContact O-CB 3.31Å; K171-L175 WeakPolarHBondContact O-CB 3.32Å; K171-L175 PolarHBondContact O-N 3.38Å; E172-L175 PolarHBondContact O-N 3.49Å; L175-L177 VanDerWaalsContact C-N 3.33Å; L175-L177 PolarHBondContact O-N 3.32Å; L175-A178 PolarHBondContact O-N 3.41Å; L175-L179 HydrophobicContact CD1-CD1 4.44Å; L175-L179 HydrophobicContact CD1-CG 4.31Å; L175-L179 HydrophobicContact CG-CD1 4.2Å; L175-L179 HydrophobicContact CG-CG 4.47Å; L175-L179 WeakPolarHBondContact O-CB 3.45Å; L175-L179 WeakPolarHBondContact O-CG 3.29Å; L175-L179 PolarHBondContact O-N 3.5Å
176E82.6Confident77.2Confident144 Ų144103.4 Ų103.467%0.67353%0.53SS*.Hα-helixtrans-59-45.8177.2-173.5175.4-169.300111.1E172 A178 L179 E180E172-E176 PolarHBondContact O-N 2.73Å; E176-A178 PolarHBondContact O-N 2.86Å; E176-L179 PolarHBondContact O-N 3.29Å; E176-E180 PolarHBondContact O-N 2.94Å
177L81.6Confident79.2Confident62 Ų62101.7 Ų101.733%0.32552%0.515SS..Hα-helixtrans-63.1-40.6175.3-179.459.8000112.2L163 I173 L175 E180 M181L163-L177 HydrophobicContact CD1-CB 4.12Å; L163-L177 HydrophobicContact CD1-CD2 3.46Å; L163-L177 VanDerWaalsContact CD1-CD2 3.46Å; L163-L177 HydrophobicContact CD1-CG 3.67Å; I173-L177 WeakPolarHBondContact O-CB 3.36Å; I173-L177 PolarHBondContact O-N 3.42Å; I173-L177 VanDerWaalsContact O-N 3.09Å; L175-L177 VanDerWaalsContact C-N 3.33Å; L175-L177 PolarHBondContact O-N 3.32Å; L177-E180 PolarHBondContact O-N 3.01Å; L177-M181 HydrophobicContact CD1-CG 4.42Å; L177-M181 HydrophobicContact CG-SD 4.37Å; L177-M181 WeakPolarHBondContact O-CB 3.5Å; L177-M181 WeakPolarHBondContact O-CG 3.39Å; L177-M181 PolarHBondContact O-N 2.64Å
178A81.3Confident81.1Confident28 Ų28103.5 Ų103.523%0.23152%0.516CS..Hα-helixtrans-63.9-42.717600000112L163 N174 L175 E176 M181 M182L163-A178 HydrophobicContact CD2-CB 4.14Å; L163-A178 HydrophobicContact CG-CB 4.38Å; N174-A178 WeakPolarHBondContact O-CB 3.22Å; N174-A178 PolarHBondContact O-N 2.96Å; L175-A178 PolarHBondContact O-N 3.41Å; E176-A178 PolarHBondContact O-N 2.86Å; A178-M181 PolarHBondContact O-N 3.46Å; A178-M182 WeakPolarHBondContact O-CB 3.35Å; A178-M182 WeakPolarHBondContact O-CG 3.46Å; A178-M182 PolarHBondContact O-N 3.03Å
179L89.4Confident83.3Confident103 Ų103102.5 Ų102.554%0.53951%0.511SS..Hα-helixtrans-63.7-41.5175.5-71.4175000111.5L175 E176 M182 R183L175-L179 HydrophobicContact CD1-CD1 4.44Å; L175-L179 HydrophobicContact CD1-CG 4.31Å; L175-L179 HydrophobicContact CG-CD1 4.2Å; L175-L179 HydrophobicContact CG-CG 4.47Å; L175-L179 WeakPolarHBondContact O-CB 3.45Å; L175-L179 WeakPolarHBondContact O-CG 3.29Å; L175-L179 PolarHBondContact O-N 3.5Å; E176-L179 PolarHBondContact O-N 3.29Å; L179-M182 PolarHBondContact O-N 2.95Å; L179-R183 WeakPolarHBondContact O-CB 3.26Å; L179-R183 PolarHBondContact O-N 3.43Å
180E88.9Confident85.2Confident93 Ų93102.8 Ų102.844%0.43550%0.501SS..Hα-helixtrans-63.9-42.6175.4-166.6-174.7173.900111.5E176 L177 R183 K184E176-E180 PolarHBondContact O-N 2.94Å; L177-E180 PolarHBondContact O-N 3.01Å; E180-R183 PolarHBondContact O-N 3.38Å; E180-K184 HydrophobicContact CG-CD 4.44Å; E180-K184 WeakPolarHBondContact O-CG 3.29Å; E180-K184 PolarHBondContact O-N 3.3Å; E180-K184 WeakPolarHBondContact OE1-CE 3.32Å; E180-K184 IonicContact OE1-NZ 3.98Å; E180-K184 PolarHBondContact OE1-NZ 3.47Å
181M87.6Confident86.9Confident34 Ų34102.3 Ų102.317%0.16750%0.498CS..Hα-helixtrans-63.9-43.8175.8-75.8-17859.100112L163 L177 A178 R183 K184 F185L163-M181 HydrophobicContact CD1-SD 4.47Å; L163-M181 HydrophobicContact CD2-CE 3.98Å; L163-M181 HydrophobicContact CD2-SD 3.41Å; L163-M181 WeakPolarHBondContact CD2-SD 3.25Å; L177-M181 HydrophobicContact CD1-CG 4.42Å; L177-M181 HydrophobicContact CG-SD 4.37Å; L177-M181 WeakPolarHBondContact O-CB 3.5Å; L177-M181 WeakPolarHBondContact O-CG 3.39Å; L177-M181 PolarHBondContact O-N 2.64Å; A178-M181 PolarHBondContact O-N 3.46Å; M181-R183 VanDerWaalsContact C-N 3.32Å; M181-R183 PolarHBondContact O-N 3.25Å; M181-K184 PolarHBondContact O-N 2.93Å; M181-F185 HydrophobicContact CB-CE2 4.33Å; M181-F185 HydrophobicContact CE-CE2 3.98Å; M181-F185 HydrophobicContact CE-CZ 3.99Å; M181-F185 WeakPolarHBondContact O-CB 3.39Å; M181-F185 VanDerWaalsContact O-CD2 3.26Å; M181-F185 WeakPolarHBondContact O-CD2 3.18Å; M181-F185 VanDerWaalsContact O-CG 3.32Å; M181-F185 WeakPolarHBondContact O-CG 3.16Å; M181-F185 PolarHBondContact O-N 2.91Å
182M91.3Very high88.6Confident129 Ų12998.4 Ų98.464%0.63549%0.487SS*.Hα-helixtrans-58.9-44.8174.7-76.6-177.965.100111.4A178 L179 K184 F185 Q186A178-M182 WeakPolarHBondContact O-CB 3.35Å; A178-M182 WeakPolarHBondContact O-CG 3.46Å; A178-M182 PolarHBondContact O-N 3.03Å; L179-M182 PolarHBondContact O-N 2.95Å; M182-K184 PolarHBondContact O-N 3.31Å; M182-F185 PolarHBondContact O-N 2.94Å; M182-Q186 WeakPolarHBondContact O-CB 3.27Å; M182-Q186 PolarHBondContact O-N 3.09Å
183R95.1Very high90.2Very high190 Ų19096 Ų9672%0.71748%0.479SS*.Hα-helixtrans-61.3-44.6176.2-175.3-178.8176.1133.12.3111.8L179 E180 M181 Q186 V187L179-R183 WeakPolarHBondContact O-CB 3.26Å; L179-R183 PolarHBondContact O-N 3.43Å; E180-R183 PolarHBondContact O-N 3.38Å; M181-R183 VanDerWaalsContact C-N 3.32Å; M181-R183 PolarHBondContact O-N 3.25Å; R183-Q186 PolarHBondContact O-N 2.86Å; R183-V187 WeakPolarHBondContact O-CG2 3.42Å; R183-V187 PolarHBondContact O-N 3.24Å; R183-V187 VanDerWaalsContact O-N 3.08Å
184K95.6Very high91.7Very high114 Ų11495.6 Ų95.650%0.49648%0.477SS..Hα-helixtrans-64.5-41.8177.1-74.5175.6-177166.90111.7E180 M181 M182 V187 V188E180-K184 HydrophobicContact CG-CD 4.44Å; E180-K184 WeakPolarHBondContact O-CG 3.29Å; E180-K184 PolarHBondContact O-N 3.3Å; E180-K184 WeakPolarHBondContact OE1-CE 3.32Å; E180-K184 IonicContact OE1-NZ 3.98Å; E180-K184 PolarHBondContact OE1-NZ 3.47Å; M181-K184 PolarHBondContact O-N 2.93Å; M182-K184 PolarHBondContact O-N 3.31Å; K184-V187 PolarHBondContact O-N 2.85Å; K184-V188 WeakPolarHBondContact O-CG2 3.32Å; K184-V188 PolarHBondContact O-N 3.41Å
185F96.5Very high92.9Very high116 Ų11699.5 Ų99.551%0.50949%0.492SS..Hα-helixtrans-63.9-41.3175.1-70.5-37.3000112.1M181 M182 V187 V188 L189M181-F185 HydrophobicContact CB-CE2 4.33Å; M181-F185 HydrophobicContact CE-CE2 3.98Å; M181-F185 HydrophobicContact CE-CZ 3.99Å; M181-F185 WeakPolarHBondContact O-CB 3.39Å; M181-F185 VanDerWaalsContact O-CD2 3.26Å; M181-F185 WeakPolarHBondContact O-CD2 3.18Å; M181-F185 VanDerWaalsContact O-CG 3.32Å; M181-F185 WeakPolarHBondContact O-CG 3.16Å; M181-F185 PolarHBondContact O-N 2.91Å; M182-F185 PolarHBondContact O-N 2.94Å; F185-V187 PolarHBondContact O-N 2.9Å; F185-V188 PolarHBondContact O-N 2.87Å; F185-L189 WeakPolarHBondContact O-CB 3.33Å; F185-L189 VanDerWaalsContact O-CG 3.25Å; F185-L189 WeakPolarHBondContact O-CG 3.47Å; F185-L189 PolarHBondContact O-N 3.04Å
186Q97Very high93.6Very high112 Ų11298.8 Ų98.852%0.52349%0.489SS..Hα-helixtrans-57.9-48174.7179.8174.4-10.600111.4M182 R183 V188 L189 E190M182-Q186 WeakPolarHBondContact O-CB 3.27Å; M182-Q186 PolarHBondContact O-N 3.09Å; R183-Q186 PolarHBondContact O-N 2.86Å; Q186-V188 VanDerWaalsContact C-N 3.35Å; Q186-V188 PolarHBondContact O-N 3.48Å; Q186-L189 PolarHBondContact O-N 3.25Å; Q186-E190 HydrophobicContact CG-CG 4.39Å; Q186-E190 VanDerWaalsContact CG-OE1 3.26Å; Q186-E190 WeakPolarHBondContact CG-OE1 3.48Å; Q186-E190 PolarHBondContact NE2-OE1 2.76Å; Q186-E190 WeakPolarHBondContact O-CB 3.48Å; Q186-E190 WeakPolarHBondContact O-CG 3.39Å; Q186-E190 PolarHBondContact O-N 3.43Å
187V96.8Very high94.3Very high86 Ų8697.1 Ų97.152%0.52148%0.484SS..Hα-helixtrans-60-43.2177.2172.80000112R183 K184 F185 E190 D191R183-V187 WeakPolarHBondContact O-CG2 3.42Å; R183-V187 PolarHBondContact O-N 3.24Å; R183-V187 VanDerWaalsContact O-N 3.08Å; K184-V187 PolarHBondContact O-N 2.85Å; F185-V187 PolarHBondContact O-N 2.9Å; V187-E190 PolarHBondContact O-N 3.21Å; V187-D191 WeakPolarHBondContact O-CB 3.45Å; V187-D191 PolarHBondContact O-N 3.19Å
188V97.6Very high95.1Very high86 Ų8697.9 Ų97.952%0.52149%0.488SS..Hα-helixtrans-66.7-38.4178.5171.20000111.6K184 F185 Q186 T192K184-V188 WeakPolarHBondContact O-CG2 3.32Å; K184-V188 PolarHBondContact O-N 3.41Å; F185-V188 PolarHBondContact O-N 2.87Å; Q186-V188 VanDerWaalsContact C-N 3.35Å; Q186-V188 PolarHBondContact O-N 3.48Å; V188-T192 WeakPolarHBondContact O-CB 3.42Å; V188-T192 PolarHBondContact O-N 3.48Å; V188-T192 PolarHBondContact O-OG1 3.18Å
189L98.2Very high95.9Very high109 Ų109101.5 Ų101.557%0.57150%0.503SS*.Hα-helixtrans-68.1-43.9176.8-73.5171.7000111.4F185 Q186 T192 L193F185-L189 WeakPolarHBondContact O-CB 3.33Å; F185-L189 VanDerWaalsContact O-CG 3.25Å; F185-L189 WeakPolarHBondContact O-CG 3.47Å; F185-L189 PolarHBondContact O-N 3.04Å; Q186-L189 PolarHBondContact O-N 3.25Å; L189-T192 PolarHBondContact O-N 2.99Å; L189-L193 WeakPolarHBondContact O-CB 3.39Å; L189-L193 VanDerWaalsContact O-CG 3.29Å; L189-L193 WeakPolarHBondContact O-CG 3.33Å; L189-L193 PolarHBondContact O-N 3Å
190E98Very high96.4Very high107 Ų107102.9 Ų102.950%0.550%0.504SS..Hα-helixtrans-59.3-46.7175.4-74.5172.9-171.400111.3Q186 V187 T192 L193 L194Q186-E190 HydrophobicContact CG-CG 4.39Å; Q186-E190 VanDerWaalsContact CG-OE1 3.26Å; Q186-E190 WeakPolarHBondContact CG-OE1 3.48Å; Q186-E190 PolarHBondContact NE2-OE1 2.76Å; Q186-E190 WeakPolarHBondContact O-CB 3.48Å; Q186-E190 WeakPolarHBondContact O-CG 3.39Å; Q186-E190 PolarHBondContact O-N 3.43Å; V187-E190 PolarHBondContact O-N 3.21Å; E190-T192 PolarHBondContact O-N 3.4Å; E190-L193 PolarHBondContact O-N 3.29Å; E190-L194 WeakPolarHBondContact O-CB 3.26Å; E190-L194 PolarHBondContact O-N 2.98Å
191D97.7Very high96.8Very high70 Ų70103.9 Ų103.937%0.37451%0.509SS..Hα-helixtrans-62.7-41.8175.7175.368.8000112.4V187 L194 K195V187-D191 WeakPolarHBondContact O-CB 3.45Å; V187-D191 PolarHBondContact O-N 3.19Å; D191-L194 PolarHBondContact O-N 3.46Å; D191-K195 WeakPolarHBondContact O-CG 3.42Å; D191-K195 PolarHBondContact O-N 3.26Å; D191-K195 WeakPolarHBondContact OD1-CE 3.21Å; D191-K195 IonicContact OD1-NZ 3.68Å; D191-K195 VanDerWaalsContact OD2-CE 3.28Å; D191-K195 WeakPolarHBondContact OD2-CE 3.3Å; D191-K195 IonicContact OD2-NZ 3.54Å; D191-K195 PolarHBondContact OD2-NZ 3.37Å
192T98Very high97.3Very high61 Ų61106.8 Ų106.837%0.37453%0.525SS..Hα-helixtrans-65.8-43.3177.8-58.30000111.6V188 L189 E190 K195 N196V188-T192 WeakPolarHBondContact O-CB 3.42Å; V188-T192 PolarHBondContact O-N 3.48Å; V188-T192 PolarHBondContact O-OG1 3.18Å; L189-T192 PolarHBondContact O-N 2.99Å; E190-T192 PolarHBondContact O-N 3.4Å; T192-K195 PolarHBondContact O-N 2.86Å; T192-N196 WeakPolarHBondContact O-CB 3.06Å; T192-N196 VanDerWaalsContact O-CG 3.27Å; T192-N196 PolarHBondContact O-N 2.86Å; T192-N196 PolarHBondContact O-ND2 3.37Å
193L98.4Very high97.6Very high119 Ų119105.1 Ų105.162%0.62352%0.522SS*.Hα-helixtrans-64.4-40.6177.1-73.6175.3000111.5L189 E190 N196 L197L189-L193 WeakPolarHBondContact O-CB 3.39Å; L189-L193 VanDerWaalsContact O-CG 3.29Å; L189-L193 WeakPolarHBondContact O-CG 3.33Å; L189-L193 PolarHBondContact O-N 3Å; E190-L193 PolarHBondContact O-N 3.29Å; L193-N196 PolarHBondContact O-N 2.88Å; L193-L197 WeakPolarHBondContact O-CB 3.08Å; L193-L197 PolarHBondContact O-N 3.08Å
194L98.4Very high97.8Very high101 Ų101101.2 Ų101.253%0.52951%0.512SS..Hα-helixtrans-63.1-45.4176.2-174.165.7000111.6E190 D191 N196 L197 I198E190-L194 WeakPolarHBondContact O-CB 3.26Å; E190-L194 PolarHBondContact O-N 2.98Å; D191-L194 PolarHBondContact O-N 3.46Å; L194-N196 VanDerWaalsContact C-N 3.33Å; L194-N196 PolarHBondContact O-N 2.83Å; L194-L197 WeakPolarHBondContact O-CB 3Å; L194-L197 PolarHBondContact O-N 2.92Å; L194-I198 HydrophobicContact CG-CD1 4.23Å; L194-I198 WeakPolarHBondContact O-CG1 3.33Å; L194-I198 PolarHBondContact O-N 3.24Å
195K98.5Very high97.9Very high121 Ų12199.5 Ų99.553%0.52651%0.511SS..Hα-helixtrans-60-42.3174.8-75168.9-179.7165.30112.2D191 T192 I198 L199D191-K195 WeakPolarHBondContact O-CG 3.42Å; D191-K195 PolarHBondContact O-N 3.26Å; D191-K195 WeakPolarHBondContact OD1-CE 3.21Å; D191-K195 IonicContact OD1-NZ 3.68Å; D191-K195 VanDerWaalsContact OD2-CE 3.28Å; D191-K195 WeakPolarHBondContact OD2-CE 3.3Å; D191-K195 IonicContact OD2-NZ 3.54Å; D191-K195 PolarHBondContact OD2-NZ 3.37Å; T192-K195 PolarHBondContact O-N 2.86Å; K195-I198 PolarHBondContact O-N 2.71Å; K195-L199 WeakPolarHBondContact O-CB 3.39Å; K195-L199 PolarHBondContact O-N 3.3Å
196N97.6Very high98Very high90 Ų9099.1 Ų99.148%0.48151%0.514SS..Hα-helixtrans-66.6-37177.6-73.8-14.7000112.4T192 L193 L194 L199 K200T192-N196 WeakPolarHBondContact O-CB 3.06Å; T192-N196 VanDerWaalsContact O-CG 3.27Å; T192-N196 PolarHBondContact O-N 2.86Å; T192-N196 PolarHBondContact O-ND2 3.37Å; L193-N196 PolarHBondContact O-N 2.88Å; L194-N196 VanDerWaalsContact C-N 3.33Å; L194-N196 PolarHBondContact O-N 2.83Å; N196-L199 PolarHBondContact O-N 2.74Å; N196-K200 WeakPolarHBondContact O-CB 3Å; N196-K200 PolarHBondContact O-N 2.89Å
197L97.9Very high98Very high108 Ų10895.3 Ų95.357%0.56550%0.504SS*.Hα-helixtrans-62.1-49.3174.4-177.168.5000111.2L193 L194 L199 K200 E201L193-L197 WeakPolarHBondContact O-CB 3.08Å; L193-L197 PolarHBondContact O-N 3.08Å; L194-L197 WeakPolarHBondContact O-CB 3Å; L194-L197 PolarHBondContact O-N 2.92Å; L197-L199 VanDerWaalsContact C-N 3.34Å; L197-L199 PolarHBondContact O-N 2.97Å; L197-K200 WeakPolarHBondContact O-CB 3.32Å; L197-K200 PolarHBondContact O-N 3.14Å; L197-E201 PolarHBondContact O-N 3.27Å
198I98Very high98.1Very high79 Ų7997.7 Ų97.741%0.40551%0.51SS..Hα-helixtrans-62.4-42.1177.9-65.7165.7000110.9L194 K195 K200 E201 N202L194-I198 HydrophobicContact CG-CD1 4.23Å; L194-I198 WeakPolarHBondContact O-CG1 3.33Å; L194-I198 PolarHBondContact O-N 3.24Å; K195-I198 PolarHBondContact O-N 2.71Å; I198-K200 VanDerWaalsContact C-N 3.32Å; I198-K200 PolarHBondContact O-N 3.35Å; I198-E201 PolarHBondContact O-N 3.49Å; I198-N202 WeakPolarHBondContact O-CB 3.47Å; I198-N202 VanDerWaalsContact O-CG 3.27Å; I198-N202 PolarHBondContact O-N 3.14Å
199L98.2Very high98.1Very high104 Ų10497 Ų9755%0.54550%0.501SS..Hα-helixtrans-61.9-42176.4-176.463.8000111.4K195 N196 L197 N202 V203K195-L199 WeakPolarHBondContact O-CB 3.39Å; K195-L199 PolarHBondContact O-N 3.3Å; N196-L199 PolarHBondContact O-N 2.74Å; L197-L199 VanDerWaalsContact C-N 3.34Å; L197-L199 PolarHBondContact O-N 2.97Å; L199-N202 PolarHBondContact O-N 2.85Å; L199-V203 VanDerWaalsContact O-CG2 3.3Å; L199-V203 WeakPolarHBondContact O-CG2 3.27Å; L199-V203 PolarHBondContact O-N 3.41Å
200K98.5Very high98.1Very high131 Ų13196.7 Ų96.757%0.5750%0.499SS*.Hα-helixtrans-61-44.8175.6-176.8-176.4175.7-172.90111.5N196 L197 I198 V203 Q204N196-K200 WeakPolarHBondContact O-CB 3Å; N196-K200 PolarHBondContact O-N 2.89Å; L197-K200 WeakPolarHBondContact O-CB 3.32Å; L197-K200 PolarHBondContact O-N 3.14Å; I198-K200 VanDerWaalsContact C-N 3.32Å; I198-K200 PolarHBondContact O-N 3.35Å; K200-V203 PolarHBondContact O-N 2.81Å; K200-Q204 WeakPolarHBondContact O-CG 3.2Å; K200-Q204 PolarHBondContact O-N 3.32Å
201E98.1Very high98.1Very high114 Ų11495 Ų9553%0.53350%0.499SS..Hα-helixtrans-61.6-46.2176.1-174.9177.7-176.600111.5L197 I198 V203 Q204 T205L197-E201 PolarHBondContact O-N 3.27Å; I198-E201 PolarHBondContact O-N 3.49Å; E201-V203 VanDerWaalsContact C-N 3.34Å; E201-V203 PolarHBondContact O-N 3.45Å; E201-Q204 WeakPolarHBondContact O-CB 3.41Å; E201-Q204 PolarHBondContact O-N 2.9Å; E201-Q204 VanDerWaalsContact O-N 3.11Å; E201-T205 PolarHBondContact O-N 3.35Å; E201-T205 PolarHBondContact O-OG1 3.33Å
202N97.8Very high98.1Very high95 Ų9598 Ų9851%0.50851%0.505SS..Hα-helixtrans-59.5-42.4176.5-72.1-16.4000112.5I198 L199 Q204 T205 L206I198-N202 WeakPolarHBondContact O-CB 3.47Å; I198-N202 VanDerWaalsContact O-CG 3.27Å; I198-N202 PolarHBondContact O-N 3.14Å; L199-N202 PolarHBondContact O-N 2.85Å; N202-Q204 VanDerWaalsContact C-N 3.34Å; N202-T205 PolarHBondContact O-N 2.94Å; N202-L206 WeakPolarHBondContact O-CB 3.34Å; N202-L206 PolarHBondContact O-N 2.66Å
203V98.4Very high98.1Very high95 Ų9598.4 Ų98.458%0.57650%0.504SS*.Hα-helixtrans-63.7-39.9175.6169.40000111L199 K200 E201 G207L199-V203 VanDerWaalsContact O-CG2 3.3Å; L199-V203 WeakPolarHBondContact O-CG2 3.27Å; L199-V203 PolarHBondContact O-N 3.41Å; K200-V203 PolarHBondContact O-N 2.81Å; E201-V203 VanDerWaalsContact C-N 3.34Å; E201-V203 PolarHBondContact O-N 3.45Å; V203-G207 PolarHBondContact O-N 2.89Å
204Q97.9Very high98.1Very high107 Ų10796.6 Ų96.650%0.550%0.501SS..Hα-helixtrans-64.5-46.5175.9-73.9177.6-30.100111.9K200 E201 N202 G207 Q208K200-Q204 WeakPolarHBondContact O-CG 3.2Å; K200-Q204 PolarHBondContact O-N 3.32Å; E201-Q204 WeakPolarHBondContact O-CB 3.41Å; E201-Q204 PolarHBondContact O-N 2.9Å; E201-Q204 VanDerWaalsContact O-N 3.11Å; N202-Q204 VanDerWaalsContact C-N 3.34Å; Q204-G207 PolarHBondContact O-N 2.97Å; Q204-Q208 WeakPolarHBondContact O-CG 3.5Å; Q204-Q208 PolarHBondContact O-N 3.45Å
205T98.1Very high98Very high79 Ų7997.5 Ų97.549%0.48551%0.506SS..Hα-helixtrans-60.1-46.4176.4-59.50000111.5E201 N202 G207 Q208 E209E201-T205 PolarHBondContact O-N 3.35Å; E201-T205 PolarHBondContact O-OG1 3.33Å; N202-T205 PolarHBondContact O-N 2.94Å; T205-G207 VanDerWaalsContact C-N 3.31Å; T205-G207 PolarHBondContact O-N 3.44Å; T205-Q208 PolarHBondContact O-N 3.03Å; T205-E209 PolarHBondContact O-N 2.73Å
206L98.4Very high97.9Very high108 Ų10895.9 Ų95.957%0.56550%0.501SS*.Hα-helixtrans-63-38.9175.8-177.660.6000111.6N202 E209 I210N202-L206 WeakPolarHBondContact O-CB 3.34Å; N202-L206 PolarHBondContact O-N 2.66Å; L206-E209 PolarHBondContact O-N 3.41Å; L206-I210 HydrophobicContact CD1-CD1 4.34Å; L206-I210 HydrophobicContact CD1-CG1 4.4Å; L206-I210 HydrophobicContact CG-CD1 3.98Å; L206-I210 HydrophobicContact CG-CG1 4.48Å; L206-I210 VanDerWaalsContact O-CG1 3.27Å; L206-I210 WeakPolarHBondContact O-CG1 3.22Å; L206-I210 PolarHBondContact O-N 3.41Å
207G98.2Very high97.8Very high31 Ų3196.1 Ų96.132%0.3250%0.502SS..Hα-helixtrans-62.6-39.1175.100000113.4V203 Q204 T205 S211V203-G207 PolarHBondContact O-N 2.89Å; Q204-G207 PolarHBondContact O-N 2.97Å; T205-G207 VanDerWaalsContact C-N 3.31Å; T205-G207 PolarHBondContact O-N 3.44Å; G207-S211 WeakPolarHBondContact O-CB 3.39Å; G207-S211 PolarHBondContact O-N 3.11Å; G207-S211 PolarHBondContact O-OG 2.91Å
208Q98Very high97.6Very high137 Ų13792.6 Ų92.664%0.6449%0.491SS*.Hα-helixtrans-64.8-43.7173.4-70.9172.21.700111.4Q204 T205 S211 R212Q204-Q208 WeakPolarHBondContact O-CG 3.5Å; Q204-Q208 PolarHBondContact O-N 3.45Å; T205-Q208 PolarHBondContact O-N 3.03Å; Q208-S211 WeakPolarHBondContact O-CB 3.38Å; Q208-S211 PolarHBondContact O-N 3.35Å; Q208-R212 WeakPolarHBondContact O-CB 3.4Å; Q208-R212 PolarHBondContact O-N 3.07Å
209E98.4Very high97.5Very high72 Ų7294.7 Ų94.734%0.33650%0.5SS..Hα-helixtrans-65.9-41.5178.7-175.461.9-174.900112.2T205 L206 S211 R212 L213T205-E209 PolarHBondContact O-N 2.73Å; L206-E209 PolarHBondContact O-N 3.41Å; E209-S211 VanDerWaalsContact C-N 3.3Å; E209-S211 PolarHBondContact O-N 2.97Å; E209-R212 PolarHBondContact O-N 3.31Å; E209-R212 IonicContact OE1-CZ 3.5Å; E209-R212 IonicContact OE1-NE 2.68Å; E209-R212 IonicContact OE1-NH2 3.52Å; E209-R212 PolarHBondContact OE1-NH2 3.47Å; E209-R212 IonicContact OE2-CZ 2.66Å; E209-R212 IonicContact OE2-NE 2.66Å; E209-R212 PolarHBondContact OE2-NE 3.5Å; E209-R212 IonicContact OE2-NH2 3.5Å; E209-R212 PolarHBondContact OE2-NH2 3.37Å; E209-L213 HydrophobicContact CG-CD1 4.06Å; E209-L213 HydrophobicContact CG-CG 4.5Å; E209-L213 WeakPolarHBondContact O-CB 3.41Å; E209-L213 VanDerWaalsContact O-CG 3.32Å; E209-L213 WeakPolarHBondContact O-CG 3.15Å; E209-L213 PolarHBondContact O-N 3.18Å
210I98Very high97.3Very high101 Ų10194.4 Ų94.452%0.51850%0.498SS..Hα-helixtrans-59.8-42.7172.3-69.8166.5000110.5L206 L213 S214L206-I210 HydrophobicContact CD1-CD1 4.34Å; L206-I210 HydrophobicContact CD1-CG1 4.4Å; L206-I210 HydrophobicContact CG-CD1 3.98Å; L206-I210 HydrophobicContact CG-CG1 4.48Å; L206-I210 VanDerWaalsContact O-CG1 3.27Å; L206-I210 WeakPolarHBondContact O-CG1 3.22Å; L206-I210 PolarHBondContact O-N 3.41Å; I210-L213 PolarHBondContact O-N 2.91Å; I210-S214 WeakPolarHBondContact O-CB 3.26Å; I210-S214 PolarHBondContact O-N 3.39Å
211S97.7Very high97Very high71 Ų7197.8 Ų97.850%0.49751%0.507SS..Hα-helixtrans-64.4-43.1178.6-57.20000111.6G207 Q208 E209 S214 L215G207-S211 WeakPolarHBondContact O-CB 3.39Å; G207-S211 PolarHBondContact O-N 3.11Å; G207-S211 PolarHBondContact O-OG 2.91Å; Q208-S211 WeakPolarHBondContact O-CB 3.38Å; Q208-S211 PolarHBondContact O-N 3.35Å; E209-S211 VanDerWaalsContact C-N 3.3Å; E209-S211 PolarHBondContact O-N 2.97Å; S211-S214 PolarHBondContact O-N 3.33Å; S211-L215 WeakPolarHBondContact O-CG 3.46Å; S211-L215 PolarHBondContact O-N 2.84Å; S211-L215 VanDerWaalsContact O-N 3.08Å
212R98Very high96.6Very high134 Ų13497.9 Ų97.951%0.50651%0.511SS..Hα-helixtrans-60-52175.1-173.9-178.779.295.11.4111.5Q208 E209 S214 L215 E216Q208-R212 WeakPolarHBondContact O-CB 3.4Å; Q208-R212 PolarHBondContact O-N 3.07Å; E209-R212 PolarHBondContact O-N 3.31Å; E209-R212 IonicContact OE1-CZ 3.5Å; E209-R212 IonicContact OE1-NE 2.68Å; E209-R212 IonicContact OE1-NH2 3.52Å; E209-R212 PolarHBondContact OE1-NH2 3.47Å; E209-R212 IonicContact OE2-CZ 2.66Å; E209-R212 IonicContact OE2-NE 2.66Å; E209-R212 PolarHBondContact OE2-NE 3.5Å; E209-R212 IonicContact OE2-NH2 3.5Å; E209-R212 PolarHBondContact OE2-NH2 3.37Å; R212-S214 VanDerWaalsContact C-N 3.29Å; R212-S214 PolarHBondContact O-N 2.89Å; R212-L215 PolarHBondContact O-N 3.32Å; R212-E216 PolarHBondContact O-N 3.42Å
213L98Very high96.2Very high69 Ų6999 Ų9936%0.36151%0.512SS..Hα-helixtrans-64.8-32.2178.5-70.3172.2000112.4E209 I210 N217E209-L213 HydrophobicContact CG-CD1 4.06Å; E209-L213 HydrophobicContact CG-CG 4.5Å; E209-L213 WeakPolarHBondContact O-CB 3.41Å; E209-L213 VanDerWaalsContact O-CG 3.32Å; E209-L213 WeakPolarHBondContact O-CG 3.15Å; E209-L213 PolarHBondContact O-N 3.18Å; I210-L213 PolarHBondContact O-N 2.91Å; L213-N217 VanDerWaalsContact O-CB 3.25Å; L213-N217 WeakPolarHBondContact O-CB 3.31Å; L213-N217 VanDerWaalsContact O-CG 3.28Å; L213-N217 PolarHBondContact O-N 3.15Å; L213-N217 PolarHBondContact O-ND2 3.44Å
214S97.1Very high95.6Very high81 Ų8197.3 Ų97.357%0.56651%0.505SS*.Hα-helixtrans-67.5-40.7176.1-170.40000111.7I210 S211 R212 G218I210-S214 WeakPolarHBondContact O-CB 3.26Å; I210-S214 PolarHBondContact O-N 3.39Å; S211-S214 PolarHBondContact O-N 3.33Å; R212-S214 VanDerWaalsContact C-N 3.29Å; R212-S214 PolarHBondContact O-N 2.89Å; S214-G218 PolarHBondContact O-N 3.29Å
215L96.5Very high95Very high121 Ų12194.1 Ų94.163%0.63450%0.497SS*.Hα-helixtrans-65.2-50173.7-72.9170.2000111.4S211 R212 N217 G218 E219S211-L215 WeakPolarHBondContact O-CG 3.46Å; S211-L215 PolarHBondContact O-N 2.84Å; S211-L215 VanDerWaalsContact O-N 3.08Å; R212-L215 PolarHBondContact O-N 3.32Å; L215-N217 VanDerWaalsContact C-N 3.34Å; L215-N217 PolarHBondContact O-N 3.45Å; L215-G218 WeakPolarHBondContact O-CA 3.28Å; L215-G218 PolarHBondContact O-N 3.49Å; L215-E219 WeakPolarHBondContact O-CG 3.12Å; L215-E219 PolarHBondContact O-N 3.34Å
216E96.6Very high94.3Very high87 Ų8795.1 Ų95.141%0.40750%0.499SS..Hα-helixtrans-58.7-44178.4-175.5177.7179.100111.6R212 G218 E219 L220R212-E216 PolarHBondContact O-N 3.42Å; E216-G218 VanDerWaalsContact C-N 3.3Å; E216-G218 PolarHBondContact O-N 3.08Å; E216-E219 PolarHBondContact O-N 3.49Å; E216-L220 HydrophobicContact CG-CD1 4.16Å; E216-L220 WeakPolarHBondContact O-CB 3.47Å; E216-L220 VanDerWaalsContact O-CG 3.23Å; E216-L220 WeakPolarHBondContact O-CG 3.31Å; E216-L220 PolarHBondContact O-N 3.14Å
217N95Very high93.4Very high95 Ų9597.3 Ų97.351%0.50851%0.505SS..Hα-helixtrans-63.4-35.1173.9-79.9-50.2000112.5L213 L215 R221L213-N217 VanDerWaalsContact O-CB 3.25Å; L213-N217 WeakPolarHBondContact O-CB 3.31Å; L213-N217 VanDerWaalsContact O-CG 3.28Å; L213-N217 PolarHBondContact O-N 3.15Å; L213-N217 PolarHBondContact O-ND2 3.44Å; L215-N217 VanDerWaalsContact C-N 3.34Å; L215-N217 PolarHBondContact O-N 3.45Å; N217-R221 WeakPolarHBondContact O-CB 3.31Å; N217-R221 WeakPolarHBondContact O-CG 3.44Å; N217-R221 PolarHBondContact O-N 3.17Å; N217-R221 VanDerWaalsContact O-N 3.09Å
218G95.6Very high92.3Very high33 Ų33102 Ų10234%0.3452%0.518SS..Hα-helixtrans-64.6-48.4174.400000112.4S214 L215 E216 R221 L222S214-G218 PolarHBondContact O-N 3.29Å; L215-G218 WeakPolarHBondContact O-CA 3.28Å; L215-G218 PolarHBondContact O-N 3.49Å; E216-G218 VanDerWaalsContact C-N 3.3Å; E216-G218 PolarHBondContact O-N 3.08Å; G218-R221 PolarHBondContact O-N 3.09Å; G218-L222 PolarHBondContact O-N 3.35Å
219E94.4Very high90.9Very high124 Ų124102.5 Ų102.558%0.57952%0.52SS*.Hα-helixtrans-61.7-43.4177-69.9177.3172.800111.8L215 E216 R221 L222 H223L215-E219 WeakPolarHBondContact O-CG 3.12Å; L215-E219 PolarHBondContact O-N 3.34Å; E216-E219 PolarHBondContact O-N 3.49Å; E219-R221 VanDerWaalsContact C-N 3.31Å; E219-R221 PolarHBondContact O-N 3.35Å; E219-L222 PolarHBondContact O-N 3Å; E219-H223 PolarHBondContact O-N 2.91Å
220L93.6Very high89.5Confident98 Ų98103 Ų10351%0.51354%0.537SS..Hα-helixtrans-62.6-36.9175.9-73.3172.7000112.4E216 S224E216-L220 HydrophobicContact CG-CD1 4.16Å; E216-L220 WeakPolarHBondContact O-CB 3.47Å; E216-L220 VanDerWaalsContact O-CG 3.23Å; E216-L220 WeakPolarHBondContact O-CG 3.31Å; E216-L220 PolarHBondContact O-N 3.14Å; L220-S224 WeakPolarHBondContact O-CB 3.33Å; L220-S224 PolarHBondContact O-N 3.47Å
221R92.2Very high87.9Confident202 Ų202103.9 Ų103.976%0.76255%0.547SS*.Hα-helixtrans-69-39176.1-73.3177.792164.58.8112.2N217 G218 E219 S224 A225N217-R221 WeakPolarHBondContact O-CB 3.31Å; N217-R221 WeakPolarHBondContact O-CG 3.44Å; N217-R221 PolarHBondContact O-N 3.17Å; N217-R221 VanDerWaalsContact O-N 3.09Å; G218-R221 PolarHBondContact O-N 3.09Å; E219-R221 VanDerWaalsContact C-N 3.31Å; E219-R221 PolarHBondContact O-N 3.35Å; R221-S224 PolarHBondContact O-N 2.86Å; R221-A225 PolarHBondContact O-N 3.39Å
222L90.1Very high85.7Confident116 Ų116110.4 Ų110.461%0.60758%0.575SS**Hα-helixtrans-63.7-48173-70174.1000111G218 E219 S224 A225 D226G218-L222 PolarHBondContact O-N 3.35Å; E219-L222 PolarHBondContact O-N 3Å; L222-S224 VanDerWaalsContact C-N 3.27Å; L222-S224 PolarHBondContact O-N 2.89Å; L222-A225 PolarHBondContact O-N 3.35Å; L222-A225 VanDerWaalsContact O-N 3.12Å; L222-D226 PolarHBondContact O-N 2.91Å
223H89.1Confident85.1Confident117 Ų117109.2 Ų109.254%0.54258%0.578SS.*Hα-helixtrans-63.2-29.6176-81.8-28.1000114E219 K227E219-H223 PolarHBondContact O-N 2.91Å; H223-K227 VanDerWaalsContact O-CG 3.29Å; H223-K227 WeakPolarHBondContact O-CG 3.2Å; H223-K227 PolarHBondContact O-N 3.3Å
224S87Confident84.4Confident60 Ų60111.3 Ų111.342%0.4259%0.59SS.*Hα-helixtrans-70.9-42172.3-1670000111.6L220 R221 L222 K227 E228L220-S224 WeakPolarHBondContact O-CB 3.33Å; L220-S224 PolarHBondContact O-N 3.47Å; R221-S224 PolarHBondContact O-N 2.86Å; L222-S224 VanDerWaalsContact C-N 3.27Å; L222-S224 PolarHBondContact O-N 2.89Å; S224-K227 PolarHBondContact O-N 2.78Å; S224-E228 PolarHBondContact O-N 2.83Å; S224-E228 VanDerWaalsContact O-N 3.15Å
225A85.7Confident83.7Confident41 Ų41113 Ų11334%0.33959%0.591SS.*Hα-helixtrans-66.4-39.9177.800000112.3R221 L222 K227 E228 H229R221-A225 PolarHBondContact O-N 3.39Å; L222-A225 PolarHBondContact O-N 3.35Å; L222-A225 VanDerWaalsContact O-N 3.12Å; A225-K227 VanDerWaalsContact C-N 3.29Å; A225-K227 PolarHBondContact O-N 2.82Å; A225-E228 PolarHBondContact O-N 3.35Å; A225-H229 PolarHBondContact O-CD2 3.18Å; A225-H229 PolarHBondContact O-N 2.89Å
226D83.3Confident82.9Confident99 Ų99112.5 Ų112.553%0.52959%0.589SS.*Hα-helixtrans-63.7-36.1176.6-68.8-21.3000111.9L222 H229 A230L222-D226 PolarHBondContact O-N 2.91Å; D226-H229 PolarHBondContact O-N 2.94Å; D226-A230 WeakPolarHBondContact O-CB 3.1Å; D226-A230 PolarHBondContact O-N 2.81Å
227K79.6Confident82.1Confident155 Ų155114.1 Ų114.167%0.67460%0.6SS**Hα-helixtrans-69.1-38.5176.2-75.9175.9-177.6179.30112.4H223 S224 A225 A230 T231H223-K227 VanDerWaalsContact O-CG 3.29Å; H223-K227 WeakPolarHBondContact O-CG 3.2Å; H223-K227 PolarHBondContact O-N 3.3Å; S224-K227 PolarHBondContact O-N 2.78Å; A225-K227 VanDerWaalsContact C-N 3.29Å; A225-K227 PolarHBondContact O-N 2.82Å; K227-A230 PolarHBondContact O-N 3.43Å; K227-T231 PolarHBondContact O-N 3.32Å; K227-T231 PolarHBondContact O-OG1 3.26Å
228E74.1Confident81.2Confident130 Ų130115.4 Ų115.461%0.60761%0.606SS**Hα-helixtrans-66.3-38.2174.8-72.5-178.7177.100111.5S224 A225 T231S224-E228 PolarHBondContact O-N 2.83Å; S224-E228 VanDerWaalsContact O-N 3.15Å; A225-E228 PolarHBondContact O-N 3.35Å; E228-T231 PolarHBondContact O-N 3.01Å; E228-T231 PolarHBondContact O-OG1 2.78Å
229H68Low80.2Confident146 Ų146121.3 Ų121.368%0.67663%0.625SS**Hα-helixtrans-72.2-29.2174.9-85.5-69.2000113.9A225 D226 T231A225-H229 PolarHBondContact O-CD2 3.18Å; A225-H229 PolarHBondContact O-N 2.89Å; D226-H229 PolarHBondContact O-N 2.94Å; H229-T231 VanDerWaalsContact C-N 3.28Å; H229-T231 PolarHBondContact O-N 2.95Å
230A69.8Low79.1Confident83 Ų83121.1 Ų121.169%0.68663%0.629SS**THydrogen-bonded Turntrans-78.2-8.9176.200000113.9D226 K227D226-A230 WeakPolarHBondContact O-CB 3.1Å; D226-A230 PolarHBondContact O-N 2.81Å; K227-A230 PolarHBondContact O-N 3.43Å
231T63.7Low77.8Confident119 Ų119123 Ų12373%0.7364%0.638SS**THydrogen-bonded Turntrans-99.96.4178.225.60000114.4K227 E228 H229K227-T231 PolarHBondContact O-N 3.32Å; K227-T231 PolarHBondContact O-OG1 3.26Å; E228-T231 PolarHBondContact O-N 3.01Å; E228-T231 PolarHBondContact O-OG1 2.78Å; H229-T231 VanDerWaalsContact C-N 3.28Å; H229-T231 PolarHBondContact O-N 2.95Å
232L51.6Low76.5Confident208 Ų208115.8 Ų115.8100%1.08963%0.627SS**  trans-112.40170.6-67.9174.3000111

Retrieved 232 of 232 residues in 119.8 ms (Link to these results)