A0A077YZE5_TRITR Loading...

Collagen and Col cuticle N domain containing prot ein

AlphaFold DB , UniProt , Accession A0A077YZE5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 310 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
1M44.5Very low52.5Low244 Ų244164.5 Ų164.5100%1.20283%0.825SS**  0108.10-77.7164.5160.800108.6
2Q43.5Very low53.5Low193 Ų193156.7 Ų156.790%0.90280%0.797SS**  trans-153.5131.1143.1-110.7171.515.300105.8
3L48.7Very low54.8Low154 Ų154155.3 Ų155.381%0.80679%0.792SS**  trans-83.6116.3-168.5-157.875.1000107.2D5L3-D5 PolarHBondContact O-N 3.12Å
4N48.9Very low56.5Low143 Ų143158.1 Ų158.177%0.76579%0.788SS**  trans-72.999.7170.8-74.6-11.3000107.6E6N4-E6 PolarHBondContact O-N 3.26Å
5D54.5Low58.2Low143 Ų143152.1 Ų152.177%0.76576%0.764SS**  trans-65.778.8168.9-106.5-72.2000109.3L3 V7L3-D5 PolarHBondContact O-N 3.12Å; D5-V7 VanDerWaalsContact C-N 3.3Å; D5-V7 PolarHBondContact O-N 2.98Å
6E53.8Low59.9Low176 Ų176148.5 Ų148.582%0.82275%0.753SS**  trans-77.385.6-179.4-158.5164.9114.200109N4 P8N4-E6 PolarHBondContact O-N 3.26Å; E6-P8 WeakPolarHBondContact O-CD 3.11Å
7V54.1Low61.5Low118 Ų118142.7 Ų142.772%0.71573%0.733SS**  trans-45.6111178.4177.40000109.1D5D5-V7 VanDerWaalsContact C-N 3.3Å; D5-V7 PolarHBondContact O-N 2.98Å
8P57.7Low63Low105 Ų105143.7 Ų143.768%0.68273%0.731SS**  trans-61.6133.4-170.221.8-32.2000109E6 K10E6-P8 WeakPolarHBondContact O-CD 3.11Å; P8-K10 PolarHBondContact O-N 3.02Å
9P55.8Low64.3Low104 Ų104139.6 Ų139.668%0.67572%0.716SS**  trans-57.8135.5-169.622-33.3000109.4R11P9-R11 PolarHBondContact O-N 3.16Å
10K55.4Low65.6Low208 Ų208135.3 Ų135.390%0.90470%0.702SS**  trans-64.171.6172.2-68.1-179.6179.8176.40109.4P8 S12P8-K10 PolarHBondContact O-N 3.02Å; K10-S12 PolarHBondContact O-N 3.34Å
11R60.5Low66.9Low222 Ų222133.2 Ų133.284%0.83870%0.695SS**  trans-55.5116178.2-91.6-175.3169174.8-2.3106.5P9 L13P9-R11 PolarHBondContact O-N 3.16Å; R11-L13 PolarHBondContact O-N 3.32Å
12S65.4Low69.2Low70 Ų70124 Ų12449%0.4966%0.657SS.*  trans-53.9110.8-176.4-171.90000108.5K10 R14 P15K10-S12 PolarHBondContact O-N 3.34Å; S12-R14 PolarHBondContact O-N 3.48Å; S12-P15 WeakPolarHBondContact O-CD 3.47Å; S12-P15 VanDerWaalsContact O-CG 3.23Å; S12-P15 WeakPolarHBondContact O-CG 3.22Å; S12-P15 VanDerWaalsContact OG-CD 3.29Å; S12-P15 WeakPolarHBondContact OG-CD 3.25Å
13L69.7Low71.6Confident139 Ų139122.1 Ų122.173%0.72865%0.647SS**Hα-helixtrans-66.6-22.6-178.3-168.166.9000111R11 V16 A17R11-L13 PolarHBondContact O-N 3.32Å; L13-V16 PolarHBondContact O-N 3.29Å; L13-A17 WeakPolarHBondContact O-CB 3.34Å; L13-A17 PolarHBondContact O-N 3.41Å
14R79.3Confident73.7Confident195 Ų195118.4 Ų118.474%0.73663%0.634SS**Hα-helixtrans-58-59.1-178.4-64.4-179.5177176.8-1.5113.2S12 V16 A17 F18S12-R14 PolarHBondContact O-N 3.48Å; R14-V16 VanDerWaalsContact C-N 3.3Å; R14-V16 PolarHBondContact O-N 3.48Å; R14-A17 PolarHBondContact O-N 3.46Å; R14-F18 WeakPolarHBondContact O-CD2 3.39Å; R14-F18 PolarHBondContact O-N 3.32Å
15P82.1Confident75.9Confident67 Ų67115 Ų11544%0.43562%0.618SS.*Hα-helixtrans-58.5-38.6177.221.9-34.8000113S12 A17 F18 C19S12-P15 WeakPolarHBondContact O-CD 3.47Å; S12-P15 VanDerWaalsContact O-CG 3.23Å; S12-P15 WeakPolarHBondContact O-CG 3.22Å; S12-P15 VanDerWaalsContact OG-CD 3.29Å; S12-P15 WeakPolarHBondContact OG-CD 3.25Å; P15-A17 PolarHBondContact O-N 3.41Å; P15-F18 PolarHBondContact O-N 3.46Å; P15-C19 WeakPolarHBondContact O-CB 3.17Å; P15-C19 PolarHBondContact O-N 3.48Å; P15-C19 PolarHBondContact O-SG 3.42Å
16V85.6Confident77.8Confident95 Ų95112.7 Ų112.758%0.57661%0.609SS**Hα-helixtrans-62.8-44.6177.4-1760000110.9L13 R14 C19 A20L13-V16 PolarHBondContact O-N 3.29Å; R14-V16 VanDerWaalsContact C-N 3.3Å; R14-V16 PolarHBondContact O-N 3.48Å; V16-C19 PolarHBondContact O-N 3.47Å; V16-A20 WeakPolarHBondContact O-CB 3.23Å; V16-A20 PolarHBondContact O-N 3.08Å
17A87.1Confident79.8Confident50 Ų50106.9 Ų106.941%0.41359%0.591SS.*Hα-helixtrans-64.6-43.5175.500000112.5L13 R14 P15 A20 V21L13-A17 WeakPolarHBondContact O-CB 3.34Å; L13-A17 PolarHBondContact O-N 3.41Å; R14-A17 PolarHBondContact O-N 3.46Å; P15-A17 PolarHBondContact O-N 3.41Å; A17-A20 PolarHBondContact O-N 3.35Å; A17-V21 WeakPolarHBondContact O-CG2 3.24Å; A17-V21 PolarHBondContact O-N 3.37Å
18F88.2Confident81.8Confident160 Ų160105.7 Ų105.770%0.70258%0.584SS**Hα-helixtrans-62.1-43.3176-82.5-65.8000112.2R14 P15 V21 A22R14-F18 WeakPolarHBondContact O-CD2 3.39Å; R14-F18 PolarHBondContact O-N 3.32Å; P15-F18 PolarHBondContact O-N 3.46Å; F18-V21 PolarHBondContact O-N 3.48Å; F18-A22 VanDerWaalsContact O-CB 3.31Å; F18-A22 WeakPolarHBondContact O-CB 3.44Å; F18-A22 PolarHBondContact O-N 3.37Å
19C87.5Confident83.5Confident66 Ų66105.6 Ų105.645%0.44658%0.577SS.*Hα-helixtrans-60.7-45.7173.6-70.40000111.6P15 V16 V21 A22 F23P15-C19 WeakPolarHBondContact O-CB 3.17Å; P15-C19 PolarHBondContact O-N 3.48Å; P15-C19 PolarHBondContact O-SG 3.42Å; V16-C19 PolarHBondContact O-N 3.47Å; C19-V21 VanDerWaalsContact C-N 3.34Å; C19-V21 PolarHBondContact O-N 3.41Å; C19-A22 PolarHBondContact O-N 3.45Å; C19-F23 HydrophobicContact CB-CD2 4.33Å; C19-F23 HydrophobicContact CB-CE2 4.19Å; C19-F23 WeakPolarHBondContact O-CD2 3.34Å; C19-F23 PolarHBondContact O-N 3.35Å
20A89.9Confident85.4Confident53 Ų53103.7 Ų103.744%0.43857%0.566SS.*Hα-helixtrans-61.3-39.8178.900000113V16 A17 S24V16-A20 WeakPolarHBondContact O-CB 3.23Å; V16-A20 PolarHBondContact O-N 3.08Å; A17-A20 PolarHBondContact O-N 3.35Å; A20-S24 WeakPolarHBondContact O-CB 3.33Å; A20-S24 PolarHBondContact O-N 3.44Å; A20-S24 VanDerWaalsContact O-N 3.1Å; A20-S24 PolarHBondContact O-OG 3.45Å
21V93.3Very high87.3Confident93 Ų9397 Ų9756%0.56455%0.545SS*.Hα-helixtrans-68.1-43.9174.1174.60000110.9A17 F18 C19 S24 T25A17-V21 WeakPolarHBondContact O-CG2 3.24Å; A17-V21 PolarHBondContact O-N 3.37Å; F18-V21 PolarHBondContact O-N 3.48Å; C19-V21 VanDerWaalsContact C-N 3.34Å; C19-V21 PolarHBondContact O-N 3.41Å; V21-S24 PolarHBondContact O-N 3.18Å; V21-T25 HydrophobicContact CG1-CG2 4.42Å; V21-T25 WeakPolarHBondContact O-CG2 3.37Å; V21-T25 PolarHBondContact O-N 3.14Å; V21-T25 PolarHBondContact O-OG1 2.96Å
22A92.3Very high89Confident49 Ų4990.9 Ų90.941%0.40553%0.532SS..Hα-helixtrans-63.6-43.7179.100000112.9F18 C19 T25 V26F18-A22 VanDerWaalsContact O-CB 3.31Å; F18-A22 WeakPolarHBondContact O-CB 3.44Å; F18-A22 PolarHBondContact O-N 3.37Å; C19-A22 PolarHBondContact O-N 3.45Å; A22-T25 PolarHBondContact O-N 2.86Å; A22-T25 PolarHBondContact O-OG1 3.4Å; A22-T25 VanDerWaalsContact O-OG1 3.04Å; A22-V26 WeakPolarHBondContact O-CB 3.27Å; A22-V26 VanDerWaalsContact O-CG2 3.29Å; A22-V26 WeakPolarHBondContact O-CG2 3.17Å; A22-V26 PolarHBondContact O-N 3.31Å
23F93.3Very high90.3Very high154 Ų15492.6 Ų92.668%0.67554%0.535SS*.Hα-helixtrans-65.2-40.3174.9-74.1-61.1000111.7C19 A27C19-F23 HydrophobicContact CB-CD2 4.33Å; C19-F23 HydrophobicContact CB-CE2 4.19Å; C19-F23 WeakPolarHBondContact O-CD2 3.34Å; C19-F23 PolarHBondContact O-N 3.35Å; F23-A27 VanDerWaalsContact O-CB 3.29Å; F23-A27 WeakPolarHBondContact O-CB 3.17Å; F23-A27 PolarHBondContact O-N 3.49Å
24S93.9Very high91.6Very high76 Ų7689 Ų8953%0.53152%0.519SS..Hα-helixtrans-61.5-45175.4-61.20000112.3A20 V21 A27 V28A20-S24 WeakPolarHBondContact O-CB 3.33Å; A20-S24 PolarHBondContact O-N 3.44Å; A20-S24 VanDerWaalsContact O-N 3.1Å; A20-S24 PolarHBondContact O-OG 3.45Å; V21-S24 PolarHBondContact O-N 3.18Å; S24-A27 PolarHBondContact O-N 3.24Å; S24-V28 WeakPolarHBondContact O-CG2 3.12Å; S24-V28 PolarHBondContact O-N 3.37Å
25T93.9Very high92.3Very high72 Ų7285.4 Ų85.444%0.44251%0.513SS..Hα-helixtrans-69.1-40.9179.353.10000112.2V21 A22 V28 L29V21-T25 HydrophobicContact CG1-CG2 4.42Å; V21-T25 WeakPolarHBondContact O-CG2 3.37Å; V21-T25 PolarHBondContact O-N 3.14Å; V21-T25 PolarHBondContact O-OG1 2.96Å; A22-T25 PolarHBondContact O-N 2.86Å; A22-T25 PolarHBondContact O-OG1 3.4Å; A22-T25 VanDerWaalsContact O-OG1 3.04Å; T25-V28 PolarHBondContact O-N 2.86Å; T25-L29 WeakPolarHBondContact O-CB 3.44Å; T25-L29 VanDerWaalsContact O-CG 3.26Å; T25-L29 WeakPolarHBondContact O-CG 3.32Å; T25-L29 PolarHBondContact O-N 3.38Å
26V95.4Very high93Very high94 Ų9485.4 Ų85.457%0.5751%0.513SS*.Hα-helixtrans-63-41.3174.71720000111.5A22 L29 S30A22-V26 WeakPolarHBondContact O-CB 3.27Å; A22-V26 VanDerWaalsContact O-CG2 3.29Å; A22-V26 WeakPolarHBondContact O-CG2 3.17Å; A22-V26 PolarHBondContact O-N 3.31Å; V26-L29 PolarHBondContact O-N 2.6Å; V26-S30 WeakPolarHBondContact O-CB 3.37Å; V26-S30 PolarHBondContact O-N 3.46Å
27A94.9Very high93.5Very high55 Ų5586 Ų8646%0.45551%0.513SS..Hα-helixtrans-62.8-46.2175.600000112F23 S24 S30 C31F23-A27 VanDerWaalsContact O-CB 3.29Å; F23-A27 WeakPolarHBondContact O-CB 3.17Å; F23-A27 PolarHBondContact O-N 3.49Å; S24-A27 PolarHBondContact O-N 3.24Å; A27-S30 PolarHBondContact O-N 2.91Å; A27-C31 PolarHBondContact O-N 3.32Å; A27-C31 PolarHBondContact O-SG 3.24Å; A27-C31 VanDerWaalsContact O-SG 3.37Å
28V96Very high93.8Very high92 Ų9288.9 Ų88.956%0.55852%0.519SS*.Hα-helixtrans-62.2-45.7176.61710000111.4S24 T25 S30 C31 V32S24-V28 WeakPolarHBondContact O-CG2 3.12Å; S24-V28 PolarHBondContact O-N 3.37Å; T25-V28 PolarHBondContact O-N 2.86Å; V28-S30 VanDerWaalsContact C-N 3.34Å; V28-S30 PolarHBondContact O-N 3.48Å; V28-C31 PolarHBondContact O-N 3.08Å; V28-V32 HydrophobicContact CG1-CG2 4.25Å; V28-V32 WeakPolarHBondContact O-CB 3.22Å; V28-V32 VanDerWaalsContact O-CG2 3.28Å; V28-V32 WeakPolarHBondContact O-CG2 3.17Å; V28-V32 PolarHBondContact O-N 3.46Å
29L94.4Very high94.2Very high104 Ų10488.1 Ų88.155%0.54551%0.512SS..Hα-helixtrans-61.8-41.5177.2-71.9170.6000112T25 V26 V32 I33T25-L29 WeakPolarHBondContact O-CB 3.44Å; T25-L29 VanDerWaalsContact O-CG 3.26Å; T25-L29 WeakPolarHBondContact O-CG 3.32Å; T25-L29 PolarHBondContact O-N 3.38Å; V26-L29 PolarHBondContact O-N 2.6Å; L29-V32 PolarHBondContact O-N 2.91Å; L29-I33 VanDerWaalsContact O-CG1 3.29Å; L29-I33 WeakPolarHBondContact O-CG1 3.42Å; L29-I33 PolarHBondContact O-N 2.88Å
30S95.1Very high94.6Very high63 Ų6389.5 Ų89.544%0.44152%0.515SS..Hα-helixtrans-59.4-47.4174.6-173.10000111.4V26 A27 V28 V32 I33 T34V26-S30 WeakPolarHBondContact O-CB 3.37Å; V26-S30 PolarHBondContact O-N 3.46Å; A27-S30 PolarHBondContact O-N 2.91Å; V28-S30 VanDerWaalsContact C-N 3.34Å; V28-S30 PolarHBondContact O-N 3.48Å; S30-V32 PolarHBondContact O-N 3.32Å; S30-I33 PolarHBondContact O-N 3.46Å; S30-T34 WeakPolarHBondContact O-CB 3.22Å; S30-T34 WeakPolarHBondContact O-CG2 3.4Å; S30-T34 PolarHBondContact O-N 3.3Å; S30-T34 PolarHBondContact O-OG1 3.4Å
31C94.9Very high94.9Very high68 Ų6894.2 Ų94.246%0.45952%0.523SS..Hα-helixtrans-61.7-43.2175.6-68.90000112.6A27 V28 I33 T34 L35A27-C31 PolarHBondContact O-N 3.32Å; A27-C31 PolarHBondContact O-SG 3.24Å; A27-C31 VanDerWaalsContact O-SG 3.37Å; V28-C31 PolarHBondContact O-N 3.08Å; C31-I33 VanDerWaalsContact C-N 3.28Å; C31-I33 PolarHBondContact O-N 3.44Å; C31-T34 WeakPolarHBondContact CA-OG1 3.43Å; C31-T34 PolarHBondContact O-N 2.84Å; C31-T34 PolarHBondContact O-OG1 3.39Å; C31-L35 HydrophobicContact CB-CD1 4.5Å; C31-L35 WeakPolarHBondContact O-CB 2.9Å; C31-L35 VanDerWaalsContact O-CG 3.25Å; C31-L35 WeakPolarHBondContact O-CG 3.48Å; C31-L35 PolarHBondContact O-N 3.41Å
32V96Very high95Very high94 Ų9493 Ų9357%0.5752%0.516SS*.Hα-helixtrans-65.7-27.9179.4170.70000112.6V28 L29 S30 P36V28-V32 HydrophobicContact CG1-CG2 4.25Å; V28-V32 WeakPolarHBondContact O-CB 3.22Å; V28-V32 VanDerWaalsContact O-CG2 3.28Å; V28-V32 WeakPolarHBondContact O-CG2 3.17Å; V28-V32 PolarHBondContact O-N 3.46Å; L29-V32 PolarHBondContact O-N 2.91Å; S30-V32 PolarHBondContact O-N 3.32Å; V32-P36 WeakPolarHBondContact O-CD 3.5Å; V32-P36 WeakPolarHBondContact O-CG 2.81Å
33I94.6Very high95.1Very high106 Ų10694.8 Ų94.854%0.54452%0.515SS..Hα-helixtrans-86.6-43.4175.9-63.6165.2000111.2L29 S30 C31 P36 L37L29-I33 VanDerWaalsContact O-CG1 3.29Å; L29-I33 WeakPolarHBondContact O-CG1 3.42Å; L29-I33 PolarHBondContact O-N 2.88Å; S30-I33 PolarHBondContact O-N 3.46Å; C31-I33 VanDerWaalsContact C-N 3.28Å; C31-I33 PolarHBondContact O-N 3.44Å; I33-P36 WeakPolarHBondContact O-CD 3.2Å; I33-L37 HydrophobicContact CG2-CD1 3.99Å; I33-L37 VanDerWaalsContact O-CG 3.31Å; I33-L37 WeakPolarHBondContact O-CG 3.1Å; I33-L37 PolarHBondContact O-N 3.2Å
34T94.9Very high95.1Very high64 Ų6491 Ų9139%0.39351%0.508SS..Hα-helixtrans-72.3-36.8-175.650.40000113.6S30 C31 L37 M38S30-T34 WeakPolarHBondContact O-CB 3.22Å; S30-T34 WeakPolarHBondContact O-CG2 3.4Å; S30-T34 PolarHBondContact O-N 3.3Å; S30-T34 PolarHBondContact O-OG1 3.4Å; C31-T34 WeakPolarHBondContact CA-OG1 3.43Å; C31-T34 PolarHBondContact O-N 2.84Å; C31-T34 PolarHBondContact O-OG1 3.39Å; T34-L37 PolarHBondContact O-N 2.91Å; T34-M38 WeakPolarHBondContact O-CB 3.49Å; T34-M38 WeakPolarHBondContact O-CG 3.26Å; T34-M38 PolarHBondContact O-N 2.87Å
35L95.7Very high95Very high119 Ų11990 Ų9062%0.62350%0.499SS*.Hα-helixtrans-64.6-45.9-178.5-69.3171000113.2C31 M38 Y39C31-L35 HydrophobicContact CB-CD1 4.5Å; C31-L35 WeakPolarHBondContact O-CB 2.9Å; C31-L35 VanDerWaalsContact O-CG 3.25Å; C31-L35 WeakPolarHBondContact O-CG 3.48Å; C31-L35 PolarHBondContact O-N 3.41Å; L35-M38 PolarHBondContact O-N 3.36Å; L35-Y39 WeakPolarHBondContact O-CB 3.4Å; L35-Y39 PolarHBondContact O-N 3.11Å
36P96.2Very high94.9Very high66 Ų6692.1 Ų92.143%0.42950%0.504SS..Hα-helixtrans-64.3-37.2173.5-24.235.6000113.4V32 I33 Y39 N40V32-P36 WeakPolarHBondContact O-CD 3.5Å; V32-P36 WeakPolarHBondContact O-CG 2.81Å; I33-P36 WeakPolarHBondContact O-CD 3.2Å; P36-Y39 PolarHBondContact O-N 2.76Å; P36-N40 WeakPolarHBondContact O-CB 3.22Å; P36-N40 PolarHBondContact O-N 3.42Å; P36-N40 PolarHBondContact O-ND2 3.06Å
37L95.4Very high94.7Very high109 Ų10992 Ų9257%0.57150%0.504SS*.Hα-helixtrans-63.7-44.5175.6-70.6173.9000111.3I33 T34 N40 Y41I33-L37 HydrophobicContact CG2-CD1 3.99Å; I33-L37 VanDerWaalsContact O-CG 3.31Å; I33-L37 WeakPolarHBondContact O-CG 3.1Å; I33-L37 PolarHBondContact O-N 3.2Å; T34-L37 PolarHBondContact O-N 2.91Å; L37-N40 PolarHBondContact O-N 2.68Å; L37-Y41 VanDerWaalsContact O-CB 3.3Å; L37-Y41 WeakPolarHBondContact O-CB 3.38Å; L37-Y41 PolarHBondContact O-N 3.15Å
38M94.9Very high94.3Very high110 Ų11094.7 Ų94.754%0.54251%0.51SS..Hα-helixtrans-64.6-39.8174.5-73.8-60.2-60.900112.2T34 L35 Y41 V42T34-M38 WeakPolarHBondContact O-CB 3.49Å; T34-M38 WeakPolarHBondContact O-CG 3.26Å; T34-M38 PolarHBondContact O-N 2.87Å; L35-M38 PolarHBondContact O-N 3.36Å; M38-Y41 PolarHBondContact O-N 3.39Å; M38-V42 WeakPolarHBondContact O-CB 3.16Å; M38-V42 VanDerWaalsContact O-CG2 3.27Å; M38-V42 WeakPolarHBondContact O-CG2 3.36Å; M38-V42 PolarHBondContact O-N 3.05Å
39Y96.5Very high93.9Very high144 Ų14495.8 Ų95.857%0.56551%0.51SS*.Hα-helixtrans-62.5-49176.1-176.4-98.4000111.8L35 P36 Y41 V42 Q43L35-Y39 WeakPolarHBondContact O-CB 3.4Å; L35-Y39 PolarHBondContact O-N 3.11Å; P36-Y39 PolarHBondContact O-N 2.76Å; Y39-Y41 VanDerWaalsContact C-N 3.33Å; Y39-Y41 PolarHBondContact O-N 2.81Å; Y39-V42 PolarHBondContact O-N 3.49Å; Y39-Q43 HydrophobicContact CD1-CG 4.36Å; Y39-Q43 HydrophobicContact CE1-CG 4.05Å; Y39-Q43 VanDerWaalsContact CE1-NE2 3.31Å; Y39-Q43 VanDerWaalsContact CZ-NE2 3.34Å; Y39-Q43 WeakPolarHBondContact O-CG 3.2Å; Y39-Q43 PolarHBondContact O-N 2.65Å; Y39-Q43 PolarHBondContact OH-NE2 2.82Å
40N94.6Very high93.7Very high95 Ų9596.7 Ų96.751%0.50851%0.511SS..Hα-helixtrans-62.6-39.6177.1-68.7-14.9000111.8P36 L37 S44P36-N40 WeakPolarHBondContact O-CB 3.22Å; P36-N40 PolarHBondContact O-N 3.42Å; P36-N40 PolarHBondContact O-ND2 3.06Å; L37-N40 PolarHBondContact O-N 2.68Å; N40-S44 WeakPolarHBondContact O-CB 3.31Å; N40-S44 PolarHBondContact O-N 2.66Å
41Y95.7Very high93.4Very high152 Ų15298.6 Ų98.660%0.59652%0.517SS*.Hα-helixtrans-64-47.9175179.2-103.4000111.8L37 M38 Y39 Q43 S44 V45L37-Y41 VanDerWaalsContact O-CB 3.3Å; L37-Y41 WeakPolarHBondContact O-CB 3.38Å; L37-Y41 PolarHBondContact O-N 3.15Å; M38-Y41 PolarHBondContact O-N 3.39Å; Y39-Y41 VanDerWaalsContact C-N 3.33Å; Y39-Y41 PolarHBondContact O-N 2.81Å; Y41-Q43 PolarHBondContact O-N 2.89Å; Y41-S44 PolarHBondContact O-N 3.07Å; Y41-V45 HydrophobicContact CD1-CG2 4.36Å; Y41-V45 HydrophobicContact CD2-CG2 4.4Å; Y41-V45 HydrophobicContact CE1-CG2 3.94Å; Y41-V45 HydrophobicContact CE2-CG2 3.99Å; Y41-V45 WeakPolarHBondContact O-CG2 3.32Å; Y41-V45 PolarHBondContact O-N 2.78Å
42V96.3Very high93Very high68 Ų68101.2 Ų101.241%0.41252%0.522SS..Hα-helixtrans-61.6-42.7177169.70000111M38 Y39 V45 Q46M38-V42 WeakPolarHBondContact O-CB 3.16Å; M38-V42 VanDerWaalsContact O-CG2 3.27Å; M38-V42 WeakPolarHBondContact O-CG2 3.36Å; M38-V42 PolarHBondContact O-N 3.05Å; Y39-V42 PolarHBondContact O-N 3.49Å; V42-V45 PolarHBondContact O-N 2.87Å; V42-Q46 HydrophobicContact CG1-CG 4.34Å; V42-Q46 WeakPolarHBondContact O-CB 3.44Å; V42-Q46 VanDerWaalsContact O-CG 3.29Å; V42-Q46 WeakPolarHBondContact O-CG 3.29Å; V42-Q46 PolarHBondContact O-N 3.27Å
43Q94.9Very high92.6Very high85 Ų85101 Ų10140%0.39752%0.521SS..Hα-helixtrans-60.3-45.9173.6-77.2-165.3-30.300112Y39 Y41 V45 Q46 T47Y39-Q43 HydrophobicContact CD1-CG 4.36Å; Y39-Q43 HydrophobicContact CE1-CG 4.05Å; Y39-Q43 VanDerWaalsContact CE1-NE2 3.31Å; Y39-Q43 VanDerWaalsContact CZ-NE2 3.34Å; Y39-Q43 WeakPolarHBondContact O-CG 3.2Å; Y39-Q43 PolarHBondContact O-N 2.65Å; Y39-Q43 PolarHBondContact OH-NE2 2.82Å; Y41-Q43 PolarHBondContact O-N 2.89Å; Q43-V45 VanDerWaalsContact C-N 3.33Å; Q43-V45 PolarHBondContact O-N 3.19Å; Q43-Q46 PolarHBondContact O-N 3.1Å; Q43-T47 PolarHBondContact O-N 2.87Å; Q43-T47 PolarHBondContact O-OG1 3.08Å
44S92.7Very high92.2Very high74 Ų7499.5 Ų99.552%0.51751%0.514SS..Hα-helixtrans-63.4-37.3179-172.60000112.8N40 Y41 T47 L48N40-S44 WeakPolarHBondContact O-CB 3.31Å; N40-S44 PolarHBondContact O-N 2.66Å; Y41-S44 PolarHBondContact O-N 3.07Å; S44-T47 WeakPolarHBondContact CA-OG1 3.35Å; S44-T47 PolarHBondContact O-OG1 3.24Å; S44-L48 PolarHBondContact O-N 3.18Å
45V92.8Very high91.8Very high57 Ų5799.7 Ų99.735%0.34551%0.51SS..Hα-helixtrans-71.4-40.9174.8172.70000110.6Y41 V42 Q43 L48 M49Y41-V45 HydrophobicContact CD1-CG2 4.36Å; Y41-V45 HydrophobicContact CD2-CG2 4.4Å; Y41-V45 HydrophobicContact CE1-CG2 3.94Å; Y41-V45 HydrophobicContact CE2-CG2 3.99Å; Y41-V45 WeakPolarHBondContact O-CG2 3.32Å; Y41-V45 PolarHBondContact O-N 2.78Å; V42-V45 PolarHBondContact O-N 2.87Å; Q43-V45 VanDerWaalsContact C-N 3.33Å; Q43-V45 PolarHBondContact O-N 3.19Å; V45-L48 PolarHBondContact O-N 2.97Å; V45-M49 HydrophobicContact CG1-CG 4.32Å; V45-M49 VanDerWaalsContact O-CG 3.26Å; V45-M49 WeakPolarHBondContact O-CG 3.38Å; V45-M49 PolarHBondContact O-N 2.95Å
46Q91.4Very high91Very high115 Ų11598 Ų9854%0.53751%0.507SS..Hα-helixtrans-60.1-45.9175-79.2179.8-30.600111.6V42 Q43 L48 M49 Q50V42-Q46 HydrophobicContact CG1-CG 4.34Å; V42-Q46 WeakPolarHBondContact O-CB 3.44Å; V42-Q46 VanDerWaalsContact O-CG 3.29Å; V42-Q46 WeakPolarHBondContact O-CG 3.29Å; V42-Q46 PolarHBondContact O-N 3.27Å; Q43-Q46 PolarHBondContact O-N 3.1Å; Q46-L48 VanDerWaalsContact C-N 3.33Å; Q46-L48 PolarHBondContact O-N 2.82Å; Q46-M49 PolarHBondContact O-N 3.17Å; Q46-Q50 WeakPolarHBondContact O-CB 3.36Å; Q46-Q50 PolarHBondContact O-N 2.97Å
47T91Very high90.5Very high93 Ų93100.4 Ų100.457%0.57151%0.51SS*.Hα-helixtrans-62-38.7177.847.50000112.9Q43 S44 Q50 D51Q43-T47 PolarHBondContact O-N 2.87Å; Q43-T47 PolarHBondContact O-OG1 3.08Å; S44-T47 WeakPolarHBondContact CA-OG1 3.35Å; S44-T47 PolarHBondContact O-OG1 3.24Å; T47-Q50 PolarHBondContact O-N 2.97Å; T47-D51 PolarHBondContact O-N 3.26Å; T47-D51 VanDerWaalsContact O-N 3.08Å
48L87.4Confident90.1Very high111 Ų11198.8 Ų98.858%0.58151%0.505SS*.Hα-helixtrans-66.1-46.2177.2-17865.2000111.5S44 V45 Q46 Q50 D51 E52S44-L48 PolarHBondContact O-N 3.18Å; V45-L48 PolarHBondContact O-N 2.97Å; Q46-L48 VanDerWaalsContact C-N 3.33Å; Q46-L48 PolarHBondContact O-N 2.82Å; L48-Q50 VanDerWaalsContact C-N 3.29Å; L48-Q50 PolarHBondContact O-N 3.33Å; L48-D51 PolarHBondContact O-N 2.98Å; L48-E52 PolarHBondContact O-N 3.28Å
49M87.3Confident89.5Confident114 Ų11497.3 Ų97.356%0.56249%0.493SS*.Hα-helixtrans-63.7-35.1176.2-67.2-69.9-67.600112V45 Q46 V53V45-M49 HydrophobicContact CG1-CG 4.32Å; V45-M49 VanDerWaalsContact O-CG 3.26Å; V45-M49 WeakPolarHBondContact O-CG 3.38Å; V45-M49 PolarHBondContact O-N 2.95Å; Q46-M49 PolarHBondContact O-N 3.17Å; M49-V53 VanDerWaalsContact O-CG2 3.27Å; M49-V53 WeakPolarHBondContact O-CG2 3.31Å; M49-V53 PolarHBondContact O-N 3.17Å
50Q89.6Confident88.8Confident124 Ų12493 Ų9358%0.57948%0.484SS*.Hα-helixtrans-64.9-45.4176.8-148.788.83.400111.1Q46 T47 L48 V53 D54Q46-Q50 WeakPolarHBondContact O-CB 3.36Å; Q46-Q50 PolarHBondContact O-N 2.97Å; T47-Q50 PolarHBondContact O-N 2.97Å; L48-Q50 VanDerWaalsContact C-N 3.29Å; L48-Q50 PolarHBondContact O-N 3.33Å; Q50-V53 PolarHBondContact O-N 3.39Å; Q50-D54 WeakPolarHBondContact O-CB 3.4Å; Q50-D54 PolarHBondContact O-N 2.97Å
51D88.8Confident88.2Confident103 Ų10394.5 Ų94.555%0.55149%0.486SS*.Hα-helixtrans-63.6-42.5-179.6-167.750.3000111.9T47 L48 V53 D54 F55T47-D51 PolarHBondContact O-N 3.26Å; T47-D51 VanDerWaalsContact O-N 3.08Å; L48-D51 PolarHBondContact O-N 2.98Å; D51-V53 PolarHBondContact O-N 2.84Å; D51-D54 PolarHBondContact O-N 3.46Å; D51-F55 WeakPolarHBondContact O-CB 3.18Å; D51-F55 PolarHBondContact O-N 3.08Å
52E86Confident87.6Confident122 Ų12290.5 Ų90.557%0.5748%0.475SS*.Hα-helixtrans-63.4-39.9174-70.7-162.3167.900112.8L48 C56L48-E52 PolarHBondContact O-N 3.28Å; E52-C56 WeakPolarHBondContact O-CB 3.5Å; E52-C56 PolarHBondContact O-N 3Å
53V88.6Confident86.6Confident91 Ų9192.9 Ų92.955%0.55248%0.484SS*.Hα-helixtrans-67.7-45.4177.8169.10000111.2M49 Q50 D51 C56 K57M49-V53 VanDerWaalsContact O-CG2 3.27Å; M49-V53 WeakPolarHBondContact O-CG2 3.31Å; M49-V53 PolarHBondContact O-N 3.17Å; Q50-V53 PolarHBondContact O-N 3.39Å; D51-V53 PolarHBondContact O-N 2.84Å; V53-C56 PolarHBondContact O-N 2.94Å; V53-K57 VanDerWaalsContact O-CB 3.26Å; V53-K57 WeakPolarHBondContact O-CB 3.47Å; V53-K57 PolarHBondContact O-N 2.89Å
54D86.6Confident86Confident74 Ų7498 Ų9840%0.39650%0.499SS..Hα-helixtrans-70.5-32.3178.4-80.5-36.3000112Q50 D51 K57 T58Q50-D54 WeakPolarHBondContact O-CB 3.4Å; Q50-D54 PolarHBondContact O-N 2.97Å; D51-D54 PolarHBondContact O-N 3.46Å; D54-K57 PolarHBondContact O-N 2.71Å; D54-T58 WeakPolarHBondContact O-CB 3.44Å; D54-T58 PolarHBondContact O-N 3.47Å; D54-T58 PolarHBondContact O-OG1 3.29Å
55F84.7Confident85.5Confident68 Ų68100.1 Ų100.130%0.29850%0.499SS..Hα-helixtrans-62.4-51.1169.1-178.9-101.9000111.5D51 K57 T58 R59 V105D51-F55 WeakPolarHBondContact O-CB 3.18Å; D51-F55 PolarHBondContact O-N 3.08Å; F55-K57 VanDerWaalsContact C-N 3.27Å; F55-K57 PolarHBondContact O-N 3.25Å; F55-T58 PolarHBondContact O-N 2.99Å; F55-R59 HydrophobicContact CE1-CB 4.37Å; F55-R59 HydrophobicContact CZ-CB 4.23Å; F55-R59 HydrophobicContact CZ-CG 4.44Å; F55-R59 VanDerWaalsContact O-CB 3.31Å; F55-R59 WeakPolarHBondContact O-CB 3.37Å; F55-R59 PolarHBondContact O-N 3.43Å; F55-V105 HydrophobicContact CD1-CG1 4.28Å; F55-V105 HydrophobicContact CD2-CB 4.16Å; F55-V105 HydrophobicContact CD2-CG1 4.29Å; F55-V105 HydrophobicContact CD2-CG2 3.86Å; F55-V105 HydrophobicContact CE1-CB 4.37Å; F55-V105 HydrophobicContact CE1-CG1 3.56Å; F55-V105 HydrophobicContact CE2-CB 3.44Å; F55-V105 VanDerWaalsContact CE2-CB 3.44Å; F55-V105 HydrophobicContact CE2-CG1 3.59Å; F55-V105 HydrophobicContact CE2-CG2 3.67Å; F55-V105 HydrophobicContact CZ-CB 3.59Å; F55-V105 HydrophobicContact CZ-CG1 3.18Å; F55-V105 HydrophobicContact CZ-CG2 4.19Å
56C80.3Confident84.9Confident83 Ų83103 Ų10356%0.56151%0.509SS*.Hα-helixtrans-57.4-39.6174.8-83.60000112.4E52 V53 S60E52-C56 WeakPolarHBondContact O-CB 3.5Å; E52-C56 PolarHBondContact O-N 3Å; V53-C56 PolarHBondContact O-N 2.94Å; C56-S60 VanDerWaalsContact O-CB 3.32Å; C56-S60 WeakPolarHBondContact O-CB 3.39Å; C56-S60 PolarHBondContact O-N 3.15Å; C56-S60 PolarHBondContact O-OG 3.3Å
57K84.8Confident84.2Confident117 Ų117102.7 Ų102.751%0.50951%0.509SS..Hα-helixtrans-71.6-32.2179.2-166.2175.1-170.8174.40113.2V53 D54 F55 S60 K61V53-K57 VanDerWaalsContact O-CB 3.26Å; V53-K57 WeakPolarHBondContact O-CB 3.47Å; V53-K57 PolarHBondContact O-N 2.89Å; D54-K57 PolarHBondContact O-N 2.71Å; F55-K57 VanDerWaalsContact C-N 3.27Å; F55-K57 PolarHBondContact O-N 3.25Å; K57-S60 WeakPolarHBondContact CA-OG 3.34Å; K57-S60 PolarHBondContact O-OG 3.48Å; K57-K61 VanDerWaalsContact O-CG 3.3Å; K57-K61 WeakPolarHBondContact O-CG 3.47Å; K57-K61 PolarHBondContact O-N 3.2Å
58T86.3Confident83.7Confident75 Ų75102.6 Ų102.646%0.4651%0.508SS..Hα-helixtrans-75.1-50.3175.4-58.10000110.1D54 F55 S60 K61 D62D54-T58 WeakPolarHBondContact O-CB 3.44Å; D54-T58 PolarHBondContact O-N 3.47Å; D54-T58 PolarHBondContact O-OG1 3.29Å; F55-T58 PolarHBondContact O-N 2.99Å; T58-S60 VanDerWaalsContact C-N 3.34Å; T58-S60 PolarHBondContact O-N 3.28Å; T58-K61 WeakPolarHBondContact O-CB 3.4Å; T58-K61 PolarHBondContact O-N 3.46Å; T58-K61 VanDerWaalsContact O-N 3.16Å; T58-D62 PolarHBondContact O-N 2.95Å
59R83.4Confident83.3Confident78 Ų78103 Ų10329%0.29451%0.507SS..Hα-helixtrans-58.7-42178.5-172-176.8-177.5108.37.3112.8F55 D62 M63 P107F55-R59 HydrophobicContact CE1-CB 4.37Å; F55-R59 HydrophobicContact CZ-CB 4.23Å; F55-R59 HydrophobicContact CZ-CG 4.44Å; F55-R59 VanDerWaalsContact O-CB 3.31Å; F55-R59 WeakPolarHBondContact O-CB 3.37Å; F55-R59 PolarHBondContact O-N 3.43Å; R59-D62 PolarHBondContact O-N 3.15Å; R59-M63 HydrophobicContact CG-SD 4.37Å; R59-M63 WeakPolarHBondContact O-CB 3.26Å; R59-M63 WeakPolarHBondContact O-CG 3.3Å; R59-M63 PolarHBondContact O-N 3.46Å; R59-P107 VanDerWaalsContact NH2-CA 3.32Å
60S80.9Confident82.6Confident53 Ų53103.1 Ų103.137%0.37151%0.509SS..Hα-helixtrans-65.3-41.9176.149.40000112.6C56 K57 T58 D62 M63 W64C56-S60 VanDerWaalsContact O-CB 3.32Å; C56-S60 WeakPolarHBondContact O-CB 3.39Å; C56-S60 PolarHBondContact O-N 3.15Å; C56-S60 PolarHBondContact O-OG 3.3Å; K57-S60 WeakPolarHBondContact CA-OG 3.34Å; K57-S60 PolarHBondContact O-OG 3.48Å; T58-S60 VanDerWaalsContact C-N 3.34Å; T58-S60 PolarHBondContact O-N 3.28Å; S60-D62 VanDerWaalsContact C-N 3.35Å; S60-D62 PolarHBondContact O-N 2.9Å; S60-M63 PolarHBondContact O-N 3.46Å; S60-W64 WeakPolarHBondContact O-CB 3.37Å; S60-W64 PolarHBondContact O-N 3.34Å
61K83.7Confident81.8Confident127 Ų127102.3 Ų102.355%0.55251%0.505SS*.Hα-helixtrans-58.8-43.7173.7-79.61741771790112.6K57 T58 W64 K65K57-K61 VanDerWaalsContact O-CG 3.3Å; K57-K61 WeakPolarHBondContact O-CG 3.47Å; K57-K61 PolarHBondContact O-N 3.2Å; T58-K61 WeakPolarHBondContact O-CB 3.4Å; T58-K61 PolarHBondContact O-N 3.46Å; T58-K61 VanDerWaalsContact O-N 3.16Å; K61-W64 PolarHBondContact O-N 2.89Å; K61-K65 WeakPolarHBondContact O-CG 3.29Å; K61-K65 PolarHBondContact O-N 2.87Å
62D82.7Confident80.9Confident69 Ų69100.6 Ų100.637%0.36951%0.506SS..Hα-helixtrans-71-43.2-178.7-66.7-28.6000111.3T58 R59 S60 W64 K65 E66T58-D62 PolarHBondContact O-N 2.95Å; R59-D62 PolarHBondContact O-N 3.15Å; S60-D62 VanDerWaalsContact C-N 3.35Å; S60-D62 PolarHBondContact O-N 2.9Å; D62-W64 VanDerWaalsContact C-N 3.25Å; D62-W64 PolarHBondContact O-N 3.37Å; D62-K65 PolarHBondContact O-N 2.81Å; D62-K65 VanDerWaalsContact O-N 3.15Å; D62-K65 IonicContact OD1-NZ 2.6Å; D62-K65 PolarHBondContact OD1-NZ 3.03Å; D62-E66 WeakPolarHBondContact O-CG 3.34Å; D62-E66 PolarHBondContact O-N 3.16Å; D62-E66 VanDerWaalsContact O-N 3.15Å
63M75.3Confident79.7Confident118 Ų118101.4 Ų101.458%0.58151%0.513SS*.Hα-helixtrans-57.5-37.3171-72.6-179.167.100112.8R59 S60 M67R59-M63 HydrophobicContact CG-SD 4.37Å; R59-M63 WeakPolarHBondContact O-CB 3.26Å; R59-M63 WeakPolarHBondContact O-CG 3.3Å; R59-M63 PolarHBondContact O-N 3.46Å; S60-M63 PolarHBondContact O-N 3.46Å; M63-M67 WeakPolarHBondContact O-CB 3.36Å; M63-M67 PolarHBondContact O-N 3.4Å
64W80.8Confident78.4Confident191 Ų191101.1 Ų101.172%0.72352%0.52SS*.Hα-helixtrans-70.5-36.5177-79.630.8000112.7S60 K61 D62 M67 V68S60-W64 WeakPolarHBondContact O-CB 3.37Å; S60-W64 PolarHBondContact O-N 3.34Å; K61-W64 PolarHBondContact O-N 2.89Å; D62-W64 VanDerWaalsContact C-N 3.25Å; D62-W64 PolarHBondContact O-N 3.37Å; W64-M67 PolarHBondContact O-N 2.99Å; W64-V68 WeakPolarHBondContact O-CB 3.27Å; W64-V68 VanDerWaalsContact O-CG2 3.24Å; W64-V68 WeakPolarHBondContact O-CG2 3.41Å; W64-V68 PolarHBondContact O-N 3.22Å
65K82.5Confident77Confident119 Ų119103.8 Ų103.852%0.51754%0.539SS..Hα-helixtrans-61.1-48.6173.9-71.1169.2-167.4158.50111.2K61 D62 M67 V68 Q69K61-K65 WeakPolarHBondContact O-CG 3.29Å; K61-K65 PolarHBondContact O-N 2.87Å; D62-K65 PolarHBondContact O-N 2.81Å; D62-K65 VanDerWaalsContact O-N 3.15Å; D62-K65 IonicContact OD1-NZ 2.6Å; D62-K65 PolarHBondContact OD1-NZ 3.03Å; K65-M67 VanDerWaalsContact C-N 3.35Å; K65-M67 PolarHBondContact O-N 3.33Å; K65-V68 PolarHBondContact O-N 3.4Å; K65-Q69 WeakPolarHBondContact O-CG 3.49Å; K65-Q69 PolarHBondContact O-N 2.78Å
66E81.6Confident75.3Confident117 Ų117102.3 Ų102.355%0.54754%0.543SS..Hα-helixtrans-59.9-45.8177.3-61.8-63.112200110.8D62 V68 Q69 L70D62-E66 WeakPolarHBondContact O-CG 3.34Å; D62-E66 PolarHBondContact O-N 3.16Å; D62-E66 VanDerWaalsContact O-N 3.15Å; E66-V68 PolarHBondContact O-N 2.75Å; E66-Q69 PolarHBondContact O-N 3.32Å; E66-L70 VanDerWaalsContact O-CG 3.32Å; E66-L70 WeakPolarHBondContact O-CG 3.39Å; E66-L70 PolarHBondContact O-N 3.27Å
67M75.7Confident73.6Confident109 Ų109107.6 Ų107.654%0.53756%0.556SS.*Hα-helixtrans-64.5-39.9178.7-168.8176-173.900112.8M63 W64 K65 L70 Q71M63-M67 WeakPolarHBondContact O-CB 3.36Å; M63-M67 PolarHBondContact O-N 3.4Å; W64-M67 PolarHBondContact O-N 2.99Å; K65-M67 VanDerWaalsContact C-N 3.35Å; K65-M67 PolarHBondContact O-N 3.33Å; M67-L70 PolarHBondContact O-N 3.38Å; M67-Q71 WeakPolarHBondContact O-CB 3.38Å; M67-Q71 WeakPolarHBondContact O-CG 3.34Å; M67-Q71 PolarHBondContact O-N 2.91Å
68V81.6Confident71.5Confident91 Ų91112.4 Ų112.455%0.55258%0.577SS**Hα-helixtrans-67.9-38.8175.7168.30000111.3W64 K65 E66 Q71 A72W64-V68 WeakPolarHBondContact O-CB 3.27Å; W64-V68 VanDerWaalsContact O-CG2 3.24Å; W64-V68 WeakPolarHBondContact O-CG2 3.41Å; W64-V68 PolarHBondContact O-N 3.22Å; K65-V68 PolarHBondContact O-N 3.4Å; E66-V68 PolarHBondContact O-N 2.75Å; V68-Q71 PolarHBondContact O-N 2.9Å; V68-A72 VanDerWaalsContact O-CB 3.31Å; V68-A72 WeakPolarHBondContact O-CB 3.48Å; V68-A72 PolarHBondContact O-N 3.42Å
69Q79.3Confident69.2Low119 Ų119112.2 Ų112.256%0.55659%0.59SS**Hα-helixtrans-62.6-45.9173.4-76.2-177.8-7.500111.5K65 E66 Q71 A72 L73K65-Q69 WeakPolarHBondContact O-CG 3.49Å; K65-Q69 PolarHBondContact O-N 2.78Å; E66-Q69 PolarHBondContact O-N 3.32Å; Q69-Q71 PolarHBondContact O-N 3.34Å; Q69-A72 PolarHBondContact O-N 3.43Å; Q69-L73 WeakPolarHBondContact O-CG 3.31Å; Q69-L73 PolarHBondContact O-N 2.88Å
70L71.6Confident66.8Low117 Ų117116.6 Ų116.661%0.61361%0.614SS**Hα-helixtrans-63.2-39.9176.3-68.9170.6000112.3E66 M67 L73 A74E66-L70 VanDerWaalsContact O-CG 3.32Å; E66-L70 WeakPolarHBondContact O-CG 3.39Å; E66-L70 PolarHBondContact O-N 3.27Å; M67-L70 PolarHBondContact O-N 3.38Å; L70-L73 PolarHBondContact O-N 3.34Å; L70-A74 WeakPolarHBondContact O-CB 3.29Å; L70-A74 PolarHBondContact O-N 3.43Å
71Q71.9Confident64.8Low108 Ų108119.8 Ų119.851%0.50563%0.634SS.*Hα-helixtrans-67.2-38.7174.5-76.7-176.1-13.900112.8M67 V68 Q69 L73 A74 V75M67-Q71 WeakPolarHBondContact O-CB 3.38Å; M67-Q71 WeakPolarHBondContact O-CG 3.34Å; M67-Q71 PolarHBondContact O-N 2.91Å; V68-Q71 PolarHBondContact O-N 2.9Å; Q69-Q71 PolarHBondContact O-N 3.34Å; Q71-L73 VanDerWaalsContact C-N 3.33Å; Q71-L73 PolarHBondContact O-N 2.85Å; Q71-A74 PolarHBondContact O-N 3.5Å; Q71-A74 VanDerWaalsContact O-N 3.16Å; Q71-V75 WeakPolarHBondContact O-CG2 3.47Å; Q71-V75 PolarHBondContact O-N 3.08Å
72A70.9Confident62.7Low67 Ų67120.5 Ų120.555%0.55464%0.642SS**Hα-helixtrans-64.1-38.1176.400000112V68 Q69 G76V68-A72 VanDerWaalsContact O-CB 3.31Å; V68-A72 WeakPolarHBondContact O-CB 3.48Å; V68-A72 PolarHBondContact O-N 3.42Å; Q69-A72 PolarHBondContact O-N 3.43Å; A72-G76 PolarHBondContact O-N 3.41Å
73L61.6Low60.5Low138 Ų138123.6 Ų123.672%0.72366%0.659SS**Hα-helixtrans-65.9-38.5171.6-67.1170.6000111.8Q69 L70 Q71 G76Q69-L73 WeakPolarHBondContact O-CG 3.31Å; Q69-L73 PolarHBondContact O-N 2.88Å; L70-L73 PolarHBondContact O-N 3.34Å; Q71-L73 VanDerWaalsContact C-N 3.33Å; Q71-L73 PolarHBondContact O-N 2.85Å; L73-G76 PolarHBondContact O-N 2.87Å
74A59.5Low58.8Low85 Ų85126 Ų12670%0.70267%0.672SS**Hα-helixtrans-75.4-30.8-177.700000115L70 Q71 G76L70-A74 WeakPolarHBondContact O-CB 3.29Å; L70-A74 PolarHBondContact O-N 3.43Å; Q71-A74 PolarHBondContact O-N 3.5Å; Q71-A74 VanDerWaalsContact O-N 3.16Å; A74-G76 VanDerWaalsContact C-N 3.32Å
75V57.2Low56.8Low131 Ų131123 Ų12379%0.79468%0.675SS**Hα-helixtrans-86.4-8.3176.6-179.30000111.6Q71 K77Q71-V75 WeakPolarHBondContact O-CG2 3.47Å; Q71-V75 PolarHBondContact O-N 3.08Å; V75-K77 PolarHBondContact O-N 2.92Å
76G48.9Very low54.6Low37 Ų37125.3 Ų125.338%0.38169%0.687SS.*SBendtrans-73.183.1-179.700000115.3A72 L73 A74A72-G76 PolarHBondContact O-N 3.41Å; L73-G76 PolarHBondContact O-N 2.87Å; A74-G76 VanDerWaalsContact C-N 3.32Å
77K46.5Very low52.3Low194 Ų194123.6 Ų123.684%0.84369%0.693SS**  trans72.3124.9162.6-62.2176.8176176.50117.5V75 G79V75-K77 PolarHBondContact O-N 2.92Å; K77-G79 PolarHBondContact O-N 3.46Å
78K40.3Very low50.4Low217 Ų217124 Ų12494%0.94370%0.704SS**SBendtrans-52.5128.1161.3-73.2175.5171.7177.90110.7
79G37.3Very low48.3Very low72 Ų72125.3 Ų125.374%0.74271%0.712SS**SBendtrans88.741.5147.300000118K77K77-G79 PolarHBondContact O-N 3.46Å
80E32.2Very low46.2Very low170 Ų170126.1 Ų126.179%0.79473%0.725SS**  trans-153141.2149.2-111.8171.3106.300110.3I82E80-I82 PolarHBondContact O-N 3.31Å
81P39.4Very low44.5Very low120 Ų120126.4 Ų126.478%0.77973%0.731SS**  trans-78.788.4-177.231.9-33.6000110.4N83P81-N83 PolarHBondContact O-N 2.88Å; P81-N83 VanDerWaalsContact O-N 3.08Å
82I40.6Very low43Very low141 Ų141132.7 Ų132.772%0.72375%0.75SS**  trans-71.4108.2178-55.4-177.2000108.9E80 I84E80-I82 PolarHBondContact O-N 3.31Å; I82-I84 PolarHBondContact O-N 3.21Å
83N36.1Very low41.3Very low135 Ų135134.3 Ų134.372%0.72276%0.758SS**  trans-53.2134.5173.5-80.5-93.3000110.2P81 V85P81-N83 PolarHBondContact O-N 2.88Å; P81-N83 VanDerWaalsContact O-N 3.08Å; N83-V85 PolarHBondContact O-N 3.44Å
84I39.5Very low40.1Very low168 Ų168137.2 Ų137.286%0.86277%0.765SS**  trans-70.289170-59.2163.8000106.9I82 E86I82-I84 PolarHBondContact O-N 3.21Å; I84-E86 PolarHBondContact O-N 2.92Å; I84-E86 VanDerWaalsContact O-N 3.17Å
85V39.2Very low38.9Very low128 Ų128143.1 Ų143.178%0.77677%0.769SS**  trans-64.3113.5166.1177.20000106.3N83 A87N83-V85 PolarHBondContact O-N 3.44Å; V85-A87 PolarHBondContact O-N 2.89Å
86E35.2Very low37.5Very low167 Ų167146.2 Ų146.278%0.7878%0.775SS**  trans-50.4111.5175.2-86.6172.895.100109.6I84I84-E86 PolarHBondContact O-N 2.92Å; I84-E86 VanDerWaalsContact O-N 3.17Å
87A32.9Very low36.9Very low82 Ų82152.6 Ų152.668%0.67879%0.788SS**  trans-56.2131.1164.200000107.2V85 V89V85-A87 PolarHBondContact O-N 2.89Å; A87-V89 PolarHBondContact O-N 3.24Å
88P35.9Very low36.2Very low118 Ų118145.8 Ų145.877%0.76677%0.773SS**  trans-61.4115-170.223.3-33.3000109.4V90P88-V90 PolarHBondContact O-N 2.84Å
89V38.3Very low36.3Very low118 Ų118142.7 Ų142.772%0.71578%0.775SS**  trans-54.2106.3169.2173.70000106.7A87 T91A87-V89 PolarHBondContact O-N 3.24Å; V89-T91 VanDerWaalsContact C-N 3.27Å; V89-T91 PolarHBondContact O-N 3.49Å
90V35.4Very low36.1Very low136 Ų136141 Ų14182%0.82476%0.758SS**  trans-63.297.3175.9175.30000106.4P88 R92P88-V90 PolarHBondContact O-N 2.84Å; V90-R92 PolarHBondContact O-N 2.7Å
91T35.7Very low36.6Very low122 Ų122139.4 Ų139.475%0.74876%0.762SS**  trans-54.2128.8-179.818.40000107.9V89 S93V89-T91 VanDerWaalsContact C-N 3.27Å; V89-T91 PolarHBondContact O-N 3.49Å; T91-S93 PolarHBondContact O-N 3.32Å
92R39.3Very low36.4Very low240 Ų240136.6 Ų136.691%0.90675%0.745SS**  trans-59.478.6-175.9-175179.6179.7173.61.3110.7V90 K94V90-R92 PolarHBondContact O-N 2.7Å; R92-K94 PolarHBondContact O-N 3.01Å; R92-K94 VanDerWaalsContact O-N 3.11Å
93S36.2Very low36.5Very low101 Ų101135.6 Ų135.671%0.70675%0.745SS**  trans-60117.8172.6-177.70000106.9T91 R95T91-S93 PolarHBondContact O-N 3.32Å; S93-R95 PolarHBondContact O-N 2.87Å
94K36.5Very low36.6Very low200 Ų200135 Ų13587%0.8774%0.742SS**  trans-74.566.8-170.8-164.1-178.3-173.6-1770109R92 Q96R92-K94 PolarHBondContact O-N 3.01Å; R92-K94 VanDerWaalsContact O-N 3.11Å; K94-Q96 PolarHBondContact O-N 2.88Å; K94-Q96 VanDerWaalsContact O-N 3.15Å
95R33.3Very low36.5Very low209 Ų209131 Ų13179%0.78973%0.726SS**  trans-54.5122.2176.9-80.1-168.1175.7-153.9-0.8108.1S93 Y97S93-R95 PolarHBondContact O-N 2.87Å; R95-Y97 WeakPolarHBondContact O-CD2 3.26Å; R95-Y97 PolarHBondContact O-N 3.36Å
96Q29.1Very low36.6Very low196 Ų196131.5 Ų131.592%0.91672%0.723SS**  trans-57.5111.7172.3-81.1160.4-61.200108.3K94 G98K94-Q96 PolarHBondContact O-N 2.88Å; K94-Q96 VanDerWaalsContact O-N 3.15Å; Q96-G98 PolarHBondContact O-N 3.48Å; Q96-G98 VanDerWaalsContact O-N 3.07Å
97Y36.6Very low37Very low171 Ų171127.9 Ų127.967%0.67171%0.714SS**  trans-7398.3164.8-76.6-86.7000107.8R95 S102R95-Y97 WeakPolarHBondContact O-CD2 3.26Å; R95-Y97 PolarHBondContact O-N 3.36Å; Y97-S102 WeakPolarHBondContact CE1-OG 3.41Å
98G31.6Very low37.2Very low50 Ų50128.6 Ų128.652%0.51572%0.72SS.*  trans-57.4159.7149.100000109.7Q96 G100Q96-G98 PolarHBondContact O-N 3.48Å; Q96-G98 VanDerWaalsContact O-N 3.07Å; G98-G100 PolarHBondContact O-N 3.48Å
99P42.6Very low37.5Very low152 Ų152126.4 Ų126.499%0.98772%0.719SS**SBendtrans-71.789.7-166.529.1-35.4000112.2
100G33.1Very low37.9Very low38 Ų38128.2 Ų128.239%0.39272%0.724SS.*  trans-137.7127.2166.600000108.9G98 S102G98-G100 PolarHBondContact O-N 3.48Å; G100-S102 PolarHBondContact O-N 3.35Å; G100-S102 PolarHBondContact O-OG 2.87Å
101P42.5Very low38.5Very low135 Ų135127.5 Ų127.588%0.87772%0.724SS**  trans-71.5100.3-165.828.7-34.6000111
102S35Very low39.3Very low61 Ų61125.8 Ų125.843%0.42772%0.716SS.*  trans-99.692.6-179.3-58.90000110Y97 G100 N104Y97-S102 WeakPolarHBondContact CE1-OG 3.41Å; G100-S102 PolarHBondContact O-N 3.35Å; G100-S102 PolarHBondContact O-OG 2.87Å; S102-N104 PolarHBondContact O-N 3.39Å; S102-N104 PolarHBondContact O-ND2 2.9Å
103V42.3Very low40.2Very low120 Ų120119.2 Ų119.273%0.72771%0.707SS**  trans-65.5114.4172.4-75.40000109.8V105V103-V105 PolarHBondContact O-N 3.06Å
104N37.7Very low40.9Very low122 Ų122116.4 Ų116.465%0.65269%0.687SS**  trans-86.897.7179-74.5-87.5000109.1S102 L106S102-N104 PolarHBondContact O-N 3.39Å; S102-N104 PolarHBondContact O-ND2 2.9Å; N104-L106 PolarHBondContact O-N 3.04Å
105V39.1Very low42Very low85 Ų85114.2 Ų114.252%0.51568%0.68SS.*  trans-80.1108.6174.9-164.40000110F55 V103F55-V105 HydrophobicContact CD1-CG1 4.28Å; F55-V105 HydrophobicContact CD2-CB 4.16Å; F55-V105 HydrophobicContact CD2-CG1 4.29Å; F55-V105 HydrophobicContact CD2-CG2 3.86Å; F55-V105 HydrophobicContact CE1-CB 4.37Å; F55-V105 HydrophobicContact CE1-CG1 3.56Å; F55-V105 HydrophobicContact CE2-CB 3.44Å; F55-V105 VanDerWaalsContact CE2-CB 3.44Å; F55-V105 HydrophobicContact CE2-CG1 3.59Å; F55-V105 HydrophobicContact CE2-CG2 3.67Å; F55-V105 HydrophobicContact CZ-CB 3.59Å; F55-V105 HydrophobicContact CZ-CG1 3.18Å; F55-V105 HydrophobicContact CZ-CG2 4.19Å; V103-V105 PolarHBondContact O-N 3.06Å
106L41.1Very low43.4Very low139 Ų139109 Ų10973%0.72867%0.665SS**PPolyproline II helixtrans-78.3160.6174.9-83.1115.7000112.1N104N104-L106 PolarHBondContact O-N 3.04Å
107P42.6Very low45Very low91 Ų91100 Ų10059%0.59162%0.623SS**PPolyproline II helixtrans-72.6138.9179.128.8-33.7000113R59 G109R59-P107 VanDerWaalsContact NH2-CA 3.32Å; P107-G109 PolarHBondContact O-N 3.44Å
108A36.9Very low46.5Very low97 Ų9796.7 Ų96.780%0.80262%0.623SS**THydrogen-bonded Turntrans-59.4121170.800000110.2
109G42.7Very low48.5Very low71 Ų7198.2 Ų98.273%0.73262%0.624SS**THydrogen-bonded Turntrans174.6-39.5-177.700000113.3P107P107-G109 PolarHBondContact O-N 3.44Å
110D45.9Very low50.2Low156 Ų15691.2 Ų91.283%0.83458%0.58SS**  trans-98.5106-179.1-71.4-53.6000112.2
111C49.8Very low52.3Low121 Ų12193.6 Ų93.682%0.81859%0.588SS**SBendtrans-62.9139.2167-66.50000110.5
112C51.7Low54Low87 Ų8791 Ų9159%0.58857%0.571SS**  trans70.7101.8-170.8-480000113.8C114C112-C114 VanDerWaalsContact CB-SG 3.56Å; C112-C114 PolarHBondContact O-N 3Å
113S57.6Low56.2Low102 Ų10288.3 Ų88.371%0.71355%0.553SS**  trans-69.161.1153.649.70000110.4Q115S113-Q115 PolarHBondContact O-N 2.91Å
114C51.7Low57.9Low42 Ų4286.5 Ų86.528%0.28454%0.544SS..  trans-60.893163.6-70.10000107.2C112 Q116 C162C112-C114 VanDerWaalsContact CB-SG 3.56Å; C112-C114 PolarHBondContact O-N 3Å; C114-Q116 PolarHBondContact O-N 3.47Å; C114-C162 HydrophobicContact CB-CB 4.33Å; C114-C162 VanDerWaalsContact SG-SG 3.69Å
115Q59.4Low59.8Low153 Ų15384.8 Ų84.872%0.71554%0.539SS*.  trans-59107.4165.7-78.4-17055.400106.1S113 G117 G288S113-Q115 PolarHBondContact O-N 2.91Å; Q115-G117 PolarHBondContact O-N 3.37Å; Q115-G288 WeakPolarHBondContact O-CA 3.39Å
116Q62.4Low61.7Low101 Ų10181 Ų8147%0.47252%0.518SS..PPolyproline II helixtrans-57.2120.4-179.7-147.2-177.721.900106.4C114C114-Q116 PolarHBondContact O-N 3.47Å
117G62.1Low63.3Low5 Ų585 Ų855%0.05252%0.523CS..PPolyproline II helixtrans-52.7147.3-176.700000110Q115 G165 K286Q115-G117 PolarHBondContact O-N 3.37Å; G117-G165 WeakPolarHBondContact O-CA 3.44Å; G117-K286 WeakPolarHBondContact CA-O 3.32Å
118P69.2Low65Low103 Ų10386.2 Ų86.267%0.66953%0.525SS*.PPolyproline II helixtrans-51.2140.7-172.921-33.1000110.1G120 G285P118-G120 PolarHBondContact O-N 2.89Å; P118-G285 WeakPolarHBondContact O-CA 3.32Å
119P73.7Confident66.6Low82 Ų8282 Ų8253%0.53249%0.49SS..PPolyproline II helixtrans-48.7142-179.9-24.731.1000110.5P166P119-P166 WeakPolarHBondContact CA-O 3.4Å; P119-P166 HydrophobicContact CB-CG 4.22Å; P119-P166 HydrophobicContact CG-CG 3.98Å
120G77.4Confident68.1Low5 Ų588.8 Ų88.85%0.05249%0.494CS..PPolyproline II helixtrans-56.8160.4176.400000111.5P118 P166 G168 P283P118-G120 PolarHBondContact O-N 2.89Å; G120-P166 PolarHBondContact N-O 3.35Å; G120-G168 WeakPolarHBondContact O-CA 3.24Å; G120-P283 WeakPolarHBondContact CA-O 3.44Å
121P76.9Confident69.5Low87 Ų8785.9 Ų85.957%0.56548%0.484SS*.PPolyproline II helixtrans-52.3148.2174.325.2-34.3000109.8G282 P283P121-G282 WeakPolarHBondContact O-CA 3.23Å; P121-P283 HydrophobicContact CG-CG 4.35Å
122P79Confident70.4Confident81 Ų8180.4 Ų80.453%0.52645%0.448SS..PPolyproline II helixtrans-49.4148.7174-24.732.9000111.1P169P122-P169 HydrophobicContact CB-CG 4.06Å; P122-P169 HydrophobicContact CG-CG 3.92Å
123G80.1Confident71.3Confident5 Ų580 Ų805%0.05245%0.45CS..PPolyproline II helixtrans-58.2161.4175.800000112.8P169 G171 P280G123-P169 PolarHBondContact N-O 3.32Å; G123-G171 VanDerWaalsContact O-CA 3.22Å; G123-G171 WeakPolarHBondContact O-CA 3.48Å; G123-P280 VanDerWaalsContact CA-O 3.32Å; G123-P280 WeakPolarHBondContact CA-O 3.28Å
124P78.4Confident72Confident82 Ų8279.3 Ų79.353%0.53244%0.444SS..PPolyproline II helixtrans-54.4150.1164.828.4-34.9000108.9G279 P280P124-G279 WeakPolarHBondContact O-CA 3.29Å; P124-P280 HydrophobicContact CG-CG 3.98Å
125P79Confident72.7Confident86 Ų8677.7 Ų77.756%0.55843%0.434SS*.PPolyproline II helixtrans-51156.7177.9-27.735.4000113.1P172P125-P172 HydrophobicContact CB-CG 4.35Å; P125-P172 HydrophobicContact CG-CG 4.29Å
126G77.4Confident73Confident6 Ų678.9 Ų78.96%0.06243%0.432CS..PPolyproline II helixtrans-51.1151169.400000112.2P172 G174 P277G126-P172 PolarHBondContact N-O 2.89Å; G126-G174 VanDerWaalsContact O-CA 3.27Å; G126-G174 WeakPolarHBondContact O-CA 3.35Å; G126-P277 WeakPolarHBondContact CA-O 2.99Å
127R76.4Confident73.3Confident222 Ų22277.5 Ų77.584%0.83843%0.432SS*.PPolyproline II helixtrans-58.9145.1161.1-70.1-173.9176-166.8-2.1108.2G276R127-G276 WeakPolarHBondContact O-CA 3.08Å
128D76.7Confident73Confident116 Ų11679.6 Ų79.662%0.6245%0.453SS*.PPolyproline II helixtrans-48.8147.8177.8-51.9-21.1000111.4P175D128-P175 HydrophobicContact CB-CG 4.25Å; D128-P175 WeakPolarHBondContact OD1-CD 3.26Å; D128-P175 WeakPolarHBondContact OD1-CG 3.31Å
129G71.6Confident72.5Confident8 Ų880 Ų808%0.08245%0.45CS..PPolyproline II helixtrans-51.3144.7171.700000111.4P175 G177 P274G129-P175 PolarHBondContact N-O 3.44Å; G129-G177 WeakPolarHBondContact O-CA 3.25Å; G129-P274 WeakPolarHBondContact CA-O 3.22Å
130R74.5Confident71.7Confident215 Ų21581.8 Ų81.881%0.81146%0.461SS*.PPolyproline II helixtrans-56.8141.8168.2-67.4-173.2179.3-151.10.2108.1G273R130-G273 WeakPolarHBondContact O-CA 3.33Å
131P73.8Confident70.2Confident95 Ų9585 Ų8562%0.61749%0.494SS*.PPolyproline II helixtrans-48.6149.1173.6-27.534.9000111.4
132G70.2Confident68.9Low6 Ų686.8 Ų86.86%0.06251%0.506CS..PPolyproline II helixtrans-50.7149.7173.400000111.8L178 G180 A271G132-L178 PolarHBondContact N-O 3.26Å; G132-G180 VanDerWaalsContact O-CA 3.23Å; G132-G180 WeakPolarHBondContact O-CA 3.42Å; G132-A271 VanDerWaalsContact CA-O 3.24Å; G132-A271 WeakPolarHBondContact CA-O 3.46Å
133A70.8Confident67.2Low78 Ų7889.3 Ų89.365%0.64552%0.522SS*.PPolyproline II helixtrans-57.5144.6166.300000108.8G270A133-G270 WeakPolarHBondContact O-CA 3.18Å
134P72.3Confident65Low88 Ų8892.5 Ų92.557%0.57156%0.555SS**PPolyproline II helixtrans-47.7148171-27.134.8000111.5P181P134-P181 WeakPolarHBondContact CA-O 3.32Å; P134-P181 HydrophobicContact CB-CG 4.02Å; P134-P181 HydrophobicContact CG-CG 3.97Å
135G64.7Low63.2Low8 Ų899.6 Ų99.68%0.08257%0.571CS.*PPolyproline II helixtrans-50.1145.2172.600000111.5P181 G183 D268G135-P181 PolarHBondContact N-O 3.44Å; G135-G183 VanDerWaalsContact O-CA 3.22Å; G135-G183 WeakPolarHBondContact O-CA 3.27Å; G135-D268 VanDerWaalsContact CA-O 3.25Å; G135-D268 WeakPolarHBondContact CA-O 3.43Å
136R67.3Low61.2Low177 Ų177102.7 Ų102.767%0.66858%0.583SS**PPolyproline II helixtrans-67.1135.9173.4-73.4-172.7173.6-146.10.8108.9N139R136-N139 PolarHBondContact NH1-OD1 3.45Å
137P68.5Low59.1Low73 Ų73106.1 Ų106.147%0.47462%0.618SS.*PPolyproline II helixtrans-53.3148.9156.3-22.634.1000109.9N139P137-N139 PolarHBondContact O-N 2.99Å
138G55.6Low57Low48 Ų48103 Ų10350%0.49562%0.618SS.*PPolyproline II helixtrans-53.8128.9178.600000111.5P140G138-P140 WeakPolarHBondContact O-CD 3.37Å
139N58.5Low55.1Low112 Ų112105 Ų10560%0.59963%0.628SS**PPolyproline II helixtrans-85127.9-167.5-50.8-95.2000112.7R136 P137R136-N139 PolarHBondContact NH1-OD1 3.45Å; P137-N139 PolarHBondContact O-N 2.99Å
140P57.7Low53.7Low119 Ų119112 Ų11277%0.77366%0.663SS**PPolyproline II helixtrans-64.9158.3148.2-20.434.5000111.8G138G138-P140 WeakPolarHBondContact O-CD 3.37Å
141G44.9Very low52.9Low72 Ų72107.5 Ų107.574%0.74266%0.661SS**PPolyproline II helixtrans-75.3164.9-16500000118.5
142P48.9Very low51.5Low125 Ų125108.6 Ų108.681%0.81267%0.669SS**  trans-89.9-178.7-173.340-39.3000113.7
143P43.9Very low50.4Low134 Ų134114.4 Ų114.487%0.8771%0.705SS**  cis-130.6-16810.837.9-16.5000114.1
144G33.7Very low49.4Very low72 Ų72116.6 Ų116.674%0.74271%0.713SS**  cis162.9-161.3-3.600000113.1
145R41.9Very low48Very low232 Ų232118.4 Ų118.488%0.87573%0.725SS**  trans90.4112172.7-69.5-168.5156.2159.9-1.9122.2
146D36Very low47Very low151 Ų151128 Ų12881%0.80776%0.764SS**  53.4130.6122-41.6-27.4000123.7
147G33Very low46.4Very low77 Ų77125.3 Ų125.379%0.79477%0.77SS**  trans167.869.1163.300000121.8
148N32.6Very low45.3Very low157 Ų157128 Ų12884%0.8479%0.787SS**  trans32.8122.9131.2-89.9-3.1000123.8
149L36.4Very low44.4Very low158 Ų158131.3 Ų131.383%0.82780%0.802SS**  156.8153.1114.7-89.1160.9000118
150L41.7Very low43.7Very low154 Ų154134.6 Ų134.681%0.80681%0.813SS**  trans-46.9145.1-176.8-59.9158.8000119.6
151P58.2Low43.1Very low121 Ų121137.7 Ų137.779%0.78682%0.815SS**  trans-106141.5161.436.4-28.7000114.2
152P45.1Very low43.2Very low119 Ų119138.5 Ų138.577%0.77381%0.808SS**PPolyproline II helixtrans-95.3153.6178.836.4-34.6000114.3
153P46.2Very low43.3Very low128 Ų128136.5 Ų136.583%0.83180%0.795SS**PPolyproline II helixtrans-91.3131.7178.933.6-32.8000114.3
154P51.2Low44.2Very low123 Ų123133.3 Ų133.380%0.79977%0.774SS**PPolyproline II helixtrans-91.7170.2177.635.9-34.7000114.6
155P42.3Very low45.5Very low127 Ų127129.9 Ų129.983%0.82574%0.739SS**  trans-99.8-176.8-154.239.2-37.9000117.8
156K44.3Very low46.7Very low208 Ų208120.6 Ų120.690%0.90471%0.709SS**  trans-82.6139.9-164.4-45.2169.8-171.9176.80114.4
157P53.7Low48.5Very low122 Ų122117.4 Ų117.479%0.79269%0.69SS**  trans-109.8149.7167.836.9-29.5000114.4
158P46.7Very low50.5Low129 Ų129113.8 Ų113.884%0.83865%0.653SS**  trans-97.1174.4-175.538.2-36.8000116
159C34.6Very low52.5Low118 Ų118109.6 Ų109.680%0.79763%0.634SS**  trans-80.9154-171.4-46.60000115.8
160Q44.9Very low54.4Low180 Ų180105.6 Ų105.684%0.84162%0.617SS**  trans-173.9138.9139.2-108.3165.970.800115.5
161K44.5Very low56.1Low185 Ų18598.3 Ų98.380%0.80458%0.579SS**SBendtrans58.5133.2166.1-66.4-177.3179176.10119.1P163K161-P163 WeakPolarHBondContact O-CD 3.37Å; K161-P163 VanDerWaalsContact O-N 3.11Å
162C47Very low56.9Low89 Ų8996 Ų9660%0.60156%0.564SS**  trans-56.7105.4-172.8-55.50000113.1C114C114-C162 HydrophobicContact CB-CB 4.33Å; C114-C162 VanDerWaalsContact SG-SG 3.69Å
163P52.5Low58.5Low82 Ų8293.8 Ų93.853%0.53255%0.55SS.*  trans-82.4170.6176.527.3-17.9000110.7K161K161-P163 WeakPolarHBondContact O-CD 3.37Å; K161-P163 VanDerWaalsContact O-N 3.11Å
164P61.4Low60Low67 Ų6787.8 Ų87.844%0.43551%0.511SS..SBendtrans-46.3164.2164.2-28.936.3000113.2P284P164-P284 HydrophobicContact CB-CB 3.94Å
165G61.5Low61.1Low1 Ų185.5 Ų85.51%0.0150%0.496CS..BIsolated β-bridgetrans-43.5132.2169.200000109.6G117 M167 G285G117-G165 WeakPolarHBondContact O-CA 3.44Å; G165-M167 PolarHBondContact O-N 3.02Å; G165-G285 PolarHBondContact N-O 2.98Å; G165-G285 PolarHBondContact O-N 2.89Å
166P66.2Low62.8Low37 Ų3785 Ų8524%0.2448%0.481CS..  trans-58135-167.528.1-32.1000107.2P119 G120 G168P119-P166 WeakPolarHBondContact CA-O 3.4Å; P119-P166 HydrophobicContact CB-CG 4.22Å; P119-P166 HydrophobicContact CG-CG 3.98Å; G120-P166 PolarHBondContact N-O 3.35Å; P166-G168 PolarHBondContact O-N 3.36Å
167M73.8Confident64.2Low84 Ų8475.3 Ų75.341%0.41444%0.44SS..  trans-43.1139.1177.9-164.616361.400108.1G165 R281 G282G165-M167 PolarHBondContact O-N 3.02Å; M167-R281 VanDerWaalsContact C-NE 3.34Å; M167-R281 HydrophobicContact CB-CG 4.16Å; M167-R281 HydrophobicContact CE-CB 3.88Å; M167-R281 HydrophobicContact CE-CG 4.16Å; M167-R281 HydrophobicContact CG-CB 4.01Å; M167-R281 HydrophobicContact CG-CG 3.77Å; M167-R281 PolarHBondContact O-NE 3.27Å; M167-R281 PolarHBondContact O-NH2 3.47Å; M167-R281 HydrophobicContact SD-CB 4.29Å; M167-G282 WeakPolarHBondContact CG-O 3.41Å
168G75.2Confident65.4Low1 Ų176 Ų761%0.0144%0.437CS..PPolyproline II helixtrans-54.1171-166.800000113.1G120 P166 R281 G282G120-G168 WeakPolarHBondContact O-CA 3.24Å; P166-G168 PolarHBondContact O-N 3.36Å; G168-R281 WeakPolarHBondContact O-CD 3.29Å; G168-R281 WeakPolarHBondContact O-CG 3.16Å; G168-R281 PolarHBondContact O-NE 2.98Å; G168-G282 PolarHBondContact N-O 2.9Å
169P74.8Confident66.9Low68 Ų6872.6 Ų72.644%0.44242%0.415SS..PPolyproline II helixtrans-55.9150.2164.426.7-32.8000109.4P122 G123 G171P122-P169 HydrophobicContact CB-CG 4.06Å; P122-P169 HydrophobicContact CG-CG 3.92Å; G123-P169 PolarHBondContact N-O 3.32Å; P169-G171 PolarHBondContact O-N 3.17Å
170P77.5Confident68.7Low74 Ų7467.2 Ų67.248%0.48138%0.379SS..PPolyproline II helixtrans-46.8142.5166.5-27.135.8000110.3P278P170-P278 HydrophobicContact CB-CB 4.03Å
171G77.4Confident70.1Confident1 Ų162.5 Ų62.51%0.0136%0.364CS..EExtended strand (participates in β ladder)trans-57.1153.2172.300000110.1G123 P169 G279G123-G171 VanDerWaalsContact O-CA 3.22Å; G123-G171 WeakPolarHBondContact O-CA 3.48Å; P169-G171 PolarHBondContact O-N 3.17Å; G171-G279 PolarHBondContact N-O 3.4Å; G171-G279 PolarHBondContact O-N 3.35Å; G171-G279 VanDerWaalsContact O-N 3.08Å
172P74.9Confident71.7Confident73 Ų7359.7 Ų59.747%0.47435%0.354SS..EExtended strand (participates in β ladder)trans-53.1149.5175.924.9-34.1000110.1P125 G126 G174P125-P172 HydrophobicContact CB-CG 4.35Å; P125-P172 HydrophobicContact CG-CG 4.29Å; G126-P172 PolarHBondContact N-O 2.89Å; P172-G174 PolarHBondContact O-N 2.84Å
173P77.5Confident72.8Confident73 Ų7355.8 Ų55.847%0.47433%0.328SS..EExtended strand (participates in β ladder)trans-48.3141.1172.8-2634.7000111.2V275 G276P173-V275 HydrophobicContact CB-CG1 3.41Å; P173-V275 VanDerWaalsContact CB-CG1 3.41Å; P173-G276 WeakPolarHBondContact CB-O 3.42Å
174G77.5Confident73.9Confident1 Ų157.7 Ų57.71%0.0133%0.334CS..PPolyproline II helixtrans-61159174.700000110.5G126 P172 V275 G276G126-G174 VanDerWaalsContact O-CA 3.27Å; G126-G174 WeakPolarHBondContact O-CA 3.35Å; P172-G174 PolarHBondContact O-N 2.84Å; G174-V275 WeakPolarHBondContact O-CG1 3.48Å; G174-G276 PolarHBondContact N-O 3.22Å; G174-G276 PolarHBondContact O-N 3.45Å
175P75Confident74.5Confident75 Ų7559 Ų5949%0.48734%0.342SS..PPolyproline II helixtrans-55.7158.5175.227.2-35.2000110.8D128 G129 G276D128-P175 HydrophobicContact CB-CG 4.25Å; D128-P175 WeakPolarHBondContact OD1-CD 3.26Å; D128-P175 WeakPolarHBondContact OD1-CG 3.31Å; G129-P175 PolarHBondContact N-O 3.44Å; P175-G276 PolarHBondContact O-N 3.37Å
176K77.6Confident74.9Confident117 Ų11759.6 Ų59.651%0.50935%0.349SS..BIsolated β-bridgetrans-54.9144.2172.4-73.1-178.3177.5176.80110.1E272 V275K176-E272 HydrophobicContact CD-CB 4.33Å; K176-E272 WeakPolarHBondContact CD-OE2 3.34Å; K176-E272 WeakPolarHBondContact CE-OE2 3.42Å; K176-E272 IonicContact NZ-OE2 2.75Å; K176-E272 PolarHBondContact NZ-OE2 2.93Å; K176-V275 HydrophobicContact CG-CG2 3.86Å
177G74.8Confident75.2Confident4 Ų466.4 Ų66.44%0.04138%0.378CS..PPolyproline II helixtrans-64.4148.2170.500000110.4G129 G273G129-G177 WeakPolarHBondContact O-CA 3.25Å; G177-G273 PolarHBondContact N-O 2.91Å; G177-G273 PolarHBondContact O-N 2.99Å
178L77.3Confident74.8Confident137 Ų13767.2 Ų67.272%0.71739%0.389SS*.PPolyproline II helixtrans-54.6152.6175.1-62.7177.2000111G132G132-L178 PolarHBondContact N-O 3.26Å
179P78.2Confident74.3Confident58 Ų5868.8 Ų68.838%0.37741%0.405SS..PPolyproline II helixtrans-48.2144.5171.3-27.735.5000112.1M269 E272P179-M269 HydrophobicContact CB-CG 4.17Å; P179-M269 HydrophobicContact CB-SD 4.05Å; P179-E272 HydrophobicContact CG-CG 4.44Å
180G73.3Confident73.8Confident4 Ų474.3 Ų74.34%0.04143%0.427CS..BIsolated β-bridgetrans-66.1156.7174.400000111.4G132 G270G132-G180 VanDerWaalsContact O-CA 3.23Å; G132-G180 WeakPolarHBondContact O-CA 3.42Å; G180-G270 PolarHBondContact N-O 3.42Å; G180-G270 PolarHBondContact O-N 3.48Å
181P74.6Confident73Confident82 Ų8276.7 Ų76.753%0.53244%0.436SS..PPolyproline II helixtrans-57.3154.6173.526.9-34.6000110.6P134 G135P134-P181 WeakPolarHBondContact CA-O 3.32Å; P134-P181 HydrophobicContact CB-CG 4.02Å; P134-P181 HydrophobicContact CG-CG 3.97Å; G135-P181 PolarHBondContact N-O 3.44Å
182Q77.1Confident72Confident126 Ų12678.1 Ų78.159%0.58945%0.451SS*.PPolyproline II helixtrans-57.3141.8176.6-169.8173.50.400110.8P266 G267Q182-P266 VanDerWaalsContact NE2-CB 3.29Å; Q182-G267 WeakPolarHBondContact CG-O 3.3Å; Q182-G267 PolarHBondContact NE2-O 3.03Å; Q182-G267 VanDerWaalsContact NE2-O 3.08Å
183G71.3Confident71.3Confident7 Ų778.9 Ų78.97%0.07246%0.463CS..PPolyproline II helixtrans-67.2150176.100000112.4G135 G267 D268G135-G183 VanDerWaalsContact O-CA 3.22Å; G135-G183 WeakPolarHBondContact O-CA 3.27Å; G183-G267 PolarHBondContact O-N 3.47Å; G183-D268 PolarHBondContact N-O 3.16Å; G183-D268 VanDerWaalsContact N-O 3.14Å
184D75.2Confident70.2Confident121 Ų12180.9 Ų80.965%0.64748%0.476SS*.PPolyproline II helixtrans-59.4149.4176.3-63.4-62.1000111.5
185P73.4Confident69Low94 Ų9482.3 Ų82.361%0.6149%0.491SS*.PPolyproline II helixtrans-57.3145.3176.8-23.634000112.6
186G69.7Low68.3Low15 Ų1589.9 Ų89.916%0.15551%0.51CS..PPolyproline II helixtrans-61.2147.2174.700000112.8G264 D265G186-G264 PolarHBondContact O-N 3.04Å; G186-D265 PolarHBondContact N-O 3.45Å
187E73.1Confident67.5Low180 Ų18089.9 Ų89.984%0.84152%0.522SS*.PPolyproline II helixtrans-57.4147.3177.4-64.8-174.2112.600111.5
188P66.4Low66.7Low101 Ų10191.2 Ų91.266%0.65654%0.535SS*.PPolyproline II helixtrans-56.3140.3178.3-25.134.6000112.5M190P188-M190 PolarHBondContact O-N 3.48Å
189G64.1Low65.7Low33 Ų3390.7 Ų90.734%0.3454%0.54SS..PPolyproline II helixtrans-59.5136.6174.700000111.8G261G189-G261 PolarHBondContact O-N 3.19Å
190M64.8Low64.8Low184 Ų18496.1 Ų96.191%0.90656%0.561SS**PPolyproline II helixtrans-54.6148.8-179.2-62.3-175.274.600112.4P188P188-M190 PolarHBondContact O-N 3.48Å
191D59.7Low64.3Low124 Ų12497.3 Ų97.366%0.66357%0.573SS**PPolyproline II helixtrans-53.2138.6-179.1-67.5-36.9000112.8A193D191-A193 PolarHBondContact O-N 3.29Å
192G56.1Low63.8Low32 Ų3299 Ų9933%0.3358%0.584SS.*PPolyproline II helixtrans-61.2135.3177.200000111.8
193A60.5Low63.3Low88 Ų8899.2 Ų99.273%0.72760%0.596SS**PPolyproline II helixtrans-53.8145.8-179.300000112.2D191D191-A193 PolarHBondContact O-N 3.29Å
194P55.4Low63Low116 Ų116101 Ų10175%0.75362%0.615SS**PPolyproline II helixtrans-52.5140.8-178.7-28.335.2000113.3
195G52.2Low62.5Low31 Ų31100.8 Ų100.832%0.3262%0.62SS.*PPolyproline II helixtrans-56.3141.5175.900000111.7
196R60.2Low62.2Low234 Ų234102.2 Ų102.288%0.88363%0.629SS**PPolyproline II helixtrans-59.5147.8176.3-70.5-174.5175.5-171.6-1.3110.5
197P60.5Low61.8Low116 Ų116104.1 Ų104.175%0.75365%0.648SS**PPolyproline II helixtrans-51.6142.1173.2-26.634.9000111.9
198G57.6Low61.3Low32 Ų32103.1 Ų103.133%0.3365%0.647SS.*PPolyproline II helixtrans-62.3154175.800000111.9
199P56.5Low61.3Low126 Ų126104.1 Ų104.182%0.81865%0.654SS**PPolyproline II helixtrans-62.1150.3175.628.1-34.9000111.1G201P199-G201 PolarHBondContact O-N 3.49Å
200Q59.6Low61.1Low173 Ų173105.3 Ų105.381%0.80867%0.667SS**PPolyproline II helixtrans-55.5133.4176.9-176.9172.251.900111
201G62.4Low60.7Low29 Ų29105.9 Ų105.930%0.29967%0.667SS.*PPolyproline II helixtrans-60.2152.1177.100000112.6P199P199-G201 PolarHBondContact O-N 3.49Å
202P63.2Low60.8Low118 Ų118104.8 Ų104.877%0.76668%0.675SS**PPolyproline II helixtrans-62.1153.2-178.527.2-35.3000112
203P67.6Low61Low130 Ų130106.5 Ų106.584%0.84469%0.692SS**PPolyproline II helixtrans-55.4140175.7-25.134.5000112.5
204G65.1Low60.7Low45 Ų45111.6 Ų111.646%0.46470%0.701SS.*PPolyproline II helixtrans-60.1154.9176.100000112.9
205P65.1Low61.2Low115 Ų115115.7 Ų115.775%0.74771%0.707SS**PPolyproline II helixtrans-62.4156.7-178.326.8-35.1000112.1G207P205-G207 PolarHBondContact O-N 3.36Å
206P67.1Low61.7Low125 Ų125116.8 Ų116.881%0.81272%0.719SS**PPolyproline II helixtrans-55.5138.8173.8-23.634000111.9
207G61.4Low61.6Low54 Ų54111.3 Ų111.356%0.55771%0.714SS**PPolyproline II helixtrans-60.5149.1173.800000112P205P205-G207 PolarHBondContact O-N 3.36Å
208I62Low61.9Low159 Ų159112 Ų11282%0.81572%0.718SS**PPolyproline II helixtrans-56.3143.8177.153.7175.2000111.5G210I208-G210 PolarHBondContact O-N 3.45Å
209P65.3Low62.1Low122 Ų122113.9 Ų113.979%0.79274%0.737SS**PPolyproline II helixtrans-56.5137.9171.8-23.534.2000110.9
210G60Low61.8Low59 Ų59116.8 Ų116.861%0.60874%0.74SS**PPolyproline II helixtrans-62.9147173.700000111.5I208I208-G210 PolarHBondContact O-N 3.45Å
211E57.6Low61.7Low196 Ų196114.7 Ų114.792%0.91674%0.741SS**PPolyproline II helixtrans-60.8149.1178.4-62.8-170121.300111.5G213E211-G213 PolarHBondContact O-N 2.93Å
212A61.9Low61.5Low101 Ų101116.5 Ų116.584%0.83576%0.76SS**PPolyproline II helixtrans-64.5126.3-179.500000110.1E214A212-E214 PolarHBondContact O-N 3.35Å
213G60.1Low60.8Low67 Ų67120.3 Ų120.369%0.69177%0.765SS**PPolyproline II helixtrans-56138.4178.800000111.9E211E211-G213 PolarHBondContact O-N 2.93Å
214E55.1Low59.7Low195 Ų195119.8 Ų119.891%0.91176%0.759SS**PPolyproline II helixtrans-55.8142.5-178.2-67.2-169.4107.500111.7A212 G216A212-E214 PolarHBondContact O-N 3.35Å; E214-G216 PolarHBondContact O-N 2.98Å; E214-G216 VanDerWaalsContact O-N 3.16Å
215K64.3Low59.1Low202 Ų202125.1 Ų125.188%0.87878%0.775SS**PPolyproline II helixtrans-60.3121177.7178.5-178.8-70.5177.50108.8
216G63.2Low58.3Low55 Ų55126.1 Ų126.157%0.56777%0.774SS**PPolyproline II helixtrans-52.2144.6176.400000111.9E214E214-G216 PolarHBondContact O-N 2.98Å; E214-G216 VanDerWaalsContact O-N 3.16Å
217P58Low57.7Low119 Ų119127.3 Ų127.377%0.77378%0.78SS**PPolyproline II helixtrans-58.5147.6-174.724-34000111.3G219P217-G219 PolarHBondContact O-N 3.41Å
218P66.6Low57.5Low129 Ų129129 Ų12984%0.83879%0.788SS**PPolyproline II helixtrans-53.9133173.8-24.234000110.8
219G62.3Low57Low72 Ų72127 Ų12774%0.74279%0.786SS**PPolyproline II helixtrans-57.6143.5177.900000111.7P217P217-G219 PolarHBondContact O-N 3.41Å
220E50.8Low56.7Low188 Ų188127.4 Ų127.488%0.87979%0.788SS**PPolyproline II helixtrans-55138.2-177.3-74-177.289.100111.8G222E220-G222 PolarHBondContact O-N 3.01Å
221P57.3Low57Low128 Ų128127.7 Ų127.783%0.83179%0.791SS**  trans-58112.2178.5-25.534.8000112K223P221-K223 PolarHBondContact O-N 3.02Å
222G57.6Low57.1Low68 Ų68124.1 Ų124.170%0.70179%0.785SS**  trans-55.1126.1173.200000110.8E220 V224E220-G222 PolarHBondContact O-N 3.01Å; G222-V224 PolarHBondContact O-N 2.87Å; G222-V224 VanDerWaalsContact O-N 3.12Å
223K48.2Very low57.4Low197 Ų197125.4 Ų125.486%0.85779%0.785SS**  trans-51.9117.7-176.9-173.4178.5-178.3-178.70110.6P221 I225P221-K223 PolarHBondContact O-N 3.02Å; K223-I225 PolarHBondContact O-N 3.37Å
224V44.8Very low57.7Low120 Ų120125.8 Ų125.873%0.72779%0.789SS**  trans-62.4103.7-170.4-178.20000111.7G222G222-V224 PolarHBondContact O-N 2.87Å; G222-V224 VanDerWaalsContact O-N 3.12Å
225I52.4Low58.1Low156 Ų156121.7 Ų121.780%0.878%0.782SS**  trans-12782.6158.946.8170.9000108.3K223K223-I225 PolarHBondContact O-N 3.37Å
226N49.4Very low58.3Low136 Ų136117.9 Ų117.973%0.72778%0.778SS**SBendtrans-0.7124.5-179-57.8-6.4000119.4
227T54.4Low58.3Low151 Ų151118.4 Ų118.493%0.92678%0.783SS**  trans88.942.3164.7-20.60000117.7
228A56.1Low58.6Low89 Ų89120.7 Ų120.774%0.73679%0.788SS**  trans-118136.2160.500000110.6
229P51.2Low58.7Low118 Ų118120.4 Ų120.477%0.76679%0.786SS**PPolyproline II helixtrans-72.3157.4-179.529.4-34.5000112.5
230P60.2Low58.7Low129 Ų129119.3 Ų119.384%0.83878%0.775SS**PPolyproline II helixtrans-57.2145.8178.9-25.234.9000113.5
231G65Low59.4Low66 Ų66116.4 Ų116.468%0.6877%0.772SS**PPolyproline II helixtrans-62.1149.6176.400000112.7
232P60.8Low59.9Low121 Ų121121.4 Ų121.479%0.78677%0.774SS**PPolyproline II helixtrans-64.7150.5-17827.1-34.8000111.9
233P68.6Low60.3Low127 Ų127119.9 Ų119.983%0.82576%0.759SS**PPolyproline II helixtrans-56.4142.8174.4-24.434.3000112.5
234G66.4Low61.2Low75 Ų75116 Ų11677%0.77375%0.754SS**PPolyproline II helixtrans-59.6145.3174.100000112.2
235S61.6Low62.4Low110 Ų110116 Ų11677%0.76976%0.756SS**PPolyproline II helixtrans-61.7146.317952.60000112
236P68.7Low63Low122 Ų122110.5 Ų110.579%0.79274%0.738SS**PPolyproline II helixtrans-53.7143.6174.5-25.534.6000112.7
237G64.6Low63.8Low66 Ų66109.5 Ų109.568%0.6874%0.739SS**PPolyproline II helixtrans-61.2147.6173.100000111.8
238L63.1Low64.6Low166 Ų166107.6 Ų107.687%0.86973%0.729SS**PPolyproline II helixtrans-64.4145.9176.3-65.2176.1000110.6G240L238-G240 PolarHBondContact O-N 2.87Å
239P68.3Low64.9Low123 Ų123105 Ų10580%0.79971%0.71SS**PPolyproline II helixtrans-54.9137.7172.8-25.234.5000111.9
240G63.8Low65.4Low49 Ų49108 Ų10851%0.50571%0.714SS.*PPolyproline II helixtrans-59.7151.7176.100000112.4L238L238-G240 PolarHBondContact O-N 2.87Å
241P65.9Low65.7Low127 Ų127109.6 Ų109.683%0.82572%0.715SS**PPolyproline II helixtrans-61.7148.2-179.626.5-34.6000111.6G243P241-G243 PolarHBondContact O-N 2.89Å
242R67.7Low65.3Low234 Ų234108 Ų10888%0.88370%0.699SS**PPolyproline II helixtrans-56.2126.3175.1177.1179.3173.4173.50.4110
243G64.8Low65.2Low36 Ų36110.1 Ų110.137%0.37170%0.702SS.*PPolyproline II helixtrans-57.8152.4174.400000112.7P241P241-G243 PolarHBondContact O-N 2.89Å
244P67Low64.8Low116 Ų116107.5 Ų107.575%0.75369%0.692SS**PPolyproline II helixtrans-60.8155.4-17726.3-35000112
245P70.5Confident64.4Low119 Ų119105.5 Ų105.577%0.77367%0.671SS**PPolyproline II helixtrans-54.4141.6170.9-23.334000111.5
246G65.1Low64.2Low40 Ų40105.7 Ų105.741%0.41267%0.67SS.*PPolyproline II helixtrans-60.9156.6171.400000111.8
247P66.8Low64.1Low115 Ų115104.8 Ų104.875%0.74766%0.664SS**PPolyproline II helixtrans-60.3152.8179.526.6-34.9000111.5
248P69.6Low63.8Low112 Ų112103 Ų10373%0.72765%0.645SS**PPolyproline II helixtrans-54.5140.9172.8-24.534.4000111.8
249G62.4Low63.6Low33 Ų33100.5 Ų100.534%0.3464%0.639SS.*PPolyproline II helixtrans-61142.717200000111.2
250H61.9Low63.6Low183 Ų18399.1 Ų99.185%0.84763%0.63SS**PPolyproline II helixtrans-57.6146.5178.4-45.7-88000111.5G252H250-G252 PolarHBondContact O-N 3.26Å
251D66.3Low63.8Low161 Ų16198 Ų9886%0.86162%0.618SS**PPolyproline II helixtrans-58.5136.2174.7-67.4-44.8000111I253D251-I253 PolarHBondContact O-N 3.17Å
252G57.9Low63.8Low34 Ų3497.2 Ų97.235%0.35161%0.613SS.*PPolyproline II helixtrans-63.5130.5176.600000110.9H250 A254H250-G252 PolarHBondContact O-N 3.26Å; G252-A254 PolarHBondContact O-N 2.71Å
253I57.7Low64Low164 Ų16491.2 Ų91.284%0.84160%0.604SS**PPolyproline II helixtrans-52.1131.4176.8-57.8173000109D251 G255D251-I253 PolarHBondContact O-N 3.17Å; I253-G255 PolarHBondContact O-N 3.38Å
254A60.1Low64.2Low73 Ų7390.7 Ų90.760%0.60360%0.599SS**PPolyproline II helixtrans-55.1133.617800000110.5G252G252-A254 PolarHBondContact O-N 2.71Å
255G58.4Low64.4Low33 Ų3391.7 Ų91.734%0.3460%0.598SS.*PPolyproline II helixtrans-58.1146.4175.300000110.8I253I253-G255 PolarHBondContact O-N 3.38Å
256P56.9Low64.5Low114 Ų11490.3 Ų90.374%0.7459%0.589SS**PPolyproline II helixtrans-57.1152.8178.625.9-34.8000110.8
257P66.9Low64.8Low103 Ų10388.5 Ų88.567%0.66957%0.57SS**PPolyproline II helixtrans-50.5144.9171.2-25.934.8000111.3
258G59.4Low65.2Low27 Ų2789 Ų8928%0.27857%0.567SS.*PPolyproline II helixtrans-59.7152.1172.100000110.7
259P57.4Low65.5Low115 Ų11590.5 Ų90.575%0.74757%0.566SS**PPolyproline II helixtrans-57.9150.2173.827-34.7000110.3
260P70.1Confident66Low94 Ų9489 Ų8961%0.6155%0.551SS**PPolyproline II helixtrans-52148.4173.3-27.335.5000111.7
261G66.7Low66.6Low25 Ų2584 Ų8426%0.25854%0.541SS..PPolyproline II helixtrans-58.6154.617500000111.6G189G189-G261 PolarHBondContact O-N 3.19Å
262P65.4Low67.2Low110 Ų11081.9 Ų81.971%0.71453%0.526SS*.PPolyproline II helixtrans-56.8152.8172.226.7-34.4000110.4
263P72Confident67.9Low108 Ų10880.3 Ų80.370%0.70151%0.51SS*.PPolyproline II helixtrans-53.2143.4170.7-2434.1000110.8
264G69.8Low68.9Low25 Ų2577 Ų7726%0.25850%0.499SS..PPolyproline II helixtrans-61.1150.4174.200000111.4G186G186-G264 PolarHBondContact O-N 3.04Å
265D70.3Confident69.8Low138 Ų13877.5 Ų77.574%0.73849%0.494SS*.PPolyproline II helixtrans-54.9148.8178.3-70.1-56.2000111.3G186 G267G186-D265 PolarHBondContact N-O 3.45Å; D265-G267 PolarHBondContact O-N 3.27Å
266P72.7Confident70.6Confident89 Ų8976 Ų7658%0.57848%0.479SS*.PPolyproline II helixtrans-56.8137.4173.6-22.333.2000110.8Q182Q182-P266 VanDerWaalsContact NE2-CB 3.29Å
267G72.3Confident71.6Confident3 Ų374.9 Ų74.93%0.03147%0.472CS..PPolyproline II helixtrans-57.4149.7175.800000111.9Q182 G183 D265Q182-G267 WeakPolarHBondContact CG-O 3.3Å; Q182-G267 PolarHBondContact NE2-O 3.03Å; Q182-G267 VanDerWaalsContact NE2-O 3.08Å; G183-G267 PolarHBondContact O-N 3.47Å; D265-G267 PolarHBondContact O-N 3.27Å
268D75.4Confident72.1Confident125 Ų12574 Ų7467%0.66847%0.466SS*.PPolyproline II helixtrans-58159.2177.7-74.9-47.9000111.4G135 G183 G270G135-D268 VanDerWaalsContact CA-O 3.25Å; G135-D268 WeakPolarHBondContact CA-O 3.43Å; G183-D268 PolarHBondContact N-O 3.16Å; G183-D268 VanDerWaalsContact N-O 3.14Å; D268-G270 PolarHBondContact O-N 3.41Å
269M75.8Confident73.1Confident143 Ų14372.9 Ų72.970%0.70445%0.454SS*.PPolyproline II helixtrans-66134.1167.2-177.8169.859.600109.8P179 A271P179-M269 HydrophobicContact CB-CG 4.17Å; P179-M269 HydrophobicContact CB-SD 4.05Å; M269-A271 PolarHBondContact O-N 3.22Å
270G72.5Confident74.1Confident3 Ų371.6 Ų71.63%0.03145%0.446CS..BIsolated β-bridgetrans-58.2135.1177.600000111.9A133 G180 D268A133-G270 WeakPolarHBondContact O-CA 3.18Å; G180-G270 PolarHBondContact N-O 3.42Å; G180-G270 PolarHBondContact O-N 3.48Å; D268-G270 PolarHBondContact O-N 3.41Å
271A74.3Confident74.5Confident78 Ų7873.1 Ų73.165%0.64544%0.44SS*.PPolyproline II helixtrans-54.9152.417900000111.8G132 M269 G273G132-A271 VanDerWaalsContact CA-O 3.24Å; G132-A271 WeakPolarHBondContact CA-O 3.46Å; M269-A271 PolarHBondContact O-N 3.22Å; A271-G273 PolarHBondContact O-N 2.86Å
272E78.1Confident75Confident115 Ų11572 Ų7254%0.53743%0.428SS..PPolyproline II helixtrans-51.9139.3175.1-69.5-176.7142.600111.6K176 P179K176-E272 HydrophobicContact CD-CB 4.33Å; K176-E272 WeakPolarHBondContact CD-OE2 3.34Å; K176-E272 WeakPolarHBondContact CE-OE2 3.42Å; K176-E272 IonicContact NZ-OE2 2.75Å; K176-E272 PolarHBondContact NZ-OE2 2.93Å; P179-E272 HydrophobicContact CG-CG 4.44Å
273G74.4Confident75.6Confident2 Ų270.4 Ų70.42%0.02142%0.418CS..PPolyproline II helixtrans-61.3148177.100000111.9R130 G177 A271R130-G273 WeakPolarHBondContact O-CA 3.33Å; G177-G273 PolarHBondContact N-O 2.91Å; G177-G273 PolarHBondContact O-N 2.99Å; A271-G273 PolarHBondContact O-N 2.86Å
274P76.9Confident75.7Confident93 Ų9369 Ų6960%0.60441%0.409SS*.PPolyproline II helixtrans-56.4148.3176.626.3-34.8000110.4G129 G276G129-P274 WeakPolarHBondContact CA-O 3.22Å; P274-G276 PolarHBondContact O-N 3.49Å
275V79.2Confident75.7Confident84 Ų8468 Ų6851%0.50940%0.398SS..BIsolated β-bridgetrans-51.9134.1174.9-176.50000109.5P173 G174 K176P173-V275 HydrophobicContact CB-CG1 3.41Å; P173-V275 VanDerWaalsContact CB-CG1 3.41Å; G174-V275 WeakPolarHBondContact O-CG1 3.48Å; K176-V275 HydrophobicContact CG-CG2 3.86Å
276G76.4Confident75.6Confident2 Ų269.7 Ų69.72%0.02140%0.399CS..PPolyproline II helixtrans-57.5146.9-179.500000112.4R127 P173 G174 P175 P274R127-G276 WeakPolarHBondContact O-CA 3.08Å; P173-G276 WeakPolarHBondContact CB-O 3.42Å; G174-G276 PolarHBondContact N-O 3.22Å; G174-G276 PolarHBondContact O-N 3.45Å; P175-G276 PolarHBondContact O-N 3.37Å; P274-G276 PolarHBondContact O-N 3.49Å
277P77.1Confident75.2Confident90 Ų9070.8 Ų70.858%0.58441%0.406SS*.PPolyproline II helixtrans-56.9148.1178.726.5-34.8000110.3G126 G279G126-P277 WeakPolarHBondContact CA-O 2.99Å; P277-G279 PolarHBondContact O-N 2.93Å
278P78.7Confident74.4Confident85 Ų8572 Ų7255%0.55242%0.419SS*.EExtended strand (participates in β ladder)trans-48.7141.6175.3-28.335.3000112.4P170P170-P278 HydrophobicContact CB-CB 4.03Å
279G78.6Confident73.4Confident3 Ų369.3 Ų69.33%0.03141%0.41CS..EExtended strand (participates in β ladder)trans-59.8153.7-179.200000112.7P124 G171 P277 R281P124-G279 WeakPolarHBondContact O-CA 3.29Å; G171-G279 PolarHBondContact N-O 3.4Å; G171-G279 PolarHBondContact O-N 3.35Å; G171-G279 VanDerWaalsContact O-N 3.08Å; P277-G279 PolarHBondContact O-N 2.93Å; G279-R281 PolarHBondContact O-N 2.88Å
280P79.1Confident72.3Confident89 Ų8966.1 Ų66.158%0.57840%0.401SS*.PPolyproline II helixtrans-53.8140.7175.426.9-34.9000109G123 P124 G282G123-P280 VanDerWaalsContact CA-O 3.32Å; G123-P280 WeakPolarHBondContact CA-O 3.28Å; P124-P280 HydrophobicContact CG-CG 3.98Å; P280-G282 PolarHBondContact O-N 3.34Å
281R79.9Confident71.5Confident125 Ų12571.7 Ų71.747%0.47243%0.43SS..PPolyproline II helixtrans-57.2129.8-174.8-157.7174.8165.9-165.8-5.4110M167 G168 G279M167-R281 VanDerWaalsContact C-NE 3.34Å; M167-R281 HydrophobicContact CB-CG 4.16Å; M167-R281 HydrophobicContact CE-CB 3.88Å; M167-R281 HydrophobicContact CE-CG 4.16Å; M167-R281 HydrophobicContact CG-CB 4.01Å; M167-R281 HydrophobicContact CG-CG 3.77Å; M167-R281 PolarHBondContact O-NE 3.27Å; M167-R281 PolarHBondContact O-NH2 3.47Å; M167-R281 HydrophobicContact SD-CB 4.29Å; G168-R281 WeakPolarHBondContact O-CD 3.29Å; G168-R281 WeakPolarHBondContact O-CG 3.16Å; G168-R281 PolarHBondContact O-NE 2.98Å; G279-R281 PolarHBondContact O-N 2.88Å
282G77.1Confident70.4Confident1 Ų176 Ų761%0.0144%0.436CS..PPolyproline II helixtrans-61.4156.1-176.500000112.2P121 M167 G168 P280P121-G282 WeakPolarHBondContact O-CA 3.23Å; M167-G282 WeakPolarHBondContact CG-O 3.41Å; G168-G282 PolarHBondContact N-O 2.9Å; P280-G282 PolarHBondContact O-N 3.34Å
283P76.6Confident68.7Low78 Ų7874.5 Ų74.551%0.50644%0.438SS..PPolyproline II helixtrans-54.1156-169.422.9-34.3000112.7G120 P121 G285G120-P283 WeakPolarHBondContact CA-O 3.44Å; P121-P283 HydrophobicContact CG-CG 4.35Å; P283-G285 PolarHBondContact O-N 3.42Å
284P75.3Confident67.4Low78 Ų7879.6 Ų79.651%0.50647%0.47SS..PPolyproline II helixtrans-48.4138.9174.3-2835.9000112.5P164P164-P284 HydrophobicContact CB-CB 3.94Å
285G69.5Low65.9Low4 Ų480.3 Ų80.34%0.04148%0.475CS..BIsolated β-bridgetrans-60.5155.1172.700000110.7P118 G165 P283P118-G285 WeakPolarHBondContact O-CA 3.32Å; G165-G285 PolarHBondContact N-O 2.98Å; G165-G285 PolarHBondContact O-N 2.89Å; P283-G285 PolarHBondContact O-N 3.42Å
286K67.6Low64.3Low173 Ų17381.2 Ų81.275%0.75248%0.483SS*.PPolyproline II helixtrans-53142.6176.2-65.7-173.2179.5-176.90109.3G117 G288G117-K286 WeakPolarHBondContact CA-O 3.32Å; K286-G288 PolarHBondContact O-N 2.73Å
287P63.6Low62.5Low112 Ų11292.9 Ų92.973%0.72753%0.526SS*.PPolyproline II helixtrans-50.5135.7175.4-27.335.3000111
288G56.8Low60.8Low28 Ų2893.8 Ų93.829%0.28953%0.53SS..PPolyproline II helixtrans-64.7143.9176.900000111.2Q115 K286 C290Q115-G288 WeakPolarHBondContact O-CA 3.39Å; K286-G288 PolarHBondContact O-N 2.73Å; G288-C290 PolarHBondContact O-N 3.3Å
289S55Low59.1Low70 Ų7099.3 Ų99.349%0.4955%0.549SS..PPolyproline II helixtrans-75.6122.5173.348.60000110D291S289-D291 VanDerWaalsContact CB-OD2 3.26Å; S289-D291 WeakPolarHBondContact CB-OD2 3.47Å; S289-D291 PolarHBondContact O-N 3.39Å; S289-D291 VanDerWaalsContact O-N 3.08Å; S289-D291 PolarHBondContact OG-OD2 2.96Å
290C51.4Low57.3Low75 Ų75103.9 Ų103.951%0.50758%0.58SS.*  trans-83.366.7171.1-60.50000109.4G288 H292 C293G288-C290 PolarHBondContact O-N 3.3Å; C290-H292 PolarHBondContact O-N 3.1Å; C290-C293 HydrophobicContact CB-CB 4.2Å; C290-C293 PolarHBondContact O-N 2.9Å
291D55.2Low55.3Low120 Ų120103.4 Ų103.464%0.64259%0.591SS**THydrogen-bonded Turntrans-63.7-11-171.5-67.6-59000114.1S289S289-D291 VanDerWaalsContact CB-OD2 3.26Å; S289-D291 WeakPolarHBondContact CB-OD2 3.47Å; S289-D291 PolarHBondContact O-N 3.39Å; S289-D291 VanDerWaalsContact O-N 3.08Å; S289-D291 PolarHBondContact OG-OD2 2.96Å
292H51.4Low53.4Low169 Ų169106 Ų10678%0.78261%0.606SS**THydrogen-bonded Turntrans-125.737177.9-74.125.3000112.9C290 P294C290-H292 PolarHBondContact O-N 3.1Å; H292-P294 VanDerWaalsContact O-CD 3.22Å; H292-P294 WeakPolarHBondContact O-CD 3.38Å
293C42.5Very low51.6Low84 Ų84112.6 Ų112.657%0.56864%0.637SS**  trans-98.192.8159.6-156.20000108.6C290C290-C293 HydrophobicContact CB-CB 4.2Å; C290-C293 PolarHBondContact O-N 2.9Å
294P48.1Very low49.9Very low108 Ų108115.6 Ų115.670%0.70166%0.66SS**PPolyproline II helixtrans-56.8129.4168.925.2-32.7000107.3H292H292-P294 VanDerWaalsContact O-CD 3.22Å; H292-P294 WeakPolarHBondContact O-CD 3.38Å
295P45.6Very low48Very low109 Ų109114.1 Ų114.171%0.70866%0.658SS**PPolyproline II helixtrans-59146.3-171.523.9-33.7000109.8R297P295-R297 PolarHBondContact O-N 2.98Å
296P44.1Very low46.6Very low103 Ų103123.6 Ų123.667%0.66969%0.694SS**PPolyproline II helixtrans-53.5136.2174.824.7-33.8000108.3T298P296-T298 PolarHBondContact O-N 3.25Å
297R40Very low45.5Very low246 Ų246127 Ų12793%0.92870%0.702SS**  trans-6287.3176.6-71.6-176.8-180178.2-0109.1P295 E299P295-R297 PolarHBondContact O-N 2.98Å; R297-E299 PolarHBondContact O-N 2.65Å
298T41.8Very low44.4Very low110 Ų110130.1 Ų130.168%0.67571%0.705SS**  trans-79.7111.9169.144.10000107.5P296 S300P296-T298 PolarHBondContact O-N 3.25Å; T298-S300 PolarHBondContact O-N 3.04Å
299E42.9Very low43.3Very low201 Ų201138.6 Ų138.694%0.93973%0.733SS**SBendtrans-67.778.6176.7-63.8-177.8124.800110.8R297R297-E299 PolarHBondContact O-N 2.65Å
300S40.3Very low42.7Very low98 Ų98146.8 Ų146.869%0.68577%0.77SS**  trans-165.349.4173.246.10000112.2T298 F302T298-S300 PolarHBondContact O-N 3.04Å; S300-F302 VanDerWaalsContact C-N 3.32Å; S300-F302 PolarHBondContact O-N 2.92Å
301G36Very low42.3Very low79 Ų79150.4 Ų150.481%0.81478%0.784SS**  trans-71.285.5163.900000111.4
302F40.5Very low41.6Very low180 Ų180151.9 Ų151.979%0.78979%0.791SS**  trans-162.983.4134.2-136.7-108.5000112.6S300S300-F302 VanDerWaalsContact C-N 3.32Å; S300-F302 PolarHBondContact O-N 2.92Å
303E39.4Very low41.1Very low139 Ų139151 Ų15165%0.6579%0.791SS**  60.176118.1-153175.7144.700118.6G305E303-G305 PolarHBondContact O-N 3.3Å
304S40.4Very low41Very low142 Ų142154.9 Ų154.999%0.99381%0.805SS**  trans-7465.6158.4-163.10000110.8
305G37.1Very low40.5Very low46 Ų46157.9 Ų157.947%0.47481%0.811SS.*  trans-99.4-9.7-174.300000115.6E303 R307E303-G305 PolarHBondContact O-N 3.3Å; G305-R307 VanDerWaalsContact C-N 3.27Å; G305-R307 PolarHBondContact O-N 2.92Å
306Y39.3Very low40.2Very low204 Ų204161.1 Ų161.180%0.882%0.818SS**  trans-80.663.1-172.6-86.1-82.4000114.4K308Y306-K308 HydrophobicContact CD1-CG 4.33Å; Y306-K308 PolarHBondContact O-N 2.82Å
307R43.4Very low39.9Very low244 Ų244165.3 Ų165.392%0.92183%0.829SS**  trans-77.671.3163.6-160.4178.9-165.7-175.55.4109.9G305 K309G305-R307 VanDerWaalsContact C-N 3.27Å; G305-R307 PolarHBondContact O-N 2.92Å; R307-K309 PolarHBondContact O-N 3.03Å; R307-K309 VanDerWaalsContact O-N 3.1Å
308K41.5Very low39.9Very low178 Ų178159.1 Ų159.177%0.77482%0.821SS**  trans-60.1113.1175.7-79.5-172.4175.4-179.50110Y306Y306-K308 HydrophobicContact CD1-CG 4.33Å; Y306-K308 PolarHBondContact O-N 2.82Å
309K34.3Very low39.7Very low205 Ų205163.2 Ų163.289%0.89183%0.833SS**  trans-72.4121.2153.5-77.5-175.9173.1-175.30108R307R307-K309 PolarHBondContact O-N 3.03Å; R307-K309 VanDerWaalsContact O-N 3.1Å
310L41.9Very low39.5Very low242 Ų242159.7 Ų159.7100%1.26782%0.824SS**  trans-161.80149.4-104.4163.2000106.7

Retrieved 310 of 310 residues in 121.3 ms (Link to these results)