A0A087YFF2_POEFO Loading...

Procollagen, type IX, alpha 2

AlphaFold DB , UniProt , Accession A0A087YFF2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 688 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
1M67.8Low82.7Confident202 Ų202110.2 Ų110.2100%0.99561%0.614SS**  0-64.70-62.4-51.5-97.400113.3A3 L4 S5M1-A3 PolarHBondContact O-N 3.05Å; M1-L4 PolarHBondContact O-N 3.13Å; M1-L4 VanDerWaalsContact O-N 3.14Å; M1-S5 PolarHBondContact O-N 3.14Å; M1-S5 VanDerWaalsContact O-N 3.13Å
2A72.8Confident83.4Confident84 Ų84107.2 Ų107.269%0.69460%0.601SS**Hα-helixtrans-53.9-48-174.300000114.9L4 S5 A6A2-L4 VanDerWaalsContact C-N 3.33Å; A2-L4 PolarHBondContact O-N 3.32Å; A2-S5 WeakPolarHBondContact O-CB 3.3Å; A2-S5 PolarHBondContact O-N 3.34Å; A2-A6 PolarHBondContact O-N 3.27Å
3A75.5Confident83.9Confident73 Ų73107.2 Ų107.260%0.60360%0.597SS**Hα-helixtrans-61.3-37.2178.800000113.6M1 A6 L7M1-A3 PolarHBondContact O-N 3.05Å; A3-A6 PolarHBondContact O-N 3.26Å; A3-L7 PolarHBondContact O-N 3.25Å
4L80.4Confident84.2Confident120 Ų120106.7 Ų106.763%0.62859%0.592SS**Hα-helixtrans-68.4-37.8177.2-160.578.1000111.3M1 A2 L7 L8M1-L4 PolarHBondContact O-N 3.13Å; M1-L4 VanDerWaalsContact O-N 3.14Å; A2-L4 VanDerWaalsContact C-N 3.33Å; A2-L4 PolarHBondContact O-N 3.32Å; L4-L7 PolarHBondContact O-N 2.99Å; L4-L8 PolarHBondContact O-N 3.45Å
5S85.9Confident84.5Confident63 Ų63106.4 Ų106.444%0.44158%0.584SS.*Hα-helixtrans-64.6-39.4174-171.80000111.9M1 A2 K9M1-S5 PolarHBondContact O-N 3.14Å; M1-S5 VanDerWaalsContact O-N 3.13Å; A2-S5 WeakPolarHBondContact O-CB 3.3Å; A2-S5 PolarHBondContact O-N 3.34Å; S5-K9 WeakPolarHBondContact O-CB 3.46Å; S5-K9 VanDerWaalsContact O-CG 3.3Å; S5-K9 WeakPolarHBondContact O-CG 3.46Å; S5-K9 PolarHBondContact O-N 2.9Å
6A85.6Confident84.5Confident55 Ų55104.9 Ų104.946%0.45558%0.579SS.*Hα-helixtrans-63.9-47.1174.900000111.9A2 A3 L8 K9 T10A2-A6 PolarHBondContact O-N 3.27Å; A3-A6 PolarHBondContact O-N 3.26Å; A6-L8 PolarHBondContact O-N 3.47Å; A6-K9 PolarHBondContact O-N 3.05Å; A6-T10 PolarHBondContact O-N 2.95Å; A6-T10 PolarHBondContact O-OG1 3.47Å
7L86.9Confident84.6Confident117 Ų117104.2 Ų104.261%0.61357%0.574SS**Hα-helixtrans-61.3-40.7176-96.9146.4000113A3 L4 T10 W11A3-L7 PolarHBondContact O-N 3.25Å; L4-L7 PolarHBondContact O-N 2.99Å; L7-T10 PolarHBondContact O-OG1 3.43Å; L7-T10 VanDerWaalsContact O-OG1 3.1Å; L7-W11 WeakPolarHBondContact O-CB 3.43Å; L7-W11 PolarHBondContact O-N 3.28Å
8L87.4Confident84.3Confident113 Ų113102.6 Ų102.659%0.59257%0.57SS**Hα-helixtrans-66.4-40.3176.6-137.479.2000111.5L4 A6 W11 V12L4-L8 PolarHBondContact O-N 3.45Å; A6-L8 PolarHBondContact O-N 3.47Å; L8-W11 PolarHBondContact O-N 3.49Å; L8-V12 WeakPolarHBondContact O-CG2 3.37Å; L8-V12 PolarHBondContact O-N 3.45Å
9K88.4Confident84Confident136 Ų136102.9 Ų102.959%0.59157%0.57SS**Hα-helixtrans-66.3-44.6177.8-75.1177.3-179.9-173.20112.3S5 A6 W11 V12 I13S5-K9 WeakPolarHBondContact O-CB 3.46Å; S5-K9 VanDerWaalsContact O-CG 3.3Å; S5-K9 WeakPolarHBondContact O-CG 3.46Å; S5-K9 PolarHBondContact O-N 2.9Å; A6-K9 PolarHBondContact O-N 3.05Å; K9-W11 VanDerWaalsContact C-N 3.31Å; K9-W11 PolarHBondContact O-N 2.95Å; K9-V12 PolarHBondContact O-N 3.04Å; K9-I13 WeakPolarHBondContact O-CB 3.34Å; K9-I13 WeakPolarHBondContact O-CD1 3.42Å; K9-I13 VanDerWaalsContact O-CG1 3.22Å; K9-I13 WeakPolarHBondContact O-CG1 3.47Å; K9-I13 PolarHBondContact O-N 3.19Å
10T87.4Confident83.6Confident87 Ų87100.7 Ų100.753%0.53457%0.566SS.*Hα-helixtrans-65.4-36.3176.953.50000111.8A6 L7 I13 L14A6-T10 PolarHBondContact O-N 2.95Å; A6-T10 PolarHBondContact O-OG1 3.47Å; L7-T10 PolarHBondContact O-OG1 3.43Å; L7-T10 VanDerWaalsContact O-OG1 3.1Å; T10-I13 PolarHBondContact O-N 3.36Å; T10-L14 WeakPolarHBondContact O-CB 3.47Å; T10-L14 PolarHBondContact O-N 3.33Å
11W91.5Very high83Confident162 Ų162101.5 Ų101.561%0.61457%0.568SS**Hα-helixtrans-66.2-44.8175.9-163.159.3000112.5L7 L8 K9 L14 Q15L7-W11 WeakPolarHBondContact O-CB 3.43Å; L7-W11 PolarHBondContact O-N 3.28Å; L8-W11 PolarHBondContact O-N 3.49Å; K9-W11 VanDerWaalsContact C-N 3.31Å; K9-W11 PolarHBondContact O-N 2.95Å; W11-L14 PolarHBondContact O-N 3.1Å; W11-Q15 WeakPolarHBondContact O-CB 3.47Å; W11-Q15 PolarHBondContact O-N 2.9Å
12V91.2Very high82.9Confident74 Ų7495.6 Ų95.645%0.44855%0.552SS.*Hα-helixtrans-61.8-44.6174.5170.50000111.4L8 K9 L14 Q15 T16L8-V12 WeakPolarHBondContact O-CG2 3.37Å; L8-V12 PolarHBondContact O-N 3.45Å; K9-V12 PolarHBondContact O-N 3.04Å; V12-L14 PolarHBondContact O-N 3.24Å; V12-Q15 PolarHBondContact O-N 3.35Å; V12-T16 WeakPolarHBondContact O-CG2 3.43Å; V12-T16 PolarHBondContact O-N 2.77Å; V12-T16 PolarHBondContact O-OG1 3.02Å
13I89.6Confident82.5Confident108 Ų10898.9 Ų98.955%0.55455%0.552SS**Hα-helixtrans-60-47.4177.2-69.5163.8000110.4K9 T10 Q15 T16 L17K9-I13 WeakPolarHBondContact O-CB 3.34Å; K9-I13 WeakPolarHBondContact O-CD1 3.42Å; K9-I13 VanDerWaalsContact O-CG1 3.22Å; K9-I13 WeakPolarHBondContact O-CG1 3.47Å; K9-I13 PolarHBondContact O-N 3.19Å; T10-I13 PolarHBondContact O-N 3.36Å; I13-Q15 VanDerWaalsContact C-N 3.33Å; I13-Q15 PolarHBondContact O-N 3.26Å; I13-T16 WeakPolarHBondContact CA-OG1 3.22Å; I13-T16 PolarHBondContact O-N 3.48Å; I13-T16 PolarHBondContact O-OG1 2.96Å; I13-L17 WeakPolarHBondContact O-CB 3.34Å; I13-L17 PolarHBondContact O-N 3Å
14L88.9Confident81.9Confident100 Ų100100.8 Ų100.852%0.52456%0.557SS.*Hα-helixtrans-60.9-42177.6-173.765.2000111.8T10 W11 V12 L17 C18T10-L14 WeakPolarHBondContact O-CB 3.47Å; T10-L14 PolarHBondContact O-N 3.33Å; W11-L14 PolarHBondContact O-N 3.1Å; V12-L14 PolarHBondContact O-N 3.24Å; L14-L17 PolarHBondContact O-N 3.05Å; L14-C18 PolarHBondContact O-N 3.49Å; L14-C18 PolarHBondContact O-SG 3.38Å; L14-C18 VanDerWaalsContact O-SG 3.38Å
15Q87.6Confident81Confident102 Ų102106.5 Ų106.548%0.47757%0.57SS.*Hα-helixtrans-65.2-40.5178-159.3173.420.200111.9W11 V12 I13 C18 L19W11-Q15 WeakPolarHBondContact O-CB 3.47Å; W11-Q15 PolarHBondContact O-N 2.9Å; V12-Q15 PolarHBondContact O-N 3.35Å; I13-Q15 VanDerWaalsContact C-N 3.33Å; I13-Q15 PolarHBondContact O-N 3.26Å; Q15-C18 PolarHBondContact O-N 2.91Å; Q15-L19 PolarHBondContact O-N 3.38Å
16T85.3Confident80.2Confident82 Ų82105.8 Ų105.850%0.50357%0.573SS.*Hα-helixtrans-66.4-36.217356.40000112.9V12 I13 L19 A20V12-T16 WeakPolarHBondContact O-CG2 3.43Å; V12-T16 PolarHBondContact O-N 2.77Å; V12-T16 PolarHBondContact O-OG1 3.02Å; I13-T16 WeakPolarHBondContact CA-OG1 3.22Å; I13-T16 PolarHBondContact O-N 3.48Å; I13-T16 PolarHBondContact O-OG1 2.96Å; T16-L19 PolarHBondContact O-N 3.5Å; T16-A20 WeakPolarHBondContact O-CB 3.38Å; T16-A20 PolarHBondContact O-N 3.41Å
17L85.6Confident79.3Confident94 Ų94109.4 Ų109.449%0.49259%0.592SS.*Hα-helixtrans-67.3-42.8176.6-172.967.1000111.4I13 L14 L19 A20 L21I13-L17 WeakPolarHBondContact O-CB 3.34Å; I13-L17 PolarHBondContact O-N 3Å; L14-L17 PolarHBondContact O-N 3.05Å; L17-L19 VanDerWaalsContact C-N 3.35Å; L17-L19 PolarHBondContact O-N 2.91Å; L17-A20 PolarHBondContact O-N 3.35Å; L17-L21 HydrophobicContact CG-CD1 4.26Å; L17-L21 WeakPolarHBondContact O-CG 3.47Å; L17-L21 PolarHBondContact O-N 2.85Å
18C79.6Confident78.1Confident75 Ų75108.6 Ų108.651%0.50760%0.601SS.*Hα-helixtrans-62.3-40173.9-70.30000112.4L14 Q15 A22L14-C18 PolarHBondContact O-N 3.49Å; L14-C18 PolarHBondContact O-SG 3.38Å; L14-C18 VanDerWaalsContact O-SG 3.38Å; Q15-C18 PolarHBondContact O-N 2.91Å; C18-A22 WeakPolarHBondContact O-CB 3.33Å; C18-A22 PolarHBondContact O-N 3.41Å
19L78.6Confident77.2Confident108 Ų108106 Ų10657%0.56560%0.602SS**Hα-helixtrans-66.4-40.4174.9-89.2156.7000112.5Q15 T16 L17 A22 Q23Q15-L19 PolarHBondContact O-N 3.38Å; T16-L19 PolarHBondContact O-N 3.5Å; L17-L19 VanDerWaalsContact C-N 3.35Å; L17-L19 PolarHBondContact O-N 2.91Å; L19-A22 PolarHBondContact O-N 3.37Å; L19-Q23 WeakPolarHBondContact O-CG 3.35Å; L19-Q23 PolarHBondContact O-N 3.39Å
20A75.6Confident76.3Confident59 Ų59105.2 Ų105.249%0.48861%0.611SS.*Hα-helixtrans-63.6-45.3175.800000111.8T16 L17 A22 Q23T16-A20 WeakPolarHBondContact O-CB 3.38Å; T16-A20 PolarHBondContact O-N 3.41Å; L17-A20 PolarHBondContact O-N 3.35Å; A20-A22 VanDerWaalsContact C-N 3.31Å; A20-A22 PolarHBondContact O-N 3.19Å; A20-Q23 PolarHBondContact O-N 3.41Å
21L72.1Confident75.5Confident118 Ų118107.1 Ų107.162%0.61863%0.625SS**Hα-helixtrans-65.2-32.3177.2-69.3171000112.6L17 Q23 V24L17-L21 HydrophobicContact CG-CD1 4.26Å; L17-L21 WeakPolarHBondContact O-CG 3.47Å; L17-L21 PolarHBondContact O-N 2.85Å; L21-Q23 VanDerWaalsContact C-N 3.26Å; L21-Q23 PolarHBondContact O-N 3.37Å; L21-V24 PolarHBondContact O-N 3.04Å
22A65.9Low74.5Confident78 Ų78102.3 Ų102.365%0.64563%0.625SS**Hα-helixtrans-70-18.2175.800000114.2C18 L19 A20C18-A22 WeakPolarHBondContact O-CB 3.33Å; C18-A22 PolarHBondContact O-N 3.41Å; L19-A22 PolarHBondContact O-N 3.37Å; A20-A22 VanDerWaalsContact C-N 3.31Å; A20-A22 PolarHBondContact O-N 3.19Å
23Q63Low73.5Confident152 Ų152104.4 Ų104.471%0.7164%0.64SS**THydrogen-bonded Turntrans-92.6-7.6177.9-65.8-64.4-26.100113.6L19 A20 L21 R25L19-Q23 WeakPolarHBondContact O-CG 3.35Å; L19-Q23 PolarHBondContact O-N 3.39Å; A20-Q23 PolarHBondContact O-N 3.41Å; L21-Q23 VanDerWaalsContact C-N 3.26Å; L21-Q23 PolarHBondContact O-N 3.37Å; Q23-R25 PolarHBondContact O-N 2.94Å
24V64.5Low72.7Confident114 Ų114105.3 Ų105.369%0.69165%0.653SS**  trans-77.473.5174.7-171.70000109.9L21 G26L21-V24 PolarHBondContact O-N 3.04Å; V24-G26 PolarHBondContact O-N 2.97Å; V24-G26 VanDerWaalsContact O-N 3.15Å
25R61.1Low71.8Confident239 Ų239103.5 Ų103.590%0.90266%0.659SS**  trans-72.9103.6169.1-165.8172.3-173168.60.4107.8Q23Q23-R25 PolarHBondContact O-N 2.94Å
26G67.9Low70.9Confident49 Ų49104.2 Ų104.251%0.50567%0.672SS.*PPolyproline II helixtrans-53154.5177.300000112.2V24 A28V24-G26 PolarHBondContact O-N 2.97Å; V24-G26 VanDerWaalsContact O-N 3.15Å; G26-A28 PolarHBondContact O-N 2.94Å
27P66.4Low70.2Confident131 Ų131106.1 Ų106.185%0.85169%0.686SS**PPolyproline II helixtrans-53.7137.4-178.223.7-34000110G29P27-G29 PolarHBondContact O-N 3.15Å; P27-G29 VanDerWaalsContact O-N 3.1Å
28A63.3Low69Low99 Ų99105 Ų10582%0.81870%0.697SS**PPolyproline II helixtrans-56.1121.6176.700000108.6G26G26-A28 PolarHBondContact O-N 2.94Å
29G68Low68.3Low59 Ų59109 Ų10961%0.60871%0.712SS**PPolyproline II helixtrans-55.2147.3176.400000110.1P27P27-G29 PolarHBondContact O-N 3.15Å; P27-G29 VanDerWaalsContact O-N 3.1Å
30P69.6Low67.7Low120 Ų120109.5 Ų109.578%0.77972%0.721SS**PPolyproline II helixtrans-53.5142.8178.523.9-33.9000109.5G32P30-G32 PolarHBondContact O-N 3.49Å; P30-G32 VanDerWaalsContact O-N 3.15Å
31P70.5Confident66.9Low127 Ų127109.9 Ų109.983%0.82573%0.731SS**PPolyproline II helixtrans-49.1126.9175.3-26.634.3000109.6
32G70.7Confident66Low60 Ų60109.6 Ų109.662%0.61974%0.739SS**PPolyproline II helixtrans-53.5142.2176.800000109.5P30P30-G32 PolarHBondContact O-N 3.49Å; P30-G32 VanDerWaalsContact O-N 3.15Å
33P69.6Low65.8Low118 Ų118113.3 Ų113.377%0.76675%0.748SS**PPolyproline II helixtrans-52.9141.5178.923.5-33.7000109.2G35P33-G35 PolarHBondContact O-N 3.45Å; P33-G35 VanDerWaalsContact O-N 3.15Å
34P73.5Confident65.4Low127 Ų127109 Ų10983%0.82575%0.745SS**PPolyproline II helixtrans-47.7127.9176.9-27.834.7000109.6
35G68.8Low65Low62 Ų62111.5 Ų111.564%0.63975%0.752SS**PPolyproline II helixtrans-51.3138.9177.900000109.2P33P33-G35 PolarHBondContact O-N 3.45Å; P33-G35 VanDerWaalsContact O-N 3.15Å
36P68.4Low65Low118 Ų118107.9 Ų107.977%0.76675%0.751SS**PPolyproline II helixtrans-52.2139.5-178.122.7-33.5000109G38P36-G38 PolarHBondContact O-N 3.1Å; P36-G38 VanDerWaalsContact O-N 3.11Å
37P70.8Confident64.6Low122 Ų122108.7 Ų108.779%0.79276%0.759SS**PPolyproline II helixtrans-47.6125.9178.6-27.634.2000109.3I39P37-I39 PolarHBondContact O-N 3.27Å; P37-I39 VanDerWaalsContact O-N 3.14Å
38G61.3Low64.2Low70 Ų70111.6 Ų111.672%0.72276%0.762SS**PPolyproline II helixtrans-51.1126.8179.300000108.5P36 P40P36-G38 PolarHBondContact O-N 3.1Å; P36-G38 VanDerWaalsContact O-N 3.11Å; G38-P40 VanDerWaalsContact O-N 3.11Å
39I64.3Low64.3Low159 Ų159116.4 Ų116.482%0.81576%0.764SS**  trans-45122.9-17941.8169.2000108.6P37 G41P37-I39 PolarHBondContact O-N 3.27Å; P37-I39 VanDerWaalsContact O-N 3.14Å; I39-G41 PolarHBondContact O-N 3.38Å
40P66.3Low64.2Low118 Ų118116.1 Ų116.177%0.76676%0.761SS**PPolyproline II helixtrans-50.2122.8174-27.435.1000107.6G38 S42G38-P40 VanDerWaalsContact O-N 3.11Å; P40-S42 PolarHBondContact O-N 3.21Å; P40-S42 VanDerWaalsContact O-N 3.11Å
41G59Low64Low67 Ų67115.8 Ų115.869%0.69176%0.759SS**PPolyproline II helixtrans-52.7125.3177.800000107I39 D43I39-G41 PolarHBondContact O-N 3.38Å; G41-D43 PolarHBondContact O-N 3.17Å
42S53.6Low64.2Low112 Ų112115.7 Ų115.778%0.78376%0.758SS**PPolyproline II helixtrans-48118.5-172.752.10000109P40 G44P40-S42 PolarHBondContact O-N 3.21Å; P40-S42 VanDerWaalsContact O-N 3.11Å; S42-G44 PolarHBondContact O-N 3.42Å
43D60.3Low63.9Low156 Ų156116.2 Ų116.283%0.83476%0.764SS**PPolyproline II helixtrans-48.4122174.3-73.2-50000107.1G41 I45G41-D43 PolarHBondContact O-N 3.17Å; D43-I45 PolarHBondContact O-N 3.48Å; D43-I45 VanDerWaalsContact O-N 3.11Å
44G54.8Low63.6Low63 Ų63115.7 Ų115.765%0.64976%0.763SS**PPolyproline II helixtrans-55.9124.1-176.800000107.7S42 D46S42-G44 PolarHBondContact O-N 3.42Å; G44-D46 PolarHBondContact O-N 3.41Å
45I56Low63.6Low165 Ų165115.6 Ų115.685%0.84676%0.762SS**  trans-42.8107-171.343.8161.6000110.8D43 G47D43-I45 PolarHBondContact O-N 3.48Å; D43-I45 VanDerWaalsContact O-N 3.11Å; I45-G47 VanDerWaalsContact C-N 3.35Å; I45-G47 PolarHBondContact O-N 3.15Å
46D62.2Low63.6Low163 Ų163115.4 Ų115.487%0.87276%0.76SS**  trans-59.6103.9173.2-95.6-24.4000105.9G44 E48G44-D46 PolarHBondContact O-N 3.41Å; D46-E48 PolarHBondContact O-N 3.25Å
47G58.9Low63.4Low66 Ų66115.5 Ų115.568%0.6876%0.761SS**  trans-53.2127.4-173.600000109.1I45 K49I45-G47 VanDerWaalsContact C-N 3.35Å; I45-G47 PolarHBondContact O-N 3.15Å; G47-K49 PolarHBondContact O-N 3.47Å
48E59Low63.4Low192 Ų192115.7 Ų115.790%0.89776%0.762SS**  trans-39.7110.6-165.3-70.1-172.3156.900110.9D46 G50D46-E48 PolarHBondContact O-N 3.25Å; E48-G50 PolarHBondContact O-N 3.19Å
49K63.9Low63.5Low201 Ų201115.8 Ų115.887%0.87476%0.763SS**  trans-59109179.7-175.4-176.4-178.2-174.50106.7G47G47-K49 PolarHBondContact O-N 3.47Å
50G66.2Low63.3Low52 Ų52115.3 Ų115.354%0.53676%0.757SS.*PPolyproline II helixtrans-47.5141.5-176.200000110.4E48E48-G50 PolarHBondContact O-N 3.19Å
51P66.9Low63.4Low113 Ų113118.9 Ų118.973%0.73476%0.761SS**PPolyproline II helixtrans-50.5137.7-171.720.7-33.3000109.6G53P51-G53 PolarHBondContact O-N 3.41Å; P51-G53 VanDerWaalsContact O-N 3.11Å
52P72.8Confident63.6Low126 Ų126118.5 Ų118.582%0.81876%0.757SS**PPolyproline II helixtrans-48.1125.7177.3-26.333.8000109.2S54P52-S54 PolarHBondContact O-N 2.94Å
53G66.4Low64Low71 Ų71122 Ų12273%0.73276%0.761SS**PPolyproline II helixtrans-51.3129.9176.400000108.5P51P51-G53 PolarHBondContact O-N 3.41Å; P51-G53 VanDerWaalsContact O-N 3.11Å
54S63Low64.5Low107 Ų107120 Ų12075%0.74876%0.756SS**PPolyproline II helixtrans-46.1132178.449.20000109.3P52 G56P52-S54 PolarHBondContact O-N 2.94Å; S54-G56 PolarHBondContact O-N 3.27Å
55P73.7Confident65.2Low124 Ų124120.1 Ų120.181%0.80576%0.758SS**PPolyproline II helixtrans-47.3131.1174.5-27.434.7000109.4
56G66.8Low65.6Low59 Ų59121 Ų12161%0.60876%0.759SS**PPolyproline II helixtrans-53.8144.4175.700000109.3S54S54-G56 PolarHBondContact O-N 3.27Å
57P65.8Low66.1Low119 Ų119119.1 Ų119.177%0.77376%0.755SS**PPolyproline II helixtrans-51.9133.1177.923-33.2000108.4G59P57-G59 PolarHBondContact O-N 3.07Å; P57-G59 VanDerWaalsContact O-N 3.08Å
58P69.7Low66.8Low127 Ų127118.8 Ų118.883%0.82575%0.752SS**PPolyproline II helixtrans-50.7123.6175-25.834.1000108.3Q60P58-Q60 PolarHBondContact O-N 3.41Å
59G64.4Low67.4Low71 Ų71115.8 Ų115.873%0.73275%0.749SS**PPolyproline II helixtrans-52.3132.5-179.700000108.8P57 K61P57-G59 PolarHBondContact O-N 3.07Å; P57-G59 VanDerWaalsContact O-N 3.08Å; G59-K61 PolarHBondContact O-N 3.05Å
60Q60.5Low67.8Low149 Ų149114 Ų11470%0.69675%0.749SS**  trans-49.2115.3-177.5-70-17065.200108.2P58 G62 E218P58-Q60 PolarHBondContact O-N 3.41Å; Q60-G62 PolarHBondContact O-N 3.15Å; Q60-E218 PolarHBondContact NE2-OE1 2.81Å
61K66.4Low67.9Low193 Ų193114.2 Ų114.284%0.83975%0.752SS**  trans-63.8109.5174.4-178.7-175.9178.6-173.20105G59 E63G59-K61 PolarHBondContact O-N 3.05Å; K61-E63 PolarHBondContact O-N 3.5Å
62G63.2Low68Low60 Ų60114.6 Ų114.662%0.61975%0.754SS**  trans-45.9134.4-176.300000110.2Q60Q60-G62 PolarHBondContact O-N 3.15Å
63E62.8Low67.7Low185 Ų185114.6 Ų114.686%0.86475%0.754SS**PPolyproline II helixtrans-49.1127.4-175.6-63.7-174.2136.900108.9K61 G65K61-E63 PolarHBondContact O-N 3.5Å; E63-G65 PolarHBondContact O-N 3.42Å
64P71.1Confident67.6Low113 Ų113114.3 Ų114.373%0.73475%0.751SS**PPolyproline II helixtrans-54.7116.6171.4-21.732.7000107.1E66P64-E66 PolarHBondContact O-N 3.4Å
65G68.8Low67.5Low67 Ų67118.4 Ų118.469%0.69176%0.758SS**PPolyproline II helixtrans-50.9138.3-176.900000109.9E63E63-G65 PolarHBondContact O-N 3.42Å
66E65.6Low66.7Low183 Ų183120.1 Ų120.186%0.85576%0.761SS**  trans-44.7126.4-174.6-66.7-171.4139.800109.9P64 G68P64-E66 PolarHBondContact O-N 3.4Å; E66-G68 PolarHBondContact O-N 3.49Å
67P72.8Confident66.1Low123 Ų123120.5 Ų120.580%0.79976%0.764SS**PPolyproline II helixtrans-51122.6172.8-26.234.8000108.2
68G72.6Confident65.7Low59 Ų59123 Ų12361%0.60877%0.769SS**PPolyproline II helixtrans-52.1140.2178.100000109.1E66 D70E66-G68 PolarHBondContact O-N 3.49Å; G68-D70 PolarHBondContact O-N 3.15Å
69P71.1Confident64.8Low129 Ų129124.9 Ų124.984%0.83877%0.772SS**PPolyproline II helixtrans-51.8130.3-171.721.5-33.9000109.9G71P69-G71 PolarHBondContact O-N 3Å; P69-G71 VanDerWaalsContact O-N 3.14Å
70D72.8Confident64.1Low164 Ų164124.7 Ų124.788%0.87777%0.77SS**PPolyproline II helixtrans-48.6124.6-178.8-75.9-45000109.2G68G68-D70 PolarHBondContact O-N 3.15Å
71G68.3Low63.6Low57 Ų57126.3 Ų126.359%0.58878%0.783SS**PPolyproline II helixtrans-54.9142.8177.900000109.6P69P69-G71 PolarHBondContact O-N 3Å; P69-G71 VanDerWaalsContact O-N 3.14Å
72P68.9Low62.9Low120 Ų120125 Ų12578%0.77978%0.784SS**PPolyproline II helixtrans-52134.7-178.522.5-33.6000109.4G74P72-G74 PolarHBondContact O-N 2.8Å; P72-G74 VanDerWaalsContact O-N 3.1Å
73P67.1Low62.3Low126 Ų126125.4 Ų125.482%0.81879%0.788SS**PPolyproline II helixtrans-50.5123-177.6-28.434.7000110.3E75P73-E75 PolarHBondContact O-N 3.22Å
74G64.1Low62.3Low65 Ų65121.7 Ų121.767%0.6779%0.788SS**PPolyproline II helixtrans-56131.2178.100000109.5P72 N76P72-G74 PolarHBondContact O-N 2.8Å; P72-G74 VanDerWaalsContact O-N 3.1Å; G74-N76 PolarHBondContact O-N 2.94Å
75E61.8Low61.1Low194 Ų194126 Ų12691%0.90780%0.795SS**PPolyproline II helixtrans-54.6131-176.5-65.7-174.3146.400110.3P73 G77P73-E75 PolarHBondContact O-N 3.22Å; E75-G77 PolarHBondContact O-N 3.49Å
76N56.7Low60.4Low160 Ų160126.3 Ų126.386%0.85680%0.798SS**PPolyproline II helixtrans-57117.4-177.8-69.2-34.1000109.6G74 I78G74-N76 PolarHBondContact O-N 2.94Å; N76-I78 PolarHBondContact O-N 3.28Å
77G52.9Low59.9Low66 Ų66125.8 Ų125.868%0.6880%0.802SS**PPolyproline II helixtrans-57.3130.3172.300000109.8E75 D79E75-G77 PolarHBondContact O-N 3.49Å; G77-D79 PolarHBondContact O-N 3.49Å
78I57.5Low58.7Low172 Ų172130.6 Ų130.688%0.88280%0.804SS**PPolyproline II helixtrans-53119.8-177.144.9168.6000112.2N76 G80N76-I78 PolarHBondContact O-N 3.28Å; I78-G80 PolarHBondContact O-N 2.82Å
79D51.5Low58.3Low166 Ų166130.2 Ų130.289%0.88880%0.8SS**PPolyproline II helixtrans-62.2127.1179.1-76.8-51.1000111.5G77G77-D79 PolarHBondContact O-N 3.49Å
80G49.3Very low57.9Low67 Ų67130.4 Ų130.469%0.69180%0.801SS**PPolyproline II helixtrans-68.6141.317300000111.9I78 I82I78-G80 PolarHBondContact O-N 2.82Å; G80-I82 PolarHBondContact O-N 3.46Å
81L50.2Low57.1Low184 Ų184129.3 Ų129.396%0.96379%0.794SS**PPolyproline II helixtrans-50.1131.7-174.4-74.9161.2000113.8G83L81-G83 PolarHBondContact O-N 3.35Å
82I52.3Low56.5Low166 Ų166129.6 Ų129.685%0.85180%0.797SS**PPolyproline II helixtrans-65.7120.7-172.1-64.3167.4000111.8G80G80-I82 PolarHBondContact O-N 3.46Å
83G50.3Low56Low68 Ų68131.3 Ų131.370%0.70180%0.8SS**PPolyproline II helixtrans-87118.9159.100000110.5L81 K85L81-G83 PolarHBondContact O-N 3.35Å; G83-K85 PolarHBondContact O-N 2.88Å
84A61.7Low55.6Low106 Ų106131.3 Ų131.388%0.87680%0.8SS**PPolyproline II helixtrans-64.4121.1179.400000111.4
85K46.3Very low55.4Low204 Ų204131.1 Ų131.189%0.88780%0.798SS**  trans-145.298.3-179.7-168.5178.5-176.8179.90113.6G83G83-K85 PolarHBondContact O-N 2.88Å
86G55.2Low55.4Low73 Ų73128.1 Ų128.175%0.75380%0.795SS**  trans64.2126.8141.600000118.9
87D53.6Low55.2Low173 Ų173130.4 Ų130.493%0.92580%0.797SS**  trans-55141.8168.9-68.5-60.7000112.4G89D87-G89 PolarHBondContact O-N 3.3Å
88R49.6Very low55.4Low223 Ų223130.4 Ų130.484%0.84280%0.797SS**  trans-72.5110.5-167-168.2177.7-176.2-178.51.6110.9
89G62.9Low55.2Low51 Ų51131.1 Ų131.153%0.52680%0.797SS.*PPolyproline II helixtrans-56.9155.9169.500000112.4D87D87-G89 PolarHBondContact O-N 3.3Å
90P62.9Low55.4Low133 Ų133129.3 Ų129.386%0.86479%0.794SS**PPolyproline II helixtrans-58.5143.5-176.424.4-34000111.6G92P90-G92 PolarHBondContact O-N 3.11Å; P90-G92 VanDerWaalsContact O-N 3.15Å
91I55.9Low55.9Low141 Ų141129.1 Ų129.172%0.72379%0.792SS**PPolyproline II helixtrans-58.9117.8-176.6-65.6171.3000109.5
92G56.1Low56.5Low64 Ų64126.6 Ų126.666%0.6679%0.787SS**PPolyproline II helixtrans-64.9138.5170.400000110.7P90P90-G92 PolarHBondContact O-N 3.11Å; P90-G92 VanDerWaalsContact O-N 3.15Å
93N59Low56.6Low156 Ų156124.5 Ų124.583%0.83479%0.787SS**PPolyproline II helixtrans-53.7138176.7-69-36.5000110.6G95N93-G95 PolarHBondContact O-N 3.14Å
94P57.3Low56.9Low126 Ų126124.6 Ų124.682%0.81879%0.788SS**PPolyproline II helixtrans-53.7127.6177.5-26.634.8000111.5
95G60.2Low56.8Low61 Ų61128.5 Ų128.563%0.62979%0.788SS**PPolyproline II helixtrans-59.6150.2176.700000111.6N93 K97N93-G95 PolarHBondContact O-N 3.14Å; G95-K97 PolarHBondContact O-N 2.89Å
96P62.5Low57.3Low131 Ų131125 Ų12585%0.85179%0.786SS**PPolyproline II helixtrans-57.4129-179.724.4-33.6000110.2G98P96-G98 PolarHBondContact O-N 3.27Å; P96-G98 VanDerWaalsContact O-N 3.16Å
97K52.6Low57.4Low207 Ų207124.9 Ų124.990%0.979%0.785SS**PPolyproline II helixtrans-55.7120.6-177.8-163.2177.4-172.2179.60109.2G95 Q99G95-K97 PolarHBondContact O-N 2.89Å; K97-Q99 PolarHBondContact O-N 3.29Å
98G56.2Low57.8Low66 Ų66128.1 Ų128.168%0.6878%0.784SS**PPolyproline II helixtrans-53.8137.1-177.200000111.6P96P96-G98 PolarHBondContact O-N 3.27Å; P96-G98 VanDerWaalsContact O-N 3.16Å
99Q54.8Low57.9Low188 Ų188123.6 Ų123.688%0.87978%0.783SS**PPolyproline II helixtrans-60.6133.6176.2-68.1-178.3000109.2K97 G101K97-Q99 PolarHBondContact O-N 3.29Å; Q99-G101 PolarHBondContact O-N 3.4Å
100P55.2Low57.3Low127 Ų127124.6 Ų124.683%0.82579%0.794SS**PPolyproline II helixtrans-55.6129.1173.8-24.834.5000110.3
101G59.8Low57.1Low63 Ų63125.6 Ų125.665%0.64980%0.797SS**PPolyproline II helixtrans-60.2148.6176.700000111.2Q99 S103Q99-G101 PolarHBondContact O-N 3.4Å; G101-S103 PolarHBondContact O-N 3.13Å
102P61.3Low56.8Low131 Ų131121.8 Ų121.885%0.85179%0.793SS**PPolyproline II helixtrans-59.9132.2179.125.6-33.8000110.3G104P102-G104 PolarHBondContact O-N 3.28Å
103S55.2Low56.8Low123 Ų123126.7 Ų126.786%0.8680%0.803SS**PPolyproline II helixtrans-54.9129.7177.5-63.40000110.9G101G101-S103 PolarHBondContact O-N 3.13Å
104G56.2Low56.7Low69 Ų69125 Ų12571%0.71180%0.801SS**PPolyproline II helixtrans-60.6148.7178.600000112.6P102P102-G104 PolarHBondContact O-N 3.28Å
105E60.4Low56.7Low189 Ų189122.5 Ų122.588%0.88380%0.797SS**PPolyproline II helixtrans-59135.9179.2-65.2-170.3140.700111.5G107E105-G107 PolarHBondContact O-N 3.28Å
106P56.6Low56.8Low129 Ų129128.1 Ų128.184%0.83881%0.812SS**PPolyproline II helixtrans-57.7127.3176.5-2635.1000112.2
107G57.2Low56.6Low71 Ų71126.6 Ų126.673%0.73281%0.811SS**PPolyproline II helixtrans-57.7141178.400000112.5E105E105-G107 PolarHBondContact O-N 3.28Å
108R61.9Low57.2Low242 Ų242120.1 Ų120.191%0.91380%0.803SS**PPolyproline II helixtrans-59.2134.3-179.3-66-175.5178.7-160.6-0.7110.6G110R108-G110 PolarHBondContact O-N 3.19Å
109P52Low57.5Low127 Ų127121.5 Ų121.583%0.82581%0.808SS**PPolyproline II helixtrans-58.4126.1-178.8-25.134.1000112.2
110G49Very low58Low73 Ų73118.6 Ų118.675%0.75381%0.805SS**PPolyproline II helixtrans-67.6134.6173.400000111.1R108 G112R108-G110 PolarHBondContact O-N 3.19Å; G110-G112 PolarHBondContact O-N 3.39Å
111V60Low58.6Low153 Ų153115.4 Ų115.493%0.92780%0.795SS**  trans-77.476.4176.9-171.70000109.5
112G48.4Very low58.9Low61 Ų61118.7 Ų118.763%0.62981%0.805SS**PPolyproline II helixtrans-81120.3169.300000110.5G110 P114G110-G112 PolarHBondContact O-N 3.39Å; G112-P114 WeakPolarHBondContact O-CD 3.25Å
113L56.4Low59.1Low168 Ų168120.4 Ų120.488%0.8881%0.805SS**PPolyproline II helixtrans-58.7124167.1-81.7150.5000109G115L113-G115 PolarHBondContact O-N 2.95Å
114P56.4Low59.2Low121 Ų121117.5 Ų117.579%0.78680%0.795SS**PPolyproline II helixtrans-60.8128.2177.4-23.333.9000110.7G112G112-P114 WeakPolarHBondContact O-CD 3.25Å
115G58Low59.5Low72 Ų72122.1 Ų122.174%0.74280%0.802SS**PPolyproline II helixtrans-59.1138.7170.400000110.4L113 A117L113-G115 PolarHBondContact O-N 2.95Å; G115-A117 PolarHBondContact O-N 2.96Å
116L62.7Low59.7Low180 Ų180118.9 Ų118.994%0.94280%0.798SS**PPolyproline II helixtrans-54.5125.5177.9-72.3167.8000109.8G118L116-G118 PolarHBondContact O-N 3.35Å
117A59Low59.8Low99 Ų99116 Ų11682%0.81879%0.791SS**PPolyproline II helixtrans-59.2127.1179.100000110G115G115-A117 PolarHBondContact O-N 2.96Å
118G64.4Low60.1Low71 Ų71121.9 Ų121.973%0.73280%0.8SS**PPolyproline II helixtrans-56.8141.8174.100000110.8L116L116-G118 PolarHBondContact O-N 3.35Å
119A63.3Low60Low95 Ų95118.4 Ų118.479%0.78580%0.797SS**PPolyproline II helixtrans-54.9135.3-178.800000110.7G121A119-G121 PolarHBondContact O-N 3.22Å
120P65.3Low60.2Low127 Ų127115.4 Ų115.483%0.82579%0.79SS**PPolyproline II helixtrans-54.5131.5175.6-25.434.2000110.8
121G67.5Low60.9Low59 Ų59117.1 Ų117.161%0.60879%0.79SS**PPolyproline II helixtrans-57.9149.1174.500000111.2A119 I123A119-G121 PolarHBondContact O-N 3.22Å; G121-I123 PolarHBondContact O-N 3.27Å
122P65Low61.4Low133 Ų133115.9 Ų115.986%0.86479%0.785SS**PPolyproline II helixtrans-58.2131.5-178.824.3-33.6000110.5G124P122-G124 PolarHBondContact O-N 3.35Å
123I65.6Low62.1Low166 Ų166115.8 Ų115.885%0.85179%0.785SS**PPolyproline II helixtrans-60.6121.3177.7-63.2170.6000108.1G121 L125G121-I123 PolarHBondContact O-N 3.27Å; I123-L125 PolarHBondContact O-N 3.04Å
124G56.8Low62.6Low63 Ų63114 Ų11465%0.64978%0.783SS**PPolyproline II helixtrans-58.1134.1176.800000111.1P122P122-G124 PolarHBondContact O-N 3.35Å
125L62.8Low63.2Low166 Ų166118 Ų11887%0.86979%0.788SS**PPolyproline II helixtrans-57.4138.6177.7-71.6166.9000110.3I123 G127I123-L125 PolarHBondContact O-N 3.04Å; L125-G127 PolarHBondContact O-N 2.95Å
126P64.9Low63.6Low121 Ų121118.1 Ų118.179%0.78679%0.789SS**PPolyproline II helixtrans-55.7128.7175.3-24.333.7000110.9Q128P126-Q128 PolarHBondContact O-N 3.47Å
127G59.5Low64Low68 Ų68116.5 Ų116.570%0.70179%0.787SS**PPolyproline II helixtrans-57.3138.1174.900000110.8L125 I129L125-G127 PolarHBondContact O-N 2.95Å; G127-I129 PolarHBondContact O-N 2.82Å
128Q62.5Low64.5Low195 Ų195119.8 Ų119.891%0.91179%0.79SS**PPolyproline II helixtrans-59.1125.6179.8-70.3-178-0.600110.1P126 G130P126-Q128 PolarHBondContact O-N 3.47Å; Q128-G130 PolarHBondContact O-N 3.38Å
129I61Low64.7Low168 Ų168118.8 Ų118.886%0.86278%0.779SS**PPolyproline II helixtrans-64.9117.3175.7-62.8171.9000107.7G127 S131G127-I129 PolarHBondContact O-N 2.82Å; I129-S131 PolarHBondContact O-N 3.33Å
130G56.2Low65.1Low64 Ų64120.1 Ų120.166%0.6678%0.78SS**PPolyproline II helixtrans-56.7136.717800000111.6Q128Q128-G130 PolarHBondContact O-N 3.38Å
131S61.9Low65.7Low110 Ų110120.1 Ų120.177%0.76978%0.78SS**PPolyproline II helixtrans-55.7130.517952.40000111I129 G133I129-S131 PolarHBondContact O-N 3.33Å; S131-G133 PolarHBondContact O-N 3.03Å
132P70.7Confident65.9Low126 Ų126120.4 Ų120.482%0.81878%0.782SS**PPolyproline II helixtrans-53.6132176.7-27.235000111.8
133G64.4Low66.1Low60 Ų60119.9 Ų119.962%0.61978%0.779SS**PPolyproline II helixtrans-59.3152.5-179.900000112.7S131 K135S131-G133 PolarHBondContact O-N 3.03Å; G133-K135 PolarHBondContact O-N 2.83Å
134P66.2Low66.6Low131 Ų131118 Ų11885%0.85178%0.778SS**PPolyproline II helixtrans-58.8133.7179.825.2-34000110.6G136P134-G136 PolarHBondContact O-N 3.26Å
135K70.1Confident67.1Low204 Ų204118.5 Ų118.589%0.88778%0.783SS**PPolyproline II helixtrans-60.8128.2177-74.7-177.4176.5177.80109.7G133G133-K135 PolarHBondContact O-N 2.83Å
136G65.3Low67.6Low74 Ų74118.4 Ų118.476%0.76378%0.783SS**PPolyproline II helixtrans-56.9142.8175.100000111.9P134 L138P134-G136 PolarHBondContact O-N 3.26Å; G136-L138 PolarHBondContact O-N 3.29Å
137V71.3Confident68.2Low147 Ų147118.5 Ų118.589%0.89178%0.783SS**PPolyproline II helixtrans-63.5129.8179.6-176.80000109.5G139V137-G139 PolarHBondContact O-N 3.34Å
138L69.6Low68.6Low168 Ų168118.2 Ų118.288%0.8878%0.78SS**PPolyproline II helixtrans-63.4125.8177.3-17470000109.8G136G136-L138 PolarHBondContact O-N 3.29Å
139G69Low68.9Low50 Ų50114.8 Ų114.852%0.51578%0.775SS.*PPolyproline II helixtrans-60.8154.1177.500000112.7V137V137-G139 PolarHBondContact O-N 3.34Å
140P71.8Confident69.6Low123 Ų123113 Ų11380%0.79977%0.774SS**PPolyproline II helixtrans-60.4144.3-179.925.6-34.2000111.2G142P140-G142 PolarHBondContact O-N 3.36Å
141P76.9Confident70.2Confident127 Ų127113.4 Ų113.483%0.82578%0.779SS**PPolyproline II helixtrans-56.8134176.9-24.534.1000111.8
142G71.4Confident70.3Confident64 Ų64117.8 Ų117.866%0.6678%0.784SS**PPolyproline II helixtrans-60153.3176.100000112.6P140P140-G142 PolarHBondContact O-N 3.36Å
143P70.4Confident70.4Confident123 Ų123117.8 Ų117.880%0.79978%0.784SS**PPolyproline II helixtrans-61149.7179.926.1-34.5000111.5G145P143-G145 PolarHBondContact O-N 3.3Å
144P76.3Confident70.5Confident126 Ų126117.9 Ų117.982%0.81879%0.785SS**PPolyproline II helixtrans-56.2135.3175.4-23.934000111.8
145G67.3Low70.3Confident74 Ų74117.4 Ų117.476%0.76378%0.782SS**PPolyproline II helixtrans-60144.6174.500000111.8P143P143-G145 PolarHBondContact O-N 3.3Å
146L72.9Confident70Confident164 Ų164113.8 Ų113.886%0.85978%0.78SS**PPolyproline II helixtrans-59.1142.5177.7-65.4173.6000110.7G148L146-G148 PolarHBondContact O-N 3.36Å
147P76.6Confident69.4Low122 Ų122113.6 Ų113.679%0.79278%0.778SS**PPolyproline II helixtrans-54.6135.2173-25.134.6000111.4
148G68.7Low68.2Low63 Ų63116.1 Ų116.165%0.64978%0.776SS**PPolyproline II helixtrans-61.9147.9176.800000111.7L146L146-G148 PolarHBondContact O-N 3.36Å
149P69.1Low67Low122 Ų122118 Ų11879%0.79278%0.778SS**PPolyproline II helixtrans-60.9146.4178.526.2-34.4000111G151P149-G151 PolarHBondContact O-N 3.49Å
150P74.9Confident66Low130 Ų130123 Ų12384%0.84479%0.791SS**PPolyproline II helixtrans-53.7138.9176.8-26.635000112.4
151G69.4Low64.5Low74 Ų74120.1 Ų120.176%0.76378%0.784SS**PPolyproline II helixtrans-58.5139.5176.500000111.6P149P149-G151 PolarHBondContact O-N 3.49Å
152K65.1Low63Low201 Ų201121.8 Ų121.887%0.87479%0.785SS**PPolyproline II helixtrans-58.9138.1177.4-65.3-176.9179.3-177.40109.9G154K152-G154 PolarHBondContact O-N 3.36Å
153P72.6Confident61.6Low126 Ų126127.6 Ų127.682%0.81880%0.795SS**PPolyproline II helixtrans-53.5138.6174.2-26.735.1000111.6
154G64.9Low60.6Low63 Ų63131.1 Ų131.165%0.64980%0.801SS**PPolyproline II helixtrans-63.2150.7176.700000111.9K152K152-G154 PolarHBondContact O-N 3.36Å
155P62Low58.9Low121 Ų121128.5 Ų128.579%0.78680%0.796SS**PPolyproline II helixtrans-62.1141.9178.326.8-34.3000110.9G157P155-G157 PolarHBondContact O-N 3.48Å
156P64Low57.4Low128 Ų128131.2 Ų131.283%0.83180%0.804SS**PPolyproline II helixtrans-62.8137.1177.726.2-33.7000110.7K158P156-K158 PolarHBondContact O-N 3.31Å
157G52.5Low55.9Low70 Ų70127.3 Ų127.372%0.72280%0.795SS**PPolyproline II helixtrans-64.8125.1-178.100000112.1P155 F159P155-G157 PolarHBondContact O-N 3.48Å; G157-F159 PolarHBondContact O-N 3.31Å
158K47.6Very low54.3Low199 Ų199128.4 Ų128.487%0.86579%0.794SS**  trans-69.4113.1166.8-90.5-174.1170.3-176.10109.2P156P156-K158 PolarHBondContact O-N 3.31Å
159F44.1Very low52.8Low207 Ų207133.7 Ų133.791%0.90881%0.807SS**  trans-69.1129.5161-91.6-97.6000109.3G157G157-F159 PolarHBondContact O-N 3.31Å
160I47.5Very low51.7Low157 Ų157136.1 Ų136.181%0.80581%0.808SS**  trans-112.9100.2169.7-58.1173.5000106.1
161G41.1Very low50.1Low62 Ų62135.8 Ų135.864%0.63981%0.807SS**  trans-89.8123.2157.700000107.7
162L44.5Very low49.2Very low162 Ų162138.1 Ų138.185%0.84881%0.809SS**  79.891.483.5-93.7156.3000111.9
163E43.1Very low48.6Very low185 Ų185136.9 Ų136.986%0.86481%0.811SS**  trans-89.9129.7145.6-78-173.6150.500108.7
164E47.7Very low47.6Very low197 Ų197138.4 Ų138.492%0.92181%0.812SS**  trans35.5125154.6-55.1-166.8135.100122.3
165G40.6Very low46.5Very low71 Ų71141.4 Ų141.473%0.73282%0.822SS**  125.979.1124.800000119.1
166S36.2Very low46Very low131 Ų131141.4 Ų141.492%0.91682%0.822SS**  trans167.8153.8130.742.40000111.5
167A42Very low45.4Very low82 Ų82140.2 Ų140.268%0.67882%0.823SS**  trans-101.1176.7-162.600000114.8
168D43.3Very low45.6Very low145 Ų145139.9 Ų139.978%0.77582%0.819SS**  trans68.696.4157.1-56.1-35.9000119.3
169L36.7Very low45.6Very low175 Ų175136.4 Ų136.492%0.91682%0.817SS**  -166124.6126.5-103.9149.7000111.7C171L169-C171 PolarHBondContact O-N 3.05Å
170Q46.8Very low46.2Very low172 Ų172136.3 Ų136.380%0.80482%0.816SS**  trans-54.5129.6176.7-96.976.1-6.500113.2
171C41Very low46.5Very low123 Ų123131.6 Ų131.683%0.83181%0.807SS**  trans-146.2135.4144.3-101.10000111.5L169L169-C171 PolarHBondContact O-N 3.05Å
172P49.4Very low46.7Very low124 Ų124134.8 Ų134.881%0.80582%0.816SS**  trans-84.6167-172.334.2-35.6000113.7N174P172-N174 PolarHBondContact O-N 3.11Å
173L52.9Low47.2Very low175 Ų175136.3 Ų136.392%0.91682%0.819SS**SBendtrans-54.291.3-178.8-65157.9000114.2
174N51.5Low47.6Very low157 Ų157130.5 Ų130.584%0.8481%0.809SS**  trans-176.5102.9140.2-104.3-14.9000111.5P172P172-N174 PolarHBondContact O-N 3.11Å
175C41.5Very low47.6Very low127 Ų127129.4 Ų129.486%0.85881%0.808SS**  trans-105120.3158.1-75.20000107.9
176P52.3Low48.1Very low120 Ų120135 Ų13578%0.77982%0.815SS**PPolyproline II helixtrans-62146.8171.227.9-33.4000109.3G178P176-G178 PolarHBondContact O-N 3.02Å; P176-G178 VanDerWaalsContact O-N 3.16Å
177A51.7Low48.8Very low103 Ų103132 Ų13285%0.85181%0.806SS**PPolyproline II helixtrans-52.8125.3177.500000109.9
178G55.2Low49.1Very low63 Ų63134 Ų13465%0.64981%0.809SS**PPolyproline II helixtrans-52.2142.8-17700000111.3P176 K180P176-G178 PolarHBondContact O-N 3.02Å; P176-G178 VanDerWaalsContact O-N 3.16Å; G178-K180 PolarHBondContact O-N 3.43Å
179P48.4Very low49.6Very low127 Ų127136.7 Ų136.783%0.82581%0.814SS**PPolyproline II helixtrans-53.5128.1-171.821.6-33.3000110.1G181P179-G181 PolarHBondContact O-N 2.92Å; P179-G181 VanDerWaalsContact O-N 3.12Å
180K56.2Low50.2Low205 Ų205131.4 Ų131.489%0.89180%0.801SS**PPolyproline II helixtrans-50.4122.6-178.6-154.2177.5-168.8177.10108.1G178G178-K180 PolarHBondContact O-N 3.43Å
181G53.7Low50.2Low58 Ų58131 Ų13160%0.59880%0.799SS**PPolyproline II helixtrans-49142.7-17300000111.5P179 Q183P179-G181 PolarHBondContact O-N 2.92Å; P179-G181 VanDerWaalsContact O-N 3.12Å; G181-Q183 PolarHBondContact O-N 3.39Å
182P46.7Very low50.6Low129 Ų129135 Ų13584%0.83880%0.803SS**PPolyproline II helixtrans-51.4131.4-168.120.8-33.3000110.3G184P182-G184 PolarHBondContact O-N 3.39Å
183Q53.8Low50.6Low193 Ų193132.1 Ų132.190%0.90280%0.795SS**PPolyproline II helixtrans-51.8118.2-176.7-169.6173.78.200108.7G181 L185G181-Q183 PolarHBondContact O-N 3.39Å; Q183-L185 PolarHBondContact O-N 2.91Å
184G52.5Low50.5Low64 Ų64134.7 Ų134.766%0.6679%0.793SS**PPolyproline II helixtrans-50.6127.9-170.800000110.5P182 Q186P182-G184 PolarHBondContact O-N 3.39Å; G184-Q186 PolarHBondContact O-N 2.86Å; G184-Q186 VanDerWaalsContact O-N 3.12Å
185L46.4Very low50.3Low173 Ų173131.5 Ų131.591%0.90679%0.788SS**  trans-43.4120.1-171.1-74.3167.1000110.4Q183 G187Q183-L185 PolarHBondContact O-N 2.91Å; L185-G187 PolarHBondContact O-N 3.47Å
186Q52.8Low50.6Low188 Ų188128.7 Ų128.788%0.87978%0.781SS**  trans-54.6118.9179.6-170.8178.263.600108G184 V188G184-Q186 PolarHBondContact O-N 2.86Å; G184-Q186 VanDerWaalsContact O-N 3.12Å; Q186-V188 PolarHBondContact O-N 3.45Å
187G50.7Low50.6Low70 Ų70129 Ų12972%0.72278%0.78SS**  trans-52.5113-168.200000110.8L185 K189L185-G187 PolarHBondContact O-N 3.47Å; G187-K189 PolarHBondContact O-N 2.81Å; G187-K189 VanDerWaalsContact O-N 3.17Å
188V48.1Very low50.5Low122 Ų122131 Ų13174%0.73978%0.776SS**PPolyproline II helixtrans-51.5124.8-179.1-81.40000109Q186 G190Q186-V188 PolarHBondContact O-N 3.45Å; V188-G190 PolarHBondContact O-N 3.34Å
189K53Low50.1Low202 Ų202130.8 Ų130.888%0.87877%0.773SS**PPolyproline II helixtrans-48.5117.9179.7-175.6175.7-176.5174.80108.1G187 H191G187-K189 PolarHBondContact O-N 2.81Å; G187-K189 VanDerWaalsContact O-N 3.17Å; K189-H191 PolarHBondContact O-N 2.99Å
190G50Low50.4Low64 Ų64131.9 Ų131.966%0.6677%0.772SS**PPolyproline II helixtrans-47.3126.2-171.100000110.2V188 K192V188-G190 PolarHBondContact O-N 3.34Å; G190-K192 PolarHBondContact O-N 3.45Å
191H46.2Very low50.6Low164 Ų164127.3 Ų127.376%0.75976%0.764SS**PPolyproline II helixtrans-55133.7-177.2-58.51000107.9K189 G193K189-H191 PolarHBondContact O-N 2.99Å; H191-G193 PolarHBondContact O-N 3.49Å
192K50.3Low50.3Low207 Ų207127.8 Ų127.890%0.977%0.768SS**  trans-50114.2-178.1-173.1179.9-174.8-179.60107.4G190 R194G190-K192 PolarHBondContact O-N 3.45Å; K192-R194 PolarHBondContact O-N 2.86Å
193G48.8Very low50.5Low63 Ų63127.1 Ų127.165%0.64977%0.767SS**PPolyproline II helixtrans-49.2128.8-170.900000109.3H191 A195H191-G193 PolarHBondContact O-N 3.49Å; G193-A195 PolarHBondContact O-N 3.45Å; G193-A195 VanDerWaalsContact O-N 3.07Å
194R51.7Low50.4Low230 Ų230125.5 Ų125.587%0.86876%0.762SS**PPolyproline II helixtrans-48.6124.1176.8-170.3-177.7-168.3-148.54106.2K192 G196K192-R194 PolarHBondContact O-N 2.86Å; R194-G196 PolarHBondContact O-N 3.29Å
195A47.2Very low50Low90 Ų90125.2 Ų125.274%0.74476%0.76SS**PPolyproline II helixtrans-47.2123.8-178.300000107.5G193 V197G193-A195 PolarHBondContact O-N 3.45Å; G193-A195 VanDerWaalsContact O-N 3.07Å; A195-V197 PolarHBondContact O-N 3.02Å
196G46.8Very low50.3Low68 Ų68126.2 Ų126.270%0.70176%0.757SS**PPolyproline II helixtrans-49.8130-17500000108R194 L198R194-G196 PolarHBondContact O-N 3.29Å; G196-L198 PolarHBondContact O-N 3Å
197V51.8Low50.8Low126 Ų126123.1 Ų123.176%0.76475%0.753SS**PPolyproline II helixtrans-49.9124.7171.8179.80000105.3A195 G199A195-V197 PolarHBondContact O-N 3.02Å; V197-G199 PolarHBondContact O-N 3.31Å
198L49.2Very low50.8Low145 Ų145122.6 Ų122.676%0.75975%0.748SS**  trans-48.1111.2178176.671.7000106.1G196 D200G196-L198 PolarHBondContact O-N 3Å; L198-D200 PolarHBondContact O-N 3.3Å; L198-D200 VanDerWaalsContact O-N 3.14Å
199G47.8Very low51Low58 Ų58123.1 Ų123.160%0.59875%0.754SS**  trans-55.2126.8-179.200000107V197V197-G199 PolarHBondContact O-N 3.31Å
200D55.6Low51.1Low150 Ų150123.1 Ų123.180%0.80275%0.754SS**  trans-45.8121.7-177.3-68-62.5000108L198 G202L198-D200 PolarHBondContact O-N 3.3Å; L198-D200 VanDerWaalsContact O-N 3.14Å; D200-G202 PolarHBondContact O-N 3.44Å
201P59.7Low51Low110 Ų110123.1 Ų123.171%0.71475%0.754SS**  trans-49.5113.8-172.7-30.935.6000109.1S203P201-S203 PolarHBondContact O-N 3.19Å
202G46.3Very low51.3Low67 Ų67123.1 Ų123.169%0.69176%0.76SS**  trans-48.2120.5-163.700000109.3D200 I204D200-G202 PolarHBondContact O-N 3.44Å; G202-I204 PolarHBondContact O-N 2.84Å
203S51.2Low51.3Low115 Ų115120.2 Ų120.280%0.80476%0.759SS**  trans-49.9113.4-170.247.30000108.6P201 G205P201-S203 PolarHBondContact O-N 3.19Å; S203-G205 PolarHBondContact O-N 2.88Å
204I51.3Low51Low159 Ų159120.4 Ų120.482%0.81576%0.761SS**  trans-52.3114.7-177.8-70.7173.2000105.9G202 K206G202-I204 PolarHBondContact O-N 2.84Å; I204-K206 PolarHBondContact O-N 3.11Å; I204-K206 VanDerWaalsContact O-N 3.11Å
205G45.6Very low50.4Low59 Ų59117.6 Ų117.661%0.60876%0.761SS**PPolyproline II helixtrans-52.4124.4-174.500000108S203 P207S203-G205 PolarHBondContact O-N 2.88Å; G205-P207 WeakPolarHBondContact O-CD 3.42Å
206K52.8Low50.2Low194 Ų194118.7 Ų118.784%0.84376%0.763SS**PPolyproline II helixtrans-48119.8-179.2-66.9-178.1-178.6178.40107.2I204 G208I204-K206 PolarHBondContact O-N 3.11Å; I204-K206 VanDerWaalsContact O-N 3.11Å; K206-G208 PolarHBondContact O-N 2.86Å; K206-G208 VanDerWaalsContact O-N 3.13Å
207P62.6Low50Low122 Ų122118.6 Ų118.679%0.79276%0.762SS**PPolyproline II helixtrans-50.6126178.5-29.536.1000109.1G205G205-P207 WeakPolarHBondContact O-CD 3.42Å
208G50.1Low50.2Low60 Ų60120.1 Ų120.162%0.61976%0.761SS**PPolyproline II helixtrans-57146.8-17500000110.8K206 K210K206-G208 PolarHBondContact O-N 2.86Å; K206-G208 VanDerWaalsContact O-N 3.13Å; G208-K210 PolarHBondContact O-N 3.42Å
209P52.8Low50Low133 Ų133122.5 Ų122.586%0.86477%0.768SS**  trans-59.4114.3-179.925.6-33.5000109.1G211P209-G211 PolarHBondContact O-N 3.42Å; P209-G211 VanDerWaalsContact O-N 3.12Å
210K54.7Low49.9Very low201 Ų201122.8 Ų122.887%0.87477%0.772SS**  trans-69.4108.8171.5-173179.8-179.2-174.40106.7G208G208-K210 PolarHBondContact O-N 3.42Å
211G48.5Very low49.4Very low64 Ų64123.7 Ų123.766%0.6677%0.774SS**  trans-60.9148-176.600000112.8P209P209-G211 PolarHBondContact O-N 3.42Å; P209-G211 VanDerWaalsContact O-N 3.12Å
212D51.8Low49.4Very low165 Ų165124 Ų12488%0.88278%0.776SS**  trans-68.7133.1-177.2-53-73.6000112.3
213V51Low49.8Very low146 Ų146123.6 Ų123.689%0.88577%0.773SS**  trans-133.3135.2153-179.70000106.5
214G41.8Very low49.8Very low67 Ų67124.2 Ų124.269%0.69177%0.774SS**  trans-73.8163.9-161.200000117.3
215I40.4Very low50.4Low171 Ų171122.7 Ų122.788%0.87777%0.774SS**  trans-14.9150.5150.463.9179.3000116.4
216S42.5Very low50.7Low112 Ų112122.9 Ų122.978%0.78378%0.777SS**  cis-153.5170.23.7-145.80000107.7
217G42.8Very low50.3Low66 Ų66120.4 Ų120.468%0.6878%0.78SS**  cis-164.4-163.312.700000114.7
218E55.3Low49.7Very low158 Ų158122.6 Ų122.674%0.73879%0.785SS**  trans-84.1134.1-154.5-58.7176.3146.100114.2Q60Q60-E218 PolarHBondContact NE2-OE1 2.81Å
219Q45.6Very low49.7Very low195 Ų195122.9 Ų122.991%0.91179%0.787SS**  trans-123.1127.6152.8-163.2173.31500107.9
220G45Very low49.5Very low65 Ų65122.9 Ų122.967%0.6778%0.779SS**  trans-61.7149.9-16300000115.1P222G220-P222 WeakPolarHBondContact O-CD 3.46Å
221I46.4Very low49.2Very low168 Ų168124.6 Ų124.686%0.86278%0.78SS**  trans-59.3112.5-176.6-54.3166.4000110.8
222P59.9Low48.7Very low116 Ų116123.9 Ų123.975%0.75377%0.773SS**PPolyproline II helixtrans-72.4142.7165.7-12.331000109.2G220G220-P222 WeakPolarHBondContact O-CD 3.46Å
223G54.5Low48.3Very low60 Ų60127.1 Ų127.162%0.61977%0.774SS**PPolyproline II helixtrans-59156.2-179.100000113.4
224P51.4Low48.7Very low127 Ų127126.1 Ų126.183%0.82577%0.771SS**PPolyproline II helixtrans-58.5128-176.623.9-33.8000111.4
225P62.2Low48.8Very low127 Ų127126.4 Ų126.483%0.82577%0.773SS**PPolyproline II helixtrans-58.6139175.5-25.635000112.3
226G52.3Low48.5Very low64 Ų64126.7 Ų126.766%0.6677%0.773SS**PPolyproline II helixtrans-65.3162.517500000113.2
227P45.3Very low48.7Very low141 Ų141130 Ų13092%0.91678%0.779SS**PPolyproline II helixtrans-65.5153-175.526.9-34.4000113.7
228L49Very low48.9Very low169 Ų169130 Ų13089%0.88578%0.778SS**PPolyproline II helixtrans-77.3141.2-163.8-15579.3000114.7
229G50.1Low48.6Very low65 Ų65128.9 Ų128.967%0.6779%0.785SS**PPolyproline II helixtrans-97166.2167.300000113.8
230L49.7Very low49Very low134 Ų134127.1 Ų127.170%0.70277%0.774SS**  trans-120.199.9-163.9-79.7163.5000116.4
231R47.6Very low49.3Very low237 Ų237126.7 Ų126.789%0.89477%0.77SS**  trans62.1119.5131.2-169.5-174-170.5-174.53.1121.8
232G38.3Very low49.1Very low49 Ų49123.4 Ų123.451%0.50575%0.751SS.*  trans-166.2147151.700000116.9
233Y42.5Very low48.9Very low233 Ų233123 Ų12391%0.91476%0.757SS**  trans-149.9167.5173.3-87.3-66.9000107.3
234P60.4Low48.5Very low125 Ų125123.6 Ų123.681%0.81276%0.764SS**  cis-141.8-179.7-11.834-12000117.1
235G42.3Very low48.5Very low72 Ų72124 Ų12474%0.74277%0.766SS**  trans119.3147.8148.400000117.4
236M34.8Very low48.4Very low178 Ų178129.1 Ų129.188%0.87777%0.769SS**  cis-151.5149.4-6.9-86.2179.656.100112.1
237M46.9Very low48.2Very low182 Ų182128.9 Ų128.990%0.89777%0.767SS**  trans-24.7158.1163-175.2172.764.700119.2
238G46.4Very low48.3Very low65 Ų65133.4 Ų133.467%0.6777%0.767SS**  cis-176-152.39.700000109.5
239P50.6Low48.2Very low135 Ų135134.3 Ų134.388%0.87776%0.764SS**  cis-136.8-163744.9-25.2000116.7
240K53.3Low48.1Very low158 Ų158133.9 Ų133.969%0.68776%0.76SS**  trans-89.2170.1-177.4-164.1-179.3175.3-1700111.9
241G51.9Low47.9Very low56 Ų56135.4 Ų135.458%0.57777%0.767SS**  cis-154.8-152.86.300000112.4
242E42.3Very low47.7Very low98 Ų98131 Ų13146%0.45877%0.766SS.*  cis-139.8177.3-7.8-7289.4-156.200111.1G478E242-G478 VanDerWaalsContact CD-N 3.31Å; E242-G478 WeakPolarHBondContact OE2-CA 3.48Å; E242-G478 PolarHBondContact OE2-N 3.29Å
243A55.3Low48Very low108 Ų108131.6 Ų131.689%0.89377%0.772SS**  trans-141143176.500000113.9
244G46.5Very low48.8Very low73 Ų73126.7 Ų126.775%0.75377%0.769SS**  trans177.4161.2159.600000112.4
245P50.3Low48.2Very low135 Ų135127.9 Ų127.988%0.87777%0.774SS**  cis-108.1169.7-16.531.6-15.3000112.3
246R60.3Low48.6Very low234 Ų234127.6 Ų127.688%0.88377%0.771SS**  trans-90.9129-171.1-174.9177.2-179169.1-2.5112.6
247G47.7Very low49.1Very low60 Ų60127.2 Ų127.262%0.61977%0.77SS**  trans-124112.8168.300000111.7
248Y47.5Very low50Low235 Ų235124.1 Ų124.192%0.92276%0.764SS**  trans45.4123.4164.8-54.6-78.6000119.9
249K48Very low50.2Low188 Ų188124.2 Ų124.282%0.81777%0.765SS**  trans-131.9120.2167.4-164.7177.2-171.2-179.20111.2
250G47.6Very low50.4Low57 Ų57123.8 Ų123.859%0.58876%0.762SS**  trans-100.9137.6155.500000110.2
251I46.3Very low50.9Low166 Ų166122.4 Ų122.485%0.85177%0.769SS**  trans2.4142.6143.651.3172.7000117.7
252V41.6Very low50.6Low143 Ų143123.7 Ų123.787%0.86778%0.782SS**  cis-138.2168.423.2174.60000107.9
253G45.1Very low50.9Low62 Ų62126.2 Ų126.264%0.63979%0.794SS**  cis-171.7-156.61.500000110.7
254P60.1Low50.9Low130 Ų130130.4 Ų130.484%0.84480%0.795SS**  trans-100.6143.3-171.336.6-32.2000115.5
255V47.4Very low50.8Low151 Ų151130.1 Ų130.192%0.91579%0.792SS**  trans-123.4141.1165.2177.20000108.5
256G50.1Low50.9Low66 Ų66129 Ų12968%0.6878%0.784SS**PPolyproline II helixtrans-75173-160.600000117.4P258G256-P258 WeakPolarHBondContact O-CD 3.35Å
257I45.3Very low50.4Low169 Ų169127.3 Ų127.387%0.86779%0.787SS**PPolyproline II helixtrans-91.8120.2-171.3-53.6169.9000110.9
258P66.4Low50.5Low118 Ų118127.5 Ų127.577%0.76679%0.789SS**PPolyproline II helixtrans-72.5141.2165.4-16.532.6000111.7G256G256-P258 WeakPolarHBondContact O-CD 3.35Å
259G51.8Low50.9Low66 Ų66122.9 Ų122.968%0.6879%0.788SS**PPolyproline II helixtrans-76157.2-174.500000115.1
260P53.3Low51.1Low127 Ų127122.5 Ų122.583%0.82579%0.793SS**PPolyproline II helixtrans-79138-177.931.4-34.4000113.2
261P63.8Low51.2Low129 Ų129123 Ų12384%0.83880%0.799SS**PPolyproline II helixtrans-64.9155.4163-20.534.1000112.6
262G47.1Very low51.9Low82 Ų82123.2 Ų123.285%0.84580%0.802SS**PPolyproline II helixtrans-91.4164.3-170.800000116.5
263E48.3Very low52.3Low152 Ų152122.2 Ų122.271%0.7180%0.801SS**  trans-104.5151.8-178.9-64.3-172142.300113.4
264E53.8Low52.2Low196 Ų196122.7 Ų122.792%0.91681%0.806SS**PPolyproline II helixtrans-96.1156.1177.6-165.3170.4-168.100112.1
265G45.8Very low52.1Low66 Ų66126 Ų12668%0.6881%0.811SS**PPolyproline II helixtrans-89.4170.3-157.900000118.5
266P51.2Low52.6Low111 Ų111128.9 Ų128.972%0.72181%0.811SS**PPolyproline II helixtrans-91.2150.5-170.135.5-36.2000115.4
267Q51Low52.6Low200 Ų200129 Ų12994%0.93581%0.812SS**PPolyproline II helixtrans-96.7154.1173.9-170.3171.3-10.300112.7
268G48.9Very low52.8Low64 Ų64129.1 Ų129.166%0.6681%0.814SS**  trans-78.7-179.2-167.300000118.2
269P56.3Low52.6Low138 Ų138133.4 Ų133.490%0.89682%0.821SS**  trans-84.7154.4-164.834.2-36.6000114.7
270L52.1Low52.3Low179 Ų179134 Ų13494%0.93783%0.826SS**  trans-114.1144173.4-171.562.9000110.6
271G48.9Very low52Low69 Ų69132 Ų13271%0.71183%0.829SS**  trans-92.9-178.3-161.900000117.8
272D62.3Low51.7Low169 Ų169137.9 Ų137.990%0.90483%0.834SS**  trans-82141.9-168.4-65.2-55.3000115.8
273S49.2Very low51.8Low123 Ų123137.3 Ų137.386%0.8683%0.828SS**  136.3152.8124.4-161.10000115.7
274G42.3Very low52Low72 Ų72138.8 Ų138.874%0.74284%0.839SS**  trans166.294.2175.600000111.9
275E59Low52.2Low200 Ų200138.6 Ų138.694%0.93584%0.838SS**PPolyproline II helixtrans-66.7146.8-179.4-66.3179.8118.500112.7
276K58.1Low52.7Low211 Ų211138.1 Ų138.192%0.91783%0.834SS**PPolyproline II helixtrans-102120.2-175.9-165.5178-166174.50111.4
277G48.9Very low53.2Low68 Ų68139.5 Ų139.570%0.70184%0.843SS**PPolyproline II helixtrans-68.1165.9-172.100000117.4
278D50.7Low53.3Low172 Ų172139.1 Ų139.192%0.9284%0.841SS**PPolyproline II helixtrans-68.8151.4-163.3-59.1-74.9000116.7
279K60.9Low53.3Low208 Ų208139 Ų13990%0.90484%0.84SS**PPolyproline II helixtrans-98.6126.5173.2-160.9173.9-173177.80110.4
280G46.6Very low53.4Low77 Ų77137.9 Ų137.979%0.79484%0.842SS**PPolyproline II helixtrans-53.5145.2-169.800000116.2
281G46.5Very low53.5Low85 Ų85136.1 Ų136.188%0.87684%0.839SS**PPolyproline II helixtrans-71.4145.7-167.300000115.9
282R58.1Low53.5Low253 Ų253136 Ų13696%0.95584%0.837SS**PPolyproline II helixtrans-89.5140.1166.7-165.4177.2-174.8-162.40.6109
283G48.6Very low53.5Low70 Ų70138.7 Ų138.772%0.72284%0.841SS**PPolyproline II helixtrans-58.6151.2-167.100000116.1Q285G283-Q285 PolarHBondContact O-N 3.39Å
284I53.5Low53.7Low184 Ų184142.8 Ų142.894%0.94484%0.843SS**  trans-61.9110.5-179.945.3169.2000112.6
285Q57.5Low53.8Low191 Ų191142.3 Ų142.389%0.89384%0.838SS**  trans-96.7131.1164.9-168.4169.14.300108.7G283G283-Q285 PolarHBondContact O-N 3.39Å
286G55.6Low53.6Low57 Ų57142.3 Ų142.359%0.58884%0.838SS**  trans-63.8159.3-16600000115.5Q288G286-Q288 PolarHBondContact O-N 3.44Å
287P62.3Low53Low140 Ų140139.8 Ų139.891%0.90984%0.835SS**  trans-72.2102-173.329.5-34.8000111.8
288Q52.7Low52.6Low192 Ų192139.7 Ų139.790%0.89783%0.833SS**  trans-86.2128.3169.7-167.9165.1-2000110G286G286-Q288 PolarHBondContact O-N 3.44Å
289G49.6Very low52.7Low62 Ų62140.3 Ų140.364%0.63984%0.836SS**  trans-69.8161-157.900000117.1V291G289-V291 PolarHBondContact O-N 2.77Å
290A59Low52.2Low113 Ų113136.3 Ų136.393%0.93483%0.831SS**  trans-65.7115.517900000112.3
291V54.3Low52Low143 Ų143136.4 Ų136.487%0.86783%0.832SS**PPolyproline II helixtrans-96.4128.4169.8177.20000108.8G289G289-V291 PolarHBondContact O-N 2.77Å
292G48.3Very low52Low66 Ų66140 Ų14068%0.6883%0.83SS**PPolyproline II helixtrans-74.4162.4-160.700000116.6K294G292-K294 PolarHBondContact O-N 2.92Å
293K62Low51.5Low225 Ų225135.8 Ų135.898%0.97883%0.826SS**PPolyproline II helixtrans-59.7116.6171.8-62.7-176.8178.9-176.70110
294K52.2Low51.3Low210 Ų210135.5 Ų135.591%0.91382%0.823SS**PPolyproline II helixtrans-102.9130.2174.8-166171.5-179.1178.90110.3G292G292-K294 PolarHBondContact O-N 2.92Å
295G46.3Very low50.8Low61 Ų61136.5 Ų136.563%0.62982%0.821SS**PPolyproline II helixtrans-61.8160.5-156.400000119N297G295-N297 PolarHBondContact O-N 3.16Å
296E54.1Low50.6Low200 Ų200135.7 Ų135.794%0.93582%0.822SS**PPolyproline II helixtrans-64.8116.3161.6-65.4174.9123.400109.3
297N45.7Very low50.1Low159 Ų159136 Ų13685%0.8583%0.825SS**  trans-108.1102.7175.3-89.314.3000110.9G295G295-N297 PolarHBondContact O-N 3.16Å
298G40.6Very low49.3Very low65 Ų65135.9 Ų135.967%0.6782%0.822SS**  trans56.5117.4142.200000119.7P300G298-P300 WeakPolarHBondContact O-CD 3.32Å
299L53Low49.3Very low186 Ų186133.2 Ų133.297%0.97482%0.821SS**  trans-71121.8158.3-69.8167.6000110.5
300P48.9Very low49.3Very low123 Ų123133.5 Ų133.580%0.79982%0.824SS**  trans-115.4127.5173.812.711000112.4G298G298-P300 WeakPolarHBondContact O-CD 3.32Å
301G43.2Very low49Very low80 Ų80135.9 Ų135.983%0.82582%0.82SS**  trans83.296155.400000117.2
302I47.5Very low49.6Very low161 Ų161134.8 Ų134.883%0.82682%0.816SS**  trans-80.8151.2155.138.9170.1000111.1
303D46.7Very low49.9Very low163 Ų163135.1 Ų135.187%0.87282%0.819SS**  trans72.7125.6164.5-65.3-15.3000121.3
304G44.1Very low49.7Very low64 Ų64132.7 Ų132.766%0.6682%0.815SS**  trans-172.651-178.900000114.8
305K44.3Very low50.1Low206 Ų206132.5 Ų132.590%0.89681%0.814SS**  trans57.1141.7154.660.6-175.1169.7-171.10120.2
306D51.3Low50.7Low173 Ų173132.8 Ų132.893%0.92582%0.817SS**  trans-58.8146.7-176.4-59.7-78.4000115.4
307G46.3Very low50.9Low63 Ų63127.8 Ų127.865%0.64981%0.81SS**  trans-176.797.6172.900000115.4
308T45.3Very low52.2Low139 Ų139126.1 Ų126.185%0.85381%0.808SS**  trans69.2128.9165.867.40000118.9G310T308-G310 PolarHBondContact O-N 3.26Å
309P53.3Low53.3Low135 Ų135126.5 Ų126.588%0.87781%0.812SS**  trans-68.4113.7171.6-19.432.7000112.5
310G48.9Very low53.8Low68 Ų68126.7 Ų126.770%0.70181%0.808SS**PPolyproline II helixtrans-70.9137.5169.500000112.1T308T308-G310 PolarHBondContact O-N 3.26Å
311I53.2Low54.9Low163 Ų163126.8 Ų126.884%0.83681%0.808SS**PPolyproline II helixtrans-57.2128.8178.2-57.3160.7000109.4G313I311-G313 PolarHBondContact O-N 3.37Å; I311-G313 VanDerWaalsContact O-N 3.11Å
312P67.4Low55.8Low121 Ų121126.5 Ų126.579%0.78681%0.805SS**PPolyproline II helixtrans-56.7118.4174.9-26.635.5000111.5
313G54.6Low56.5Low73 Ų73127.6 Ų127.675%0.75381%0.809SS**PPolyproline II helixtrans-60.6139.2-179.800000112I311 K315I311-G313 PolarHBondContact O-N 3.37Å; I311-G313 VanDerWaalsContact O-N 3.11Å; G313-K315 PolarHBondContact O-N 3.48Å; G313-K315 VanDerWaalsContact O-N 3.11Å
314I55.8Low57.9Low173 Ų173125.9 Ų125.989%0.88781%0.807SS**  trans-55.6115.6174.748.8172.9000110.4G316I314-G316 PolarHBondContact O-N 3.27Å
315K62.6Low58.9Low207 Ų207126 Ų12690%0.981%0.807SS**PPolyproline II helixtrans-65.1123.9170.9-174176.1-179.5179.10107.8G313G313-K315 PolarHBondContact O-N 3.48Å; G313-K315 VanDerWaalsContact O-N 3.11Å
316G58.4Low60Low66 Ų66122.1 Ų122.168%0.6880%0.803SS**PPolyproline II helixtrans-52.9142.6-175.800000112.9I314I314-G316 PolarHBondContact O-N 3.27Å
317A58.1Low61.1Low95 Ų95120 Ų12079%0.78580%0.799SS**PPolyproline II helixtrans-58.3137.3179.900000111G319A317-G319 PolarHBondContact O-N 2.84Å
318P73.8Confident61.8Low125 Ų125120.3 Ų120.381%0.81280%0.802SS**PPolyproline II helixtrans-54.8139.2167.4-23.534.1000110.6
319G62.4Low62.4Low73 Ų73120.1 Ų120.175%0.75380%0.803SS**PPolyproline II helixtrans-58.5142.5-178.900000112.3A317A317-G319 PolarHBondContact O-N 2.84Å
320Q64.2Low62.6Low190 Ų190118.4 Ų118.489%0.88880%0.8SS**PPolyproline II helixtrans-61.9134.3178-71.5-177.5-9.400110.8
321P72.1Confident63Low125 Ų125119 Ų11981%0.81281%0.807SS**PPolyproline II helixtrans-57.3140.4166.6-23.334.2000111
322G61.7Low62.7Low73 Ų73118.2 Ų118.275%0.75381%0.81SS**PPolyproline II helixtrans-62.2144179.600000112.7
323M62.3Low61.8Low185 Ų185117.3 Ų117.391%0.91181%0.812SS**PPolyproline II helixtrans-63.8136-179.8-67.1177.766.900111.8
324P75.4Confident61.5Low127 Ų127117.6 Ų117.683%0.82582%0.815SS**PPolyproline II helixtrans-59.4144.1169.4-23.634.4000112.2
325G64.8Low61.1Low65 Ų65117.3 Ų117.367%0.6781%0.814SS**PPolyproline II helixtrans-68.1154.4178.500000113.4
326P67.2Low60.6Low125 Ų125113.2 Ų113.281%0.81281%0.809SS**PPolyproline II helixtrans-67.9145.4-177.728-34.8000112.4
327P74.4Confident60Low130 Ų130113.9 Ų113.984%0.84482%0.816SS**PPolyproline II helixtrans-61.1145.3175.5-23.234.1000113.4
328G61.2Low59.3Low68 Ų68115.6 Ų115.670%0.70182%0.817SS**PPolyproline II helixtrans-71.3150.5176.200000113.3
329P58.1Low58.3Low135 Ų135115.8 Ų115.888%0.87782%0.818SS**PPolyproline II helixtrans-69.7145.1-179.929.1-34.7000112.3
330A58.1Low57.7Low99 Ų99116.3 Ų116.382%0.81882%0.824SS**PPolyproline II helixtrans-73.3144.1-177.200000113.1
331G57Low56.6Low82 Ų82111 Ų11185%0.84582%0.82SS**PPolyproline II helixtrans-75.3144.2175.200000113.1
332T47.7Very low55.5Low146 Ų146115.1 Ų115.190%0.89683%0.825SS**PPolyproline II helixtrans-85151.5177.545.80000112.3
333A48.5Very low55.2Low101 Ų101115.2 Ų115.284%0.83583%0.826SS**PPolyproline II helixtrans-75.4150.1-175.300000113.6
334G48.6Very low54Low79 Ų79115.5 Ų115.581%0.81483%0.825SS**PPolyproline II helixtrans-78.3152.2176.700000113.9
335L46.4Very low52.9Low167 Ų167115.4 Ų115.487%0.87482%0.824SS**PPolyproline II helixtrans-82.5151.4179.3-72.3162.9000112.3
336P52.9Low52.1Low122 Ų122116 Ų11679%0.79283%0.83SS**PPolyproline II helixtrans-65.4144.2179-20.333.1000113.7
337G45.9Very low51.7Low79 Ų79121.9 Ų121.981%0.81484%0.836SS**PPolyproline II helixtrans-74.5143.7178.100000113.6
338T42.3Very low50.1Low131 Ų131125.8 Ų125.880%0.80484%0.84SS**PPolyproline II helixtrans-88.3147.5176.744.70000112.3
339P53Low49.5Very low130 Ų130126 Ų12684%0.84484%0.843SS**PPolyproline II helixtrans-64.2145.9-178.8-23.735000114.4
340G48.8Very low49Very low84 Ų84128.6 Ų128.687%0.86684%0.843SS**PPolyproline II helixtrans-74133.5-175.200000114.7
341G42.6Very low48.3Very low78 Ų78130.1 Ų130.180%0.80484%0.844SS**PPolyproline II helixtrans-90.8140.1174.100000113.3
342K47.9Very low48Very low212 Ų212129.5 Ų129.592%0.92284%0.838SS**PPolyproline II helixtrans-78.8137.6172-163.7175.8-177.5-179.10109.3
343G56.2Low48.7Very low75 Ų75128.7 Ų128.777%0.77384%0.835SS**PPolyproline II helixtrans-75.2162.2-164.800000116.7
344E37.5Very low48.5Very low190 Ų190135.7 Ų135.789%0.88884%0.84SS**  trans-133.3166.6178.7-86.2-147.6127.400113.5
345P52.1Low48.6Very low126 Ų126134.5 Ų134.582%0.81883%0.828SS**  trans-80.2-170.8-158.5-18.735.8000118.7
346G47.5Very low48.7Very low77 Ų77135.5 Ų135.579%0.79483%0.827SS**  trans-71170.8-153.800000120.7
347R59Low48.1Very low249 Ų249135.6 Ų135.694%0.9483%0.831SS**  trans-75152.7-160.1-62.4174.6169.4-167.4-6.7116.2
348K41Very low47.9Very low212 Ų212135.4 Ų135.492%0.92283%0.829SS**  trans-120.7145.8157.7-163.3172.8-177.1178.60109.5
349G47.4Very low47.6Very low73 Ų73137.7 Ų137.775%0.75383%0.832SS**  trans-77162.8-156.200000118.6
350E48.9Very low47.7Very low188 Ų188137.6 Ų137.688%0.87983%0.832SS**  trans-91.2141.4-172.8-58.2168.6134.700113.5
351P43.8Very low47.5Very low132 Ų132137 Ų13786%0.85783%0.825SS**  trans-92.4114.4152.3-5.725.1000110.4
352G50.4Low47.6Very low68 Ų68139.6 Ų139.670%0.70183%0.826SS**  trans-85.6-162.816300000111.7
353P62.3Low48.1Very low129 Ų129135.5 Ų135.584%0.83882%0.821SS**  cis-134.9168.3-10.941-26.4000113.9
354R43.7Very low47.9Very low249 Ų249135 Ų13594%0.9482%0.816SS**  trans-163.5103.4136.1-154.3165.4-177.8164.1-0112
355G51.7Low48.5Very low54 Ų54132.2 Ų132.256%0.55782%0.815SS**  trans-80.1-175.1166.700000112
356H48.4Very low48.5Very low187 Ų187134.2 Ų134.287%0.86682%0.817SS**  cis-1541538.1-63.169.5000109.6
357S40.1Very low48.5Very low124 Ų124133.4 Ų133.487%0.86781%0.809SS**  trans-166.1133.3138.730.40000110.9
358G41.4Very low47.9Very low75 Ų75130.3 Ų130.377%0.77381%0.806SS**  trans-79.7-176.8176.600000112.8
359M36.5Very low48.9Very low179 Ų179126 Ų12688%0.88280%0.799SS**  cis-136.9154.112.2-96.2162.65000111.3
360P53.6Low49.2Very low128 Ų128125.9 Ų125.983%0.83180%0.798SS**PPolyproline II helixtrans-66.3131.5172.9-18.232000112.6
361G44.4Very low49.1Very low71 Ų71124.7 Ų124.773%0.73280%0.796SS**PPolyproline II helixtrans-75.6152.2159.100000111
362T45.7Very low50.1Low134 Ų134123.8 Ų123.882%0.82279%0.79SS**PPolyproline II helixtrans-57.7146-170.447.20000114.5G364T362-G364 PolarHBondContact O-N 3.2Å
363P59.2Low50.4Low126 Ų126124 Ų12482%0.81879%0.792SS**PPolyproline II helixtrans-53.6136168.9-24.134000111.9
364G50.8Low49.8Very low64 Ų64126.7 Ų126.766%0.6679%0.794SS**PPolyproline II helixtrans-64.7152.8168.400000111.1T362T362-G364 PolarHBondContact O-N 3.2Å
365P50.3Low50.6Low132 Ų132120.8 Ų120.886%0.85779%0.787SS**PPolyproline II helixtrans-60.1146.5-177.525.3-34.1000111.7G367P365-G367 PolarHBondContact O-N 2.95Å
366L52Low50.8Low167 Ų167121.7 Ų121.787%0.87480%0.797SS**PPolyproline II helixtrans-50.9120.8170.9179.167.9000109.3E368L366-E368 PolarHBondContact O-N 3Å
367G48Very low50.4Low61 Ų61121.3 Ų121.363%0.62980%0.797SS**PPolyproline II helixtrans-59.6131.3172.700000109.9P365P365-G367 PolarHBondContact O-N 2.95Å
368E46.5Very low51.2Low184 Ų184124.3 Ų124.386%0.8680%0.798SS**PPolyproline II helixtrans-56.2138.7178.3-66-177.5133.600110.1L366 G370L366-E368 PolarHBondContact O-N 3Å; E368-G370 PolarHBondContact O-N 3.37Å
369P62.4Low51.7Low121 Ų121123.7 Ų123.779%0.78679%0.792SS**PPolyproline II helixtrans-53.1127.8177.1-26.835000110.6I371P369-I371 PolarHBondContact O-N 2.86Å
370G52.5Low52Low71 Ų71121.5 Ų121.573%0.73279%0.788SS**PPolyproline II helixtrans-53.3129.6-179.600000110.9E368E368-G370 PolarHBondContact O-N 3.37Å
371I47.9Very low52.4Low162 Ų162120.9 Ų120.983%0.83178%0.784SS**PPolyproline II helixtrans-51.5125177.4-48.7171.3000107.5P369 G373P369-I371 PolarHBondContact O-N 2.86Å; I371-G373 PolarHBondContact O-N 3.24Å
372P65.2Low53Low114 Ų114120.3 Ų120.374%0.7478%0.779SS**PPolyproline II helixtrans-52.9129.2178-27.535.2000110.1E374P372-E374 PolarHBondContact O-N 3.32Å
373G56.4Low53.4Low72 Ų72120.3 Ų120.374%0.74278%0.781SS**PPolyproline II helixtrans-55.2131-177.100000110.7I371I371-G373 PolarHBondContact O-N 3.24Å
374E48.3Very low53.1Low186 Ų186124 Ų12487%0.86978%0.784SS**PPolyproline II helixtrans-53.4130.3177.2-69.1-172.7124.200109.3P372 G376P372-E374 PolarHBondContact O-N 3.32Å; E374-G376 PolarHBondContact O-N 3.47Å; E374-G376 VanDerWaalsContact O-N 3.14Å
375P61.8Low53.3Low124 Ų124124 Ų12481%0.80578%0.784SS**PPolyproline II helixtrans-52.2124.7174.8-2735.1000109.5M377P375-M377 PolarHBondContact O-N 3.18Å
376G55.1Low53Low73 Ų73125.7 Ų125.775%0.75379%0.786SS**PPolyproline II helixtrans-53.5126.2-176.700000110.1E374 E378E374-G376 PolarHBondContact O-N 3.47Å; E374-G376 VanDerWaalsContact O-N 3.14Å; G376-E378 PolarHBondContact O-N 3.29Å
377M39.4Very low52.8Low179 Ų179129.8 Ų129.888%0.88279%0.79SS**  trans-55.1114.1179-76.9-173.76900109.2P375 G379P375-M377 PolarHBondContact O-N 3.18Å; M377-G379 PolarHBondContact O-N 3.17Å
378E58Low52.6Low187 Ų187129.9 Ų129.987%0.87479%0.791SS**  trans-53129.2175.8-168.3173.7-172.100108.7G376 V380G376-E378 PolarHBondContact O-N 3.29Å; E378-V380 PolarHBondContact O-N 3.23Å
379G51.7Low52.6Low63 Ų63130.3 Ų130.365%0.64979%0.793SS**  trans-56.3126-166.100000111.5M377 P381M377-G379 PolarHBondContact O-N 3.17Å; G379-P381 WeakPolarHBondContact O-CD 3.35Å
380V42.1Very low51.8Low132 Ų132136.6 Ų136.680%0.880%0.801SS**  trans-49.8114.6179.8-176.30000108.4E378 G382E378-V380 PolarHBondContact O-N 3.23Å; V380-G382 PolarHBondContact O-N 3.12Å
381P62.8Low51.6Low115 Ų115135.8 Ų135.875%0.74779%0.793SS**  trans-58127.7-175.8-27.635.9000109.6G379G379-P381 WeakPolarHBondContact O-CD 3.35Å
382G58Low52.1Low60 Ų60134 Ų13462%0.61979%0.791SS**  trans-51.6139.5179.200000110.1V380 K384V380-G382 PolarHBondContact O-N 3.12Å; G382-K384 PolarHBondContact O-N 3.21Å
383P53.3Low51.8Low134 Ų134136.1 Ų136.187%0.8780%0.802SS**  trans-52.1108.9-170.518.1-31.3000110.5G385P383-G385 PolarHBondContact O-N 3.2Å
384K51.8Low51.5Low203 Ų203135.4 Ų135.488%0.88380%0.795SS**  trans-59.5110.3-177.5178.8179.6-178.8176.90107.8G382 D386G382-K384 PolarHBondContact O-N 3.21Å; K384-D386 PolarHBondContact O-N 3.11Å
385G55.2Low51.8Low65 Ų65132.9 Ų132.967%0.6780%0.795SS**  trans-51.4136.6-172.100000112.5P383 R387P383-G385 PolarHBondContact O-N 3.2Å; G385-R387 PolarHBondContact O-N 2.95Å
386D44.7Very low51.4Low166 Ų166136.6 Ų136.689%0.88880%0.801SS**  trans-54113.2-178.6-74.3-49.8000110.5K384 G388K384-D386 PolarHBondContact O-N 3.11Å; D386-G388 PolarHBondContact O-N 2.93Å
387R47.3Very low51.1Low253 Ų253136.6 Ų136.696%0.95580%0.802SS**  trans-67.1108.6180-174.9172.7178.3139.2-3.7107.6G385G385-R387 PolarHBondContact O-N 2.95Å
388G44.5Very low51.6Low64 Ų64133 Ų13366%0.6680%0.801SS**  trans-56.5146.7-154.200000116.2D386 R390D386-G388 PolarHBondContact O-N 2.93Å; G388-R390 PolarHBondContact O-N 3.08Å
389Q46.3Very low51.8Low193 Ų193130.8 Ų130.890%0.90280%0.799SS**  trans-61.5107.5156-69.2-171.213.100108.5G391Q389-G391 VanDerWaalsContact C-N 3.31Å; Q389-G391 PolarHBondContact O-N 3.26Å
390R46.1Very low51.9Low252 Ų252130.8 Ų130.895%0.95180%0.8SS**  trans-68.894.5165.8-174.9177.9-67.4180-3.1106.5G388G388-R390 PolarHBondContact O-N 3.08Å
391G46.8Very low52.6Low54 Ų54134.3 Ų134.356%0.55780%0.804SS**  trans-95-165.8-152.900000116.5Q389Q389-G391 VanDerWaalsContact C-N 3.31Å; Q389-G391 PolarHBondContact O-N 3.26Å
392P59.3Low52.8Low124 Ų124134.7 Ų134.781%0.80581%0.807SS**  trans-75.4143.8163.832.9-32.2000110G394P392-G394 PolarHBondContact O-N 2.99Å; P392-G394 VanDerWaalsContact O-N 3.12Å
393V59.8Low52.8Low160 Ų160135.3 Ų135.397%0.9781%0.813SS**  trans-66.5112.6174.6177.90000108.7
394G48.7Very low52.8Low57 Ų57135 Ų13559%0.58881%0.814SS**  trans-125.4161.1-175.100000112.2P392P392-G394 PolarHBondContact O-N 2.99Å; P392-G394 VanDerWaalsContact O-N 3.12Å
395P54.9Low53.2Low133 Ų133134.7 Ų134.786%0.86481%0.812SS**PPolyproline II helixtrans-73.7158.5-145.726.2-35.5000116.4
396Q54.1Low53.4Low201 Ų201134.8 Ų134.894%0.93981%0.813SS**PPolyproline II helixtrans-47.2140.3-178.7-173.3172.8-23.400114.1
397G48.9Very low53.8Low74 Ų74136.5 Ų136.576%0.76382%0.816SS**PPolyproline II helixtrans-70.8153.9-159.700000117.3
398A48.8Very low54.2Low104 Ų104135 Ų13586%0.8681%0.811SS**PPolyproline II helixtrans-90.2137.7171.700000111.8
399V62.8Low55.1Low139 Ų139134.4 Ų134.484%0.84280%0.804SS**PPolyproline II helixtrans-59.7144.3178.7176.10000111.5
400G53.3Low55.8Low64 Ų64131.7 Ų131.766%0.6680%0.803SS**PPolyproline II helixtrans-57.8136.4178.300000112.8P402G400-P402 WeakPolarHBondContact O-CD 3.35Å
401K56.3Low56.3Low206 Ų206127.3 Ų127.390%0.89680%0.797SS**PPolyproline II helixtrans-70124.2179.8-69.3-174.9177.9-178.60110.5
402P68.1Low56.3Low123 Ų123127.6 Ų127.680%0.79980%0.8SS**PPolyproline II helixtrans-61.2153.6174.3-24.235.2000112.8G400G400-P402 WeakPolarHBondContact O-CD 3.35Å
403G58.2Low56.3Low73 Ų73129.5 Ų129.575%0.75380%0.802SS**PPolyproline II helixtrans-61.8150.3179.200000113.6K405G403-K405 PolarHBondContact O-N 3.06Å
404S53.6Low56.6Low128 Ų128127.4 Ų127.490%0.89579%0.792SS**  trans-6599.3179.149.90000111.5
405K59.2Low56.6Low195 Ų195128 Ų12885%0.84880%0.798SS**PPolyproline II helixtrans-66.5136.7171.6-173.1169.8-176.3166.70109.8G403G403-K405 PolarHBondContact O-N 3.06Å
406G59Low56.8Low67 Ų67127.7 Ų127.769%0.69180%0.796SS**PPolyproline II helixtrans-57.8154.7-174.100000114.7R408G406-R408 PolarHBondContact O-N 3.06Å
407E53.7Low56.6Low203 Ų203127.3 Ų127.395%0.94979%0.794SS**PPolyproline II helixtrans-57.6128-177.8-64.5-178.2151.400111.5
408R55.8Low56.7Low222 Ų222127.3 Ų127.384%0.83879%0.794SS**PPolyproline II helixtrans-82.2133.9176.7-177.1-177.1-68.4176.6-2.3108.3G406G406-R408 PolarHBondContact O-N 3.06Å
409G64.3Low56.4Low51 Ų51130.5 Ų130.553%0.52680%0.796SS.*PPolyproline II helixtrans-55.5161.6172.900000113.2
410P60.3Low55.5Low136 Ų136130.6 Ų130.688%0.88380%0.797SS**PPolyproline II helixtrans-56.3141.2-17022-33.5000112.8G412P410-G412 PolarHBondContact O-N 3.34Å
411I56.4Low55.4Low159 Ų159131 Ų13182%0.81580%0.802SS**PPolyproline II helixtrans-64.1128.2179.2-66.6171.8000109.2
412G46.6Very low54.9Low61 Ų61128.1 Ų128.163%0.62980%0.801SS**PPolyproline II helixtrans-64.8142.3174.500000111.9P410P410-G412 PolarHBondContact O-N 3.34Å
413I58.9Low53.7Low163 Ų163132.2 Ų132.284%0.83681%0.807SS**PPolyproline II helixtrans-58.1130.5176.9-55171.1000108.8G415I413-G415 PolarHBondContact O-N 3.21Å
414P66.1Low53.3Low116 Ų116131.4 Ų131.475%0.75380%0.798SS**PPolyproline II helixtrans-54.1130.8174.2-26.535.3000111.3
415G49Very low52.6Low69 Ų69133.1 Ų133.171%0.71180%0.797SS**PPolyproline II helixtrans-64.1136.2-17300000112.5I413I413-G415 PolarHBondContact O-N 3.21Å
416P60.3Low52Low127 Ų127132 Ų13283%0.82580%0.795SS**PPolyproline II helixtrans-62.9138.6172.426.6-33.2000110.2G418P416-G418 PolarHBondContact O-N 3.37Å
417Q50Low51.1Low193 Ų193131.7 Ų131.790%0.90279%0.792SS**PPolyproline II helixtrans-59.8131.3-179.3-171.3171.4-21.800110.5L419Q417-L419 PolarHBondContact O-N 3.43Å
418G49.7Very low50.3Low74 Ų74130.6 Ų130.676%0.76379%0.785SS**PPolyproline II helixtrans-63.6131.9-166.100000114.1P416P416-G418 PolarHBondContact O-N 3.37Å
419L42Very low49.7Very low171 Ų171129 Ų12990%0.89579%0.786SS**PPolyproline II helixtrans-97.2136167.1-76.6171.8000110.9Q417Q417-L419 PolarHBondContact O-N 3.43Å
420T45.1Very low48.7Very low141 Ų141129.8 Ų129.887%0.86580%0.795SS**PPolyproline II helixtrans-58.2136.1-173.1-50.20000112.8
421G50Low47.7Very low74 Ų74133.4 Ų133.476%0.76380%0.797SS**PPolyproline II helixtrans-73146.9-172.500000114.9
422T46.7Very low47.2Very low145 Ų145132.7 Ų132.789%0.8980%0.8SS**  trans-112.1130.4164.449.90000110.4
423K43.8Very low46.8Very low209 Ų209132.9 Ų132.991%0.90980%0.801SS**  trans-89.7144.9-174.9168.8-170.3174.7-173.40111.1
424G48.8Very low46.5Very low56 Ų56131.4 Ų131.458%0.57780%0.802SS**  trans87.6147.2166.700000114.6
425D39.5Very low46Very low164 Ų164134.5 Ų134.588%0.87780%0.804SS**  cis-147.6158.53.6-79.8-47.2000114.2
426Q46.5Very low45.7Very low170 Ų170134.4 Ų134.479%0.79480%0.803SS**  trans-27.5145.5164.6-173.7175.8-57.300117.4F428Q426-F428 HydrophobicContact CG-CD2 4.13Å; Q426-F428 HydrophobicContact CG-CE2 3.79Å
427G39.4Very low45.2Very low62 Ų62133.9 Ų133.964%0.63979%0.793SS**  cis164.4-165-1.200000113.8
428F38Very low45.2Very low179 Ų179132.5 Ų132.579%0.78579%0.79SS**  trans63.2141.9168.3-59.8-75.1000117.8Q426Q426-F428 HydrophobicContact CG-CD2 4.13Å; Q426-F428 HydrophobicContact CG-CE2 3.79Å
429Q43Very low45.6Very low188 Ų188132.6 Ų132.688%0.87979%0.791SS**  cis-156.1139-4.2165.8177.40.900110.2
430G43.5Very low45.5Very low68 Ų68131.7 Ų131.770%0.70179%0.787SS**  trans149.291.6162.400000111.2
431K39Very low45.9Very low212 Ų212130.8 Ų130.892%0.92278%0.784SS**  trans-82.1130.7-170.2-67-174.2-179.4-178.60112.6
432V46Very low46.1Very low145 Ų145131 Ų13188%0.87979%0.786SS**  trans-36.9145.6157.5179.40000111.6
433G38.3Very low45.7Very low64 Ų64131.5 Ų131.566%0.6679%0.789SS**  cis158-159.9200000110.3
434P52.5Low45.8Very low133 Ų133130.9 Ų130.986%0.86479%0.789SS**  trans-109115.8178.634.5-24.1000113.1
435K55.4Low45.9Very low181 Ų181131.3 Ų131.379%0.78779%0.794SS**  trans-152.8141.9150.5-150.7-170.1-174.4-144.60113.1D437K435-D437 WeakPolarHBondContact CE-OD1 3.46Å; K435-D437 WeakPolarHBondContact CE-OD2 3.44Å; K435-D437 IonicContact NZ-OD1 3.61Å; K435-D437 IonicContact NZ-OD2 2.61Å; K435-D437 PolarHBondContact NZ-OD2 3.29Å
436G43.1Very low45.7Very low67 Ų67132 Ų13269%0.69180%0.797SS**  trans153.789.4179.900000105.1
437D49.8Very low45.4Very low115 Ų115128.4 Ų128.462%0.61580%0.796SS**  53.9123.253.8-75.112.9000113.2K435K435-D437 WeakPolarHBondContact CE-OD1 3.46Å; K435-D437 WeakPolarHBondContact CE-OD2 3.44Å; K435-D437 IonicContact NZ-OD1 3.61Å; K435-D437 IonicContact NZ-OD2 2.61Å; K435-D437 PolarHBondContact NZ-OD2 3.29Å
438I49.7Very low45.9Very low164 Ų164129 Ų12984%0.84180%0.801SS**SBendtrans24.6110.2164-55.5179.6000116.2
439G56.8Low46.2Very low76 Ų76129.8 Ų129.878%0.78481%0.808SS**  trans-76.1156.1-166.400000117.3
440D40.8Very low46.3Very low152 Ų152130.4 Ų130.481%0.81381%0.808SS**  trans-106153.9-178.6-70-57.7000113.1
441P52.8Low46.5Very low122 Ų122130.2 Ų130.279%0.79281%0.806SS**  trans-61.1150.1171-21.634000113.3
442G53.5Low47Very low79 Ų79129.5 Ų129.581%0.81481%0.806SS**  trans-70.7155.3-16800000116.4
443V40.2Very low46.9Very low156 Ų156133 Ų13395%0.94581%0.809SS**  trans-140.6158.7169.2-83.90000110.8
444E46.1Very low47.3Very low195 Ų195133.3 Ų133.391%0.91181%0.812SS**  trans-107.8134.2-160.6-178.1177.8-155.200112.9
445G49.9Very low47.1Very low66 Ų66135.6 Ų135.668%0.6882%0.816SS**  trans90.9155.1144.600000121.1
446L35.9Very low46.6Very low179 Ų179133.1 Ų133.194%0.93782%0.821SS**  trans78.1137.5163.6-48.2178.7000117.7
447A39.9Very low46.6Very low94 Ų94132.8 Ų132.878%0.77782%0.818SS**  cis-157.5175.2-1800000109.1
448G49.2Very low46.6Very low73 Ų73136.5 Ų136.575%0.75383%0.831SS**  trans-64.6-176.3-176.700000115.8
449E45.1Very low46.4Very low197 Ų197134.6 Ų134.692%0.92183%0.83SS**  cis-146.8163.522.3-60.3173.410200109.9
450K45.7Very low46Very low201 Ų201134.2 Ų134.287%0.87483%0.826SS**  177.3127.571.6-170.2175.6-168.9171.80105.7
451G46.1Very low46.7Very low64 Ų64132.9 Ų132.966%0.6683%0.825SS**  88.8120.553.600000109.6
452E50.6Low46.4Very low197 Ų197137.1 Ų137.192%0.92183%0.831SS**  cis-154.9150-3.1-66.7173.9101.100109.5
453K44.5Very low46.6Very low219 Ų219136.4 Ų136.495%0.95282%0.824SS**  trans-160.5118.2141-139.2174.2-167175.90109.8
454G45.5Very low46.8Very low69 Ų69138.5 Ų138.571%0.71182%0.824SS**  trans-111.2-173.9-159.500000117
455L47.5Very low46.9Very low181 Ų181137.8 Ų137.895%0.94882%0.82SS**  trans69.291.9156.7-52.4179.2000117.9
456S45.1Very low47.2Very low129 Ų129138.4 Ų138.490%0.90283%0.826SS**  -149.2143.8107.1-1660000109.5
457G44.5Very low47.7Very low60 Ų60137 Ų13762%0.61982%0.819SS**  trans-131.1151.2-177.100000112.1
458E48.4Very low48.5Very low193 Ų193143.8 Ų143.890%0.90282%0.824SS**  trans69.3149.8168.3-55.8-162.5124.500115.9
459P46.8Very low48.6Very low124 Ų124143.6 Ų143.681%0.80582%0.822SS**  cis-124.6150.418.1195.6000116.5
460G47.3Very low48.8Very low68 Ų68139.6 Ų139.670%0.70181%0.807SS**  trans-89.6-171.7142.900000110.1
461P55.8Low49.7Very low124 Ų124135.5 Ų135.581%0.80580%0.801SS**  cis-131.6177.8-3.242-27.7000113
462K47.3Very low49.9Very low211 Ų211135.9 Ų135.992%0.91781%0.805SS**  trans-162.9116130.2-127.8175.8-178.6177.70112.7
463G57.9Low49.8Very low64 Ų64134.4 Ų134.466%0.6680%0.798SS**  trans-98.5132.5160.300000110.1
464Q43.9Very low50.6Low201 Ų201131.5 Ų131.594%0.93979%0.793SS**  trans153.1126.7156.4-87.9171.424.100106.2
465Q47.1Very low51.1Low179 Ų179131.3 Ų131.384%0.83679%0.79SS**  -159.7145.759.4-179.6172.1-300109.8I467Q465-I467 PolarHBondContact O-N 3.38Å
466G57.3Low51.7Low79 Ų79128.7 Ų128.781%0.81478%0.784SS**PPolyproline II helixtrans-67.3122.217900000111.8
467I46Very low52.6Low151 Ų151128.6 Ų128.677%0.77478%0.779SS**PPolyproline II helixtrans-91.3139173.655.9173.1000111.2Q465Q465-I467 PolarHBondContact O-N 3.38Å
468R57.5Low53.4Low235 Ų235127 Ų12789%0.88776%0.762SS**PPolyproline II helixtrans-62.4134.5177.9-176.1-178.6-165.7154.62.1109.3D470R468-D470 PolarHBondContact O-N 3.15Å
469G50.8Low53.9Low69 Ų69124.8 Ų124.871%0.71176%0.756SS**PPolyproline II helixtrans-53.8124.7-176.800000112.8
470D50Low55.1Low114 Ų114124.5 Ų124.561%0.6175%0.754SS**PPolyproline II helixtrans-66.2131-178-63.7-71.8000111.4R468 G472R468-D470 PolarHBondContact O-N 3.15Å; D470-G472 PolarHBondContact O-N 3.21Å
471P63.6Low55.8Low114 Ų114123.9 Ų123.974%0.7475%0.748SS**PPolyproline II helixtrans-58131.6168.3-23.234.4000110.3H473P471-H473 PolarHBondContact O-N 3.04Å
472G50.6Low56.3Low73 Ų73127.4 Ų127.475%0.75375%0.751SS**PPolyproline II helixtrans-50.6127.2-170.300000113.4D470 N474D470-G472 PolarHBondContact O-N 3.21Å; G472-N474 PolarHBondContact O-N 3.42Å
473H48.4Very low57.7Low166 Ų166123.2 Ų123.277%0.76975%0.745SS**PPolyproline II helixtrans-65.7127.5179.2-57.4-36000110.9P471P471-H473 PolarHBondContact O-N 3.04Å
474N60.5Low58.1Low158 Ų158123.6 Ų123.685%0.84575%0.749SS**PPolyproline II helixtrans-60.8139.4164.7-72.7-25000109.1G472G472-N474 PolarHBondContact O-N 3.42Å
475G57.7Low59.3Low64 Ų64121.4 Ų121.466%0.6674%0.744SS**PPolyproline II helixtrans-59.2152.3-177.800000112.9T477G475-T477 PolarHBondContact O-N 2.99Å
476P58.4Low60.7Low127 Ų127118.8 Ų118.883%0.82574%0.742SS**PPolyproline II helixtrans-66.6129-175.827.6-34.6000111.6G478P476-G478 PolarHBondContact O-N 3.44Å
477T64.9Low61.1Low127 Ų127118 Ų11878%0.77974%0.735SS**PPolyproline II helixtrans-62.1122.6164-47.10000108.8G475G475-T477 PolarHBondContact O-N 2.99Å
478G61.3Low62.3Low26 Ų26116.6 Ų116.627%0.26874%0.735SS.*PPolyproline II helixtrans-78.7164.7-175.500000114.4E242 P476E242-G478 VanDerWaalsContact CD-N 3.31Å; E242-G478 WeakPolarHBondContact OE2-CA 3.48Å; E242-G478 PolarHBondContact OE2-N 3.29Å; P476-G478 PolarHBondContact O-N 3.44Å
479D59.8Low63.2Low147 Ų147111.3 Ų111.379%0.78673%0.731SS**PPolyproline II helixtrans-70.9142.5-171.1-63.8-60.8000114G481D479-G481 PolarHBondContact O-N 3.18Å
480P71.2Confident63.7Low117 Ų117111.5 Ų111.576%0.7673%0.733SS**  trans-57.2112.9169.7-25.735.2000112.3K482P480-K482 PolarHBondContact O-N 3.47Å
481G61.2Low64.4Low55 Ų55114 Ų11457%0.56775%0.745SS**PPolyproline II helixtrans-49133.1176.400000113.7D479D479-G481 PolarHBondContact O-N 3.18Å
482K66.8Low64.9Low198 Ų198114.4 Ų114.486%0.86175%0.748SS**PPolyproline II helixtrans-61.4144-172.4-53.5-174.6-177.5-174.40111.8P480P480-K482 PolarHBondContact O-N 3.47Å
483P75.9Confident65.3Low124 Ų124114 Ų11481%0.80574%0.743SS**PPolyproline II helixtrans-55.6138.7170.9-23.434000111
484G66.5Low65.9Low72 Ų72112.2 Ų112.274%0.74275%0.747SS**PPolyproline II helixtrans-69.5141.1177.300000111.8
485D69.8Low66.2Low155 Ų155116.3 Ų116.383%0.82975%0.75SS**PPolyproline II helixtrans-59.2133.9-179.9-62.6-59.7000111.3G487D485-G487 PolarHBondContact O-N 3.2Å
486P76.5Confident66Low124 Ų124116.4 Ų116.481%0.80575%0.751SS**PPolyproline II helixtrans-56.5130175.5-25.834.9000111.7
487G66.2Low65.8Low63 Ų63118.7 Ų118.765%0.64976%0.756SS**PPolyproline II helixtrans-57.7145.1178.200000111.9D485D485-G487 PolarHBondContact O-N 3.2Å
488P70Confident65.3Low120 Ų120120.3 Ų120.378%0.77976%0.759SS**PPolyproline II helixtrans-59.1141.1-177.524.3-33.9000110.9G490P488-G490 PolarHBondContact O-N 2.98Å
489P77.3Confident64.8Low125 Ų125122 Ų12281%0.81278%0.777SS**PPolyproline II helixtrans-53.6132.8176.7-26.534.7000111.5L491P489-L491 PolarHBondContact O-N 3.02Å
490G61.5Low64.4Low72 Ų72124.2 Ų124.274%0.74278%0.783SS**PPolyproline II helixtrans-56.3133.9178.500000111.3P488P488-G490 PolarHBondContact O-N 2.98Å
491L64.6Low63.9Low166 Ų166129.8 Ų129.887%0.86979%0.789SS**PPolyproline II helixtrans-54.3133.6179.8-68.6172.1000110.3P489 G493P489-L491 PolarHBondContact O-N 3.02Å; L491-G493 PolarHBondContact O-N 2.99Å
492P74.5Confident63.5Low123 Ų123130.2 Ų130.280%0.79979%0.793SS**PPolyproline II helixtrans-53.4126.4176.4-27.235.1000111
493G59.2Low63Low64 Ų64127.2 Ų127.266%0.6679%0.791SS**PPolyproline II helixtrans-56.3143.2-178.800000111.5L491 R495L491-G493 PolarHBondContact O-N 2.99Å; G493-R495 PolarHBondContact O-N 2.98Å; G493-R495 VanDerWaalsContact O-N 3.16Å
494P59.3Low62.5Low129 Ų129126.6 Ų126.684%0.83879%0.787SS**PPolyproline II helixtrans-57.1124.5-176.823.4-33.4000109.9G496P494-G496 PolarHBondContact O-N 3.39Å
495R66.9Low61.9Low245 Ų245126.5 Ų126.593%0.92579%0.785SS**  trans-55.5114.6177.4-177.7177-177.2165.80.7108.1G493 L497G493-R495 PolarHBondContact O-N 2.98Å; G493-R495 VanDerWaalsContact O-N 3.16Å; R495-L497 PolarHBondContact O-N 3.34Å
496G54.9Low61.3Low66 Ų66125.6 Ų125.668%0.6879%0.785SS**  trans-50.6128.5-175.600000111P494 N498P494-G496 PolarHBondContact O-N 3.39Å; G496-N498 PolarHBondContact O-N 3.23Å; G496-N498 VanDerWaalsContact O-N 3.07Å
497L52.4Low60.7Low175 Ų175125.1 Ų125.192%0.91678%0.782SS**  trans-55.8117.5176.4-70170.8000107.9R495 G499R495-L497 PolarHBondContact O-N 3.34Å; L497-G499 PolarHBondContact O-N 3.14Å; L497-G499 VanDerWaalsContact O-N 3.07Å
498N54.8Low59.9Low160 Ų160125.3 Ų125.386%0.85678%0.784SS**  trans-63.3114.6178.8-167.837.8000107.1G496 E500G496-N498 PolarHBondContact O-N 3.23Å; G496-N498 VanDerWaalsContact O-N 3.07Å; N498-E500 PolarHBondContact O-N 3.31Å
499G52.2Low59.1Low62 Ų62127.4 Ų127.464%0.63979%0.787SS**  trans-53.7131-171.400000111L497 R501L497-G499 PolarHBondContact O-N 3.14Å; L497-G499 VanDerWaalsContact O-N 3.07Å; G499-R501 PolarHBondContact O-N 3.06Å
500E51.3Low58.2Low193 Ų193127.1 Ų127.190%0.90279%0.785SS**  trans-54125.7177.1-65.2-173.2155.200108.7N498 G502N498-E500 PolarHBondContact O-N 3.31Å; E500-G502 PolarHBondContact O-N 3.1Å
501R60.6Low57.7Low235 Ų235127 Ų12789%0.88779%0.785SS**  trans-58.6113.5179.3179.3-174.5-63.7-169.40.3107.1G499 V503G499-R501 PolarHBondContact O-N 3.06Å; R501-V503 PolarHBondContact O-N 3.29Å
502G51.9Low56.9Low63 Ų63126.8 Ų126.865%0.64978%0.779SS**PPolyproline II helixtrans-46.8127.8-178.700000110.7E500E500-G502 PolarHBondContact O-N 3.1Å
503V56.1Low55.9Low136 Ų136127.3 Ų127.382%0.82478%0.78SS**PPolyproline II helixtrans-52.5126.2-177.3-153.30000108R501 G505R501-V503 PolarHBondContact O-N 3.29Å; V503-G505 PolarHBondContact O-N 3Å; V503-G505 VanDerWaalsContact O-N 3.14Å
504P66.6Low55.6Low111 Ų111127.5 Ų127.572%0.72178%0.782SS**PPolyproline II helixtrans-51.9125.7177.3-2835.5000109.6V506P504-V506 PolarHBondContact O-N 3.01Å
505G53Low55.2Low69 Ų69131.5 Ų131.571%0.71178%0.78SS**PPolyproline II helixtrans-52.9127-177.600000109.7V503 P507V503-G505 PolarHBondContact O-N 3Å; V503-G505 VanDerWaalsContact O-N 3.14Å; G505-P507 VanDerWaalsContact O-N 3.16Å
506V56.7Low54.6Low137 Ų137127.4 Ų127.483%0.8378%0.777SS**PPolyproline II helixtrans-50.6124.3-179.1-173.30000107.8P504 G508P504-V506 PolarHBondContact O-N 3.01Å; V506-G508 PolarHBondContact O-N 3.38Å; V506-G508 VanDerWaalsContact O-N 3.14Å
507P64.2Low54.5Low114 Ų114126.9 Ų126.974%0.7477%0.766SS**PPolyproline II helixtrans-50.5126.5178.5-28.735.4000109.4G505 I509G505-P507 VanDerWaalsContact O-N 3.16Å; P507-I509 PolarHBondContact O-N 3.2Å; P507-I509 VanDerWaalsContact O-N 3.15Å
508G49.9Very low55.1Low67 Ų67122 Ų12269%0.69175%0.746SS**PPolyproline II helixtrans-52.1125.8-177.900000109.1V506 P510V506-G508 PolarHBondContact O-N 3.38Å; V506-G508 VanDerWaalsContact O-N 3.14Å; G508-P510 WeakPolarHBondContact O-CD 3.49Å
509I53.8Low55.6Low164 Ų164120.2 Ų120.284%0.84174%0.737SS**  trans-45.3117.3-178.7-8.5174000107.7P507 G511P507-I509 PolarHBondContact O-N 3.2Å; P507-I509 VanDerWaalsContact O-N 3.15Å; I509-G511 PolarHBondContact O-N 3.34Å
510P58Low56.3Low118 Ų118124.7 Ų124.777%0.76674%0.741SS**  trans-53.3121.1175.9-27.235.5000107.6G508 Q512G508-P510 WeakPolarHBondContact O-CD 3.49Å; P510-Q512 PolarHBondContact O-N 3.07Å
511G51.2Low57.2Low71 Ų71120.6 Ų120.673%0.73272%0.722SS**  trans-51.7130.1178.800000107.8I509 T513I509-G511 PolarHBondContact O-N 3.34Å; G511-T513 PolarHBondContact O-N 3.19Å
512Q46.4Very low57.9Low161 Ų161113.2 Ų113.275%0.75270%0.699SS**  trans-45.6118.7-173.9-69.8-176.410.700108.4P510 G514P510-Q512 PolarHBondContact O-N 3.07Å; Q512-G514 PolarHBondContact O-N 3.05Å
513T54.1Low59Low133 Ų133114.9 Ų114.982%0.81669%0.692SS**PPolyproline II helixtrans-46.511817242.30000106.5G511 R515G511-T513 PolarHBondContact O-N 3.19Å; T513-R515 PolarHBondContact O-N 2.86Å
514G52.2Low60.1Low68 Ų68114.7 Ų114.770%0.70168%0.682SS**PPolyproline II helixtrans-50.5118.7-17200000107.9Q512 D516Q512-G514 PolarHBondContact O-N 3.05Å; G514-D516 PolarHBondContact O-N 3.14Å
515R52.9Low60.8Low213 Ų213112.6 Ų112.680%0.80467%0.667SS**PPolyproline II helixtrans-54.3122.6-178.6-67.5-179.7-175.3174.50.7106.6T513 A517T513-R515 PolarHBondContact O-N 2.86Å; R515-A517 PolarHBondContact O-N 3.06Å
516D53.7Low62.4Low160 Ų160113 Ų11386%0.85666%0.656SS**PPolyproline II helixtrans-49.4118.9175.7-58.8-65.7000107.2G514 S518G514-D516 PolarHBondContact O-N 3.14Å; D516-S518 PolarHBondContact O-N 3.06Å
517A53.5Low63.8Low55 Ų55111.7 Ų111.746%0.45564%0.643SS.*  trans-66.3103.4-173.700000106.8R515 D519 I522R515-A517 PolarHBondContact O-N 3.06Å; A517-D519 PolarHBondContact O-N 2.88Å; A517-I522 HydrophobicContact CB-CD1 3.98Å; A517-I522 HydrophobicContact CB-CG1 3.78Å; A517-I522 WeakPolarHBondContact O-CD1 3.25Å
518S64.6Low64.8Low71 Ų71112.9 Ų112.950%0.49764%0.637SS.*  trans-51.1137.5177.556.40000108.6D516 Q520 H521 I522D516-S518 PolarHBondContact O-N 3.06Å; S518-Q520 PolarHBondContact O-N 2.91Å; S518-H521 PolarHBondContact O-N 3.11Å; S518-I522 PolarHBondContact O-N 3.15Å
519D64.9Low66.4Low124 Ų124114.8 Ų114.866%0.66363%0.629SS**Hα-helixtrans-52.8-31.1-171.3-64.8-51.3000112.3A517 H521 I522 I523A517-D519 PolarHBondContact O-N 2.88Å; D519-H521 PolarHBondContact O-N 2.77Å; D519-I522 PolarHBondContact O-N 3.43Å; D519-I523 HydrophobicContact CB-CD1 4.41Å; D519-I523 VanDerWaalsContact O-CB 3.32Å; D519-I523 WeakPolarHBondContact O-CB 3.34Å; D519-I523 WeakPolarHBondContact O-CD1 3.49Å; D519-I523 WeakPolarHBondContact O-CG1 3.32Å; D519-I523 PolarHBondContact O-N 3.07Å
520Q66.3Low68.1Low155 Ų155112.1 Ų112.172%0.72462%0.616SS**Hα-helixtrans-56.9-42.7172.8-67.4179.2-15.800113.7S518 I523 E524S518-Q520 PolarHBondContact O-N 2.91Å; Q520-I523 PolarHBondContact O-N 3.42Å; Q520-E524 WeakPolarHBondContact O-CB 3.41Å; Q520-E524 WeakPolarHBondContact O-CG 3.49Å; Q520-E524 PolarHBondContact O-N 3.29Å
521H70.4Confident69.2Low107 Ų107112.2 Ų112.250%0.49561%0.606SS.*Hα-helixtrans-71.7-36.5178-168.857.7000112S518 D519 E524 V525S518-H521 PolarHBondContact O-N 3.11Å; D519-H521 PolarHBondContact O-N 2.77Å; H521-E524 IonicContact ND1-OE2 3.99Å; H521-E524 PolarHBondContact O-N 2.9Å; H521-V525 WeakPolarHBondContact O-CB 3.44Å; H521-V525 VanDerWaalsContact O-CG2 3.31Å; H521-V525 WeakPolarHBondContact O-CG2 3.38Å; H521-V525 PolarHBondContact O-N 2.99Å
522I74.7Confident70.8Confident80 Ų80114.8 Ų114.841%0.4160%0.599SS.*Hα-helixtrans-63.9-45.5172.7-57.3179.3000109.7A517 S518 D519 E524 V525 V526A517-I522 HydrophobicContact CB-CD1 3.98Å; A517-I522 HydrophobicContact CB-CG1 3.78Å; A517-I522 WeakPolarHBondContact O-CD1 3.25Å; S518-I522 PolarHBondContact O-N 3.15Å; D519-I522 PolarHBondContact O-N 3.43Å; I522-E524 PolarHBondContact O-N 3.19Å; I522-V525 PolarHBondContact O-N 3.17Å; I522-V526 HydrophobicContact CG2-CG2 4.26Å; I522-V526 WeakPolarHBondContact O-CB 3.31Å; I522-V526 VanDerWaalsContact O-CG2 3.24Å; I522-V526 WeakPolarHBondContact O-CG2 3.5Å; I522-V526 PolarHBondContact O-N 2.97Å
523I76.8Confident72.4Confident98 Ų98115.7 Ų115.750%0.50360%0.596SS.*Hα-helixtrans-60.8-44.3176.8-70.8163.3000110.9D519 Q520 V526 L527D519-I523 HydrophobicContact CB-CD1 4.41Å; D519-I523 VanDerWaalsContact O-CB 3.32Å; D519-I523 WeakPolarHBondContact O-CB 3.34Å; D519-I523 WeakPolarHBondContact O-CD1 3.49Å; D519-I523 WeakPolarHBondContact O-CG1 3.32Å; D519-I523 PolarHBondContact O-N 3.07Å; Q520-I523 PolarHBondContact O-N 3.42Å; I523-V526 PolarHBondContact O-N 3.12Å; I523-L527 HydrophobicContact CG2-CD1 3.63Å; I523-L527 WeakPolarHBondContact O-CB 3.28Å; I523-L527 WeakPolarHBondContact O-CD1 3.5Å; I523-L527 PolarHBondContact O-N 3.04Å
524E77.6Confident73.7Confident132 Ų132115.1 Ų115.162%0.61759%0.587SS**Hα-helixtrans-61.4-46.2175.6-80-174.1156.100112.5Q520 H521 I522 L527 K528Q520-E524 WeakPolarHBondContact O-CB 3.41Å; Q520-E524 WeakPolarHBondContact O-CG 3.49Å; Q520-E524 PolarHBondContact O-N 3.29Å; H521-E524 IonicContact ND1-OE2 3.99Å; H521-E524 PolarHBondContact O-N 2.9Å; I522-E524 PolarHBondContact O-N 3.19Å; E524-L527 PolarHBondContact O-N 3.22Å; E524-K528 VanDerWaalsContact O-CB 3.28Å; E524-K528 WeakPolarHBondContact O-CB 3.24Å; E524-K528 PolarHBondContact O-N 3.12Å
525V82.5Confident74.7Confident68 Ų68117.8 Ų117.841%0.41258%0.581SS.*Hα-helixtrans-65-41178.4171.50000110.9H521 I522 K528 M529H521-V525 WeakPolarHBondContact O-CB 3.44Å; H521-V525 VanDerWaalsContact O-CG2 3.31Å; H521-V525 WeakPolarHBondContact O-CG2 3.38Å; H521-V525 PolarHBondContact O-N 2.99Å; I522-V525 PolarHBondContact O-N 3.17Å; V525-K528 PolarHBondContact O-N 3.2Å; V525-M529 WeakPolarHBondContact O-CG 3.35Å; V525-M529 PolarHBondContact O-N 2.94Å
526V86.9Confident75.5Confident77 Ų77110.5 Ų110.547%0.46757%0.567SS.*Hα-helixtrans-67.5-43.1176.8170.50000111.5I522 I523 K528 M529 L530I522-V526 HydrophobicContact CG2-CG2 4.26Å; I522-V526 WeakPolarHBondContact O-CB 3.31Å; I522-V526 VanDerWaalsContact O-CG2 3.24Å; I522-V526 WeakPolarHBondContact O-CG2 3.5Å; I522-V526 PolarHBondContact O-N 2.97Å; I523-V526 PolarHBondContact O-N 3.12Å; V526-K528 VanDerWaalsContact C-N 3.33Å; V526-K528 PolarHBondContact O-N 3.16Å; V526-M529 PolarHBondContact O-N 3.31Å; V526-L530 HydrophobicContact CG1-CD1 4.29Å; V526-L530 WeakPolarHBondContact O-CB 3.38Å; V526-L530 PolarHBondContact O-N 3.36Å
527L84.8Confident76.6Confident109 Ų109107.7 Ų107.757%0.57156%0.555SS**Hα-helixtrans-60.7-43.1173.7-106.3108.7000111.2I523 E524 L530 Q531I523-L527 HydrophobicContact CG2-CD1 3.63Å; I523-L527 WeakPolarHBondContact O-CB 3.28Å; I523-L527 WeakPolarHBondContact O-CD1 3.5Å; I523-L527 PolarHBondContact O-N 3.04Å; E524-L527 PolarHBondContact O-N 3.22Å; L527-L530 PolarHBondContact O-N 3.04Å; L527-Q531 WeakPolarHBondContact O-CB 3.13Å; L527-Q531 PolarHBondContact O-N 3.27Å
528K84.9Confident77.3Confident140 Ų140107.7 Ų107.761%0.60956%0.555SS**Hα-helixtrans-65.2-42.4179.6-163.6174-175.7179.70111.6E524 V525 V526 Q531 E532E524-K528 VanDerWaalsContact O-CB 3.28Å; E524-K528 WeakPolarHBondContact O-CB 3.24Å; E524-K528 PolarHBondContact O-N 3.12Å; V525-K528 PolarHBondContact O-N 3.2Å; V526-K528 VanDerWaalsContact C-N 3.33Å; V526-K528 PolarHBondContact O-N 3.16Å; K528-Q531 PolarHBondContact O-N 3.27Å; K528-E532 PolarHBondContact O-N 3Å
529M85.1Confident77.4Confident107 Ų107109.2 Ų109.253%0.52756%0.561SS.*Hα-helixtrans-62.8-42.7171.4-77.9-171.269.700112.4V525 V526 Q531 E532 R533V525-M529 WeakPolarHBondContact O-CG 3.35Å; V525-M529 PolarHBondContact O-N 2.94Å; V526-M529 PolarHBondContact O-N 3.31Å; M529-Q531 VanDerWaalsContact C-N 3.28Å; M529-Q531 PolarHBondContact O-N 3.49Å; M529-E532 PolarHBondContact O-N 3.13Å; M529-R533 VanDerWaalsContact O-CG 3.25Å; M529-R533 WeakPolarHBondContact O-CG 3.16Å; M529-R533 PolarHBondContact O-N 3.2Å
530L87.6Confident77.3Confident108 Ų108107.1 Ų107.157%0.56556%0.556SS**Hα-helixtrans-61.7-39.7175.4-116.888.7000111.3V526 L527 R533 L534V526-L530 HydrophobicContact CG1-CD1 4.29Å; V526-L530 WeakPolarHBondContact O-CB 3.38Å; V526-L530 PolarHBondContact O-N 3.36Å; L527-L530 PolarHBondContact O-N 3.04Å; L530-R533 PolarHBondContact O-N 3.46Å; L530-L534 PolarHBondContact O-N 2.85Å
531Q82.9Confident76.8Confident120 Ų120102.4 Ų102.456%0.56154%0.544SS*.Hα-helixtrans-70.4-39.9-178.8-166160.929.300112.1L527 K528 M529 R533 L534 Q535L527-Q531 WeakPolarHBondContact O-CB 3.13Å; L527-Q531 PolarHBondContact O-N 3.27Å; K528-Q531 PolarHBondContact O-N 3.27Å; M529-Q531 VanDerWaalsContact C-N 3.28Å; M529-Q531 PolarHBondContact O-N 3.49Å; Q531-R533 VanDerWaalsContact C-N 3.34Å; Q531-L534 PolarHBondContact O-N 2.88Å; Q531-Q535 WeakPolarHBondContact O-CB 3.34Å; Q531-Q535 WeakPolarHBondContact O-CG 3.33Å; Q531-Q535 PolarHBondContact O-N 3.39Å
532E83.9Confident76.2Confident125 Ų125105.5 Ų105.558%0.58456%0.556SS**Hα-helixtrans-61.4-41.1170.3-75.5-179.7176.700111.8K528 M529 Q535 A536K528-E532 PolarHBondContact O-N 3Å; M529-E532 PolarHBondContact O-N 3.13Å; E532-Q535 PolarHBondContact O-N 3.12Å; E532-A536 WeakPolarHBondContact O-CB 3.32Å; E532-A536 PolarHBondContact O-N 3.14Å
533R79.9Confident75Confident180 Ų180111.7 Ų111.768%0.67957%0.574SS**Hα-helixtrans-66.9-41.9175.7-66.4-66.9178.6-179.2-1112.2M529 L530 Q531 A536 V537M529-R533 VanDerWaalsContact O-CG 3.25Å; M529-R533 WeakPolarHBondContact O-CG 3.16Å; M529-R533 PolarHBondContact O-N 3.2Å; L530-R533 PolarHBondContact O-N 3.46Å; Q531-R533 VanDerWaalsContact C-N 3.34Å; R533-A536 PolarHBondContact O-N 3.41Å; R533-V537 WeakPolarHBondContact O-CG2 3.5Å; R533-V537 PolarHBondContact O-N 3.47Å
534L81Confident73.7Confident121 Ų121111.2 Ų111.263%0.63459%0.585SS**Hα-helixtrans-63.5-39.6173.8-107.879.3000111.9L530 Q531 V537 A538L530-L534 PolarHBondContact O-N 2.85Å; Q531-L534 PolarHBondContact O-N 2.88Å; L534-V537 PolarHBondContact O-N 3.34Å; L534-A538 VanDerWaalsContact O-CB 3.32Å; L534-A538 WeakPolarHBondContact O-CB 3.14Å; L534-A538 PolarHBondContact O-N 3.47Å
535Q73.1Confident72.4Confident124 Ų124111 Ų11158%0.57959%0.592SS**Hα-helixtrans-65.3-42.2175.8-75.5-174.35.900111.7Q531 E532 V537 A538 V539Q531-Q535 WeakPolarHBondContact O-CB 3.34Å; Q531-Q535 WeakPolarHBondContact O-CG 3.33Å; Q531-Q535 PolarHBondContact O-N 3.39Å; E532-Q535 PolarHBondContact O-N 3.12Å; Q535-V537 VanDerWaalsContact C-N 3.34Å; Q535-V537 PolarHBondContact O-N 3.42Å; Q535-A538 PolarHBondContact O-N 3.24Å; Q535-V539 WeakPolarHBondContact O-CG2 3.21Å; Q535-V539 PolarHBondContact O-N 3.14Å
536A70.7Confident70.9Confident60 Ų60115 Ų11550%0.49661%0.61SS.*Hα-helixtrans-60.8-42.1173.600000112.2E532 R533 V539 S540E532-A536 WeakPolarHBondContact O-CB 3.32Å; E532-A536 PolarHBondContact O-N 3.14Å; R533-A536 PolarHBondContact O-N 3.41Å; A536-V539 PolarHBondContact O-N 3.34Å; A536-S540 WeakPolarHBondContact O-CB 3.4Å; A536-S540 PolarHBondContact O-N 3.2Å
537V76.3Confident68.6Low101 Ų101115 Ų11561%0.61263%0.626SS**Hα-helixtrans-66.7-40.3175.2172.10000111.6R533 L534 Q535 V539 S540 A541R533-V537 WeakPolarHBondContact O-CG2 3.5Å; R533-V537 PolarHBondContact O-N 3.47Å; L534-V537 PolarHBondContact O-N 3.34Å; Q535-V537 VanDerWaalsContact C-N 3.34Å; Q535-V537 PolarHBondContact O-N 3.42Å; V537-V539 PolarHBondContact O-N 3.44Å; V537-S540 WeakPolarHBondContact O-CB 3.48Å; V537-S540 PolarHBondContact O-N 3.21Å; V537-A541 WeakPolarHBondContact O-CB 3.2Å; V537-A541 PolarHBondContact O-N 2.99Å
538A67.9Low67Low54 Ų54114 Ų11445%0.44664%0.642SS.*Hα-helixtrans-66-36.7177.400000112.8L534 Q535 K542L534-A538 VanDerWaalsContact O-CB 3.32Å; L534-A538 WeakPolarHBondContact O-CB 3.14Å; L534-A538 PolarHBondContact O-N 3.47Å; Q535-A538 PolarHBondContact O-N 3.24Å; A538-K542 PolarHBondContact O-N 3.38Å; A538-K542 VanDerWaalsContact O-N 3.07Å
539V67.7Low65.3Low104 Ų104112 Ų11263%0.6365%0.652SS**Hα-helixtrans-68.4-38.1172.7171.30000111.1Q535 A536 V537 R543Q535-V539 WeakPolarHBondContact O-CG2 3.21Å; Q535-V539 PolarHBondContact O-N 3.14Å; A536-V539 PolarHBondContact O-N 3.34Å; V537-V539 PolarHBondContact O-N 3.44Å; V539-R543 PolarHBondContact O-N 3.17Å
540S61.2Low63.4Low80 Ų80110.7 Ų110.756%0.55967%0.666SS**Hα-helixtrans-66.3-45.9174-167.50000112.3A536 V537 K542 R543 A544A536-S540 WeakPolarHBondContact O-CB 3.4Å; A536-S540 PolarHBondContact O-N 3.2Å; V537-S540 WeakPolarHBondContact O-CB 3.48Å; V537-S540 PolarHBondContact O-N 3.21Å; S540-K542 PolarHBondContact O-N 3.3Å; S540-R543 WeakPolarHBondContact O-CA 3.41Å; S540-R543 VanDerWaalsContact O-CB 3.25Å; S540-R543 WeakPolarHBondContact O-CB 3.2Å; S540-R543 PolarHBondContact O-N 2.96Å; S540-A544 PolarHBondContact O-N 2.96Å
541A57.8Low61.4Low56 Ų56112.8 Ų112.846%0.46368%0.682SS.*Hα-helixtrans-63-38.417900000112.4V537 R543 A544V537-A541 WeakPolarHBondContact O-CB 3.2Å; V537-A541 PolarHBondContact O-N 2.99Å; A541-R543 PolarHBondContact O-N 3.41Å; A541-A544 PolarHBondContact O-N 3.33Å
542K56.1Low59.7Low172 Ų172115.6 Ų115.675%0.74870%0.698SS**Hα-helixtrans-63-23.2171.3-81.2-171.6174.4-174.50113.6A538 S540A538-K542 PolarHBondContact O-N 3.38Å; A538-K542 VanDerWaalsContact O-N 3.07Å; S540-K542 PolarHBondContact O-N 3.3Å
543R50.6Low58.5Low210 Ų210112.1 Ų112.179%0.79270%0.695SS**Hα-helixtrans-82.4-23.6176.7-145.8174-166159.73.5112.9V539 S540 A541V539-R543 PolarHBondContact O-N 3.17Å; S540-R543 WeakPolarHBondContact O-CA 3.41Å; S540-R543 VanDerWaalsContact O-CB 3.25Å; S540-R543 WeakPolarHBondContact O-CB 3.2Å; S540-R543 PolarHBondContact O-N 2.96Å; A541-R543 PolarHBondContact O-N 3.41Å
544A49.1Very low57.7Low88 Ų88109.3 Ų109.373%0.72770%0.701SS**Hα-helixtrans-77.6-18.2179.900000114.4S540 A541S540-A544 PolarHBondContact O-N 2.96Å; A541-A544 PolarHBondContact O-N 3.33Å
545V50.7Low56.5Low126 Ų126109.8 Ų109.876%0.76471%0.711SS**THydrogen-bonded Turntrans-87.3-10-176.5-179.70000112.9
546L50Low55.7Low152 Ų152106.8 Ų106.880%0.79671%0.713SS**SBendtrans-127.295.8-178.9-76169.6000112
547G39.8Very low55.3Low78 Ų78109.7 Ų109.780%0.80473%0.727SS**  trans107.892.5161.300000115.1
548G51.1Low54.4Low87 Ų87111.1 Ų111.190%0.89774%0.739SS**  trans-85110.2161.400000111
549A47.9Very low53.9Low99 Ų99111.5 Ų111.582%0.81875%0.747SS**  trans-167.7126.5157.300000110.5
550G46.5Very low53.5Low80 Ų80112.4 Ų112.483%0.82576%0.755SS**  trans59.289.7159.700000118.1M552G550-M552 PolarHBondContact O-N 3.17Å; G550-M552 VanDerWaalsContact O-N 3.15Å
551V44.3Very low53.3Low151 Ų151114.8 Ų114.892%0.91577%0.769SS**  trans-75.4100.9167.8-176.80000110
552M48.2Very low53.3Low180 Ų180115.5 Ų115.589%0.88778%0.781SS**PPolyproline II helixtrans-80.8128155-98.617659.900108.8G550G550-M552 PolarHBondContact O-N 3.17Å; G550-M552 VanDerWaalsContact O-N 3.15Å
553G58Low53Low51 Ų51111.9 Ų111.953%0.52678%0.784SS.*PPolyproline II helixtrans-63.4159.9175.800000112.5
554P63.3Low53.3Low122 Ų122107.7 Ų107.779%0.79278%0.784SS**PPolyproline II helixtrans-59.1145.1176.426.1-34.3000110.7G556P554-G556 PolarHBondContact O-N 3.14Å
555P56Low53.9Low130 Ų130106 Ų10684%0.84478%0.775SS**PPolyproline II helixtrans-54.3131.2174.8-24.634000111
556G57Low54.2Low62 Ų62106.6 Ų106.664%0.63978%0.782SS**PPolyproline II helixtrans-59.9154.817500000111.7P554P554-G556 PolarHBondContact O-N 3.14Å
557P61.3Low54.1Low121 Ų121106.7 Ų106.779%0.78678%0.778SS**PPolyproline II helixtrans-57.3147.1177.425.6-34.3000110.7G559P557-G559 PolarHBondContact O-N 3.07Å
558P57.7Low54.7Low131 Ų131105.6 Ų105.685%0.85177%0.766SS**PPolyproline II helixtrans-54130.2-179.9-25.934.3000111.8
559G58.5Low54.8Low61 Ų61108 Ų10863%0.62977%0.766SS**PPolyproline II helixtrans-61.2153.417600000111.9P557P557-G559 PolarHBondContact O-N 3.07Å
560P58.8Low54.5Low123 Ų123110.9 Ų110.980%0.79976%0.762SS**PPolyproline II helixtrans-59.6146.117826-34.3000110.9G562P560-G562 PolarHBondContact O-N 3.07Å
561P57.2Low54.4Low131 Ų131110.3 Ų110.385%0.85176%0.756SS**PPolyproline II helixtrans-55.3133.2179.8-25.934.5000112.3
562G57.6Low54.4Low70 Ų70111.4 Ų111.472%0.72276%0.756SS**PPolyproline II helixtrans-60.2150.3175.400000112.1P560P560-G562 PolarHBondContact O-N 3.07Å
563A50.3Low54.4Low96 Ų96109 Ų10979%0.79375%0.754SS**PPolyproline II helixtrans-57139.6179.700000111.4G565A563-G565 PolarHBondContact O-N 3.26Å
564P55.3Low53.6Low123 Ų123109.8 Ų109.880%0.79976%0.762SS**PPolyproline II helixtrans-59.3127.5178.4-23.533.6000111.6
565G63Low52.9Low53 Ų53111.3 Ų111.355%0.54677%0.769SS.*PPolyproline II helixtrans-62.9152.916900000111.4A563 Q567A563-G565 PolarHBondContact O-N 3.26Å; G565-Q567 PolarHBondContact O-N 3.3Å
566P55.8Low52.1Low138 Ų138115.5 Ų115.590%0.89677%0.768SS**PPolyproline II helixtrans-62.6119.9-178.726-33.8000110.5
567Q47.7Very low51.3Low154 Ų154115.3 Ų115.372%0.7277%0.767SS**PPolyproline II helixtrans-75.6129.9175.8-65.1-176.1100109.8G565 H570G565-Q567 PolarHBondContact O-N 3.3Å; Q567-H570 PolarHBondContact OE1-CE1 3.22Å
568G53.5Low50.4Low54 Ų54118 Ų11856%0.55777%0.773SS**PPolyproline II helixtrans-64.7161.9168.600000111.9H570G568-H570 PolarHBondContact O-N 3.23Å
569P52.3Low49.6Very low137 Ų137115.7 Ų115.789%0.8976%0.758SS**PPolyproline II helixtrans-61.1135.5-171.924.3-34000112.8
570H42.6Very low48.7Very low161 Ų161116.5 Ų116.575%0.74577%0.766SS**PPolyproline II helixtrans-69.7135.7-177-59.1-63.4000112.9Q567 G568Q567-H570 PolarHBondContact OE1-CE1 3.22Å; G568-H570 PolarHBondContact O-N 3.23Å
571G43.8Very low47.7Very low68 Ų68119.9 Ų119.970%0.70177%0.773SS**PPolyproline II helixtrans-71.6154.3162.500000112.1
572L44.9Very low46.7Very low173 Ų173121.9 Ų121.991%0.90678%0.775SS**PPolyproline II helixtrans-61.8136.9-174.2-67167.1000112.9G574L572-G574 PolarHBondContact O-N 3.16Å
573P48.4Very low45.7Very low129 Ų129121.9 Ų121.984%0.83878%0.775SS**  trans-74.5115.3177.4-14.129.3000112.5
574G41.3Very low45.4Very low68 Ų68120.7 Ų120.770%0.70177%0.772SS**  trans-72.4152.5163.500000112.2L572 R576L572-G574 PolarHBondContact O-N 3.16Å; G574-R576 PolarHBondContact O-N 3.02Å
575T47.4Very low44.8Very low154 Ų154121.3 Ų121.395%0.94578%0.776SS**  trans-68.8107.2-176.838.80000112.3
576R39.3Very low43.6Very low218 Ų218122.4 Ų122.482%0.82379%0.787SS**PPolyproline II helixtrans-92.7119.8178.8-169.7169.2-173.6170.43.9112G574G574-R576 PolarHBondContact O-N 3.02Å
577G40.4Very low42.6Very low59 Ų59125.5 Ų125.561%0.60879%0.79SS**PPolyproline II helixtrans-65.2159.7167.300000112.9P579G577-P579 WeakPolarHBondContact O-CD 3.38Å
578I42.2Very low41.9Very low177 Ų177126.8 Ų126.891%0.90880%0.8SS**PPolyproline II helixtrans-62117.8-168.5-55170000112.2
579P41.6Very low41.1Very low83 Ų83126.9 Ų126.954%0.53980%0.801SS.*PPolyproline II helixtrans-92.6144.1169.4-5.326.9000111.8G577G577-P579 WeakPolarHBondContact O-CD 3.38Å
580G38.7Very low40.3Very low77 Ų77128.4 Ų128.479%0.79480%0.801SS**PPolyproline II helixtrans-75172.4-178.600000115.5
581M37.9Very low40.1Very low194 Ų194127.4 Ų127.496%0.95681%0.807SS**PPolyproline II helixtrans-74.1142.9-178.9-60.5-176-66.600112.4
582I37.3Very low39.8Very low174 Ų174127.3 Ų127.389%0.89281%0.806SS**PPolyproline II helixtrans-77.6129.5168.9-65.7169.6000108.5
583G35.4Very low39.6Very low70 Ų70127.9 Ų127.972%0.72281%0.809SS**PPolyproline II helixtrans-78.4152.2-179.700000113.9
584G44.8Very low39.1Very low71 Ų71130.9 Ų130.973%0.73281%0.809SS**PPolyproline II helixtrans-77.1163.316700000112.5
585P42.3Very low39.1Very low136 Ų136130.8 Ų130.888%0.88381%0.808SS**SBendtrans-80133.2-170.430.9-34.8000114
586G39.1Very low38.7Very low76 Ų76133.7 Ų133.778%0.78481%0.808SS**  trans69.176.7141.600000118.9
587Q33.8Very low38.6Very low202 Ų202134.4 Ų134.494%0.94481%0.81SS**  trans-127.6134.9147.5-98.5-177.7-9.600110.8
588I33.3Very low39Very low181 Ų181134.2 Ų134.293%0.92881%0.808SS**  trans-87.2130-179.9-69.1168.7000108.9
589G35.6Very low39Very low56 Ų56132.2 Ų132.258%0.57781%0.807SS**  trans105.3119.5161.200000115.4
590N36Very low39Very low169 Ų169138.6 Ų138.690%0.90483%0.826SS**  -155.9128.9112.6-97.3-32.8000111.4
591T38.7Very low39.1Very low140 Ų140138 Ų13886%0.85982%0.821SS**PPolyproline II helixtrans-65.1153.6180-24.50000111.3
592G38.1Very low39.3Very low67 Ų67138.3 Ų138.369%0.69182%0.819SS**PPolyproline II helixtrans-59.7161.7178.600000114.6K594G592-K594 PolarHBondContact O-N 3.22Å
593L40.3Very low39.5Very low184 Ų184142 Ų14296%0.96382%0.822SS**PPolyproline II helixtrans-47.9118-177.7-74.7163000112.6G595L593-G595 PolarHBondContact O-N 3.27Å
594K37.2Very low39.6Very low193 Ų193141.9 Ų141.984%0.83982%0.82SS**  trans-72.5113.8178.7-155.8171.6-168.6168.30109.4G592G592-K594 PolarHBondContact O-N 3.22Å
595G42Very low39.7Very low66 Ų66146 Ų14668%0.6883%0.825SS**  trans-55.6147.6177.500000112.6L593 R597L593-G595 PolarHBondContact O-N 3.27Å; G595-R597 PolarHBondContact O-N 3.34Å
596K39.3Very low39.8Very low215 Ų215145.8 Ų145.894%0.93583%0.825SS**  trans-59.2130.2178.9-68.4-177.7-179.8177.20110G598K596-G598 PolarHBondContact O-N 3.37Å
597R35.6Very low39.8Very low233 Ų233145.5 Ų145.588%0.87982%0.821SS**  trans-73113.5-177.7-153.4-177.2-54.7-157.79109.3G595G595-R597 PolarHBondContact O-N 3.34Å
598G48.8Very low40.7Very low55 Ų55144.9 Ų144.957%0.56782%0.815SS**  trans-67.3167.1171.900000112.6K596K596-G598 PolarHBondContact O-N 3.37Å
599P43.3Very low41.1Very low135 Ų135142.2 Ų142.288%0.87781%0.81SS**  trans-62.8154.7178.327.3-34.2000112G601P599-G601 PolarHBondContact O-N 3.4Å
600K41.8Very low41.5Very low216 Ų216148 Ų14894%0.93982%0.822SS**  trans-72.196.4-167.5-165.3-178.3-174.2-174.80111.4
601G39.9Very low42Very low66 Ų66146.1 Ų146.168%0.6882%0.818SS**  trans-72.7159.9170.200000113.1P599P599-G601 PolarHBondContact O-N 3.4Å
602E42.9Very low42.4Very low199 Ų199142.8 Ų142.893%0.9381%0.812SS**  trans-75.1167.3-171.9-63.1-179.3141.500113.9G604E602-G604 PolarHBondContact O-N 2.61Å
603R40.4Very low42.8Very low253 Ų253148.5 Ų148.596%0.95582%0.821SS**  trans-76.6106.4-172.5-176.2-170-60.9-179.51.5110.9
604G38.2Very low43.4Very low66 Ų66145.8 Ų145.868%0.6881%0.814SS**  trans-96.4160.7168.900000113.9E602E602-G604 PolarHBondContact O-N 2.61Å
605D46.3Very low43.9Very low157 Ų157139.5 Ų139.584%0.8480%0.804SS**  trans-68156.2-169.5-69.6-72.5000116.7G607D605-G607 PolarHBondContact O-N 3.2Å
606P44.7Very low44.1Very low133 Ų133142.3 Ų142.386%0.86481%0.81SS**  trans-78.185.8-175.831.9-35.8000113.4
607G40.3Very low45Very low69 Ų69137.8 Ų137.871%0.71180%0.803SS**PPolyproline II helixtrans-83.8147.5169.300000114.1D605D605-G607 PolarHBondContact O-N 3.2Å
608K52.7Low45.7Very low189 Ų189130.1 Ų130.182%0.82280%0.796SS**PPolyproline II helixtrans-60.9148.3-178.2-66.9-178177.9-176.40113.3
609P41.5Very low45.9Very low126 Ų126135.6 Ų135.682%0.81881%0.811SS**PPolyproline II helixtrans-74.6134.4172.831.4-33.9000111.7
610H42.9Very low46.4Very low178 Ų178135.5 Ų135.582%0.82480%0.799SS**PPolyproline II helixtrans-85.8139.3169.2-54.8-76.4000110.1G612H610-G612 PolarHBondContact O-N 3.33Å
611P47.8Very low46.9Very low128 Ų128128.1 Ų128.183%0.83178%0.784SS**PPolyproline II helixtrans-64.1133.7170-17.931.3000110.5
612G46.5Very low47.5Very low70 Ų70130.9 Ų130.972%0.72279%0.79SS**PPolyproline II helixtrans-64.4149.317200000111.6H610H610-G612 PolarHBondContact O-N 3.33Å
613Q45.4Very low48.1Very low188 Ų188126.6 Ų126.688%0.87978%0.779SS**PPolyproline II helixtrans-62.6140.2178.2-72.1-176.1-1100111.3
614P53.4Low48.8Very low126 Ų126117.9 Ų117.982%0.81877%0.768SS**PPolyproline II helixtrans-57.8141.9171.9-23.734.2000111.8
615G48.4Very low49.7Very low61 Ų61122.9 Ų122.963%0.62978%0.777SS**PPolyproline II helixtrans-64154.3174.700000112.3
616P46.1Very low50.1Low126 Ų126121.1 Ų121.182%0.81877%0.768SS**PPolyproline II helixtrans-61.9145.8-17926.1-34.4000111.6
617P57.1Low50.5Low119 Ų119117.5 Ų117.577%0.77376%0.755SS**PPolyproline II helixtrans-57.3143.6178.4-2534.4000112.8I619P617-I619 PolarHBondContact O-N 3.26Å
618G51.5Low51.1Low72 Ų72119.5 Ų119.574%0.74275%0.753SS**PPolyproline II helixtrans-61.3134.6174.700000111.6Q620G618-Q620 PolarHBondContact O-N 3.45Å
619I53.9Low51.3Low170 Ų170112.5 Ų112.587%0.87273%0.73SS**PPolyproline II helixtrans-65.6127.9179.8-51.2175.4000108.7P617P617-I619 PolarHBondContact O-N 3.26Å
620Q52.5Low51.9Low134 Ų134119 Ų11963%0.62674%0.739SS**PPolyproline II helixtrans-62.7137.8175.5-71.6-174.69.300110.7G618G618-Q620 PolarHBondContact O-N 3.45Å
621G52.2Low52.6Low61 Ų61116.5 Ų116.563%0.62973%0.731SS**PPolyproline II helixtrans-63.3153.7173.700000111.9
622P52Low52.8Low124 Ų124113.3 Ų113.381%0.80572%0.721SS**PPolyproline II helixtrans-60.8148.5178.826.4-34.5000111.1
623P56.8Low53.2Low109 Ų109118.8 Ų118.871%0.70872%0.72SS**PPolyproline II helixtrans-55.6142.5176.3-24.334000112I625P623-I625 PolarHBondContact O-N 3.39Å
624G54.9Low53.5Low70 Ų70115.6 Ų115.672%0.72272%0.716SS**PPolyproline II helixtrans-61.4134.8172.200000111
625I57.5Low53.6Low170 Ų170111.7 Ų111.787%0.87270%0.698SS**PPolyproline II helixtrans-64.8137.3174.640.9172.9000111.2P623 G627P623-I625 PolarHBondContact O-N 3.39Å; I625-G627 PolarHBondContact O-N 3.49Å
626D54.4Low54Low121 Ų121118.3 Ų118.365%0.64771%0.713SS**PPolyproline II helixtrans-62.3125.6-172.8-60.6-54.3000111.9
627G53.4Low54.4Low56 Ų56122.1 Ų122.158%0.57771%0.711SS**PPolyproline II helixtrans-84.6119.6176.400000111.7I625 G635I625-G627 PolarHBondContact O-N 3.49Å; G627-G635 PolarHBondContact O-N 3.05Å
628V52.2Low54.3Low111 Ų111119 Ų11967%0.67370%0.7SS**BIsolated β-bridgetrans-84.9123.8172.4-167.50000109.2
629A55.9Low54.4Low43 Ų43121.8 Ų121.836%0.35571%0.705SS.*PPolyproline II helixtrans-68.1155.7172.600000110.7D631 G632 R633A629-D631 PolarHBondContact O-N 3.28Å; A629-G632 PolarHBondContact O-N 3.11Å; A629-R633 PolarHBondContact N-O 3.23Å
630R54.5Low54.3Low263 Ų263121.3 Ų121.399%0.99270%0.699SS**THydrogen-bonded Turntrans-61.2-17.2-175.8-88.1-173.9166.3-171.7-3.9114.3
631D58.7Low54.3Low125 Ų125118.4 Ų118.467%0.66871%0.706SS**THydrogen-bonded Turntrans-98.815.3-179.442.2-59.2000113.3A629 R633A629-D631 PolarHBondContact O-N 3.28Å; D631-R633 VanDerWaalsContact C-N 3.34Å; D631-R633 PolarHBondContact O-N 3.11Å
632G51.4Low54.3Low60 Ų60120.3 Ų120.362%0.61972%0.715SS**SBendtrans78.68160.200000116.2A629A629-G632 PolarHBondContact O-N 3.11Å
633R55.9Low54.3Low186 Ų186118 Ų11870%0.70271%0.706SS**SBendtrans-96.9141.7171.5-54.4-171.4-158.7-148.35110.3A629 D631 G635A629-R633 PolarHBondContact N-O 3.23Å; D631-R633 VanDerWaalsContact C-N 3.34Å; D631-R633 PolarHBondContact O-N 3.11Å; R633-G635 PolarHBondContact O-N 2.78Å
634P50Low54.2Low121 Ų121116.3 Ų116.379%0.78671%0.71SS**BIsolated β-bridgetrans-60127.9169.2-2032.3000109.9
635G55.6Low54Low44 Ų44120.7 Ų120.745%0.45471%0.711SS.*PPolyproline II helixtrans-69.8145.7174.300000111.5G627 R633 R637G627-G635 PolarHBondContact O-N 3.05Å; R633-G635 PolarHBondContact O-N 2.78Å; G635-R637 PolarHBondContact O-N 3.27Å
636E58.1Low53.7Low199 Ų199117.7 Ų117.793%0.9370%0.702SS**PPolyproline II helixtrans-62.2137.6175.5-69.6-169.1145.700111.3G638E636-G638 PolarHBondContact O-N 3.41Å; E636-G638 VanDerWaalsContact O-N 3.13Å
637R52.8Low53.3Low207 Ų207115.6 Ų115.678%0.78171%0.709SS**  trans-66.3111.5-179.4179.6178.8-67.5-176.9-0.5110.1G635G635-R637 PolarHBondContact O-N 3.27Å
638G55.7Low53.2Low53 Ų53120.2 Ų120.255%0.54672%0.716SS.*PPolyproline II helixtrans-57.6151.2171.500000112.4E636E636-G638 PolarHBondContact O-N 3.41Å; E636-G638 VanDerWaalsContact O-N 3.13Å
639P53.3Low52.9Low131 Ų131121 Ų12185%0.85172%0.723SS**PPolyproline II helixtrans-61.8139.4-174.525-34.2000112G641P639-G641 PolarHBondContact O-N 3.41Å
640Q51.7Low52.9Low159 Ų159122.5 Ų122.574%0.74374%0.743SS**PPolyproline II helixtrans-61.9130.4177.1-112.4176.7-43.200110.6A642Q640-A642 PolarHBondContact O-N 3.36Å
641G53.2Low52.8Low74 Ų74120 Ų12076%0.76374%0.739SS**PPolyproline II helixtrans-63.5128.8174.300000111.2P639P639-G641 PolarHBondContact O-N 3.41Å
642A51.8Low52.2Low100 Ų100118.8 Ų118.883%0.82675%0.747SS**PPolyproline II helixtrans-65.5143.5177.400000111.3Q640Q640-A642 PolarHBondContact O-N 3.36Å
643A51.7Low52.3Low75 Ų75118.9 Ų118.962%0.6275%0.748SS**PPolyproline II helixtrans-66.1135.1172.300000110.2
644G54.6Low52.2Low75 Ų75116 Ų11677%0.77375%0.753SS**PPolyproline II helixtrans-67.3140.8176.800000111.9
645E51.3Low52.2Low162 Ų162116.2 Ų116.276%0.75775%0.754SS**PPolyproline II helixtrans-64.7143.5178.5-74.2-158.6140.600112.5G647 H648E645-G647 PolarHBondContact O-N 3.23Å; E645-H648 IonicContact OE2-CE1 3.98Å
646P51.6Low51.6Low106 Ų106117.7 Ų117.769%0.68877%0.769SS**PPolyproline II helixtrans-58.3134.5167.4-2334.2000111.8H648P646-H648 PolarHBondContact O-N 3.06Å; P646-H648 PolarHBondContact O-ND1 3.38Å; P646-H648 VanDerWaalsContact O-ND1 3.17Å
647G46.7Very low50.9Low77 Ų77116.8 Ų116.879%0.79477%0.77SS**PPolyproline II helixtrans-60.3120.3178.100000112E645E645-G647 PolarHBondContact O-N 3.23Å
648H49.7Very low50.3Low154 Ų154114.2 Ų114.271%0.71377%0.771SS**PPolyproline II helixtrans-73.7131.5178.1-70.956.5000110.4E645 P646 G650E645-H648 IonicContact OE2-CE1 3.98Å; P646-H648 PolarHBondContact O-N 3.06Å; P646-H648 PolarHBondContact O-ND1 3.38Å; P646-H648 VanDerWaalsContact O-ND1 3.17Å; H648-G650 PolarHBondContact O-N 3.3Å
649P47.8Very low49.4Very low127 Ų127115.4 Ų115.483%0.82578%0.783SS**PPolyproline II helixtrans-59.9133.8172.8-23.634.2000111.4
650G55.7Low48.6Very low74 Ų74119 Ų11976%0.76379%0.785SS**PPolyproline II helixtrans-58.8141.6177.900000112.2H648 A652H648-G650 PolarHBondContact O-N 3.3Å; G650-A652 PolarHBondContact O-N 3.25Å
651K51.1Low47.9Very low210 Ų210117.7 Ų117.791%0.91379%0.792SS**PPolyproline II helixtrans-58.1138.5178.2-65.4-176.6179.8-179.10110.3G653K651-G653 PolarHBondContact O-N 3.4Å
652A45.8Very low46.8Very low101 Ų101123.7 Ų123.784%0.83580%0.801SS**PPolyproline II helixtrans-57.3136.2175.500000110.7G650G650-A652 PolarHBondContact O-N 3.25Å
653G54.4Low46Very low62 Ų62123.5 Ų123.564%0.63980%0.799SS**PPolyproline II helixtrans-62.7152.8174.900000111.6K651K651-G653 PolarHBondContact O-N 3.4Å
654P53.1Low45.2Very low125 Ų125124.5 Ų124.581%0.81281%0.807SS**PPolyproline II helixtrans-62.2144.4179.527-34.4000110.8
655P50.6Low44.2Very low126 Ų126129.4 Ų129.482%0.81881%0.812SS**PPolyproline II helixtrans-62.3138.417626.5-33.6000110.6
656G43.8Very low43.2Very low74 Ų74127.1 Ų127.176%0.76381%0.813SS**PPolyproline II helixtrans-61.7140.3176.400000111.8
657L43.2Very low42.3Very low180 Ų180130.3 Ų130.394%0.94282%0.823SS**PPolyproline II helixtrans-59.3134.5178.8-86.4152000111.7
658L40.1Very low41.7Very low154 Ų154131.1 Ų131.181%0.80682%0.823SS**PPolyproline II helixtrans-67.6128.6172.2-74.4161.4000109.8F660L658-F660 PolarHBondContact O-N 3.32Å
659G36Very low40.9Very low77 Ų77128.2 Ų128.279%0.79483%0.825SS**PPolyproline II helixtrans-71.4116.9173.600000110.9
660F37.8Very low40.2Very low206 Ų206127.4 Ų127.490%0.90482%0.822SS**PPolyproline II helixtrans-79.5122.5166.4-82.7-96.6000109.6L658L658-F660 PolarHBondContact O-N 3.32Å
661C35.8Very low39Very low132 Ų132127.9 Ų127.989%0.89282%0.819SS**PPolyproline II helixtrans-86.3131.8158.6-68.50000108.4
662E31.1Very low38.2Very low200 Ų200128 Ų12894%0.93582%0.816SS**  trans-136150.3156.8-154.4172-174.500109.6
663A35Very low37.5Very low97 Ų97128.9 Ų128.980%0.80281%0.811SS**  trans-111.7136.9-159.500000112.5
664A33.9Very low36.6Very low95 Ų95131.5 Ų131.579%0.78582%0.819SS**  trans-151.2133.2162.900000112.3
665M34.2Very low36.3Very low179 Ų179130.8 Ų130.888%0.88281%0.814SS**  trans7495.3160-55-86.164.200119.2
666C30.7Very low35.4Very low114 Ų114135.7 Ų135.777%0.7782%0.817SS**  trans-76.3176151.3-59.20000112.2
667L33Very low35Very low173 Ų173139.3 Ų139.391%0.90682%0.818SS**  trans88.489.7159.1-63.1162.7000119.5
668A33.4Very low34.6Very low94 Ų94139.6 Ų139.678%0.77781%0.814SS**  -171.9109.1117.100000108.9
669A32.2Very low34.2Very low92 Ų92140.9 Ų140.976%0.7682%0.816SS**  56.390.3101.600000113.4
670S32.8Very low34.2Very low110 Ų110142.2 Ų142.277%0.76982%0.82SS**  89.7115.566.368.30000115.6
671A31.4Very low33.9Very low85 Ų85136 Ų13670%0.70281%0.814SS**  trans76.7162.4150.100000120.9
672Y33.8Very low33.9Very low213 Ų213136 Ų13684%0.83581%0.809SS**  trans73.986.9179.4-63.7-86.8000116.4
673T32.2Very low34.3Very low119 Ų119133.5 Ų133.573%0.7380%0.801SS**  64.610977.571.30000115.1
674S33.9Very low34.3Very low116 Ų116138.5 Ų138.581%0.81181%0.805SS**  trans-64.2158.5154.8-44.70000110.2
675P46.6Very low34.5Very low110 Ų110137.1 Ų137.171%0.71480%0.8SS**  -153.617092.341.3-24.3000117.1
676R33Very low35.3Very low230 Ų230133.8 Ų133.887%0.86879%0.792SS**  trans69.2125.6157.5-73.9177.9169.1-176.2-4.5118.8
677L34.6Very low35.7Very low150 Ų150135.5 Ų135.579%0.78579%0.793SS**  79.395.566.9-118.9164.1000113
678Q34.4Very low35.9Very low186 Ų186137.6 Ų137.687%0.86981%0.813SS**  trans-163.6169.5141.5-114.9161.8-35.500112.9
679E32.9Very low36.1Very low181 Ų181139.8 Ų139.885%0.84681%0.814SS**  trans-91.3173.5-151.2-70165.710200117.2
680A34.8Very low36.3Very low105 Ų105142.3 Ų142.387%0.86882%0.817SS**  trans-19.6147161.500000119.6
681G33.1Very low36.5Very low76 Ų76144.1 Ų144.178%0.78482%0.82SS**  trans-171.1103.3169.800000114.7
682T35.3Very low36.7Very low130 Ų130147.5 Ų147.580%0.79883%0.827SS**  trans-44.8136.6172.932.50000118.8
683I38.8Very low36.9Very low148 Ų148143.4 Ų143.476%0.75983%0.826SS**  43.1107.6126.8-49.4170.8000119.2
684K35.2Very low37.2Very low202 Ų202145.1 Ų145.188%0.87883%0.833SS**  -178.3151.1118.4-111.9163.8-176.2175.80112.2
685G38.3Very low37.5Very low67 Ų67147.1 Ų147.169%0.69183%0.834SS**  trans-79.4-158.1161.800000111.6
686P50.2Low36.8Very low109 Ų109150 Ų15071%0.70884%0.843SS**  cis-139.8-173.122.742.6-24.3000115.7
687N38.8Very low37.1Very low149 Ų149143.3 Ų143.380%0.79784%0.841SS**  trans66.6133.9168.9-50.8-26000114.7
688V38.7Very low37.3Very low217 Ų217142.7 Ų142.7100%1.31585%0.846SS**  cis-130.3021.3172.70000110.6

Retrieved 688 of 688 residues in 90.6 ms (Link to these results)