B5X9K5_SALSA Loading...

Endothelial differentiation-related factor 1 homolog

AlphaFold DB , UniProt , Accession B5X9K5, Species SALSA (Salmo salar, Atlantic salmon), Gene EDF1, Length 148 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
1M45.3Very low57.5Low244 Ų244148.7 Ų148.7100%1.20281%0.812SS**  0113.40-75.3-177.4168.400106.8
2A51.2Low58.1Low96 Ų96149.3 Ų149.379%0.79381%0.812SS**  trans30101.5169.400000116.8
3E61.8Low58.1Low190 Ų190155.8 Ų155.889%0.88882%0.818SS**  40.586.360.4-74.7-172.5123.100114.1
4S53.3Low59Low123 Ų123158.9 Ų158.986%0.8682%0.821SS**  trans171.589.1136.3-76.90000111.1
5D58.3Low59.8Low132 Ų132161.6 Ų161.671%0.70682%0.824SS**  trans-145.530.8164.9-136.6-11000112
6W57.8Low60.8Low255 Ų255154.9 Ų154.997%0.96681%0.807SS**SBendtrans-98.26.1-177.8-83.888.2000114.2
7D57.9Low61.7Low154 Ų154151.5 Ų151.582%0.82480%0.797SS**  trans-116.413.5-177.9-105.6-25.3000114.5V9D7-V9 VanDerWaalsContact C-N 3.27Å; D7-V9 PolarHBondContact O-N 3.29Å
8T60.9Low62.9Low101 Ų101147.3 Ų147.362%0.6278%0.779SS**  trans-83.773171.422.90000110.4T10T8-T10 PolarHBondContact O-N 3.25Å; T8-T10 PolarHBondContact O-OG1 3Å
9V60.3Low63.7Low118 Ų118143.3 Ų143.372%0.71577%0.768SS**  trans-55.4104.2166.9178.30000108.2D7 V11D7-V9 VanDerWaalsContact C-N 3.27Å; D7-V9 PolarHBondContact O-N 3.29Å; V9-V11 HydrophobicContact CG1-CG2 4.27Å; V9-V11 PolarHBondContact O-N 3.39Å
10T62.3Low64.4Low116 Ų116140.2 Ų140.271%0.71276%0.763SS**  trans-70.892.9177.8-29.10000108T8 L12T8-T10 PolarHBondContact O-N 3.25Å; T8-T10 PolarHBondContact O-OG1 3Å; T10-L12 HydrophobicContact CG2-CD1 4.06Å; T10-L12 PolarHBondContact O-N 3.43Å
11V63.4Low65.1Low107 Ų107138.7 Ų138.765%0.64875%0.752SS**  trans-71.193.5178.4-177.80000108.8V9 R13V9-V11 HydrophobicContact CG1-CG2 4.27Å; V9-V11 PolarHBondContact O-N 3.39Å; V11-R13 PolarHBondContact O-N 2.91Å; V11-R13 VanDerWaalsContact O-N 3.16Å
12L64.8Low66.7Low155 Ų155129.5 Ų129.581%0.81271%0.714SS**SBendtrans-66.2-11.2-176.7-110.270.5000114.9T10T10-L12 HydrophobicContact CG2-CD1 4.06Å; T10-L12 PolarHBondContact O-N 3.43Å
13R58Low68.2Low235 Ų235132.8 Ų132.889%0.88771%0.711SS**  trans-158.7109.1173.6-115.4-179.3-100-176.6-5.7111.6V11 K15V11-R13 PolarHBondContact O-N 2.91Å; V11-R13 VanDerWaalsContact O-N 3.16Å; R13-K15 PolarHBondContact O-N 2.88Å
14K70.4Confident69.3Low199 Ų199125.7 Ų125.787%0.86568%0.682SS**  trans-78.6111.5167.5-168.4170.9-176.7175.70108.4G16K14-G16 PolarHBondContact O-N 3.5Å
15K72.1Confident70.9Confident199 Ų199128.4 Ų128.487%0.86568%0.678SS**PPolyproline II helixtrans-59.4129175.8-167.7168.1-177.3172.30108.9R13R13-K15 PolarHBondContact O-N 2.88Å
16G74.9Confident72.3Confident54 Ų54130.1 Ų130.156%0.55768%0.682SS**PPolyproline II helixtrans-57.6156.9178.200000112.1K14K14-G16 PolarHBondContact O-N 3.5Å
17P77.1Confident73.7Confident97 Ų97119.5 Ų119.563%0.6365%0.649SS**PPolyproline II helixtrans-60.1141.7179.725.1-32.8000111Q21P17-Q21 HydrophobicContact CB-CB 4.06Å
18T83.1Confident75.1Confident77 Ų77115.4 Ų115.447%0.47263%0.626SS.*PPolyproline II helixtrans-66.2159.2173.161.20000111.1A20 Q21 A22T18-A20 PolarHBondContact O-N 3.27Å; T18-A20 VanDerWaalsContact O-N 3.11Å; T18-Q21 WeakPolarHBondContact O-CA 3.44Å; T18-Q21 WeakPolarHBondContact O-CB 3.44Å; T18-Q21 PolarHBondContact O-N 3Å; T18-Q21 VanDerWaalsContact OG1-CD 3.23Å; T18-Q21 VanDerWaalsContact OG1-CG 3.29Å; T18-Q21 WeakPolarHBondContact OG1-CG 3.49Å; T18-Q21 PolarHBondContact OG1-OE1 2.99Å; T18-A22 PolarHBondContact O-N 3.45Å
19A77.8Confident76.5Confident70 Ų70112.8 Ų112.858%0.57961%0.61SS**Hα-helixtrans-55.8-32.5179.700000113.6K23A19-K23 WeakPolarHBondContact O-CB 3.29Å; A19-K23 VanDerWaalsContact O-CG 3.27Å; A19-K23 WeakPolarHBondContact O-CG 3.45Å; A19-K23 PolarHBondContact O-N 3.2Å
20A78.5Confident77.9Confident81 Ų81108.7 Ų108.767%0.66959%0.589SS**Hα-helixtrans-70.4-37.8175.300000112.3T18 S24T18-A20 PolarHBondContact O-N 3.27Å; T18-A20 VanDerWaalsContact O-N 3.11Å; A20-S24 PolarHBondContact O-N 3.19Å
21Q78.6Confident79.1Confident110 Ų110103.6 Ų103.651%0.51456%0.558SS.*Hα-helixtrans-71.6-40.9177.1-70.9165.9-40.600111.5P17 T18 K23 S24 A27P17-Q21 HydrophobicContact CB-CB 4.06Å; T18-Q21 WeakPolarHBondContact O-CA 3.44Å; T18-Q21 WeakPolarHBondContact O-CB 3.44Å; T18-Q21 PolarHBondContact O-N 3Å; T18-Q21 VanDerWaalsContact OG1-CD 3.23Å; T18-Q21 VanDerWaalsContact OG1-CG 3.29Å; T18-Q21 WeakPolarHBondContact OG1-CG 3.49Å; T18-Q21 PolarHBondContact OG1-OE1 2.99Å; Q21-K23 VanDerWaalsContact C-N 3.31Å; Q21-K23 PolarHBondContact O-N 3.39Å; Q21-S24 VanDerWaalsContact O-CB 3.26Å; Q21-S24 WeakPolarHBondContact O-CB 3.33Å; Q21-S24 PolarHBondContact O-N 3.28Å; Q21-S24 PolarHBondContact O-OG 3.47Å; Q21-A27 VanDerWaalsContact O-CB 3.31Å; Q21-A27 WeakPolarHBondContact O-CB 3.48Å
22A77.8Confident80.4Confident51 Ų51104.3 Ų104.342%0.42155%0.554SS.*Hα-helixtrans-64.1-34.117700000112.7T18 S24T18-A22 PolarHBondContact O-N 3.45Å; A22-S24 VanDerWaalsContact C-N 3.3Å; A22-S24 PolarHBondContact O-N 3.26Å
23K82.5Confident81.7Confident165 Ų165107 Ų10772%0.71755%0.554SS**THydrogen-bonded Turntrans-864.3177.1-66.1175.4-176-176.80113.8A19 Q21 I28A19-K23 WeakPolarHBondContact O-CB 3.29Å; A19-K23 VanDerWaalsContact O-CG 3.27Å; A19-K23 WeakPolarHBondContact O-CG 3.45Å; A19-K23 PolarHBondContact O-N 3.2Å; Q21-K23 VanDerWaalsContact C-N 3.31Å; Q21-K23 PolarHBondContact O-N 3.39Å; K23-I28 WeakPolarHBondContact O-CD1 3.35Å
24S86.6Confident83.2Confident41 Ų41103.2 Ų103.229%0.28754%0.54SS..SBendtrans-69.1149.2179.872.30000111.2A20 Q21 A22 Q26 A27 I28A20-S24 PolarHBondContact O-N 3.19Å; Q21-S24 VanDerWaalsContact O-CB 3.26Å; Q21-S24 WeakPolarHBondContact O-CB 3.33Å; Q21-S24 PolarHBondContact O-N 3.28Å; Q21-S24 PolarHBondContact O-OG 3.47Å; A22-S24 VanDerWaalsContact C-N 3.3Å; A22-S24 PolarHBondContact O-N 3.26Å; S24-Q26 PolarHBondContact O-N 3.17Å; S24-A27 PolarHBondContact O-N 3.35Å; S24-A27 VanDerWaalsContact O-N 3.1Å; S24-A27 VanDerWaalsContact OG-CB 3.24Å; S24-A27 WeakPolarHBondContact OG-CB 3.46Å; S24-A27 PolarHBondContact OG-N 3.05Å; S24-I28 WeakPolarHBondContact O-CG1 3.2Å; S24-I28 PolarHBondContact O-N 3.28Å
25K86.8Confident84Confident179 Ų17996.9 Ų96.978%0.77853%0.53SS*.Hα-helixtrans-56.1-39.6179.1-172.1176.6-179.5-178.20111.8T29K25-T29 WeakPolarHBondContact O-CB 3.46Å; K25-T29 PolarHBondContact O-N 3.39Å; K25-T29 PolarHBondContact O-OG1 3.49Å
26Q87.8Confident84.9Confident168 Ų16891.9 Ų91.979%0.78551%0.51SS*.Hα-helixtrans-65.4-43.9178-69175.2-11.400111.8S24 T29 A30S24-Q26 PolarHBondContact O-N 3.17Å; Q26-T29 PolarHBondContact O-N 3.36Å; Q26-A30 WeakPolarHBondContact O-CB 3.34Å; Q26-A30 PolarHBondContact O-N 2.98Å
27A85.8Confident85.3Confident33 Ų3397.3 Ų97.327%0.27353%0.526SS..Hα-helixtrans-64.2-44.6177.100000111.9Q21 S24 A30 A31Q21-A27 VanDerWaalsContact O-CB 3.31Å; Q21-A27 WeakPolarHBondContact O-CB 3.48Å; S24-A27 PolarHBondContact O-N 3.35Å; S24-A27 VanDerWaalsContact O-N 3.1Å; S24-A27 VanDerWaalsContact OG-CB 3.24Å; S24-A27 WeakPolarHBondContact OG-CB 3.46Å; S24-A27 PolarHBondContact OG-N 3.05Å; A27-A30 PolarHBondContact O-N 3.02Å; A27-A31 WeakPolarHBondContact O-CB 3.39Å; A27-A31 PolarHBondContact O-N 2.74Å
28I88Confident85.7Confident68 Ų6896.2 Ų96.235%0.34952%0.515SS..Hα-helixtrans-62.1-47.3177.7-63.4166.8000110.6K23 S24 A30 A31 Q32K23-I28 WeakPolarHBondContact O-CD1 3.35Å; S24-I28 WeakPolarHBondContact O-CG1 3.2Å; S24-I28 PolarHBondContact O-N 3.28Å; I28-A30 VanDerWaalsContact C-N 3.32Å; I28-A30 PolarHBondContact O-N 3.25Å; I28-A31 PolarHBondContact O-N 2.83Å; I28-Q32 WeakPolarHBondContact O-CG 3.39Å; I28-Q32 PolarHBondContact O-N 3.46Å
29T90.9Very high86Confident46 Ų46102 Ų10228%0.28254%0.536SS..Hα-helixtrans-64.9-35.4178.5-600000112.4K25 Q26 R33K25-T29 WeakPolarHBondContact O-CB 3.46Å; K25-T29 PolarHBondContact O-N 3.39Å; K25-T29 PolarHBondContact O-OG1 3.49Å; Q26-T29 PolarHBondContact O-N 3.36Å; T29-R33 WeakPolarHBondContact O-CG 3.39Å; T29-R33 PolarHBondContact O-N 2.88Å
30A89.4Confident86.6Confident31 Ų31104.8 Ų104.826%0.25655%0.547SS..Hα-helixtrans-67.7-43.3175.700000112.1Q26 A27 I28 R33 R34Q26-A30 WeakPolarHBondContact O-CB 3.34Å; Q26-A30 PolarHBondContact O-N 2.98Å; A27-A30 PolarHBondContact O-N 3.02Å; I28-A30 VanDerWaalsContact C-N 3.32Å; I28-A30 PolarHBondContact O-N 3.25Å; A30-R33 PolarHBondContact O-N 3.14Å; A30-R34 WeakPolarHBondContact O-CG 3.34Å; A30-R34 PolarHBondContact O-N 3.09Å; A30-R34 VanDerWaalsContact O-N 3.1Å
31A87.8Confident87.2Confident9 Ų9107.1 Ų107.17%0.07455%0.553CS.*Hα-helixtrans-61.6-42.5175.100000111.9A27 I28 R33 R34 G35 E36 L38A27-A31 WeakPolarHBondContact O-CB 3.39Å; A27-A31 PolarHBondContact O-N 2.74Å; I28-A31 PolarHBondContact O-N 2.83Å; A31-R33 VanDerWaalsContact C-N 3.31Å; A31-R33 PolarHBondContact O-N 3.44Å; A31-R34 PolarHBondContact O-N 3.32Å; A31-G35 PolarHBondContact O-N 3.4Å; A31-G35 VanDerWaalsContact O-N 3.16Å; A31-E36 HydrophobicContact CB-CB 4.15Å; A31-E36 WeakPolarHBondContact CB-OE2 3.27Å; A31-E36 PolarHBondContact O-N 3.43Å; A31-E36 VanDerWaalsContact O-N 3.08Å; A31-L38 HydrophobicContact CB-CD2 3.83Å
32Q90.4Very high87.8Confident122 Ų122110.6 Ų110.657%0.5757%0.566SS**Hα-helixtrans-56.4-42.3173.2-75.9179.7-29.900112.8I28 G35 L38I28-Q32 WeakPolarHBondContact O-CG 3.39Å; I28-Q32 PolarHBondContact O-N 3.46Å; Q32-G35 PolarHBondContact O-N 2.98Å; Q32-L38 HydrophobicContact CB-CD1 4.31Å; Q32-L38 HydrophobicContact CG-CD1 3.23Å
33R91.7Very high88.5Confident213 Ų213116.5 Ų116.580%0.80458%0.583SS**Hα-helixtrans-71.4-30.8-179.9-72174.2-177.6176.4-0.5113.1T29 A30 A31 G35T29-R33 WeakPolarHBondContact O-CG 3.39Å; T29-R33 PolarHBondContact O-N 2.88Å; A30-R33 PolarHBondContact O-N 3.14Å; A31-R33 VanDerWaalsContact C-N 3.31Å; A31-R33 PolarHBondContact O-N 3.44Å; R33-G35 VanDerWaalsContact C-N 3.29Å
34R90.4Very high88.6Confident155 Ų155120.5 Ų120.559%0.58559%0.593SS**Hα-helixtrans-83.3-5.2178.1-68.2-168.8-58-103-6113.1A30 A31 E36A30-R34 WeakPolarHBondContact O-CG 3.34Å; A30-R34 PolarHBondContact O-N 3.09Å; A30-R34 VanDerWaalsContact O-N 3.1Å; A31-R34 PolarHBondContact O-N 3.32Å; R34-E36 VanDerWaalsContact C-N 3.26Å; R34-E36 HydrophobicContact CB-CG 4.06Å; R34-E36 IonicContact CZ-OE1 3.36Å; R34-E36 IonicContact CZ-OE2 3.63Å; R34-E36 IonicContact NE-OE1 2.73Å; R34-E36 PolarHBondContact NE-OE1 2.9Å; R34-E36 IonicContact NE-OE2 3.57Å; R34-E36 IonicContact NH2-OE1 3.18Å; R34-E36 PolarHBondContact NH2-OE1 3.36Å; R34-E36 IonicContact NH2-OE2 2.81Å; R34-E36 PolarHBondContact NH2-OE2 3.27Å; R34-E36 PolarHBondContact O-N 3.25Å
35G87.1Confident88.7Confident65 Ų65121.7 Ų121.767%0.6760%0.601SS**THydrogen-bonded Turntrans69.224.8-176.400000113.1A31 Q32 R33A31-G35 PolarHBondContact O-N 3.4Å; A31-G35 VanDerWaalsContact O-N 3.16Å; Q32-G35 PolarHBondContact O-N 2.98Å; R33-G35 VanDerWaalsContact C-N 3.29Å
36E89.4Confident88.8Confident94 Ų94115.2 Ų115.244%0.43958%0.581SS.*  trans-75.2149.4175.5-69.1170.7-177.600110.6A31 R34A31-E36 HydrophobicContact CB-CB 4.15Å; A31-E36 WeakPolarHBondContact CB-OE2 3.27Å; A31-E36 PolarHBondContact O-N 3.43Å; A31-E36 VanDerWaalsContact O-N 3.08Å; R34-E36 VanDerWaalsContact C-N 3.26Å; R34-E36 HydrophobicContact CB-CG 4.06Å; R34-E36 IonicContact CZ-OE1 3.36Å; R34-E36 IonicContact CZ-OE2 3.63Å; R34-E36 IonicContact NE-OE1 2.73Å; R34-E36 PolarHBondContact NE-OE1 2.9Å; R34-E36 IonicContact NE-OE2 3.57Å; R34-E36 IonicContact NH2-OE1 3.18Å; R34-E36 PolarHBondContact NH2-OE1 3.36Å; R34-E36 IonicContact NH2-OE2 2.81Å; R34-E36 PolarHBondContact NH2-OE2 3.27Å; R34-E36 PolarHBondContact O-N 3.25Å
37D83.6Confident88.9Confident168 Ų168111.6 Ų111.690%0.89859%0.589SS**  trans-65.2135.4178-69-40.6000112
38L86.7Confident89.2Confident75 Ų75116.8 Ų116.839%0.39361%0.608SS.*  trans-121.6117.6-178.6-69.1166.9000110.7A31 Q32 T40A31-L38 HydrophobicContact CB-CD2 3.83Å; Q32-L38 HydrophobicContact CB-CD1 4.31Å; Q32-L38 HydrophobicContact CG-CD1 3.23Å; L38-T40 PolarHBondContact O-N 3.49Å
39E89.6Confident89.1Confident197 Ų197119.6 Ų119.692%0.92162%0.624SS**  trans-77.2125.2171.5-66.5-175166.900110.7
40T89.5Confident89Confident130 Ų130124 Ų12480%0.79864%0.639SS**  trans-115.7133.4171.864.30000109.9L38L38-T40 PolarHBondContact O-N 3.49Å
41T91Very high88.6Confident130 Ų130128.1 Ų128.180%0.79865%0.653SS**  trans-128.5137.3175.756.10000109.9K43T41-K43 PolarHBondContact O-N 2.87Å
42K92.2Very high88.4Confident183 Ų183133 Ų13380%0.79667%0.674SS**PPolyproline II helixtrans-70.4129.9175.4-174.7178.4178.5-178.80109A46K42-A46 HydrophobicContact CG-CB 4.06Å
43K91.1Very high88Confident175 Ų175131.6 Ų131.676%0.76167%0.67SS**PPolyproline II helixtrans-66.9141.8175.3-66.4-178.7179.7173.90110.8T41 S45 A46T41-K43 PolarHBondContact O-N 2.87Å; K43-S45 PolarHBondContact O-N 3.18Å; K43-A46 HydrophobicContact CB-CB 4.19Å; K43-A46 WeakPolarHBondContact O-CB 3.45Å; K43-A46 PolarHBondContact O-N 3.4Å
44W85.4Confident87.5Confident248 Ų248127.1 Ų127.194%0.93966%0.659SS**THydrogen-bonded Turntrans-57.7133.5168.5-173.2-108.6000110A46W44-A46 VanDerWaalsContact C-N 3.25Å; W44-A46 PolarHBondContact O-N 3.11Å
45S88.6Confident86.9Confident66 Ų66123.2 Ų123.246%0.46265%0.653SS.*THydrogen-bonded Turntrans6219-171.9-55.30000116.2K43 G47 Q48K43-S45 PolarHBondContact O-N 3.18Å; S45-G47 PolarHBondContact O-N 2.9Å; S45-Q48 PolarHBondContact O-N 2.88Å
46A89.1Confident86.6Confident43 Ų43124 Ų12436%0.35564%0.638SS.*THydrogen-bonded Turntrans-62.8135.7172.600000112K42 K43 W44K42-A46 HydrophobicContact CG-CB 4.06Å; K43-A46 HydrophobicContact CB-CB 4.19Å; K43-A46 WeakPolarHBondContact O-CB 3.45Å; K43-A46 PolarHBondContact O-N 3.4Å; W44-A46 VanDerWaalsContact C-N 3.25Å; W44-A46 PolarHBondContact O-N 3.11Å
47G89.7Confident86.3Confident92 Ų92125.1 Ų125.195%0.94865%0.647SS**THydrogen-bonded Turntrans82.39.5179.100000114.7S45S45-G47 PolarHBondContact O-N 2.9Å
48Q91.8Very high86.2Confident142 Ų142121.5 Ų121.566%0.66463%0.631SS**  trans-116.3151.6177.6-63.7-178.9-34.400111.1S45S45-Q48 PolarHBondContact O-N 2.88Å
49N86.9Confident86.1Confident128 Ų128120.3 Ų120.368%0.68463%0.632SS**  trans-117.662.8176.2-171.47000111.3Q51N49-Q51 PolarHBondContact ND2-NE2 2.97Å; N49-Q51 PolarHBondContact O-N 3.2Å; N49-Q51 VanDerWaalsContact O-N 3.1Å; N49-Q51 PolarHBondContact OD1-NE2 3.1Å
50K87.3Confident85.8Confident139 Ų139117.2 Ų117.260%0.60462%0.615SS**  trans-68.5110176.4-171.8164.7-174.3163.10109.3H52 L53K50-H52 WeakPolarHBondContact CE-O 3.07Å; K50-L53 HydrophobicContact CB-CD1 4.08Å; K50-L53 HydrophobicContact CG-CD1 4.18Å; K50-L53 WeakPolarHBondContact O-CD1 3.18Å
51Q82.2Confident85.4Confident117 Ų117114.4 Ų114.455%0.54760%0.595SS.*SBendtrans-72.1-37.9-175.1-70-67-55.800113N49 Q119N49-Q51 PolarHBondContact ND2-NE2 2.97Å; N49-Q51 PolarHBondContact O-N 3.2Å; N49-Q51 VanDerWaalsContact O-N 3.1Å; N49-Q51 PolarHBondContact OD1-NE2 3.1Å; Q51-Q119 PolarHBondContact O-NE2 2.77Å
52H82.8Confident85Confident111 Ų111114.8 Ų114.851%0.51459%0.592SS.*SBendtrans-106.4101.3179.8-165.2-58.7000110.4K50K50-H52 WeakPolarHBondContact CE-O 3.07Å
53L81.4Confident84.7Confident93 Ų93115.1 Ų115.149%0.48759%0.589SS.*  trans-86.5150.1172.9-93.565.7000110.7K50K50-L53 HydrophobicContact CB-CD1 4.08Å; K50-L53 HydrophobicContact CG-CD1 4.18Å; K50-L53 WeakPolarHBondContact O-CD1 3.18Å
54M81.8Confident84.1Confident119 Ų119111.3 Ų111.359%0.58657%0.573SS**  trans-72.3131.7170.5-63.7-53.8119.300109.1T58M54-T58 HydrophobicContact CB-CG2 4.35Å; M54-T58 HydrophobicContact CG-CG2 4.23Å
55T78.4Confident83.5Confident72 Ų72105.2 Ų105.244%0.44256%0.564SS.*SBendtrans-79.6-23.9-175.4-167.50000113.2
56K80.5Confident82.6Confident83 Ų83110.8 Ų110.836%0.36158%0.582SS.*SBendtrans-113.4155.7176.8-75.5-174174.8-170.30110.1T58 L61 H70K56-T58 PolarHBondContact O-N 2.89Å; K56-L61 HydrophobicContact CB-CD1 3.77Å; K56-L61 HydrophobicContact CB-CG 4.2Å; K56-L61 HydrophobicContact CD-CD1 4.25Å; K56-L61 HydrophobicContact CD-CD2 3.84Å; K56-L61 HydrophobicContact CD-CG 4.3Å; K56-H70 PolarHBondContact NZ-CD2 3.25Å; K56-H70 PolarHBondContact NZ-NE2 2.94Å; K56-H70 VanDerWaalsContact NZ-NE2 3.11Å
57N82.6Confident81.4Confident116 Ų116114.6 Ų114.662%0.6259%0.593SS**  trans-69.7113.4174.1-74.2-51.9000109.8A59 K60 L61N57-A59 VanDerWaalsContact C-N 3.27Å; N57-A59 PolarHBondContact O-N 2.73Å; N57-K60 HydrophobicContact CB-CB 4.24Å; N57-K60 HydrophobicContact CB-CD 4.39Å; N57-K60 HydrophobicContact CB-CG 4.1Å; N57-K60 PolarHBondContact O-N 3.45Å; N57-L61 PolarHBondContact O-N 2.77Å; N57-L61 VanDerWaalsContact O-N 3.13Å
58T82.7Confident80.6Confident92 Ų92117.9 Ų117.956%0.56459%0.588SS**Hα-helixtrans-59.6-37.5-178.153.60000112.3M54 K56 K60 L61 D62M54-T58 HydrophobicContact CB-CG2 4.35Å; M54-T58 HydrophobicContact CG-CG2 4.23Å; K56-T58 PolarHBondContact O-N 2.89Å; T58-K60 PolarHBondContact O-N 3.24Å; T58-L61 PolarHBondContact O-N 3.08Å; T58-D62 WeakPolarHBondContact O-CB 3.44Å; T58-D62 PolarHBondContact O-N 3.44Å
59A84.1Confident79.8Confident51 Ų51118.4 Ų118.442%0.42159%0.59SS.*Hα-helixtrans-68.2-20.4177.700000114.3N57 R63N57-A59 VanDerWaalsContact C-N 3.27Å; N57-A59 PolarHBondContact O-N 2.73Å; A59-R63 WeakPolarHBondContact O-CG 3.22Å; A59-R63 PolarHBondContact O-NH1 3.39Å
60K82.6Confident79.4Confident131 Ų131115.8 Ų115.857%0.5757%0.574SS**Hα-helixtrans-83-45.5171.2-70.7-167.1175-166.30110.4N57 T58 D62 R63 E64N57-K60 HydrophobicContact CB-CB 4.24Å; N57-K60 HydrophobicContact CB-CD 4.39Å; N57-K60 HydrophobicContact CB-CG 4.1Å; N57-K60 PolarHBondContact O-N 3.45Å; T58-K60 PolarHBondContact O-N 3.24Å; K60-D62 PolarHBondContact O-N 2.99Å; K60-R63 PolarHBondContact O-N 3.16Å; K60-E64 WeakPolarHBondContact O-CG 3.44Å; K60-E64 PolarHBondContact O-N 3.33Å
61L82Confident79.2Confident71 Ų71117.6 Ų117.637%0.37259%0.585SS.*Hα-helixtrans-56.7-36.4175.7-74.7174.6000113K56 N57 T58 R63K56-L61 HydrophobicContact CB-CD1 3.77Å; K56-L61 HydrophobicContact CB-CG 4.2Å; K56-L61 HydrophobicContact CD-CD1 4.25Å; K56-L61 HydrophobicContact CD-CD2 3.84Å; K56-L61 HydrophobicContact CD-CG 4.3Å; N57-L61 PolarHBondContact O-N 2.77Å; N57-L61 VanDerWaalsContact O-N 3.13Å; T58-L61 PolarHBondContact O-N 3.08Å; L61-R63 VanDerWaalsContact C-N 3.32Å
62D82.2Confident79.5Confident138 Ų138119.8 Ų119.874%0.73859%0.588SS**THydrogen-bonded Turntrans-71.5-26.1178.1-169.756.2000113.2T58 K60T58-D62 WeakPolarHBondContact O-CB 3.44Å; T58-D62 PolarHBondContact O-N 3.44Å; K60-D62 PolarHBondContact O-N 2.99Å
63R84.6Confident79.7Confident191 Ų191115 Ų11572%0.72157%0.566SS**THydrogen-bonded Turntrans-91.9-23177.1-70.2-175.9176.987-1.9113.2A59 K60 L61 T65A59-R63 WeakPolarHBondContact O-CG 3.22Å; A59-R63 PolarHBondContact O-NH1 3.39Å; K60-R63 PolarHBondContact O-N 3.16Å; L61-R63 VanDerWaalsContact C-N 3.32Å; R63-T65 PolarHBondContact O-N 2.92Å
64E78.8Confident80Confident94 Ų94113.3 Ų113.344%0.43956%0.562SS.*  trans-76.6102.2177.7-80.5168-170.500109.3K60K60-E64 WeakPolarHBondContact O-CG 3.44Å; K60-E64 PolarHBondContact O-N 3.33Å
65T72.8Confident80.3Confident120 Ų120112.8 Ų112.874%0.73656%0.561SS**  trans-100-7.2177.953.30000113.8R63R63-T65 PolarHBondContact O-N 2.92Å
66E70Confident80.8Confident183 Ų183115 Ų11586%0.85557%0.567SS**SBendtrans-109-30.9-168.1-62.1-176.5165.400114.5
67E64.9Low81.3Confident123 Ų123111.5 Ų111.558%0.57555%0.552SS**  trans-97.7105.7-176.7-172.2163.7-134.800112Q69E67-Q69 HydrophobicContact CG-CG 4.37Å
68L72Confident81.7Confident162 Ų162106 Ų10685%0.84852%0.523SS*.  trans-91.1-10.1179.5-103.884.2000114.8
69Q74.7Confident82.2Confident152 Ų152107.2 Ų107.271%0.7152%0.521SS*.  trans-99.9140.6-174.863.3174.5-27.500112.9E67E67-Q69 HydrophobicContact CG-CG 4.37Å
70H79Confident82.6Confident74 Ų74105.4 Ų105.434%0.34350%0.504SS..  trans-110.7130.3175.7-73.872.8000109.9K56 R72 I115K56-H70 PolarHBondContact NZ-CD2 3.25Å; K56-H70 PolarHBondContact NZ-NE2 2.94Å; K56-H70 VanDerWaalsContact NZ-NE2 3.11Å; H70-R72 PolarHBondContact O-N 3.27Å; H70-I115 HydrophobicContact CB-CD1 3.94Å; H70-I115 HydrophobicContact CB-CG1 4.19Å
71Q83.2Confident83.1Confident177 Ų17799.2 Ų99.283%0.82748%0.477SS*.PPolyproline II helixtrans-60.6129.5169.1-67.9-177.217.900109.7P116Q71-P116 WeakPolarHBondContact O-CD 3.22Å
72R87.6Confident83.6Confident162 Ų16299.7 Ų99.761%0.61148%0.477SS*.PPolyproline II helixtrans-99.9165.7178.4-59.1-176.6-174.2-98.61110.3H70 S74 G112 K113 A114H70-R72 PolarHBondContact O-N 3.27Å; R72-S74 PolarHBondContact O-N 3.5Å; R72-G112 WeakPolarHBondContact CB-O 3.36Å; R72-K113 PolarHBondContact NH1-O 2.88Å; R72-A114 WeakPolarHBondContact CA-O 2.97Å
73V87.1Confident84.1Confident11 Ų1198.3 Ų98.37%0.06747%0.467CS..PPolyproline II helixtrans-60.4134.5174178.60000109.6V77 Y109 G112 A114 P116V73-V77 HydrophobicContact CG1-CB 3.67Å; V73-V77 HydrophobicContact CG1-CG1 3.59Å; V73-Y109 HydrophobicContact CG2-CD1 3.78Å; V73-Y109 HydrophobicContact CG2-CE1 3.8Å; V73-G112 WeakPolarHBondContact O-CA 3.27Å; V73-A114 HydrophobicContact CG2-CB 4.39Å; V73-A114 WeakPolarHBondContact CG2-O 3.36Å; V73-A114 PolarHBondContact N-O 3.08Å; V73-P116 HydrophobicContact CG2-CB 3.91Å; V73-P116 HydrophobicContact CG2-CG 4.47Å
74S88.1Confident84.5Confident58 Ų5889.3 Ų89.341%0.40643%0.433SS..PPolyproline II helixtrans-68.9152.5177.270.80000111.2R72 E76 V77 G78R72-S74 PolarHBondContact O-N 3.5Å; S74-E76 PolarHBondContact O-N 3.01Å; S74-V77 PolarHBondContact O-N 3.26Å; S74-V77 WeakPolarHBondContact OG-CG2 3.39Å; S74-G78 PolarHBondContact O-N 3.06Å
75L88.1Confident85.3Confident107 Ų10786.5 Ų86.556%0.5642%0.419SS*.Hα-helixtrans-61.9-30.1178.7-172.764.5000112.5G78 K79L75-G78 PolarHBondContact O-N 3.11Å; L75-K79 WeakPolarHBondContact O-CG 3.36Å; L75-K79 PolarHBondContact O-N 3.07Å
76E89.3Confident86.2Confident119 Ų11986.1 Ų86.156%0.55641%0.409SS*.Hα-helixtrans-59.8-47.8175.2-173.6-174.1170.400111.7S74 G78 K79 V80S74-E76 PolarHBondContact O-N 3.01Å; E76-G78 VanDerWaalsContact C-N 3.29Å; E76-G78 PolarHBondContact O-N 2.84Å; E76-K79 PolarHBondContact O-N 2.78Å; E76-V80 WeakPolarHBondContact O-CG2 3.46Å; E76-V80 PolarHBondContact O-N 2.74Å
77V90.3Very high87.3Confident9 Ų983.9 Ų83.96%0.05540%0.403CS..Hα-helixtrans-61.3-41.2176.6172.60000110.6V73 S74 K79 V80 I81 L132 I137V73-V77 HydrophobicContact CG1-CB 3.67Å; V73-V77 HydrophobicContact CG1-CG1 3.59Å; S74-V77 PolarHBondContact O-N 3.26Å; S74-V77 WeakPolarHBondContact OG-CG2 3.39Å; V77-K79 PolarHBondContact O-N 2.71Å; V77-V80 PolarHBondContact O-N 2.93Å; V77-I81 HydrophobicContact CG1-CD1 3.99Å; V77-I81 HydrophobicContact CG1-CG1 4.49Å; V77-I81 VanDerWaalsContact O-CG1 3.29Å; V77-I81 WeakPolarHBondContact O-CG1 3.25Å; V77-I81 PolarHBondContact O-N 2.89Å; V77-L132 HydrophobicContact CG1-CB 4.34Å; V77-L132 HydrophobicContact CG1-CD2 4.33Å; V77-I137 HydrophobicContact CG2-CD1 4.01Å; V77-I137 HydrophobicContact CG2-CG2 4.24Å
78G91.8Very high88.6Confident1 Ų182.8 Ų82.81%0.0140%0.396CS..Hα-helixtrans-58.4-44.1175.400000113S74 L75 E76 I81 Q82S74-G78 PolarHBondContact O-N 3.06Å; L75-G78 PolarHBondContact O-N 3.11Å; E76-G78 VanDerWaalsContact C-N 3.29Å; E76-G78 PolarHBondContact O-N 2.84Å; G78-I81 PolarHBondContact O-N 3.4Å; G78-Q82 PolarHBondContact O-N 3.01Å
79K92.6Very high89.6Confident118 Ų11878.2 Ų78.251%0.51339%0.388SS..Hα-helixtrans-63.3-43.2175.5-71.6177.9-180-178.20112.3L75 E76 V77 I81 Q82 Q83L75-K79 WeakPolarHBondContact O-CG 3.36Å; L75-K79 PolarHBondContact O-N 3.07Å; E76-K79 PolarHBondContact O-N 2.78Å; V77-K79 PolarHBondContact O-N 2.71Å; K79-I81 VanDerWaalsContact C-N 3.34Å; K79-I81 PolarHBondContact O-N 3.22Å; K79-Q82 PolarHBondContact O-N 2.97Å; K79-Q83 WeakPolarHBondContact O-CB 3.41Å; K79-Q83 WeakPolarHBondContact O-CG 3.42Å; K79-Q83 PolarHBondContact O-N 3.2Å
80V93.1Very high90.5Very high13 Ų1372.5 Ų72.58%0.07936%0.362CS..Hα-helixtrans-63.6-40.2178.2173.40000111.5E76 V77 Q83 G84 L130 L132 I137E76-V80 WeakPolarHBondContact O-CG2 3.46Å; E76-V80 PolarHBondContact O-N 2.74Å; V77-V80 PolarHBondContact O-N 2.93Å; V80-Q83 PolarHBondContact O-N 2.87Å; V80-G84 PolarHBondContact O-N 3.23Å; V80-L130 HydrophobicContact CG1-CB 4.27Å; V80-L130 HydrophobicContact CG1-CD1 3.92Å; V80-L132 HydrophobicContact CB-CD2 4.04Å; V80-L132 HydrophobicContact CG1-CD2 3.53Å; V80-I137 HydrophobicContact CG2-CG2 4.02Å
81I93Very high91.2Very high0 Ų072.2 Ų72.20%037%0.366CS..Hα-helixtrans-60.8-48.2174.8-66.9167.6000110.2V77 G78 K79 G84 R85 L95 E110 I124 L132V77-I81 HydrophobicContact CG1-CD1 3.99Å; V77-I81 HydrophobicContact CG1-CG1 4.49Å; V77-I81 VanDerWaalsContact O-CG1 3.29Å; V77-I81 WeakPolarHBondContact O-CG1 3.25Å; V77-I81 PolarHBondContact O-N 2.89Å; G78-I81 PolarHBondContact O-N 3.4Å; K79-I81 VanDerWaalsContact C-N 3.34Å; K79-I81 PolarHBondContact O-N 3.22Å; I81-G84 PolarHBondContact O-N 2.98Å; I81-R85 VanDerWaalsContact O-CB 3.27Å; I81-R85 WeakPolarHBondContact O-CB 3.46Å; I81-R85 PolarHBondContact O-N 3.33Å; I81-L95 HydrophobicContact CG2-CD2 4.36Å; I81-E110 HydrophobicContact CB-CG 4.35Å; I81-E110 HydrophobicContact CG2-CG 3.86Å; I81-I124 HydrophobicContact CD1-CD1 4.43Å; I81-I124 HydrophobicContact CG1-CG2 4.14Å; I81-I124 HydrophobicContact CG2-CG2 4.14Å; I81-L132 HydrophobicContact CD1-CD1 4.01Å; I81-L132 HydrophobicContact CG1-CD1 3.58Å; I81-L132 HydrophobicContact CG1-CD2 3.72Å; I81-L132 HydrophobicContact CG1-CG 4.31Å
82Q93.4Very high91.8Very high81 Ų8167.1 Ų67.138%0.37934%0.342SS..Hα-helixtrans-61.5-46.6-179.6179.4176.684.600111.8G78 K79 R85 Q86 E110G78-Q82 PolarHBondContact O-N 3.01Å; K79-Q82 PolarHBondContact O-N 2.97Å; Q82-R85 PolarHBondContact O-N 3.33Å; Q82-Q86 VanDerWaalsContact CG-NE2 3.31Å; Q82-Q86 WeakPolarHBondContact O-CG 3.29Å; Q82-Q86 PolarHBondContact O-N 2.95Å; Q82-E110 HydrophobicContact CB-CG 4.41Å
83Q92.6Very high92.1Very high110 Ų11066.2 Ų66.251%0.51434%0.342SS..Hα-helixtrans-62.6-48.4176.6-72174.64.500111.5K79 V80 R85 Q86 N87K79-Q83 WeakPolarHBondContact O-CB 3.41Å; K79-Q83 WeakPolarHBondContact O-CG 3.42Å; K79-Q83 PolarHBondContact O-N 3.2Å; V80-Q83 PolarHBondContact O-N 2.87Å; Q83-R85 PolarHBondContact O-N 2.85Å; Q83-Q86 PolarHBondContact O-N 3.22Å; Q83-N87 WeakPolarHBondContact O-CB 3.44Å; Q83-N87 PolarHBondContact O-N 2.98Å; Q83-N87 PolarHBondContact O-ND2 2.64Å; Q83-N87 PolarHBondContact O-OD1 2.92Å
84G92.8Very high92.5Very high2 Ų269.1 Ų69.12%0.02136%0.357CS..Hα-helixtrans-61-33.3178.200000113.1V80 I81 K88V80-G84 PolarHBondContact O-N 3.23Å; I81-G84 PolarHBondContact O-N 2.98Å; G84-K88 PolarHBondContact O-N 3.43Å
85R94.5Very high92.8Very high35 Ų3566.3 Ų66.313%0.13234%0.338CS..Hα-helixtrans-68.6-49.2173.9-178.4-178.165.174.9-4.8111.7I81 Q82 Q83 K88 G89 L90 L95 E110I81-R85 VanDerWaalsContact O-CB 3.27Å; I81-R85 WeakPolarHBondContact O-CB 3.46Å; I81-R85 PolarHBondContact O-N 3.33Å; Q82-R85 PolarHBondContact O-N 3.33Å; Q83-R85 PolarHBondContact O-N 2.85Å; R85-K88 CarbonylContact O-C 3.58Å; R85-K88 PolarHBondContact O-N 3.15Å; R85-G89 PolarHBondContact O-N 3.18Å; R85-L90 WeakPolarHBondContact CD-O 3.32Å; R85-L90 HydrophobicContact CG-CB 3.84Å; R85-L90 WeakPolarHBondContact CG-O 3.43Å; R85-L90 PolarHBondContact NH1-O 3.03Å; R85-L90 PolarHBondContact O-N 2.98Å; R85-L90 VanDerWaalsContact O-N 3.1Å; R85-L95 HydrophobicContact CB-CD2 4.4Å; R85-L95 HydrophobicContact CG-CD2 4.34Å; R85-E110 IonicContact CZ-OE1 3.9Å; R85-E110 IonicContact NE-OE1 3.89Å; R85-E110 PolarHBondContact NE-OE1 2.91Å; R85-E110 IonicContact NH2-OE1 2.71Å; R85-E110 IonicContact NH2-OE2 3.09Å
86Q92.9Very high93.1Very high112 Ų11261.2 Ų61.252%0.52331%0.311SS..Hα-helixtrans-63.2-42.3179.5-72178.328.900112.1Q82 Q83 K88 G89Q82-Q86 VanDerWaalsContact CG-NE2 3.31Å; Q82-Q86 WeakPolarHBondContact O-CG 3.29Å; Q82-Q86 PolarHBondContact O-N 2.95Å; Q83-Q86 PolarHBondContact O-N 3.22Å; Q86-K88 PolarHBondContact O-N 3.17Å; Q86-K88 VanDerWaalsContact O-N 3.11Å; Q86-G89 PolarHBondContact O-N 3.34Å
87N92.3Very high93.4Very high136 Ų13659.9 Ų59.973%0.72731%0.311SS*.Hα-helixtrans-60.4-23.5176.6-69.1-9.8000112.9Q83Q83-N87 WeakPolarHBondContact O-CB 3.44Å; Q83-N87 PolarHBondContact O-N 2.98Å; Q83-N87 PolarHBondContact O-ND2 2.64Å; Q83-N87 PolarHBondContact O-OD1 2.92Å
88K91.6Very high93.5Very high100 Ų10065.6 Ų65.644%0.43534%0.335SS..THydrogen-bonded Turntrans-99.14.4175.2-69.7-164.9178.7-179.10114.1G84 R85 Q86 L90 A127 I128G84-K88 PolarHBondContact O-N 3.43Å; R85-K88 CarbonylContact O-C 3.58Å; R85-K88 PolarHBondContact O-N 3.15Å; Q86-K88 PolarHBondContact O-N 3.17Å; Q86-K88 VanDerWaalsContact O-N 3.11Å; K88-L90 HydrophobicContact CB-CD1 3.95Å; K88-L90 HydrophobicContact CB-CG 4.03Å; K88-L90 PolarHBondContact O-N 2.95Å; K88-A127 WeakPolarHBondContact CD-O 3.42Å; K88-A127 PolarHBondContact NZ-O 3.22Å; K88-I128 VanDerWaalsContact CE-C 3.47Å; K88-I128 WeakPolarHBondContact CE-O 3.43Å; K88-I128 PolarHBondContact NZ-O 2.97Å
89G93.1Very high93.6Very high66 Ų6665.8 Ų65.868%0.6834%0.336SS*.THydrogen-bonded Turntrans62.422.9-178.500000114.2R85 Q86R85-G89 PolarHBondContact O-N 3.18Å; Q86-G89 PolarHBondContact O-N 3.34Å
90L93.4Very high93.7Very high32 Ų3266.6 Ų66.617%0.16835%0.346CS..  trans-89.6141.8-177.2-67.3170.5000110.5R85 K88 D94R85-L90 WeakPolarHBondContact CD-O 3.32Å; R85-L90 HydrophobicContact CG-CB 3.84Å; R85-L90 WeakPolarHBondContact CG-O 3.43Å; R85-L90 PolarHBondContact NH1-O 3.03Å; R85-L90 PolarHBondContact O-N 2.98Å; R85-L90 VanDerWaalsContact O-N 3.1Å; K88-L90 HydrophobicContact CB-CD1 3.95Å; K88-L90 HydrophobicContact CB-CG 4.03Å; K88-L90 PolarHBondContact O-N 2.95Å; L90-D94 HydrophobicContact CD2-CB 4.06Å
91T95.4Very high93.7Very high68 Ų6868.3 Ų68.342%0.41735%0.353SS..  trans-82166.9164.872.40000110.9K93 D94 L95T91-K93 PolarHBondContact O-N 3.17Å; T91-K93 PolarHBondContact OG1-N 3.3Å; T91-D94 VanDerWaalsContact CB-OD2 3.29Å; T91-D94 WeakPolarHBondContact CB-OD2 3.36Å; T91-D94 VanDerWaalsContact CG2-OD2 3.32Å; T91-D94 WeakPolarHBondContact CG2-OD2 3.45Å; T91-D94 PolarHBondContact N-OD2 3.13Å; T91-D94 PolarHBondContact O-N 3.44Å; T91-D94 PolarHBondContact OG1-N 3.12Å; T91-D94 VanDerWaalsContact OG1-N 3.12Å; T91-D94 PolarHBondContact OG1-OD1 3.19Å; T91-D94 PolarHBondContact OG1-OD2 3.27Å; T91-L95 PolarHBondContact O-N 2.93Å
92Q94.1Very high93.8Very high70 Ų7075.8 Ų75.833%0.32739%0.386SS..Hα-helixtrans-58.8-36.9173.9-71.6178.5-1400111.3A96 I106 E110Q92-A96 WeakPolarHBondContact O-CB 3.18Å; Q92-A96 PolarHBondContact O-N 3.15Å; Q92-I106 HydrophobicContact CB-CG2 4.19Å; Q92-I106 HydrophobicContact CG-CG2 4.09Å; Q92-E110 PolarHBondContact NE2-OE2 3.16Å
93K95.5Very high93.8Very high143 Ų14375 Ų7562%0.62239%0.387SS*.Hα-helixtrans-66-42.5176.4-173.6-177.5177.1-174.70111.5T91 A96 T97 P103T91-K93 PolarHBondContact O-N 3.17Å; T91-K93 PolarHBondContact OG1-N 3.3Å; K93-A96 PolarHBondContact O-N 3.3Å; K93-T97 WeakPolarHBondContact O-CB 3.49Å; K93-T97 PolarHBondContact O-N 3.26Å; K93-T97 PolarHBondContact O-OG1 2.93Å; K93-P103 HydrophobicContact CG-CG 4.48Å
94D94Very high93.9Very high71 Ų7175.5 Ų75.538%0.3839%0.39SS..Hα-helixtrans-68-42.7179.7-54.5-35.5000111.3L90 T91 T97 K98L90-D94 HydrophobicContact CD2-CB 4.06Å; T91-D94 VanDerWaalsContact CB-OD2 3.29Å; T91-D94 WeakPolarHBondContact CB-OD2 3.36Å; T91-D94 VanDerWaalsContact CG2-OD2 3.32Å; T91-D94 WeakPolarHBondContact CG2-OD2 3.45Å; T91-D94 PolarHBondContact N-OD2 3.13Å; T91-D94 PolarHBondContact O-N 3.44Å; T91-D94 PolarHBondContact OG1-N 3.12Å; T91-D94 VanDerWaalsContact OG1-N 3.12Å; T91-D94 PolarHBondContact OG1-OD1 3.19Å; T91-D94 PolarHBondContact OG1-OD2 3.27Å; D94-T97 PolarHBondContact O-N 2.96Å; D94-K98 VanDerWaalsContact O-CB 3.27Å; D94-K98 WeakPolarHBondContact O-CB 3.38Å; D94-K98 PolarHBondContact O-N 2.86Å
95L94.3Very high93.9Very high0 Ų077.3 Ų77.30%040%0.4CS..Hα-helixtrans-60.8-48174.6179.660.1000110.8I81 R85 T91 T97 K98 I99 I106 A127 I128I81-L95 HydrophobicContact CG2-CD2 4.36Å; R85-L95 HydrophobicContact CB-CD2 4.4Å; R85-L95 HydrophobicContact CG-CD2 4.34Å; T91-L95 PolarHBondContact O-N 2.93Å; L95-T97 VanDerWaalsContact C-N 3.35Å; L95-T97 PolarHBondContact O-N 3.04Å; L95-K98 WeakPolarHBondContact O-CB 3.48Å; L95-K98 PolarHBondContact O-N 3.3Å; L95-I99 HydrophobicContact CD1-CG2 4.28Å; L95-I99 WeakPolarHBondContact O-CG1 3.4Å; L95-I99 PolarHBondContact O-N 2.98Å; L95-I106 HydrophobicContact CD2-CD1 4.14Å; L95-I106 HydrophobicContact CD2-CG2 4.08Å; L95-I106 HydrophobicContact CG-CD1 4.21Å; L95-A127 HydrophobicContact CD1-CB 3.64Å; L95-I128 HydrophobicContact CD1-CG2 4.14Å; L95-I128 HydrophobicContact CD2-CG2 4.42Å
96A95.4Very high93.9Very high0 Ų075.6 Ų75.60%039%0.394CS..Hα-helixtrans-58.5-45.4178.300000112Q92 K93 K98 I99 N100 E101 P103 I106Q92-A96 WeakPolarHBondContact O-CB 3.18Å; Q92-A96 PolarHBondContact O-N 3.15Å; K93-A96 PolarHBondContact O-N 3.3Å; A96-K98 PolarHBondContact O-N 2.85Å; A96-I99 WeakPolarHBondContact O-CG1 3.27Å; A96-I99 PolarHBondContact O-N 2.89Å; A96-N100 PolarHBondContact O-N 3.02Å; A96-E101 CarbonylContact C-O 3.47Å; A96-E101 WeakPolarHBondContact CB-O 3.41Å; A96-E101 PolarHBondContact O-N 3.06Å; A96-P103 HydrophobicContact CB-CB 4.32Å; A96-P103 HydrophobicContact CB-CG 4.13Å; A96-I106 HydrophobicContact CB-CG1 3.87Å
97T95.5Very high94Very high91 Ų9171.2 Ų71.256%0.55838%0.377SS*.Hα-helixtrans-62.5-43.5176.7-54.90000110.7K93 D94 L95 I99 N100K93-T97 WeakPolarHBondContact O-CB 3.49Å; K93-T97 PolarHBondContact O-N 3.26Å; K93-T97 PolarHBondContact O-OG1 2.93Å; D94-T97 PolarHBondContact O-N 2.96Å; L95-T97 VanDerWaalsContact C-N 3.35Å; L95-T97 PolarHBondContact O-N 3.04Å; T97-I99 VanDerWaalsContact C-N 3.3Å; T97-I99 PolarHBondContact O-N 3.06Å; T97-N100 PolarHBondContact O-N 3.38Å
98K93.4Very high94.1Very high128 Ų12867.2 Ų67.256%0.55736%0.355SS*.Hα-helixtrans-63.5-32.2178.6-170.1169.4-172.9168.60113.4D94 L95 A96 A127D94-K98 VanDerWaalsContact O-CB 3.27Å; D94-K98 WeakPolarHBondContact O-CB 3.38Å; D94-K98 PolarHBondContact O-N 2.86Å; L95-K98 WeakPolarHBondContact O-CB 3.48Å; L95-K98 PolarHBondContact O-N 3.3Å; A96-K98 PolarHBondContact O-N 2.85Å; K98-A127 HydrophobicContact CD-CB 4.41Å
99I93.9Very high94.2Very high6 Ų662.9 Ų62.93%0.03134%0.336CS..Hα-helixtrans-95.2-1.4177.569.7163.1000113.8L95 A96 T97 E101 I106 V120 K123 I124 A127L95-I99 HydrophobicContact CD1-CG2 4.28Å; L95-I99 WeakPolarHBondContact O-CG1 3.4Å; L95-I99 PolarHBondContact O-N 2.98Å; A96-I99 WeakPolarHBondContact O-CG1 3.27Å; A96-I99 PolarHBondContact O-N 2.89Å; T97-I99 VanDerWaalsContact C-N 3.3Å; T97-I99 PolarHBondContact O-N 3.06Å; I99-E101 HydrophobicContact CD1-CB 3.77Å; I99-E101 HydrophobicContact CD1-CG 3.52Å; I99-E101 HydrophobicContact CG1-CB 3.84Å; I99-E101 HydrophobicContact CG1-CG 3.74Å; I99-I106 HydrophobicContact CD1-CD1 3.52Å; I99-I106 HydrophobicContact CD1-CG1 4.45Å; I99-I106 HydrophobicContact CG1-CD1 4.47Å; I99-V120 HydrophobicContact CD1-CG1 4.46Å; I99-K123 HydrophobicContact CB-CB 3.95Å; I99-K123 HydrophobicContact CB-CD 4.29Å; I99-K123 HydrophobicContact CG2-CB 3.98Å; I99-K123 WeakPolarHBondContact O-CD 3.41Å; I99-K123 PolarHBondContact O-NZ 3.32Å; I99-K123 VanDerWaalsContact O-NZ 3.12Å; I99-I124 HydrophobicContact CD1-CD1 4.4Å; I99-I124 HydrophobicContact CD1-CG1 3.77Å; I99-A127 HydrophobicContact CG2-CB 3.93Å
100N93.4Very high94.1Very high135 Ų13560.5 Ų60.572%0.72231%0.307SS*.THydrogen-bonded Turntrans55.848.3-173.9-54-76.5000112.6A96 T97A96-N100 PolarHBondContact O-N 3.02Å; T97-N100 PolarHBondContact O-N 3.38Å
101E93.7Very high94Very high48 Ų4862.6 Ų62.622%0.22432%0.324CS..SBendtrans-126167.1172.8-61.9-62.3161.400110A96 I99 V120 K123A96-E101 CarbonylContact C-O 3.47Å; A96-E101 WeakPolarHBondContact CB-O 3.41Å; A96-E101 PolarHBondContact O-N 3.06Å; I99-E101 HydrophobicContact CD1-CB 3.77Å; I99-E101 HydrophobicContact CD1-CG 3.52Å; I99-E101 HydrophobicContact CG1-CB 3.84Å; I99-E101 HydrophobicContact CG1-CG 3.74Å; E101-V120 HydrophobicContact CG-CG1 4.49Å; E101-K123 IonicContact OE1-NZ 2.75Å; E101-K123 PolarHBondContact OE1-NZ 3.02Å
102K94.1Very high93.7Very high158 Ų15860 Ų6069%0.68731%0.311SS*.  trans-74.2145.6176.3-61.9-177.1177.1-178.40111Q104 V105K102-Q104 PolarHBondContact O-N 3.34Å; K102-V105 HydrophobicContact CB-CG2 4.22Å; K102-V105 WeakPolarHBondContact O-CB 3.39Å; K102-V105 PolarHBondContact O-N 3.45Å
103P94.1Very high93.3Very high63 Ų6363.1 Ų63.141%0.40932%0.323SS..Hα-helixtrans-55-35.8175.7-26.234.4000113.6K93 A96 V105 I106 A107K93-P103 HydrophobicContact CG-CG 4.48Å; A96-P103 HydrophobicContact CB-CB 4.32Å; A96-P103 HydrophobicContact CB-CG 4.13Å; P103-V105 PolarHBondContact O-N 3.2Å; P103-I106 PolarHBondContact O-N 2.9Å; P103-I106 VanDerWaalsContact O-N 3.15Å; P103-A107 PolarHBondContact O-N 3.42Å; P103-A107 VanDerWaalsContact O-N 3.08Å
104Q94.7Very high93Very high121 Ų12156.9 Ų56.957%0.56530%0.299SS*.Hα-helixtrans-57.5-37.8175.8-172.161.934.800112.4K102 I106 A107 D108K102-Q104 PolarHBondContact O-N 3.34Å; Q104-I106 PolarHBondContact O-N 3.28Å; Q104-A107 PolarHBondContact O-N 2.92Å; Q104-D108 PolarHBondContact NE2-OD1 2.74Å; Q104-D108 VanDerWaalsContact O-CG 3.25Å; Q104-D108 PolarHBondContact O-N 2.95Å
105V93.3Very high92.8Very high40 Ų4057.2 Ų57.224%0.24230%0.3CS..Hα-helixtrans-61.6-49.2178-178.50000109.3K102 P103 A107 D108 Y109 V120K102-V105 HydrophobicContact CB-CG2 4.22Å; K102-V105 WeakPolarHBondContact O-CB 3.39Å; K102-V105 PolarHBondContact O-N 3.45Å; P103-V105 PolarHBondContact O-N 3.2Å; V105-A107 VanDerWaalsContact C-N 3.3Å; V105-A107 PolarHBondContact O-N 2.75Å; V105-D108 PolarHBondContact O-N 2.96Å; V105-D108 VanDerWaalsContact O-N 3.16Å; V105-Y109 HydrophobicContact CG1-CD2 3.66Å; V105-Y109 HydrophobicContact CG1-CE2 3.53Å; V105-Y109 VanDerWaalsContact O-CD2 3.22Å; V105-Y109 WeakPolarHBondContact O-CD2 3.37Å; V105-Y109 PolarHBondContact O-N 2.9Å; V105-V120 HydrophobicContact CG1-CG1 4.36Å
106I94.3Very high92.4Very high0 Ų059.2 Ų59.20%031%0.313CS..Hα-helixtrans-57.9-44.2177.6-62.4-56.7000111.5Q92 L95 A96 I99 P103 Q104 D108 Y109 E110 I124Q92-I106 HydrophobicContact CB-CG2 4.19Å; Q92-I106 HydrophobicContact CG-CG2 4.09Å; L95-I106 HydrophobicContact CD2-CD1 4.14Å; L95-I106 HydrophobicContact CD2-CG2 4.08Å; L95-I106 HydrophobicContact CG-CD1 4.21Å; A96-I106 HydrophobicContact CB-CG1 3.87Å; I99-I106 HydrophobicContact CD1-CD1 3.52Å; I99-I106 HydrophobicContact CD1-CG1 4.45Å; I99-I106 HydrophobicContact CG1-CD1 4.47Å; P103-I106 PolarHBondContact O-N 2.9Å; P103-I106 VanDerWaalsContact O-N 3.15Å; Q104-I106 PolarHBondContact O-N 3.28Å; I106-D108 VanDerWaalsContact C-N 3.34Å; I106-D108 PolarHBondContact O-N 3.47Å; I106-Y109 PolarHBondContact O-N 3.41Å; I106-E110 HydrophobicContact CG2-CG 4.38Å; I106-E110 PolarHBondContact O-N 3.45Å; I106-I124 HydrophobicContact CD1-CD1 3.86Å; I106-I124 HydrophobicContact CD1-CG1 4.12Å
107A94.8Very high92.2Very high19 Ų1960.1 Ų60.116%0.15732%0.318CS..Hα-helixtrans-60.5-42.7177.700000112.1P103 Q104 V105 Y109 E110 C111P103-A107 PolarHBondContact O-N 3.42Å; P103-A107 VanDerWaalsContact O-N 3.08Å; Q104-A107 PolarHBondContact O-N 2.92Å; V105-A107 VanDerWaalsContact C-N 3.3Å; V105-A107 PolarHBondContact O-N 2.75Å; A107-Y109 VanDerWaalsContact C-N 3.32Å; A107-Y109 PolarHBondContact O-N 3.41Å; A107-E110 PolarHBondContact O-N 2.89Å; A107-C111 WeakPolarHBondContact O-CB 3.41Å; A107-C111 PolarHBondContact O-N 3.18Å; A107-C111 PolarHBondContact O-SG 2.83Å
108D93.8Very high91.9Very high53 Ų5360.3 Ų60.328%0.28332%0.315SS..Hα-helixtrans-67.7-32.1178.4-66.9-22.4000112.4Q104 V105 I106 G112 K113 A114Q104-D108 PolarHBondContact NE2-OD1 2.74Å; Q104-D108 VanDerWaalsContact O-CG 3.25Å; Q104-D108 PolarHBondContact O-N 2.95Å; V105-D108 PolarHBondContact O-N 2.96Å; V105-D108 VanDerWaalsContact O-N 3.16Å; I106-D108 VanDerWaalsContact C-N 3.34Å; I106-D108 PolarHBondContact O-N 3.47Å; D108-G112 PolarHBondContact O-N 3.39Å; D108-K113 PolarHBondContact O-N 3.33Å; D108-A114 HydrophobicContact CB-CB 4.08Å; D108-A114 PolarHBondContact O-N 2.92Å; D108-A114 VanDerWaalsContact O-N 3.08Å
109Y93.8Very high91.7Very high8 Ų857.5 Ų57.53%0.03130%0.304CS..Hα-helixtrans-72.1-44.8173.6-88.5-96.4000112V73 V105 I106 A107 C111 G112 A114 I115 N117 V120 M121V73-Y109 HydrophobicContact CG2-CD1 3.78Å; V73-Y109 HydrophobicContact CG2-CE1 3.8Å; V105-Y109 HydrophobicContact CG1-CD2 3.66Å; V105-Y109 HydrophobicContact CG1-CE2 3.53Å; V105-Y109 VanDerWaalsContact O-CD2 3.22Å; V105-Y109 WeakPolarHBondContact O-CD2 3.37Å; V105-Y109 PolarHBondContact O-N 2.9Å; I106-Y109 PolarHBondContact O-N 3.41Å; A107-Y109 VanDerWaalsContact C-N 3.32Å; A107-Y109 PolarHBondContact O-N 3.41Å; Y109-C111 PolarHBondContact O-N 3.23Å; Y109-G112 PolarHBondContact O-N 3.02Å; Y109-A114 HydrophobicContact CD1-CB 4.2Å; Y109-A114 HydrophobicContact CD2-CB 3.4Å; Y109-A114 HydrophobicContact CE1-CB 4.32Å; Y109-A114 HydrophobicContact CE2-CB 3.56Å; Y109-A114 HydrophobicContact CG-CB 3.76Å; Y109-I115 PolarHBondContact OH-O 2.87Å; Y109-N117 WeakPolarHBondContact OH-CB 3.38Å; Y109-N117 PolarHBondContact OH-N 3.11Å; Y109-V120 HydrophobicContact CE2-CG1 3.99Å; Y109-M121 HydrophobicContact CE1-CG 3.87Å
110E91.5Very high91.6Very high16 Ų1657.6 Ų57.68%0.07531%0.305CS..Hα-helixtrans-62-33175.3-72.7-173.4-178.200111.4I81 Q82 R85 Q92 I106 A107I81-E110 HydrophobicContact CB-CG 4.35Å; I81-E110 HydrophobicContact CG2-CG 3.86Å; Q82-E110 HydrophobicContact CB-CG 4.41Å; R85-E110 IonicContact CZ-OE1 3.9Å; R85-E110 IonicContact NE-OE1 3.89Å; R85-E110 PolarHBondContact NE-OE1 2.91Å; R85-E110 IonicContact NH2-OE1 2.71Å; R85-E110 IonicContact NH2-OE2 3.09Å; Q92-E110 PolarHBondContact NE2-OE2 3.16Å; I106-E110 HydrophobicContact CG2-CG 4.38Å; I106-E110 PolarHBondContact O-N 3.45Å; A107-E110 PolarHBondContact O-N 2.89Å
111C91.3Very high91.5Very high76 Ų7651.8 Ų51.851%0.51427%0.273SS..THydrogen-bonded Turntrans-84-3.6177-62.80000115A107 Y109 K113A107-C111 WeakPolarHBondContact O-CB 3.41Å; A107-C111 PolarHBondContact O-N 3.18Å; A107-C111 PolarHBondContact O-SG 2.83Å; Y109-C111 PolarHBondContact O-N 3.23Å; C111-K113 HydrophobicContact CB-CD 4.43Å; C111-K113 HydrophobicContact CB-CG 4.2Å; C111-K113 PolarHBondContact O-N 2.78Å
112G88Confident91.4Very high14 Ų1449.9 Ų49.914%0.14427%0.267CS..THydrogen-bonded Turntrans68.615-176.300000115R72 V73 D108 Y109R72-G112 WeakPolarHBondContact CB-O 3.36Å; V73-G112 WeakPolarHBondContact O-CA 3.27Å; D108-G112 PolarHBondContact O-N 3.39Å; Y109-G112 PolarHBondContact O-N 3.02Å
113K87.5Confident91.3Very high135 Ų13544 Ų4459%0.58724%0.241SC*.  trans-85.4-26.4178.6-67.3-177.4-177.91790112.2R72 D108 C111R72-K113 PolarHBondContact NH1-O 2.88Å; D108-K113 PolarHBondContact O-N 3.33Å; C111-K113 HydrophobicContact CB-CD 4.43Å; C111-K113 HydrophobicContact CB-CG 4.2Å; C111-K113 PolarHBondContact O-N 2.78Å
114A88.3Confident91.2Very high13 Ų1341 Ų4111%0.10722%0.222CC..SBendtrans-67.5149.3-175.600000113.1R72 V73 D108 Y109R72-A114 WeakPolarHBondContact CA-O 2.97Å; V73-A114 HydrophobicContact CG2-CB 4.39Å; V73-A114 WeakPolarHBondContact CG2-O 3.36Å; V73-A114 PolarHBondContact N-O 3.08Å; D108-A114 HydrophobicContact CB-CB 4.08Å; D108-A114 PolarHBondContact O-N 2.92Å; D108-A114 VanDerWaalsContact O-N 3.08Å; Y109-A114 HydrophobicContact CD1-CB 4.2Å; Y109-A114 HydrophobicContact CD2-CB 3.4Å; Y109-A114 HydrophobicContact CE1-CB 4.32Å; Y109-A114 HydrophobicContact CE2-CB 3.56Å; Y109-A114 HydrophobicContact CG-CB 3.76Å
115I88.9Confident91.1Very high78 Ų7835.8 Ų35.840%0.420%0.197SC..PPolyproline II helixtrans-78.5127.1164.4-63174.5000107.3H70 Y109 N117H70-I115 HydrophobicContact CB-CD1 3.94Å; H70-I115 HydrophobicContact CB-CG1 4.19Å; Y109-I115 PolarHBondContact OH-O 2.87Å; I115-N117 PolarHBondContact O-N 2.87Å
116P87.8Confident91Very high42 Ų4242 Ų4227%0.27322%0.217SC..PPolyproline II helixtrans-63.4120.8-176.921.8-29.6000111.3Q71 V73 M121Q71-P116 WeakPolarHBondContact O-CD 3.22Å; V73-P116 HydrophobicContact CG2-CB 3.91Å; V73-P116 HydrophobicContact CG2-CG 4.47Å; P116-M121 HydrophobicContact CB-CE 3.64Å; P116-M121 HydrophobicContact CB-SD 4.07Å
117N90.1Very high90.9Very high19 Ų1942.4 Ų42.410%0.10222%0.22CC..  trans-111.8118.5170-176.4-28.5000109.6Y109 I115 Q119 V120 M121Y109-N117 WeakPolarHBondContact OH-CB 3.38Å; Y109-N117 PolarHBondContact OH-N 3.11Å; I115-N117 PolarHBondContact O-N 2.87Å; N117-Q119 PolarHBondContact O-N 3.12Å; N117-Q119 VanDerWaalsContact O-N 3.17Å; N117-Q119 WeakPolarHBondContact OD1-CB 3.38Å; N117-Q119 PolarHBondContact OD1-N 2.97Å; N117-V120 HydrophobicContact CB-CB 4.27Å; N117-V120 HydrophobicContact CB-CG2 4.12Å; N117-V120 PolarHBondContact O-N 3.17Å; N117-V120 VanDerWaalsContact O-N 3.15Å; N117-M121 WeakPolarHBondContact O-CG 3.46Å; N117-M121 PolarHBondContact O-N 3.43Å
118N89.2Confident90.7Very high95 Ų9541.8 Ų41.851%0.50821%0.214SC..Hα-helixtrans-58.1-30.7-177.7-78.7-0.5000113.9M121 G122N118-M121 WeakPolarHBondContact OD1-CE 3.05Å; N118-G122 PolarHBondContact O-N 3.48Å
119Q89.6Confident90.4Very high68 Ų6840.4 Ų40.432%0.31821%0.213SC..Hα-helixtrans-70.5-46.7178.1-171.8-178.5-8.600111Q51 N117 G122 K123Q51-Q119 PolarHBondContact O-NE2 2.77Å; N117-Q119 PolarHBondContact O-N 3.12Å; N117-Q119 VanDerWaalsContact O-N 3.17Å; N117-Q119 WeakPolarHBondContact OD1-CB 3.38Å; N117-Q119 PolarHBondContact OD1-N 2.97Å; Q119-G122 PolarHBondContact O-N 2.71Å; Q119-K123 WeakPolarHBondContact O-CG 3.42Å; Q119-K123 PolarHBondContact O-N 3.44Å
120V91.8Very high90.2Very high8 Ų841.5 Ų41.55%0.04822%0.219CC..Hα-helixtrans-65.4-48.8178177.90000110I99 E101 V105 Y109 N117 G122 K123 I124I99-V120 HydrophobicContact CD1-CG1 4.46Å; E101-V120 HydrophobicContact CG-CG1 4.49Å; V105-V120 HydrophobicContact CG1-CG1 4.36Å; Y109-V120 HydrophobicContact CE2-CG1 3.99Å; N117-V120 HydrophobicContact CB-CB 4.27Å; N117-V120 HydrophobicContact CB-CG2 4.12Å; N117-V120 PolarHBondContact O-N 3.17Å; N117-V120 VanDerWaalsContact O-N 3.15Å; V120-G122 VanDerWaalsContact C-N 3.31Å; V120-G122 PolarHBondContact O-N 3.21Å; V120-K123 WeakPolarHBondContact O-CB 3.29Å; V120-K123 PolarHBondContact O-N 3.2Å; V120-I124 HydrophobicContact CG1-CD1 3.96Å; V120-I124 HydrophobicContact CG1-CG1 4.48Å; V120-I124 WeakPolarHBondContact O-CG1 3.26Å; V120-I124 PolarHBondContact O-N 3.1Å
121M91.1Very high90.1Very high13 Ų1343.1 Ų43.16%0.06423%0.225CC..Hα-helixtrans-56.4-45.1176-69.5-169.7-71.600111.5Y109 P116 N117 N118 K123 I124 E125 R133Y109-M121 HydrophobicContact CE1-CG 3.87Å; P116-M121 HydrophobicContact CB-CE 3.64Å; P116-M121 HydrophobicContact CB-SD 4.07Å; N117-M121 WeakPolarHBondContact O-CG 3.46Å; N117-M121 PolarHBondContact O-N 3.43Å; N118-M121 WeakPolarHBondContact OD1-CE 3.05Å; M121-K123 VanDerWaalsContact C-N 3.3Å; M121-K123 PolarHBondContact O-N 3.18Å; M121-I124 PolarHBondContact O-N 3.19Å; M121-E125 VanDerWaalsContact O-CG 3.27Å; M121-E125 WeakPolarHBondContact O-CG 3.44Å; M121-E125 PolarHBondContact O-N 3.41Å; M121-R133 HydrophobicContact CB-CG 4.35Å; M121-R133 HydrophobicContact CE-CG 4.16Å; M121-R133 HydrophobicContact SD-CG 4.14Å
122G91.4Very high89.9Confident9 Ų939.7 Ų39.79%0.09320%0.202CC..Hα-helixtrans-66.6-24.717700000114.8N118 Q119 V120 R126N118-G122 PolarHBondContact O-N 3.48Å; Q119-G122 PolarHBondContact O-N 2.71Å; V120-G122 VanDerWaalsContact C-N 3.31Å; V120-G122 PolarHBondContact O-N 3.21Å; G122-R126 WeakPolarHBondContact O-CG 3.44Å; G122-R126 PolarHBondContact O-NE 3.23Å
123K92.4Very high89.8Confident34 Ų3443.8 Ų43.815%0.14821%0.213CC..Hα-helixtrans-73.9-44.3170-69.9171.5174.9-172.70110.7I99 E101 Q119 V120 M121 R126 A127I99-K123 HydrophobicContact CB-CB 3.95Å; I99-K123 HydrophobicContact CB-CD 4.29Å; I99-K123 HydrophobicContact CG2-CB 3.98Å; I99-K123 WeakPolarHBondContact O-CD 3.41Å; I99-K123 PolarHBondContact O-NZ 3.32Å; I99-K123 VanDerWaalsContact O-NZ 3.12Å; E101-K123 IonicContact OE1-NZ 2.75Å; E101-K123 PolarHBondContact OE1-NZ 3.02Å; Q119-K123 WeakPolarHBondContact O-CG 3.42Å; Q119-K123 PolarHBondContact O-N 3.44Å; V120-K123 WeakPolarHBondContact O-CB 3.29Å; V120-K123 PolarHBondContact O-N 3.2Å; M121-K123 VanDerWaalsContact C-N 3.3Å; M121-K123 PolarHBondContact O-N 3.18Å; K123-R126 PolarHBondContact O-N 3.49Å; K123-A127 PolarHBondContact O-N 3.01Å
124I92.3Very high89.5Confident0 Ų040.4 Ų40.40%022%0.216CC..Hα-helixtrans-62.1-48.9178.3-61.7168.7000110.1I81 I99 I106 V120 M121 R126 A127 I128 L132I81-I124 HydrophobicContact CD1-CD1 4.43Å; I81-I124 HydrophobicContact CG1-CG2 4.14Å; I81-I124 HydrophobicContact CG2-CG2 4.14Å; I99-I124 HydrophobicContact CD1-CD1 4.4Å; I99-I124 HydrophobicContact CD1-CG1 3.77Å; I106-I124 HydrophobicContact CD1-CD1 3.86Å; I106-I124 HydrophobicContact CD1-CG1 4.12Å; V120-I124 HydrophobicContact CG1-CD1 3.96Å; V120-I124 HydrophobicContact CG1-CG1 4.48Å; V120-I124 WeakPolarHBondContact O-CG1 3.26Å; V120-I124 PolarHBondContact O-N 3.1Å; M121-I124 PolarHBondContact O-N 3.19Å; I124-R126 VanDerWaalsContact C-N 3.26Å; I124-R126 PolarHBondContact O-N 2.96Å; I124-A127 WeakPolarHBondContact O-CA 3.24Å; I124-A127 WeakPolarHBondContact O-CB 3.31Å; I124-A127 PolarHBondContact O-N 2.95Å; I124-I128 HydrophobicContact CG2-CD1 3.99Å; I124-I128 HydrophobicContact CG2-CG1 4.41Å; I124-I128 HydrophobicContact CG2-CG2 4.23Å; I124-I128 WeakPolarHBondContact O-CG1 3.38Å; I124-I128 PolarHBondContact O-N 3.31Å; I124-L132 HydrophobicContact CB-CD1 3.9Å; I124-L132 HydrophobicContact CG2-CD1 3.55Å
125E92Very high88.9Confident11 Ų1150 Ų505%0.05126%0.255CS..Hα-helixtrans-49.9-45.8177.5-75.3174.1165.300112.1M121 G129 L130 L132 R133 L141M121-E125 VanDerWaalsContact O-CG 3.27Å; M121-E125 WeakPolarHBondContact O-CG 3.44Å; M121-E125 PolarHBondContact O-N 3.41Å; E125-G129 VanDerWaalsContact O-CA 3.22Å; E125-G129 WeakPolarHBondContact O-CA 3.14Å; E125-G129 PolarHBondContact O-N 3.48Å; E125-L130 VanDerWaalsContact CA-O 3.25Å; E125-L130 WeakPolarHBondContact CA-O 3.47Å; E125-L130 WeakPolarHBondContact CB-O 3.47Å; E125-L130 WeakPolarHBondContact CG-O 3.27Å; E125-L130 PolarHBondContact O-N 3.5Å; E125-L132 HydrophobicContact CG-CB 3.72Å; E125-L132 HydrophobicContact CG-CD1 3.96Å; E125-L132 HydrophobicContact CG-CG 3.72Å; E125-L132 PolarHBondContact OE1-N 3.04Å; E125-R133 WeakPolarHBondContact OE1-CG 3.5Å; E125-R133 IonicContact OE1-CZ 3.87Å; E125-R133 PolarHBondContact OE1-N 3.44Å; E125-R133 IonicContact OE1-NE 2.97Å; E125-R133 PolarHBondContact OE1-NE 3.1Å; E125-R133 IonicContact OE1-NH2 3.92Å; E125-R133 IonicContact OE2-CZ 3.36Å; E125-R133 IonicContact OE2-NE 3.22Å; E125-R133 PolarHBondContact OE2-NE 2.95Å; E125-R133 IonicContact OE2-NH2 3.89Å; E125-R133 PolarHBondContact OE2-NH2 3.18Å; E125-L141 HydrophobicContact CB-CD2 4.43Å
126R91.2Very high88.6Confident171 Ų17149.9 Ų49.965%0.64526%0.256SS*.Hα-helixtrans-70.6-34.6178-72.6179.5-72.7136.6-6.2112.8G122 K123 I124 L141G122-R126 WeakPolarHBondContact O-CG 3.44Å; G122-R126 PolarHBondContact O-NE 3.23Å; K123-R126 PolarHBondContact O-N 3.49Å; I124-R126 VanDerWaalsContact C-N 3.26Å; I124-R126 PolarHBondContact O-N 2.96Å; R126-L141 HydrophobicContact CG-CD2 4.04Å
127A91.4Very high88.4Confident8 Ų850 Ų507%0.06625%0.254CS..Hα-helixtrans-70.3-43.1178.400000111.8K88 L95 K98 I99 K123 I124K88-A127 WeakPolarHBondContact CD-O 3.42Å; K88-A127 PolarHBondContact NZ-O 3.22Å; L95-A127 HydrophobicContact CD1-CB 3.64Å; K98-A127 HydrophobicContact CD-CB 4.41Å; I99-A127 HydrophobicContact CG2-CB 3.93Å; K123-A127 PolarHBondContact O-N 3.01Å; I124-A127 WeakPolarHBondContact O-CA 3.24Å; I124-A127 WeakPolarHBondContact O-CB 3.31Å; I124-A127 PolarHBondContact O-N 2.95Å
128I90.6Very high87.8Confident6 Ų650.6 Ų50.63%0.03126%0.264CS..Hα-helixtrans-92.1-16.3-178.573.4179.6000113.6K88 L95 I124 L130 L132K88-I128 VanDerWaalsContact CE-C 3.47Å; K88-I128 WeakPolarHBondContact CE-O 3.43Å; K88-I128 PolarHBondContact NZ-O 2.97Å; L95-I128 HydrophobicContact CD1-CG2 4.14Å; L95-I128 HydrophobicContact CD2-CG2 4.42Å; I124-I128 HydrophobicContact CG2-CD1 3.99Å; I124-I128 HydrophobicContact CG2-CG1 4.41Å; I124-I128 HydrophobicContact CG2-CG2 4.23Å; I124-I128 WeakPolarHBondContact O-CG1 3.38Å; I124-I128 PolarHBondContact O-N 3.31Å; I128-L130 VanDerWaalsContact C-N 3.32Å; I128-L130 HydrophobicContact CD1-CB 4.07Å; I128-L130 HydrophobicContact CD1-CD1 4.4Å; I128-L130 HydrophobicContact CG1-CB 4.02Å; I128-L130 HydrophobicContact CG1-CG 4.34Å; I128-L132 HydrophobicContact CD1-CD1 4.11Å; I128-L132 HydrophobicContact CD1-CD2 4.07Å; I128-L132 HydrophobicContact CD1-CG 4.3Å
129G88.1Confident87.7Confident25 Ų2550.3 Ų50.326%0.25826%0.262SS..THydrogen-bonded Turntrans73.420.3178.800000114.3E125 L141E125-G129 VanDerWaalsContact O-CA 3.22Å; E125-G129 WeakPolarHBondContact O-CA 3.14Å; E125-G129 PolarHBondContact O-N 3.48Å; G129-L141 PolarHBondContact O-N 3.24Å
130L90.1Very high87.4Confident31 Ų3151.2 Ų51.216%0.16227%0.274CS..BIsolated β-bridgetrans-121.4149.1177.9-57.6177000109.3V80 E125 I128 L139V80-L130 HydrophobicContact CG1-CB 4.27Å; V80-L130 HydrophobicContact CG1-CD1 3.92Å; E125-L130 VanDerWaalsContact CA-O 3.25Å; E125-L130 WeakPolarHBondContact CA-O 3.47Å; E125-L130 WeakPolarHBondContact CB-O 3.47Å; E125-L130 WeakPolarHBondContact CG-O 3.27Å; E125-L130 PolarHBondContact O-N 3.5Å; I128-L130 VanDerWaalsContact C-N 3.32Å; I128-L130 HydrophobicContact CD1-CB 4.07Å; I128-L130 HydrophobicContact CD1-CD1 4.4Å; I128-L130 HydrophobicContact CG1-CB 4.02Å; I128-L130 HydrophobicContact CG1-CG 4.34Å; L130-L139 CarbonylContact C-O 3.57Å; L130-L139 WeakPolarHBondContact CA-O 3.36Å
131K90.2Very high86.8Confident49 Ų4953.7 Ų53.721%0.21329%0.286CS..  trans-77134.6171.9-70.6176.9-179.1167.60110D136 G138 L139 L141K131-D136 WeakPolarHBondContact CB-O 3.42Å; K131-D136 HydrophobicContact CD-CB 3.79Å; K131-D136 IonicContact NZ-OD2 2.94Å; K131-D136 PolarHBondContact NZ-OD2 3.16Å; K131-D136 VanDerWaalsContact NZ-OD2 3.09Å; K131-G138 PolarHBondContact O-N 3.2Å; K131-L139 PolarHBondContact N-O 2.96Å; K131-L141 HydrophobicContact CG-CD1 3.8Å
132L86.8Confident85.7Confident4 Ų460.6 Ų60.62%0.02132%0.319CS..  trans-118.12.3179.1-61.6177000112.1V77 V80 I81 I124 E125 I128V77-L132 HydrophobicContact CG1-CB 4.34Å; V77-L132 HydrophobicContact CG1-CD2 4.33Å; V80-L132 HydrophobicContact CB-CD2 4.04Å; V80-L132 HydrophobicContact CG1-CD2 3.53Å; I81-L132 HydrophobicContact CD1-CD1 4.01Å; I81-L132 HydrophobicContact CG1-CD1 3.58Å; I81-L132 HydrophobicContact CG1-CD2 3.72Å; I81-L132 HydrophobicContact CG1-CG 4.31Å; I124-L132 HydrophobicContact CB-CD1 3.9Å; I124-L132 HydrophobicContact CG2-CD1 3.55Å; E125-L132 HydrophobicContact CG-CB 3.72Å; E125-L132 HydrophobicContact CG-CD1 3.96Å; E125-L132 HydrophobicContact CG-CG 3.72Å; E125-L132 PolarHBondContact OE1-N 3.04Å; I128-L132 HydrophobicContact CD1-CD1 4.11Å; I128-L132 HydrophobicContact CD1-CD2 4.07Å; I128-L132 HydrophobicContact CD1-CG 4.3Å
133R84.7Confident84.2Confident101 Ų10164.6 Ų64.638%0.38135%0.351SS..SBendtrans-134.6149.9-174.2-64177.9-67.5166.8-0.9110.9M121 E125M121-R133 HydrophobicContact CB-CG 4.35Å; M121-R133 HydrophobicContact CE-CG 4.16Å; M121-R133 HydrophobicContact SD-CG 4.14Å; E125-R133 WeakPolarHBondContact OE1-CG 3.5Å; E125-R133 IonicContact OE1-CZ 3.87Å; E125-R133 PolarHBondContact OE1-N 3.44Å; E125-R133 IonicContact OE1-NE 2.97Å; E125-R133 PolarHBondContact OE1-NE 3.1Å; E125-R133 IonicContact OE1-NH2 3.92Å; E125-R133 IonicContact OE2-CZ 3.36Å; E125-R133 IonicContact OE2-NE 3.22Å; E125-R133 PolarHBondContact OE2-NE 2.95Å; E125-R133 IonicContact OE2-NH2 3.89Å; E125-R133 PolarHBondContact OE2-NH2 3.18Å
134G81.6Confident82.5Confident63 Ų6372.1 Ų72.165%0.64938%0.383SS*.SBendtrans85.4-156.7178.100000112.5I137G134-I137 WeakPolarHBondContact O-CG1 3.33Å
135K76.6Confident80.5Confident214 Ų21477.6 Ų77.693%0.9342%0.419SS*.SBendtrans-82.1-20.6-177.7-62.5-176.3179.1-174.50113.3I137K135-I137 PolarHBondContact O-N 2.73Å
136D81.9Confident78.4Confident76 Ų7686.6 Ų86.641%0.40646%0.458SS..  trans-98.243-171.9-63.4-16.5000112.3K131 G138 L139K131-D136 WeakPolarHBondContact CB-O 3.42Å; K131-D136 HydrophobicContact CD-CB 3.79Å; K131-D136 IonicContact NZ-OD2 2.94Å; K131-D136 PolarHBondContact NZ-OD2 3.16Å; K131-D136 VanDerWaalsContact NZ-OD2 3.09Å; D136-G138 PolarHBondContact O-N 2.81Å; D136-L139 HydrophobicContact CB-CB 4.3Å; D136-L139 HydrophobicContact CB-CD1 3.55Å; D136-L139 HydrophobicContact CB-CG 4.47Å; D136-L139 PolarHBondContact O-N 3.08Å
137I82.6Confident76.3Confident46 Ų4688.3 Ų88.324%0.23647%0.47CS..THydrogen-bonded Turntrans-66133.3-176.9-64.5170.1000109.4V77 V80 G134 K135 L139V77-I137 HydrophobicContact CG2-CD1 4.01Å; V77-I137 HydrophobicContact CG2-CG2 4.24Å; V80-I137 HydrophobicContact CG2-CG2 4.02Å; G134-I137 WeakPolarHBondContact O-CG1 3.33Å; K135-I137 PolarHBondContact O-N 2.73Å; I137-L139 VanDerWaalsContact C-N 3.28Å; I137-L139 PolarHBondContact O-N 3.34Å
138G79.2Confident73.8Confident30 Ų30101.1 Ų101.131%0.30952%0.524SS..THydrogen-bonded Turntrans84.9-9.6-179.400000115.3K131 D136K131-G138 PolarHBondContact O-N 3.2Å; D136-G138 PolarHBondContact O-N 2.81Å
139L85.4Confident72.9Confident89 Ų89105.9 Ų105.947%0.46655%0.549SS..SBendtrans-73.4152.3173.3-77.9161.9000111.4L130 K131 D136 I137 L141L130-L139 CarbonylContact C-O 3.57Å; L130-L139 WeakPolarHBondContact CA-O 3.36Å; K131-L139 PolarHBondContact N-O 2.96Å; D136-L139 HydrophobicContact CB-CB 4.3Å; D136-L139 HydrophobicContact CB-CD1 3.55Å; D136-L139 HydrophobicContact CB-CG 4.47Å; D136-L139 PolarHBondContact O-N 3.08Å; I137-L139 VanDerWaalsContact C-N 3.28Å; I137-L139 PolarHBondContact O-N 3.34Å; L139-L141 PolarHBondContact O-N 3.34Å
140P83.4Confident72.1Confident87 Ų87110.1 Ų110.157%0.56556%0.564SS**BIsolated β-bridgetrans-54137.6173.7-2433.2000111.7E142P140-E142 PolarHBondContact O-N 3.1Å
141L80.1Confident71.1Confident60 Ų60114.5 Ų114.531%0.31459%0.586SS.*  trans-73.3101172.2-171.373.7000108.1E125 R126 G129 K131 L139 A143E125-L141 HydrophobicContact CB-CD2 4.43Å; R126-L141 HydrophobicContact CG-CD2 4.04Å; G129-L141 PolarHBondContact O-N 3.24Å; K131-L141 HydrophobicContact CG-CD1 3.8Å; L139-L141 PolarHBondContact O-N 3.34Å; L141-A143 PolarHBondContact O-N 3.42Å
142E68.6Low70Confident159 Ų159118.4 Ų118.474%0.74361%0.608SS**  trans-42.3110.7169.2-71-90.6128.400109.6P140 K144P140-E142 PolarHBondContact O-N 3.1Å; E142-K144 VanDerWaalsContact C-N 3.34Å; E142-K144 PolarHBondContact O-N 3.19Å
143A59.6Low68.9Low93 Ų93125.5 Ų125.577%0.76965%0.645SS**  trans-68.195.4179.100000107.8L141 P145L141-A143 PolarHBondContact O-N 3.42Å; A143-P145 WeakPolarHBondContact O-CD 3.37Å
144K57.1Low67.9Low191 Ų191127.1 Ų127.183%0.8366%0.663SS**  trans-52.6121.5169.7-75.7-172.9178.5-179.40107E142 K146E142-K144 VanDerWaalsContact C-N 3.34Å; E142-K144 PolarHBondContact O-N 3.19Å; K144-K146 PolarHBondContact O-N 3.41Å
145P50.1Low66.9Low115 Ų115131.7 Ų131.775%0.74766%0.664SS**  trans-56.4129.3179.721.3-31000107.5A143 K147A143-P145 WeakPolarHBondContact O-CD 3.37Å; P145-K147 VanDerWaalsContact C-N 3.34Å; P145-K147 PolarHBondContact O-N 3.5Å
146K48.2Very low66.2Low201 Ų201125.4 Ų125.487%0.87464%0.643SS**  trans-57.3103.1171.9-74-177.4178.9177.70106.2K144 K148K144-K146 PolarHBondContact O-N 3.41Å; K146-K148 PolarHBondContact O-N 3.48Å
147K45.1Very low64.9Low206 Ų206129.5 Ų129.590%0.89666%0.663SS**  trans-59.7109.2166-79.8-172174.8-175.30105.7P145P145-K147 VanDerWaalsContact C-N 3.34Å; P145-K147 PolarHBondContact O-N 3.5Å
148K38.9Very low63.2Low277 Ų277137.1 Ų137.1100%1.20470%0.702SS**  trans-60.50164.4-76.7-174.8176-178.90108.9K146K146-K148 PolarHBondContact O-N 3.48Å

Retrieved 148 of 148 residues in 56.4 ms (Link to these results)