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Unique cartilage matrix-associated protein

May be involved in the negative control of osteogenic differentiation of osteochondrogenic precursor cells in peripheral zones of fetal cartilage and at the cartilage-bone interface.

AlphaFold DB , UniProt , Accession Q8WVF2, Species HUMAN (Homo sapiens, Human), Gene UCMA, Length 138 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
1M59.3Low87Confident208 Ų208114.6 Ų114.6100%1.02559%0.593SS**  0119.50-73.9-140.9156.300108.3Q5M1-Q5 VanDerWaalsContact CA-OE1 3.27Å
2T82.8Confident87.6Confident87 Ų87117.8 Ų117.853%0.53460%0.599SS.*  trans-83.2142.3-176.253.30000109.2R4 Q5T2-R4 PolarHBondContact O-N 3.4Å; T2-Q5 VanDerWaalsContact N-OE1 3.17Å; T2-Q5 WeakPolarHBondContact O-CA 3.49Å; T2-Q5 VanDerWaalsContact O-CB 3.32Å; T2-Q5 WeakPolarHBondContact O-CB 3.3Å; T2-Q5 PolarHBondContact O-N 3.01Å
3W84.8Confident88Confident191 Ų191113.3 Ų113.372%0.72359%0.585SS**Hα-helixtrans-49.3-30.5-176.377-76.2000113.9Q5 A6 V7W3-Q5 VanDerWaalsContact C-N 3.33Å; W3-Q5 PolarHBondContact O-N 3.3Å; W3-A6 WeakPolarHBondContact O-CB 3.17Å; W3-A6 PolarHBondContact O-N 3.18Å; W3-A6 VanDerWaalsContact O-N 3.11Å; W3-V7 HydrophobicContact CE3-CG2 3.93Å; W3-V7 HydrophobicContact CZ3-CG2 4.14Å; W3-V7 PolarHBondContact O-N 3.22Å
4R89.6Confident88.4Confident175 Ų175108.5 Ų108.566%0.6657%0.571SS**Hα-helixtrans-56.5-42.4171.9-66.3-175.9176.3-174.4-1112.7T2 A6 V7 L8T2-R4 PolarHBondContact O-N 3.4Å; R4-A6 VanDerWaalsContact C-N 3.34Å; R4-V7 PolarHBondContact O-N 3.46Å; R4-L8 WeakPolarHBondContact O-CB 3.4Å; R4-L8 VanDerWaalsContact O-CG 3.24Å; R4-L8 WeakPolarHBondContact O-CG 3.42Å; R4-L8 PolarHBondContact O-N 2.96Å
5Q88.4Confident88.7Confident89 Ų89107.7 Ų107.742%0.41657%0.572SS.*Hα-helixtrans-64.4-38.4175.3-65.7175.7-37.600111.3M1 T2 W3 L8 L9M1-Q5 VanDerWaalsContact CA-OE1 3.27Å; T2-Q5 VanDerWaalsContact N-OE1 3.17Å; T2-Q5 WeakPolarHBondContact O-CA 3.49Å; T2-Q5 VanDerWaalsContact O-CB 3.32Å; T2-Q5 WeakPolarHBondContact O-CB 3.3Å; T2-Q5 PolarHBondContact O-N 3.01Å; W3-Q5 VanDerWaalsContact C-N 3.33Å; W3-Q5 PolarHBondContact O-N 3.3Å; Q5-L8 PolarHBondContact O-N 3.24Å; Q5-L9 VanDerWaalsContact O-CB 3.31Å; Q5-L9 WeakPolarHBondContact O-CB 3.47Å; Q5-L9 WeakPolarHBondContact O-CD1 3.46Å; Q5-L9 WeakPolarHBondContact O-CG 3.38Å; Q5-L9 PolarHBondContact O-N 3.33Å
6A89Confident88.9Confident63 Ų63104.8 Ų104.852%0.52156%0.559SS.*Hα-helixtrans-65.5-43.9177.300000112W3 R4 L9 S10W3-A6 WeakPolarHBondContact O-CB 3.17Å; W3-A6 PolarHBondContact O-N 3.18Å; W3-A6 VanDerWaalsContact O-N 3.11Å; R4-A6 VanDerWaalsContact C-N 3.34Å; A6-L9 PolarHBondContact O-N 2.91Å; A6-S10 WeakPolarHBondContact O-CB 3.27Å; A6-S10 PolarHBondContact O-N 3.37Å
7V92.2Very high88.9Confident72 Ų72105.2 Ų105.244%0.43656%0.56SS.*Hα-helixtrans-64.1-45.3175.5176.20000111W3 R4 L9 S10 C11W3-V7 HydrophobicContact CE3-CG2 3.93Å; W3-V7 HydrophobicContact CZ3-CG2 4.14Å; W3-V7 PolarHBondContact O-N 3.22Å; R4-V7 PolarHBondContact O-N 3.46Å; V7-L9 PolarHBondContact O-N 3.25Å; V7-S10 PolarHBondContact O-N 2.71Å; V7-C11 PolarHBondContact O-N 3.08Å; V7-C11 PolarHBondContact O-SG 3.36Å; V7-C11 VanDerWaalsContact O-SG 3.35Å
8L92.3Very high88.9Confident121 Ų121105.8 Ų105.863%0.63456%0.563SS**Hα-helixtrans-62.1-43.4178.1-72.6171.9000112R4 Q5 C11 F12R4-L8 WeakPolarHBondContact O-CB 3.4Å; R4-L8 VanDerWaalsContact O-CG 3.24Å; R4-L8 WeakPolarHBondContact O-CG 3.42Å; R4-L8 PolarHBondContact O-N 2.96Å; Q5-L8 PolarHBondContact O-N 3.24Å; L8-C11 PolarHBondContact O-N 3.32Å; L8-F12 WeakPolarHBondContact O-CB 3.34Å; L8-F12 PolarHBondContact O-N 2.89Å
9L93.3Very high88.6Confident109 Ų109102.5 Ų102.557%0.57155%0.549SS*.Hα-helixtrans-62.7-41.7175.5-75.8166.8000111.7Q5 A6 V7 F12 S13Q5-L9 VanDerWaalsContact O-CB 3.31Å; Q5-L9 WeakPolarHBondContact O-CB 3.47Å; Q5-L9 WeakPolarHBondContact O-CD1 3.46Å; Q5-L9 WeakPolarHBondContact O-CG 3.38Å; Q5-L9 PolarHBondContact O-N 3.33Å; A6-L9 PolarHBondContact O-N 2.91Å; V7-L9 PolarHBondContact O-N 3.25Å; L9-F12 PolarHBondContact O-N 3.41Å; L9-S13 PolarHBondContact O-N 3.26Å; L9-S13 PolarHBondContact O-OG 3.42Å
10S93.2Very high88.3Confident74 Ų74103 Ų10352%0.51755%0.55SS..Hα-helixtrans-62.8-44.4176-177.40000112.3A6 V7 F12 S13 A14A6-S10 WeakPolarHBondContact O-CB 3.27Å; A6-S10 PolarHBondContact O-N 3.37Å; V7-S10 PolarHBondContact O-N 2.71Å; S10-F12 VanDerWaalsContact C-N 3.34Å; S10-S13 WeakPolarHBondContact CA-OG 3.43Å; S10-S13 PolarHBondContact O-N 3.1Å; S10-S13 PolarHBondContact O-OG 3.13Å; S10-A14 WeakPolarHBondContact O-CB 3.1Å; S10-A14 PolarHBondContact O-N 3.37Å
11C92.4Very high87.9Confident72 Ų72103.2 Ų103.249%0.48655%0.55SS.*Hα-helixtrans-63.8-42.3175.6-690000111V7 L8 A14 V15V7-C11 PolarHBondContact O-N 3.08Å; V7-C11 PolarHBondContact O-SG 3.36Å; V7-C11 VanDerWaalsContact O-SG 3.35Å; L8-C11 PolarHBondContact O-N 3.32Å; C11-A14 PolarHBondContact O-N 3.33Å; C11-V15 WeakPolarHBondContact O-CG2 3.42Å; C11-V15 PolarHBondContact O-N 3.29Å
12F93.5Very high88.7Confident152 Ų152102.6 Ų102.667%0.66754%0.536SS*.Hα-helixtrans-62.9-44178.1-151.8-89000111.3L8 L9 S10 A14 V15 V16L8-F12 WeakPolarHBondContact O-CB 3.34Å; L8-F12 PolarHBondContact O-N 2.89Å; L9-F12 PolarHBondContact O-N 3.41Å; S10-F12 VanDerWaalsContact C-N 3.34Å; F12-A14 VanDerWaalsContact C-N 3.34Å; F12-A14 PolarHBondContact O-N 3.13Å; F12-V15 PolarHBondContact O-N 3.42Å; F12-V16 HydrophobicContact CD1-CG2 4.08Å; F12-V16 HydrophobicContact CE1-CG2 4.16Å; F12-V16 WeakPolarHBondContact O-CG2 3.43Å; F12-V16 PolarHBondContact O-N 2.9Å
13S93.2Very high88Confident60 Ų60104.2 Ų104.242%0.4254%0.538SS..Hα-helixtrans-63.6-37.617559.70000112.6L9 S10 V16 L17L9-S13 PolarHBondContact O-N 3.26Å; L9-S13 PolarHBondContact O-OG 3.42Å; S10-S13 WeakPolarHBondContact CA-OG 3.43Å; S10-S13 PolarHBondContact O-N 3.1Å; S10-S13 PolarHBondContact O-OG 3.13Å; S13-V16 PolarHBondContact O-N 3.28Å; S13-L17 WeakPolarHBondContact O-CB 3.4Å; S13-L17 VanDerWaalsContact O-CG 3.31Å; S13-L17 WeakPolarHBondContact O-CG 3.42Å; S13-L17 PolarHBondContact O-N 3.44Å
14A93.5Very high86.9Confident46 Ų4697.5 Ų97.538%0.3853%0.528SS..Hα-helixtrans-65.2-41.7176.500000111.7S10 C11 F12 L17 L18S10-A14 WeakPolarHBondContact O-CB 3.1Å; S10-A14 PolarHBondContact O-N 3.37Å; C11-A14 PolarHBondContact O-N 3.33Å; F12-A14 VanDerWaalsContact C-N 3.34Å; F12-A14 PolarHBondContact O-N 3.13Å; A14-L17 PolarHBondContact O-N 3.39Å; A14-L18 WeakPolarHBondContact O-CB 3.3Å; A14-L18 VanDerWaalsContact O-CG 3.25Å; A14-L18 WeakPolarHBondContact O-CG 3.49Å; A14-L18 PolarHBondContact O-N 2.74Å
15V92.9Very high85.2Confident97 Ų9794.4 Ų94.459%0.58853%0.529SS*.Hα-helixtrans-64-43.2175.5173.70000111C11 F12 L18 S19C11-V15 WeakPolarHBondContact O-CG2 3.42Å; C11-V15 PolarHBondContact O-N 3.29Å; F12-V15 PolarHBondContact O-N 3.42Å; V15-L18 PolarHBondContact O-N 3.01Å; V15-S19 PolarHBondContact O-N 3.46Å; V15-S19 PolarHBondContact O-OG 3.15Å; V15-S19 VanDerWaalsContact O-OG 3.1Å
16V91.7Very high83.3Confident61 Ų6193.8 Ų93.837%0.3753%0.534SS..Hα-helixtrans-62.5-43.6176.3172.30000111.4F12 S13 L18 S19 M20F12-V16 HydrophobicContact CD1-CG2 4.08Å; F12-V16 HydrophobicContact CE1-CG2 4.16Å; F12-V16 WeakPolarHBondContact O-CG2 3.43Å; F12-V16 PolarHBondContact O-N 2.9Å; S13-V16 PolarHBondContact O-N 3.28Å; V16-L18 VanDerWaalsContact C-N 3.34Å; V16-L18 PolarHBondContact O-N 3.15Å; V16-S19 VanDerWaalsContact CA-OG 3.31Å; V16-S19 WeakPolarHBondContact CA-OG 3.44Å; V16-S19 PolarHBondContact O-N 3.49Å; V16-S19 PolarHBondContact O-OG 3.41Å; V16-M20 HydrophobicContact CG1-CE 4.49Å; V16-M20 HydrophobicContact CG1-CG 4.41Å; V16-M20 WeakPolarHBondContact O-CG 3.18Å; V16-M20 PolarHBondContact O-N 3.08Å
17L89.2Confident81.3Confident111 Ų11196.4 Ų96.458%0.58154%0.543SS*.Hα-helixtrans-61.3-43.6174.9-74.9171.6000111.3S13 A14 M20 L21S13-L17 WeakPolarHBondContact O-CB 3.4Å; S13-L17 VanDerWaalsContact O-CG 3.31Å; S13-L17 WeakPolarHBondContact O-CG 3.42Å; S13-L17 PolarHBondContact O-N 3.44Å; A14-L17 PolarHBondContact O-N 3.39Å; L17-M20 PolarHBondContact O-N 3.29Å; L17-L21 WeakPolarHBondContact O-CB 3.32Å; L17-L21 WeakPolarHBondContact O-CD1 3.46Å; L17-L21 PolarHBondContact O-N 3.41Å
18L88.2Confident78.7Confident116 Ų11697.3 Ų97.361%0.60755%0.553SS**Hα-helixtrans-66.3-36.1177.8-72.2171.1000112.7A14 V15 V16 R22A14-L18 WeakPolarHBondContact O-CB 3.3Å; A14-L18 VanDerWaalsContact O-CG 3.25Å; A14-L18 WeakPolarHBondContact O-CG 3.49Å; A14-L18 PolarHBondContact O-N 2.74Å; V15-L18 PolarHBondContact O-N 3.01Å; V16-L18 VanDerWaalsContact C-N 3.34Å; V16-L18 PolarHBondContact O-N 3.15Å; L18-R22 VanDerWaalsContact O-CB 3.28Å; L18-R22 WeakPolarHBondContact O-CB 3.37Å; L18-R22 PolarHBondContact O-N 3.06Å
19S83.4Confident76.3Confident43 Ų4398 Ų9830%0.30156%0.562SS.*Hα-helixtrans-69-40.8173.748.60000111.9V15 V16 R22 E23V15-S19 PolarHBondContact O-N 3.46Å; V15-S19 PolarHBondContact O-OG 3.15Å; V15-S19 VanDerWaalsContact O-OG 3.1Å; V16-S19 VanDerWaalsContact CA-OG 3.31Å; V16-S19 WeakPolarHBondContact CA-OG 3.44Å; V16-S19 PolarHBondContact O-N 3.49Å; V16-S19 PolarHBondContact O-OG 3.41Å; S19-R22 PolarHBondContact O-N 3.26Å; S19-E23 WeakPolarHBondContact O-CB 3.47Å; S19-E23 WeakPolarHBondContact O-CG 3.39Å; S19-E23 PolarHBondContact O-N 3.2Å
20M83.1Confident73.9Confident113 Ų11395.4 Ų95.456%0.55756%0.562SS**Hα-helixtrans-66-39.2174.9-65.5-68.4158.700111.7V16 L17 E23 G24V16-M20 HydrophobicContact CG1-CE 4.49Å; V16-M20 HydrophobicContact CG1-CG 4.41Å; V16-M20 WeakPolarHBondContact O-CG 3.18Å; V16-M20 PolarHBondContact O-N 3.08Å; L17-M20 PolarHBondContact O-N 3.29Å; M20-E23 PolarHBondContact O-N 2.84Å; M20-G24 PolarHBondContact O-N 3.11Å
21L79.4Confident71.6Confident108 Ų10897.5 Ų97.557%0.56557%0.572SS**Hα-helixtrans-63.6-42.1171.6-92.1144.8000110.9L17 G24 T25L17-L21 WeakPolarHBondContact O-CB 3.32Å; L17-L21 WeakPolarHBondContact O-CD1 3.46Å; L17-L21 PolarHBondContact O-N 3.41Å; L21-G24 CarbonylContact O-C 3.3Å; L21-G24 PolarHBondContact O-N 3.2Å; L21-T25 WeakPolarHBondContact O-CB 3.44Å; L21-T25 WeakPolarHBondContact O-CG2 3.37Å; L21-T25 PolarHBondContact O-N 3.44Å; L21-T25 PolarHBondContact O-OG1 3.46Å
22R76.6Confident69.2Low194 Ų194102.9 Ų102.973%0.73259%0.592SS**Hα-helixtrans-63.2-44.5176.8-173.1174176.3-170.7-2.4111.5L18 S19 T25 S26L18-R22 VanDerWaalsContact O-CB 3.28Å; L18-R22 WeakPolarHBondContact O-CB 3.37Å; L18-R22 PolarHBondContact O-N 3.06Å; S19-R22 PolarHBondContact O-N 3.26Å; R22-T25 VanDerWaalsContact CA-OG1 3.28Å; R22-T25 WeakPolarHBondContact CA-OG1 3.28Å; R22-T25 CarbonylContact O-C 3.6Å; R22-T25 PolarHBondContact O-N 3.36Å; R22-T25 PolarHBondContact O-OG1 3.35Å; R22-S26 PolarHBondContact O-N 2.92Å; R22-S26 PolarHBondContact O-OG 3.01Å
23E67.7Low66.5Low122 Ų122102.8 Ų102.857%0.5759%0.594SS**Hα-helixtrans-66.1-39.6176.3-72.4172.6-158.700112S19 M20 S26S19-E23 WeakPolarHBondContact O-CB 3.47Å; S19-E23 WeakPolarHBondContact O-CG 3.39Å; S19-E23 PolarHBondContact O-N 3.2Å; M20-E23 PolarHBondContact O-N 2.84Å; E23-S26 WeakPolarHBondContact CA-OG 3.47Å; E23-S26 CarbonylContact O-C 3.52Å; E23-S26 VanDerWaalsContact O-C 3.3Å; E23-S26 WeakPolarHBondContact O-CA 3.49Å; E23-S26 PolarHBondContact O-N 3.4Å; E23-S26 VanDerWaalsContact O-N 3.13Å; E23-S26 PolarHBondContact O-OG 2.63Å
24G61.3Low63.8Low50 Ų50107.8 Ų107.852%0.51561%0.612SS.*Hα-helixtrans-69.9-28.6173.100000113.7M20 L21 S26 V27M20-G24 PolarHBondContact O-N 3.11Å; L21-G24 CarbonylContact O-C 3.3Å; L21-G24 PolarHBondContact O-N 3.2Å; G24-S26 VanDerWaalsContact C-N 3.3Å; G24-V27 PolarHBondContact O-N 3.04Å
25T55Low61.4Low109 Ų109110.9 Ų110.967%0.66964%0.638SS**Hα-helixtrans-81.6-11.7170.4610000112.4L21 R22 V27L21-T25 WeakPolarHBondContact O-CB 3.44Å; L21-T25 WeakPolarHBondContact O-CG2 3.37Å; L21-T25 PolarHBondContact O-N 3.44Å; L21-T25 PolarHBondContact O-OG1 3.46Å; R22-T25 VanDerWaalsContact CA-OG1 3.28Å; R22-T25 WeakPolarHBondContact CA-OG1 3.28Å; R22-T25 CarbonylContact O-C 3.6Å; R22-T25 PolarHBondContact O-N 3.36Å; R22-T25 PolarHBondContact O-OG1 3.35Å; T25-V27 VanDerWaalsContact C-N 3.29Å
26S48.9Very low58.9Low76 Ų76109 Ų10953%0.53164%0.638SS.*THydrogen-bonded Turntrans-95.543.8163.264.90000111.7R22 E23 G24 S28R22-S26 PolarHBondContact O-N 2.92Å; R22-S26 PolarHBondContact O-OG 3.01Å; E23-S26 WeakPolarHBondContact CA-OG 3.47Å; E23-S26 CarbonylContact O-C 3.52Å; E23-S26 VanDerWaalsContact O-C 3.3Å; E23-S26 WeakPolarHBondContact O-CA 3.49Å; E23-S26 PolarHBondContact O-N 3.4Å; E23-S26 VanDerWaalsContact O-N 3.13Å; E23-S26 PolarHBondContact O-OG 2.63Å; G24-S26 VanDerWaalsContact C-N 3.3Å; S26-S28 PolarHBondContact O-N 3.36Å
27V46.4Very low56.8Low118 Ų118114.2 Ų114.272%0.71566%0.658SS**  trans-7177.1139.71760000104.7G24 T25 V29G24-V27 PolarHBondContact O-N 3.04Å; T25-V27 VanDerWaalsContact C-N 3.29Å; V27-V29 PolarHBondContact O-N 2.53Å
28S37Very low54.7Low91 Ų91117.2 Ų117.264%0.63667%0.669SS**  47.978.397-166.80000108.4S26 G30S26-S28 PolarHBondContact O-N 3.36Å; S28-G30 PolarHBondContact O-N 3.17Å
29V43.4Very low53.1Low136 Ų136115.5 Ų115.582%0.82467%0.671SS**  trans-50.9101150.2176.30000103.8V27 T31V27-V29 PolarHBondContact O-N 2.53Å; V29-T31 PolarHBondContact O-N 3.25Å
30G41.6Very low51.7Low55 Ų55116.2 Ų116.257%0.56768%0.676SS**  trans-49.2121.3178.400000107.2S28 M32S28-G30 PolarHBondContact O-N 3.17Å; G30-M32 PolarHBondContact O-N 3.4Å
31T45.3Very low50.5Low118 Ų118117.2 Ų117.272%0.72468%0.68SS**  trans-63.571.7166-48.80000107.4V29 Q33V29-T31 PolarHBondContact O-N 3.25Å; T31-Q33 HydrophobicContact CG2-CG 3.91Å; T31-Q33 PolarHBondContact O-N 3.18Å
32M41.1Very low49.7Very low185 Ų185117.5 Ų117.591%0.91168%0.682SS**  trans-82.478.8152.9-128.3-169.9-132.600104.9G30 M34G30-M32 PolarHBondContact O-N 3.4Å; M32-M34 PolarHBondContact O-N 3Å; M32-M34 VanDerWaalsContact O-N 3.11Å
33Q38.6Very low49.1Very low150 Ų150111.1 Ų111.170%0.70167%0.671SS**  trans-51.4114144.5-76.7171.7-17.800105.8T31T31-Q33 HydrophobicContact CG2-CG 3.91Å; T31-Q33 PolarHBondContact O-N 3.18Å
34M35.4Very low48.8Very low164 Ų164111.5 Ų111.581%0.80867%0.67SS**SBend158.9125.7125.2-78.2-53.3167.500109.1M32M32-M34 PolarHBondContact O-N 3Å; M32-M34 VanDerWaalsContact O-N 3.11Å
35A43Very low48.9Very low112 Ų112115.4 Ų115.493%0.92668%0.675SS**SBendtrans73.890.9161.200000117.5
36G40.4Very low49.6Very low56 Ų56119.2 Ų119.258%0.57768%0.682SS**  trans143.460.1154.300000114.5E38 A39G36-E38 PolarHBondContact O-N 2.87Å; G36-A39 PolarHBondContact O-N 2.71Å
37E46.9Very low50.9Low172 Ų172122 Ų12280%0.80469%0.69SS**THydrogen-bonded Turntrans-61.2-9.1178.7-158151.8160.500113.8
38E47Very low52.5Low174 Ų174123.7 Ų123.781%0.81369%0.688SS**THydrogen-bonded Turntrans-83-22.2-178.4-58.2-67.2150.800114.7G36G36-E38 PolarHBondContact O-N 2.87Å
39A54.4Low54.7Low79 Ų79124.4 Ų124.465%0.65368%0.683SS**Hα-helixtrans-88.7-17.6-173.300000114.3G36G36-A39 PolarHBondContact O-N 2.71Å
40S52.5Low56.6Low58 Ų58124.2 Ų124.241%0.40667%0.673SS.*Hα-helixtrans-85.6-22.5-176.181.70000113.5K44S40-K44 WeakPolarHBondContact O-CG 3.35Å; S40-K44 PolarHBondContact O-N 2.85Å
41E58.3Low58.6Low134 Ų134129.7 Ų129.763%0.62668%0.684SS**Hα-helixtrans-70.7-39.6179-62.8-136.3140.800111.7K44 Q45E41-K44 PolarHBondContact O-N 3.4Å; E41-Q45 PolarHBondContact O-N 2.93Å
42D63.2Low60.3Low114 Ų114126.5 Ų126.561%0.6167%0.666SS**Hα-helixtrans-69.5-38-178-152.425.7000111.9Q45 K46D42-Q45 PolarHBondContact O-N 3.36Å; D42-K46 PolarHBondContact O-N 3.3Å; D42-K46 VanDerWaalsContact O-N 3.08Å
43A63.6Low62.3Low60 Ų60121.9 Ų121.950%0.49665%0.645SS.*Hα-helixtrans-68-36.6172.900000112.5K46 I47A43-K46 PolarHBondContact O-N 3.07Å; A43-I47 PolarHBondContact O-N 3.46Å
44K61Low64.3Low130 Ų130116.5 Ų116.557%0.56563%0.626SS**Hα-helixtrans-67.6-42.3172.9-78.3174.3-178171.30111.3S40 E41 K46 I47 F48S40-K44 WeakPolarHBondContact O-CG 3.35Å; S40-K44 PolarHBondContact O-N 2.85Å; E41-K44 PolarHBondContact O-N 3.4Å; K44-K46 PolarHBondContact O-N 3.46Å; K44-I47 PolarHBondContact O-N 2.83Å; K44-I47 VanDerWaalsContact O-N 3.15Å; K44-F48 VanDerWaalsContact O-CD2 3.27Å; K44-F48 WeakPolarHBondContact O-CD2 3.12Å; K44-F48 PolarHBondContact O-N 3.32Å
45Q64.3Low66.5Low133 Ų133111.1 Ų111.162%0.62161%0.605SS**Hα-helixtrans-59.6-31.7174.4-85.6-176.13.400112.7E41 D42 F48E41-Q45 PolarHBondContact O-N 2.93Å; D42-Q45 PolarHBondContact O-N 3.36Å; Q45-F48 CarbonylContact O-C 3.59Å
46K68.4Low68.2Low188 Ų188109.9 Ų109.982%0.81758%0.583SS**Hα-helixtrans-71.1-28.7177.2-162.8170.8-176.2177.80114D42 A43 K44D42-K46 PolarHBondContact O-N 3.3Å; D42-K46 VanDerWaalsContact O-N 3.08Å; A43-K46 PolarHBondContact O-N 3.07Å; K44-K46 PolarHBondContact O-N 3.46Å
47I76.8Confident70Confident135 Ų135112.2 Ų112.269%0.69258%0.577SS**Hα-helixtrans-80.9-38.9175.8-60.2170.5000110.2A43 K44A43-I47 PolarHBondContact O-N 3.46Å; K44-I47 PolarHBondContact O-N 2.83Å; K44-I47 VanDerWaalsContact O-N 3.15Å
48F80.3Confident71.3Confident153 Ų153110.1 Ų110.167%0.67157%0.571SS**SBendtrans-98.496.4-178.2-64.2-72.7000111.1K44 Q45 Q50K44-F48 VanDerWaalsContact O-CD2 3.27Å; K44-F48 WeakPolarHBondContact O-CD2 3.12Å; K44-F48 PolarHBondContact O-N 3.32Å; Q45-F48 CarbonylContact O-C 3.59Å; F48-Q50 PolarHBondContact O-N 2.99Å
49M82.8Confident72.6Confident107 Ų107108.5 Ų108.553%0.52756%0.561SS.*  trans-56.2135.1170.2178.7170.450.900110.7D53 A54M49-D53 HydrophobicContact CG-CB 3.81Å; M49-D53 HydrophobicContact SD-CB 4.12Å; M49-A54 HydrophobicContact CE-CB 3.69Å; M49-A54 HydrophobicContact CG-CB 4.37Å; M49-A54 HydrophobicContact SD-CB 4.5Å
50Q84.5Confident73.3Confident131 Ų131115.2 Ų115.261%0.61257%0.57SS**  trans-56.3140.2178.4-164.5174.24000111.2F48 S52 D53 A54F48-Q50 PolarHBondContact O-N 2.99Å; Q50-S52 WeakPolarHBondContact CG-OG 3.33Å; Q50-S52 PolarHBondContact O-N 3.16Å; Q50-S52 VanDerWaalsContact O-N 3.15Å; Q50-S52 PolarHBondContact OE1-OG 3.06Å; Q50-D53 PolarHBondContact O-N 3.03Å; Q50-A54 PolarHBondContact O-N 2.85Å
51E81.9Confident74Confident171 Ų171120.9 Ų120.980%0.79958%0.582SS**Hα-helixtrans-57.3-34.6-173.767.4171.2-165.100113.4A54 S55E51-A54 PolarHBondContact O-N 2.98Å; E51-S55 WeakPolarHBondContact O-CB 3.32Å; E51-S55 PolarHBondContact O-N 3.21Å
52S81.7Confident74.5Confident50 Ų50117.7 Ų117.735%0.3559%0.585SS.*Hα-helixtrans-62-45.3176.544.30000111.2Q50 S55 N56Q50-S52 WeakPolarHBondContact CG-OG 3.33Å; Q50-S52 PolarHBondContact O-N 3.16Å; Q50-S52 VanDerWaalsContact O-N 3.15Å; Q50-S52 PolarHBondContact OE1-OG 3.06Å; S52-S55 PolarHBondContact O-N 3.45Å; S52-S55 PolarHBondContact O-OG 3.44Å; S52-N56 PolarHBondContact O-N 2.95Å; S52-N56 PolarHBondContact O-ND2 3.47Å; S52-N56 VanDerWaalsContact O-ND2 3.13Å
53D82.5Confident74.9Confident88 Ų88121.6 Ų121.647%0.47160%0.597SS.*Hα-helixtrans-71.5-40.5178.5-72-11.1000111.5M49 Q50 S55 N56 F57M49-D53 HydrophobicContact CG-CB 3.81Å; M49-D53 HydrophobicContact SD-CB 4.12Å; Q50-D53 PolarHBondContact O-N 3.03Å; D53-S55 VanDerWaalsContact C-N 3.29Å; D53-S55 PolarHBondContact O-N 3.43Å; D53-N56 PolarHBondContact O-N 3.15Å; D53-N56 VanDerWaalsContact O-N 3.13Å; D53-F57 PolarHBondContact O-N 3.37Å; D53-F57 VanDerWaalsContact O-N 3.1Å
54A81.5Confident75.4Confident37 Ų37128.5 Ų128.531%0.30661%0.61SS.*Hα-helixtrans-59.7-40.2173.400000111.9M49 Q50 E51 N56 F57M49-A54 HydrophobicContact CE-CB 3.69Å; M49-A54 HydrophobicContact CG-CB 4.37Å; M49-A54 HydrophobicContact SD-CB 4.5Å; Q50-A54 PolarHBondContact O-N 2.85Å; E51-A54 PolarHBondContact O-N 2.98Å; A54-N56 VanDerWaalsContact C-N 3.25Å; A54-N56 PolarHBondContact O-N 3.4Å; A54-F57 WeakPolarHBondContact O-CB 3.45Å; A54-F57 PolarHBondContact O-N 2.8Å
55S80.9Confident76.3Confident52 Ų52126.4 Ų126.436%0.36461%0.612SS.*Hα-helixtrans-63.3-32.6177.786.20000112.4E51 S52 D53 K59E51-S55 WeakPolarHBondContact O-CB 3.32Å; E51-S55 PolarHBondContact O-N 3.21Å; S52-S55 PolarHBondContact O-N 3.45Å; S52-S55 PolarHBondContact O-OG 3.44Å; D53-S55 VanDerWaalsContact C-N 3.29Å; D53-S55 PolarHBondContact O-N 3.43Å; S55-K59 WeakPolarHBondContact O-CD 3.32Å; S55-K59 VanDerWaalsContact O-CG 3.3Å; S55-K59 WeakPolarHBondContact O-CG 3.28Å
56N79.4Confident77.2Confident86 Ų86125.9 Ų125.946%0.4662%0.62SS.*Hα-helixtrans-81.2-25179.9-71.5-40.1000112.8S52 D53 A54 L58 K59 R60S52-N56 PolarHBondContact O-N 2.95Å; S52-N56 PolarHBondContact O-ND2 3.47Å; S52-N56 VanDerWaalsContact O-ND2 3.13Å; D53-N56 PolarHBondContact O-N 3.15Å; D53-N56 VanDerWaalsContact O-N 3.13Å; A54-N56 VanDerWaalsContact C-N 3.25Å; A54-N56 PolarHBondContact O-N 3.4Å; N56-L58 PolarHBondContact O-N 2.75Å; N56-K59 PolarHBondContact O-N 3.29Å; N56-R60 WeakPolarHBondContact O-CB 3.42Å; N56-R60 PolarHBondContact O-N 2.82Å
57F78.4Confident78Confident104 Ų104120.8 Ų120.846%0.45660%0.598SS.*Hα-helixtrans-58.1-46.3179.3-175.6-100.1000112.4D53 A54D53-F57 PolarHBondContact O-N 3.37Å; D53-F57 VanDerWaalsContact O-N 3.1Å; A54-F57 WeakPolarHBondContact O-CB 3.45Å; A54-F57 PolarHBondContact O-N 2.8Å
58L73Confident78.7Confident128 Ų128116.7 Ų116.767%0.6758%0.581SS**Hα-helixtrans-74.9-37.4177.1-63.4178.7000112N56 R60 R61 G62N56-L58 PolarHBondContact O-N 2.75Å; L58-R60 VanDerWaalsContact C-N 3.33Å; L58-R60 PolarHBondContact O-N 2.92Å; L58-R61 PolarHBondContact O-N 3.13Å; L58-G62 PolarHBondContact O-N 2.8Å
59K75.1Confident79.4Confident140 Ų140119.1 Ų119.161%0.60959%0.586SS**Hα-helixtrans-60.8-41.1177.2-71.2172.2-1741670112.1S55 N56 R61 G62S55-K59 WeakPolarHBondContact O-CD 3.32Å; S55-K59 VanDerWaalsContact O-CG 3.3Å; S55-K59 WeakPolarHBondContact O-CG 3.28Å; N56-K59 PolarHBondContact O-N 3.29Å; K59-R61 VanDerWaalsContact C-N 3.28Å; K59-R61 PolarHBondContact O-N 3.37Å; K59-G62 PolarHBondContact O-N 2.98Å
60R69.7Low79.9Confident221 Ų221119.7 Ų119.783%0.83459%0.591SS**Hα-helixtrans-64.7-32.5178.4-167.3173.4-178.9176.30.3112.1N56 L58 G62N56-R60 WeakPolarHBondContact O-CB 3.42Å; N56-R60 PolarHBondContact O-N 2.82Å; L58-R60 VanDerWaalsContact C-N 3.33Å; L58-R60 PolarHBondContact O-N 2.92Å; R60-G62 VanDerWaalsContact C-N 3.35Å
61R66.9Low80.4Confident176 Ų176117.4 Ų117.466%0.66458%0.58SS**Hα-helixtrans-74.9-21.6175.9-70.2-175.9178.2-123.1-1.3113.6L58 K59 K63L58-R61 PolarHBondContact O-N 3.13Å; K59-R61 VanDerWaalsContact C-N 3.28Å; K59-R61 PolarHBondContact O-N 3.37Å; R61-K63 VanDerWaalsContact C-N 3.29Å; R61-K63 PolarHBondContact O-N 2.77Å
62G69.4Low81Confident68 Ų68111.8 Ų111.870%0.70156%0.558SS**Hα-helixtrans-65.7-26.9-178.900000114.4L58 K59 R60L58-G62 PolarHBondContact O-N 2.8Å; K59-G62 PolarHBondContact O-N 2.98Å; R60-G62 VanDerWaalsContact C-N 3.35Å
63K70.6Confident81.7Confident195 Ų195112.8 Ų112.885%0.84856%0.559SS**  trans-103.972.6173.5-72.7177.4-179.1178.30109.9R61 S65R61-K63 VanDerWaalsContact C-N 3.29Å; R61-K63 PolarHBondContact O-N 2.77Å; K63-S65 PolarHBondContact O-N 2.9Å
64R75.4Confident82.4Confident205 Ų205112.2 Ų112.277%0.77456%0.559SS**PPolyproline II helixtrans-61.9130161.6-159.4173.3-179.7115.31.5106.8
65S79.3Confident83Confident87 Ų87114.8 Ų114.861%0.60856%0.564SS**PPolyproline II helixtrans-55.5147.4172.152.30000108.6K63 K67K63-S65 PolarHBondContact O-N 2.9Å; S65-K67 PolarHBondContact O-N 2.87Å
66P83.3Confident83.8Confident122 Ų122116.2 Ų116.279%0.79257%0.568SS**PPolyproline II helixtrans-47.5136.5166.2-25.234.1000108.6S68P66-S68 PolarHBondContact O-N 3.19Å
67K85.2Confident84.6Confident80 Ų80120.6 Ų120.635%0.34858%0.578SS.*PPolyproline II helixtrans-57.1132.4-177.7-158.6168.1-151.4138.70109.7S65 E71 V72 E75S65-K67 PolarHBondContact O-N 2.87Å; K67-E71 HydrophobicContact CD-CB 4.12Å; K67-E71 HydrophobicContact CG-CB 3.6Å; K67-E71 HydrophobicContact CG-CG 4.49Å; K67-E71 WeakPolarHBondContact CG-OE2 3.48Å; K67-V72 HydrophobicContact CB-CG2 3.88Å; K67-V72 HydrophobicContact CD-CG2 3.71Å; K67-V72 HydrophobicContact CG-CG2 3.8Å; K67-E75 WeakPolarHBondContact CE-OE1 3.44Å; K67-E75 WeakPolarHBondContact CE-OE2 3.38Å; K67-E75 IonicContact NZ-OE1 2.53Å; K67-E75 PolarHBondContact NZ-OE1 2.97Å; K67-E75 IonicContact NZ-OE2 2.63Å; K67-E75 PolarHBondContact NZ-OE2 2.96Å
68S91.7Very high85.5Confident49 Ų49120.6 Ų120.634%0.34358%0.579SS.*PPolyproline II helixtrans-64150.9175.266.80000110P66 D70 E71 V72P66-S68 PolarHBondContact O-N 3.19Å; S68-D70 PolarHBondContact O-N 3.18Å; S68-E71 WeakPolarHBondContact CB-OE1 3.43Å; S68-E71 WeakPolarHBondContact O-CB 3.33Å; S68-E71 PolarHBondContact O-N 3.2Å; S68-E71 WeakPolarHBondContact OG-CB 3.28Å; S68-E71 WeakPolarHBondContact OG-CG 3.46Å; S68-E71 PolarHBondContact OG-N 2.82Å; S68-E71 PolarHBondContact OG-OE1 2.83Å; S68-V72 PolarHBondContact O-N 3.34Å; S68-V72 VanDerWaalsContact O-N 3.08Å
69R93.6Very high86.6Confident204 Ų204122 Ų12277%0.7758%0.58SS**Hα-helixtrans-59.9-34.9-179-172.4150.596133.5-2.2112V72 N73R69-V72 PolarHBondContact O-N 2.71Å; R69-N73 WeakPolarHBondContact O-CB 3.44Å; R69-N73 PolarHBondContact O-N 2.81Å; R69-N73 PolarHBondContact O-ND2 3.32Å
70D94.5Very high87.7Confident120 Ų120121 Ų12164%0.64258%0.581SS**Hα-helixtrans-68.4-41.3178.1-62.9-25.5000111.8S68 V72 N73 V74S68-D70 PolarHBondContact O-N 3.18Å; D70-V72 VanDerWaalsContact C-N 3.35Å; D70-V72 PolarHBondContact O-N 3.36Å; D70-N73 PolarHBondContact O-N 3.03Å; D70-V74 VanDerWaalsContact O-CG2 3.3Å; D70-V74 WeakPolarHBondContact O-CG2 3.43Å; D70-V74 PolarHBondContact O-N 2.84Å
71E93.8Very high89.1Confident82 Ų82117.9 Ų117.938%0.38357%0.569SS.*Hα-helixtrans-58.8-44.8172-80.2167.4-115.800111.8K67 S68 N73 V74 E75K67-E71 HydrophobicContact CD-CB 4.12Å; K67-E71 HydrophobicContact CG-CB 3.6Å; K67-E71 HydrophobicContact CG-CG 4.49Å; K67-E71 WeakPolarHBondContact CG-OE2 3.48Å; S68-E71 WeakPolarHBondContact CB-OE1 3.43Å; S68-E71 WeakPolarHBondContact O-CB 3.33Å; S68-E71 PolarHBondContact O-N 3.2Å; S68-E71 WeakPolarHBondContact OG-CB 3.28Å; S68-E71 WeakPolarHBondContact OG-CG 3.46Å; S68-E71 PolarHBondContact OG-N 2.82Å; S68-E71 PolarHBondContact OG-OE1 2.83Å; E71-N73 VanDerWaalsContact C-N 3.32Å; E71-N73 PolarHBondContact O-N 3.4Å; E71-V74 PolarHBondContact O-N 2.8Å; E71-E75 WeakPolarHBondContact O-CG 3.34Å; E71-E75 PolarHBondContact O-N 3.47Å
72V94.8Very high90.6Very high54 Ų54114.1 Ų114.133%0.32757%0.566SS.*Hα-helixtrans-60.9-43176.11760000111K67 S68 R69 D70 E75 N76K67-V72 HydrophobicContact CB-CG2 3.88Å; K67-V72 HydrophobicContact CD-CG2 3.71Å; K67-V72 HydrophobicContact CG-CG2 3.8Å; S68-V72 PolarHBondContact O-N 3.34Å; S68-V72 VanDerWaalsContact O-N 3.08Å; R69-V72 PolarHBondContact O-N 2.71Å; D70-V72 VanDerWaalsContact C-N 3.35Å; D70-V72 PolarHBondContact O-N 3.36Å; V72-E75 PolarHBondContact O-N 3.23Å; V72-N76 WeakPolarHBondContact O-CB 3.28Å; V72-N76 VanDerWaalsContact O-CG 3.25Å; V72-N76 PolarHBondContact O-N 2.83Å; V72-N76 PolarHBondContact O-ND2 3.16Å
73N96.4Very high91.9Very high70 Ų70112.7 Ų112.737%0.37454%0.542SS..Hα-helixtrans-64.4-42.1179-71.4-24000112.1R69 D70 E71 N76 R77R69-N73 WeakPolarHBondContact O-CB 3.44Å; R69-N73 PolarHBondContact O-N 2.81Å; R69-N73 PolarHBondContact O-ND2 3.32Å; D70-N73 PolarHBondContact O-N 3.03Å; E71-N73 VanDerWaalsContact C-N 3.32Å; E71-N73 PolarHBondContact O-N 3.4Å; N73-N76 PolarHBondContact O-N 3.25Å; N73-R77 WeakPolarHBondContact O-CG 3.03Å; N73-R77 PolarHBondContact O-N 3.03Å
74V96.5Very high93.3Very high76 Ų76108.7 Ų108.746%0.46153%0.526SS..Hα-helixtrans-63.9-43.1177171.30000110.9D70 E71 R77 Q78D70-V74 VanDerWaalsContact O-CG2 3.3Å; D70-V74 WeakPolarHBondContact O-CG2 3.43Å; D70-V74 PolarHBondContact O-N 2.84Å; E71-V74 PolarHBondContact O-N 2.8Å; V74-R77 WeakPolarHBondContact O-CB 3.39Å; V74-R77 PolarHBondContact O-N 3.02Å; V74-Q78 WeakPolarHBondContact O-CG 3.24Å; V74-Q78 PolarHBondContact O-N 3.19Å
75E95Very high94.3Very high91 Ų91104.2 Ų104.243%0.42552%0.517SS..Hα-helixtrans-65.8-41.4176.6-74.6-172.3167.300113K67 E71 V72 R77 Q78 K79K67-E75 WeakPolarHBondContact CE-OE1 3.44Å; K67-E75 WeakPolarHBondContact CE-OE2 3.38Å; K67-E75 IonicContact NZ-OE1 2.53Å; K67-E75 PolarHBondContact NZ-OE1 2.97Å; K67-E75 IonicContact NZ-OE2 2.63Å; K67-E75 PolarHBondContact NZ-OE2 2.96Å; E71-E75 WeakPolarHBondContact O-CG 3.34Å; E71-E75 PolarHBondContact O-N 3.47Å; V72-E75 PolarHBondContact O-N 3.23Å; E75-R77 VanDerWaalsContact C-N 3.28Å; E75-R77 PolarHBondContact O-N 3.39Å; E75-Q78 PolarHBondContact O-N 2.89Å; E75-Q78 VanDerWaalsContact O-N 3.16Å; E75-K79 WeakPolarHBondContact O-CB 3.29Å; E75-K79 PolarHBondContact O-N 3.36Å
76N97.1Very high95.2Very high82 Ų82106.7 Ų106.744%0.43951%0.513SS..Hα-helixtrans-60.6-40.5175.4-74.9-22.5000111.3V72 N73 K79 L80V72-N76 WeakPolarHBondContact O-CB 3.28Å; V72-N76 VanDerWaalsContact O-CG 3.25Å; V72-N76 PolarHBondContact O-N 2.83Å; V72-N76 PolarHBondContact O-ND2 3.16Å; N73-N76 PolarHBondContact O-N 3.25Å; N76-K79 PolarHBondContact O-N 3.32Å; N76-L80 VanDerWaalsContact O-CG 3.32Å; N76-L80 WeakPolarHBondContact O-CG 3.26Å; N76-L80 PolarHBondContact O-N 2.85Å
77R97.1Very high96Very high179 Ų179108.6 Ų108.668%0.67550%0.504SS*.Hα-helixtrans-62.3-42.8173.7-72.3174-179.8-172.40.2112.2N73 V74 E75 L80 R81N73-R77 WeakPolarHBondContact O-CG 3.03Å; N73-R77 PolarHBondContact O-N 3.03Å; V74-R77 WeakPolarHBondContact O-CB 3.39Å; V74-R77 PolarHBondContact O-N 3.02Å; E75-R77 VanDerWaalsContact C-N 3.28Å; E75-R77 PolarHBondContact O-N 3.39Å; R77-L80 PolarHBondContact O-N 2.94Å; R77-R81 WeakPolarHBondContact O-CG 3.31Å; R77-R81 PolarHBondContact O-N 2.87Å
78Q96.9Very high96.6Very high103 Ų103108.9 Ų108.948%0.48151%0.507SS..Hα-helixtrans-63.4-44.3176.1-72.3-178.3-6.200111.5V74 E75 L80 R81 V82V74-Q78 WeakPolarHBondContact O-CG 3.24Å; V74-Q78 PolarHBondContact O-N 3.19Å; E75-Q78 PolarHBondContact O-N 2.89Å; E75-Q78 VanDerWaalsContact O-N 3.16Å; Q78-L80 VanDerWaalsContact C-N 3.35Å; Q78-L80 PolarHBondContact O-N 2.84Å; Q78-R81 PolarHBondContact O-N 3.48Å; Q78-V82 WeakPolarHBondContact O-CG2 3.5Å; Q78-V82 PolarHBondContact O-N 2.92Å
79K97.2Very high96.9Very high158 Ų158112.5 Ų112.569%0.68751%0.514SS*.Hα-helixtrans-60.1-43.9177.2-176.2179.1178.3-176.40111.9E75 N76 V82 D83E75-K79 WeakPolarHBondContact O-CB 3.29Å; E75-K79 PolarHBondContact O-N 3.36Å; N76-K79 PolarHBondContact O-N 3.32Å; K79-V82 PolarHBondContact O-N 2.88Å; K79-D83 WeakPolarHBondContact O-CB 3.31Å; K79-D83 PolarHBondContact O-N 3.21Å
80L98Very high97.1Very high119 Ų119109.7 Ų109.762%0.62350%0.504SS*.Hα-helixtrans-62.7-44.8177.1-73.1172000111.7N76 R77 Q78 V82 D83 E84N76-L80 VanDerWaalsContact O-CG 3.32Å; N76-L80 WeakPolarHBondContact O-CG 3.26Å; N76-L80 PolarHBondContact O-N 2.85Å; R77-L80 PolarHBondContact O-N 2.94Å; Q78-L80 VanDerWaalsContact C-N 3.35Å; Q78-L80 PolarHBondContact O-N 2.84Å; L80-V82 PolarHBondContact O-N 3.1Å; L80-D83 PolarHBondContact O-N 3.34Å; L80-E84 WeakPolarHBondContact O-CB 3.2Å; L80-E84 PolarHBondContact O-N 3.48Å
81R98.1Very high97.3Very high155 Ų155109 Ų10959%0.58550%0.498SS*.Hα-helixtrans-61.7-41.6176.3-72.3-165.2-61.7-1733112.9R77 Q78 D83 E84 L85R77-R81 WeakPolarHBondContact O-CG 3.31Å; R77-R81 PolarHBondContact O-N 2.87Å; Q78-R81 PolarHBondContact O-N 3.48Å; R81-D83 VanDerWaalsContact C-N 3.32Å; R81-E84 PolarHBondContact O-N 2.85Å; R81-L85 WeakPolarHBondContact O-CB 3.25Å; R81-L85 VanDerWaalsContact O-CG 3.28Å; R81-L85 WeakPolarHBondContact O-CG 3.43Å; R81-L85 PolarHBondContact O-N 3.26Å
82V98Very high97.6Very high98 Ų98110.6 Ų110.659%0.59451%0.505SS*.Hα-helixtrans-66.6-37.31771730000111.1Q78 K79 L80 R86Q78-V82 WeakPolarHBondContact O-CG2 3.5Å; Q78-V82 PolarHBondContact O-N 2.92Å; K79-V82 PolarHBondContact O-N 2.88Å; L80-V82 PolarHBondContact O-N 3.1Å; V82-R86 WeakPolarHBondContact O-CB 3.45Å; V82-R86 PolarHBondContact O-N 3.49Å; V82-R86 VanDerWaalsContact O-N 3.15Å
83D98.1Very high97.7Very high38 Ų38112 Ų11220%0.20351%0.508CS..Hα-helixtrans-67.4-41.8175.5-165.857.5000112K79 L80 R81 R86 R87K79-D83 WeakPolarHBondContact O-CB 3.31Å; K79-D83 PolarHBondContact O-N 3.21Å; L80-D83 PolarHBondContact O-N 3.34Å; R81-D83 VanDerWaalsContact C-N 3.32Å; D83-R86 PolarHBondContact O-N 3.19Å; D83-R86 IonicContact OD1-CZ 3.64Å; D83-R86 IonicContact OD1-NE 3.77Å; D83-R86 IonicContact OD1-NH2 2.71Å; D83-R86 PolarHBondContact OD1-NH2 3.25Å; D83-R87 VanDerWaalsContact O-CG 3.32Å; D83-R87 WeakPolarHBondContact O-CG 3.47Å; D83-R87 PolarHBondContact O-N 2.99Å; D83-R87 IonicContact OD2-CZ 3.21Å; D83-R87 IonicContact OD2-NE 2.9Å; D83-R87 PolarHBondContact OD2-NE 3.46Å; D83-R87 IonicContact OD2-NH2 2.77Å; D83-R87 PolarHBondContact OD2-NH2 2.86Å
84E98.3Very high97.8Very high111 Ų111114.5 Ų114.552%0.51951%0.512SS..Hα-helixtrans-60.7-52.9176.3-174168-148.200111.4L80 R81 R86 R87 E88L80-E84 WeakPolarHBondContact O-CB 3.2Å; L80-E84 PolarHBondContact O-N 3.48Å; R81-E84 PolarHBondContact O-N 2.85Å; E84-R86 PolarHBondContact O-N 2.96Å; E84-R87 WeakPolarHBondContact O-CA 3.37Å; E84-R87 WeakPolarHBondContact O-CB 3.16Å; E84-R87 PolarHBondContact O-N 3.45Å; E84-E88 WeakPolarHBondContact O-CG 3.48Å; E84-E88 PolarHBondContact O-N 2.98Å
85L98.4Very high97.9Very high110 Ų110115.6 Ų115.658%0.57652%0.515SS*.Hα-helixtrans-56.2-38.3176-72.3171.6000112.7R81 Y89R81-L85 WeakPolarHBondContact O-CB 3.25Å; R81-L85 VanDerWaalsContact O-CG 3.28Å; R81-L85 WeakPolarHBondContact O-CG 3.43Å; R81-L85 PolarHBondContact O-N 3.26Å; L85-Y89 WeakPolarHBondContact O-CB 3.39Å; L85-Y89 PolarHBondContact O-N 3.09Å
86R98.2Very high98.1Very high139 Ų139116.6 Ų116.653%0.52552%0.52SS..Hα-helixtrans-69.3-37.7177.5-178.2175.261.7176.60111.6V82 D83 E84 Y90V82-R86 WeakPolarHBondContact O-CB 3.45Å; V82-R86 PolarHBondContact O-N 3.49Å; V82-R86 VanDerWaalsContact O-N 3.15Å; D83-R86 PolarHBondContact O-N 3.19Å; D83-R86 IonicContact OD1-CZ 3.64Å; D83-R86 IonicContact OD1-NE 3.77Å; D83-R86 IonicContact OD1-NH2 2.71Å; D83-R86 PolarHBondContact OD1-NH2 3.25Å; E84-R86 PolarHBondContact O-N 2.96Å; R86-Y90 HydrophobicContact CG-CD2 3.89Å; R86-Y90 HydrophobicContact CG-CE2 3.5Å; R86-Y90 WeakPolarHBondContact O-CD2 3.33Å; R86-Y90 PolarHBondContact O-N 2.99Å
87R98.5Very high98.1Very high162 Ų162119.2 Ų119.261%0.61153%0.528SS*.Hα-helixtrans-66.7-47.5175.4-72.1173-168.7-150.24110.9D83 E84 Y89 Y90 E91D83-R87 VanDerWaalsContact O-CG 3.32Å; D83-R87 WeakPolarHBondContact O-CG 3.47Å; D83-R87 PolarHBondContact O-N 2.99Å; D83-R87 IonicContact OD2-CZ 3.21Å; D83-R87 IonicContact OD2-NE 2.9Å; D83-R87 PolarHBondContact OD2-NE 3.46Å; D83-R87 IonicContact OD2-NH2 2.77Å; D83-R87 PolarHBondContact OD2-NH2 2.86Å; E84-R87 WeakPolarHBondContact O-CA 3.37Å; E84-R87 WeakPolarHBondContact O-CB 3.16Å; E84-R87 PolarHBondContact O-N 3.45Å; R87-Y89 VanDerWaalsContact C-N 3.3Å; R87-Y89 PolarHBondContact O-N 2.82Å; R87-Y90 PolarHBondContact O-N 3.25Å; R87-Y90 VanDerWaalsContact O-N 3.16Å; R87-E91 VanDerWaalsContact O-CB 3.28Å; R87-E91 WeakPolarHBondContact O-CB 3.46Å; R87-E91 PolarHBondContact O-N 3.39Å
88E98.4Very high98.2Very high87 Ų87115.2 Ų115.241%0.40752%0.517SS..Hα-helixtrans-54.6-47.9176.3-71.1173.3168.900110.5E84 Y90 E91 E92E84-E88 WeakPolarHBondContact O-CG 3.48Å; E84-E88 PolarHBondContact O-N 2.98Å; E88-Y90 PolarHBondContact O-N 2.98Å; E88-E91 PolarHBondContact O-N 3.31Å; E88-E92 WeakPolarHBondContact O-CB 3.38Å; E88-E92 WeakPolarHBondContact O-CG 3.46Å; E88-E92 PolarHBondContact O-N 2.86Å
89Y98.4Very high98.2Very high124 Ų124114.8 Ų114.849%0.48652%0.518SS..Hα-helixtrans-56.3-46.7176.3173.5-105.8000113.4L85 R87 Q93L85-Y89 WeakPolarHBondContact O-CB 3.39Å; L85-Y89 PolarHBondContact O-N 3.09Å; R87-Y89 VanDerWaalsContact C-N 3.3Å; R87-Y89 PolarHBondContact O-N 2.82Å; Y89-Q93 HydrophobicContact CD2-CG 4.49Å; Y89-Q93 HydrophobicContact CE1-CG 4.32Å; Y89-Q93 HydrophobicContact CE2-CG 4.06Å; Y89-Q93 WeakPolarHBondContact O-CB 3.44Å; Y89-Q93 VanDerWaalsContact O-CG 3.26Å; Y89-Q93 WeakPolarHBondContact O-CG 3.39Å; Y89-Q93 PolarHBondContact O-N 3.47Å
90Y98.3Very high98.3Very high145 Ų145112.7 Ų112.757%0.56951%0.509SS*.Hα-helixtrans-74-28.6179.5-70.8-56.5000113.2R86 R87 E88 R94R86-Y90 HydrophobicContact CG-CD2 3.89Å; R86-Y90 HydrophobicContact CG-CE2 3.5Å; R86-Y90 WeakPolarHBondContact O-CD2 3.33Å; R86-Y90 PolarHBondContact O-N 2.99Å; R87-Y90 PolarHBondContact O-N 3.25Å; R87-Y90 VanDerWaalsContact O-N 3.16Å; E88-Y90 PolarHBondContact O-N 2.98Å; Y90-R94 WeakPolarHBondContact O-CB 3.49Å; Y90-R94 PolarHBondContact O-N 3.34Å
91E98.5Very high98.3Very high107 Ų107109.7 Ų109.750%0.550%0.495SS..Hα-helixtrans-69.5-44.3174177.7151.4-126.700111.3R87 E88 R94 N95R87-E91 VanDerWaalsContact O-CB 3.28Å; R87-E91 WeakPolarHBondContact O-CB 3.46Å; R87-E91 PolarHBondContact O-N 3.39Å; E88-E91 PolarHBondContact O-N 3.31Å; E91-R94 PolarHBondContact O-N 2.9Å; E91-R94 IonicContact OE1-NH2 3.23Å; E91-R94 PolarHBondContact OE1-NH2 2.84Å; E91-N95 VanDerWaalsContact O-CB 3.24Å; E91-N95 WeakPolarHBondContact O-CB 3.47Å; E91-N95 PolarHBondContact O-N 3.39Å
92E98.5Very high98.3Very high114 Ų114108.1 Ų108.153%0.53350%0.495SS..Hα-helixtrans-58.7-49.6171.5-74.2177.2173.600111E88 R94 N95 E96E88-E92 WeakPolarHBondContact O-CB 3.38Å; E88-E92 WeakPolarHBondContact O-CG 3.46Å; E88-E92 PolarHBondContact O-N 2.86Å; E92-R94 VanDerWaalsContact C-N 3.3Å; E92-R94 PolarHBondContact O-N 3.44Å; E92-N95 PolarHBondContact O-N 3.2Å; E92-E96 WeakPolarHBondContact O-CB 3.31Å; E92-E96 VanDerWaalsContact O-CG 3.29Å; E92-E96 WeakPolarHBondContact O-CG 3.4Å; E92-E96 PolarHBondContact O-N 3Å
93Q98.6Very high98.3Very high85 Ų85108.2 Ų108.240%0.39749%0.489SS..Hα-helixtrans-59.4-39.5177.9-74.1-66-70.100113Y89 E96 F97Y89-Q93 HydrophobicContact CD2-CG 4.49Å; Y89-Q93 HydrophobicContact CE1-CG 4.32Å; Y89-Q93 HydrophobicContact CE2-CG 4.06Å; Y89-Q93 WeakPolarHBondContact O-CB 3.44Å; Y89-Q93 VanDerWaalsContact O-CG 3.26Å; Y89-Q93 WeakPolarHBondContact O-CG 3.39Å; Y89-Q93 PolarHBondContact O-N 3.47Å; Q93-E96 PolarHBondContact NE2-OE2 2.96Å; Q93-F97 PolarHBondContact O-N 3.27Å
94R98.5Very high98.3Very high121 Ų121109.7 Ų109.746%0.45749%0.494SS..Hα-helixtrans-67.8-46.5176.1-176.4-175.866.2-118.3-3110.9Y90 E91 E92 F97 E98Y90-R94 WeakPolarHBondContact O-CB 3.49Å; Y90-R94 PolarHBondContact O-N 3.34Å; E91-R94 PolarHBondContact O-N 2.9Å; E91-R94 IonicContact OE1-NH2 3.23Å; E91-R94 PolarHBondContact OE1-NH2 2.84Å; E92-R94 VanDerWaalsContact C-N 3.3Å; E92-R94 PolarHBondContact O-N 3.44Å; R94-F97 PolarHBondContact O-N 3.47Å; R94-E98 WeakPolarHBondContact CD-OE1 3.35Å; R94-E98 HydrophobicContact CG-CG 4.34Å; R94-E98 WeakPolarHBondContact CG-OE1 3.42Å; R94-E98 IonicContact NE-OE1 2.87Å; R94-E98 WeakPolarHBondContact O-CB 3.3Å; R94-E98 WeakPolarHBondContact O-CG 3.45Å; R94-E98 PolarHBondContact O-N 3.37Å
95N98.4Very high98.3Very high99 Ų99108.8 Ų108.853%0.52949%0.493SS..Hα-helixtrans-64.1-40.2-179.4-172.154.2000111.8E91 E92 F97 E98 N99E91-N95 VanDerWaalsContact O-CB 3.24Å; E91-N95 WeakPolarHBondContact O-CB 3.47Å; E91-N95 PolarHBondContact O-N 3.39Å; E92-N95 PolarHBondContact O-N 3.2Å; N95-F97 VanDerWaalsContact C-N 3.34Å; N95-F97 PolarHBondContact O-N 3.31Å; N95-E98 PolarHBondContact O-N 2.96Å; N95-N99 WeakPolarHBondContact O-CB 3.16Å; N95-N99 PolarHBondContact O-N 3.48Å
96E98.4Very high98.2Very high112 Ų112108.2 Ų108.252%0.52349%0.49SS..Hα-helixtrans-59.2-44.9172.6-76174.3-178.500111.5E92 Q93 F100E92-E96 WeakPolarHBondContact O-CB 3.31Å; E92-E96 VanDerWaalsContact O-CG 3.29Å; E92-E96 WeakPolarHBondContact O-CG 3.4Å; E92-E96 PolarHBondContact O-N 3Å; Q93-E96 PolarHBondContact NE2-OE2 2.96Å; E96-F100 WeakPolarHBondContact O-CB 3.36Å; E96-F100 PolarHBondContact O-N 3.35Å
97F98.2Very high98.2Very high138 Ų138105.3 Ų105.361%0.60548%0.483SS*.Hα-helixtrans-68.7-43.8178.7-179.6-98.3000112.7Q93 R94 N95 F100 V101Q93-F97 PolarHBondContact O-N 3.27Å; R94-F97 PolarHBondContact O-N 3.47Å; N95-F97 VanDerWaalsContact C-N 3.34Å; N95-F97 PolarHBondContact O-N 3.31Å; F97-F100 PolarHBondContact O-N 2.89Å; F97-V101 HydrophobicContact CD1-CG2 4.32Å; F97-V101 HydrophobicContact CE1-CG2 3.86Å; F97-V101 HydrophobicContact CE2-CG2 4.17Å; F97-V101 HydrophobicContact CZ-CG2 3.77Å; F97-V101 WeakPolarHBondContact O-CG2 3.29Å; F97-V101 PolarHBondContact O-N 3.21Å
98E98.1Very high98.1Very high94 Ų94103.1 Ų103.144%0.43948%0.48SS..Hα-helixtrans-60.4-47.5175.9-75.8172.5179.700110.5R94 N95 F100 V101 E102R94-E98 WeakPolarHBondContact CD-OE1 3.35Å; R94-E98 HydrophobicContact CG-CG 4.34Å; R94-E98 WeakPolarHBondContact CG-OE1 3.42Å; R94-E98 IonicContact NE-OE1 2.87Å; R94-E98 WeakPolarHBondContact O-CB 3.3Å; R94-E98 WeakPolarHBondContact O-CG 3.45Å; R94-E98 PolarHBondContact O-N 3.37Å; N95-E98 PolarHBondContact O-N 2.96Å; E98-F100 PolarHBondContact O-N 3.39Å; E98-V101 PolarHBondContact O-N 2.92Å; E98-E102 WeakPolarHBondContact O-CG 3.44Å; E98-E102 PolarHBondContact O-N 3.44Å
99N98.2Very high98Very high95 Ų95105.6 Ų105.651%0.50849%0.491SS..Hα-helixtrans-61.9-41.6177.2-167.225.3000112.1N95 V101 E102 E103N95-N99 WeakPolarHBondContact O-CB 3.16Å; N95-N99 PolarHBondContact O-N 3.48Å; N99-V101 PolarHBondContact O-N 2.88Å; N99-E102 PolarHBondContact O-N 2.85Å; N99-E103 VanDerWaalsContact O-CB 3.29Å; N99-E103 WeakPolarHBondContact O-CB 3.21Å; N99-E103 PolarHBondContact O-N 2.87Å
100F98.3Very high98Very high113 Ų113104.8 Ų104.850%0.49649%0.492SS..Hα-helixtrans-61.9-42.3175.1172.5-103000112.5E96 F97 E98 Q104E96-F100 WeakPolarHBondContact O-CB 3.36Å; E96-F100 PolarHBondContact O-N 3.35Å; F97-F100 PolarHBondContact O-N 2.89Å; E98-F100 PolarHBondContact O-N 3.39Å; F100-Q104 HydrophobicContact CD1-CG 4.5Å; F100-Q104 HydrophobicContact CD2-CG 4.26Å; F100-Q104 HydrophobicContact CE1-CG 4.04Å; F100-Q104 HydrophobicContact CE2-CG 3.78Å; F100-Q104 HydrophobicContact CZ-CG 3.65Å; F100-Q104 WeakPolarHBondContact O-CB 2.83Å; F100-Q104 VanDerWaalsContact O-CG 3.3Å; F100-Q104 WeakPolarHBondContact O-CG 3.48Å; F100-Q104 PolarHBondContact O-N 2.89Å
101V98.2Very high97.9Very high56 Ų56104.7 Ų104.734%0.33949%0.49SS..Hα-helixtrans-67.9-41178.5170.90000111.1F97 E98 N99 N105F97-V101 HydrophobicContact CD1-CG2 4.32Å; F97-V101 HydrophobicContact CE1-CG2 3.86Å; F97-V101 HydrophobicContact CE2-CG2 4.17Å; F97-V101 HydrophobicContact CZ-CG2 3.77Å; F97-V101 WeakPolarHBondContact O-CG2 3.29Å; F97-V101 PolarHBondContact O-N 3.21Å; E98-V101 PolarHBondContact O-N 2.92Å; N99-V101 PolarHBondContact O-N 2.88Å; V101-N105 VanDerWaalsContact O-CG 3.26Å; V101-N105 PolarHBondContact O-N 2.65Å; V101-N105 VanDerWaalsContact O-N 3.07Å; V101-N105 PolarHBondContact O-ND2 2.84Å; V101-N105 VanDerWaalsContact O-ND2 3.13Å
102E98Very high97.7Very high122 Ų122102.9 Ų102.957%0.5749%0.49SS*.Hα-helixtrans-61.9-49.4173.9-74.2-172.4172.200111.2E98 N99 Q104 N105 D106E98-E102 WeakPolarHBondContact O-CG 3.44Å; E98-E102 PolarHBondContact O-N 3.44Å; N99-E102 PolarHBondContact O-N 2.85Å; E102-Q104 VanDerWaalsContact C-N 3.33Å; E102-Q104 PolarHBondContact O-N 3.22Å; E102-N105 PolarHBondContact O-N 3.13Å; E102-N105 VanDerWaalsContact O-N 3.09Å; E102-D106 WeakPolarHBondContact O-CB 3.41Å; E102-D106 PolarHBondContact O-N 3.07Å
103E98.1Very high97.5Very high100 Ų100103.1 Ų103.147%0.46749%0.486SS..Hα-helixtrans-58.8-42.4177.7-172.7173.5-153.300111.7N99 N105 D106 E107N99-E103 VanDerWaalsContact O-CB 3.29Å; N99-E103 WeakPolarHBondContact O-CB 3.21Å; N99-E103 PolarHBondContact O-N 2.87Å; E103-N105 PolarHBondContact O-N 2.81Å; E103-D106 PolarHBondContact O-N 3.2Å; E103-E107 HydrophobicContact CG-CG 4.39Å; E103-E107 VanDerWaalsContact O-CB 3.25Å; E103-E107 WeakPolarHBondContact O-CB 3.26Å; E103-E107 WeakPolarHBondContact O-CG 3.37Å; E103-E107 PolarHBondContact O-N 2.94Å
104Q98.2Very high97.3Very high70 Ų70104 Ų10433%0.32749%0.49SS..Hα-helixtrans-64.7-37.4176-74.5-57.2-74.700113.4F100 E102 E107 Q108F100-Q104 HydrophobicContact CD1-CG 4.5Å; F100-Q104 HydrophobicContact CD2-CG 4.26Å; F100-Q104 HydrophobicContact CE1-CG 4.04Å; F100-Q104 HydrophobicContact CE2-CG 3.78Å; F100-Q104 HydrophobicContact CZ-CG 3.65Å; F100-Q104 WeakPolarHBondContact O-CB 2.83Å; F100-Q104 VanDerWaalsContact O-CG 3.3Å; F100-Q104 WeakPolarHBondContact O-CG 3.48Å; F100-Q104 PolarHBondContact O-N 2.89Å; E102-Q104 VanDerWaalsContact C-N 3.33Å; E102-Q104 PolarHBondContact O-N 3.22Å; Q104-E107 PolarHBondContact NE2-OE2 3.34Å; Q104-Q108 VanDerWaalsContact O-CB 3.26Å; Q104-Q108 WeakPolarHBondContact O-CB 3.25Å; Q104-Q108 PolarHBondContact O-N 3.47Å
105N97.8Very high97.1Very high91 Ų91101.1 Ų101.149%0.48749%0.492SS..Hα-helixtrans-69.2-46176.8-72.2-31.7000111V101 E102 E103 Q108 E109V101-N105 VanDerWaalsContact O-CG 3.26Å; V101-N105 PolarHBondContact O-N 2.65Å; V101-N105 VanDerWaalsContact O-N 3.07Å; V101-N105 PolarHBondContact O-ND2 2.84Å; V101-N105 VanDerWaalsContact O-ND2 3.13Å; E102-N105 PolarHBondContact O-N 3.13Å; E102-N105 VanDerWaalsContact O-N 3.09Å; E103-N105 PolarHBondContact O-N 2.81Å; N105-Q108 PolarHBondContact O-N 3.04Å; N105-E109 WeakPolarHBondContact O-CB 3.22Å; N105-E109 PolarHBondContact O-N 2.93Å
106D97.6Very high96.7Very high98 Ų9899.3 Ų99.352%0.52448%0.484SS..Hα-helixtrans-63.2-47.1178.6-74.2-4.9000110.9E102 E103 Q108 E109 E110E102-D106 WeakPolarHBondContact O-CB 3.41Å; E102-D106 PolarHBondContact O-N 3.07Å; E103-D106 PolarHBondContact O-N 3.2Å; D106-Q108 VanDerWaalsContact C-N 3.29Å; D106-Q108 PolarHBondContact O-N 3.11Å; D106-E109 PolarHBondContact O-N 3.45Å; D106-E110 WeakPolarHBondContact O-CB 3.31Å; D106-E110 WeakPolarHBondContact O-CG 3.24Å; D106-E110 PolarHBondContact O-N 2.9Å
107E97.5Very high96.1Very high78 Ų7897.3 Ų97.336%0.36448%0.475SS..Hα-helixtrans-58-41.5173.9-77.9-178.2172.800111.6E103 Q104 R111E103-E107 HydrophobicContact CG-CG 4.39Å; E103-E107 VanDerWaalsContact O-CB 3.25Å; E103-E107 WeakPolarHBondContact O-CB 3.26Å; E103-E107 WeakPolarHBondContact O-CG 3.37Å; E103-E107 PolarHBondContact O-N 2.94Å; Q104-E107 PolarHBondContact NE2-OE2 3.34Å; E107-R111 WeakPolarHBondContact O-CB 3.42Å; E107-R111 WeakPolarHBondContact O-CG 3.47Å; E107-R111 PolarHBondContact O-N 3.01Å
108Q97.1Very high95.8Very high117 Ų11796.6 Ų96.655%0.54747%0.474SS..Hα-helixtrans-66.5-42.9177.5-178.9172.9-0.700111.9Q104 N105 D106 S112Q104-Q108 VanDerWaalsContact O-CB 3.26Å; Q104-Q108 WeakPolarHBondContact O-CB 3.25Å; Q104-Q108 PolarHBondContact O-N 3.47Å; N105-Q108 PolarHBondContact O-N 3.04Å; D106-Q108 VanDerWaalsContact C-N 3.29Å; D106-Q108 PolarHBondContact O-N 3.11Å; Q108-S112 WeakPolarHBondContact O-CB 3.39Å; Q108-S112 PolarHBondContact O-N 3.42Å
109E96.6Very high95.4Very high138 Ų138100 Ų10065%0.64548%0.482SS*.Hα-helixtrans-63.7-44.4176.8-175.6170176.300111N105 D106 S112 R113N105-E109 WeakPolarHBondContact O-CB 3.22Å; N105-E109 PolarHBondContact O-N 2.93Å; D106-E109 PolarHBondContact O-N 3.45Å; E109-S112 WeakPolarHBondContact O-CB 3.34Å; E109-S112 PolarHBondContact O-N 2.96Å; E109-R113 VanDerWaalsContact O-CB 3.3Å; E109-R113 WeakPolarHBondContact O-CB 3.44Å; E109-R113 PolarHBondContact O-N 3.11Å
110E97.1Very high94.8Very high108 Ų108101.2 Ų101.251%0.50548%0.48SS..Hα-helixtrans-62.5-49.1176.2-74.5-161.5156.400111.8D106 S112 R113 E114D106-E110 WeakPolarHBondContact O-CB 3.31Å; D106-E110 WeakPolarHBondContact O-CG 3.24Å; D106-E110 PolarHBondContact O-N 2.9Å; E110-S112 VanDerWaalsContact C-N 3.25Å; E110-S112 PolarHBondContact O-N 3.45Å; E110-R113 WeakPolarHBondContact O-CB 3.5Å; E110-R113 PolarHBondContact O-N 2.9Å; E110-R113 VanDerWaalsContact O-N 3.15Å; E110-E114 WeakPolarHBondContact O-CB 3.22Å; E110-E114 WeakPolarHBondContact O-CG 3.47Å; E110-E114 PolarHBondContact O-N 3.37Å
111R96.6Very high94.1Very high142 Ų142101.9 Ų101.954%0.53649%0.485SS..Hα-helixtrans-57.9-40.6175.2-73.8-177.3-42.9-151.10.9111.9E107 A115E107-R111 WeakPolarHBondContact O-CB 3.42Å; E107-R111 WeakPolarHBondContact O-CG 3.47Å; E107-R111 PolarHBondContact O-N 3.01Å; R111-A115 VanDerWaalsContact O-CB 3.26Å; R111-A115 WeakPolarHBondContact O-CB 3.41Å; R111-A115 PolarHBondContact O-N 3.47Å
112S94.7Very high93.6Very high70 Ų70108.9 Ų108.949%0.4951%0.505SS..Hα-helixtrans-64.7-48.1177.2-170.90000110.5Q108 E109 E110 E114 A115 V116Q108-S112 WeakPolarHBondContact O-CB 3.39Å; Q108-S112 PolarHBondContact O-N 3.42Å; E109-S112 WeakPolarHBondContact O-CB 3.34Å; E109-S112 PolarHBondContact O-N 2.96Å; E110-S112 VanDerWaalsContact C-N 3.25Å; E110-S112 PolarHBondContact O-N 3.45Å; S112-E114 PolarHBondContact O-N 3.15Å; S112-A115 PolarHBondContact O-N 2.81Å; S112-V116 VanDerWaalsContact O-CG2 3.25Å; S112-V116 WeakPolarHBondContact O-CG2 3.35Å; S112-V116 PolarHBondContact O-N 3.3Å
113R93.8Very high92.8Very high118 Ų118106.8 Ų106.845%0.44550%0.495SS..Hα-helixtrans-58.3-48.4178.4-174.8176.46982.5-2.2111.3E109 E110 V116 E117E109-R113 VanDerWaalsContact O-CB 3.3Å; E109-R113 WeakPolarHBondContact O-CB 3.44Å; E109-R113 PolarHBondContact O-N 3.11Å; E110-R113 WeakPolarHBondContact O-CB 3.5Å; E110-R113 PolarHBondContact O-N 2.9Å; E110-R113 VanDerWaalsContact O-N 3.15Å; R113-V116 PolarHBondContact O-N 3.45Å; R113-E117 WeakPolarHBondContact CG-OE1 3.4Å; R113-E117 IonicContact CZ-OE1 3.93Å; R113-E117 IonicContact NH1-OE1 3.57Å; R113-E117 PolarHBondContact NH1-OE1 2.89Å; R113-E117 IonicContact NH1-OE2 3.91Å; R113-E117 WeakPolarHBondContact O-CB 3.43Å; R113-E117 WeakPolarHBondContact O-CG 3.2Å; R113-E117 PolarHBondContact O-N 2.81Å
114E94.5Very high91.8Very high104 Ų104109.4 Ų109.449%0.48650%0.502SS..Hα-helixtrans-60.4-48.4176.2-73.2-176.5170.100111.5E110 S112 V116 E117 Q118E110-E114 WeakPolarHBondContact O-CB 3.22Å; E110-E114 WeakPolarHBondContact O-CG 3.47Å; E110-E114 PolarHBondContact O-N 3.37Å; S112-E114 PolarHBondContact O-N 3.15Å; E114-V116 VanDerWaalsContact C-N 3.3Å; E114-V116 PolarHBondContact O-N 3.27Å; E114-E117 CarbonylContact O-C 3.45Å; E114-E117 PolarHBondContact O-N 2.78Å; E114-E117 VanDerWaalsContact O-N 3.14Å; E114-Q118 WeakPolarHBondContact O-CB 3.3Å; E114-Q118 WeakPolarHBondContact O-CG 3.49Å; E114-Q118 PolarHBondContact O-N 2.8Å
115A93.5Very high90.9Very high61 Ų61112 Ų11250%0.50452%0.518SS..Hα-helixtrans-59-41.8179.200000112.1R111 S112 Q118 W119R111-A115 VanDerWaalsContact O-CB 3.26Å; R111-A115 WeakPolarHBondContact O-CB 3.41Å; R111-A115 PolarHBondContact O-N 3.47Å; S112-A115 PolarHBondContact O-N 2.81Å; A115-Q118 PolarHBondContact O-N 2.93Å; A115-W119 WeakPolarHBondContact O-CB 3.33Å; A115-W119 PolarHBondContact O-N 2.93Å
116V89.9Confident89.9Confident60 Ų60110 Ų11036%0.36452%0.519SS..Hα-helixtrans-69.8-38.7177.1-174.60000110.9S112 R113 E114 R120S112-V116 VanDerWaalsContact O-CG2 3.25Å; S112-V116 WeakPolarHBondContact O-CG2 3.35Å; S112-V116 PolarHBondContact O-N 3.3Å; R113-V116 PolarHBondContact O-N 3.45Å; E114-V116 VanDerWaalsContact C-N 3.3Å; E114-V116 PolarHBondContact O-N 3.27Å; V116-R120 VanDerWaalsContact CG1-NH2 3.26Å; V116-R120 WeakPolarHBondContact O-CB 3.25Å; V116-R120 VanDerWaalsContact O-CG 3.25Å; V116-R120 WeakPolarHBondContact O-CG 3.32Å; V116-R120 PolarHBondContact O-N 2.94Å; V116-R120 PolarHBondContact O-NE 2.98Å
117E86.8Confident88.8Confident70 Ų70112.3 Ų112.333%0.32753%0.531SS..Hα-helixtrans-64-42.5173.5-75.4174.7-163.500112.6R113 E114 R120 Q121R113-E117 WeakPolarHBondContact CG-OE1 3.4Å; R113-E117 IonicContact CZ-OE1 3.93Å; R113-E117 IonicContact NH1-OE1 3.57Å; R113-E117 PolarHBondContact NH1-OE1 2.89Å; R113-E117 IonicContact NH1-OE2 3.91Å; R113-E117 WeakPolarHBondContact O-CB 3.43Å; R113-E117 WeakPolarHBondContact O-CG 3.2Å; R113-E117 PolarHBondContact O-N 2.81Å; E114-E117 CarbonylContact O-C 3.45Å; E114-E117 PolarHBondContact O-N 2.78Å; E114-E117 VanDerWaalsContact O-N 3.14Å; E117-R120 PolarHBondContact O-N 3.14Å; E117-Q121 WeakPolarHBondContact O-CG 3.46Å; E117-Q121 PolarHBondContact O-N 3.27Å
118Q91.3Very high87.3Confident123 Ų123115.8 Ų115.858%0.57555%0.547SS*.Hα-helixtrans-63.5-48.3176.4-70-67.5-21.400111.6E114 A115 R120 Q121 W122E114-Q118 WeakPolarHBondContact O-CB 3.3Å; E114-Q118 WeakPolarHBondContact O-CG 3.49Å; E114-Q118 PolarHBondContact O-N 2.8Å; A115-Q118 PolarHBondContact O-N 2.93Å; Q118-R120 VanDerWaalsContact C-N 3.26Å; Q118-R120 PolarHBondContact O-N 3.02Å; Q118-Q121 PolarHBondContact O-N 3.33Å; Q118-W122 PolarHBondContact O-N 2.76Å
119W90.3Very high85.9Confident165 Ų165116 Ų11663%0.62556%0.558SS**Hα-helixtrans-60-39.2176.4-170.480.2000111.6A115 W122 H123A115-W119 WeakPolarHBondContact O-CB 3.33Å; A115-W119 PolarHBondContact O-N 2.93Å; W119-W122 PolarHBondContact O-N 2.91Å; W119-H123 AromaticContact CD1-CD2 3.98Å; W119-H123 AromaticContact CD2-CD2 3.64Å; W119-H123 AromaticContact CE2-CD2 3.21Å; W119-H123 AromaticContact CE2-NE2 3.4Å; W119-H123 AromaticContact CH2-CD2 3.95Å; W119-H123 AromaticContact CZ2-CD2 3.4Å; W119-H123 WeakPolarHBondContact CZ2-CD2 3.26Å; W119-H123 AromaticContact CZ2-NE2 3.42Å; W119-H123 WeakPolarHBondContact CZ2-NE2 3.32Å; W119-H123 AromaticContact NE1-CD2 3.43Å; W119-H123 PolarHBondContact NE1-CD2 3.24Å; W119-H123 AromaticContact NE1-NE2 3.34Å; W119-H123 PolarHBondContact NE1-NE2 3.26Å; W119-H123 PolarHBondContact O-CD2 3.49Å; W119-H123 PolarHBondContact O-N 3.35Å; W119-H123 VanDerWaalsContact O-N 3.09Å
120R84.9Confident84.4Confident122 Ų122113.5 Ų113.546%0.4656%0.556SS.*Hα-helixtrans-65.6-42175-80.5-174.5-77.6-135.23.6113.2V116 E117 Q118 W122 H123 Y124V116-R120 VanDerWaalsContact CG1-NH2 3.26Å; V116-R120 WeakPolarHBondContact O-CB 3.25Å; V116-R120 VanDerWaalsContact O-CG 3.25Å; V116-R120 WeakPolarHBondContact O-CG 3.32Å; V116-R120 PolarHBondContact O-N 2.94Å; V116-R120 PolarHBondContact O-NE 2.98Å; E117-R120 PolarHBondContact O-N 3.14Å; Q118-R120 VanDerWaalsContact C-N 3.26Å; Q118-R120 PolarHBondContact O-N 3.02Å; R120-W122 VanDerWaalsContact C-N 3.32Å; R120-H123 CarbonylContact O-C 3.52Å; R120-H123 PolarHBondContact O-N 3.33Å; R120-Y124 PolarHBondContact O-N 3.34Å; R120-Y124 VanDerWaalsContact O-N 3.12Å
121Q84Confident82.8Confident127 Ų127115.3 Ų115.359%0.59356%0.559SS**Hα-helixtrans-63.3-39.9175.4-74.5175.441.600111.5E117 Q118 H123 Y124E117-Q121 WeakPolarHBondContact O-CG 3.46Å; E117-Q121 PolarHBondContact O-N 3.27Å; Q118-Q121 PolarHBondContact O-N 3.33Å; Q121-H123 VanDerWaalsContact C-N 3.34Å; Q121-H123 PolarHBondContact O-N 3.48Å; Q121-Y124 WeakPolarHBondContact O-CB 3.25Å; Q121-Y124 PolarHBondContact O-N 3.21Å
122W86.4Confident81.1Confident203 Ų203115.6 Ų115.677%0.76957%0.571SS**Hα-helixtrans-65.2-37.4178-166.377.5000112.7Q118 W119 R120Q118-W122 PolarHBondContact O-N 2.76Å; W119-W122 PolarHBondContact O-N 2.91Å; R120-W122 VanDerWaalsContact C-N 3.32Å
123H82.5Confident79.5Confident78 Ų78120.1 Ų120.136%0.36158%0.578SS.*THydrogen-bonded Turntrans-92.216.1177.1-77.2-70.1000114.6W119 R120 Q121 D125W119-H123 AromaticContact CD1-CD2 3.98Å; W119-H123 AromaticContact CD2-CD2 3.64Å; W119-H123 AromaticContact CE2-CD2 3.21Å; W119-H123 AromaticContact CE2-NE2 3.4Å; W119-H123 AromaticContact CH2-CD2 3.95Å; W119-H123 AromaticContact CZ2-CD2 3.4Å; W119-H123 WeakPolarHBondContact CZ2-CD2 3.26Å; W119-H123 AromaticContact CZ2-NE2 3.42Å; W119-H123 WeakPolarHBondContact CZ2-NE2 3.32Å; W119-H123 AromaticContact NE1-CD2 3.43Å; W119-H123 PolarHBondContact NE1-CD2 3.24Å; W119-H123 AromaticContact NE1-NE2 3.34Å; W119-H123 PolarHBondContact NE1-NE2 3.26Å; W119-H123 PolarHBondContact O-CD2 3.49Å; W119-H123 PolarHBondContact O-N 3.35Å; W119-H123 VanDerWaalsContact O-N 3.09Å; R120-H123 CarbonylContact O-C 3.52Å; R120-H123 PolarHBondContact O-N 3.33Å; Q121-H123 VanDerWaalsContact C-N 3.34Å; Q121-H123 PolarHBondContact O-N 3.48Å; H123-D125 PolarHBondContact O-N 2.97Å
124Y77.2Confident77.7Confident154 Ų154120.1 Ų120.160%0.60459%0.587SS**  trans-76.288.5-176.7-172.1-108.2000111.7R120 Q121 G126R120-Y124 PolarHBondContact O-N 3.34Å; R120-Y124 VanDerWaalsContact O-N 3.12Å; Q121-Y124 WeakPolarHBondContact O-CB 3.25Å; Q121-Y124 PolarHBondContact O-N 3.21Å; Y124-G126 VanDerWaalsContact C-N 3.26Å; Y124-G126 PolarHBondContact O-N 2.96Å
125D79Confident75.8Confident125 Ų125123.8 Ų123.867%0.66860%0.596SS**  trans-82.84.2179.2-64.8-20000113.6H123 L127H123-D125 PolarHBondContact O-N 2.97Å; D125-L127 HydrophobicContact CB-CD1 4.25Å; D125-L127 PolarHBondContact O-N 3.5Å
126G76.5Confident74.2Confident50 Ų50128.1 Ų128.152%0.51561%0.606SS.*SBendtrans70.1-5.8-177.100000115.8Y124Y124-G126 VanDerWaalsContact C-N 3.26Å; Y124-G126 PolarHBondContact O-N 2.96Å
127L74.4Confident72.3Confident146 Ų146132.9 Ų132.976%0.76462%0.624SS**  trans-79.7-18.5-179.7-81.9149.4000114.1D125D125-L127 HydrophobicContact CB-CD1 4.25Å; D125-L127 PolarHBondContact O-N 3.5Å
128H66.8Low70.7Confident151 Ų151138.9 Ų138.970%0.69967%0.666SS**SBendtrans-106.2133.5179.5-69-68.6000110.7S130H128-S130 PolarHBondContact O-N 3.39Å
129P67.7Low69.7Low120 Ų120139.7 Ų139.778%0.77967%0.67SS**  trans-58.8141.3176.523.2-30.8000110Y131P129-Y131 PolarHBondContact O-N 3.05Å
130S65.1Low68.6Low86 Ų86138.4 Ų138.460%0.60167%0.673SS**  trans-53.6129.8171.659.80000108.4H128 L132H128-S130 PolarHBondContact O-N 3.39Å; S130-L132 PolarHBondContact O-N 2.92Å
131Y63.6Low67.7Low146 Ų146139.3 Ų139.357%0.57368%0.684SS**  trans-49.7110.3176.9135.1-93.3000108.8P129 Y133P129-Y131 PolarHBondContact O-N 3.05Å; Y131-Y133 AromaticContact CE1-CD2 3.68Å; Y131-Y133 HydrophobicContact CE1-CD2 3.68Å; Y131-Y133 HydrophobicContact CE1-CE2 4.49Å; Y131-Y133 HydrophobicContact CE1-CG 4.22Å; Y131-Y133 VanDerWaalsContact CZ-CA 3.43Å; Y131-Y133 AromaticContact CZ-CD2 3.55Å; Y131-Y133 AromaticContact CZ-CG 3.84Å; Y131-Y133 PolarHBondContact O-N 3.12Å; Y131-Y133 VanDerWaalsContact O-N 3.11Å; Y131-Y133 WeakPolarHBondContact OH-CD2 3.37Å; Y131-Y133 WeakPolarHBondContact OH-CE2 3.38Å; Y131-Y133 VanDerWaalsContact OH-CG 3.24Å
132L60.8Low66.7Low149 Ų149140 Ų14078%0.7869%0.69SS**  trans-66.7111.4163.8-74.1167.7000103.9S130 N134S130-L132 PolarHBondContact O-N 2.92Å; L132-N134 PolarHBondContact O-N 3.4Å
133Y59.9Low65.5Low164 Ų164136.1 Ų136.164%0.64369%0.685SS**  trans-44.8106.5171.9-158.5-79.2000107Y131 R135Y131-Y133 AromaticContact CE1-CD2 3.68Å; Y131-Y133 HydrophobicContact CE1-CD2 3.68Å; Y131-Y133 HydrophobicContact CE1-CE2 4.49Å; Y131-Y133 HydrophobicContact CE1-CG 4.22Å; Y131-Y133 VanDerWaalsContact CZ-CA 3.43Å; Y131-Y133 AromaticContact CZ-CD2 3.55Å; Y131-Y133 AromaticContact CZ-CG 3.84Å; Y131-Y133 PolarHBondContact O-N 3.12Å; Y131-Y133 VanDerWaalsContact O-N 3.11Å; Y131-Y133 WeakPolarHBondContact OH-CD2 3.37Å; Y131-Y133 WeakPolarHBondContact OH-CE2 3.38Å; Y131-Y133 VanDerWaalsContact OH-CG 3.24Å; Y133-R135 HydrophobicContact CD1-CG 3.58Å; Y133-R135 HydrophobicContact CE1-CG 4.22Å; Y133-R135 PolarHBondContact O-N 3.09Å
134N57.3Low64.4Low119 Ų119139.9 Ų139.964%0.63671%0.706SS**  trans-64.776.5172.9-84.5-20000106L132 H136L132-N134 PolarHBondContact O-N 3.4Å; N134-H136 PolarHBondContact O-CD2 3.34Å; N134-H136 PolarHBondContact O-N 3.45Å
135R53.8Low63.4Low181 Ų181138.9 Ų138.968%0.68371%0.714SS**  trans-67.792161.2-65.5-172.6-161.6-1282.1103.7Y133 H137Y133-R135 HydrophobicContact CD1-CG 3.58Å; Y133-R135 HydrophobicContact CE1-CG 4.22Å; Y133-R135 PolarHBondContact O-N 3.09Å; R135-H137 WeakPolarHBondContact CB-CE1 3.42Å; R135-H137 VanDerWaalsContact CD-CE1 3.46Å; R135-H137 WeakPolarHBondContact CD-CE1 3.4Å; R135-H137 PolarHBondContact O-N 3.4Å
136H59.3Low62.3Low151 Ų151140 Ų14070%0.69972%0.717SS**  trans-61.3100159-70.2-82.9000105.4N134 T138N134-H136 PolarHBondContact O-CD2 3.34Å; N134-H136 PolarHBondContact O-N 3.45Å; H136-T138 VanDerWaalsContact C-N 3.26Å; H136-T138 PolarHBondContact O-N 3.43Å
137H50.6Low61.1Low161 Ų161147.5 Ų147.575%0.74573%0.734SS**  trans-81.183.5166.9-62.8-24.6000106.5R135R135-H137 WeakPolarHBondContact CB-CE1 3.42Å; R135-H137 VanDerWaalsContact CD-CE1 3.46Å; R135-H137 WeakPolarHBondContact CD-CE1 3.4Å; R135-H137 PolarHBondContact O-N 3.4Å
138T53.6Low59.9Low196 Ų196147.6 Ų147.6100%1.20273%0.731SS**  trans-143.90166.148.60000108.4H136H136-T138 VanDerWaalsContact C-N 3.26Å; H136-T138 PolarHBondContact O-N 3.43Å

Retrieved 138 of 138 residues in 32.5 ms (Link to these results)