A0A060WT37_ONCMY Loading...

Activating transcription factor 3

AlphaFold DB , UniProt , Accession A0A060WT37, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene atf3, Length 199 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M44.2Very low48.2Very low239 Ų239152.8 Ų152.8100%1.17783%0.83SS**  0111.50-60.9-169.3-158.600107.3
2M41.5Very low48.3Very low184 Ų184152.6 Ų152.691%0.90683%0.828SS**  trans-74.9116.3178.7-68-84.7177.800108.3Q4M2-Q4 PolarHBondContact O-N 3.09Å
3L52.2Low48.7Very low165 Ų165152.5 Ų152.586%0.86482%0.824SS**  trans-86.6103.9171.7-78.5166.3000108.4
4Q52.2Low49.3Very low180 Ų180149.8 Ų149.884%0.84182%0.822SS**PPolyproline II helixtrans-63.7130.1171.6-88.4153-11.600110.8M2M2-Q4 PolarHBondContact O-N 3.09Å
5H43.6Very low49Very low183 Ų183146.5 Ų146.585%0.84782%0.822SS**PPolyproline II helixtrans-81.6122.2160.4-60.9-68000108.2G7H5-G7 PolarHBondContact O-N 2.86Å
6P53.1Low48.9Very low105 Ų105144.4 Ų144.468%0.68282%0.82SS**PPolyproline II helixtrans-76.2122.9167.421.5-14.2000108.7F8P6-F8 PolarHBondContact O-N 3.48Å
7G47.4Very low48.7Very low78 Ų78141.5 Ų141.580%0.80482%0.818SS**PPolyproline II helixtrans-61.7128171.600000110.6H5H5-G7 PolarHBondContact O-N 2.86Å
8F45.3Very low48.7Very low201 Ų201142.5 Ų142.588%0.88282%0.819SS**  trans-89.5112.1169.1-91.8-92000108.9P6P6-F8 PolarHBondContact O-N 3.48Å
9S46.6Very low49Very low84 Ų84141 Ų14159%0.58781%0.813SS**  trans-70.7142.1171.350.90000111.4S11S9-S11 PolarHBondContact O-N 3.17Å
10L49.9Very low48.9Very low166 Ų166139.9 Ų139.987%0.86981%0.811SS**THydrogen-bonded Turntrans-71.623.8-178.1-90.8155000115.3
11S54.5Low48.8Very low96 Ų96138.4 Ų138.467%0.67181%0.807SS**THydrogen-bonded Turntrans-105.2-6.9-166.7-44.80000116.3S9S9-S11 PolarHBondContact O-N 3.17Å
12D48.9Very low49.2Very low150 Ų150135.3 Ų135.380%0.80279%0.794SS**  trans-110.945.4-174.4-64.4-36000113.6S14D12-S14 PolarHBondContact O-N 3.37Å
13I54.2Low49.6Very low152 Ų152131 Ų13178%0.77978%0.782SS**  trans-87.484.8166.9-54.5166.6000107.9
14S56.7Low49.6Very low114 Ų114128.6 Ų128.680%0.79778%0.776SS**  trans-173.597.7157.3178.30000111.7D12D12-S14 PolarHBondContact O-N 3.37Å
15A44.4Very low49.6Very low100 Ų100126.9 Ų126.983%0.82678%0.781SS**  trans-158.8110.6150.300000109.8A17A15-A17 PolarHBondContact O-N 3.14Å
16S47.8Very low50.1Low113 Ų113120.8 Ų120.879%0.7977%0.767SS**  trans-57.2117.5178.4-52.30000112.5L18S16-L18 PolarHBondContact O-N 2.95Å
17A45.6Very low50.4Low95 Ų95121.4 Ų121.479%0.78577%0.769SS**  trans-8592.3158.300000108.2A15 V19A15-A17 PolarHBondContact O-N 3.14Å; A17-V19 PolarHBondContact O-N 3.32Å; A17-V19 VanDerWaalsContact O-N 3.13Å
18L49.3Very low50.7Low160 Ų160123.5 Ų123.584%0.83876%0.762SS**  trans-71.2101.2167.7-76.5162.9000108.2S16 P20S16-L18 PolarHBondContact O-N 2.95Å; L18-P20 WeakPolarHBondContact O-CD 3.28Å
19V53.3Low51.5Low114 Ų114116.6 Ų116.669%0.69174%0.736SS**  trans-79.5122.5165.2178.40000107.3A17 C21A17-V19 PolarHBondContact O-N 3.32Å; A17-V19 VanDerWaalsContact O-N 3.13Å; V19-C21 VanDerWaalsContact C-N 3.34Å; V19-C21 PolarHBondContact O-N 2.98Å
20P47Very low52.2Low119 Ų119119.3 Ų119.377%0.77374%0.743SS**  trans-67.894.8169.2-16.631.1000109L18 L22L18-P20 WeakPolarHBondContact O-CD 3.28Å; P20-L22 PolarHBondContact O-N 3.3Å; P20-L22 VanDerWaalsContact O-N 3.11Å
21C47.6Very low52.8Low108 Ų108117.4 Ų117.473%0.7373%0.73SS**  trans-73.498169.635.40000108.8V19 S23V19-C21 VanDerWaalsContact C-N 3.34Å; V19-C21 PolarHBondContact O-N 2.98Å; C21-S23 PolarHBondContact O-N 3.31Å
22L51.2Low53.4Low175 Ų175115.1 Ų115.192%0.91671%0.71SS**  trans-67.286.6160-66.4169.2000107.5P20P20-L22 PolarHBondContact O-N 3.3Å; P20-L22 VanDerWaalsContact O-N 3.11Å
23S50.7Low54Low93 Ų93114.2 Ų114.265%0.6570%0.699SS**  trans-126.2134.4166-69.90000108.3C21C21-S23 PolarHBondContact O-N 3.31Å
24P51.9Low54.6Low114 Ų114110.5 Ų110.574%0.7468%0.684SS**  trans-60.1149.7178.4-9.421.7000109.5G26P24-G26 PolarHBondContact O-N 3.07Å
25P51.8Low55.1Low145 Ų145109.6 Ų109.694%0.94267%0.67SS**  trans-73.471.5174.532.1-32.8000109.4
26G55.8Low56.2Low54 Ų54110.6 Ų110.656%0.55766%0.656SS**  trans-102.3101.6164.300000107.2P24 L28P24-G26 PolarHBondContact O-N 3.07Å; G26-L28 VanDerWaalsContact C-N 3.31Å; G26-L28 PolarHBondContact O-N 3.44Å
27T58Low57.4Low118 Ų118109.3 Ų109.372%0.72464%0.643SS**  trans-63.997167.5-177.90000107.3T29T27-T29 VanDerWaalsContact C-N 3.3Å; T27-T29 HydrophobicContact CG2-CG2 4.12Å; T27-T29 PolarHBondContact O-N 2.96Å
28L54.1Low58.7Low123 Ų123108.4 Ų108.464%0.64463%0.63SS**  trans-71.699.1164-64.8-174000105.4G26 D32G26-L28 VanDerWaalsContact C-N 3.31Å; G26-L28 PolarHBondContact O-N 3.44Å; L28-D32 WeakPolarHBondContact CA-OD2 3.36Å
29T62.7Low60.1Low56 Ų56106 Ų10634%0.34462%0.617SS.*  trans-72.7158.8-179.361.20000109T27 E31 D32T27-T29 VanDerWaalsContact C-N 3.3Å; T27-T29 HydrophobicContact CG2-CG2 4.12Å; T27-T29 PolarHBondContact O-N 2.96Å; T29-E31 PolarHBondContact O-N 2.9Å; T29-E31 VanDerWaalsContact O-N 3.08Å; T29-D32 PolarHBondContact N-OD2 2.95Å; T29-D32 WeakPolarHBondContact O-CB 3.27Å; T29-D32 PolarHBondContact O-N 3.17Å; T29-D32 PolarHBondContact OG1-OD2 3.37Å
30L60.8Low61.5Low140 Ų140104.9 Ų104.973%0.73361%0.61SS**Hα-helixtrans-54.4-29.4176.2-173.765.1000112D32 F33 T34L30-D32 VanDerWaalsContact C-N 3.28Å; L30-D32 PolarHBondContact O-N 3.02Å; L30-F33 PolarHBondContact O-N 2.75Å; L30-T34 PolarHBondContact O-N 3.13Å; L30-T34 VanDerWaalsContact O-N 3.1Å; L30-T34 PolarHBondContact O-OG1 2.89Å
31E62.9Low63.3Low126 Ų126106.7 Ų106.759%0.58961%0.606SS**Hα-helixtrans-59-35.4174-59.3-69.314800112.4T29 T34 N35T29-E31 PolarHBondContact O-N 2.9Å; T29-E31 VanDerWaalsContact O-N 3.08Å; E31-T34 VanDerWaalsContact C-OG1 3.29Å; E31-T34 VanDerWaalsContact CA-OG1 3.23Å; E31-T34 WeakPolarHBondContact CA-OG1 3.39Å; E31-T34 PolarHBondContact O-N 3.03Å; E31-T34 PolarHBondContact O-OG1 3.39Å; E31-N35 WeakPolarHBondContact O-CB 3.35Å; E31-N35 PolarHBondContact O-N 3.46Å; E31-N35 PolarHBondContact O-ND2 3.19Å
32D67.2Low65.1Low48 Ų48105.5 Ų105.526%0.25759%0.589SS.*Hα-helixtrans-67.7-43.9178.1-63.8-46.5000110.6L28 T29 L30 T34 N35 F36L28-D32 WeakPolarHBondContact CA-OD2 3.36Å; T29-D32 PolarHBondContact N-OD2 2.95Å; T29-D32 WeakPolarHBondContact O-CB 3.27Å; T29-D32 PolarHBondContact O-N 3.17Å; T29-D32 PolarHBondContact OG1-OD2 3.37Å; L30-D32 VanDerWaalsContact C-N 3.28Å; L30-D32 PolarHBondContact O-N 3.02Å; D32-T34 VanDerWaalsContact C-N 3.33Å; D32-T34 PolarHBondContact O-N 3.5Å; D32-N35 PolarHBondContact O-N 3.01Å; D32-N35 VanDerWaalsContact O-N 3.15Å; D32-F36 HydrophobicContact CB-CD2 4.29Å; D32-F36 HydrophobicContact CB-CE2 3.99Å; D32-F36 WeakPolarHBondContact O-CD2 3.35Å; D32-F36 WeakPolarHBondContact O-CG 3.36Å; D32-F36 PolarHBondContact O-N 3.09Å
33F61.2Low66.8Low132 Ų132104 Ų10458%0.57958%0.578SS**Hα-helixtrans-62.6-38.8174.7-84.3-89.9000112.3L30 N35 T37L30-F33 PolarHBondContact O-N 2.75Å; F33-N35 VanDerWaalsContact C-N 3.3Å; F33-N35 PolarHBondContact O-N 3.25Å; F33-T37 WeakPolarHBondContact O-CB 3.31Å; F33-T37 PolarHBondContact O-N 3.47Å; F33-T37 VanDerWaalsContact O-N 3.12Å; F33-T37 PolarHBondContact O-OG1 3.35Å
34T66Low68.5Low74 Ų74104.5 Ų104.545%0.45457%0.573SS.*Hα-helixtrans-68.7-30.8175.8530000112.3L30 E31 D32 P38L30-T34 PolarHBondContact O-N 3.13Å; L30-T34 VanDerWaalsContact O-N 3.1Å; L30-T34 PolarHBondContact O-OG1 2.89Å; E31-T34 VanDerWaalsContact C-OG1 3.29Å; E31-T34 VanDerWaalsContact CA-OG1 3.23Å; E31-T34 WeakPolarHBondContact CA-OG1 3.39Å; E31-T34 PolarHBondContact O-N 3.03Å; E31-T34 PolarHBondContact O-OG1 3.39Å; D32-T34 VanDerWaalsContact C-N 3.33Å; D32-T34 PolarHBondContact O-N 3.5Å; T34-P38 WeakPolarHBondContact O-CD 3.49Å
35N67.8Low70.3Confident94 Ų94106.9 Ų106.950%0.50357%0.567SS.*Hα-helixtrans-78.1-35176.9-74.6-39.1000113.2E31 D32 F33 P38E31-N35 WeakPolarHBondContact O-CB 3.35Å; E31-N35 PolarHBondContact O-N 3.46Å; E31-N35 PolarHBondContact O-ND2 3.19Å; D32-N35 PolarHBondContact O-N 3.01Å; D32-N35 VanDerWaalsContact O-N 3.15Å; F33-N35 VanDerWaalsContact C-N 3.3Å; F33-N35 PolarHBondContact O-N 3.25Å; N35-P38 VanDerWaalsContact O-CD 3.3Å; N35-P38 WeakPolarHBondContact O-CD 3.49Å; N35-P38 VanDerWaalsContact O-CG 3.29Å; N35-P38 WeakPolarHBondContact O-CG 3.33Å
36F68.1Low72Confident121 Ų121104.5 Ų104.553%0.53154%0.543SS..Hα-helixtrans-76.8-32.2177.5-71-61.9000113.5D32 L39 V40D32-F36 HydrophobicContact CB-CD2 4.29Å; D32-F36 HydrophobicContact CB-CE2 3.99Å; D32-F36 WeakPolarHBondContact O-CD2 3.35Å; D32-F36 WeakPolarHBondContact O-CG 3.36Å; D32-F36 PolarHBondContact O-N 3.09Å; F36-L39 PolarHBondContact O-N 3.49Å; F36-V40 WeakPolarHBondContact O-CG2 3.43Å; F36-V40 PolarHBondContact O-N 3.36Å
37T71.9Confident73.6Confident86 Ų86104.6 Ų104.653%0.52854%0.539SS..Hα-helixtrans-54.6-45.8-179.2-60.90000114.4F33 K41F33-T37 WeakPolarHBondContact O-CB 3.31Å; F33-T37 PolarHBondContact O-N 3.47Å; F33-T37 VanDerWaalsContact O-N 3.12Å; F33-T37 PolarHBondContact O-OG1 3.35Å; T37-K41 WeakPolarHBondContact O-CB 3.44Å; T37-K41 PolarHBondContact O-N 3.22Å
38P72.6Confident75Confident77 Ų77102.7 Ų102.750%0.552%0.523SS..Hα-helixtrans-67.1-37.2176.924.9-34.1000112.6T34 N35 K41 E42T34-P38 WeakPolarHBondContact O-CD 3.49Å; N35-P38 VanDerWaalsContact O-CD 3.3Å; N35-P38 WeakPolarHBondContact O-CD 3.49Å; N35-P38 VanDerWaalsContact O-CG 3.29Å; N35-P38 WeakPolarHBondContact O-CG 3.33Å; P38-K41 PolarHBondContact O-N 2.95Å; P38-E42 WeakPolarHBondContact O-CB 3.4Å; P38-E42 PolarHBondContact O-N 2.95Å
39L80.4Confident76.6Confident110 Ų110100 Ų10058%0.57651%0.508SS*.Hα-helixtrans-66.8-48.4178.1-75.2153.2000111.4F36 K41 E42 E43F36-L39 PolarHBondContact O-N 3.49Å; L39-K41 VanDerWaalsContact C-N 3.28Å; L39-K41 PolarHBondContact O-N 3.19Å; L39-E42 PolarHBondContact O-N 2.95Å; L39-E43 WeakPolarHBondContact O-CG 3.22Å; L39-E43 PolarHBondContact O-N 3.09Å
40V82.4Confident77.7Confident90 Ų90102 Ų10255%0.54552%0.516SS..Hα-helixtrans-62.7-37.9177.4175.30000111F36 L44F36-V40 WeakPolarHBondContact O-CG2 3.43Å; F36-V40 PolarHBondContact O-N 3.36Å; V40-L44 WeakPolarHBondContact O-CB 3.32Å; V40-L44 PolarHBondContact O-N 3.39Å
41K83.3Confident78.9Confident156 Ų156102.1 Ų102.168%0.67851%0.511SS*.Hα-helixtrans-65.9-40.9176.1-173.7179.1-179.2-177.10111.7T37 P38 L39 R45T37-K41 WeakPolarHBondContact O-CB 3.44Å; T37-K41 PolarHBondContact O-N 3.22Å; P38-K41 PolarHBondContact O-N 2.95Å; L39-K41 VanDerWaalsContact C-N 3.28Å; L39-K41 PolarHBondContact O-N 3.19Å; K41-R45 WeakPolarHBondContact O-CB 3.47Å; K41-R45 PolarHBondContact O-N 3.16Å
42E86Confident79.8Confident83 Ų83102.4 Ų102.439%0.38851%0.506SS..Hα-helixtrans-71.4-41.3177.8-17354.5-147.300111.8P38 L39 L44 R45 Q46P38-E42 WeakPolarHBondContact O-CB 3.4Å; P38-E42 PolarHBondContact O-N 2.95Å; L39-E42 PolarHBondContact O-N 2.95Å; E42-L44 PolarHBondContact O-N 3.23Å; E42-R45 WeakPolarHBondContact O-CB 3.28Å; E42-R45 PolarHBondContact O-N 3.2Å; E42-Q46 WeakPolarHBondContact O-CB 3.35Å; E42-Q46 WeakPolarHBondContact O-CG 3.46Å; E42-Q46 PolarHBondContact O-N 3.08Å; E42-Q46 PolarHBondContact OE1-NE2 3.45Å
43E86.3Confident80.3Confident143 Ų143104.1 Ų104.167%0.66852%0.515SS*.Hα-helixtrans-62.9-42.7173.5-73.8-159.8161.600111.8L39 R45 Q46 A47L39-E43 WeakPolarHBondContact O-CG 3.22Å; L39-E43 PolarHBondContact O-N 3.09Å; E43-R45 VanDerWaalsContact C-N 3.33Å; E43-R45 PolarHBondContact O-N 3.43Å; E43-Q46 PolarHBondContact O-N 3.34Å; E43-A47 WeakPolarHBondContact O-CB 3.3Å; E43-A47 PolarHBondContact O-N 3.39Å
44L88.2Confident81Confident105 Ų105101.5 Ų101.555%0.5551%0.513SS..Hα-helixtrans-65.1-39.1174.6-177.460.7000111.1V40 E42 A47 I48V40-L44 WeakPolarHBondContact O-CB 3.32Å; V40-L44 PolarHBondContact O-N 3.39Å; E42-L44 PolarHBondContact O-N 3.23Å; L44-A47 PolarHBondContact O-N 3.07Å; L44-I48 HydrophobicContact CD1-CD1 4.08Å; L44-I48 HydrophobicContact CD1-CG1 4.32Å; L44-I48 HydrophobicContact CG-CD1 3.88Å; L44-I48 WeakPolarHBondContact O-CB 3.34Å; L44-I48 WeakPolarHBondContact O-CD1 3.4Å; L44-I48 WeakPolarHBondContact O-CG1 3.46Å; L44-I48 PolarHBondContact O-N 2.97Å
45R88.6Confident81.5Confident163 Ų163101.2 Ų101.262%0.61551%0.509SS*.Hα-helixtrans-63.5-47.1176.1-177.6-178167.8129-0.5111.1K41 E42 E43 I48 Q49K41-R45 WeakPolarHBondContact O-CB 3.47Å; K41-R45 PolarHBondContact O-N 3.16Å; E42-R45 WeakPolarHBondContact O-CB 3.28Å; E42-R45 PolarHBondContact O-N 3.2Å; E43-R45 VanDerWaalsContact C-N 3.33Å; E43-R45 PolarHBondContact O-N 3.43Å; R45-I48 PolarHBondContact O-N 3.04Å; R45-Q49 VanDerWaalsContact O-CB 3.29Å; R45-Q49 WeakPolarHBondContact O-CB 3.48Å; R45-Q49 PolarHBondContact O-N 3.06Å
46Q88.1Confident81.6Confident95 Ų9599.1 Ų99.144%0.44451%0.509SS..Hα-helixtrans-66.2-39.2175.8-74-179.828.300111.8E42 E43 I48 Q49 N50E42-Q46 WeakPolarHBondContact O-CB 3.35Å; E42-Q46 WeakPolarHBondContact O-CG 3.46Å; E42-Q46 PolarHBondContact O-N 3.08Å; E42-Q46 PolarHBondContact OE1-NE2 3.45Å; E43-Q46 PolarHBondContact O-N 3.34Å; Q46-I48 VanDerWaalsContact C-N 3.34Å; Q46-I48 PolarHBondContact O-N 2.93Å; Q46-Q49 PolarHBondContact O-N 3.28Å; Q46-N50 VanDerWaalsContact O-CB 3.22Å; Q46-N50 WeakPolarHBondContact O-CB 3.42Å; Q46-N50 VanDerWaalsContact O-CG 3.28Å; Q46-N50 PolarHBondContact O-N 3.21Å
47A89Confident81.7Confident56 Ų5698.3 Ų98.346%0.46351%0.51SS..Hα-helixtrans-63-42.1174.600000111.3E43 L44 K51E43-A47 WeakPolarHBondContact O-CB 3.3Å; E43-A47 PolarHBondContact O-N 3.39Å; L44-A47 PolarHBondContact O-N 3.07Å; A47-K51 WeakPolarHBondContact O-CB 3.39Å; A47-K51 PolarHBondContact O-N 3.46Å
48I88Confident81.4Confident79 Ų7998.7 Ų98.741%0.40552%0.516SS..Hα-helixtrans-65.8-44174.6-70.1165.1000110.5L44 R45 Q46 K51 R52L44-I48 HydrophobicContact CD1-CD1 4.08Å; L44-I48 HydrophobicContact CD1-CG1 4.32Å; L44-I48 HydrophobicContact CG-CD1 3.88Å; L44-I48 WeakPolarHBondContact O-CB 3.34Å; L44-I48 WeakPolarHBondContact O-CD1 3.4Å; L44-I48 WeakPolarHBondContact O-CG1 3.46Å; L44-I48 PolarHBondContact O-N 2.97Å; R45-I48 PolarHBondContact O-N 3.04Å; Q46-I48 VanDerWaalsContact C-N 3.34Å; Q46-I48 PolarHBondContact O-N 2.93Å; I48-K51 CarbonylContact O-C 3.59Å; I48-K51 PolarHBondContact O-N 2.94Å; I48-R52 HydrophobicContact CG2-CG 4.44Å; I48-R52 WeakPolarHBondContact O-CB 3.23Å; I48-R52 VanDerWaalsContact O-CG 3.26Å; I48-R52 WeakPolarHBondContact O-CG 3.33Å; I48-R52 PolarHBondContact O-N 3.32Å
49Q87.3Confident81Confident67 Ų6798.1 Ų98.131%0.31351%0.511SS..Hα-helixtrans-65.1-49.3179.6-174.8175.5-1.900111.3R45 Q46 K51 R52 L53R45-Q49 VanDerWaalsContact O-CB 3.29Å; R45-Q49 WeakPolarHBondContact O-CB 3.48Å; R45-Q49 PolarHBondContact O-N 3.06Å; Q46-Q49 PolarHBondContact O-N 3.28Å; Q49-K51 VanDerWaalsContact C-N 3.25Å; Q49-K51 PolarHBondContact O-N 2.97Å; Q49-R52 CarbonylContact O-C 3.54Å; Q49-R52 WeakPolarHBondContact O-CA 3.39Å; Q49-R52 WeakPolarHBondContact O-CB 3.31Å; Q49-R52 PolarHBondContact O-N 3.03Å; Q49-L53 HydrophobicContact CG-CD1 4.13Å; Q49-L53 HydrophobicContact CG-CG 4.4Å; Q49-L53 WeakPolarHBondContact O-CB 3.4Å; Q49-L53 WeakPolarHBondContact O-CG 3.34Å; Q49-L53 PolarHBondContact O-N 3.36Å
50N86Confident79.7Confident98 Ų9899.3 Ų99.352%0.52452%0.518SS..Hα-helixtrans-60.3-36.7174.2-73.7-16.7000111.5Q46 R52 S54Q46-N50 VanDerWaalsContact O-CB 3.22Å; Q46-N50 WeakPolarHBondContact O-CB 3.42Å; Q46-N50 VanDerWaalsContact O-CG 3.28Å; Q46-N50 PolarHBondContact O-N 3.21Å; N50-R52 VanDerWaalsContact C-N 3.34Å; N50-S54 VanDerWaalsContact O-CB 3.23Å; N50-S54 WeakPolarHBondContact O-CB 3.48Å; N50-S54 PolarHBondContact O-N 3.01Å; N50-S54 PolarHBondContact O-OG 3.34Å
51K85.4Confident78.5Confident142 Ų142103 Ų10362%0.61753%0.531SS*.Hα-helixtrans-69.3-30.7173.3-169.9168.2-175.7175.30112.6A47 I48 Q49 S54 N55A47-K51 WeakPolarHBondContact O-CB 3.39Å; A47-K51 PolarHBondContact O-N 3.46Å; I48-K51 CarbonylContact O-C 3.59Å; I48-K51 PolarHBondContact O-N 2.94Å; Q49-K51 VanDerWaalsContact C-N 3.25Å; Q49-K51 PolarHBondContact O-N 2.97Å; K51-S54 WeakPolarHBondContact CA-OG 3.42Å; K51-S54 PolarHBondContact O-OG 3.49Å; K51-N55 WeakPolarHBondContact O-CB 3.37Å; K51-N55 PolarHBondContact O-N 3.31Å; K51-N55 VanDerWaalsContact O-N 3.17Å; K51-N55 PolarHBondContact O-ND2 3.46Å; K51-N55 PolarHBondContact O-OD1 3.44Å
52R81.9Confident77.1Confident132 Ų132100.5 Ų100.550%0.49853%0.534SS..Hα-helixtrans-74.6-42.8173.3-75.3169.8177.2-101.62.9111.8I48 Q49 N50 N55 G56 L57I48-R52 HydrophobicContact CG2-CG 4.44Å; I48-R52 WeakPolarHBondContact O-CB 3.23Å; I48-R52 VanDerWaalsContact O-CG 3.26Å; I48-R52 WeakPolarHBondContact O-CG 3.33Å; I48-R52 PolarHBondContact O-N 3.32Å; Q49-R52 CarbonylContact O-C 3.54Å; Q49-R52 WeakPolarHBondContact O-CA 3.39Å; Q49-R52 WeakPolarHBondContact O-CB 3.31Å; Q49-R52 PolarHBondContact O-N 3.03Å; N50-R52 VanDerWaalsContact C-N 3.34Å; R52-N55 CarbonylContact O-C 3.59Å; R52-N55 WeakPolarHBondContact O-CA 3.28Å; R52-N55 WeakPolarHBondContact O-CB 3.44Å; R52-N55 PolarHBondContact O-N 3.37Å; R52-G56 PolarHBondContact O-N 3.36Å; R52-L57 HydrophobicContact CB-CB 4.38Å; R52-L57 PolarHBondContact O-N 3.33Å
53L78.1Confident75.3Confident84 Ų84104.5 Ų104.544%0.4456%0.558SS.*Hα-helixtrans-66.7-49.5177.8-69.7176.1000112Q49 N55 G56Q49-L53 HydrophobicContact CG-CD1 4.13Å; Q49-L53 HydrophobicContact CG-CG 4.4Å; Q49-L53 WeakPolarHBondContact O-CB 3.4Å; Q49-L53 WeakPolarHBondContact O-CG 3.34Å; Q49-L53 PolarHBondContact O-N 3.36Å; L53-N55 PolarHBondContact O-N 3.3Å; L53-N55 VanDerWaalsContact O-N 3.12Å; L53-G56 PolarHBondContact O-N 3.47Å
54S76.6Confident73.4Confident76 Ų76103.3 Ų103.353%0.53156%0.564SS.*THydrogen-bonded Turntrans-58.4-26.1169.258.20000111.1N50 K51 R80N50-S54 VanDerWaalsContact O-CB 3.23Å; N50-S54 WeakPolarHBondContact O-CB 3.48Å; N50-S54 PolarHBondContact O-N 3.01Å; N50-S54 PolarHBondContact O-OG 3.34Å; K51-S54 WeakPolarHBondContact CA-OG 3.42Å; K51-S54 PolarHBondContact O-OG 3.49Å; S54-R80 VanDerWaalsContact O-CZ 3.3Å; S54-R80 PolarHBondContact O-NH2 3.45Å
55N75.9Confident71.4Confident68 Ų68102.3 Ų102.336%0.36457%0.571SS.*THydrogen-bonded Turntrans-81.2-2.3173-68.1-5000117.8K51 R52 L53 L57 R80K51-N55 WeakPolarHBondContact O-CB 3.37Å; K51-N55 PolarHBondContact O-N 3.31Å; K51-N55 VanDerWaalsContact O-N 3.17Å; K51-N55 PolarHBondContact O-ND2 3.46Å; K51-N55 PolarHBondContact O-OD1 3.44Å; R52-N55 CarbonylContact O-C 3.59Å; R52-N55 WeakPolarHBondContact O-CA 3.28Å; R52-N55 WeakPolarHBondContact O-CB 3.44Å; R52-N55 PolarHBondContact O-N 3.37Å; L53-N55 PolarHBondContact O-N 3.3Å; L53-N55 VanDerWaalsContact O-N 3.12Å; N55-L57 VanDerWaalsContact C-N 3.26Å; N55-L57 PolarHBondContact O-N 3.3Å; N55-R80 WeakPolarHBondContact O-CD 2.94Å; N55-R80 PolarHBondContact O-NH1 3.38Å; N55-R80 VanDerWaalsContact OD1-CZ 3.24Å; N55-R80 PolarHBondContact OD1-NH1 2.93Å; N55-R80 PolarHBondContact OD1-NH2 2.93Å
56G69.9Low69.4Low50 Ų50100.3 Ų100.352%0.51558%0.582SS.*THydrogen-bonded Turntrans71.416.4-179.100000114.3R52 L53R52-G56 PolarHBondContact O-N 3.36Å; L53-G56 PolarHBondContact O-N 3.47Å
57L70.3Confident67.3Low104 Ų104101.4 Ų101.455%0.54560%0.6SS.*  trans-94.2105.4169.7-111.971000107.8R52 N55R52-L57 HydrophobicContact CB-CB 4.38Å; R52-L57 PolarHBondContact O-N 3.33Å; N55-L57 VanDerWaalsContact C-N 3.26Å; N55-L57 PolarHBondContact O-N 3.3Å
58S64.1Low65.5Low95 Ų95103.5 Ų103.566%0.66461%0.612SS**  trans-6614917657.80000111.5
59T64.3Low63.5Low64 Ų64104.1 Ų104.139%0.39362%0.623SS.*  trans-99.366.1179.90.70000109.4M61T59-M61 PolarHBondContact O-N 3.37Å
60D53.2Low61.7Low135 Ų135107.8 Ų107.872%0.72265%0.645SS**  trans-85.498.9169.1-77.4-34.1000108.9S62D60-S62 PolarHBondContact O-N 2.91Å
61M58.6Low59.7Low167 Ų167113.8 Ų113.882%0.82366%0.66SS**  trans-81.799157.3-65.6-68.298.400106.5T59T59-M61 PolarHBondContact O-N 3.37Å
62S53.3Low57.6Low105 Ų105112.6 Ų112.673%0.73466%0.664SS**  trans-104.2114.8163.7-178.10000107.6D60 C64D60-S62 PolarHBondContact O-N 2.91Å; S62-C64 PolarHBondContact O-N 3.32Å
63D48.5Very low56Low167 Ų167112.1 Ų112.189%0.89368%0.682SS**  trans-63.2114165.2-69.4-45.4000108.6
64C46.3Very low54.3Low118 Ų118116.1 Ų116.180%0.79770%0.698SS**  trans-152.5115.7167.5-177.20000111S62S62-C64 PolarHBondContact O-N 3.32Å
65A46Very low52.8Low84 Ų84116.4 Ų116.469%0.69471%0.705SS**  trans-69.9142.2170.800000111.5
66S47.5Very low51.2Low121 Ų121118.8 Ų118.885%0.84672%0.724SS**  trans47.3111.3152.4-53.80000119.8
67S43.8Very low50.2Low117 Ų117121.1 Ų121.182%0.81873%0.732SS**  -170.9137.1127.1-172.50000111.1
68S51.1Low49Very low101 Ų101121 Ų12171%0.70674%0.736SS**  trans-56.9141172.860.90000112.6
69S46Very low48.2Very low92 Ų92125.3 Ų125.364%0.64374%0.743SS**  147.1120.4122.6670000111.3
70D48.1Very low47.7Very low144 Ų144127.3 Ų127.377%0.7774%0.743SS**  trans44.498146.3-153.27.8000117.5
71R44.5Very low47.7Very low224 Ų224129.9 Ų129.985%0.84575%0.751SS**  trans-134.3103.6163.9-62.3-64.4161.5179.2-1.4109S73R71-S73 PolarHBondContact O-N 2.93Å
72T41.7Very low47.5Very low116 Ų116125.7 Ų125.771%0.71273%0.728SS**  trans-31.6131.3156.142.50000111.3E74T72-E74 PolarHBondContact O-N 3.47Å
73S47.3Very low47.7Very low123 Ų123126.4 Ų126.486%0.8672%0.722SS**  trans-6771.1178.249.70000111.7R71R71-S73 PolarHBondContact O-N 2.93Å
74E43.6Very low48.4Very low168 Ų168123.2 Ų123.279%0.78571%0.711SS**  trans-95.885.5164.8-76.8-77.5147.500107T72T72-E74 PolarHBondContact O-N 3.47Å
75A45.8Very low49.5Very low82 Ų82125.1 Ų125.168%0.67871%0.708SS**  trans-58.6127.4164.200000107.6S77A75-S77 PolarHBondContact O-N 2.9Å
76P42.2Very low51Low117 Ų117126 Ų12676%0.7670%0.698SS**  trans-64.6105.3173.312-8000107.1V78P76-V78 HydrophobicContact CB-CG2 4.48Å; P76-V78 PolarHBondContact O-N 2.87Å
77S48.9Very low52.6Low99 Ų99121.7 Ų121.769%0.69267%0.668SS**  trans-62.273.8164.41560000107.6A75 K79A75-S77 PolarHBondContact O-N 2.9Å; S77-K79 VanDerWaalsContact C-N 3.25Å; S77-K79 PolarHBondContact O-N 3.34Å
78V44.9Very low54.7Low102 Ų102119.6 Ų119.662%0.61865%0.647SS**  trans-65.1100.6161.1-176.40000104.2P76 R80P76-V78 HydrophobicContact CB-CG2 4.48Å; P76-V78 PolarHBondContact O-N 2.87Å; V78-R80 PolarHBondContact O-N 3.46Å
79K47.5Very low56.7Low186 Ų186122.6 Ų122.681%0.80964%0.643SS**  trans-60.775166.8-71.3175.3179.81750106.9S77 E81S77-K79 VanDerWaalsContact C-N 3.25Å; S77-K79 PolarHBondContact O-N 3.34Å; K79-E81 VanDerWaalsContact C-N 3.27Å; K79-E81 PolarHBondContact O-N 3.17Å
80R53Low58.9Low106 Ų106123.8 Ų123.840%0.463%0.633SS.*  trans-7198.6165-167.9160.7174-132.8-6.3104.1S54 N55 V78 K82S54-R80 VanDerWaalsContact O-CZ 3.3Å; S54-R80 PolarHBondContact O-NH2 3.45Å; N55-R80 WeakPolarHBondContact O-CD 2.94Å; N55-R80 PolarHBondContact O-NH1 3.38Å; N55-R80 VanDerWaalsContact OD1-CZ 3.24Å; N55-R80 PolarHBondContact OD1-NH1 2.93Å; N55-R80 PolarHBondContact OD1-NH2 2.93Å; V78-R80 PolarHBondContact O-N 3.46Å; R80-K82 PolarHBondContact O-N 3.31Å
81E52.9Low61.1Low189 Ų189122.7 Ų122.788%0.88362%0.622SS**  trans-54.287.3162.9-74.4-178.5161.900106.5K79 I83K79-E81 VanDerWaalsContact C-N 3.27Å; K79-E81 PolarHBondContact O-N 3.17Å; E81-I83 PolarHBondContact O-N 2.93Å
82K54.1Low63.5Low79 Ų79120.5 Ų120.534%0.34361%0.613SS.*  trans-57.4130164.3-69.9171.1-174.2158.20104.3R80R80-K82 PolarHBondContact O-N 3.31Å
83I59Low66.1Low119 Ų119121.5 Ų121.561%0.6160%0.604SS**  trans-37.9120164-61.5162.6000106.2E81 E85 E86 S87E81-I83 PolarHBondContact O-N 2.93Å; I83-E85 HydrophobicContact CG2-CB 4.28Å; I83-E85 PolarHBondContact O-N 3.3Å; I83-E86 WeakPolarHBondContact O-CB 3.29Å; I83-E86 PolarHBondContact O-N 3.45Å; I83-S87 PolarHBondContact O-N 3.41Å
84P63.1Low68.5Low101 Ų101123.1 Ų123.166%0.65659%0.591SS**Hα-helixtrans-49-33.6-166.9-32.935.4000113.6E86 S87 D88P84-E86 PolarHBondContact O-N 2.9Å; P84-S87 WeakPolarHBondContact O-CB 3.35Å; P84-S87 PolarHBondContact O-N 3.46Å; P84-D88 PolarHBondContact O-N 3.49Å
85E67.8Low71.1Confident158 Ų158121.3 Ų121.374%0.73858%0.583SS**Hα-helixtrans-61.2-39.4175.2-162.5179.3175.800114.5I83 R89I83-E85 HydrophobicContact CG2-CB 4.28Å; I83-E85 PolarHBondContact O-N 3.3Å; E85-R89 WeakPolarHBondContact O-CB 3.46Å; E85-R89 PolarHBondContact O-N 3.13Å; E85-R89 VanDerWaalsContact O-N 3.11Å
86E77.7Confident73.6Confident102 Ų102125.1 Ų125.148%0.47758%0.58SS.*Hα-helixtrans-71-36.3177.4-160.4-155.6157.500111.6I83 P84 R90I83-E86 WeakPolarHBondContact O-CB 3.29Å; I83-E86 PolarHBondContact O-N 3.45Å; P84-E86 PolarHBondContact O-N 2.9Å; E86-R90 WeakPolarHBondContact O-CB 2.97Å; E86-R90 PolarHBondContact O-N 3.42Å; E86-R90 VanDerWaalsContact O-N 3.08Å
87S82.6Confident76.2Confident31 Ų31125 Ų12522%0.21757%0.573CS.*Hα-helixtrans-57.9-49.5174145.30000111.1I83 P84 R90 K91I83-S87 PolarHBondContact O-N 3.41Å; P84-S87 WeakPolarHBondContact O-CB 3.35Å; P84-S87 PolarHBondContact O-N 3.46Å; S87-R90 WeakPolarHBondContact O-CB 3.17Å; S87-R90 PolarHBondContact O-N 3.32Å; S87-R90 VanDerWaalsContact O-N 3.16Å; S87-K91 WeakPolarHBondContact O-CG 3.45Å; S87-K91 PolarHBondContact O-N 3.29Å; S87-K91 WeakPolarHBondContact OG-CE 3.41Å
88D88Confident78.6Confident73 Ų73128 Ų12839%0.3957%0.574SS.*Hα-helixtrans-74.1-35.3-174.1-67.6-19.7000112P84 R90 K91 R92P84-D88 PolarHBondContact O-N 3.49Å; D88-R90 PolarHBondContact O-N 3.14Å; D88-K91 PolarHBondContact O-N 2.96Å; D88-K91 IonicContact OD1-NZ 2.86Å; D88-K91 PolarHBondContact OD1-NZ 2.9Å; D88-R92 WeakPolarHBondContact O-CG 3.46Å; D88-R92 PolarHBondContact O-N 3.17Å
89R91.6Very high81.1Confident163 Ų163127.7 Ų127.762%0.61557%0.572SS**Hα-helixtrans-58.2-39.1169.1-168.5177.4-174.4-162.72.9111.5E85 R93E85-R89 WeakPolarHBondContact O-CB 3.46Å; E85-R89 PolarHBondContact O-N 3.13Å; E85-R89 VanDerWaalsContact O-N 3.11Å; R89-R93 WeakPolarHBondContact O-CG 3.49Å; R89-R93 PolarHBondContact O-N 3.36Å
90R92.4Very high83.6Confident117 Ų117121.5 Ų121.544%0.44256%0.555SS.*Hα-helixtrans-69.9-39.5176.8-167170.8-174.6172.9-3.8112.2E86 S87 D88 R93 R94E86-R90 WeakPolarHBondContact O-CB 2.97Å; E86-R90 PolarHBondContact O-N 3.42Å; E86-R90 VanDerWaalsContact O-N 3.08Å; S87-R90 WeakPolarHBondContact O-CB 3.17Å; S87-R90 PolarHBondContact O-N 3.32Å; S87-R90 VanDerWaalsContact O-N 3.16Å; D88-R90 PolarHBondContact O-N 3.14Å; R90-R93 PolarHBondContact O-N 3.42Å; R90-R94 WeakPolarHBondContact O-CG 2.9Å; R90-R94 PolarHBondContact O-N 2.91Å; R90-R94 VanDerWaalsContact O-N 3.07Å
91K94Very high85.7Confident122 Ų122118.2 Ų118.253%0.5355%0.551SS.*Hα-helixtrans-60-50173.8-69.2173.7-167158.70111.3S87 D88 R93 R94 E95S87-K91 WeakPolarHBondContact O-CG 3.45Å; S87-K91 PolarHBondContact O-N 3.29Å; S87-K91 WeakPolarHBondContact OG-CE 3.41Å; D88-K91 PolarHBondContact O-N 2.96Å; D88-K91 IonicContact OD1-NZ 2.86Å; D88-K91 PolarHBondContact OD1-NZ 2.9Å; K91-R93 PolarHBondContact O-N 3.39Å; K91-R94 PolarHBondContact O-N 3.43Å; K91-E95 PolarHBondContact O-N 2.97Å
92R94.8Very high87.9Confident177 Ų177111.4 Ų111.467%0.66853%0.527SS*.Hα-helixtrans-58.3-33.4177-69.1179.8-177.3-159.6-0.8113.2D88 R96D88-R92 WeakPolarHBondContact O-CG 3.46Å; D88-R92 PolarHBondContact O-N 3.17Å; R92-R96 WeakPolarHBondContact O-CG 3.35Å; R92-R96 PolarHBondContact O-N 2.96Å; R92-R96 PolarHBondContact O-NE 2.9Å
93R97.1Very high90Very high138 Ų138115.1 Ų115.152%0.52154%0.543SS..Hα-helixtrans-70.4-43.7174.7-76.5178.6178-173.9-0.6112R89 R90 K91 R96 N97R89-R93 WeakPolarHBondContact O-CG 3.49Å; R89-R93 PolarHBondContact O-N 3.36Å; R90-R93 PolarHBondContact O-N 3.42Å; K91-R93 PolarHBondContact O-N 3.39Å; R93-R96 PolarHBondContact O-N 3.42Å; R93-N97 WeakPolarHBondContact O-CB 3.43Å; R93-N97 PolarHBondContact O-N 2.78Å
94R97.6Very high91.9Very high156 Ų156113.7 Ų113.759%0.58954%0.542SS*.Hα-helixtrans-63.9-41.6177.3-72179.2179.8-177.3-1.8111.8R90 K91 N97 K98R90-R94 WeakPolarHBondContact O-CG 2.9Å; R90-R94 PolarHBondContact O-N 2.91Å; R90-R94 VanDerWaalsContact O-N 3.07Å; K91-R94 PolarHBondContact O-N 3.43Å; R94-N97 PolarHBondContact O-N 3.39Å; R94-K98 WeakPolarHBondContact O-CB 3.49Å; R94-K98 PolarHBondContact O-N 3.26Å
95E97.3Very high93.6Very high130 Ų130117.9 Ų117.961%0.60755%0.545SS*.Hα-helixtrans-63.1-46.7177.8-172.5170.6-160.900111.6K91 N97 K98 V99K91-E95 PolarHBondContact O-N 2.97Å; E95-N97 VanDerWaalsContact C-N 3.34Å; E95-N97 PolarHBondContact O-N 3.08Å; E95-K98 WeakPolarHBondContact O-CB 3.3Å; E95-K98 PolarHBondContact O-N 3.18Å; E95-V99 WeakPolarHBondContact O-CG2 3.34Å; E95-V99 PolarHBondContact O-N 2.87Å
96R98.3Very high95.1Very high162 Ų162114.7 Ų114.761%0.61153%0.533SS*.Hα-helixtrans-58.9-43.3172.6-77.1-176.3-75.6154.8-14.7112.7R92 R93 V99 A100R92-R96 WeakPolarHBondContact O-CG 3.35Å; R92-R96 PolarHBondContact O-N 2.96Å; R92-R96 PolarHBondContact O-NE 2.9Å; R93-R96 PolarHBondContact O-N 3.42Å; R96-V99 PolarHBondContact O-N 3.06Å; R96-A100 WeakPolarHBondContact O-CB 3.29Å; R96-A100 PolarHBondContact O-N 2.98Å
97N98Very high96.1Very high115 Ų115117.2 Ų117.262%0.61554%0.543SS*.Hα-helixtrans-66.4-37.1177-177.7-101.1000112.1R93 R94 E95 A100 A101R93-N97 WeakPolarHBondContact O-CB 3.43Å; R93-N97 PolarHBondContact O-N 2.78Å; R94-N97 PolarHBondContact O-N 3.39Å; E95-N97 VanDerWaalsContact C-N 3.34Å; E95-N97 PolarHBondContact O-N 3.08Å; N97-A100 PolarHBondContact O-N 3.1Å; N97-A101 VanDerWaalsContact O-CB 3.3Å; N97-A101 WeakPolarHBondContact O-CB 3.22Å; N97-A101 PolarHBondContact O-N 2.74Å
98K98.4Very high96.8Very high162 Ų162123.2 Ų123.270%0.70457%0.565SS**Hα-helixtrans-59.3-47.6174.3-176.3-178.3179.1-175.80110.8R94 E95 A101 A102R94-K98 WeakPolarHBondContact O-CB 3.49Å; R94-K98 PolarHBondContact O-N 3.26Å; E95-K98 WeakPolarHBondContact O-CB 3.3Å; E95-K98 PolarHBondContact O-N 3.18Å; K98-A101 PolarHBondContact O-N 2.93Å; K98-A102 WeakPolarHBondContact O-CB 3.42Å; K98-A102 PolarHBondContact O-N 2.86Å
99V98.3Very high97.4Very high96 Ų96126 Ų12658%0.58257%0.574SS**Hα-helixtrans-64.4-44.2176.2176.40000111.2E95 R96 A101 A102 K103E95-V99 WeakPolarHBondContact O-CG2 3.34Å; E95-V99 PolarHBondContact O-N 2.87Å; R96-V99 PolarHBondContact O-N 3.06Å; V99-A101 PolarHBondContact O-N 3.11Å; V99-A102 PolarHBondContact O-N 3.01Å; V99-K103 WeakPolarHBondContact O-CB 3.36Å; V99-K103 PolarHBondContact O-N 3.21Å
100A98.6Very high97.7Very high56 Ų56124 Ų12446%0.46357%0.571SS.*Hα-helixtrans-62.9-41.7178.700000112.5R96 N97 K103 C104R96-A100 WeakPolarHBondContact O-CB 3.29Å; R96-A100 PolarHBondContact O-N 2.98Å; N97-A100 PolarHBondContact O-N 3.1Å; A100-K103 PolarHBondContact O-N 2.92Å; A100-C104 WeakPolarHBondContact O-CB 3.45Å; A100-C104 PolarHBondContact O-N 3.25Å
101A98.6Very high98Very high37 Ų37125.3 Ų125.331%0.30658%0.58SS.*Hα-helixtrans-65.1-43.3176.200000111.6N97 K98 V99 C104 R105N97-A101 VanDerWaalsContact O-CB 3.3Å; N97-A101 WeakPolarHBondContact O-CB 3.22Å; N97-A101 PolarHBondContact O-N 2.74Å; K98-A101 PolarHBondContact O-N 2.93Å; V99-A101 PolarHBondContact O-N 3.11Å; A101-C104 PolarHBondContact O-N 3.2Å; A101-R105 WeakPolarHBondContact O-CG 3.35Å; A101-R105 PolarHBondContact O-N 3.47Å
102A98.6Very high98.2Very high45 Ų45123.4 Ų123.437%0.37258%0.578SS.*Hα-helixtrans-60.9-45.317400000111.5K98 V99 C104 R105 N106K98-A102 WeakPolarHBondContact O-CB 3.42Å; K98-A102 PolarHBondContact O-N 2.86Å; V99-A102 PolarHBondContact O-N 3.01Å; A102-C104 PolarHBondContact O-N 3.49Å; A102-R105 PolarHBondContact O-N 3.47Å; A102-N106 WeakPolarHBondContact O-CB 3.3Å; A102-N106 PolarHBondContact O-N 2.64Å; A102-N106 PolarHBondContact O-OD1 3.45Å
103K98.7Very high98.4Very high157 Ų157118.1 Ų118.168%0.68356%0.564SS**Hα-helixtrans-62.5-40.1176.8-170.3174.4-176.1175.40112.4V99 A100 N106 K107V99-K103 WeakPolarHBondContact O-CB 3.36Å; V99-K103 PolarHBondContact O-N 3.21Å; A100-K103 PolarHBondContact O-N 2.92Å; K103-N106 PolarHBondContact O-N 2.97Å; K103-K107 VanDerWaalsContact O-CB 3.29Å; K103-K107 WeakPolarHBondContact O-CB 3.34Å; K103-K107 PolarHBondContact O-N 3.41Å
104C98.7Very high98.5Very high89 Ų89115.4 Ų115.460%0.60157%0.565SS**Hα-helixtrans-62.8-46.4175.6-175.70000111.4A100 A101 A102 K107 K108A100-C104 WeakPolarHBondContact O-CB 3.45Å; A100-C104 PolarHBondContact O-N 3.25Å; A101-C104 PolarHBondContact O-N 3.2Å; A102-C104 PolarHBondContact O-N 3.49Å; C104-K107 PolarHBondContact O-N 2.92Å; C104-K108 WeakPolarHBondContact O-CB 3.39Å; C104-K108 PolarHBondContact O-N 2.94Å
105R98.7Very high98.5Very high189 Ų189112.7 Ų112.771%0.71356%0.562SS**Hα-helixtrans-61.7-46.5176.1-71173.5-178.8176.2-0.9111.8A101 A102 K108 K109A101-R105 WeakPolarHBondContact O-CG 3.35Å; A101-R105 PolarHBondContact O-N 3.47Å; A102-R105 PolarHBondContact O-N 3.47Å; R105-K108 PolarHBondContact O-N 2.8Å; R105-K109 WeakPolarHBondContact O-CB 3.49Å; R105-K109 PolarHBondContact O-N 2.93Å
106N98.6Very high98.6Very high92 Ų92111.4 Ų111.449%0.49256%0.556SS.*Hα-helixtrans-63.3-45.9178.3-75.38.9000111.5A102 K103 K108 K109 E110A102-N106 WeakPolarHBondContact O-CB 3.3Å; A102-N106 PolarHBondContact O-N 2.64Å; A102-N106 PolarHBondContact O-OD1 3.45Å; K103-N106 PolarHBondContact O-N 2.97Å; N106-K108 VanDerWaalsContact C-N 3.28Å; N106-K108 PolarHBondContact O-N 3.36Å; N106-K109 CarbonylContact O-C 3.21Å; N106-K109 WeakPolarHBondContact O-CB 3.4Å; N106-K109 PolarHBondContact O-N 2.92Å; N106-K109 VanDerWaalsContact O-N 3.1Å; N106-E110 WeakPolarHBondContact O-CB 3.4Å; N106-E110 WeakPolarHBondContact O-CG 3.38Å; N106-E110 PolarHBondContact O-N 3.49Å
107K98.8Very high98.6Very high155 Ų155109.9 Ų109.967%0.67455%0.553SS**Hα-helixtrans-60.9-38.1177.4-172.7174.3-176.1179.10112.2K103 C104 K111K103-K107 VanDerWaalsContact O-CB 3.29Å; K103-K107 WeakPolarHBondContact O-CB 3.34Å; K103-K107 PolarHBondContact O-N 3.41Å; C104-K107 PolarHBondContact O-N 2.92Å; K107-K111 WeakPolarHBondContact O-CB 3.28Å; K107-K111 PolarHBondContact O-N 2.89Å; K107-K111 VanDerWaalsContact O-N 3.1Å
108K98.7Very high98.6Very high157 Ų157109.9 Ų109.968%0.68355%0.549SS*.Hα-helixtrans-64.9-46.2174.1-172.1178.6-179.3-177.40110.8C104 R105 N106 K111 T112C104-K108 WeakPolarHBondContact O-CB 3.39Å; C104-K108 PolarHBondContact O-N 2.94Å; R105-K108 PolarHBondContact O-N 2.8Å; N106-K108 VanDerWaalsContact C-N 3.28Å; N106-K108 PolarHBondContact O-N 3.36Å; K108-K111 PolarHBondContact O-N 2.94Å; K108-T112 PolarHBondContact O-N 3.41Å; K108-T112 VanDerWaalsContact O-N 3.08Å; K108-T112 PolarHBondContact O-OG1 3.12Å
109K98.7Very high98.6Very high132 Ų132104.4 Ų104.457%0.57453%0.532SS*.Hα-helixtrans-60.1-52.5177.5-175.8-177.8174.9-175.10111.5R105 N106 K111 T112 D113R105-K109 WeakPolarHBondContact O-CB 3.49Å; R105-K109 PolarHBondContact O-N 2.93Å; N106-K109 CarbonylContact O-C 3.21Å; N106-K109 WeakPolarHBondContact O-CB 3.4Å; N106-K109 PolarHBondContact O-N 2.92Å; N106-K109 VanDerWaalsContact O-N 3.1Å; K109-K111 VanDerWaalsContact C-N 3.28Å; K109-K111 PolarHBondContact O-N 3.15Å; K109-T112 CarbonylContact O-C 3.58Å; K109-T112 PolarHBondContact O-N 3.37Å; K109-D113 WeakPolarHBondContact CE-OD2 3.21Å; K109-D113 WeakPolarHBondContact O-CB 3.38Å; K109-D113 VanDerWaalsContact O-CG 3.26Å; K109-D113 PolarHBondContact O-N 2.93Å
110E98.7Very high98.7Very high119 Ų119104.7 Ų104.756%0.55653%0.527SS*.Hα-helixtrans-55.1-43177.7-73.2166.3-165.100111.8N106 T112 D113 C114N106-E110 WeakPolarHBondContact O-CB 3.4Å; N106-E110 WeakPolarHBondContact O-CG 3.38Å; N106-E110 PolarHBondContact O-N 3.49Å; E110-T112 PolarHBondContact O-N 3.12Å; E110-D113 PolarHBondContact O-N 2.95Å; E110-C114 WeakPolarHBondContact O-CB 3.23Å; E110-C114 PolarHBondContact O-N 2.68Å; E110-C114 PolarHBondContact O-SG 2.92Å
111K98.6Very high98.7Very high146 Ų146107.1 Ų107.164%0.63553%0.531SS*.Hα-helixtrans-60.7-46175.8-174.2179.5-179.9-177.10111.7K107 K108 K109 L115K107-K111 WeakPolarHBondContact O-CB 3.28Å; K107-K111 PolarHBondContact O-N 2.89Å; K107-K111 VanDerWaalsContact O-N 3.1Å; K108-K111 PolarHBondContact O-N 2.94Å; K109-K111 VanDerWaalsContact C-N 3.28Å; K109-K111 PolarHBondContact O-N 3.15Å; K111-L115 HydrophobicContact CG-CD1 4.45Å; K111-L115 WeakPolarHBondContact O-CG 3.44Å; K111-L115 PolarHBondContact O-N 3.14Å; K111-L115 VanDerWaalsContact O-N 3.15Å
112T98.5Very high98.7Very high81 Ų81110.6 Ų110.650%0.49754%0.543SS..Hα-helixtrans-65-44.6177.8-62.20000111.4K108 K109 E110 C114 L115 Q116K108-T112 PolarHBondContact O-N 3.41Å; K108-T112 VanDerWaalsContact O-N 3.08Å; K108-T112 PolarHBondContact O-OG1 3.12Å; K109-T112 CarbonylContact O-C 3.58Å; K109-T112 PolarHBondContact O-N 3.37Å; E110-T112 PolarHBondContact O-N 3.12Å; T112-C114 VanDerWaalsContact C-N 3.32Å; T112-C114 PolarHBondContact O-N 3.35Å; T112-L115 PolarHBondContact O-N 3.35Å; T112-Q116 WeakPolarHBondContact O-CB 3.47Å; T112-Q116 PolarHBondContact O-N 3.05Å
113D98.7Very high98.7Very high67 Ų67114.1 Ų114.136%0.35855%0.552SS.*Hα-helixtrans-62.5-38.5178.8-66.5-5.9000111.3K109 E110 K117K109-D113 WeakPolarHBondContact CE-OD2 3.21Å; K109-D113 WeakPolarHBondContact O-CB 3.38Å; K109-D113 VanDerWaalsContact O-CG 3.26Å; K109-D113 PolarHBondContact O-N 2.93Å; E110-D113 PolarHBondContact O-N 2.95Å; D113-K117 VanDerWaalsContact O-CG 3.28Å; D113-K117 WeakPolarHBondContact O-CG 3.46Å; D113-K117 PolarHBondContact O-N 2.86Å
114C98.5Very high98.7Very high81 Ų81109.9 Ų109.955%0.54754%0.543SS..Hα-helixtrans-63.8-47.7174.6-73.20000112.1E110 T112 Q116 K117 E118E110-C114 WeakPolarHBondContact O-CB 3.23Å; E110-C114 PolarHBondContact O-N 2.68Å; E110-C114 PolarHBondContact O-SG 2.92Å; T112-C114 VanDerWaalsContact C-N 3.32Å; T112-C114 PolarHBondContact O-N 3.35Å; C114-Q116 VanDerWaalsContact C-N 3.31Å; C114-Q116 PolarHBondContact O-N 3.46Å; C114-K117 PolarHBondContact O-N 3.18Å; C114-E118 WeakPolarHBondContact O-CB 3.4Å; C114-E118 PolarHBondContact O-N 2.94Å
115L98.8Very high98.6Very high99 Ų99108.8 Ų108.852%0.51853%0.533SS..Hα-helixtrans-63.3-39.2178.8-69.8172.5000111.8K111 T112 E118 S119K111-L115 HydrophobicContact CG-CD1 4.45Å; K111-L115 WeakPolarHBondContact O-CG 3.44Å; K111-L115 PolarHBondContact O-N 3.14Å; K111-L115 VanDerWaalsContact O-N 3.15Å; T112-L115 PolarHBondContact O-N 3.35Å; L115-E118 PolarHBondContact O-N 3.38Å; L115-S119 PolarHBondContact O-N 3.19Å
116Q98.6Very high98.6Very high103 Ų103103.6 Ų103.648%0.48152%0.519SS..Hα-helixtrans-62.3-48.1177.2-176.361.63100111.2T112 C114 E118 S119 E120T112-Q116 WeakPolarHBondContact O-CB 3.47Å; T112-Q116 PolarHBondContact O-N 3.05Å; C114-Q116 VanDerWaalsContact C-N 3.31Å; C114-Q116 PolarHBondContact O-N 3.46Å; Q116-E118 VanDerWaalsContact C-N 3.32Å; Q116-E118 PolarHBondContact O-N 3.3Å; Q116-S119 WeakPolarHBondContact O-CB 3.14Å; Q116-S119 PolarHBondContact O-N 3.33Å; Q116-E120 WeakPolarHBondContact CG-OE1 3.45Å; Q116-E120 PolarHBondContact NE2-OE1 2.84Å; Q116-E120 VanDerWaalsContact NE2-OE1 3.11Å; Q116-E120 WeakPolarHBondContact O-CG 3.2Å; Q116-E120 PolarHBondContact O-N 2.97Å
117K98.7Very high98.6Very high130 Ų130102.6 Ų102.657%0.56552%0.519SS*.Hα-helixtrans-61.3-40.6176.1-72.8172.9-177.7-179.70112.4D113 C114 S119 E120 I121D113-K117 VanDerWaalsContact O-CG 3.28Å; D113-K117 WeakPolarHBondContact O-CG 3.46Å; D113-K117 PolarHBondContact O-N 2.86Å; C114-K117 PolarHBondContact O-N 3.18Å; K117-S119 VanDerWaalsContact C-N 3.34Å; K117-E120 PolarHBondContact O-N 2.99Å; K117-I121 WeakPolarHBondContact O-CD1 3.47Å; K117-I121 VanDerWaalsContact O-CG1 3.23Å; K117-I121 WeakPolarHBondContact O-CG1 3.46Å; K117-I121 PolarHBondContact O-N 2.96Å
118E98.6Very high98.6Very high114 Ų114100.5 Ų100.553%0.53351%0.512SS..Hα-helixtrans-62.9-42176.1-172.7174.3-17500111.2C114 L115 Q116 I121 L122C114-E118 WeakPolarHBondContact O-CB 3.4Å; C114-E118 PolarHBondContact O-N 2.94Å; L115-E118 PolarHBondContact O-N 3.38Å; Q116-E118 VanDerWaalsContact C-N 3.32Å; Q116-E118 PolarHBondContact O-N 3.3Å; E118-I121 PolarHBondContact O-N 3.38Å; E118-L122 HydrophobicContact CG-CD1 4.18Å; E118-L122 WeakPolarHBondContact O-CB 3.28Å; E118-L122 VanDerWaalsContact O-CG 3.28Å; E118-L122 WeakPolarHBondContact O-CG 3.41Å; E118-L122 PolarHBondContact O-N 3.49Å
119S98.8Very high98.6Very high47 Ų4797.6 Ų97.633%0.32950%0.503SS..Hα-helixtrans-58.2-49.9173-160.30000111.6L115 Q116 K117 I121 L122 E123L115-S119 PolarHBondContact O-N 3.19Å; Q116-S119 WeakPolarHBondContact O-CB 3.14Å; Q116-S119 PolarHBondContact O-N 3.33Å; K117-S119 VanDerWaalsContact C-N 3.34Å; S119-I121 VanDerWaalsContact C-N 3.33Å; S119-I121 PolarHBondContact O-N 3.39Å; S119-L122 PolarHBondContact O-N 3.02Å; S119-E123 WeakPolarHBondContact O-CB 3.19Å; S119-E123 WeakPolarHBondContact O-CG 3.29Å; S119-E123 PolarHBondContact O-N 2.94Å; S119-E123 PolarHBondContact OG-OE1 2.89Å
120E98.7Very high98.6Very high103 Ų10397.8 Ų97.848%0.48150%0.504SS..Hα-helixtrans-60.1-41.6-179.7-71.6166.1-167.300112.1Q116 K117 S124Q116-E120 WeakPolarHBondContact CG-OE1 3.45Å; Q116-E120 PolarHBondContact NE2-OE1 2.84Å; Q116-E120 VanDerWaalsContact NE2-OE1 3.11Å; Q116-E120 WeakPolarHBondContact O-CG 3.2Å; Q116-E120 PolarHBondContact O-N 2.97Å; K117-E120 PolarHBondContact O-N 2.99Å; E120-S124 WeakPolarHBondContact O-CB 3.36Å; E120-S124 PolarHBondContact O-N 3.37Å
121I98.6Very high98.6Very high107 Ų10794.8 Ų94.855%0.54950%0.5SS..Hα-helixtrans-63.8-48175.8-68.3164.1000110.3K117 E118 S119 E123 S124 V125K117-I121 WeakPolarHBondContact O-CD1 3.47Å; K117-I121 VanDerWaalsContact O-CG1 3.23Å; K117-I121 WeakPolarHBondContact O-CG1 3.46Å; K117-I121 PolarHBondContact O-N 2.96Å; E118-I121 PolarHBondContact O-N 3.38Å; S119-I121 VanDerWaalsContact C-N 3.33Å; S119-I121 PolarHBondContact O-N 3.39Å; I121-E123 VanDerWaalsContact C-N 3.34Å; I121-E123 PolarHBondContact O-N 3.46Å; I121-S124 WeakPolarHBondContact O-CB 3.5Å; I121-S124 PolarHBondContact O-N 3.34Å; I121-V125 HydrophobicContact CG2-CG2 4.41Å; I121-V125 WeakPolarHBondContact O-CG2 3.49Å; I121-V125 PolarHBondContact O-N 2.9Å
122L98.8Very high98.6Very high109 Ų10992.3 Ų92.357%0.57149%0.491SS*.Hα-helixtrans-63.9-39.1-179.6-72.2173.7000112E118 S119 N126E118-L122 HydrophobicContact CG-CD1 4.18Å; E118-L122 WeakPolarHBondContact O-CB 3.28Å; E118-L122 VanDerWaalsContact O-CG 3.28Å; E118-L122 WeakPolarHBondContact O-CG 3.41Å; E118-L122 PolarHBondContact O-N 3.49Å; S119-L122 PolarHBondContact O-N 3.02Å; L122-N126 WeakPolarHBondContact O-CB 3.41Å; L122-N126 PolarHBondContact O-N 3.11Å
123E98.6Very high98.6Very high120 Ų12092.1 Ų92.156%0.56149%0.489SS*.Hα-helixtrans-63-44.9174.9-76.2169.1-147.200111.6S119 I121 N126 S127S119-E123 WeakPolarHBondContact O-CB 3.19Å; S119-E123 WeakPolarHBondContact O-CG 3.29Å; S119-E123 PolarHBondContact O-N 2.94Å; S119-E123 PolarHBondContact OG-OE1 2.89Å; I121-E123 VanDerWaalsContact C-N 3.34Å; I121-E123 PolarHBondContact O-N 3.46Å; E123-N126 PolarHBondContact O-N 3.18Å; E123-S127 WeakPolarHBondContact O-CB 3.29Å; E123-S127 PolarHBondContact O-N 3.26Å
124S98.6Very high98.5Very high68 Ų6893 Ų9348%0.47649%0.491SS..Hα-helixtrans-58.6-53.3175-178.10000111.3E120 I121 N126 S127 E128E120-S124 WeakPolarHBondContact O-CB 3.36Å; E120-S124 PolarHBondContact O-N 3.37Å; I121-S124 WeakPolarHBondContact O-CB 3.5Å; I121-S124 PolarHBondContact O-N 3.34Å; S124-N126 VanDerWaalsContact C-N 3.3Å; S124-N126 PolarHBondContact O-N 3.45Å; S124-S127 PolarHBondContact O-N 3.15Å; S124-S127 VanDerWaalsContact O-N 3.14Å; S124-S127 PolarHBondContact O-OG 3.37Å; S124-E128 PolarHBondContact O-N 3.25Å
125V98.6Very high98.5Very high65 Ų6594 Ų9439%0.39449%0.488SS..Hα-helixtrans-60.8-39.4178.7173.50000111.5I121 E128 L129I121-V125 HydrophobicContact CG2-CG2 4.41Å; I121-V125 WeakPolarHBondContact O-CG2 3.49Å; I121-V125 PolarHBondContact O-N 2.9Å; V125-E128 PolarHBondContact O-N 2.92Å; V125-L129 HydrophobicContact CG1-CD1 3.95Å; V125-L129 HydrophobicContact CG1-CG 4.32Å; V125-L129 WeakPolarHBondContact O-CB 3.22Å; V125-L129 VanDerWaalsContact O-CG 3.3Å; V125-L129 WeakPolarHBondContact O-CG 3.44Å; V125-L129 PolarHBondContact O-N 3.2Å
126N98.6Very high98.5Very high80 Ų8094.4 Ų94.443%0.42849%0.49SS..Hα-helixtrans-62.5-44.7176.7-170.5-66000111.5L122 E123 S124 E128 L129 K130L122-N126 WeakPolarHBondContact O-CB 3.41Å; L122-N126 PolarHBondContact O-N 3.11Å; E123-N126 PolarHBondContact O-N 3.18Å; S124-N126 VanDerWaalsContact C-N 3.3Å; S124-N126 PolarHBondContact O-N 3.45Å; N126-E128 VanDerWaalsContact C-N 3.35Å; N126-L129 PolarHBondContact O-N 2.94Å; N126-K130 WeakPolarHBondContact O-CB 3.08Å; N126-K130 WeakPolarHBondContact O-CG 3.3Å; N126-K130 PolarHBondContact O-N 3.37Å; N126-K130 VanDerWaalsContact OD1-CD 3.29Å; N126-K130 WeakPolarHBondContact OD1-CD 3.34Å; N126-K130 WeakPolarHBondContact OD1-CE 3.49Å; N126-K130 PolarHBondContact OD1-NZ 3.37Å
127S98.4Very high98.3Very high71 Ų7194.7 Ų94.750%0.49749%0.49SS..Hα-helixtrans-63-41.5177.675.50000111.9E123 S124 K130 A131E123-S127 WeakPolarHBondContact O-CB 3.29Å; E123-S127 PolarHBondContact O-N 3.26Å; S124-S127 PolarHBondContact O-N 3.15Å; S124-S127 VanDerWaalsContact O-N 3.14Å; S124-S127 PolarHBondContact O-OG 3.37Å; S127-K130 PolarHBondContact O-N 3.41Å; S127-A131 PolarHBondContact O-N 3.02Å
128E98.6Very high98.1Very high111 Ų11191.6 Ų91.652%0.51948%0.479SS..Hα-helixtrans-64.5-47.3177.3-171.4-175.3168.500111.6S124 V125 N126 K130 A131 Q132S124-E128 PolarHBondContact O-N 3.25Å; V125-E128 PolarHBondContact O-N 2.92Å; N126-E128 VanDerWaalsContact C-N 3.35Å; E128-K130 VanDerWaalsContact C-N 3.32Å; E128-K130 PolarHBondContact O-N 2.96Å; E128-A131 PolarHBondContact O-N 2.8Å; E128-Q132 WeakPolarHBondContact O-CG 3.48Å; E128-Q132 PolarHBondContact O-N 3.2Å; E128-Q132 PolarHBondContact OE1-NE2 2.97Å
129L98.7Very high97.9Very high96 Ų9690.1 Ų90.150%0.50347%0.472SS..Hα-helixtrans-62.4-39177.5-72.2174.6000112V125 N126 Q132 V133V125-L129 HydrophobicContact CG1-CD1 3.95Å; V125-L129 HydrophobicContact CG1-CG 4.32Å; V125-L129 WeakPolarHBondContact O-CB 3.22Å; V125-L129 VanDerWaalsContact O-CG 3.3Å; V125-L129 WeakPolarHBondContact O-CG 3.44Å; V125-L129 PolarHBondContact O-N 3.2Å; N126-L129 PolarHBondContact O-N 2.94Å; L129-Q132 PolarHBondContact O-N 3.4Å; L129-V133 VanDerWaalsContact O-CG2 3.31Å; L129-V133 WeakPolarHBondContact O-CG2 3.38Å; L129-V133 PolarHBondContact O-N 3.43Å
130K98.1Very high97.7Very high136 Ų13694.1 Ų94.159%0.59148%0.484SS*.Hα-helixtrans-61.8-44.8174.4-78.9172.8173.8161.40111.7N126 S127 E128 Q132 V133 E134N126-K130 WeakPolarHBondContact O-CB 3.08Å; N126-K130 WeakPolarHBondContact O-CG 3.3Å; N126-K130 PolarHBondContact O-N 3.37Å; N126-K130 VanDerWaalsContact OD1-CD 3.29Å; N126-K130 WeakPolarHBondContact OD1-CD 3.34Å; N126-K130 WeakPolarHBondContact OD1-CE 3.49Å; N126-K130 PolarHBondContact OD1-NZ 3.37Å; S127-K130 PolarHBondContact O-N 3.41Å; E128-K130 VanDerWaalsContact C-N 3.32Å; E128-K130 PolarHBondContact O-N 2.96Å; K130-Q132 VanDerWaalsContact C-N 3.35Å; K130-Q132 PolarHBondContact O-N 2.98Å; K130-V133 PolarHBondContact O-N 3.06Å; K130-E134 PolarHBondContact O-N 3.48Å
131A98.4Very high97.3Very high56 Ų5694.3 Ų94.346%0.46348%0.484SS..Hα-helixtrans-61.6-42.5176.200000111.7S127 E128 V133 E134 E135S127-A131 PolarHBondContact O-N 3.02Å; E128-A131 PolarHBondContact O-N 2.8Å; A131-V133 PolarHBondContact O-N 3.44Å; A131-E134 PolarHBondContact O-N 2.9Å; A131-E135 WeakPolarHBondContact O-CB 3.35Å; A131-E135 PolarHBondContact O-N 3.04Å
132Q98.6Very high96.9Very high95 Ų9595.3 Ų95.344%0.44449%0.487SS..Hα-helixtrans-62.9-40.5175.3-69.2-179.63100112.3E128 L129 K130 E134 E135 L136E128-Q132 WeakPolarHBondContact O-CG 3.48Å; E128-Q132 PolarHBondContact O-N 3.2Å; E128-Q132 PolarHBondContact OE1-NE2 2.97Å; L129-Q132 PolarHBondContact O-N 3.4Å; K130-Q132 VanDerWaalsContact C-N 3.35Å; K130-Q132 PolarHBondContact O-N 2.98Å; Q132-E134 VanDerWaalsContact C-N 3.35Å; Q132-E135 PolarHBondContact O-N 3.08Å; Q132-L136 WeakPolarHBondContact O-CB 3.41Å; Q132-L136 VanDerWaalsContact O-CG 3.28Å; Q132-L136 WeakPolarHBondContact O-CG 3.45Å; Q132-L136 PolarHBondContact O-N 3.29Å
133V98.1Very high96.7Very high76 Ų7695 Ų9546%0.46149%0.485SS..Hα-helixtrans-62.8-42.9175.6167.30000111.2L129 K130 A131 K137L129-V133 VanDerWaalsContact O-CG2 3.31Å; L129-V133 WeakPolarHBondContact O-CG2 3.38Å; L129-V133 PolarHBondContact O-N 3.43Å; K130-V133 PolarHBondContact O-N 3.06Å; A131-V133 PolarHBondContact O-N 3.44Å; V133-K137 HydrophobicContact CG1-CD 4.23Å; V133-K137 WeakPolarHBondContact O-CB 3.36Å; V133-K137 VanDerWaalsContact O-CG 3.3Å; V133-K137 WeakPolarHBondContact O-CG 3.34Å; V133-K137 PolarHBondContact O-N 3.49Å
134E97.6Very high96.1Very high87 Ų8791.6 Ų91.641%0.40747%0.472SS..Hα-helixtrans-63.9-46.4177.5-175.4170.1-15700111.8K130 A131 Q132 L136 K137 N138K130-E134 PolarHBondContact O-N 3.48Å; A131-E134 PolarHBondContact O-N 2.9Å; Q132-E134 VanDerWaalsContact C-N 3.35Å; E134-L136 PolarHBondContact O-N 2.82Å; E134-K137 WeakPolarHBondContact O-CB 3.46Å; E134-K137 PolarHBondContact O-N 2.86Å; E134-K137 VanDerWaalsContact O-N 3.14Å; E134-N138 PolarHBondContact O-N 3.44Å
135E98.1Very high95.3Very high101 Ų10194.6 Ų94.647%0.47247%0.474SS..Hα-helixtrans-58.7-46.4176.3178.855.2-155.400111.6A131 Q132 K137 N138 Q139A131-E135 WeakPolarHBondContact O-CB 3.35Å; A131-E135 PolarHBondContact O-N 3.04Å; Q132-E135 PolarHBondContact O-N 3.08Å; E135-K137 VanDerWaalsContact C-N 3.32Å; E135-K137 PolarHBondContact O-N 3.48Å; E135-N138 WeakPolarHBondContact O-CB 3.26Å; E135-N138 PolarHBondContact O-N 3.1Å; E135-N138 VanDerWaalsContact O-N 3.17Å; E135-Q139 WeakPolarHBondContact O-CG 3.4Å; E135-Q139 PolarHBondContact O-N 3.39Å; E135-Q139 PolarHBondContact OE1-NE2 2.78Å
136L98.2Very high94.8Very high108 Ų10896.8 Ų96.857%0.56548%0.482SS*.Hα-helixtrans-63.9-36.2176.8-71.8172.4000112.6Q132 E134 K140Q132-L136 WeakPolarHBondContact O-CB 3.41Å; Q132-L136 VanDerWaalsContact O-CG 3.28Å; Q132-L136 WeakPolarHBondContact O-CG 3.45Å; Q132-L136 PolarHBondContact O-N 3.29Å; E134-L136 PolarHBondContact O-N 2.82Å; L136-K140 WeakPolarHBondContact O-CB 3.37Å; L136-K140 PolarHBondContact O-N 2.88Å
137K95.2Very high94.2Very high109 Ų10998.2 Ų98.247%0.47449%0.489SS..Hα-helixtrans-63.2-43.9173.2-78.2175177.2-178.50110.9V133 E134 E135 K140 Q141V133-K137 HydrophobicContact CG1-CD 4.23Å; V133-K137 WeakPolarHBondContact O-CB 3.36Å; V133-K137 VanDerWaalsContact O-CG 3.3Å; V133-K137 WeakPolarHBondContact O-CG 3.34Å; V133-K137 PolarHBondContact O-N 3.49Å; E134-K137 WeakPolarHBondContact O-CB 3.46Å; E134-K137 PolarHBondContact O-N 2.86Å; E134-K137 VanDerWaalsContact O-N 3.14Å; E135-K137 VanDerWaalsContact C-N 3.32Å; E135-K137 PolarHBondContact O-N 3.48Å; K137-K140 PolarHBondContact O-N 2.79Å; K137-Q141 WeakPolarHBondContact O-CG 3.4Å; K137-Q141 PolarHBondContact O-N 3.38Å
138N93.8Very high93.2Very high64 Ų6497.2 Ų97.234%0.34248%0.478SS..Hα-helixtrans-63.3-46.7178.1-70.2-19.5000111.3E134 E135 K140 Q141 Q142E134-N138 PolarHBondContact O-N 3.44Å; E135-N138 WeakPolarHBondContact O-CB 3.26Å; E135-N138 PolarHBondContact O-N 3.1Å; E135-N138 VanDerWaalsContact O-N 3.17Å; N138-K140 PolarHBondContact O-N 2.91Å; N138-Q141 PolarHBondContact O-N 3.01Å; N138-Q142 WeakPolarHBondContact O-CG 3.43Å; N138-Q142 PolarHBondContact O-N 3.1Å
139Q95.9Very high92.4Very high84 Ų8497.5 Ų97.539%0.39348%0.482SS..Hα-helixtrans-59.5-44.5175.7-70177.26.600111.9E135 Q141 Q142 L143E135-Q139 WeakPolarHBondContact O-CG 3.4Å; E135-Q139 PolarHBondContact O-N 3.39Å; E135-Q139 PolarHBondContact OE1-NE2 2.78Å; Q139-Q141 PolarHBondContact O-N 3.32Å; Q139-Q142 PolarHBondContact O-N 3.24Å; Q139-L143 WeakPolarHBondContact O-CG 3.49Å; Q139-L143 PolarHBondContact O-N 3.47Å
140K93.4Very high91.6Very high131 Ų13197.8 Ų97.857%0.5748%0.481SS*.Hα-helixtrans-58-48.3174.1177.5-169.5170.1-173.90111.2L136 K137 N138 Q142 L143 V144L136-K140 WeakPolarHBondContact O-CB 3.37Å; L136-K140 PolarHBondContact O-N 2.88Å; K137-K140 PolarHBondContact O-N 2.79Å; N138-K140 PolarHBondContact O-N 2.91Å; K140-Q142 VanDerWaalsContact C-N 3.34Å; K140-Q142 PolarHBondContact O-N 3.29Å; K140-L143 PolarHBondContact O-N 3.29Å; K140-V144 HydrophobicContact CG-CG2 4.37Å; K140-V144 WeakPolarHBondContact O-CB 3.23Å; K140-V144 VanDerWaalsContact O-CG2 3.28Å; K140-V144 WeakPolarHBondContact O-CG2 3.16Å; K140-V144 PolarHBondContact O-N 3.28Å
141Q90.8Very high90.5Very high106 Ų10694.2 Ų94.250%0.49546%0.463SS..Hα-helixtrans-60.5-43.7179.8-73.9175.5900111.5K137 N138 Q139 V144 Y145K137-Q141 WeakPolarHBondContact O-CG 3.4Å; K137-Q141 PolarHBondContact O-N 3.38Å; N138-Q141 PolarHBondContact O-N 3.01Å; Q139-Q141 PolarHBondContact O-N 3.32Å; Q141-V144 PolarHBondContact O-N 2.8Å; Q141-Y145 WeakPolarHBondContact O-CB 3.46Å; Q141-Y145 PolarHBondContact O-N 3.46Å
142Q90.9Very high89.5Confident128 Ų12896.6 Ų96.660%0.59847%0.474SS*.Hα-helixtrans-61.4-45.5175.9-72.2-179-000112.3N138 Q139 K140 Y145 M146N138-Q142 WeakPolarHBondContact O-CG 3.43Å; N138-Q142 PolarHBondContact O-N 3.1Å; Q139-Q142 PolarHBondContact O-N 3.24Å; K140-Q142 VanDerWaalsContact C-N 3.34Å; K140-Q142 PolarHBondContact O-N 3.29Å; Q142-Y145 WeakPolarHBondContact O-CB 3.33Å; Q142-Y145 PolarHBondContact O-N 2.74Å; Q142-M146 WeakPolarHBondContact O-CG 3.03Å; Q142-M146 PolarHBondContact O-N 3.33Å
143L92.5Very high88.5Confident102 Ų10296.9 Ų96.953%0.53448%0.483SS..Hα-helixtrans-61.9-45.4176.6-72.2174.8000111.7Q139 K140 Y145 M146 L147Q139-L143 WeakPolarHBondContact O-CG 3.49Å; Q139-L143 PolarHBondContact O-N 3.47Å; K140-L143 PolarHBondContact O-N 3.29Å; L143-Y145 VanDerWaalsContact C-N 3.32Å; L143-Y145 PolarHBondContact O-N 3.47Å; L143-M146 HydrophobicContact CD2-CE 3.67Å; L143-M146 PolarHBondContact O-N 2.83Å; L143-L147 WeakPolarHBondContact O-CG 3.44Å; L143-L147 PolarHBondContact O-N 3.33Å
144V85.9Confident87.7Confident49 Ų4994.3 Ų94.330%0.29747%0.468SS..Hα-helixtrans-60.5-43.3176.2169.10000110.8K140 Q141 L147 N148K140-V144 HydrophobicContact CG-CG2 4.37Å; K140-V144 WeakPolarHBondContact O-CB 3.23Å; K140-V144 VanDerWaalsContact O-CG2 3.28Å; K140-V144 WeakPolarHBondContact O-CG2 3.16Å; K140-V144 PolarHBondContact O-N 3.28Å; Q141-V144 PolarHBondContact O-N 2.8Å; V144-L147 PolarHBondContact O-N 2.79Å; V144-N148 WeakPolarHBondContact O-CB 3.44Å; V144-N148 VanDerWaalsContact O-CG 3.25Å; V144-N148 PolarHBondContact O-N 2.99Å; V144-N148 PolarHBondContact O-ND2 3.49Å
145Y82.9Confident86.5Confident132 Ų13296.5 Ų96.552%0.51848%0.481SS..Hα-helixtrans-59.2-49.2175.7173.1-102.1000111.9Q141 Q142 L143 L147 N148 L149 F171Q141-Y145 WeakPolarHBondContact O-CB 3.46Å; Q141-Y145 PolarHBondContact O-N 3.46Å; Q142-Y145 WeakPolarHBondContact O-CB 3.33Å; Q142-Y145 PolarHBondContact O-N 2.74Å; L143-Y145 VanDerWaalsContact C-N 3.32Å; L143-Y145 PolarHBondContact O-N 3.47Å; Y145-L147 PolarHBondContact O-N 2.91Å; Y145-N148 PolarHBondContact O-N 3.28Å; Y145-L149 PolarHBondContact O-N 2.85Å; Y145-F171 HydrophobicContact CD2-CZ 4.37Å
146M88.6Confident85.2Confident111 Ų11197.3 Ų97.355%0.54749%0.492SS..Hα-helixtrans-61.4-42.7177.8-71.6-165.8-6200112.4Q142 L143 N148 L149 H150Q142-M146 WeakPolarHBondContact O-CG 3.03Å; Q142-M146 PolarHBondContact O-N 3.33Å; L143-M146 HydrophobicContact CD2-CE 3.67Å; L143-M146 PolarHBondContact O-N 2.83Å; M146-N148 VanDerWaalsContact C-N 3.31Å; M146-N148 PolarHBondContact O-N 3.35Å; M146-L149 PolarHBondContact O-N 3.31Å; M146-H150 PolarHBondContact O-N 2.89Å
147L86.1Confident83.5Confident110 Ų11097 Ų9758%0.57648%0.484SS*.Hα-helixtrans-62.1-40.7176.2-73.2175.5000111.7L143 V144 Y145 L149 H150 R151L143-L147 WeakPolarHBondContact O-CG 3.44Å; L143-L147 PolarHBondContact O-N 3.33Å; V144-L147 PolarHBondContact O-N 2.79Å; Y145-L147 PolarHBondContact O-N 2.91Å; L147-L149 VanDerWaalsContact C-N 3.35Å; L147-H150 PolarHBondContact O-N 3.43Å; L147-R151 PolarHBondContact O-N 3.49Å
148N76.8Confident81.6Confident49 Ų4995.7 Ų95.726%0.26249%0.493SS..Hα-helixtrans-67-35.6177.6-74.6-21.2000112.4V144 Y145 M146 H150 R151 P152 F171V144-N148 WeakPolarHBondContact O-CB 3.44Å; V144-N148 VanDerWaalsContact O-CG 3.25Å; V144-N148 PolarHBondContact O-N 2.99Å; V144-N148 PolarHBondContact O-ND2 3.49Å; Y145-N148 PolarHBondContact O-N 3.28Å; M146-N148 VanDerWaalsContact C-N 3.31Å; M146-N148 PolarHBondContact O-N 3.35Å; N148-H150 VanDerWaalsContact C-N 3.35Å; N148-R151 PolarHBondContact O-N 2.82Å; N148-P152 VanDerWaalsContact O-CD 3.31Å; N148-P152 WeakPolarHBondContact O-CD 3.42Å; N148-F171 WeakPolarHBondContact ND2-CD2 3.45Å
149L81Confident79.8Confident118 Ų118100.1 Ų100.162%0.61851%0.512SS*.Hα-helixtrans-67.5-35.6174.6-168.667.5000112.2Y145 M146 L147 P152Y145-L149 PolarHBondContact O-N 2.85Å; M146-L149 PolarHBondContact O-N 3.31Å; L147-L149 VanDerWaalsContact C-N 3.35Å; L149-P152 WeakPolarHBondContact O-CD 3.48Å
150H82.9Confident77.9Confident101 Ų101102.7 Ų102.747%0.46853%0.528SS..Hα-helixtrans-75-32176.3178.865.8000113.2M146 L147 N148 P152 T153 C154M146-H150 PolarHBondContact O-N 2.89Å; L147-H150 PolarHBondContact O-N 3.43Å; N148-H150 VanDerWaalsContact C-N 3.35Å; H150-P152 VanDerWaalsContact C-CD 3.42Å; H150-P152 VanDerWaalsContact O-N 3.15Å; H150-T153 CarbonylContact O-C 3.5Å; H150-T153 PolarHBondContact O-N 3.38Å; H150-T153 PolarHBondContact O-OG1 2.88Å; H150-C154 PolarHBondContact O-N 3.47Å
151R75.3Confident75.9Confident61 Ų6199.2 Ų99.223%0.2353%0.529CS..THydrogen-bonded Turntrans-49.3-42.3-171.9-149.7-179.3-172.2113.2-5.3114.6L147 N148 C154 R157 T163 E167L147-R151 PolarHBondContact O-N 3.49Å; N148-R151 PolarHBondContact O-N 2.82Å; R151-C154 WeakPolarHBondContact O-CB 3.42Å; R151-R157 VanDerWaalsContact NE-CZ 3.26Å; R151-R157 VanDerWaalsContact NE-NH1 3.18Å; R151-T163 HydrophobicContact CG-CG2 4.24Å; R151-E167 IonicContact CZ-OE2 2.75Å; R151-E167 IonicContact NE-OE2 3.84Å; R151-E167 PolarHBondContact NE-OE2 3.4Å; R151-E167 VanDerWaalsContact NE-OE2 3.13Å; R151-E167 IonicContact NH2-OE1 2.87Å; R151-E167 PolarHBondContact NH2-OE1 2.95Å; R151-E167 IonicContact NH2-OE2 3.13Å; R151-E167 PolarHBondContact NH2-OE2 2.99Å
152P76.7Confident74.2Confident106 Ų106102.6 Ų102.669%0.68855%0.545SS*.THydrogen-bonded Turntrans-72.6-24.7178.8-17.932.8000114.4N148 L149 H150N148-P152 VanDerWaalsContact O-CD 3.31Å; N148-P152 WeakPolarHBondContact O-CD 3.42Å; L149-P152 WeakPolarHBondContact O-CD 3.48Å; H150-P152 VanDerWaalsContact C-CD 3.42Å; H150-P152 VanDerWaalsContact O-N 3.15Å
153T78.8Confident72.4Confident101 Ų10199.4 Ų99.462%0.6253%0.534SS*.THydrogen-bonded Turntrans-98.8-2.2-179.761.30000112.5H150 I155H150-T153 CarbonylContact O-C 3.5Å; H150-T153 PolarHBondContact O-N 3.38Å; H150-T153 PolarHBondContact O-OG1 2.88Å; T153-I155 PolarHBondContact O-N 2.96Å
154C80.7Confident70.9Confident22 Ų2297.5 Ų97.515%0.14953%0.528CS..  trans-68.1112.1-178.8-172.10000111.2H150 R151 V156 R157 A158H150-C154 PolarHBondContact O-N 3.47Å; R151-C154 WeakPolarHBondContact O-CB 3.42Å; C154-V156 PolarHBondContact O-N 2.78Å; C154-V156 VanDerWaalsContact O-N 3.16Å; C154-R157 HydrophobicContact CB-CB 4.4Å; C154-R157 PolarHBondContact O-N 3.05Å; C154-A158 PolarHBondContact O-N 2.83Å
155I71.1Confident69.6Low133 Ų133101 Ų10168%0.68254%0.541SS*.Hα-helixtrans-58.7-29.9-179.8-61165000111.9T153 R157 A158T153-I155 PolarHBondContact O-N 2.96Å; I155-R157 VanDerWaalsContact C-N 3.33Å; I155-R157 PolarHBondContact O-N 3Å; I155-A158 PolarHBondContact O-N 2.68Å
156V71.3Confident68.4Low118 Ų118100.2 Ų100.272%0.71555%0.546SS*.Hα-helixtrans-68.3-30.1176.7-175.60000111.9C154C154-V156 PolarHBondContact O-N 2.78Å; C154-V156 VanDerWaalsContact O-N 3.16Å
157R62.8Low67Low103 Ų10398.5 Ų98.539%0.38954%0.537SS..Hα-helixtrans-92.2-23.1175.6-75.2-170.9-174.5-120.10.5113.8R151 C154 I155 Q159 N160 G161 E167R151-R157 VanDerWaalsContact NE-CZ 3.26Å; R151-R157 VanDerWaalsContact NE-NH1 3.18Å; C154-R157 HydrophobicContact CB-CB 4.4Å; C154-R157 PolarHBondContact O-N 3.05Å; I155-R157 VanDerWaalsContact C-N 3.33Å; I155-R157 PolarHBondContact O-N 3Å; R157-Q159 PolarHBondContact O-N 2.97Å; R157-N160 CarbonylContact O-C 3.56Å; R157-N160 PolarHBondContact O-N 3.32Å; R157-G161 PolarHBondContact O-N 3.19Å; R157-E167 IonicContact NH1-OE2 2.9Å
158A56.4Low66Low81 Ų81100 Ų10067%0.66954%0.535SS*.Hα-helixtrans-59.7-22.9174.600000112.9C154 I155C154-A158 PolarHBondContact O-N 2.83Å; I155-A158 PolarHBondContact O-N 2.68Å
159Q54.1Low65.3Low157 Ų157102 Ų10273%0.73455%0.546SS*.THydrogen-bonded Turntrans-83.9-16.5176-60.2-174.136.200113.8R157R157-Q159 PolarHBondContact O-N 2.97Å
160N55.9Low64.6Low138 Ų138101.4 Ų101.474%0.73854%0.542SS*.SBendtrans-123.834.3-176-66.842.6000111.3R157 Q162R157-N160 CarbonylContact O-C 3.56Å; R157-N160 PolarHBondContact O-N 3.32Å; N160-Q162 PolarHBondContact O-N 3.17Å
161G53.1Low63.6Low57 Ų5799.7 Ų99.759%0.58853%0.534SS*.  trans-42.4112.4-163.900000116.1R157R157-G161 PolarHBondContact O-N 3.19Å
162Q53.8Low63.2Low177 Ų177101 Ų10183%0.82755%0.545SS*.  trans168.2122.3132.2-90.9174.220.100106.7N160 P164N160-Q162 PolarHBondContact O-N 3.17Å; Q162-P164 VanDerWaalsContact O-CD 3.27Å; Q162-P164 WeakPolarHBondContact O-CD 3.39Å
163T53.8Low62.8Low61 Ų61101.4 Ų101.437%0.37454%0.537SS..  trans-74.4114.3160.442.70000106.9R151 E165R151-T163 HydrophobicContact CG-CG2 4.24Å; T163-E165 PolarHBondContact O-N 3.31Å
164P61.7Low62.1Low62 Ų62101.8 Ų101.840%0.40353%0.532SS..  trans-57.6138.8177.2-21.133.1000109.7Q162 D166 E167Q162-P164 VanDerWaalsContact O-CD 3.27Å; Q162-P164 WeakPolarHBondContact O-CD 3.39Å; P164-D166 PolarHBondContact O-N 3.47Å; P164-D166 VanDerWaalsContact O-N 3.09Å; P164-E167 PolarHBondContact O-N 3.47Å
165E58.3Low61.4Low123 Ų123105 Ų10558%0.57555%0.547SS*.Hα-helixtrans-57.6-27.2-179.5-61-157.7128.700112.5T163 E167 R168 N169T163-E165 PolarHBondContact O-N 3.31Å; E165-E167 VanDerWaalsContact C-N 3.27Å; E165-E167 PolarHBondContact O-N 3.25Å; E165-R168 PolarHBondContact O-N 3.33Å; E165-R168 VanDerWaalsContact O-N 3.07Å; E165-R168 IonicContact OE1-NH2 3.21Å; E165-R168 PolarHBondContact OE1-NH2 3Å; E165-N169 PolarHBondContact O-N 2.79Å; E165-N169 PolarHBondContact O-ND2 3.4Å
166D57.6Low61.2Low115 Ų115105.2 Ų105.262%0.61554%0.542SS*.Hα-helixtrans-55-40173.7-58.2-32.4000112.1P164 R168 N169 L170P164-D166 PolarHBondContact O-N 3.47Å; P164-D166 VanDerWaalsContact O-N 3.09Å; D166-R168 VanDerWaalsContact C-N 3.35Å; D166-R168 PolarHBondContact O-N 3.18Å; D166-N169 PolarHBondContact O-N 3.3Å; D166-L170 VanDerWaalsContact O-CD1 3.28Å; D166-L170 WeakPolarHBondContact O-CD1 3.41Å; D166-L170 PolarHBondContact O-N 3.29Å
167E59Low60.9Low76 Ų76104.4 Ų104.436%0.35553%0.531SS..Hα-helixtrans-69.6-30.8178.8-61.4-167.5147.100112.4R151 R157 P164 E165 F171R151-E167 IonicContact CZ-OE2 2.75Å; R151-E167 IonicContact NE-OE2 3.84Å; R151-E167 PolarHBondContact NE-OE2 3.4Å; R151-E167 VanDerWaalsContact NE-OE2 3.13Å; R151-E167 IonicContact NH2-OE1 2.87Å; R151-E167 PolarHBondContact NH2-OE1 2.95Å; R151-E167 IonicContact NH2-OE2 3.13Å; R151-E167 PolarHBondContact NH2-OE2 2.99Å; R157-E167 IonicContact NH1-OE2 2.9Å; P164-E167 PolarHBondContact O-N 3.47Å; E165-E167 VanDerWaalsContact C-N 3.27Å; E165-E167 PolarHBondContact O-N 3.25Å; E167-F171 PolarHBondContact O-N 2.91Å
168R64.1Low60.8Low141 Ų141100.6 Ų100.653%0.53252%0.524SS..Hα-helixtrans-74.3-36.7173.6-67.5-167.5-60.7-180-1.7111.8E165 D166 F171 I172E165-R168 PolarHBondContact O-N 3.33Å; E165-R168 VanDerWaalsContact O-N 3.07Å; E165-R168 IonicContact OE1-NH2 3.21Å; E165-R168 PolarHBondContact OE1-NH2 3Å; D166-R168 VanDerWaalsContact C-N 3.35Å; D166-R168 PolarHBondContact O-N 3.18Å; R168-F171 WeakPolarHBondContact O-CB 3.45Å; R168-F171 PolarHBondContact O-N 2.87Å; R168-I172 PolarHBondContact O-N 3.48Å
169N63.3Low60.9Low92 Ų92100.6 Ų100.649%0.49252%0.516SS..Hα-helixtrans-68.5-38.8177.5-69.6-30.1000111.3E165 D166 F171 I172 Q173E165-N169 PolarHBondContact O-N 2.79Å; E165-N169 PolarHBondContact O-ND2 3.4Å; D166-N169 PolarHBondContact O-N 3.3Å; N169-F171 VanDerWaalsContact C-N 3.26Å; N169-F171 PolarHBondContact O-N 2.79Å; N169-I172 PolarHBondContact O-N 3.49Å; N169-Q173 PolarHBondContact O-N 3.48Å
170L65Low60.9Low105 Ų10598.1 Ų98.155%0.5551%0.507SS..Hα-helixtrans-55.8-40.5169.3-95.7127.1000111.9D166 Q173 Q174D166-L170 VanDerWaalsContact O-CD1 3.28Å; D166-L170 WeakPolarHBondContact O-CD1 3.41Å; D166-L170 PolarHBondContact O-N 3.29Å; L170-Q173 PolarHBondContact O-N 3.12Å; L170-Q174 WeakPolarHBondContact O-CB 3.35Å; L170-Q174 PolarHBondContact O-N 3.21Å
171F62.7Low60.8Low65 Ų6596.5 Ų96.529%0.28550%0.495SS..Hα-helixtrans-63.8-44.5177175.1-105.6000113.1Y145 N148 E167 R168 N169 Q173 Q174 I175Y145-F171 HydrophobicContact CD2-CZ 4.37Å; N148-F171 WeakPolarHBondContact ND2-CD2 3.45Å; E167-F171 PolarHBondContact O-N 2.91Å; R168-F171 WeakPolarHBondContact O-CB 3.45Å; R168-F171 PolarHBondContact O-N 2.87Å; N169-F171 VanDerWaalsContact C-N 3.26Å; N169-F171 PolarHBondContact O-N 2.79Å; F171-Q173 VanDerWaalsContact C-N 3.31Å; F171-Q173 PolarHBondContact O-N 2.66Å; F171-Q174 PolarHBondContact O-N 3.07Å; F171-I175 HydrophobicContact CD1-CD1 4.27Å; F171-I175 HydrophobicContact CD2-CD1 4.38Å; F171-I175 HydrophobicContact CE1-CD1 3.64Å; F171-I175 HydrophobicContact CE2-CD1 3.78Å; F171-I175 HydrophobicContact CE2-CG1 4.36Å; F171-I175 HydrophobicContact CZ-CD1 3.38Å; F171-I175 HydrophobicContact CZ-CG1 4.4Å; F171-I175 WeakPolarHBondContact O-CG1 3.39Å; F171-I175 PolarHBondContact O-N 3.32Å; F171-I175 VanDerWaalsContact O-N 3.08Å
172I67.4Low60.8Low89 Ų8998.3 Ų98.346%0.45649%0.489SS..Hα-helixtrans-65.6-38.2177.9-64.8177.1000110.8R168 N169 K176R168-I172 PolarHBondContact O-N 3.48Å; N169-I172 PolarHBondContact O-N 3.49Å; I172-K176 HydrophobicContact CG2-CD 4.29Å; I172-K176 WeakPolarHBondContact O-CG 3.36Å; I172-K176 PolarHBondContact O-N 2.9Å; I172-K176 VanDerWaalsContact O-N 3.09Å
173Q67Low60.6Low113 Ų11395.5 Ų95.553%0.52848%0.476SS..Hα-helixtrans-66.5-42.2177.3-173.1168.7-1.200111.7N169 L170 F171 I175 K176 E177N169-Q173 PolarHBondContact O-N 3.48Å; L170-Q173 PolarHBondContact O-N 3.12Å; F171-Q173 VanDerWaalsContact C-N 3.31Å; F171-Q173 PolarHBondContact O-N 2.66Å; Q173-I175 PolarHBondContact O-N 2.86Å; Q173-K176 PolarHBondContact O-N 3.05Å; Q173-E177 HydrophobicContact CG-CG 4.5Å; Q173-E177 WeakPolarHBondContact CG-OE1 3.49Å; Q173-E177 PolarHBondContact NE2-OE1 2.96Å; Q173-E177 VanDerWaalsContact NE2-OE1 3.14Å; Q173-E177 WeakPolarHBondContact O-CB 3.48Å; Q173-E177 WeakPolarHBondContact O-CG 3.5Å; Q173-E177 PolarHBondContact O-N 2.79Å
174Q64.5Low60.3Low109 Ų10998.6 Ų98.651%0.50949%0.486SS..Hα-helixtrans-70-32.2-178.9-137.5155.816.700113.1L170 F171 G178L170-Q174 WeakPolarHBondContact O-CB 3.35Å; L170-Q174 PolarHBondContact O-N 3.21Å; F171-Q174 PolarHBondContact O-N 3.07Å; Q174-G178 PolarHBondContact O-N 2.97Å
175I67.3Low59.7Low90 Ų9099.9 Ų99.946%0.46249%0.489SS..Hα-helixtrans-67.1-46.1170-70.9-174.5000110.6F171 Q173 E177 G178 T179F171-I175 HydrophobicContact CD1-CD1 4.27Å; F171-I175 HydrophobicContact CD2-CD1 4.38Å; F171-I175 HydrophobicContact CE1-CD1 3.64Å; F171-I175 HydrophobicContact CE2-CD1 3.78Å; F171-I175 HydrophobicContact CE2-CG1 4.36Å; F171-I175 HydrophobicContact CZ-CD1 3.38Å; F171-I175 HydrophobicContact CZ-CG1 4.4Å; F171-I175 WeakPolarHBondContact O-CG1 3.39Å; F171-I175 PolarHBondContact O-N 3.32Å; F171-I175 VanDerWaalsContact O-N 3.08Å; Q173-I175 PolarHBondContact O-N 2.86Å; I175-E177 VanDerWaalsContact C-N 3.34Å; I175-E177 PolarHBondContact O-N 3.16Å; I175-G178 PolarHBondContact O-N 3.34Å; I175-T179 PolarHBondContact O-N 3.08Å; I175-T179 PolarHBondContact O-OG1 2.92Å; I175-T179 VanDerWaalsContact O-OG1 3.07Å
176K66.1Low59.2Low137 Ų13799.4 Ų99.460%0.59649%0.49SS*.Hα-helixtrans-60.4-42.4177.4-76.7177.2177.1-177.60112.3I172 Q173 G178 T179 L180I172-K176 HydrophobicContact CG2-CD 4.29Å; I172-K176 WeakPolarHBondContact O-CG 3.36Å; I172-K176 PolarHBondContact O-N 2.9Å; I172-K176 VanDerWaalsContact O-N 3.09Å; Q173-K176 PolarHBondContact O-N 3.05Å; K176-G178 VanDerWaalsContact C-N 3.35Å; K176-T179 PolarHBondContact O-N 3.21Å; K176-L180 WeakPolarHBondContact O-CG 3.48Å; K176-L180 PolarHBondContact O-N 3.19Å; K176-L180 VanDerWaalsContact O-N 3.09Å
177E64.3Low58.7Low102 Ų102101.2 Ų101.248%0.47750%0.495SS..Hα-helixtrans-67-34.8176.6-72.8171.9-171.700112.4Q173 I175 H181Q173-E177 HydrophobicContact CG-CG 4.5Å; Q173-E177 WeakPolarHBondContact CG-OE1 3.49Å; Q173-E177 PolarHBondContact NE2-OE1 2.96Å; Q173-E177 VanDerWaalsContact NE2-OE1 3.14Å; Q173-E177 WeakPolarHBondContact O-CB 3.48Å; Q173-E177 WeakPolarHBondContact O-CG 3.5Å; Q173-E177 PolarHBondContact O-N 2.79Å; I175-E177 VanDerWaalsContact C-N 3.34Å; I175-E177 PolarHBondContact O-N 3.16Å; E177-H181 PolarHBondContact O-N 3.21Å
178G61.3Low58.2Low23 Ų23105.1 Ų105.124%0.23751%0.513CS..Hα-helixtrans-66.3-40.917300000113.4Q174 I175 K176 H181 M182Q174-G178 PolarHBondContact O-N 2.97Å; I175-G178 PolarHBondContact O-N 3.34Å; K176-G178 VanDerWaalsContact C-N 3.35Å; G178-H181 PolarHBondContact O-N 3.19Å; G178-M182 PolarHBondContact O-N 2.75Å
179T58.5Low57.5Low81 Ų81106 Ų10650%0.49752%0.522SS..Hα-helixtrans-66.9-41176.8-53.20000112.1I175 K176 H181 M182 E183I175-T179 PolarHBondContact O-N 3.08Å; I175-T179 PolarHBondContact O-OG1 2.92Å; I175-T179 VanDerWaalsContact O-OG1 3.07Å; K176-T179 PolarHBondContact O-N 3.21Å; T179-H181 VanDerWaalsContact C-N 3.3Å; T179-H181 PolarHBondContact O-N 2.81Å; T179-M182 PolarHBondContact O-N 2.89Å; T179-E183 PolarHBondContact O-N 2.69Å
180L54Low56.6Low105 Ų105107.2 Ų107.255%0.5553%0.533SS..Hα-helixtrans-65.9-30.4178.2-70.8171.5000113.3K176 Q184K176-L180 WeakPolarHBondContact O-CG 3.48Å; K176-L180 PolarHBondContact O-N 3.19Å; K176-L180 VanDerWaalsContact O-N 3.09Å; L180-Q184 PolarHBondContact O-N 2.7Å
181H54.9Low55.6Low104 Ų104106.9 Ų106.948%0.48154%0.54SS..Hα-helixtrans-73.9-28.4178.9-137.892.9000112.7E177 G178 T179E177-H181 PolarHBondContact O-N 3.21Å; G178-H181 PolarHBondContact O-N 3.19Å; T179-H181 VanDerWaalsContact C-N 3.3Å; T179-H181 PolarHBondContact O-N 2.81Å
182M52.1Low55Low95 Ų95109.1 Ų109.147%0.46856%0.559SS.*Hα-helixtrans-71-39.7173.1-78.5-9667.700111.7G178 T179 Q184 L185G178-M182 PolarHBondContact O-N 2.75Å; T179-M182 PolarHBondContact O-N 2.89Å; M182-Q184 VanDerWaalsContact C-N 3.28Å; M182-Q184 PolarHBondContact O-N 3.42Å; M182-L185 HydrophobicContact CE-CD1 4.22Å; M182-L185 PolarHBondContact O-N 3.32Å
183E49.1Very low54.1Low118 Ų118110 Ų11055%0.55157%0.571SS**Hα-helixtrans-65-27.9176.1-101.9175111.500113.7T179T179-E183 PolarHBondContact O-N 2.69Å
184Q48.9Very low53.4Low126 Ų126110.7 Ų110.759%0.58958%0.582SS**Hα-helixtrans-76.7-26.4178.6-75.7179.9-2600113.7L180 M182L180-Q184 PolarHBondContact O-N 2.7Å; M182-Q184 VanDerWaalsContact C-N 3.28Å; M182-Q184 PolarHBondContact O-N 3.42Å
185L48.6Very low52.8Low88 Ų88111.5 Ų111.546%0.46160%0.595SS.*Hα-helixtrans-76-33.6175.8-84154.2000111.8M182 H187 H188M182-L185 HydrophobicContact CE-CD1 4.22Å; M182-L185 PolarHBondContact O-N 3.32Å; L185-H187 VanDerWaalsContact C-N 3.35Å; L185-H187 PolarHBondContact O-N 2.79Å; L185-H188 PolarHBondContact O-N 3.19Å
186D48.2Very low52.2Low114 Ų114112.1 Ų112.161%0.6161%0.606SS**Hα-helixtrans-70-28.2177.6-75.4-26.3000113.4H188D186-H188 PolarHBondContact O-N 2.9Å
187H47.2Very low51.1Low153 Ų153109 Ų10971%0.70861%0.613SS**THydrogen-bonded Turntrans-75.9-17.4177.9-94.568.3000114.5L185L185-H187 VanDerWaalsContact C-N 3.35Å; L185-H187 PolarHBondContact O-N 2.79Å
188H48.2Very low50.4Low158 Ų158112.8 Ų112.873%0.73163%0.63SS**THydrogen-bonded Turntrans-94-7.9-179.6-101.9-69.9000114.4L185 D186L185-H188 PolarHBondContact O-N 3.19Å; D186-H188 PolarHBondContact O-N 2.9Å
189H48.3Very low49.7Very low158 Ų158124.3 Ų124.373%0.73168%0.678SS**SBendtrans-99-2.9178.5-84.3-80.4000114.8
190T44.9Very low49.3Very low118 Ų118126.5 Ų126.572%0.72469%0.687SS**  trans-95.2-3.1-178.2290000115.5V192T190-V192 PolarHBondContact O-N 3.11Å
191S45.1Very low49Very low98 Ų98127.6 Ų127.669%0.68569%0.694SS**  trans-90.769.3172.565.60000111.7P193S191-P193 WeakPolarHBondContact O-CD 3.43Å
192V48.5Very low48.7Very low113 Ų113128.9 Ų128.969%0.68571%0.706SS**  trans-78.8117.9160.5-178.90000107.3T190 T194T190-V192 PolarHBondContact O-N 3.11Å; V192-T194 PolarHBondContact O-N 3Å; V192-T194 VanDerWaalsContact O-N 3.12Å
193P49.4Very low48.5Very low108 Ų108130.9 Ų130.970%0.70172%0.72SS**  trans-72.3108.1171.727.9-29.1000108.9S191 T195S191-P193 WeakPolarHBondContact O-CD 3.43Å; P193-T195 PolarHBondContact O-N 3.49Å
194T51.4Low48.5Very low126 Ų126131.8 Ų131.877%0.77373%0.73SS**  trans-6497.8162.8-56.90000108.3V192 C196V192-T194 PolarHBondContact O-N 3Å; V192-T194 VanDerWaalsContact O-N 3.12Å; T194-C196 PolarHBondContact O-N 3.33Å
195T53.5Low48.4Very low126 Ų126132.1 Ų132.177%0.77374%0.74SS**  trans-82.2105.3166.357.50000108.4P193 G197P193-T195 PolarHBondContact O-N 3.49Å; T195-G197 PolarHBondContact O-N 2.87Å
196C52.7Low48.4Very low104 Ų104135.3 Ų135.370%0.70376%0.759SS**  trans-51.2133168.6-74.20000111T194T194-C196 PolarHBondContact O-N 3.33Å
197G44.8Very low48.4Very low72 Ų72136.9 Ų136.974%0.74277%0.771SS**  trans-64.7142.8164.200000110.9T195T195-G197 PolarHBondContact O-N 2.87Å
198H49.4Very low48.5Very low181 Ų181135.6 Ų135.684%0.83878%0.776SS**  trans-127.4138.8156.5-87.5-65.5000109
199H46.2Very low48.6Very low265 Ų265133.5 Ų133.5100%1.22778%0.78SS**  trans-52.90176.1-76.7-101.7000113.8

Retrieved 199 of 199 residues in 239.4 ms (Link to these results)