A0A096MJ67_RAT Loading...

RELT-like 1

AlphaFold DB , UniProt , Accession A0A096MJ67, Species RAT (Rattus norvegicus, Rat), Gene Rell1, Length 257 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
1M43.1Very low41.2Very low230 Ų230153 Ų153100%1.13380%0.797SS**  056.60-154.8166.9-150.400106.2
2V37.3Very low40.9Very low123 Ų123155.3 Ų155.375%0.74580%0.801SS**  41.2118.484.6-690000113.9
3D42.5Very low40.2Very low140 Ų140155.5 Ų155.575%0.74979%0.792SS**  trans83.277.2153.3-49-35.9000119.4
4C40.8Very low39.7Very low119 Ų119153.1 Ų153.180%0.80479%0.794SS**SBendtrans-132.4128141.7-74.30000108
5F42.2Very low39.5Very low201 Ų201151.2 Ų151.288%0.88279%0.786SS**  trans89.261.3-176.8-65.2-91000116.3
6L44.3Very low39.3Very low157 Ų157151.6 Ų151.682%0.82279%0.789SS**  trans-62.2129.9136.8-77.9162.4000108.4
7P45.6Very low39.2Very low104 Ų104150.6 Ų150.668%0.67579%0.792SS**  trans-67136.8164.325.9-28.9000109.1V9P7-V9 PolarHBondContact O-N 2.66Å
8W35.3Very low39.2Very low234 Ų234145.4 Ų145.489%0.88678%0.78SS**  trans-62.196.2174.7-174.976.6000109.3P10W8-P10 WeakPolarHBondContact O-CD 3.47Å
9V42.8Very low39Very low108 Ų108144.3 Ų144.366%0.65578%0.784SS**  trans-84.8120169177.20000107.4P7 E11P7-V9 PolarHBondContact O-N 2.66Å; V9-E11 PolarHBondContact O-N 3.01Å
10P41.9Very low39.3Very low90 Ų90149.4 Ų149.458%0.58479%0.792SS**  trans-75.7103.9163.229.6-27.8000107.7W8 Q12W8-P10 WeakPolarHBondContact O-CD 3.47Å; P10-Q12 PolarHBondContact O-N 3.18Å
11E36.9Very low39.2Very low177 Ų177149.3 Ų149.383%0.82780%0.797SS**  trans-6799.2174.1-167.9154.4114.100109.6V9 K13V9-E11 PolarHBondContact O-N 3.01Å; E11-K13 PolarHBondContact O-N 3.42Å
12Q37.7Very low39.1Very low181 Ų181145.4 Ų145.485%0.84678%0.78SS**  trans-76.7106.3164.7-86.3-1705.300108.8P10 C14P10-Q12 PolarHBondContact O-N 3.18Å; Q12-C14 PolarHBondContact O-N 2.87Å
13K32.6Very low39Very low158 Ų158147.6 Ų147.669%0.68778%0.782SS**  trans-80.4106.4170.7-167.2161.2-175.2164.10109.8E11 D15E11-K13 PolarHBondContact O-N 3.42Å; K13-D15 WeakPolarHBondContact CE-OD1 3.46Å; K13-D15 PolarHBondContact O-N 3.34Å
14C32.7Very low38.7Very low122 Ų122146.5 Ų146.582%0.82479%0.785SS**  trans-77.691.1164.5-84.30000109.3Q12Q12-C14 PolarHBondContact O-N 2.87Å
15D37.3Very low38.7Very low124 Ų124151.3 Ų151.366%0.66379%0.787SS**  trans-88.6102.8164.2-73.5-29.2000108.9K13K13-D15 WeakPolarHBondContact CE-OD1 3.46Å; K13-D15 PolarHBondContact O-N 3.34Å
16N35.3Very low38.7Very low158 Ų158146 Ų14685%0.84578%0.78SS**  trans-86.2105.1169.7-164.97.3000108.2
17T37.6Very low38.6Very low135 Ų135146.4 Ų146.483%0.82878%0.777SS**  trans-141.4109.1164.4-64.40000108.1
18G39.3Very low38.1Very low57 Ų57147.6 Ų147.659%0.58878%0.783SS**  trans-70.4151.718000000112.8
19S36.4Very low38.3Very low123 Ų123142.3 Ų142.386%0.8678%0.777SS**  -177.5134.4125.5-80.80000110
20R43.6Very low38.2Very low246 Ų246143 Ų14393%0.92878%0.783SS**  trans-79.3131.3179.4-55.5164.590.5167.76.1108.6
21T37.2Very low38Very low148 Ų148143.3 Ų143.391%0.90879%0.787SS**  trans-155142.1151.7-1.10000110.8
22L40.9Very low38.3Very low148 Ų148141.4 Ų141.478%0.77578%0.782SS**  trans-88.2165.8-161.5-69.3159.4000115
23H35.8Very low38.7Very low169 Ų169137.8 Ų137.878%0.78278%0.775SS**  trans91.6109.5148.8-67.9-65.4000121.4
24S35.6Very low39.1Very low117 Ų117135.1 Ų135.182%0.81877%0.772SS**  63.9110.4121.2-155.70000119.9
25R41.6Very low40Very low221 Ų221136.5 Ų136.583%0.83477%0.771SS**  -171.8134.9115.7-165.7168.5173.9113.8-3110.1
26A43.3Very low40.4Very low89 Ų89136.8 Ų136.874%0.73677%0.772SS**  trans-72.3137.917400000111.2
27E41.9Very low41.2Very low165 Ų165135.8 Ų135.877%0.77177%0.774SS**  trans-165.8108.1151-108.1157.4-170.600110.4
28T35.3Very low42.2Very low130 Ų130131.2 Ų131.280%0.79875%0.754SS**  trans56.997.8139.7-8.60000121.2
29T38.3Very low43Very low123 Ų123136.4 Ų136.476%0.75577%0.769SS**  trans-0.4135134-48.20000116.3
30P41.9Very low44Very low121 Ų121132.9 Ų132.979%0.78675%0.752SS**  -116125.352.921.3-2.3000114L32P30-L32 PolarHBondContact O-N 2.91Å
31S36.6Very low45.1Very low97 Ų97127.3 Ų127.368%0.67874%0.736SS**  trans-39.4120.4159.847.20000110.5
32L44.4Very low46.9Very low137 Ų137124.9 Ų124.972%0.71772%0.723SS**  trans-11.5131.3139.8-171.971.5000111.2P30 T34P30-L32 PolarHBondContact O-N 2.91Å; L32-T34 PolarHBondContact O-N 3.45Å
33P44.3Very low48.6Very low106 Ų106123.2 Ų123.269%0.68871%0.711SS**  trans-64.392.2162.228.2-29.7000106.1N35P33-N35 PolarHBondContact O-N 3.4Å
34T41.5Very low50.8Low101 Ų101123 Ų12362%0.6271%0.705SS**  trans-49.4100.4151-62.40000104L32 N36L32-T34 PolarHBondContact O-N 3.45Å; T34-N36 PolarHBondContact O-N 3.39Å
35N51.6Low53.1Low152 Ų152121.5 Ų121.581%0.81369%0.686SS**  trans-58.791.9168.1-85.6-46.2000105.7P33 P37P33-N35 PolarHBondContact O-N 3.4Å; N35-P37 VanDerWaalsContact O-CD 3.25Å; N35-P37 WeakPolarHBondContact O-CD 3.46Å
36N45.8Very low55.3Low129 Ų129113.2 Ų113.269%0.6967%0.665SS**  trans-89.2103.2175.3-145-11.8000103.5T34 G38T34-N36 PolarHBondContact O-N 3.39Å; N36-G38 PolarHBondContact O-N 2.93Å
37P52.7Low57.5Low137 Ų137117.1 Ų117.189%0.8966%0.662SS**  trans-8157.4177.236.3-33.9000107.9N35N35-P37 VanDerWaalsContact O-CD 3.25Å; N35-P37 WeakPolarHBondContact O-CD 3.46Å
38G58Low59.6Low39 Ų39112.4 Ų112.440%0.40264%0.644SS.*  trans-141.6103.5-169.700000109.1N36N36-G38 PolarHBondContact O-N 2.93Å
39N55.6Low62.3Low167 Ų167111.3 Ų111.389%0.89363%0.633SS**  trans103.834.2171.884.810.8000119H41N39-H41 PolarHBondContact O-N 3.44Å
40G58.3Low64.9Low49 Ų49110.2 Ų110.251%0.50563%0.626SS.*  trans-74.4115.7162.200000111.2
41H65.7Low67.4Low129 Ų129107.6 Ų107.660%0.59761%0.609SS**  trans-45.6126.9171.3-146.1-101.4000109N39 E43 Y44N39-H41 PolarHBondContact O-N 3.44Å; H41-E43 PolarHBondContact O-N 3.33Å; H41-Y44 PolarHBondContact O-N 2.79Å
42P74.8Confident70.2Confident97 Ų97106.8 Ų106.863%0.6360%0.599SS**Hα-helixtrans-57.6-23.1-172.222-33.4000112.7I45 A46P42-I45 PolarHBondContact O-N 2.74Å; P42-A46 PolarHBondContact O-N 3.49Å
43E77.3Confident72.6Confident113 Ų113108.1 Ų108.153%0.52860%0.6SS.*Hα-helixtrans-64.3-42.6174-57.5-160.8-175.500112.9H41 I45 A46 Y47H41-E43 PolarHBondContact O-N 3.33Å; E43-I45 VanDerWaalsContact C-N 3.34Å; E43-I45 PolarHBondContact O-N 3.2Å; E43-A46 PolarHBondContact O-N 3.31Å; E43-Y47 HydrophobicContact CB-CE2 4.16Å; E43-Y47 WeakPolarHBondContact O-CD2 3.45Å; E43-Y47 PolarHBondContact O-N 2.92Å
44Y82.8Confident75.1Confident165 Ų165109.3 Ų109.365%0.64759%0.594SS**Hα-helixtrans-66.9-38.1178.2-176.6-103.6000111.8H41 A46 Y47 V48H41-Y44 PolarHBondContact O-N 2.79Å; Y44-A46 VanDerWaalsContact C-N 3.32Å; Y44-A46 PolarHBondContact O-N 3.46Å; Y44-Y47 PolarHBondContact O-N 2.85Å; Y44-V48 HydrophobicContact CE1-CG2 4.16Å; Y44-V48 WeakPolarHBondContact O-CG2 3.38Å; Y44-V48 PolarHBondContact O-N 3.25Å
45I84.3Confident77.6Confident84 Ų84109 Ų10943%0.43159%0.592SS.*Hα-helixtrans-62-43.4174.7-60.2173.5000109.7P42 E43 V48 L49P42-I45 PolarHBondContact O-N 2.74Å; E43-I45 VanDerWaalsContact C-N 3.34Å; E43-I45 PolarHBondContact O-N 3.2Å; I45-V48 PolarHBondContact O-N 3.2Å; I45-L49 HydrophobicContact CG2-CD1 3.52Å; I45-L49 HydrophobicContact CG2-CG 3.93Å; I45-L49 WeakPolarHBondContact O-CB 3.16Å; I45-L49 VanDerWaalsContact O-CG 3.3Å; I45-L49 WeakPolarHBondContact O-CG 3.24Å; I45-L49 PolarHBondContact O-N 3.34Å
46A86.6Confident79.7Confident47 Ų47107.4 Ų107.439%0.38858%0.581SS.*Hα-helixtrans-63.1-43.3175.600000112.4P42 E43 Y44 V48 L49 V50P42-A46 PolarHBondContact O-N 3.49Å; E43-A46 PolarHBondContact O-N 3.31Å; Y44-A46 VanDerWaalsContact C-N 3.32Å; Y44-A46 PolarHBondContact O-N 3.46Å; A46-V48 PolarHBondContact O-N 3.45Å; A46-V48 VanDerWaalsContact O-N 3.15Å; A46-L49 PolarHBondContact O-N 2.96Å; A46-V50 VanDerWaalsContact O-CB 3.26Å; A46-V50 WeakPolarHBondContact O-CB 3.47Å; A46-V50 WeakPolarHBondContact O-CG2 3.32Å; A46-V50 PolarHBondContact O-N 2.92Å
47Y88.7Confident82Confident172 Ų172102.9 Ų102.968%0.67557%0.565SS**Hα-helixtrans-61.6-21.2176.7-73-61.3000113.7E43 Y44 P51E43-Y47 HydrophobicContact CB-CE2 4.16Å; E43-Y47 WeakPolarHBondContact O-CD2 3.45Å; E43-Y47 PolarHBondContact O-N 2.92Å; Y44-Y47 PolarHBondContact O-N 2.85Å; Y47-P51 WeakPolarHBondContact O-CD 3.1Å; Y47-P51 WeakPolarHBondContact O-CG 3.18Å
48V88Confident84.1Confident66 Ų66100.7 Ų100.740%0.455%0.545SS..Hα-helixtrans-94.6-44.7174.9177.60000111.7Y44 I45 A46 P51 V52Y44-V48 HydrophobicContact CE1-CG2 4.16Å; Y44-V48 WeakPolarHBondContact O-CG2 3.38Å; Y44-V48 PolarHBondContact O-N 3.25Å; I45-V48 PolarHBondContact O-N 3.2Å; A46-V48 PolarHBondContact O-N 3.45Å; A46-V48 VanDerWaalsContact O-N 3.15Å; V48-P51 VanDerWaalsContact O-CD 3.32Å; V48-P51 WeakPolarHBondContact O-CD 3.49Å; V48-P51 WeakPolarHBondContact O-CG 3.27Å; V48-V52 WeakPolarHBondContact O-CB 3.24Å; V48-V52 WeakPolarHBondContact O-CG2 3.29Å; V48-V52 PolarHBondContact O-N 3.25Å
49L91.4Very high85.9Confident107 Ų107102.7 Ų102.756%0.5655%0.546SS*.Hα-helixtrans-69.5-38.1-177-68.7-177.4000113I45 A46 V52 F53I45-L49 HydrophobicContact CG2-CD1 3.52Å; I45-L49 HydrophobicContact CG2-CG 3.93Å; I45-L49 WeakPolarHBondContact O-CB 3.16Å; I45-L49 VanDerWaalsContact O-CG 3.3Å; I45-L49 WeakPolarHBondContact O-CG 3.24Å; I45-L49 PolarHBondContact O-N 3.34Å; A46-L49 PolarHBondContact O-N 2.96Å; L49-V52 PolarHBondContact O-N 2.92Å; L49-F53 VanDerWaalsContact O-CB 3.23Å; L49-F53 WeakPolarHBondContact O-CB 3.32Å; L49-F53 PolarHBondContact O-N 3.39Å
50V92.9Very high87.7Confident99 Ų9996.2 Ų96.260%0.652%0.519SS*.Hα-helixtrans-61.1-52.4-180172.80000112.1A46 V52 F53 F54A46-V50 VanDerWaalsContact O-CB 3.26Å; A46-V50 WeakPolarHBondContact O-CB 3.47Å; A46-V50 WeakPolarHBondContact O-CG2 3.32Å; A46-V50 PolarHBondContact O-N 2.92Å; V50-V52 PolarHBondContact O-N 3.33Å; V50-F53 PolarHBondContact O-N 2.85Å; V50-F54 VanDerWaalsContact O-CB 3.29Å; V50-F54 WeakPolarHBondContact O-CB 3.34Å; V50-F54 PolarHBondContact O-N 3.28Å
51P94.1Very high89.4Confident66 Ų6698.6 Ų98.643%0.42952%0.523SS..Hα-helixtrans-66.9-36.1177.624.1-32.9000112.5Y47 V48 F54 V55Y47-P51 WeakPolarHBondContact O-CD 3.1Å; Y47-P51 WeakPolarHBondContact O-CG 3.18Å; V48-P51 VanDerWaalsContact O-CD 3.32Å; V48-P51 WeakPolarHBondContact O-CD 3.49Å; V48-P51 WeakPolarHBondContact O-CG 3.27Å; P51-F54 PolarHBondContact O-N 2.74Å; P51-V55 VanDerWaalsContact O-CG2 3.3Å; P51-V55 WeakPolarHBondContact O-CG2 3.38Å; P51-V55 PolarHBondContact O-N 3.46Å
52V95Very high90.6Very high80 Ų8097.3 Ų97.349%0.48552%0.52SS..Hα-helixtrans-62.3-49175.7170.90000110.7V48 L49 V50 F54 V55 M56V48-V52 WeakPolarHBondContact O-CB 3.24Å; V48-V52 WeakPolarHBondContact O-CG2 3.29Å; V48-V52 PolarHBondContact O-N 3.25Å; L49-V52 PolarHBondContact O-N 2.92Å; V50-V52 PolarHBondContact O-N 3.33Å; V52-F54 VanDerWaalsContact C-N 3.28Å; V52-F54 PolarHBondContact O-N 3.5Å; V52-V55 PolarHBondContact O-N 3.18Å; V52-M56 HydrophobicContact CG1-CG 4.32Å; V52-M56 WeakPolarHBondContact O-CB 3.4Å; V52-M56 VanDerWaalsContact O-CG 3.26Å; V52-M56 WeakPolarHBondContact O-CG 3.21Å; V52-M56 PolarHBondContact O-N 3.45Å
53F95.6Very high91.4Very high166 Ų16696.4 Ų96.473%0.72851%0.509SS*.Hα-helixtrans-63-36.9177.5-173.7-99000111.9L49 V50 G57L49-F53 VanDerWaalsContact O-CB 3.23Å; L49-F53 WeakPolarHBondContact O-CB 3.32Å; L49-F53 PolarHBondContact O-N 3.39Å; V50-F53 PolarHBondContact O-N 2.85Å; F53-G57 WeakPolarHBondContact O-CA 3.37Å; F53-G57 PolarHBondContact O-N 3.47Å
54F95.9Very high92Very high131 Ų13193.8 Ų93.858%0.57550%0.503SS*.Hα-helixtrans-65.3-46.4176.3-171-105.7000111.9V50 P51 V52 G57 L58V50-F54 VanDerWaalsContact O-CB 3.29Å; V50-F54 WeakPolarHBondContact O-CB 3.34Å; V50-F54 PolarHBondContact O-N 3.28Å; P51-F54 PolarHBondContact O-N 2.74Å; V52-F54 VanDerWaalsContact C-N 3.28Å; V52-F54 PolarHBondContact O-N 3.5Å; F54-G57 PolarHBondContact O-N 2.9Å; F54-L58 HydrophobicContact CD1-CD1 3.78Å; F54-L58 HydrophobicContact CD1-CG 4.34Å; F54-L58 HydrophobicContact CE1-CD1 3.28Å; F54-L58 HydrophobicContact CE1-CG 4.12Å; F54-L58 HydrophobicContact CE2-CD1 4.29Å; F54-L58 HydrophobicContact CE2-CG 4.37Å; F54-L58 HydrophobicContact CG-CD1 4.48Å; F54-L58 HydrophobicContact CZ-CD1 3.58Å; F54-L58 HydrophobicContact CZ-CD2 4.41Å; F54-L58 HydrophobicContact CZ-CG 4.13Å; F54-L58 WeakPolarHBondContact O-CB 3.09Å; F54-L58 VanDerWaalsContact O-CG 3.27Å; F54-L58 WeakPolarHBondContact O-CG 3.28Å; F54-L58 PolarHBondContact O-N 3.42Å
55V95.1Very high92.3Very high93 Ų9391.6 Ų91.656%0.56450%0.498SS*.Hα-helixtrans-64.6-45.9177.3173.40000110.9P51 V52 L58 L59P51-V55 VanDerWaalsContact O-CG2 3.3Å; P51-V55 WeakPolarHBondContact O-CG2 3.38Å; P51-V55 PolarHBondContact O-N 3.46Å; V52-V55 PolarHBondContact O-N 3.18Å; V55-L58 PolarHBondContact O-N 3.31Å; V55-L59 WeakPolarHBondContact O-CB 2.94Å; V55-L59 PolarHBondContact O-N 2.93Å
56M94.6Very high92.6Very high120 Ų12092.1 Ų92.159%0.59150%0.502SS*.Hα-helixtrans-64.4-40.1177.3-67.7-57.5-67.600112.2V52 L59 G60V52-M56 HydrophobicContact CG1-CG 4.32Å; V52-M56 WeakPolarHBondContact O-CB 3.4Å; V52-M56 VanDerWaalsContact O-CG 3.26Å; V52-M56 WeakPolarHBondContact O-CG 3.21Å; V52-M56 PolarHBondContact O-N 3.45Å; M56-L59 PolarHBondContact O-N 2.84Å; M56-G60 PolarHBondContact O-N 2.91Å
57G95.3Very high92.7Very high33 Ų3393.1 Ų93.134%0.3450%0.5SS..Hα-helixtrans-68.2-43.8177.500000112.8F53 F54 L59 G60 V61F53-G57 WeakPolarHBondContact O-CA 3.37Å; F53-G57 PolarHBondContact O-N 3.47Å; F54-G57 PolarHBondContact O-N 2.9Å; G57-L59 VanDerWaalsContact C-N 3.35Å; G57-G60 PolarHBondContact O-N 3.07Å; G57-V61 WeakPolarHBondContact O-CG2 3.46Å; G57-V61 PolarHBondContact O-N 2.85Å
58L96Very high92.4Very high91 Ų9192.4 Ų92.448%0.47650%0.5SS..Hα-helixtrans-65.2-39.6174.5-72.7-174.3000111.9F54 V55 G60 V61 L62F54-L58 HydrophobicContact CD1-CD1 3.78Å; F54-L58 HydrophobicContact CD1-CG 4.34Å; F54-L58 HydrophobicContact CE1-CD1 3.28Å; F54-L58 HydrophobicContact CE1-CG 4.12Å; F54-L58 HydrophobicContact CE2-CD1 4.29Å; F54-L58 HydrophobicContact CE2-CG 4.37Å; F54-L58 HydrophobicContact CG-CD1 4.48Å; F54-L58 HydrophobicContact CZ-CD1 3.58Å; F54-L58 HydrophobicContact CZ-CD2 4.41Å; F54-L58 HydrophobicContact CZ-CG 4.13Å; F54-L58 WeakPolarHBondContact O-CB 3.09Å; F54-L58 VanDerWaalsContact O-CG 3.27Å; F54-L58 WeakPolarHBondContact O-CG 3.28Å; F54-L58 PolarHBondContact O-N 3.42Å; V55-L58 PolarHBondContact O-N 3.31Å; L58-G60 VanDerWaalsContact C-N 3.33Å; L58-V61 PolarHBondContact O-N 2.95Å; L58-L62 VanDerWaalsContact O-CB 3.24Å; L58-L62 WeakPolarHBondContact O-CB 3.38Å; L58-L62 PolarHBondContact O-N 3.16Å
59L95.1Very high92.2Very high81 Ų8197.6 Ų97.642%0.42452%0.517SS..Hα-helixtrans-61.2-44173.6-177.663.6000110.8V55 M56 G57 L62 I63V55-L59 WeakPolarHBondContact O-CB 2.94Å; V55-L59 PolarHBondContact O-N 2.93Å; M56-L59 PolarHBondContact O-N 2.84Å; G57-L59 VanDerWaalsContact C-N 3.35Å; L59-L62 PolarHBondContact O-N 3.28Å; L59-I63 HydrophobicContact CD1-CD1 3.93Å; L59-I63 HydrophobicContact CD1-CG1 4.2Å; L59-I63 HydrophobicContact CD2-CD1 4.43Å; L59-I63 HydrophobicContact CG-CD1 3.73Å; L59-I63 HydrophobicContact CG-CG1 4.39Å; L59-I63 WeakPolarHBondContact O-CB 3.46Å; L59-I63 WeakPolarHBondContact O-CG1 3.17Å; L59-I63 PolarHBondContact O-N 2.7Å
60G93.7Very high91.8Very high31 Ų31100.4 Ų100.432%0.3253%0.525SS..Hα-helixtrans-58.4-47.8174.200000112.6M56 G57 L58 L62 I63 C64M56-G60 PolarHBondContact O-N 2.91Å; G57-G60 PolarHBondContact O-N 3.07Å; L58-G60 VanDerWaalsContact C-N 3.33Å; G60-L62 VanDerWaalsContact C-N 3.34Å; G60-L62 PolarHBondContact O-N 3.42Å; G60-I63 PolarHBondContact O-N 3.1Å; G60-C64 VanDerWaalsContact O-CB 3.28Å; G60-C64 WeakPolarHBondContact O-CB 3.46Å; G60-C64 PolarHBondContact O-N 3.29Å; G60-C64 PolarHBondContact O-SG 3.35Å
61V93.6Very high91.2Very high99 Ų9998.7 Ų98.760%0.653%0.528SS*.Hα-helixtrans-63-40.1176.4173.90000111.8G57 L58 C64 H65G57-V61 WeakPolarHBondContact O-CG2 3.46Å; G57-V61 PolarHBondContact O-N 2.85Å; L58-V61 PolarHBondContact O-N 2.95Å; V61-C64 PolarHBondContact O-N 2.93Å; V61-H65 WeakPolarHBondContact O-CB 3.13Å; V61-H65 PolarHBondContact O-N 2.85Å
62L92.6Very high90.5Very high102 Ų102102.2 Ų102.253%0.53453%0.533SS..Hα-helixtrans-66.9-45.6179.6-173.3134.9000111.4L58 L59 G60 H65 L66L58-L62 VanDerWaalsContact O-CB 3.24Å; L58-L62 WeakPolarHBondContact O-CB 3.38Å; L58-L62 PolarHBondContact O-N 3.16Å; L59-L62 PolarHBondContact O-N 3.28Å; G60-L62 VanDerWaalsContact C-N 3.34Å; G60-L62 PolarHBondContact O-N 3.42Å; L62-H65 PolarHBondContact O-N 3.36Å; L62-L66 HydrophobicContact CD2-CD1 3.75Å; L62-L66 HydrophobicContact CD2-CG 4.49Å; L62-L66 VanDerWaalsContact O-CG 3.31Å; L62-L66 WeakPolarHBondContact O-CG 3.22Å; L62-L66 PolarHBondContact O-N 2.93Å
63I91.6Very high89.5Confident79 Ų79105.8 Ų105.841%0.40554%0.538SS..Hα-helixtrans-61.2-48.1174.1-67.1167.1000109.6L59 G60 H65 L66 L67L59-I63 HydrophobicContact CD1-CD1 3.93Å; L59-I63 HydrophobicContact CD1-CG1 4.2Å; L59-I63 HydrophobicContact CD2-CD1 4.43Å; L59-I63 HydrophobicContact CG-CD1 3.73Å; L59-I63 HydrophobicContact CG-CG1 4.39Å; L59-I63 WeakPolarHBondContact O-CB 3.46Å; L59-I63 WeakPolarHBondContact O-CG1 3.17Å; L59-I63 PolarHBondContact O-N 2.7Å; G60-I63 PolarHBondContact O-N 3.1Å; I63-H65 VanDerWaalsContact C-N 3.26Å; I63-H65 PolarHBondContact O-N 2.94Å; I63-L66 PolarHBondContact O-N 3.17Å; I63-L66 VanDerWaalsContact O-N 3.16Å; I63-L67 HydrophobicContact CG2-CD1 3.67Å; I63-L67 HydrophobicContact CG2-CG 4.13Å; I63-L67 WeakPolarHBondContact O-CB 3.38Å; I63-L67 WeakPolarHBondContact O-CG 3.38Å; I63-L67 PolarHBondContact O-N 3.16Å
64C89.3Confident88.2Confident57 Ų57101.2 Ų101.239%0.38553%0.526SS..Hα-helixtrans-56-39.3175.1-75.30000112.5G60 V61 K68G60-C64 VanDerWaalsContact O-CB 3.28Å; G60-C64 WeakPolarHBondContact O-CB 3.46Å; G60-C64 PolarHBondContact O-N 3.29Å; G60-C64 PolarHBondContact O-SG 3.35Å; V61-C64 PolarHBondContact O-N 2.93Å; C64-K68 WeakPolarHBondContact O-CB 3.44Å; C64-K68 PolarHBondContact O-N 3.14Å
65H89.9Confident86.5Confident119 Ų11999.8 Ų99.855%0.55153%0.528SS*.Hα-helixtrans-72.6-37.3178.9-165.2-83.5000112.7V61 L62 I63 K69V61-H65 WeakPolarHBondContact O-CB 3.13Å; V61-H65 PolarHBondContact O-N 2.85Å; L62-H65 PolarHBondContact O-N 3.36Å; I63-H65 VanDerWaalsContact C-N 3.26Å; I63-H65 PolarHBondContact O-N 2.94Å; H65-K69 VanDerWaalsContact O-CB 3.27Å; H65-K69 WeakPolarHBondContact O-CB 3.31Å; H65-K69 PolarHBondContact O-N 3.43Å
66L90.3Very high84.5Confident96 Ų96101.9 Ų101.950%0.50354%0.541SS..Hα-helixtrans-67-40.8174.4-69174.3000111.5L62 I63 K69 K70L62-L66 HydrophobicContact CD2-CD1 3.75Å; L62-L66 HydrophobicContact CD2-CG 4.49Å; L62-L66 VanDerWaalsContact O-CG 3.31Å; L62-L66 WeakPolarHBondContact O-CG 3.22Å; L62-L66 PolarHBondContact O-N 2.93Å; I63-L66 PolarHBondContact O-N 3.17Å; I63-L66 VanDerWaalsContact O-N 3.16Å; L66-K69 PolarHBondContact O-N 3.17Å; L66-K70 PolarHBondContact O-N 2.66Å; L66-K70 VanDerWaalsContact O-N 3.14Å
67L87.2Confident82.2Confident67 Ų67103.6 Ų103.635%0.35155%0.548SS..Hα-helixtrans-64.3-46.9174.7-70.4177.3000110.3I63 K69 K70 G71 Y72I63-L67 HydrophobicContact CG2-CD1 3.67Å; I63-L67 HydrophobicContact CG2-CG 4.13Å; I63-L67 WeakPolarHBondContact O-CB 3.38Å; I63-L67 WeakPolarHBondContact O-CG 3.38Å; I63-L67 PolarHBondContact O-N 3.16Å; L67-K69 VanDerWaalsContact C-N 3.35Å; L67-K69 PolarHBondContact O-N 3.43Å; L67-K70 CarbonylContact O-C 3.57Å; L67-K70 PolarHBondContact O-N 3.11Å; L67-K70 VanDerWaalsContact O-N 3.16Å; L67-G71 PolarHBondContact O-N 2.92Å; L67-Y72 HydrophobicContact CB-CD2 4.35Å; L67-Y72 HydrophobicContact CB-CG 4.48Å; L67-Y72 HydrophobicContact CD2-CD2 3.73Å; L67-Y72 HydrophobicContact CD2-CE2 4.27Å; L67-Y72 HydrophobicContact CD2-CG 3.98Å; L67-Y72 WeakPolarHBondContact O-CB 3.34Å; L67-Y72 WeakPolarHBondContact O-CD2 3.27Å; L67-Y72 PolarHBondContact O-N 3.14Å
68K83.3Confident79.8Confident157 Ų157106.1 Ų106.168%0.68357%0.566SS**Hα-helixtrans-60.7-40175.3-177173.7175.6169.80113C64 K70 G71C64-K68 WeakPolarHBondContact O-CB 3.44Å; C64-K68 PolarHBondContact O-N 3.14Å; K68-K70 VanDerWaalsContact C-N 3.27Å; K68-K70 PolarHBondContact O-N 3.45Å; K68-G71 PolarHBondContact O-N 3.26Å; K68-G71 VanDerWaalsContact O-N 3.17Å
69K84.4Confident77.3Confident175 Ų175110.7 Ų110.776%0.76158%0.584SS**Hα-helixtrans-70.6-23.8179.4-161.5175.4-177.6-179.90112.7H65 L66 L67H65-K69 VanDerWaalsContact O-CB 3.27Å; H65-K69 WeakPolarHBondContact O-CB 3.31Å; H65-K69 PolarHBondContact O-N 3.43Å; L66-K69 PolarHBondContact O-N 3.17Å; L67-K69 VanDerWaalsContact C-N 3.35Å; L67-K69 PolarHBondContact O-N 3.43Å
70K82.2Confident74.5Confident167 Ų167116.2 Ų116.273%0.72661%0.608SS**THydrogen-bonded Turntrans-91.21.7172.8-75.6-179.1173.81710113.6L66 L67 K68 Y72L66-K70 PolarHBondContact O-N 2.66Å; L66-K70 VanDerWaalsContact O-N 3.14Å; L67-K70 CarbonylContact O-C 3.57Å; L67-K70 PolarHBondContact O-N 3.11Å; L67-K70 VanDerWaalsContact O-N 3.16Å; K68-K70 VanDerWaalsContact C-N 3.27Å; K68-K70 PolarHBondContact O-N 3.45Å; K70-Y72 HydrophobicContact CB-CD2 3.52Å; K70-Y72 HydrophobicContact CB-CE2 3.43Å; K70-Y72 VanDerWaalsContact CB-CE2 3.43Å; K70-Y72 HydrophobicContact CD-CE2 3.94Å; K70-Y72 HydrophobicContact CG-CE2 4.33Å
71G80.3Confident71.8Confident63 Ų63122.1 Ų122.165%0.64963%0.627SS**THydrogen-bonded Turntrans85.77178.600000114.7L67 K68 R73L67-G71 PolarHBondContact O-N 2.92Å; K68-G71 PolarHBondContact O-N 3.26Å; K68-G71 VanDerWaalsContact O-N 3.17Å; G71-R73 PolarHBondContact O-N 3.14Å
72Y80.1Confident69.2Low140 Ų140124.2 Ų124.255%0.54964%0.64SS.*  trans-71.1130.4173-60.8-83.5000109.7L67 K70L67-Y72 HydrophobicContact CB-CD2 4.35Å; L67-Y72 HydrophobicContact CB-CG 4.48Å; L67-Y72 HydrophobicContact CD2-CD2 3.73Å; L67-Y72 HydrophobicContact CD2-CE2 4.27Å; L67-Y72 HydrophobicContact CD2-CG 3.98Å; L67-Y72 WeakPolarHBondContact O-CB 3.34Å; L67-Y72 WeakPolarHBondContact O-CD2 3.27Å; L67-Y72 PolarHBondContact O-N 3.14Å; K70-Y72 HydrophobicContact CB-CD2 3.52Å; K70-Y72 HydrophobicContact CB-CE2 3.43Å; K70-Y72 VanDerWaalsContact CB-CE2 3.43Å; K70-Y72 HydrophobicContact CD-CE2 3.94Å; K70-Y72 HydrophobicContact CG-CE2 4.33Å
73R73.4Confident66.7Low154 Ų154128.1 Ų128.158%0.58166%0.656SS**  trans-80.6123.8170.5-66.7-123.2-179.6164.9-0.4107.9G71 T75 I96G71-R73 PolarHBondContact O-N 3.14Å; R73-T75 VanDerWaalsContact C-N 3.33Å; R73-T75 PolarHBondContact O-N 3.09Å; R73-I96 HydrophobicContact CG-CG2 3.88Å
74C67.9Low64.1Low71 Ų71132.4 Ų132.448%0.4867%0.674SS.*  trans-74.490174.1-50.40000108.4T76C74-T76 PolarHBondContact O-N 3.42Å
75T61.3Low61.6Low100 Ų100138.8 Ų138.861%0.61370%0.698SS**  trans-83.399.7164.849.40000107R73 E77R73-T75 VanDerWaalsContact C-N 3.33Å; R73-T75 PolarHBondContact O-N 3.09Å; T75-E77 VanDerWaalsContact C-N 3.28Å; T75-E77 PolarHBondContact O-N 3.02Å; T75-E77 VanDerWaalsContact O-N 3.16Å
76T53.6Low59.2Low137 Ų137142 Ų14284%0.8471%0.711SS**  trans-82.979.5169.848.60000107.6C74C74-T76 PolarHBondContact O-N 3.42Å
77E44.8Very low56.4Low157 Ų157144.2 Ų144.273%0.73473%0.727SS**  trans-124.86.6178.974.1-173.6167.800115.2T75T75-E77 VanDerWaalsContact C-N 3.28Å; T75-E77 PolarHBondContact O-N 3.02Å; T75-E77 VanDerWaalsContact O-N 3.16Å
78A45.7Very low54.2Low86 Ų86149.8 Ų149.871%0.71175%0.752SS**SBendtrans-132.399164.900000105.5
79E42.4Very low52.4Low187 Ų187150.7 Ų150.787%0.87476%0.755SS**SBend-170.243.489.4-79168.1-179.300109.9E81E79-E81 PolarHBondContact O-N 2.86Å
80Q38.2Very low50.5Low196 Ų196149.3 Ų149.392%0.91676%0.755SS**SBendtrans-93.940.7162.2-156.8175.71.200110
81E35.3Very low48.4Very low155 Ų155149.4 Ų149.472%0.72476%0.758SS**  trans-132.673.4175-72.4-173.8177.500108.1E79E79-E81 PolarHBondContact O-N 2.86Å
82V39.9Very low47.2Very low143 Ų143153.6 Ų153.687%0.86777%0.765SS**SBendtrans-111-2151.9-1800000110.2
83E39.3Very low45.3Very low185 Ų185153.5 Ų153.586%0.86477%0.774SS**SBendtrans-13858.5178.1-67.5-172.7158.800111.3
84E36.8Very low44Very low168 Ų168152.4 Ų152.479%0.78578%0.779SS**  trans-162.771.2152.5-110.7167.4-160.600109.8K86E84-K86 PolarHBondContact O-N 3.43Å
85E37.8Very low43.1Very low192 Ų192151.8 Ų151.890%0.89778%0.776SS**  trans-52.6123.5158.7-176.3-173146.600109.2
86K38.4Very low42.7Very low187 Ų187152.1 Ų152.181%0.81377%0.773SS**  trans84.598.6-174.3-68.3177164179.70115.2E84E84-K86 PolarHBondContact O-N 3.43Å
87V32.5Very low42.7Very low141 Ų141151.9 Ų151.986%0.85577%0.767SS**  -174.685.298.1160.20000106.6
88E40.7Very low43.2Very low185 Ų185148.4 Ų148.486%0.86475%0.75SS**  trans-74.2117.8161.5-178.5-172175.400107.8
89K45.7Very low43.7Very low175 Ų175149.4 Ų149.476%0.76174%0.744SS**  trans177.1118.1139.2-98.8161.5-170.5178.20111.2
90I43.3Very low44.3Very low147 Ų147145.1 Ų145.175%0.75473%0.734SS**  trans79.1120.8153.5-47.4151.9000111.9
91E39.2Very low45.8Very low168 Ų168138.9 Ų138.979%0.78571%0.707SS**  cis-161.2131.123.5-147.3165.6149.400108N93E91-N93 PolarHBondContact O-N 3.16Å
92L54.3Low47.8Very low151 Ų151134.9 Ų134.979%0.79169%0.694SS**  trans-71114.8162.1-166.9170.7000106.6
93N41.1Very low49.8Very low138 Ų138132.8 Ų132.874%0.73868%0.681SS**  trans-142.1106153.8-158.110.3000110.7E91E91-N93 PolarHBondContact O-N 3.16Å
94D45.7Very low51.8Low131 Ų131125.6 Ų125.670%0.70166%0.656SS**  trans-37.1165157.4-94-50.9000113
95S49.7Very low53.9Low58 Ų58121.2 Ų121.241%0.40664%0.636SS.*  trans90.264.5165.4790000117.5N97 E98S95-N97 PolarHBondContact O-N 2.94Å; S95-E98 WeakPolarHBondContact O-CG 3.24Å; S95-E98 PolarHBondContact O-N 2.88Å; S95-E98 WeakPolarHBondContact OG-CG 3.21Å
96I51.4Low56.1Low107 Ų107116.3 Ų116.355%0.54962%0.615SS.*THydrogen-bonded Turntrans-77.530.9157.8-162.9148.1000113.5R73R73-I96 HydrophobicContact CG-CG2 3.88Å
97N55Low58.4Low133 Ų133111 Ų11171%0.71160%0.598SS**THydrogen-bonded Turntrans-10810.7165.4-171.763000112.3S95S95-N97 PolarHBondContact O-N 2.94Å
98E55.7Low60.7Low83 Ų83109.4 Ų109.439%0.38858%0.581SS.*  trans-96.4-0.3-176.5-56.8-62.1133.300113.7S95 S100 D101 T102S95-E98 WeakPolarHBondContact O-CG 3.24Å; S95-E98 PolarHBondContact O-N 2.88Å; S95-E98 WeakPolarHBondContact OG-CG 3.21Å; E98-S100 VanDerWaalsContact C-N 3.3Å; E98-S100 PolarHBondContact O-N 2.85Å; E98-D101 CarbonylContact O-C 3.52Å; E98-D101 WeakPolarHBondContact O-CA 3.28Å; E98-D101 PolarHBondContact O-N 3.38Å; E98-T102 PolarHBondContact O-N 2.97Å; E98-T102 PolarHBondContact O-OG1 3.49Å; E98-T102 VanDerWaalsContact O-OG1 3.1Å
99N56.2Low62.8Low108 Ų108108.3 Ų108.358%0.57857%0.57SS**THydrogen-bonded Turntrans-74.4-14.4-172.167.661.7000114.8
100S55Low64.5Low96 Ų96103.6 Ų103.667%0.67155%0.552SS**THydrogen-bonded Turntrans-79.5-24.1165.453.60000112.1E98E98-S100 VanDerWaalsContact C-N 3.3Å; E98-S100 PolarHBondContact O-N 2.85Å
101D68.6Low66.4Low65 Ų65102.5 Ų102.535%0.34855%0.546SS..Hα-helixtrans-92.7-15.5-179.7-151.521.5000112.3E98 V103 G104 Q105E98-D101 CarbonylContact O-C 3.52Å; E98-D101 WeakPolarHBondContact O-CA 3.28Å; E98-D101 PolarHBondContact O-N 3.38Å; D101-V103 VanDerWaalsContact C-N 3.33Å; D101-V103 PolarHBondContact O-N 2.89Å; D101-G104 CarbonylContact O-C 3.56Å; D101-G104 PolarHBondContact O-N 3.39Å; D101-G104 VanDerWaalsContact O-N 3.16Å; D101-Q105 WeakPolarHBondContact O-CB 3.41Å; D101-Q105 PolarHBondContact O-N 3.05Å; D101-Q105 PolarHBondContact OD2-NE2 2.87Å; D101-Q105 PolarHBondContact OD2-OE1 3.43Å
102T76.7Confident68.4Low72 Ų72102.1 Ų102.144%0.44254%0.541SS..Hα-helixtrans-60.9-42175-43.70000111.8E98 I106E98-T102 PolarHBondContact O-N 2.97Å; E98-T102 PolarHBondContact O-OG1 3.49Å; E98-T102 VanDerWaalsContact O-OG1 3.1Å; T102-I106 HydrophobicContact CG2-CD1 3.98Å; T102-I106 WeakPolarHBondContact O-CB 3.16Å; T102-I106 VanDerWaalsContact O-CD1 3.28Å; T102-I106 WeakPolarHBondContact O-CD1 3.22Å; T102-I106 WeakPolarHBondContact O-CG1 3.4Å; T102-I106 PolarHBondContact O-N 3.45Å
103V82.6Confident69.6Low98 Ų9898.6 Ų98.659%0.59452%0.523SS*.Hα-helixtrans-68.5-40.9175.2179.80000110.7D101 I106 V107D101-V103 VanDerWaalsContact C-N 3.33Å; D101-V103 PolarHBondContact O-N 2.89Å; V103-I106 PolarHBondContact O-N 3.26Å; V103-V107 HydrophobicContact CG1-CG2 4.46Å; V103-V107 VanDerWaalsContact O-CG2 3.29Å; V103-V107 WeakPolarHBondContact O-CG2 3.26Å; V103-V107 PolarHBondContact O-N 3.22Å
104G82.1Confident71.5Confident34 Ų3499.9 Ų99.935%0.35153%0.525SS..Hα-helixtrans-61.1-47.5176.600000112.4D101 V107 H108D101-G104 CarbonylContact O-C 3.56Å; D101-G104 PolarHBondContact O-N 3.39Å; D101-G104 VanDerWaalsContact O-N 3.16Å; G104-V107 PolarHBondContact O-N 2.84Å; G104-H108 VanDerWaalsContact O-CB 3.24Å; G104-H108 WeakPolarHBondContact O-CB 3.41Å; G104-H108 PolarHBondContact O-N 3.45Å
105Q80.4Confident72.9Confident77 Ų7796.6 Ų96.636%0.3652%0.516SS..Hα-helixtrans-61.3-46.9173.5-112.498.867.900111.1D101 V107 H108 Y109D101-Q105 WeakPolarHBondContact O-CB 3.41Å; D101-Q105 PolarHBondContact O-N 3.05Å; D101-Q105 PolarHBondContact OD2-NE2 2.87Å; D101-Q105 PolarHBondContact OD2-OE1 3.43Å; Q105-V107 VanDerWaalsContact C-N 3.34Å; Q105-V107 PolarHBondContact O-N 2.86Å; Q105-H108 CarbonylContact O-C 3.56Å; Q105-H108 PolarHBondContact O-N 3.03Å; Q105-Y109 HydrophobicContact CB-CD2 4.07Å; Q105-Y109 HydrophobicContact CB-CE2 3.9Å; Q105-Y109 HydrophobicContact CG-CD2 4.29Å; Q105-Y109 HydrophobicContact CG-CE2 3.7Å; Q105-Y109 WeakPolarHBondContact O-CB 3.3Å; Q105-Y109 WeakPolarHBondContact O-CD2 3.4Å; Q105-Y109 PolarHBondContact O-N 3.12Å
106I83.9Confident74.1Confident89 Ų8996.4 Ų96.446%0.45651%0.51SS..Hα-helixtrans-59.2-46.5178.6-69.9161.7000110.4T102 V103 H108 Y109 I110T102-I106 HydrophobicContact CG2-CD1 3.98Å; T102-I106 WeakPolarHBondContact O-CB 3.16Å; T102-I106 VanDerWaalsContact O-CD1 3.28Å; T102-I106 WeakPolarHBondContact O-CD1 3.22Å; T102-I106 WeakPolarHBondContact O-CG1 3.4Å; T102-I106 PolarHBondContact O-N 3.45Å; V103-I106 PolarHBondContact O-N 3.26Å; I106-H108 VanDerWaalsContact C-N 3.33Å; I106-H108 PolarHBondContact O-N 3.3Å; I106-Y109 PolarHBondContact O-N 3.11Å; I106-I110 HydrophobicContact CG2-CD1 3.62Å; I106-I110 HydrophobicContact CG2-CG1 4.31Å; I106-I110 WeakPolarHBondContact O-CB 3.27Å; I106-I110 WeakPolarHBondContact O-CD1 3.37Å; I106-I110 WeakPolarHBondContact O-CG1 3.35Å; I106-I110 PolarHBondContact O-N 3.43Å
107V86.1Confident75.3Confident75 Ų7593.3 Ų93.346%0.45550%0.5SS..Hα-helixtrans-61.4-42.9176.2171.60000111.2V103 G104 Q105 I110 M111V103-V107 HydrophobicContact CG1-CG2 4.46Å; V103-V107 VanDerWaalsContact O-CG2 3.29Å; V103-V107 WeakPolarHBondContact O-CG2 3.26Å; V103-V107 PolarHBondContact O-N 3.22Å; G104-V107 PolarHBondContact O-N 2.84Å; Q105-V107 VanDerWaalsContact C-N 3.34Å; Q105-V107 PolarHBondContact O-N 2.86Å; V107-I110 PolarHBondContact O-N 2.89Å; V107-M111 HydrophobicContact CG1-CE 4.1Å; V107-M111 WeakPolarHBondContact O-CB 3.49Å; V107-M111 PolarHBondContact O-N 3.46Å
108H80.8Confident76.4Confident108 Ų10892.4 Ų92.450%0.550%0.496SS..Hα-helixtrans-64.4-39.9177.1-177.3-103.7000112G104 Q105 I106 M111 K112G104-H108 VanDerWaalsContact O-CB 3.24Å; G104-H108 WeakPolarHBondContact O-CB 3.41Å; G104-H108 PolarHBondContact O-N 3.45Å; Q105-H108 CarbonylContact O-C 3.56Å; Q105-H108 PolarHBondContact O-N 3.03Å; I106-H108 VanDerWaalsContact C-N 3.33Å; I106-H108 PolarHBondContact O-N 3.3Å; H108-M111 PolarHBondContact O-N 3.03Å; H108-K112 WeakPolarHBondContact O-CB 3.29Å; H108-K112 PolarHBondContact O-N 2.9Å
109Y84.5Confident77.6Confident161 Ų16192.9 Ų92.963%0.63150%0.5SS*.Hα-helixtrans-66-40.5173.7-78.4-62.7000112Q105 I106 N113Q105-Y109 HydrophobicContact CB-CD2 4.07Å; Q105-Y109 HydrophobicContact CB-CE2 3.9Å; Q105-Y109 HydrophobicContact CG-CD2 4.29Å; Q105-Y109 HydrophobicContact CG-CE2 3.7Å; Q105-Y109 WeakPolarHBondContact O-CB 3.3Å; Q105-Y109 WeakPolarHBondContact O-CD2 3.4Å; Q105-Y109 PolarHBondContact O-N 3.12Å; I106-Y109 PolarHBondContact O-N 3.11Å; Y109-N113 PolarHBondContact O-N 3.47Å
110I82.5Confident78.6Confident77 Ų7791.7 Ų91.740%0.39549%0.493SS..Hα-helixtrans-63.7-45.2177.1-69.9163.9000110.4I106 V107 N113 N116I106-I110 HydrophobicContact CG2-CD1 3.62Å; I106-I110 HydrophobicContact CG2-CG1 4.31Å; I106-I110 WeakPolarHBondContact O-CB 3.27Å; I106-I110 WeakPolarHBondContact O-CD1 3.37Å; I106-I110 WeakPolarHBondContact O-CG1 3.35Å; I106-I110 PolarHBondContact O-N 3.43Å; V107-I110 PolarHBondContact O-N 2.89Å; I110-N113 PolarHBondContact O-N 3.5Å; I110-N116 VanDerWaalsContact O-CB 3.32Å; I110-N116 WeakPolarHBondContact O-CB 3.46Å; I110-N116 PolarHBondContact O-ND2 3.04Å
111M82.4Confident79.4Confident124 Ų12494.5 Ų94.561%0.61149%0.493SS*.Hα-helixtrans-73-31-178.8-164.1-176.2-40.900113V107 H108 N113V107-M111 HydrophobicContact CG1-CE 4.1Å; V107-M111 WeakPolarHBondContact O-CB 3.49Å; V107-M111 PolarHBondContact O-N 3.46Å; H108-M111 PolarHBondContact O-N 3.03Å; M111-N113 VanDerWaalsContact C-N 3.31Å
112K81.3Confident79.8Confident160 Ų16093.6 Ų93.670%0.69650%0.495SS*.Hα-helixtrans-77.7-15.4177.8-176.5166.7175.6159.60113.3H108 E114H108-K112 WeakPolarHBondContact O-CB 3.29Å; H108-K112 PolarHBondContact O-N 2.9Å; K112-E114 PolarHBondContact O-N 3.16Å
113N80.7Confident79.6Confident76 Ų7695.4 Ų95.441%0.40650%0.5SS..  trans-75.8112.5174.1-174.3-17.1000109.8Y109 I110 M111 A115 N116 A117Y109-N113 PolarHBondContact O-N 3.47Å; I110-N113 PolarHBondContact O-N 3.5Å; M111-N113 VanDerWaalsContact C-N 3.31Å; N113-A115 VanDerWaalsContact C-N 3.26Å; N113-A115 PolarHBondContact O-N 2.95Å; N113-A115 PolarHBondContact OD1-N 3.19Å; N113-N116 HydrophobicContact CB-CB 4.1Å; N113-N116 WeakPolarHBondContact O-CA 3.18Å; N113-N116 WeakPolarHBondContact O-CB 3.34Å; N113-N116 PolarHBondContact O-N 2.91Å; N113-A117 PolarHBondContact O-N 3.28Å
114E79.5Confident78.9Confident166 Ų16695.8 Ų95.878%0.77650%0.502SS*.Hα-helixtrans-56.5-36.7-176.6-170.4174.6175.800113.1K112 N116 A117 D118K112-E114 PolarHBondContact O-N 3.16Å; E114-N116 VanDerWaalsContact C-N 3.32Å; E114-N116 PolarHBondContact O-N 2.9Å; E114-A117 PolarHBondContact O-N 3.26Å; E114-D118 PolarHBondContact O-N 3.48Å
115A76.8Confident78.1Confident62 Ų6296.4 Ų96.451%0.51250%0.504SS..Hα-helixtrans-68.4-31.3176.100000112.8N113 I119N113-A115 VanDerWaalsContact C-N 3.26Å; N113-A115 PolarHBondContact O-N 2.95Å; N113-A115 PolarHBondContact OD1-N 3.19Å; A115-I119 WeakPolarHBondContact O-CG1 3.23Å
116N74.1Confident77Confident54 Ų5498.6 Ų98.629%0.28952%0.518SS..Hα-helixtrans-80.4-32.3175.5-67.7-12.7000111.5I110 N113 E114 D118 I119 L120I110-N116 VanDerWaalsContact O-CB 3.32Å; I110-N116 WeakPolarHBondContact O-CB 3.46Å; I110-N116 PolarHBondContact O-ND2 3.04Å; N113-N116 HydrophobicContact CB-CB 4.1Å; N113-N116 WeakPolarHBondContact O-CA 3.18Å; N113-N116 WeakPolarHBondContact O-CB 3.34Å; N113-N116 PolarHBondContact O-N 2.91Å; E114-N116 VanDerWaalsContact C-N 3.32Å; E114-N116 PolarHBondContact O-N 2.9Å; N116-D118 VanDerWaalsContact C-N 3.3Å; N116-D118 PolarHBondContact O-N 3.42Å; N116-I119 PolarHBondContact O-N 3.35Å; N116-L120 VanDerWaalsContact O-CB 3.27Å; N116-L120 WeakPolarHBondContact O-CB 3.03Å; N116-L120 WeakPolarHBondContact O-CD1 3.47Å; N116-L120 WeakPolarHBondContact O-CG 3.32Å; N116-L120 PolarHBondContact O-N 3.44Å
117A76.3Confident75.6Confident41 Ų41100.8 Ų100.834%0.33953%0.531SS..Hα-helixtrans-62.9-38.1177.100000111.7N113 E114 K121N113-A117 PolarHBondContact O-N 3.28Å; E114-A117 PolarHBondContact O-N 3.26Å; A117-K121 WeakPolarHBondContact O-CB 3.45Å; A117-K121 PolarHBondContact O-N 2.87Å
118D78.6Confident74.1Confident114 Ų114101.7 Ų101.761%0.6154%0.54SS*.Hα-helixtrans-68.5-43.7177.1-165.338.6000112.1E114 N116 K121 A122E114-D118 PolarHBondContact O-N 3.48Å; N116-D118 VanDerWaalsContact C-N 3.3Å; N116-D118 PolarHBondContact O-N 3.42Å; D118-K121 PolarHBondContact O-N 3.44Å; D118-A122 WeakPolarHBondContact O-CB 3.05Å; D118-A122 PolarHBondContact O-N 3.2Å
119I79.8Confident72.5Confident94 Ų94104.8 Ų104.848%0.48256%0.557SS.*Hα-helixtrans-65.2-43.5175.4-62.8168.3000111.2A115 N116 K121 A122 M123A115-I119 WeakPolarHBondContact O-CG1 3.23Å; N116-I119 PolarHBondContact O-N 3.35Å; I119-K121 VanDerWaalsContact C-N 3.3Å; I119-K121 PolarHBondContact O-N 3.3Å; I119-A122 PolarHBondContact O-N 3.33Å; I119-M123 HydrophobicContact CG2-CE 3.84Å; I119-M123 HydrophobicContact CG2-SD 4.35Å; I119-M123 WeakPolarHBondContact O-CG 3.4Å; I119-M123 PolarHBondContact O-N 2.84Å
120L77.6Confident70.9Confident83 Ų83103.3 Ų103.344%0.43557%0.565SS.*Hα-helixtrans-63.1-37.8175.9-74167.2000111.2N116 V124N116-L120 VanDerWaalsContact O-CB 3.27Å; N116-L120 WeakPolarHBondContact O-CB 3.03Å; N116-L120 WeakPolarHBondContact O-CD1 3.47Å; N116-L120 WeakPolarHBondContact O-CG 3.32Å; N116-L120 PolarHBondContact O-N 3.44Å; L120-V124 VanDerWaalsContact O-CG2 3.24Å; L120-V124 WeakPolarHBondContact O-CG2 3.26Å; L120-V124 PolarHBondContact O-N 2.89Å
121K73.1Confident69.2Low154 Ų154106.8 Ų106.867%0.6758%0.584SS**Hα-helixtrans-69.7-39.6176.1-172.1178.4-179.8-1750112.1A117 D118 I119 V124 A125A117-K121 WeakPolarHBondContact O-CB 3.45Å; A117-K121 PolarHBondContact O-N 2.87Å; D118-K121 PolarHBondContact O-N 3.44Å; I119-K121 VanDerWaalsContact C-N 3.3Å; I119-K121 PolarHBondContact O-N 3.3Å; K121-V124 PolarHBondContact O-N 2.9Å; K121-A125 WeakPolarHBondContact O-CB 3.3Å; K121-A125 PolarHBondContact O-N 3.38Å
122A75.8Confident67.5Low46 Ų46106.6 Ų106.638%0.3859%0.589SS.*Hα-helixtrans-64-44.1173.900000111.5D118 I119 V124 A125 D126D118-A122 WeakPolarHBondContact O-CB 3.05Å; D118-A122 PolarHBondContact O-N 3.2Å; I119-A122 PolarHBondContact O-N 3.33Å; A122-V124 PolarHBondContact O-N 2.91Å; A122-A125 PolarHBondContact O-N 2.78Å; A122-D126 VanDerWaalsContact O-CG 3.25Å; A122-D126 PolarHBondContact O-N 3.44Å
123M72Confident65.4Low111 Ų111108.4 Ų108.455%0.54760%0.6SS.*Hα-helixtrans-64.4-36175.4-72.1-177.9178.100113.2I119 N127I119-M123 HydrophobicContact CG2-CE 3.84Å; I119-M123 HydrophobicContact CG2-SD 4.35Å; I119-M123 WeakPolarHBondContact O-CG 3.4Å; I119-M123 PolarHBondContact O-N 2.84Å; M123-N127 PolarHBondContact O-N 3.24Å; M123-N127 PolarHBondContact O-ND2 3.44Å
124V67.8Low63.9Low106 Ų106109.6 Ų109.664%0.64262%0.615SS**Hα-helixtrans-71.2-35.4174.5171.80000111L120 K121 A122 S128L120-V124 VanDerWaalsContact O-CG2 3.24Å; L120-V124 WeakPolarHBondContact O-CG2 3.26Å; L120-V124 PolarHBondContact O-N 2.89Å; K121-V124 PolarHBondContact O-N 2.9Å; A122-V124 PolarHBondContact O-N 2.91Å; V124-S128 PolarHBondContact O-N 3.34Å
125A66Low62.7Low47 Ų47106.6 Ų106.639%0.38861%0.609SS.*Hα-helixtrans-69-39175.900000112.6K121 A122 N127 S128 M129K121-A125 WeakPolarHBondContact O-CB 3.3Å; K121-A125 PolarHBondContact O-N 3.38Å; A122-A125 PolarHBondContact O-N 2.78Å; A125-N127 VanDerWaalsContact C-N 3.26Å; A125-N127 PolarHBondContact O-N 3.38Å; A125-S128 WeakPolarHBondContact CA-OG 3.25Å; A125-S128 WeakPolarHBondContact O-CA 2.91Å; A125-S128 WeakPolarHBondContact O-CB 3.16Å; A125-S128 PolarHBondContact O-N 3.03Å; A125-S128 PolarHBondContact O-OG 3.33Å; A125-M129 PolarHBondContact O-N 2.8Å
126D58.1Low60.7Low122 Ų122110.4 Ų110.465%0.65263%0.626SS**Hα-helixtrans-68.3-24179-70-20.7000113A122A122-D126 VanDerWaalsContact O-CG 3.25Å; A122-D126 PolarHBondContact O-N 3.44Å
127N54.3Low59.2Low136 Ų136114.5 Ų114.573%0.72765%0.653SS**THydrogen-bonded Turntrans-83.2-13169.7-72.9-73.1000113.2M123 A125M123-N127 PolarHBondContact O-N 3.24Å; M123-N127 PolarHBondContact O-ND2 3.44Å; A125-N127 VanDerWaalsContact C-N 3.26Å; A125-N127 PolarHBondContact O-N 3.38Å
128S54Low57.7Low94 Ų94117.5 Ų117.566%0.65767%0.669SS**SBendtrans-90.5-4.1177.274.80000114V124 A125V124-S128 PolarHBondContact O-N 3.34Å; A125-S128 WeakPolarHBondContact CA-OG 3.25Å; A125-S128 WeakPolarHBondContact O-CA 2.91Å; A125-S128 WeakPolarHBondContact O-CB 3.16Å; A125-S128 PolarHBondContact O-N 3.03Å; A125-S128 PolarHBondContact O-OG 3.33Å
129M46.8Very low55.6Low172 Ų172117.4 Ų117.485%0.84768%0.678SS**SBendtrans-98.622.2177.5-151.7-168.7-176.100113.6A125A125-M129 PolarHBondContact O-N 2.8Å
130V51.9Low53.5Low131 Ų131119 Ų11979%0.79469%0.691SS**  trans-120.474.1166.6-172.50000108.5
131D46.3Very low52.1Low150 Ų150120.8 Ų120.880%0.80271%0.709SS**  trans-146.8147142.5-157.29.6000110.6
132V47.7Very low50Low120 Ų120116.8 Ų116.873%0.72771%0.71SS**  trans87.575.9174.5-160.10000117.2
133E37Very low47.8Very low198 Ų198120.4 Ų120.493%0.92573%0.733SS**  trans-127.483.8130.8-161.9-177.6121.500109.4
134S48.9Very low46.8Very low101 Ų101120.9 Ų120.971%0.70675%0.745SS**  trans-110125.7144.4-163.50000104.3
135P53Low46.2Very low102 Ų102121.3 Ų121.366%0.66275%0.75SS**  -160.5136.283.436.6-15000116.1
136V35.8Very low44.7Very low142 Ų142126.3 Ų126.386%0.86178%0.775SS**  trans-169.4109.2136.6-106.60000111.3
137T42.4Very low43.8Very low140 Ų140125.6 Ų125.686%0.85978%0.779SS**  trans-101.6140.3140.334.90000106.7
138P44.1Very low43.6Very low105 Ų105125.2 Ų125.268%0.68278%0.784SS**  -152.9157.498.737.5-18.5000117
139S35.5Very low42.5Very low112 Ų112123.7 Ų123.778%0.78378%0.784SS**  trans86.8133152.1-42.40000119
140T36.1Very low42.5Very low126 Ų126121.1 Ų121.177%0.77378%0.78SS**  cis-169.4-164-11.6-49.90000106.2
141P47Very low41.4Very low122 Ų122122.2 Ų122.279%0.79278%0.781SS**  -114.1164.8-107.438.3-20.2000117
142G29.1Very low41.3Very low69 Ų69120.8 Ų120.871%0.71178%0.782SS**  trans133.3121.4141.500000119.5
143S30.7Very low40.9Very low123 Ų123120.8 Ų120.886%0.8679%0.785SS**  trans97124.9148.8-42.30000120.4
144P50.7Low41.2Very low121 Ų121115 Ų11579%0.78678%0.778SS**  trans-103.9-167.6160.440.7-29.7000110.7
145P55.8Low40.7Very low115 Ų115114.4 Ų114.475%0.74778%0.779SS**  cis-122162-40.335.6-20.9000112.2
146V33.4Very low40.1Very low152 Ų152115.7 Ų115.792%0.92179%0.785SS**  trans-147.8116.2153.2-172.90000110.6
147S39.8Very low40.6Very low106 Ų106115 Ų11574%0.74178%0.784SS**  trans-101.8161.8153.1-137.20000106.7
148P49.1Very low40.9Very low128 Ų128111.6 Ų111.683%0.83178%0.776SS**  cis-152.3151.848.836.6-13.3000118.9
149G31.3Very low41.2Very low63 Ų63114.4 Ų114.465%0.64978%0.778SS**  trans114.3164.7133.300000118.8
150P46.2Very low42.1Very low117 Ų117113.1 Ų113.176%0.7676%0.759SS**  cis-139.9171.7-4739.2-23.2000113.3
151L30Very low42.9Very low155 Ų155112.3 Ų112.381%0.81275%0.754SS**  trans81.990.5159.5-48.7173.8000118.1
152S44.2Very low43.5Very low119 Ų119108.4 Ų108.483%0.83273%0.729SS**  trans-61.3142.4137.2-89.80000109.5
153P39.3Very low45Very low121 Ų121108.1 Ų108.179%0.78673%0.726SS**  -118.1124.1125.3316.3000108.7
154G42.7Very low46.2Very low75 Ų75111.3 Ų111.377%0.77373%0.727SS**  trans-51141.417500000112.8
155A37.4Very low46.3Very low90 Ų90110 Ų11074%0.74471%0.71SS**  trans-149.1100.5145.700000105.3
156T41.8Very low46.3Very low128 Ų128110.2 Ų110.279%0.78570%0.704SS**  trans-36.913315549.90000108.5G158T156-G158 PolarHBondContact O-N 3.48Å
157P46.3Very low47.5Very low128 Ų128104.9 Ų104.983%0.83167%0.669SS**  trans-58.2104.2-176.620.5-29000108.4K159P157-K159 VanDerWaalsContact C-N 3.3Å; P157-K159 PolarHBondContact O-N 3.28Å
158G48.6Very low48.4Very low68 Ų68106.9 Ų106.970%0.70168%0.678SS**  trans-67.193.1-178.800000107.8T156 H160T156-G158 PolarHBondContact O-N 3.48Å; G158-H160 PolarHBondContact O-N 2.83Å
159K50.3Low48.5Very low165 Ų165105.8 Ų105.872%0.71767%0.668SS**  trans-52.9111.8164.759.1-162.7176.5-164.30107.6P157P157-K159 VanDerWaalsContact C-N 3.3Å; P157-K159 PolarHBondContact O-N 3.28Å
160H54.3Low49.7Very low84 Ų84106.8 Ų106.839%0.38968%0.679SS.*  trans-91139.6169.277.4-81.1000108.3G158 H167G158-H160 PolarHBondContact O-N 2.83Å; H160-H167 AromaticContact CE1-CD2 3.57Å; H160-H167 AromaticContact CE1-CE1 3.26Å; H160-H167 PolarHBondContact CE1-CE1 3.42Å; H160-H167 AromaticContact CE1-ND1 3.85Å; H160-H167 AromaticContact CE1-NE2 3.09Å; H160-H167 PolarHBondContact CE1-NE2 3.45Å; H160-H167 AromaticContact NE2-CE1 2.92Å; H160-H167 PolarHBondContact NE2-CE1 3.38Å; H160-H167 AromaticContact NE2-ND1 3.75Å; H160-H167 AromaticContact NE2-NE2 3.14Å; H160-H167 PolarHBondContact NE2-NE2 3.42Å; H160-H167 VanDerWaalsContact NE2-NE2 3.14Å
161V53.1Low49.9Very low109 Ų109104.4 Ų104.466%0.66168%0.675SS**  trans-102.596.3-178.4179.20000107.4G163V161-G163 VanDerWaalsContact C-N 3.32Å; V161-G163 PolarHBondContact O-N 3.5Å; V161-G163 VanDerWaalsContact O-N 3.11Å
162C59.9Low50.7Low41 Ų41104.3 Ų104.328%0.27768%0.68SS.*BIsolated β-bridgetrans-83.981.6171.2-175.90000108.6H164 H165C162-H164 PolarHBondContact O-N 2.94Å; C162-H165 PolarHBondContact O-N 3.39Å
163G61Low51Low63 Ų63104.9 Ų104.965%0.64968%0.679SS**THydrogen-bonded Turntrans58.4-28.5166.700000119.5V161V161-G163 VanDerWaalsContact C-N 3.32Å; V161-G163 PolarHBondContact O-N 3.5Å; V161-G163 VanDerWaalsContact O-N 3.11Å
164H54.5Low51.6Low189 Ų189107.5 Ų107.588%0.87568%0.681SS**THydrogen-bonded Turntrans-168.79.6-179.4-130.1-82.7000115.9C162C162-H164 PolarHBondContact O-N 2.94Å
165H54.2Low52.1Low93 Ų93114.7 Ų114.743%0.43168%0.684SS.*BIsolated β-bridgetrans-154.7151.1172.1112.5-76.5000114.2C162 H167C162-H165 PolarHBondContact O-N 3.39Å; H165-H167 AromaticContact CE1-CE1 3.99Å; H165-H167 AromaticContact CE1-CG 3.81Å; H165-H167 AromaticContact CE1-ND1 3.14Å; H165-H167 PolarHBondContact CE1-ND1 2.86Å; H165-H167 AromaticContact ND1-ND1 3.83Å; H165-H167 AromaticContact NE2-CG 3.93Å; H165-H167 AromaticContact NE2-ND1 3.68Å
166L54Low52.8Low120 Ų120117.7 Ų117.763%0.62869%0.688SS**  trans-92.8131.7174.5-110.575000110.7
167H60.6Low53.4Low40 Ų40116.1 Ų116.119%0.18568%0.678CS.*  trans-138.3152.5167.258.5-84.1000113.2H160 H165H160-H167 AromaticContact CE1-CD2 3.57Å; H160-H167 AromaticContact CE1-CE1 3.26Å; H160-H167 PolarHBondContact CE1-CE1 3.42Å; H160-H167 AromaticContact CE1-ND1 3.85Å; H160-H167 AromaticContact CE1-NE2 3.09Å; H160-H167 PolarHBondContact CE1-NE2 3.45Å; H160-H167 AromaticContact NE2-CE1 2.92Å; H160-H167 PolarHBondContact NE2-CE1 3.38Å; H160-H167 AromaticContact NE2-ND1 3.75Å; H160-H167 AromaticContact NE2-NE2 3.14Å; H160-H167 PolarHBondContact NE2-NE2 3.42Å; H160-H167 VanDerWaalsContact NE2-NE2 3.14Å; H165-H167 AromaticContact CE1-CE1 3.99Å; H165-H167 AromaticContact CE1-CG 3.81Å; H165-H167 AromaticContact CE1-ND1 3.14Å; H165-H167 PolarHBondContact CE1-ND1 2.86Å; H165-H167 AromaticContact ND1-ND1 3.83Å; H165-H167 AromaticContact NE2-CG 3.93Å; H165-H167 AromaticContact NE2-ND1 3.68Å
168T57Low54.2Low149 Ų149111.6 Ų111.691%0.91465%0.649SS**  trans-99.884.5178.3-40.90000108.9
169V51.6Low54.8Low105 Ų105114.7 Ų114.764%0.63665%0.645SS**  trans-124.4104.7167.7178.90000107.6G171V169-G171 PolarHBondContact O-N 2.84Å
170G56.8Low55Low84 Ų84116.9 Ų116.987%0.86665%0.649SS**  trans-72.5116171.800000109.5
171G49.4Very low55.2Low66 Ų66114.7 Ų114.768%0.6864%0.643SS**  trans-176.8126.2172.200000110.5V169 V173V169-G171 PolarHBondContact O-N 2.84Å; G171-V173 PolarHBondContact O-N 3.37Å
172V48.7Very low55.3Low153 Ų153117 Ų11793%0.92764%0.639SS**  trans-75.486.4174.8175.60000108.2
173V48.5Very low55Low131 Ų131120.7 Ų120.779%0.79465%0.652SS**  trans-147.1125.4158.9-179.30000108.5G171G171-V173 PolarHBondContact O-N 3.37Å
174E52.3Low54.7Low177 Ų177126.1 Ų126.183%0.82766%0.658SS**  trans10.8126.5163.7-147.9159178.100119.1D176E174-D176 PolarHBondContact O-N 3.22Å
175R54.1Low54.5Low226 Ų226126.2 Ų126.285%0.85365%0.651SS**THydrogen-bonded Turntrans-58.6131.3179.8-51.1-177.1-169-176.24108.3
176D52Low54.5Low153 Ų153131.4 Ų131.482%0.81867%0.667SS**THydrogen-bonded Turntrans1122.4160.2-53.6-25.5000119.1E174E174-D176 PolarHBondContact O-N 3.22Å
177V53.9Low54.5Low95 Ų95133.5 Ų133.558%0.57667%0.673SS**  trans-137.778178.1-144.30000114.1Q179V177-Q179 PolarHBondContact O-N 3.17Å
178C63.2Low54.1Low32 Ų32140.9 Ų140.922%0.21671%0.705CS.*  trans-67.3105.9163.3-179.80000109.5R180 C181 R182C178-R180 PolarHBondContact O-N 3.29Å; C178-R180 VanDerWaalsContact O-N 3.12Å; C178-C181 HydrophobicContact CB-CB 3.96Å; C178-C181 PolarHBondContact O-N 2.94Å; C178-R182 PolarHBondContact O-N 3.34Å
179Q61.5Low54Low134 Ų134139.6 Ų139.663%0.62669%0.691SS**Hα-helixtrans-52.8-35.1178.8-143.5112.35.100111.9V177 H183V177-Q179 PolarHBondContact O-N 3.17Å; Q179-H183 PolarHBondContact O-CD2 3.47Å; Q179-H183 PolarHBondContact O-N 3.15Å
180R54.1Low53.8Low211 Ų211144.3 Ų144.380%0.79670%0.703SS**Hα-helixtrans-75.7-28.3-178.3-150.8155.2-175.888.7-2.7113.2C178C178-R180 PolarHBondContact O-N 3.29Å; C178-R180 VanDerWaalsContact O-N 3.12Å
181C58.6Low53.1Low38 Ų38145.6 Ų145.626%0.25770%0.696SS.*Hα-helixtrans-79.6-38.3173.1-67.40000112C178 H183 K184C178-C181 HydrophobicContact CB-CB 3.96Å; C178-C181 PolarHBondContact O-N 2.94Å; C181-H183 VanDerWaalsContact C-N 3.26Å; C181-H183 PolarHBondContact O-N 2.95Å; C181-K184 PolarHBondContact O-N 3.34Å
182R55.1Low52.9Low156 Ų156148 Ų14859%0.58970%0.697SS**Hα-helixtrans-59.7-35.4179.3-177.2177.1163.8-162.6-4.4112.5C178C178-R182 PolarHBondContact O-N 3.34Å
183H54.9Low52.5Low120 Ų120147.7 Ų147.756%0.55669%0.691SS**Hα-helixtrans-79.3-30.8-175-71.9-149.8000113.6Q179 C181Q179-H183 PolarHBondContact O-CD2 3.47Å; Q179-H183 PolarHBondContact O-N 3.15Å; C181-H183 VanDerWaalsContact C-N 3.26Å; C181-H183 PolarHBondContact O-N 2.95Å
184K53.1Low52.5Low177 Ų177151.2 Ų151.277%0.7770%0.695SS**Hα-helixtrans-77.3-21.9179.5-81.7175.9-179.8-840113.9C181C181-K184 PolarHBondContact O-N 3.34Å
185R51.6Low51.9Low191 Ų191149.5 Ų149.572%0.72170%0.697SS**THydrogen-bonded Turntrans-83.1-13.1179.3-160.4-168.4-70.9-175.6-2.4113.7H187R185-H187 PolarHBondContact O-N 2.95Å
186W54.3Low51.4Low201 Ų201148 Ų14876%0.76170%0.697SS**G310 helixtrans-81.7-7.9-171.7-165-87.2000114.9F188W186-F188 PolarHBondContact O-N 3.19Å
187H54Low50.9Low164 Ų164148 Ų14876%0.75969%0.692SS**G310 helixtrans-82.9-2.7-177.9-75.7-78000115.6R185R185-H187 PolarHBondContact O-N 2.95Å
188F52.2Low50Low195 Ų195148.6 Ų148.686%0.85570%0.7SS**G310 helixtrans-116.64.5-175.5-79.7-77.5000116.2W186W186-F188 PolarHBondContact O-N 3.19Å
189I53.4Low49.1Very low122 Ų122158.2 Ų158.263%0.62673%0.732SS**  trans-130.990.6177.7-52.5161.4000108.7
190K48.3Very low48.9Very low205 Ų205157.4 Ų157.489%0.89174%0.738SS**  trans-98.3114.3162.2-111.7171.2172.21740107.7
191P40.9Very low48.5Very low110 Ų110156.9 Ų156.971%0.71474%0.736SS**  trans-70.9134156.3-5.522.4000108.4
192T46.5Very low48Very low116 Ų116167 Ų16771%0.71277%0.769SS**  trans-49.8135.4160.21710000110.4
193N40.7Very low47.7Very low148 Ų148167 Ų16779%0.79178%0.776SS**  165.2130.2128-72.6-22.5000110.5
194K47.4Very low47.7Very low204 Ų204165.1 Ų165.189%0.88779%0.789SS**  trans-91.3143.3-178-52.8-176.6-179.7178.40110.4
195T40.2Very low47.3Very low142 Ų142165.2 Ų165.287%0.87179%0.792SS**  trans-153.3107.7143.8440000112.3
196K44Very low47.1Very low194 Ų194162.4 Ų162.484%0.84380%0.796SS**  54.1114.5129-156.1166.2-176-172.80121.9
197E40.6Very low47Very low154 Ų154158 Ų15872%0.7279%0.792SS**  trans72.3116.1133.4-154.574.1-133.200121.8
198S36.1Very low46.8Very low107 Ų107154.2 Ų154.275%0.74878%0.78SS**  175.7117.7111.255.60000113.6
199R43.6Very low46.6Very low233 Ų233152.3 Ų152.388%0.87978%0.778SS**  trans49.8146.7149.3-74.7-170.2180165.11.3123.5
200P57.6Low46.6Very low117 Ų117151.7 Ų151.776%0.7678%0.784SS**  trans-87.8164.3179.637.7-34.4000113.1
201R46.3Very low47Very low200 Ų200147.7 Ų147.776%0.75578%0.777SS**  trans90.999.8161.4-160.8178.8-172.2-118.9-3.1117.1
202R47.4Very low47.4Very low252 Ų252145.6 Ų145.695%0.95178%0.775SS**  -137.3113.2126.6-70.1-165.7179.8-105.4-2109.5
203Q48.1Very low48.1Very low155 Ų155152.6 Ų152.672%0.72479%0.788SS**  trans-68.4144.4166.4-69.8164.1-59.300108.8
204G55.5Low48.5Very low81 Ų81153.7 Ų153.784%0.83579%0.786SS**  trans107.369.9158.600000115.9
205E45.2Very low49Very low179 Ų179154 Ų15484%0.83678%0.782SS**  trans-142.2112.3148.2-166.2169.4170.400109.3T207E205-T207 PolarHBondContact O-N 2.85Å
206V47.1Very low49.5Very low131 Ų131152.5 Ų152.579%0.79477%0.772SS**  trans-81.5101.6174.6175.50000106.2V208V206-V208 PolarHBondContact O-N 2.69Å
207T52Low50.3Low110 Ų110149 Ų14968%0.67577%0.768SS**  trans-70.2102.6174.253.50000108.7E205 L209E205-T207 PolarHBondContact O-N 2.85Å; T207-L209 PolarHBondContact O-N 2.72Å
208V49Very low50.8Low84 Ų84151.2 Ų151.251%0.50978%0.775SS.*  trans-57.1100.7167.5179.60000107.5V206 S210V206-V208 PolarHBondContact O-N 2.69Å; V208-S210 VanDerWaalsContact C-N 3.26Å; V208-S210 PolarHBondContact O-N 3.04Å; V208-S210 PolarHBondContact O-OG 3.23Å
209L48.3Very low51.3Low155 Ų155151.8 Ų151.881%0.81277%0.773SS**  trans-64.797.2164.7-71.5172.8000106.3T207 V211T207-L209 PolarHBondContact O-N 2.72Å; L209-V211 PolarHBondContact O-N 3.48Å
210S53.1Low51.1Low109 Ų109149.1 Ų149.176%0.76277%0.771SS**  trans-72.977.4179.7-60.60000108.9V208V208-S210 VanDerWaalsContact C-N 3.26Å; V208-S210 PolarHBondContact O-N 3.04Å; V208-S210 PolarHBondContact O-OG 3.23Å
211V57.8Low50.4Low121 Ų121152 Ų15273%0.73377%0.773SS**  trans-83.8128.7158.2-1650000105.5L209 R213L209-V211 PolarHBondContact O-N 3.48Å; V211-R213 PolarHBondContact O-N 2.89Å
212G48.2Very low50.5Low65 Ų65151.1 Ų151.167%0.6778%0.775SS**THydrogen-bonded Turntrans-37.5130.4-164.100000116.6F214G212-F214 PolarHBondContact O-N 3.47Å
213R61.1Low50.4Low264 Ų264144.1 Ų144.1100%0.99677%0.765SS**THydrogen-bonded Turntrans56.3-4.9159.4-47.8-174.1-174-1772119.4V211V211-R213 PolarHBondContact O-N 2.89Å
214F49.3Very low50.3Low170 Ų170144 Ų14475%0.74677%0.769SS**  trans-113.6104.9179.1-160-110000111.2G212 V216G212-F214 PolarHBondContact O-N 3.47Å; F214-V216 HydrophobicContact CD1-CG2 3.52Å; F214-V216 HydrophobicContact CE1-CG2 3.23Å; F214-V216 HydrophobicContact CZ-CG2 4.25Å
215R57.9Low49.9Very low210 Ų210148.9 Ų148.979%0.79277%0.771SS**  trans-94.7103.9176.2-71.4-176.6162.7-153.3-4.5109.4
216V51.5Low49.8Very low112 Ų112147.8 Ų147.868%0.67976%0.763SS**  trans-91103.2166.3-176.50000108.2F214 K218F214-V216 HydrophobicContact CD1-CG2 3.52Å; F214-V216 HydrophobicContact CE1-CG2 3.23Å; F214-V216 HydrophobicContact CZ-CG2 4.25Å; V216-K218 PolarHBondContact O-N 2.94Å
217T59.8Low49.7Very low121 Ų121151.2 Ų151.274%0.74277%0.77SS**  trans-76.7106.9168.149.70000108.3V219T217-V219 PolarHBondContact O-N 3.23Å
218K52.1Low49.5Very low200 Ų200155.9 Ų155.987%0.8778%0.775SS**  trans-75.4108.4166.4-159.2-179.2-175173.80107.4V216 E220V216-K218 PolarHBondContact O-N 2.94Å; K218-E220 PolarHBondContact O-N 3.29Å
219V46.2Very low49.3Very low118 Ų118161.1 Ų161.172%0.71579%0.786SS**  trans-64.9119.1168.3175.40000107.1T217 H221T217-V219 PolarHBondContact O-N 3.23Å; V219-H221 PolarHBondContact O-N 2.87Å; V219-H221 VanDerWaalsContact O-N 3.14Å
220E40Very low48.9Very low178 Ų178159.2 Ų159.283%0.83279%0.786SS**  trans-62.4110.9170.8-173.8-171.9177.500108.2K218 K222K218-E220 PolarHBondContact O-N 3.29Å; E220-K222 VanDerWaalsContact C-N 3.32Å; E220-K222 PolarHBondContact O-N 3.36Å
221H42Very low48.3Very low176 Ų176161 Ų16182%0.81579%0.786SS**  trans-73.995.4168.3-123.9-85000107.8V219 S223V219-H221 PolarHBondContact O-N 2.87Å; V219-H221 VanDerWaalsContact O-N 3.14Å; H221-S223 PolarHBondContact O-N 3.14Å; H221-S223 VanDerWaalsContact O-N 3.14Å
222K49.4Very low47.3Very low183 Ų183163.2 Ų163.280%0.79679%0.791SS**  trans-50.4110.7162-175.7172.4-179172.10109.1E220E220-K222 VanDerWaalsContact C-N 3.32Å; E220-K222 PolarHBondContact O-N 3.36Å
223S44.2Very low46.8Very low105 Ų105165.1 Ų165.173%0.73479%0.794SS**  trans-129.477.2161.454.90000110.2H221 Q225H221-S223 PolarHBondContact O-N 3.14Å; H221-S223 VanDerWaalsContact O-N 3.14Å; S223-Q225 VanDerWaalsContact C-N 3.3Å; S223-Q225 PolarHBondContact O-N 3.14Å; S223-Q225 VanDerWaalsContact O-N 3.11Å
224N46.3Very low45.8Very low152 Ų152158.6 Ų158.681%0.81378%0.783SS**  trans-66.693.1150.2-169.8-75.3000107.3
225Q47.3Very low45.2Very low184 Ų184155.3 Ų155.386%0.8678%0.781SS**  trans-168.2137.2157.8-129.2177.66.200110.6S223S223-Q225 VanDerWaalsContact C-N 3.3Å; S223-Q225 PolarHBondContact O-N 3.14Å; S223-Q225 VanDerWaalsContact O-N 3.11Å
226K42.6Very low44.3Very low156 Ų156148.6 Ų148.668%0.67878%0.777SS**  trans104.440.3164.5-140.8169.2-174.7-178.50117.4R228K226-R228 PolarHBondContact O-N 2.98Å
227E45.8Very low43.6Very low202 Ų202150.4 Ų150.494%0.94478%0.781SS**  trans-76.480.4131.4-170.1-178.3-171.300107.9
228R46.8Very low42.5Very low208 Ų208152.9 Ų152.979%0.78578%0.784SS**  trans-169123.6158-150.6171.6-177.9-101.9-0.1109.6K226K226-R228 PolarHBondContact O-N 2.98Å
229R45.1Very low41.8Very low194 Ų194149 Ų14973%0.73278%0.783SS**  trans78.1109.1170.592-147.4179.6-176.41.5114.6
230S40.6Very low41.4Very low116 Ų116149.3 Ų149.381%0.81178%0.784SS**  cis33.783.324.8-161.30000113.6
231L41.3Very low41Very low147 Ų147148.1 Ų148.177%0.7778%0.784SS**  trans173.4137.4133.2-87.2179.3000107.9
232M36.5Very low40.7Very low167 Ų167143 Ų14382%0.82378%0.778SS**  trans85.593.9169.3-55.9177.2175.400114.8
233S37.2Very low40.1Very low105 Ų105142.1 Ų142.173%0.73478%0.782SS**  73.7127.681.669.20000110.9
234V39.9Very low40.3Very low127 Ų127142.5 Ų142.577%0.7778%0.78SS**  cis-162.4150.549.7163.80000108.9
235S37.3Very low40.2Very low100 Ų100140.8 Ų140.870%0.69978%0.777SS**  trans-38.7140.916949.60000116.7
236G39Very low39.9Very low69 Ų69138.7 Ų138.771%0.71178%0.776SS**  trans-77.6143150.900000110.5
237I36.6Very low40.1Very low151 Ų151136.9 Ų136.977%0.77478%0.778SS**  trans-165.6128.1138.244.2165.3000109.4
238E35.7Very low39.9Very low173 Ų173133.2 Ų133.281%0.80877%0.772SS**  trans66.8113.7130.1-153.5165.2-173.700120.1
239S37.4Very low39.4Very low119 Ų119130.2 Ų130.283%0.83278%0.777SS**  -170129.9125.9-82.70000112.6
240V37.9Very low38.9Very low123 Ų123129.9 Ų129.975%0.74578%0.781SS**  trans-60.6133.8165.164.10000111.5
241N32.9Very low38.8Very low154 Ų154135.1 Ų135.182%0.82478%0.783SS**  trans171145.7132.2-97.1-47.9000110.8
242G35.7Very low38.7Very low67 Ų67136.4 Ų136.469%0.69179%0.785SS**  trans-64.8157.5-163.300000116.2
243D36.9Very low38.9Very low166 Ų166139.5 Ų139.589%0.88879%0.787SS**  -160.2150.3123.4-113.2-32.5000111.4
244V47.8Very low39.2Very low112 Ų112139 Ų13968%0.67978%0.784SS**  trans-31.8140.6-178.8178.90000116.8V246V244-V246 PolarHBondContact O-N 3.11Å
245P43.4Very low39.3Very low116 Ų116139.4 Ų139.475%0.75378%0.781SS**  trans-80.6114.3169.931.5-29.5000111.2T247P245-T247 PolarHBondContact O-N 3.33Å
246V40.5Very low39.7Very low140 Ų140141.4 Ų141.485%0.84879%0.79SS**  trans-77.9110167.9169.30000109.2V244V244-V246 PolarHBondContact O-N 3.11Å
247T46.9Very low39.5Very low118 Ų118150.7 Ų150.772%0.72481%0.814SS**  trans-81.1151.9166.7460000111.6P245P245-T247 PolarHBondContact O-N 3.33Å
248P41.7Very low39.6Very low125 Ų125150.7 Ų150.781%0.81282%0.816SS**  trans-77.2150.4-174.132.2-33.7000113.2
249V37.9Very low39.9Very low145 Ų145149.5 Ų149.588%0.87982%0.817SS**  trans-40134.41751710000114.8
250K34.3Very low40Very low188 Ų188151.2 Ų151.282%0.81782%0.816SS**  167.7115.3124.1-173.2176.4-173.9-175.20113
251R38.6Very low40.1Very low226 Ų226152.8 Ų152.885%0.85382%0.82SS**  trans174.5110139.9-100.2177.5-177.8112.7-3.2108
252E37.6Very low40.6Very low174 Ų174152.8 Ų152.881%0.81382%0.82SS**  85.2115.388-159.3171.216000110.9
253R41.6Very low40.9Very low231 Ų231158.5 Ų158.587%0.87283%0.829SS**  trans-100.1120.2-170.8177.9-176.9-173.2163.43.1107.9
254S42.7Very low41.2Very low95 Ų95157.9 Ų157.966%0.66482%0.824SS**  trans-159.893.5163.4-54.90000105.1
255D42.1Very low40.7Very low135 Ų135161.5 Ų161.572%0.72284%0.836SS**  81.9143.992.9-77.4-28.2000113.4
256T46.8Very low40.4Very low142 Ų142165.3 Ų165.387%0.87184%0.842SS**  trans81.2124.1-179.662.30000115.5
257E34.4Very low40.4Very low264 Ų264167.5 Ų167.5100%1.23484%0.842SS**  cis-154.705-178.4178.1107.500107.2

Retrieved 257 of 257 residues in 31.7 ms (Link to these results)