A0A096N104_PAPAN Loading...

NADH dehydrogenase [ubiquinone] 1 beta subcomplex subunit 5, mitochondrial

Accessory subunit of the mitochondrial membrane respiratory chain NADH dehydrogenase (Complex I), that is believed not to be involved in catalysis. Complex I functions in the transfer of electrons from NADH to the respiratory chain. The immediate electron acceptor for the enzyme is believed to be ubiquinone.

AlphaFold DB , UniProt , Accession A0A096N104, Species PAPAN (Papio anubis, Olive baboon), Gene NDUFB5, Length 189 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
1M42.7Very low44.5Very low241 Ų241158.1 Ų158.1100%1.18786%0.86SS**  072.10-64.8-167.4-83.100107.5
2A42.8Very low44.3Very low111 Ų111155.8 Ų155.892%0.91785%0.854SS**  5792.774.500000112.9
3G43.8Very low44.3Very low81 Ų81153.3 Ų153.384%0.83585%0.847SS**  trans177.543.4175.600000112.3
4M39.4Very low44.3Very low176 Ų176148.5 Ų148.587%0.86784%0.837SS**  trans-86.2137.2176-75.4-167.617200111.4
5S46Very low44.1Very low108 Ų108146.1 Ų146.176%0.75583%0.827SS**  trans34.1102.1142.370.40000119.3
6L49.8Very low43.9Very low160 Ų160142.1 Ų142.184%0.83882%0.817SS**  trans-136.5105156.9-70.4169.9000103.8
7L48.1Very low43.9Very low166 Ų166139.4 Ų139.487%0.86982%0.816SS**  -174.781.768.6-82.6156.5000109
8R45.2Very low44.1Very low241 Ų241140.7 Ų140.791%0.90982%0.818SS**  trans-104.898.8159.6-108-175.5174.1-176.6-0.9106.4
9R46.8Very low44.1Very low240 Ų240138.1 Ų138.191%0.90681%0.809SS**  trans154.893.8157.6-86.1157.9-168.3-127.75.6111
10V43.1Very low44.2Very low133 Ų133135.6 Ų135.681%0.80681%0.813SS**  trans-146.778.5149-179.80000104.3
11S41.2Very low44Very low82 Ų82140.3 Ų140.357%0.57382%0.817SS**  82.512395.365.40000113T13S11-T13 PolarHBondContact O-N 3.35Å; S11-T13 PolarHBondContact O-OG1 3.28Å
12V42.5Very low43.7Very low130 Ų130134.7 Ų134.779%0.78880%0.802SS**SBendtrans-58.321.4-176.3168.60000115.1A14V12-A14 PolarHBondContact O-N 2.9Å
13T45Very low43.4Very low124 Ų124137.5 Ų137.576%0.76180%0.8SS**THydrogen-bonded Turntrans-80.633.5178.847.10000113.7S11S11-T13 PolarHBondContact O-N 3.35Å; S11-T13 PolarHBondContact O-OG1 3.28Å
14A43.8Very low43.4Very low86 Ų86137.2 Ų137.271%0.71180%0.797SS**THydrogen-bonded Turntrans-120.3-9.9173.400000113.4V12V12-A14 PolarHBondContact O-N 2.9Å
15V41.7Very low43.2Very low112 Ų112135.3 Ų135.368%0.67980%0.795SS**THydrogen-bonded Turntrans-107.4-16.1-177.7-177.10000112.9A17V15-A17 PolarHBondContact O-N 2.7Å
16A41.3Very low43.1Very low82 Ų82141.8 Ų141.868%0.67880%0.803SS**THydrogen-bonded Turntrans-875-18000000115.1
17A43.8Very low42.5Very low96 Ų96141.9 Ų141.979%0.79380%0.804SS**THydrogen-bonded Turntrans-89.5-2.417500000113.6V15V15-A17 PolarHBondContact O-N 2.7Å
18L46.4Very low42.4Very low163 Ų163137.3 Ų137.385%0.85380%0.797SS**SBendtrans-106.61.5-176.7-78.1170.1000115.2
19S43.8Very low41.8Very low92 Ų92135.6 Ų135.664%0.64380%0.797SS**  trans-123.994.6174.360.60000111.3R21S19-R21 VanDerWaalsContact C-N 3.33Å; S19-R21 PolarHBondContact O-N 2.77Å
20G46.3Very low41.5Very low87 Ų87127.7 Ų127.790%0.89779%0.79SS**  trans-67.984.2173.500000112.2
21R40.1Very low41.1Very low235 Ų235124.8 Ų124.889%0.88779%0.787SS**  trans-142.8102.7165-122.1176.3175.2178.1-2110.8S19 L23S19-R21 VanDerWaalsContact C-N 3.33Å; S19-R21 PolarHBondContact O-N 2.77Å; R21-L23 PolarHBondContact O-N 2.91Å
22S36.1Very low41.5Very low124 Ų124130.3 Ų130.387%0.86780%0.801SS**  trans-69.1110.4169.858.80000110
23L38.1Very low42Very low170 Ų170131.5 Ų131.589%0.8980%0.802SS**  trans-82.5113.7164.2-97.2153000107.9R21R21-L23 PolarHBondContact O-N 2.91Å
24G42.3Very low41.8Very low75 Ų75132.1 Ų132.177%0.77381%0.806SS**  trans-73.1125.7175.900000111
25T36.5Very low42Very low135 Ų135139.5 Ų139.583%0.82882%0.815SS**  trans-94.1102.8165.435.20000109.2L27T25-L27 PolarHBondContact O-N 2.85Å
26R44.1Very low42Very low244 Ų244137.6 Ų137.692%0.92182%0.818SS**  trans-60.9116.4151.8-84.6-175.8175.6-166.4-0.3107.4
27L37.6Very low42.4Very low162 Ų162143.1 Ų143.185%0.84883%0.827SS**  trans-153.5105.3155.2-117139.3000107.7T25T25-L27 PolarHBondContact O-N 2.85Å
28G45Very low42.6Very low71 Ų71144.4 Ų144.473%0.73283%0.828SS**  trans-74.7139.6170.300000110
29F32.3Very low42.6Very low204 Ų204146 Ų14690%0.89583%0.828SS**  trans-146120.1153.4-138.6-96.7000107.2
30G40Very low43Very low74 Ų74146.3 Ų146.376%0.76384%0.836SS**  trans-70150.9175.400000111
31G36.3Very low43.3Very low72 Ų72148.4 Ų148.474%0.74283%0.831SS**  trans173.378.8178.200000112.3
32F47.8Very low44.1Very low198 Ų198140.7 Ų140.787%0.86882%0.817SS**  trans14.2110.7141.2-161.1-105.4000116.1
33L53.8Low45.1Very low155 Ų155140.2 Ų140.281%0.81281%0.811SS**  trans134.657.5161.4-70-178.8000112.9
34T40.8Very low46Very low137 Ų137137.5 Ų137.584%0.8480%0.801SS**  trans-119.398.2164.858.60000109.9G36T34-G36 PolarHBondContact O-N 3.5Å; T34-G36 VanDerWaalsContact O-N 3.16Å
35R47.9Very low46.8Very low241 Ų241144.9 Ų144.991%0.90981%0.806SS**  trans-54114.4164.9-156.8176.6-172.9175.61.5107.4F37R35-F37 PolarHBondContact O-N 2.65Å
36G41.7Very low47.5Very low72 Ų72147.1 Ų147.174%0.74281%0.807SS**PPolyproline II helixtrans-63.5117.4-176.300000111.2T34T34-G36 PolarHBondContact O-N 3.5Å; T34-G36 VanDerWaalsContact O-N 3.16Å
37F49.7Very low48Very low198 Ų198141.1 Ų141.187%0.86880%0.802SS**PPolyproline II helixtrans-70.5132.1162.5-79.4-88.2000108.4R35 K39R35-F37 PolarHBondContact O-N 2.65Å; F37-K39 PolarHBondContact O-N 3.44Å; F37-K39 VanDerWaalsContact O-N 3.12Å
38P47.6Very low48.8Very low124 Ų124136.5 Ų136.581%0.80579%0.794SS**PPolyproline II helixtrans-61.6121.6175.225.4-31.8000108.5A40P38-A40 PolarHBondContact O-N 2.97Å
39K47.2Very low49.2Very low197 Ų197137.6 Ų137.686%0.85781%0.805SS**  trans-61.4102175.5-154.5176.4-170175.60107F37 V41F37-K39 PolarHBondContact O-N 3.44Å; F37-K39 VanDerWaalsContact O-N 3.12Å; K39-V41 PolarHBondContact O-N 3.27Å
40A51Low50.5Low97 Ų97134.4 Ų134.480%0.80279%0.793SS**  trans-61.3103.5172.100000107.8P38 A42P38-A40 PolarHBondContact O-N 2.97Å; A40-A42 VanDerWaalsContact C-N 3.29Å; A40-A42 PolarHBondContact O-N 3.34Å
41V53.9Low51.7Low132 Ų132133.8 Ų133.880%0.879%0.786SS**  trans-70.592.3173.4179.40000106.4K39K39-V41 PolarHBondContact O-N 3.27Å
42A57.6Low53.4Low73 Ų73140.3 Ų140.360%0.60379%0.794SS**  trans-63.5129.6172.800000108.7A40 V44A40-A42 VanDerWaalsContact C-N 3.29Å; A40-A42 PolarHBondContact O-N 3.34Å; A42-V44 PolarHBondContact O-N 3.2Å; A42-V44 VanDerWaalsContact O-N 3.09Å
43P55.9Low54.6Low114 Ų114140.2 Ų140.274%0.7479%0.788SS**  trans-63114.9178.824.1-32.1000109.8R45P43-R45 PolarHBondContact O-N 3.09Å; P43-R45 VanDerWaalsContact O-N 3.1Å
44V57.2Low56Low112 Ų112140.1 Ų140.168%0.67979%0.788SS**  trans-7598.9176178.20000107.9A42 H46A42-V44 PolarHBondContact O-N 3.2Å; A42-V44 VanDerWaalsContact O-N 3.09Å; V44-H46 PolarHBondContact O-N 3.37Å
45R58Low58.1Low231 Ų231142.5 Ų142.587%0.87279%0.786SS**  trans-76.2109.9171.6-73.1-172.7172-166.4-2.1109.3P43 S47P43-R45 PolarHBondContact O-N 3.09Å; P43-R45 VanDerWaalsContact O-N 3.1Å; R45-S47 VanDerWaalsContact C-N 3.34Å; R45-S47 PolarHBondContact O-N 3.46Å
46H52.5Low60Low181 Ų181135.4 Ų135.484%0.83877%0.77SS**  trans-83.376.7168.1-68.4-76.9000109.8V44V44-H46 PolarHBondContact O-N 3.37Å
47S53.8Low62.1Low118 Ų118138.1 Ų138.183%0.82577%0.772SS**  trans-129.2116.3170.2-1790000109.9R45R45-S47 VanDerWaalsContact C-N 3.34Å; R45-S47 PolarHBondContact O-N 3.46Å
48G54.6Low64Low66 Ų66135.9 Ų135.968%0.6876%0.762SS**SBendtrans109.5114.2175.100000113.6H50G48-H50 PolarHBondContact O-N 2.96Å
49G52.7Low66.1Low93 Ų93134.4 Ų134.496%0.95976%0.76SS**SBendtrans-67.750.8-175.900000116
50H60Low68.2Low138 Ų138128.9 Ų128.964%0.63975%0.746SS**SBendtrans-137.5122.3171.7-140.987.7000107.2G48 R53G48-H50 PolarHBondContact O-N 2.96Å; H50-R53 VanDerWaalsContact CD2-CZ 3.44Å; H50-R53 PolarHBondContact CD2-NE 3.47Å; H50-R53 PolarHBondContact CD2-NH2 3.34Å; H50-R53 PolarHBondContact NE2-NH2 2.98Å
51G66Low70.2Confident61 Ų61131 Ų13163%0.62974%0.737SS**  trans-46.1152.3-162.100000115.5R53G51-R53 VanDerWaalsContact O-CG 3.28Å; G51-R53 WeakPolarHBondContact O-CG 3.28Å; G51-R53 PolarHBondContact O-N 2.97Å
52K70.8Confident72.2Confident208 Ų208130.6 Ų130.690%0.90473%0.725SS**  trans-34.480.1-175.954.5175-176.6-174.10115.8
53R74.4Confident74Confident196 Ų196133.8 Ų133.874%0.7472%0.722SS**  trans-80123.8175.9-64-172.6-174.7173-1.8108.7H50 G51H50-R53 VanDerWaalsContact CD2-CZ 3.44Å; H50-R53 PolarHBondContact CD2-NE 3.47Å; H50-R53 PolarHBondContact CD2-NH2 3.34Å; H50-R53 PolarHBondContact NE2-NH2 2.98Å; G51-R53 VanDerWaalsContact O-CG 3.28Å; G51-R53 WeakPolarHBondContact O-CG 3.28Å; G51-R53 PolarHBondContact O-N 2.97Å
54L82.3Confident75.9Confident154 Ų154133.5 Ų133.581%0.80671%0.714SS**  trans-84.9139.9175.3-61.9174.8000109.9V56L54-V56 PolarHBondContact O-N 3.09Å
55F85.5Confident77.8Confident186 Ų186130.8 Ų130.882%0.81670%0.701SS**  trans-70114.3170.3-178.4-101.9000109.2V57F55-V57 HydrophobicContact CD1-CG2 4.03Å; F55-V57 HydrophobicContact CE1-CG2 3.94Å
56V86.9Confident79.6Confident93 Ų93125.5 Ų125.556%0.56468%0.68SS**  trans-91.7109.8178.7-170.50000108.7L54 K58L54-V56 PolarHBondContact O-N 3.09Å; V56-K58 HydrophobicContact CB-CG 4.46Å; V56-K58 HydrophobicContact CG1-CD 4.3Å; V56-K58 HydrophobicContact CG1-CG 3.86Å; V56-K58 PolarHBondContact O-N 2.91Å; V56-K58 VanDerWaalsContact O-N 3.13Å
57V87Confident81.8Confident129 Ų129123.2 Ų123.278%0.78267%0.668SS**  trans-66.6111.3172.9-175.40000108.2F55F55-V57 HydrophobicContact CD1-CG2 4.03Å; F55-V57 HydrophobicContact CE1-CG2 3.94Å
58K89.4Confident83.9Confident151 Ų151121.4 Ų121.466%0.65765%0.649SS**  trans-124.2148.9176.5-65.4-178.6-179.4172.50108.9V56V56-K58 HydrophobicContact CB-CG 4.46Å; V56-K58 HydrophobicContact CG1-CD 4.3Å; V56-K58 HydrophobicContact CG1-CG 3.86Å; V56-K58 PolarHBondContact O-N 2.91Å; V56-K58 VanDerWaalsContact O-N 3.13Å
59A90.9Very high85.9Confident92 Ų92125.6 Ų125.676%0.7665%0.648SS**  trans-59.7154.4168.800000111K61A59-K61 PolarHBondContact O-N 3.36Å; A59-K61 VanDerWaalsContact O-N 3.16Å
60S92.6Very high88.1Confident81 Ų81125 Ų12557%0.56662%0.623SS**  trans-66113.8-179.6-177.50000110.9F62S60-F62 VanDerWaalsContact C-N 3.28Å
61K93.1Very high89.9Confident143 Ų143122.3 Ų122.362%0.62261%0.613SS**  trans-85.80.4173.6-64.2-169.5173.9-165.80113.5A59 S65A59-K61 PolarHBondContact O-N 3.36Å; A59-K61 VanDerWaalsContact O-N 3.16Å; K61-S65 VanDerWaalsContact O-CB 3.3Å; K61-S65 WeakPolarHBondContact O-CB 3.15Å; K61-S65 PolarHBondContact O-N 2.92Å; K61-S65 VanDerWaalsContact O-N 3.1Å; K61-S65 PolarHBondContact O-OG 3.1Å
62F94.8Very high91.4Very high123 Ų123127.9 Ų127.954%0.53962%0.615SS.*Hα-helixtrans-65.3-48.4-172176.1-100.8000111.5S60 S65 R66S60-F62 VanDerWaalsContact C-N 3.28Å; F62-S65 PolarHBondContact O-N 2.79Å; F62-R66 WeakPolarHBondContact O-CB 3.46Å; F62-R66 PolarHBondContact O-N 3.31Å
63Y96.2Very high92.7Very high139 Ų139123.6 Ų123.655%0.54560%0.597SS.*Hα-helixtrans-67-43.3-176.9-68.4-77.3000112.4S65 R66 F67Y63-S65 PolarHBondContact O-N 3.12Å; Y63-R66 PolarHBondContact O-N 2.94Å; Y63-F67 WeakPolarHBondContact O-CB 3.47Å; Y63-F67 PolarHBondContact O-N 3.49Å
64D95.4Very high93.8Very high108 Ų108121.2 Ų121.258%0.57859%0.589SS**Hα-helixtrans-61-46.7176.4-56.1-20.2000111.2R66 F67 L68D64-R66 VanDerWaalsContact C-N 3.33Å; D64-R66 PolarHBondContact O-N 3.09Å; D64-F67 PolarHBondContact O-N 3.34Å; D64-L68 WeakPolarHBondContact O-CG 3.44Å; D64-L68 PolarHBondContact O-N 3.31Å
65S96.1Very high94.5Very high56 Ų56119 Ų11939%0.39258%0.576SS.*Hα-helixtrans-65.6-39.1178.8-56.80000111.5K61 F62 Y63 K69K61-S65 VanDerWaalsContact O-CB 3.3Å; K61-S65 WeakPolarHBondContact O-CB 3.15Å; K61-S65 PolarHBondContact O-N 2.92Å; K61-S65 VanDerWaalsContact O-N 3.1Å; K61-S65 PolarHBondContact O-OG 3.1Å; F62-S65 PolarHBondContact O-N 2.79Å; Y63-S65 PolarHBondContact O-N 3.12Å; S65-K69 WeakPolarHBondContact O-CB 3.35Å; S65-K69 WeakPolarHBondContact O-CG 3.32Å; S65-K69 PolarHBondContact O-N 3.14Å
66R97.4Very high95.1Very high119 Ų119111.9 Ų111.945%0.44955%0.552SS.*Hα-helixtrans-66-44.6176.9-174.7-179.471.5171.16.6111F62 Y63 D64 K69 L70F62-R66 WeakPolarHBondContact O-CB 3.46Å; F62-R66 PolarHBondContact O-N 3.31Å; Y63-R66 PolarHBondContact O-N 2.94Å; D64-R66 VanDerWaalsContact C-N 3.33Å; D64-R66 PolarHBondContact O-N 3.09Å; R66-K69 PolarHBondContact O-N 2.99Å; R66-L70 HydrophobicContact CG-CD1 4.17Å; R66-L70 WeakPolarHBondContact O-CG 3.27Å; R66-L70 PolarHBondContact O-N 3.17Å
67F97.6Very high95.6Very high133 Ų133112.2 Ų112.258%0.58355%0.55SS*.Hα-helixtrans-59.5-48.8176.8174.3-103.6000111.2Y63 D64 K69 L70 L71Y63-F67 WeakPolarHBondContact O-CB 3.47Å; Y63-F67 PolarHBondContact O-N 3.49Å; D64-F67 PolarHBondContact O-N 3.34Å; F67-K69 VanDerWaalsContact C-N 3.31Å; F67-K69 PolarHBondContact O-N 2.9Å; F67-L70 PolarHBondContact O-N 3.47Å; F67-L71 HydrophobicContact CE1-CD2 4.42Å; F67-L71 WeakPolarHBondContact O-CB 3.44Å; F67-L71 PolarHBondContact O-N 3.31Å
68L97.8Very high96.1Very high81 Ų81110.5 Ų110.542%0.42454%0.54SS..Hα-helixtrans-63.8-36178-68.7175.1000112.8D64 R72D64-L68 WeakPolarHBondContact O-CG 3.44Å; D64-L68 PolarHBondContact O-N 3.31Å; L68-R72 WeakPolarHBondContact O-CB 3.41Å; L68-R72 VanDerWaalsContact O-CG 3.24Å; L68-R72 WeakPolarHBondContact O-CG 3.33Å; L68-R72 PolarHBondContact O-N 2.76Å
69K97.8Very high96.5Very high153 Ų153104.6 Ų104.667%0.66552%0.522SS*.Hα-helixtrans-64.6-45.7173.8-76.1172.9-177.9-174.20111.6S65 R66 F67 F73S65-K69 WeakPolarHBondContact O-CB 3.35Å; S65-K69 WeakPolarHBondContact O-CG 3.32Å; S65-K69 PolarHBondContact O-N 3.14Å; R66-K69 PolarHBondContact O-N 2.99Å; F67-K69 VanDerWaalsContact C-N 3.31Å; F67-K69 PolarHBondContact O-N 2.9Å; K69-F73 VanDerWaalsContact O-CB 3.31Å; K69-F73 WeakPolarHBondContact O-CB 3.31Å; K69-F73 PolarHBondContact O-N 3.47Å
70L98.1Very high96.8Very high82 Ų82105.1 Ų105.143%0.42951%0.511SS..Hα-helixtrans-64.9-44.7177.4-71.5172.8000111.5R66 F67 R72 F73 Y74R66-L70 HydrophobicContact CG-CD1 4.17Å; R66-L70 WeakPolarHBondContact O-CG 3.27Å; R66-L70 PolarHBondContact O-N 3.17Å; F67-L70 PolarHBondContact O-N 3.47Å; L70-R72 PolarHBondContact O-N 3.12Å; L70-F73 WeakPolarHBondContact O-CB 3.47Å; L70-F73 PolarHBondContact O-N 2.98Å; L70-F73 VanDerWaalsContact O-N 3.15Å; L70-Y74 HydrophobicContact CD2-CE2 4.46Å; L70-Y74 WeakPolarHBondContact O-CD2 3.33Å; L70-Y74 PolarHBondContact O-N 2.9Å
71L97.6Very high97.1Very high80 Ų80104.2 Ų104.242%0.41950%0.503SS..Hα-helixtrans-56.8-50.2176.8-179.967.2000111.3F67 F73 Y74 I75F67-L71 HydrophobicContact CE1-CD2 4.42Å; F67-L71 WeakPolarHBondContact O-CB 3.44Å; F67-L71 PolarHBondContact O-N 3.31Å; L71-F73 VanDerWaalsContact C-N 3.3Å; L71-F73 PolarHBondContact O-N 3.13Å; L71-Y74 PolarHBondContact O-N 3.26Å; L71-I75 HydrophobicContact CD1-CD1 4.02Å; L71-I75 HydrophobicContact CG-CD1 3.97Å; L71-I75 VanDerWaalsContact O-CG1 3.31Å; L71-I75 WeakPolarHBondContact O-CG1 3.43Å; L71-I75 PolarHBondContact O-N 3.37Å
72R97.9Very high97.3Very high178 Ų178101 Ų10167%0.67250%0.495SS*.Hα-helixtrans-62.1-39176.8-71.8171.9-175.6179.41111.9L68 L70 A76L68-R72 WeakPolarHBondContact O-CB 3.41Å; L68-R72 VanDerWaalsContact O-CG 3.24Å; L68-R72 WeakPolarHBondContact O-CG 3.33Å; L68-R72 PolarHBondContact O-N 2.76Å; L70-R72 PolarHBondContact O-N 3.12Å; R72-A76 WeakPolarHBondContact O-CB 3.42Å; R72-A76 PolarHBondContact O-N 3.41Å
73F97.9Very high97.4Very high119 Ų11999.3 Ų99.352%0.52250%0.495SS..Hα-helixtrans-61.1-49.9177.5175.7-99.9000111.6K69 L70 L71 I75 A76 L77K69-F73 VanDerWaalsContact O-CB 3.31Å; K69-F73 WeakPolarHBondContact O-CB 3.31Å; K69-F73 PolarHBondContact O-N 3.47Å; L70-F73 WeakPolarHBondContact O-CB 3.47Å; L70-F73 PolarHBondContact O-N 2.98Å; L70-F73 VanDerWaalsContact O-N 3.15Å; L71-F73 VanDerWaalsContact C-N 3.3Å; L71-F73 PolarHBondContact O-N 3.13Å; F73-I75 PolarHBondContact O-N 3.24Å; F73-A76 PolarHBondContact O-N 2.91Å; F73-L77 WeakPolarHBondContact O-CB 3.31Å; F73-L77 PolarHBondContact O-N 3.38Å
74Y97.5Very high97.5Very high146 Ų14696.7 Ų96.757%0.57349%0.49SS*.Hα-helixtrans-68.9-33.8-179.5-75.4-70.2000113.4L70 L71 L77L70-Y74 HydrophobicContact CD2-CE2 4.46Å; L70-Y74 WeakPolarHBondContact O-CD2 3.33Å; L70-Y74 PolarHBondContact O-N 2.9Å; L71-Y74 PolarHBondContact O-N 3.26Å; Y74-L77 HydrophobicContact CD1-CD2 4.32Å
75I97.8Very high97.5Very high107 Ų10796.3 Ų96.355%0.54949%0.487SS..Hα-helixtrans-66.7-44.9172.2-67169000110.5L71 F73 L77 G79L71-I75 HydrophobicContact CD1-CD1 4.02Å; L71-I75 HydrophobicContact CG-CD1 3.97Å; L71-I75 VanDerWaalsContact O-CG1 3.31Å; L71-I75 WeakPolarHBondContact O-CG1 3.43Å; L71-I75 PolarHBondContact O-N 3.37Å; F73-I75 PolarHBondContact O-N 3.24Å; I75-L77 VanDerWaalsContact C-N 3.32Å; I75-L77 PolarHBondContact O-N 3.25Å; I75-G79 WeakPolarHBondContact O-CA 3.44Å; I75-G79 PolarHBondContact O-N 3.48Å
76A97.4Very high97.5Very high37 Ų3796.7 Ų96.731%0.30648%0.484SS..Hα-helixtrans-68.2-31.718000000112.6R72 F73 T78 G79 I80R72-A76 WeakPolarHBondContact O-CB 3.42Å; R72-A76 PolarHBondContact O-N 3.41Å; F73-A76 PolarHBondContact O-N 2.91Å; A76-T78 VanDerWaalsContact C-N 3.32Å; A76-T78 PolarHBondContact O-N 3.35Å; A76-G79 PolarHBondContact O-N 3.37Å; A76-I80 HydrophobicContact CB-CD1 3.97Å; A76-I80 HydrophobicContact CB-CG1 4.36Å; A76-I80 WeakPolarHBondContact O-CB 3.27Å; A76-I80 WeakPolarHBondContact O-CG1 3.16Å; A76-I80 PolarHBondContact O-N 3.05Å
77L97.3Very high97.4Very high99 Ų9994.4 Ų94.452%0.51848%0.483SS..Hα-helixtrans-57.2-42.9-178.8-177.665000112.4F73 Y74 I75 P81F73-L77 WeakPolarHBondContact O-CB 3.31Å; F73-L77 PolarHBondContact O-N 3.38Å; Y74-L77 HydrophobicContact CD1-CD2 4.32Å; I75-L77 VanDerWaalsContact C-N 3.32Å; I75-L77 PolarHBondContact O-N 3.25Å; L77-P81 VanDerWaalsContact O-CD 3.22Å; L77-P81 WeakPolarHBondContact O-CD 3.31Å; L77-P81 WeakPolarHBondContact O-CG 3.44Å
78T97Very high97.4Very high94 Ų9492 Ų9258%0.57748%0.476SS*.Hα-helixtrans-97.9-32.3175.6550000112.4A76 P81 V82A76-T78 VanDerWaalsContact C-N 3.32Å; A76-T78 PolarHBondContact O-N 3.35Å; T78-P81 WeakPolarHBondContact O-CD 3.34Å; T78-V82 WeakPolarHBondContact O-CB 3.41Å; T78-V82 VanDerWaalsContact O-CG2 3.22Å; T78-V82 WeakPolarHBondContact O-CG2 3.24Å; T78-V82 PolarHBondContact O-N 2.9Å; T78-V82 VanDerWaalsContact O-N 3.09Å
79G98.1Very high97.4Very high27 Ų2789.4 Ų89.428%0.27846%0.463SS..Hα-helixtrans-63.3-43-178.700000113.5I75 A76 V82 V83I75-G79 WeakPolarHBondContact O-CA 3.44Å; I75-G79 PolarHBondContact O-N 3.48Å; A76-G79 PolarHBondContact O-N 3.37Å; G79-V82 PolarHBondContact O-N 3.27Å; G79-V83 VanDerWaalsContact O-CG2 3.31Å; G79-V83 WeakPolarHBondContact O-CG2 3.23Å; G79-V83 PolarHBondContact O-N 3.46Å
80I97.7Very high97.2Very high102 Ų10285.4 Ų85.452%0.52345%0.449SS..Hα-helixtrans-63.7-51.6179.9-65.3168.6000110.9A76 V82 V83 I84A76-I80 HydrophobicContact CB-CD1 3.97Å; A76-I80 HydrophobicContact CB-CG1 4.36Å; A76-I80 WeakPolarHBondContact O-CB 3.27Å; A76-I80 WeakPolarHBondContact O-CG1 3.16Å; A76-I80 PolarHBondContact O-N 3.05Å; I80-V82 VanDerWaalsContact C-N 3.32Å; I80-V82 PolarHBondContact O-N 3.16Å; I80-V83 PolarHBondContact O-N 2.94Å; I80-I84 HydrophobicContact CG2-CD1 3.76Å; I80-I84 HydrophobicContact CG2-CG1 4.45Å; I80-I84 VanDerWaalsContact O-CG1 3.31Å; I80-I84 WeakPolarHBondContact O-CG1 3.36Å; I80-I84 PolarHBondContact O-N 3.16Å
81P97.9Very high97.1Very high62 Ų6287 Ų8740%0.40346%0.461SS..Hα-helixtrans-56.3-42.5173.9-27.134.1000113.7L77 T78 I84 I85L77-P81 VanDerWaalsContact O-CD 3.22Å; L77-P81 WeakPolarHBondContact O-CD 3.31Å; L77-P81 WeakPolarHBondContact O-CG 3.44Å; T78-P81 WeakPolarHBondContact O-CD 3.34Å; P81-I84 PolarHBondContact O-N 2.77Å; P81-I85 VanDerWaalsContact O-CG1 3.28Å; P81-I85 WeakPolarHBondContact O-CG1 3.38Å; P81-I85 PolarHBondContact O-N 3.22Å
82V97.5Very high97Very high76 Ų7691 Ų9146%0.46148%0.476SS..Hα-helixtrans-63-45.4179.2168.60000111.4T78 G79 I80 I84 I85 I86T78-V82 WeakPolarHBondContact O-CB 3.41Å; T78-V82 VanDerWaalsContact O-CG2 3.22Å; T78-V82 WeakPolarHBondContact O-CG2 3.24Å; T78-V82 PolarHBondContact O-N 2.9Å; T78-V82 VanDerWaalsContact O-N 3.09Å; G79-V82 PolarHBondContact O-N 3.27Å; I80-V82 VanDerWaalsContact C-N 3.32Å; I80-V82 PolarHBondContact O-N 3.16Å; V82-I84 VanDerWaalsContact C-N 3.33Å; V82-I84 PolarHBondContact O-N 3.1Å; V82-I85 PolarHBondContact O-N 3.12Å; V82-I86 HydrophobicContact CG1-CD1 3.7Å; V82-I86 HydrophobicContact CG1-CG1 4.44Å; V82-I86 VanDerWaalsContact O-CG1 3.27Å; V82-I86 WeakPolarHBondContact O-CG1 3.21Å; V82-I86 PolarHBondContact O-N 2.98Å
83V97.8Very high96.9Very high87 Ų8788.2 Ų88.253%0.52747%0.473SS..Hα-helixtrans-61.9-43.1176.71710000110.7G79 I80 I85 I86 T87G79-V83 VanDerWaalsContact O-CG2 3.31Å; G79-V83 WeakPolarHBondContact O-CG2 3.23Å; G79-V83 PolarHBondContact O-N 3.46Å; I80-V83 PolarHBondContact O-N 2.94Å; V83-I85 VanDerWaalsContact C-N 3.35Å; V83-I85 PolarHBondContact O-N 2.91Å; V83-I86 PolarHBondContact O-N 3.01Å; V83-T87 HydrophobicContact CG1-CG2 4.33Å; V83-T87 WeakPolarHBondContact O-CG2 3.24Å; V83-T87 PolarHBondContact O-N 2.93Å; V83-T87 PolarHBondContact O-OG1 3.13Å
84I97.4Very high96.6Very high85 Ų8583.6 Ų83.644%0.43646%0.459SS..Hα-helixtrans-60.4-44.5176.2-68.2167.3000110.7I80 P81 V82 I86 T87 L88I80-I84 HydrophobicContact CG2-CD1 3.76Å; I80-I84 HydrophobicContact CG2-CG1 4.45Å; I80-I84 VanDerWaalsContact O-CG1 3.31Å; I80-I84 WeakPolarHBondContact O-CG1 3.36Å; I80-I84 PolarHBondContact O-N 3.16Å; P81-I84 PolarHBondContact O-N 2.77Å; V82-I84 VanDerWaalsContact C-N 3.33Å; V82-I84 PolarHBondContact O-N 3.1Å; I84-I86 PolarHBondContact O-N 3.48Å; I84-T87 WeakPolarHBondContact CA-OG1 3.3Å; I84-T87 PolarHBondContact O-N 3.43Å; I84-T87 PolarHBondContact O-OG1 3.46Å; I84-L88 HydrophobicContact CG2-CD1 3.74Å; I84-L88 HydrophobicContact CG2-CG 4.18Å; I84-L88 WeakPolarHBondContact O-CB 3.42Å; I84-L88 WeakPolarHBondContact O-CG 3.31Å; I84-L88 PolarHBondContact O-N 3.04Å
85I96.3Very high96.3Very high100 Ų10082 Ų8251%0.51346%0.457SS..Hα-helixtrans-62.7-45.2178.4-69.5164.2000110.6P81 V82 V83 T87 L88 V89P81-I85 VanDerWaalsContact O-CG1 3.28Å; P81-I85 WeakPolarHBondContact O-CG1 3.38Å; P81-I85 PolarHBondContact O-N 3.22Å; V82-I85 PolarHBondContact O-N 3.12Å; V83-I85 VanDerWaalsContact C-N 3.35Å; V83-I85 PolarHBondContact O-N 2.91Å; I85-T87 PolarHBondContact O-N 3.37Å; I85-L88 PolarHBondContact O-N 3.44Å; I85-V89 HydrophobicContact CG2-CG2 4.35Å; I85-V89 WeakPolarHBondContact O-CB 3.32Å; I85-V89 VanDerWaalsContact O-CG2 3.24Å; I85-V89 WeakPolarHBondContact O-CG2 3.39Å; I85-V89 PolarHBondContact O-N 2.93Å
86I95.8Very high96.1Very high64 Ų6478.2 Ų78.233%0.32844%0.442SS..Hα-helixtrans-62.1-44.2178.6-66.6164.8000110.7V82 V83 I84 V89 N90 I117V82-I86 HydrophobicContact CG1-CD1 3.7Å; V82-I86 HydrophobicContact CG1-CG1 4.44Å; V82-I86 VanDerWaalsContact O-CG1 3.27Å; V82-I86 WeakPolarHBondContact O-CG1 3.21Å; V82-I86 PolarHBondContact O-N 2.98Å; V83-I86 PolarHBondContact O-N 3.01Å; I84-I86 PolarHBondContact O-N 3.48Å; I86-V89 PolarHBondContact O-N 3.29Å; I86-N90 WeakPolarHBondContact O-CB 3.22Å; I86-N90 VanDerWaalsContact O-CG 3.26Å; I86-N90 PolarHBondContact O-N 2.88Å; I86-I117 HydrophobicContact CG1-CD1 3.9Å
87T96.3Very high95.8Very high71 Ų7185.1 Ų85.144%0.43647%0.468SS..Hα-helixtrans-66.1-41.3178.456.10000111.9V83 I84 I85 N90 V91V83-T87 HydrophobicContact CG1-CG2 4.33Å; V83-T87 WeakPolarHBondContact O-CG2 3.24Å; V83-T87 PolarHBondContact O-N 2.93Å; V83-T87 PolarHBondContact O-OG1 3.13Å; I84-T87 WeakPolarHBondContact CA-OG1 3.3Å; I84-T87 PolarHBondContact O-N 3.43Å; I84-T87 PolarHBondContact O-OG1 3.46Å; I85-T87 PolarHBondContact O-N 3.37Å; T87-N90 PolarHBondContact O-N 2.84Å; T87-V91 WeakPolarHBondContact O-CB 3.41Å; T87-V91 VanDerWaalsContact O-CG2 3.27Å; T87-V91 WeakPolarHBondContact O-CG2 3.38Å; T87-V91 PolarHBondContact O-N 3.43Å
88L96.9Very high95.6Very high83 Ų8389 Ų8944%0.43549%0.488SS..Hα-helixtrans-61.9-44.5175.4-70173000111.6I84 I85 N90 V91 F92I84-L88 HydrophobicContact CG2-CD1 3.74Å; I84-L88 HydrophobicContact CG2-CG 4.18Å; I84-L88 WeakPolarHBondContact O-CB 3.42Å; I84-L88 WeakPolarHBondContact O-CG 3.31Å; I84-L88 PolarHBondContact O-N 3.04Å; I85-L88 PolarHBondContact O-N 3.44Å; L88-N90 VanDerWaalsContact C-N 3.34Å; L88-N90 PolarHBondContact O-N 3.48Å; L88-V91 PolarHBondContact O-N 3.15Å; L88-F92 HydrophobicContact CB-CD2 4.35Å; L88-F92 HydrophobicContact CD2-CD2 4Å; L88-F92 HydrophobicContact CD2-CE2 3.56Å; L88-F92 WeakPolarHBondContact O-CB 3.46Å; L88-F92 WeakPolarHBondContact O-CD2 3.31Å; L88-F92 PolarHBondContact O-N 3.05Å
89V96.6Very high95.4Very high25 Ų2588.4 Ų88.415%0.15249%0.492CS..Hα-helixtrans-60.8-44.7176.7168.40000110.8I85 I86 V91 I93 G94 P116 I117I85-V89 HydrophobicContact CG2-CG2 4.35Å; I85-V89 WeakPolarHBondContact O-CB 3.32Å; I85-V89 VanDerWaalsContact O-CG2 3.24Å; I85-V89 WeakPolarHBondContact O-CG2 3.39Å; I85-V89 PolarHBondContact O-N 2.93Å; I86-V89 PolarHBondContact O-N 3.29Å; V89-V91 PolarHBondContact O-N 3.4Å; V89-I93 HydrophobicContact CG1-CD1 4.21Å; V89-I93 HydrophobicContact CG2-CD1 4.33Å; V89-I93 WeakPolarHBondContact O-CA 3.16Å; V89-I93 VanDerWaalsContact O-CB 3.31Å; V89-I93 WeakPolarHBondContact O-CB 3.33Å; V89-I93 PolarHBondContact O-N 3.38Å; V89-G94 PolarHBondContact O-N 3.28Å; V89-G94 VanDerWaalsContact O-N 3.09Å; V89-P116 HydrophobicContact CG1-CB 4.06Å; V89-P116 HydrophobicContact CG1-CG 3.36Å; V89-I117 HydrophobicContact CG1-CG1 4.12Å
90N95.3Very high95.2Very high69 Ų6996.1 Ų96.137%0.36952%0.521SS..Hα-helixtrans-69.7-31.5-178.9-71-7.7000113.3I86 T87 L88 G94 H115I86-N90 WeakPolarHBondContact O-CB 3.22Å; I86-N90 VanDerWaalsContact O-CG 3.26Å; I86-N90 PolarHBondContact O-N 2.88Å; T87-N90 PolarHBondContact O-N 2.84Å; L88-N90 VanDerWaalsContact C-N 3.34Å; L88-N90 PolarHBondContact O-N 3.48Å; N90-G94 WeakPolarHBondContact O-CA 3.46Å; N90-H115 PolarHBondContact OD1-NE2 3.02Å; N90-H115 VanDerWaalsContact OD1-NE2 3.12Å
91V95.8Very high95.1Very high115 Ų11595.8 Ų95.870%0.69752%0.519SS*.Hα-helixtrans-82.3-43.6-179.9171.70000112T87 L88 V89T87-V91 WeakPolarHBondContact O-CB 3.41Å; T87-V91 VanDerWaalsContact O-CG2 3.27Å; T87-V91 WeakPolarHBondContact O-CG2 3.38Å; T87-V91 PolarHBondContact O-N 3.43Å; L88-V91 PolarHBondContact O-N 3.15Å; V89-V91 PolarHBondContact O-N 3.4Å
92F95.9Very high95Very high165 Ų16596.6 Ų96.672%0.72453%0.525SS*.Hα-helixtrans-91.4-35.8-173.1-71.1-71.5000114L88L88-F92 HydrophobicContact CB-CD2 4.35Å; L88-F92 HydrophobicContact CD2-CD2 4Å; L88-F92 HydrophobicContact CD2-CE2 3.56Å; L88-F92 WeakPolarHBondContact O-CB 3.46Å; L88-F92 WeakPolarHBondContact O-CD2 3.31Å; L88-F92 PolarHBondContact O-N 3.05Å
93I94.1Very high94.8Very high120 Ų120102.4 Ų102.462%0.61555%0.547SS*.THydrogen-bonded Turntrans-97.6-44.2-178.6-59166.4000110.1V89 P116V89-I93 HydrophobicContact CG1-CD1 4.21Å; V89-I93 HydrophobicContact CG2-CD1 4.33Å; V89-I93 WeakPolarHBondContact O-CA 3.16Å; V89-I93 VanDerWaalsContact O-CB 3.31Å; V89-I93 WeakPolarHBondContact O-CB 3.33Å; V89-I93 PolarHBondContact O-N 3.38Å; I93-P116 HydrophobicContact CG2-CB 4.01Å; I93-P116 HydrophobicContact CG2-CG 4.25Å
94G91.6Very high94.6Very high22 Ų22102.3 Ų102.323%0.22756%0.564CS.*  trans75.8177.8-179.100000114V89 N90 P116V89-G94 PolarHBondContact O-N 3.28Å; V89-G94 VanDerWaalsContact O-N 3.09Å; N90-G94 WeakPolarHBondContact O-CA 3.46Å; G94-P116 WeakPolarHBondContact O-CD 3.42Å
95E92.4Very high94.5Very high112 Ų112103.5 Ų103.552%0.52356%0.563SS.*PPolyproline II helixtrans-83.6145.4173.7-65.2-169.9166.900110.7K114E95-K114 HydrophobicContact CB-CG 4.45Å; E95-K114 WeakPolarHBondContact OE2-CE 3.38Å; E95-K114 IonicContact OE2-NZ 2.65Å; E95-K114 PolarHBondContact OE2-NZ 2.89Å
96A92.4Very high94.5Very high28 Ų28105.6 Ų105.623%0.23157%0.574CS.*PPolyproline II helixtrans-72.8147.1173.500000111.2K114 R119A96-K114 WeakPolarHBondContact CB-O 3.41Å; A96-K114 PolarHBondContact N-O 2.99Å; A96-K114 VanDerWaalsContact N-O 3.09Å; A96-K114 WeakPolarHBondContact O-CG 3.33Å; A96-R119 VanDerWaalsContact CB-NH2 3.31Å
97E90.9Very high94.5Very high182 Ų182103.4 Ų103.485%0.8556%0.564SS**PPolyproline II helixtrans-88.1145.4170.2-64.5-173.816600110.2A99E97-A99 PolarHBondContact O-N 3.37Å
98L93.6Very high94.5Very high181 Ų181105.2 Ų105.295%0.94857%0.567SS**PPolyproline II helixtrans-74119.8174.8-179.665.3000108.2
99A93.5Very high94.5Very high80 Ų80102.7 Ų102.766%0.66155%0.554SS**  trans-115.6151.7173.700000109.7E97E97-A99 PolarHBondContact O-N 3.37Å
100E93.4Very high94.5Very high189 Ų189104.1 Ų104.188%0.88356%0.556SS**PPolyproline II helixtrans-66146.7169-65.5-180179.500109.8P102E100-P102 WeakPolarHBondContact O-CD 3.31Å
101I95.6Very high94.5Very high95 Ų95103.2 Ų103.249%0.48755%0.55SS..PPolyproline II helixtrans-72.4121.8179.1-59.7173000107.5Y105 P107 Y112I101-Y105 VanDerWaalsContact CG2-O 3.23Å; I101-Y105 WeakPolarHBondContact CG2-O 3.28Å; I101-P107 HydrophobicContact CD1-CG 4.01Å; I101-P107 HydrophobicContact CG1-CG 3.96Å; I101-P107 HydrophobicContact CG2-CG 3.88Å; I101-Y112 HydrophobicContact CD1-CE1 4.3Å
102P95.3Very high94.5Very high80 Ų80104 Ų10452%0.51954%0.541SS..PPolyproline II helixtrans-67.8147.4179.521.3-23.4000111E100 G104 Y105E100-P102 WeakPolarHBondContact O-CD 3.31Å; P102-G104 PolarHBondContact O-N 3.49Å; P102-Y105 HydrophobicContact CG-CD1 4.05Å; P102-Y105 HydrophobicContact CG-CG 4.17Å; P102-Y105 PolarHBondContact O-N 2.83Å
103E93.2Very high94.5Very high198 Ų198101.1 Ų101.193%0.92553%0.526SS*.THydrogen-bonded Turntrans-57.2125.7-178.5-70-69.6179.600111.5Y105E103-Y105 VanDerWaalsContact C-N 3.3Å; E103-Y105 PolarHBondContact O-N 2.93Å
104G94.3Very high94.6Very high85 Ų85101.4 Ų101.488%0.87652%0.523SS*.THydrogen-bonded Turntrans80.40.1-179.600000115.7P102P102-G104 PolarHBondContact O-N 3.49Å
105Y96.2Very high94.8Very high109 Ų109102.3 Ų102.343%0.42752%0.521SS..  trans-96.1131171.3-176.6-114.2000110.9I101 P102 E103 P107 E111I101-Y105 VanDerWaalsContact CG2-O 3.23Å; I101-Y105 WeakPolarHBondContact CG2-O 3.28Å; P102-Y105 HydrophobicContact CG-CD1 4.05Å; P102-Y105 HydrophobicContact CG-CG 4.17Å; P102-Y105 PolarHBondContact O-N 2.83Å; E103-Y105 VanDerWaalsContact C-N 3.3Å; E103-Y105 PolarHBondContact O-N 2.93Å; Y105-P107 HydrophobicContact CD1-CG 4.07Å; Y105-P107 HydrophobicContact CE1-CB 4.14Å; Y105-P107 HydrophobicContact CE1-CG 4.08Å; Y105-E111 PolarHBondContact OH-OE1 3.46Å; Y105-E111 VanDerWaalsContact OH-OE1 3.06Å; Y105-E111 PolarHBondContact OH-OE2 2.87Å
106I95.3Very high95Very high145 Ų14598.2 Ų98.274%0.74450%0.504SS*.  trans-106.8108.8173.3-59.8173.6000106.9
107P96.1Very high95.1Very high18 Ų1899.3 Ų99.312%0.11751%0.506CS..  trans-64.8144.3178.3-19.130.5000111.4I101 Y105 E111 Y112I101-P107 HydrophobicContact CD1-CG 4.01Å; I101-P107 HydrophobicContact CG1-CG 3.96Å; I101-P107 HydrophobicContact CG2-CG 3.88Å; Y105-P107 HydrophobicContact CD1-CG 4.07Å; Y105-P107 HydrophobicContact CE1-CB 4.14Å; Y105-P107 HydrophobicContact CE1-CG 4.08Å; P107-E111 WeakPolarHBondContact CA-OE2 3.42Å; P107-E111 HydrophobicContact CB-CB 4.23Å; P107-E111 WeakPolarHBondContact CB-OE2 3.37Å; P107-Y112 HydrophobicContact CB-CE1 4.28Å; P107-Y112 HydrophobicContact CB-CE2 4.06Å; P107-Y112 HydrophobicContact CG-CE1 4.32Å
108E95.6Very high95.4Very high108 Ų10893.2 Ų93.251%0.50548%0.483SS..  trans-69.1154.5171.1-69.1-68.8163.700110.9W110 E111 Y112E108-W110 HydrophobicContact CB-CG 4.49Å; E108-W110 PolarHBondContact O-N 3.09Å; E108-E111 HydrophobicContact CB-CG 4.18Å; E108-E111 PolarHBondContact N-OE2 3.28Å; E108-E111 WeakPolarHBondContact O-CB 3.48Å; E108-E111 PolarHBondContact O-N 3.36Å; E108-Y112 WeakPolarHBondContact O-CD2 3.39Å; E108-Y112 WeakPolarHBondContact O-CE2 3.48Å
109H96.6Very high95.5Very high31 Ų3187.7 Ų87.714%0.14445%0.45CS..THydrogen-bonded Turntrans-58.5-25.3-173.769.3-75.9000114.6Y113 A122 F126H109-Y113 WeakPolarHBondContact O-CE2 3.41Å; H109-A122 PolarHBondContact NE2-O 2.89Å; H109-F126 PolarHBondContact NE2-O 2.95Å
110W96.9Very high95.7Very high55 Ų5590 Ų9021%0.20844%0.441CS..THydrogen-bonded Turntrans-83.9-20178.755.4-88.3000113.3E108 Y112 Y113 R119 A122 R123E108-W110 HydrophobicContact CB-CG 4.49Å; E108-W110 PolarHBondContact O-N 3.09Å; W110-Y112 VanDerWaalsContact C-N 3.25Å; W110-Y112 PolarHBondContact O-N 3.09Å; W110-Y113 WeakPolarHBondContact O-CD2 3.36Å; W110-Y113 PolarHBondContact O-N 2.87Å; W110-R119 HydrophobicContact CB-CG 4.42Å; W110-R119 HydrophobicContact CD2-CG 4.27Å; W110-R119 HydrophobicContact CE3-CG 3.28Å; W110-R119 HydrophobicContact CZ3-CG 3.89Å; W110-R119 WeakPolarHBondContact O-CG 3.4Å; W110-A122 HydrophobicContact CB-CB 3.92Å; W110-R123 HydrophobicContact CB-CB 3.96Å; W110-R123 HydrophobicContact CD2-CB 4.17Å; W110-R123 HydrophobicContact CD2-CG 4.28Å; W110-R123 HydrophobicContact CG-CB 3.72Å; W110-R123 HydrophobicContact CG-CG 4.07Å
111E95.8Very high95.9Very high49 Ų4983.6 Ų83.623%0.22941%0.413CS..THydrogen-bonded Turntrans-70.3-25.3-177.6-66.7179.2-179.200112.5Y105 P107 E108 Y113 R119Y105-E111 PolarHBondContact OH-OE1 3.46Å; Y105-E111 VanDerWaalsContact OH-OE1 3.06Å; Y105-E111 PolarHBondContact OH-OE2 2.87Å; P107-E111 WeakPolarHBondContact CA-OE2 3.42Å; P107-E111 HydrophobicContact CB-CB 4.23Å; P107-E111 WeakPolarHBondContact CB-OE2 3.37Å; E108-E111 HydrophobicContact CB-CG 4.18Å; E108-E111 PolarHBondContact N-OE2 3.28Å; E108-E111 WeakPolarHBondContact O-CB 3.48Å; E108-E111 PolarHBondContact O-N 3.36Å; E111-Y113 PolarHBondContact O-N 3.21Å; E111-Y113 VanDerWaalsContact O-N 3.13Å; E111-R119 PolarHBondContact O-NH2 3.22Å; E111-R119 VanDerWaalsContact O-NH2 3.12Å
112Y96.3Very high95.9Very high132 Ų13279.1 Ų79.152%0.51839%0.39SS..THydrogen-bonded Turntrans-64.1-12.4174-60.6-77000114.1I101 P107 E108 W110I101-Y112 HydrophobicContact CD1-CE1 4.3Å; P107-Y112 HydrophobicContact CB-CE1 4.28Å; P107-Y112 HydrophobicContact CB-CE2 4.06Å; P107-Y112 HydrophobicContact CG-CE1 4.32Å; E108-Y112 WeakPolarHBondContact O-CD2 3.39Å; E108-Y112 WeakPolarHBondContact O-CE2 3.48Å; W110-Y112 VanDerWaalsContact C-N 3.25Å; W110-Y112 PolarHBondContact O-N 3.09Å
113Y95.9Very high96Very high105 Ų10580.9 Ų80.941%0.41239%0.386SS..  trans-90.6134177.9-63.2-77.9000112.4H109 W110 E111 R119 A122H109-Y113 WeakPolarHBondContact O-CE2 3.41Å; W110-Y113 WeakPolarHBondContact O-CD2 3.36Å; W110-Y113 PolarHBondContact O-N 2.87Å; E111-Y113 PolarHBondContact O-N 3.21Å; E111-Y113 VanDerWaalsContact O-N 3.13Å; Y113-R119 VanDerWaalsContact O-CZ 3.26Å; Y113-R119 PolarHBondContact O-NE 3.4Å; Y113-R119 PolarHBondContact O-NH2 2.91Å; Y113-A122 HydrophobicContact CD2-CB 3.54Å; Y113-A122 HydrophobicContact CE2-CB 3.32Å
114K95.3Very high96.2Very high126 Ų12675.5 Ų75.555%0.54836%0.364SS..SBendtrans-69-48.5-179.1-165.2-170.3-170.8-161.10114E95 A96E95-K114 HydrophobicContact CB-CG 4.45Å; E95-K114 WeakPolarHBondContact OE2-CE 3.38Å; E95-K114 IonicContact OE2-NZ 2.65Å; E95-K114 PolarHBondContact OE2-NZ 2.89Å; A96-K114 WeakPolarHBondContact CB-O 3.41Å; A96-K114 PolarHBondContact N-O 2.99Å; A96-K114 VanDerWaalsContact N-O 3.09Å; A96-K114 WeakPolarHBondContact O-CG 3.33Å
115H96.4Very high96.3Very high40 Ų4078 Ų7819%0.18535%0.351CS..SBendtrans-85.6134.3-170.6-169-85.3000111.3N90 I117 S118 R119N90-H115 PolarHBondContact OD1-NE2 3.02Å; N90-H115 VanDerWaalsContact OD1-NE2 3.12Å; H115-I117 VanDerWaalsContact C-N 3.29Å; H115-I117 WeakPolarHBondContact ND1-CB 3.35Å; H115-I117 PolarHBondContact ND1-N 2.89Å; H115-I117 VanDerWaalsContact ND1-N 3.14Å; H115-I117 PolarHBondContact O-N 2.93Å; H115-S118 PolarHBondContact O-N 2.81Å; H115-S118 VanDerWaalsContact O-N 3.09Å; H115-R119 WeakPolarHBondContact O-CB 3.21Å; H115-R119 PolarHBondContact O-N 2.99Å
116P95.8Very high96.3Very high26 Ų2678.7 Ų78.717%0.16936%0.356CS..Hα-helixtrans-60.4-34.6-176.322.9-35.5000113.6V89 I93 G94 R119 W120V89-P116 HydrophobicContact CG1-CB 4.06Å; V89-P116 HydrophobicContact CG1-CG 3.36Å; I93-P116 HydrophobicContact CG2-CB 4.01Å; I93-P116 HydrophobicContact CG2-CG 4.25Å; G94-P116 WeakPolarHBondContact O-CD 3.42Å; P116-R119 WeakPolarHBondContact O-CB 3.42Å; P116-W120 WeakPolarHBondContact O-CB 3.34Å; P116-W120 PolarHBondContact O-N 2.94Å
117I95.9Very high96.4Very high51 Ų5175.6 Ų75.626%0.26234%0.341SS..Hα-helixtrans-67.9-45.6174.8-58.4178.8000110.9I86 V89 H115 R119 W120 I121I86-I117 HydrophobicContact CG1-CD1 3.9Å; V89-I117 HydrophobicContact CG1-CG1 4.12Å; H115-I117 VanDerWaalsContact C-N 3.29Å; H115-I117 WeakPolarHBondContact ND1-CB 3.35Å; H115-I117 PolarHBondContact ND1-N 2.89Å; H115-I117 VanDerWaalsContact ND1-N 3.14Å; H115-I117 PolarHBondContact O-N 2.93Å; I117-R119 VanDerWaalsContact C-N 3.27Å; I117-R119 PolarHBondContact O-N 3.46Å; I117-W120 PolarHBondContact O-N 2.94Å; I117-I121 HydrophobicContact CG2-CD1 3.95Å; I117-I121 HydrophobicContact CG2-CG1 4.42Å; I117-I121 VanDerWaalsContact O-CG1 3.31Å; I117-I121 WeakPolarHBondContact O-CG1 3.37Å; I117-I121 PolarHBondContact O-N 3.06Å
118S96.3Very high96.4Very high54 Ų5476.1 Ų76.138%0.37835%0.345SS..Hα-helixtrans-61.8-40.4177.3-56.30000111.2H115 I121 A122H115-S118 PolarHBondContact O-N 2.81Å; H115-S118 VanDerWaalsContact O-N 3.09Å; S118-I121 PolarHBondContact O-N 3.27Å; S118-A122 WeakPolarHBondContact O-CB 3.17Å; S118-A122 PolarHBondContact O-N 2.84Å
119R96.5Very high96.4Very high66 Ų6674.6 Ų74.625%0.24934%0.344CS..Hα-helixtrans-60.5-45.7174.3-172.1170.9-70.2-173.1-2112.2A96 W110 E111 Y113 H115 P116 I117 A122 R123A96-R119 VanDerWaalsContact CB-NH2 3.31Å; W110-R119 HydrophobicContact CB-CG 4.42Å; W110-R119 HydrophobicContact CD2-CG 4.27Å; W110-R119 HydrophobicContact CE3-CG 3.28Å; W110-R119 HydrophobicContact CZ3-CG 3.89Å; W110-R119 WeakPolarHBondContact O-CG 3.4Å; E111-R119 PolarHBondContact O-NH2 3.22Å; E111-R119 VanDerWaalsContact O-NH2 3.12Å; Y113-R119 VanDerWaalsContact O-CZ 3.26Å; Y113-R119 PolarHBondContact O-NE 3.4Å; Y113-R119 PolarHBondContact O-NH2 2.91Å; H115-R119 WeakPolarHBondContact O-CB 3.21Å; H115-R119 PolarHBondContact O-N 2.99Å; P116-R119 WeakPolarHBondContact O-CB 3.42Å; I117-R119 VanDerWaalsContact C-N 3.27Å; I117-R119 PolarHBondContact O-N 3.46Å; R119-A122 PolarHBondContact O-N 3.48Å; R119-R123 WeakPolarHBondContact O-CB 3.22Å; R119-R123 PolarHBondContact O-N 2.82Å
120W96.8Very high96.4Very high128 Ų12877.6 Ų77.649%0.48536%0.359SS..Hα-helixtrans-64.1-40.4174.7-179.891.2000112P116 I117 R123 N124 F125P116-W120 WeakPolarHBondContact O-CB 3.34Å; P116-W120 PolarHBondContact O-N 2.94Å; I117-W120 PolarHBondContact O-N 2.94Å; W120-R123 PolarHBondContact O-N 3.28Å; W120-N124 VanDerWaalsContact CD1-ND2 3.28Å; W120-N124 VanDerWaalsContact CE2-ND2 3.26Å; W120-N124 PolarHBondContact NE1-ND2 3.36Å; W120-N124 VanDerWaalsContact NE1-ND2 3.12Å; W120-N124 PolarHBondContact O-N 3.33Å; W120-N124 VanDerWaalsContact O-N 3.12Å; W120-N124 PolarHBondContact O-ND2 3.33Å; W120-F125 HydrophobicContact CE3-CE2 4.45Å; W120-F125 AromaticContact CH2-CE2 3.72Å; W120-F125 HydrophobicContact CH2-CE2 3.72Å; W120-F125 HydrophobicContact CH2-CZ 4.25Å; W120-F125 HydrophobicContact CZ3-CD2 4.45Å; W120-F125 AromaticContact CZ3-CE2 3.62Å; W120-F125 HydrophobicContact CZ3-CE2 3.62Å
121I97Very high96.4Very high55 Ų5579.9 Ų79.928%0.28237%0.37SS..Hα-helixtrans-64-49176.6-67.7167.5000110.5I117 S118 R123 N124 F125 F126I117-I121 HydrophobicContact CG2-CD1 3.95Å; I117-I121 HydrophobicContact CG2-CG1 4.42Å; I117-I121 VanDerWaalsContact O-CG1 3.31Å; I117-I121 WeakPolarHBondContact O-CG1 3.37Å; I117-I121 PolarHBondContact O-N 3.06Å; S118-I121 PolarHBondContact O-N 3.27Å; I121-R123 VanDerWaalsContact C-N 3.26Å; I121-R123 PolarHBondContact O-N 2.9Å; I121-N124 PolarHBondContact O-N 3.3Å; I121-F125 HydrophobicContact CG2-CD2 4.27Å; I121-F125 PolarHBondContact O-N 3.48Å; I121-F126 HydrophobicContact CG2-CD2 4.21Å; I121-F126 HydrophobicContact CG2-CE1 4.35Å; I121-F126 HydrophobicContact CG2-CE2 3.75Å; I121-F126 HydrophobicContact CG2-CZ 3.83Å
122A96.9Very high96.5Very high1 Ų182.2 Ų82.21%0.00838%0.383CS..Hα-helixtrans-60.9-36.9-179.500000112.2H109 W110 Y113 S118 R119 F126H109-A122 PolarHBondContact NE2-O 2.89Å; W110-A122 HydrophobicContact CB-CB 3.92Å; Y113-A122 HydrophobicContact CD2-CB 3.54Å; Y113-A122 HydrophobicContact CE2-CB 3.32Å; S118-A122 WeakPolarHBondContact O-CB 3.17Å; S118-A122 PolarHBondContact O-N 2.84Å; R119-A122 PolarHBondContact O-N 3.48Å; A122-F126 HydrophobicContact CB-CD2 4.46Å
123R96.5Very high96.6Very high116 Ų11683.1 Ų83.144%0.43839%0.387SS..Hα-helixtrans-70.3-40.1177.6-172.9173.964.9-139.93.5113.6W110 R119 W120 I121W110-R123 HydrophobicContact CB-CB 3.96Å; W110-R123 HydrophobicContact CD2-CB 4.17Å; W110-R123 HydrophobicContact CD2-CG 4.28Å; W110-R123 HydrophobicContact CG-CB 3.72Å; W110-R123 HydrophobicContact CG-CG 4.07Å; R119-R123 WeakPolarHBondContact O-CB 3.22Å; R119-R123 PolarHBondContact O-N 2.82Å; W120-R123 PolarHBondContact O-N 3.28Å; I121-R123 VanDerWaalsContact C-N 3.26Å; I121-R123 PolarHBondContact O-N 2.9Å
124N97.3Very high96.7Very high85 Ų8584.5 Ų84.546%0.45540%0.397SS..Hα-helixtrans-95.1-29.9-171.3-66.9-72.5000114.2W120 I121W120-N124 VanDerWaalsContact CD1-ND2 3.28Å; W120-N124 VanDerWaalsContact CE2-ND2 3.26Å; W120-N124 PolarHBondContact NE1-ND2 3.36Å; W120-N124 VanDerWaalsContact NE1-ND2 3.12Å; W120-N124 PolarHBondContact O-N 3.33Å; W120-N124 VanDerWaalsContact O-N 3.12Å; W120-N124 PolarHBondContact O-ND2 3.33Å; I121-N124 PolarHBondContact O-N 3.3Å
125F97.3Very high96.9Very high139 Ų13985.2 Ų85.261%0.6140%0.4SS*.THydrogen-bonded Turntrans-116.6-34-171.6-64.5-74000114W120 I121W120-F125 HydrophobicContact CE3-CE2 4.45Å; W120-F125 AromaticContact CH2-CE2 3.72Å; W120-F125 HydrophobicContact CH2-CE2 3.72Å; W120-F125 HydrophobicContact CH2-CZ 4.25Å; W120-F125 HydrophobicContact CZ3-CD2 4.45Å; W120-F125 AromaticContact CZ3-CE2 3.62Å; W120-F125 HydrophobicContact CZ3-CE2 3.62Å; I121-F125 HydrophobicContact CG2-CD2 4.27Å; I121-F125 PolarHBondContact O-N 3.48Å
126F96.6Very high97Very high123 Ų12385.8 Ų85.854%0.53941%0.409SS..SBendtrans-94.5140.3-175.3-60-24.4000111.5H109 I121 A122H109-F126 PolarHBondContact NE2-O 2.95Å; I121-F126 HydrophobicContact CG2-CD2 4.21Å; I121-F126 HydrophobicContact CG2-CE1 4.35Å; I121-F126 HydrophobicContact CG2-CE2 3.75Å; I121-F126 HydrophobicContact CG2-CZ 3.83Å; A122-F126 HydrophobicContact CB-CD2 4.46Å
127D95.9Very high97.1Very high80 Ų8089 Ų8943%0.42842%0.423SS..PPolyproline II helixtrans-69.6152.2168.6-78-35.2000110K131 I132D127-K131 HydrophobicContact CB-CD 4.11Å; D127-K131 IonicContact OD1-NZ 3.12Å; D127-K131 PolarHBondContact OD1-NZ 3.12Å; D127-K131 IonicContact OD2-NZ 2.68Å; D127-I132 HydrophobicContact CB-CD1 4.08Å; D127-I132 HydrophobicContact CB-CG1 3.94Å
128S96.9Very high97.2Very high29 Ų2988.8 Ų88.820%0.20343%0.428CS..PPolyproline II helixtrans-63.1143.9172.374.30000110.3E130 K131 I132S128-E130 VanDerWaalsContact CB-OE2 3.24Å; S128-E130 WeakPolarHBondContact CB-OE2 3.32Å; S128-E130 PolarHBondContact O-N 2.99Å; S128-E130 PolarHBondContact OG-OE2 3.14Å; S128-K131 WeakPolarHBondContact O-CB 3.24Å; S128-K131 PolarHBondContact O-N 3.43Å; S128-K131 VanDerWaalsContact O-N 3.17Å; S128-K131 VanDerWaalsContact OG-CB 3.25Å; S128-K131 WeakPolarHBondContact OG-CB 3.22Å; S128-K131 PolarHBondContact OG-N 2.67Å; S128-I132 PolarHBondContact O-N 2.95Å
129P96.8Very high97.3Very high75 Ų7589.2 Ų89.249%0.48743%0.429SS..Hα-helixtrans-61.8-33.6-179.524.9-32.3000111.9K131 I132 Y133P129-K131 VanDerWaalsContact C-N 3.34Å; P129-K131 PolarHBondContact O-N 3.47Å; P129-I132 PolarHBondContact O-N 2.75Å; P129-Y133 VanDerWaalsContact O-CB 3.32Å; P129-Y133 WeakPolarHBondContact O-CB 3.44Å; P129-Y133 PolarHBondContact O-N 3.12Å
130E96.5Very high97.4Very high94 Ų9491.4 Ų91.444%0.43944%0.444SS..Hα-helixtrans-60.8-44.9175.7-55.677.1-164.400110.5S128 I132 Y133 E134S128-E130 VanDerWaalsContact CB-OE2 3.24Å; S128-E130 WeakPolarHBondContact CB-OE2 3.32Å; S128-E130 PolarHBondContact O-N 2.99Å; S128-E130 PolarHBondContact OG-OE2 3.14Å; E130-I132 VanDerWaalsContact C-N 3.35Å; E130-I132 PolarHBondContact O-N 2.9Å; E130-Y133 PolarHBondContact O-N 3.42Å; E130-E134 WeakPolarHBondContact O-CG 3.08Å; E130-E134 PolarHBondContact O-N 2.7Å
131K96.8Very high97.5Very high104 Ų10490.9 Ų90.945%0.45245%0.448SS..Hα-helixtrans-60.8-43.8177.8177.2-179174.6-170.40111.6D127 S128 P129 K135D127-K131 HydrophobicContact CB-CD 4.11Å; D127-K131 IonicContact OD1-NZ 3.12Å; D127-K131 PolarHBondContact OD1-NZ 3.12Å; D127-K131 IonicContact OD2-NZ 2.68Å; S128-K131 WeakPolarHBondContact O-CB 3.24Å; S128-K131 PolarHBondContact O-N 3.43Å; S128-K131 VanDerWaalsContact O-N 3.17Å; S128-K131 VanDerWaalsContact OG-CB 3.25Å; S128-K131 WeakPolarHBondContact OG-CB 3.22Å; S128-K131 PolarHBondContact OG-N 2.67Å; P129-K131 VanDerWaalsContact C-N 3.34Å; P129-K131 PolarHBondContact O-N 3.47Å; K131-K135 WeakPolarHBondContact O-CB 3.37Å; K131-K135 PolarHBondContact O-N 3.4Å
132I97.7Very high97.6Very high98 Ų9892.1 Ų92.150%0.50345%0.454SS..Hα-helixtrans-66.9-43.2178.7-63.6174.3000110.3D127 S128 P129 E130 S136D127-I132 HydrophobicContact CB-CD1 4.08Å; D127-I132 HydrophobicContact CB-CG1 3.94Å; S128-I132 PolarHBondContact O-N 2.95Å; P129-I132 PolarHBondContact O-N 2.75Å; E130-I132 VanDerWaalsContact C-N 3.35Å; E130-I132 PolarHBondContact O-N 2.9Å; I132-S136 WeakPolarHBondContact O-CB 3.25Å; I132-S136 PolarHBondContact O-N 3.25Å; I132-S136 PolarHBondContact O-OG 2.88Å
133Y98Very high97.7Very high150 Ų15097.6 Ų97.659%0.58848%0.479SS*.Hα-helixtrans-60.6-55.1180-177.1-101.4000111.5P129 E130 K135 S136 M137P129-Y133 VanDerWaalsContact O-CB 3.32Å; P129-Y133 WeakPolarHBondContact O-CB 3.44Å; P129-Y133 PolarHBondContact O-N 3.12Å; E130-Y133 PolarHBondContact O-N 3.42Å; Y133-K135 PolarHBondContact O-N 3.19Å; Y133-S136 PolarHBondContact O-N 3.06Å; Y133-S136 VanDerWaalsContact O-N 3.14Å; Y133-S136 PolarHBondContact O-OG 3.31Å; Y133-M137 HydrophobicContact CD1-SD 3.89Å; Y133-M137 HydrophobicContact CE1-CG 4.27Å; Y133-M137 HydrophobicContact CE1-SD 3.22Å; Y133-M137 WeakPolarHBondContact CE1-SD 3.24Å; Y133-M137 HydrophobicContact CE2-SD 4.47Å; Y133-M137 VanDerWaalsContact CZ-SD 3.57Å; Y133-M137 PolarHBondContact O-N 3.17Å
134E98.4Very high97.8Very high135 Ų13594.6 Ų94.663%0.63148%0.479SS*.Hα-helixtrans-64.1-41.4-179.2-69-179.317400112.3E130 S136 M137 A138E130-E134 WeakPolarHBondContact O-CG 3.08Å; E130-E134 PolarHBondContact O-N 2.7Å; E134-S136 VanDerWaalsContact C-N 3.28Å; E134-S136 PolarHBondContact O-N 3.34Å; E134-M137 PolarHBondContact O-N 3.42Å; E134-A138 WeakPolarHBondContact O-CB 3.33Å; E134-A138 PolarHBondContact O-N 3.28Å
135K98.3Very high97.8Very high140 Ų14095.1 Ų95.161%0.60948%0.479SS*.Hα-helixtrans-58.7-42.9174.7-178.3-179.6177.9-176.60111.2K131 Y133 A138 V139K131-K135 WeakPolarHBondContact O-CB 3.37Å; K131-K135 PolarHBondContact O-N 3.4Å; Y133-K135 PolarHBondContact O-N 3.19Å; K135-A138 PolarHBondContact O-N 2.97Å; K135-V139 WeakPolarHBondContact O-CG2 3.43Å; K135-V139 PolarHBondContact O-N 2.93Å
136S98.2Very high97.9Very high53 Ų5393.6 Ų93.637%0.37147%0.472SS..Hα-helixtrans-65.7-41.1178.175.10000111.9I132 Y133 E134 A138 V139 L140I132-S136 WeakPolarHBondContact O-CB 3.25Å; I132-S136 PolarHBondContact O-N 3.25Å; I132-S136 PolarHBondContact O-OG 2.88Å; Y133-S136 PolarHBondContact O-N 3.06Å; Y133-S136 VanDerWaalsContact O-N 3.14Å; Y133-S136 PolarHBondContact O-OG 3.31Å; E134-S136 VanDerWaalsContact C-N 3.28Å; E134-S136 PolarHBondContact O-N 3.34Å; S136-A138 PolarHBondContact O-N 3.41Å; S136-V139 PolarHBondContact O-N 3.47Å; S136-L140 WeakPolarHBondContact O-CG 3.48Å; S136-L140 PolarHBondContact O-N 2.9Å
137M98.4Very high98Very high94 Ų9490 Ų9046%0.46347%0.465SS..Hα-helixtrans-61.6-43175-71-174.770.600112.1Y133 E134 V139 L140 Q141Y133-M137 HydrophobicContact CD1-SD 3.89Å; Y133-M137 HydrophobicContact CE1-CG 4.27Å; Y133-M137 HydrophobicContact CE1-SD 3.22Å; Y133-M137 WeakPolarHBondContact CE1-SD 3.24Å; Y133-M137 HydrophobicContact CE2-SD 4.47Å; Y133-M137 VanDerWaalsContact CZ-SD 3.57Å; Y133-M137 PolarHBondContact O-N 3.17Å; E134-M137 PolarHBondContact O-N 3.42Å; M137-V139 VanDerWaalsContact C-N 3.35Å; M137-V139 PolarHBondContact O-N 3.3Å; M137-L140 PolarHBondContact O-N 3.41Å; M137-Q141 PolarHBondContact O-N 3.11Å
138A98.6Very high98.1Very high46 Ų4691.3 Ų91.338%0.3847%0.468SS..Hα-helixtrans-62.3-42.2177.500000111.9E134 K135 S136 Q141 I142E134-A138 WeakPolarHBondContact O-CB 3.33Å; E134-A138 PolarHBondContact O-N 3.28Å; K135-A138 PolarHBondContact O-N 2.97Å; S136-A138 PolarHBondContact O-N 3.41Å; A138-Q141 PolarHBondContact O-N 2.94Å; A138-I142 WeakPolarHBondContact O-CD1 3.49Å; A138-I142 VanDerWaalsContact O-CG1 3.28Å; A138-I142 WeakPolarHBondContact O-CG1 3.38Å; A138-I142 PolarHBondContact O-N 3.41Å
139V98.6Very high98.2Very high63 Ų6395 Ų9538%0.38249%0.486SS..Hα-helixtrans-61.6-47.3175.4170.30000110.6K135 S136 M137 Q141 I142 E143K135-V139 WeakPolarHBondContact O-CG2 3.43Å; K135-V139 PolarHBondContact O-N 2.93Å; S136-V139 PolarHBondContact O-N 3.47Å; M137-V139 VanDerWaalsContact C-N 3.35Å; M137-V139 PolarHBondContact O-N 3.3Å; V139-Q141 VanDerWaalsContact C-N 3.32Å; V139-Q141 PolarHBondContact O-N 3.06Å; V139-I142 PolarHBondContact O-N 3.47Å; V139-E143 HydrophobicContact CG1-CG 4.33Å; V139-E143 WeakPolarHBondContact CG1-OE1 3.47Å; V139-E143 WeakPolarHBondContact O-CB 3.33Å; V139-E143 WeakPolarHBondContact O-CG 3.42Å; V139-E143 PolarHBondContact O-N 3.43Å
140L98.6Very high98.3Very high111 Ų11198.6 Ų98.658%0.58149%0.489SS*.Hα-helixtrans-59.7-42.7178.7-72.6172.9000112.1S136 M137 E143 A144S136-L140 WeakPolarHBondContact O-CG 3.48Å; S136-L140 PolarHBondContact O-N 2.9Å; M137-L140 PolarHBondContact O-N 3.41Å; L140-E143 PolarHBondContact O-N 3.22Å; L140-A144 VanDerWaalsContact O-CB 3.24Å; L140-A144 WeakPolarHBondContact O-CB 3.34Å; L140-A144 PolarHBondContact O-N 3.37Å
141Q98.7Very high98.4Very high118 Ų118100.1 Ų100.155%0.55150%0.5SS*.Hα-helixtrans-61.5-50.2177.7-178.2178.9-10.600111.4M137 A138 V139 E143 A144 E145M137-Q141 PolarHBondContact O-N 3.11Å; A138-Q141 PolarHBondContact O-N 2.94Å; V139-Q141 VanDerWaalsContact C-N 3.32Å; V139-Q141 PolarHBondContact O-N 3.06Å; Q141-E143 VanDerWaalsContact C-N 3.28Å; Q141-E143 PolarHBondContact O-N 3.03Å; Q141-A144 PolarHBondContact O-N 3.35Å; Q141-E145 WeakPolarHBondContact CG-OE1 3.38Å; Q141-E145 PolarHBondContact NE2-OE1 2.93Å; Q141-E145 WeakPolarHBondContact O-CG 3.36Å; Q141-E145 PolarHBondContact O-N 3.39Å
142I98.6Very high98.5Very high81 Ų81100.6 Ų100.642%0.41550%0.502SS..Hα-helixtrans-60.4-41.6-179.8-69166.2000110.9A138 V139 K146A138-I142 WeakPolarHBondContact O-CD1 3.49Å; A138-I142 VanDerWaalsContact O-CG1 3.28Å; A138-I142 WeakPolarHBondContact O-CG1 3.38Å; A138-I142 PolarHBondContact O-N 3.41Å; V139-I142 PolarHBondContact O-N 3.47Å; I142-K146 HydrophobicContact CG2-CD 3.97Å; I142-K146 VanDerWaalsContact CG2-CE 3.46Å; I142-K146 WeakPolarHBondContact O-CB 3.45Å; I142-K146 WeakPolarHBondContact O-CD 3.21Å; I142-K146 WeakPolarHBondContact O-CG 3.4Å; I142-K146 PolarHBondContact O-N 3.28Å
143E98.6Very high98.5Very high115 Ų11599.5 Ų99.554%0.53750%0.495SS..Hα-helixtrans-69.7-40.2-180-72.8-179.7176.300112.2V139 L140 Q141 K146 A147V139-E143 HydrophobicContact CG1-CG 4.33Å; V139-E143 WeakPolarHBondContact CG1-OE1 3.47Å; V139-E143 WeakPolarHBondContact O-CB 3.33Å; V139-E143 WeakPolarHBondContact O-CG 3.42Å; V139-E143 PolarHBondContact O-N 3.43Å; L140-E143 PolarHBondContact O-N 3.22Å; Q141-E143 VanDerWaalsContact C-N 3.28Å; Q141-E143 PolarHBondContact O-N 3.03Å; E143-K146 PolarHBondContact O-N 2.94Å; E143-A147 WeakPolarHBondContact O-CB 3.28Å; E143-A147 PolarHBondContact O-N 3.07Å
144A98.6Very high98.5Very high53 Ų5397.8 Ų97.844%0.43850%0.495SS..Hα-helixtrans-62.2-48.5175.100000111.4L140 Q141 K146 A147 E148L140-A144 VanDerWaalsContact O-CB 3.24Å; L140-A144 WeakPolarHBondContact O-CB 3.34Å; L140-A144 PolarHBondContact O-N 3.37Å; Q141-A144 PolarHBondContact O-N 3.35Å; A144-K146 VanDerWaalsContact C-N 3.35Å; A144-K146 PolarHBondContact O-N 3.3Å; A144-A147 WeakPolarHBondContact O-CB 3.38Å; A144-A147 PolarHBondContact O-N 2.91Å; A144-A147 VanDerWaalsContact O-N 3.1Å; A144-E148 PolarHBondContact O-N 3.18Å
145E98.7Very high98.5Very high97 Ų9795.3 Ų95.345%0.45348%0.484SS..Hα-helixtrans-60.2-44.2177.2-72.5174.1-168.400111.4Q141 A147 E148 L149Q141-E145 WeakPolarHBondContact CG-OE1 3.38Å; Q141-E145 PolarHBondContact NE2-OE1 2.93Å; Q141-E145 WeakPolarHBondContact O-CG 3.36Å; Q141-E145 PolarHBondContact O-N 3.39Å; E145-A147 VanDerWaalsContact C-N 3.32Å; E145-A147 PolarHBondContact O-N 3.36Å; E145-E148 PolarHBondContact O-N 3.4Å; E145-L149 WeakPolarHBondContact O-CB 3.26Å; E145-L149 VanDerWaalsContact O-CG 3.28Å; E145-L149 WeakPolarHBondContact O-CG 3.28Å; E145-L149 PolarHBondContact O-N 3.11Å
146K98.7Very high98.4Very high107 Ų10791.7 Ų91.747%0.46547%0.473SS..Hα-helixtrans-61.4-39.1174.5-75.6171.2-177.9171.50112.2I142 E143 A144 R150I142-K146 HydrophobicContact CG2-CD 3.97Å; I142-K146 VanDerWaalsContact CG2-CE 3.46Å; I142-K146 WeakPolarHBondContact O-CB 3.45Å; I142-K146 WeakPolarHBondContact O-CD 3.21Å; I142-K146 WeakPolarHBondContact O-CG 3.4Å; I142-K146 PolarHBondContact O-N 3.28Å; E143-K146 PolarHBondContact O-N 2.94Å; A144-K146 VanDerWaalsContact C-N 3.35Å; A144-K146 PolarHBondContact O-N 3.3Å; K146-R150 VanDerWaalsContact O-CG 3.26Å; K146-R150 WeakPolarHBondContact O-CG 3.49Å; K146-R150 PolarHBondContact O-N 3.36Å; K146-R150 VanDerWaalsContact O-N 3.11Å
147A98.6Very high98.4Very high47 Ų4793.9 Ų93.939%0.38847%0.473SS..Hα-helixtrans-65.5-45.9177.900000111.2E143 A144 E145 L149 R150 L151E143-A147 WeakPolarHBondContact O-CB 3.28Å; E143-A147 PolarHBondContact O-N 3.07Å; A144-A147 WeakPolarHBondContact O-CB 3.38Å; A144-A147 PolarHBondContact O-N 2.91Å; A144-A147 VanDerWaalsContact O-N 3.1Å; E145-A147 VanDerWaalsContact C-N 3.32Å; E145-A147 PolarHBondContact O-N 3.36Å; A147-L149 PolarHBondContact O-N 3.19Å; A147-R150 PolarHBondContact O-N 2.94Å; A147-L151 PolarHBondContact O-N 3.1Å
148E98.6Very high98.3Very high107 Ų10795.6 Ų95.650%0.547%0.474SS..Hα-helixtrans-61.6-44.3175.8-72.9-168.7-169.700112.6A144 E145 R150 L151 K152A144-E148 PolarHBondContact O-N 3.18Å; E145-E148 PolarHBondContact O-N 3.4Å; E148-R150 VanDerWaalsContact C-N 3.29Å; E148-R150 PolarHBondContact O-N 3.5Å; E148-L151 PolarHBondContact O-N 2.9Å; E148-K152 WeakPolarHBondContact O-CG 3.41Å; E148-K152 PolarHBondContact O-N 2.67Å; E148-K152 IonicContact OE2-NZ 3.82Å; E148-K152 PolarHBondContact OE2-NZ 3.31Å; E148-K152 VanDerWaalsContact OE2-NZ 3.11Å
149L98.7Very high98.2Very high108 Ų10896 Ų9657%0.56547%0.47SS*.Hα-helixtrans-62.4-37.2178.9-73.4174.5000111.8E145 A147 K152 E153E145-L149 WeakPolarHBondContact O-CB 3.26Å; E145-L149 VanDerWaalsContact O-CG 3.28Å; E145-L149 WeakPolarHBondContact O-CG 3.28Å; E145-L149 PolarHBondContact O-N 3.11Å; A147-L149 PolarHBondContact O-N 3.19Å; L149-K152 PolarHBondContact O-N 3.42Å; L149-E153 VanDerWaalsContact O-CB 3.32Å; L149-E153 WeakPolarHBondContact O-CB 3.41Å; L149-E153 PolarHBondContact O-N 2.87Å
150R98.4Very high98.1Very high150 Ų15094.8 Ų94.857%0.56646%0.46SS*.Hα-helixtrans-64.7-39.9174.7-72.8175.5-168.4122.6-5.3112.2K146 A147 E148 E153 L154K146-R150 VanDerWaalsContact O-CG 3.26Å; K146-R150 WeakPolarHBondContact O-CG 3.49Å; K146-R150 PolarHBondContact O-N 3.36Å; K146-R150 VanDerWaalsContact O-N 3.11Å; A147-R150 PolarHBondContact O-N 2.94Å; E148-R150 VanDerWaalsContact C-N 3.29Å; E148-R150 PolarHBondContact O-N 3.5Å; R150-E153 PolarHBondContact O-N 3.23Å; R150-L154 WeakPolarHBondContact O-CG 3.38Å; R150-L154 PolarHBondContact O-N 2.94Å; R150-L154 VanDerWaalsContact O-N 3.08Å
151L98.6Very high97.9Very high125 Ų12597.3 Ų97.365%0.65446%0.462SS*.Hα-helixtrans-65.2-45.1175.1-67.7175.2000111.2A147 E148 E153 L154 E155A147-L151 PolarHBondContact O-N 3.1Å; E148-L151 PolarHBondContact O-N 2.9Å; L151-E153 VanDerWaalsContact C-N 3.33Å; L151-E153 PolarHBondContact O-N 3.41Å; L151-L154 PolarHBondContact O-N 2.92Å; L151-E155 PolarHBondContact O-N 3.45Å; L151-E155 VanDerWaalsContact O-N 3.09Å
152K98.5Very high97.8Very high114 Ų11498.9 Ų98.950%0.49647%0.471SS..Hα-helixtrans-61.1-41.9175.7-71.3168.1-177.6158.40111.3E148 L149 E155 V156E148-K152 WeakPolarHBondContact O-CG 3.41Å; E148-K152 PolarHBondContact O-N 2.67Å; E148-K152 IonicContact OE2-NZ 3.82Å; E148-K152 PolarHBondContact OE2-NZ 3.31Å; E148-K152 VanDerWaalsContact OE2-NZ 3.11Å; L149-K152 PolarHBondContact O-N 3.42Å; K152-E155 PolarHBondContact O-N 2.93Å; K152-V156 WeakPolarHBondContact O-CB 3.42Å; K152-V156 VanDerWaalsContact O-CG2 3.24Å; K152-V156 WeakPolarHBondContact O-CG2 3.28Å; K152-V156 PolarHBondContact O-N 2.85Å
153E98.1Very high97.7Very high76 Ų76103.1 Ų103.136%0.35548%0.482SS..Hα-helixtrans-60.8-46177.1-175.1-174.2179.500111.8L149 R150 L151 E155 V156 R157L149-E153 VanDerWaalsContact O-CB 3.32Å; L149-E153 WeakPolarHBondContact O-CB 3.41Å; L149-E153 PolarHBondContact O-N 2.87Å; R150-E153 PolarHBondContact O-N 3.23Å; L151-E153 VanDerWaalsContact C-N 3.33Å; L151-E153 PolarHBondContact O-N 3.41Å; E153-E155 VanDerWaalsContact C-N 3.32Å; E153-E155 PolarHBondContact O-N 3.46Å; E153-V156 PolarHBondContact O-N 3.36Å; E153-R157 HydrophobicContact CG-CG 4.47Å; E153-R157 WeakPolarHBondContact O-CB 3.3Å; E153-R157 WeakPolarHBondContact O-CG 3.41Å; E153-R157 PolarHBondContact O-N 3.44Å; E153-R157 IonicContact OE1-CZ 3.58Å; E153-R157 IonicContact OE1-NE 3.42Å; E153-R157 PolarHBondContact OE1-NE 2.88Å; E153-R157 VanDerWaalsContact OE1-NE 3.12Å; E153-R157 IonicContact OE1-NH2 2.84Å; E153-R157 PolarHBondContact OE1-NH2 3.49Å
154L98Very high97.4Very high114 Ų11499.8 Ų99.860%0.59748%0.478SS*.Hα-helixtrans-61.1-42.6177.6-71.5175.1000111.6R150 L151 R157 R158R150-L154 WeakPolarHBondContact O-CG 3.38Å; R150-L154 PolarHBondContact O-N 2.94Å; R150-L154 VanDerWaalsContact O-N 3.08Å; L151-L154 PolarHBondContact O-N 2.92Å; L154-R157 PolarHBondContact O-N 3.09Å; L154-R158 WeakPolarHBondContact O-CB 3.38Å; L154-R158 PolarHBondContact O-N 3.31Å
155E97.9Very high97.2Very high83 Ų83102.5 Ų102.539%0.38849%0.486SS..Hα-helixtrans-66.9-43.2178.1-176.357.8-164.200111.9L151 K152 E153 R157 R158 L159L151-E155 PolarHBondContact O-N 3.45Å; L151-E155 VanDerWaalsContact O-N 3.09Å; K152-E155 PolarHBondContact O-N 2.93Å; E153-E155 VanDerWaalsContact C-N 3.32Å; E153-E155 PolarHBondContact O-N 3.46Å; E155-R157 PolarHBondContact O-N 3.47Å; E155-R158 WeakPolarHBondContact O-CB 3.24Å; E155-R158 PolarHBondContact O-N 3.34Å; E155-R158 IonicContact OE1-CZ 2.7Å; E155-R158 IonicContact OE1-NE 3.65Å; E155-R158 PolarHBondContact OE1-NE 3.25Å; E155-R158 IonicContact OE1-NH2 3.11Å; E155-R158 PolarHBondContact OE1-NH2 3.38Å; E155-R158 IonicContact OE2-CZ 3.7Å; E155-R158 IonicContact OE2-NE 2.67Å; E155-R158 PolarHBondContact OE2-NE 3.48Å; E155-R158 IonicContact OE2-NH2 3.45Å; E155-L159 HydrophobicContact CG-CD1 4.39Å; E155-L159 WeakPolarHBondContact O-CG 3.43Å; E155-L159 PolarHBondContact O-N 3.08Å
156V97.6Very high97Very high63 Ų6398.4 Ų98.438%0.38247%0.469SS..Hα-helixtrans-60.5-46.9174.8169.10000110.8K152 E153 R158 L159 M160K152-V156 WeakPolarHBondContact O-CB 3.42Å; K152-V156 VanDerWaalsContact O-CG2 3.24Å; K152-V156 WeakPolarHBondContact O-CG2 3.28Å; K152-V156 PolarHBondContact O-N 2.85Å; E153-V156 PolarHBondContact O-N 3.36Å; V156-R158 VanDerWaalsContact C-N 3.3Å; V156-R158 PolarHBondContact O-N 2.96Å; V156-L159 PolarHBondContact O-N 3.08Å; V156-M160 HydrophobicContact CG1-CE 3.57Å; V156-M160 HydrophobicContact CG1-CG 4.22Å; V156-M160 HydrophobicContact CG1-SD 3.77Å; V156-M160 WeakPolarHBondContact O-CB 3.41Å; V156-M160 VanDerWaalsContact O-CG 3.31Å; V156-M160 WeakPolarHBondContact O-CG 3.32Å; V156-M160 PolarHBondContact O-N 2.68Å
157R96.9Very high96.9Very high100 Ų10098.5 Ų98.538%0.37748%0.481SS..Hα-helixtrans-60.7-39.2176.5-75.4-178.2-180-156.62.8112.1E153 L154 E155 R161 W168E153-R157 HydrophobicContact CG-CG 4.47Å; E153-R157 WeakPolarHBondContact O-CB 3.3Å; E153-R157 WeakPolarHBondContact O-CG 3.41Å; E153-R157 PolarHBondContact O-N 3.44Å; E153-R157 IonicContact OE1-CZ 3.58Å; E153-R157 IonicContact OE1-NE 3.42Å; E153-R157 PolarHBondContact OE1-NE 2.88Å; E153-R157 VanDerWaalsContact OE1-NE 3.12Å; E153-R157 IonicContact OE1-NH2 2.84Å; E153-R157 PolarHBondContact OE1-NH2 3.49Å; L154-R157 PolarHBondContact O-N 3.09Å; E155-R157 PolarHBondContact O-N 3.47Å; R157-R161 WeakPolarHBondContact O-CB 3.32Å; R157-R161 PolarHBondContact O-N 2.79Å; R157-R161 VanDerWaalsContact O-N 3.08Å; R157-W168 HydrophobicContact CG-CE3 3.87Å; R157-W168 HydrophobicContact CG-CZ3 3.67Å
158R96.8Very high96.6Very high130 Ų130102.1 Ų102.149%0.49149%0.485SS..Hα-helixtrans-61.9-49.1175.9-171.7-173.174.983.70.4110.8L154 E155 V156 R161 M162L154-R158 WeakPolarHBondContact O-CB 3.38Å; L154-R158 PolarHBondContact O-N 3.31Å; E155-R158 WeakPolarHBondContact O-CB 3.24Å; E155-R158 PolarHBondContact O-N 3.34Å; E155-R158 IonicContact OE1-CZ 2.7Å; E155-R158 IonicContact OE1-NE 3.65Å; E155-R158 PolarHBondContact OE1-NE 3.25Å; E155-R158 IonicContact OE1-NH2 3.11Å; E155-R158 PolarHBondContact OE1-NH2 3.38Å; E155-R158 IonicContact OE2-CZ 3.7Å; E155-R158 IonicContact OE2-NE 2.67Å; E155-R158 PolarHBondContact OE2-NE 3.48Å; E155-R158 IonicContact OE2-NH2 3.45Å; V156-R158 VanDerWaalsContact C-N 3.3Å; V156-R158 PolarHBondContact O-N 2.96Å; R158-R161 PolarHBondContact O-N 3.4Å; R158-M162 VanDerWaalsContact O-CG 3.28Å; R158-M162 WeakPolarHBondContact O-CG 3.4Å; R158-M162 PolarHBondContact O-N 3.14Å
159L97.3Very high96.3Very high54 Ų54100.5 Ų100.528%0.28347%0.474SS..Hα-helixtrans-65.2-46-179.9-69.6173.8000112.3E155 V156 R161 M162 R163E155-L159 HydrophobicContact CG-CD1 4.39Å; E155-L159 WeakPolarHBondContact O-CG 3.43Å; E155-L159 PolarHBondContact O-N 3.08Å; V156-L159 PolarHBondContact O-N 3.08Å; L159-R161 VanDerWaalsContact C-N 3.32Å; L159-R161 PolarHBondContact O-N 2.86Å; L159-M162 PolarHBondContact O-N 3.17Å; L159-M162 VanDerWaalsContact O-N 3.14Å; L159-R163 PolarHBondContact O-N 3.12Å
160M96.2Very high96.1Very high37 Ų37102.8 Ų102.818%0.18248%0.477CS..Hα-helixtrans-60.7-40.2178.3-72.5-178.9171.400112V156 M162 G164 W168 Y169V156-M160 HydrophobicContact CG1-CE 3.57Å; V156-M160 HydrophobicContact CG1-CG 4.22Å; V156-M160 HydrophobicContact CG1-SD 3.77Å; V156-M160 WeakPolarHBondContact O-CB 3.41Å; V156-M160 VanDerWaalsContact O-CG 3.31Å; V156-M160 WeakPolarHBondContact O-CG 3.32Å; V156-M160 PolarHBondContact O-N 2.68Å; M160-M162 VanDerWaalsContact C-N 3.35Å; M160-M162 PolarHBondContact O-N 2.89Å; M160-G164 WeakPolarHBondContact O-CA 3.31Å; M160-G164 PolarHBondContact O-N 2.84Å; M160-W168 HydrophobicContact SD-CB 4.12Å; M160-W168 HydrophobicContact SD-CD2 4.34Å; M160-W168 HydrophobicContact SD-CE3 3.98Å; M160-W168 HydrophobicContact SD-CG 4.42Å; M160-Y169 HydrophobicContact CB-CD2 4.46Å
161R94.9Very high95.9Very high164 Ų164104.4 Ų104.462%0.61948%0.484SS*.Hα-helixtrans-65.3-37.4175.6-173-178.1-64.4178.91.1112.6R157 R158 L159 Y169R157-R161 WeakPolarHBondContact O-CB 3.32Å; R157-R161 PolarHBondContact O-N 2.79Å; R157-R161 VanDerWaalsContact O-N 3.08Å; R158-R161 PolarHBondContact O-N 3.4Å; L159-R161 VanDerWaalsContact C-N 3.32Å; L159-R161 PolarHBondContact O-N 2.86Å; R161-Y169 HydrophobicContact CB-CD2 3.94Å; R161-Y169 HydrophobicContact CB-CE2 4.05Å; R161-Y169 HydrophobicContact CB-CG 4.41Å; R161-Y169 PolarHBondContact NH2-OH 3.49Å
162M95.6Very high95.7Very high151 Ų151107 Ų10774%0.74449%0.493SS*.Hα-helixtrans-75.2-34.8-178.5-70.3-64.5-62.500112.9R158 L159 M160R158-M162 VanDerWaalsContact O-CG 3.28Å; R158-M162 WeakPolarHBondContact O-CG 3.4Å; R158-M162 PolarHBondContact O-N 3.14Å; L159-M162 PolarHBondContact O-N 3.17Å; L159-M162 VanDerWaalsContact O-N 3.14Å; M160-M162 VanDerWaalsContact C-N 3.35Å; M160-M162 PolarHBondContact O-N 2.89Å
163R96.1Very high95.4Very high171 Ų171106.8 Ų106.865%0.64550%0.501SS*.Hα-helixtrans-99-33.5-174.6-66.1-179.3-177.8175.80.2114L159 D165L159-R163 PolarHBondContact O-N 3.12Å; R163-D165 HydrophobicContact CB-CB 4.33Å; R163-D165 WeakPolarHBondContact CB-OD1 3.4Å; R163-D165 VanDerWaalsContact CD-OD2 3.3Å; R163-D165 WeakPolarHBondContact CD-OD2 3.39Å; R163-D165 PolarHBondContact O-N 3.4Å
164G93.6Very high95.3Very high44 Ų44110.1 Ų110.145%0.45452%0.52SS..  trans69.415.9-174.200000114.5M160M160-G164 WeakPolarHBondContact O-CA 3.31Å; M160-G164 PolarHBondContact O-N 2.84Å
165D94.6Very high95.2Very high111 Ų111108.8 Ų108.859%0.59451%0.513SS*.  trans-89.1-12.6-178.258.5-5.8000113.6R163R163-D165 HydrophobicContact CB-CB 4.33Å; R163-D165 WeakPolarHBondContact CB-OD1 3.4Å; R163-D165 VanDerWaalsContact CD-OD2 3.3Å; R163-D165 WeakPolarHBondContact CD-OD2 3.39Å; R163-D165 PolarHBondContact O-N 3.4Å
166G93.5Very high95.1Very high11 Ų11112.1 Ų112.111%0.11353%0.526CS..SBendtrans-89.3168.7-179.700000113.9W168G166-W168 PolarHBondContact O-N 3.37Å
167P95.8Very high94.9Very high108 Ų108116.5 Ų116.570%0.70154%0.543SS*.SBendtrans-70.8-14.9175.330.4-36.3000113.3
168W92.6Very high94.8Very high124 Ų124118.1 Ų118.147%0.4756%0.558SS.*SBendtrans-97.8148.7175.2-65.5-15.2000110.5R157 M160 G166 Y170R157-W168 HydrophobicContact CG-CE3 3.87Å; R157-W168 HydrophobicContact CG-CZ3 3.67Å; M160-W168 HydrophobicContact SD-CB 4.12Å; M160-W168 HydrophobicContact SD-CD2 4.34Å; M160-W168 HydrophobicContact SD-CE3 3.98Å; M160-W168 HydrophobicContact SD-CG 4.42Å; G166-W168 PolarHBondContact O-N 3.37Å; W168-Y170 PolarHBondContact O-N 3.31Å
169Y92.9Very high94.6Very high73 Ų73116.8 Ų116.829%0.28656%0.56SS.*SBendtrans62.222.2-173.3-52.4-72.8000114.4M160 R161 Y171M160-Y169 HydrophobicContact CB-CD2 4.46Å; R161-Y169 HydrophobicContact CB-CD2 3.94Å; R161-Y169 HydrophobicContact CB-CE2 4.05Å; R161-Y169 HydrophobicContact CB-CG 4.41Å; R161-Y169 PolarHBondContact NH2-OH 3.49Å; Y169-Y171 WeakPolarHBondContact O-CD2 3.36Å; Y169-Y171 PolarHBondContact O-N 3.29Å
170Y94.7Very high94.4Very high156 Ų156118.9 Ų118.961%0.61257%0.571SS**  trans-72.5112.7164.8-176.2-100.9000108.8W168 E172W168-Y170 PolarHBondContact O-N 3.31Å; Y170-E172 HydrophobicContact CD1-CG 4.3Å; Y170-E172 HydrophobicContact CE1-CG 4.03Å
171Y94.1Very high94.1Very high183 Ų183124.9 Ų124.972%0.71860%0.599SS**PPolyproline II helixtrans-95.6119172-61.4-72.4000107.8Y169 T173Y169-Y171 WeakPolarHBondContact O-CD2 3.36Å; Y169-Y171 PolarHBondContact O-N 3.29Å; Y171-T173 PolarHBondContact O-N 3.33Å
172E93.1Very high93.9Very high180 Ų180119.7 Ų119.784%0.84159%0.588SS**PPolyproline II helixtrans-59.2128.9-177.1-66.6175.2-179.800110.9Y170Y170-E172 HydrophobicContact CD1-CG 4.3Å; Y170-E172 HydrophobicContact CE1-CG 4.03Å
173T94.1Very high93.7Very high110 Ų110118.9 Ų118.968%0.67559%0.594SS**PPolyproline II helixtrans-92.7166.9170.856.60000110.1Y171 D175Y171-T173 PolarHBondContact O-N 3.33Å; T173-D175 PolarHBondContact O-N 3.23Å
174I95.7Very high93.5Very high145 Ų145115.3 Ų115.374%0.74458%0.582SS**PPolyproline II helixtrans-54.2129.3174.1-59.5176.2000108.7L178I174-L178 HydrophobicContact CG2-CD1 3.79Å
175D95.6Very high93.3Very high87 Ų87118.5 Ų118.547%0.46561%0.605SS.*PPolyproline II helixtrans-67.5136.9178.9-167.46.2000110.4T173 E177 L178T173-D175 PolarHBondContact O-N 3.23Å; D175-E177 PolarHBondContact O-N 3.3Å; D175-L178 PolarHBondContact O-N 3.25Å
176K94.6Very high93.1Very high152 Ų152116.9 Ų116.966%0.66160%0.599SS**G310 helixtrans-64.2-24.7179.867.5177.2-175.9176.20111.9L178 I179K176-L178 PolarHBondContact O-N 3.32Å; K176-I179 VanDerWaalsContact O-CB 3.31Å; K176-I179 WeakPolarHBondContact O-CB 3.33Å; K176-I179 WeakPolarHBondContact O-CG1 3.31Å; K176-I179 PolarHBondContact O-N 3.38Å
177E94.4Very high92.6Very high156 Ų156122.5 Ų122.573%0.72963%0.633SS**G310 helixtrans-67-16.8-178-60.6-167.6172.400113D175 I179D175-E177 PolarHBondContact O-N 3.3Å; E177-I179 PolarHBondContact O-N 3.04Å
178L94.1Very high92Very high133 Ų133124.4 Ų124.470%0.69664%0.638SS**G310 helixtrans-73.9-11.2173.4-61.7169.9000112.8I174 D175 K176 D180I174-L178 HydrophobicContact CG2-CD1 3.79Å; D175-L178 PolarHBondContact O-N 3.25Å; K176-L178 PolarHBondContact O-N 3.32Å; L178-D180 PolarHBondContact O-N 3.42Å
179I92.6Very high90.7Very high102 Ų102127 Ų12752%0.52366%0.661SS.*SBendtrans-74.4115177.1-59.4171.9000109K176 E177 H181K176-I179 VanDerWaalsContact O-CB 3.31Å; K176-I179 WeakPolarHBondContact O-CB 3.33Å; K176-I179 WeakPolarHBondContact O-CG1 3.31Å; K176-I179 PolarHBondContact O-N 3.38Å; E177-I179 PolarHBondContact O-N 3.04Å; I179-H181 PolarHBondContact O-CD2 3.21Å; I179-H181 PolarHBondContact O-N 3.31Å
180D92.7Very high90.6Very high98 Ų98129.7 Ų129.752%0.52468%0.679SS.*  trans-75.7113.5172.1172.327.9000110.5L178 S182 K184L178-D180 PolarHBondContact O-N 3.42Å; D180-S182 VanDerWaalsContact C-N 3.35Å; D180-S182 WeakPolarHBondContact OD1-CB 3.18Å; D180-S182 PolarHBondContact OD1-N 2.75Å; D180-S182 PolarHBondContact OD1-OG 3.39Å; D180-S182 PolarHBondContact OD2-OG 3.18Å; D180-K184 VanDerWaalsContact CG-NZ 3.32Å; D180-K184 PolarHBondContact O-NZ 2.84Å; D180-K184 IonicContact OD1-NZ 2.87Å; D180-K184 IonicContact OD2-NZ 3.15Å; D180-K184 PolarHBondContact OD2-NZ 2.9Å
181H90.5Very high90.4Very high164 Ų164128.3 Ų128.376%0.75968%0.683SS**  trans-9011.7177.7-64.1-65.5000114.1I179I179-H181 PolarHBondContact O-CD2 3.21Å; I179-H181 PolarHBondContact O-N 3.31Å
182S90.9Very high90.2Very high55 Ų55125.2 Ų125.239%0.38568%0.681SS.*SBendtrans-64.9153174.173.60000112.6D180 K184D180-S182 VanDerWaalsContact C-N 3.35Å; D180-S182 WeakPolarHBondContact OD1-CB 3.18Å; D180-S182 PolarHBondContact OD1-N 2.75Å; D180-S182 PolarHBondContact OD1-OG 3.39Å; D180-S182 PolarHBondContact OD2-OG 3.18Å; S182-K184 PolarHBondContact O-N 2.78Å; S182-K184 PolarHBondContact O-NZ 3.03Å; S182-K184 PolarHBondContact OG-NZ 2.75Å
183P90.8Very high90.1Very high134 Ų134122 Ų12287%0.8767%0.671SS**PPolyproline II helixtrans-57.5125.4174.6-22.633.2000111.5
184K92.6Very high89.8Confident95 Ų95122.8 Ų122.841%0.41367%0.671SS.*PPolyproline II helixtrans-87.3163.2-178.5-58.8-65178.4-92.90111.5D180 S182 T186 N189D180-K184 VanDerWaalsContact CG-NZ 3.32Å; D180-K184 PolarHBondContact O-NZ 2.84Å; D180-K184 IonicContact OD1-NZ 2.87Å; D180-K184 IonicContact OD2-NZ 3.15Å; D180-K184 PolarHBondContact OD2-NZ 2.9Å; S182-K184 PolarHBondContact O-N 2.78Å; S182-K184 PolarHBondContact O-NZ 3.03Å; S182-K184 PolarHBondContact OG-NZ 2.75Å; K184-T186 PolarHBondContact O-N 3.27Å; K184-N189 HydrophobicContact CB-CB 4.48Å
185A90.2Very high89.4Confident111 Ų111121.3 Ų121.392%0.91767%0.666SS**SBendtrans-66.9-21-175.200000114.3
186T89.2Confident89Confident77 Ų77123.7 Ų123.747%0.47268%0.681SS.*SBendtrans-127.3147.5177.756.20000110.5K184 D188 N189K184-T186 PolarHBondContact O-N 3.27Å; T186-D188 VanDerWaalsContact C-N 3.32Å; T186-D188 PolarHBondContact O-N 3.27Å; T186-N189 PolarHBondContact OG1-ND2 2.65Å
187P83.6Confident88.5Confident129 Ų129121.5 Ų121.584%0.83868%0.682SS**SBendtrans-69.7-22.9-173.425.3-33.2000114.7
188D82.8Confident88Confident148 Ų148118.7 Ų118.779%0.79168%0.678SS**  trans-102.979.8179.8-60.9-30000110.8T186T186-D188 VanDerWaalsContact C-N 3.32Å; T186-D188 PolarHBondContact O-N 3.27Å
189N66.6Low87.5Confident178 Ų178117.4 Ų117.495%0.95268%0.677SS**  trans-151.20169-67.8-49.2000112.1K184 T186K184-N189 HydrophobicContact CB-CB 4.48Å; T186-N189 PolarHBondContact OG1-ND2 2.65Å

Retrieved 189 of 189 residues in 634.6 ms (Link to these results)