A0A060Y0R4_ONCMY Loading...

Neuronal vesicle trafficking-associated protein 1

AlphaFold DB , UniProt , Accession A0A060Y0R4, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110528471, Length 182 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
1M39.5Very low41Very low234 Ų234157 Ų157100%1.15384%0.835SS**  0138.10-107.6146.95900108
2V44.7Very low40.5Very low148 Ų148153.4 Ų153.490%0.89782%0.816SS**  trans55.483-169.2-68.50000114.5
3K48.7Very low39.8Very low189 Ų189151.8 Ų151.882%0.82281%0.808SS**  83.188.854.1-158.1169.4-176.6170.50114.4
4L42.9Very low39.3Very low167 Ų167146.9 Ų146.987%0.87480%0.8SS**  trans52.5126.2142.1-82.589.5000121
5G39.5Very low39.5Very low74 Ų74151.1 Ų151.176%0.76381%0.807SS**  trans167.583.7150.300000112.3
6N41.2Very low39.1Very low169 Ų169147.3 Ų147.390%0.90480%0.803SS**  trans-51.7145.9-178.9-92.220.2000114.5
7N48.5Very low39.3Very low150 Ų150146.2 Ų146.280%0.80280%0.801SS**  trans-70.6160.4160.3-74.7-78000111.8
8F38.8Very low39.2Very low193 Ų193144.2 Ų144.285%0.84680%0.8SS**  trans99.9142.2146.6-128.3-99000119.2
9S35.4Very low39.1Very low87 Ų87146.1 Ų146.161%0.60880%0.802SS**  trans84.7117.8154.124.90000120.1
10D32.7Very low39.1Very low141 Ų141146.1 Ų146.175%0.75480%0.801SS**  79.5111.5126.6-73.5-58.5000120.1
11K38.7Very low39.6Very low175 Ų175142.2 Ų142.276%0.76180%0.795SS**  77.3134.8117.8-156-179175.7172.60115.8
12N36Very low39.5Very low114 Ų114140 Ų14061%0.6178%0.779SS**  trans103.5129.8134.2-124.111.9000116.1
13N30.8Very low39.6Very low132 Ų132139.4 Ų139.471%0.70677%0.771SS**  trans68.6107.1135.7-83.4-17.1000116.3
14A33.2Very low39.4Very low84 Ų84135.7 Ų135.769%0.69476%0.764SS**  96.6117.973.100000110.2
15K42.4Very low39.4Very low210 Ų210134.7 Ų134.791%0.91376%0.758SS**  trans67.9103.3155.1-68.6-171.5175.8-176.60118.3
16A32.8Very low40Very low89 Ų89137.1 Ų137.174%0.73676%0.761SS**  trans-150.3110133.500000105.7
17V43.3Very low40.4Very low129 Ų129136.9 Ų136.978%0.78276%0.758SS**  49.4101.994.7-179.30000112
18S36.2Very low40.8Very low110 Ų110136.7 Ų136.777%0.76976%0.756SS**  trans-15398.5154.5-54.40000102.9
19E38.4Very low41.5Very low180 Ų180134.1 Ų134.184%0.84176%0.756SS**  31.280.984.9-64.9-70123.100110.2
20D39.4Very low42.4Very low146 Ų146135 Ų13578%0.78176%0.76SS**  trans-14495.6144.2-148.22.2000108.3F22D20-F22 PolarHBondContact O-N 3.42Å
21G49.8Very low43.1Very low65 Ų65136.8 Ų136.867%0.6777%0.769SS**  trans-78.5109.4170.100000108.5
22F35.8Very low43.8Very low188 Ų188133.7 Ų133.783%0.82576%0.76SS**  trans-142.892.7150.7-95.5-81.8000108.3D20D20-F22 PolarHBondContact O-N 3.42Å
23D46.8Very low44.3Very low135 Ų135132 Ų13272%0.72276%0.762SS**  trans40.3122.5139.2-83.3-30.7000121
24T45Very low45.4Very low112 Ų112129.8 Ų129.869%0.68776%0.757SS**  95.4122.8126.557.80000121
25I43.8Very low46.3Very low145 Ų145133.4 Ų133.474%0.74476%0.759SS**  trans103.7118147.6-57.6135.8000115
26P50.4Low46.5Very low126 Ų126130.2 Ų130.282%0.81875%0.752SS**  trans-76.8130.8-153.628.1-34.5000114.7
27L50.1Low47.1Very low163 Ų163134.4 Ų134.485%0.85376%0.756SS**  trans-68.4133.1164.6-79.481.3000111.6
28I57.7Low47.2Very low146 Ų146137.5 Ų137.575%0.74976%0.759SS**  trans-27.8140.1152.8-62137.5000114
29T52.4Low47.5Very low140 Ų140138 Ų13886%0.85976%0.76SS**  -176.2133.6124.324.10000113.9
30P54.1Low47.6Very low106 Ų106133.9 Ų133.969%0.68876%0.757SS**  trans-99.6146.9176.637.2-30.2000112.4
31L48.3Very low48Very low178 Ų178133.3 Ų133.393%0.93275%0.753SS**  trans-161.9146157.8-143.860.7000117.1
32D54Low47.6Very low110 Ų110137.9 Ų137.959%0.58876%0.762SS**  trans-50.7143.7-177.817929000117.7S34D32-S34 VanDerWaalsContact CG-OG 3.3Å; D32-S34 PolarHBondContact OD1-N 3.31Å; D32-S34 PolarHBondContact OD1-OG 2.99Å; D32-S34 PolarHBondContact OD2-OG 3.1Å
33A45.8Very low48.5Very low79 Ų79136.6 Ų136.665%0.65376%0.756SS**  trans-130.539.4174.900000113Q35A33-Q35 PolarHBondContact O-N 2.64Å
34S54.5Low48.1Very low85 Ų85136.5 Ų136.559%0.59476%0.76SS**THydrogen-bonded Turntrans-52.97.714962.40000114.5D32D32-S34 VanDerWaalsContact CG-OG 3.3Å; D32-S34 PolarHBondContact OD1-N 3.31Å; D32-S34 PolarHBondContact OD1-OG 2.99Å; D32-S34 PolarHBondContact OD2-OG 3.1Å
35Q52.3Low48.1Very low159 Ų159137.1 Ų137.174%0.74376%0.763SS**THydrogen-bonded Turntrans-106.97.3-174.1-65.8-165.128.700116.5A33 Q37A33-Q35 PolarHBondContact O-N 2.64Å; Q35-Q37 VanDerWaalsContact C-N 3.32Å
36L45.7Very low47.7Very low144 Ų144136.1 Ų136.175%0.75476%0.764SS**  trans-105.351.1167.5-69.4169.3000110.8F38L36-F38 VanDerWaalsContact O-CD2 3.27Å; L36-F38 WeakPolarHBondContact O-CD2 3.46Å; L36-F38 PolarHBondContact O-N 2.93Å; L36-F38 VanDerWaalsContact O-N 3.16Å
37Q45Very low47.8Very low176 Ų176140 Ų14082%0.82277%0.768SS**  trans-54.1108.8159.3-174.4160.912.700108.6Q35 P39Q35-Q37 VanDerWaalsContact C-N 3.32Å; Q37-P39 VanDerWaalsContact O-CD 3.29Å; Q37-P39 WeakPolarHBondContact O-CD 2.99Å
38F46.8Very low48Very low194 Ų194138.6 Ų138.685%0.85177%0.766SS**PPolyproline II helixtrans-78118175.7-78.3-93.4000110.2L36L36-F38 VanDerWaalsContact O-CD2 3.27Å; L36-F38 WeakPolarHBondContact O-CD2 3.46Å; L36-F38 PolarHBondContact O-N 2.93Å; L36-F38 VanDerWaalsContact O-N 3.16Å
39P42.5Very low47.7Very low121 Ų121139.8 Ų139.879%0.78677%0.766SS**PPolyproline II helixtrans-87.2149.3161.718-0.4000111.2Q37Q37-P39 VanDerWaalsContact O-CD 3.29Å; Q37-P39 WeakPolarHBondContact O-CD 2.99Å
40A40.3Very low47.3Very low94 Ų94138.6 Ų138.678%0.77776%0.759SS**PPolyproline II helixtrans-49.8131.1-167.500000117.6
41L47.9Very low46.3Very low133 Ų133139.9 Ų139.970%0.69676%0.76SS**  37.8105.2113.3-153.3139.3000116.2K43L41-K43 HydrophobicContact CD2-CD 4.02Å; L41-K43 HydrophobicContact CD2-CG 3.5Å; L41-K43 VanDerWaalsContact CD2-CG 3.5Å
42D39.6Very low45.7Very low162 Ų162141.1 Ų141.187%0.86675%0.753SS**  trans-123.8140.2149-144.9-2.9000111.8
43K54.9Low44.8Very low161 Ų161143 Ų14370%0.776%0.764SS**  trans-93.7-174-160.1-61.6174-178.2176.90110.4L41L41-K43 HydrophobicContact CD2-CD 4.02Å; L41-K43 HydrophobicContact CD2-CG 3.5Å; L41-K43 VanDerWaalsContact CD2-CG 3.5Å
44V39.3Very low44.7Very low132 Ų132142.1 Ų142.180%0.876%0.762SS**  trans98.8101.5170.2-1680000110.3
45V45.4Very low44.1Very low125 Ų125141.8 Ų141.876%0.75877%0.772SS**  -152.9124.773.4161.90000112.2
46V34.5Very low43.5Very low125 Ų125142.3 Ų142.376%0.75878%0.78SS**  trans39.6114.7141.8-164.30000119.5
47K52.8Low43.2Very low207 Ų207142.3 Ų142.390%0.977%0.774SS**  trans-93101.8-175.9-162175.6-173.6177.50109.9K49K47-K49 PolarHBondContact O-N 2.68Å
48T54.9Low43.7Very low133 Ų133143.9 Ų143.982%0.81678%0.778SS**  trans-84.5107.316440.50000109.5T50T48-T50 PolarHBondContact O-N 3.31Å
49K50.2Low43.6Very low171 Ų171140.1 Ų140.174%0.74378%0.776SS**  trans-66.1107.8175.2-177.2-174.1-177.2-176.70109.6K47 D51K47-K49 PolarHBondContact O-N 2.68Å; K49-D51 WeakPolarHBondContact CE-OD2 3.37Å; K49-D51 WeakPolarHBondContact CG-OD2 3.34Å
50T44.7Very low43.6Very low115 Ų115144.9 Ų144.971%0.70678%0.778SS**  trans-125.986.4150.948.50000107.9T48 Y52 K57T48-T50 PolarHBondContact O-N 3.31Å; T50-Y52 PolarHBondContact O-N 3.37Å; T50-K57 PolarHBondContact O-NZ 2.77Å
51D33.6Very low44Very low133 Ų133148.8 Ų148.871%0.71179%0.785SS**  trans-64103.7161.4-69.7-52.5000107.3K49K49-D51 WeakPolarHBondContact CE-OD2 3.37Å; K49-D51 WeakPolarHBondContact CG-OD2 3.34Å
52Y35.8Very low44Very low204 Ų204152.2 Ų152.280%0.879%0.789SS**  trans-112.8102.8155.3-171.1-97.3000105.1T50T50-Y52 PolarHBondContact O-N 3.37Å
53D34.3Very low44.3Very low150 Ų150149.2 Ų149.280%0.80278%0.781SS**  trans-63.8133.3170.2-173.841.1000108.4
54G43.2Very low43.8Very low61 Ų61146 Ų14663%0.62978%0.777SS**SBendcis-140.6154.923.900000116.2
55G43Very low44.2Very low78 Ų78147.1 Ų147.180%0.80477%0.77SS**SBendtrans92.329.9154.100000118.1
56N40.1Very low44.7Very low169 Ų169146.4 Ų146.490%0.90476%0.761SS**  trans62.2125157.4-136.12.4000119.5
57K37.5Very low45.5Very low144 Ų144143.5 Ų143.563%0.62675%0.75SS**  trans-90.1128.2-158.8-62.7168.5178.5167.20113.8T50T50-K57 PolarHBondContact O-NZ 2.77Å
58K55.5Low45.4Very low210 Ų210139.5 Ų139.591%0.91374%0.735SS**  36.298.4121-149.1174-170.1176.80118.2
59S45.2Very low45.2Very low115 Ų115140.7 Ų140.780%0.80473%0.729SS**  trans-158.754.3153.7710000115.2
60R42.7Very low45.4Very low221 Ų221134.4 Ų134.483%0.83471%0.707SS**  trans-134.5111.9140.3-71.2-167.2-163.5-145.15.5107.1R62R60-R62 PolarHBondContact O-N 3.27Å
61L48.6Very low45.8Very low176 Ų176134 Ų13492%0.92170%0.699SS**  trans-55.677.1143.1-80.385.2000106.7S63L61-S63 VanDerWaalsContact C-N 3.25Å; L61-S63 PolarHBondContact O-N 2.67Å
62R48.3Very low46.7Very low204 Ų204131.1 Ų131.177%0.7769%0.69SS**  trans-83.791.6154.7-167.286-172.3-165.95.5102.6R60 P64R60-R62 PolarHBondContact O-N 3.27Å; R62-P64 WeakPolarHBondContact O-CD 3.26Å
63S45.8Very low47.6Very low99 Ų99126.4 Ų126.469%0.69268%0.677SS**  trans-41.5108.3168-42.60000107.7L61 K65L61-S63 VanDerWaalsContact C-N 3.25Å; L61-S63 PolarHBondContact O-N 2.67Å; S63-K65 PolarHBondContact O-N 2.98Å
64P44.8Very low48.8Very low95 Ų95124 Ų12462%0.61766%0.663SS**  trans-72.7126.8170.54.312.9000104R62 I66R62-P64 WeakPolarHBondContact O-CD 3.26Å; P64-I66 HydrophobicContact CB-CD1 4.23Å; P64-I66 HydrophobicContact CB-CG1 3.97Å; P64-I66 HydrophobicContact CG-CD1 4Å; P64-I66 HydrophobicContact CG-CG1 4.31Å; P64-I66 PolarHBondContact O-N 3.33Å
65K47.8Very low49.4Very low154 Ų154127.7 Ų127.767%0.6766%0.664SS**  trans-57.977.8166.4-86.7-177.2155.4-155.50108.5S63 A67 E68S63-K65 PolarHBondContact O-N 2.98Å; K65-A67 PolarHBondContact O-N 3.43Å; K65-E68 IonicContact NZ-OE1 2.82Å; K65-E68 PolarHBondContact NZ-OE1 3.49Å
66I55.2Low50.1Low110 Ų110126.6 Ų126.656%0.56465%0.653SS**THydrogen-bonded Turntrans-78.5-8.7176.3-67.1164.7000110P64 E68 S70P64-I66 HydrophobicContact CB-CD1 4.23Å; P64-I66 HydrophobicContact CB-CG1 3.97Å; P64-I66 HydrophobicContact CG-CD1 4Å; P64-I66 HydrophobicContact CG-CG1 4.31Å; P64-I66 PolarHBondContact O-N 3.33Å; I66-E68 VanDerWaalsContact C-N 3.33Å; I66-E68 PolarHBondContact O-N 2.82Å; I66-S70 VanDerWaalsContact O-CB 3.28Å; I66-S70 WeakPolarHBondContact O-CB 3.43Å; I66-S70 PolarHBondContact O-N 3.49Å; I66-S70 PolarHBondContact O-OG 2.83Å
67A52.4Low50.9Low64 Ų64121.2 Ų121.253%0.52963%0.626SS.*Hα-helixtrans-64.3-33.1178.800000113.1K65 S70 I71K65-A67 PolarHBondContact O-N 3.43Å; A67-S70 PolarHBondContact O-OG 3.44Å; A67-I71 WeakPolarHBondContact O-CD1 3.37Å; A67-I71 WeakPolarHBondContact O-CG1 2.89Å
68E51Low51.9Low123 Ų123116.5 Ų116.558%0.57561%0.611SS**Hα-helixtrans-89.7-28.1-172.9-66.7167.9-15500113.2K65 I66K65-E68 IonicContact NZ-OE1 2.82Å; K65-E68 PolarHBondContact NZ-OE1 3.49Å; I66-E68 VanDerWaalsContact C-N 3.33Å; I66-E68 PolarHBondContact O-N 2.82Å
69F50.6Low52.5Low158 Ų158113.9 Ų113.969%0.69360%0.602SS**Hα-helixtrans-89.3-25176.8-87.8-81.7000113.8S72 I73F69-S72 PolarHBondContact O-OG 3.38Å; F69-I73 WeakPolarHBondContact O-CD1 3.15Å; F69-I73 WeakPolarHBondContact O-CG1 3.08Å; F69-I73 PolarHBondContact O-N 2.69Å
70S53.1Low53.6Low40 Ų40117.7 Ų117.728%0.2860%0.599SS.*Hα-helixtrans-71-37.8175.856.10000111.4I66 A67 S72 I73 I74I66-S70 VanDerWaalsContact O-CB 3.28Å; I66-S70 WeakPolarHBondContact O-CB 3.43Å; I66-S70 PolarHBondContact O-N 3.49Å; I66-S70 PolarHBondContact O-OG 2.83Å; A67-S70 PolarHBondContact O-OG 3.44Å; S70-S72 PolarHBondContact O-N 3.18Å; S70-I73 PolarHBondContact O-N 2.82Å; S70-I74 WeakPolarHBondContact O-CB 3.08Å; S70-I74 WeakPolarHBondContact O-CD1 3.17Å; S70-I74 WeakPolarHBondContact O-CG1 3.14Å; S70-I74 PolarHBondContact O-N 2.67Å
71I53.2Low55.1Low106 Ų106111.7 Ų111.754%0.54458%0.583SS.*Hα-helixtrans-65.3-40.2-177.6-62.3164.4000111.8A67 I74 E75A67-I71 WeakPolarHBondContact O-CD1 3.37Å; A67-I71 WeakPolarHBondContact O-CG1 2.89Å; I71-I74 PolarHBondContact O-N 3.34Å; I71-E75 WeakPolarHBondContact O-CB 3.18Å; I71-E75 PolarHBondContact O-N 2.74Å
72S53.8Low56.8Low73 Ų73110.2 Ų110.251%0.5157%0.569SS.*Hα-helixtrans-75.6-32.5-17958.20000113.9F69 S70 G76F69-S72 PolarHBondContact O-OG 3.38Å; S70-S72 PolarHBondContact O-N 3.18Å; S72-G76 PolarHBondContact O-N 2.9Å
73I54.2Low58.7Low104 Ų104104.7 Ų104.753%0.53356%0.557SS.*Hα-helixtrans-74-36.5171.8-59.8170.8000109.7F69 S70 V77F69-I73 WeakPolarHBondContact O-CD1 3.15Å; F69-I73 WeakPolarHBondContact O-CG1 3.08Å; F69-I73 PolarHBondContact O-N 2.69Å; S70-I73 PolarHBondContact O-N 2.82Å; I73-V77 HydrophobicContact CG2-CG2 3.86Å; I73-V77 WeakPolarHBondContact O-CB 3.28Å; I73-V77 WeakPolarHBondContact O-CG2 3.25Å; I73-V77 PolarHBondContact O-N 2.7Å
74I59Low60.7Low101 Ų101103.4 Ų103.452%0.51855%0.546SS..Hα-helixtrans-68.6-40.5175.2-66.9160.7000110.1S70 I71 S78S70-I74 WeakPolarHBondContact O-CB 3.08Å; S70-I74 WeakPolarHBondContact O-CD1 3.17Å; S70-I74 WeakPolarHBondContact O-CG1 3.14Å; S70-I74 PolarHBondContact O-N 2.67Å; I71-I74 PolarHBondContact O-N 3.34Å; I74-S78 WeakPolarHBondContact O-CA 3.44Å; I74-S78 WeakPolarHBondContact O-CB 2.99Å; I74-S78 PolarHBondContact O-N 2.86Å; I74-S78 PolarHBondContact O-OG 3.3Å
75E56.4Low62.7Low137 Ų137104.5 Ų104.564%0.6455%0.546SS*.Hα-helixtrans-64.3-49.1-178.9-15573-150.400111.8I71 S78I71-E75 WeakPolarHBondContact O-CB 3.18Å; I71-E75 PolarHBondContact O-N 2.74Å; E75-S78 PolarHBondContact O-OG 3.42Å
76G56.7Low64.8Low55 Ų55102.5 Ų102.557%0.56754%0.542SS*.Hα-helixtrans-79.4-23.8-178.500000115.2S72S72-G76 PolarHBondContact O-N 2.9Å
77V56.5Low66.7Low57 Ų57100.9 Ų100.935%0.34554%0.537SS..Hα-helixtrans-96.8-12.2175-1600000110.3I73 E79 R80 L81I73-V77 HydrophobicContact CG2-CG2 3.86Å; I73-V77 WeakPolarHBondContact O-CB 3.28Å; I73-V77 WeakPolarHBondContact O-CG2 3.25Å; I73-V77 PolarHBondContact O-N 2.7Å; V77-E79 VanDerWaalsContact C-N 3.33Å; V77-E79 PolarHBondContact O-N 3.41Å; V77-R80 PolarHBondContact O-N 3.5Å; V77-L81 HydrophobicContact CB-CD1 3.91Å; V77-L81 HydrophobicContact CB-CG 4.26Å; V77-L81 HydrophobicContact CG1-CD1 3.51Å; V77-L81 HydrophobicContact CG1-CD2 4.2Å; V77-L81 HydrophobicContact CG1-CG 3.45Å; V77-L81 VanDerWaalsContact CG1-CG 3.45Å; V77-L81 WeakPolarHBondContact O-CA 3.44Å; V77-L81 WeakPolarHBondContact O-CB 3.21Å; V77-L81 WeakPolarHBondContact O-CG 3.23Å; V77-L81 PolarHBondContact O-N 2.85Å
78S58.5Low68.6Low44 Ų44102.5 Ų102.531%0.30854%0.536SS..Hα-helixtrans-62.3-38.4177.863.70000111.4I74 E75 K82I74-S78 WeakPolarHBondContact O-CA 3.44Å; I74-S78 WeakPolarHBondContact O-CB 2.99Å; I74-S78 PolarHBondContact O-N 2.86Å; I74-S78 PolarHBondContact O-OG 3.3Å; E75-S78 PolarHBondContact O-OG 3.42Å; S78-K82 WeakPolarHBondContact O-CA 2.96Å; S78-K82 WeakPolarHBondContact O-CB 3.39Å; S78-K82 PolarHBondContact O-N 3.29Å
79E67.9Low70.7Confident155 Ų15599.3 Ų99.372%0.72453%0.526SS*.Hα-helixtrans-68.4-43.3-179.5-157.1171.7-159.600110.7V77 V83V77-E79 VanDerWaalsContact C-N 3.33Å; V77-E79 PolarHBondContact O-N 3.41Å; E79-V83 WeakPolarHBondContact O-CG2 3.48Å; E79-V83 PolarHBondContact O-N 2.85Å; E79-V83 VanDerWaalsContact O-N 3.1Å
80R68.4Low72.8Confident195 Ų19594 Ų9474%0.73651%0.512SS*.Hα-helixtrans-72.7-37.6178-59.9-174.4-175.2-102.2-0.7112.6V77 T84V77-R80 PolarHBondContact O-N 3.5Å; R80-T84 VanDerWaalsContact O-CB 3.26Å; R80-T84 WeakPolarHBondContact O-CB 3.21Å; R80-T84 PolarHBondContact O-N 3.36Å; R80-T84 PolarHBondContact O-OG1 3.4Å
81L75.5Confident74.9Confident96 Ų9697 Ų9750%0.50352%0.524SS..Hα-helixtrans-74.7-32175.2-72.4169.8000111.6V77 T84 L85V77-L81 HydrophobicContact CB-CD1 3.91Å; V77-L81 HydrophobicContact CB-CG 4.26Å; V77-L81 HydrophobicContact CG1-CD1 3.51Å; V77-L81 HydrophobicContact CG1-CD2 4.2Å; V77-L81 HydrophobicContact CG1-CG 3.45Å; V77-L81 VanDerWaalsContact CG1-CG 3.45Å; V77-L81 WeakPolarHBondContact O-CA 3.44Å; V77-L81 WeakPolarHBondContact O-CB 3.21Å; V77-L81 WeakPolarHBondContact O-CG 3.23Å; V77-L81 PolarHBondContact O-N 2.85Å; L81-T84 PolarHBondContact O-N 2.87Å; L81-L85 WeakPolarHBondContact O-CA 3.04Å; L81-L85 WeakPolarHBondContact O-CB 3.2Å; L81-L85 PolarHBondContact O-N 2.68Å
82K83.1Confident76.9Confident144 Ų14494.4 Ų94.463%0.62652%0.518SS*.Hα-helixtrans-70.8-42.4177.3-170.7171.3-173.5172.20109.5S78 L86S78-K82 WeakPolarHBondContact O-CA 2.96Å; S78-K82 WeakPolarHBondContact O-CB 3.39Å; S78-K82 PolarHBondContact O-N 3.29Å; K82-L86 HydrophobicContact CG-CD1 4.46Å; K82-L86 VanDerWaalsContact O-CB 3.23Å; K82-L86 WeakPolarHBondContact O-CB 3.12Å; K82-L86 WeakPolarHBondContact O-CG 3.27Å; K82-L86 PolarHBondContact O-N 2.7Å
83V88Confident79Confident88 Ų8897.3 Ų97.353%0.53352%0.522SS..Hα-helixtrans-62.2-49.1169.1176.20000110.7E79 L85 L86 V87E79-V83 WeakPolarHBondContact O-CG2 3.48Å; E79-V83 PolarHBondContact O-N 2.85Å; E79-V83 VanDerWaalsContact O-N 3.1Å; V83-L85 PolarHBondContact O-N 3.42Å; V83-L86 PolarHBondContact O-N 3.5Å; V83-V87 HydrophobicContact CG1-CG2 4.33Å; V83-V87 WeakPolarHBondContact O-CB 3.33Å; V83-V87 WeakPolarHBondContact O-CG2 3.29Å; V83-V87 PolarHBondContact O-N 3.45Å
84T88.4Confident81Confident73 Ų7397.7 Ų97.745%0.44852%0.524SS..Hα-helixtrans-63.2-39.8-179.1-55.80000112.3R80 L81 V87 I88R80-T84 VanDerWaalsContact O-CB 3.26Å; R80-T84 WeakPolarHBondContact O-CB 3.21Å; R80-T84 PolarHBondContact O-N 3.36Å; R80-T84 PolarHBondContact O-OG1 3.4Å; L81-T84 PolarHBondContact O-N 2.87Å; T84-V87 PolarHBondContact O-N 3.33Å; T84-I88 HydrophobicContact CG2-CD1 3.89Å; T84-I88 WeakPolarHBondContact O-CB 3.49Å; T84-I88 WeakPolarHBondContact O-CD1 3.35Å; T84-I88 WeakPolarHBondContact O-CG1 2.84Å; T84-I88 PolarHBondContact O-N 2.84Å
85L87.8Confident82.7Confident117 Ų11797.6 Ų97.661%0.61353%0.529SS*.Hα-helixtrans-68.9-41.9177.1-177.967.2000110.9L81 V83 V87 I88 C89L81-L85 WeakPolarHBondContact O-CA 3.04Å; L81-L85 WeakPolarHBondContact O-CB 3.2Å; L81-L85 PolarHBondContact O-N 2.68Å; V83-L85 PolarHBondContact O-N 3.42Å; L85-V87 VanDerWaalsContact C-N 3.31Å; L85-V87 PolarHBondContact O-N 3.17Å; L85-I88 PolarHBondContact O-N 3.33Å; L85-C89 WeakPolarHBondContact O-CB 3.26Å; L85-C89 PolarHBondContact O-N 2.96Å
86L91.9Very high84.5Confident113 Ų11394.3 Ų94.359%0.59252%0.52SS*.Hα-helixtrans-62.6-39.8173.2-73.9173.5000111.2K82 V83 C89 A90K82-L86 HydrophobicContact CG-CD1 4.46Å; K82-L86 VanDerWaalsContact O-CB 3.23Å; K82-L86 WeakPolarHBondContact O-CB 3.12Å; K82-L86 WeakPolarHBondContact O-CG 3.27Å; K82-L86 PolarHBondContact O-N 2.7Å; V83-L86 PolarHBondContact O-N 3.5Å; L86-C89 PolarHBondContact O-N 3.36Å; L86-A90 VanDerWaalsContact O-CB 3.26Å; L86-A90 WeakPolarHBondContact O-CB 3.48Å; L86-A90 PolarHBondContact O-N 3.34Å
87V93.7Very high86.3Confident76 Ų7695.8 Ų95.846%0.46152%0.518SS..Hα-helixtrans-64.8-48.1175.4170.50000110.9V83 T84 L85 C89 A90 L91V83-V87 HydrophobicContact CG1-CG2 4.33Å; V83-V87 WeakPolarHBondContact O-CB 3.33Å; V83-V87 WeakPolarHBondContact O-CG2 3.29Å; V83-V87 PolarHBondContact O-N 3.45Å; T84-V87 PolarHBondContact O-N 3.33Å; L85-V87 VanDerWaalsContact C-N 3.31Å; L85-V87 PolarHBondContact O-N 3.17Å; V87-C89 VanDerWaalsContact C-N 3.31Å; V87-C89 PolarHBondContact O-N 3.42Å; V87-A90 PolarHBondContact O-N 3.16Å; V87-L91 HydrophobicContact CG1-CD1 3.99Å; V87-L91 HydrophobicContact CG1-CG 4.4Å; V87-L91 WeakPolarHBondContact O-CB 2.88Å; V87-L91 VanDerWaalsContact O-CG 3.25Å; V87-L91 WeakPolarHBondContact O-CG 3.07Å; V87-L91 PolarHBondContact O-N 3.32Å
88I93.7Very high88.1Confident98 Ų9897.5 Ų97.550%0.50353%0.528SS..Hα-helixtrans-61.6-42176.7-68.1163.1000110.7T84 L85 L91 A92T84-I88 HydrophobicContact CG2-CD1 3.89Å; T84-I88 WeakPolarHBondContact O-CB 3.49Å; T84-I88 WeakPolarHBondContact O-CD1 3.35Å; T84-I88 WeakPolarHBondContact O-CG1 2.84Å; T84-I88 PolarHBondContact O-N 2.84Å; L85-I88 PolarHBondContact O-N 3.33Å; I88-L91 PolarHBondContact O-N 3.44Å; I88-A92 WeakPolarHBondContact O-CB 3.3Å; I88-A92 PolarHBondContact O-N 3.26Å
89C93.9Very high89.6Confident55 Ų55101.8 Ų101.837%0.37254%0.542SS..Hα-helixtrans-63.1-45.7177.8-164.10000110.9L85 L86 V87 A92 F93L85-C89 WeakPolarHBondContact O-CB 3.26Å; L85-C89 PolarHBondContact O-N 2.96Å; L86-C89 PolarHBondContact O-N 3.36Å; V87-C89 VanDerWaalsContact C-N 3.31Å; V87-C89 PolarHBondContact O-N 3.42Å; C89-A92 PolarHBondContact O-N 3.47Å; C89-F93 WeakPolarHBondContact O-CD2 3.11Å; C89-F93 PolarHBondContact O-N 2.87Å; C89-F93 WeakPolarHBondContact SG-CE2 3.08Å
90A95.5Very high90.6Very high48 Ų4899.4 Ų99.440%0.39753%0.533SS..Hα-helixtrans-62.2-43.5175.100000112.1L86 V87 F93 L94L86-A90 VanDerWaalsContact O-CB 3.26Å; L86-A90 WeakPolarHBondContact O-CB 3.48Å; L86-A90 PolarHBondContact O-N 3.34Å; V87-A90 PolarHBondContact O-N 3.16Å; A90-F93 PolarHBondContact O-N 2.83Å; A90-L94 WeakPolarHBondContact O-CB 3.34Å; A90-L94 VanDerWaalsContact O-CG 3.3Å; A90-L94 WeakPolarHBondContact O-CG 3.22Å; A90-L94 PolarHBondContact O-N 2.89Å
91L96.2Very high91.7Very high102 Ų10294.1 Ų94.153%0.53452%0.522SS..Hα-helixtrans-62.6-43.7175.4-70.7173.2000111.6V87 I88 L94 V95V87-L91 HydrophobicContact CG1-CD1 3.99Å; V87-L91 HydrophobicContact CG1-CG 4.4Å; V87-L91 WeakPolarHBondContact O-CB 2.88Å; V87-L91 VanDerWaalsContact O-CG 3.25Å; V87-L91 WeakPolarHBondContact O-CG 3.07Å; V87-L91 PolarHBondContact O-N 3.32Å; I88-L91 PolarHBondContact O-N 3.44Å; L91-L94 PolarHBondContact O-N 2.81Å; L91-V95 WeakPolarHBondContact O-CG2 3.35Å; L91-V95 PolarHBondContact O-N 3.44Å
92A96.1Very high92.2Very high51 Ų5192.5 Ų92.542%0.42152%0.516SS..Hα-helixtrans-61.4-44.6175.500000111.4I88 C89 V95 C96I88-A92 WeakPolarHBondContact O-CB 3.3Å; I88-A92 PolarHBondContact O-N 3.26Å; C89-A92 PolarHBondContact O-N 3.47Å; A92-V95 PolarHBondContact O-N 3.44Å; A92-C96 WeakPolarHBondContact O-CB 3.29Å; A92-C96 PolarHBondContact O-N 2.77Å; A92-C96 PolarHBondContact O-SG 2.8Å
93F97.3Very high92Very high135 Ų13591.1 Ų91.159%0.59251%0.508SS*.Hα-helixtrans-63.8-41.6175.5-78.8-59.7000112.8C89 A90 C96 V97C89-F93 WeakPolarHBondContact O-CD2 3.11Å; C89-F93 PolarHBondContact O-N 2.87Å; C89-F93 WeakPolarHBondContact SG-CE2 3.08Å; A90-F93 PolarHBondContact O-N 2.83Å; F93-C96 PolarHBondContact O-N 3.46Å; F93-V97 VanDerWaalsContact O-CG2 3.3Å; F93-V97 WeakPolarHBondContact O-CG2 3.49Å; F93-V97 PolarHBondContact O-N 3.43Å
94L96.1Very high91.5Very high111 Ų11192.6 Ų92.658%0.58151%0.507SS*.Hα-helixtrans-60.8-46175.8-74.7174000111.4A90 L91 C96 V97 V98A90-L94 WeakPolarHBondContact O-CB 3.34Å; A90-L94 VanDerWaalsContact O-CG 3.3Å; A90-L94 WeakPolarHBondContact O-CG 3.22Å; A90-L94 PolarHBondContact O-N 2.89Å; L91-L94 PolarHBondContact O-N 2.81Å; L94-C96 VanDerWaalsContact C-N 3.35Å; L94-C96 PolarHBondContact O-N 3.26Å; L94-V97 PolarHBondContact O-N 3.41Å; L94-V98 WeakPolarHBondContact O-CB 3.23Å; L94-V98 VanDerWaalsContact O-CG2 3.29Å; L94-V98 WeakPolarHBondContact O-CG2 3.31Å; L94-V98 PolarHBondContact O-N 3.49Å
95V95.5Very high90.8Very high100 Ų10093.4 Ų93.461%0.60651%0.512SS*.Hα-helixtrans-62.4-42.7174.9174.70000110.8L91 A92 V97 V98 F99L91-V95 WeakPolarHBondContact O-CG2 3.35Å; L91-V95 PolarHBondContact O-N 3.44Å; A92-V95 PolarHBondContact O-N 3.44Å; V95-V97 PolarHBondContact O-N 2.91Å; V95-V98 PolarHBondContact O-N 3.31Å; V95-F99 VanDerWaalsContact O-CB 3.23Å; V95-F99 WeakPolarHBondContact O-CB 3.33Å; V95-F99 PolarHBondContact O-N 3.26Å
96C94.4Very high89.7Confident68 Ų6896 Ų9646%0.45952%0.515SS..Hα-helixtrans-61.5-42.6175.8-75.10000112.3A92 F93 L94 F99 L100A92-C96 WeakPolarHBondContact O-CB 3.29Å; A92-C96 PolarHBondContact O-N 2.77Å; A92-C96 PolarHBondContact O-SG 2.8Å; F93-C96 PolarHBondContact O-N 3.46Å; L94-C96 VanDerWaalsContact C-N 3.35Å; L94-C96 PolarHBondContact O-N 3.26Å; C96-F99 PolarHBondContact O-N 2.85Å; C96-L100 VanDerWaalsContact O-CB 3.31Å; C96-L100 WeakPolarHBondContact O-CB 3.3Å; C96-L100 WeakPolarHBondContact O-CG 3.18Å; C96-L100 PolarHBondContact O-N 3.15Å
97V94.6Very high88Confident86 Ų8693.8 Ų93.852%0.52150%0.502SS..Hα-helixtrans-67-45.5177.8171.10000110.6F93 L94 V95 F99 L100 V101F93-V97 VanDerWaalsContact O-CG2 3.3Å; F93-V97 WeakPolarHBondContact O-CG2 3.49Å; F93-V97 PolarHBondContact O-N 3.43Å; L94-V97 PolarHBondContact O-N 3.41Å; V95-V97 PolarHBondContact O-N 2.91Å; V97-F99 VanDerWaalsContact C-N 3.33Å; V97-F99 PolarHBondContact O-N 3.21Å; V97-L100 PolarHBondContact O-N 3.47Å; V97-V101 HydrophobicContact CG1-CG2 4.45Å; V97-V101 VanDerWaalsContact O-CG2 3.32Å; V97-V101 WeakPolarHBondContact O-CG2 3.26Å; V97-V101 PolarHBondContact O-N 2.79Å
98V93.6Very high86.1Confident93 Ų9397.5 Ų97.556%0.56451%0.508SS*.Hα-helixtrans-60-45.81751720000110.2L94 V95 L100 V101 V102L94-V98 WeakPolarHBondContact O-CB 3.23Å; L94-V98 VanDerWaalsContact O-CG2 3.29Å; L94-V98 WeakPolarHBondContact O-CG2 3.31Å; L94-V98 PolarHBondContact O-N 3.49Å; V95-V98 PolarHBondContact O-N 3.31Å; V98-L100 VanDerWaalsContact C-N 3.33Å; V98-L100 PolarHBondContact O-N 2.81Å; V98-V101 PolarHBondContact O-N 3.39Å; V98-V102 HydrophobicContact CG1-CG2 4.22Å; V98-V102 WeakPolarHBondContact O-CB 3.35Å; V98-V102 VanDerWaalsContact O-CG2 3.22Å; V98-V102 WeakPolarHBondContact O-CG2 3.19Å; V98-V102 PolarHBondContact O-N 3.5Å
99F90.2Very high84.2Confident134 Ų13499.5 Ų99.559%0.58852%0.516SS*.Hα-helixtrans-63.9-36.7176.2-168.2-94.9000111.7V95 C96 V97 Y103V95-F99 VanDerWaalsContact O-CB 3.23Å; V95-F99 WeakPolarHBondContact O-CB 3.33Å; V95-F99 PolarHBondContact O-N 3.26Å; C96-F99 PolarHBondContact O-N 2.85Å; V97-F99 VanDerWaalsContact C-N 3.33Å; V97-F99 PolarHBondContact O-N 3.21Å; F99-Y103 HydrophobicContact CE1-CD2 4.2Å; F99-Y103 WeakPolarHBondContact O-CA 3.31Å; F99-Y103 WeakPolarHBondContact O-CB 3.32Å; F99-Y103 PolarHBondContact O-N 2.68Å
100L89.6Confident82.3Confident105 Ų105102.2 Ų102.255%0.5552%0.523SS..Hα-helixtrans-70.3-34.6175.4-76.7173.7000112.5C96 V97 V98 K104C96-L100 VanDerWaalsContact O-CB 3.31Å; C96-L100 WeakPolarHBondContact O-CB 3.3Å; C96-L100 WeakPolarHBondContact O-CG 3.18Å; C96-L100 PolarHBondContact O-N 3.15Å; V97-L100 PolarHBondContact O-N 3.47Å; V98-L100 VanDerWaalsContact C-N 3.33Å; V98-L100 PolarHBondContact O-N 2.81Å; L100-K104 WeakPolarHBondContact O-CA 3.2Å; L100-K104 WeakPolarHBondContact O-CB 3.38Å; L100-K104 VanDerWaalsContact O-CG 3.26Å; L100-K104 WeakPolarHBondContact O-CG 3.45Å; L100-K104 PolarHBondContact O-N 2.68Å
101V90.3Very high80.6Confident84 Ų84104.9 Ų104.951%0.50954%0.536SS..Hα-helixtrans-70.2-48.6174171.40000109.7V97 V98 K104 V105V97-V101 HydrophobicContact CG1-CG2 4.45Å; V97-V101 VanDerWaalsContact O-CG2 3.32Å; V97-V101 WeakPolarHBondContact O-CG2 3.26Å; V97-V101 PolarHBondContact O-N 2.79Å; V98-V101 PolarHBondContact O-N 3.39Å; V101-K104 CarbonylContact O-C 3.53Å; V101-K104 PolarHBondContact O-N 3.19Å; V101-V105 HydrophobicContact CG1-CG2 4.41Å; V101-V105 WeakPolarHBondContact O-CB 3.48Å; V101-V105 WeakPolarHBondContact O-CG2 3.08Å; V101-V105 PolarHBondContact O-N 2.84Å
102V85.8Confident78.6Confident62 Ų62100.8 Ų100.838%0.37652%0.516SS..Hα-helixtrans-61-46.7175.3171.80000109.8V98 K104 V105 Y106V98-V102 HydrophobicContact CG1-CG2 4.22Å; V98-V102 WeakPolarHBondContact O-CB 3.35Å; V98-V102 VanDerWaalsContact O-CG2 3.22Å; V98-V102 WeakPolarHBondContact O-CG2 3.19Å; V98-V102 PolarHBondContact O-N 3.5Å; V102-K104 PolarHBondContact O-N 2.73Å; V102-V105 CarbonylContact O-C 3.59Å; V102-V105 PolarHBondContact O-N 3.18Å; V102-V105 VanDerWaalsContact O-N 3.15Å; V102-Y106 HydrophobicContact CG1-CD2 3.55Å; V102-Y106 HydrophobicContact CG1-CE2 4.05Å; V102-Y106 HydrophobicContact CG1-CG 4.33Å; V102-Y106 WeakPolarHBondContact O-CA 3.09Å; V102-Y106 WeakPolarHBondContact O-CB 3.45Å; V102-Y106 PolarHBondContact O-N 2.77Å
103Y80.4Confident76.8Confident114 Ų114102.6 Ų102.645%0.44752%0.523SS..Hα-helixtrans-62.4-41.1174.2-177.9-87.9000111.1F99 V105 Q107F99-Y103 HydrophobicContact CE1-CD2 4.2Å; F99-Y103 WeakPolarHBondContact O-CA 3.31Å; F99-Y103 WeakPolarHBondContact O-CB 3.32Å; F99-Y103 PolarHBondContact O-N 2.68Å; Y103-V105 VanDerWaalsContact C-N 3.29Å; Y103-V105 PolarHBondContact O-N 3.41Å; Y103-Q107 HydrophobicContact CD1-CB 4.31Å; Y103-Q107 HydrophobicContact CD2-CB 4.21Å; Y103-Q107 HydrophobicContact CD2-CG 3.58Å; Y103-Q107 HydrophobicContact CE1-CB 4.19Å; Y103-Q107 HydrophobicContact CE2-CB 4.09Å; Y103-Q107 HydrophobicContact CE2-CG 3.55Å; Y103-Q107 HydrophobicContact CG-CB 4.29Å; Y103-Q107 HydrophobicContact CG-CG 4.07Å; Y103-Q107 VanDerWaalsContact O-CA 3.23Å; Y103-Q107 WeakPolarHBondContact O-CA 3.02Å; Y103-Q107 WeakPolarHBondContact O-CB 3.23Å; Y103-Q107 PolarHBondContact O-N 3.25Å
104K76.9Confident75Confident120 Ų120104.7 Ų104.752%0.52254%0.541SS..Hα-helixtrans-66.2-30.7174.1-87.8-65.8-164.8107.80112.6L100 V101 V102 Y108L100-K104 WeakPolarHBondContact O-CA 3.2Å; L100-K104 WeakPolarHBondContact O-CB 3.38Å; L100-K104 VanDerWaalsContact O-CG 3.26Å; L100-K104 WeakPolarHBondContact O-CG 3.45Å; L100-K104 PolarHBondContact O-N 2.68Å; V101-K104 CarbonylContact O-C 3.53Å; V101-K104 PolarHBondContact O-N 3.19Å; V102-K104 PolarHBondContact O-N 2.73Å; K104-Y108 HydrophobicContact CD-CD2 3.69Å; K104-Y108 HydrophobicContact CD-CE2 3.42Å; K104-Y108 VanDerWaalsContact CD-CE2 3.42Å; K104-Y108 WeakPolarHBondContact O-CB 3.37Å; K104-Y108 WeakPolarHBondContact O-CD2 2.91Å; K104-Y108 PolarHBondContact O-N 3.17Å
105V74Confident73.4Confident90 Ų90101.6 Ų101.655%0.54554%0.536SS..Hα-helixtrans-85.8-48.7-179.8172.90000110.5V101 V102 Y103 E109V101-V105 HydrophobicContact CG1-CG2 4.41Å; V101-V105 WeakPolarHBondContact O-CB 3.48Å; V101-V105 WeakPolarHBondContact O-CG2 3.08Å; V101-V105 PolarHBondContact O-N 2.84Å; V102-V105 CarbonylContact O-C 3.59Å; V102-V105 PolarHBondContact O-N 3.18Å; V102-V105 VanDerWaalsContact O-N 3.15Å; Y103-V105 VanDerWaalsContact C-N 3.29Å; Y103-V105 PolarHBondContact O-N 3.41Å; V105-E109 WeakPolarHBondContact O-CB 3.16Å; V105-E109 PolarHBondContact O-N 3.33Å; V105-E109 VanDerWaalsContact O-N 3.17Å
106Y64.4Low71.7Confident170 Ų170101.2 Ų101.267%0.66753%0.526SS*.Hα-helixtrans-77.1-27.4179.5-86.5-93.5000114.6V102 E109 Q110V102-Y106 HydrophobicContact CG1-CD2 3.55Å; V102-Y106 HydrophobicContact CG1-CE2 4.05Å; V102-Y106 HydrophobicContact CG1-CG 4.33Å; V102-Y106 WeakPolarHBondContact O-CA 3.09Å; V102-Y106 WeakPolarHBondContact O-CB 3.45Å; V102-Y106 PolarHBondContact O-N 2.77Å; Y106-E109 CarbonylContact O-C 3.07Å; Y106-Q110 PolarHBondContact O-N 2.75Å
107Q56.8Low70.2Confident68 Ų68103.3 Ų103.332%0.31853%0.53SS..THydrogen-bonded Turntrans-103.7-4.7175.9-59-101.298.800112.9Y103 Q110Y103-Q107 HydrophobicContact CD1-CB 4.31Å; Y103-Q107 HydrophobicContact CD2-CB 4.21Å; Y103-Q107 HydrophobicContact CD2-CG 3.58Å; Y103-Q107 HydrophobicContact CE1-CB 4.19Å; Y103-Q107 HydrophobicContact CE2-CB 4.09Å; Y103-Q107 HydrophobicContact CE2-CG 3.55Å; Y103-Q107 HydrophobicContact CG-CB 4.29Å; Y103-Q107 HydrophobicContact CG-CG 4.07Å; Y103-Q107 VanDerWaalsContact O-CA 3.23Å; Y103-Q107 WeakPolarHBondContact O-CA 3.02Å; Y103-Q107 WeakPolarHBondContact O-CB 3.23Å; Y103-Q107 PolarHBondContact O-N 3.25Å; Q107-Q110 HydrophobicContact CB-CB 4.47Å; Q107-Q110 WeakPolarHBondContact O-CB 3.47Å; Q107-Q110 PolarHBondContact O-N 3.44Å; Q107-Q110 VanDerWaalsContact OE1-CG 3.24Å
108Y53.3Low68.8Low153 Ų153105.6 Ų105.660%0.653%0.531SS*.THydrogen-bonded Turntrans-77.7-33.3154.2-96.6-108.1000111.5K104 Q110K104-Y108 HydrophobicContact CD-CD2 3.69Å; K104-Y108 HydrophobicContact CD-CE2 3.42Å; K104-Y108 VanDerWaalsContact CD-CE2 3.42Å; K104-Y108 WeakPolarHBondContact O-CB 3.37Å; K104-Y108 WeakPolarHBondContact O-CD2 2.91Å; K104-Y108 PolarHBondContact O-N 3.17Å; Y108-Q110 PolarHBondContact O-N 3.27Å
109E52.7Low67.3Low141 Ų141104.9 Ų104.966%0.65953%0.526SS*.THydrogen-bonded Turntrans-89.841.7161.2-72.3-72.3142.400109.4V105 Y106 P111V105-E109 WeakPolarHBondContact O-CB 3.16Å; V105-E109 PolarHBondContact O-N 3.33Å; V105-E109 VanDerWaalsContact O-N 3.17Å; Y106-E109 CarbonylContact O-C 3.07Å; E109-P111 VanDerWaalsContact C-N 3.33Å; E109-P111 WeakPolarHBondContact O-CD 3.06Å
110Q55.5Low66Low111 Ų111107.6 Ų107.652%0.51954%0.541SS..  trans-63.5105.8168.7-161.4165.75.400104.7Y106 Q107 Y108 C112Y106-Q110 PolarHBondContact O-N 2.75Å; Q107-Q110 HydrophobicContact CB-CB 4.47Å; Q107-Q110 WeakPolarHBondContact O-CB 3.47Å; Q107-Q110 PolarHBondContact O-N 3.44Å; Q107-Q110 VanDerWaalsContact OE1-CG 3.24Å; Y108-Q110 PolarHBondContact O-N 3.27Å; Q110-C112 PolarHBondContact O-N 3.01Å
111P59.4Low64.8Low105 Ų105104.9 Ų104.968%0.68254%0.538SS*.PPolyproline II helixtrans-64.1119.8-170.527.3-29.4000103.8E109E109-P111 VanDerWaalsContact C-N 3.33Å; E109-P111 WeakPolarHBondContact O-CD 3.06Å
112C53.4Low63.6Low16 Ų16110 Ų11011%0.10855%0.548CS..PPolyproline II helixtrans-47.5133.7176.6-58.10000107.5Q110 D114 F116 C123Q110-C112 PolarHBondContact O-N 3.01Å; C112-D114 PolarHBondContact O-N 3.48Å; C112-F116 HydrophobicContact CB-CB 3.4Å; C112-F116 WeakPolarHBondContact CB-O 3.33Å; C112-C123 HydrophobicContact CB-CB 3.79Å; C112-C123 WeakPolarHBondContact CB-SG 3.07Å; C112-C123 VanDerWaalsContact SG-CA 3.52Å; C112-C123 WeakPolarHBondContact SG-CB 3.2Å; C112-C123 CovalentContact SG-SG 2.05Å; C112-C123 PolarHBondContact SG-SG 3.19Å
113P59.7Low62.6Low89 Ų89110.1 Ų110.158%0.57855%0.551SS**SBendtrans-51144-173.419.3-31.8000110.2G115 F116P113-G115 PolarHBondContact O-N 3.47Å; P113-F116 HydrophobicContact CG-CD2 4.06Å; P113-F116 HydrophobicContact CG-CE2 4.49Å; P113-F116 WeakPolarHBondContact O-CD2 3.39Å; P113-F116 PolarHBondContact O-N 3.03Å
114D59.4Low61.6Low179 Ų179109 Ų10996%0.95755%0.551SS**THydrogen-bonded Turntrans-41.4114.1-171.7-79.5-43.2000112.1C112C112-D114 PolarHBondContact O-N 3.48Å
115G61Low60.8Low46 Ų46106.6 Ų106.647%0.47455%0.547SS..THydrogen-bonded Turntrans108.87.6-174.700000116.1P113 T126P113-G115 PolarHBondContact O-N 3.47Å; G115-T126 VanDerWaalsContact C-OG1 3.23Å; G115-T126 WeakPolarHBondContact O-CB 3.04Å; G115-T126 PolarHBondContact O-N 3.32Å; G115-T126 PolarHBondContact O-OG1 3.37Å
116F59.7Low60.3Low91 Ų91105.7 Ų105.740%0.39954%0.543SS..EExtended strand (participates in β ladder)trans-123.3140.6172.3-70.8-106.6000110.2C112 P113 C123 M124 P125C112-F116 HydrophobicContact CB-CB 3.4Å; C112-F116 WeakPolarHBondContact CB-O 3.33Å; P113-F116 HydrophobicContact CG-CD2 4.06Å; P113-F116 HydrophobicContact CG-CE2 4.49Å; P113-F116 WeakPolarHBondContact O-CD2 3.39Å; P113-F116 PolarHBondContact O-N 3.03Å; F116-C123 HydrophobicContact CB-CB 4.47Å; F116-M124 CarbonylContact C-O 3.48Å; F116-M124 WeakPolarHBondContact CA-O 3.21Å; F116-M124 WeakPolarHBondContact CB-O 3.13Å; F116-P125 HydrophobicContact CD1-CB 3.86Å; F116-P125 HydrophobicContact CD1-CG 4.43Å; F116-P125 HydrophobicContact CE1-CB 3.53Å; F116-P125 HydrophobicContact CE1-CG 3.98Å; F116-P125 HydrophobicContact CG-CB 4.48Å; F116-P125 HydrophobicContact CZ-CB 3.91Å
117M63.5Low59.8Low113 Ų113101.1 Ų101.156%0.55755%0.547SS*.EExtended strand (participates in β ladder)trans-109.4143.5176.7-50.9-141.9-62.100110.2V119 M124 T126M117-V119 HydrophobicContact CB-CG2 4.41Å; M117-V119 PolarHBondContact O-N 3.15Å; M117-M124 PolarHBondContact N-O 3.12Å; M117-M124 PolarHBondContact O-N 3.25Å; M117-M124 VanDerWaalsContact O-N 3.15Å; M117-T126 HydrophobicContact CG-CG2 4.35Å; M117-T126 WeakPolarHBondContact CG-OG1 3.48Å
118Y64.5Low59.8Low134 Ų134104.5 Ų104.553%0.52556%0.564SS.*EExtended strand (participates in β ladder)trans-81.499.1176.5-167.7-97.8000109.6
119V62.8Low59.8Low78 Ų78107 Ų10747%0.47357%0.574SS.*EExtended strand (participates in β ladder)trans-121.3122.6176.6-178.20000107.9M117 G121 R122M117-V119 HydrophobicContact CB-CG2 4.41Å; M117-V119 PolarHBondContact O-N 3.15Å; V119-G121 PolarHBondContact O-N 2.87Å; V119-R122 PolarHBondContact N-O 3.34Å; V119-R122 PolarHBondContact O-N 3.06Å; V119-R122 VanDerWaalsContact O-O 3.07Å
120Q62.1Low60.1Low190 Ų190102.9 Ų102.989%0.88857%0.569SS**THydrogen-bonded Turntrans57.842.9171.4-155.2175.43.300114.5R122Q120-R122 VanDerWaalsContact C-N 3.28Å; Q120-R122 PolarHBondContact O-N 3.01Å
121G66.4Low59.8Low48 Ų48108.3 Ų108.350%0.49559%0.587SS.*THydrogen-bonded Turntrans75.89.5173.400000115.4V119V119-G121 PolarHBondContact O-N 2.87Å
122R63.6Low58.8Low192 Ų192114.1 Ų114.173%0.72560%0.597SS**EExtended strand (participates in β ladder)trans-135144.5176.3-60.1-175.7-178.5-172.40.5110.1V119 Q120 M124V119-R122 PolarHBondContact N-O 3.34Å; V119-R122 PolarHBondContact O-N 3.06Å; V119-R122 VanDerWaalsContact O-O 3.07Å; Q120-R122 VanDerWaalsContact C-N 3.28Å; Q120-R122 PolarHBondContact O-N 3.01Å; R122-M124 PolarHBondContact O-N 2.05Å
123C64.4Low58.3Low64 Ų64118.4 Ų118.443%0.43262%0.624SS.*EExtended strand (participates in β ladder)trans-78.9117.7171.7-730000109.9C112 F116C112-C123 HydrophobicContact CB-CB 3.79Å; C112-C123 WeakPolarHBondContact CB-SG 3.07Å; C112-C123 VanDerWaalsContact SG-CA 3.52Å; C112-C123 WeakPolarHBondContact SG-CB 3.2Å; C112-C123 CovalentContact SG-SG 2.05Å; C112-C123 PolarHBondContact SG-SG 3.19Å; F116-C123 HydrophobicContact CB-CB 4.47Å
124M60Low57.8Low91 Ų91120.8 Ų120.845%0.44864%0.64SS.*EExtended strand (participates in β ladder)trans-113.9141.2175.9-75.9-158.6163.100111.1F116 M117 R122 T126F116-M124 CarbonylContact C-O 3.48Å; F116-M124 WeakPolarHBondContact CA-O 3.21Å; F116-M124 WeakPolarHBondContact CB-O 3.13Å; M117-M124 PolarHBondContact N-O 3.12Å; M117-M124 PolarHBondContact O-N 3.25Å; M117-M124 VanDerWaalsContact O-N 3.15Å; R122-M124 PolarHBondContact O-N 2.05Å; M124-T126 PolarHBondContact O-N 3.48Å
125P60.6Low57.8Low69 Ų69116.1 Ų116.145%0.44863%0.634SS.*EExtended strand (participates in β ladder)trans-66.6132.7-179.825.1-30.7000110.4F116 G127 M128F116-P125 HydrophobicContact CD1-CB 3.86Å; F116-P125 HydrophobicContact CD1-CG 4.43Å; F116-P125 HydrophobicContact CE1-CB 3.53Å; F116-P125 HydrophobicContact CE1-CG 3.98Å; F116-P125 HydrophobicContact CG-CB 4.48Å; F116-P125 HydrophobicContact CZ-CB 3.91Å; P125-G127 PolarHBondContact O-N 3.33Å; P125-M128 PolarHBondContact O-N 3.44Å
126T62.3Low57.2Low72 Ų72117.4 Ų117.444%0.44265%0.647SS.*G310 helixtrans-58.9-6.5-178.2-61.90000113.9G115 M117 M124 M128G115-T126 VanDerWaalsContact C-OG1 3.23Å; G115-T126 WeakPolarHBondContact O-CB 3.04Å; G115-T126 PolarHBondContact O-N 3.32Å; G115-T126 PolarHBondContact O-OG1 3.37Å; M117-T126 HydrophobicContact CG-CG2 4.35Å; M117-T126 WeakPolarHBondContact CG-OG1 3.48Å; M124-T126 PolarHBondContact O-N 3.48Å; T126-M128 PolarHBondContact O-N 3.43Å
127G55.8Low56.6Low73 Ų73125 Ų12575%0.75367%0.673SS**G310 helixtrans-79.3-3178.700000116.4P125P125-G127 PolarHBondContact O-N 3.33Å
128M55.5Low56.2Low139 Ų139123.3 Ų123.369%0.68569%0.685SS**G310 helixtrans-96.4-13.9-171.3-161.6159.9160.200115.3P125 T126P125-M128 PolarHBondContact O-N 3.44Å; T126-M128 PolarHBondContact O-N 3.43Å
129Y53Low55.8Low205 Ų205127.2 Ų127.280%0.80470%0.698SS**SBendtrans-119.52.4-176.2-77.9-81000115.4
130G59.8Low55.4Low55 Ų55130.1 Ų130.157%0.56771%0.711SS**SBendtrans-113.893.317600000112.3
131Y48.4Very low54.9Low226 Ų226130.3 Ų130.389%0.88671%0.709SS**SBendtrans76.751.5143.8-121.3-89.3000120
132Y39.4Very low54.5Low227 Ų227133.7 Ų133.789%0.8972%0.72SS**  trans-142138153.8-89.3-84.7000112.2
133P41.5Very low54Low105 Ų105130.2 Ų130.268%0.68271%0.714SS**  trans-74.9166.5-171.133-34.1000112.2G135P133-G135 PolarHBondContact O-N 3.46Å; P133-G135 VanDerWaalsContact O-N 3.08Å
134P49.5Very low53.6Low140 Ų140133.6 Ų133.691%0.90973%0.727SS**SBendtrans-71.4108-175.130.4-33.2000109.7
135G60.2Low53.2Low80 Ų80135.3 Ų135.383%0.82574%0.738SS**  trans157.7105.5172.200000114P133P133-G135 PolarHBondContact O-N 3.46Å; P133-G135 VanDerWaalsContact O-N 3.08Å
136G47.9Very low52.9Low73 Ų73139.5 Ų139.575%0.75375%0.751SS**  trans137.1104.1155.100000115.2
137R47.2Very low52.4Low250 Ų250144.9 Ų144.994%0.94377%0.765SS**  trans68.177.2148.9-68.4174.1146.4172-7.3116.7R139R137-R139 PolarHBondContact O-N 2.8Å
138G55.3Low52.1Low78 Ų78147.5 Ų147.580%0.80476%0.761SS**  trans-60114.6138.700000109.6
139R56.1Low51.9Low216 Ų216148.3 Ų148.382%0.81577%0.766SS**  trans-175-4.6148-118.2170.7168.4159-4.1118.7R137R137-R139 PolarHBondContact O-N 2.8Å
140L54.5Low51.6Low139 Ų139141.5 Ų141.573%0.72875%0.751SS**SBendtrans-115-5.9-167.6-62.8177.5000117.5
141F52Low51.1Low195 Ų195147 Ų14786%0.85576%0.759SS**SBendtrans-100.70.6-176.3-66.4-74.9000115.6
142T57.9Low51.1Low118 Ų118144.9 Ų144.972%0.72476%0.758SS**SBendtrans-93.6-6.4179.48.70000115.2
143I53.5Low51.4Low119 Ų119139.8 Ų139.861%0.6175%0.751SS**SBendtrans-91.1-18.5-172.6-65.4176.5000113.4
144I55.2Low51.6Low135 Ų135141.2 Ų141.269%0.69275%0.751SS**SBendtrans-80.7-23.1-176.8-68.1160.1000112.5
145N52.5Low51.5Low127 Ų127140.7 Ų140.768%0.67975%0.745SS**THydrogen-bonded Turntrans-78.1-18.8179.5-108.3-17.9000114.3
146H54.3Low50.8Low157 Ų157147.7 Ų147.773%0.72775%0.747SS**Hα-helixtrans-86.5-12-179.4-123.5-78.9000113.9
147Y49.8Very low51.1Low186 Ų186149.4 Ų149.473%0.72975%0.747SS**Hα-helixtrans-85.9-23.1-176.5-128-90.3000113.7
148N50.9Low50.6Low127 Ų127144.2 Ų144.268%0.67974%0.743SS**Hα-helixtrans-91.6-26.2-177.3-144.6-21000112.8
149M50.1Low50Low157 Ų157145.4 Ų145.477%0.77374%0.739SS**Hα-helixtrans-78.6-20.4179.2-54.9-149.3174.100113.7
150A48.5Very low49.7Very low61 Ų61139.9 Ų139.950%0.50473%0.731SS.*THydrogen-bonded Turntrans-82.5-11.217800000114.1
151K48.3Very low49.3Very low170 Ų170143.5 Ų143.574%0.73974%0.735SS**THydrogen-bonded Turntrans-91.9-5.1-176.5-85-162.1174.6-157.50115.6
152Q47.8Very low48.9Very low182 Ų182142.9 Ų142.985%0.8574%0.737SS**SBendtrans-97-3.6176.7-78.9-170.5-15.200115.1
153T45.4Very low48.5Very low121 Ų121142.9 Ų142.974%0.74274%0.737SS**SBendtrans-106.70.6-179.3-141.80000116
154I47.5Very low48.3Very low135 Ų135142.4 Ų142.469%0.69274%0.74SS**  trans-106.763.8179.1-53179.2000110
155T46Very low48Very low128 Ų128143.3 Ų143.379%0.78574%0.743SS**  trans-97.680.3153.740.30000108.3
156R46.7Very low47.7Very low227 Ų227141.5 Ų141.586%0.85774%0.74SS**SBendtrans176.9131.7138.9-101.6176.5172.9178.9-1.4111.5
157S52.6Low47.4Very low109 Ų109142 Ų14276%0.76274%0.742SS**  trans57.6109.5167.257.60000115.1
158V38.3Very low47.3Very low141 Ų141140.5 Ų140.586%0.85574%0.742SS**  -157.9120.363.81720000109.2
159S41.6Very low47.1Very low103 Ų103142.6 Ų142.672%0.7275%0.745SS**  trans-86.2177.6150.2-47.90000107.4
160P50.6Low46.9Very low100 Ų100140 Ų14065%0.64974%0.738SS**  cis-147.1178.18.720.89.2000114.2
161W45.1Very low46.9Very low216 Ų216141.7 Ų141.782%0.81874%0.743SS**SBendtrans91.621159.4-53.8106.3000123.8
162M44.6Very low47Very low182 Ų182140.9 Ų140.990%0.89774%0.741SS**SBendtrans-125.616.1176.6-88.6-156.572.900118.6
163T48.7Very low47Very low117 Ų117139.4 Ų139.472%0.71873%0.734SS**SBendtrans-114.9-1.7166.956.40000113.8M165T163-M165 PolarHBondContact O-N 2.9Å
164V50.2Low47.2Very low110 Ų110140 Ų14067%0.66773%0.729SS**THydrogen-bonded Turntrans-88.641.9175.1-170.80000111.4
165M47.5Very low47.4Very low154 Ų154138.7 Ų138.776%0.75973%0.727SS**THydrogen-bonded Turntrans-144.3-0.4167.7-81.4-15182.200114.3T163T163-M165 PolarHBondContact O-N 2.9Å
166S47.4Very low47.8Very low88 Ų88140.2 Ų140.262%0.61573%0.725SS**SBendtrans-96.3-13.417551.70000114
167E46.9Very low48.1Very low167 Ų167133.6 Ų133.678%0.7871%0.71SS**SBendtrans-97.3-5.2-179.4-148.4169.3133.600113.8T171E167-T171 PolarHBondContact O-OG1 3.08Å; E167-T171 VanDerWaalsContact O-OG1 3.12Å
168E48.4Very low48Very low155 Ų155136.2 Ų136.272%0.72471%0.71SS**SBendtrans-100.1-8.5178.8-158.9173.7145.400113.6
169K47.3Very low48.9Very low171 Ų171138 Ų13874%0.74371%0.709SS**SBendtrans-105.90.7177.4-83.3-164.6175.6-166.50115.7
170V44.4Very low49.4Very low104 Ų104142.1 Ų142.163%0.6371%0.714SS**SBendtrans-102.6-23175.4179.10000112
171T49.6Very low49.6Very low96 Ų96145.4 Ų145.459%0.58973%0.725SS**SBendtrans-89.1-4.5-178.921.40000115.2E167E167-T171 PolarHBondContact O-OG1 3.08Å; E167-T171 VanDerWaalsContact O-OG1 3.12Å
172Q50Low49.5Very low152 Ų152143.1 Ų143.171%0.7175%0.752SS**SBendtrans-95.5-15.7174.4-126174.31300113.8
173Q47.2Very low49.7Very low152 Ų152141.2 Ų141.271%0.7175%0.745SS**SBendtrans-93.1-11.9179-164.6169.4-9.400113.4T177Q173-T177 PolarHBondContact O-OG1 3.25Å
174E51.6Low49.8Very low134 Ų134142.4 Ų142.463%0.62675%0.746SS**SBendtrans-90.5-19.9179-157.2172.9159.600113
175T50.4Low49.8Very low106 Ų106144.2 Ų144.265%0.6575%0.751SS**SBendtrans-91.8-10.3176.748.40000115.1
176E54Low49.9Very low160 Ų160143.6 Ų143.675%0.74875%0.75SS**SBendtrans-96.7-13.5176.2-72.9-169.4152.700114.1
177T53.1Low50.1Low89 Ų89147.1 Ų147.155%0.54676%0.759SS.*SBendtrans-93.5-6.7-179.344.90000114.4Q173Q173-T177 PolarHBondContact O-OG1 3.25Å
178H51.9Low50.3Low163 Ų163145.8 Ų145.876%0.75576%0.757SS**SBendtrans-91.2-2171.9-89.1-91.6000114.5
179Q55.6Low50.4Low180 Ų180145.1 Ų145.184%0.84176%0.76SS**SBendtrans-109.229175.3-156.8178.5-11.700113.1
180K52.5Low50.6Low189 Ų189143.2 Ų143.282%0.82276%0.761SS**SBendtrans-13624.4172.9-144.6-176.7-178.8-173.20114.1
181L54.7Low51.2Low169 Ų169146.4 Ų146.489%0.88577%0.772SS**  trans-136.224.9176.1-99.2146.2000112.8
182A43.3Very low51.3Low167 Ų167151 Ų151100%1.3879%0.788SS**  trans-115.50160.700000108.9

Retrieved 182 of 182 residues in 351.2 ms (Link to these results)