A0A087YST3_POEFO Loading...

Forkhead box Q1b

AlphaFold DB , UniProt , Accession A0A087YST3, Species POEFO (Poecilia formosa, Amazon molly), Gene FOXQ1, Length 274 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
1M45.3Very low48.6Very low242 Ų242136.6 Ų136.6100%1.19282%0.819SS**  0118.80-97168.315900105.8
2E46.2Very low48Very low176 Ų176135.3 Ų135.382%0.82282%0.821SS**  trans-75.7167.1173.4-59.4-58.6109.700110.4
3P63.8Low47.4Very low111 Ų111130.7 Ų130.772%0.72182%0.818SS**  cis-133.4168.9-41.235.8-21.4000112.4
4D46.8Very low47.6Very low169 Ų169133.4 Ų133.490%0.90482%0.824SS**  trans-103.9144152.5-168.46.1000108.1
5G41.9Very low48.1Very low71 Ų71137.7 Ų137.773%0.73283%0.83SS**  trans-131.5115.4-161.500000113.8
6G46.8Very low48.4Very low67 Ų67140.1 Ų140.169%0.69184%0.836SS**  trans-144.6159.5-179.500000115.1
7I48.6Very low47.7Very low167 Ų167136.4 Ų136.486%0.85683%0.833SS**  trans60.4163.5171.219.9-176000115
8P52.8Low48Very low121 Ų121135.2 Ų135.279%0.78683%0.832SS**  cis-128.2175.51443.3-27.7000117.3
9S45.2Very low48.1Very low103 Ų103136.9 Ų136.972%0.7284%0.835SS**  trans-90.1166166.9-39.50000112.7
10P54.3Low48Very low111 Ų111133.9 Ų133.972%0.72183%0.833SS**  trans-114.5150.8138.239.3-31.7000109.4
11L42.4Very low47.5Very low165 Ų165135.2 Ų135.286%0.86484%0.835SS**  60.1132.853.3-60.9178.1000112.1
12S41.3Very low47.8Very low120 Ų120129.5 Ų129.584%0.83982%0.817SS**  cis-163.6165.42.650.10000110
13G41Very low47.6Very low76 Ų76127.5 Ų127.578%0.78482%0.816SS**  trans149.792.2157.200000116.4
14D49.3Very low47.1Very low169 Ų169126.5 Ų126.590%0.90482%0.818SS**  trans-94.1136.2160.6-57.9-83.5000109.3
15E56.3Low47Very low197 Ų197125.9 Ų125.992%0.92182%0.815SS**  trans-145.1148.8164.4-155172.4138.600110.6
16L51.7Low47.2Very low177 Ų177128.5 Ų128.593%0.92782%0.821SS**  trans-116.7150.3-167.6-73.3168.5000112.7
17G36.3Very low47.1Very low76 Ų76131.2 Ų131.278%0.78483%0.827SS**  trans117.6163.9165.700000114
18S53.1Low47Very low116 Ų116127.7 Ų127.781%0.81182%0.823SS**  cis-158.8155.1-12.7-1770000108.1
19D51.5Low47.1Very low167 Ų167127.7 Ų127.789%0.89382%0.823SS**  trans-60.6145.8171.9-56.5-80.7000111.7
20G44.4Very low46.9Very low77 Ų77129 Ų12979%0.79483%0.827SS**  trans-168.6116.7-17900000112.7
21D38Very low46.5Very low162 Ų162130.4 Ų130.487%0.86683%0.833SS**  trans-75163.8-169.6-83.8-64.1000116.2
22C51.2Low46.4Very low122 Ų122131.3 Ų131.382%0.82483%0.833SS**  trans-75122.7173.455.90000113.2
23V42.3Very low46.7Very low133 Ų133129.4 Ų129.481%0.80683%0.832SS**  trans-135.2135.8158.7-179.60000109.5
24A54.2Low46.6Very low91 Ų91131.6 Ų131.675%0.75284%0.836SS**  trans-83.6140.7177.700000111.8
25N43.5Very low46.2Very low156 Ų156132.2 Ų132.283%0.83483%0.833SS**  trans-151.5123.9160-101.3-43000110.7
26S47Very low45.9Very low125 Ų125127.8 Ų127.887%0.87482%0.824SS**  trans-106130.4168.6-68.20000109.6
27P45.3Very low45.7Very low124 Ų124123 Ų12381%0.80582%0.818SS**  trans-116.4147.2146.434.1-26.4000111.1
28A45.8Very low46.1Very low93 Ų93128.5 Ų128.577%0.76982%0.82SS**  trans-96.6-167.817100000110.4
29P54.5Low45.9Very low122 Ų122126.2 Ų126.279%0.79281%0.814SS**  -99.3146.3-96.336-27.8000112.8
30V40.4Very low46.1Very low131 Ų131127.6 Ų127.679%0.79481%0.812SS**  trans-121119.6169.6179.50000109.9
31T47.8Very low46.3Very low140 Ų140129.3 Ų129.386%0.85981%0.81SS**  trans-80.3114.717344.80000111
32Q39.4Very low47.1Very low183 Ų183129.1 Ų129.186%0.85580%0.798SS**  trans-129.4144.7154.7-69.4-168.1-8.700109.1
33G46.7Very low47.3Very low81 Ų81128.1 Ų128.184%0.83579%0.788SS**  trans-78.1136-16500000113.7
34S40.4Very low48.3Very low122 Ų122131.8 Ų131.885%0.85379%0.788SS**  trans-104.2111159.948.50000109.2S36S34-S36 PolarHBondContact O-N 2.91Å
35E41.3Very low49.4Very low182 Ų182133.5 Ų133.585%0.8578%0.775SS**  trans-70132-175.4-70.3-168104.800112.6G37E35-G37 PolarHBondContact O-N 3.44Å
36S49.4Very low51.1Low103 Ų103131.8 Ų131.872%0.7277%0.772SS**  trans57.12315079.40000118S34 K38S34-S36 PolarHBondContact O-N 2.91Å; S36-K38 PolarHBondContact O-N 3.01Å
37G47.3Very low52.9Low78 Ų78131.1 Ų131.180%0.80475%0.753SS**  trans-62.763162.800000112.4E35 G39E35-G37 PolarHBondContact O-N 3.44Å; G37-G39 PolarHBondContact O-N 3.24Å
38K45.2Very low54.8Low191 Ų191125.8 Ų125.883%0.8372%0.718SS**  trans-66.281.1176.9-78.1-178.1177.1172.10108.7S36 K40S36-K38 PolarHBondContact O-N 3.01Å; K38-K40 PolarHBondContact O-N 2.67Å
39G48.1Very low56.8Low67 Ų67125.2 Ų125.269%0.69171%0.707SS**  trans-51.3106.7167.800000107.9G37G37-G39 PolarHBondContact O-N 3.24Å
40K56.3Low58.5Low196 Ų196122.8 Ų122.885%0.85268%0.682SS**  trans-46115.4-177.7-70169.5-179.6169.70106.6K38 Y42K38-K40 PolarHBondContact O-N 2.67Å; K40-Y42 PolarHBondContact O-N 2.61Å
41P48.8Very low60.9Low114 Ų114117.8 Ų117.874%0.7465%0.654SS**  trans-56.7113.6-171.521-32.1000106.4T43P41-T43 PolarHBondContact O-N 2.66Å
42Y54.8Low63.1Low158 Ų158113.1 Ų113.162%0.6262%0.621SS**  trans-65.994.6-174.9175.6-106.7000105.9K40 R44K40-Y42 PolarHBondContact O-N 2.61Å; Y42-R44 HydrophobicContact CD1-CG 3.53Å; Y42-R44 HydrophobicContact CE1-CG 3.79Å; Y42-R44 WeakPolarHBondContact O-CG 3.33Å; Y42-R44 PolarHBondContact O-N 3.13Å
43T55.8Low65.7Low100 Ų100105.9 Ų105.961%0.61359%0.587SS**  trans-6193.9-178-80.40000105.8P41 R45P41-T43 PolarHBondContact O-N 2.66Å; T43-R45 HydrophobicContact CG2-CG 3.89Å; T43-R45 PolarHBondContact O-N 2.76Å
44R62.7Low67.9Low211 Ų211102 Ų10280%0.79655%0.547SS*.  trans-70.573.3175.8-73-170.4-179.8-119.1-0.4106.3Y42Y42-R44 HydrophobicContact CD1-CG 3.53Å; Y42-R44 HydrophobicContact CE1-CG 3.79Å; Y42-R44 WeakPolarHBondContact O-CG 3.33Å; Y42-R44 PolarHBondContact O-N 3.13Å
45R76.3Confident70.4Confident127 Ų12796.4 Ų96.448%0.47951%0.508SS..  trans-43.8124.9176.9-68.1-175.2179.9-96.58.4106.3T43 K47 P82 F83T43-R45 HydrophobicContact CG2-CG 3.89Å; T43-R45 PolarHBondContact O-N 2.76Å; R45-K47 PolarHBondContact O-N 2.79Å; R45-K47 VanDerWaalsContact O-N 3.12Å; R45-P82 WeakPolarHBondContact CD-O 3.11Å; R45-F83 VanDerWaalsContact O-CD2 3.25Å; R45-F83 WeakPolarHBondContact O-CD2 3.5Å
46P80.4Confident73Confident119 Ų11987.8 Ų87.877%0.77347%0.468SS*.PPolyproline II helixtrans-56.2123.7-161.818.3-31.6000110.3
47K83.5Confident75.1Confident112 Ų11282.9 Ų82.949%0.48743%0.434SS..PPolyproline II helixtrans-60.1127-179-178.4170.7-175.7171.20108.2R45 F83R45-K47 PolarHBondContact O-N 2.79Å; R45-K47 VanDerWaalsContact O-N 3.12Å; K47-F83 HydrophobicContact CB-CD2 4.25Å; K47-F83 HydrophobicContact CB-CE1 4.49Å; K47-F83 HydrophobicContact CB-CE2 4.05Å; K47-F83 HydrophobicContact CB-CZ 4.18Å; K47-F83 HydrophobicContact CD-CE1 4.22Å; K47-F83 HydrophobicContact CD-CZ 3.96Å; K47-F83 HydrophobicContact CG-CD1 4.28Å; K47-F83 HydrophobicContact CG-CE1 3.88Å; K47-F83 HydrophobicContact CG-CE2 4.27Å; K47-F83 HydrophobicContact CG-CZ 3.88Å
48P86.8Confident77.3Confident11 Ų1180.3 Ų80.37%0.07140%0.401CS..PPolyproline II helixtrans-53.4144.7-176.7-28.434.5000112.6Y50 L55 F81 F83 F84P48-Y50 HydrophobicContact CB-CD2 3.81Å; P48-Y50 PolarHBondContact O-N 2.97Å; P48-L55 HydrophobicContact CB-CD2 4.32Å; P48-F81 HydrophobicContact CB-CD1 4.09Å; P48-F81 HydrophobicContact CB-CE1 4.34Å; P48-F81 HydrophobicContact CG-CB 3.95Å; P48-F81 HydrophobicContact CG-CD1 3.71Å; P48-F81 HydrophobicContact CG-CE1 4.44Å; P48-F81 HydrophobicContact CG-CG 3.9Å; P48-F83 HydrophobicContact CG-CB 4.43Å; P48-F84 HydrophobicContact CG-CE2 4.3Å
49P86.7Confident79.8Confident82 Ų8271.2 Ų71.253%0.53236%0.361SS..SBendtrans-71.715.7-175.530.7-36.7000114.5R139P49-R139 PolarHBondContact O-N 3.39Å
50Y89.7Confident82Confident70 Ų7068.2 Ų68.228%0.27533%0.329SS..BIsolated β-bridgetrans-107.3161.5-168.7-56.9-57.9000112.2P48 L55 M58 F81 F137 R139P48-Y50 HydrophobicContact CB-CD2 3.81Å; P48-Y50 PolarHBondContact O-N 2.97Å; Y50-L55 HydrophobicContact CD2-CD2 4.13Å; Y50-M58 HydrophobicContact CD1-CE 4.37Å; Y50-M58 HydrophobicContact CD2-CE 3.79Å; Y50-M58 HydrophobicContact CE2-CE 4.12Å; Y50-M58 HydrophobicContact CG-CE 3.94Å; Y50-F81 HydrophobicContact CD2-CE1 4.21Å; Y50-F81 HydrophobicContact CD2-CZ 4.28Å; Y50-F81 HydrophobicContact CE2-CE1 4.01Å; Y50-F81 HydrophobicContact CE2-CZ 4.27Å; Y50-F137 WeakPolarHBondContact CA-O 3.34Å; Y50-F137 HydrophobicContact CD1-CB 3.76Å; Y50-F137 WeakPolarHBondContact CD1-O 3.49Å; Y50-F137 HydrophobicContact CE1-CB 3.93Å; Y50-R139 PolarHBondContact O-NH2 2.72Å
51S91.9Very high83.7Confident27 Ų2767.1 Ų67.119%0.18932%0.32CS..  trans-80.9166164.662.80000110.6I53 A54 L55S51-I53 VanDerWaalsContact C-N 3.28Å; S51-A54 PolarHBondContact O-N 3.12Å; S51-A54 WeakPolarHBondContact OG-CB 3.36Å; S51-A54 PolarHBondContact OG-N 3.42Å; S51-L55 WeakPolarHBondContact O-CB 3.41Å; S51-L55 WeakPolarHBondContact O-CD1 3.37Å; S51-L55 VanDerWaalsContact O-CG 3.23Å; S51-L55 WeakPolarHBondContact O-CG 3.18Å; S51-L55 PolarHBondContact O-N 3.09Å
52Y94.8Very high85.8Confident42 Ų4266.8 Ų66.817%0.16531%0.308CS..Hα-helixtrans-65-35.2171.4-74.1-65.5000111.5A54 L55 I56 F84 S94 V95Y52-A54 PolarHBondContact O-N 2.75Å; Y52-L55 HydrophobicContact CD1-CD1 4.09Å; Y52-L55 PolarHBondContact O-N 3.14Å; Y52-I56 WeakPolarHBondContact O-CD1 3.28Å; Y52-I56 VanDerWaalsContact O-CG1 3.23Å; Y52-I56 WeakPolarHBondContact O-CG1 3.35Å; Y52-I56 PolarHBondContact O-N 3.27Å; Y52-F84 HydrophobicContact CE1-CE1 4.08Å; Y52-F84 HydrophobicContact CE1-CZ 4.31Å; Y52-S94 PolarHBondContact OH-OG 2.69Å; Y52-V95 HydrophobicContact CD1-CG2 4.3Å
53I93.4Very high87.8Confident30 Ų3060.2 Ų60.215%0.15429%0.286CS..Hα-helixtrans-54-53.4170.4-51.8171.3000110.4S51 L55 I56 A57 N102 C104 F105 Y130S51-I53 VanDerWaalsContact C-N 3.28Å; I53-L55 VanDerWaalsContact C-N 3.32Å; I53-L55 PolarHBondContact O-N 3.47Å; I53-I56 PolarHBondContact O-N 3.23Å; I53-A57 VanDerWaalsContact O-CB 3.29Å; I53-A57 WeakPolarHBondContact O-CB 3.18Å; I53-A57 PolarHBondContact O-N 2.67Å; I53-N102 VanDerWaalsContact CD1-OD1 3.26Å; I53-N102 WeakPolarHBondContact CD1-OD1 3.32Å; I53-C104 HydrophobicContact CG2-CB 4.28Å; I53-F105 HydrophobicContact CB-CE2 4.36Å; I53-F105 HydrophobicContact CB-CZ 4.37Å; I53-F105 HydrophobicContact CG1-CE2 4.47Å; I53-F105 HydrophobicContact CG2-CE2 3.95Å; I53-F105 HydrophobicContact CG2-CZ 3.8Å; I53-Y130 HydrophobicContact CG2-CD1 3.99Å; I53-Y130 HydrophobicContact CG2-CD2 3.94Å; I53-Y130 HydrophobicContact CG2-CE1 4.05Å; I53-Y130 HydrophobicContact CG2-CE2 4.01Å; I53-Y130 HydrophobicContact CG2-CG 3.97Å
54A91.9Very high89.6Confident0 Ų062.1 Ų62.10%030%0.303CS..Hα-helixtrans-59.5-40.9178.100000112.9S51 Y52 A57 M58 Y130 F137S51-A54 PolarHBondContact O-N 3.12Å; S51-A54 WeakPolarHBondContact OG-CB 3.36Å; S51-A54 PolarHBondContact OG-N 3.42Å; Y52-A54 PolarHBondContact O-N 2.75Å; A54-A57 PolarHBondContact O-N 3.21Å; A54-M58 WeakPolarHBondContact O-CE 3.3Å; A54-M58 WeakPolarHBondContact O-CG 3.49Å; A54-M58 PolarHBondContact O-N 3.47Å; A54-Y130 WeakPolarHBondContact CA-OH 3.49Å; A54-Y130 VanDerWaalsContact CB-OH 3.24Å; A54-Y130 WeakPolarHBondContact CB-OH 3.22Å; A54-F137 HydrophobicContact CB-CB 4.11Å; A54-F137 HydrophobicContact CB-CD1 4.13Å; A54-F137 WeakPolarHBondContact CB-O 3.46Å
55L94.4Very high91.1Very high5 Ų555 Ų553%0.02629%0.286CS..Hα-helixtrans-65.3-41.6179.1-74.1167.3000112.6P48 Y50 S51 Y52 I53 M58 A59 L77 F81 F84P48-L55 HydrophobicContact CB-CD2 4.32Å; Y50-L55 HydrophobicContact CD2-CD2 4.13Å; S51-L55 WeakPolarHBondContact O-CB 3.41Å; S51-L55 WeakPolarHBondContact O-CD1 3.37Å; S51-L55 VanDerWaalsContact O-CG 3.23Å; S51-L55 WeakPolarHBondContact O-CG 3.18Å; S51-L55 PolarHBondContact O-N 3.09Å; Y52-L55 HydrophobicContact CD1-CD1 4.09Å; Y52-L55 PolarHBondContact O-N 3.14Å; I53-L55 VanDerWaalsContact C-N 3.32Å; I53-L55 PolarHBondContact O-N 3.47Å; L55-M58 HydrophobicContact CD2-CE 3.93Å; L55-M58 HydrophobicContact CG-CE 4.49Å; L55-A59 PolarHBondContact O-N 3.45Å; L55-L77 HydrophobicContact CB-CD2 3.79Å; L55-L77 HydrophobicContact CD2-CD2 4.04Å; L55-L77 HydrophobicContact CG-CD2 4.42Å; L55-F81 HydrophobicContact CD2-CD2 3.78Å; L55-F81 HydrophobicContact CD2-CE1 4.4Å; L55-F81 HydrophobicContact CD2-CE2 3.38Å; L55-F81 HydrophobicContact CD2-CG 4.44Å; L55-F81 HydrophobicContact CD2-CZ 3.73Å; L55-F84 HydrophobicContact CD1-CE2 4.03Å; L55-F84 HydrophobicContact CD1-CZ 3.67Å; L55-F84 HydrophobicContact CD2-CE2 4.32Å
56I95.8Very high91.9Very high0 Ų050.5 Ų50.50%028%0.279CS..Hα-helixtrans-71-42.3175.9-63.6160.6000110.3Y52 I53 M58 A59 I60 I73 V95 N98 L99 F105Y52-I56 WeakPolarHBondContact O-CD1 3.28Å; Y52-I56 VanDerWaalsContact O-CG1 3.23Å; Y52-I56 WeakPolarHBondContact O-CG1 3.35Å; Y52-I56 PolarHBondContact O-N 3.27Å; I53-I56 PolarHBondContact O-N 3.23Å; I56-M58 PolarHBondContact O-N 2.92Å; I56-A59 WeakPolarHBondContact O-CB 3.36Å; I56-A59 PolarHBondContact O-N 2.96Å; I56-A59 VanDerWaalsContact O-N 3.12Å; I56-I60 HydrophobicContact CG2-CD1 3.89Å; I56-I60 HydrophobicContact CG2-CG1 4.46Å; I56-I60 WeakPolarHBondContact O-CG1 3.39Å; I56-I60 PolarHBondContact O-N 3.43Å; I56-I73 HydrophobicContact CG1-CG2 4.11Å; I56-I73 HydrophobicContact CG2-CD1 4.22Å; I56-I73 HydrophobicContact CG2-CG2 4.5Å; I56-V95 HydrophobicContact CD1-CG1 4.27Å; I56-V95 HydrophobicContact CG1-CG1 4.37Å; I56-N98 HydrophobicContact CD1-CB 3.96Å; I56-L99 HydrophobicContact CD1-CD2 4.11Å; I56-L99 HydrophobicContact CD1-CG 4.09Å; I56-L99 HydrophobicContact CG2-CD2 3.69Å; I56-F105 HydrophobicContact CB-CE1 3.9Å; I56-F105 HydrophobicContact CB-CE2 4.38Å; I56-F105 HydrophobicContact CB-CZ 3.67Å; I56-F105 HydrophobicContact CD1-CE2 4.18Å; I56-F105 HydrophobicContact CD1-CZ 4.32Å; I56-F105 HydrophobicContact CG2-CD1 3.86Å; I56-F105 HydrophobicContact CG2-CE1 3.35Å; I56-F105 HydrophobicContact CG2-CE2 4.29Å; I56-F105 HydrophobicContact CG2-CZ 3.6Å
57A93.4Very high92.6Very high1 Ų150 Ų501%0.00826%0.261CS..Hα-helixtrans-62.6-39.9178.500000112.5I53 A54 A59 I60 R61 L124 Y130I53-A57 VanDerWaalsContact O-CB 3.29Å; I53-A57 WeakPolarHBondContact O-CB 3.18Å; I53-A57 PolarHBondContact O-N 2.67Å; A54-A57 PolarHBondContact O-N 3.21Å; A57-A59 VanDerWaalsContact C-N 3.35Å; A57-I60 PolarHBondContact O-N 3.24Å; A57-R61 WeakPolarHBondContact O-CB 3.24Å; A57-R61 VanDerWaalsContact O-CG 3.3Å; A57-R61 WeakPolarHBondContact O-CG 3.34Å; A57-R61 PolarHBondContact O-N 3.45Å; A57-L124 HydrophobicContact CB-CD1 4.35Å; A57-L124 HydrophobicContact CB-CD2 3.93Å; A57-Y130 HydrophobicContact CB-CD1 3.94Å; A57-Y130 HydrophobicContact CB-CE1 3.56Å
58M93.8Very high93.3Very high24 Ų2445.3 Ų45.312%0.11824%0.242CC..Hα-helixtrans-61.2-42.2171.4-74.7-177.1-68.200111.8Y50 A54 L55 I56 I60 R61 E62 F81Y50-M58 HydrophobicContact CD1-CE 4.37Å; Y50-M58 HydrophobicContact CD2-CE 3.79Å; Y50-M58 HydrophobicContact CE2-CE 4.12Å; Y50-M58 HydrophobicContact CG-CE 3.94Å; A54-M58 WeakPolarHBondContact O-CE 3.3Å; A54-M58 WeakPolarHBondContact O-CG 3.49Å; A54-M58 PolarHBondContact O-N 3.47Å; L55-M58 HydrophobicContact CD2-CE 3.93Å; L55-M58 HydrophobicContact CG-CE 4.49Å; I56-M58 PolarHBondContact O-N 2.92Å; M58-I60 PolarHBondContact O-N 3.45Å; M58-R61 PolarHBondContact O-N 3.01Å; M58-E62 WeakPolarHBondContact O-CB 3.35Å; M58-E62 WeakPolarHBondContact O-CG 3.49Å; M58-E62 PolarHBondContact O-N 3.46Å; M58-F81 HydrophobicContact CE-CE2 4.38Å; M58-F81 HydrophobicContact CE-CZ 3.9Å
59A95.8Very high93.8Very high0 Ų045.4 Ų45.40%024%0.242CC..Hα-helixtrans-59-48.2176.400000112.1L55 I56 A57 S63 L68 Y76L55-A59 PolarHBondContact O-N 3.45Å; I56-A59 WeakPolarHBondContact O-CB 3.36Å; I56-A59 PolarHBondContact O-N 2.96Å; I56-A59 VanDerWaalsContact O-N 3.12Å; A57-A59 VanDerWaalsContact C-N 3.35Å; A59-S63 PolarHBondContact O-N 2.99Å; A59-L68 HydrophobicContact CB-CD1 3.84Å; A59-L68 WeakPolarHBondContact O-CD1 3.32Å; A59-Y76 VanDerWaalsContact CA-CE1 3.49Å; A59-Y76 HydrophobicContact CB-CD1 3.28Å; A59-Y76 HydrophobicContact CB-CD2 4.25Å; A59-Y76 HydrophobicContact CB-CE1 3.58Å; A59-Y76 HydrophobicContact CB-CE2 4.48Å; A59-Y76 HydrophobicContact CB-CG 3.66Å
60I94.9Very high94.3Very high3 Ų343.9 Ų43.92%0.01523%0.229CC..Hα-helixtrans-68.9-42.4-178.6-63.7172.6000111.1I56 A57 M58 E62 S63 G66 F105 W122 L124I56-I60 HydrophobicContact CG2-CD1 3.89Å; I56-I60 HydrophobicContact CG2-CG1 4.46Å; I56-I60 WeakPolarHBondContact O-CG1 3.39Å; I56-I60 PolarHBondContact O-N 3.43Å; A57-I60 PolarHBondContact O-N 3.24Å; M58-I60 PolarHBondContact O-N 3.45Å; I60-E62 VanDerWaalsContact C-N 3.33Å; I60-E62 PolarHBondContact O-N 3.03Å; I60-S63 WeakPolarHBondContact O-CB 3.29Å; I60-S63 PolarHBondContact O-N 3.48Å; I60-S63 PolarHBondContact O-OG 3.31Å; I60-G66 VanDerWaalsContact CG2-O 3.27Å; I60-G66 WeakPolarHBondContact CG2-O 3.5Å; I60-F105 HydrophobicContact CD1-CD1 4.01Å; I60-F105 HydrophobicContact CD1-CE1 4.21Å; I60-W122 HydrophobicContact CD1-CB 4.48Å; I60-L124 HydrophobicContact CB-CD1 4.46Å; I60-L124 HydrophobicContact CB-CG 4.34Å; I60-L124 HydrophobicContact CD1-CG 4.47Å; I60-L124 HydrophobicContact CG2-CD1 4.3Å; I60-L124 HydrophobicContact CG2-CG 4.09Å
61R92Very high94.6Very high174 Ų17442.8 Ų42.866%0.65724%0.235SC*.Hα-helixtrans-68-28.5178.8-72.4-178.570.5-154.62.2114.1A57 M58 S63 L124A57-R61 WeakPolarHBondContact O-CB 3.24Å; A57-R61 VanDerWaalsContact O-CG 3.3Å; A57-R61 WeakPolarHBondContact O-CG 3.34Å; A57-R61 PolarHBondContact O-N 3.45Å; M58-R61 PolarHBondContact O-N 3.01Å; R61-S63 VanDerWaalsContact C-N 3.34Å; R61-L124 HydrophobicContact CG-CD1 3.61Å
62E93.9Very high94.9Very high106 Ų10645.6 Ų45.650%0.49525%0.245SC..THydrogen-bonded Turntrans-89.6-1.3176.4-67.7169.9-150.300112.7M58 I60 Y76 K80M58-E62 WeakPolarHBondContact O-CB 3.35Å; M58-E62 WeakPolarHBondContact O-CG 3.49Å; M58-E62 PolarHBondContact O-N 3.46Å; I60-E62 VanDerWaalsContact C-N 3.33Å; I60-E62 PolarHBondContact O-N 3.03Å; E62-Y76 HydrophobicContact CB-CE2 4.17Å; E62-Y76 PolarHBondContact OE1-OH 3.48Å; E62-Y76 VanDerWaalsContact OE1-OH 3.13Å; E62-Y76 WeakPolarHBondContact OE2-CE2 3.25Å; E62-Y76 PolarHBondContact OE2-OH 3.37Å; E62-K80 IonicContact OE1-NZ 2.66Å; E62-K80 PolarHBondContact OE1-NZ 3.07Å; E62-K80 IonicContact OE2-NZ 2.67Å; E62-K80 PolarHBondContact OE2-NZ 2.95Å
63S95.3Very high95Very high21 Ų2143.6 Ų43.615%0.14724%0.237CC..SBendtrans-82.7130.4169.4760000110.8A59 I60 R61 S65 G66 R67A59-S63 PolarHBondContact O-N 2.99Å; I60-S63 WeakPolarHBondContact O-CB 3.29Å; I60-S63 PolarHBondContact O-N 3.48Å; I60-S63 PolarHBondContact O-OG 3.31Å; R61-S63 VanDerWaalsContact C-N 3.34Å; S63-S65 PolarHBondContact O-N 3.24Å; S63-S65 VanDerWaalsContact O-N 3.14Å; S63-S65 PolarHBondContact OG-OG 2.77Å; S63-G66 PolarHBondContact O-N 2.82Å; S63-G66 VanDerWaalsContact O-N 3.12Å; S63-G66 PolarHBondContact OG-N 3.37Å; S63-R67 PolarHBondContact OG-N 3.12Å
64S95.1Very high95.2Very high139 Ų13942.8 Ų42.897%0.97223%0.233SC*.THydrogen-bonded Turntrans-62.8-18.5176.152.20000113.5
65S93.7Very high95.5Very high63 Ų6346 Ų4644%0.44125%0.25SS..THydrogen-bonded Turntrans-88.7-11.6178.453.20000114.2S63 R67S63-S65 PolarHBondContact O-N 3.24Å; S63-S65 VanDerWaalsContact O-N 3.14Å; S63-S65 PolarHBondContact OG-OG 2.77Å; S65-R67 PolarHBondContact O-N 3.02Å; S65-R67 VanDerWaalsContact O-N 3.09Å; S65-R67 PolarHBondContact OG-O 2.87Å
66G93.6Very high95.6Very high32 Ų3247.5 Ų47.533%0.3326%0.256SS..SBendtrans60.312.8-170.900000114.6I60 S63I60-G66 VanDerWaalsContact CG2-O 3.27Å; I60-G66 WeakPolarHBondContact CG2-O 3.5Å; S63-G66 PolarHBondContact O-N 2.82Å; S63-G66 VanDerWaalsContact O-N 3.12Å; S63-G66 PolarHBondContact OG-N 3.37Å
67R95.2Very high95.7Very high107 Ų10747.5 Ų47.540%0.40426%0.256SS..EExtended strand (participates in β ladder)trans-154.5136.7-17472.7-172.9174.6174.6-2.4111.2S63 S65 Y121 W122 M123S63-R67 PolarHBondContact OG-N 3.12Å; S65-R67 PolarHBondContact O-N 3.02Å; S65-R67 VanDerWaalsContact O-N 3.09Å; S65-R67 PolarHBondContact OG-O 2.87Å; R67-Y121 HydrophobicContact CG-CD1 4.1Å; R67-Y121 HydrophobicContact CG-CG 4.28Å; R67-W122 WeakPolarHBondContact CA-O 3.46Å; R67-M123 HydrophobicContact CB-CE 4.46Å; R67-M123 HydrophobicContact CB-CG 3.34Å; R67-M123 HydrophobicContact CB-SD 3.84Å
68L97.2Very high95.8Very high15 Ų1549.6 Ų49.68%0.07927%0.266CS..EExtended strand (participates in β ladder)trans-137.2147.4-179.3-67.7-178.4000111.8A59 E72 I73 W122A59-L68 HydrophobicContact CB-CD1 3.84Å; A59-L68 WeakPolarHBondContact O-CD1 3.32Å; L68-E72 HydrophobicContact CB-CB 4.23Å; L68-E72 HydrophobicContact CD2-CB 3.94Å; L68-E72 HydrophobicContact CG-CB 4.49Å; L68-I73 HydrophobicContact CB-CD1 4.22Å; L68-I73 HydrophobicContact CB-CG1 3.74Å; L68-I73 HydrophobicContact CD1-CG1 4.03Å; L68-W122 PolarHBondContact N-O 3.02Å; L68-W122 WeakPolarHBondContact O-CB 3.33Å; L68-W122 PolarHBondContact O-N 3.11Å
69T97.2Very high95.9Very high13 Ų1355.5 Ų55.58%0.0829%0.291CS..EExtended strand (participates in β ladder)trans-73.4164.9166.763.50000111.5A71 E72 I73 D119 Y121T69-A71 PolarHBondContact O-N 3.43Å; T69-E72 VanDerWaalsContact CB-OE2 3.27Å; T69-E72 WeakPolarHBondContact CB-OE2 3.23Å; T69-E72 WeakPolarHBondContact CG2-OE2 3.48Å; T69-E72 PolarHBondContact N-OE2 3.36Å; T69-E72 PolarHBondContact O-N 3.32Å; T69-E72 WeakPolarHBondContact OG1-CG 3.38Å; T69-E72 PolarHBondContact OG1-N 3.26Å; T69-E72 PolarHBondContact OG1-OE2 3.1Å; T69-I73 WeakPolarHBondContact O-CD1 3.27Å; T69-I73 VanDerWaalsContact O-CG1 3.32Å; T69-I73 WeakPolarHBondContact O-CG1 3.27Å; T69-I73 PolarHBondContact O-N 3.33Å; T69-D119 HydrophobicContact CG2-CB 4.32Å; T69-Y121 HydrophobicContact CG2-CD1 3.84Å; T69-Y121 HydrophobicContact CG2-CE1 3.77Å
70L96.5Very high95.9Very high50 Ų5060 Ų6026%0.26231%0.31SS..Hα-helixtrans-56.3-35.5171.7174.563.5000112.4N74 V95 R96 L99L70-N74 PolarHBondContact O-N 3.27Å; L70-N74 PolarHBondContact O-ND2 2.84Å; L70-V95 HydrophobicContact CD1-CG1 3.99Å; L70-R96 HydrophobicContact CD1-CG 3.88Å; L70-R96 HydrophobicContact CD2-CG 3.7Å; L70-R96 HydrophobicContact CG-CG 4.46Å; L70-L99 HydrophobicContact CD1-CD1 3.85Å
71A96.8Very high95.8Very high47 Ų4761.1 Ų61.139%0.38832%0.315SS..Hα-helixtrans-64.1-53177.900000111T69 I73 N74 D75T69-A71 PolarHBondContact O-N 3.43Å; A71-I73 VanDerWaalsContact C-N 3.31Å; A71-I73 PolarHBondContact O-N 2.95Å; A71-N74 WeakPolarHBondContact O-CB 3.42Å; A71-N74 PolarHBondContact O-N 2.71Å; A71-N74 VanDerWaalsContact O-N 3.08Å; A71-D75 PolarHBondContact O-N 2.84Å
72E97.4Very high95.8Very high85 Ų8555.2 Ų55.240%0.39730%0.3SS..Hα-helixtrans-62.1-36.2-179.2-65.8158.9121.400112.5L68 T69 D75 Y76L68-E72 HydrophobicContact CB-CB 4.23Å; L68-E72 HydrophobicContact CD2-CB 3.94Å; L68-E72 HydrophobicContact CG-CB 4.49Å; T69-E72 VanDerWaalsContact CB-OE2 3.27Å; T69-E72 WeakPolarHBondContact CB-OE2 3.23Å; T69-E72 WeakPolarHBondContact CG2-OE2 3.48Å; T69-E72 PolarHBondContact N-OE2 3.36Å; T69-E72 PolarHBondContact O-N 3.32Å; T69-E72 WeakPolarHBondContact OG1-CG 3.38Å; T69-E72 PolarHBondContact OG1-N 3.26Å; T69-E72 PolarHBondContact OG1-OE2 3.1Å; E72-D75 PolarHBondContact O-N 3.04Å; E72-Y76 VanDerWaalsContact O-CB 3.27Å; E72-Y76 WeakPolarHBondContact O-CB 3.37Å; E72-Y76 PolarHBondContact O-N 2.76Å
73I97.7Very high95.8Very high0 Ų052.7 Ų52.70%029%0.287CS..Hα-helixtrans-62-46.2173.3-67.9163.1000110.8I56 L68 T69 A71 D75 L77 V95 L99 W122I56-I73 HydrophobicContact CG1-CG2 4.11Å; I56-I73 HydrophobicContact CG2-CD1 4.22Å; I56-I73 HydrophobicContact CG2-CG2 4.5Å; L68-I73 HydrophobicContact CB-CD1 4.22Å; L68-I73 HydrophobicContact CB-CG1 3.74Å; L68-I73 HydrophobicContact CD1-CG1 4.03Å; T69-I73 WeakPolarHBondContact O-CD1 3.27Å; T69-I73 VanDerWaalsContact O-CG1 3.32Å; T69-I73 WeakPolarHBondContact O-CG1 3.27Å; T69-I73 PolarHBondContact O-N 3.33Å; A71-I73 VanDerWaalsContact C-N 3.31Å; A71-I73 PolarHBondContact O-N 2.95Å; I73-D75 VanDerWaalsContact C-N 3.33Å; I73-D75 PolarHBondContact O-N 3.12Å; I73-L77 HydrophobicContact CG2-CD1 4.34Å; I73-L77 VanDerWaalsContact O-CG 3.27Å; I73-L77 WeakPolarHBondContact O-CG 3.33Å; I73-L77 PolarHBondContact O-N 3.47Å; I73-L77 VanDerWaalsContact O-N 3.11Å; I73-V95 HydrophobicContact CG2-CG1 3.87Å; I73-L99 HydrophobicContact CD1-CD1 4.27Å; I73-L99 HydrophobicContact CD1-CD2 4.19Å; I73-W122 HydrophobicContact CD1-CB 4.2Å
74N97.2Very high95.7Very high14 Ų1451.8 Ų51.88%0.07528%0.28CS..Hα-helixtrans-62.4-42.3177.2-72.4-56.4000111.3L70 A71 L77 M78 W91L70-N74 PolarHBondContact O-N 3.27Å; L70-N74 PolarHBondContact O-ND2 2.84Å; A71-N74 WeakPolarHBondContact O-CB 3.42Å; A71-N74 PolarHBondContact O-N 2.71Å; A71-N74 VanDerWaalsContact O-N 3.08Å; N74-L77 PolarHBondContact O-N 2.84Å; N74-M78 WeakPolarHBondContact O-CG 3.32Å; N74-M78 PolarHBondContact O-N 2.71Å; N74-W91 HydrophobicContact CB-CH2 3.96Å; N74-W91 HydrophobicContact CB-CZ3 4.16Å; N74-W91 WeakPolarHBondContact OD1-CZ3 3.41Å
75D97.6Very high95.6Very high67 Ų6751.6 Ų51.636%0.35826%0.258SS..Hα-helixtrans-69.7-41.1-179.2-74.6-1000112.7A71 E72 I73 L77 M78 K79A71-D75 PolarHBondContact O-N 2.84Å; E72-D75 PolarHBondContact O-N 3.04Å; I73-D75 VanDerWaalsContact C-N 3.33Å; I73-D75 PolarHBondContact O-N 3.12Å; D75-L77 VanDerWaalsContact C-N 3.3Å; D75-L77 PolarHBondContact O-N 2.94Å; D75-M78 HydrophobicContact CB-CE 4.46Å; D75-M78 PolarHBondContact O-N 2.84Å; D75-M78 WeakPolarHBondContact OD1-CE 3.46Å; D75-K79 WeakPolarHBondContact O-CB 3.4Å; D75-K79 WeakPolarHBondContact O-CD 3.27Å; D75-K79 WeakPolarHBondContact O-CG 3.38Å; D75-K79 PolarHBondContact O-N 2.88Å
76Y97.6Very high95.5Very high36 Ų3651.6 Ų51.614%0.14127%0.269CS..Hα-helixtrans-56.2-45.5171.5171-84.9000111A59 E62 E72 K79 K80A59-Y76 VanDerWaalsContact CA-CE1 3.49Å; A59-Y76 HydrophobicContact CB-CD1 3.28Å; A59-Y76 HydrophobicContact CB-CD2 4.25Å; A59-Y76 HydrophobicContact CB-CE1 3.58Å; A59-Y76 HydrophobicContact CB-CE2 4.48Å; A59-Y76 HydrophobicContact CB-CG 3.66Å; E62-Y76 HydrophobicContact CB-CE2 4.17Å; E62-Y76 PolarHBondContact OE1-OH 3.48Å; E62-Y76 VanDerWaalsContact OE1-OH 3.13Å; E62-Y76 WeakPolarHBondContact OE2-CE2 3.25Å; E62-Y76 PolarHBondContact OE2-OH 3.37Å; E72-Y76 VanDerWaalsContact O-CB 3.27Å; E72-Y76 WeakPolarHBondContact O-CB 3.37Å; E72-Y76 PolarHBondContact O-N 2.76Å; Y76-K79 PolarHBondContact O-N 2.67Å; Y76-K80 HydrophobicContact CE1-CB 4.42Å; Y76-K80 HydrophobicContact CE1-CD 4.09Å; Y76-K80 HydrophobicContact CE2-CD 4.21Å; Y76-K80 WeakPolarHBondContact O-CB 3.49Å; Y76-K80 PolarHBondContact O-N 2.92Å; Y76-K80 WeakPolarHBondContact OH-CD 3.47Å; Y76-K80 PolarHBondContact OH-NZ 3.42Å
77L97Very high95.4Very high0 Ų056 Ų560%029%0.294CS..Hα-helixtrans-65.4-41.1179.6-69178.6000112.3L55 I73 N74 D75 F81 F84 W91 V95L55-L77 HydrophobicContact CB-CD2 3.79Å; L55-L77 HydrophobicContact CD2-CD2 4.04Å; L55-L77 HydrophobicContact CG-CD2 4.42Å; I73-L77 HydrophobicContact CG2-CD1 4.34Å; I73-L77 VanDerWaalsContact O-CG 3.27Å; I73-L77 WeakPolarHBondContact O-CG 3.33Å; I73-L77 PolarHBondContact O-N 3.47Å; I73-L77 VanDerWaalsContact O-N 3.11Å; N74-L77 PolarHBondContact O-N 2.84Å; D75-L77 VanDerWaalsContact C-N 3.3Å; D75-L77 PolarHBondContact O-N 2.94Å; L77-F81 HydrophobicContact CD2-CD2 4.02Å; L77-F81 HydrophobicContact CD2-CE2 4.14Å; L77-F81 PolarHBondContact O-N 3.08Å; L77-F84 HydrophobicContact CB-CD2 3.73Å; L77-F84 HydrophobicContact CB-CE2 4.24Å; L77-F84 HydrophobicContact CB-CG 4.25Å; L77-F84 HydrophobicContact CD2-CE2 4.23Å; L77-W91 HydrophobicContact CB-CZ3 4.42Å; L77-W91 HydrophobicContact CD1-CZ3 4.32Å; L77-V95 HydrophobicContact CD1-CG2 3.92Å
78M96.3Very high95.2Very high45 Ų4557.5 Ų57.522%0.22230%0.301CS..Hα-helixtrans-65.2-39.1173.6-67.6-175-59.700112.2N74 D75 F84 R85 W91N74-M78 WeakPolarHBondContact O-CG 3.32Å; N74-M78 PolarHBondContact O-N 2.71Å; D75-M78 HydrophobicContact CB-CE 4.46Å; D75-M78 PolarHBondContact O-N 2.84Å; D75-M78 WeakPolarHBondContact OD1-CE 3.46Å; M78-F84 HydrophobicContact CG-CB 4.22Å; M78-R85 VanDerWaalsContact O-CG 3.28Å; M78-R85 WeakPolarHBondContact O-CG 3.5Å; M78-R85 PolarHBondContact O-NE 3.01Å; M78-W91 HydrophobicContact CG-CH2 3.74Å; M78-W91 HydrophobicContact CG-CZ2 3.69Å; M78-W91 HydrophobicContact SD-CH2 4.17Å; M78-W91 HydrophobicContact SD-CZ2 3.9Å
79K96.3Very high95.1Very high149 Ų14960.3 Ų60.365%0.64832%0.319SS*.Hα-helixtrans-64-56.1175.8-72.7162.8-174.4171.70110.7D75 Y76 R85D75-K79 WeakPolarHBondContact O-CB 3.4Å; D75-K79 WeakPolarHBondContact O-CD 3.27Å; D75-K79 WeakPolarHBondContact O-CG 3.38Å; D75-K79 PolarHBondContact O-N 2.88Å; Y76-K79 PolarHBondContact O-N 2.67Å; K79-R85 PolarHBondContact O-NH2 3.47Å
80K94.8Very high95Very high93 Ų9361.1 Ų61.140%0.40433%0.329SS..Hα-helixtrans-77.9-37.8-171.3-165.3166.5-170.8167.30114.8E62 Y76E62-K80 IonicContact OE1-NZ 2.66Å; E62-K80 PolarHBondContact OE1-NZ 3.07Å; E62-K80 IonicContact OE2-NZ 2.67Å; E62-K80 PolarHBondContact OE2-NZ 2.95Å; Y76-K80 HydrophobicContact CE1-CB 4.42Å; Y76-K80 HydrophobicContact CE1-CD 4.09Å; Y76-K80 HydrophobicContact CE2-CD 4.21Å; Y76-K80 WeakPolarHBondContact O-CB 3.49Å; Y76-K80 PolarHBondContact O-N 2.92Å; Y76-K80 WeakPolarHBondContact OH-CD 3.47Å; Y76-K80 PolarHBondContact OH-NZ 3.42Å
81F93.6Very high94.9Very high28 Ų2859 Ų5912%0.12332%0.318CS..  trans-118.8111.5-175.3-55.9-79.1000111.9P48 Y50 L55 M58 L77 F83 F84P48-F81 HydrophobicContact CB-CD1 4.09Å; P48-F81 HydrophobicContact CB-CE1 4.34Å; P48-F81 HydrophobicContact CG-CB 3.95Å; P48-F81 HydrophobicContact CG-CD1 3.71Å; P48-F81 HydrophobicContact CG-CE1 4.44Å; P48-F81 HydrophobicContact CG-CG 3.9Å; Y50-F81 HydrophobicContact CD2-CE1 4.21Å; Y50-F81 HydrophobicContact CD2-CZ 4.28Å; Y50-F81 HydrophobicContact CE2-CE1 4.01Å; Y50-F81 HydrophobicContact CE2-CZ 4.27Å; L55-F81 HydrophobicContact CD2-CD2 3.78Å; L55-F81 HydrophobicContact CD2-CE1 4.4Å; L55-F81 HydrophobicContact CD2-CE2 3.38Å; L55-F81 HydrophobicContact CD2-CG 4.44Å; L55-F81 HydrophobicContact CD2-CZ 3.73Å; M58-F81 HydrophobicContact CE-CE2 4.38Å; M58-F81 HydrophobicContact CE-CZ 3.9Å; L77-F81 HydrophobicContact CD2-CD2 4.02Å; L77-F81 HydrophobicContact CD2-CE2 4.14Å; L77-F81 PolarHBondContact O-N 3.08Å; F81-F83 PolarHBondContact O-N 3.05Å; F81-F84 HydrophobicContact CB-CD2 3.79Å; F81-F84 HydrophobicContact CB-CE2 3.99Å; F81-F84 HydrophobicContact CD2-CD2 4.45Å; F81-F84 HydrophobicContact CD2-CE2 4.22Å; F81-F84 HydrophobicContact CG-CE2 4.36Å; F81-F84 PolarHBondContact O-N 3.23Å; F81-F84 VanDerWaalsContact O-N 3.1Å
82P93Very high94.9Very high50 Ų5060.9 Ų60.933%0.32532%0.315SS..G310 helixtrans-55-22180-30.637.4000115.9R45 F84 R85R45-P82 WeakPolarHBondContact CD-O 3.11Å; P82-F84 VanDerWaalsContact C-N 3.26Å; P82-F84 PolarHBondContact O-N 2.8Å; P82-R85 PolarHBondContact O-N 3.05Å
83F92.1Very high94.9Very high53 Ų5361.3 Ų61.323%0.23232%0.32CS..G310 helixtrans-60.2-27.6175.8171.8-104.9000114.5R45 K47 P48 F81R45-F83 VanDerWaalsContact O-CD2 3.25Å; R45-F83 WeakPolarHBondContact O-CD2 3.5Å; K47-F83 HydrophobicContact CB-CD2 4.25Å; K47-F83 HydrophobicContact CB-CE1 4.49Å; K47-F83 HydrophobicContact CB-CE2 4.05Å; K47-F83 HydrophobicContact CB-CZ 4.18Å; K47-F83 HydrophobicContact CD-CE1 4.22Å; K47-F83 HydrophobicContact CD-CZ 3.96Å; K47-F83 HydrophobicContact CG-CD1 4.28Å; K47-F83 HydrophobicContact CG-CE1 3.88Å; K47-F83 HydrophobicContact CG-CE2 4.27Å; K47-F83 HydrophobicContact CG-CZ 3.88Å; P48-F83 HydrophobicContact CG-CB 4.43Å; F81-F83 PolarHBondContact O-N 3.05Å
84F94.1Very high94.9Very high2 Ų263 Ų631%0.00933%0.332CS..G310 helixtrans-90.3-1.8-179.8-60.2-61.8000113.8P48 Y52 L55 L77 M78 F81 P82 W91P48-F84 HydrophobicContact CG-CE2 4.3Å; Y52-F84 HydrophobicContact CE1-CE1 4.08Å; Y52-F84 HydrophobicContact CE1-CZ 4.31Å; L55-F84 HydrophobicContact CD1-CE2 4.03Å; L55-F84 HydrophobicContact CD1-CZ 3.67Å; L55-F84 HydrophobicContact CD2-CE2 4.32Å; L77-F84 HydrophobicContact CB-CD2 3.73Å; L77-F84 HydrophobicContact CB-CE2 4.24Å; L77-F84 HydrophobicContact CB-CG 4.25Å; L77-F84 HydrophobicContact CD2-CE2 4.23Å; M78-F84 HydrophobicContact CG-CB 4.22Å; F81-F84 HydrophobicContact CB-CD2 3.79Å; F81-F84 HydrophobicContact CB-CE2 3.99Å; F81-F84 HydrophobicContact CD2-CD2 4.45Å; F81-F84 HydrophobicContact CD2-CE2 4.22Å; F81-F84 HydrophobicContact CG-CE2 4.36Å; F81-F84 PolarHBondContact O-N 3.23Å; F81-F84 VanDerWaalsContact O-N 3.1Å; P82-F84 VanDerWaalsContact C-N 3.26Å; P82-F84 PolarHBondContact O-N 2.8Å; F84-W91 HydrophobicContact CB-CD2 4.21Å; F84-W91 HydrophobicContact CB-CH2 4.19Å; F84-W91 HydrophobicContact CB-CZ2 3.87Å; F84-W91 HydrophobicContact CB-CZ3 4.49Å; F84-W91 HydrophobicContact CD1-CB 3.96Å; F84-W91 AromaticContact CD1-CD2 3.5Å; F84-W91 HydrophobicContact CD1-CD2 3.5Å; F84-W91 AromaticContact CD1-CE3 3.77Å; F84-W91 HydrophobicContact CD1-CE3 3.77Å; F84-W91 AromaticContact CD1-CG 3.59Å; F84-W91 HydrophobicContact CD1-CG 3.59Å; F84-W91 HydrophobicContact CD1-CZ3 4.45Å; F84-W91 HydrophobicContact CE1-CB 4.03Å; F84-W91 HydrophobicContact CE1-CD2 4.28Å; F84-W91 HydrophobicContact CE1-CE3 4.33Å; F84-W91 HydrophobicContact CE1-CG 4.17Å; F84-W91 HydrophobicContact CG-CD2 4.19Å; F84-W91 HydrophobicContact CG-CE3 4.29Å; F84-W91 WeakPolarHBondContact O-CZ2 3.5Å; F84-W91 PolarHBondContact O-NE1 3.01Å
85R93.1Very high94.9Very high134 Ų13462.4 Ų62.451%0.50633%0.329SS..  trans-86.3143.9179.5-55.3-179.9-170.4170.53111.2M78 K79 P82M78-R85 VanDerWaalsContact O-CG 3.28Å; M78-R85 WeakPolarHBondContact O-CG 3.5Å; M78-R85 PolarHBondContact O-NE 3.01Å; K79-R85 PolarHBondContact O-NH2 3.47Å; P82-R85 PolarHBondContact O-N 3.05Å
86G91.4Very high94.8Very high64 Ų6465 Ų6566%0.6633%0.334SS*.SBendtrans116.8-170.8176.500000113.1Y88G86-Y88 PolarHBondContact O-N 2.86Å
87S90.7Very high94.8Very high123 Ų12368.1 Ų68.186%0.8635%0.349SS*.SBendtrans-73.3-21.7-176.151.50000114.5T89S87-T89 PolarHBondContact O-N 3.5Å
88Y92Very high94.8Very high139 Ų13969.4 Ų69.455%0.54536%0.356SS..  trans-74.3108.4178.3178-104.8000111.3G86 W91G86-Y88 PolarHBondContact O-N 2.86Å; Y88-W91 AromaticContact CD1-CD1 3.95Å; Y88-W91 PolarHBondContact O-NE1 3.3Å
89T94.2Very high94.8Very high75 Ų7567.4 Ų67.446%0.4635%0.346SS..  trans-103.6-2.6-177.353.30000114.4S87 W91 R92S87-T89 PolarHBondContact O-N 3.5Å; T89-W91 PolarHBondContact O-N 3.34Å; T89-R92 VanDerWaalsContact O-CB 3.25Å; T89-R92 WeakPolarHBondContact O-CB 3.23Å; T89-R92 WeakPolarHBondContact O-CG 3.33Å; T89-R92 PolarHBondContact O-N 3.35Å
90G95Very high94.7Very high29 Ų2964.7 Ų64.730%0.29935%0.346SS..THydrogen-bonded Turntrans-58.2-26.3-173.400000114.8R92 N93G90-R92 PolarHBondContact O-N 3Å; G90-N93 WeakPolarHBondContact O-CB 3.32Å; G90-N93 PolarHBondContact O-N 3.5Å; G90-N93 VanDerWaalsContact O-N 3.11Å
91W95.3Very high94.7Very high5 Ų565.1 Ų65.12%0.01935%0.352CS..Hα-helixtrans-60-28.8172.260.6-94.8000113.5N74 L77 M78 F84 Y88 T89 N93 S94 V95N74-W91 HydrophobicContact CB-CH2 3.96Å; N74-W91 HydrophobicContact CB-CZ3 4.16Å; N74-W91 WeakPolarHBondContact OD1-CZ3 3.41Å; L77-W91 HydrophobicContact CB-CZ3 4.42Å; L77-W91 HydrophobicContact CD1-CZ3 4.32Å; M78-W91 HydrophobicContact CG-CH2 3.74Å; M78-W91 HydrophobicContact CG-CZ2 3.69Å; M78-W91 HydrophobicContact SD-CH2 4.17Å; M78-W91 HydrophobicContact SD-CZ2 3.9Å; F84-W91 HydrophobicContact CB-CD2 4.21Å; F84-W91 HydrophobicContact CB-CH2 4.19Å; F84-W91 HydrophobicContact CB-CZ2 3.87Å; F84-W91 HydrophobicContact CB-CZ3 4.49Å; F84-W91 HydrophobicContact CD1-CB 3.96Å; F84-W91 AromaticContact CD1-CD2 3.5Å; F84-W91 HydrophobicContact CD1-CD2 3.5Å; F84-W91 AromaticContact CD1-CE3 3.77Å; F84-W91 HydrophobicContact CD1-CE3 3.77Å; F84-W91 AromaticContact CD1-CG 3.59Å; F84-W91 HydrophobicContact CD1-CG 3.59Å; F84-W91 HydrophobicContact CD1-CZ3 4.45Å; F84-W91 HydrophobicContact CE1-CB 4.03Å; F84-W91 HydrophobicContact CE1-CD2 4.28Å; F84-W91 HydrophobicContact CE1-CE3 4.33Å; F84-W91 HydrophobicContact CE1-CG 4.17Å; F84-W91 HydrophobicContact CG-CD2 4.19Å; F84-W91 HydrophobicContact CG-CE3 4.29Å; F84-W91 WeakPolarHBondContact O-CZ2 3.5Å; F84-W91 PolarHBondContact O-NE1 3.01Å; Y88-W91 AromaticContact CD1-CD1 3.95Å; Y88-W91 PolarHBondContact O-NE1 3.3Å; T89-W91 PolarHBondContact O-N 3.34Å; W91-N93 PolarHBondContact O-N 2.76Å; W91-S94 WeakPolarHBondContact O-CB 3.27Å; W91-S94 PolarHBondContact O-N 2.78Å; W91-V95 HydrophobicContact CE3-CG2 3.99Å; W91-V95 HydrophobicContact CZ3-CG2 4.28Å; W91-V95 PolarHBondContact O-N 2.93Å
92R96.8Very high94.6Very high87 Ų8765.3 Ų65.333%0.32836%0.355SS..Hα-helixtrans-61.7-30.7175.8-62.7-175.1170.3-178.8-7.5111.7T89 G90 V95 R96T89-R92 VanDerWaalsContact O-CB 3.25Å; T89-R92 WeakPolarHBondContact O-CB 3.23Å; T89-R92 WeakPolarHBondContact O-CG 3.33Å; T89-R92 PolarHBondContact O-N 3.35Å; G90-R92 PolarHBondContact O-N 3Å; R92-V95 PolarHBondContact O-N 3Å; R92-R96 WeakPolarHBondContact O-CG 3.48Å; R92-R96 PolarHBondContact O-N 3.17Å; R92-R96 VanDerWaalsContact O-N 3.09Å
93N97Very high94.5Very high95 Ų9569.3 Ų69.351%0.50837%0.373SS..Hα-helixtrans-68.4-40.7173.9-162.942.2000111.4G90 W91 V95 R96 H97G90-N93 WeakPolarHBondContact O-CB 3.32Å; G90-N93 PolarHBondContact O-N 3.5Å; G90-N93 VanDerWaalsContact O-N 3.11Å; W91-N93 PolarHBondContact O-N 2.76Å; N93-V95 VanDerWaalsContact C-N 3.32Å; N93-V95 PolarHBondContact O-N 2.63Å; N93-R96 PolarHBondContact O-N 3.33Å; N93-R96 PolarHBondContact OD1-NH2 3.31Å; N93-H97 VanDerWaalsContact O-CB 3.32Å; N93-H97 WeakPolarHBondContact O-CB 3.42Å; N93-H97 PolarHBondContact O-N 2.97Å
94S97.1Very high94.5Very high36 Ų3667.8 Ų67.825%0.25237%0.369SS..Hα-helixtrans-62.6-38.1173.7-49.70000112.4Y52 W91 N98Y52-S94 PolarHBondContact OH-OG 2.69Å; W91-S94 WeakPolarHBondContact O-CB 3.27Å; W91-S94 PolarHBondContact O-N 2.78Å; S94-N98 WeakPolarHBondContact O-CB 3.48Å; S94-N98 PolarHBondContact O-N 2.76Å; S94-N98 PolarHBondContact O-ND2 3.27Å
95V97.2Very high94.5Very high0 Ų068.2 Ų68.20%037%0.371CS..Hα-helixtrans-60.8-54.1174.5173.40000110.6Y52 I56 L70 I73 L77 W91 R92 N93 H97 N98 L99Y52-V95 HydrophobicContact CD1-CG2 4.3Å; I56-V95 HydrophobicContact CD1-CG1 4.27Å; I56-V95 HydrophobicContact CG1-CG1 4.37Å; L70-V95 HydrophobicContact CD1-CG1 3.99Å; I73-V95 HydrophobicContact CG2-CG1 3.87Å; L77-V95 HydrophobicContact CD1-CG2 3.92Å; W91-V95 HydrophobicContact CE3-CG2 3.99Å; W91-V95 HydrophobicContact CZ3-CG2 4.28Å; W91-V95 PolarHBondContact O-N 2.93Å; R92-V95 PolarHBondContact O-N 3Å; N93-V95 VanDerWaalsContact C-N 3.32Å; N93-V95 PolarHBondContact O-N 2.63Å; V95-H97 VanDerWaalsContact C-N 3.34Å; V95-H97 PolarHBondContact O-N 3.3Å; V95-N98 PolarHBondContact O-N 3.08Å; V95-N98 VanDerWaalsContact O-N 3.15Å; V95-L99 HydrophobicContact CG1-CD1 4.19Å; V95-L99 WeakPolarHBondContact O-CG 3.15Å; V95-L99 PolarHBondContact O-N 3.47Å
96R97.2Very high94.6Very high123 Ų12365.2 Ų65.246%0.46436%0.364SS..Hα-helixtrans-53.4-49.6176.5-70.9-172.4-57.9-118.15.6112.4L70 R92 N93 N98 L99 S100L70-R96 HydrophobicContact CD1-CG 3.88Å; L70-R96 HydrophobicContact CD2-CG 3.7Å; L70-R96 HydrophobicContact CG-CG 4.46Å; R92-R96 WeakPolarHBondContact O-CG 3.48Å; R92-R96 PolarHBondContact O-N 3.17Å; R92-R96 VanDerWaalsContact O-N 3.09Å; N93-R96 PolarHBondContact O-N 3.33Å; N93-R96 PolarHBondContact OD1-NH2 3.31Å; R96-N98 VanDerWaalsContact C-N 3.33Å; R96-N98 PolarHBondContact O-N 3.05Å; R96-L99 WeakPolarHBondContact O-CB 2.99Å; R96-L99 PolarHBondContact O-N 3.45Å; R96-S100 PolarHBondContact O-N 2.91Å; R96-S100 PolarHBondContact O-OG 3.5Å
97H97.3Very high94.8Very high101 Ų10167 Ų6747%0.46835%0.354SS..Hα-helixtrans-62.1-37.3179.9170.367.9000112.7N93 V95 S100 L101N93-H97 VanDerWaalsContact O-CB 3.32Å; N93-H97 WeakPolarHBondContact O-CB 3.42Å; N93-H97 PolarHBondContact O-N 2.97Å; V95-H97 VanDerWaalsContact C-N 3.34Å; V95-H97 PolarHBondContact O-N 3.3Å; H97-S100 PolarHBondContact O-N 3.37Å; H97-S100 PolarHBondContact O-OG 3.09Å; H97-L101 WeakPolarHBondContact CE1-CD1 3.09Å; H97-L101 WeakPolarHBondContact O-CB 3.35Å; H97-L101 PolarHBondContact O-N 3.09Å
98N96.6Very high95Very high26 Ų2663.3 Ų63.314%0.13933%0.326CS..Hα-helixtrans-72-32.9177.5-84-112000112.5I56 S94 V95 R96 N102I56-N98 HydrophobicContact CD1-CB 3.96Å; S94-N98 WeakPolarHBondContact O-CB 3.48Å; S94-N98 PolarHBondContact O-N 2.76Å; S94-N98 PolarHBondContact O-ND2 3.27Å; V95-N98 PolarHBondContact O-N 3.08Å; V95-N98 VanDerWaalsContact O-N 3.15Å; R96-N98 VanDerWaalsContact C-N 3.33Å; R96-N98 PolarHBondContact O-N 3.05Å; N98-N102 PolarHBondContact O-N 2.87Å; N98-N102 PolarHBondContact O-ND2 2.93Å
99L96.1Very high95Very high3 Ų360 Ų602%0.01632%0.317CS..Hα-helixtrans-64.4-39.5173.3-69.6167.8000111.9I56 L70 I73 V95 R96 F105 W122I56-L99 HydrophobicContact CD1-CD2 4.11Å; I56-L99 HydrophobicContact CD1-CG 4.09Å; I56-L99 HydrophobicContact CG2-CD2 3.69Å; L70-L99 HydrophobicContact CD1-CD1 3.85Å; I73-L99 HydrophobicContact CD1-CD1 4.27Å; I73-L99 HydrophobicContact CD1-CD2 4.19Å; V95-L99 HydrophobicContact CG1-CD1 4.19Å; V95-L99 WeakPolarHBondContact O-CG 3.15Å; V95-L99 PolarHBondContact O-N 3.47Å; R96-L99 WeakPolarHBondContact O-CB 2.99Å; R96-L99 PolarHBondContact O-N 3.45Å; L99-F105 HydrophobicContact CD2-CB 4.15Å; L99-F105 HydrophobicContact CD2-CD1 4.33Å; L99-F105 HydrophobicContact CD2-CD2 4.21Å; L99-F105 HydrophobicContact CD2-CG 3.95Å; L99-W122 HydrophobicContact CB-CD2 4.05Å; L99-W122 HydrophobicContact CB-CE3 4.01Å; L99-W122 HydrophobicContact CB-CH2 3.88Å; L99-W122 HydrophobicContact CB-CZ2 3.94Å; L99-W122 HydrophobicContact CB-CZ3 3.93Å; L99-W122 HydrophobicContact CD1-CD2 4.22Å; L99-W122 HydrophobicContact CD1-CG 4.24Å; L99-W122 HydrophobicContact CD2-CB 4.07Å; L99-W122 HydrophobicContact CD2-CD2 3.82Å; L99-W122 HydrophobicContact CD2-CE3 4.01Å; L99-W122 HydrophobicContact CD2-CG 3.84Å; L99-W122 HydrophobicContact CG-CD2 4.25Å; L99-W122 WeakPolarHBondContact O-CZ3 3.39Å
100S95.2Very high94.7Very high93 Ų9364 Ų6465%0.6532%0.324SS*.Hα-helixtrans-87.4-16.5-178.862.10000115.4R96 H97R96-S100 PolarHBondContact O-N 2.91Å; R96-S100 PolarHBondContact O-OG 3.5Å; H97-S100 PolarHBondContact O-N 3.37Å; H97-S100 PolarHBondContact O-OG 3.09Å
101L93.9Very high94.3Very high102 Ų10265.5 Ų65.553%0.53433%0.325SS..Hα-helixtrans-96.2-26.4-175.9-179.6146.6000113.9H97H97-L101 WeakPolarHBondContact CE1-CD1 3.09Å; H97-L101 WeakPolarHBondContact O-CB 3.35Å; H97-L101 PolarHBondContact O-N 3.09Å
102N92Very high93.8Very high32 Ų3270.6 Ų70.617%0.17136%0.359CS..  trans-112.8123-170.8-55.4-93.1000111I53 N98 C104 F105I53-N102 VanDerWaalsContact CD1-OD1 3.26Å; I53-N102 WeakPolarHBondContact CD1-OD1 3.32Å; N98-N102 PolarHBondContact O-N 2.87Å; N98-N102 PolarHBondContact O-ND2 2.93Å; N102-C104 HydrophobicContact CB-CB 4.28Å; N102-C104 PolarHBondContact O-N 3.39Å; N102-F105 HydrophobicContact CB-CD2 4.36Å; N102-F105 PolarHBondContact O-N 2.91Å
103D91.1Very high93.2Very high134 Ų13470.8 Ų70.872%0.71737%0.374SS*.THydrogen-bonded Turntrans-62.7-1.2176.2-50.1-52.4000114.2F105 N125D103-F105 PolarHBondContact O-N 2.86Å; D103-N125 WeakPolarHBondContact O-CB 3.28Å; D103-N125 PolarHBondContact O-ND2 3.18Å
104C91.8Very high92.6Very high21 Ų2174.7 Ų74.714%0.14238%0.381CS..THydrogen-bonded Turntrans-61.2-23.2164.9-55.90000112.6I53 N102 L124 N125I53-C104 HydrophobicContact CG2-CB 4.28Å; N102-C104 HydrophobicContact CB-CB 4.28Å; N102-C104 PolarHBondContact O-N 3.39Å; C104-L124 WeakPolarHBondContact O-CA 3.42Å; C104-N125 PolarHBondContact O-N 3.11Å
105F94.3Very high91.7Very high10 Ų1076 Ų764%0.04439%0.389CS..EExtended strand (participates in β ladder)trans-121.5122.5-175.1-54.2-63.3000112.2I53 I56 I60 L99 N102 D103 W122 M123 L124I53-F105 HydrophobicContact CB-CE2 4.36Å; I53-F105 HydrophobicContact CB-CZ 4.37Å; I53-F105 HydrophobicContact CG1-CE2 4.47Å; I53-F105 HydrophobicContact CG2-CE2 3.95Å; I53-F105 HydrophobicContact CG2-CZ 3.8Å; I56-F105 HydrophobicContact CB-CE1 3.9Å; I56-F105 HydrophobicContact CB-CE2 4.38Å; I56-F105 HydrophobicContact CB-CZ 3.67Å; I56-F105 HydrophobicContact CD1-CE2 4.18Å; I56-F105 HydrophobicContact CD1-CZ 4.32Å; I56-F105 HydrophobicContact CG2-CD1 3.86Å; I56-F105 HydrophobicContact CG2-CE1 3.35Å; I56-F105 HydrophobicContact CG2-CE2 4.29Å; I56-F105 HydrophobicContact CG2-CZ 3.6Å; I60-F105 HydrophobicContact CD1-CD1 4.01Å; I60-F105 HydrophobicContact CD1-CE1 4.21Å; L99-F105 HydrophobicContact CD2-CB 4.15Å; L99-F105 HydrophobicContact CD2-CD1 4.33Å; L99-F105 HydrophobicContact CD2-CD2 4.21Å; L99-F105 HydrophobicContact CD2-CG 3.95Å; N102-F105 HydrophobicContact CB-CD2 4.36Å; N102-F105 PolarHBondContact O-N 2.91Å; D103-F105 PolarHBondContact O-N 2.86Å; F105-W122 HydrophobicContact CB-CE3 3.97Å; F105-W122 HydrophobicContact CB-CZ3 4.37Å; F105-M123 CarbonylContact C-O 3.57Å; F105-M123 WeakPolarHBondContact CA-O 3.25Å; F105-L124 HydrophobicContact CD1-CD2 4.02Å; F105-L124 HydrophobicContact CE1-CD2 3.64Å
106L94.7Very high90.9Very high72 Ų7287.7 Ų87.738%0.37743%0.433SS..EExtended strand (participates in β ladder)trans-98.3128.1175.3-57-179.3000110.2V108 W122 M123 N125L106-V108 PolarHBondContact O-N 3.18Å; L106-W122 WeakPolarHBondContact O-CA 3.36Å; L106-M123 PolarHBondContact N-O 3.3Å; L106-M123 PolarHBondContact O-N 3.05Å; L106-N125 HydrophobicContact CD1-CB 4.04Å; L106-N125 HydrophobicContact CD2-CB 3.94Å; L106-N125 HydrophobicContact CG-CB 3.73Å
107K95.4Very high89.9Confident102 Ų10283.2 Ų83.244%0.44343%0.426SS..EExtended strand (participates in β ladder)trans-76.4109.2167.7-175.6-163.3170.2-161.90108.7P115 N120 W122K107-P115 PolarHBondContact NZ-O 3.06Å; K107-N120 WeakPolarHBondContact CE-ND2 3.49Å; K107-N120 HydrophobicContact CG-CB 4.21Å; K107-N120 PolarHBondContact NZ-ND2 3.21Å; K107-W122 HydrophobicContact CB-CE3 4.18Å; K107-W122 HydrophobicContact CB-CH2 3.88Å; K107-W122 HydrophobicContact CB-CZ2 4.28Å; K107-W122 HydrophobicContact CB-CZ3 3.81Å; K107-W122 HydrophobicContact CG-CH2 4.39Å; K107-W122 HydrophobicContact CG-CZ2 4.33Å
108V93.9Very high88.8Confident45 Ų4587.3 Ų87.327%0.27344%0.442SS..EExtended strand (participates in β ladder)trans-100.2128.3177.3177.10000109.5L106 R110 Y121 M123L106-V108 PolarHBondContact O-N 3.18Å; V108-R110 PolarHBondContact O-N 2.82Å; V108-Y121 PolarHBondContact N-O 3.42Å; V108-Y121 PolarHBondContact O-N 2.98Å; V108-M123 HydrophobicContact CB-SD 4.43Å; V108-M123 HydrophobicContact CG2-CB 4.24Å; V108-M123 HydrophobicContact CG2-CG 3.98Å; V108-M123 HydrophobicContact CG2-SD 3.78Å
109L93.2Very high88.3Confident68 Ų6890.1 Ų90.136%0.35646%0.457SS..  trans-68.2132-178.3-61.4-174.6000111.1P115 N120L109-P115 HydrophobicContact CD1-CB 3.81Å; L109-P115 HydrophobicContact CD2-CB 4.23Å; L109-N120 VanDerWaalsContact CA-OD1 3.28Å; L109-N120 WeakPolarHBondContact CA-OD1 3.38Å
110R88.3Confident88.3Confident161 Ų16190.5 Ų90.561%0.60846%0.459SS*.SBendtrans-77.4-32.6174.1-179.9167.1-171.7-78.2-1.7112.2V108 N120 Y121V108-R110 PolarHBondContact O-N 2.82Å; R110-N120 PolarHBondContact N-OD1 3.47Å; R110-Y121 HydrophobicContact CB-CD2 4.06Å; R110-Y121 HydrophobicContact CB-CE2 3.95Å; R110-Y121 HydrophobicContact CG-CD2 4.36Å; R110-Y121 HydrophobicContact CG-CE2 3.72Å; R110-Y121 PolarHBondContact NE-OH 3.46Å
111D86.5Confident88.3Confident59 Ų5988.3 Ų88.332%0.31644%0.437SS..  trans-137.3112.5176.2173.1-1.2000107.4S113 R114D111-S113 VanDerWaalsContact CG-OG 3.22Å; D111-S113 PolarHBondContact O-N 2.86Å; D111-S113 WeakPolarHBondContact OD1-CA 3.45Å; D111-S113 WeakPolarHBondContact OD1-CB 3.5Å; D111-S113 PolarHBondContact OD1-N 2.94Å; D111-S113 PolarHBondContact OD1-OG 3.37Å; D111-S113 PolarHBondContact OD2-OG 2.99Å; D111-S113 VanDerWaalsContact OD2-OG 3.12Å; D111-R114 HydrophobicContact CB-CB 4.34Å; D111-R114 CarbonylContact O-C 3.39Å; D111-R114 PolarHBondContact O-N 3.01Å; D111-R114 WeakPolarHBondContact OD2-CG 3.26Å
112P83.8Confident88.4Confident112 Ų11285.4 Ų85.473%0.72742%0.419SS*.THydrogen-bonded Turntrans-59.5-26.8178.5-25.535.5000114R114P112-R114 VanDerWaalsContact C-N 3.28Å; P112-R114 PolarHBondContact O-N 2.83Å
113S85.4Confident88.6Confident92 Ų9286.8 Ų86.864%0.64343%0.425SS*.THydrogen-bonded Turntrans-75.9-16177.376.90000113.1D111D111-S113 VanDerWaalsContact CG-OG 3.22Å; D111-S113 PolarHBondContact O-N 2.86Å; D111-S113 WeakPolarHBondContact OD1-CA 3.45Å; D111-S113 WeakPolarHBondContact OD1-CB 3.5Å; D111-S113 PolarHBondContact OD1-N 2.94Å; D111-S113 PolarHBondContact OD1-OG 3.37Å; D111-S113 PolarHBondContact OD2-OG 2.99Å; D111-S113 VanDerWaalsContact OD2-OG 3.12Å
114R83.6Confident88.7Confident177 Ų17781.5 Ų81.567%0.66840%0.397SS*.  trans-12967.3-178-64.5-177.4-177.2-90.5-0.3111.3D111 P112 W116 G117D111-R114 HydrophobicContact CB-CB 4.34Å; D111-R114 CarbonylContact O-C 3.39Å; D111-R114 PolarHBondContact O-N 3.01Å; D111-R114 WeakPolarHBondContact OD2-CG 3.26Å; P112-R114 VanDerWaalsContact C-N 3.28Å; P112-R114 PolarHBondContact O-N 2.83Å; R114-W116 PolarHBondContact O-N 3.25Å; R114-W116 VanDerWaalsContact O-N 3.12Å; R114-G117 WeakPolarHBondContact O-CA 3.42Å; R114-G117 PolarHBondContact O-N 3.15Å
115P77.8Confident88.7Confident64 Ų6481.6 Ų81.642%0.41640%0.396SS..THydrogen-bonded Turntrans-60.5-26.3-176.924.1-35000114.3K107 L109 G117 N120K107-P115 PolarHBondContact NZ-O 3.06Å; L109-P115 HydrophobicContact CD1-CB 3.81Å; L109-P115 HydrophobicContact CD2-CB 4.23Å; P115-G117 VanDerWaalsContact C-N 3.27Å; P115-G117 PolarHBondContact O-N 3.36Å; P115-N120 PolarHBondContact O-ND2 3.09Å
116W80.6Confident88.4Confident244 Ų24484.8 Ų84.892%0.92442%0.417SS*.THydrogen-bonded Turntrans-869.1174.6-126-94.7000114.4R114R114-W116 PolarHBondContact O-N 3.25Å; R114-W116 VanDerWaalsContact O-N 3.12Å
117G75.7Confident87.9Confident30 Ų3089.2 Ų89.231%0.30944%0.436SS..  trans-53.9141.4-179.800000113.4R114 P115 N120R114-G117 WeakPolarHBondContact O-CA 3.42Å; R114-G117 PolarHBondContact O-N 3.15Å; P115-G117 VanDerWaalsContact C-N 3.27Å; P115-G117 PolarHBondContact O-N 3.36Å; G117-N120 PolarHBondContact O-ND2 3.4Å
118K75Confident87.1Confident187 Ų18785 Ų8581%0.81342%0.419SS*.THydrogen-bonded Turntrans-57148.3157.5-139.2178.5-173.4177.70108.1N120K118-N120 PolarHBondContact O-N 2.82Å
119D87.1Confident85.7Confident84 Ų8492 Ų9245%0.44945%0.449SS..THydrogen-bonded Turntrans62.641.5168.6-44.3-50.5000114.9T69T69-D119 HydrophobicContact CG2-CB 4.32Å
120N94.1Very high84.3Confident12 Ų1291.1 Ų91.16%0.06444%0.441CS..  trans-64.1151.7160-78-60.1000111.6K107 L109 R110 P115 G117 K118K107-N120 WeakPolarHBondContact CE-ND2 3.49Å; K107-N120 HydrophobicContact CG-CB 4.21Å; K107-N120 PolarHBondContact NZ-ND2 3.21Å; L109-N120 VanDerWaalsContact CA-OD1 3.28Å; L109-N120 WeakPolarHBondContact CA-OD1 3.38Å; R110-N120 PolarHBondContact N-OD1 3.47Å; P115-N120 PolarHBondContact O-ND2 3.09Å; G117-N120 PolarHBondContact O-ND2 3.4Å; K118-N120 PolarHBondContact O-N 2.82Å
121Y96Very high83Confident46 Ų4685.7 Ų85.718%0.1843%0.426CS..EExtended strand (participates in β ladder)trans-83154.7-179.4-68.4-68000112.2R67 T69 V108 R110R67-Y121 HydrophobicContact CG-CD1 4.1Å; R67-Y121 HydrophobicContact CG-CG 4.28Å; T69-Y121 HydrophobicContact CG2-CD1 3.84Å; T69-Y121 HydrophobicContact CG2-CE1 3.77Å; V108-Y121 PolarHBondContact N-O 3.42Å; V108-Y121 PolarHBondContact O-N 2.98Å; R110-Y121 HydrophobicContact CB-CD2 4.06Å; R110-Y121 HydrophobicContact CB-CE2 3.95Å; R110-Y121 HydrophobicContact CG-CD2 4.36Å; R110-Y121 HydrophobicContact CG-CE2 3.72Å; R110-Y121 PolarHBondContact NE-OH 3.46Å
122W96.4Very high81.3Confident42 Ų4289.9 Ų89.916%0.15944%0.442CS..EExtended strand (participates in β ladder)trans-119.9132.6169.4-65.190.6000109.7I60 R67 L68 I73 L99 F105 L106 K107I60-W122 HydrophobicContact CD1-CB 4.48Å; R67-W122 WeakPolarHBondContact CA-O 3.46Å; L68-W122 PolarHBondContact N-O 3.02Å; L68-W122 WeakPolarHBondContact O-CB 3.33Å; L68-W122 PolarHBondContact O-N 3.11Å; I73-W122 HydrophobicContact CD1-CB 4.2Å; L99-W122 HydrophobicContact CB-CD2 4.05Å; L99-W122 HydrophobicContact CB-CE3 4.01Å; L99-W122 HydrophobicContact CB-CH2 3.88Å; L99-W122 HydrophobicContact CB-CZ2 3.94Å; L99-W122 HydrophobicContact CB-CZ3 3.93Å; L99-W122 HydrophobicContact CD1-CD2 4.22Å; L99-W122 HydrophobicContact CD1-CG 4.24Å; L99-W122 HydrophobicContact CD2-CB 4.07Å; L99-W122 HydrophobicContact CD2-CD2 3.82Å; L99-W122 HydrophobicContact CD2-CE3 4.01Å; L99-W122 HydrophobicContact CD2-CG 3.84Å; L99-W122 HydrophobicContact CG-CD2 4.25Å; L99-W122 WeakPolarHBondContact O-CZ3 3.39Å; F105-W122 HydrophobicContact CB-CE3 3.97Å; F105-W122 HydrophobicContact CB-CZ3 4.37Å; L106-W122 WeakPolarHBondContact O-CA 3.36Å; K107-W122 HydrophobicContact CB-CE3 4.18Å; K107-W122 HydrophobicContact CB-CH2 3.88Å; K107-W122 HydrophobicContact CB-CZ2 4.28Å; K107-W122 HydrophobicContact CB-CZ3 3.81Å; K107-W122 HydrophobicContact CG-CH2 4.39Å; K107-W122 HydrophobicContact CG-CZ2 4.33Å
123M95.4Very high79.8Confident61 Ų6187.9 Ų87.930%0.344%0.435SS..EExtended strand (participates in β ladder)trans-124.5156.4178.3-69.9-172.867.300110.1R67 F105 L106 V108R67-M123 HydrophobicContact CB-CE 4.46Å; R67-M123 HydrophobicContact CB-CG 3.34Å; R67-M123 HydrophobicContact CB-SD 3.84Å; F105-M123 CarbonylContact C-O 3.57Å; F105-M123 WeakPolarHBondContact CA-O 3.25Å; L106-M123 PolarHBondContact N-O 3.3Å; L106-M123 PolarHBondContact O-N 3.05Å; V108-M123 HydrophobicContact CB-SD 4.43Å; V108-M123 HydrophobicContact CG2-CB 4.24Å; V108-M123 HydrophobicContact CG2-CG 3.98Å; V108-M123 HydrophobicContact CG2-SD 3.78Å
124L93.5Very high78Confident23 Ų2391 Ų9112%0.1244%0.444CS..EExtended strand (participates in β ladder)trans-71.9135.8166.1-75.6168.6000109.4A57 I60 R61 C104 F105 P126 T131A57-L124 HydrophobicContact CB-CD1 4.35Å; A57-L124 HydrophobicContact CB-CD2 3.93Å; I60-L124 HydrophobicContact CB-CD1 4.46Å; I60-L124 HydrophobicContact CB-CG 4.34Å; I60-L124 HydrophobicContact CD1-CG 4.47Å; I60-L124 HydrophobicContact CG2-CD1 4.3Å; I60-L124 HydrophobicContact CG2-CG 4.09Å; R61-L124 HydrophobicContact CG-CD1 3.61Å; C104-L124 WeakPolarHBondContact O-CA 3.42Å; F105-L124 HydrophobicContact CD1-CD2 4.02Å; F105-L124 HydrophobicContact CE1-CD2 3.64Å; L124-P126 WeakPolarHBondContact O-CD 3.12Å; L124-T131 HydrophobicContact CB-CG2 4.35Å
125N92Very high76.6Confident22 Ų2284.7 Ų84.712%0.11843%0.434CS..  trans-75.1116.1174.2-178.70.1000109.9D103 C104 L106 H127 S128 T131D103-N125 WeakPolarHBondContact O-CB 3.28Å; D103-N125 PolarHBondContact O-ND2 3.18Å; C104-N125 PolarHBondContact O-N 3.11Å; L106-N125 HydrophobicContact CD1-CB 4.04Å; L106-N125 HydrophobicContact CD2-CB 3.94Å; L106-N125 HydrophobicContact CG-CB 3.73Å; N125-H127 PolarHBondContact O-N 3.29Å; N125-H127 VanDerWaalsContact O-N 3.07Å; N125-H127 PolarHBondContact OD1-N 3.25Å; N125-H127 VanDerWaalsContact OD1-N 3.09Å; N125-H127 PolarHBondContact OD1-ND1 3.06Å; N125-H127 VanDerWaalsContact OD1-ND1 3.09Å; N125-S128 WeakPolarHBondContact O-CB 3.16Å; N125-S128 PolarHBondContact O-N 2.87Å; N125-S128 PolarHBondContact O-OG 3.05Å; N125-T131 PolarHBondContact O-OG1 2.86Å
126P87.9Confident75.7Confident77 Ų7786.8 Ų86.850%0.545%0.446SS..THydrogen-bonded Turntrans-59.1-22.7-180-24.335.5000114.4L124 F132L124-P126 WeakPolarHBondContact O-CD 3.12Å; P126-F132 VanDerWaalsContact O-CE2 3.32Å; P126-F132 WeakPolarHBondContact O-CE2 3.35Å; P126-F132 WeakPolarHBondContact O-CZ 3.32Å
127H83.4Confident74.7Confident166 Ų16677.6 Ų77.677%0.76941%0.412SS*.THydrogen-bonded Turntrans-89.6-1.1-179.2-46.792.8000113.1N125N125-H127 PolarHBondContact O-N 3.29Å; N125-H127 VanDerWaalsContact O-N 3.07Å; N125-H127 PolarHBondContact OD1-N 3.25Å; N125-H127 VanDerWaalsContact OD1-N 3.09Å; N125-H127 PolarHBondContact OD1-ND1 3.06Å; N125-H127 VanDerWaalsContact OD1-ND1 3.09Å
128S79.2Confident73.9Confident13 Ų1385.5 Ų85.59%0.09143%0.433CS..SBendtrans-80.1144.418073.50000111.8N125 Y130 T131N125-S128 WeakPolarHBondContact O-CB 3.16Å; N125-S128 PolarHBondContact O-N 2.87Å; N125-S128 PolarHBondContact O-OG 3.05Å; S128-Y130 PolarHBondContact O-N 3.06Å; S128-T131 PolarHBondContact O-N 3.42Å; S128-T131 VanDerWaalsContact O-N 3.08Å; S128-T131 PolarHBondContact O-OG1 3.4Å; S128-T131 PolarHBondContact OG-OG1 3.12Å
129E64.8Low73.1Confident193 Ų19382.7 Ų82.790%0.90242%0.417SS*.G310 helixtrans-55.9-22.2170.2-164.9-172.6171.500111.7T131E129-T131 VanDerWaalsContact C-N 3.32Å; E129-T131 PolarHBondContact O-N 3Å
130Y64.8Low71.9Confident48 Ų4890.2 Ų90.219%0.18844%0.439CS..G310 helixtrans-75.8-12.7179.6-149-93.8000114.8I53 A54 A57 S128 F132 V136 F137I53-Y130 HydrophobicContact CG2-CD1 3.99Å; I53-Y130 HydrophobicContact CG2-CD2 3.94Å; I53-Y130 HydrophobicContact CG2-CE1 4.05Å; I53-Y130 HydrophobicContact CG2-CE2 4.01Å; I53-Y130 HydrophobicContact CG2-CG 3.97Å; A54-Y130 WeakPolarHBondContact CA-OH 3.49Å; A54-Y130 VanDerWaalsContact CB-OH 3.24Å; A54-Y130 WeakPolarHBondContact CB-OH 3.22Å; A57-Y130 HydrophobicContact CB-CD1 3.94Å; A57-Y130 HydrophobicContact CB-CE1 3.56Å; S128-Y130 PolarHBondContact O-N 3.06Å; Y130-F132 VanDerWaalsContact C-N 3.34Å; Y130-F132 PolarHBondContact O-N 2.65Å; Y130-V136 PolarHBondContact OH-O 3.4Å; Y130-F137 HydrophobicContact CE1-CE1 4.41Å; Y130-F137 WeakPolarHBondContact OH-CD1 3.16Å
131T60Low70.2Confident47 Ų47100.6 Ų100.629%0.28848%0.478SS..G310 helixtrans-81.9-10-172.1-14.10000114.2L124 N125 S128 E129L124-T131 HydrophobicContact CB-CG2 4.35Å; N125-T131 PolarHBondContact O-OG1 2.86Å; S128-T131 PolarHBondContact O-N 3.42Å; S128-T131 VanDerWaalsContact O-N 3.08Å; S128-T131 PolarHBondContact O-OG1 3.4Å; S128-T131 PolarHBondContact OG-OG1 3.12Å; E129-T131 VanDerWaalsContact C-N 3.32Å; E129-T131 PolarHBondContact O-N 3Å
132F50.7Low68.5Low147 Ų147107.9 Ų107.965%0.64551%0.51SS*.SBendtrans-127139.9-168-56.9-78.7000113.1P126 Y130P126-F132 VanDerWaalsContact O-CE2 3.32Å; P126-F132 WeakPolarHBondContact O-CE2 3.35Å; P126-F132 WeakPolarHBondContact O-CZ 3.32Å; Y130-F132 VanDerWaalsContact C-N 3.34Å; Y130-F132 PolarHBondContact O-N 2.65Å
133A51.3Low66.8Low71 Ų71117.1 Ų117.159%0.58755%0.545SS*.SBendtrans53.8112.3166.100000119.7
134D48.9Very low65.2Low156 Ų156121.7 Ų121.783%0.83457%0.569SS**THydrogen-bonded Turn55.573.3121.7-48.9-29.8000119.1
135G54.6Low63.5Low45 Ų45124.7 Ų124.746%0.46460%0.597SS.*THydrogen-bonded Turntrans113.8-10.414900000116.6F137G135-F137 PolarHBondContact O-N 3.38Å
136V59.1Low61.6Low108 Ų108133.1 Ų133.166%0.65563%0.633SS**THydrogen-bonded Turntrans-73.116.1-179.1-153.30000113.6Y130 R138Y130-V136 PolarHBondContact OH-O 3.4Å; V136-R138 VanDerWaalsContact C-N 3.27Å; V136-R138 PolarHBondContact O-N 3.48Å
137F57.9Low59.7Low51 Ų51140.8 Ų140.822%0.22465%0.652CS.*THydrogen-bonded Turntrans-68-26.2171.2-53.3-66.2000112.7Y50 A54 Y130 G135Y50-F137 WeakPolarHBondContact CA-O 3.34Å; Y50-F137 HydrophobicContact CD1-CB 3.76Å; Y50-F137 WeakPolarHBondContact CD1-O 3.49Å; Y50-F137 HydrophobicContact CE1-CB 3.93Å; A54-F137 HydrophobicContact CB-CB 4.11Å; A54-F137 HydrophobicContact CB-CD1 4.13Å; A54-F137 WeakPolarHBondContact CB-O 3.46Å; Y130-F137 HydrophobicContact CE1-CE1 4.41Å; Y130-F137 WeakPolarHBondContact OH-CD1 3.16Å; G135-F137 PolarHBondContact O-N 3.38Å
138R59.6Low57.8Low196 Ų196135.7 Ų135.774%0.7464%0.644SS**BIsolated β-bridgetrans-73.2131.6-178.7-59.5-176.776.9-159.28.1110.8V136 R140V136-R138 VanDerWaalsContact C-N 3.27Å; V136-R138 PolarHBondContact O-N 3.48Å; R138-R140 PolarHBondContact O-N 2.79Å
139R58.3Low56.1Low129 Ų129140.7 Ų140.749%0.48768%0.676SS.*  trans-59.9109.6179.9-169.5-175.8-52134.415.6111.4P49 Y50 R141P49-R139 PolarHBondContact O-N 3.39Å; Y50-R139 PolarHBondContact O-NH2 2.72Å; R139-R141 PolarHBondContact O-N 3.35Å
140R62.7Low54.9Low241 Ų241141 Ų14191%0.90967%0.674SS**  trans-54.1108.6174.8-162.8175-165.5164.24.6109.3R138R138-R140 PolarHBondContact O-N 2.79Å
141R58.6Low53.8Low231 Ų231147.3 Ų147.387%0.87271%0.706SS**  trans-67135.4172.5-70-177.5178.6176.1-0.9107.9R139 R143R139-R141 PolarHBondContact O-N 3.35Å; R141-R143 PolarHBondContact O-N 3.22Å
142K60.3Low53Low199 Ų199153.3 Ų153.387%0.86573%0.73SS**  trans-60.2108.9172.5-175173.5-177.8176.50107.8I144K142-I144 PolarHBondContact O-N 3.17Å
143R60Low52.4Low235 Ų235155.5 Ų155.589%0.88774%0.743SS**  trans-60.7107.5165.1-96.9172.364.9168.8-3.1105.9R141 A145R141-R143 PolarHBondContact O-N 3.22Å; R143-A145 PolarHBondContact O-N 3.42Å
144I61Low51.6Low157 Ų157156.8 Ų156.881%0.80575%0.748SS**  trans-57.2120.8157.3-62.6171.7000104.4K142 K146K142-I144 PolarHBondContact O-N 3.17Å; I144-K146 PolarHBondContact O-N 3.45Å
145A58.8Low51.5Low86 Ų86155.2 Ų155.271%0.71175%0.746SS**  trans-7381.6-176.900000109.1R143 R147R143-A145 PolarHBondContact O-N 3.42Å; A145-R147 VanDerWaalsContact C-N 3.32Å; A145-R147 PolarHBondContact O-N 2.94Å
146K51.6Low50.7Low200 Ų200160.1 Ų160.187%0.8776%0.761SS**  trans-58.4102.9162.6-163.6-176.6-172.9-170.20105.4I144 G148I144-K146 PolarHBondContact O-N 3.45Å; K146-G148 PolarHBondContact O-N 2.98Å
147R48.8Very low49.5Very low238 Ų238161.6 Ų161.690%0.89876%0.763SS**PPolyproline II helixtrans-54.4126.1174.9-67.9-178.7176.8-177.4-1.5106.3A145A145-R147 VanDerWaalsContact C-N 3.32Å; A145-R147 PolarHBondContact O-N 2.94Å
148G43.8Very low48.8Very low59 Ų59166.5 Ų166.561%0.60879%0.79SS**PPolyproline II helixtrans-62.1150.3172.100000109.3K146 K150K146-G148 PolarHBondContact O-N 2.98Å; G148-K150 PolarHBondContact O-N 2.86Å
149P43.5Very low47.8Very low117 Ų117163.4 Ų163.476%0.7680%0.799SS**PPolyproline II helixtrans-51.7139.6156.8-18.331.8000108.3E151P149-E151 PolarHBondContact O-N 2.77Å
150K39.3Very low47Very low199 Ų199166 Ų16687%0.86582%0.817SS**  trans-78.6106.2157.8-73.9-175.7174.2-171.20105.6G148G148-K150 PolarHBondContact O-N 2.86Å
151E41.3Very low45.7Very low182 Ų182161.6 Ų161.685%0.8581%0.811SS**  trans-70.3140.4161.5-76.8164.3168.500107.9P149P149-E151 PolarHBondContact O-N 2.77Å
152Q43.2Very low45Very low172 Ų172154.9 Ų154.980%0.80480%0.796SS**  trans-13287.1-165178.8178.3-23.400107.5
153E37.5Very low43.8Very low194 Ų194156.5 Ų156.591%0.90780%0.797SS**  trans-91.7113.9176.7-68.4-166.6137.600110.7
154S35.8Very low42.8Very low98 Ų98153.1 Ų153.169%0.68580%0.795SS**  trans-155.490.1162.459.30000108.2
155P47Very low42.4Very low122 Ų122151.2 Ų151.279%0.79279%0.793SS**  trans-84.6117.6176.931.5-29.5000110.1
156D35.9Very low41Very low149 Ų149151.4 Ų151.480%0.79780%0.795SS**  trans-164.6154.2135.4-123.5-24.9000115.5
157M34.2Very low40.5Very low139 Ų139146.4 Ų146.469%0.68579%0.791SS**  trans53.4101.5154.8-62.1-58.3-74.700122.9
158L44.7Very low40Very low153 Ų153144.2 Ų144.280%0.80179%0.791SS**  38.3119.1128.4-52.2-175.6000121.4
159S38.5Very low39.9Very low132 Ų132149.3 Ų149.392%0.92380%0.799SS**  -163.6160.8113.945.80000111.1
160E40Very low39.9Very low184 Ų184155.6 Ų155.686%0.8681%0.807SS**  trans-131.5123.3-165.4175.4-178.1170.500110.3
161D36.5Very low40.3Very low147 Ų147151 Ų15179%0.78680%0.796SS**  trans-166.7115.5150.5-127.2-25.3000115.8
162T43.4Very low40.6Very low91 Ų91145.1 Ų145.156%0.55878%0.784SS**  40.492.5127.3-50.60000121.7
163R35Very low41.4Very low232 Ų232142 Ų14288%0.87579%0.788SS**  166.4156.5117.9-91.9148.3-171.8144.23.7116.6
164L38.7Very low42.6Very low164 Ų164140 Ų14086%0.85978%0.776SS**  trans-122.4172.6162.5-69.8177.2000107.4
165P52.4Low43.9Very low117 Ų117143.4 Ų143.476%0.7678%0.779SS**  cis-142.8-171.315.144.5-25.6000117.5
166A31Very low45.2Very low91 Ų91144 Ų14475%0.75278%0.78SS**  trans85.9134.4147.400000121.5
167A39.1Very low47.2Very low95 Ų95138.5 Ų138.579%0.78575%0.753SS**  trans55.6144.3163.400000117.5
168E38.5Very low49.1Very low191 Ų191136.4 Ų136.489%0.89375%0.753SS**  cis-146-168.137.2-87.3-170.6159.900114.7
169E42.9Very low50.4Low166 Ų166137.7 Ų137.778%0.77675%0.752SS**  trans-52.3136.3-172.4-169.5179.3173.300116.6V171E169-V171 HydrophobicContact CB-CG2 4.38Å; E169-V171 HydrophobicContact CG-CG2 4.02Å; E169-V171 PolarHBondContact O-N 3.47Å
170R43.4Very low52.6Low249 Ų249132.3 Ų132.394%0.9472%0.716SS**  trans-77.669.3168.5-80.3-166.2173.6-170.60.6112.1G172R170-G172 PolarHBondContact O-N 3.28Å
171V47Very low54.3Low104 Ų104129.4 Ų129.463%0.6371%0.705SS**  trans-62.3119.2165.5-178.10000108.7E169 A173E169-V171 HydrophobicContact CB-CG2 4.38Å; E169-V171 HydrophobicContact CG-CG2 4.02Å; E169-V171 PolarHBondContact O-N 3.47Å; V171-A173 PolarHBondContact O-N 3.36Å
172G48Very low56.3Low58 Ų58127.2 Ų127.260%0.59869%0.693SS**  trans-60.5131.3-175.800000112.3R170 K174R170-G172 PolarHBondContact O-N 3.28Å; G172-K174 PolarHBondContact O-N 3.15Å
173A59.1Low57.9Low107 Ų107124.8 Ų124.888%0.88468%0.68SS**  trans-60.497.3-176.600000111.9V171 F175V171-A173 PolarHBondContact O-N 3.36Å; A173-F175 PolarHBondContact O-N 2.9Å
174K63.6Low59.9Low151 Ų151118.4 Ų118.466%0.65766%0.662SS**  trans-63.7128.1174.5-62.9-174-179.9-1740109G172 T176G172-K174 PolarHBondContact O-N 3.15Å; K174-T176 VanDerWaalsContact C-N 3.35Å; K174-T176 PolarHBondContact O-N 3.5Å
175F63.5Low61.7Low169 Ų169117.1 Ų117.174%0.74166%0.655SS**  trans-73.485.8-178178.7-109.1000110.6A173 S177 A180A173-F175 PolarHBondContact O-N 2.9Å; F175-S177 WeakPolarHBondContact CE1-OG 3.23Å; F175-S177 PolarHBondContact O-N 2.86Å; F175-S177 VanDerWaalsContact O-N 3.15Å; F175-A180 VanDerWaalsContact O-CB 3.29Å; F175-A180 WeakPolarHBondContact O-CB 3.29Å
176T73.6Confident62.5Low134 Ų134115.4 Ų115.482%0.82265%0.646SS**  trans-69.7107178.446.80000110.5K174K174-T176 VanDerWaalsContact C-N 3.35Å; K174-T176 PolarHBondContact O-N 3.5Å
177S78.6Confident64.3Low34 Ų34115.5 Ų115.524%0.23864%0.638CS.*SBendtrans-153.5161.5174.172.50000110F175 F179 A180 S183F175-S177 WeakPolarHBondContact CE1-OG 3.23Å; F175-S177 PolarHBondContact O-N 2.86Å; F175-S177 VanDerWaalsContact O-N 3.15Å; S177-F179 PolarHBondContact O-N 2.92Å; S177-F179 PolarHBondContact OG-N 2.95Å; S177-A180 VanDerWaalsContact O-CB 3.23Å; S177-A180 WeakPolarHBondContact O-CB 3.49Å; S177-A180 PolarHBondContact O-N 3.12Å; S177-A180 PolarHBondContact OG-N 2.99Å; S177-S183 VanDerWaalsContact O-CB 3.25Å; S177-S183 WeakPolarHBondContact O-CB 3.25Å
178S72.5Confident65.3Low96 Ų96116.2 Ų116.267%0.67163%0.634SS**THydrogen-bonded Turntrans-62.8-5.5174.5-170.60000114.5
179F72.4Confident66Low180 Ų180116.3 Ų116.379%0.78963%0.632SS**THydrogen-bonded Turntrans-112.56.3173.8-64.7-73.8000112.9S177S177-F179 PolarHBondContact O-N 2.92Å; S177-F179 PolarHBondContact OG-N 2.95Å
180A85.2Confident66.4Low19 Ų19117.7 Ų117.716%0.15764%0.635CS.*SBendtrans-68.3143.6171.700000109.9F175 S177 D182 S183 I184F175-A180 VanDerWaalsContact O-CB 3.29Å; F175-A180 WeakPolarHBondContact O-CB 3.29Å; S177-A180 VanDerWaalsContact O-CB 3.23Å; S177-A180 WeakPolarHBondContact O-CB 3.49Å; S177-A180 PolarHBondContact O-N 3.12Å; S177-A180 PolarHBondContact OG-N 2.99Å; A180-D182 VanDerWaalsContact C-N 3.3Å; A180-D182 PolarHBondContact O-N 2.99Å; A180-S183 WeakPolarHBondContact O-CA 3.44Å; A180-S183 WeakPolarHBondContact O-CB 3.5Å; A180-S183 PolarHBondContact O-N 3.11Å; A180-I184 WeakPolarHBondContact O-CG1 3.41Å; A180-I184 PolarHBondContact O-N 2.91Å
181I76.8Confident66.7Low123 Ų123114.9 Ų114.963%0.63163%0.625SS**Hα-helixtrans-54.9-49.7179.7-63.1170.8000109.8S183 I184 L185I181-S183 PolarHBondContact O-N 3.23Å; I181-I184 PolarHBondContact O-N 3.21Å; I181-I184 VanDerWaalsContact O-N 3.11Å; I181-L185 HydrophobicContact CG2-CD1 3.71Å; I181-L185 HydrophobicContact CG2-CG 4.29Å; I181-L185 WeakPolarHBondContact O-CG 3.36Å; I181-L185 PolarHBondContact O-N 3.35Å
182D77.1Confident66.6Low100 Ų100119.1 Ų119.154%0.53563%0.629SS.*Hα-helixtrans-53.1-40.3175.8-55.39.9000112.1A180 S186A180-D182 VanDerWaalsContact C-N 3.3Å; A180-D182 PolarHBondContact O-N 2.99Å; D182-S186 WeakPolarHBondContact O-CB 3.19Å; D182-S186 PolarHBondContact O-N 2.98Å; D182-S186 PolarHBondContact O-OG 3.18Å
183S77.6Confident66.6Low41 Ų41124 Ų12429%0.28764%0.637SS.*Hα-helixtrans-76.4-27.8-179.5-173.60000114S177 A180 I181 S186S177-S183 VanDerWaalsContact O-CB 3.25Å; S177-S183 WeakPolarHBondContact O-CB 3.25Å; A180-S183 WeakPolarHBondContact O-CA 3.44Å; A180-S183 WeakPolarHBondContact O-CB 3.5Å; A180-S183 PolarHBondContact O-N 3.11Å; I181-S183 PolarHBondContact O-N 3.23Å; S183-S186 WeakPolarHBondContact CA-OG 3.47Å; S183-S186 PolarHBondContact O-OG 2.96Å
184I75.9Confident65.4Low97 Ų97125.3 Ų125.350%0.49762%0.624SS.*Hα-helixtrans-77.9-35.9176-66.3165.2000109.8A180 I181 T187A180-I184 WeakPolarHBondContact O-CG1 3.41Å; A180-I184 PolarHBondContact O-N 2.91Å; I181-I184 PolarHBondContact O-N 3.21Å; I181-I184 VanDerWaalsContact O-N 3.11Å; I184-T187 PolarHBondContact O-OG1 3.4Å
185L77.1Confident64.4Low137 Ų137127.4 Ų127.472%0.71764%0.636SS**Hα-helixtrans-80.8-26.6178-63.2177.7000113I181 T187I181-L185 HydrophobicContact CG2-CD1 3.71Å; I181-L185 HydrophobicContact CG2-CG 4.29Å; I181-L185 WeakPolarHBondContact O-CG 3.36Å; I181-L185 PolarHBondContact O-N 3.35Å; L185-T187 VanDerWaalsContact C-N 3.29Å; L185-T187 PolarHBondContact O-N 3.27Å
186S70.1Confident63.3Low81 Ų81128.1 Ų128.157%0.56664%0.641SS**SBendtrans-73.7-14.4-179.663.80000114.7D182 S183 P188D182-S186 WeakPolarHBondContact O-CB 3.19Å; D182-S186 PolarHBondContact O-N 2.98Å; D182-S186 PolarHBondContact O-OG 3.18Å; S183-S186 WeakPolarHBondContact CA-OG 3.47Å; S183-S186 PolarHBondContact O-OG 2.96Å; S186-P188 WeakPolarHBondContact O-CD 3.15Å
187T67.7Low61.8Low94 Ų94127 Ų12758%0.57764%0.636SS**SBendtrans-91.7101.6175.951.70000110.5I184 L185 F189I184-T187 PolarHBondContact O-OG1 3.4Å; L185-T187 VanDerWaalsContact C-N 3.29Å; L185-T187 PolarHBondContact O-N 3.27Å; T187-F189 PolarHBondContact O-N 2.83Å
188P61.1Low60Low110 Ų110132.6 Ų132.671%0.71466%0.664SS**  trans-62.7130172.926.8-34.3000109.5S186 K190S186-P188 WeakPolarHBondContact O-CD 3.15Å; P188-K190 VanDerWaalsContact C-N 3.34Å; P188-K190 PolarHBondContact O-N 3.32Å
189F52.6Low58.5Low193 Ų193134.9 Ų134.985%0.84667%0.674SS**  trans-68.288.7-178.2-172.3-90.5000110.5T187 R191T187-F189 PolarHBondContact O-N 2.83Å; F189-R191 PolarHBondContact O-N 2.97Å
190K52.4Low57Low194 Ų194133.6 Ų133.684%0.84367%0.67SS**  trans-67.698.2170.1-80.7-162.1173.1-169.60109.4P188 R192P188-K190 VanDerWaalsContact C-N 3.34Å; P188-K190 PolarHBondContact O-N 3.32Å; K190-R192 PolarHBondContact O-N 3.47Å
191R47.9Very low54.8Low190 Ų190141.4 Ų141.472%0.71770%0.701SS**  trans-55122.7157.5179.7-179.5-69.4156.9-1.4107.4F189 E193F189-R191 PolarHBondContact O-N 2.97Å; R191-E193 HydrophobicContact CG-CG 4.46Å; R191-E193 PolarHBondContact O-N 3.43Å; R191-E193 VanDerWaalsContact O-N 3.07Å
192R45.4Very low53.3Low193 Ų193141.2 Ų141.273%0.72871%0.708SS**  trans-79.988-177.8-175.6175.8-176-158.8-6.7109.7K190 E194K190-R192 PolarHBondContact O-N 3.47Å; R192-E194 HydrophobicContact CG-CG 3.65Å; R192-E194 VanDerWaalsContact CZ-CD 3.48Å; R192-E194 IonicContact CZ-OE1 3.19Å; R192-E194 IonicContact CZ-OE2 3.58Å; R192-E194 IonicContact NE-OE1 2.71Å; R192-E194 PolarHBondContact NE-OE1 3.25Å; R192-E194 IonicContact NE-OE2 3.73Å; R192-E194 IonicContact NH2-OE1 2.84Å; R192-E194 PolarHBondContact NH2-OE1 3.23Å; R192-E194 IonicContact NH2-OE2 2.83Å; R192-E194 PolarHBondContact NH2-OE2 2.71Å
193E47.5Very low52Low160 Ų160142 Ų14275%0.74872%0.716SS**  trans-84.5111.3166.7-74.9166.6-172.100108.3R191R191-E193 HydrophobicContact CG-CG 4.46Å; R191-E193 PolarHBondContact O-N 3.43Å; R191-E193 VanDerWaalsContact O-N 3.07Å
194E34.4Very low50.4Low135 Ų135145.9 Ų145.963%0.63174%0.74SS**  trans-106.6109.4-179.3-66.2-109.613700109.9R192R192-E194 HydrophobicContact CG-CG 3.65Å; R192-E194 VanDerWaalsContact CZ-CD 3.48Å; R192-E194 IonicContact CZ-OE1 3.19Å; R192-E194 IonicContact CZ-OE2 3.58Å; R192-E194 IonicContact NE-OE1 2.71Å; R192-E194 PolarHBondContact NE-OE1 3.25Å; R192-E194 IonicContact NE-OE2 3.73Å; R192-E194 IonicContact NH2-OE1 2.84Å; R192-E194 PolarHBondContact NH2-OE1 3.23Å; R192-E194 IonicContact NH2-OE2 2.83Å; R192-E194 PolarHBondContact NH2-OE2 2.71Å
195H42.2Very low49Very low196 Ų196149.3 Ų149.391%0.90775%0.754SS**  trans-110.4111164.6-107-59.7000108.7
196H40.2Very low47.6Very low183 Ų183150.7 Ų150.785%0.84776%0.759SS**  trans-142147.1163.3-118.1-50.4000108
197P43.4Very low46.6Very low110 Ų110155.1 Ų155.171%0.71477%0.765SS**  trans-92.2177.3-168.737.9-34.2000113.6
198D39.8Very low45.5Very low153 Ų153161.6 Ų161.682%0.81878%0.779SS**  trans-20.5119.9179.2-90.4-64.9000118.5
199T41.4Very low44.8Very low144 Ų144160.7 Ų160.788%0.88377%0.773SS**  trans-147.2149139.9-47.60000108.7
200Q41Very low44.8Very low152 Ų152157.8 Ų157.871%0.7178%0.776SS**  trans-91.2129.2-154.7-61.3-1783.700116
201K40.1Very low44.5Very low183 Ų183150.6 Ų150.680%0.79676%0.757SS**  trans66.6158.4149.1-62.5167.9-177.5170.60118.6
202P44.2Very low44.6Very low120 Ų120146.6 Ų146.678%0.77977%0.765SS**  cis-123.2159.1-32.136.9-23.8000112.5
203T50.8Low45.1Very low117 Ų117145 Ų14572%0.71877%0.765SS**  trans-101142.6-179.847.10000113.1Q205T203-Q205 PolarHBondContact O-N 3.18Å
204P43.7Very low45.5Very low121 Ų121143.9 Ų143.979%0.78677%0.77SS**  trans-82.682160.732.9-30.7000109.3M206P204-M206 PolarHBondContact O-N 3.07Å
205Q46.5Very low46.6Very low169 Ų169144.5 Ų144.579%0.7978%0.777SS**  trans-74.488.2-176.8-170.9173.66.600111.6T203 Y207T203-Q205 PolarHBondContact O-N 3.18Å; Q205-Y207 VanDerWaalsContact C-N 3.29Å; Q205-Y207 PolarHBondContact O-N 3.43Å
206M47.8Very low47Very low167 Ų167141 Ų14182%0.82377%0.771SS**  trans-7181.1174.1-78.2-72171.500111.7P204P204-M206 PolarHBondContact O-N 3.07Å
207Y49.1Very low47.2Very low173 Ų173141.5 Ų141.568%0.67877%0.767SS**  trans-73.1120.8167172-99.8000109.9Q205 P209Q205-Y207 VanDerWaalsContact C-N 3.29Å; Q205-Y207 PolarHBondContact O-N 3.43Å; Y207-P209 HydrophobicContact CD1-CB 4.37Å; Y207-P209 HydrophobicContact CD1-CG 3.97Å; Y207-P209 HydrophobicContact CE1-CB 3.78Å; Y207-P209 HydrophobicContact CE1-CG 3.88Å; Y207-P209 WeakPolarHBondContact O-CD 3.43Å
208W43.9Very low47.5Very low230 Ų230140.4 Ų140.487%0.87177%0.767SS**  trans-85115.4168.4-71.698.5000109.4
209P45.8Very low47.9Very low91 Ų91138.1 Ų138.159%0.59176%0.755SS**  trans-76127.6178.2-12.228.7000111.1Y207 G211Y207-P209 HydrophobicContact CD1-CB 4.37Å; Y207-P209 HydrophobicContact CD1-CG 3.97Å; Y207-P209 HydrophobicContact CE1-CB 3.78Å; Y207-P209 HydrophobicContact CE1-CG 3.88Å; Y207-P209 WeakPolarHBondContact O-CD 3.43Å; P209-G211 PolarHBondContact O-N 3.06Å
210S53.1Low48Very low132 Ų132139.1 Ų139.192%0.92375%0.754SS**  trans-72.177.2160.8-70.30000109.6
211G45.4Very low48.4Very low43 Ų43141 Ų14144%0.44376%0.756SS.*  trans-111.6110.1178.200000111.6P209 H213P209-G211 PolarHBondContact O-N 3.06Å; G211-H213 PolarHBondContact O-N 3.42Å; G211-H213 PolarHBondContact O-ND1 2.84Å
212A51.8Low48.9Very low106 Ų106137.1 Ų137.188%0.87675%0.75SS**  trans-64.6130.5176.400000111.1
213H55.1Low49Very low160 Ų160137.7 Ų137.774%0.74175%0.751SS**  trans-115.693.4-179.626.7-80.5000110.5G211 L215G211-H213 PolarHBondContact O-N 3.42Å; G211-H213 PolarHBondContact O-ND1 2.84Å; H213-L215 PolarHBondContact O-N 2.83Å
214T56.7Low49Very low137 Ų137140.3 Ų140.384%0.8476%0.755SS**  trans-70.698.9166.435.50000109.7
215L55.9Low49.2Very low148 Ų148143.2 Ų143.278%0.77576%0.757SS**  trans-82.7127.8174.8-63.7-179.3000110.9H213 Y217H213-L215 PolarHBondContact O-N 2.83Å; L215-Y217 PolarHBondContact O-N 3.19Å
216P50.8Low49.5Very low122 Ų122140.8 Ų140.879%0.79276%0.756SS**  trans-72.5123.2172.229.3-32.7000110.3A218P216-A218 PolarHBondContact O-N 2.85Å
217Y44.8Very low49Very low194 Ų194142.7 Ų142.776%0.76176%0.756SS**  trans-79.686.9-179.9-177.9-114.5000111.3L215 L219L215-Y217 PolarHBondContact O-N 3.19Å; Y217-L219 HydrophobicContact CD1-CD1 4.36Å; Y217-L219 HydrophobicContact CD1-CD2 4.45Å; Y217-L219 HydrophobicContact CD1-CG 3.98Å; Y217-L219 HydrophobicContact CE1-CD1 4.02Å; Y217-L219 HydrophobicContact CE1-CD2 3.51Å; Y217-L219 HydrophobicContact CE1-CG 3.52Å; Y217-L219 PolarHBondContact O-N 3.46Å
218A50.7Low48.5Very low87 Ų87142.6 Ų142.672%0.71977%0.766SS**  trans-79111.1173.900000111.2P216 N220P216-A218 PolarHBondContact O-N 2.85Å; A218-N220 PolarHBondContact O-N 2.9Å
219L47.6Very low48.3Very low105 Ų105135.6 Ų135.655%0.5575%0.752SS.*  trans-76.693.7-179.3-84.7157.9000112.6Y217 Y221Y217-L219 HydrophobicContact CD1-CD1 4.36Å; Y217-L219 HydrophobicContact CD1-CD2 4.45Å; Y217-L219 HydrophobicContact CD1-CG 3.98Å; Y217-L219 HydrophobicContact CE1-CD1 4.02Å; Y217-L219 HydrophobicContact CE1-CD2 3.51Å; Y217-L219 HydrophobicContact CE1-CG 3.52Å; Y217-L219 PolarHBondContact O-N 3.46Å; L219-Y221 HydrophobicContact CD2-CD2 3.87Å; L219-Y221 HydrophobicContact CD2-CE2 3.78Å; L219-Y221 PolarHBondContact O-N 3.2Å
220N42.8Very low47.7Very low164 Ų164140.2 Ų140.288%0.87777%0.766SS**  trans-83.385.5164-88.82.2000110.9A218A218-N220 PolarHBondContact O-N 2.9Å
221Y48.9Very low47Very low191 Ų191138.5 Ų138.575%0.74976%0.759SS**PPolyproline II helixtrans-88.1128.7163.4-98.8-85.9000110.4L219L219-Y221 HydrophobicContact CD2-CD2 3.87Å; L219-Y221 HydrophobicContact CD2-CE2 3.78Å; L219-Y221 PolarHBondContact O-N 3.2Å
222P52.2Low46.5Very low102 Ų102141.1 Ų141.166%0.66278%0.777SS**PPolyproline II helixtrans-70.5129.6168.729.3-32.5000110.1H224P222-H224 PolarHBondContact O-N 2.96Å
223V45.8Very low45.6Very low133 Ų133146.7 Ų146.781%0.80678%0.777SS**PPolyproline II helixtrans-71.4124-178.2176.60000110.4
224H50.3Low44.6Very low172 Ų172143.2 Ų143.280%0.79677%0.771SS**PPolyproline II helixtrans-80126.1166.9-80.3-100.5000110.2P222 P226P222-H224 PolarHBondContact O-N 2.96Å; H224-P226 WeakPolarHBondContact O-CD 3.38Å
225H47.3Very low43.6Very low181 Ų181142 Ų14284%0.83877%0.768SS**PPolyproline II helixtrans-67.6126.2166.7-80.6-93.6000110.4Y227H225-Y227 PolarHBondContact O-N 2.88Å
226P53.3Low42.9Very low119 Ų119142 Ų14277%0.77378%0.775SS**PPolyproline II helixtrans-77.4118165.430.5-30.8000110H224H224-P226 WeakPolarHBondContact O-CD 3.38Å
227Y36.9Very low42.6Very low207 Ų207144.7 Ų144.781%0.81278%0.776SS**  trans-76.2115.3168.2175.2-96.1000108.8H225H225-Y227 PolarHBondContact O-N 2.88Å
228L39.5Very low42.9Very low170 Ų170141 Ų14189%0.8978%0.776SS**  trans-79120.4176.8-81.4169000110.4
229S38.8Very low42.1Very low83 Ų83140.1 Ų140.158%0.5878%0.776SS**  trans-159.986.6177.6171.50000112.7
230E34.3Very low41.5Very low189 Ų189147 Ų14788%0.88379%0.794SS**  trans-173.1123144.6-101.8167.8168.900105
231A38Very low41.5Very low95 Ų95146.6 Ų146.679%0.78579%0.792SS**  cis78.391.648.200000113.9
232A36Very low41.9Very low99 Ų99142 Ų14282%0.81879%0.786SS**  trans-175.2143.5136.700000114.8
233Y31.6Very low41.2Very low223 Ų223147.2 Ų147.288%0.87579%0.794SS**  trans96.3141.7138.2-126.1-105.1000123.9
234S34.7Very low41Very low86 Ų86147.2 Ų147.260%0.60179%0.788SS**  trans62.579168.4-74.30000121.5
235S35.1Very low40.6Very low113 Ų113147 Ų14779%0.7979%0.788SS**  33.9125.3111.5-45.70000122.2
236T41.8Very low40.2Very low148 Ų148142 Ų14291%0.90878%0.778SS**  trans-143.2148.7137.510.30000111.2
237E44.5Very low39.6Very low177 Ų177143 Ų14383%0.82778%0.782SS**  trans-77.2171.8-161.4-82-68.4102.900116.3
238P51.8Low39.7Very low117 Ų117137.6 Ų137.676%0.7678%0.78SS**  trans-103.8177.3-147.340.6-40.1000116.9
239G32.3Very low39.8Very low69 Ų69136.4 Ų136.471%0.71178%0.779SS**  trans-164.8108170.100000117.7
240R36.8Very low39.7Very low248 Ų248135.5 Ų135.594%0.93678%0.783SS**  trans67.1100.9145.1-57.2-178.2-175.4-172.71121.3
241D41.8Very low40.1Very low156 Ų156138 Ų13883%0.83479%0.785SS**  -61.4166.8126.3-79-43.4000110.6
242P57.4Low40.4Very low95 Ų95140.3 Ų140.362%0.61779%0.788SS**  cis-149.5-173.633.631.6-4.7000118.6
243Y38.1Very low40.6Very low212 Ų212139.6 Ų139.683%0.83178%0.783SS**  trans75.6151.1163.8-58.5-55000117.3
244L41.8Very low41.9Very low132 Ų132135.1 Ų135.169%0.69178%0.781SS**  cis-158.2-1802.1-127.6171.9000111.7
245H41.9Very low42.3Very low168 Ų168140 Ų14078%0.77879%0.794SS**  trans71.9125.5175.2-59-83.1000117.5
246A37.8Very low42.7Very low77 Ų77139.6 Ų139.664%0.63680%0.798SS**  cis107.2143.35.700000117.4
247T40.3Very low42.9Very low139 Ų139136 Ų13685%0.85378%0.783SS**  trans66.6120.4-179.158.70000116
248A39.3Very low42.6Very low94 Ų94137 Ų13778%0.77779%0.785SS**  80.914555.700000112.6
249V42.8Very low42.3Very low144 Ų144140.5 Ų140.587%0.87379%0.788SS**  cis-150.2160.624.7178.40000108.2
250G36.6Very low43.4Very low64 Ų64143.7 Ų143.766%0.6679%0.793SS**  cis136.187.8-1.400000114.8
251R42.7Very low44.6Very low243 Ų243137.6 Ų137.692%0.91779%0.786SS**  trans-149.9122.8174.1-85.6172.9176.3168.3-0.9108.4
252V42.6Very low44.9Very low142 Ų142135.4 Ų135.486%0.86178%0.783SS**  76.612259.1-179.80000113
253A41.5Very low44.3Very low85 Ų85142 Ų14270%0.70280%0.796SS**  trans-95.1-167.9-176.100000112.8
254P59.2Low44.8Very low129 Ų129136 Ų13684%0.83879%0.79SS**  -143.7-175.183.340.1-23.5000115.5
255E43.1Very low45.3Very low187 Ų187141.1 Ų141.187%0.87480%0.8SS**  trans-74.1167.6-178.1-53.1177.5112.600115
256A43.2Very low45.3Very low106 Ų106136.8 Ų136.888%0.87680%0.801SS**  trans-135.8129151.200000109.8
257A45.4Very low45.8Very low71 Ų71143 Ų14359%0.58781%0.814SS**  trans-137.8169.6-177.100000111.7
258F37.9Very low46.3Very low198 Ų198145 Ų14587%0.86881%0.813SS**  trans69.6153.9-173.5-55-86.8000114
259K45.6Very low47.2Very low191 Ų191147 Ų14783%0.8381%0.81SS**  cis-148.6142.511.8-151.4160.9-175.8170.50111.9
260V56.2Low47.8Very low136 Ų136147.1 Ų147.182%0.82481%0.805SS**  trans-96.1128.3169.9176.90000109.8
261P61.7Low48.4Very low120 Ų120149.7 Ų149.778%0.77981%0.813SS**  trans-87.4148.6164.734.6-31.4000111
262S48.3Very low48.8Very low110 Ų110146.7 Ų146.777%0.76981%0.814SS**  trans-126.4171.7179.769.40000112.4
263R43.8Very low49.3Very low235 Ų235148.2 Ų148.289%0.88782%0.817SS**  trans80.5119169.3-84.3-179.9160.1168.3-5.4120.3
264A48.5Very low49.7Very low86 Ų86153.1 Ų153.171%0.71185%0.846SS**  78.2114.7124.400000120.9
265R52.4Low49.3Very low238 Ų238154.4 Ų154.490%0.89885%0.846SS**  -146.5140.5106.7-112.9168.6-74.6-175.4-1.5109.8
266G43.2Very low49.6Very low77 Ų77152.6 Ų152.679%0.79485%0.845SS**  trans-87.8146.8172.500000110.3
267F47.2Very low49.9Very low208 Ų208155.2 Ų155.291%0.91284%0.843SS**  trans-92115.6170.5-74.3-87.4000108.9
268H51.5Low50.2Low180 Ų180160.2 Ų160.283%0.83386%0.858SS**  trans-75.5134172.4-144.3-76.1000108.4
269I57.6Low51Low138 Ų138157.8 Ų157.871%0.70886%0.857SS**  trans-86.7178.8164.6-21.4-177.8000107.7
270D55.5Low51.3Low146 Ų146155.6 Ų155.678%0.78186%0.859SS**  trans70.290.3177.7-45.1-32.7000116.1
271S48.6Very low51Low117 Ų117157 Ų15782%0.81886%0.862SS**  trans176.881.4133.9-171.60000111.4
272L50.8Low50.2Low181 Ų181159.8 Ų159.895%0.94887%0.868SS**  trans-147.762.4162.7-82.5-174.1000109.6
273L53.5Low50.3Low174 Ų174164 Ų16491%0.91188%0.876SS**  trans-151.969.4170.3-142163.3000110.7
274S51.3Low50.9Low188 Ų188157.5 Ų157.5100%1.31588%0.875SS**  trans-156.80160.8-176.30000109.5

Retrieved 274 of 274 residues in 244.2 ms (Link to these results)