A0A060XAV7_ONCMY Loading...

Single-stranded DNA-binding protein, mitochondrial

AlphaFold DB , UniProt , Accession A0A060XAV7, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 148 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
1M36.1Very low45Very low237 Ų237163.9 Ų163.9100%1.16787%0.874SS**  0116.30-83.2172157.600108.9
2L38.8Very low45.1Very low156 Ų156161.9 Ų161.982%0.81786%0.855SS**  trans45.7111.3141.1-69.1163.8000119.5
3R41.5Very low45.3Very low240 Ų240161.3 Ų161.391%0.90685%0.852SS**  168.9147.790.6-105164.6170.3-151.2-4.5113.6
4N44.1Very low46.1Very low174 Ų174155.9 Ų155.993%0.9383%0.828SS**  trans-63156.9178.9-70.1-21.9000115.1
5G41.9Very low46.3Very low81 Ų81159.1 Ų159.184%0.83582%0.824SS**  trans-178.1105157.600000111.8
6A48.4Very low46.4Very low109 Ų109159.2 Ų159.290%0.90182%0.819SS**  trans-70.1146.6-179.300000113.2
7A45.3Very low46.5Very low98 Ų98158.5 Ų158.581%0.8181%0.811SS**  trans-150.8126.2152.100000110.1
8Q49.3Very low46.9Very low169 Ų169154.9 Ų154.979%0.7980%0.803SS**  trans-54.3141.1179.2-68.6145.9-6500112.6
9V55.3Low47.4Very low143 Ų143152.6 Ų152.687%0.86780%0.796SS**  trans-132.1101.2146.6-174.80000109.2R11V9-R11 PolarHBondContact O-N 3.44Å
10F47.8Very low47.8Very low152 Ų152152.2 Ų152.267%0.66780%0.795SS**  trans-42.4124.4160.9-104.6-114.7000111.6Q12F10-Q12 HydrophobicContact CD1-CB 4.06Å
11R46.4Very low48.3Very low244 Ų244150.1 Ų150.192%0.92179%0.789SS**  trans-127.582.6145.1-104-174.1178.2-175.80.6108.4V9 L13V9-R11 PolarHBondContact O-N 3.44Å; R11-L13 VanDerWaalsContact C-N 3.32Å; R11-L13 PolarHBondContact O-N 2.89Å
12Q46Very low49.5Very low140 Ų140142.8 Ų142.865%0.65476%0.761SS**  trans-60.695.5164.2-165.3179.6-18.100107.4F10 V14F10-Q12 HydrophobicContact CD1-CB 4.06Å; Q12-V14 HydrophobicContact CG-CG2 3.66Å; Q12-V14 PolarHBondContact O-N 2.82Å
13L48.5Very low50.6Low154 Ų154142.3 Ų142.381%0.80676%0.759SS**  trans-77.781.1164.7-132.4143.1000105.4R11 R15R11-L13 VanDerWaalsContact C-N 3.32Å; R11-L13 PolarHBondContact O-N 2.89Å; L13-R15 HydrophobicContact CD2-CG 4.37Å; L13-R15 PolarHBondContact O-N 2.97Å
14V56.4Low51.8Low86 Ų86138 Ų13852%0.52175%0.752SS.*  trans-6093.7162.7-179.40000104.9Q12 H16Q12-V14 HydrophobicContact CG-CG2 3.66Å; Q12-V14 PolarHBondContact O-N 2.82Å; V14-H16 PolarHBondContact O-N 2.98Å
15R49.1Very low53.2Low204 Ų204136.5 Ų136.577%0.7774%0.743SS**  trans-63.895.2154.8-78.4-175.4175.8179.1-1104.7L13 Q17L13-R15 HydrophobicContact CD2-CG 4.37Å; L13-R15 PolarHBondContact O-N 2.97Å; R15-Q17 PolarHBondContact O-N 2.82Å
16H47.8Very low55Low160 Ų160140.2 Ų140.274%0.74174%0.739SS**  trans-6185.2152.9-113-81.1000105.4V14 S18V14-H16 PolarHBondContact O-N 2.98Å; H16-S18 PolarHBondContact O-N 3.12Å; H16-S18 VanDerWaalsContact O-N 3.12Å
17Q48.6Very low56.7Low148 Ų148146 Ų14669%0.69274%0.737SS**  trans-72.193.9150.3-80.1-174.7-0.900104.2R15 T19R15-Q17 PolarHBondContact O-N 2.82Å; Q17-T19 PolarHBondContact O-N 2.82Å
18S52.7Low58.9Low94 Ų94146.3 Ų146.366%0.65773%0.733SS**  trans-57.991.8154-42.70000105.3H16 D20H16-S18 PolarHBondContact O-N 3.12Å; H16-S18 VanDerWaalsContact O-N 3.12Å; S18-D20 PolarHBondContact O-N 2.81Å
19T56.5Low61.1Low110 Ų110145.8 Ų145.868%0.67573%0.734SS**  trans-66.682.5153.936.40000105Q17 T21Q17-T19 PolarHBondContact O-N 2.82Å; T19-T21 PolarHBondContact O-N 2.83Å; T19-T21 PolarHBondContact O-OG1 2.85Å
20D56.1Low63Low145 Ų145143.2 Ų143.278%0.77572%0.716SS**  trans-69.964.6162.3-135.5-11.2000106.1S18 S22S18-D20 PolarHBondContact O-N 2.81Å; D20-S22 PolarHBondContact O-N 2.73Å
21T58.8Low65.3Low108 Ų108143.7 Ų143.766%0.66371%0.713SS**  trans-67.179.2156.929.50000105T19 L23T19-T21 PolarHBondContact O-N 2.83Å; T19-T21 PolarHBondContact O-OG1 2.85Å; T21-L23 PolarHBondContact O-N 2.75Å
22S60.1Low67.8Low84 Ų84133.2 Ų133.259%0.58768%0.676SS**  trans-47.6106.6151.762.70000104.8D20 I24D20-S22 PolarHBondContact O-N 2.73Å; S22-I24 PolarHBondContact O-N 2.85Å
23L62.8Low70.2Confident146 Ų146131.9 Ų131.976%0.76467%0.67SS**  trans-64.889.9171.6-67.5169.1000103.9T21 L25T21-L23 PolarHBondContact O-N 2.75Å; L23-L25 PolarHBondContact O-N 3.42Å
24I65.6Low72.6Confident149 Ų149125.7 Ų125.776%0.76464%0.637SS**  trans-64.986.6162.9-60177.6000103.5S22 E26S22-I24 PolarHBondContact O-N 2.85Å; I24-E26 PolarHBondContact O-N 3.27Å
25L74.2Confident74.5Confident142 Ų142125.5 Ų125.574%0.74363%0.633SS**  trans-68.6101-177.8-143141.9000105L23 R27L23-L25 PolarHBondContact O-N 3.42Å; L25-R27 PolarHBondContact O-N 2.95Å
26E79.7Confident76.7Confident160 Ų160116.2 Ų116.275%0.74860%0.601SS**  trans-55128-178.5-172.1-174162.200109.1I24I24-E26 PolarHBondContact O-N 3.27Å
27R84.7Confident79Confident231 Ų231115.5 Ų115.587%0.87259%0.592SS**  trans-96.698.8178.7-64.6-177.173.294.3-1.4108.9L25L25-R27 PolarHBondContact O-N 2.95Å
28S91.5Very high81.3Confident103 Ų103108.6 Ų108.672%0.7256%0.56SS**  trans-81.6152.8169.7-420000111.1
29I94.3Very high83.4Confident158 Ų158105.1 Ų105.181%0.8154%0.539SS*.  trans-111.7123179.2-60174000109.3R31I29-R31 HydrophobicContact CG2-CB 4.14Å
30N96.2Very high85.2Confident90 Ų90104.9 Ų104.948%0.48153%0.53SS..  trans-120.1105.7166.6177.6-6.7000107.5L113N30-L113 PolarHBondContact ND2-O 2.86Å; N30-L113 PolarHBondContact OD1-N 3.13Å
31R96.4Very high87Confident161 Ų161102 Ų10261%0.60852%0.515SS*.  trans-137.1132.2-178.5-172.6177.9-175.4171.95.2109.7I29 E110 G111I29-R31 HydrophobicContact CG2-CB 4.14Å; R31-E110 IonicContact CZ-OE1 3.88Å; R31-E110 IonicContact NH2-OE1 2.92Å; R31-E110 PolarHBondContact NH2-OE1 2.76Å; R31-G111 CarbonylContact C-O 3.49Å; R31-G111 WeakPolarHBondContact CA-O 3.23Å
32V97.7Very high88.8Confident24 Ų2497.3 Ų97.315%0.14549%0.486CS..EExtended strand (participates in β ladder)trans-121.4134.1173.9175.20000108L34 E110 G111 L113 I131V32-L34 HydrophobicContact CG1-CD1 4.03Å; V32-L34 HydrophobicContact CG1-CD2 4.33Å; V32-L34 HydrophobicContact CG1-CG 3.75Å; V32-E110 WeakPolarHBondContact O-CA 3.21Å; V32-G111 PolarHBondContact N-O 2.87Å; V32-G111 PolarHBondContact O-N 3.21Å; V32-L113 HydrophobicContact CG2-CB 4.02Å; V32-L113 HydrophobicContact CG2-CD1 4.46Å; V32-I131 HydrophobicContact CB-CG2 4.37Å; V32-I131 HydrophobicContact CG1-CD1 4.44Å; V32-I131 HydrophobicContact CG1-CG1 4.21Å; V32-I131 HydrophobicContact CG1-CG2 4.15Å
33Q97.6Very high90.5Very high112 Ų11296.7 Ų96.752%0.52348%0.478SS..EExtended strand (participates in β ladder)trans-128.3124.5168.6-68.3-174.3-19.600108.4V109 E110Q33-V109 CarbonylContact C-O 3.55Å; Q33-V109 WeakPolarHBondContact CA-O 3.49Å; Q33-E110 HydrophobicContact CG-CG 4.12Å; Q33-E110 PolarHBondContact NE2-OE1 2.91Å
34L97.1Very high92.1Very high24 Ų2492.8 Ų92.813%0.12646%0.457CS..EExtended strand (participates in β ladder)trans-131.4131.1-179.8-63.7175.7000110.3V32 M58 T60 H84 L108 V109 I131V32-L34 HydrophobicContact CG1-CD1 4.03Å; V32-L34 HydrophobicContact CG1-CD2 4.33Å; V32-L34 HydrophobicContact CG1-CG 3.75Å; L34-M58 HydrophobicContact CB-CE 3.82Å; L34-M58 HydrophobicContact CB-SD 4.05Å; L34-M58 HydrophobicContact CD1-SD 4.16Å; L34-T60 HydrophobicContact CD2-CG2 4.31Å; L34-H84 HydrophobicContact CD1-CB 3.94Å; L34-L108 CarbonylContact O-C 3.48Å; L34-L108 VanDerWaalsContact O-CA 3.28Å; L34-L108 WeakPolarHBondContact O-CA 3.24Å; L34-V109 PolarHBondContact N-O 2.89Å; L34-V109 PolarHBondContact O-N 3.1Å; L34-I131 HydrophobicContact CD1-CD1 3.46Å; L34-I131 VanDerWaalsContact CD1-CD1 3.46Å
35L97.1Very high93.4Very high82 Ų8292.7 Ų92.743%0.42945%0.447SS..EExtended strand (participates in β ladder)trans-113.6118.5168.817660.6000108.2R106 L108 L139L35-R106 HydrophobicContact CD1-CG 4.29Å; L35-L108 HydrophobicContact CB-CD1 3.98Å; L35-L108 HydrophobicContact CD1-CB 4.34Å; L35-L139 HydrophobicContact CD1-CD1 3.22Å
36G96.2Very high94.1Very high9 Ų993.3 Ų93.39%0.09345%0.446CS..EExtended strand (participates in β ladder)trans-163.8-169.6-174.300000113.3A59 R106 V107G36-A59 VanDerWaalsContact CA-O 3.24Å; G36-A59 WeakPolarHBondContact CA-O 3.25Å; G36-R106 WeakPolarHBondContact O-CA 3.35Å; G36-V107 PolarHBondContact N-O 2.91Å; G36-V107 VanDerWaalsContact N-O 3.08Å; G36-V107 PolarHBondContact O-N 2.92Å
37R96.1Very high94.4Very high145 Ų14589.7 Ų89.755%0.54744%0.435SS..EExtended strand (participates in β ladder)trans-114.9140.1177.8-69.8-174.1178.6-85.54.2111.1M58 A59 G104 S105R37-M58 CarbonylContact O-C 3.6Å; R37-M58 WeakPolarHBondContact O-CA 3.31Å; R37-M58 WeakPolarHBondContact O-CB 3.5Å; R37-A59 PolarHBondContact N-O 3.48Å; R37-A59 VanDerWaalsContact N-O 3.1Å; R37-A59 PolarHBondContact O-N 3.33Å; R37-G104 PolarHBondContact NH1-O 2.75Å; R37-G104 VanDerWaalsContact NH1-O 3.09Å; R37-S105 WeakPolarHBondContact CA-O 3.48Å
38V96.8Very high94.3Very high4 Ų487.9 Ų87.92%0.02444%0.436CS..EExtended strand (participates in β ladder)trans-73.7129.8179.3174.20000109.8Q40 F56 S57 V101 K102 G104 S105 V107V38-Q40 WeakPolarHBondContact CG1-O 3.36Å; V38-F56 HydrophobicContact CG1-CD2 4.2Å; V38-F56 HydrophobicContact CG2-CD2 3.93Å; V38-F56 HydrophobicContact CG2-CE2 3.98Å; V38-S57 CarbonylContact C-O 3.57Å; V38-S57 WeakPolarHBondContact CA-O 3.41Å; V38-V101 HydrophobicContact CB-CG1 4.11Å; V38-V101 HydrophobicContact CG1-CG1 3.79Å; V38-V101 HydrophobicContact CG2-CG1 3.57Å; V38-K102 WeakPolarHBondContact CB-O 3.22Å; V38-K102 WeakPolarHBondContact CG1-O 3.16Å; V38-G104 WeakPolarHBondContact O-CA 3.4Å; V38-G104 PolarHBondContact O-N 3.44Å; V38-S105 WeakPolarHBondContact CG2-O 3.46Å; V38-S105 PolarHBondContact N-O 3.1Å; V38-V107 HydrophobicContact CG2-CG1 4.28Å; V38-V107 HydrophobicContact CG2-CG2 3.78Å
39G95.3Very high93.9Very high21 Ų2187.3 Ų87.322%0.21645%0.447CS..SBendtrans-84.7-31.7-177.100000114.7S57 K103G39-S57 PolarHBondContact N-O 3.26Å; G39-K103 WeakPolarHBondContact O-CE 3.4Å; G39-K103 WeakPolarHBondContact O-CG 3.34Å
40Q94.6Very high93.4Very high104 Ų10488.7 Ų88.749%0.48644%0.442SS..SBendtrans-144.3154.8-176.968.3-170.4-45.300110V38 S57V38-Q40 WeakPolarHBondContact CG1-O 3.36Å; Q40-S57 PolarHBondContact NE2-OG 3.02Å
41D95.1Very high93Very high86 Ų8690.3 Ų90.346%0.4645%0.451SS..  trans-58.3144.7176.7-68.7-40.4000111.4V43 K102 K103D41-V43 PolarHBondContact O-N 3.45Å; D41-K102 WeakPolarHBondContact OD1-CA 3.39Å; D41-K103 PolarHBondContact OD1-N 3.05Å
42P96.4Very high92.9Very high9 Ų983.7 Ų83.76%0.05843%0.429CS..  trans-64.3136.5179.529.5-37.3000110.8T54 F56 Y98 V101P42-T54 HydrophobicContact CB-CG2 3.74Å; P42-F56 HydrophobicContact CB-CB 4.24Å; P42-Y98 HydrophobicContact CB-CD2 4.45Å; P42-Y98 HydrophobicContact CG-CD2 4.34Å; P42-Y98 WeakPolarHBondContact O-CE2 3.44Å; P42-V101 WeakPolarHBondContact CD-O 3.46Å; P42-V101 HydrophobicContact CG-CB 4.03Å; P42-V101 HydrophobicContact CG-CG1 4.42Å; P42-V101 VanDerWaalsContact CG-O 3.26Å; P42-V101 WeakPolarHBondContact CG-O 3.35Å
43V96.1Very high92.8Very high70 Ų7083.3 Ų83.342%0.42443%0.426SS..EExtended strand (participates in β ladder)trans-109.7122.8176.5-178.60000108.7D41 R45 I55D41-V43 PolarHBondContact O-N 3.45Å; V43-R45 HydrophobicContact CG1-CG 4.27Å; V43-I55 PolarHBondContact N-O 3.35Å; V43-I55 PolarHBondContact O-N 3.21Å
44M95.1Very high92.7Very high64 Ų6478 Ų7832%0.31540%0.401SS..EExtended strand (participates in β ladder)trans-84122.9169.7-171174.2-74.100109.2P52 V53 Y98M44-P52 HydrophobicContact CG-CB 4.33Å; M44-P52 HydrophobicContact SD-CB 4.44Å; M44-V53 WeakPolarHBondContact CA-O 3.49Å; M44-Y98 HydrophobicContact CB-CD2 3.93Å; M44-Y98 HydrophobicContact CB-CE2 4.01Å; M44-Y98 HydrophobicContact CB-CG 4.37Å; M44-Y98 HydrophobicContact CE-CD1 4.07Å; M44-Y98 HydrophobicContact CE-CG 3.96Å
45R92.4Very high92.7Very high147 Ų14777.9 Ų77.956%0.55540%0.401SS*.EExtended strand (participates in β ladder)trans-111125.3172.6-66.6-168.8179.5-176.3-1.6109.1V43 P52 V53 I55V43-R45 HydrophobicContact CG1-CG 4.27Å; R45-P52 WeakPolarHBondContact O-CA 3.24Å; R45-V53 HydrophobicContact CB-CG1 4.02Å; R45-V53 PolarHBondContact N-O 2.87Å; R45-V53 PolarHBondContact O-N 2.79Å; R45-I55 HydrophobicContact CG-CD1 4.48Å
46Q89.9Confident92.7Very high155 Ų15574.1 Ų74.172%0.72438%0.381SS*.  trans-111.6124170.1-171.3171.7-17.800107.8P52Q46-P52 HydrophobicContact CB-CB 4.2Å; Q46-P52 HydrophobicContact CG-CB 4.29Å
47V85.1Confident92.7Very high85 Ų8574.7 Ų74.752%0.51538%0.383SS..  trans-107136.9173.7179.90000106.7G49 R50V47-G49 PolarHBondContact O-N 2.73Å; V47-R50 HydrophobicContact CB-CB 4.26Å; V47-R50 PolarHBondContact O-N 2.92Å
48E83.4Confident92.8Very high192 Ų19267.8 Ų67.890%0.89736%0.357SS*.THydrogen-bonded Turntrans-51.8130178.9-66.2-178.8174.500111R50E48-R50 PolarHBondContact O-N 3.12Å
49G82.6Confident92.8Very high92 Ų9268.1 Ų68.195%0.94836%0.361SS*.THydrogen-bonded Turntrans72.44-177.800000115.8V47V47-G49 PolarHBondContact O-N 2.73Å
50R83.7Confident92.8Very high186 Ų18668.3 Ų68.370%0.70236%0.358SS*.SBendtrans-120.9151.5175.4-63-172-178.5-165.90.6112.1V47 E48V47-R50 HydrophobicContact CB-CB 4.26Å; V47-R50 PolarHBondContact O-N 2.92Å; E48-R50 PolarHBondContact O-N 3.12Å
51N88.7Confident92.8Very high125 Ų12567.5 Ų67.567%0.66836%0.357SS*.  trans-59.3135.8172.5-73-31000110.2
52P93.8Very high92.7Very high22 Ų2268.7 Ų68.714%0.14336%0.359CS..  trans-62.3150.317714-18.9000111.3M44 R45 Q46 R94M44-P52 HydrophobicContact CG-CB 4.33Å; M44-P52 HydrophobicContact SD-CB 4.44Å; R45-P52 WeakPolarHBondContact O-CA 3.24Å; Q46-P52 HydrophobicContact CB-CB 4.2Å; Q46-P52 HydrophobicContact CG-CB 4.29Å; P52-R94 VanDerWaalsContact CD-NH1 3.29Å; P52-R94 VanDerWaalsContact CG-CZ 3.46Å; P52-R94 WeakPolarHBondContact O-CD 3.08Å; P52-R94 PolarHBondContact O-NH1 2.81Å
53V94.9Very high92.3Very high16 Ų1674.5 Ų74.510%0.09739%0.387CS..EExtended strand (participates in β ladder)trans-129132.3-178.460.90000109.7M44 R45 I55 I88 F89M44-V53 WeakPolarHBondContact CA-O 3.49Å; R45-V53 HydrophobicContact CB-CG1 4.02Å; R45-V53 PolarHBondContact N-O 2.87Å; R45-V53 PolarHBondContact O-N 2.79Å; V53-I55 HydrophobicContact CG1-CD1 3.98Å; V53-I55 HydrophobicContact CG1-CG1 4.16Å; V53-I55 HydrophobicContact CG2-CD1 4.39Å; V53-I55 HydrophobicContact CG2-CG1 3.91Å; V53-I88 WeakPolarHBondContact CA-O 3.4Å; V53-I88 WeakPolarHBondContact CG2-O 3.43Å; V53-F89 HydrophobicContact CB-CD1 3.91Å; V53-F89 HydrophobicContact CB-CE1 3.76Å; V53-F89 HydrophobicContact CB-CZ 4.47Å; V53-F89 HydrophobicContact CG1-CE1 4.45Å; V53-F89 HydrophobicContact CG2-CD1 3.78Å; V53-F89 HydrophobicContact CG2-CD2 4.45Å; V53-F89 HydrophobicContact CG2-CE1 3.54Å; V53-F89 HydrophobicContact CG2-CE2 4.24Å; V53-F89 HydrophobicContact CG2-CG 4.25Å; V53-F89 HydrophobicContact CG2-CZ 3.8Å
54T96.8Very high91.8Very high0 Ų076.8 Ų76.80%039%0.388CS..EExtended strand (participates in β ladder)trans-95.8127.7172-62.40000108.8P42 I88 R94 A97P42-T54 HydrophobicContact CB-CG2 3.74Å; T54-I88 HydrophobicContact CG2-CD1 4.26Å; T54-I88 PolarHBondContact N-O 2.73Å; T54-I88 VanDerWaalsContact N-O 3.13Å; T54-I88 PolarHBondContact O-N 3.19Å; T54-R94 WeakPolarHBondContact CB-O 3.5Å; T54-R94 WeakPolarHBondContact OG1-CB 3.36Å; T54-R94 PolarHBondContact OG1-O 3.11Å; T54-A97 HydrophobicContact CG2-CB 4.39Å
55I96.3Very high91.1Very high22 Ų2283.5 Ų83.511%0.11341%0.41CS..EExtended strand (participates in β ladder)trans-126.6133.9-174.1-51.4179.1000109.2V43 R45 V53 R85 V86V43-I55 PolarHBondContact N-O 3.35Å; V43-I55 PolarHBondContact O-N 3.21Å; R45-I55 HydrophobicContact CG-CD1 4.48Å; V53-I55 HydrophobicContact CG1-CD1 3.98Å; V53-I55 HydrophobicContact CG1-CG1 4.16Å; V53-I55 HydrophobicContact CG2-CD1 4.39Å; V53-I55 HydrophobicContact CG2-CG1 3.91Å; I55-R85 HydrophobicContact CG2-CG 4.27Å; I55-V86 WeakPolarHBondContact CA-O 3.47Å; I55-V86 WeakPolarHBondContact CG2-O 3.11Å
56F96.9Very high89.8Confident2 Ų279 Ų791%0.00940%0.401CS..EExtended strand (participates in β ladder)trans-145.3166.2171.464.8-87.1000110.6V38 P42 M58 V86 I88 V107 V109 I136V38-F56 HydrophobicContact CG1-CD2 4.2Å; V38-F56 HydrophobicContact CG2-CD2 3.93Å; V38-F56 HydrophobicContact CG2-CE2 3.98Å; P42-F56 HydrophobicContact CB-CB 4.24Å; F56-M58 HydrophobicContact CE2-CB 4.28Å; F56-M58 HydrophobicContact CE2-SD 4.44Å; F56-V86 HydrophobicContact CD1-CB 4.31Å; F56-V86 HydrophobicContact CD1-CG1 4.49Å; F56-V86 HydrophobicContact CD2-CB 4.34Å; F56-V86 HydrophobicContact CE1-CB 3.87Å; F56-V86 HydrophobicContact CE1-CG1 3.69Å; F56-V86 HydrophobicContact CE2-CB 3.93Å; F56-V86 HydrophobicContact CE2-CG1 4.37Å; F56-V86 HydrophobicContact CE2-CG2 3.97Å; F56-V86 HydrophobicContact CZ-CB 3.69Å; F56-V86 HydrophobicContact CZ-CG1 3.63Å; F56-V86 HydrophobicContact CZ-CG2 4.04Å; F56-V86 PolarHBondContact N-O 3.09Å; F56-V86 VanDerWaalsContact N-O 3.11Å; F56-V86 PolarHBondContact O-N 3.34Å; F56-I88 HydrophobicContact CD1-CD1 4.41Å; F56-I88 HydrophobicContact CE1-CD1 3.87Å; F56-I88 HydrophobicContact CE1-CG1 4.4Å; F56-V107 HydrophobicContact CE2-CG2 4.36Å; F56-V109 HydrophobicContact CE2-CG2 4.47Å; F56-V109 HydrophobicContact CZ-CG2 4.01Å; F56-I136 HydrophobicContact CE1-CD1 4.1Å; F56-I136 HydrophobicContact CZ-CD1 4.22Å
57S97Very high88.6Confident21 Ų2174.1 Ų74.115%0.14739%0.393CS..EExtended strand (participates in β ladder)trans-108.2146170.160.10000111V38 G39 Q40 H84V38-S57 CarbonylContact C-O 3.57Å; V38-S57 WeakPolarHBondContact CA-O 3.41Å; G39-S57 PolarHBondContact N-O 3.26Å; Q40-S57 PolarHBondContact NE2-OG 3.02Å; S57-H84 CarbonylContact C-O 3.55Å; S57-H84 VanDerWaalsContact CA-O 3.23Å; S57-H84 WeakPolarHBondContact CA-O 3.4Å
58M96.8Very high87.2Confident0 Ų076.5 Ų76.50%040%0.402CS..EExtended strand (participates in β ladder)trans-132.2149.4172.967.2-177.6-64.400111.6L34 R37 F56 H84 V86 V107 V109L34-M58 HydrophobicContact CB-CE 3.82Å; L34-M58 HydrophobicContact CB-SD 4.05Å; L34-M58 HydrophobicContact CD1-SD 4.16Å; R37-M58 CarbonylContact O-C 3.6Å; R37-M58 WeakPolarHBondContact O-CA 3.31Å; R37-M58 WeakPolarHBondContact O-CB 3.5Å; F56-M58 HydrophobicContact CE2-CB 4.28Å; F56-M58 HydrophobicContact CE2-SD 4.44Å; M58-H84 HydrophobicContact CG-CB 3.89Å; M58-H84 PolarHBondContact N-O 3.49Å; M58-H84 PolarHBondContact O-N 3.24Å; M58-H84 PolarHBondContact O-ND1 3.47Å; M58-V86 HydrophobicContact CG-CG2 4.12Å; M58-V86 HydrophobicContact SD-CG2 3.88Å; M58-V107 HydrophobicContact CE-CG2 4.17Å; M58-V109 HydrophobicContact CE-CG2 4.34Å; M58-V109 HydrophobicContact SD-CB 4.17Å; M58-V109 HydrophobicContact SD-CG2 3.66Å
59A97.5Very high86Confident12 Ų1274.2 Ų74.210%0.09940%0.401CS..EExtended strand (participates in β ladder)trans-104.6137.9176.700000110.6G36 R37 T81 T82 W83G36-A59 VanDerWaalsContact CA-O 3.24Å; G36-A59 WeakPolarHBondContact CA-O 3.25Å; R37-A59 PolarHBondContact N-O 3.48Å; R37-A59 VanDerWaalsContact N-O 3.1Å; R37-A59 PolarHBondContact O-N 3.33Å; A59-T81 HydrophobicContact CB-CG2 3.79Å; A59-T82 WeakPolarHBondContact CA-O 3.34Å; A59-W83 HydrophobicContact CB-CD2 4.25Å; A59-W83 HydrophobicContact CB-CE3 3.92Å; A59-W83 HydrophobicContact CB-CH2 3.99Å; A59-W83 HydrophobicContact CB-CZ2 4.31Å; A59-W83 HydrophobicContact CB-CZ3 3.75Å
60T96.6Very high84.8Confident25 Ų2578.9 Ų78.915%0.15340%0.399CS..EExtended strand (participates in β ladder)trans-114.7142160.565.90000108.7L34 T81 T82 H84L34-T60 HydrophobicContact CD2-CG2 4.31Å; T60-T81 WeakPolarHBondContact O-CA 3.31Å; T60-T82 PolarHBondContact N-O 2.94Å; T60-T82 PolarHBondContact O-N 2.9Å; T60-H84 PolarHBondContact OG1-CE1 2.85Å
61N94.6Very high83.6Confident87 Ų8775.5 Ų75.547%0.46540%0.399SS..EExtended strand (participates in β ladder)trans-117.6135.3-176.5-61.2-8.9000109.5Q79 K80 T81N61-Q79 PolarHBondContact ND2-NE2 2.86Å; N61-K80 CarbonylContact C-O 3.57Å; N61-K80 WeakPolarHBondContact CA-O 3.21Å; N61-T81 VanDerWaalsContact OD1-CG2 3.32Å; N61-T81 WeakPolarHBondContact OD1-CG2 3.36Å; N61-T81 PolarHBondContact OD1-OG1 2.97Å
62E91.5Very high81.9Confident110 Ų11072.9 Ų72.951%0.51439%0.39SS..EExtended strand (participates in β ladder)trans-115.3130.8171.4-69.2171.5-175.500108W64 Q79 K80E62-W64 HydrophobicContact CB-CZ3 4.49Å; E62-Q79 CarbonylContact O-C 3.59Å; E62-Q79 WeakPolarHBondContact O-CA 3.49Å; E62-K80 PolarHBondContact N-O 2.81Å; E62-K80 PolarHBondContact O-N 3.25Å
63M88.2Confident80.2Confident131 Ų13178.9 Ų78.965%0.64543%0.429SS*.EExtended strand (participates in β ladder)trans-119.2132177.5-65.8174.2-179.800108.9V77 S78 Q79M63-V77 HydrophobicContact CB-CG1 4.42Å; M63-S78 WeakPolarHBondContact CA-O 3.49Å; M63-Q79 HydrophobicContact CE-CG 4.48Å; M63-Q79 HydrophobicContact CG-CB 4.37Å; M63-Q79 HydrophobicContact CG-CG 4.17Å
64W85.9Confident78.5Confident118 Ų11882 Ų8245%0.44746%0.456SS..EExtended strand (participates in β ladder)trans-136.3149.5173.96495.2000109.9E62 S66 S78 K80E62-W64 HydrophobicContact CB-CZ3 4.49Å; W64-S66 VanDerWaalsContact CD1-OG 3.24Å; W64-S66 PolarHBondContact NE1-OG 2.91Å; W64-S66 VanDerWaalsContact NE1-OG 3.13Å; W64-S78 PolarHBondContact N-O 2.87Å; W64-S78 PolarHBondContact O-N 3.49Å; W64-K80 HydrophobicContact CH2-CB 3.59Å; W64-K80 HydrophobicContact CZ3-CB 3.42Å; W64-K80 VanDerWaalsContact CZ3-CB 3.42Å
65R79.9Confident76.8Confident206 Ų20683.6 Ų83.678%0.77747%0.473SS*.EExtended strand (participates in β ladder)trans-87.4124.8172.8-68.3-173.4177.195.4-0.6107.9V77R65-V77 HydrophobicContact CG-CG2 4.22Å
66S66Low75.7Confident52 Ų5288.6 Ų88.636%0.36450%0.5SS..EExtended strand (participates in β ladder)trans-104.7108.1174.5-57.70000107.6W64 D76 S78W64-S66 VanDerWaalsContact CD1-OG 3.24Å; W64-S66 PolarHBondContact NE1-OG 2.91Å; W64-S66 VanDerWaalsContact NE1-OG 3.13Å; S66-D76 PolarHBondContact N-O 2.79Å; S66-S78 PolarHBondContact OG-OG 3.01Å
67G64.3Low74.9Confident53 Ų5392.9 Ų92.955%0.54653%0.526SS..SBendtrans159.3141.4175.700000112V69G67-V69 PolarHBondContact O-N 2.86Å
68D56.8Low74.4Confident134 Ų13493.7 Ų93.772%0.71753%0.532SS*.  trans-61.2123.6167-88.6-38000108.7E70 T71D68-E70 PolarHBondContact O-N 2.87Å; D68-T71 PolarHBondContact O-N 3.13Å
69V56.9Low74Confident144 Ų14498.7 Ų98.787%0.87356%0.555SS**THydrogen-bonded Turntrans-58.5-18-178.1178.50000111.7G67G67-V69 PolarHBondContact O-N 2.86Å
70E58.6Low73.8Confident191 Ų191103.5 Ų103.589%0.89357%0.574SS**THydrogen-bonded Turntrans-86.7-23.7-173.6-60.4-165.5164.400114.8D68D68-E70 PolarHBondContact O-N 2.87Å
71T57.7Low73.7Confident115 Ų115105 Ų10571%0.70658%0.583SS**THydrogen-bonded Turntrans-117.3-14.8-167.2-35.20000114.7D68D68-T71 PolarHBondContact O-N 3.13Å
72S54Low73.8Confident69 Ų69103.2 Ų103.248%0.48358%0.575SS.*  trans-133.4107.8-176.1-67.40000112A74S72-A74 PolarHBondContact O-N 2.85Å
73P57.6Low74.1Confident148 Ų148105.6 Ų105.696%0.96158%0.58SS**SBendtrans-67.9-13.917825.1-31.8000113.6
74A58.5Low74.5Confident81 Ų81101.1 Ų101.167%0.66956%0.557SS**SBendtrans-115.581.2172.300000108.9S72 D76S72-A74 PolarHBondContact O-N 2.85Å; A74-D76 PolarHBondContact O-N 2.89Å
75G61.8Low75Confident34 Ų34100.4 Ų100.435%0.35155%0.554SS.*  trans-66.4127.3173.900000110.7V77G75-V77 PolarHBondContact O-N 2.95Å; G75-V77 VanDerWaalsContact O-N 3.15Å
76D73.1Confident75.8Confident128 Ų12890.6 Ų90.668%0.68452%0.517SS*.EExtended strand (participates in β ladder)trans-64.4114.1176.8-77.9-29.9000109.8S66 A74 S78S66-D76 PolarHBondContact N-O 2.79Å; A74-D76 PolarHBondContact O-N 2.89Å; D76-S78 PolarHBondContact O-N 2.97Å
77V79.9Confident77.2Confident91 Ų9188.3 Ų88.355%0.55250%0.501SS*.EExtended strand (participates in β ladder)trans-81.6112175-175.60000108.2M63 R65 G75M63-V77 HydrophobicContact CB-CG1 4.42Å; R65-V77 HydrophobicContact CG-CG2 4.22Å; G75-V77 PolarHBondContact O-N 2.95Å; G75-V77 VanDerWaalsContact O-N 3.15Å
78S85.6Confident78.8Confident38 Ų3885.8 Ų85.827%0.26648%0.475SS..EExtended strand (participates in β ladder)trans-91.3144.4174.6-63.20000110.7M63 W64 S66 D76M63-S78 WeakPolarHBondContact CA-O 3.49Å; W64-S78 PolarHBondContact N-O 2.87Å; W64-S78 PolarHBondContact O-N 3.49Å; S66-S78 PolarHBondContact OG-OG 3.01Å; D76-S78 PolarHBondContact O-N 2.97Å
79Q90Very high80.6Confident105 Ų10584.1 Ų84.149%0.49146%0.462SS..EExtended strand (participates in β ladder)trans-128.1130.7179.1-177.8-177.3-23.400111.2N61 E62 M63N61-Q79 PolarHBondContact ND2-NE2 2.86Å; E62-Q79 CarbonylContact O-C 3.59Å; E62-Q79 WeakPolarHBondContact O-CA 3.49Å; M63-Q79 HydrophobicContact CE-CG 4.48Å; M63-Q79 HydrophobicContact CG-CB 4.37Å; M63-Q79 HydrophobicContact CG-CG 4.17Å
80K92.6Very high82.4Confident113 Ų11383.2 Ų83.249%0.49145%0.446SS..EExtended strand (participates in β ladder)trans-111.2135.7168.9-172.4173.4179.2-175.80109.9N61 E62 W64N61-K80 CarbonylContact C-O 3.57Å; N61-K80 WeakPolarHBondContact CA-O 3.21Å; E62-K80 PolarHBondContact N-O 2.81Å; E62-K80 PolarHBondContact O-N 3.25Å; W64-K80 HydrophobicContact CH2-CB 3.59Å; W64-K80 HydrophobicContact CZ3-CB 3.42Å; W64-K80 VanDerWaalsContact CZ3-CB 3.42Å
81T94.9Very high84Confident57 Ų5777.3 Ų77.335%0.3543%0.425SS..EExtended strand (participates in β ladder)trans-115.8124.8174.7-57.70000109.2A59 T60 N61A59-T81 HydrophobicContact CB-CG2 3.79Å; T60-T81 WeakPolarHBondContact O-CA 3.31Å; N61-T81 VanDerWaalsContact OD1-CG2 3.32Å; N61-T81 WeakPolarHBondContact OD1-CG2 3.36Å; N61-T81 PolarHBondContact OD1-OG1 2.97Å
82T96.8Very high85.7Confident50 Ų5074.2 Ų74.231%0.30742%0.415SS..EExtended strand (participates in β ladder)trans-109.1126.7176.9-57.10000109.7A59 T60 H84A59-T82 WeakPolarHBondContact CA-O 3.34Å; T60-T82 PolarHBondContact N-O 2.94Å; T60-T82 PolarHBondContact O-N 2.9Å; T82-H84 VanDerWaalsContact CG2-CE1 3.45Å; T82-H84 WeakPolarHBondContact CG2-CE1 3.44Å; T82-H84 PolarHBondContact O-CE1 2.92Å; T82-H84 VanDerWaalsContact O-CE1 3.24Å; T82-H84 PolarHBondContact O-ND1 3.31Å; T82-H84 VanDerWaalsContact O-ND1 3.09Å
83W96.6Very high87.6Confident160 Ų16072 Ų7261%0.60640%0.398SS*.EExtended strand (participates in β ladder)trans-96.8129.2-179.8-69.897.2000111.1A59A59-W83 HydrophobicContact CB-CD2 4.25Å; A59-W83 HydrophobicContact CB-CE3 3.92Å; A59-W83 HydrophobicContact CB-CH2 3.99Å; A59-W83 HydrophobicContact CB-CZ2 4.31Å; A59-W83 HydrophobicContact CB-CZ3 3.75Å
84H96.9Very high89.4Confident37 Ų3766.2 Ų66.217%0.17136%0.357CS..EExtended strand (participates in β ladder)trans-117.5135-176.6-5678.1000109.1L34 S57 M58 T60 T82 I131L34-H84 HydrophobicContact CD1-CB 3.94Å; S57-H84 CarbonylContact C-O 3.55Å; S57-H84 VanDerWaalsContact CA-O 3.23Å; S57-H84 WeakPolarHBondContact CA-O 3.4Å; M58-H84 HydrophobicContact CG-CB 3.89Å; M58-H84 PolarHBondContact N-O 3.49Å; M58-H84 PolarHBondContact O-N 3.24Å; M58-H84 PolarHBondContact O-ND1 3.47Å; T60-H84 PolarHBondContact OG1-CE1 2.85Å; T82-H84 VanDerWaalsContact CG2-CE1 3.45Å; T82-H84 WeakPolarHBondContact CG2-CE1 3.44Å; T82-H84 PolarHBondContact O-CE1 2.92Å; T82-H84 VanDerWaalsContact O-CE1 3.24Å; T82-H84 PolarHBondContact O-ND1 3.31Å; T82-H84 VanDerWaalsContact O-ND1 3.09Å; H84-I131 HydrophobicContact CB-CD1 3.77Å
85R96.3Very high91.1Very high102 Ų10265.4 Ų65.439%0.38534%0.341SS..EExtended strand (participates in β ladder)trans-95.7121172.8-174.6176.2-176-103.72.7109.2I55 T130 I131I55-R85 HydrophobicContact CG2-CG 4.27Å; R85-T130 HydrophobicContact CG-CG2 4.43Å; R85-T130 PolarHBondContact NH1-OG1 2.81Å; R85-I131 PolarHBondContact O-N 2.87Å
86V97.2Very high92.7Very high0 Ų066.4 Ų66.40%034%0.34CS..EExtended strand (participates in β ladder)trans-110.1133.6179.2-1770000109.3I55 F56 M58 I88 V109 I131 A133I55-V86 WeakPolarHBondContact CA-O 3.47Å; I55-V86 WeakPolarHBondContact CG2-O 3.11Å; F56-V86 HydrophobicContact CD1-CB 4.31Å; F56-V86 HydrophobicContact CD1-CG1 4.49Å; F56-V86 HydrophobicContact CD2-CB 4.34Å; F56-V86 HydrophobicContact CE1-CB 3.87Å; F56-V86 HydrophobicContact CE1-CG1 3.69Å; F56-V86 HydrophobicContact CE2-CB 3.93Å; F56-V86 HydrophobicContact CE2-CG1 4.37Å; F56-V86 HydrophobicContact CE2-CG2 3.97Å; F56-V86 HydrophobicContact CZ-CB 3.69Å; F56-V86 HydrophobicContact CZ-CG1 3.63Å; F56-V86 HydrophobicContact CZ-CG2 4.04Å; F56-V86 PolarHBondContact N-O 3.09Å; F56-V86 VanDerWaalsContact N-O 3.11Å; F56-V86 PolarHBondContact O-N 3.34Å; M58-V86 HydrophobicContact CG-CG2 4.12Å; M58-V86 HydrophobicContact SD-CG2 3.88Å; V86-I88 HydrophobicContact CG1-CG1 4.49Å; V86-V109 HydrophobicContact CG1-CG1 3.94Å; V86-V109 HydrophobicContact CG2-CG1 4.36Å; V86-I131 CarbonylContact C-O 3.55Å; V86-I131 WeakPolarHBondContact CA-O 3.42Å; V86-A133 HydrophobicContact CG1-CB 3.76Å
87S96.4Very high93.7Very high4 Ų460.3 Ų60.33%0.02831%0.308CS..EExtended strand (participates in β ladder)trans-126.1131.8174.7-65.30000110.3T130 I131 I132 A133S87-T130 VanDerWaalsContact OG-CG2 3.22Å; S87-T130 WeakPolarHBondContact OG-CG2 3.4Å; S87-I131 PolarHBondContact N-O 3.41Å; S87-I132 WeakPolarHBondContact O-CA 3.32Å; S87-A133 PolarHBondContact O-N 3.21Å
88I96.8Very high94.4Very high0 Ų061.1 Ų61.10%030%0.302CS..EExtended strand (participates in β ladder)trans-117.4115.4-177.5-48.9156.3000108.9V53 T54 F56 V86 L93 R94 A97 A133 I136V53-I88 WeakPolarHBondContact CA-O 3.4Å; V53-I88 WeakPolarHBondContact CG2-O 3.43Å; T54-I88 HydrophobicContact CG2-CD1 4.26Å; T54-I88 PolarHBondContact N-O 2.73Å; T54-I88 VanDerWaalsContact N-O 3.13Å; T54-I88 PolarHBondContact O-N 3.19Å; F56-I88 HydrophobicContact CD1-CD1 4.41Å; F56-I88 HydrophobicContact CE1-CD1 3.87Å; F56-I88 HydrophobicContact CE1-CG1 4.4Å; V86-I88 HydrophobicContact CG1-CG1 4.49Å; I88-L93 HydrophobicContact CG2-CB 3.87Å; I88-L93 HydrophobicContact CG2-CD2 3.9Å; I88-L93 HydrophobicContact CG2-CG 3.82Å; I88-R94 HydrophobicContact CB-CB 3.98Å; I88-R94 HydrophobicContact CG2-CB 3.77Å; I88-R94 WeakPolarHBondContact O-CB 3.16Å; I88-A97 HydrophobicContact CD1-CB 3.18Å; I88-A133 HydrophobicContact CG1-CB 3.97Å; I88-I136 HydrophobicContact CD1-CD1 3.5Å; I88-I136 VanDerWaalsContact CD1-CD1 3.5Å; I88-I136 HydrophobicContact CG1-CD1 3.92Å
89F95Very high94.7Very high99 Ų9965 Ų6543%0.43432%0.316SS..  trans-99.4-24177.3-64.5-82.1000113V53 P91 I132V53-F89 HydrophobicContact CB-CD1 3.91Å; V53-F89 HydrophobicContact CB-CE1 3.76Å; V53-F89 HydrophobicContact CB-CZ 4.47Å; V53-F89 HydrophobicContact CG1-CE1 4.45Å; V53-F89 HydrophobicContact CG2-CD1 3.78Å; V53-F89 HydrophobicContact CG2-CD2 4.45Å; V53-F89 HydrophobicContact CG2-CE1 3.54Å; V53-F89 HydrophobicContact CG2-CE2 4.24Å; V53-F89 HydrophobicContact CG2-CG 4.25Å; V53-F89 HydrophobicContact CG2-CZ 3.8Å; F89-P91 WeakPolarHBondContact O-CD 3.5Å; F89-I132 HydrophobicContact CD2-CG2 4Å; F89-I132 HydrophobicContact CE2-CD1 4.3Å; F89-I132 HydrophobicContact CE2-CG1 4.14Å; F89-I132 HydrophobicContact CE2-CG2 4.46Å
90K94.4Very high94.8Very high125 Ų12566.8 Ų66.854%0.54332%0.319SS..SBendtrans-62118.3-178-176.6173.2-178.2176.80110G92 L93 R94K90-G92 PolarHBondContact O-N 2.91Å; K90-L93 HydrophobicContact CB-CB 4.04Å; K90-L93 HydrophobicContact CD-CB 4.18Å; K90-L93 HydrophobicContact CG-CB 4.16Å; K90-L93 PolarHBondContact O-N 3.48Å; K90-L93 VanDerWaalsContact O-N 3.1Å; K90-R94 PolarHBondContact O-N 2.79Å
91P91.4Very high94.8Very high68 Ų6861.4 Ų61.444%0.44230%0.296SS..Hα-helixtrans-54.3-48.9-169.2-30.435.9000115.2F89 L93 R94 D95F89-P91 WeakPolarHBondContact O-CD 3.5Å; P91-L93 PolarHBondContact O-N 3.08Å; P91-R94 VanDerWaalsContact O-CG 3.31Å; P91-R94 WeakPolarHBondContact O-CG 3.39Å; P91-D95 PolarHBondContact O-N 2.97Å; P91-D95 VanDerWaalsContact O-OD2 3.09Å
92G93.2Very high94.8Very high49 Ų4963.5 Ų63.551%0.50530%0.3SS..Hα-helixtrans-66.9-39.1178.100000113.2K90 V96K90-G92 PolarHBondContact O-N 2.91Å; G92-V96 VanDerWaalsContact O-CG2 3.25Å; G92-V96 WeakPolarHBondContact O-CG2 3.11Å; G92-V96 PolarHBondContact O-N 2.79Å
93L95.1Very high94.7Very high23 Ų2368 Ų6812%0.1232%0.315CS..Hα-helixtrans-73.3-37.1-176.4-171.663.6000111.9I88 K90 P91 D95 A97 D134 I136I88-L93 HydrophobicContact CG2-CB 3.87Å; I88-L93 HydrophobicContact CG2-CD2 3.9Å; I88-L93 HydrophobicContact CG2-CG 3.82Å; K90-L93 HydrophobicContact CB-CB 4.04Å; K90-L93 HydrophobicContact CD-CB 4.18Å; K90-L93 HydrophobicContact CG-CB 4.16Å; K90-L93 PolarHBondContact O-N 3.48Å; K90-L93 VanDerWaalsContact O-N 3.1Å; P91-L93 PolarHBondContact O-N 3.08Å; L93-D95 VanDerWaalsContact C-N 3.33Å; L93-D95 PolarHBondContact O-N 3.01Å; L93-A97 WeakPolarHBondContact O-CB 3.26Å; L93-A97 PolarHBondContact O-N 2.89Å; L93-D134 WeakPolarHBondContact CD2-O 3.44Å; L93-I136 HydrophobicContact CD1-CB 4.13Å; L93-I136 HydrophobicContact CD1-CG1 4.36Å; L93-I136 HydrophobicContact CD2-CD1 4.5Å; L93-I136 HydrophobicContact CD2-CG1 4.24Å; L93-I136 HydrophobicContact CG-CD1 4.45Å; L93-I136 HydrophobicContact CG-CG1 4.49Å
94R95.4Very high94.5Very high26 Ų2662 Ų6210%0.09830%0.303CS..Hα-helixtrans-67.3-35.9-178.978.7-178.3172.7-149.1-9.5111.6P52 T54 I88 K90 P91 Y98P52-R94 VanDerWaalsContact CD-NH1 3.29Å; P52-R94 VanDerWaalsContact CG-CZ 3.46Å; P52-R94 WeakPolarHBondContact O-CD 3.08Å; P52-R94 PolarHBondContact O-NH1 2.81Å; T54-R94 WeakPolarHBondContact CB-O 3.5Å; T54-R94 WeakPolarHBondContact OG1-CB 3.36Å; T54-R94 PolarHBondContact OG1-O 3.11Å; I88-R94 HydrophobicContact CB-CB 3.98Å; I88-R94 HydrophobicContact CG2-CB 3.77Å; I88-R94 WeakPolarHBondContact O-CB 3.16Å; K90-R94 PolarHBondContact O-N 2.79Å; P91-R94 VanDerWaalsContact O-CG 3.31Å; P91-R94 WeakPolarHBondContact O-CG 3.39Å; R94-Y98 WeakPolarHBondContact O-CB 3.48Å; R94-Y98 PolarHBondContact O-N 2.87Å
95D94.1Very high94.4Very high64 Ų6460.7 Ų60.734%0.34230%0.298SS..Hα-helixtrans-73.9-45.8-178.3-62-18.5000109.8P91 L93 A97 Y98 Q99P91-D95 PolarHBondContact O-N 2.97Å; P91-D95 VanDerWaalsContact O-OD2 3.09Å; L93-D95 VanDerWaalsContact C-N 3.33Å; L93-D95 PolarHBondContact O-N 3.01Å; D95-A97 PolarHBondContact O-N 2.85Å; D95-Y98 PolarHBondContact O-N 2.83Å; D95-Q99 WeakPolarHBondContact O-CG 3.44Å; D95-Q99 PolarHBondContact O-N 2.85Å
96V94.3Very high94.3Very high55 Ų5561.3 Ų61.333%0.33330%0.3SS..Hα-helixtrans-59.2-47.2172.4174.60000110.2G92 Y98 Q99 Y100 F138G92-V96 VanDerWaalsContact O-CG2 3.25Å; G92-V96 WeakPolarHBondContact O-CG2 3.11Å; G92-V96 PolarHBondContact O-N 2.79Å; V96-Y98 VanDerWaalsContact C-N 3.3Å; V96-Y98 PolarHBondContact O-N 2.8Å; V96-Q99 PolarHBondContact O-N 2.8Å; V96-Y100 HydrophobicContact CB-CD2 4.31Å; V96-Y100 HydrophobicContact CG1-CD2 3.59Å; V96-Y100 HydrophobicContact CG1-CE2 4.1Å; V96-Y100 WeakPolarHBondContact O-CB 3.28Å; V96-Y100 VanDerWaalsContact O-CD2 3.24Å; V96-Y100 WeakPolarHBondContact O-CD2 3.48Å; V96-Y100 PolarHBondContact O-N 3.31Å; V96-F138 HydrophobicContact CG1-CE2 3.77Å; V96-F138 HydrophobicContact CG1-CZ 3.69Å
97A94.4Very high94.3Very high0 Ų061.3 Ų61.30%030%0.3CS..Hα-helixtrans-61.7-39.5178.900000112.2T54 I88 L93 D95 Q99 V101 I136T54-A97 HydrophobicContact CG2-CB 4.39Å; I88-A97 HydrophobicContact CD1-CB 3.18Å; L93-A97 WeakPolarHBondContact O-CB 3.26Å; L93-A97 PolarHBondContact O-N 2.89Å; D95-A97 PolarHBondContact O-N 2.85Å; A97-Q99 VanDerWaalsContact C-N 3.34Å; A97-Q99 PolarHBondContact O-N 3.09Å; A97-V101 HydrophobicContact CB-CG2 4.09Å; A97-V101 WeakPolarHBondContact O-CA 3.47Å; A97-V101 WeakPolarHBondContact O-CB 3.42Å; A97-V101 VanDerWaalsContact O-CG2 3.3Å; A97-V101 WeakPolarHBondContact O-CG2 3.3Å; A97-V101 PolarHBondContact O-N 3.03Å; A97-I136 HydrophobicContact CB-CD1 4.3Å
98Y94.9Very high94.3Very high109 Ų10963.5 Ų63.543%0.42731%0.311SS..Hα-helixtrans-64.6-38.5177.2-178.7-109.8000112.7P42 M44 R94 D95 V96P42-Y98 HydrophobicContact CB-CD2 4.45Å; P42-Y98 HydrophobicContact CG-CD2 4.34Å; P42-Y98 WeakPolarHBondContact O-CE2 3.44Å; M44-Y98 HydrophobicContact CB-CD2 3.93Å; M44-Y98 HydrophobicContact CB-CE2 4.01Å; M44-Y98 HydrophobicContact CB-CG 4.37Å; M44-Y98 HydrophobicContact CE-CD1 4.07Å; M44-Y98 HydrophobicContact CE-CG 3.96Å; R94-Y98 WeakPolarHBondContact O-CB 3.48Å; R94-Y98 PolarHBondContact O-N 2.87Å; D95-Y98 PolarHBondContact O-N 2.83Å; V96-Y98 VanDerWaalsContact C-N 3.3Å; V96-Y98 PolarHBondContact O-N 2.8Å
99Q92.3Very high94.4Very high120 Ų12063.5 Ų63.556%0.56131%0.311SS*.Hα-helixtrans-73.8-47.9179.6-70.1175.6-3.100112.5D95 V96 A97D95-Q99 WeakPolarHBondContact O-CG 3.44Å; D95-Q99 PolarHBondContact O-N 2.85Å; V96-Q99 PolarHBondContact O-N 2.8Å; A97-Q99 VanDerWaalsContact C-N 3.34Å; A97-Q99 PolarHBondContact O-N 3.09Å
100Y91.4Very high94.5Very high142 Ų14260.9 Ų60.956%0.55730%0.3SS*.Hα-helixtrans-99.9-25.2-167.7-64.5-81.2000114.5V96V96-Y100 HydrophobicContact CB-CD2 4.31Å; V96-Y100 HydrophobicContact CG1-CD2 3.59Å; V96-Y100 HydrophobicContact CG1-CE2 4.1Å; V96-Y100 WeakPolarHBondContact O-CB 3.28Å; V96-Y100 VanDerWaalsContact O-CD2 3.24Å; V96-Y100 WeakPolarHBondContact O-CD2 3.48Å; V96-Y100 PolarHBondContact O-N 3.31Å
101V93.4Very high94.7Very high0 Ų055.2 Ų55.20%028%0.277CS..  trans-74.8132.4173.3-178.30000109.4V38 P42 A97 V107 F138V38-V101 HydrophobicContact CB-CG1 4.11Å; V38-V101 HydrophobicContact CG1-CG1 3.79Å; V38-V101 HydrophobicContact CG2-CG1 3.57Å; P42-V101 WeakPolarHBondContact CD-O 3.46Å; P42-V101 HydrophobicContact CG-CB 4.03Å; P42-V101 HydrophobicContact CG-CG1 4.42Å; P42-V101 VanDerWaalsContact CG-O 3.26Å; P42-V101 WeakPolarHBondContact CG-O 3.35Å; A97-V101 HydrophobicContact CB-CG2 4.09Å; A97-V101 WeakPolarHBondContact O-CA 3.47Å; A97-V101 WeakPolarHBondContact O-CB 3.42Å; A97-V101 VanDerWaalsContact O-CG2 3.3Å; A97-V101 WeakPolarHBondContact O-CG2 3.3Å; A97-V101 PolarHBondContact O-N 3.03Å; V101-V107 HydrophobicContact CG2-CG1 4.48Å; V101-F138 HydrophobicContact CG2-CD1 4.18Å; V101-F138 HydrophobicContact CG2-CE1 3.49Å; V101-F138 VanDerWaalsContact CG2-CE1 3.49Å; V101-F138 HydrophobicContact CG2-CZ 4.44Å
102K94.1Very high94.9Very high101 Ų10156.2 Ų56.244%0.43928%0.275SS..  trans-131.6164.8169.5-60.4-63.8171.6-159.50109.9V38 D41 G104 S105V38-K102 WeakPolarHBondContact CB-O 3.22Å; V38-K102 WeakPolarHBondContact CG1-O 3.16Å; D41-K102 WeakPolarHBondContact OD1-CA 3.39Å; K102-G104 PolarHBondContact O-N 3.15Å; K102-S105 PolarHBondContact N-OG 2.86Å; K102-S105 VanDerWaalsContact N-OG 3.15Å; K102-S105 WeakPolarHBondContact O-CB 3.19Å; K102-S105 PolarHBondContact O-N 3.34Å; K102-S105 PolarHBondContact O-OG 3.49Å
103K94.8Very high95.1Very high145 Ų14556.2 Ų56.263%0.6326%0.263SS*.THydrogen-bonded Turntrans-51.2132.2168.3178.7174.1-179.6-174.50110.1G39 D41 S105G39-K103 WeakPolarHBondContact O-CE 3.4Å; G39-K103 WeakPolarHBondContact O-CG 3.34Å; D41-K103 PolarHBondContact OD1-N 3.05Å; K103-S105 VanDerWaalsContact C-N 3.28Å; K103-S105 PolarHBondContact O-N 2.8Å
104G93.4Very high95.2Very high34 Ų3458.6 Ų58.635%0.35128%0.276SS..THydrogen-bonded Turntrans86.1-14.3-178.800000114.9R37 V38 K102 R106R37-G104 PolarHBondContact NH1-O 2.75Å; R37-G104 VanDerWaalsContact NH1-O 3.09Å; V38-G104 WeakPolarHBondContact O-CA 3.4Å; V38-G104 PolarHBondContact O-N 3.44Å; K102-G104 PolarHBondContact O-N 3.15Å; G104-R106 PolarHBondContact O-N 2.86Å
105S94.1Very high95.1Very high8 Ų864.7 Ų64.76%0.05630%0.3CS..  trans-56.5128.9176.9-660000110.6R37 V38 K102 K103 S140R37-S105 WeakPolarHBondContact CA-O 3.48Å; V38-S105 WeakPolarHBondContact CG2-O 3.46Å; V38-S105 PolarHBondContact N-O 3.1Å; K102-S105 PolarHBondContact N-OG 2.86Å; K102-S105 VanDerWaalsContact N-OG 3.15Å; K102-S105 WeakPolarHBondContact O-CB 3.19Å; K102-S105 PolarHBondContact O-N 3.34Å; K102-S105 PolarHBondContact O-OG 3.49Å; K103-S105 VanDerWaalsContact C-N 3.28Å; K103-S105 PolarHBondContact O-N 2.8Å; S105-S140 WeakPolarHBondContact CA-OG 3.37Å
106R95.3Very high94.9Very high116 Ų11662.8 Ų62.844%0.43830%0.295SS..EExtended strand (participates in β ladder)trans-79122.8167.6-164.8178.6-171-179.31.8109.4L35 G36 G104 L139 S140L35-R106 HydrophobicContact CD1-CG 4.29Å; G36-R106 WeakPolarHBondContact O-CA 3.35Å; G104-R106 PolarHBondContact O-N 2.86Å; R106-L139 HydrophobicContact CB-CB 4.27Å; R106-L139 HydrophobicContact CG-CB 4.21Å; R106-L139 HydrophobicContact CG-CD1 4.41Å; R106-L139 WeakPolarHBondContact O-CB 3.42Å; R106-L139 PolarHBondContact O-N 3.3Å; R106-S140 WeakPolarHBondContact CA-OG 3.36Å; R106-S140 PolarHBondContact N-OG 3.29Å; R106-S140 PolarHBondContact O-OG 3.13Å
107V96.2Very high94.6Very high0 Ų066.1 Ų66.10%031%0.307CS..EExtended strand (participates in β ladder)trans-136.5142.9-177.4-63.30000110.4G36 V38 F56 M58 V101 V109 I136 V137 F138G36-V107 PolarHBondContact N-O 2.91Å; G36-V107 VanDerWaalsContact N-O 3.08Å; G36-V107 PolarHBondContact O-N 2.92Å; V38-V107 HydrophobicContact CG2-CG1 4.28Å; V38-V107 HydrophobicContact CG2-CG2 3.78Å; F56-V107 HydrophobicContact CE2-CG2 4.36Å; M58-V107 HydrophobicContact CE-CG2 4.17Å; V101-V107 HydrophobicContact CG2-CG1 4.48Å; V107-V109 HydrophobicContact CG2-CG2 3.99Å; V107-I136 HydrophobicContact CB-CG2 4.25Å; V107-I136 HydrophobicContact CG1-CG2 4.44Å; V107-V137 WeakPolarHBondContact CA-O 3.49Å; V107-F138 HydrophobicContact CG1-CD1 4.4Å
108L97.2Very high94.1Very high50 Ų5072 Ų7226%0.26233%0.33SS..EExtended strand (participates in β ladder)trans-96.4126161.5-179.477.1000107.5L34 L35 I136 V137 L139L34-L108 CarbonylContact O-C 3.48Å; L34-L108 VanDerWaalsContact O-CA 3.28Å; L34-L108 WeakPolarHBondContact O-CA 3.24Å; L35-L108 HydrophobicContact CB-CD1 3.98Å; L35-L108 HydrophobicContact CD1-CB 4.34Å; L108-I136 CarbonylContact O-C 3.57Å; L108-I136 VanDerWaalsContact O-CA 3.31Å; L108-I136 WeakPolarHBondContact O-CA 3.38Å; L108-V137 HydrophobicContact CB-CB 4.09Å; L108-V137 HydrophobicContact CD2-CB 4.42Å; L108-V137 HydrophobicContact CD2-CG2 4.18Å; L108-V137 PolarHBondContact N-O 3Å; L108-V137 PolarHBondContact O-N 2.95Å; L108-L139 HydrophobicContact CB-CD1 4.21Å
109V97.3Very high93.8Very high0 Ų070.6 Ų70.60%033%0.333CS..EExtended strand (participates in β ladder)trans-115.1126.8177.6178.30000108.1Q33 L34 F56 M58 V86 V107 I131 A133 I136Q33-V109 CarbonylContact C-O 3.55Å; Q33-V109 WeakPolarHBondContact CA-O 3.49Å; L34-V109 PolarHBondContact N-O 2.89Å; L34-V109 PolarHBondContact O-N 3.1Å; F56-V109 HydrophobicContact CE2-CG2 4.47Å; F56-V109 HydrophobicContact CZ-CG2 4.01Å; M58-V109 HydrophobicContact CE-CG2 4.34Å; M58-V109 HydrophobicContact SD-CB 4.17Å; M58-V109 HydrophobicContact SD-CG2 3.66Å; V86-V109 HydrophobicContact CG1-CG1 3.94Å; V86-V109 HydrophobicContact CG2-CG1 4.36Å; V107-V109 HydrophobicContact CG2-CG2 3.99Å; V109-I131 HydrophobicContact CG1-CG2 4.45Å; V109-A133 HydrophobicContact CG1-CB 3.81Å; V109-I136 HydrophobicContact CG2-CG1 4.3Å
110E98.1Very high93.4Very high43 Ų4367.9 Ų67.920%0.20132%0.323CS..EExtended strand (participates in β ladder)trans-113.9141.8167.3-53.1-169107.100110.1R31 V32 Q33 A133 D134 N135R31-E110 IonicContact CZ-OE1 3.88Å; R31-E110 IonicContact NH2-OE1 2.92Å; R31-E110 PolarHBondContact NH2-OE1 2.76Å; V32-E110 WeakPolarHBondContact O-CA 3.21Å; Q33-E110 HydrophobicContact CG-CG 4.12Å; Q33-E110 PolarHBondContact NE2-OE1 2.91Å; E110-A133 WeakPolarHBondContact O-CA 3.42Å; E110-D134 PolarHBondContact O-N 2.86Å; E110-N135 HydrophobicContact CB-CB 4.26Å; E110-N135 PolarHBondContact N-O 3.4Å; E110-N135 PolarHBondContact O-N 3.15Å; E110-N135 VanDerWaalsContact O-N 3.12Å; E110-N135 VanDerWaalsContact O-O 3.14Å; E110-N135 PolarHBondContact OE2-ND2 2.79Å
111G97.5Very high93.2Very high6 Ų670.8 Ų70.86%0.06234%0.338CS..EExtended strand (participates in β ladder)trans177.3-146.2179.200000112.3R31 V32 I132R31-G111 CarbonylContact C-O 3.49Å; R31-G111 WeakPolarHBondContact CA-O 3.23Å; V32-G111 PolarHBondContact N-O 2.87Å; V32-G111 PolarHBondContact O-N 3.21Å; G111-I132 CarbonylContact C-O 3.59Å; G111-I132 WeakPolarHBondContact CA-O 2.98Å
112K97.3Very high93Very high90 Ų9077 Ų7739%0.39137%0.372SS..EExtended strand (participates in β ladder)trans-135.7154.2-178.462.4-173.2178.3-175.60111.3I131 I132K112-I131 CarbonylContact O-C 3.56Å; K112-I131 WeakPolarHBondContact O-CA 3.32Å; K112-I132 HydrophobicContact CG-CB 3.93Å; K112-I132 PolarHBondContact N-O 3.25Å; K112-I132 PolarHBondContact O-N 3.02Å
113L97.2Very high92.8Very high48 Ų4878.8 Ų78.825%0.25139%0.386SS..EExtended strand (participates in β ladder)trans-82.6135175.1-159.366.4000110.3N30 V32 Y115 T129 I131N30-L113 PolarHBondContact ND2-O 2.86Å; N30-L113 PolarHBondContact OD1-N 3.13Å; V32-L113 HydrophobicContact CG2-CB 4.02Å; V32-L113 HydrophobicContact CG2-CD1 4.46Å; L113-Y115 HydrophobicContact CD2-CE1 4.31Å; L113-Y115 HydrophobicContact CD2-CE2 3.83Å; L113-Y115 WeakPolarHBondContact CD2-OH 3.45Å; L113-Y115 HydrophobicContact CG-CE2 4.21Å; L113-T129 HydrophobicContact CD1-CG2 3.45Å; L113-T129 VanDerWaalsContact CD1-CG2 3.45Å; L113-T129 HydrophobicContact CD2-CG2 4.24Å; L113-T129 HydrophobicContact CG-CG2 3.9Å; L113-I131 HydrophobicContact CD1-CG1 3.93Å
114D96.2Very high92.6Very high74 Ų7475.2 Ų75.240%0.39638%0.376SS..EExtended strand (participates in β ladder)trans-131.4135.1176.6-173.367.3000109.6T130 I132D114-T130 PolarHBondContact N-O 2.86Å; D114-T130 PolarHBondContact O-N 2.99Å; D114-T130 VanDerWaalsContact O-O 3.06Å; D114-I132 HydrophobicContact CB-CD1 3.62Å; D114-I132 HydrophobicContact CB-CG1 3.86Å
115Y94.3Very high92.4Very high153 Ų15382.6 Ų82.660%0.639%0.393SS*.EExtended strand (participates in β ladder)trans-108.7102.1177.2-61.1-86.3000108L113 T129L113-Y115 HydrophobicContact CD2-CE1 4.31Å; L113-Y115 HydrophobicContact CD2-CE2 3.83Å; L113-Y115 WeakPolarHBondContact CD2-OH 3.45Å; L113-Y115 HydrophobicContact CG-CE2 4.21Å; Y115-T129 HydrophobicContact CD1-CG2 4.05Å; Y115-T129 WeakPolarHBondContact CD1-OG1 3.39Å; Y115-T129 HydrophobicContact CE1-CG2 3.8Å; Y115-T129 WeakPolarHBondContact CE1-OG1 3.49Å
116G88.8Confident92.2Very high24 Ų2488.5 Ų88.525%0.24741%0.414CS..EExtended strand (participates in β ladder)trans-90.3159.9174.100000111.6Q127 A128G116-Q127 CarbonylContact O-C 3.58Å; G116-Q127 WeakPolarHBondContact O-CA 3.5Å; G116-A128 PolarHBondContact N-O 3Å; G116-A128 PolarHBondContact O-N 2.85Å
117E88.2Confident92Very high125 Ų12590 Ų9058%0.58443%0.426SS*.EExtended strand (participates in β ladder)trans-111.9140.4166.2-64.5-169.3165.500109.7R125 R126 Q127E117-R125 IonicContact OE2-NH1 3.93Å; E117-R126 WeakPolarHBondContact CA-O 3.48Å; E117-Q127 HydrophobicContact CG-CG 4.36Å
118Y84.6Confident91.6Very high123 Ų12391 Ų9148%0.48243%0.434SS..EExtended strand (participates in β ladder)trans-134.9149.9169.470.1-80.6000110R126 A128Y118-R126 HydrophobicContact CD1-CB 4.17Å; Y118-R126 WeakPolarHBondContact CD1-O 3.44Å; Y118-R126 HydrophobicContact CE1-CB 3.65Å; Y118-R126 HydrophobicContact CE2-CB 4.08Å; Y118-R126 HydrophobicContact CE2-CG 4.47Å; Y118-R126 PolarHBondContact N-O 3.24Å; Y118-R126 PolarHBondContact O-N 2.82Å; Y118-A128 HydrophobicContact CD1-CB 3.7Å; Y118-A128 HydrophobicContact CE1-CB 3.71Å
119V87.6Confident91.4Very high81 Ų8192.2 Ų92.249%0.49144%0.444SS..EExtended strand (participates in β ladder)trans-95.4123.5175.8-1770000107.7R125V119-R125 HydrophobicContact CG2-CG 4.29Å
120D85.6Confident91.3Very high63 Ų6392.7 Ų92.734%0.33745%0.447SS..  trans-76.5169175.7-162.85.3000111N122 N123 V124D120-N122 PolarHBondContact O-N 3.09Å; D120-N123 PolarHBondContact O-N 2.8Å; D120-V124 PolarHBondContact N-O 3.48Å
121K86Confident91.3Very high202 Ų20291 Ų9188%0.87844%0.44SS*.THydrogen-bonded Turntrans-55.2-25.9179.7-65.2-177.5179.4-1790113.7N123K121-N123 PolarHBondContact O-N 3.49Å
122N90.4Very high91.3Very high132 Ų13292 Ų9271%0.70644%0.443SS*.THydrogen-bonded Turntrans-87.114.3177.6-60-22.7000113.2D120 V124D120-N122 PolarHBondContact O-N 3.09Å; N122-V124 HydrophobicContact CB-CG2 4.4Å; N122-V124 PolarHBondContact O-N 2.95Å
123N88.2Confident91.3Very high138 Ų13887.8 Ų87.874%0.73843%0.425SS*.SBendtrans60.722.8-177.9-155.235.7000114.8D120 K121D120-N123 PolarHBondContact O-N 2.8Å; K121-N123 PolarHBondContact O-N 3.49Å
124V91.9Very high91.3Very high69 Ų6989.5 Ų89.542%0.41843%0.434SS..  trans-94.8128.2176.7-179.80000109.4D120 N122 R126D120-V124 PolarHBondContact N-O 3.48Å; N122-V124 HydrophobicContact CB-CG2 4.4Å; N122-V124 PolarHBondContact O-N 2.95Å; V124-R126 PolarHBondContact O-N 3Å
125R89.1Confident91.3Very high190 Ų19089.3 Ų89.372%0.71743%0.433SS*.EExtended strand (participates in β ladder)trans-70.3126.2172.7-65.5-172.9-176.6-1634110E117 V119E117-R125 IonicContact OE2-NH1 3.93Å; V119-R125 HydrophobicContact CG2-CG 4.29Å
126R90.2Very high91.3Very high132 Ų13282.5 Ų82.550%0.49841%0.407SS..EExtended strand (participates in β ladder)trans-120.9137.6176.2-65.2-66.5-172.4172.5-0.9109E117 Y118 V124E117-R126 WeakPolarHBondContact CA-O 3.48Å; Y118-R126 HydrophobicContact CD1-CB 4.17Å; Y118-R126 WeakPolarHBondContact CD1-O 3.44Å; Y118-R126 HydrophobicContact CE1-CB 3.65Å; Y118-R126 HydrophobicContact CE2-CB 4.08Å; Y118-R126 HydrophobicContact CE2-CG 4.47Å; Y118-R126 PolarHBondContact N-O 3.24Å; Y118-R126 PolarHBondContact O-N 2.82Å; V124-R126 PolarHBondContact O-N 3Å
127Q89.5Confident91.6Very high146 Ų14684.2 Ų84.268%0.68241%0.413SS*.EExtended strand (participates in β ladder)trans-82.6135.2170.3-69.2-179.7-10.700109.3G116 E117G116-Q127 CarbonylContact O-C 3.58Å; G116-Q127 WeakPolarHBondContact O-CA 3.5Å; E117-Q127 HydrophobicContact CG-CG 4.36Å
128A88.6Confident91.9Very high22 Ų2281.7 Ų81.718%0.18240%0.4CS..EExtended strand (participates in β ladder)trans-120.1114.4175.100000109.6G116 Y118G116-A128 PolarHBondContact N-O 3Å; G116-A128 PolarHBondContact O-N 2.85Å; Y118-A128 HydrophobicContact CD1-CB 3.7Å; Y118-A128 HydrophobicContact CE1-CB 3.71Å
129T93.9Very high92.1Very high75 Ų7579.8 Ų79.846%0.4640%0.398SS..EExtended strand (participates in β ladder)trans-79.6124.1169.2-48.30000109.4L113 Y115L113-T129 HydrophobicContact CD1-CG2 3.45Å; L113-T129 VanDerWaalsContact CD1-CG2 3.45Å; L113-T129 HydrophobicContact CD2-CG2 4.24Å; L113-T129 HydrophobicContact CG-CG2 3.9Å; Y115-T129 HydrophobicContact CD1-CG2 4.05Å; Y115-T129 WeakPolarHBondContact CD1-OG1 3.39Å; Y115-T129 HydrophobicContact CE1-CG2 3.8Å; Y115-T129 WeakPolarHBondContact CE1-OG1 3.49Å
130T95.3Very high91.6Very high11 Ų1177.6 Ų77.67%0.06739%0.386CS..EExtended strand (participates in β ladder)trans-131.7144.6178.8-60.60000109.6R85 S87 D114R85-T130 HydrophobicContact CG-CG2 4.43Å; R85-T130 PolarHBondContact NH1-OG1 2.81Å; S87-T130 VanDerWaalsContact OG-CG2 3.22Å; S87-T130 WeakPolarHBondContact OG-CG2 3.4Å; D114-T130 PolarHBondContact N-O 2.86Å; D114-T130 PolarHBondContact O-N 2.99Å; D114-T130 VanDerWaalsContact O-O 3.06Å
131I97.6Very high90.6Very high8 Ų882 Ų824%0.04141%0.409CS..EExtended strand (participates in β ladder)trans-97.2119.7172.1-64.3139.1000108V32 L34 H84 R85 V86 S87 V109 K112 L113V32-I131 HydrophobicContact CB-CG2 4.37Å; V32-I131 HydrophobicContact CG1-CD1 4.44Å; V32-I131 HydrophobicContact CG1-CG1 4.21Å; V32-I131 HydrophobicContact CG1-CG2 4.15Å; L34-I131 HydrophobicContact CD1-CD1 3.46Å; L34-I131 VanDerWaalsContact CD1-CD1 3.46Å; H84-I131 HydrophobicContact CB-CD1 3.77Å; R85-I131 PolarHBondContact O-N 2.87Å; V86-I131 CarbonylContact C-O 3.55Å; V86-I131 WeakPolarHBondContact CA-O 3.42Å; S87-I131 PolarHBondContact N-O 3.41Å; V109-I131 HydrophobicContact CG1-CG2 4.45Å; K112-I131 CarbonylContact O-C 3.56Å; K112-I131 WeakPolarHBondContact O-CA 3.32Å; L113-I131 HydrophobicContact CD1-CG1 3.93Å
132I97.1Very high89.1Confident25 Ų2579 Ų7913%0.12840%0.403CS..EExtended strand (participates in β ladder)trans-85.9110.9172.5-61.2178.7000107.2S87 F89 G111 K112 D114S87-I132 WeakPolarHBondContact O-CA 3.32Å; F89-I132 HydrophobicContact CD2-CG2 4Å; F89-I132 HydrophobicContact CE2-CD1 4.3Å; F89-I132 HydrophobicContact CE2-CG1 4.14Å; F89-I132 HydrophobicContact CE2-CG2 4.46Å; G111-I132 CarbonylContact C-O 3.59Å; G111-I132 WeakPolarHBondContact CA-O 2.98Å; K112-I132 HydrophobicContact CG-CB 3.93Å; K112-I132 PolarHBondContact N-O 3.25Å; K112-I132 PolarHBondContact O-N 3.02Å; D114-I132 HydrophobicContact CB-CD1 3.62Å; D114-I132 HydrophobicContact CB-CG1 3.86Å
133A97.4Very high87.4Confident2 Ų280 Ų802%0.01741%0.407CS..EExtended strand (participates in β ladder)trans-81.8129.1-177.600000111.7V86 S87 I88 V109 E110 I136V86-A133 HydrophobicContact CG1-CB 3.76Å; S87-A133 PolarHBondContact O-N 3.21Å; I88-A133 HydrophobicContact CG1-CB 3.97Å; V109-A133 HydrophobicContact CG1-CB 3.81Å; E110-A133 WeakPolarHBondContact O-CA 3.42Å; A133-I136 HydrophobicContact CB-CD1 4.28Å; A133-I136 HydrophobicContact CB-CG1 4.28Å
134D96.4Very high85.8Confident84 Ų8484.9 Ų84.945%0.44942%0.415SS..EExtended strand (participates in β ladder)trans-99.9-28.5174.5-67.2-44.1000111.6L93 E110L93-D134 WeakPolarHBondContact CD2-O 3.44Å; E110-D134 PolarHBondContact O-N 2.86Å
135N96.4Very high83.9Confident71 Ų7185.3 Ų85.338%0.3843%0.433SS..EExtended strand (participates in β ladder)trans-147.1146179.3-171.422.3000111.5E110E110-N135 HydrophobicContact CB-CB 4.26Å; E110-N135 PolarHBondContact N-O 3.4Å; E110-N135 PolarHBondContact O-N 3.15Å; E110-N135 VanDerWaalsContact O-N 3.12Å; E110-N135 VanDerWaalsContact O-O 3.14Å; E110-N135 PolarHBondContact OE2-ND2 2.79Å
136I95.5Very high82Confident9 Ų986 Ų865%0.04644%0.441CS..EExtended strand (participates in β ladder)trans-137.4129.8175.2-60.6176.2000108.7F56 I88 L93 A97 V107 L108 V109 A133 F138F56-I136 HydrophobicContact CE1-CD1 4.1Å; F56-I136 HydrophobicContact CZ-CD1 4.22Å; I88-I136 HydrophobicContact CD1-CD1 3.5Å; I88-I136 VanDerWaalsContact CD1-CD1 3.5Å; I88-I136 HydrophobicContact CG1-CD1 3.92Å; L93-I136 HydrophobicContact CD1-CB 4.13Å; L93-I136 HydrophobicContact CD1-CG1 4.36Å; L93-I136 HydrophobicContact CD2-CD1 4.5Å; L93-I136 HydrophobicContact CD2-CG1 4.24Å; L93-I136 HydrophobicContact CG-CD1 4.45Å; L93-I136 HydrophobicContact CG-CG1 4.49Å; A97-I136 HydrophobicContact CB-CD1 4.3Å; V107-I136 HydrophobicContact CB-CG2 4.25Å; V107-I136 HydrophobicContact CG1-CG2 4.44Å; L108-I136 CarbonylContact O-C 3.57Å; L108-I136 VanDerWaalsContact O-CA 3.31Å; L108-I136 WeakPolarHBondContact O-CA 3.38Å; V109-I136 HydrophobicContact CG2-CG1 4.3Å; A133-I136 HydrophobicContact CB-CD1 4.28Å; A133-I136 HydrophobicContact CB-CG1 4.28Å; I136-F138 HydrophobicContact CG2-CE1 4.27Å; I136-F138 HydrophobicContact CG2-CE2 4.3Å; I136-F138 HydrophobicContact CG2-CZ 4.11Å
137V95.3Very high80.3Confident60 Ų6087.6 Ų87.636%0.36446%0.459SS..EExtended strand (participates in β ladder)trans-107.4123.8169.9-173.70000108.8V107 L108 L139V107-V137 WeakPolarHBondContact CA-O 3.49Å; L108-V137 HydrophobicContact CB-CB 4.09Å; L108-V137 HydrophobicContact CD2-CB 4.42Å; L108-V137 HydrophobicContact CD2-CG2 4.18Å; L108-V137 PolarHBondContact N-O 3Å; L108-V137 PolarHBondContact O-N 2.95Å; V137-L139 HydrophobicContact CG1-CD2 4.08Å; V137-L139 HydrophobicContact CG1-CG 4.5Å
138F92.9Very high77.9Confident73 Ų7393.5 Ų93.532%0.3249%0.487SS..EExtended strand (participates in β ladder)trans-85.4123177.5-54.6-93.4000108.7V96 V101 V107 I136V96-F138 HydrophobicContact CG1-CE2 3.77Å; V96-F138 HydrophobicContact CG1-CZ 3.69Å; V101-F138 HydrophobicContact CG2-CD1 4.18Å; V101-F138 HydrophobicContact CG2-CE1 3.49Å; V101-F138 VanDerWaalsContact CG2-CE1 3.49Å; V101-F138 HydrophobicContact CG2-CZ 4.44Å; V107-F138 HydrophobicContact CG1-CD1 4.4Å; I136-F138 HydrophobicContact CG2-CE1 4.27Å; I136-F138 HydrophobicContact CG2-CE2 4.3Å; I136-F138 HydrophobicContact CG2-CZ 4.11Å
139L90Very high77.3Confident82 Ų8297.1 Ų97.143%0.42950%0.502SS..  trans-115.116.4-174.8-62.1168.2000112.2L35 R106 L108 V137L35-L139 HydrophobicContact CD1-CD1 3.22Å; R106-L139 HydrophobicContact CB-CB 4.27Å; R106-L139 HydrophobicContact CG-CB 4.21Å; R106-L139 HydrophobicContact CG-CD1 4.41Å; R106-L139 WeakPolarHBondContact O-CB 3.42Å; R106-L139 PolarHBondContact O-N 3.3Å; L108-L139 HydrophobicContact CB-CD1 4.21Å; V137-L139 HydrophobicContact CG1-CD2 4.08Å; V137-L139 HydrophobicContact CG1-CG 4.5Å
140S76.5Confident76.5Confident35 Ų3598.2 Ų98.225%0.24551%0.505CS..  trans-110.6130.6-175.4-55.40000110.8S105 R106 N142S105-S140 WeakPolarHBondContact CA-OG 3.37Å; R106-S140 WeakPolarHBondContact CA-OG 3.36Å; R106-S140 PolarHBondContact N-OG 3.29Å; R106-S140 PolarHBondContact O-OG 3.13Å; S140-N142 PolarHBondContact O-N 3.35Å; S140-N142 VanDerWaalsContact O-N 3.09Å
141D63.7Low75.4Confident155 Ų155103.1 Ų103.183%0.82953%0.529SS*.  trans-77.416.9-178.2-64.3-33.9000114.5I143 R144D141-I143 PolarHBondContact O-N 3.19Å; D141-R144 PolarHBondContact O-N 3.44Å
142N55.9Low74.1Confident140 Ų140108.6 Ų108.675%0.74956%0.558SS**THydrogen-bonded Turntrans-70.618.3-176.6-91.2-0.9000114.5S140 R144S140-N142 PolarHBondContact O-N 3.35Å; S140-N142 VanDerWaalsContact O-N 3.09Å; N142-R144 VanDerWaalsContact C-N 3.28Å
143I55.2Low72.7Confident153 Ų153113.9 Ų113.979%0.78558%0.584SS**THydrogen-bonded Turntrans-79-12.1172-60.8177.9000111.2D141D141-I143 PolarHBondContact O-N 3.19Å
144R53.3Low71Confident241 Ų241121.3 Ų121.391%0.90962%0.622SS**SBendtrans-110.2107.9177.5-84.5179.9154.7180-6.5113.1D141 N142D141-R144 PolarHBondContact O-N 3.44Å; N142-R144 VanDerWaalsContact C-N 3.28Å
145G52.1Low69.2Low77 Ų77124 Ų12479%0.79464%0.635SS**  trans127.572.8153.500000115.8
146K48.6Very low67.1Low205 Ų205128.1 Ų128.189%0.89165%0.654SS**SBendtrans-143.928.2152.4-128.5-174-173.1-172.30114.3
147D54.8Low64.7Low165 Ų165138 Ų13888%0.88271%0.705SS**  trans-125.272.7165.9-67.5-33.6000108.5
148Q38.9Very low62Low270 Ų270145.1 Ų145.1100%1.26274%0.736SS**  trans-149.90151.5-73.3-1620.800108.4

Retrieved 148 of 148 residues in 670.3 ms (Link to these results)