A0A096NDH7_PAPAN Loading...

Poly(rC)-binding protein 4

Single-stranded nucleic acid binding protein that binds preferentially to oligo dC.

AlphaFold DB , UniProt , Accession A0A096NDH7, Species PAPAN (Papio anubis, Olive baboon), Gene PCBP4, Length 403 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
1M46.8Very low42.8Very low250 Ų250137.9 Ų137.9100%1.23283%0.825SS**  0108.40-80.4161.4150.300107.3
2S38.8Very low42.8Very low121 Ų121134.8 Ų134.885%0.84681%0.811SS**  trans-16585.7177.944.90000106
3G41.2Very low43Very low81 Ų81134.5 Ų134.584%0.83580%0.795SS**  trans-74.5123.1179.800000109.9D5G3-D5 VanDerWaalsContact C-N 3.32Å; G3-D5 PolarHBondContact O-N 3.14Å
4S40.3Very low43.9Very low121 Ų121133.9 Ų133.985%0.84679%0.785SS**  trans-81.284.616352.20000108.1G6S4-G6 VanDerWaalsContact C-N 3.29Å; S4-G6 PolarHBondContact O-N 2.92Å
5D41.5Very low45.2Very low161 Ų161132.2 Ų132.286%0.86178%0.784SS**  trans-71.690.2168.8-162.1-108.3000108G3 G7G3-D5 VanDerWaalsContact C-N 3.32Å; G3-D5 PolarHBondContact O-N 3.14Å; D5-G7 PolarHBondContact O-N 3.21Å
6G38.1Very low47.3Very low65 Ų65128.2 Ų128.267%0.6776%0.757SS**  trans-78.294.2175.800000108.9S4 L8S4-G6 VanDerWaalsContact C-N 3.29Å; S4-G6 PolarHBondContact O-N 2.92Å; G6-L8 PolarHBondContact O-N 3.17Å
7G35.6Very low49.3Very low62 Ų62127.3 Ų127.364%0.63975%0.753SS**  trans-55108.4173.700000110.4D5 E9D5-G7 PolarHBondContact O-N 3.21Å; G7-E9 PolarHBondContact O-N 3.08Å
8L42.2Very low51.3Low135 Ų135120.6 Ų120.671%0.70771%0.713SS**  trans-69.1112.6168.2-74.1170.9000107.2G6 E10G6-L8 PolarHBondContact O-N 3.17Å; L8-E10 PolarHBondContact O-N 3.08Å
9E43.7Very low53.1Low172 Ų172118.3 Ų118.380%0.80470%0.7SS**  trans-52.8121.4-175.4-63.7166.6120.800110.7G7 E11G7-E9 PolarHBondContact O-N 3.08Å; E9-E11 PolarHBondContact O-N 3.48Å
10E49.1Very low54.8Low196 Ų196112.7 Ų112.792%0.91667%0.667SS**  trans-73.275171.1-71.1-165.2108.600109.6L8L8-E10 PolarHBondContact O-N 3.08Å
11E53.2Low56.4Low153 Ų153108.9 Ų108.972%0.71564%0.641SS**  trans-55146.6163.2-86.1-84.987.300110.4E9 E13E9-E11 PolarHBondContact O-N 3.48Å; E11-E13 PolarHBondContact O-N 3.18Å
12P43.3Very low58.3Low101 Ų10197 Ų9766%0.65658%0.582SS**  trans-63.3113.3-164.824.6-34.4000112.3L14P12-L14 VanDerWaalsContact C-N 3.3Å; P12-L14 PolarHBondContact O-N 3.24Å
13E45.3Very low60.6Low130 Ų13091.6 Ų91.661%0.60754%0.544SS*.  trans-66.283.4178.5-75-114.8101.200111.9E11 S15 A70E11-E13 PolarHBondContact O-N 3.18Å; E13-S15 PolarHBondContact O-N 2.91Å; E13-S15 VanDerWaalsContact O-N 3.13Å; E13-A70 WeakPolarHBondContact OE1-CB 3.4Å; E13-A70 WeakPolarHBondContact OE2-CB 3.25Å
14L55.3Low62.8Low126 Ų12688.1 Ų88.166%0.6651%0.506SS*.  trans-58.2114.2154.5-62.9175.7000107.1P12 I16P12-L14 VanDerWaalsContact C-N 3.3Å; P12-L14 PolarHBondContact O-N 3.24Å; L14-I16 HydrophobicContact CB-CD1 3.69Å; L14-I16 HydrophobicContact CB-CG1 3.89Å; L14-I16 HydrophobicContact CD1-CD1 4.05Å; L14-I16 PolarHBondContact O-N 2.94Å
15S64.4Low64.9Low109 Ų10986.1 Ų86.176%0.76248%0.483SS*.  trans-73.552.5-178.251.50000112.7E13E13-S15 PolarHBondContact O-N 2.91Å; E13-S15 VanDerWaalsContact O-N 3.13Å
16I78.1Confident66.8Low68 Ų6880.1 Ų80.135%0.34946%0.459SS..  trans-75.4129.1179.5-63165.5000108.4L14 T69 L171L14-I16 HydrophobicContact CB-CD1 3.69Å; L14-I16 HydrophobicContact CB-CG1 3.89Å; L14-I16 HydrophobicContact CD1-CD1 4.05Å; L14-I16 PolarHBondContact O-N 2.94Å; I16-T69 PolarHBondContact O-N 3.22Å; I16-L171 HydrophobicContact CB-CD1 4.5Å; I16-L171 HydrophobicContact CD1-CD1 4.26Å; I16-L171 HydrophobicContact CG2-CD1 4.15Å; I16-L171 HydrophobicContact CG2-CD2 3.52Å; I16-L171 HydrophobicContact CG2-CG 4.46Å
17T81.9Confident68.9Low113 Ų11383.4 Ų83.469%0.69346%0.455SS*.EExtended strand (participates in β ladder)trans-84.5131.4174.250.60000110.2G67T17-G67 WeakPolarHBondContact CA-O 3.4Å
18L83.9Confident71.2Confident6 Ų681.4 Ų81.43%0.03143%0.429CS..EExtended strand (participates in β ladder)trans-126.1142.9-171.6-131.5145.6000109.1T66 G67 T69 V72 C167 L171L18-T66 VanDerWaalsContact O-CA 3.27Å; L18-T66 WeakPolarHBondContact O-CA 3.48Å; L18-G67 PolarHBondContact N-O 3.22Å; L18-G67 PolarHBondContact O-N 3.34Å; L18-T69 HydrophobicContact CD1-CG2 4.42Å; L18-V72 HydrophobicContact CB-CG2 4.27Å; L18-C167 WeakPolarHBondContact CD1-SG 3.47Å; L18-L171 HydrophobicContact CD1-CD1 3.63Å; L18-L171 HydrophobicContact CD1-CD2 3.55Å; L18-L171 HydrophobicContact CD1-CG 3.61Å; L18-L171 HydrophobicContact CG-CD2 3.79Å; L18-L171 HydrophobicContact CG-CG 4.32Å
19T86.3Confident73.3Confident78 Ų7875 Ų7548%0.47940%0.396SS..EExtended strand (participates in β ladder)trans-122.7109.4172.4-64.40000109.1T64 I65 T66T19-T64 HydrophobicContact CG2-CG2 3.59Å; T19-I65 CarbonylContact C-O 3.43Å; T19-I65 WeakPolarHBondContact CA-O 3.25Å; T19-T66 WeakPolarHBondContact CG2-OG1 3.34Å; T19-T66 WeakPolarHBondContact OG1-CG2 3.35Å; T19-T66 PolarHBondContact OG1-OG1 3.36Å
20L87.4Confident75.3Confident5 Ų568.7 Ų68.73%0.02638%0.376CS..EExtended strand (participates in β ladder)trans-99134.6176-164.968.9000109.4M22 T64 I65 V72 V76 L106 V163L20-M22 HydrophobicContact CD2-CG 4.37Å; L20-M22 HydrophobicContact CD2-SD 4.41Å; L20-M22 HydrophobicContact CG-CG 4.46Å; L20-T64 CarbonylContact O-C 3.51Å; L20-T64 WeakPolarHBondContact O-CA 3.45Å; L20-I65 PolarHBondContact N-O 3.28Å; L20-I65 PolarHBondContact O-N 3.5Å; L20-V72 HydrophobicContact CB-CG1 3.93Å; L20-V72 HydrophobicContact CD2-CG1 4.08Å; L20-V76 HydrophobicContact CD2-CG2 3.49Å; L20-V76 VanDerWaalsContact CD2-CG2 3.49Å; L20-L106 HydrophobicContact CD1-CD2 3.93Å; L20-L106 HydrophobicContact CD2-CD2 4.28Å; L20-L106 HydrophobicContact CG-CD2 4.35Å; L20-V163 HydrophobicContact CD2-CG1 3.93Å
21R87.6Confident77Confident34 Ų3461.1 Ų61.113%0.12835%0.345CS..EExtended strand (participates in β ladder)trans-114.6129.3174.5-63-178.874.2-1710.9109.3I62 T64 V107 E147 Y182R21-I62 HydrophobicContact CB-CG2 4.27Å; R21-T64 HydrophobicContact CG-CG2 4.07Å; R21-V107 HydrophobicContact CB-CB 3.95Å; R21-V107 PolarHBondContact O-N 2.86Å; R21-E147 IonicContact CZ-OE1 2.7Å; R21-E147 IonicContact CZ-OE2 3.96Å; R21-E147 IonicContact NH1-OE1 3.53Å; R21-E147 PolarHBondContact NH1-OE1 2.81Å; R21-E147 IonicContact NH1-OE2 2.67Å; R21-E147 PolarHBondContact NH1-OE2 3.19Å; R21-E147 IonicContact NH2-OE2 2.67Å; R21-Y182 PolarHBondContact NH2-O 3.25Å
22M88.3Confident78.7Confident0 Ų054.4 Ų54.40%031%0.314CS..EExtended strand (participates in β ladder)trans-122.6131.9-179.7-56.7175.97900108.9L20 M24 I62 T63 I65 V76 I79 L104 R105L20-M22 HydrophobicContact CD2-CG 4.37Å; L20-M22 HydrophobicContact CD2-SD 4.41Å; L20-M22 HydrophobicContact CG-CG 4.46Å; M22-M24 HydrophobicContact CB-CE 4.05Å; M22-M24 HydrophobicContact CE-CE 3.61Å; M22-M24 HydrophobicContact SD-CE 3.99Å; M22-I62 CarbonylContact O-C 3.5Å; M22-I62 WeakPolarHBondContact O-CA 3.16Å; M22-T63 PolarHBondContact N-O 3.15Å; M22-T63 PolarHBondContact O-N 3.49Å; M22-I65 HydrophobicContact SD-CD1 3.82Å; M22-V76 HydrophobicContact SD-CG2 4.39Å; M22-I79 HydrophobicContact CE-CG2 4.38Å; M22-L104 HydrophobicContact CE-CB 4.39Å; M22-L104 HydrophobicContact CE-CD1 3.71Å; M22-L104 HydrophobicContact CE-CD2 3.9Å; M22-L104 HydrophobicContact CE-CG 4.23Å; M22-R105 CarbonylContact C-O 3.58Å; M22-R105 WeakPolarHBondContact CA-O 3.31Å
23L86.9Confident80.8Confident7 Ų752.1 Ų52.14%0.03730%0.296CS..EExtended strand (participates in β ladder)trans-92.5128171.6-167.476.3000108.2E60 R61 I62 R105 V107L23-E60 HydrophobicContact CD1-CB 4.03Å; L23-E60 HydrophobicContact CG-CB 4.38Å; L23-R61 WeakPolarHBondContact CA-O 3.49Å; L23-I62 HydrophobicContact CD1-CD1 4.45Å; L23-I62 HydrophobicContact CD1-CG1 3.74Å; L23-R105 HydrophobicContact CB-CB 4.02Å; L23-R105 VanDerWaalsContact CD2-CZ 3.42Å; L23-R105 PolarHBondContact N-O 3.04Å; L23-R105 WeakPolarHBondContact O-CB 3.39Å; L23-V107 HydrophobicContact CB-CG2 3.66Å; L23-V107 HydrophobicContact CD1-CG2 4.39Å
24M85.4Confident82.7Confident9 Ų946.8 Ų46.84%0.04428%0.275CS..EExtended strand (participates in β ladder)trans-135.2149.1178.1-69.6170.7-178.800109.5M22 V29 R61 I79 L104M22-M24 HydrophobicContact CB-CE 4.05Å; M22-M24 HydrophobicContact CE-CE 3.61Å; M22-M24 HydrophobicContact SD-CE 3.99Å; M24-V29 HydrophobicContact CB-CB 4.27Å; M24-R61 PolarHBondContact N-O 3.23Å; M24-R61 PolarHBondContact O-N 2.96Å; M24-I79 HydrophobicContact CE-CG2 3.51Å; M24-L104 HydrophobicContact CE-CD2 4.31Å
25H84.6Confident84.3Confident79 Ų7950.3 Ų50.337%0.36629%0.285SS..EExtended strand (participates in β ladder)trans-73.6154.4172.4-156.8-87.5000110.4K27 E28 V29 P59H25-K27 HydrophobicContact CB-CG 4.19Å; H25-K27 PolarHBondContact O-N 3.15Å; H25-E28 WeakPolarHBondContact CB-OE2 3.23Å; H25-E28 PolarHBondContact O-N 2.86Å; H25-E28 VanDerWaalsContact O-N 3.1Å; H25-V29 WeakPolarHBondContact O-CG1 3.22Å; H25-V29 PolarHBondContact O-N 2.94Å; H25-V29 VanDerWaalsContact O-N 3.08Å; H25-P59 CarbonylContact C-O 3.57Å; H25-P59 WeakPolarHBondContact CA-O 3.36Å
26G82.4Confident85.3Confident34 Ų3455.7 Ų55.735%0.35130%0.295SS..Hα-helixtrans-55-20.7178.200000114.8G30 P59G26-G30 PolarHBondContact O-N 3.15Å; G26-P59 PolarHBondContact N-O 3.05Å
27K82.4Confident85.7Confident134 Ų13453.3 Ų53.358%0.58329%0.287SS*.Hα-helixtrans-76.9-50.6177.274.9-162.8-169.3-70.80111.3H25 G30 S31H25-K27 HydrophobicContact CB-CG 4.19Å; H25-K27 PolarHBondContact O-N 3.15Å; K27-G30 PolarHBondContact O-N 3.26Å; K27-S31 PolarHBondContact O-N 3.41Å
28E83.8Confident86.1Confident20 Ų2053.3 Ų53.39%0.09328%0.279CS..Hα-helixtrans-69.4-47.5-177.2-66.115288.400110.6H25 G30 S31 I32 L83H25-E28 WeakPolarHBondContact CB-OE2 3.23Å; H25-E28 PolarHBondContact O-N 2.86Å; H25-E28 VanDerWaalsContact O-N 3.1Å; E28-G30 PolarHBondContact O-N 3.14Å; E28-S31 WeakPolarHBondContact O-CB 3.2Å; E28-S31 PolarHBondContact O-N 2.65Å; E28-I32 WeakPolarHBondContact O-CG1 3.47Å; E28-I32 PolarHBondContact O-N 3.47Å; E28-L83 HydrophobicContact CB-CD1 3.76Å; E28-L83 HydrophobicContact CG-CD1 3.62Å
29V85.3Confident86.3Confident2 Ų254.7 Ų54.71%0.01229%0.288CS..Hα-helixtrans-61.7-29.9176.970.30000112.3M24 H25 S31 I32 I33 I53 R61M24-V29 HydrophobicContact CB-CB 4.27Å; H25-V29 WeakPolarHBondContact O-CG1 3.22Å; H25-V29 PolarHBondContact O-N 2.94Å; H25-V29 VanDerWaalsContact O-N 3.08Å; V29-S31 VanDerWaalsContact C-N 3.32Å; V29-S31 PolarHBondContact O-N 3.06Å; V29-I32 PolarHBondContact O-N 2.85Å; V29-I33 HydrophobicContact CG2-CD1 4.15Å; V29-I33 WeakPolarHBondContact O-CB 3.44Å; V29-I33 WeakPolarHBondContact O-CD1 3.22Å; V29-I33 WeakPolarHBondContact O-CG1 3.46Å; V29-I33 PolarHBondContact O-N 3.09Å; V29-I53 HydrophobicContact CG2-CD1 4.27Å; V29-I53 HydrophobicContact CG2-CG2 4.18Å; V29-R61 HydrophobicContact CG1-CB 4.33Å; V29-R61 HydrophobicContact CG1-CG 4.27Å
30G86.3Confident86.5Confident38 Ų3852.4 Ų52.439%0.39227%0.274SS..Hα-helixtrans-62-38.3172.300000112.7G26 K27 E28 G34G26-G30 PolarHBondContact O-N 3.15Å; K27-G30 PolarHBondContact O-N 3.26Å; E28-G30 PolarHBondContact O-N 3.14Å; G30-G34 PolarHBondContact O-N 3.49Å
31S85.5Confident86.6Confident38 Ų3857.3 Ų57.327%0.26630%0.295SS..Hα-helixtrans-72.2-41.9175.5-157.10000112.4K27 E28 V29 I33 G34 D86K27-S31 PolarHBondContact O-N 3.41Å; E28-S31 WeakPolarHBondContact O-CB 3.2Å; E28-S31 PolarHBondContact O-N 2.65Å; V29-S31 VanDerWaalsContact C-N 3.32Å; V29-S31 PolarHBondContact O-N 3.06Å; S31-I33 VanDerWaalsContact C-N 3.3Å; S31-I33 PolarHBondContact O-N 3.01Å; S31-G34 PolarHBondContact O-N 3.25Å; S31-G34 VanDerWaalsContact O-N 3.1Å; S31-D86 WeakPolarHBondContact CB-OD2 3.34Å; S31-D86 VanDerWaalsContact OG-CG 3.27Å; S31-D86 PolarHBondContact OG-OD2 2.85Å
32I87.4Confident86.7Confident11 Ų1162 Ų626%0.05631%0.313CS..Hα-helixtrans-62.3-35.5174.2-56.3-54000112E28 V29 T39 V40 I43 I79 K82E28-I32 WeakPolarHBondContact O-CG1 3.47Å; E28-I32 PolarHBondContact O-N 3.47Å; V29-I32 PolarHBondContact O-N 2.85Å; I32-T39 WeakPolarHBondContact O-CB 3.48Å; I32-T39 WeakPolarHBondContact O-CG2 3.16Å; I32-V40 PolarHBondContact O-N 2.82Å; I32-I43 HydrophobicContact CG2-CD1 4Å; I32-I79 HydrophobicContact CD1-CG2 4.29Å; I32-I79 HydrophobicContact CG2-CG1 4.22Å; I32-K82 HydrophobicContact CD1-CB 3.64Å
33I88.8Confident86.8Confident54 Ų5462.2 Ų62.228%0.27731%0.314SS..Hα-helixtrans-66.6-48170.9-68.3162.7000110.1V29 S31 G37 T39 V40 I53V29-I33 HydrophobicContact CG2-CD1 4.15Å; V29-I33 WeakPolarHBondContact O-CB 3.44Å; V29-I33 WeakPolarHBondContact O-CD1 3.22Å; V29-I33 WeakPolarHBondContact O-CG1 3.46Å; V29-I33 PolarHBondContact O-N 3.09Å; S31-I33 VanDerWaalsContact C-N 3.3Å; S31-I33 PolarHBondContact O-N 3.01Å; I33-G37 CarbonylContact O-C 3.52Å; I33-G37 VanDerWaalsContact O-C 3.31Å; I33-G37 VanDerWaalsContact O-CA 3.22Å; I33-G37 WeakPolarHBondContact O-CA 3.06Å; I33-T39 WeakPolarHBondContact O-CB 3.26Å; I33-T39 PolarHBondContact O-N 2.73Å; I33-V40 HydrophobicContact CB-CG1 4.41Å; I33-V40 HydrophobicContact CG2-CG1 4.15Å; I33-V40 PolarHBondContact O-N 2.72Å; I33-V40 VanDerWaalsContact O-N 3.17Å; I33-I53 HydrophobicContact CD1-CD1 3.99Å; I33-I53 HydrophobicContact CG1-CD1 3.74Å
34G85.8Confident86.9Confident17 Ų1768.2 Ų68.218%0.17534%0.336CS..  trans76.9169.3-178.400000113.4G30 S31 K36 G37G30-G34 PolarHBondContact O-N 3.49Å; S31-G34 PolarHBondContact O-N 3.25Å; S31-G34 VanDerWaalsContact O-N 3.1Å; G34-K36 PolarHBondContact O-N 3.25Å; G34-G37 PolarHBondContact O-N 3.45Å
35K87.4Confident87.1Confident200 Ų20074.1 Ų74.187%0.8736%0.363SS*.G310 helixtrans-57.8122.8179-65.6175.9-177.9173.10109.4G37 E38K35-G37 PolarHBondContact O-N 2.98Å; K35-E38 PolarHBondContact O-N 3.34Å
36K85.4Confident87.4Confident222 Ų22275.5 Ų75.597%0.96537%0.37SS*.G310 helixtrans59.217.1-174.7-55.9-178.8177.1179.60116G34 E38G34-K36 PolarHBondContact O-N 3.25Å; K36-E38 VanDerWaalsContact C-N 3.31Å; K36-E38 PolarHBondContact O-N 2.95Å
37G86.9Confident87.7Confident18 Ų1874 Ų7419%0.18635%0.354CS..G310 helixtrans7614179.600000115I33 G34 K35 V40 K41I33-G37 CarbonylContact O-C 3.52Å; I33-G37 VanDerWaalsContact O-C 3.31Å; I33-G37 VanDerWaalsContact O-CA 3.22Å; I33-G37 WeakPolarHBondContact O-CA 3.06Å; G34-G37 PolarHBondContact O-N 3.45Å; K35-G37 PolarHBondContact O-N 2.98Å; G37-V40 VanDerWaalsContact O-CG1 3.28Å; G37-V40 WeakPolarHBondContact O-CG1 3.49Å; G37-K41 WeakPolarHBondContact O-CB 3.26Å; G37-K41 PolarHBondContact O-N 3.34Å
38E89.4Confident87.9Confident114 Ų11472.4 Ų72.453%0.53336%0.36SS..Hα-helixtrans-64.6-39.6-179.1-165-167.7131.400112.1K35 K36 K41 R42K35-E38 PolarHBondContact O-N 3.34Å; K36-E38 VanDerWaalsContact C-N 3.31Å; K36-E38 PolarHBondContact O-N 2.95Å; E38-K41 PolarHBondContact O-N 2.93Å; E38-R42 WeakPolarHBondContact O-CB 3.28Å; E38-R42 PolarHBondContact O-N 3Å; E38-R42 IonicContact OE1-CZ 2.68Å; E38-R42 IonicContact OE1-NH2 3.55Å; E38-R42 PolarHBondContact OE1-NH2 3.47Å
39T89.3Confident88.1Confident34 Ų3471.8 Ų71.821%0.20936%0.358CS..Hα-helixtrans-65.8-48.8-178.9-55.40000110.8I32 I33 K41 R42 I43 K82I32-T39 WeakPolarHBondContact O-CB 3.48Å; I32-T39 WeakPolarHBondContact O-CG2 3.16Å; I33-T39 WeakPolarHBondContact O-CB 3.26Å; I33-T39 PolarHBondContact O-N 2.73Å; T39-K41 VanDerWaalsContact C-N 3.3Å; T39-K41 PolarHBondContact O-N 3.21Å; T39-R42 WeakPolarHBondContact O-CB 3.29Å; T39-R42 PolarHBondContact O-N 3.22Å; T39-R42 VanDerWaalsContact O-N 3.11Å; T39-I43 HydrophobicContact CG2-CD1 3.9Å; T39-I43 HydrophobicContact CG2-CG1 4.44Å; T39-I43 VanDerWaalsContact O-CG1 3.31Å; T39-I43 WeakPolarHBondContact O-CG1 3.36Å; T39-I43 PolarHBondContact O-N 2.89Å; T39-K82 HydrophobicContact CG2-CD 4.27Å; T39-K82 HydrophobicContact CG2-CG 4.35Å
40V89.6Confident88.2Confident30 Ų3080.5 Ų80.518%0.18239%0.391CS..Hα-helixtrans-64.5-33.1174.762.30000112.5I32 I33 G37 R42 I43 R44I32-V40 PolarHBondContact O-N 2.82Å; I33-V40 HydrophobicContact CB-CG1 4.41Å; I33-V40 HydrophobicContact CG2-CG1 4.15Å; I33-V40 PolarHBondContact O-N 2.72Å; I33-V40 VanDerWaalsContact O-N 3.17Å; G37-V40 VanDerWaalsContact O-CG1 3.28Å; G37-V40 WeakPolarHBondContact O-CG1 3.49Å; V40-R42 VanDerWaalsContact C-N 3.34Å; V40-I43 PolarHBondContact O-N 2.83Å; V40-R44 WeakPolarHBondContact O-CG 3.4Å; V40-R44 PolarHBondContact O-N 3.06Å
41K90.1Very high88.4Confident108 Ų10880.3 Ų80.347%0.4738%0.38SS..Hα-helixtrans-63.7-38.4172.2176.7175.2177.3-166.80111.9G37 E38 T39 R44 E45G37-K41 WeakPolarHBondContact O-CB 3.26Å; G37-K41 PolarHBondContact O-N 3.34Å; E38-K41 PolarHBondContact O-N 2.93Å; T39-K41 VanDerWaalsContact C-N 3.3Å; T39-K41 PolarHBondContact O-N 3.21Å; K41-R44 VanDerWaalsContact O-CG 3.25Å; K41-R44 WeakPolarHBondContact O-CG 3.45Å; K41-E45 WeakPolarHBondContact O-CB 3.49Å; K41-E45 PolarHBondContact O-N 3.09Å
42R90Very high88.5Confident134 Ų13481.7 Ų81.751%0.50639%0.387SS..Hα-helixtrans-70.9-45.3176.2-165.5-175.1-59.6-1651.1111.5E38 T39 V40 R44 E45 Q46E38-R42 WeakPolarHBondContact O-CB 3.28Å; E38-R42 PolarHBondContact O-N 3Å; E38-R42 IonicContact OE1-CZ 2.68Å; E38-R42 IonicContact OE1-NH2 3.55Å; E38-R42 PolarHBondContact OE1-NH2 3.47Å; T39-R42 WeakPolarHBondContact O-CB 3.29Å; T39-R42 PolarHBondContact O-N 3.22Å; T39-R42 VanDerWaalsContact O-N 3.11Å; V40-R42 VanDerWaalsContact C-N 3.34Å; R42-R44 PolarHBondContact O-N 3.27Å; R42-E45 PolarHBondContact O-N 3.12Å; R42-Q46 HydrophobicContact CG-CG 4.34Å; R42-Q46 WeakPolarHBondContact O-CG 3.4Å; R42-Q46 PolarHBondContact O-N 3.12Å
43I91Very high88.5Confident3 Ų383.6 Ų83.62%0.01540%0.397CS..Hα-helixtrans-60.9-47.7-179.8-64.5167.5000110.7I32 T39 V40 E45 Q46 S47 I51 M78 I79I32-I43 HydrophobicContact CG2-CD1 4Å; T39-I43 HydrophobicContact CG2-CD1 3.9Å; T39-I43 HydrophobicContact CG2-CG1 4.44Å; T39-I43 VanDerWaalsContact O-CG1 3.31Å; T39-I43 WeakPolarHBondContact O-CG1 3.36Å; T39-I43 PolarHBondContact O-N 2.89Å; V40-I43 PolarHBondContact O-N 2.83Å; I43-E45 PolarHBondContact O-N 2.79Å; I43-Q46 PolarHBondContact O-N 2.78Å; I43-S47 VanDerWaalsContact O-CB 3.25Å; I43-S47 WeakPolarHBondContact O-CB 3.33Å; I43-S47 PolarHBondContact O-N 3.28Å; I43-S47 PolarHBondContact O-OG 2.86Å; I43-I51 HydrophobicContact CB-CD1 4.42Å; I43-I51 HydrophobicContact CG2-CD1 3.7Å; I43-M78 HydrophobicContact CG1-CB 4.34Å; I43-M78 HydrophobicContact CG1-CE 4.42Å; I43-M78 HydrophobicContact CG2-CB 4.25Å; I43-I79 HydrophobicContact CD1-CG1 4.37Å; I43-I79 HydrophobicContact CG2-CG1 4.4Å
44R88Confident88Confident133 Ų13382.5 Ų82.550%0.50239%0.394SS..Hα-helixtrans-62.8-29.8178.573.1-174.5-171-173.28.2113.4V40 K41 R42 S48 I51V40-R44 WeakPolarHBondContact O-CG 3.4Å; V40-R44 PolarHBondContact O-N 3.06Å; K41-R44 VanDerWaalsContact O-CG 3.25Å; K41-R44 WeakPolarHBondContact O-CG 3.45Å; R42-R44 PolarHBondContact O-N 3.27Å; R44-S48 WeakPolarHBondContact O-CA 3.26Å; R44-S48 PolarHBondContact O-N 3.14Å; R44-S48 VanDerWaalsContact O-N 3.16Å; R44-I51 HydrophobicContact CB-CD1 4.14Å
45E90.7Very high87.2Confident133 Ų13389.6 Ų89.662%0.62142%0.423SS*.Hα-helixtrans-78.9-47.9-179.3-170.5165.782.600110.7K41 R42 I43 S48K41-E45 WeakPolarHBondContact O-CB 3.49Å; K41-E45 PolarHBondContact O-N 3.09Å; R42-E45 PolarHBondContact O-N 3.12Å; I43-E45 PolarHBondContact O-N 2.79Å; E45-S48 PolarHBondContact O-N 3.43Å
46Q90.2Very high85.7Confident108 Ų10880.5 Ų80.551%0.50539%0.385SS..Hα-helixtrans-68.2-37.1176.8-67.2-172.9-80.100113.3R42 I43R42-Q46 HydrophobicContact CG-CG 4.34Å; R42-Q46 WeakPolarHBondContact O-CG 3.4Å; R42-Q46 PolarHBondContact O-N 3.12Å; I43-Q46 PolarHBondContact O-N 2.78Å
47S88Confident84.4Confident3 Ų376.3 Ų76.32%0.02138%0.384CS..Hα-helixtrans-84.1-14179.163.20000113.9I43 A49 A71I43-S47 VanDerWaalsContact O-CB 3.25Å; I43-S47 WeakPolarHBondContact O-CB 3.33Å; I43-S47 PolarHBondContact O-N 3.28Å; I43-S47 PolarHBondContact O-OG 2.86Å; S47-A49 PolarHBondContact O-N 3.16Å; S47-A71 WeakPolarHBondContact O-CA 3.24Å; S47-A71 WeakPolarHBondContact O-CB 3.47Å
48S87.8Confident82.9Confident101 Ų10178 Ų7871%0.70639%0.392SS*.  trans5220-171.7-61.60000114.6R44 E45R44-S48 WeakPolarHBondContact O-CA 3.26Å; R44-S48 PolarHBondContact O-N 3.14Å; R44-S48 VanDerWaalsContact O-N 3.16Å; E45-S48 PolarHBondContact O-N 3.43Å
49A87Confident82.1Confident6 Ų676.6 Ų76.65%0.0539%0.393CS..  trans-100.2145-177.900000111.9S47 I51 I65 A71 A75S47-A49 PolarHBondContact O-N 3.16Å; A49-I51 PolarHBondContact O-N 3.1Å; A49-I65 HydrophobicContact CB-CG2 3.81Å; A49-A71 HydrophobicContact CB-CB 4.14Å; A49-A75 HydrophobicContact CB-CB 4.23Å
50R87.7Confident81.6Confident186 Ų18678.4 Ų78.470%0.70240%0.399SS*.EExtended strand (participates in β ladder)trans-80.798.9174.7-172.1-178.4-178.6-158.7-0110.1T66R50-T66 WeakPolarHBondContact CA-O 3.48Å; R50-T66 WeakPolarHBondContact CB-O 3.31Å; R50-T66 PolarHBondContact N-O 3.18Å; R50-T66 PolarHBondContact O-N 3.41Å
51I90.3Very high81.3Confident34 Ų3480.6 Ų80.617%0.17440%0.404CS..EExtended strand (participates in β ladder)trans-92.7121.4178-54.3170.7000109.4I43 R44 A49 T63 T64 I65I43-I51 HydrophobicContact CB-CD1 4.42Å; I43-I51 HydrophobicContact CG2-CD1 3.7Å; R44-I51 HydrophobicContact CB-CD1 4.14Å; A49-I51 PolarHBondContact O-N 3.1Å; I51-T63 HydrophobicContact CG2-CG2 3.75Å; I51-T64 WeakPolarHBondContact CA-O 3.45Å; I51-I65 HydrophobicContact CG1-CG1 4.42Å; I51-I65 HydrophobicContact CG1-CG2 4.3Å
52T87.3Confident81.2Confident66 Ų6675.7 Ų75.741%0.40538%0.383SS..EExtended strand (participates in β ladder)trans-121.3119.3176.5-56.90000108.8T64T52-T64 PolarHBondContact N-O 3.5Å; T52-T64 PolarHBondContact O-N 3.41Å
53I87.8Confident81.1Confident52 Ų5269.5 Ų69.527%0.26736%0.36SS..EExtended strand (participates in β ladder)trans-98.6121.8176.8-57.9169.4000107.8V29 I33 E55 T63V29-I53 HydrophobicContact CG2-CD1 4.27Å; V29-I53 HydrophobicContact CG2-CG2 4.18Å; I33-I53 HydrophobicContact CD1-CD1 3.99Å; I33-I53 HydrophobicContact CG1-CD1 3.74Å; I53-E55 PolarHBondContact O-N 3.22Å; I53-T63 HydrophobicContact CG1-CG2 4.35Å
54S77.5Confident81Confident30 Ų3070.5 Ų70.521%0.2137%0.366CS..PPolyproline II helixtrans-66.6121.7172-61.40000109.6I62S54-I62 PolarHBondContact N-O 3.15Å
55E69.8Low81.1Confident167 Ų16764.1 Ų64.178%0.7834%0.342SS*.PPolyproline II helixtrans-77.9126.1166.7-160.3-167.6135.300109.3I53I53-E55 PolarHBondContact O-N 3.22Å
56G56.9Low81Confident8 Ų860 Ų608%0.08233%0.326CS..  trans-144.4150.6171.200000109C58G56-C58 PolarHBondContact O-N 2.91Å
57S57Low81Confident135 Ų13555.5 Ų55.594%0.94431%0.309SS*.SBendtrans-71.5-4.5174.3-1620000112.6
58C55.5Low81.1Confident53 Ų5357.9 Ų57.936%0.35833%0.326SS..SBendtrans-75.4154.3-179.6-46.50000112.5G56 E60G56-C58 PolarHBondContact O-N 2.91Å; C58-E60 PolarHBondContact O-N 3.04Å
59P73.6Confident80.9Confident84 Ų8455 Ų5555%0.54530%0.304SS..SBendtrans-68.4-15.3171.829.2-35.7000113.4H25 G26H25-P59 CarbonylContact C-O 3.57Å; H25-P59 WeakPolarHBondContact CA-O 3.36Å; G26-P59 PolarHBondContact N-O 3.05Å
60E78.2Confident80.9Confident73 Ų7356.6 Ų56.634%0.34132%0.317SS..EExtended strand (participates in β ladder)trans-103.3135.5173.7-61.4179.8126.400110.4L23 C58 R105L23-E60 HydrophobicContact CD1-CB 4.03Å; L23-E60 HydrophobicContact CG-CB 4.38Å; C58-E60 PolarHBondContact O-N 3.04Å; E60-R105 IonicContact OE1-CZ 2.91Å; E60-R105 IonicContact OE1-NH1 3.5Å; E60-R105 PolarHBondContact OE1-NH1 3.28Å; E60-R105 IonicContact OE1-NH2 3.51Å
61R84.1Confident81Confident76 Ų7648.3 Ų48.329%0.28729%0.288SS..EExtended strand (participates in β ladder)trans-122.3153176.1-59.8-164-179.9-126.1-7.6110.4L23 M24 V29L23-R61 WeakPolarHBondContact CA-O 3.49Å; M24-R61 PolarHBondContact N-O 3.23Å; M24-R61 PolarHBondContact O-N 2.96Å; V29-R61 HydrophobicContact CG1-CB 4.33Å; V29-R61 HydrophobicContact CG1-CG 4.27Å
62I86.3Confident80.9Confident5 Ų546.9 Ų46.93%0.02628%0.281CS..EExtended strand (participates in β ladder)trans-109.4119.7178.1-60.1174.3000109.3R21 M22 L23 S54 Y182R21-I62 HydrophobicContact CB-CG2 4.27Å; M22-I62 CarbonylContact O-C 3.5Å; M22-I62 WeakPolarHBondContact O-CA 3.16Å; L23-I62 HydrophobicContact CD1-CD1 4.45Å; L23-I62 HydrophobicContact CD1-CG1 3.74Å; S54-I62 PolarHBondContact N-O 3.15Å; I62-Y182 HydrophobicContact CD1-CD1 3.46Å; I62-Y182 VanDerWaalsContact CD1-CD1 3.46Å; I62-Y182 HydrophobicContact CD1-CE1 3.97Å; I62-Y182 HydrophobicContact CD1-CG 4.42Å
63T88.4Confident80.8Confident3 Ų346.4 Ų46.42%0.01827%0.273CS..EExtended strand (participates in β ladder)trans-94.6113.7169.7-56.80000108M22 I51 I53 I65M22-T63 PolarHBondContact N-O 3.15Å; M22-T63 PolarHBondContact O-N 3.49Å; I51-T63 HydrophobicContact CG2-CG2 3.75Å; I53-T63 HydrophobicContact CG1-CG2 4.35Å; T63-I65 HydrophobicContact CG2-CG1 4.11Å
64T88.8Confident80.9Confident24 Ų2449.3 Ų49.315%0.14729%0.285CS..EExtended strand (participates in β ladder)trans-100.8121.2175.8-55.60000108.7T19 L20 R21 I51 T52T19-T64 HydrophobicContact CG2-CG2 3.59Å; L20-T64 CarbonylContact O-C 3.51Å; L20-T64 WeakPolarHBondContact O-CA 3.45Å; R21-T64 HydrophobicContact CG-CG2 4.07Å; I51-T64 WeakPolarHBondContact CA-O 3.45Å; T52-T64 PolarHBondContact N-O 3.5Å; T52-T64 PolarHBondContact O-N 3.41Å
65I91.3Very high81.5Confident0 Ų047.9 Ų47.90%028%0.275CS..EExtended strand (participates in β ladder)trans-114.1115-178.8-51.4175.4000107.3T19 L20 M22 A49 I51 T63 V72 A75 V76 I79T19-I65 CarbonylContact C-O 3.43Å; T19-I65 WeakPolarHBondContact CA-O 3.25Å; L20-I65 PolarHBondContact N-O 3.28Å; L20-I65 PolarHBondContact O-N 3.5Å; M22-I65 HydrophobicContact SD-CD1 3.82Å; A49-I65 HydrophobicContact CB-CG2 3.81Å; I51-I65 HydrophobicContact CG1-CG1 4.42Å; I51-I65 HydrophobicContact CG1-CG2 4.3Å; T63-I65 HydrophobicContact CG2-CG1 4.11Å; I65-V72 HydrophobicContact CG2-CG1 4.48Å; I65-V72 HydrophobicContact CG2-CG2 4.22Å; I65-A75 HydrophobicContact CD1-CB 4.23Å; I65-A75 HydrophobicContact CG2-CB 3.88Å; I65-V76 HydrophobicContact CD1-CG2 4.43Å; I65-I79 HydrophobicContact CD1-CD1 3.64Å
66T88.3Confident82.3Confident46 Ų4640 Ų4028%0.28224%0.239SC..EExtended strand (participates in β ladder)trans-116.1128176.9-58.80000110.5L18 T19 R50L18-T66 VanDerWaalsContact O-CA 3.27Å; L18-T66 WeakPolarHBondContact O-CA 3.48Å; T19-T66 WeakPolarHBondContact CG2-OG1 3.34Å; T19-T66 WeakPolarHBondContact OG1-CG2 3.35Å; T19-T66 PolarHBondContact OG1-OG1 3.36Å; R50-T66 WeakPolarHBondContact CA-O 3.48Å; R50-T66 WeakPolarHBondContact CB-O 3.31Å; R50-T66 PolarHBondContact N-O 3.18Å; R50-T66 PolarHBondContact O-N 3.41Å
67G90.1Very high83.8Confident13 Ų1340.9 Ų40.913%0.13424%0.244CC..EExtended strand (participates in β ladder)trans179-173.1178.800000112.3T17 L18T17-G67 WeakPolarHBondContact CA-O 3.4Å; L18-G67 PolarHBondContact N-O 3.22Å; L18-G67 PolarHBondContact O-N 3.34Å
68S89.9Confident85.2Confident54 Ų5437.3 Ų37.338%0.37821%0.213SC..EExtended strand (participates in β ladder)trans-61.7158.2168.8-40.70000111.3A70 A71 V72S68-A70 VanDerWaalsContact C-N 3.35Å; S68-A70 PolarHBondContact O-N 3.24Å; S68-A71 WeakPolarHBondContact O-CB 3.39Å; S68-A71 PolarHBondContact O-N 3.07Å; S68-V72 WeakPolarHBondContact O-CG2 3.43Å; S68-V72 PolarHBondContact O-N 3.15Å
69T84.1Confident86.8Confident41 Ų4134.9 Ų34.925%0.25220%0.196SC..Hα-helixtrans-50.8-49.1176.1-50.50000112.8I16 L18 A71 V72 F73I16-T69 PolarHBondContact O-N 3.22Å; L18-T69 HydrophobicContact CD1-CG2 4.42Å; T69-A71 PolarHBondContact O-N 3.03Å; T69-V72 PolarHBondContact O-N 3.27Å; T69-F73 WeakPolarHBondContact O-CB 3.46Å; T69-F73 PolarHBondContact O-N 3.41Å
70A85.3Confident87.4Confident39 Ų3930.9 Ų30.932%0.32217%0.17SC..Hα-helixtrans-56.7-46172.900000113.7E13 S68 V72 F73 H74E13-A70 WeakPolarHBondContact OE1-CB 3.4Å; E13-A70 WeakPolarHBondContact OE2-CB 3.25Å; S68-A70 VanDerWaalsContact C-N 3.35Å; S68-A70 PolarHBondContact O-N 3.24Å; A70-V72 PolarHBondContact O-N 3.4Å; A70-F73 WeakPolarHBondContact O-CB 3.41Å; A70-F73 PolarHBondContact O-N 2.97Å; A70-H74 PolarHBondContact O-N 3.36Å
71A89.7Confident87.8Confident12 Ų1232.7 Ų32.710%0.09918%0.177CC..Hα-helixtrans-62.8-44.5-178.600000111.8S47 A49 S68 T69 A75S47-A71 WeakPolarHBondContact O-CA 3.24Å; S47-A71 WeakPolarHBondContact O-CB 3.47Å; A49-A71 HydrophobicContact CB-CB 4.14Å; S68-A71 WeakPolarHBondContact O-CB 3.39Å; S68-A71 PolarHBondContact O-N 3.07Å; T69-A71 PolarHBondContact O-N 3.03Å; A71-A75 WeakPolarHBondContact O-CB 3.4Å; A71-A75 PolarHBondContact O-N 3.47Å
72V88.4Confident87.9Confident3 Ų331.9 Ų31.92%0.01818%0.176CC..Hα-helixtrans-66-40.6175.6177.60000110.8L18 L20 I65 S68 T69 A70 A75 V76L18-V72 HydrophobicContact CB-CG2 4.27Å; L20-V72 HydrophobicContact CB-CG1 3.93Å; L20-V72 HydrophobicContact CD2-CG1 4.08Å; I65-V72 HydrophobicContact CG2-CG1 4.48Å; I65-V72 HydrophobicContact CG2-CG2 4.22Å; S68-V72 WeakPolarHBondContact O-CG2 3.43Å; S68-V72 PolarHBondContact O-N 3.15Å; T69-V72 PolarHBondContact O-N 3.27Å; A70-V72 PolarHBondContact O-N 3.4Å; V72-A75 PolarHBondContact O-N 2.83Å; V72-V76 HydrophobicContact CG1-CG2 4.38Å; V72-V76 VanDerWaalsContact O-CG2 3.31Å; V72-V76 WeakPolarHBondContact O-CG2 3.39Å; V72-V76 PolarHBondContact O-N 3.34Å
73F85.8Confident87.8Confident56 Ų5631.7 Ų31.725%0.24618%0.175CC..Hα-helixtrans-61.1-47.2176.3179.5-101.2000112.3T69 A70 V76 S77 I160 R164T69-F73 WeakPolarHBondContact O-CB 3.46Å; T69-F73 PolarHBondContact O-N 3.41Å; A70-F73 WeakPolarHBondContact O-CB 3.41Å; A70-F73 PolarHBondContact O-N 2.97Å; F73-V76 PolarHBondContact O-N 3.41Å; F73-S77 PolarHBondContact O-N 3.4Å; F73-I160 HydrophobicContact CD2-CG2 4.41Å; F73-I160 HydrophobicContact CE2-CG2 3.39Å; F73-I160 HydrophobicContact CZ-CG2 3.54Å; F73-R164 HydrophobicContact CD2-CG 4.46Å; F73-R164 HydrophobicContact CE2-CB 4.33Å; F73-R164 HydrophobicContact CE2-CG 4.38Å
74H89.1Confident87.5Confident113 Ų11334.5 Ų34.552%0.52319%0.19SC..Hα-helixtrans-61.7-43173.7-101.315.2000112.6A70 V76 S77 M78A70-H74 PolarHBondContact O-N 3.36Å; H74-V76 PolarHBondContact O-N 3.04Å; H74-S77 PolarHBondContact O-N 2.84Å; H74-M78 WeakPolarHBondContact O-CB 3.49Å; H74-M78 VanDerWaalsContact O-CG 3.31Å; H74-M78 WeakPolarHBondContact O-CG 3.28Å; H74-M78 PolarHBondContact O-N 2.85Å; H74-M78 VanDerWaalsContact O-N 3.08Å
75A90.3Very high87.2Confident0 Ų038.6 Ų38.60%021%0.207CC..Hα-helixtrans-59.2-47.2176.400000111.7A49 I65 A71 V72 M78 I79A49-A75 HydrophobicContact CB-CB 4.23Å; I65-A75 HydrophobicContact CD1-CB 4.23Å; I65-A75 HydrophobicContact CG2-CB 3.88Å; A71-A75 WeakPolarHBondContact O-CB 3.4Å; A71-A75 PolarHBondContact O-N 3.47Å; V72-A75 PolarHBondContact O-N 2.83Å; A75-M78 PolarHBondContact O-N 3.49Å; A75-I79 WeakPolarHBondContact O-CB 3.49Å; A75-I79 WeakPolarHBondContact O-CD1 3.1Å; A75-I79 WeakPolarHBondContact O-CG1 3.48Å; A75-I79 PolarHBondContact O-N 3.03Å
76V87.6Confident86.7Confident3 Ų340.9 Ų40.92%0.01822%0.22CC..Hα-helixtrans-64.3-43.7179.9170.10000111.7L20 M22 I65 V72 F73 H74 I79 A80 V163L20-V76 HydrophobicContact CD2-CG2 3.49Å; L20-V76 VanDerWaalsContact CD2-CG2 3.49Å; M22-V76 HydrophobicContact SD-CG2 4.39Å; I65-V76 HydrophobicContact CD1-CG2 4.43Å; V72-V76 HydrophobicContact CG1-CG2 4.38Å; V72-V76 VanDerWaalsContact O-CG2 3.31Å; V72-V76 WeakPolarHBondContact O-CG2 3.39Å; V72-V76 PolarHBondContact O-N 3.34Å; F73-V76 PolarHBondContact O-N 3.41Å; H74-V76 PolarHBondContact O-N 3.04Å; V76-I79 PolarHBondContact O-N 2.98Å; V76-A80 WeakPolarHBondContact O-CB 3.28Å; V76-A80 PolarHBondContact O-N 3.18Å; V76-V163 HydrophobicContact CG1-CB 4.1Å; V76-V163 HydrophobicContact CG1-CG1 3.98Å; V76-V163 HydrophobicContact CG1-CG2 4.09Å; V76-V163 HydrophobicContact CG2-CG1 4.22Å
77S87.1Confident86.1Confident26 Ų2641.5 Ų41.518%0.18222%0.221CC..Hα-helixtrans-58.8-50.7177.3-179.50000111.4F73 H74 I79 A80 F81F73-S77 PolarHBondContact O-N 3.4Å; H74-S77 PolarHBondContact O-N 2.84Å; S77-I79 VanDerWaalsContact C-N 3.29Å; S77-I79 PolarHBondContact O-N 3.09Å; S77-A80 PolarHBondContact O-N 3.24Å; S77-A80 VanDerWaalsContact O-N 3.16Å; S77-F81 VanDerWaalsContact O-CD2 3.31Å; S77-F81 WeakPolarHBondContact O-CD2 3.3Å; S77-F81 PolarHBondContact O-N 3.01Å
78M87.7Confident85Confident60 Ų6046 Ų4630%0.29625%0.249SC..Hα-helixtrans-57.6-39.4176.6-72.2-68.4-64.600113I43 H74 A75 K82I43-M78 HydrophobicContact CG1-CB 4.34Å; I43-M78 HydrophobicContact CG1-CE 4.42Å; I43-M78 HydrophobicContact CG2-CB 4.25Å; H74-M78 WeakPolarHBondContact O-CB 3.49Å; H74-M78 VanDerWaalsContact O-CG 3.31Å; H74-M78 WeakPolarHBondContact O-CG 3.28Å; H74-M78 PolarHBondContact O-N 2.85Å; H74-M78 VanDerWaalsContact O-N 3.08Å; A75-M78 PolarHBondContact O-N 3.49Å; M78-K82 WeakPolarHBondContact O-CB 3.41Å; M78-K82 PolarHBondContact O-N 2.84Å; M78-K82 VanDerWaalsContact O-N 3.07Å
79I89.2Confident83.9Confident2 Ų247 Ų471%0.0126%0.26CS..Hα-helixtrans-69.8-42.5177.3-71.2165.9000111.3M22 M24 I32 I43 I65 A75 V76 S77 K82 L83M22-I79 HydrophobicContact CE-CG2 4.38Å; M24-I79 HydrophobicContact CE-CG2 3.51Å; I32-I79 HydrophobicContact CD1-CG2 4.29Å; I32-I79 HydrophobicContact CG2-CG1 4.22Å; I43-I79 HydrophobicContact CD1-CG1 4.37Å; I43-I79 HydrophobicContact CG2-CG1 4.4Å; I65-I79 HydrophobicContact CD1-CD1 3.64Å; A75-I79 WeakPolarHBondContact O-CB 3.49Å; A75-I79 WeakPolarHBondContact O-CD1 3.1Å; A75-I79 WeakPolarHBondContact O-CG1 3.48Å; A75-I79 PolarHBondContact O-N 3.03Å; V76-I79 PolarHBondContact O-N 2.98Å; S77-I79 VanDerWaalsContact C-N 3.29Å; S77-I79 PolarHBondContact O-N 3.09Å; I79-K82 PolarHBondContact O-N 2.81Å; I79-L83 WeakPolarHBondContact O-CB 3.17Å; I79-L83 PolarHBondContact O-N 3.44Å
80A85.9Confident82.7Confident0 Ų047.9 Ų47.90%027%0.272CS..Hα-helixtrans-63-45.6179.100000111.5V76 S77 L83 D84 L104V76-A80 WeakPolarHBondContact O-CB 3.28Å; V76-A80 PolarHBondContact O-N 3.18Å; S77-A80 PolarHBondContact O-N 3.24Å; S77-A80 VanDerWaalsContact O-N 3.16Å; A80-L83 PolarHBondContact O-N 3.05Å; A80-D84 PolarHBondContact O-N 3.25Å; A80-L104 HydrophobicContact CB-CD1 4.37Å
81F85.9Confident81.1Confident110 Ų11052 Ų5248%0.48230%0.296SS..Hα-helixtrans-63.4-41173.9-81.2-69.2000112.6S77 L83 D84 E85 I160S77-F81 VanDerWaalsContact O-CD2 3.31Å; S77-F81 WeakPolarHBondContact O-CD2 3.3Å; S77-F81 PolarHBondContact O-N 3.01Å; F81-L83 VanDerWaalsContact C-N 3.31Å; F81-L83 PolarHBondContact O-N 3.32Å; F81-D84 PolarHBondContact O-N 3.45Å; F81-E85 WeakPolarHBondContact O-CB 3.38Å; F81-E85 PolarHBondContact O-N 3.43Å; F81-I160 HydrophobicContact CE2-CD1 3.94Å
82K86.3Confident79.3Confident59 Ų5956.1 Ų56.126%0.25733%0.329SS..Hα-helixtrans-67.3-31.1176.6-87.4-71171-144.60113.5I32 T39 M78 I79 E85 D86I32-K82 HydrophobicContact CD1-CB 3.64Å; T39-K82 HydrophobicContact CG2-CD 4.27Å; T39-K82 HydrophobicContact CG2-CG 4.35Å; M78-K82 WeakPolarHBondContact O-CB 3.41Å; M78-K82 PolarHBondContact O-N 2.84Å; M78-K82 VanDerWaalsContact O-N 3.07Å; I79-K82 PolarHBondContact O-N 2.81Å; K82-E85 IonicContact NZ-OE1 2.67Å; K82-E85 PolarHBondContact NZ-OE1 2.67Å; K82-E85 IonicContact NZ-OE2 3.82Å; K82-E85 PolarHBondContact NZ-OE2 3Å; K82-D86 WeakPolarHBondContact O-CB 3.42Å; K82-D86 PolarHBondContact O-N 2.96Å
83L83.8Confident77.5Confident2 Ų264 Ų641%0.0137%0.371CS..Hα-helixtrans-73-38.5175.2-172.361.7000112.1E28 I79 A80 F81 D86 L87 V102 L104E28-L83 HydrophobicContact CB-CD1 3.76Å; E28-L83 HydrophobicContact CG-CD1 3.62Å; I79-L83 WeakPolarHBondContact O-CB 3.17Å; I79-L83 PolarHBondContact O-N 3.44Å; A80-L83 PolarHBondContact O-N 3.05Å; F81-L83 VanDerWaalsContact C-N 3.31Å; F81-L83 PolarHBondContact O-N 3.32Å; L83-D86 PolarHBondContact O-N 3.01Å; L83-L87 HydrophobicContact CG-CD1 4.2Å; L83-L87 WeakPolarHBondContact O-CB 3.37Å; L83-L87 VanDerWaalsContact O-CG 3.28Å; L83-L87 WeakPolarHBondContact O-CG 3.24Å; L83-L87 PolarHBondContact O-N 2.98Å; L83-V102 HydrophobicContact CB-CG1 4.2Å; L83-V102 HydrophobicContact CD2-CG1 3.7Å; L83-V102 HydrophobicContact CG-CG1 3.93Å; L83-L104 HydrophobicContact CD2-CD2 3.4Å; L83-L104 HydrophobicContact CD2-CG 4.45Å
84D83.3Confident75.9Confident61 Ų6165.1 Ų65.133%0.32640%0.399SS..Hα-helixtrans-60.5-45.6171-167.8-102.3000111.3A80 F81 D86 L87 C88 V102A80-D84 PolarHBondContact O-N 3.25Å; F81-D84 PolarHBondContact O-N 3.45Å; D84-D86 PolarHBondContact O-N 2.89Å; D84-L87 PolarHBondContact O-N 3.36Å; D84-C88 VanDerWaalsContact O-CB 3.3Å; D84-C88 WeakPolarHBondContact O-CB 3.19Å; D84-C88 PolarHBondContact O-N 3.38Å; D84-V102 HydrophobicContact CB-CG2 3.69Å; D84-V102 WeakPolarHBondContact OD2-CG2 3.35Å
85E82.9Confident73.6Confident111 Ų11162.8 Ų62.852%0.51941%0.405SS..Hα-helixtrans-61.2-41.7177-164.9-171.412300112.1F81 K82 C88 A89F81-E85 WeakPolarHBondContact O-CB 3.38Å; F81-E85 PolarHBondContact O-N 3.43Å; K82-E85 IonicContact NZ-OE1 2.67Å; K82-E85 PolarHBondContact NZ-OE1 2.67Å; K82-E85 IonicContact NZ-OE2 3.82Å; K82-E85 PolarHBondContact NZ-OE2 3Å; E85-C88 PolarHBondContact O-N 3.4Å; E85-A89 WeakPolarHBondContact O-CB 3.08Å; E85-A89 PolarHBondContact O-N 2.97Å
86D80.4Confident71.8Confident48 Ų4871.3 Ų71.326%0.25745%0.451SS..Hα-helixtrans-66.8-44.5176.7-168.2-115.4000112.4S31 K82 L83 D84 C88 A89 A90S31-D86 WeakPolarHBondContact CB-OD2 3.34Å; S31-D86 VanDerWaalsContact OG-CG 3.27Å; S31-D86 PolarHBondContact OG-OD2 2.85Å; K82-D86 WeakPolarHBondContact O-CB 3.42Å; K82-D86 PolarHBondContact O-N 2.96Å; L83-D86 PolarHBondContact O-N 3.01Å; D84-D86 PolarHBondContact O-N 2.89Å; D86-C88 VanDerWaalsContact C-N 3.28Å; D86-C88 PolarHBondContact O-N 3.42Å; D86-A89 PolarHBondContact O-N 3.29Å; D86-A90 PolarHBondContact O-N 3.24Å
87L74.4Confident69.8Low59 Ų5977.3 Ų77.331%0.30949%0.487SS..Hα-helixtrans-63.7-33.1175.4-73.6167.3000112.3L83 D84 V102L83-L87 HydrophobicContact CG-CD1 4.2Å; L83-L87 WeakPolarHBondContact O-CB 3.37Å; L83-L87 VanDerWaalsContact O-CG 3.28Å; L83-L87 WeakPolarHBondContact O-CG 3.24Å; L83-L87 PolarHBondContact O-N 2.98Å; D84-L87 PolarHBondContact O-N 3.36Å; L87-V102 HydrophobicContact CD1-CB 4.39Å; L87-V102 HydrophobicContact CD1-CG1 4.4Å; L87-V102 HydrophobicContact CD1-CG2 4.19Å
88C67.9Low68.2Low107 Ų10781.4 Ų81.472%0.72352%0.516SS*.Hα-helixtrans-81.4-26.6175.7-167.60000113.2D84 E85 D86D84-C88 VanDerWaalsContact O-CB 3.3Å; D84-C88 WeakPolarHBondContact O-CB 3.19Å; D84-C88 PolarHBondContact O-N 3.38Å; E85-C88 PolarHBondContact O-N 3.4Å; D86-C88 VanDerWaalsContact C-N 3.28Å; D86-C88 PolarHBondContact O-N 3.42Å
89A65.9Low66.9Low75 Ų7589.5 Ų89.562%0.6254%0.543SS*.Hα-helixtrans-83-21.6177.300000113.2E85 D86 P91E85-A89 WeakPolarHBondContact O-CB 3.08Å; E85-A89 PolarHBondContact O-N 2.97Å; D86-A89 PolarHBondContact O-N 3.29Å; A89-P91 WeakPolarHBondContact O-CD 3.49Å
90A60.3Low65.6Low59 Ų5993.6 Ų93.649%0.48857%0.57SS.*SBendtrans-69.2117.2172.700000110.8D86 A92D86-A90 PolarHBondContact O-N 3.24Å; A90-A92 PolarHBondContact O-N 3.02Å; A90-A92 VanDerWaalsContact O-N 3.1Å
91P52.3Low64.8Low127 Ų12797.1 Ų97.183%0.82559%0.592SS**  trans-74.9107.8-174.529.1-34000111.5A89 N93A89-P91 WeakPolarHBondContact O-CD 3.49Å; P91-N93 PolarHBondContact O-N 3.06Å
92A50Low64.6Low97 Ų9791.9 Ų91.980%0.80257%0.57SS**  trans-68.5110.1160.300000109.3A90 G94A90-A92 PolarHBondContact O-N 3.02Å; A90-A92 VanDerWaalsContact O-N 3.1Å; A92-G94 PolarHBondContact O-N 2.74Å; A92-G94 VanDerWaalsContact O-N 3.09Å
93N51.6Low64.5Low169 Ų16991.8 Ų91.890%0.90457%0.574SS**  trans-59.9110.6165.6-99.4-31.4000109.5P91P91-N93 PolarHBondContact O-N 3.06Å
94G51.5Low64.6Low80 Ų8091.8 Ų91.883%0.82557%0.574SS**SBendtrans63.194.7156.800000117.6A92A92-G94 PolarHBondContact O-N 2.74Å; A92-G94 VanDerWaalsContact O-N 3.09Å
95G42.2Very low64.9Low64 Ų6493 Ų9366%0.6657%0.574SS**  trans152.7134.4155.800000114.6V97G95-V97 PolarHBondContact O-N 2.85Å
96N52.2Low65.2Low178 Ų17887.7 Ų87.795%0.95255%0.549SS*.  trans-62.895.7167.1-83.330.5000109.9
97V45.4Very low65.5Low130 Ų13085.9 Ų85.979%0.78854%0.54SS*.  trans-127.7136.6167.2-171.80000107.8G95G95-V97 PolarHBondContact O-N 2.85Å
98S54.2Low66Low111 Ų11183.2 Ų83.278%0.77653%0.526SS*.  trans-52.8143.2-177.5-165.60000111.4P100S98-P100 VanDerWaalsContact O-N 3.15Å
99R58.7Low66.7Low230 Ų23079.3 Ų79.387%0.86850%0.499SS*.  trans-43.4119.6-177.2-69.8178.9175.8129.3-2.9110.3
100P62.4Low67.2Low89 Ų8977.7 Ų77.758%0.57849%0.486SS*.PPolyproline II helixtrans-61.8127.1177.524.9-32.4000108.4S98S98-P100 VanDerWaalsContact O-N 3.15Å
101P69Low68.1Low73 Ų7378 Ų7847%0.47448%0.484SS..PPolyproline II helixtrans-66.6141.7-178.427-33.9000110.2T103P101-T103 PolarHBondContact O-N 3.09Å
102V81.1Confident69.5Low1 Ų172.1 Ų72.11%0.00645%0.446CS..EExtended strand (participates in β ladder)trans-61.6133.1174.9-178.60000108.6L83 D84 L87 S153 G154 I159L83-V102 HydrophobicContact CB-CG1 4.2Å; L83-V102 HydrophobicContact CD2-CG1 3.7Å; L83-V102 HydrophobicContact CG-CG1 3.93Å; D84-V102 HydrophobicContact CB-CG2 3.69Å; D84-V102 WeakPolarHBondContact OD2-CG2 3.35Å; L87-V102 HydrophobicContact CD1-CB 4.39Å; L87-V102 HydrophobicContact CD1-CG1 4.4Å; L87-V102 HydrophobicContact CD1-CG2 4.19Å; V102-S153 VanDerWaalsContact O-CA 3.26Å; V102-S153 WeakPolarHBondContact O-CA 3.4Å; V102-G154 PolarHBondContact N-O 3.26Å; V102-G154 VanDerWaalsContact N-O 3.16Å; V102-G154 PolarHBondContact O-N 2.87Å; V102-G154 VanDerWaalsContact O-N 3.14Å; V102-I159 HydrophobicContact CB-CD1 3.7Å; V102-I159 HydrophobicContact CG1-CD1 3.95Å; V102-I159 WeakPolarHBondContact O-CD1 3.27Å
103T84.1Confident70.9Confident57 Ų5767.6 Ų67.635%0.3541%0.408SS..EExtended strand (participates in β ladder)trans-115.5113.7179.858.30000110.8P101 V152P101-T103 PolarHBondContact O-N 3.09Å; T103-V152 CarbonylContact C-O 3.21Å; T103-V152 WeakPolarHBondContact CA-O 3.45Å
104L87.4Confident72.5Confident2 Ų261.8 Ų61.81%0.0139%0.388CS..EExtended strand (participates in β ladder)trans-103.5129.2169-66.2-175000110M22 M24 A80 L83 V152 I159M22-L104 HydrophobicContact CE-CB 4.39Å; M22-L104 HydrophobicContact CE-CD1 3.71Å; M22-L104 HydrophobicContact CE-CD2 3.9Å; M22-L104 HydrophobicContact CE-CG 4.23Å; M24-L104 HydrophobicContact CE-CD2 4.31Å; A80-L104 HydrophobicContact CB-CD1 4.37Å; L83-L104 HydrophobicContact CD2-CD2 3.4Å; L83-L104 HydrophobicContact CD2-CG 4.45Å; L104-V152 PolarHBondContact N-O 3.48Å; L104-V152 PolarHBondContact O-N 2.84Å; L104-I159 HydrophobicContact CB-CG2 4.43Å; L104-I159 HydrophobicContact CD1-CG2 3.41Å; L104-I159 VanDerWaalsContact CD1-CG2 3.41Å; L104-I159 HydrophobicContact CG-CG2 4.01Å
105R88.6Confident74.1Confident86 Ų8660.3 Ų60.333%0.32537%0.366SS..EExtended strand (participates in β ladder)trans-101.8118.3170.6-67.9174.670.9-156.3-3.7108.9M22 L23 E60 V150 T151M22-R105 CarbonylContact C-O 3.58Å; M22-R105 WeakPolarHBondContact CA-O 3.31Å; L23-R105 HydrophobicContact CB-CB 4.02Å; L23-R105 VanDerWaalsContact CD2-CZ 3.42Å; L23-R105 PolarHBondContact N-O 3.04Å; L23-R105 WeakPolarHBondContact O-CB 3.39Å; E60-R105 IonicContact OE1-CZ 2.91Å; E60-R105 IonicContact OE1-NH1 3.5Å; E60-R105 PolarHBondContact OE1-NH1 3.28Å; E60-R105 IonicContact OE1-NH2 3.51Å; R105-V150 CarbonylContact C-O 3.57Å; R105-V150 WeakPolarHBondContact CA-O 3.18Å; R105-T151 HydrophobicContact CG-CG2 3.92Å
106L89.1Confident76.2Confident0 Ų057.7 Ų57.70%034%0.336CS..EExtended strand (participates in β ladder)trans-95.3141.3173.5-6398.6000109.4L20 I108 A149 V150 V152 V163L20-L106 HydrophobicContact CD1-CD2 3.93Å; L20-L106 HydrophobicContact CD2-CD2 4.28Å; L20-L106 HydrophobicContact CG-CD2 4.35Å; L106-I108 HydrophobicContact CB-CD1 4.32Å; L106-I108 HydrophobicContact CB-CG1 4.3Å; L106-A149 CarbonylContact O-C 3.31Å; L106-A149 WeakPolarHBondContact O-CA 3.47Å; L106-V150 PolarHBondContact N-O 3.07Å; L106-V150 PolarHBondContact O-N 2.96Å; L106-V152 HydrophobicContact CD1-CB 4.43Å; L106-V152 HydrophobicContact CD1-CG2 3.65Å; L106-V163 HydrophobicContact CD1-CG2 4.41Å; L106-V163 HydrophobicContact CD2-CG1 4.36Å; L106-V163 HydrophobicContact CD2-CG2 4.13Å
107V87.4Confident77.9Confident9 Ų952 Ų526%0.05531%0.305CS..EExtended strand (participates in β ladder)trans-102.5119.6174.3-176.30000107.5R21 L23 E147R21-V107 HydrophobicContact CB-CB 3.95Å; R21-V107 PolarHBondContact O-N 2.86Å; L23-V107 HydrophobicContact CB-CG2 3.66Å; L23-V107 HydrophobicContact CD1-CG2 4.39Å; V107-E147 HydrophobicContact CG1-CB 3.63Å; V107-E147 HydrophobicContact CG1-CG 4.25Å; V107-E147 WeakPolarHBondContact CG1-OE1 3.31Å
108I85.1Confident79.8Confident4 Ų447 Ų472%0.02128%0.28CS..EExtended strand (participates in β ladder)trans-132.2128.9-174.6-57-178.1000108.6L106 Q112 L116 R148 V150 I166 I170L106-I108 HydrophobicContact CB-CD1 4.32Å; L106-I108 HydrophobicContact CB-CG1 4.3Å; I108-Q112 HydrophobicContact CG2-CB 3.47Å; I108-Q112 VanDerWaalsContact CG2-CB 3.47Å; I108-L116 HydrophobicContact CD1-CD1 3.67Å; I108-L116 HydrophobicContact CG2-CD1 3.72Å; I108-R148 PolarHBondContact N-O 3.25Å; I108-R148 VanDerWaalsContact N-O 3.09Å; I108-R148 PolarHBondContact O-N 2.9Å; I108-V150 HydrophobicContact CD1-CB 4.48Å; I108-V150 HydrophobicContact CD1-CG2 4.02Å; I108-I166 HydrophobicContact CD1-CG2 3.86Å; I108-I170 HydrophobicContact CD1-CD1 4.34Å
109P82.3Confident81.4Confident25 Ų2551 Ų5116%0.16228%0.283CS..EExtended strand (participates in β ladder)trans-61.1144.2176.923.5-32000111.3S111 Q112 C113 E147P109-S111 PolarHBondContact O-N 2.86Å; P109-S111 VanDerWaalsContact O-N 3.1Å; P109-Q112 HydrophobicContact CG-CB 4.12Å; P109-Q112 HydrophobicContact CG-CG 3.81Å; P109-Q112 WeakPolarHBondContact O-CA 3.38Å; P109-Q112 WeakPolarHBondContact O-CB 3.41Å; P109-Q112 PolarHBondContact O-N 2.96Å; P109-C113 PolarHBondContact O-N 3.39Å; P109-E147 HydrophobicContact CB-CG 4.33Å
110A77.1Confident82.7Confident41 Ų4145.3 Ų45.334%0.33929%0.286SS..Hα-helixtrans-57.4-32-173.700000113.5Q112 C113 G114 L141 T146A110-Q112 VanDerWaalsContact C-N 3.31Å; A110-Q112 PolarHBondContact O-N 2.89Å; A110-C113 PolarHBondContact O-N 3.1Å; A110-G114 PolarHBondContact O-N 3.3Å; A110-G114 VanDerWaalsContact O-N 3.15Å; A110-L141 HydrophobicContact CB-CD2 4.21Å; A110-T146 VanDerWaalsContact CB-O 3.25Å; A110-T146 WeakPolarHBondContact CB-O 3.49Å; A110-T146 PolarHBondContact N-O 3.24Å
111S79.3Confident83.9Confident64 Ų6441.9 Ų41.945%0.44827%0.266SS..Hα-helixtrans-55.4-43.1172.3-177.50000112.3P109P109-S111 PolarHBondContact O-N 2.86Å; P109-S111 VanDerWaalsContact O-N 3.1Å
112Q81.5Confident84.9Confident4 Ų442.6 Ų42.62%0.01927%0.27CS..Hα-helixtrans-75.4-38.5176.2-73.1-68.3-500112.6I108 P109 A110 G114 S115 L116 S173 P175I108-Q112 HydrophobicContact CG2-CB 3.47Å; I108-Q112 VanDerWaalsContact CG2-CB 3.47Å; P109-Q112 HydrophobicContact CG-CB 4.12Å; P109-Q112 HydrophobicContact CG-CG 3.81Å; P109-Q112 WeakPolarHBondContact O-CA 3.38Å; P109-Q112 WeakPolarHBondContact O-CB 3.41Å; P109-Q112 PolarHBondContact O-N 2.96Å; A110-Q112 VanDerWaalsContact C-N 3.31Å; A110-Q112 PolarHBondContact O-N 2.89Å; Q112-G114 PolarHBondContact O-N 3.49Å; Q112-S115 PolarHBondContact O-N 3.43Å; Q112-S115 VanDerWaalsContact O-N 3.15Å; Q112-L116 PolarHBondContact O-N 3.48Å; Q112-L116 VanDerWaalsContact O-N 3.07Å; Q112-S173 VanDerWaalsContact CD-O 3.24Å; Q112-S173 PolarHBondContact NE2-O 2.93Å; Q112-S173 PolarHBondContact OE1-O 2.83Å; Q112-S173 VanDerWaalsContact OE1-O 3.06Å; Q112-P175 HydrophobicContact CG-CB 4.4Å; Q112-P175 VanDerWaalsContact NE2-CD 3.32Å; Q112-P175 VanDerWaalsContact NE2-N 3.13Å
113C79.7Confident85.3Confident3 Ų345.3 Ų45.32%0.0228%0.281CS..Hα-helixtrans-59.2-35.6-179.9-166.90000112.2P109 A110 S115 L116 I117P109-C113 PolarHBondContact O-N 3.39Å; A110-C113 PolarHBondContact O-N 3.1Å; C113-S115 PolarHBondContact O-N 2.84Å; C113-L116 PolarHBondContact O-N 3Å; C113-I117 WeakPolarHBondContact O-CD1 3.42Å; C113-I117 VanDerWaalsContact O-CG1 3.26Å; C113-I117 WeakPolarHBondContact O-CG1 3.42Å; C113-I117 PolarHBondContact O-N 3.08Å
114G84Confident85.6Confident47 Ų4744 Ų4449%0.48527%0.272SS..Hα-helixtrans-58.7-45.2174.200000113.8A110 Q112 G118A110-G114 PolarHBondContact O-N 3.3Å; A110-G114 VanDerWaalsContact O-N 3.15Å; Q112-G114 PolarHBondContact O-N 3.49Å; G114-G118 PolarHBondContact O-N 2.89Å
115S84.3Confident85.7Confident49 Ų4949 Ų4934%0.34329%0.293SS..Hα-helixtrans-66.8-41.2175.8-61.90000112.6Q112 C113 I117 G118 S173Q112-S115 PolarHBondContact O-N 3.43Å; Q112-S115 VanDerWaalsContact O-N 3.15Å; C113-S115 PolarHBondContact O-N 2.84Å; S115-I117 VanDerWaalsContact C-N 3.33Å; S115-I117 PolarHBondContact O-N 2.77Å; S115-G118 PolarHBondContact O-N 3.16Å; S115-S173 WeakPolarHBondContact CB-OG 3.5Å; S115-S173 PolarHBondContact OG-OG 3.34Å; S115-S173 VanDerWaalsContact OG-OG 3.05Å
116L87.1Confident85.8Confident9 Ų949.6 Ų49.65%0.04730%0.3CS..Hα-helixtrans-63.1-36178-77158.3000113I108 Q112 C113 I124 I166 V169 I170I108-L116 HydrophobicContact CD1-CD1 3.67Å; I108-L116 HydrophobicContact CG2-CD1 3.72Å; Q112-L116 PolarHBondContact O-N 3.48Å; Q112-L116 VanDerWaalsContact O-N 3.07Å; C113-L116 PolarHBondContact O-N 3Å; L116-I124 PolarHBondContact O-N 2.81Å; L116-I166 HydrophobicContact CD1-CG2 4.43Å; L116-I166 HydrophobicContact CD2-CB 4.19Å; L116-I166 HydrophobicContact CD2-CG1 4.21Å; L116-I166 HydrophobicContact CD2-CG2 3.96Å; L116-V169 HydrophobicContact CD2-CB 3.67Å; L116-V169 HydrophobicContact CD2-CG1 3.72Å; L116-V169 HydrophobicContact CD2-CG2 4.44Å; L116-V169 HydrophobicContact CG-CB 4.39Å; L116-V169 HydrophobicContact CG-CG1 3.92Å; L116-I170 HydrophobicContact CD1-CD1 4.48Å; L116-I170 HydrophobicContact CD1-CG1 4.13Å
117I89.1Confident85.9Confident58 Ų5849.7 Ų49.730%0.29730%0.301SS..Hα-helixtrans-72.1-46.8173.2-65.8164.9000109.9C113 S115 G121 K123 I124C113-I117 WeakPolarHBondContact O-CD1 3.42Å; C113-I117 VanDerWaalsContact O-CG1 3.26Å; C113-I117 WeakPolarHBondContact O-CG1 3.42Å; C113-I117 PolarHBondContact O-N 3.08Å; S115-I117 VanDerWaalsContact C-N 3.33Å; S115-I117 PolarHBondContact O-N 2.77Å; I117-G121 CarbonylContact O-C 3.52Å; I117-G121 WeakPolarHBondContact O-CA 2.99Å; I117-K123 PolarHBondContact O-N 2.92Å; I117-I124 HydrophobicContact CB-CG2 4.34Å; I117-I124 HydrophobicContact CG1-CG2 4.49Å; I117-I124 HydrophobicContact CG2-CG2 4.1Å; I117-I124 PolarHBondContact O-N 3.01Å
118G85Confident86Confident25 Ų2555 Ų5526%0.25832%0.32SS..  trans73.7174.5-175.700000113.2G114 S115 A120 G121G114-G118 PolarHBondContact O-N 2.89Å; S115-G118 PolarHBondContact O-N 3.16Å; G118-A120 PolarHBondContact O-N 3.29Å; G118-G121 PolarHBondContact O-N 3.43Å; G118-G121 VanDerWaalsContact O-N 3.08Å
119K87.8Confident86.3Confident194 Ų19461.9 Ų61.984%0.84335%0.352SS*.G310 helixtrans-57.1124.7179.1-63.9177.3-176.7174.80109.6G121 T122K119-G121 PolarHBondContact O-N 2.85Å; K119-G121 VanDerWaalsContact O-N 3.08Å; K119-T122 PolarHBondContact O-N 3.35Å; K119-T122 VanDerWaalsContact O-N 3.17Å; K119-T122 PolarHBondContact O-OG1 3.07Å; K119-T122 VanDerWaalsContact O-OG1 3.14Å
120A85.2Confident86.7Confident111 Ų11165.5 Ų65.592%0.91737%0.373SS*.G310 helixtrans53.820.2-176.600000116G118G118-A120 PolarHBondContact O-N 3.29Å
121G87.1Confident87.2Confident17 Ų1764 Ų6418%0.17536%0.36CS..G310 helixtrans79.612.6-178.600000115.1I117 G118 K119 K123 I124 K125I117-G121 CarbonylContact O-C 3.52Å; I117-G121 WeakPolarHBondContact O-CA 2.99Å; G118-G121 PolarHBondContact O-N 3.43Å; G118-G121 VanDerWaalsContact O-N 3.08Å; K119-G121 PolarHBondContact O-N 2.85Å; K119-G121 VanDerWaalsContact O-N 3.08Å; G121-K123 PolarHBondContact O-N 3.3Å; G121-I124 VanDerWaalsContact O-CG2 3.23Å; G121-I124 WeakPolarHBondContact O-CG2 3.49Å; G121-K125 VanDerWaalsContact O-CB 3.25Å; G121-K125 WeakPolarHBondContact O-CB 3.37Å; G121-K125 PolarHBondContact O-N 3.26Å
122T90.1Very high87.6Confident89 Ų8964 Ų6455%0.54637%0.37SS..Hα-helixtrans-61.2-44.3-177.9-57.90000112.8K119 K125 E126K119-T122 PolarHBondContact O-N 3.35Å; K119-T122 VanDerWaalsContact O-N 3.17Å; K119-T122 PolarHBondContact O-OG1 3.07Å; K119-T122 VanDerWaalsContact O-OG1 3.14Å; T122-K125 PolarHBondContact O-N 2.89Å; T122-E126 WeakPolarHBondContact O-CB 3.36Å; T122-E126 PolarHBondContact O-N 3.32Å
123K90Very high87.9Confident58 Ų5863.9 Ų63.925%0.25237%0.37SS..Hα-helixtrans-68.3-41.7-176.3-162.1104179.1-161.80111I117 G121 K125 E126 I127 E172I117-K123 PolarHBondContact O-N 2.92Å; G121-K123 PolarHBondContact O-N 3.3Å; K123-K125 PolarHBondContact O-N 3.1Å; K123-E126 WeakPolarHBondContact O-CB 3.41Å; K123-E126 PolarHBondContact O-N 3.44Å; K123-I127 HydrophobicContact CG-CD1 4.35Å; K123-I127 WeakPolarHBondContact O-CD1 3.44Å; K123-I127 VanDerWaalsContact O-CG1 3.22Å; K123-I127 WeakPolarHBondContact O-CG1 3.49Å; K123-I127 PolarHBondContact O-N 2.75Å; K123-E172 IonicContact NZ-OE1 2.66Å; K123-E172 PolarHBondContact NZ-OE1 2.91Å
124I90.7Very high88.2Confident28 Ų2870.5 Ų70.514%0.14440%0.4CS..Hα-helixtrans-69.3-31.4173.8-172.360.7000112.9L116 I117 G121 R128 V135L116-I124 PolarHBondContact O-N 2.81Å; I117-I124 HydrophobicContact CB-CG2 4.34Å; I117-I124 HydrophobicContact CG1-CG2 4.49Å; I117-I124 HydrophobicContact CG2-CG2 4.1Å; I117-I124 PolarHBondContact O-N 3.01Å; G121-I124 VanDerWaalsContact O-CG2 3.23Å; G121-I124 WeakPolarHBondContact O-CG2 3.49Å; I124-R128 WeakPolarHBondContact O-CG 3.12Å; I124-R128 PolarHBondContact O-N 3.08Å; I124-V135 HydrophobicContact CD1-CB 4.15Å; I124-V135 HydrophobicContact CD1-CG1 3.76Å
125K90.4Very high88.5Confident107 Ų10769.1 Ų69.147%0.46538%0.382SS..Hα-helixtrans-66.4-38.4173.2175.4175.2177.6-164.10111.8G121 T122 K123 R128 E129G121-K125 VanDerWaalsContact O-CB 3.25Å; G121-K125 WeakPolarHBondContact O-CB 3.37Å; G121-K125 PolarHBondContact O-N 3.26Å; T122-K125 PolarHBondContact O-N 2.89Å; K123-K125 PolarHBondContact O-N 3.1Å; K125-R128 WeakPolarHBondContact O-CG 3.36Å; K125-E129 WeakPolarHBondContact O-CB 3.31Å; K125-E129 PolarHBondContact O-N 2.97Å
126E90.1Very high88.6Confident99 Ų9973.8 Ų73.846%0.46340%0.399SS..Hα-helixtrans-66.5-50.3174-170.8-175137.300110.6T122 K123 R128 E129 T130T122-E126 WeakPolarHBondContact O-CB 3.36Å; T122-E126 PolarHBondContact O-N 3.32Å; K123-E126 WeakPolarHBondContact O-CB 3.41Å; K123-E126 PolarHBondContact O-N 3.44Å; E126-R128 PolarHBondContact O-N 3.07Å; E126-E129 WeakPolarHBondContact O-CA 3.44Å; E126-E129 WeakPolarHBondContact O-CB 3.43Å; E126-E129 PolarHBondContact O-N 2.67Å; E126-T130 PolarHBondContact O-N 2.79Å; E126-T130 PolarHBondContact O-OG1 3.13Å
127I91.4Very high88.6Confident3 Ų375.3 Ų75.32%0.01541%0.409CS..Hα-helixtrans-53.8-47.6180-68162.4000112K123 E129 T131 Q165K123-I127 HydrophobicContact CG-CD1 4.35Å; K123-I127 WeakPolarHBondContact O-CD1 3.44Å; K123-I127 VanDerWaalsContact O-CG1 3.22Å; K123-I127 WeakPolarHBondContact O-CG1 3.49Å; K123-I127 PolarHBondContact O-N 2.75Å; I127-E129 VanDerWaalsContact C-N 3.29Å; I127-E129 PolarHBondContact O-N 3.01Å; I127-T131 HydrophobicContact CG2-CG2 4.34Å; I127-T131 VanDerWaalsContact O-CB 3.26Å; I127-T131 WeakPolarHBondContact O-CB 3.49Å; I127-T131 WeakPolarHBondContact O-CG2 3.49Å; I127-T131 PolarHBondContact O-N 3.43Å; I127-T131 PolarHBondContact O-OG1 3.33Å; I127-Q165 HydrophobicContact CG1-CB 4.43Å; I127-Q165 HydrophobicContact CG1-CG 3.8Å; I127-Q165 HydrophobicContact CG2-CB 4.47Å
128R89.4Confident88.3Confident120 Ų12074.2 Ų74.245%0.45341%0.408SS..Hα-helixtrans-68.7-25.3178.269.7-176.7-171.4-168.55.5113.7I124 K125 E126 G132 V135I124-R128 WeakPolarHBondContact O-CG 3.12Å; I124-R128 PolarHBondContact O-N 3.08Å; K125-R128 WeakPolarHBondContact O-CG 3.36Å; E126-R128 PolarHBondContact O-N 3.07Å; R128-G132 WeakPolarHBondContact O-CA 3.37Å; R128-G132 PolarHBondContact O-N 2.6Å; R128-G132 VanDerWaalsContact O-N 3.14Å; R128-V135 HydrophobicContact CB-CG2 4.36Å
129E90.5Very high87.4Confident149 Ų14975.7 Ų75.770%0.69642%0.424SS*.Hα-helixtrans-81.5-45.6-179.5-170.3163.189.500110.6K125 E126 I127 T131K125-E129 WeakPolarHBondContact O-CB 3.31Å; K125-E129 PolarHBondContact O-N 2.97Å; E126-E129 WeakPolarHBondContact O-CA 3.44Å; E126-E129 WeakPolarHBondContact O-CB 3.43Å; E126-E129 PolarHBondContact O-N 2.67Å; I127-E129 VanDerWaalsContact C-N 3.29Å; I127-E129 PolarHBondContact O-N 3.01Å; E129-T131 PolarHBondContact O-N 3.06Å
130T91.1Very high86.6Confident100 Ų10072.8 Ų72.861%0.61342%0.417SS*.Hα-helixtrans-63.9-37.4173.9-53.90000112.7E126E126-T130 PolarHBondContact O-N 2.79Å; E126-T130 PolarHBondContact O-OG1 3.13Å
131T88.6Confident85.6Confident11 Ų1171.4 Ų71.47%0.06739%0.394CS..Hα-helixtrans-92.6-20.2-173.863.20000113.4I127 E129 A133 A158 L161 C162I127-T131 HydrophobicContact CG2-CG2 4.34Å; I127-T131 VanDerWaalsContact O-CB 3.26Å; I127-T131 WeakPolarHBondContact O-CB 3.49Å; I127-T131 WeakPolarHBondContact O-CG2 3.49Å; I127-T131 PolarHBondContact O-N 3.43Å; I127-T131 PolarHBondContact O-OG1 3.33Å; E129-T131 PolarHBondContact O-N 3.06Å; T131-A133 PolarHBondContact O-N 3.16Å; T131-A133 VanDerWaalsContact O-N 3.15Å; T131-A133 PolarHBondContact OG1-N 3.1Å; T131-A158 WeakPolarHBondContact O-CB 3.09Å; T131-L161 HydrophobicContact CG2-CB 4.22Å; T131-C162 VanDerWaalsContact CG2-CA 3.43Å; T131-C162 HydrophobicContact CG2-CB 3.77Å
132G86.8Confident84.3Confident63 Ų6371.7 Ų71.765%0.64939%0.391SS*.  trans66.44-171.500000114.8R128R128-G132 WeakPolarHBondContact O-CA 3.37Å; R128-G132 PolarHBondContact O-N 2.6Å; R128-G132 VanDerWaalsContact O-N 3.14Å
133A87.9Confident82.3Confident2 Ų271.9 Ų71.92%0.01739%0.394CS..  trans-84.5145.2178.800000111.7T131 V135 V152 A158 C162T131-A133 PolarHBondContact O-N 3.16Å; T131-A133 VanDerWaalsContact O-N 3.15Å; T131-A133 PolarHBondContact OG1-N 3.1Å; A133-V135 PolarHBondContact O-N 3.02Å; A133-V152 HydrophobicContact CB-CG1 3.9Å; A133-A158 HydrophobicContact CB-CB 4.21Å; A133-C162 HydrophobicContact CB-CB 4.28Å
134Q86.7Confident80.3Confident141 Ų14172.2 Ų72.266%0.65940%0.399SS*.EExtended strand (participates in β ladder)trans-80.2102.1171.1-74.7-64.8-30.100109.5S153Q134-S153 WeakPolarHBondContact CB-OG 2.99Å; Q134-S153 PolarHBondContact N-O 3.04Å; Q134-S153 PolarHBondContact O-N 2.73Å; Q134-S153 PolarHBondContact O-OG 3.47Å
135V90Very high78.7Confident18 Ų1871.6 Ų71.611%0.10940%0.397CS..EExtended strand (participates in β ladder)trans-100.5120177.9-168.20000110.4I124 R128 A133 V150 V152 C162I124-V135 HydrophobicContact CD1-CB 4.15Å; I124-V135 HydrophobicContact CD1-CG1 3.76Å; R128-V135 HydrophobicContact CB-CG2 4.36Å; A133-V135 PolarHBondContact O-N 3.02Å; V135-V150 HydrophobicContact CG1-CG1 3.5Å; V135-V152 HydrophobicContact CG1-CG2 4.14Å; V135-V152 HydrophobicContact CG2-CG1 4.34Å; V135-V152 HydrophobicContact CG2-CG2 4.34Å; V135-C162 VanDerWaalsContact CG2-SG 3.58Å
136Q86.9Confident77.5Confident147 Ų14769.4 Ų69.469%0.68739%0.393SS*.EExtended strand (participates in β ladder)trans-121.7110.5178.7-173.415861.500110.7T151Q136-T151 PolarHBondContact N-O 2.78Å; Q136-T151 PolarHBondContact O-N 2.94Å
137V87.1Confident77Confident42 Ų4264.9 Ų64.926%0.25537%0.371SS..EExtended strand (participates in β ladder)trans-80.9128.1173.3-176.50000108.6G139 R148 V150V137-G139 PolarHBondContact O-N 2.96Å; V137-R148 HydrophobicContact CG1-CG 4.11Å; V137-V150 HydrophobicContact CG1-CG2 4.37Å; V137-V150 HydrophobicContact CG2-CG1 4.27Å; V137-V150 HydrophobicContact CG2-CG2 4.2Å
138A81.3Confident76.7Confident34 Ų3467.5 Ų67.528%0.28138%0.381SS..  trans-61.4134.4173.500000110.5D140 R148 A149A138-D140 VanDerWaalsContact C-N 3.3Å; A138-R148 WeakPolarHBondContact O-CD 3.31Å; A138-R148 WeakPolarHBondContact O-CG 3.32Å; A138-R148 PolarHBondContact O-NH1 2.94Å; A138-A149 HydrophobicContact CB-CB 4.35Å; A138-A149 VanDerWaalsContact CB-O 3.29Å; A138-A149 WeakPolarHBondContact CB-O 3.18Å; A138-A149 PolarHBondContact N-O 3.32Å
139G65.7Low76.5Confident57 Ų5761.9 Ų61.959%0.58836%0.36SS*.SBendtrans-70-29.5177.900000113V137 R148V137-G139 PolarHBondContact O-N 2.96Å; G139-R148 PolarHBondContact O-NH1 3.32Å; G139-R148 PolarHBondContact O-NH2 3.49Å
140D71.4Confident76.4Confident132 Ų13255.1 Ų55.171%0.70633%0.329SS*.SBendtrans-98.5149-178.3-51.7-82.7000111.3A138A138-D140 VanDerWaalsContact C-N 3.3Å
141L63.7Low76.3Confident82 Ų8252 Ų5243%0.42931%0.31SS..PPolyproline II helixtrans-74.8149.6165.4-60.9174.1000108.3A110 R148A110-L141 HydrophobicContact CB-CD2 4.21Å; L141-R148 HydrophobicContact CD2-CB 4.35Å
142L59.9Low76.4Confident24 Ų2451.5 Ų51.513%0.12631%0.307CS..PPolyproline II helixtrans-61.3135.7170.2-74.790.5000108.3N144 S145 E147 A149L142-N144 PolarHBondContact O-N 2.92Å; L142-S145 PolarHBondContact O-N 3.49Å; L142-E147 WeakPolarHBondContact CD1-O 3.44Å; L142-E147 PolarHBondContact N-O 3.44Å; L142-A149 HydrophobicContact CD1-CB 4.15Å
143P48.5Very low76.5Confident93 Ų9350 Ų5060%0.60429%0.286SS*.THydrogen-bonded Turntrans-55.6134.6177.224.3-33.5000108.9S145P143-S145 VanDerWaalsContact C-N 3.32Å; P143-S145 PolarHBondContact O-N 2.68Å
144N49.5Very low76.5Confident65 Ų6550.7 Ų50.735%0.34829%0.294SS..THydrogen-bonded Turntrans67.26.4-170.782.252.9000118.3L142 Y182L142-N144 PolarHBondContact O-N 2.92Å; N144-Y182 WeakPolarHBondContact OD1-CD2 3.41Å; N144-Y182 WeakPolarHBondContact OD1-CE2 3.35Å
145S56.4Low76.5Confident14 Ų1448.6 Ų48.610%0.09829%0.29CS..  trans-120.2147.6177.5-161.20000114.4L142 P143 E147L142-S145 PolarHBondContact O-N 3.49Å; P143-S145 VanDerWaalsContact C-N 3.32Å; P143-S145 PolarHBondContact O-N 2.68Å; S145-E147 VanDerWaalsContact OG-CB 3.24Å; S145-E147 WeakPolarHBondContact OG-CB 3.18Å; S145-E147 WeakPolarHBondContact OG-CG 3.5Å; S145-E147 PolarHBondContact OG-N 2.85Å; S145-E147 PolarHBondContact OG-OE2 2.66Å
146T64.6Low76.1Confident62 Ų6248.7 Ų48.738%0.3829%0.291SS..SBendtrans-84.110160.454.20000112.8A110A110-T146 VanDerWaalsContact CB-O 3.25Å; A110-T146 WeakPolarHBondContact CB-O 3.49Å; A110-T146 PolarHBondContact N-O 3.24Å
147E80.2Confident76.2Confident3 Ų346.5 Ų46.51%0.01428%0.284CS..EExtended strand (participates in β ladder)trans-99.5148.3180-53.7179.192.900111.7R21 V107 P109 L142 S145 Y182R21-E147 IonicContact CZ-OE1 2.7Å; R21-E147 IonicContact CZ-OE2 3.96Å; R21-E147 IonicContact NH1-OE1 3.53Å; R21-E147 PolarHBondContact NH1-OE1 2.81Å; R21-E147 IonicContact NH1-OE2 2.67Å; R21-E147 PolarHBondContact NH1-OE2 3.19Å; R21-E147 IonicContact NH2-OE2 2.67Å; V107-E147 HydrophobicContact CG1-CB 3.63Å; V107-E147 HydrophobicContact CG1-CG 4.25Å; V107-E147 WeakPolarHBondContact CG1-OE1 3.31Å; P109-E147 HydrophobicContact CB-CG 4.33Å; L142-E147 WeakPolarHBondContact CD1-O 3.44Å; L142-E147 PolarHBondContact N-O 3.44Å; S145-E147 VanDerWaalsContact OG-CB 3.24Å; S145-E147 WeakPolarHBondContact OG-CB 3.18Å; S145-E147 WeakPolarHBondContact OG-CG 3.5Å; S145-E147 PolarHBondContact OG-N 2.85Å; S145-E147 PolarHBondContact OG-OE2 2.66Å; E147-Y182 WeakPolarHBondContact OE2-CB 3.43Å; E147-Y182 PolarHBondContact OE2-N 3.17Å
148R84.4Confident76.3Confident59 Ų5945.1 Ų45.122%0.22328%0.277CS..EExtended strand (participates in β ladder)trans-124131.3-174.5-168.6169.8-83.8-108.3-4.4108.3I108 V137 A138 G139 L141I108-R148 PolarHBondContact N-O 3.25Å; I108-R148 VanDerWaalsContact N-O 3.09Å; I108-R148 PolarHBondContact O-N 2.9Å; V137-R148 HydrophobicContact CG1-CG 4.11Å; A138-R148 WeakPolarHBondContact O-CD 3.31Å; A138-R148 WeakPolarHBondContact O-CG 3.32Å; A138-R148 PolarHBondContact O-NH1 2.94Å; G139-R148 PolarHBondContact O-NH1 3.32Å; G139-R148 PolarHBondContact O-NH2 3.49Å; L141-R148 HydrophobicContact CD2-CB 4.35Å
149A85.4Confident76.6Confident2 Ų243.5 Ų43.52%0.01726%0.264CS..EExtended strand (participates in β ladder)trans-79.7131.4177.800000110.4L106 A138 L142L106-A149 CarbonylContact O-C 3.31Å; L106-A149 WeakPolarHBondContact O-CA 3.47Å; A138-A149 HydrophobicContact CB-CB 4.35Å; A138-A149 VanDerWaalsContact CB-O 3.29Å; A138-A149 WeakPolarHBondContact CB-O 3.18Å; A138-A149 PolarHBondContact N-O 3.32Å; L142-A149 HydrophobicContact CD1-CB 4.15Å
150V89.1Confident77.6Confident6 Ų641.5 Ų41.54%0.03624%0.239CC..EExtended strand (participates in β ladder)trans-112.9111.9170.7-177.50000107.8R105 L106 I108 V135 V137 V152R105-V150 CarbonylContact C-O 3.57Å; R105-V150 WeakPolarHBondContact CA-O 3.18Å; L106-V150 PolarHBondContact N-O 3.07Å; L106-V150 PolarHBondContact O-N 2.96Å; I108-V150 HydrophobicContact CD1-CB 4.48Å; I108-V150 HydrophobicContact CD1-CG2 4.02Å; V135-V150 HydrophobicContact CG1-CG1 3.5Å; V137-V150 HydrophobicContact CG1-CG2 4.37Å; V137-V150 HydrophobicContact CG2-CG1 4.27Å; V137-V150 HydrophobicContact CG2-CG2 4.2Å; V150-V152 HydrophobicContact CG1-CG2 4.43Å
151T88.6Confident78.4Confident36 Ų3638.9 Ų38.922%0.22123%0.225CC..EExtended strand (participates in β ladder)trans-87.7122175.1-50.60000108.7R105 Q136R105-T151 HydrophobicContact CG-CG2 3.92Å; Q136-T151 PolarHBondContact N-O 2.78Å; Q136-T151 PolarHBondContact O-N 2.94Å
152V90.9Very high79.6Confident0 Ų035 Ų350%021%0.205CC..EExtended strand (participates in β ladder)trans-109.4124.3171.7-176.50000107.2T103 L104 L106 A133 V135 V150 I159 C162 I166T103-V152 CarbonylContact C-O 3.21Å; T103-V152 WeakPolarHBondContact CA-O 3.45Å; L104-V152 PolarHBondContact N-O 3.48Å; L104-V152 PolarHBondContact O-N 2.84Å; L106-V152 HydrophobicContact CD1-CB 4.43Å; L106-V152 HydrophobicContact CD1-CG2 3.65Å; A133-V152 HydrophobicContact CB-CG1 3.9Å; V135-V152 HydrophobicContact CG1-CG2 4.14Å; V135-V152 HydrophobicContact CG2-CG1 4.34Å; V135-V152 HydrophobicContact CG2-CG2 4.34Å; V150-V152 HydrophobicContact CG1-CG2 4.43Å; V152-I159 HydrophobicContact CG1-CG1 4.14Å; V152-I159 HydrophobicContact CG1-CG2 4.33Å; V152-C162 HydrophobicContact CG1-CB 4.12Å; V152-I166 HydrophobicContact CG2-CD1 4.26Å
153S88.1Confident80.9Confident30 Ų3034.2 Ų34.221%0.2120%0.201CC..EExtended strand (participates in β ladder)trans-124.5140174.4650000112.3V102 Q134V102-S153 VanDerWaalsContact O-CA 3.26Å; V102-S153 WeakPolarHBondContact O-CA 3.4Å; Q134-S153 WeakPolarHBondContact CB-OG 2.99Å; Q134-S153 PolarHBondContact N-O 3.04Å; Q134-S153 PolarHBondContact O-N 2.73Å; Q134-S153 PolarHBondContact O-OG 3.47Å
154G88.1Confident82.7Confident17 Ų1735.1 Ų35.118%0.17519%0.192CC..EExtended strand (participates in β ladder)trans166.4-158.9179.800000114.5V102V102-G154 PolarHBondContact N-O 3.26Å; V102-G154 VanDerWaalsContact N-O 3.16Å; V102-G154 PolarHBondContact O-N 2.87Å; V102-G154 VanDerWaalsContact O-N 3.14Å
155V86.9Confident84.5Confident98 Ų9835.6 Ų35.659%0.59419%0.192SC*.  trans-71.9142.1168.8-177.40000108.4D157 A158 I159V155-D157 HydrophobicContact CG1-CB 4.28Å; V155-D157 PolarHBondContact O-N 3.27Å; V155-D157 VanDerWaalsContact O-N 3.12Å; V155-A158 HydrophobicContact CB-CB 4.32Å; V155-A158 WeakPolarHBondContact O-CB 3.4Å; V155-A158 PolarHBondContact O-N 2.8Å; V155-A158 VanDerWaalsContact O-N 3.09Å; V155-I159 WeakPolarHBondContact O-CG1 3.37Å; V155-I159 PolarHBondContact O-N 3.24Å
156P82.5Confident86Confident19 Ų1935 Ų3512%0.12319%0.188CC..Hα-helixtrans-50.7-38.6179.316.2-31.4000113.7I159 I160P156-I159 WeakPolarHBondContact O-CB 3.33Å; P156-I159 PolarHBondContact O-N 2.91Å; P156-I160 WeakPolarHBondContact O-CD1 3.41Å; P156-I160 VanDerWaalsContact O-CG1 3.28Å; P156-I160 WeakPolarHBondContact O-CG1 3.47Å; P156-I160 PolarHBondContact O-N 3.41Å
157D86.9Confident86.9Confident102 Ų10232.6 Ų32.655%0.54517%0.174SC..Hα-helixtrans-61.6-49.9177-159.7-98.3000113.1V155 I159 I160 L161V155-D157 HydrophobicContact CG1-CB 4.28Å; V155-D157 PolarHBondContact O-N 3.27Å; V155-D157 VanDerWaalsContact O-N 3.12Å; D157-I159 PolarHBondContact O-N 3.38Å; D157-I160 WeakPolarHBondContact O-CB 3.37Å; D157-I160 PolarHBondContact O-N 2.82Å; D157-I160 VanDerWaalsContact O-N 3.12Å; D157-L161 PolarHBondContact O-N 3.04Å
158A89.4Confident86.9Confident13 Ų1334.7 Ų34.711%0.10719%0.191CC..Hα-helixtrans-58.6-36.3174.400000112.4T131 A133 V155 C162T131-A158 WeakPolarHBondContact O-CB 3.09Å; A133-A158 HydrophobicContact CB-CB 4.21Å; V155-A158 HydrophobicContact CB-CB 4.32Å; V155-A158 WeakPolarHBondContact O-CB 3.4Å; V155-A158 PolarHBondContact O-N 2.8Å; V155-A158 VanDerWaalsContact O-N 3.09Å; A158-C162 VanDerWaalsContact O-CB 3.28Å; A158-C162 WeakPolarHBondContact O-CB 3.37Å; A158-C162 PolarHBondContact O-N 3.47Å
159I88.3Confident86.9Confident0 Ų032 Ų320%018%0.182CC..Hα-helixtrans-69.2-42.2177-62168.2000110.8V102 L104 V152 V155 P156 D157 C162 V163V102-I159 HydrophobicContact CB-CD1 3.7Å; V102-I159 HydrophobicContact CG1-CD1 3.95Å; V102-I159 WeakPolarHBondContact O-CD1 3.27Å; L104-I159 HydrophobicContact CB-CG2 4.43Å; L104-I159 HydrophobicContact CD1-CG2 3.41Å; L104-I159 VanDerWaalsContact CD1-CG2 3.41Å; L104-I159 HydrophobicContact CG-CG2 4.01Å; V152-I159 HydrophobicContact CG1-CG1 4.14Å; V152-I159 HydrophobicContact CG1-CG2 4.33Å; V155-I159 WeakPolarHBondContact O-CG1 3.37Å; V155-I159 PolarHBondContact O-N 3.24Å; P156-I159 WeakPolarHBondContact O-CB 3.33Å; P156-I159 PolarHBondContact O-N 2.91Å; D157-I159 PolarHBondContact O-N 3.38Å; I159-C162 PolarHBondContact O-N 2.98Å; I159-V163 HydrophobicContact CG2-CG2 4.41Å; I159-V163 WeakPolarHBondContact O-CG2 3.39Å; I159-V163 PolarHBondContact O-N 3.24Å
160I86Confident86.6Confident14 Ų1433.3 Ų33.37%0.07219%0.188CC..Hα-helixtrans-60.2-46.3176.7-70.1161.2000110.5F73 F81 P156 D157 V163 R164F73-I160 HydrophobicContact CD2-CG2 4.41Å; F73-I160 HydrophobicContact CE2-CG2 3.39Å; F73-I160 HydrophobicContact CZ-CG2 3.54Å; F81-I160 HydrophobicContact CE2-CD1 3.94Å; P156-I160 WeakPolarHBondContact O-CD1 3.41Å; P156-I160 VanDerWaalsContact O-CG1 3.28Å; P156-I160 WeakPolarHBondContact O-CG1 3.47Å; P156-I160 PolarHBondContact O-N 3.41Å; D157-I160 WeakPolarHBondContact O-CB 3.37Å; D157-I160 PolarHBondContact O-N 2.82Å; D157-I160 VanDerWaalsContact O-N 3.12Å; I160-V163 PolarHBondContact O-N 3.25Å; I160-R164 PolarHBondContact O-N 2.7Å
161L88.6Confident86Confident77 Ų7735.7 Ų35.740%0.40320%0.2SC..Hα-helixtrans-61.3-43.6173.8-65.4175.6000111.8T131 D157 V163 R164 Q165T131-L161 HydrophobicContact CG2-CB 4.22Å; D157-L161 PolarHBondContact O-N 3.04Å; L161-V163 PolarHBondContact O-N 3.1Å; L161-R164 WeakPolarHBondContact O-CB 3.42Å; L161-R164 PolarHBondContact O-N 3.46Å; L161-Q165 PolarHBondContact O-N 3.23Å
162C89.2Confident85.5Confident0 Ų040.6 Ų40.60%022%0.221CC..Hα-helixtrans-63.6-42.2178.7-173.10000112.7T131 A133 V135 V152 A158 I159 R164 Q165 I166T131-C162 VanDerWaalsContact CG2-CA 3.43Å; T131-C162 HydrophobicContact CG2-CB 3.77Å; A133-C162 HydrophobicContact CB-CB 4.28Å; V135-C162 VanDerWaalsContact CG2-SG 3.58Å; V152-C162 HydrophobicContact CG1-CB 4.12Å; A158-C162 VanDerWaalsContact O-CB 3.28Å; A158-C162 WeakPolarHBondContact O-CB 3.37Å; A158-C162 PolarHBondContact O-N 3.47Å; I159-C162 PolarHBondContact O-N 2.98Å; C162-R164 VanDerWaalsContact C-N 3.34Å; C162-Q165 PolarHBondContact O-N 3.31Å; C162-I166 WeakPolarHBondContact O-CB 3.47Å; C162-I166 WeakPolarHBondContact O-CD1 3.44Å; C162-I166 VanDerWaalsContact O-CG1 3.24Å; C162-I166 WeakPolarHBondContact O-CG1 3.18Å; C162-I166 PolarHBondContact O-N 2.8Å
163V87.4Confident84.1Confident8 Ų841.9 Ų41.95%0.04823%0.23CC..Hα-helixtrans-66.7-38.5175.8178.60000110.5L20 V76 L106 I159 I160 L161 Q165 I166 C167L20-V163 HydrophobicContact CD2-CG1 3.93Å; V76-V163 HydrophobicContact CG1-CB 4.1Å; V76-V163 HydrophobicContact CG1-CG1 3.98Å; V76-V163 HydrophobicContact CG1-CG2 4.09Å; V76-V163 HydrophobicContact CG2-CG1 4.22Å; L106-V163 HydrophobicContact CD1-CG2 4.41Å; L106-V163 HydrophobicContact CD2-CG1 4.36Å; L106-V163 HydrophobicContact CD2-CG2 4.13Å; I159-V163 HydrophobicContact CG2-CG2 4.41Å; I159-V163 WeakPolarHBondContact O-CG2 3.39Å; I159-V163 PolarHBondContact O-N 3.24Å; I160-V163 PolarHBondContact O-N 3.25Å; L161-V163 PolarHBondContact O-N 3.1Å; V163-Q165 VanDerWaalsContact C-N 3.33Å; V163-Q165 PolarHBondContact O-N 2.93Å; V163-I166 PolarHBondContact O-N 2.67Å; V163-C167 WeakPolarHBondContact O-CB 3.48Å; V163-C167 PolarHBondContact O-N 2.79Å
164R85.8Confident82.7Confident113 Ų11344.4 Ų44.443%0.42625%0.245SC..Hα-helixtrans-56.4-45.5173.9-162.2-178.8-160.6136.31.6111.8F73 I160 L161 C162 C167 A168F73-R164 HydrophobicContact CD2-CG 4.46Å; F73-R164 HydrophobicContact CE2-CB 4.33Å; F73-R164 HydrophobicContact CE2-CG 4.38Å; I160-R164 PolarHBondContact O-N 2.7Å; L161-R164 WeakPolarHBondContact O-CB 3.42Å; L161-R164 PolarHBondContact O-N 3.46Å; C162-R164 VanDerWaalsContact C-N 3.34Å; R164-C167 WeakPolarHBondContact O-CB 3.37Å; R164-C167 PolarHBondContact O-N 2.91Å; R164-A168 PolarHBondContact O-N 2.98Å
165Q87.7Confident81.1Confident74 Ų7447 Ų4735%0.34626%0.259SS..Hα-helixtrans-71-39.9179.8-157.261.743.500112.9I127 L161 C162 V163 C167 A168 V169I127-Q165 HydrophobicContact CG1-CB 4.43Å; I127-Q165 HydrophobicContact CG1-CG 3.8Å; I127-Q165 HydrophobicContact CG2-CB 4.47Å; L161-Q165 PolarHBondContact O-N 3.23Å; C162-Q165 PolarHBondContact O-N 3.31Å; V163-Q165 VanDerWaalsContact C-N 3.33Å; V163-Q165 PolarHBondContact O-N 2.93Å; Q165-C167 VanDerWaalsContact C-N 3.3Å; Q165-C167 PolarHBondContact O-N 2.99Å; Q165-A168 PolarHBondContact O-N 3.01Å; Q165-V169 WeakPolarHBondContact O-CG2 3.29Å; Q165-V169 PolarHBondContact O-N 3.16Å
166I88.4Confident78.9Confident3 Ų351.2 Ų51.22%0.01527%0.269CS..Hα-helixtrans-60.1-43.8172.9-70.9165.2000110.4I108 L116 V152 C162 V163 V169 I170I108-I166 HydrophobicContact CD1-CG2 3.86Å; L116-I166 HydrophobicContact CD1-CG2 4.43Å; L116-I166 HydrophobicContact CD2-CB 4.19Å; L116-I166 HydrophobicContact CD2-CG1 4.21Å; L116-I166 HydrophobicContact CD2-CG2 3.96Å; V152-I166 HydrophobicContact CG2-CD1 4.26Å; C162-I166 WeakPolarHBondContact O-CB 3.47Å; C162-I166 WeakPolarHBondContact O-CD1 3.44Å; C162-I166 VanDerWaalsContact O-CG1 3.24Å; C162-I166 WeakPolarHBondContact O-CG1 3.18Å; C162-I166 PolarHBondContact O-N 2.8Å; V163-I166 PolarHBondContact O-N 2.67Å; I166-V169 PolarHBondContact O-N 3.47Å; I166-I170 HydrophobicContact CG2-CD1 3.72Å; I166-I170 HydrophobicContact CG2-CG1 4.48Å; I166-I170 VanDerWaalsContact O-CG1 3.31Å; I166-I170 WeakPolarHBondContact O-CG1 3.13Å; I166-I170 PolarHBondContact O-N 2.78Å
167C81.9Confident77.1Confident11 Ų1153.2 Ų53.27%0.07429%0.293CS..Hα-helixtrans-58.8-48.3178.5-164.20000111.3L18 V163 R164 Q165 V169 I170 L171L18-C167 WeakPolarHBondContact CD1-SG 3.47Å; V163-C167 WeakPolarHBondContact O-CB 3.48Å; V163-C167 PolarHBondContact O-N 2.79Å; R164-C167 WeakPolarHBondContact O-CB 3.37Å; R164-C167 PolarHBondContact O-N 2.91Å; Q165-C167 VanDerWaalsContact C-N 3.3Å; Q165-C167 PolarHBondContact O-N 2.99Å; C167-V169 PolarHBondContact O-N 2.83Å; C167-I170 PolarHBondContact O-N 3.2Å; C167-L171 PolarHBondContact O-N 2.61Å; C167-L171 VanDerWaalsContact O-N 3.09Å
168A81.9Confident74.9Confident46 Ų4653.2 Ų53.238%0.3831%0.307SS..Hα-helixtrans-58.9-41.917600000112.9R164 Q165 L171 E172R164-A168 PolarHBondContact O-N 2.98Å; Q165-A168 PolarHBondContact O-N 3.01Å; A168-L171 PolarHBondContact O-N 3.3Å; A168-E172 WeakPolarHBondContact O-CB 3.44Å; A168-E172 PolarHBondContact O-N 3.49Å
169V83.1Confident72.8Confident3 Ų355.9 Ų55.92%0.01832%0.323CS..Hα-helixtrans-70.7-33.8179.4177.20000112.7L116 Q165 I166 C167 L171 E172 S173L116-V169 HydrophobicContact CD2-CB 3.67Å; L116-V169 HydrophobicContact CD2-CG1 3.72Å; L116-V169 HydrophobicContact CD2-CG2 4.44Å; L116-V169 HydrophobicContact CG-CB 4.39Å; L116-V169 HydrophobicContact CG-CG1 3.92Å; Q165-V169 WeakPolarHBondContact O-CG2 3.29Å; Q165-V169 PolarHBondContact O-N 3.16Å; I166-V169 PolarHBondContact O-N 3.47Å; C167-V169 PolarHBondContact O-N 2.83Å; V169-L171 VanDerWaalsContact C-N 3.29Å; V169-L171 PolarHBondContact O-N 3.17Å; V169-E172 PolarHBondContact O-N 3.14Å; V169-S173 PolarHBondContact O-N 3.09Å; V169-S173 VanDerWaalsContact O-N 3.15Å; V169-S173 PolarHBondContact O-OG 3.05Å
170I80.5Confident70.8Confident29 Ų2961 Ų6115%0.14935%0.349CS..Hα-helixtrans-64.9-35.6173-68.2166.2000110.9I108 L116 I166 C167 S173I108-I170 HydrophobicContact CD1-CD1 4.34Å; L116-I170 HydrophobicContact CD1-CD1 4.48Å; L116-I170 HydrophobicContact CD1-CG1 4.13Å; I166-I170 HydrophobicContact CG2-CD1 3.72Å; I166-I170 HydrophobicContact CG2-CG1 4.48Å; I166-I170 VanDerWaalsContact O-CG1 3.31Å; I166-I170 WeakPolarHBondContact O-CG1 3.13Å; I166-I170 PolarHBondContact O-N 2.78Å; C167-I170 PolarHBondContact O-N 3.2Å; I170-S173 CarbonylContact O-C 3.21Å
171L76Confident69Low57 Ų5763.4 Ų63.430%0.29837%0.365SS..Hα-helixtrans-74-39.9173.2-68.6-172.8000113.7I16 L18 C167 A168 V169 S173 P174I16-L171 HydrophobicContact CB-CD1 4.5Å; I16-L171 HydrophobicContact CD1-CD1 4.26Å; I16-L171 HydrophobicContact CG2-CD1 4.15Å; I16-L171 HydrophobicContact CG2-CD2 3.52Å; I16-L171 HydrophobicContact CG2-CG 4.46Å; L18-L171 HydrophobicContact CD1-CD1 3.63Å; L18-L171 HydrophobicContact CD1-CD2 3.55Å; L18-L171 HydrophobicContact CD1-CG 3.61Å; L18-L171 HydrophobicContact CG-CD2 3.79Å; L18-L171 HydrophobicContact CG-CG 4.32Å; C167-L171 PolarHBondContact O-N 2.61Å; C167-L171 VanDerWaalsContact O-N 3.09Å; A168-L171 PolarHBondContact O-N 3.3Å; V169-L171 VanDerWaalsContact C-N 3.29Å; V169-L171 PolarHBondContact O-N 3.17Å; L171-S173 PolarHBondContact O-N 2.89Å; L171-P174 WeakPolarHBondContact O-CD 3.25Å
172E77.4Confident66.7Low139 Ų13961.9 Ų61.965%0.6535%0.354SS*.Hα-helixtrans-62-28.3178.2-178.7171.790.700111.6K123 A168 V169K123-E172 IonicContact NZ-OE1 2.66Å; K123-E172 PolarHBondContact NZ-OE1 2.91Å; A168-E172 WeakPolarHBondContact O-CB 3.44Å; A168-E172 PolarHBondContact O-N 3.49Å; V169-E172 PolarHBondContact O-N 3.14Å
173S61.2Low64.3Low27 Ų2766.7 Ų66.719%0.18938%0.377CS..SBendtrans-136.174.1178.453.80000112.3Q112 S115 V169 I170 L171Q112-S173 VanDerWaalsContact CD-O 3.24Å; Q112-S173 PolarHBondContact NE2-O 2.93Å; Q112-S173 PolarHBondContact OE1-O 2.83Å; Q112-S173 VanDerWaalsContact OE1-O 3.06Å; S115-S173 WeakPolarHBondContact CB-OG 3.5Å; S115-S173 PolarHBondContact OG-OG 3.34Å; S115-S173 VanDerWaalsContact OG-OG 3.05Å; V169-S173 PolarHBondContact O-N 3.09Å; V169-S173 VanDerWaalsContact O-N 3.15Å; V169-S173 PolarHBondContact O-OG 3.05Å; I170-S173 CarbonylContact O-C 3.21Å; L171-S173 PolarHBondContact O-N 2.89Å
174P60.2Low61.8Low82 Ų8268.3 Ų68.353%0.53239%0.387SS..  trans-58152179.626.7-35.1000111.3L171 K176L171-P174 WeakPolarHBondContact O-CD 3.25Å; P174-K176 PolarHBondContact O-N 3.48Å
175P54.4Low59.4Low71 Ų7167.5 Ų67.546%0.46140%0.399SS..  trans-65.1112.5-161.525.3-32.3000111.4Q112 G177Q112-P175 HydrophobicContact CG-CB 4.4Å; Q112-P175 VanDerWaalsContact NE2-CD 3.32Å; Q112-P175 VanDerWaalsContact NE2-N 3.13Å; P175-G177 PolarHBondContact O-N 3.49Å; P175-G177 VanDerWaalsContact O-N 3.1Å
176K40.3Very low57.2Low188 Ų18871.5 Ų71.582%0.81742%0.422SS*.  trans-79.593.1177.4-67.7-176.4179.8178.60109.4P174P174-K176 PolarHBondContact O-N 3.48Å
177G43.6Very low54.9Low60 Ų6072.8 Ų72.862%0.61943%0.431SS*.SBendtrans121.9172.1173.800000113.9P175 T179P175-G177 PolarHBondContact O-N 3.49Å; P175-G177 VanDerWaalsContact O-N 3.1Å; G177-T179 PolarHBondContact O-N 2.87Å; G177-T179 VanDerWaalsContact O-N 3.16Å
178A41.5Very low53.1Low103 Ų10379.1 Ų79.185%0.85146%0.464SS*.  trans-63.3113.6-178.400000111.3
179T44.6Very low51.4Low69 Ų6979.3 Ų79.342%0.42347%0.47SS..  trans-83.5126.2167-156.30000108.3G177 P181G177-T179 PolarHBondContact O-N 2.87Å; G177-T179 VanDerWaalsContact O-N 3.16Å; T179-P181 WeakPolarHBondContact O-CD 3.47Å
180I46.8Very low49.5Very low107 Ų10784.2 Ų84.255%0.54950%0.5SS..  trans-92.9106.2171.6-56.8172.4000105.9Y182I180-Y182 PolarHBondContact O-N 3.11Å
181P48.8Very low47.4Very low64 Ų6489.2 Ų89.242%0.41653%0.531SS..  trans-73.5129.1-17429.1-33.7000110.6T179 H183T179-P181 WeakPolarHBondContact O-CD 3.47Å; P181-H183 PolarHBondContact O-CE1 2.98Å; P181-H183 PolarHBondContact O-N 2.88Å; P181-H183 VanDerWaalsContact O-N 3.09Å; P181-H183 PolarHBondContact O-ND1 2.85Å; P181-H183 VanDerWaalsContact O-ND1 3.14Å
182Y41Very low45.8Very low45 Ų4594.4 Ų94.418%0.17656%0.559CS.*  trans-58.4115.7174.4-178.3-95.7000111.8R21 I62 N144 E147 I180 P184R21-Y182 PolarHBondContact NH2-O 3.25Å; I62-Y182 HydrophobicContact CD1-CD1 3.46Å; I62-Y182 VanDerWaalsContact CD1-CD1 3.46Å; I62-Y182 HydrophobicContact CD1-CE1 3.97Å; I62-Y182 HydrophobicContact CD1-CG 4.42Å; N144-Y182 WeakPolarHBondContact OD1-CD2 3.41Å; N144-Y182 WeakPolarHBondContact OD1-CE2 3.35Å; E147-Y182 WeakPolarHBondContact OE2-CB 3.43Å; E147-Y182 PolarHBondContact OE2-N 3.17Å; I180-Y182 PolarHBondContact O-N 3.11Å; Y182-P184 HydrophobicContact CE1-CB 3.92Å; Y182-P184 HydrophobicContact CE1-CG 4.49Å
183H37.4Very low44Very low101 Ų10196.2 Ų96.247%0.46857%0.572SS.*  trans-106118.616811.4-107.3000108.9P181 S185P181-H183 PolarHBondContact O-CE1 2.98Å; P181-H183 PolarHBondContact O-N 2.88Å; P181-H183 VanDerWaalsContact O-N 3.09Å; P181-H183 PolarHBondContact O-ND1 2.85Å; P181-H183 VanDerWaalsContact O-ND1 3.14Å; H183-S185 PolarHBondContact O-N 3.17Å
184P36.3Very low42.5Very low43 Ų43100.3 Ų100.328%0.27960%0.601SS.*  trans-76.763.8176.632.5-35.3000111.6Y182Y182-P184 HydrophobicContact CE1-CB 3.92Å; Y182-P184 HydrophobicContact CE1-CG 4.49Å
185S34.8Very low41.6Very low96 Ų96101.1 Ų101.167%0.67161%0.614SS**SBendtrans-132.1111.1162.9-169.60000108.1H183 S187H183-S185 PolarHBondContact O-N 3.17Å; S185-S187 PolarHBondContact O-N 3.41Å
186L41.8Very low41.3Very low157 Ų157105.1 Ų105.182%0.82263%0.632SS**  trans-4.678.1-174.5-73.378.7000116.5L188L186-L188 PolarHBondContact O-N 3.16Å
187S39.8Very low41.1Very low31 Ų31104.8 Ų104.822%0.21763%0.633CS.*  trans-80.3102.9161.2-178.80000108.4S185 G189S185-S187 PolarHBondContact O-N 3.41Å; S187-G189 PolarHBondContact O-N 2.78Å
188L44.8Very low41Very low144 Ų144105.4 Ų105.475%0.75464%0.639SS**  trans-74.838.8-177.1-148.182.8000112.5L186 T190L186-L188 PolarHBondContact O-N 3.16Å; L188-T190 PolarHBondContact O-N 3.34Å
189G45.6Very low40.5Very low49 Ų49109.9 Ų109.951%0.50564%0.64SS.*  trans-96.251.7-162.400000115.8S187S187-G189 PolarHBondContact O-N 2.78Å
190T41.9Very low40.3Very low106 Ų106112.1 Ų112.165%0.6566%0.658SS**SBendtrans-151.334.2171-33.50000115.1L188L188-T190 PolarHBondContact O-N 3.34Å
191V38.4Very low39.6Very low134 Ų134114.2 Ų114.281%0.81268%0.675SS**SBendtrans-129.542.7171.4-157.70000112.3
192L40.4Very low39.1Very low166 Ų166120.6 Ų120.687%0.86970%0.7SS**  trans-131.227.9173.4-74.8178.1000113.6
193L39.7Very low38.5Very low178 Ų178121.8 Ų121.893%0.93273%0.726SS**SBendtrans-125.156.4171.7-87.4144000111.5
194S31.3Very low38.2Very low113 Ų113125.7 Ų125.779%0.7974%0.744SS**  trans-175.285.3135.8-167.60000110.1
195A40.8Very low38Very low99 Ų99134.8 Ų134.882%0.81878%0.775SS**  trans-96122.2156.900000108
196N46.9Very low37.6Very low155 Ų155134.1 Ų134.183%0.82978%0.783SS**  trans81.171159.4-152.627.5000119.1
197Q37.9Very low37.4Very low181 Ų181131.3 Ų131.385%0.84678%0.783SS**  -137.2127.4127-70-160.829.200109.4
198G39.8Very low37.3Very low72 Ų72136.9 Ų136.974%0.74282%0.815SS**  trans-83.8128.3-17900000112.2
199F31.7Very low37Very low198 Ų198135.7 Ų135.787%0.86881%0.814SS**  trans-140.9123.4159.9-107-86.4000109.5
200S40.7Very low36.9Very low115 Ų115139.9 Ų139.980%0.80483%0.832SS**  trans-76.2124.5168.851.90000109.7
201V32.5Very low36.9Very low151 Ų151138.4 Ų138.492%0.91583%0.831SS**  trans-138.7139.1160.9116.40000110.9
202Q36.8Very low36.8Very low198 Ų198140.9 Ų140.993%0.92583%0.834SS**  trans-109132.7-165.9169.3-175.3-40.700110
203G29.9Very low37Very low71 Ų71139.8 Ų139.873%0.73283%0.834SS**  trans133.5154167.600000113.4
204Q30.9Very low37.3Very low182 Ų182136.5 Ų136.585%0.8582%0.821SS**  cis-166.7146.2-16.8-168.3165.616.100105.2
205Y31Very low37.5Very low234 Ų234140.5 Ų140.592%0.91882%0.824SS**  trans-47.1143.3-168-49.9-91.7000117.9
206G27.6Very low37.7Very low82 Ų82144.6 Ų144.685%0.84583%0.831SS**  trans-146.8120.8158.100000109.2
207A36.9Very low37.7Very low99 Ų99146 Ų14682%0.81883%0.833SS**  trans-96.5147.5-16200000114.6
208V37.1Very low37.8Very low147 Ų147145.6 Ų145.689%0.89183%0.831SS**  trans-134.1138.5156.9-71.30000109.6
209T38.2Very low37.8Very low120 Ų120150.6 Ų150.674%0.73684%0.84SS**  trans-98.3147.2-167.843.60000113A211T209-A211 VanDerWaalsContact C-N 3.34Å; T209-A211 PolarHBondContact O-N 3.44Å
210P43.8Very low37.8Very low136 Ų136147 Ų14788%0.88384%0.84SS**SBendtrans-85.866.6-175.935.8-36.5000112.2
211A41.8Very low37.6Very low76 Ų76146.7 Ų146.763%0.62884%0.837SS**  trans-123.5-10.6-176.200000115.9T209T209-A211 VanDerWaalsContact C-N 3.34Å; T209-A211 PolarHBondContact O-N 3.44Å
212E37.2Very low37.8Very low185 Ų185148.8 Ų148.886%0.86484%0.837SS**SBendtrans-105.44.7-176.2-65.2-141.9105.600115.3T214E212-T214 VanDerWaalsContact C-N 3.32Å; E212-T214 PolarHBondContact O-N 3.03Å
213V44.9Very low37.5Very low144 Ų144143.1 Ų143.187%0.87382%0.824SS**THydrogen-bonded Turntrans-93.755.7176-165.30000110.9
214T45.3Very low37.5Very low109 Ų109146.3 Ų146.367%0.66983%0.829SS**THydrogen-bonded Turntrans-143.7-12.6178.5-48.50000114E212E212-T214 VanDerWaalsContact C-N 3.32Å; E212-T214 PolarHBondContact O-N 3.03Å
215K36.5Very low38.2Very low197 Ų197143.2 Ų143.286%0.85783%0.825SS**THydrogen-bonded Turntrans-95.14.8-171.6-108.3-179.1179.1177.70117.3
216L43.8Very low38Very low184 Ų184141.8 Ų141.896%0.96382%0.823SS**THydrogen-bonded Turntrans-113.58-179.3-77.2170000115.1
217Q46.6Very low38Very low186 Ų186141.5 Ų141.587%0.86981%0.813SS**SBendtrans-106.312.2-174.5-166.3160.4-23.600114.9
218Q41Very low37.8Very low171 Ų171143.1 Ų143.180%0.79981%0.813SS**SBendtrans-120.47.5-165.4-99.8-174.8-41.400118.2
219L39.3Very low38.4Very low177 Ų177141.4 Ų141.493%0.92781%0.805SS**SBendtrans-137.558.3-174.7-71.8172.3000115.2
220S31.6Very low38.1Very low124 Ų124141.1 Ų141.187%0.86781%0.807SS**  trans-164.877.9159.158.10000113.3
221S36.9Very low37.9Very low108 Ų108140.8 Ų140.876%0.75580%0.803SS**  trans-116.4112171.756.90000111.2
222H36.2Very low37.8Very low194 Ų194143.9 Ų143.990%0.89881%0.813SS**  trans-152.395.7161-97.489000111.2
223A30.7Very low38Very low79 Ų79141.2 Ų141.265%0.65381%0.812SS**  trans26.5115147.200000121.2
224V30.9Very low37.4Very low138 Ų138138 Ų13884%0.83681%0.808SS**  90.3158.787.4-59.20000115.4
225P45.1Very low37.5Very low118 Ų118141.1 Ų141.177%0.76682%0.82SS**  cis-131.9178-34.932.2-12.5000113.3
226F26.7Very low37.8Very low204 Ų204138.1 Ų138.190%0.89581%0.813SS**  171.5138.8122.8-165.9-116.8000114.1
227A27.9Very low38.3Very low75 Ų75135.9 Ų135.962%0.6281%0.809SS**  trans56.699.5161.400000122.6
228T32.2Very low38.4Very low134 Ų134129.7 Ų129.782%0.82280%0.795SS**  trans-76.2174.6137.948.70000109.8
229P50.9Low39Very low111 Ų111126.5 Ų126.572%0.72179%0.788SS**  cis-148.1160.524.342.2-21.7000120
230S31Very low39.9Very low113 Ų113126.7 Ų126.779%0.7978%0.784SS**  174.8113.4118.9-78.30000114.9
231V38.8Very low41.6Very low130 Ų130125.5 Ų125.579%0.78877%0.772SS**  trans10.2119.4142.5-175.40000119.5
232V40.2Very low43.6Very low140 Ų140123.3 Ų123.385%0.84876%0.756SS**  -158.4143.2100.8-89.50000111.1
233P41.3Very low45.7Very low130 Ų130117.6 Ų117.684%0.84474%0.738SS**  trans-97.4136.51784.616.9000113.2
234G32.9Very low48.1Very low75 Ų75117.9 Ų117.977%0.77373%0.726SS**  trans-152.2140.8168.100000109.3
235L46.3Very low50.6Low176 Ų176117.9 Ų117.992%0.92172%0.717SS**  trans-122110.9-169.4175.872.5000110.9
236D43.3Very low52.5Low134 Ų134114.2 Ų114.272%0.71769%0.689SS**  trans-147137.516663.3-69.7000111.5
237P54.5Low55Low136 Ų136108.7 Ų108.788%0.88367%0.668SS**  trans-99.6103178.934.8-29.6000111.7
238G49Very low57.6Low56 Ų56105.1 Ų105.158%0.57764%0.639SS**SBendtrans176.4103.8170.800000116.8
239T54Low59.9Low105 Ų105101.3 Ų101.364%0.64462%0.616SS**  trans68.5108.8170-43.50000115.1T241T239-T241 PolarHBondContact O-N 3.15Å
240Q57.3Low61.3Low180 Ų18097.9 Ų97.984%0.84159%0.592SS**  trans-62.799.4163.3-76.1-178.8-28.200109.6S242Q240-S242 PolarHBondContact O-N 3.17Å
241T68.1Low63.7Low100 Ų10098.5 Ų98.561%0.61359%0.586SS**  trans-77.8105.6170.254.50000108.9T239 G293T239-T241 PolarHBondContact O-N 3.15Å; T241-G293 CarbonylContact C-O 3.59Å; T241-G293 WeakPolarHBondContact CA-O 3.48Å
242S78.1Confident65.7Low61 Ų6193.7 Ų93.743%0.42756%0.556SS.*EExtended strand (participates in β ladder)trans-81.7160.8169.5-175.70000109.8Q240 T292 G293 I298Q240-S242 PolarHBondContact O-N 3.17Å; S242-T292 WeakPolarHBondContact O-CA 3.42Å; S242-G293 PolarHBondContact N-O 3.49Å; S242-G293 PolarHBondContact O-N 2.91Å; S242-I298 WeakPolarHBondContact O-CD1 3.46Å
243S81.3Confident67.7Low75 Ų7587.2 Ų87.252%0.52452%0.517SS..EExtended strand (participates in β ladder)trans-128.4127.8168.9-66.90000108.7I291 T292S243-I291 CarbonylContact C-O 3.58Å; S243-I291 WeakPolarHBondContact CA-O 3.35Å; S243-T292 WeakPolarHBondContact OG-CG2 3.44Å; S243-T292 PolarHBondContact OG-OG1 3.31Å
244Q81Confident69.6Low85 Ų8583.1 Ų83.140%0.39750%0.499SS..EExtended strand (participates in β ladder)trans-127.7128.1-180-171.6164.6200109.9I291 I298Q244-I291 PolarHBondContact N-O 2.97Å; Q244-I291 PolarHBondContact O-N 2.89Å; Q244-I298 HydrophobicContact CB-CG2 3.87Å
245E83.3Confident71.8Confident138 Ų13882.7 Ų82.765%0.64548%0.483SS*.EExtended strand (participates in β ladder)trans-103.8147.6174.562-172.890.500111V289E245-V289 WeakPolarHBondContact CA-O 3.43Å
246F83.7Confident73.6Confident40 Ų4074.4 Ų74.418%0.17544%0.44CS..EExtended strand (participates in β ladder)trans-153159.6173.470.1-69.6000111V248 V289 I291 I305F246-V248 HydrophobicContact CD2-CG2 3.77Å; F246-V248 HydrophobicContact CE2-CG2 3.31Å; F246-V248 HydrophobicContact CZ-CG2 4.03Å; F246-V289 HydrophobicContact CD1-CB 4.19Å; F246-V289 VanDerWaalsContact CD1-O 3.3Å; F246-V289 WeakPolarHBondContact CD1-O 3.37Å; F246-V289 HydrophobicContact CE1-CB 3.59Å; F246-V289 HydrophobicContact CE1-CG1 3.64Å; F246-V289 HydrophobicContact CZ-CB 3.84Å; F246-V289 HydrophobicContact CZ-CG1 3.94Å; F246-V289 HydrophobicContact CZ-CG2 4.46Å; F246-V289 PolarHBondContact N-O 3.22Å; F246-V289 VanDerWaalsContact N-O 3.07Å; F246-V289 PolarHBondContact O-N 3.5Å; F246-I291 HydrophobicContact CD1-CD1 4.26Å; F246-I291 HydrophobicContact CD1-CG1 4.5Å; F246-I291 HydrophobicContact CE1-CD1 3.55Å; F246-I291 HydrophobicContact CE1-CG1 3.86Å; F246-I291 HydrophobicContact CZ-CD1 4.31Å; F246-I305 HydrophobicContact CE1-CD1 4.28Å; F246-I305 HydrophobicContact CE2-CG2 3.8Å; F246-I305 HydrophobicContact CZ-CB 4.16Å; F246-I305 HydrophobicContact CZ-CD1 3.71Å; F246-I305 HydrophobicContact CZ-CG2 3.7Å
247L79.3Confident75.6Confident88 Ų8870.2 Ų70.246%0.46142%0.417SS..EExtended strand (participates in β ladder)trans-96.3135.5-175.2-68.3158.2000110.4E286L247-E286 HydrophobicContact CB-CB 4.44Å; L247-E286 HydrophobicContact CD2-CB 4.1Å
248V82.3Confident77Confident0 Ų064.9 Ų64.90%039%0.386CS..EExtended strand (participates in β ladder)trans-130.6124178.1-178.90000110F246 I253 E286 R287 V289 L309F246-V248 HydrophobicContact CD2-CG2 3.77Å; F246-V248 HydrophobicContact CE2-CG2 3.31Å; F246-V248 HydrophobicContact CZ-CG2 4.03Å; V248-I253 HydrophobicContact CB-CD1 4Å; V248-I253 HydrophobicContact CG1-CB 4.01Å; V248-I253 HydrophobicContact CG1-CD1 3.7Å; V248-I253 HydrophobicContact CG1-CG1 4.42Å; V248-I253 HydrophobicContact CG2-CD1 4.45Å; V248-E286 CarbonylContact O-C 3.56Å; V248-E286 WeakPolarHBondContact O-CA 3.32Å; V248-R287 PolarHBondContact N-O 3.47Å; V248-R287 PolarHBondContact O-N 3.36Å; V248-V289 HydrophobicContact CB-CG2 4.5Å; V248-V289 HydrophobicContact CG2-CG2 3.95Å; V248-L309 HydrophobicContact CG1-CD1 4.07Å; V248-L309 HydrophobicContact CG1-CD2 3.59Å; V248-L309 HydrophobicContact CG1-CG 4.43Å; V248-L309 HydrophobicContact CG2-CD1 4.4Å
249P81.8Confident78.6Confident54 Ų5473.6 Ų73.635%0.35140%0.402SS..EExtended strand (participates in β ladder)trans-54.6139.3177.2-28.236000113.5D251 L252 I253P249-D251 PolarHBondContact O-N 3.3Å; P249-L252 PolarHBondContact O-N 2.98Å; P249-L252 VanDerWaalsContact O-N 3.09Å; P249-I253 PolarHBondContact O-N 2.92Å
250N79.3Confident79.9Confident39 Ų3978.2 Ų78.221%0.20942%0.416CS..Hα-helixtrans-61.3-26.2179.4-83.8-92000113.1I253 A284 G285 E286 R287N250-I253 WeakPolarHBondContact O-CG2 3.48Å; N250-A284 PolarHBondContact ND2-O 3.03Å; N250-A284 VanDerWaalsContact ND2-O 3.1Å; N250-G285 PolarHBondContact N-O 3Å; N250-G285 PolarHBondContact ND2-O 3.44Å; N250-E286 VanDerWaalsContact ND2-C 3.35Å; N250-E286 PolarHBondContact ND2-N 3.18Å; N250-E286 VanDerWaalsContact ND2-N 3.17Å; N250-R287 VanDerWaalsContact OD1-CG 3.3Å; N250-R287 WeakPolarHBondContact OD1-CG 3.25Å; N250-R287 PolarHBondContact OD1-NE 3.47Å
251D81.8Confident81.2Confident126 Ų12670.5 Ų70.567%0.67439%0.385SS*.Hα-helixtrans-66.3-39.7175.5-167.1-105.6000111.9P249P249-D251 PolarHBondContact O-N 3.3Å
252L80.9Confident82Confident29 Ų2969.4 Ų69.415%0.15238%0.381CS..Hα-helixtrans-97.9-20.2-172.3-54.3178.1000113.4P249 G254 C255 V256 L309 A312P249-L252 PolarHBondContact O-N 2.98Å; P249-L252 VanDerWaalsContact O-N 3.09Å; L252-G254 PolarHBondContact O-N 3.29Å; L252-C255 WeakPolarHBondContact O-CB 3.28Å; L252-C255 PolarHBondContact O-N 3.46Å; L252-V256 PolarHBondContact O-N 3.42Å; L252-L309 HydrophobicContact CB-CD2 3.36Å; L252-L309 HydrophobicContact CD1-CD2 4.25Å; L252-L309 HydrophobicContact CG-CD2 4.46Å; L252-A312 HydrophobicContact CD2-CB 3.93Å
253I82.5Confident82.4Confident4 Ų470.3 Ų70.32%0.02138%0.378CS..Hα-helixtrans-59.9-29.9178.9-16665.9000112.5V248 P249 N250 C255 V256 I257 V289V248-I253 HydrophobicContact CB-CD1 4Å; V248-I253 HydrophobicContact CG1-CB 4.01Å; V248-I253 HydrophobicContact CG1-CD1 3.7Å; V248-I253 HydrophobicContact CG1-CG1 4.42Å; V248-I253 HydrophobicContact CG2-CD1 4.45Å; P249-I253 PolarHBondContact O-N 2.92Å; N250-I253 WeakPolarHBondContact O-CG2 3.48Å; I253-C255 PolarHBondContact O-N 3.17Å; I253-V256 HydrophobicContact CD1-CB 4.25Å; I253-V256 HydrophobicContact CD1-CG1 4.48Å; I253-V256 PolarHBondContact O-N 3.19Å; I253-I257 HydrophobicContact CG1-CD1 3.95Å; I253-I257 HydrophobicContact CG1-CG1 4.32Å; I253-I257 WeakPolarHBondContact O-CG1 3.22Å; I253-I257 PolarHBondContact O-N 3.1Å; I253-V289 HydrophobicContact CD1-CG2 4.02Å
254G81Confident82.8Confident45 Ų4567.3 Ų67.346%0.46436%0.356SS..Hα-helixtrans-59.6-34.2175.200000113L252 G258L252-G254 PolarHBondContact O-N 3.29Å; G254-G258 PolarHBondContact O-N 2.9Å
255C79.9Confident83.1Confident65 Ų6566.7 Ų66.744%0.43936%0.36SS..Hα-helixtrans-76-34176.7-63.30000112.5L252 I253 A312L252-C255 WeakPolarHBondContact O-CB 3.28Å; L252-C255 PolarHBondContact O-N 3.46Å; I253-C255 PolarHBondContact O-N 3.17Å; C255-A312 HydrophobicContact CB-CB 3.57Å; C255-A312 VanDerWaalsContact SG-CB 3.57Å
256V83.3Confident83.3Confident3 Ų364.3 Ų64.32%0.01835%0.349CS..Hα-helixtrans-67.8-38.5174.2179.90000111.4L252 I253 I264 I267 I305 C308 L309L252-V256 PolarHBondContact O-N 3.42Å; I253-V256 HydrophobicContact CD1-CB 4.25Å; I253-V256 HydrophobicContact CD1-CG1 4.48Å; I253-V256 PolarHBondContact O-N 3.19Å; V256-I264 PolarHBondContact O-N 3.49Å; V256-I267 HydrophobicContact CG1-CD1 4.33Å; V256-I305 HydrophobicContact CG1-CB 4.29Å; V256-I305 HydrophobicContact CG1-CG1 3.96Å; V256-I305 HydrophobicContact CG1-CG2 3.71Å; V256-I305 HydrophobicContact CG2-CG2 3.99Å; V256-C308 HydrophobicContact CG2-CB 4.14Å; V256-L309 HydrophobicContact CG2-CD2 3.46Å; V256-L309 VanDerWaalsContact CG2-CD2 3.46Å; V256-L309 HydrophobicContact CG2-CG 3.78Å
257I86.3Confident83.5Confident46 Ų4662.5 Ų62.524%0.23634%0.341CS..Hα-helixtrans-71.4-45.5175.1-65.5168.6000110.1I253 G261 K263 I264I253-I257 HydrophobicContact CG1-CD1 3.95Å; I253-I257 HydrophobicContact CG1-CG1 4.32Å; I253-I257 WeakPolarHBondContact O-CG1 3.22Å; I253-I257 PolarHBondContact O-N 3.1Å; I257-G261 CarbonylContact O-C 3.58Å; I257-G261 WeakPolarHBondContact O-CA 3.45Å; I257-K263 WeakPolarHBondContact O-CB 3.47Å; I257-K263 PolarHBondContact O-N 3.42Å; I257-K263 VanDerWaalsContact O-N 3.11Å; I257-I264 HydrophobicContact CB-CG2 4.36Å; I257-I264 HydrophobicContact CG2-CG2 4.1Å; I257-I264 PolarHBondContact O-N 3.49Å; I257-I264 VanDerWaalsContact O-N 3.13Å
258G83.1Confident83.9Confident24 Ų2463.4 Ų63.425%0.24734%0.339CS..  trans75.3171.4-175.200000113G254 Q260 G261G254-G258 PolarHBondContact O-N 2.9Å; G258-Q260 PolarHBondContact O-N 3.15Å; G258-G261 PolarHBondContact O-N 2.99Å; G258-G261 VanDerWaalsContact O-N 3.07Å
259R83.1Confident84.2Confident239 Ų23971.1 Ų71.190%0.90238%0.375SS*.G310 helixtrans-56.7127.6176.2-64.5-179.1-176.71691.6109.2G261 S262R259-G261 PolarHBondContact O-N 3.41Å; R259-S262 PolarHBondContact O-N 3.33Å; R259-S262 PolarHBondContact O-OG 2.67Å
260Q80.1Confident84.5Confident202 Ų20273 Ų7394%0.94438%0.38SS*.G310 helixtrans55.118.8-177.4-151.4-173.890.600115.5G258 S262G258-Q260 PolarHBondContact O-N 3.15Å; Q260-S262 VanDerWaalsContact C-N 3.29Å; Q260-S262 PolarHBondContact O-N 3.15Å
261G85.1Confident84.7Confident18 Ų1871.4 Ų71.419%0.18637%0.372CS..G310 helixtrans77.38.6-178.200000115.1I257 G258 R259 K263 I264 S265I257-G261 CarbonylContact O-C 3.58Å; I257-G261 WeakPolarHBondContact O-CA 3.45Å; G258-G261 PolarHBondContact O-N 2.99Å; G258-G261 VanDerWaalsContact O-N 3.07Å; R259-G261 PolarHBondContact O-N 3.41Å; G261-K263 VanDerWaalsContact C-N 3.27Å; G261-K263 PolarHBondContact O-N 3Å; G261-I264 WeakPolarHBondContact O-CG2 3.43Å; G261-I264 PolarHBondContact O-N 3.01Å; G261-S265 WeakPolarHBondContact O-CB 3.49Å; G261-S265 PolarHBondContact O-N 3.39Å
262S85.8Confident84.8Confident77 Ų7768.3 Ų68.354%0.53837%0.37SS..Hα-helixtrans-60-36.1-177.9-54.10000112.8R259 Q260 S265 E266R259-S262 PolarHBondContact O-N 3.33Å; R259-S262 PolarHBondContact O-OG 2.67Å; Q260-S262 VanDerWaalsContact C-N 3.29Å; Q260-S262 PolarHBondContact O-N 3.15Å; S262-S265 PolarHBondContact O-N 3Å; S262-E266 WeakPolarHBondContact O-CB 3.45Å; S262-E266 PolarHBondContact O-N 2.88Å
263K86.3Confident85.2Confident80 Ų8067.1 Ų67.135%0.34836%0.364SS..Hα-helixtrans-73-44.2-177.3-163.273-166.8162.30111.6I257 G261 S265 E266 I267I257-K263 WeakPolarHBondContact O-CB 3.47Å; I257-K263 PolarHBondContact O-N 3.42Å; I257-K263 VanDerWaalsContact O-N 3.11Å; G261-K263 VanDerWaalsContact C-N 3.27Å; G261-K263 PolarHBondContact O-N 3Å; K263-S265 VanDerWaalsContact C-N 3.3Å; K263-S265 PolarHBondContact O-N 3.49Å; K263-E266 WeakPolarHBondContact CD-OE2 3.5Å; K263-E266 WeakPolarHBondContact CE-OE2 3.45Å; K263-E266 IonicContact NZ-OE2 2.85Å; K263-E266 PolarHBondContact NZ-OE2 3.48Å; K263-E266 WeakPolarHBondContact O-CB 3.21Å; K263-E266 PolarHBondContact O-N 3.36Å; K263-I267 HydrophobicContact CG-CD1 4.29Å; K263-I267 WeakPolarHBondContact O-CG1 3.49Å; K263-I267 PolarHBondContact O-N 3.43Å
264I89.1Confident85.4Confident12 Ų1273 Ų736%0.06239%0.392CS..Hα-helixtrans-67.1-31.5174.4-175.560.4000112.5V256 I257 G261 I267 R268 I275 I277V256-I264 PolarHBondContact O-N 3.49Å; I257-I264 HydrophobicContact CB-CG2 4.36Å; I257-I264 HydrophobicContact CG2-CG2 4.1Å; I257-I264 PolarHBondContact O-N 3.49Å; I257-I264 VanDerWaalsContact O-N 3.13Å; G261-I264 WeakPolarHBondContact O-CG2 3.43Å; G261-I264 PolarHBondContact O-N 3.01Å; I264-I267 HydrophobicContact CD1-CB 4.47Å; I264-I267 PolarHBondContact O-N 2.99Å; I264-R268 WeakPolarHBondContact O-CG 3.44Å; I264-R268 PolarHBondContact O-N 3.43Å; I264-I275 HydrophobicContact CD1-CB 4.42Å; I264-I275 HydrophobicContact CD1-CD1 4.26Å; I264-I275 HydrophobicContact CD1-CG2 3.93Å; I264-I277 HydrophobicContact CD1-CD1 4.26Å; I264-I277 HydrophobicContact CG1-CD1 3.88Å
265S87.2Confident85.8Confident71 Ų7171 Ų7150%0.49737%0.37SS..Hα-helixtrans-64.3-45.9172.8-1610000111.6G261 S262 K263 I267 R268 Q269G261-S265 WeakPolarHBondContact O-CB 3.49Å; G261-S265 PolarHBondContact O-N 3.39Å; S262-S265 PolarHBondContact O-N 3Å; K263-S265 VanDerWaalsContact C-N 3.3Å; K263-S265 PolarHBondContact O-N 3.49Å; S265-I267 PolarHBondContact O-N 3.18Å; S265-R268 PolarHBondContact O-N 3.19Å; S265-Q269 WeakPolarHBondContact O-CB 3.25Å; S265-Q269 PolarHBondContact O-N 3.41Å
266E86.9Confident86Confident88 Ų8874.5 Ų74.541%0.41138%0.378SS..Hα-helixtrans-59.2-45.3173-178.5-176.8-145.100111.6S262 K263 R268 Q269 M270S262-E266 WeakPolarHBondContact O-CB 3.45Å; S262-E266 PolarHBondContact O-N 2.88Å; K263-E266 WeakPolarHBondContact CD-OE2 3.5Å; K263-E266 WeakPolarHBondContact CE-OE2 3.45Å; K263-E266 IonicContact NZ-OE2 2.85Å; K263-E266 PolarHBondContact NZ-OE2 3.48Å; K263-E266 WeakPolarHBondContact O-CB 3.21Å; K263-E266 PolarHBondContact O-N 3.36Å; E266-R268 PolarHBondContact O-N 3.2Å; E266-Q269 WeakPolarHBondContact O-CB 3.39Å; E266-Q269 PolarHBondContact O-N 3.19Å; E266-Q269 VanDerWaalsContact O-N 3.15Å; E266-M270 HydrophobicContact CG-CG 4.23Å; E266-M270 HydrophobicContact CG-SD 3.75Å; E266-M270 WeakPolarHBondContact O-CB 3.39Å; E266-M270 VanDerWaalsContact O-CG 3.29Å; E266-M270 WeakPolarHBondContact O-CG 3.14Å; E266-M270 PolarHBondContact O-N 2.93Å
267I88.8Confident86.1Confident2 Ų276.6 Ų76.61%0.0139%0.389CS..Hα-helixtrans-61.5-41.3178.3-66.1167.3000111.7V256 K263 I264 S265 S271 I275 L304 I305V256-I267 HydrophobicContact CG1-CD1 4.33Å; K263-I267 HydrophobicContact CG-CD1 4.29Å; K263-I267 WeakPolarHBondContact O-CG1 3.49Å; K263-I267 PolarHBondContact O-N 3.43Å; I264-I267 HydrophobicContact CD1-CB 4.47Å; I264-I267 PolarHBondContact O-N 2.99Å; S265-I267 PolarHBondContact O-N 3.18Å; I267-S271 VanDerWaalsContact O-CB 3.29Å; I267-S271 WeakPolarHBondContact O-CB 3.29Å; I267-S271 PolarHBondContact O-N 2.96Å; I267-S271 PolarHBondContact O-OG 2.72Å; I267-I275 HydrophobicContact CG2-CD1 3.68Å; I267-L304 HydrophobicContact CB-CD1 4.46Å; I267-L304 HydrophobicContact CG1-CB 4.07Å; I267-L304 HydrophobicContact CG1-CD1 4.43Å; I267-L304 HydrophobicContact CG2-CB 3.94Å; I267-L304 HydrophobicContact CG2-CD1 4.13Å; I267-I305 HydrophobicContact CD1-CG1 4.2Å; I267-I305 HydrophobicContact CG2-CD1 4.43Å; I267-I305 HydrophobicContact CG2-CG1 4.01Å
268R88.2Confident85.6Confident107 Ų10775.8 Ų75.840%0.40439%0.392SS..Hα-helixtrans-61.4-45.7173.1-72.8169.2175.3172-0.3111.3I264 S265 E266 S271 G272 I275I264-R268 WeakPolarHBondContact O-CG 3.44Å; I264-R268 PolarHBondContact O-N 3.43Å; S265-R268 PolarHBondContact O-N 3.19Å; E266-R268 PolarHBondContact O-N 3.2Å; R268-S271 PolarHBondContact O-OG 3.37Å; R268-G272 PolarHBondContact O-N 3.47Å; R268-I275 HydrophobicContact CG-CB 4.02Å; R268-I275 HydrophobicContact CG-CD1 3.83Å; R268-I275 HydrophobicContact CG-CG1 4.22Å; R268-I275 VanDerWaalsContact CZ-O 3.27Å; R268-I275 PolarHBondContact NE-O 3.22Å; R268-I275 PolarHBondContact NH2-O 3Å
269Q88.7Confident85.2Confident163 Ų16381.9 Ų81.976%0.76242%0.418SS*.Hα-helixtrans-64.2-41.1179.5-172.965.554.700112.8S265 E266S265-Q269 WeakPolarHBondContact O-CB 3.25Å; S265-Q269 PolarHBondContact O-N 3.41Å; E266-Q269 WeakPolarHBondContact O-CB 3.39Å; E266-Q269 PolarHBondContact O-N 3.19Å; E266-Q269 VanDerWaalsContact O-N 3.15Å
270M86.4Confident84.1Confident92 Ų9275.3 Ų75.345%0.45340%0.398SS..Hα-helixtrans-75.2-36.7-179.3-69.9178.175.600113.1E266 L304E266-M270 HydrophobicContact CG-CG 4.23Å; E266-M270 HydrophobicContact CG-SD 3.75Å; E266-M270 WeakPolarHBondContact O-CB 3.39Å; E266-M270 VanDerWaalsContact O-CG 3.29Å; E266-M270 WeakPolarHBondContact O-CG 3.14Å; E266-M270 PolarHBondContact O-N 2.93Å; M270-L304 HydrophobicContact CB-CD1 3.75Å; M270-L304 HydrophobicContact CE-CD1 4.42Å; M270-L304 HydrophobicContact CE-CD2 4.19Å; M270-L304 HydrophobicContact SD-CD1 4.19Å; M270-L304 HydrophobicContact SD-CD2 4.48Å
271S85.3Confident82.8Confident6 Ų668.8 Ų68.84%0.04238%0.378CS..Hα-helixtrans-83.2-25.5-179.359.70000113.9I267 R268 A273 S297I267-S271 VanDerWaalsContact O-CB 3.29Å; I267-S271 WeakPolarHBondContact O-CB 3.29Å; I267-S271 PolarHBondContact O-N 2.96Å; I267-S271 PolarHBondContact O-OG 2.72Å; R268-S271 PolarHBondContact O-OG 3.37Å; S271-A273 PolarHBondContact O-N 2.95Å; S271-A273 PolarHBondContact OG-N 3.49Å; S271-S297 WeakPolarHBondContact O-CA 3.38Å; S271-S297 WeakPolarHBondContact O-CB 3.35Å; S271-S297 PolarHBondContact O-OG 3.26Å
272G84.1Confident81.3Confident61 Ų6177.5 Ų77.563%0.62941%0.414SS*.  trans63.114.1-166.700000113.2R268R268-G272 PolarHBondContact O-N 3.47Å
273A88Confident79.8Confident5 Ų578.1 Ų78.14%0.04143%0.433CS..  trans-96.4143.6-17900000111.5S271 I275 I291 A301S271-A273 PolarHBondContact O-N 2.95Å; S271-A273 PolarHBondContact OG-N 3.49Å; A273-I275 HydrophobicContact CB-CG1 4.34Å; A273-I275 PolarHBondContact O-N 3.04Å; A273-I291 HydrophobicContact CB-CG2 3.56Å; A273-A301 HydrophobicContact CB-CB 3.97Å
274H87.3Confident78.3Confident128 Ų12876.4 Ų76.459%0.59343%0.434SS*.EExtended strand (participates in β ladder)trans-82.697.1175.1-174.5-80.6000110.3T292H274-T292 WeakPolarHBondContact CB-O 3.35Å; H274-T292 PolarHBondContact N-O 2.83Å; H274-T292 PolarHBondContact O-N 3.39Å
275I88.9Confident77.2Confident2 Ų278.5 Ų78.51%0.0146%0.458CS..EExtended strand (participates in β ladder)trans-98.1115.1-175.3-55.7160.5000110.7I264 I267 R268 A273 I277 V289 T290 I291 A301 I305I264-I275 HydrophobicContact CD1-CB 4.42Å; I264-I275 HydrophobicContact CD1-CD1 4.26Å; I264-I275 HydrophobicContact CD1-CG2 3.93Å; I267-I275 HydrophobicContact CG2-CD1 3.68Å; R268-I275 HydrophobicContact CG-CB 4.02Å; R268-I275 HydrophobicContact CG-CD1 3.83Å; R268-I275 HydrophobicContact CG-CG1 4.22Å; R268-I275 VanDerWaalsContact CZ-O 3.27Å; R268-I275 PolarHBondContact NE-O 3.22Å; R268-I275 PolarHBondContact NH2-O 3Å; A273-I275 HydrophobicContact CB-CG1 4.34Å; A273-I275 PolarHBondContact O-N 3.04Å; I275-I277 HydrophobicContact CG2-CD1 4.38Å; I275-V289 HydrophobicContact CG2-CG1 3.57Å; I275-T290 CarbonylContact C-O 3.56Å; I275-T290 WeakPolarHBondContact CA-O 3.35Å; I275-I291 HydrophobicContact CG1-CG1 4.25Å; I275-I291 HydrophobicContact CG1-CG2 4.06Å; I275-I291 HydrophobicContact CG2-CG1 4.42Å; I275-A301 HydrophobicContact CD1-CB 3.92Å; I275-A301 HydrophobicContact CG1-CB 4.33Å; I275-I305 HydrophobicContact CD1-CD1 4.42Å; I275-I305 HydrophobicContact CG2-CD1 4.43Å
276K84.5Confident76.8Confident139 Ų13979.7 Ų79.760%0.60446%0.456SS*.EExtended strand (participates in β ladder)trans-109.2123.2177.9-173.5174.9177.1-179.10109.7T290K276-T290 PolarHBondContact N-O 3.01Å; K276-T290 PolarHBondContact O-N 3.38Å
277I85.3Confident76.6Confident47 Ų4778.1 Ų78.124%0.24145%0.446CS..EExtended strand (participates in β ladder)trans-96.3125.1178-57.689.9000107.4I264 I275 V289I264-I277 HydrophobicContact CD1-CD1 4.26Å; I264-I277 HydrophobicContact CG1-CD1 3.88Å; I275-I277 HydrophobicContact CG2-CD1 4.38Å; I277-V289 HydrophobicContact CG1-CG1 4.48Å; I277-V289 HydrophobicContact CG1-CG2 4.35Å; I277-V289 HydrophobicContact CG2-CG2 4.43Å
278G75.9Confident76.1Confident29 Ų2982.5 Ų82.530%0.29947%0.467SS..PPolyproline II helixtrans-64.7149.2174.200000111.5H288G278-H288 PolarHBondContact N-O 3.28Å
279N73.9Confident76.1Confident151 Ų15177.5 Ų77.581%0.80745%0.448SS*.PPolyproline II helixtrans-60.9153.8172.5-169.930.8000110.2A281N279-A281 PolarHBondContact O-N 2.8Å
280Q60.3Low75.9Confident101 Ų10172.2 Ų72.247%0.47243%0.427SS..  trans-66102.8171.6-176.3172.1-9.200108.8
281A52.9Low76.1Confident65 Ų6567.9 Ų67.954%0.53741%0.406SS..  trans-69.8128.2168.400000108.4N279 G283 A284N279-A281 PolarHBondContact O-N 2.8Å; A281-G283 PolarHBondContact O-N 3.5Å; A281-A284 PolarHBondContact O-N 2.89Å
282E53.1Low76.3Confident201 Ų20169.7 Ų69.794%0.93942%0.416SS*.THydrogen-bonded Turntrans-58.3130.4179.6-72.6-159.893.400111.2
283G54.6Low76.5Confident90 Ų9067.3 Ų67.393%0.92839%0.392SS*.THydrogen-bonded Turntrans93.1-19.817500000116.5A281A281-G283 PolarHBondContact O-N 3.5Å
284A55.7Low76.6Confident44 Ų4468.4 Ų68.436%0.36440%0.399SS..  trans-85.9124.3176.800000111.6N250 A281 E286N250-A284 PolarHBondContact ND2-O 3.03Å; N250-A284 VanDerWaalsContact ND2-O 3.1Å; A281-A284 PolarHBondContact O-N 2.89Å; A284-E286 PolarHBondContact O-N 3.08Å
285G65.7Low76.4Confident56 Ų5666.3 Ų66.358%0.57740%0.397SS*.SBendtrans-64.3-6.517600000114.4N250N250-G285 PolarHBondContact N-O 3Å; N250-G285 PolarHBondContact ND2-O 3.44Å
286E78.8Confident76.1Confident97 Ų9771.1 Ų71.145%0.45343%0.426SS..EExtended strand (participates in β ladder)trans-126.8147.7-172.3-61.7156.5126.100111.5L247 V248 N250 A284L247-E286 HydrophobicContact CB-CB 4.44Å; L247-E286 HydrophobicContact CD2-CB 4.1Å; V248-E286 CarbonylContact O-C 3.56Å; V248-E286 WeakPolarHBondContact O-CA 3.32Å; N250-E286 VanDerWaalsContact ND2-C 3.35Å; N250-E286 PolarHBondContact ND2-N 3.18Å; N250-E286 VanDerWaalsContact ND2-N 3.17Å; A284-E286 PolarHBondContact O-N 3.08Å
287R81.3Confident76.3Confident54 Ų5465.6 Ų65.620%0.20441%0.405CS..EExtended strand (participates in β ladder)trans-109.6140.5170.5-60.6-163.1-174.5178.2-1.6110.1V248 N250V248-R287 PolarHBondContact N-O 3.47Å; V248-R287 PolarHBondContact O-N 3.36Å; N250-R287 VanDerWaalsContact OD1-CG 3.3Å; N250-R287 WeakPolarHBondContact OD1-CG 3.25Å; N250-R287 PolarHBondContact OD1-NE 3.47Å
288H80.3Confident76.5Confident95 Ų9563.6 Ų63.644%0.4440%0.395SS..EExtended strand (participates in β ladder)trans-82.1131.8175.2-64.267.8000109.5G278G278-H288 PolarHBondContact N-O 3.28Å
289V86.6Confident76.9Confident2 Ų264.9 Ų64.91%0.01240%0.403CS..EExtended strand (participates in β ladder)trans-119.6118.9172.2-178.30000108.2E245 F246 V248 I253 I275 I277 I291 I305E245-V289 WeakPolarHBondContact CA-O 3.43Å; F246-V289 HydrophobicContact CD1-CB 4.19Å; F246-V289 VanDerWaalsContact CD1-O 3.3Å; F246-V289 WeakPolarHBondContact CD1-O 3.37Å; F246-V289 HydrophobicContact CE1-CB 3.59Å; F246-V289 HydrophobicContact CE1-CG1 3.64Å; F246-V289 HydrophobicContact CZ-CB 3.84Å; F246-V289 HydrophobicContact CZ-CG1 3.94Å; F246-V289 HydrophobicContact CZ-CG2 4.46Å; F246-V289 PolarHBondContact N-O 3.22Å; F246-V289 VanDerWaalsContact N-O 3.07Å; F246-V289 PolarHBondContact O-N 3.5Å; V248-V289 HydrophobicContact CB-CG2 4.5Å; V248-V289 HydrophobicContact CG2-CG2 3.95Å; I253-V289 HydrophobicContact CD1-CG2 4.02Å; I275-V289 HydrophobicContact CG2-CG1 3.57Å; I277-V289 HydrophobicContact CG1-CG1 4.48Å; I277-V289 HydrophobicContact CG1-CG2 4.35Å; I277-V289 HydrophobicContact CG2-CG2 4.43Å; V289-I291 HydrophobicContact CG1-CG1 4.46Å; V289-I305 HydrophobicContact CG1-CD1 4.43Å
290T86.1Confident77.6Confident51 Ų5160.6 Ų60.631%0.31338%0.379SS..EExtended strand (participates in β ladder)trans-100.4124.2177.4-45.60000109.1I275 K276I275-T290 CarbonylContact C-O 3.56Å; I275-T290 WeakPolarHBondContact CA-O 3.35Å; K276-T290 PolarHBondContact N-O 3.01Å; K276-T290 PolarHBondContact O-N 3.38Å
291I90.5Very high78.9Confident2 Ų255.8 Ų55.81%0.0136%0.357CS..EExtended strand (participates in β ladder)trans-111.9121.5176.1-49.7177.5000108.2S243 Q244 F246 A273 I275 V289 I298 A301 Q302 I305S243-I291 CarbonylContact C-O 3.58Å; S243-I291 WeakPolarHBondContact CA-O 3.35Å; Q244-I291 PolarHBondContact N-O 2.97Å; Q244-I291 PolarHBondContact O-N 2.89Å; F246-I291 HydrophobicContact CD1-CD1 4.26Å; F246-I291 HydrophobicContact CD1-CG1 4.5Å; F246-I291 HydrophobicContact CE1-CD1 3.55Å; F246-I291 HydrophobicContact CE1-CG1 3.86Å; F246-I291 HydrophobicContact CZ-CD1 4.31Å; A273-I291 HydrophobicContact CB-CG2 3.56Å; I275-I291 HydrophobicContact CG1-CG1 4.25Å; I275-I291 HydrophobicContact CG1-CG2 4.06Å; I275-I291 HydrophobicContact CG2-CG1 4.42Å; V289-I291 HydrophobicContact CG1-CG1 4.46Å; I291-I298 HydrophobicContact CB-CG2 4.48Å; I291-I298 HydrophobicContact CG2-CB 4.36Å; I291-I298 HydrophobicContact CG2-CG1 3.98Å; I291-I298 HydrophobicContact CG2-CG2 4.36Å; I291-A301 HydrophobicContact CD1-CB 3.82Å; I291-A301 HydrophobicContact CG2-CB 3.89Å; I291-Q302 HydrophobicContact CD1-CB 4.46Å; I291-I305 HydrophobicContact CD1-CD1 4.17Å
292T88.3Confident80.6Confident44 Ų4456.1 Ų56.127%0.2735%0.347SS..EExtended strand (participates in β ladder)trans-115.5132.2174.7-58.60000110S242 S243 H274S242-T292 WeakPolarHBondContact O-CA 3.42Å; S243-T292 WeakPolarHBondContact OG-CG2 3.44Å; S243-T292 PolarHBondContact OG-OG1 3.31Å; H274-T292 WeakPolarHBondContact CB-O 3.35Å; H274-T292 PolarHBondContact N-O 2.83Å; H274-T292 PolarHBondContact O-N 3.39Å
293G89.4Confident82.2Confident11 Ų1152.8 Ų52.811%0.11333%0.327CS..EExtended strand (participates in β ladder)trans166.9-165.9179.500000113.7T241 S242 I298T241-G293 CarbonylContact C-O 3.59Å; T241-G293 WeakPolarHBondContact CA-O 3.48Å; S242-G293 PolarHBondContact N-O 3.49Å; S242-G293 PolarHBondContact O-N 2.91Å; G293-I298 WeakPolarHBondContact O-CD1 3.47Å
294S88.3Confident83.7Confident28 Ų2849.8 Ų49.820%0.19629%0.29CS..  trans-64.3153.3170.1840000110.5V296 S297 I298S294-V296 PolarHBondContact O-N 3.34Å; S294-V296 PolarHBondContact OG-N 3.31Å; S294-S297 WeakPolarHBondContact O-CB 3.21Å; S294-S297 PolarHBondContact O-N 3.18Å; S294-S297 WeakPolarHBondContact OG-CB 3.46Å; S294-S297 PolarHBondContact OG-N 3.06Å; S294-S297 PolarHBondContact OG-OG 3.25Å; S294-I298 WeakPolarHBondContact O-CG1 3.44Å; S294-I298 PolarHBondContact O-N 3.13Å
295P83Confident85.2Confident84 Ų8447.8 Ų47.855%0.54527%0.273SS..Hα-helixtrans-57.6-31.9176.822.2-33.4000112.8A299P295-A299 WeakPolarHBondContact O-CB 3.22Å; P295-A299 PolarHBondContact O-N 2.9Å; P295-A299 VanDerWaalsContact O-N 3.08Å
296V84.1Confident86.2Confident103 Ų10348.4 Ų48.462%0.62427%0.266SS*.Hα-helixtrans-67.8-45.6174.1-178.60000111S294 I298 A299 L300S294-V296 PolarHBondContact O-N 3.34Å; S294-V296 PolarHBondContact OG-N 3.31Å; V296-I298 PolarHBondContact O-N 3.11Å; V296-A299 PolarHBondContact O-N 3.44Å; V296-L300 WeakPolarHBondContact O-CB 3.33Å; V296-L300 PolarHBondContact O-N 3.31Å
297S87.9Confident86.5Confident23 Ų2345.4 Ų45.416%0.16126%0.257CS..Hα-helixtrans-62.9-40.7177.3-58.40000112.2S271 S294 L300 A301S271-S297 WeakPolarHBondContact O-CA 3.38Å; S271-S297 WeakPolarHBondContact O-CB 3.35Å; S271-S297 PolarHBondContact O-OG 3.26Å; S294-S297 WeakPolarHBondContact O-CB 3.21Å; S294-S297 PolarHBondContact O-N 3.18Å; S294-S297 WeakPolarHBondContact OG-CB 3.46Å; S294-S297 PolarHBondContact OG-N 3.06Å; S294-S297 PolarHBondContact OG-OG 3.25Å; S297-L300 PolarHBondContact O-N 3.07Å; S297-A301 WeakPolarHBondContact O-CB 3.32Å; S297-A301 PolarHBondContact O-N 2.97Å
298I88.9Confident86.4Confident4 Ų443.7 Ų43.72%0.02125%0.254CS..Hα-helixtrans-65.4-47.8177.8-64.9163.2000110.6S242 Q244 I291 G293 S294 V296 L300 A301 Q302S242-I298 WeakPolarHBondContact O-CD1 3.46Å; Q244-I298 HydrophobicContact CB-CG2 3.87Å; I291-I298 HydrophobicContact CB-CG2 4.48Å; I291-I298 HydrophobicContact CG2-CB 4.36Å; I291-I298 HydrophobicContact CG2-CG1 3.98Å; I291-I298 HydrophobicContact CG2-CG2 4.36Å; G293-I298 WeakPolarHBondContact O-CD1 3.47Å; S294-I298 WeakPolarHBondContact O-CG1 3.44Å; S294-I298 PolarHBondContact O-N 3.13Å; V296-I298 PolarHBondContact O-N 3.11Å; I298-L300 VanDerWaalsContact C-N 3.31Å; I298-L300 PolarHBondContact O-N 3.04Å; I298-A301 PolarHBondContact O-N 3.36Å; I298-Q302 WeakPolarHBondContact O-CB 3.38Å; I298-Q302 PolarHBondContact O-N 2.94Å
299A85.7Confident86.5Confident57 Ų5740.6 Ų40.647%0.47124%0.24SC..Hα-helixtrans-59.4-41.9177.600000111.9P295 V296 Q302 Y303P295-A299 WeakPolarHBondContact O-CB 3.22Å; P295-A299 PolarHBondContact O-N 2.9Å; P295-A299 VanDerWaalsContact O-N 3.08Å; V296-A299 PolarHBondContact O-N 3.44Å; A299-Q302 PolarHBondContact O-N 3.17Å; A299-Y303 WeakPolarHBondContact O-CB 3.39Å; A299-Y303 PolarHBondContact O-N 3.06Å
300L87.8Confident86.2Confident60 Ų6046.4 Ų46.431%0.31427%0.267SS..Hα-helixtrans-64.5-46.8176.6-154.6173.6000111.2V296 S297 I298 Y303 L304V296-L300 WeakPolarHBondContact O-CB 3.33Å; V296-L300 PolarHBondContact O-N 3.31Å; S297-L300 PolarHBondContact O-N 3.07Å; I298-L300 VanDerWaalsContact C-N 3.31Å; I298-L300 PolarHBondContact O-N 3.04Å; L300-Y303 PolarHBondContact O-N 3.06Å; L300-L304 HydrophobicContact CD2-CD1 3.39Å; L300-L304 HydrophobicContact CD2-CG 3.8Å; L300-L304 WeakPolarHBondContact O-CG 3.44Å; L300-L304 PolarHBondContact O-N 2.94Å
301A87.9Confident85.6Confident0 Ų048.6 Ų48.60%028%0.28CS..Hα-helixtrans-60.7-45.8175.900000112.4A273 I275 I291 S297 I298 Y303 L304 I305A273-A301 HydrophobicContact CB-CB 3.97Å; I275-A301 HydrophobicContact CD1-CB 3.92Å; I275-A301 HydrophobicContact CG1-CB 4.33Å; I291-A301 HydrophobicContact CD1-CB 3.82Å; I291-A301 HydrophobicContact CG2-CB 3.89Å; S297-A301 WeakPolarHBondContact O-CB 3.32Å; S297-A301 PolarHBondContact O-N 2.97Å; I298-A301 PolarHBondContact O-N 3.36Å; A301-Y303 PolarHBondContact O-N 3.01Å; A301-L304 PolarHBondContact O-N 3.45Å; A301-I305 VanDerWaalsContact O-CG1 3.25Å; A301-I305 WeakPolarHBondContact O-CG1 3.49Å; A301-I305 PolarHBondContact O-N 3.25Å
302Q88.8Confident84.4Confident73 Ų7348.9 Ų48.934%0.34128%0.283SS..Hα-helixtrans-61.4-43.3177.7-173.4-178.67.800111.4I291 I298 A299 I305 T306I291-Q302 HydrophobicContact CD1-CB 4.46Å; I298-Q302 WeakPolarHBondContact O-CB 3.38Å; I298-Q302 PolarHBondContact O-N 2.94Å; A299-Q302 PolarHBondContact O-N 3.17Å; Q302-I305 PolarHBondContact O-N 2.8Å; Q302-T306 WeakPolarHBondContact O-CB 3.5Å; Q302-T306 PolarHBondContact O-N 3Å; Q302-T306 PolarHBondContact O-OG1 3.45Å
303Y85.5Confident83.3Confident130 Ų13054 Ų5451%0.5130%0.302SS..Hα-helixtrans-60.6-50.9175.3175.2-100.6000112.1A299 L300 A301 I305 T306 A307A299-Y303 WeakPolarHBondContact O-CB 3.39Å; A299-Y303 PolarHBondContact O-N 3.06Å; L300-Y303 PolarHBondContact O-N 3.06Å; A301-Y303 PolarHBondContact O-N 3.01Å; Y303-I305 VanDerWaalsContact C-N 3.31Å; Y303-I305 PolarHBondContact O-N 2.98Å; Y303-T306 PolarHBondContact O-N 3.21Å; Y303-A307 WeakPolarHBondContact O-CB 3.32Å; Y303-A307 PolarHBondContact O-N 3.05Å
304L86.9Confident81.6Confident28 Ų2858.4 Ų58.415%0.14733%0.331CS..Hα-helixtrans-60.8-39.1179.7-73.9174.4000112.7I267 M270 L300 A301 C308I267-L304 HydrophobicContact CB-CD1 4.46Å; I267-L304 HydrophobicContact CG1-CB 4.07Å; I267-L304 HydrophobicContact CG1-CD1 4.43Å; I267-L304 HydrophobicContact CG2-CB 3.94Å; I267-L304 HydrophobicContact CG2-CD1 4.13Å; M270-L304 HydrophobicContact CB-CD1 3.75Å; M270-L304 HydrophobicContact CE-CD1 4.42Å; M270-L304 HydrophobicContact CE-CD2 4.19Å; M270-L304 HydrophobicContact SD-CD1 4.19Å; M270-L304 HydrophobicContact SD-CD2 4.48Å; L300-L304 HydrophobicContact CD2-CD1 3.39Å; L300-L304 HydrophobicContact CD2-CG 3.8Å; L300-L304 WeakPolarHBondContact O-CG 3.44Å; L300-L304 PolarHBondContact O-N 2.94Å; A301-L304 PolarHBondContact O-N 3.45Å; L304-C308 PolarHBondContact O-N 3.43Å; L304-C308 VanDerWaalsContact O-N 3.1Å; L304-C308 PolarHBondContact O-SG 2.85Å
305I88.3Confident80.1Confident1 Ų162.5 Ų62.51%0.00536%0.355CS..Hα-helixtrans-67.7-43.8176.9-65.3166.2000110F246 V256 I267 I275 V289 I291 A301 Q302 Y303 A307 C308 L309F246-I305 HydrophobicContact CE1-CD1 4.28Å; F246-I305 HydrophobicContact CE2-CG2 3.8Å; F246-I305 HydrophobicContact CZ-CB 4.16Å; F246-I305 HydrophobicContact CZ-CD1 3.71Å; F246-I305 HydrophobicContact CZ-CG2 3.7Å; V256-I305 HydrophobicContact CG1-CB 4.29Å; V256-I305 HydrophobicContact CG1-CG1 3.96Å; V256-I305 HydrophobicContact CG1-CG2 3.71Å; V256-I305 HydrophobicContact CG2-CG2 3.99Å; I267-I305 HydrophobicContact CD1-CG1 4.2Å; I267-I305 HydrophobicContact CG2-CD1 4.43Å; I267-I305 HydrophobicContact CG2-CG1 4.01Å; I275-I305 HydrophobicContact CD1-CD1 4.42Å; I275-I305 HydrophobicContact CG2-CD1 4.43Å; V289-I305 HydrophobicContact CG1-CD1 4.43Å; I291-I305 HydrophobicContact CD1-CD1 4.17Å; A301-I305 VanDerWaalsContact O-CG1 3.25Å; A301-I305 WeakPolarHBondContact O-CG1 3.49Å; A301-I305 PolarHBondContact O-N 3.25Å; Q302-I305 PolarHBondContact O-N 2.8Å; Y303-I305 VanDerWaalsContact C-N 3.31Å; Y303-I305 PolarHBondContact O-N 2.98Å; I305-A307 PolarHBondContact O-N 2.88Å; I305-C308 PolarHBondContact O-N 3.09Å; I305-L309 HydrophobicContact CG2-CD1 4.22Å; I305-L309 HydrophobicContact CG2-CG 4.49Å; I305-L309 WeakPolarHBondContact O-CG 3.36Å; I305-L309 PolarHBondContact O-N 2.8Å
306T86.6Confident78.4Confident70 Ų7061.7 Ų61.743%0.42935%0.351SS..Hα-helixtrans-60.9-43.4177.1-53.70000111.8Q302 Y303 C308 L309 E310Q302-T306 WeakPolarHBondContact O-CB 3.5Å; Q302-T306 PolarHBondContact O-N 3Å; Q302-T306 PolarHBondContact O-OG1 3.45Å; Y303-T306 PolarHBondContact O-N 3.21Å; T306-C308 VanDerWaalsContact C-N 3.33Å; T306-C308 PolarHBondContact O-N 2.98Å; T306-L309 WeakPolarHBondContact O-CB 3.42Å; T306-L309 PolarHBondContact O-N 3.3Å; T306-L309 VanDerWaalsContact O-N 3.15Å; T306-E310 PolarHBondContact O-N 3.39Å
307A83.5Confident76.2Confident34 Ų3460.1 Ų60.128%0.28136%0.356SS..Hα-helixtrans-63-36.417600000112.8Y303 I305 E310 T311Y303-A307 WeakPolarHBondContact O-CB 3.32Å; Y303-A307 PolarHBondContact O-N 3.05Å; I305-A307 PolarHBondContact O-N 2.88Å; A307-E310 PolarHBondContact O-N 3.21Å; A307-T311 WeakPolarHBondContact O-CB 3.3Å; A307-T311 PolarHBondContact O-N 2.85Å; A307-T311 PolarHBondContact O-OG1 2.79Å
308C80.8Confident73.6Confident18 Ų1862 Ų6212%0.12238%0.379CS..Hα-helixtrans-67.6-37173.4-66.70000112.1V256 L304 I305 T306 A312V256-C308 HydrophobicContact CG2-CB 4.14Å; L304-C308 PolarHBondContact O-N 3.43Å; L304-C308 VanDerWaalsContact O-N 3.1Å; L304-C308 PolarHBondContact O-SG 2.85Å; I305-C308 PolarHBondContact O-N 3.09Å; T306-C308 VanDerWaalsContact C-N 3.33Å; T306-C308 PolarHBondContact O-N 2.98Å; C308-A312 WeakPolarHBondContact O-CB 3.33Å; C308-A312 PolarHBondContact O-N 2.74Å
309L81.5Confident70.9Confident29 Ų2968.1 Ų68.115%0.15242%0.417CS..Hα-helixtrans-67.7-40174.6-65.2172.5000112.2V248 L252 V256 I305 T306 A312 K313V248-L309 HydrophobicContact CG1-CD1 4.07Å; V248-L309 HydrophobicContact CG1-CD2 3.59Å; V248-L309 HydrophobicContact CG1-CG 4.43Å; V248-L309 HydrophobicContact CG2-CD1 4.4Å; L252-L309 HydrophobicContact CB-CD2 3.36Å; L252-L309 HydrophobicContact CD1-CD2 4.25Å; L252-L309 HydrophobicContact CG-CD2 4.46Å; V256-L309 HydrophobicContact CG2-CD2 3.46Å; V256-L309 VanDerWaalsContact CG2-CD2 3.46Å; V256-L309 HydrophobicContact CG2-CG 3.78Å; I305-L309 HydrophobicContact CG2-CD1 4.22Å; I305-L309 HydrophobicContact CG2-CG 4.49Å; I305-L309 WeakPolarHBondContact O-CG 3.36Å; I305-L309 PolarHBondContact O-N 2.8Å; T306-L309 WeakPolarHBondContact O-CB 3.42Å; T306-L309 PolarHBondContact O-N 3.3Å; T306-L309 VanDerWaalsContact O-N 3.15Å; L309-A312 PolarHBondContact O-N 2.84Å; L309-K313 WeakPolarHBondContact O-CB 3.32Å; L309-K313 PolarHBondContact O-N 2.82Å
310E79.4Confident68.7Low124 Ų12471.7 Ų71.758%0.57944%0.435SS*.Hα-helixtrans-65.5-45.2177.1-169.6166.696.600111.4T306 A307 A312 K313 S314T306-E310 PolarHBondContact O-N 3.39Å; A307-E310 PolarHBondContact O-N 3.21Å; E310-A312 VanDerWaalsContact C-N 3.29Å; E310-A312 PolarHBondContact O-N 2.82Å; E310-K313 WeakPolarHBondContact O-CB 3.41Å; E310-K313 PolarHBondContact O-N 3.07Å; E310-K313 VanDerWaalsContact O-N 3.17Å; E310-S314 PolarHBondContact O-N 2.84Å; E310-S314 VanDerWaalsContact O-N 3.15Å; E310-S314 PolarHBondContact O-OG 2.91Å
311T74.6Confident66.1Low97 Ų9772.2 Ų72.260%0.59545%0.454SS*.Hα-helixtrans-59.2-39.9174.3-53.50000112A307 S314 T315A307-T311 WeakPolarHBondContact O-CB 3.3Å; A307-T311 PolarHBondContact O-N 2.85Å; A307-T311 PolarHBondContact O-OG1 2.79Å; T311-S314 PolarHBondContact O-N 3.21Å; T311-T315 PolarHBondContact O-N 2.88Å; T311-T315 PolarHBondContact O-OG1 3.17Å
312A65.7Low63.5Low8 Ų877.5 Ų77.57%0.06649%0.492CS..Hα-helixtrans-65.6-42.5176.200000112.1L252 C255 C308 L309 E310 S314 T315 S316L252-A312 HydrophobicContact CD2-CB 3.93Å; C255-A312 HydrophobicContact CB-CB 3.57Å; C255-A312 VanDerWaalsContact SG-CB 3.57Å; C308-A312 WeakPolarHBondContact O-CB 3.33Å; C308-A312 PolarHBondContact O-N 2.74Å; L309-A312 PolarHBondContact O-N 2.84Å; E310-A312 VanDerWaalsContact C-N 3.29Å; E310-A312 PolarHBondContact O-N 2.82Å; A312-S314 VanDerWaalsContact C-N 3.26Å; A312-S314 PolarHBondContact O-N 3.02Å; A312-T315 WeakPolarHBondContact O-CA 3.41Å; A312-T315 WeakPolarHBondContact O-CB 3.3Å; A312-T315 PolarHBondContact O-N 2.98Å; A312-S316 PolarHBondContact O-N 3.1Å; A312-S316 PolarHBondContact O-OG 2.77Å
313K64.1Low61.1Low153 Ų15378.6 Ų78.667%0.66551%0.513SS*.Hα-helixtrans-62.8-29.2177.8-173174.5179.7178.50113.2L309 E310 T315L309-K313 WeakPolarHBondContact O-CB 3.32Å; L309-K313 PolarHBondContact O-N 2.82Å; E310-K313 WeakPolarHBondContact O-CB 3.41Å; E310-K313 PolarHBondContact O-N 3.07Å; E310-K313 VanDerWaalsContact O-N 3.17Å; K313-T315 VanDerWaalsContact C-N 3.29Å
314S55.2Low59Low103 Ų10378.4 Ų78.472%0.7253%0.527SS*.Hα-helixtrans-72-22170.7-53.80000113.6E310 T311 A312E310-S314 PolarHBondContact O-N 2.84Å; E310-S314 VanDerWaalsContact O-N 3.15Å; E310-S314 PolarHBondContact O-OG 2.91Å; T311-S314 PolarHBondContact O-N 3.21Å; A312-S314 VanDerWaalsContact C-N 3.26Å; A312-S314 PolarHBondContact O-N 3.02Å
315T55.5Low56.8Low114 Ų11481.4 Ų81.470%0.69956%0.556SS**Hα-helixtrans-92.8-33.6-179.4-63.80000112.5T311 A312 K313 G317T311-T315 PolarHBondContact O-N 2.88Å; T311-T315 PolarHBondContact O-OG1 3.17Å; A312-T315 WeakPolarHBondContact O-CA 3.41Å; A312-T315 WeakPolarHBondContact O-CB 3.3Å; A312-T315 PolarHBondContact O-N 2.98Å; K313-T315 VanDerWaalsContact C-N 3.29Å; T315-G317 VanDerWaalsContact C-N 3.26Å; T315-G317 PolarHBondContact O-N 3.04Å
316S46.8Very low54.1Low67 Ų6788 Ų8847%0.46959%0.591SS.*THydrogen-bonded Turntrans-815.5-178.657.40000115.2A312A312-S316 PolarHBondContact O-N 3.1Å; A312-S316 PolarHBondContact O-OG 2.77Å
317G39.6Very low52Low70 Ų7091.5 Ų91.572%0.72261%0.607SS**THydrogen-bonded Turntrans-83.4-0.2175.500000115.8T315T315-G317 VanDerWaalsContact C-N 3.26Å; T315-G317 PolarHBondContact O-N 3.04Å
318G32.9Very low50.2Low63 Ų6395.4 Ų95.465%0.64963%0.629SS**  trans-89.6122178.800000112.6
319T32.4Very low48.4Very low132 Ų13298.9 Ų98.981%0.8166%0.66SS**  trans-65.9144176.9390000112.8G321T319-G321 PolarHBondContact O-N 3.47Å
320P39.2Very low46.5Very low132 Ų132103 Ų10386%0.85769%0.688SS**  trans-7693.7171.230.8-32.3000110.1S322P320-S322 PolarHBondContact O-N 3.33Å
321G32.1Very low44.2Very low70 Ų70106.6 Ų106.672%0.72270%0.702SS**  trans-73.9113.7175.200000112.6T319T319-G321 PolarHBondContact O-N 3.47Å
322S33.6Very low42.6Very low112 Ų112107.5 Ų107.578%0.78371%0.712SS**  trans-23.9130.9167.851.70000117.5P320P320-S322 PolarHBondContact O-N 3.33Å
323A39.1Very low41.7Very low95 Ų95113 Ų11379%0.78575%0.747SS**  trans-64.5159.715600000111.4
324P42.1Very low41.2Very low126 Ų126111.2 Ų111.282%0.81875%0.751SS**  -128.3140.7125.735.4-28.6000112.2
325A39.8Very low40.2Very low91 Ų91114 Ų11475%0.75276%0.758SS**  trans-91.7140.7159.600000108.7
326D32.2Very low39.1Very low139 Ų139114.4 Ų114.474%0.74376%0.76SS**  168119.2102.3-151.5-120.3000112.9
327L42.1Very low38.5Very low144 Ų144115.6 Ų115.675%0.75477%0.774SS**  trans49.1164.7148.1-65.5176.3000123.2
328P46.2Very low38.4Very low116 Ų116120.3 Ų120.375%0.75378%0.781SS**  cis-123.2179.7-12.833-13.5000114.8
329A43.4Very low38.7Very low92 Ų92122.5 Ų122.576%0.7678%0.784SS**  trans-72.5167.5179.100000114.8
330P41.5Very low38.8Very low114 Ų114122.6 Ų122.674%0.7479%0.785SS**  -145.2150.6109.529.5-10.6000117.6
331F31.3Very low38.7Very low201 Ų201121 Ų12188%0.88278%0.782SS**  trans65.6115.4145.6-84.1-112.3000122.1
332S40.4Very low39.3Very low116 Ų116123.5 Ų123.581%0.81179%0.786SS**  trans-123.1145.5152.4-47.90000109.3
333P47.3Very low40.1Very low123 Ų123124.7 Ų124.780%0.79979%0.791SS**  trans-109.8156.8157.235.2-27.7000112.4
334P52.4Low39.7Very low115 Ų115123.9 Ų123.975%0.74779%0.792SS**  trans-109.1159-165.140.1-33.7000115.4
335L34.3Very low39.3Very low163 Ų163125.9 Ų125.985%0.85380%0.795SS**  trans-160.593.5158.1-121.9147.1000109.5
336T33.5Very low39.1Very low121 Ų121129.5 Ų129.574%0.74280%0.801SS**  70.3129.487-36.50000115.8
337A33.5Very low39Very low92 Ų92126.4 Ų126.476%0.7680%0.802SS**  trans76.9104.9160.100000120.3
338L36.6Very low38.8Very low169 Ų169126.1 Ų126.189%0.88581%0.806SS**  trans-85.9150.3150.3-144.189.9000109.4
339P39.6Very low39.2Very low110 Ų110125.7 Ų125.771%0.71480%0.804SS**  trans-131123.1146.225.8-8.6000113.9
340T35Very low38.6Very low133 Ų133131.8 Ų131.882%0.81681%0.808SS**  trans22.5123.8139.752.80000120.6
341A37.1Very low38.1Very low98 Ų98130.1 Ų130.181%0.8180%0.804SS**  trans-112.3142.3159.800000111.4
342P43.7Very low38.1Very low124 Ų124128 Ų12881%0.80580%0.8SS**  trans-97163.6169.936.8-32.2000113.1
343P51.1Low37.8Very low136 Ų136127.3 Ų127.388%0.88380%0.796SS**  trans-107161.3-169.339.7-34.6000116.1
344G31.2Very low37Very low78 Ų78128.7 Ų128.780%0.80480%0.795SS**  trans134.7157.7169.500000112.7
345L32.8Very low36.3Very low168 Ų168128 Ų12888%0.8879%0.794SS**  cis-159.5157.3-14.5-169.9138.4000108.5
346L36.4Very low36.2Very low168 Ų168125.7 Ų125.788%0.8878%0.782SS**  trans-20.2136.9173.9-161.674.6000119.3
347G29.3Very low36.3Very low74 Ų74128.9 Ų128.976%0.76379%0.786SS**  trans161.5129.2157.300000117.8
348T37.8Very low36.5Very low138 Ų138130.3 Ų130.385%0.84778%0.779SS**  trans-116.7175.9159.160.50000108.1
349P55.9Low36.2Very low107 Ų107125.5 Ų125.570%0.69577%0.77SS**  cis-128.5-162.6-15.426.3-1.3000112.7
350Y30.2Very low36Very low220 Ų220128.8 Ų128.886%0.86378%0.781SS**  trans81.1108.3162.3-91.8-99.7000122.1
351A29.8Very low36Very low78 Ų78131.6 Ų131.665%0.64578%0.782SS**  74.1160.1121.700000124.3
352I32.2Very low36.7Very low157 Ų157131.5 Ų131.581%0.80577%0.773SS**  trans69.999.2165.2-34.6-176.1000114.6
353S33.7Very low36.7Very low102 Ų102131.9 Ų131.971%0.71377%0.773SS**  67.4116.370.6-168.40000115.5
354L31.6Very low36.9Very low152 Ų152130.9 Ų130.980%0.79677%0.766SS**  trans178.2131.7130.1-96165.3000111.2
355S36.1Very low36.9Very low101 Ų101135.7 Ų135.771%0.70677%0.765SS**  trans28.4152.2138.4-43.70000121.2
356N33.9Very low36.9Very low113 Ų113134.3 Ų134.360%0.60476%0.758SS**  cis-170.3139.932.4-159.524.7000112.2I358N356-I358 WeakPolarHBondContact ND2-CD1 3.44Å
357F34.6Very low36.7Very low188 Ų188129.6 Ų129.683%0.82574%0.743SS**  trans-175.298.1139.1-114.4-83000105.7
358I38.3Very low36.9Very low123 Ų123134 Ų13463%0.63175%0.748SS**  56111.484.1-61.1167.9000110.9N356N356-I358 WeakPolarHBondContact ND2-CD1 3.44Å
359G30.3Very low37.4Very low67 Ų67132.6 Ų132.669%0.69174%0.742SS**  cis160.6160-8.900000113
360L35.5Very low37.6Very low180 Ų180133.2 Ų133.294%0.94275%0.746SS**  trans-149.5143.8150.8-102.8164.9000107.9
361K35.5Very low37.6Very low192 Ų192127.5 Ų127.584%0.83574%0.744SS**  trans-154.4166.7-158.7-113.9-166.5168.3177.70107.2
362P49.9Very low37.9Very low95 Ų95129.3 Ų129.362%0.61775%0.752SS**  -148.8-160.8-53.837.6-15.2000114.2
363V45.6Very low38.5Very low132 Ų132127.6 Ų127.680%0.875%0.751SS**  trans89.2147144.9-70.90000123.5
364P55.3Low38.4Very low115 Ų115126.5 Ų126.575%0.74776%0.756SS**  trans-135-160.3-156.745.1-24.6000113.8
365F29.7Very low39.1Very low180 Ų180125 Ų12579%0.78976%0.756SS**  trans-153.7120.1158.5-142.7-121.1000110.6
366L32.7Very low40Very low138 Ų138125.8 Ų125.872%0.72376%0.758SS**  67.4145.4112.3-117.885.2000116
367A32.5Very low40.5Very low69 Ų69126.6 Ų126.657%0.5777%0.769SS**  cis-162.2155.22.600000113
368L34.4Very low40.3Very low166 Ų166121 Ų12187%0.86977%0.765SS**  trans66154.9142.7-68.4162.7000123.5
369P47.2Very low40Very low109 Ų109123.7 Ų123.771%0.70878%0.779SS**  trans-123.9-139.7-175.634.6-9.5000111.5
370P60.7Low40.1Very low120 Ų120124.8 Ų124.878%0.77978%0.782SS**  -120.2165.1-72.732.1-15.8000114.3
371A30.5Very low39.7Very low100 Ų100120.5 Ų120.583%0.82677%0.773SS**  trans-160.3148.6157.200000113.8
372S35.5Very low39.7Very low116 Ų116122 Ų12281%0.81178%0.775SS**  trans-123.6-161.3166.5-41.40000108
373P45.1Very low39Very low121 Ų121123.9 Ų123.979%0.78679%0.785SS**  cis-136.1151.9-28.531.9-12.7000115.8
374G30.8Very low38.4Very low79 Ų79121.7 Ų121.781%0.81478%0.781SS**  trans60-170.5157.900000118.9
375P46.4Very low37.4Very low122 Ų122126.3 Ų126.379%0.79279%0.789SS**  cis-130.5-179.1-24.440.3-23.2000114
376P55.3Low37.7Very low117 Ų117126.7 Ų126.776%0.7680%0.796SS**  trans-81.3-177.3164.536.9-38000112
377P45.3Very low37.5Very low130 Ų130124.5 Ų124.584%0.84480%0.797SS**  cis-143.9-169.116.944-23.3000117.3
378G30.3Very low37.7Very low71 Ų71126 Ų12673%0.73281%0.81SS**  trans129.7110.4143.800000122.6
379L31.3Very low37.8Very low178 Ų178122.7 Ų122.793%0.93281%0.806SS**  trans54.6137.1136.9-86.3157.9000126.3
380A32.1Very low37.1Very low91 Ų91125.4 Ų125.475%0.75282%0.815SS**  trans88.9124.5144.600000122.7
381A28.4Very low35.8Very low90 Ų90123 Ų12374%0.74481%0.812SS**  trans12.1139.6144.100000119.6
382Y34.1Very low36.1Very low222 Ų222123.5 Ų123.587%0.87181%0.809SS**  cis-152.8-174.744.841.7-114.5000112
383T35.9Very low36.2Very low136 Ų136127.6 Ų127.683%0.83481%0.812SS**  cis-152.4-158.121.6-167.30000113.8
384A33.7Very low35.8Very low86 Ų86131.2 Ų131.271%0.71182%0.816SS**  trans-90149.5-159.300000119.3
385K33.8Very low36.4Very low211 Ų211132 Ų13292%0.91782%0.815SS**  -159.8146.4111.2-135.6165.6-178174.40112.7
386M35Very low36.2Very low189 Ų189134.6 Ų134.693%0.93182%0.816SS**  trans-75.2174.2180-60.5-176.517000112.5
387A29.7Very low35.5Very low91 Ų91139.1 Ų139.175%0.75282%0.818SS**  cis-151.5152.615.700000108.7
388A35.3Very low35.8Very low102 Ų102141.5 Ų141.584%0.84382%0.818SS**  cis100.192.732.700000115.7
389A36.5Very low36.4Very low95 Ų95146.1 Ų146.179%0.78582%0.818SS**  trans-179.8107.7146.300000107.3
390N33.3Very low36.9Very low167 Ų167146.7 Ų146.789%0.89381%0.813SS**  62.4124.763.5-14925.7000112.9
391G33.1Very low37.5Very low70 Ų70147.5 Ų147.572%0.72281%0.813SS**  cis-167.9-171.210.900000116.7
392S37.4Very low39.1Very low109 Ų109148.5 Ų148.576%0.76281%0.812SS**  trans-93.8156.2-166.853.70000115.4
393K37.1Very low39.6Very low203 Ų203152.4 Ų152.488%0.88383%0.828SS**  trans167149.7151.3-95.2154.9-170.21770108.8
394K37.3Very low39.8Very low197 Ų197153.3 Ų153.386%0.85783%0.827SS**  cis-161.3157.1-13.9-161.4-177.1-178.5-169.80106.6
395A43.5Very low40.1Very low96 Ų96156.8 Ų156.879%0.79383%0.833SS**  trans-72.7146172.400000112.2
396E41.8Very low40.4Very low176 Ų176153.8 Ų153.882%0.82283%0.829SS**  trans-135147.3157.8-169.5154.5104.400110.8
397R41.2Very low40.8Very low212 Ų212151.7 Ų151.780%0.882%0.823SS**  trans-133.8100-165.8167.3-169.3164.4-155.30.6107.2
398Q51.8Low41.4Very low179 Ų179155.5 Ų155.584%0.83683%0.827SS**  trans-86.6134.2175.3-78.1-169.4-7.800111.9
399K43Very low41.9Very low168 Ų168159.1 Ų159.173%0.7383%0.826SS**  trans-89.8149.3175.2-81.5175.9172.2-179.20109.4
400F40.3Very low42.2Very low191 Ų191163.6 Ų163.684%0.83883%0.829SS**  26.3130.1123.8-102.5-97.9000116.7
401S44.9Very low42.9Very low107 Ų107163.4 Ų163.475%0.74882%0.824SS**  -169.3172.766.2-57.60000111.1
402P63.2Low43.8Very low112 Ų112171.2 Ų171.273%0.72783%0.832SS**  trans-95.4169.4-168.939.1-35.4000114.3
403Y43.7Very low44.3Very low304 Ų304176.8 Ų176.8100%1.19284%0.839SS**  trans-152.30136.6-126.6-81.3000110.2

Retrieved 403 of 403 residues in 171.4 ms (Link to these results)