X5D2W5_HUMAN Loading...

Ribosomal protein L10 isoform B

AlphaFold DB , UniProt , Accession X5D2W5, Species HUMAN (Homo sapiens, Human), Gene RPL10, Length 159 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
1M49.3Very low77.8Confident174 Ų174108.6 Ų108.686%0.85754%0.539SS*.  0121.70-159.1-175.6-69.800107.6K101M1-K101 HydrophobicContact CE-CB 4.1Å; M1-K101 HydrophobicContact CE-CD 4.04Å; M1-K101 HydrophobicContact CE-CG 4.13Å; M1-K101 HydrophobicContact SD-CB 4.3Å; M1-K101 HydrophobicContact SD-CD 4.31Å; M1-K101 HydrophobicContact SD-CG 3.98Å
2G64.9Low78.3Confident73 Ų73101.6 Ų101.675%0.75351%0.507SS*.PPolyproline II helixtrans-61.5155.8-17800000112.4
3R71.4Confident78.7Confident151 Ų151106.9 Ų106.957%0.5753%0.526SS*.PPolyproline II helixtrans-72.6141.5176.2-61-179109.5-1345.6109.2E63R3-E63 IonicContact CZ-OE1 3.35Å; R3-E63 IonicContact CZ-OE2 3.43Å; R3-E63 IonicContact NH1-OE1 3.38Å; R3-E63 PolarHBondContact NH1-OE1 3.33Å; R3-E63 IonicContact NH1-OE2 2.7Å; R3-E63 PolarHBondContact NH1-OE2 3.13Å; R3-E63 IonicContact NH2-OE1 2.65Å; R3-E63 PolarHBondContact NH2-OE1 3.42Å; R3-E63 IonicContact NH2-OE2 3.32Å; R3-E63 PolarHBondContact NH2-OE2 3.18Å
4R80.7Confident78.9Confident114 Ų114107.9 Ų107.943%0.4353%0.534SS..PPolyproline II helixtrans-66.3145.7172-75.2-170.1177.3176.52.3109.8Y9 I99 N100R4-Y9 HydrophobicContact CB-CE2 4.01Å; R4-Y9 WeakPolarHBondContact CD-OH 3.36Å; R4-I99 HydrophobicContact CB-CD1 4.45Å; R4-I99 HydrophobicContact CG-CD1 4.26Å; R4-N100 PolarHBondContact NH2-O 2.99Å; R4-N100 VanDerWaalsContact NH2-O 3.14Å
5P85.3Confident79.4Confident68 Ų68113.3 Ų113.344%0.44255%0.553SS.*PPolyproline II helixtrans-62147.1178.626.7-34.8000111.1R7 C8P5-R7 HydrophobicContact CB-CG 4.12Å; P5-R7 HydrophobicContact CG-CG 4.03Å; P5-R7 PolarHBondContact O-N 2.88Å; P5-R7 VanDerWaalsContact O-N 3.09Å; P5-C8 WeakPolarHBondContact O-CB 3.41Å; P5-C8 PolarHBondContact O-N 2.9Å; P5-C8 VanDerWaalsContact O-N 3.1Å
6A82.3Confident79.6Confident73 Ų73110.8 Ų110.860%0.60355%0.549SS*.G310 helixtrans-60.6-23.2-175.100000113.6C8 Y9 R10A6-C8 PolarHBondContact O-N 2.76Å; A6-C8 VanDerWaalsContact O-N 3.08Å; A6-Y9 PolarHBondContact O-N 2.72Å; A6-R10 PolarHBondContact O-N 3.14Å
7R84.2Confident79.9Confident208 Ų208108.6 Ų108.679%0.78553%0.533SS*.G310 helixtrans-53.6-29.6173.972.4-176.7-179.1-167.50.4113.7P5 Y9P5-R7 HydrophobicContact CB-CG 4.12Å; P5-R7 HydrophobicContact CG-CG 4.03Å; P5-R7 PolarHBondContact O-N 2.88Å; P5-R7 VanDerWaalsContact O-N 3.09Å; R7-Y9 PolarHBondContact O-N 3.32Å
8C84.3Confident80.3Confident68 Ų68106.3 Ų106.346%0.45953%0.528SS..G310 helixtrans-68.6-23179.2-640000113P5 A6P5-C8 WeakPolarHBondContact O-CB 3.41Å; P5-C8 PolarHBondContact O-N 2.9Å; P5-C8 VanDerWaalsContact O-N 3.1Å; A6-C8 PolarHBondContact O-N 2.76Å; A6-C8 VanDerWaalsContact O-N 3.08Å
9Y84.8Confident80.5Confident38 Ų38106.8 Ų106.815%0.14953%0.526CS..THydrogen-bonded Turntrans-125.44.6-172.8-45.5-63.2000114.2R4 A6 R7 Y11 Q59 I97 I99 L124R4-Y9 HydrophobicContact CB-CE2 4.01Å; R4-Y9 WeakPolarHBondContact CD-OH 3.36Å; A6-Y9 PolarHBondContact O-N 2.72Å; R7-Y9 PolarHBondContact O-N 3.32Å; Y9-Y11 PolarHBondContact O-N 3.26Å; Y9-Y11 VanDerWaalsContact O-N 3.15Å; Y9-Q59 WeakPolarHBondContact O-CB 3.47Å; Y9-Q59 PolarHBondContact O-OE1 3.44Å; Y9-Q59 VanDerWaalsContact O-OE1 3.06Å; Y9-I97 HydrophobicContact CD1-CD1 4.09Å; Y9-I97 HydrophobicContact CD1-CG2 3.44Å; Y9-I97 VanDerWaalsContact CD1-CG2 3.44Å; Y9-I97 HydrophobicContact CD2-CD1 3.5Å; Y9-I97 HydrophobicContact CD2-CG2 4.42Å; Y9-I97 HydrophobicContact CE1-CD1 4.45Å; Y9-I97 HydrophobicContact CE1-CG2 3.22Å; Y9-I97 HydrophobicContact CE2-CD1 3.86Å; Y9-I97 HydrophobicContact CE2-CG2 4.21Å; Y9-I97 HydrophobicContact CG-CD1 3.62Å; Y9-I97 HydrophobicContact CG-CG1 4.46Å; Y9-I97 HydrophobicContact CG-CG2 4.06Å; Y9-I99 WeakPolarHBondContact OH-CD1 3.14Å; Y9-I99 WeakPolarHBondContact OH-CG1 3Å; Y9-L124 VanDerWaalsContact CB-CD1 3.48Å; Y9-L124 HydrophobicContact CG-CD1 4.24Å
10R83.2Confident80.8Confident97 Ų97103.7 Ų103.737%0.36652%0.516SS..SBendtrans-52.8-38.6-178.6-176.8176.3177.8-171.8-7.3113.1A6 E56 E58 Q59A6-R10 PolarHBondContact O-N 3.14Å; R10-E56 IonicContact CZ-OE2 3.03Å; R10-E56 IonicContact NH2-OE1 3.1Å; R10-E56 IonicContact NH2-OE2 3.32Å; R10-E56 PolarHBondContact NH2-OE2 2.95Å; R10-E58 HydrophobicContact CG-CB 4.3Å; R10-E58 IonicContact NE-OE2 2.7Å; R10-E58 CarbonylContact O-C 3.55Å; R10-E58 VanDerWaalsContact O-CA 3.28Å; R10-E58 WeakPolarHBondContact O-CA 3.19Å; R10-E58 WeakPolarHBondContact O-CB 3.4Å; R10-Q59 PolarHBondContact O-N 3.39Å
11Y85.9Confident81Confident131 Ų131109.2 Ų109.251%0.51453%0.531SS..SBendtrans-96.2136.4-174.1-60.5-69000112.8Y9 K13Y9-Y11 PolarHBondContact O-N 3.26Å; Y9-Y11 VanDerWaalsContact O-N 3.15Å; Y11-K13 VanDerWaalsContact C-N 3.3Å; Y11-K13 PolarHBondContact O-N 2.87Å
12C83.6Confident82.7Confident24 Ų24110 Ų11016%0.16253%0.529CS..  trans-76.375.9175.7-48.30000111.8Y57 Q59 N126C12-Y57 HydrophobicContact CB-CD1 4.37Å; C12-Y57 HydrophobicContact CB-CE1 3.42Å; C12-Y57 VanDerWaalsContact CB-CE1 3.42Å; C12-Y57 WeakPolarHBondContact CB-OH 3.14Å; C12-Q59 HydrophobicContact CB-CG 4.11Å; C12-Q59 WeakPolarHBondContact SG-CG 3.21Å; C12-N126 WeakPolarHBondContact CB-OD1 3.34Å; C12-N126 PolarHBondContact SG-OD1 3.31Å
13K82.8Confident83.4Confident171 Ų171106.9 Ų106.974%0.74350%0.496SS*.  trans-86.8-29.9-177.3-62.8179.6179.4-176.70113.7Y11Y11-K13 VanDerWaalsContact C-N 3.3Å; Y11-K13 PolarHBondContact O-N 2.87Å
14N81.9Confident83.9Confident121 Ų121109.4 Ų109.465%0.64751%0.506SS*.SBendtrans-102.2157.8-170.5-65.2-11.7000111.8
15K85.9Confident84Confident189 Ų189107.3 Ų107.382%0.82252%0.52SS*.PPolyproline II helixtrans-59.6145.8169.4-65.7-179.3-179.1-179.40110.2Y17K15-Y17 PolarHBondContact O-N 3.02Å
16P83.9Confident83.9Confident73 Ų73104.7 Ų104.747%0.47450%0.503SS..PPolyproline II helixtrans-56.4131.9176.3-23.233000111.3T129P16-T129 HydrophobicContact CB-CG2 4.29Å; P16-T129 HydrophobicContact CG-CG2 4.37Å
17Y83.4Confident84Confident74 Ų74103.6 Ų103.629%0.2949%0.489SS..  trans-125.891.4-177.2-162.6-112000109.5K15 C23 H95 V96K15-Y17 PolarHBondContact O-N 3.02Å; Y17-C23 HydrophobicContact CE1-CB 3.86Å; Y17-C23 WeakPolarHBondContact CE1-SG 3.3Å; Y17-C23 WeakPolarHBondContact CE2-SG 3.17Å; Y17-C23 PolarHBondContact OH-SG 3.43Å; Y17-H95 PolarHBondContact N-ND1 3.34Å; Y17-V96 HydrophobicContact CD1-CB 4.23Å; Y17-V96 PolarHBondContact O-N 3.29Å
18P87.1Confident84Confident67 Ų6799.9 Ų99.944%0.43549%0.485SS..BIsolated β-bridgetrans-84156.6-176.732.2-34000113S20 C23 F94P18-S20 PolarHBondContact O-N 2.92Å; P18-S20 VanDerWaalsContact O-N 3.15Å; P18-S20 PolarHBondContact O-OG 2.8Å; P18-C23 PolarHBondContact O-SG 3.1Å; P18-C23 VanDerWaalsContact O-SG 3.36Å; P18-F94 WeakPolarHBondContact CA-O 3.45Å
19K84.7Confident84Confident115 Ų11597.6 Ų97.650%0.547%0.471SS..SBendtrans-57119.3165.9-170174.1-176.4177.50108.2V26 D28K19-V26 HydrophobicContact CB-CG2 4.49Å; K19-V26 HydrophobicContact CD-CB 4.18Å; K19-V26 HydrophobicContact CD-CG1 4.36Å; K19-V26 HydrophobicContact CG-CB 4.08Å; K19-V26 HydrophobicContact CG-CG1 4.45Å; K19-V26 HydrophobicContact CG-CG2 4.2Å; K19-D28 IonicContact NZ-OD1 2.88Å; K19-D28 PolarHBondContact NZ-OD1 3.21Å
20S85.9Confident84.2Confident45 Ų45102.4 Ų102.432%0.31549%0.493SS..BIsolated β-bridgetrans-154.4175.3-171.563.50000110.4P18 F22 C23P18-S20 PolarHBondContact O-N 2.92Å; P18-S20 VanDerWaalsContact O-N 3.15Å; P18-S20 PolarHBondContact O-OG 2.8Å; S20-F22 PolarHBondContact O-N 3.25Å; S20-F22 VanDerWaalsContact O-N 3.17Å; S20-C23 CarbonylContact O-C 3.32Å; S20-C23 VanDerWaalsContact O-C 3.32Å; S20-C23 PolarHBondContact O-N 3.46Å; S20-C23 VanDerWaalsContact O-O 3.1Å; S20-C23 PolarHBondContact OG-N 2.78Å; S20-C23 PolarHBondContact OG-SG 2.89Å
21R85.8Confident84.4Confident220 Ų22098 Ų9883%0.8348%0.477SS*.THydrogen-bonded Turntrans-57.4-29.9177.3-66.9-176.6179.9-175.60.2113.1R24R21-R24 WeakPolarHBondContact O-CG 3.36Å; R21-R24 PolarHBondContact O-NE 3.12Å; R21-R24 VanDerWaalsContact O-NE 3.1Å
22F84.3Confident84.4Confident189 Ų189102.1 Ų102.183%0.82949%0.491SS*.THydrogen-bonded Turntrans-81.9-23.2177-49.8-66.5000112.7S20S20-F22 PolarHBondContact O-N 3.25Å; S20-F22 VanDerWaalsContact O-N 3.17Å
23C80.1Confident84.8Confident9 Ų9105 Ų1056%0.06150%0.504CS..BIsolated β-bridgetrans-111.579.2-176-48.40000109.8Y17 P18 S20 V26Y17-C23 HydrophobicContact CE1-CB 3.86Å; Y17-C23 WeakPolarHBondContact CE1-SG 3.3Å; Y17-C23 WeakPolarHBondContact CE2-SG 3.17Å; Y17-C23 PolarHBondContact OH-SG 3.43Å; P18-C23 PolarHBondContact O-SG 3.1Å; P18-C23 VanDerWaalsContact O-SG 3.36Å; S20-C23 CarbonylContact O-C 3.32Å; S20-C23 VanDerWaalsContact O-C 3.32Å; S20-C23 PolarHBondContact O-N 3.46Å; S20-C23 VanDerWaalsContact O-O 3.1Å; S20-C23 PolarHBondContact OG-N 2.78Å; S20-C23 PolarHBondContact OG-SG 2.89Å; C23-V26 HydrophobicContact CB-CG2 4.3Å; C23-V26 WeakPolarHBondContact O-CG2 3.45Å
24R82.7Confident85.1Confident203 Ų20399 Ų9977%0.76648%0.478SS*.  trans-90.8159.6-179.4-57.1-173.4-175.3-171.60.2111.5R21 V26R21-R24 WeakPolarHBondContact O-CG 3.36Å; R21-R24 PolarHBondContact O-NE 3.12Å; R21-R24 VanDerWaalsContact O-NE 3.1Å; R24-V26 VanDerWaalsContact C-N 3.29Å; R24-V26 PolarHBondContact O-N 3.1Å
25G81.9Confident85.5Confident71 Ų7195.4 Ų95.473%0.73246%0.459SS*.SBendtrans72.120.417800000114.6
26V82.6Confident85.6Confident12 Ų1287.3 Ų87.37%0.07342%0.424CS..PPolyproline II helixtrans-72.2124.7176.4179.70000109.1K19 C23 R24 V96 P120 M123K19-V26 HydrophobicContact CB-CG2 4.49Å; K19-V26 HydrophobicContact CD-CB 4.18Å; K19-V26 HydrophobicContact CD-CG1 4.36Å; K19-V26 HydrophobicContact CG-CB 4.08Å; K19-V26 HydrophobicContact CG-CG1 4.45Å; K19-V26 HydrophobicContact CG-CG2 4.2Å; C23-V26 HydrophobicContact CB-CG2 4.3Å; C23-V26 WeakPolarHBondContact O-CG2 3.45Å; R24-V26 VanDerWaalsContact C-N 3.29Å; R24-V26 PolarHBondContact O-N 3.1Å; V26-V96 HydrophobicContact CB-CG2 4.35Å; V26-V96 HydrophobicContact CG1-CB 4.33Å; V26-V96 HydrophobicContact CG1-CG1 3.87Å; V26-V96 HydrophobicContact CG1-CG2 3.48Å; V26-V96 VanDerWaalsContact CG1-CG2 3.48Å; V26-V96 HydrophobicContact CG2-CG1 4.07Å; V26-V96 HydrophobicContact CG2-CG2 3.9Å; V26-P120 HydrophobicContact CG2-CB 4.14Å; V26-P120 HydrophobicContact CG2-CG 4.42Å; V26-M123 HydrophobicContact CG1-CE 4.29Å; V26-M123 HydrophobicContact CG1-CG 3.82Å; V26-M123 HydrophobicContact CG1-SD 4.02Å
27P84.2Confident85.8Confident50 Ų5085.3 Ų85.333%0.32542%0.417SS..PPolyproline II helixtrans-67.3145.5175.928.1-32.8000110.3S121 M123P27-S121 WeakPolarHBondContact CG-O 3.35Å; P27-M123 WeakPolarHBondContact O-CE 3.34Å
28D84.2Confident86Confident130 Ų13086.7 Ų86.770%0.69542%0.422SS*.PPolyproline II helixtrans-68.5152.4178.7-64.8-41.8000112K19K19-D28 IonicContact NZ-OD1 2.88Å; K19-D28 PolarHBondContact NZ-OD1 3.21Å
29A86.1Confident86Confident20 Ų2089.2 Ų89.217%0.16543%0.426CS..PPolyproline II helixtrans-69.1143.8-175.100000110.2I31 P93 M123A29-I31 VanDerWaalsContact C-N 3.35Å; A29-I31 HydrophobicContact CB-CG2 4.47Å; A29-P93 HydrophobicContact CB-CG 3.54Å; A29-M123 HydrophobicContact CB-CE 3.79Å
30K87.4Confident86.1Confident140 Ų14093.3 Ų93.361%0.60944%0.444SS*.SBendtrans-66.3-39.2179.7-169.364.51771800112.1R32 E63 E66K30-R32 PolarHBondContact O-N 3.42Å; K30-E63 HydrophobicContact CB-CG 4.08Å; K30-E63 HydrophobicContact CG-CG 4.3Å; K30-E66 HydrophobicContact CG-CB 4.31Å; K30-E66 HydrophobicContact CG-CG 4.28Å
31I87.2Confident86.1Confident4 Ų492.3 Ų92.32%0.02144%0.439CS..  trans-72120.4171.8-174165000110.1A29 F34 L65 E66 V89 P93A29-I31 VanDerWaalsContact C-N 3.35Å; A29-I31 HydrophobicContact CB-CG2 4.47Å; I31-F34 HydrophobicContact CD1-CD1 3.86Å; I31-F34 HydrophobicContact CD1-CE1 3.75Å; I31-F34 HydrophobicContact CG1-CD1 4.23Å; I31-F34 HydrophobicContact CG1-CE1 3.89Å; I31-F34 HydrophobicContact CG1-CZ 4.21Å; I31-F34 HydrophobicContact CG2-CE1 3.97Å; I31-F34 HydrophobicContact CG2-CZ 4.01Å; I31-L65 HydrophobicContact CD1-CB 4.07Å; I31-L65 HydrophobicContact CD1-CD1 4.33Å; I31-L65 HydrophobicContact CG2-CD1 4.43Å; I31-E66 WeakPolarHBondContact CA-OE2 3.36Å; I31-E66 HydrophobicContact CB-CB 4.39Å; I31-V89 HydrophobicContact CD1-CB 4.21Å; I31-V89 HydrophobicContact CD1-CG1 3.92Å; I31-V89 HydrophobicContact CD1-CG2 4.18Å; I31-P93 HydrophobicContact CG2-CG 3.84Å
32R87.5Confident86Confident217 Ų21789 Ų8982%0.81943%0.43SS*.  trans-116.1-22.5177.1-64.8-177.568.2-177.41.9113K30K30-R32 PolarHBondContact O-N 3.42Å
33I90.9Very high85.7Confident84 Ų8486.4 Ų86.443%0.43143%0.43SS..  trans-118.9116.5-175.1-55.4172.2000107.5D35 L36 R69I33-D35 WeakPolarHBondContact CG2-O 3.49Å; I33-L36 HydrophobicContact CG2-CD2 3.8Å; I33-R69 VanDerWaalsContact O-CD 3.24Å; I33-R69 WeakPolarHBondContact O-CD 3.38Å
34F88.6Confident85.8Confident45 Ų4592.9 Ų92.920%0.19746%0.464CS..  trans-96.3-30.8-178.7-64.3-83.2000112.6I31 R88 V89 L91 H92I31-F34 HydrophobicContact CD1-CD1 3.86Å; I31-F34 HydrophobicContact CD1-CE1 3.75Å; I31-F34 HydrophobicContact CG1-CD1 4.23Å; I31-F34 HydrophobicContact CG1-CE1 3.89Å; I31-F34 HydrophobicContact CG1-CZ 4.21Å; I31-F34 HydrophobicContact CG2-CE1 3.97Å; I31-F34 HydrophobicContact CG2-CZ 4.01Å; F34-R88 WeakPolarHBondContact O-CA 2.94Å; F34-V89 HydrophobicContact CD1-CB 4.13Å; F34-V89 HydrophobicContact CD1-CG1 4.28Å; F34-V89 PolarHBondContact O-N 3.23Å; F34-L91 WeakPolarHBondContact CE1-O 3.33Å; F34-H92 AromaticContact CD1-CE1 3.53Å; F34-H92 AromaticContact CD1-ND1 3.57Å; F34-H92 AromaticContact CD2-CE1 3.67Å; F34-H92 AromaticContact CD2-ND1 3.92Å; F34-H92 AromaticContact CE1-CE1 3.66Å; F34-H92 AromaticContact CE1-ND1 3.18Å; F34-H92 WeakPolarHBondContact CE1-ND1 3.48Å; F34-H92 AromaticContact CE2-CE1 3.78Å; F34-H92 AromaticContact CE2-ND1 3.55Å; F34-H92 AromaticContact CG-CE1 3.55Å; F34-H92 AromaticContact CG-ND1 3.93Å; F34-H92 AromaticContact CZ-CE1 3.8Å; F34-H92 AromaticContact CZ-ND1 3.18Å; F34-H92 WeakPolarHBondContact CZ-ND1 3.22Å
35D90.2Very high85.7Confident46 Ų4686.5 Ų86.525%0.24644%0.442CS..EExtended strand (participates in β ladder)trans-107.8139179.3-59.3-55.8000111.4I33 K39 H86 I87 R88I33-D35 WeakPolarHBondContact CG2-O 3.49Å; D35-K39 VanDerWaalsContact C-CE 3.43Å; D35-K39 HydrophobicContact CB-CD 3.81Å; D35-K39 HydrophobicContact CB-CG 4.15Å; D35-K39 WeakPolarHBondContact O-CE 3.31Å; D35-K39 PolarHBondContact O-NZ 3.43Å; D35-H86 IonicContact OD1-CE1 3.21Å; D35-I87 CarbonylContact C-O 3.6Å; D35-I87 WeakPolarHBondContact CA-O 3.35Å; D35-R88 WeakPolarHBondContact OD1-CB 3.18Å; D35-R88 WeakPolarHBondContact OD1-CD 3.18Å; D35-R88 WeakPolarHBondContact OD1-CG 3.24Å; D35-R88 IonicContact OD1-NE 3.21Å
36L89.1Confident85.7Confident19 Ų1984.6 Ų84.610%0.09941%0.414CS..EExtended strand (participates in β ladder)trans-137.4170.2179.3-59165.3000111.4I33 R69 N73 H86 I87I33-L36 HydrophobicContact CG2-CD2 3.8Å; L36-R69 HydrophobicContact CD1-CG 3.45Å; L36-R69 VanDerWaalsContact CD1-CG 3.45Å; L36-R69 VanDerWaalsContact CD2-NH1 3.33Å; L36-N73 HydrophobicContact CD1-CB 4.06Å; L36-H86 PolarHBondContact O-ND1 2.86Å; L36-H86 VanDerWaalsContact O-ND1 3.13Å; L36-I87 HydrophobicContact CB-CB 4.32Å; L36-I87 PolarHBondContact N-O 2.7Å; L36-I87 PolarHBondContact O-N 2.7Å; L36-I87 VanDerWaalsContact O-N 3.16Å
37G87.8Confident85.7Confident32 Ų3288.9 Ų88.933%0.3344%0.442SS..EExtended strand (participates in β ladder)trans67.7-148-175.300000111.4K39 F85G37-K39 PolarHBondContact O-N 2.78Å; G37-K39 VanDerWaalsContact O-N 3.09Å; G37-F85 WeakPolarHBondContact CA-O 3.34Å
38R88.8Confident85.6Confident102 Ų10289.4 Ų89.439%0.38544%0.442SS..  trans-86.581.7-171.5-163.8168.4168.4-132.4-13.2112.2K40 A41 E45 F46 F85R38-K40 PolarHBondContact O-N 3.3Å; R38-A41 HydrophobicContact CB-CB 4.41Å; R38-A41 HydrophobicContact CG-CB 4.12Å; R38-A41 WeakPolarHBondContact O-CB 3.34Å; R38-A41 PolarHBondContact O-N 2.68Å; R38-E45 IonicContact CZ-OE2 3.94Å; R38-E45 IonicContact NH1-OE2 2.71Å; R38-E45 PolarHBondContact NH1-OE2 2.89Å; R38-E45 IonicContact NH2-OE1 3.54Å; R38-E45 IonicContact NH2-OE2 3.77Å; R38-E45 PolarHBondContact NH2-OE2 3.21Å; R38-F46 HydrophobicContact CB-CE2 4.48Å; R38-F46 HydrophobicContact CB-CZ 4.42Å; R38-F85 PolarHBondContact N-O 3.46Å
39K87.1Confident85.5Confident121 Ų12187.1 Ų87.153%0.52644%0.435SS..THydrogen-bonded Turntrans-62.6-22-177.9-51.7-177-171.6-164.70115.3D35 G37D35-K39 VanDerWaalsContact C-CE 3.43Å; D35-K39 HydrophobicContact CB-CD 3.81Å; D35-K39 HydrophobicContact CB-CG 4.15Å; D35-K39 WeakPolarHBondContact O-CE 3.31Å; D35-K39 PolarHBondContact O-NZ 3.43Å; G37-K39 PolarHBondContact O-N 2.78Å; G37-K39 VanDerWaalsContact O-N 3.09Å
40K86.8Confident85.4Confident201 Ų20188 Ų8887%0.87445%0.446SS*.THydrogen-bonded Turntrans-94.10.9-178.1-64.8-174.2178.2-177.50113.2R38R38-K40 PolarHBondContact O-N 3.3Å
41A84.7Confident85.3Confident24 Ų2486 Ų8620%0.19844%0.439CS..  trans-64145.4177.800000110.4R38 E45 F46R38-A41 HydrophobicContact CB-CB 4.41Å; R38-A41 HydrophobicContact CG-CB 4.12Å; R38-A41 WeakPolarHBondContact O-CB 3.34Å; R38-A41 PolarHBondContact O-N 2.68Å; A41-E45 HydrophobicContact CB-CB 4.49Å; A41-F46 HydrophobicContact CB-CD2 3.83Å; A41-F46 HydrophobicContact CB-CE2 3.3Å; A41-F46 HydrophobicContact CB-CZ 4.1Å
42K83.8Confident85Confident151 Ų15190.8 Ų90.866%0.65746%0.462SS*.  trans-75.6160.2174.5-67.2-179179.4178.30110.6D44 E45K42-D44 PolarHBondContact O-N 2.86Å; K42-E45 HydrophobicContact CB-CG 4.41Å; K42-E45 PolarHBondContact N-OE1 2.95Å; K42-E45 PolarHBondContact O-N 2.8Å; K42-E45 VanDerWaalsContact O-N 3.14Å
43V78.4Confident84.7Confident134 Ų13483.4 Ų83.481%0.81244%0.441SS*.G310 helixtrans-59.4-34.1-178.4-1780000111.6E45V43-E45 VanDerWaalsContact C-N 3.26Å; V43-E45 PolarHBondContact O-N 2.91Å
44D81.6Confident84.1Confident145 Ų14579.9 Ų79.978%0.77542%0.424SS*.G310 helixtrans-70-20.9-178.6-48.7-49.2000113.4K42K42-D44 PolarHBondContact O-N 2.86Å
45E81.8Confident83.7Confident68 Ų6884.6 Ų84.632%0.31845%0.451SS..G310 helixtrans-78.3-22.3-176.3-64.5177.8-139.100112.6R38 A41 K42 V43 S144R38-E45 IonicContact CZ-OE2 3.94Å; R38-E45 IonicContact NH1-OE2 2.71Å; R38-E45 PolarHBondContact NH1-OE2 2.89Å; R38-E45 IonicContact NH2-OE1 3.54Å; R38-E45 IonicContact NH2-OE2 3.77Å; R38-E45 PolarHBondContact NH2-OE2 3.21Å; A41-E45 HydrophobicContact CB-CB 4.49Å; K42-E45 HydrophobicContact CB-CG 4.41Å; K42-E45 PolarHBondContact N-OE1 2.95Å; K42-E45 PolarHBondContact O-N 2.8Å; K42-E45 VanDerWaalsContact O-N 3.14Å; V43-E45 VanDerWaalsContact C-N 3.26Å; V43-E45 PolarHBondContact O-N 2.91Å; E45-S144 VanDerWaalsContact O-CB 3.3Å; E45-S144 WeakPolarHBondContact O-CB 3.38Å
46F81.8Confident83.2Confident32 Ų3287.6 Ų87.614%0.1446%0.464CS..  trans-128.180.4-177.9-63-46.8000111.2R38 A41 L48 G84 H86R38-F46 HydrophobicContact CB-CE2 4.48Å; R38-F46 HydrophobicContact CB-CZ 4.42Å; A41-F46 HydrophobicContact CB-CD2 3.83Å; A41-F46 HydrophobicContact CB-CE2 3.3Å; A41-F46 HydrophobicContact CB-CZ 4.1Å; F46-L48 VanDerWaalsContact C-N 3.32Å; F46-L48 PolarHBondContact O-N 2.65Å; F46-G84 WeakPolarHBondContact CE1-O 3.37Å; F46-H86 HydrophobicContact CD2-CB 4.12Å; F46-H86 HydrophobicContact CE2-CB 3.98Å
47P81.3Confident82.7Confident101 Ų10191.8 Ų91.866%0.65648%0.479SS*.  trans-72.8-21.3-177.328.4-35.8000113.9
48L83.1Confident82.4Confident61 Ų6192.2 Ų92.232%0.31947%0.472SS..EExtended strand (participates in β ladder)trans-97.7129.7-176.8-62.5156.7000110.3F46 G142 S143 T145F46-L48 VanDerWaalsContact C-N 3.32Å; F46-L48 PolarHBondContact O-N 2.65Å; L48-G142 CarbonylContact O-C 3.58Å; L48-G142 WeakPolarHBondContact O-CA 3.38Å; L48-S143 WeakPolarHBondContact CB-O 3.34Å; L48-S143 PolarHBondContact N-O 2.75Å; L48-S143 PolarHBondContact O-N 2.91Å; L48-T145 WeakPolarHBondContact CD1-O 3.4Å
49C81.8Confident82.2Confident83 Ų8388.3 Ų88.356%0.56146%0.459SS*.EExtended strand (participates in β ladder)trans-124.6119.4174.8-162.60000111.2H51 V141C49-H51 PolarHBondContact SG-CE1 3.44Å; C49-V141 CarbonylContact C-O 3.59Å; C49-V141 WeakPolarHBondContact CA-O 3.26Å
50G84.4Confident82.1Confident39 Ų3983.7 Ų83.740%0.40244%0.439SS..EExtended strand (participates in β ladder)trans-104.2136.3171.700000111.2A140 V141G50-A140 CarbonylContact O-C 3.44Å; G50-A140 WeakPolarHBondContact O-CA 3.38Å; G50-V141 PolarHBondContact N-O 3.02Å; G50-V141 PolarHBondContact O-N 3.45Å
51H84.6Confident82.1Confident98 Ų9875.2 Ų75.245%0.45441%0.406SS..EExtended strand (participates in β ladder)trans-118.9130.8176.3-67-55.1000111.4C49 V53 M139 A140C49-H51 PolarHBondContact SG-CE1 3.44Å; H51-V53 HydrophobicContact CB-CG2 4.33Å; H51-M139 WeakPolarHBondContact CA-O 3.17Å; H51-A140 VanDerWaalsContact CE1-CB 3.45Å; H51-A140 WeakPolarHBondContact CE1-CB 3.38Å; H51-A140 VanDerWaalsContact ND1-CB 3.31Å; H51-A140 WeakPolarHBondContact ND1-CB 3.49Å
52M81.3Confident82.1Confident104 Ų10474.1 Ų74.151%0.51240%0.397SS..EExtended strand (participates in β ladder)trans-88.3121.6166.6-178.9-178.7-7200108.3S137 Q138 M139M52-S137 CarbonylContact O-C 3.58Å; M52-S137 WeakPolarHBondContact O-CA 3.19Å; M52-Q138 WeakPolarHBondContact O-CB 3.27Å; M52-Q138 PolarHBondContact O-N 3.27Å; M52-M139 HydrophobicContact CB-CB 4.47Å; M52-M139 HydrophobicContact CE-CE 3.87Å; M52-M139 PolarHBondContact N-O 2.94Å; M52-M139 HydrophobicContact SD-CE 3.66Å
53V82Confident82.3Confident62 Ų6269.1 Ų69.138%0.37638%0.376SS..EExtended strand (participates in β ladder)trans-119139.1-174.7174.70000109.2H51 G135H51-V53 HydrophobicContact CB-CG2 4.33Å; V53-G135 VanDerWaalsContact CG1-C 3.5Å; V53-G135 VanDerWaalsContact CG1-CA 3.42Å
54S76.8Confident82.7Confident10 Ų1065 Ų657%0.0736%0.355CS..  trans-88.7133.6166.325.80000111Q138S54-Q138 PolarHBondContact OG-NE2 2.7Å; S54-Q138 VanDerWaalsContact OG-NE2 3.13Å
55D81.6Confident83Confident144 Ų14458.3 Ų58.377%0.7732%0.319SS*.  trans-89.4-18.1170.3-65.1-26.7000112.5
56E78.1Confident83.4Confident108 Ų10856.5 Ų56.551%0.50531%0.311SS..SBendtrans-99.4149.5178.3-67.6-169.3175.400113.2R10 E58 L127R10-E56 IonicContact CZ-OE2 3.03Å; R10-E56 IonicContact NH2-OE1 3.1Å; R10-E56 IonicContact NH2-OE2 3.32Å; R10-E56 PolarHBondContact NH2-OE2 2.95Å; E56-E58 PolarHBondContact O-N 3.3Å; E56-L127 WeakPolarHBondContact O-CD1 3.46Å
57Y78.6Confident83.7Confident107 Ų10757.8 Ų57.842%0.4233%0.328SS..  trans-92.394.1175.1-179.8-107.7000111.6C12 L127 K128C12-Y57 HydrophobicContact CB-CD1 4.37Å; C12-Y57 HydrophobicContact CB-CE1 3.42Å; C12-Y57 VanDerWaalsContact CB-CE1 3.42Å; C12-Y57 WeakPolarHBondContact CB-OH 3.14Å; Y57-L127 HydrophobicContact CD2-CB 4.1Å; Y57-L127 HydrophobicContact CE2-CB 4.19Å; Y57-K128 HydrophobicContact CE2-CB 3.89Å; Y57-K128 HydrophobicContact CE2-CG 3.83Å; Y57-K128 WeakPolarHBondContact OH-CB 3.19Å; Y57-K128 WeakPolarHBondContact OH-CD 3.49Å; Y57-K128 WeakPolarHBondContact OH-CG 3.33Å
58E83.1Confident84.1Confident41 Ų4154.6 Ų54.619%0.19231%0.31CS..  trans-133.5171.3-174.556.8178.9-174.800114.4R10 E56 L127R10-E58 HydrophobicContact CG-CB 4.3Å; R10-E58 IonicContact NE-OE2 2.7Å; R10-E58 CarbonylContact O-C 3.55Å; R10-E58 VanDerWaalsContact O-CA 3.28Å; R10-E58 WeakPolarHBondContact O-CA 3.19Å; R10-E58 WeakPolarHBondContact O-CB 3.4Å; E56-E58 PolarHBondContact O-N 3.3Å; E58-L127 HydrophobicContact CG-CD1 3.84Å; E58-L127 WeakPolarHBondContact O-CB 3.15Å; E58-L127 WeakPolarHBondContact O-CD1 3Å; E58-L127 VanDerWaalsContact O-CG 3.3Å; E58-L127 WeakPolarHBondContact O-CG 3.46Å; E58-L127 PolarHBondContact O-N 3.36Å
59Q82.9Confident84.5Confident20 Ų2052.9 Ų52.99%0.09330%0.299CS..EExtended strand (participates in β ladder)trans-101.6118.6169.5-57-173.2-1900109.4Y9 R10 C12 H95 L124 M125 N126Y9-Q59 WeakPolarHBondContact O-CB 3.47Å; Y9-Q59 PolarHBondContact O-OE1 3.44Å; Y9-Q59 VanDerWaalsContact O-OE1 3.06Å; R10-Q59 PolarHBondContact O-N 3.39Å; C12-Q59 HydrophobicContact CB-CG 4.11Å; C12-Q59 WeakPolarHBondContact SG-CG 3.21Å; Q59-H95 PolarHBondContact NE2-CD2 2.89Å; Q59-H95 VanDerWaalsContact NE2-CD2 3.34Å; Q59-H95 PolarHBondContact NE2-NE2 3.38Å; Q59-L124 HydrophobicContact CB-CB 4.38Å; Q59-L124 HydrophobicContact CB-CD1 3.83Å; Q59-M125 VanDerWaalsContact CA-O 3.3Å; Q59-M125 WeakPolarHBondContact CA-O 3.18Å; Q59-M125 WeakPolarHBondContact CB-O 3.21Å; Q59-N126 WeakPolarHBondContact CG-OD1 3.06Å; Q59-N126 PolarHBondContact NE2-OD1 3.17Å
60L85.9Confident85Confident24 Ų2453 Ų5313%0.12629%0.294CS..EExtended strand (participates in β ladder)trans-91.9141.9174.4-67.7173000109.9L91 L124 M125L60-L91 HydrophobicContact CD1-CD1 3.91Å; L60-L124 WeakPolarHBondContact O-CA 3.37Å; L60-M125 HydrophobicContact CB-CE 3.3Å; L60-M125 HydrophobicContact CB-CG 4.08Å; L60-M125 HydrophobicContact CB-SD 3.85Å; L60-M125 HydrophobicContact CD1-CE 4.35Å; L60-M125 HydrophobicContact CD1-SD 4.31Å; L60-M125 HydrophobicContact CG-CE 4.46Å; L60-M125 PolarHBondContact O-N 3.38Å
61S86.4Confident85.4Confident24 Ų2455.4 Ų55.417%0.16830%0.303CS..EExtended strand (participates in β ladder)trans-87.6151.8179.971.80000113.2E63 A64 L65S61-E63 WeakPolarHBondContact CB-OE2 3.43Å; S61-E63 PolarHBondContact O-N 3.11Å; S61-E63 VanDerWaalsContact O-N 3.13Å; S61-E63 PolarHBondContact OG-OE2 2.99Å; S61-A64 PolarHBondContact O-N 3.46Å; S61-A64 VanDerWaalsContact OG-CB 3.27Å; S61-A64 WeakPolarHBondContact OG-CB 3.07Å; S61-A64 PolarHBondContact OG-N 3.09Å; S61-L65 PolarHBondContact O-N 2.85Å
62S85.9Confident85.7Confident1 Ų151.9 Ų51.91%0.00729%0.291CS..Hα-helixtrans-60.7-22.1175.752.20000112.8E66 M123S62-E66 WeakPolarHBondContact O-CB 3.37Å; S62-E66 PolarHBondContact O-N 3.09Å; S62-M123 PolarHBondContact N-O 3.32Å; S62-M123 PolarHBondContact OG-O 3.17Å
63E86.7Confident86.1Confident46 Ų4649.1 Ų49.122%0.21528%0.278CS..Hα-helixtrans-85-38.2178.4-56.372.4-146.500111.7R3 K30 S61 L65 E66 A67R3-E63 IonicContact CZ-OE1 3.35Å; R3-E63 IonicContact CZ-OE2 3.43Å; R3-E63 IonicContact NH1-OE1 3.38Å; R3-E63 PolarHBondContact NH1-OE1 3.33Å; R3-E63 IonicContact NH1-OE2 2.7Å; R3-E63 PolarHBondContact NH1-OE2 3.13Å; R3-E63 IonicContact NH2-OE1 2.65Å; R3-E63 PolarHBondContact NH2-OE1 3.42Å; R3-E63 IonicContact NH2-OE2 3.32Å; R3-E63 PolarHBondContact NH2-OE2 3.18Å; K30-E63 HydrophobicContact CB-CG 4.08Å; K30-E63 HydrophobicContact CG-CG 4.3Å; S61-E63 WeakPolarHBondContact CB-OE2 3.43Å; S61-E63 PolarHBondContact O-N 3.11Å; S61-E63 VanDerWaalsContact O-N 3.13Å; S61-E63 PolarHBondContact OG-OE2 2.99Å; E63-L65 VanDerWaalsContact C-N 3.29Å; E63-L65 PolarHBondContact O-N 2.83Å; E63-E66 PolarHBondContact O-N 2.71Å; E63-A67 WeakPolarHBondContact O-CB 3.3Å; E63-A67 PolarHBondContact O-N 3.16Å
64A87.7Confident86.6Confident46 Ų4654 Ų5438%0.3829%0.294SS..Hα-helixtrans-61.4-42.5173.200000110.4S61 A67 A68S61-A64 PolarHBondContact O-N 3.46Å; S61-A64 VanDerWaalsContact OG-CB 3.27Å; S61-A64 WeakPolarHBondContact OG-CB 3.07Å; S61-A64 PolarHBondContact OG-N 3.09Å; A64-A67 PolarHBondContact O-N 3.04Å; A64-A68 VanDerWaalsContact O-CB 3.3Å; A64-A68 WeakPolarHBondContact O-CB 3.39Å; A64-A68 PolarHBondContact O-N 2.91Å
65L87.6Confident87.3Confident5 Ų558.8 Ų58.83%0.02631%0.312CS..Hα-helixtrans-61-45.6173.3-77.2-171.1000112.9I31 S61 E63 A67 A68 R69 V89 L91 M125I31-L65 HydrophobicContact CD1-CB 4.07Å; I31-L65 HydrophobicContact CD1-CD1 4.33Å; I31-L65 HydrophobicContact CG2-CD1 4.43Å; S61-L65 PolarHBondContact O-N 2.85Å; E63-L65 VanDerWaalsContact C-N 3.29Å; E63-L65 PolarHBondContact O-N 2.83Å; L65-A67 VanDerWaalsContact C-N 3.33Å; L65-A67 PolarHBondContact O-N 3.13Å; L65-A68 PolarHBondContact O-N 3.2Å; L65-R69 WeakPolarHBondContact O-CB 3.36Å; L65-R69 PolarHBondContact O-N 3.18Å; L65-V89 HydrophobicContact CD1-CG1 4.25Å; L65-V89 HydrophobicContact CD2-CG1 4.29Å; L65-L91 HydrophobicContact CD1-CB 3.98Å; L65-L91 HydrophobicContact CD2-CB 4.36Å; L65-L91 HydrophobicContact CD2-CD1 3.98Å; L65-M125 HydrophobicContact CD1-CE 3.1Å; L65-M125 HydrophobicContact CD1-SD 4.35Å; L65-M125 HydrophobicContact CD2-CE 3.82Å; L65-M125 HydrophobicContact CG-CE 3.34Å
66E89.5Confident87.6Confident30 Ų3053.2 Ų53.214%0.1428%0.281CS..Hα-helixtrans-66.3-38.3-179.5-175.158.9-16200111.3K30 I31 S62 E63 R69 I70K30-E66 HydrophobicContact CG-CB 4.31Å; K30-E66 HydrophobicContact CG-CG 4.28Å; I31-E66 WeakPolarHBondContact CA-OE2 3.36Å; I31-E66 HydrophobicContact CB-CB 4.39Å; S62-E66 WeakPolarHBondContact O-CB 3.37Å; S62-E66 PolarHBondContact O-N 3.09Å; E63-E66 PolarHBondContact O-N 2.71Å; E66-R69 VanDerWaalsContact CD-NE 3.34Å; E66-R69 PolarHBondContact O-N 3.06Å; E66-R69 IonicContact OE1-CZ 3.76Å; E66-R69 IonicContact OE1-NE 2.65Å; E66-R69 PolarHBondContact OE1-NE 3.39Å; E66-R69 VanDerWaalsContact OE1-NE 3.1Å; E66-R69 IonicContact OE1-NH2 3.62Å; E66-R69 PolarHBondContact OE1-NH2 2.94Å; E66-R69 IonicContact OE2-CZ 3.99Å; E66-R69 IonicContact OE2-NE 3.88Å; E66-R69 PolarHBondContact OE2-NE 3.38Å; E66-I70 HydrophobicContact CG-CD1 4.04Å; E66-I70 WeakPolarHBondContact O-CD1 3.33Å; E66-I70 VanDerWaalsContact O-CG1 3.22Å; E66-I70 WeakPolarHBondContact O-CG1 3.46Å; E66-I70 PolarHBondContact O-N 3.5Å
67A88.9Confident88.1Confident59 Ų5950.4 Ų50.449%0.48827%0.272SS..Hα-helixtrans-64.6-47.5174.500000111.8E63 A64 L65 R69 I70 C71E63-A67 WeakPolarHBondContact O-CB 3.3Å; E63-A67 PolarHBondContact O-N 3.16Å; A64-A67 PolarHBondContact O-N 3.04Å; L65-A67 VanDerWaalsContact C-N 3.33Å; L65-A67 PolarHBondContact O-N 3.13Å; A67-R69 VanDerWaalsContact C-N 3.3Å; A67-R69 PolarHBondContact O-N 3.22Å; A67-I70 PolarHBondContact O-N 3.48Å; A67-C71 WeakPolarHBondContact O-CB 3.41Å; A67-C71 PolarHBondContact O-N 2.94Å
68A89.8Confident88.7Confident35 Ų3554.2 Ų54.229%0.28929%0.29SS..Hα-helixtrans-59.4-42.7176.500000111.3A64 L65 C71 A72 M139A64-A68 VanDerWaalsContact O-CB 3.3Å; A64-A68 WeakPolarHBondContact O-CB 3.39Å; A64-A68 PolarHBondContact O-N 2.91Å; L65-A68 PolarHBondContact O-N 3.2Å; A68-C71 PolarHBondContact O-N 3.43Å; A68-A72 WeakPolarHBondContact O-CB 3.14Å; A68-A72 PolarHBondContact O-N 3.17Å; A68-M139 HydrophobicContact CB-CE 3.92Å
69R91.3Very high88.9Confident25 Ų2555.5 Ų55.59%0.09430%0.304CS..Hα-helixtrans-60.2-49.3175.9-173.8-157.271.570.5-3.7112.1I33 L36 L65 E66 A67 C71 N73 V89I33-R69 VanDerWaalsContact O-CD 3.24Å; I33-R69 WeakPolarHBondContact O-CD 3.38Å; L36-R69 HydrophobicContact CD1-CG 3.45Å; L36-R69 VanDerWaalsContact CD1-CG 3.45Å; L36-R69 VanDerWaalsContact CD2-NH1 3.33Å; L65-R69 WeakPolarHBondContact O-CB 3.36Å; L65-R69 PolarHBondContact O-N 3.18Å; E66-R69 VanDerWaalsContact CD-NE 3.34Å; E66-R69 PolarHBondContact O-N 3.06Å; E66-R69 IonicContact OE1-CZ 3.76Å; E66-R69 IonicContact OE1-NE 2.65Å; E66-R69 PolarHBondContact OE1-NE 3.39Å; E66-R69 VanDerWaalsContact OE1-NE 3.1Å; E66-R69 IonicContact OE1-NH2 3.62Å; E66-R69 PolarHBondContact OE1-NH2 2.94Å; E66-R69 IonicContact OE2-CZ 3.99Å; E66-R69 IonicContact OE2-NE 3.88Å; E66-R69 PolarHBondContact OE2-NE 3.38Å; A67-R69 VanDerWaalsContact C-N 3.3Å; A67-R69 PolarHBondContact O-N 3.22Å; R69-C71 VanDerWaalsContact C-N 3.33Å; R69-C71 PolarHBondContact O-N 3.44Å; R69-N73 WeakPolarHBondContact O-CB 3.04Å; R69-N73 PolarHBondContact O-N 3.44Å; R69-V89 HydrophobicContact CB-CG2 4.37Å; R69-V89 HydrophobicContact CG-CG2 4.15Å
70I92.1Very high88.9Confident86 Ų8656.5 Ų56.544%0.44131%0.313SS..Hα-helixtrans-62.6-42.8179.2-68.9164.6000110.5E66 A67 N73 K74E66-I70 HydrophobicContact CG-CD1 4.04Å; E66-I70 WeakPolarHBondContact O-CD1 3.33Å; E66-I70 VanDerWaalsContact O-CG1 3.22Å; E66-I70 WeakPolarHBondContact O-CG1 3.46Å; E66-I70 PolarHBondContact O-N 3.5Å; A67-I70 PolarHBondContact O-N 3.48Å; I70-N73 PolarHBondContact O-N 2.85Å; I70-K74 WeakPolarHBondContact O-CB 3.2Å; I70-K74 PolarHBondContact O-N 2.81Å
71C92.5Very high88.9Confident88 Ų8856.9 Ų56.960%0.59532%0.322SS*.Hα-helixtrans-60.3-52.7178-173.10000111.5A67 A68 R69 N73 K74 Y75A67-C71 WeakPolarHBondContact O-CB 3.41Å; A67-C71 PolarHBondContact O-N 2.94Å; A68-C71 PolarHBondContact O-N 3.43Å; R69-C71 VanDerWaalsContact C-N 3.33Å; R69-C71 PolarHBondContact O-N 3.44Å; C71-N73 VanDerWaalsContact C-N 3.33Å; C71-N73 PolarHBondContact O-N 2.98Å; C71-K74 PolarHBondContact O-N 3.35Å; C71-Y75 PolarHBondContact O-N 3.36Å
72A90.1Very high88.8Confident24 Ų2462.9 Ų62.920%0.19835%0.345CS..Hα-helixtrans-58.8-44.4178.300000111.7A68 K74 Y75 M76 I87A68-A72 WeakPolarHBondContact O-CB 3.14Å; A68-A72 PolarHBondContact O-N 3.17Å; A72-K74 PolarHBondContact O-N 2.83Å; A72-Y75 PolarHBondContact O-N 3.08Å; A72-M76 WeakPolarHBondContact O-CB 3.39Å; A72-M76 VanDerWaalsContact O-CG 3.27Å; A72-M76 WeakPolarHBondContact O-CG 3.3Å; A72-M76 PolarHBondContact O-N 3.28Å; A72-I87 HydrophobicContact CB-CD1 4.25Å
73N90.8Very high88.7Confident46 Ų4668.3 Ų68.325%0.24637%0.374CS..Hα-helixtrans-63.4-42.9178-172.658.8000112.3L36 R69 I70 C71 Y75 M76 V77L36-N73 HydrophobicContact CD1-CB 4.06Å; R69-N73 WeakPolarHBondContact O-CB 3.04Å; R69-N73 PolarHBondContact O-N 3.44Å; I70-N73 PolarHBondContact O-N 2.85Å; C71-N73 VanDerWaalsContact C-N 3.33Å; C71-N73 PolarHBondContact O-N 2.98Å; N73-Y75 VanDerWaalsContact C-N 3.31Å; N73-Y75 PolarHBondContact O-N 3.15Å; N73-M76 PolarHBondContact O-N 2.87Å; N73-V77 WeakPolarHBondContact O-CB 3.08Å; N73-V77 WeakPolarHBondContact O-CG2 3.21Å; N73-V77 PolarHBondContact O-N 3.1Å
74K92.3Very high88.6Confident166 Ų16666.7 Ų66.772%0.72237%0.37SS*.Hα-helixtrans-62-41.1178.8-171.8177.4-178.6-178.50111.4I70 C71 A72 K78I70-K74 WeakPolarHBondContact O-CB 3.2Å; I70-K74 PolarHBondContact O-N 2.81Å; C71-K74 PolarHBondContact O-N 3.35Å; A72-K74 PolarHBondContact O-N 2.83Å; K74-K78 PolarHBondContact O-N 3.06Å
75Y90.9Very high88.7Confident109 Ų10964.6 Ų64.643%0.42735%0.352SS..Hα-helixtrans-66.7-50.6177.1-177.7-102.1000111.8C71 A72 N73 V77 K78 S79C71-Y75 PolarHBondContact O-N 3.36Å; A72-Y75 PolarHBondContact O-N 3.08Å; N73-Y75 VanDerWaalsContact C-N 3.31Å; N73-Y75 PolarHBondContact O-N 3.15Å; Y75-V77 PolarHBondContact O-N 3.03Å; Y75-K78 WeakPolarHBondContact O-CB 3.33Å; Y75-K78 PolarHBondContact O-N 3.5Å; Y75-K78 VanDerWaalsContact O-N 3.09Å; Y75-S79 PolarHBondContact O-N 3.25Å; Y75-S79 PolarHBondContact O-OG 2.88Å
76M87.9Confident88.7Confident27 Ų2766.8 Ų66.813%0.13336%0.363CS..Hα-helixtrans-65.9-36-177.1-66.1-59.8-66.100112.9A72 N73 K78 S79 C80 F85 I87 V141A72-M76 WeakPolarHBondContact O-CB 3.39Å; A72-M76 VanDerWaalsContact O-CG 3.27Å; A72-M76 WeakPolarHBondContact O-CG 3.3Å; A72-M76 PolarHBondContact O-N 3.28Å; N73-M76 PolarHBondContact O-N 2.87Å; M76-K78 VanDerWaalsContact C-N 3.3Å; M76-K78 PolarHBondContact O-N 3.49Å; M76-S79 PolarHBondContact O-N 3.4Å; M76-C80 PolarHBondContact O-N 3.4Å; M76-F85 VanDerWaalsContact C-CE1 3.44Å; M76-F85 HydrophobicContact CB-CD1 3.6Å; M76-F85 HydrophobicContact CB-CD2 4.02Å; M76-F85 HydrophobicContact CB-CE1 3.51Å; M76-F85 HydrophobicContact CB-CE2 3.93Å; M76-F85 HydrophobicContact CB-CG 3.85Å; M76-F85 HydrophobicContact CB-CZ 3.68Å; M76-F85 HydrophobicContact CE-CB 3.76Å; M76-F85 HydrophobicContact CE-CD1 4.44Å; M76-F85 HydrophobicContact CE-CG 4.11Å; M76-I87 HydrophobicContact CB-CD1 4.33Å; M76-I87 HydrophobicContact CG-CD1 3.97Å; M76-V141 HydrophobicContact CE-CG1 3.74Å; M76-V141 HydrophobicContact SD-CG1 4.43Å
77V90Very high88.8Confident50 Ų5065.4 Ų65.430%0.30336%0.356SS..Hα-helixtrans-63.4-37173.4171.40000111.5N73 Y75 G81 K82 F85N73-V77 WeakPolarHBondContact O-CB 3.08Å; N73-V77 WeakPolarHBondContact O-CG2 3.21Å; N73-V77 PolarHBondContact O-N 3.1Å; Y75-V77 PolarHBondContact O-N 3.03Å; V77-G81 WeakPolarHBondContact O-CA 3.3Å; V77-G81 PolarHBondContact O-N 3.29Å; V77-K82 HydrophobicContact CG1-CG 3.93Å; V77-K82 HydrophobicContact CG2-CG 4.11Å; V77-F85 HydrophobicContact CG2-CE1 3.87Å; V77-F85 HydrophobicContact CG2-CZ 3.73Å
78K91.1Very high88.8Confident186 Ų18668.9 Ų68.981%0.80936%0.357SS*.Hα-helixtrans-70.8-39.9177.7-174.6-178.5176.9-174.90111.9K74 Y75 M76K74-K78 PolarHBondContact O-N 3.06Å; Y75-K78 WeakPolarHBondContact O-CB 3.33Å; Y75-K78 PolarHBondContact O-N 3.5Å; Y75-K78 VanDerWaalsContact O-N 3.09Å; M76-K78 VanDerWaalsContact C-N 3.3Å; M76-K78 PolarHBondContact O-N 3.49Å
79S87.4Confident88.7Confident68 Ų6867.2 Ų67.248%0.47634%0.343SS..Hα-helixtrans-85-44.4-173.4-57.60000113.8Y75 M76Y75-S79 PolarHBondContact O-N 3.25Å; Y75-S79 PolarHBondContact O-OG 2.88Å; M76-S79 PolarHBondContact O-N 3.4Å
80C82.1Confident88.5Confident42 Ų4270.1 Ų70.128%0.28435%0.354SS..Hα-helixtrans-117.6-3.2-169.7-58.50000113.7M76 F85M76-C80 PolarHBondContact O-N 3.4Å; C80-F85 HydrophobicContact CB-CD1 4.47Å
81G86.4Confident88Confident32 Ų3266.6 Ų66.633%0.3334%0.336SS..  trans75.5167.2-172.200000113.1V77 D83 G84 F85V77-G81 WeakPolarHBondContact O-CA 3.3Å; V77-G81 PolarHBondContact O-N 3.29Å; G81-D83 VanDerWaalsContact C-N 3.26Å; G81-D83 PolarHBondContact O-N 2.96Å; G81-G84 PolarHBondContact O-N 3.41Å; G81-F85 WeakPolarHBondContact O-CD1 3.28Å; G81-F85 WeakPolarHBondContact O-CE1 3.31Å
82K82.8Confident87.6Confident150 Ų15065.6 Ų65.665%0.65232%0.322SS*.THydrogen-bonded Turntrans-65.2-26.4-173.4-68.4178.9-178.7175.30114V77V77-K82 HydrophobicContact CG1-CG 3.93Å; V77-K82 HydrophobicContact CG2-CG 4.11Å
83D85.1Confident87.3Confident114 Ų11465 Ų6561%0.6132%0.316SS*.THydrogen-bonded Turntrans-101.6-4.9-174.1-60.8-53.1000113.8G81G81-D83 VanDerWaalsContact C-N 3.26Å; G81-D83 PolarHBondContact O-N 2.96Å
84G85.1Confident87Confident13 Ų1368.7 Ų68.713%0.13433%0.33CS..SBendtrans-87.81.1-175.700000115.2F46 G81F46-G84 WeakPolarHBondContact CE1-O 3.37Å; G81-G84 PolarHBondContact O-N 3.41Å
85F88.4Confident86.7Confident1 Ų161.4 Ų61.40%0.00430%0.299CS..EExtended strand (participates in β ladder)trans-149.4160.2-177.268.7-92.5000113.9G37 R38 M76 V77 C80 G81 I87 G142G37-F85 WeakPolarHBondContact CA-O 3.34Å; R38-F85 PolarHBondContact N-O 3.46Å; M76-F85 VanDerWaalsContact C-CE1 3.44Å; M76-F85 HydrophobicContact CB-CD1 3.6Å; M76-F85 HydrophobicContact CB-CD2 4.02Å; M76-F85 HydrophobicContact CB-CE1 3.51Å; M76-F85 HydrophobicContact CB-CE2 3.93Å; M76-F85 HydrophobicContact CB-CG 3.85Å; M76-F85 HydrophobicContact CB-CZ 3.68Å; M76-F85 HydrophobicContact CE-CB 3.76Å; M76-F85 HydrophobicContact CE-CD1 4.44Å; M76-F85 HydrophobicContact CE-CG 4.11Å; V77-F85 HydrophobicContact CG2-CE1 3.87Å; V77-F85 HydrophobicContact CG2-CZ 3.73Å; C80-F85 HydrophobicContact CB-CD1 4.47Å; G81-F85 WeakPolarHBondContact O-CD1 3.28Å; G81-F85 WeakPolarHBondContact O-CE1 3.31Å; F85-I87 HydrophobicContact CD2-CD1 3.8Å; F85-I87 HydrophobicContact CD2-CG1 3.7Å; F85-I87 HydrophobicContact CE2-CD1 3.57Å; F85-I87 HydrophobicContact CE2-CG1 3.93Å; F85-G142 CarbonylContact C-O 3.55Å; F85-G142 VanDerWaalsContact CA-O 3.26Å; F85-G142 WeakPolarHBondContact CA-O 3.44Å
86H89.3Confident86.4Confident52 Ų5256.3 Ų56.324%0.24128%0.279CS..EExtended strand (participates in β ladder)trans-129121.2167.7175.952000109.8D35 L36 F46 V141 G142D35-H86 IonicContact OD1-CE1 3.21Å; L36-H86 PolarHBondContact O-ND1 2.86Å; L36-H86 VanDerWaalsContact O-ND1 3.13Å; F46-H86 HydrophobicContact CD2-CB 4.12Å; F46-H86 HydrophobicContact CE2-CB 3.98Å; H86-V141 CarbonylContact O-C 3.5Å; H86-V141 WeakPolarHBondContact O-CA 3.26Å; H86-G142 PolarHBondContact N-O 2.95Å; H86-G142 PolarHBondContact O-N 3.18Å
87I89.9Confident86.2Confident0 Ų055.6 Ų55.60%028%0.276CS..EExtended strand (participates in β ladder)trans-111134.9175.5-61.5165.5000108.8D35 L36 A72 M76 F85 A140 V141D35-I87 CarbonylContact C-O 3.6Å; D35-I87 WeakPolarHBondContact CA-O 3.35Å; L36-I87 HydrophobicContact CB-CB 4.32Å; L36-I87 PolarHBondContact N-O 2.7Å; L36-I87 PolarHBondContact O-N 2.7Å; L36-I87 VanDerWaalsContact O-N 3.16Å; A72-I87 HydrophobicContact CB-CD1 4.25Å; M76-I87 HydrophobicContact CB-CD1 4.33Å; M76-I87 HydrophobicContact CG-CD1 3.97Å; F85-I87 HydrophobicContact CD2-CD1 3.8Å; F85-I87 HydrophobicContact CD2-CG1 3.7Å; F85-I87 HydrophobicContact CE2-CD1 3.57Å; F85-I87 HydrophobicContact CE2-CG1 3.93Å; I87-A140 CarbonylContact C-O 3.55Å; I87-A140 WeakPolarHBondContact CA-O 3.36Å; I87-V141 HydrophobicContact CG1-CB 4.41Å; I87-V141 HydrophobicContact CG1-CG1 3.98Å; I87-V141 HydrophobicContact CG1-CG2 3.95Å
88R88.6Confident85.8Confident133 Ų13359.6 Ų59.650%0.50229%0.285SS..EExtended strand (participates in β ladder)trans-128.5122.8172.4-179.8163.2-172.2-167.52.7111.4F34 D35 M139 A140F34-R88 WeakPolarHBondContact O-CA 2.94Å; D35-R88 WeakPolarHBondContact OD1-CB 3.18Å; D35-R88 WeakPolarHBondContact OD1-CD 3.18Å; D35-R88 WeakPolarHBondContact OD1-CG 3.24Å; D35-R88 IonicContact OD1-NE 3.21Å; R88-M139 WeakPolarHBondContact O-CA 3.18Å; R88-A140 PolarHBondContact N-O 3.14Å; R88-A140 PolarHBondContact O-N 3.4Å
89V89.1Confident85.4Confident0 Ų051.7 Ų51.70%025%0.252CS..EExtended strand (participates in β ladder)trans-82.5116.1167.4-175.90000107.8I31 F34 L65 R69 L91 M139I31-V89 HydrophobicContact CD1-CB 4.21Å; I31-V89 HydrophobicContact CD1-CG1 3.92Å; I31-V89 HydrophobicContact CD1-CG2 4.18Å; F34-V89 HydrophobicContact CD1-CB 4.13Å; F34-V89 HydrophobicContact CD1-CG1 4.28Å; F34-V89 PolarHBondContact O-N 3.23Å; L65-V89 HydrophobicContact CD1-CG1 4.25Å; L65-V89 HydrophobicContact CD2-CG1 4.29Å; R69-V89 HydrophobicContact CB-CG2 4.37Å; R69-V89 HydrophobicContact CG-CG2 4.15Å; V89-L91 HydrophobicContact CG1-CB 4.38Å; V89-M139 HydrophobicContact CG1-CG 4.47Å; V89-M139 HydrophobicContact CG2-CG 4.09Å; V89-M139 HydrophobicContact CG2-SD 4.06Å
90R85.8Confident85Confident86 Ų8650.9 Ų50.933%0.32524%0.242SC..  trans-85.3-17-176.9-63.7178.771.9160.511.4112.7S137 Q138R90-S137 WeakPolarHBondContact CD-OG 3.4Å; R90-S137 PolarHBondContact NE-OG 2.95Å; R90-S137 PolarHBondContact NH1-OG 3.22Å; R90-Q138 PolarHBondContact N-O 3.42Å
91L82.5Confident84.3Confident11 Ų1154.7 Ų54.76%0.05825%0.254CS..  trans-87.5128.4-175.6-69.3169.5000111.6F34 L60 L65 V89 M125 L127 Q138F34-L91 WeakPolarHBondContact CE1-O 3.33Å; L60-L91 HydrophobicContact CD1-CD1 3.91Å; L65-L91 HydrophobicContact CD1-CB 3.98Å; L65-L91 HydrophobicContact CD2-CB 4.36Å; L65-L91 HydrophobicContact CD2-CD1 3.98Å; V89-L91 HydrophobicContact CG1-CB 4.38Å; L91-M125 HydrophobicContact CB-CE 4.09Å; L91-M125 HydrophobicContact CB-SD 3.51Å; L91-M125 VanDerWaalsContact CB-SD 3.51Å; L91-M125 HydrophobicContact CD1-CE 4.25Å; L91-M125 HydrophobicContact CD1-SD 3.59Å; L91-M125 VanDerWaalsContact CD1-SD 3.59Å; L91-M125 HydrophobicContact CD2-SD 3.65Å; L91-M125 HydrophobicContact CG-SD 3.75Å; L91-L127 HydrophobicContact CD2-CD2 4.26Å; L91-Q138 HydrophobicContact CD1-CB 3.53Å; L91-Q138 HydrophobicContact CD1-CG 3.78Å; L91-Q138 HydrophobicContact CG-CB 4.42Å
92H83Confident83.4Confident68 Ų6856.4 Ų56.432%0.31525%0.254SS..  trans-115.9127.8175.5-67-73.7000110.8F34 F94F34-H92 AromaticContact CD1-CE1 3.53Å; F34-H92 AromaticContact CD1-ND1 3.57Å; F34-H92 AromaticContact CD2-CE1 3.67Å; F34-H92 AromaticContact CD2-ND1 3.92Å; F34-H92 AromaticContact CE1-CE1 3.66Å; F34-H92 AromaticContact CE1-ND1 3.18Å; F34-H92 WeakPolarHBondContact CE1-ND1 3.48Å; F34-H92 AromaticContact CE2-CE1 3.78Å; F34-H92 AromaticContact CE2-ND1 3.55Å; F34-H92 AromaticContact CG-CE1 3.55Å; F34-H92 AromaticContact CG-ND1 3.93Å; F34-H92 AromaticContact CZ-CE1 3.8Å; F34-H92 AromaticContact CZ-ND1 3.18Å; F34-H92 WeakPolarHBondContact CZ-ND1 3.22Å; H92-F94 HydrophobicContact CB-CD2 4.11Å; H92-F94 HydrophobicContact CB-CE1 4.21Å; H92-F94 HydrophobicContact CB-CE2 3.43Å; H92-F94 VanDerWaalsContact CB-CE2 3.43Å; H92-F94 HydrophobicContact CB-CZ 3.49Å; H92-F94 VanDerWaalsContact CB-CZ 3.49Å; H92-F94 WeakPolarHBondContact O-CD2 3.39Å; H92-F94 PolarHBondContact O-N 3.18Å; H92-F94 VanDerWaalsContact O-N 3.15Å
93P85.6Confident82.6Confident11 Ų1154 Ų547%0.07125%0.248CC..  trans-79.598.2-179.231.5-34000111.2A29 I31 M123 L124A29-P93 HydrophobicContact CB-CG 3.54Å; I31-P93 HydrophobicContact CG2-CG 3.84Å; P93-M123 HydrophobicContact CB-CB 4.18Å; P93-L124 CarbonylContact C-O 3.55Å
94F83.9Confident81.9Confident124 Ų12454.3 Ų54.354%0.54426%0.259SS..  trans-102.6-21.7177-62.9-59000114P18 H92 L124P18-F94 WeakPolarHBondContact CA-O 3.45Å; H92-F94 HydrophobicContact CB-CD2 4.11Å; H92-F94 HydrophobicContact CB-CE1 4.21Å; H92-F94 HydrophobicContact CB-CE2 3.43Å; H92-F94 VanDerWaalsContact CB-CE2 3.43Å; H92-F94 HydrophobicContact CB-CZ 3.49Å; H92-F94 VanDerWaalsContact CB-CZ 3.49Å; H92-F94 WeakPolarHBondContact O-CD2 3.39Å; H92-F94 PolarHBondContact O-N 3.18Å; H92-F94 VanDerWaalsContact O-N 3.15Å; F94-L124 PolarHBondContact N-O 3.15Å
95H85.4Confident81.2Confident12 Ų1258.1 Ų58.16%0.05628%0.282CS..EExtended strand (participates in β ladder)trans-85122.8-174.3-178.640.1000111.2Y17 Q59 M123 L124 N126Y17-H95 PolarHBondContact N-ND1 3.34Å; Q59-H95 PolarHBondContact NE2-CD2 2.89Å; Q59-H95 VanDerWaalsContact NE2-CD2 3.34Å; Q59-H95 PolarHBondContact NE2-NE2 3.38Å; H95-M123 CarbonylContact O-C 3.49Å; H95-M123 WeakPolarHBondContact O-CA 3.48Å; H95-L124 CarbonylContact C-O 3.57Å; H95-L124 WeakPolarHBondContact CA-O 3.48Å; H95-L124 WeakPolarHBondContact CB-O 3.18Å; H95-L124 PolarHBondContact N-O 3.42Å; H95-L124 CarbonylContact O-C 3.45Å; H95-L124 WeakPolarHBondContact O-CA 3.37Å; H95-L124 PolarHBondContact O-N 2.65Å; H95-N126 PolarHBondContact CD2-ND2 3.14Å; H95-N126 VanDerWaalsContact CG-ND2 3.25Å
96V84.2Confident80.3Confident3 Ų363.3 Ų63.32%0.01833%0.326CS..EExtended strand (participates in β ladder)trans-90.9128.1177.3-172.90000110.5Y17 V26 P120 M123Y17-V96 HydrophobicContact CD1-CB 4.23Å; Y17-V96 PolarHBondContact O-N 3.29Å; V26-V96 HydrophobicContact CB-CG2 4.35Å; V26-V96 HydrophobicContact CG1-CB 4.33Å; V26-V96 HydrophobicContact CG1-CG1 3.87Å; V26-V96 HydrophobicContact CG1-CG2 3.48Å; V26-V96 VanDerWaalsContact CG1-CG2 3.48Å; V26-V96 HydrophobicContact CG2-CG1 4.07Å; V26-V96 HydrophobicContact CG2-CG2 3.9Å; V96-P120 HydrophobicContact CG1-CB 3.63Å; V96-M123 HydrophobicContact CG2-CG 4.07Å
97I84.3Confident79.2Confident12 Ų1263.6 Ų63.66%0.06234%0.342CS..EExtended strand (participates in β ladder)trans-81.6141167.3-43.8174.1000109.6Y9 S121 S122 L124Y9-I97 HydrophobicContact CD1-CD1 4.09Å; Y9-I97 HydrophobicContact CD1-CG2 3.44Å; Y9-I97 VanDerWaalsContact CD1-CG2 3.44Å; Y9-I97 HydrophobicContact CD2-CD1 3.5Å; Y9-I97 HydrophobicContact CD2-CG2 4.42Å; Y9-I97 HydrophobicContact CE1-CD1 4.45Å; Y9-I97 HydrophobicContact CE1-CG2 3.22Å; Y9-I97 HydrophobicContact CE2-CD1 3.86Å; Y9-I97 HydrophobicContact CE2-CG2 4.21Å; Y9-I97 HydrophobicContact CG-CD1 3.62Å; Y9-I97 HydrophobicContact CG-CG1 4.46Å; Y9-I97 HydrophobicContact CG-CG2 4.06Å; I97-S121 PolarHBondContact O-N 3.06Å; I97-S121 PolarHBondContact O-OG 3.41Å; I97-S122 WeakPolarHBondContact CD1-OG 3.18Å; I97-S122 PolarHBondContact N-O 2.81Å; I97-L124 HydrophobicContact CD1-CD1 3.19Å; I97-L124 HydrophobicContact CD1-CD2 3.68Å; I97-L124 HydrophobicContact CD1-CG 3.23Å; I97-L124 HydrophobicContact CG1-CB 4.23Å; I97-L124 HydrophobicContact CG1-CD1 3.34Å; I97-L124 HydrophobicContact CG1-CD2 4.31Å; I97-L124 HydrophobicContact CG1-CG 3.33Å
98R81.9Confident77.9Confident133 Ų13364.3 Ų64.350%0.50235%0.348SS..EExtended strand (participates in β ladder)trans-104.6133.7168-60.9-171-67.6-174-0.8110.8A118 S119R98-A118 HydrophobicContact CB-CB 3.9Å; R98-S119 WeakPolarHBondContact CA-O 3.34Å
99I82.6Confident76.6Confident21 Ų2164.8 Ų64.811%0.10836%0.361CS..EExtended strand (participates in β ladder)trans-113.9123.4170.6-69.5175.9000107.9R4 Y9 K101 S119 S121R4-I99 HydrophobicContact CB-CD1 4.45Å; R4-I99 HydrophobicContact CG-CD1 4.26Å; Y9-I99 WeakPolarHBondContact OH-CD1 3.14Å; Y9-I99 WeakPolarHBondContact OH-CG1 3Å; I99-K101 HydrophobicContact CG2-CG 4.4Å; I99-K101 PolarHBondContact O-N 3.07Å; I99-S119 PolarHBondContact N-O 2.8Å; I99-S119 PolarHBondContact O-N 2.83Å; I99-S119 PolarHBondContact O-OG 2.7Å; I99-S121 VanDerWaalsContact CD1-CB 3.48Å; I99-S121 WeakPolarHBondContact CD1-OG 3.48Å; I99-S121 WeakPolarHBondContact CG1-OG 3.48Å
100N78.3Confident74.9Confident50 Ų5076.4 Ų76.427%0.26741%0.405SS..  trans-76.9113.4161.5-165.711.2000108.4R4 Q114 A118R4-N100 PolarHBondContact NH2-O 2.99Å; R4-N100 VanDerWaalsContact NH2-O 3.14Å; N100-Q114 PolarHBondContact ND2-O 3.09Å; N100-A118 HydrophobicContact CB-CB 4.46Å
101K68Low73.5Confident123 Ų12376.2 Ų76.254%0.53542%0.417SS..PPolyproline II helixtrans-79.9123.4-177.1-72.5-178.9-176.8172.80108.4M1 I99M1-K101 HydrophobicContact CE-CB 4.1Å; M1-K101 HydrophobicContact CE-CD 4.04Å; M1-K101 HydrophobicContact CE-CG 4.13Å; M1-K101 HydrophobicContact SD-CB 4.3Å; M1-K101 HydrophobicContact SD-CD 4.31Å; M1-K101 HydrophobicContact SD-CG 3.98Å; I99-K101 HydrophobicContact CG2-CG 4.4Å; I99-K101 PolarHBondContact O-N 3.07Å
102M67.4Low71.9Confident67 Ų6776.9 Ų76.933%0.3342%0.421SS..PPolyproline II helixtrans-97.9137.9172-61.1-69.9-70.800108.1T112 Q114M102-T112 HydrophobicContact CE-CG2 4.23Å; M102-T112 HydrophobicContact SD-CG2 4.11Å; M102-Q114 HydrophobicContact CE-CB 4.43Å; M102-Q114 HydrophobicContact CE-CG 3.57Å; M102-Q114 HydrophobicContact SD-CB 4.32Å; M102-Q114 HydrophobicContact SD-CG 3.95Å
103L65.9Low70.4Confident100 Ų10077.5 Ų77.552%0.52443%0.433SS..PPolyproline II helixtrans-77.8128.3169.8-67.4161.1000107.5A108L103-A108 HydrophobicContact CB-CB 4.13Å; L103-A108 VanDerWaalsContact O-CB 3.26Å; L103-A108 WeakPolarHBondContact O-CB 3.35Å
104S69.9Low68.7Low121 Ų12181.5 Ų81.585%0.84645%0.451SS*.  trans-103.318.3-178.9-57.50000113
105C71.7Confident67.1Low92 Ų9287 Ų8762%0.62247%0.468SS*.SBendtrans-77.4149.9178.4-54.30000110.9G107 A108C105-G107 PolarHBondContact O-N 3.36Å; C105-A108 WeakPolarHBondContact O-CB 3.48Å; C105-A108 PolarHBondContact O-N 2.95Å
106A69.8Low65.2Low111 Ų11190.7 Ų90.792%0.91750%0.495SS*.THydrogen-bonded Turntrans-55.7130.6171.200000110.1
107G64.9Low63.8Low57 Ų5793.5 Ų93.559%0.58853%0.525SS*.THydrogen-bonded Turntrans837.1-174.300000115.8C105 D109 R110C105-G107 PolarHBondContact O-N 3.36Å; G107-D109 PolarHBondContact O-N 3.44Å; G107-D109 VanDerWaalsContact O-N 3.1Å; G107-R110 PolarHBondContact O-N 3.06Å
108A62.1Low62.7Low15 Ų1595 Ų9512%0.12454%0.539CS..THydrogen-bonded Turntrans-60.9-15.5175.900000114.2L103 C105 R110 S111 T112L103-A108 HydrophobicContact CB-CB 4.13Å; L103-A108 VanDerWaalsContact O-CB 3.26Å; L103-A108 WeakPolarHBondContact O-CB 3.35Å; C105-A108 WeakPolarHBondContact O-CB 3.48Å; C105-A108 PolarHBondContact O-N 2.95Å; A108-R110 PolarHBondContact O-N 3.08Å; A108-S111 PolarHBondContact O-N 3.13Å; A108-T112 WeakPolarHBondContact O-CB 3.5Å; A108-T112 PolarHBondContact O-N 3.4Å; A108-T112 VanDerWaalsContact O-N 3.11Å; A108-T112 PolarHBondContact O-OG1 3.2Å
109D61.3Low61.7Low143 Ų14390.4 Ų90.477%0.76553%0.527SS*.THydrogen-bonded Turntrans-55.1-37.8175.4-165.9-86.5000112.4G107G107-D109 PolarHBondContact O-N 3.44Å; G107-D109 VanDerWaalsContact O-N 3.1Å
110R54.9Low60.5Low245 Ų24591.3 Ų91.393%0.92553%0.534SS*.THydrogen-bonded Turntrans-82.4-23.6-177.2-68.3-173.2178.1147.50.2115G107 A108G107-R110 PolarHBondContact O-N 3.06Å; A108-R110 PolarHBondContact O-N 3.08Å
111S56.7Low59.5Low82 Ų8290.5 Ų90.557%0.57353%0.533SS*.THydrogen-bonded Turntrans-118.74.2-167.538.80000113.6A108 S113A108-S111 PolarHBondContact O-N 3.13Å; S111-S113 PolarHBondContact O-N 3.44Å
112T48.6Very low59.1Low25 Ų2585.2 Ų85.215%0.15351%0.511CS..  trans-90.7105.9175.1-43.70000109.6M102 A108 Q114M102-T112 HydrophobicContact CE-CG2 4.23Å; M102-T112 HydrophobicContact SD-CG2 4.11Å; A108-T112 WeakPolarHBondContact O-CB 3.5Å; A108-T112 PolarHBondContact O-N 3.4Å; A108-T112 VanDerWaalsContact O-N 3.11Å; A108-T112 PolarHBondContact O-OG1 3.2Å; T112-Q114 VanDerWaalsContact CB-CG 3.44Å; T112-Q114 HydrophobicContact CG2-CB 4.19Å; T112-Q114 HydrophobicContact CG2-CG 3.29Å; T112-Q114 PolarHBondContact O-N 3.1Å
113S50Low58.4Low81 Ų8182.8 Ų82.857%0.56650%0.499SS*.  trans-68.765.5159.657.50000108.9S111 R115 S116S111-S113 PolarHBondContact O-N 3.44Å; S113-R115 PolarHBondContact O-N 3.32Å; S113-S116 WeakPolarHBondContact CB-OG 3.27Å; S113-S116 PolarHBondContact O-N 3.08Å
114Q51Low57.8Low95 Ų9578.4 Ų78.444%0.44448%0.476SS..THydrogen-bonded Turntrans-57.3-6.9-165.6-71.2-172.16.800114.7N100 M102 T112N100-Q114 PolarHBondContact ND2-O 3.09Å; M102-Q114 HydrophobicContact CE-CB 4.43Å; M102-Q114 HydrophobicContact CE-CG 3.57Å; M102-Q114 HydrophobicContact SD-CB 4.32Å; M102-Q114 HydrophobicContact SD-CG 3.95Å; T112-Q114 VanDerWaalsContact CB-CG 3.44Å; T112-Q114 HydrophobicContact CG2-CB 4.19Å; T112-Q114 HydrophobicContact CG2-CG 3.29Å; T112-Q114 PolarHBondContact O-N 3.1Å
115R49.5Very low56.9Low239 Ų23972.8 Ų72.890%0.90244%0.437SS*.THydrogen-bonded Turntrans-122.71.4-180-71.9178.3174.6175-1.7114.3S113 G117S113-R115 PolarHBondContact O-N 3.32Å; R115-G117 PolarHBondContact O-N 2.7Å
116S46.9Very low56Low89 Ų8968.7 Ų68.762%0.62241%0.409SS*.SBendtrans-92.783.6-172.3-530000111.9S113S113-S116 WeakPolarHBondContact CB-OG 3.27Å; S113-S116 PolarHBondContact O-N 3.08Å
117G55Low54.9Low63 Ų6363.9 Ų63.965%0.64937%0.367SS*.  trans84.3100.6162.200000115.4R115 S119R115-G117 PolarHBondContact O-N 2.7Å; G117-S119 PolarHBondContact O-N 3.34Å
118A60.3Low53.4Low44 Ų4468 Ų6836%0.36437%0.369SS..PPolyproline II helixtrans-73.8123.7174.600000111.6R98 N100R98-A118 HydrophobicContact CB-CB 3.9Å; N100-A118 HydrophobicContact CB-CB 4.46Å
119S60.3Low52.2Low36 Ų3670.6 Ų70.625%0.25238%0.384SS..EExtended strand (participates in β ladder)trans-80.8141.9176.662.10000112.1R98 I99 G117R98-S119 WeakPolarHBondContact CA-O 3.34Å; I99-S119 PolarHBondContact N-O 2.8Å; I99-S119 PolarHBondContact O-N 2.83Å; I99-S119 PolarHBondContact O-OG 2.7Å; G117-S119 PolarHBondContact O-N 3.34Å
120P58.6Low50.6Low39 Ų3970.6 Ų70.625%0.25337%0.373SS..EExtended strand (participates in β ladder)trans-66.3132.8170.126.1-30.2000110V26 V96V26-P120 HydrophobicContact CG2-CB 4.14Å; V26-P120 HydrophobicContact CG2-CG 4.42Å; V96-P120 HydrophobicContact CG1-CB 3.63Å
121S57.6Low49.3Very low33 Ų3369.9 Ų69.923%0.23137%0.371CS..EExtended strand (participates in β ladder)trans-121.3-30.1-171.163.60000115P27 I97 I99P27-S121 WeakPolarHBondContact CG-O 3.35Å; I97-S121 PolarHBondContact O-N 3.06Å; I97-S121 PolarHBondContact O-OG 3.41Å; I99-S121 VanDerWaalsContact CD1-CB 3.48Å; I99-S121 WeakPolarHBondContact CD1-OG 3.48Å; I99-S121 WeakPolarHBondContact CG1-OG 3.48Å
122S57.9Low48.4Very low12 Ų1272.4 Ų72.48%0.08438%0.377CS..EExtended strand (participates in β ladder)trans-168151.3-172.246.30000110.5I97I97-S122 WeakPolarHBondContact CD1-OG 3.18Å; I97-S122 PolarHBondContact N-O 2.81Å
123M53.7Low47.7Very low17 Ų1779.2 Ų79.28%0.08440%0.404CS..EExtended strand (participates in β ladder)trans-93.5127.5171-71.6-164.6-89.400110.7V26 P27 A29 S62 P93 H95 V96V26-M123 HydrophobicContact CG1-CE 4.29Å; V26-M123 HydrophobicContact CG1-CG 3.82Å; V26-M123 HydrophobicContact CG1-SD 4.02Å; P27-M123 WeakPolarHBondContact O-CE 3.34Å; A29-M123 HydrophobicContact CB-CE 3.79Å; S62-M123 PolarHBondContact N-O 3.32Å; S62-M123 PolarHBondContact OG-O 3.17Å; P93-M123 HydrophobicContact CB-CB 4.18Å; H95-M123 CarbonylContact O-C 3.49Å; H95-M123 WeakPolarHBondContact O-CA 3.48Å; V96-M123 HydrophobicContact CG2-CG 4.07Å
124L53.1Low46.9Very low7 Ų780.5 Ų80.54%0.03741%0.413CS..EExtended strand (participates in β ladder)trans-104.6173.8160.7-62.3-179.8000109.1Y9 Q59 L60 P93 F94 H95 I97Y9-L124 VanDerWaalsContact CB-CD1 3.48Å; Y9-L124 HydrophobicContact CG-CD1 4.24Å; Q59-L124 HydrophobicContact CB-CB 4.38Å; Q59-L124 HydrophobicContact CB-CD1 3.83Å; L60-L124 WeakPolarHBondContact O-CA 3.37Å; P93-L124 CarbonylContact C-O 3.55Å; F94-L124 PolarHBondContact N-O 3.15Å; H95-L124 CarbonylContact C-O 3.57Å; H95-L124 WeakPolarHBondContact CA-O 3.48Å; H95-L124 WeakPolarHBondContact CB-O 3.18Å; H95-L124 PolarHBondContact N-O 3.42Å; H95-L124 CarbonylContact O-C 3.45Å; H95-L124 WeakPolarHBondContact O-CA 3.37Å; H95-L124 PolarHBondContact O-N 2.65Å; I97-L124 HydrophobicContact CD1-CD1 3.19Å; I97-L124 HydrophobicContact CD1-CD2 3.68Å; I97-L124 HydrophobicContact CD1-CG 3.23Å; I97-L124 HydrophobicContact CG1-CB 4.23Å; I97-L124 HydrophobicContact CG1-CD1 3.34Å; I97-L124 HydrophobicContact CG1-CD2 4.31Å; I97-L124 HydrophobicContact CG1-CG 3.33Å
125M50.3Low46.8Very low3 Ų378 Ų782%0.01541%0.413CS..EExtended strand (participates in β ladder)trans-107150156.976.3-164.187.800109.1Q59 L60 L65 L91Q59-M125 VanDerWaalsContact CA-O 3.3Å; Q59-M125 WeakPolarHBondContact CA-O 3.18Å; Q59-M125 WeakPolarHBondContact CB-O 3.21Å; L60-M125 HydrophobicContact CB-CE 3.3Å; L60-M125 HydrophobicContact CB-CG 4.08Å; L60-M125 HydrophobicContact CB-SD 3.85Å; L60-M125 HydrophobicContact CD1-CE 4.35Å; L60-M125 HydrophobicContact CD1-SD 4.31Å; L60-M125 HydrophobicContact CG-CE 4.46Å; L60-M125 PolarHBondContact O-N 3.38Å; L65-M125 HydrophobicContact CD1-CE 3.1Å; L65-M125 HydrophobicContact CD1-SD 4.35Å; L65-M125 HydrophobicContact CD2-CE 3.82Å; L65-M125 HydrophobicContact CG-CE 3.34Å; L91-M125 HydrophobicContact CB-CE 4.09Å; L91-M125 HydrophobicContact CB-SD 3.51Å; L91-M125 VanDerWaalsContact CB-SD 3.51Å; L91-M125 HydrophobicContact CD1-CE 4.25Å; L91-M125 HydrophobicContact CD1-SD 3.59Å; L91-M125 VanDerWaalsContact CD1-SD 3.59Å; L91-M125 HydrophobicContact CD2-SD 3.65Å; L91-M125 HydrophobicContact CG-SD 3.75Å
126N52.7Low46.9Very low6 Ų667.8 Ų67.83%0.03238%0.378CS..EExtended strand (participates in β ladder)trans-89.6130.6156.9-84.8-56.3000107.5C12 Q59 H95 K128 T129C12-N126 WeakPolarHBondContact CB-OD1 3.34Å; C12-N126 PolarHBondContact SG-OD1 3.31Å; Q59-N126 WeakPolarHBondContact CG-OD1 3.06Å; Q59-N126 PolarHBondContact NE2-OD1 3.17Å; H95-N126 PolarHBondContact CD2-ND2 3.14Å; H95-N126 VanDerWaalsContact CG-ND2 3.25Å; N126-K128 HydrophobicContact CB-CB 4.24Å; N126-K128 PolarHBondContact O-N 3.15Å; N126-K128 VanDerWaalsContact O-N 3.08Å; N126-T129 PolarHBondContact O-N 3.38Å; N126-T129 PolarHBondContact O-OG1 3.47Å
127L46.7Very low47.3Very low10 Ų1064.4 Ų64.45%0.05236%0.355CS..G310 helixtrans-59.1-16.5165-81.6165.4000111.6E56 Y57 E58 L91E56-L127 WeakPolarHBondContact O-CD1 3.46Å; Y57-L127 HydrophobicContact CD2-CB 4.1Å; Y57-L127 HydrophobicContact CE2-CB 4.19Å; E58-L127 HydrophobicContact CG-CD1 3.84Å; E58-L127 WeakPolarHBondContact O-CB 3.15Å; E58-L127 WeakPolarHBondContact O-CD1 3Å; E58-L127 VanDerWaalsContact O-CG 3.3Å; E58-L127 WeakPolarHBondContact O-CG 3.46Å; E58-L127 PolarHBondContact O-N 3.36Å; L91-L127 HydrophobicContact CD2-CD2 4.26Å
128K34.2Very low47.8Very low143 Ų14362.7 Ų62.762%0.62233%0.33SS*.G310 helixtrans-70-27.1175.1-125.9-177.4-168.71730115.5Y57 N126 W130Y57-K128 HydrophobicContact CE2-CB 3.89Å; Y57-K128 HydrophobicContact CE2-CG 3.83Å; Y57-K128 WeakPolarHBondContact OH-CB 3.19Å; Y57-K128 WeakPolarHBondContact OH-CD 3.49Å; Y57-K128 WeakPolarHBondContact OH-CG 3.33Å; N126-K128 HydrophobicContact CB-CB 4.24Å; N126-K128 PolarHBondContact O-N 3.15Å; N126-K128 VanDerWaalsContact O-N 3.08Å; K128-W130 CarbonylContact O-C 3.43Å; K128-W130 PolarHBondContact O-N 3Å
129T36.2Very low47.7Very low71 Ų7161 Ų6144%0.43632%0.315SS..G310 helixtrans-77.9-5.2-174.728.50000113P16 N126P16-T129 HydrophobicContact CB-CG2 4.29Å; P16-T129 HydrophobicContact CG-CG2 4.37Å; N126-T129 PolarHBondContact O-N 3.38Å; N126-T129 PolarHBondContact O-OG1 3.47Å
130W28.1Very low47.8Very low143 Ų14360 Ų6054%0.54231%0.309SS..SBendtrans-97.9112.6152.4-97.961000107.4K128 L132K128-W130 CarbonylContact O-C 3.43Å; K128-W130 PolarHBondContact O-N 3Å; W130-L132 PolarHBondContact O-N 2.88Å
131W28.4Very low48.1Very low230 Ų23059.9 Ų59.987%0.87131%0.307SS*.  trans-61.1125.9-170.2-148.171.5000110.8
132L36.3Very low47.9Very low135 Ų13558.9 Ų58.971%0.70730%0.302SS*.SBendtrans45.895.7163.5-120.586.9000117.2W130W130-L132 PolarHBondContact O-N 2.88Å
133K34Very low47.8Very low168 Ų16858.9 Ų58.973%0.7330%0.301SS*.  trans166.9130.3132.6-94.4166.3179.8-175.20110.4G135 S136K133-G135 PolarHBondContact O-N 3.14Å; K133-G135 VanDerWaalsContact O-N 3.1Å; K133-S136 PolarHBondContact O-N 3.1Å; K133-S136 PolarHBondContact O-OG 2.89Å
134S34.4Very low47.5Very low108 Ų10861.3 Ų61.376%0.75532%0.32SS*.THydrogen-bonded Turntrans-39.811314431.80000107.9
135G48.6Very low47.4Very low42 Ų4264.7 Ų64.743%0.43334%0.341SS..THydrogen-bonded Turntrans129.45.7-167.600000116.6V53 K133 S137V53-G135 VanDerWaalsContact CG1-C 3.5Å; V53-G135 VanDerWaalsContact CG1-CA 3.42Å; K133-G135 PolarHBondContact O-N 3.14Å; K133-G135 VanDerWaalsContact O-N 3.1Å; G135-S137 PolarHBondContact O-N 3.17Å; G135-S137 VanDerWaalsContact O-N 3.1Å
136S51.1Low46.9Very low24 Ų2469.2 Ų69.217%0.16837%0.373CS..  trans-68.7110.7-179.3-220000110.4K133 Q138K133-S136 PolarHBondContact O-N 3.1Å; K133-S136 PolarHBondContact O-OG 2.89Å; S136-Q138 PolarHBondContact O-N 3.44Å
137S55.1Low46.5Very low19 Ų1972.6 Ų72.613%0.13340%0.395CS..EExtended strand (participates in β ladder)trans-67.4115.1174.862.60000110.1M52 R90 G135M52-S137 CarbonylContact O-C 3.58Å; M52-S137 WeakPolarHBondContact O-CA 3.19Å; R90-S137 WeakPolarHBondContact CD-OG 3.4Å; R90-S137 PolarHBondContact NE-OG 2.95Å; R90-S137 PolarHBondContact NH1-OG 3.22Å; G135-S137 PolarHBondContact O-N 3.17Å; G135-S137 VanDerWaalsContact O-N 3.1Å
138Q65.8Low46Very low26 Ų2677.6 Ų77.612%0.12143%0.426CS..EExtended strand (participates in β ladder)trans-74.5-46.3-178.7-53-173.925.400111.6M52 S54 R90 L91 S136M52-Q138 WeakPolarHBondContact O-CB 3.27Å; M52-Q138 PolarHBondContact O-N 3.27Å; S54-Q138 PolarHBondContact OG-NE2 2.7Å; S54-Q138 VanDerWaalsContact OG-NE2 3.13Å; R90-Q138 PolarHBondContact N-O 3.42Å; L91-Q138 HydrophobicContact CD1-CB 3.53Å; L91-Q138 HydrophobicContact CD1-CG 3.78Å; L91-Q138 HydrophobicContact CG-CB 4.42Å; S136-Q138 PolarHBondContact O-N 3.44Å
139M59.4Low46.2Very low10 Ų1075.4 Ų75.45%0.04943%0.425CS..EExtended strand (participates in β ladder)trans-136.7142179.6-66.4-167.4-71.500110H51 M52 A68 R88 V89H51-M139 WeakPolarHBondContact CA-O 3.17Å; M52-M139 HydrophobicContact CB-CB 4.47Å; M52-M139 HydrophobicContact CE-CE 3.87Å; M52-M139 PolarHBondContact N-O 2.94Å; M52-M139 HydrophobicContact SD-CE 3.66Å; A68-M139 HydrophobicContact CB-CE 3.92Å; R88-M139 WeakPolarHBondContact O-CA 3.18Å; V89-M139 HydrophobicContact CG1-CG 4.47Å; V89-M139 HydrophobicContact CG2-CG 4.09Å; V89-M139 HydrophobicContact CG2-SD 4.06Å
140A61.2Low46.2Very low15 Ų1575.9 Ų75.912%0.12444%0.435CS..EExtended strand (participates in β ladder)trans-116.5138.7173.400000109.5G50 H51 I87 R88G50-A140 CarbonylContact O-C 3.44Å; G50-A140 WeakPolarHBondContact O-CA 3.38Å; H51-A140 VanDerWaalsContact CE1-CB 3.45Å; H51-A140 WeakPolarHBondContact CE1-CB 3.38Å; H51-A140 VanDerWaalsContact ND1-CB 3.31Å; H51-A140 WeakPolarHBondContact ND1-CB 3.49Å; I87-A140 CarbonylContact C-O 3.55Å; I87-A140 WeakPolarHBondContact CA-O 3.36Å; R88-A140 PolarHBondContact N-O 3.14Å; R88-A140 PolarHBondContact O-N 3.4Å
141V65.6Low46.3Very low36 Ų3674.7 Ų74.722%0.21844%0.439CS..EExtended strand (participates in β ladder)trans-125.4121.2174.6-171.80000108.7C49 G50 M76 H86 I87C49-V141 CarbonylContact C-O 3.59Å; C49-V141 WeakPolarHBondContact CA-O 3.26Å; G50-V141 PolarHBondContact N-O 3.02Å; G50-V141 PolarHBondContact O-N 3.45Å; M76-V141 HydrophobicContact CE-CG1 3.74Å; M76-V141 HydrophobicContact SD-CG1 4.43Å; H86-V141 CarbonylContact O-C 3.5Å; H86-V141 WeakPolarHBondContact O-CA 3.26Å; I87-V141 HydrophobicContact CG1-CB 4.41Å; I87-V141 HydrophobicContact CG1-CG1 3.98Å; I87-V141 HydrophobicContact CG1-CG2 3.95Å
142G53.2Low46.5Very low12 Ų1276.1 Ų76.112%0.12445%0.445CS..EExtended strand (participates in β ladder)trans-96.3128.6168.100000110.3L48 F85 H86L48-G142 CarbonylContact O-C 3.58Å; L48-G142 WeakPolarHBondContact O-CA 3.38Å; F85-G142 CarbonylContact C-O 3.55Å; F85-G142 VanDerWaalsContact CA-O 3.26Å; F85-G142 WeakPolarHBondContact CA-O 3.44Å; H86-G142 PolarHBondContact N-O 2.95Å; H86-G142 PolarHBondContact O-N 3.18Å
143S55.2Low46.6Very low11 Ų1174.4 Ų74.48%0.07744%0.44CS..EExtended strand (participates in β ladder)trans-139.2154.1174.464.30000112.3L48 T145L48-S143 WeakPolarHBondContact CB-O 3.34Å; L48-S143 PolarHBondContact N-O 2.75Å; L48-S143 PolarHBondContact O-N 2.91Å; S143-T145 PolarHBondContact OG-O 2.77Å
144S48.4Very low46.4Very low69 Ų6971.7 Ų71.748%0.48344%0.442SS..SBendtrans-93.1-22.4174.858.80000112.6E45E45-S144 VanDerWaalsContact O-CB 3.3Å; E45-S144 WeakPolarHBondContact O-CB 3.38Å
145T51.4Low46.7Very low77 Ų7770.8 Ų70.847%0.47245%0.45SS..SBendtrans-89.6136.4171.9-10000109L48 S143L48-T145 WeakPolarHBondContact CD1-O 3.4Å; S143-T145 PolarHBondContact OG-O 2.77Å
146S39.3Very low45.7Very low98 Ų9871.6 Ų71.669%0.68546%0.458SS*.  trans-39.1134.8175-51.90000110.4V148S146-V148 PolarHBondContact O-N 3.42Å
147P44Very low44.9Very low77 Ų7776.2 Ų76.250%0.549%0.487SS..  trans-63.7112.7177.829.1-29.2000105.2V149P147-V149 PolarHBondContact O-N 2.57Å
148V36.5Very low43.7Very low116 Ų11681.7 Ų81.770%0.70352%0.524SS*.  trans-59.697.3150.1174.20000102.3S146 A150S146-V148 PolarHBondContact O-N 3.42Å; V148-A150 VanDerWaalsContact C-N 3.29Å; V148-A150 PolarHBondContact O-N 3.1Å
149V38.4Very low42.1Very low97 Ų9790.2 Ų90.259%0.58858%0.578SS**  trans-44.3103.3174.7173.50000104.4P147 L151P147-V149 PolarHBondContact O-N 2.57Å; V149-L151 HydrophobicContact CG1-CB 3.97Å; V149-L151 HydrophobicContact CG1-CD1 3.58Å; V149-L151 HydrophobicContact CG1-CG 4.4Å; V149-L151 PolarHBondContact O-N 3.11Å
150A36.1Very low41.3Very low80 Ų8094.2 Ų94.266%0.66161%0.605SS**  trans-69.678.2164.600000103.9V148 W152V148-A150 VanDerWaalsContact C-N 3.29Å; V148-A150 PolarHBondContact O-N 3.1Å; A150-W152 PolarHBondContact O-N 3.26Å
151L29.7Very low40.2Very low119 Ų11998.4 Ų98.462%0.62363%0.63SS**  trans-63.887.2174-15785.8000103.9V149 T153V149-L151 HydrophobicContact CG1-CB 3.97Å; V149-L151 HydrophobicContact CG1-CD1 3.58Å; V149-L151 HydrophobicContact CG1-CG 4.4Å; V149-L151 PolarHBondContact O-N 3.11Å; L151-T153 WeakPolarHBondContact CD2-OG1 3.12Å; L151-T153 HydrophobicContact CG-CG2 4.1Å; L151-T153 WeakPolarHBondContact CG-OG1 3.41Å; L151-T153 PolarHBondContact O-N 3.02Å
152W32.9Very low38.8Very low260 Ų260101.8 Ų101.899%0.98565%0.653SS**  trans-77.149166-135.149.6000108.1A150A150-W152 PolarHBondContact O-N 3.26Å
153T37.5Very low38Very low98 Ų98107.1 Ų107.160%0.60168%0.684SS**  trans-10684.8163.565.60000107.3L151L151-T153 WeakPolarHBondContact CD2-OG1 3.12Å; L151-T153 HydrophobicContact CG-CG2 4.1Å; L151-T153 WeakPolarHBondContact CG-OG1 3.41Å; L151-T153 PolarHBondContact O-N 3.02Å
154S30.6Very low36.9Very low111 Ų111113.1 Ų113.178%0.77672%0.722SS**  trans-161.4105.5136.243.60000107.6G156S154-G156 PolarHBondContact O-N 3.33Å; S154-G156 VanDerWaalsContact O-N 3.12Å
155G40.2Very low36.1Very low90 Ų90116.1 Ų116.193%0.92874%0.738SS**  trans-52117.2155.400000108.2
156G28.9Very low35Very low58 Ų58118.9 Ų118.960%0.59876%0.757SS**  trans-125.1129.3163.300000106.8S154 C158S154-G156 PolarHBondContact O-N 3.33Å; S154-G156 VanDerWaalsContact O-N 3.12Å; G156-C158 PolarHBondContact O-N 3.32Å
157P33.5Very low34.7Very low121 Ų121120.5 Ų120.579%0.78676%0.762SS**  trans-63.7135.9-177.725.9-31.8000110.1T159P157-T159 PolarHBondContact O-N 3.32Å; P157-T159 VanDerWaalsContact O-N 3.11Å
158C30.6Very low33.9Very low134 Ų134124.1 Ų124.191%0.90578%0.784SS**  trans-64109168.6-51.80000108.8G156G156-C158 PolarHBondContact O-N 3.32Å
159T32.4Very low33.7Very low205 Ų205124.8 Ų124.8100%1.25879%0.792SS**  trans-94.40154.453.20000109.3P157P157-T159 PolarHBondContact O-N 3.32Å; P157-T159 VanDerWaalsContact O-N 3.11Å

Retrieved 159 of 159 residues in 29.8 ms (Link to these results)

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