A0A096N1H7_PAPAN Loading...

RING finger protein 32

May play a role in sperm formation.

AlphaFold DB , UniProt , Accession A0A096N1H7, Species PAPAN (Papio anubis, Olive baboon), Gene RNF32, Length 362 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
1M35.9Very low43.5Very low232 Ų232159.2 Ų159.2100%1.14382%0.82SS**  0121.80-70.9-165.5112.500109.8
2L40.5Very low44.4Very low164 Ų164154.8 Ų154.886%0.85980%0.799SS**  trans19.7105.1156.6-60.7161.4000118.6
3K35.9Very low46.1Very low209 Ų209150.4 Ų150.491%0.90978%0.778SS**  trans-90114.5155.9-93.2179175.5176.90108.9K5K3-K5 PolarHBondContact O-N 3.1Å
4N39.3Very low48.6Very low158 Ų158147.4 Ų147.485%0.84576%0.763SS**  trans-57.9117.2173.5-73.1-31.8000110.7G6N4-G6 PolarHBondContact O-N 3.32Å
5K38.8Very low50.9Low201 Ų201141.9 Ų141.987%0.87475%0.748SS**  trans-74.9104.6164.8-82.7179.3175.5176.30108.2K3 H7K3-K5 PolarHBondContact O-N 3.1Å; K5-H7 PolarHBondContact O-N 3.34Å
6G37.6Very low52.9Low78 Ų78137.6 Ų137.680%0.80473%0.728SS**  trans-65.1109.5170.900000111N4 S8N4-G6 PolarHBondContact O-N 3.32Å; G6-S8 PolarHBondContact O-N 3.09Å
7H48.6Very low54.8Low194 Ų194132.4 Ų132.490%0.89870%0.701SS**  trans-74.895.7159.6-92.7-78.6000108.9K5K5-H7 PolarHBondContact O-N 3.34Å
8S47.3Very low56.5Low81 Ų81127.6 Ų127.657%0.56668%0.684SS**  trans-166.994158.6-163.90000111.5G6G6-S8 PolarHBondContact O-N 3.09Å
9S49.4Very low58.1Low88 Ų88125.7 Ų125.762%0.61568%0.677SS**SBendtrans-147.9-21.4166.8165.50000111.2K11S9-K11 VanDerWaalsContact C-N 3.34Å; S9-K11 PolarHBondContact O-N 3.14Å
10K52Low59.5Low191 Ų191119.5 Ų119.583%0.8364%0.644SS**THydrogen-bonded Turntrans-73.2-20.4173.5-67.2-175.3177.5-1770114
11K52.7Low60.7Low155 Ų155117.3 Ų117.367%0.67463%0.631SS**THydrogen-bonded Turntrans-80.9-29.9-178.2-77.7-175.6176.7-179.60113.5S9 N13 L14S9-K11 VanDerWaalsContact C-N 3.34Å; S9-K11 PolarHBondContact O-N 3.14Å; K11-N13 VanDerWaalsContact C-N 3.32Å; K11-N13 PolarHBondContact O-N 3.11Å; K11-L14 PolarHBondContact O-N 3.18Å
12D54.4Low63Low107 Ų107112.2 Ų112.257%0.57261%0.605SS**Hα-helixtrans-74.1-24.2-172.8-58.4-28.6000113
13N67.4Low65.2Low97 Ų97106.4 Ų106.452%0.51957%0.574SS.*Hα-helixtrans-85.6-14.6175-67.9-28.3000113.4K11 N17K11-N13 VanDerWaalsContact C-N 3.32Å; K11-N13 PolarHBondContact O-N 3.11Å; N13-N17 WeakPolarHBondContact O-CB 3.29Å; N13-N17 PolarHBondContact O-N 3.03Å; N13-N17 PolarHBondContact O-ND2 3.49Å; N13-N17 PolarHBondContact O-OD1 2.85Å
14L80.2Confident67.5Low109 Ų10997.4 Ų97.457%0.57154%0.536SS*.Hα-helixtrans-68.9-41.2-177.8-74.7168.6000111.8K11 N17 A18K11-L14 PolarHBondContact O-N 3.18Å; L14-N17 PolarHBondContact O-N 3.43Å; L14-A18 VanDerWaalsContact O-CB 3.23Å; L14-A18 WeakPolarHBondContact O-CB 3.29Å; L14-A18 PolarHBondContact O-N 2.92Å
15A82.7Confident69.6Low65 Ų6593.9 Ų93.954%0.53752%0.516SS..Hα-helixtrans-65.5-45177.800000111.4A18 V19A15-A18 PolarHBondContact O-N 3.32Å; A15-V19 WeakPolarHBondContact O-CB 3.43Å; A15-V19 VanDerWaalsContact O-CG2 3.26Å; A15-V19 WeakPolarHBondContact O-CG2 3.34Å; A15-V19 PolarHBondContact O-N 3.28Å
16V83.6Confident71.7Confident72 Ų7288.4 Ų88.444%0.43650%0.496SS..Hα-helixtrans-64.2-42.2177.41800000111.1A20 L95V16-A20 WeakPolarHBondContact O-CB 3.49Å; V16-A20 PolarHBondContact O-N 3.2Å; V16-L95 HydrophobicContact CG1-CD1 4.31Å
17N85.4Confident73.6Confident49 Ų4989 Ų8926%0.26247%0.474SS..Hα-helixtrans-66.1-41176.8-70.5-10.5000112.2N13 L14 A20 L21 L97N13-N17 WeakPolarHBondContact O-CB 3.29Å; N13-N17 PolarHBondContact O-N 3.03Å; N13-N17 PolarHBondContact O-ND2 3.49Å; N13-N17 PolarHBondContact O-OD1 2.85Å; L14-N17 PolarHBondContact O-N 3.43Å; N17-A20 PolarHBondContact O-N 3.4Å; N17-L21 VanDerWaalsContact O-CB 3.3Å; N17-L21 WeakPolarHBondContact O-CB 3.42Å; N17-L21 PolarHBondContact O-N 3.12Å; N17-L97 HydrophobicContact CB-CD1 3.59Å; N17-L97 HydrophobicContact CB-CD2 4.32Å
18A84.8Confident74.9Confident47 Ų4785.7 Ų85.739%0.38846%0.462SS..Hα-helixtrans-65.6-44.2177.300000111.9L14 A15 L21 Q22L14-A18 VanDerWaalsContact O-CB 3.23Å; L14-A18 WeakPolarHBondContact O-CB 3.29Å; L14-A18 PolarHBondContact O-N 2.92Å; A15-A18 PolarHBondContact O-N 3.32Å; A18-L21 PolarHBondContact O-N 3.42Å; A18-Q22 WeakPolarHBondContact O-CG 3.39Å; A18-Q22 PolarHBondContact O-N 3Å
19V87.1Confident76.3Confident91 Ų9186.8 Ų86.855%0.55246%0.461SS*.Hα-helixtrans-65.7-41.9175.7172.10000111.1A15 L21 Q22 D23A15-V19 WeakPolarHBondContact O-CB 3.43Å; A15-V19 VanDerWaalsContact O-CG2 3.26Å; A15-V19 WeakPolarHBondContact O-CG2 3.34Å; A15-V19 PolarHBondContact O-N 3.28Å; V19-L21 VanDerWaalsContact C-N 3.3Å; V19-L21 PolarHBondContact O-N 3.33Å; V19-Q22 PolarHBondContact O-N 3.48Å; V19-D23 WeakPolarHBondContact O-CB 3.19Å; V19-D23 PolarHBondContact O-N 3.15Å
20A86.6Confident77.1Confident2 Ų290.5 Ų90.52%0.01747%0.469CS..Hα-helixtrans-60.9-40.8175.300000111.6V16 N17 H24 L91 A92 L95V16-A20 WeakPolarHBondContact O-CB 3.49Å; V16-A20 PolarHBondContact O-N 3.2Å; N17-A20 PolarHBondContact O-N 3.4Å; A20-H24 WeakPolarHBondContact O-CB 3.38Å; A20-H24 PolarHBondContact O-N 3.11Å; A20-L91 HydrophobicContact CB-CB 4.14Å; A20-L91 HydrophobicContact CB-CD2 4.08Å; A20-L91 HydrophobicContact CB-CG 4.03Å; A20-A92 HydrophobicContact CB-CB 4.16Å; A20-A92 WeakPolarHBondContact O-CB 3.48Å; A20-L95 HydrophobicContact CB-CD1 4.17Å
21L84.9Confident77.7Confident73 Ų7385 Ų8538%0.38245%0.448SS..Hα-helixtrans-68.1-42.8177.8-170.768.6000111.9N17 A18 V19 H24 I25 I98N17-L21 VanDerWaalsContact O-CB 3.3Å; N17-L21 WeakPolarHBondContact O-CB 3.42Å; N17-L21 PolarHBondContact O-N 3.12Å; A18-L21 PolarHBondContact O-N 3.42Å; V19-L21 VanDerWaalsContact C-N 3.3Å; V19-L21 PolarHBondContact O-N 3.33Å; L21-H24 WeakPolarHBondContact O-CB 3.48Å; L21-H24 PolarHBondContact O-N 3.4Å; L21-I25 HydrophobicContact CG-CD1 4.15Å; L21-I25 VanDerWaalsContact O-CG1 3.31Å; L21-I25 WeakPolarHBondContact O-CG1 3.47Å; L21-I25 PolarHBondContact O-N 3.26Å; L21-I98 HydrophobicContact CD1-CD1 3.6Å; L21-I98 HydrophobicContact CD1-CG1 4.1Å
22Q84.4Confident77.8Confident125 Ų12585.6 Ų85.658%0.58445%0.446SS*.Hα-helixtrans-63.1-45.2175.2-74.1174.8-8.500111.9A18 V19 H24 I25 L26A18-Q22 WeakPolarHBondContact O-CG 3.39Å; A18-Q22 PolarHBondContact O-N 3Å; V19-Q22 PolarHBondContact O-N 3.48Å; Q22-H24 VanDerWaalsContact C-N 3.28Å; Q22-H24 PolarHBondContact O-N 2.86Å; Q22-I25 PolarHBondContact O-N 3.03Å; Q22-L26 WeakPolarHBondContact O-CB 3.49Å; Q22-L26 VanDerWaalsContact O-CG 3.28Å; Q22-L26 WeakPolarHBondContact O-CG 3.48Å; Q22-L26 PolarHBondContact O-N 3.49Å
23D85.3Confident77.6Confident42 Ų4288 Ų8823%0.22546%0.459CS..Hα-helixtrans-60.6-37.7174.1172.571.8000111.7V19 R27V19-D23 WeakPolarHBondContact O-CB 3.19Å; V19-D23 PolarHBondContact O-N 3.15Å; D23-R27 VanDerWaalsContact CG-NE 3.29Å; D23-R27 VanDerWaalsContact CG-NH2 3.34Å; D23-R27 WeakPolarHBondContact O-CB 3.38Å; D23-R27 VanDerWaalsContact O-CG 3.25Å; D23-R27 WeakPolarHBondContact O-CG 3.43Å; D23-R27 PolarHBondContact O-N 3.26Å; D23-R27 IonicContact OD1-CZ 3.36Å; D23-R27 IonicContact OD1-NE 3.87Å; D23-R27 PolarHBondContact OD1-NE 3.41Å; D23-R27 IonicContact OD1-NH2 3.22Å; D23-R27 PolarHBondContact OD1-NH2 2.98Å; D23-R27 IonicContact OD2-CZ 3.04Å; D23-R27 IonicContact OD2-NE 2.64Å; D23-R27 PolarHBondContact OD2-NE 3.27Å; D23-R27 IonicContact OD2-NH1 3.9Å; D23-R27 IonicContact OD2-NH2 3.5Å; D23-R27 PolarHBondContact OD2-NH2 3.41Å
24H84.8Confident76.7Confident21 Ų2189.8 Ų89.810%0.09747%0.468CS..Hα-helixtrans-64.1-49.3174.9-177.190000112.2A20 L21 Q22 L26 R27 D28 T90 A92 Q93 I98A20-H24 WeakPolarHBondContact O-CB 3.38Å; A20-H24 PolarHBondContact O-N 3.11Å; L21-H24 WeakPolarHBondContact O-CB 3.48Å; L21-H24 PolarHBondContact O-N 3.4Å; Q22-H24 VanDerWaalsContact C-N 3.28Å; Q22-H24 PolarHBondContact O-N 2.86Å; H24-L26 VanDerWaalsContact C-N 3.31Å; H24-L26 PolarHBondContact O-N 3Å; H24-R27 PolarHBondContact O-N 2.85Å; H24-R27 VanDerWaalsContact O-N 3.17Å; H24-D28 WeakPolarHBondContact O-CB 3.46Å; H24-D28 PolarHBondContact O-N 2.84Å; H24-T90 PolarHBondContact ND1-OG1 3.27Å; H24-A92 HydrophobicContact CB-CB 3.83Å; H24-Q93 PolarHBondContact CE1-NE2 2.8Å; H24-I98 HydrophobicContact CB-CD1 4.19Å; H24-I98 WeakPolarHBondContact CD2-CD1 3.36Å; H24-I98 WeakPolarHBondContact NE2-CD1 3.38Å
25I84.1Confident74.8Confident83 Ų8389.1 Ų89.143%0.42647%0.472SS..Hα-helixtrans-60.7-42179.1-67.2164.6000110.8L21 Q22 R27 D28 L29L21-I25 HydrophobicContact CG-CD1 4.15Å; L21-I25 VanDerWaalsContact O-CG1 3.31Å; L21-I25 WeakPolarHBondContact O-CG1 3.47Å; L21-I25 PolarHBondContact O-N 3.26Å; Q22-I25 PolarHBondContact O-N 3.03Å; I25-R27 VanDerWaalsContact C-N 3.33Å; I25-R27 PolarHBondContact O-N 2.71Å; I25-D28 PolarHBondContact O-N 3.41Å; I25-L29 HydrophobicContact CG2-CD1 3.78Å; I25-L29 HydrophobicContact CG2-CG 4.44Å; I25-L29 WeakPolarHBondContact O-CB 3.35Å; I25-L29 VanDerWaalsContact O-CG 3.3Å; I25-L29 WeakPolarHBondContact O-CG 3.5Å; I25-L29 PolarHBondContact O-N 3.19Å
26L82.8Confident73.1Confident86 Ų8693.1 Ų93.145%0.4549%0.49SS..Hα-helixtrans-64.9-35.4177.3-71.6171.6000112.9Q22 H24 Q30 L31Q22-L26 WeakPolarHBondContact O-CB 3.49Å; Q22-L26 VanDerWaalsContact O-CG 3.28Å; Q22-L26 WeakPolarHBondContact O-CG 3.48Å; Q22-L26 PolarHBondContact O-N 3.49Å; H24-L26 VanDerWaalsContact C-N 3.31Å; H24-L26 PolarHBondContact O-N 3Å; L26-Q30 PolarHBondContact O-N 3.3Å; L26-L31 HydrophobicContact CD2-CB 4.2Å; L26-L31 HydrophobicContact CD2-CD1 4.46Å; L26-L31 PolarHBondContact O-N 3.48Å
27R77.3Confident70.9Confident92 Ų9292.6 Ų92.635%0.34749%0.493SS..Hα-helixtrans-74.6-38.9176.1-73.6176-166.7-162.711.9112.6D23 H24 I25 Q30D23-R27 VanDerWaalsContact CG-NE 3.29Å; D23-R27 VanDerWaalsContact CG-NH2 3.34Å; D23-R27 WeakPolarHBondContact O-CB 3.38Å; D23-R27 VanDerWaalsContact O-CG 3.25Å; D23-R27 WeakPolarHBondContact O-CG 3.43Å; D23-R27 PolarHBondContact O-N 3.26Å; D23-R27 IonicContact OD1-CZ 3.36Å; D23-R27 IonicContact OD1-NE 3.87Å; D23-R27 PolarHBondContact OD1-NE 3.41Å; D23-R27 IonicContact OD1-NH2 3.22Å; D23-R27 PolarHBondContact OD1-NH2 2.98Å; D23-R27 IonicContact OD2-CZ 3.04Å; D23-R27 IonicContact OD2-NE 2.64Å; D23-R27 PolarHBondContact OD2-NE 3.27Å; D23-R27 IonicContact OD2-NH1 3.9Å; D23-R27 IonicContact OD2-NH2 3.5Å; D23-R27 PolarHBondContact OD2-NH2 3.41Å; H24-R27 PolarHBondContact O-N 2.85Å; H24-R27 VanDerWaalsContact O-N 3.17Å; I25-R27 VanDerWaalsContact C-N 3.33Å; I25-R27 PolarHBondContact O-N 2.71Å; R27-Q30 PolarHBondContact O-N 2.85Å
28D76.6Confident68.4Low123 Ų12397.9 Ų97.966%0.65852%0.521SS*.Hα-helixtrans-65.6-40.6178.4-164.752.6000111.3H24 I25 Q30H24-D28 WeakPolarHBondContact O-CB 3.46Å; H24-D28 PolarHBondContact O-N 2.84Å; I25-D28 PolarHBondContact O-N 3.41Å; D28-Q30 PolarHBondContact O-N 2.86Å
29L76.7Confident65.9Low104 Ų104103.4 Ų103.455%0.54554%0.539SS..THydrogen-bonded Turntrans-79.91.6174.9-61.5174.6000114I25 L31I25-L29 HydrophobicContact CG2-CD1 3.78Å; I25-L29 HydrophobicContact CG2-CG 4.44Å; I25-L29 WeakPolarHBondContact O-CB 3.35Å; I25-L29 VanDerWaalsContact O-CG 3.3Å; I25-L29 WeakPolarHBondContact O-CG 3.5Å; I25-L29 PolarHBondContact O-N 3.19Å; L29-L31 HydrophobicContact CB-CD1 3.69Å; L29-L31 HydrophobicContact CB-CG 3.69Å; L29-L31 HydrophobicContact CD1-CD1 3.86Å; L29-L31 HydrophobicContact CG-CD1 4.44Å; L29-L31 PolarHBondContact O-N 3.46Å; L29-L31 VanDerWaalsContact O-N 3.11Å
30Q65.4Low63.5Low167 Ų167104.8 Ų104.878%0.7855%0.552SS**THydrogen-bonded Turntrans55.522.5-176.5-57.4-177.4-18.200114.9L26 R27 D28 R32L26-Q30 PolarHBondContact O-N 3.3Å; R27-Q30 PolarHBondContact O-N 2.85Å; D28-Q30 PolarHBondContact O-N 2.86Å; Q30-R32 PolarHBondContact O-N 3.27Å
31L64.4Low61Low75 Ų75114.2 Ų114.239%0.39359%0.593SS.*G310 helixtrans-81.69.9-172.9-64.9174.1000114.5L26 L29 N33 L34L26-L31 HydrophobicContact CD2-CB 4.2Å; L26-L31 HydrophobicContact CD2-CD1 4.46Å; L26-L31 PolarHBondContact O-N 3.48Å; L29-L31 HydrophobicContact CB-CD1 3.69Å; L29-L31 HydrophobicContact CB-CG 3.69Å; L29-L31 HydrophobicContact CD1-CD1 3.86Å; L29-L31 HydrophobicContact CG-CD1 4.44Å; L29-L31 PolarHBondContact O-N 3.46Å; L29-L31 VanDerWaalsContact O-N 3.11Å; L31-N33 PolarHBondContact O-N 2.8Å; L31-L34 HydrophobicContact CD2-CD1 4.19Å; L31-L34 PolarHBondContact O-N 3.04Å
32R55.1Low58.5Low167 Ų167116.8 Ų116.863%0.6361%0.612SS**G310 helixtrans-64.1-12-171.1-148.6179.8-172.6-166.31.4114.6Q30 L34Q30-R32 PolarHBondContact O-N 3.27Å; R32-L34 VanDerWaalsContact C-N 3.35Å
33N49.5Very low55.9Low158 Ų158119 Ų11985%0.84562%0.623SS**G310 helixtrans-89.710.5-179.1-62.6-24.7000114.2L31L31-N33 PolarHBondContact O-N 2.8Å
34L48.6Very low53.2Low135 Ų135123 Ų12371%0.70765%0.648SS**G310 helixtrans-107.411.4179.3-65.8170.8000114.1L31 R32 V36L31-L34 HydrophobicContact CD2-CD1 4.19Å; L31-L34 PolarHBondContact O-N 3.04Å; R32-L34 VanDerWaalsContact C-N 3.35Å; L34-V36 PolarHBondContact O-N 3.3Å
35S41.6Very low50.6Low94 Ų94129.7 Ų129.766%0.65768%0.679SS**  trans-74.5107.9178.5166.60000111.8A37S35-A37 PolarHBondContact O-N 3.11Å
36V47Very low48.1Very low150 Ų150134.9 Ų134.991%0.90970%0.699SS**  trans-73.911177.6173.30000114L34L34-V36 PolarHBondContact O-N 3.3Å
37A36.9Very low45.5Very low61 Ų61139.8 Ų139.850%0.50472%0.716SS.*  trans-111.695.2176.800000111.3S35 H39S35-A37 PolarHBondContact O-N 3.11Å; A37-H39 PolarHBondContact O-N 2.93Å
38D31.8Very low43.3Very low159 Ų159144 Ų14485%0.8574%0.74SS**  trans-66104.5166.7-87.3-39.5000110
39H33.8Very low41.1Very low164 Ų164145.5 Ų145.576%0.75975%0.748SS**  trans-108.495.6156.4-69.6-39.8000108.1A37 K41A37-H39 PolarHBondContact O-N 2.93Å; H39-K41 PolarHBondContact O-N 3.28Å; H39-K41 VanDerWaalsContact O-N 3.08Å
40S34.9Very low39.1Very low119 Ų119150.4 Ų150.483%0.83277%0.765SS**  trans-41.8107.3169.947.90000111.6
41K35.6Very low37.6Very low200 Ų200147.6 Ų147.687%0.8776%0.764SS**  trans-100.1110.5167.9-75.3-173.2179.5179.80109.9H39 Q43H39-K41 PolarHBondContact O-N 3.28Å; H39-K41 VanDerWaalsContact O-N 3.08Å; K41-Q43 PolarHBondContact O-N 3.02Å
42T32Very low36.3Very low128 Ų128152.2 Ų152.279%0.78579%0.788SS**  trans-39119.6168.2-46.70000112.4V44T42-V44 PolarHBondContact O-N 3.4Å
43Q29.1Very low35.3Very low172 Ų172153.1 Ų153.180%0.80480%0.797SS**  trans-76.6101.4175.4-142.5-178.124.600108.7K41 Q45K41-Q43 PolarHBondContact O-N 3.02Å; Q43-Q45 PolarHBondContact O-N 3.06Å
44V29.4Very low34.7Very low124 Ų124156.2 Ų156.275%0.75280%0.796SS**  trans-87.3103.5168.71770000107.9T42 K46T42-V44 PolarHBondContact O-N 3.4Å; V44-K46 PolarHBondContact O-N 3.46Å
45Q29.5Very low34.2Very low163 Ų163156.7 Ų156.776%0.76280%0.8SS**  trans-68.7111.8172.2-68.9-178.9-4.600109.8Q43Q43-Q45 PolarHBondContact O-N 3.06Å
46K31.2Very low34Very low192 Ų192158.2 Ų158.284%0.83581%0.805SS**  trans-83.6110.3164.2-106.5-177.1174.4-177.90108.7V44 E48V44-K46 PolarHBondContact O-N 3.46Å; K46-E48 PolarHBondContact O-N 3.27Å
47K30.2Very low33.8Very low189 Ų189160.1 Ų160.182%0.82280%0.801SS**  trans-69.4117.5163.9-84.3178.7172.5176.20108.9
48E29.6Very low33.8Very low181 Ų181162.2 Ų162.285%0.84682%0.818SS**  trans-100.1117.3163.9-76.3-172.9166.300109.6K46 K50K46-E48 PolarHBondContact O-N 3.27Å; E48-K50 PolarHBondContact O-N 2.85Å
49N31.2Very low34.4Very low154 Ų154162.4 Ų162.482%0.82482%0.817SS**  trans-74.9111.5177.9-68-32.8000109.9S51N49-S51 PolarHBondContact O-N 2.65Å
50K35.1Very low34.7Very low206 Ų206160.4 Ų160.490%0.89682%0.817SS**  trans-84102164.6-85.3179.9175.2175.50109.5E48E48-K50 PolarHBondContact O-N 2.85Å
51S34.3Very low34.7Very low108 Ų108162.2 Ų162.276%0.75582%0.818SS**  trans-84.1108.2166.658.60000110N49N49-S51 PolarHBondContact O-N 2.65Å
52L35.8Very low35.2Very low173 Ų173158.6 Ų158.691%0.90681%0.812SS**  trans-78.3112.3164.9-73157.4000108.2
53K34.5Very low35.9Very low186 Ų186156 Ų15681%0.80981%0.811SS**  trans-107.1116.5162.6-75.6-169176.8-1750108.6
54R36.8Very low36.6Very low222 Ų222155.6 Ų155.684%0.83881%0.813SS**  trans-110.892.2-179.4-170.3-177.7-168.2176.83.4106.8
55D37.4Very low37.2Very low146 Ų146159.9 Ų159.978%0.78182%0.822SS**  trans-10483.8174.2-67.3-30.2000109.1K57D55-K57 PolarHBondContact O-N 3.42Å
56T37.6Very low37.5Very low125 Ų125161.4 Ų161.477%0.76783%0.826SS**  trans-79.1106168.915.90000109.3
57K44.1Very low37.7Very low191 Ų191158.7 Ų158.783%0.8383%0.826SS**  trans-92.4125.5164.4-72.1-175.3179.8-177.80109.3D55D55-K57 PolarHBondContact O-N 3.42Å
58A35.2Very low37.9Very low104 Ų104157.8 Ų157.886%0.8683%0.826SS**  trans-68.7133.1171.300000110
59I45.1Very low38.1Very low163 Ų163157.7 Ų157.784%0.83683%0.826SS**  trans-113.1119.7172.5-76.7170.2000107.2
60T39.8Very low37.9Very low122 Ų122155.8 Ų155.875%0.74882%0.823SS**  trans-76.4136.9173.342.60000111T62T60-T62 PolarHBondContact O-N 3.05Å
61D35.7Very low37.8Very low158 Ų158151.3 Ų151.385%0.84582%0.815SS**  trans-69.4113.2179.6-175.912.5000111.7
62T45.5Very low37.7Very low123 Ų123155.8 Ų155.876%0.75582%0.821SS**  trans-120.799.1166.9560000108.4T60 L64T60-T62 PolarHBondContact O-N 3.05Å; T62-L64 PolarHBondContact O-N 3.22Å
63G47.7Very low37.7Very low74 Ų74154.8 Ų154.876%0.76382%0.816SS**  trans-65.680.8-174.700000114.9
64L42.5Very low37.7Very low163 Ų163154.4 Ų154.485%0.85382%0.817SS**  trans-131111.3166.6-143.776.9000110.5T62 K66T62-L64 PolarHBondContact O-N 3.22Å; L64-K66 PolarHBondContact O-N 3.02Å
65K42.1Very low38Very low214 Ų214149.2 Ų149.293%0.9381%0.806SS**  trans-64.5102.2-175-66.7178.4179.5176.70111.2
66K36.6Very low38.4Very low195 Ų195147 Ų14785%0.84880%0.802SS**  trans-76.6133.1160.8-107.1177.7178.6174.70109.5L64 M68L64-K66 PolarHBondContact O-N 3.02Å; K66-M68 PolarHBondContact O-N 2.91Å
67T35.5Very low39.4Very low135 Ų135144 Ų14483%0.82878%0.779SS**  trans-40.2123.4169.5-40.80000110.2Q69T67-Q69 VanDerWaalsContact C-N 3.32Å; T67-Q69 PolarHBondContact O-N 3.18Å
68M34.8Very low40.5Very low170 Ų170141.8 Ų141.884%0.83777%0.77SS**  trans-60.191.9179-68.2-10379.100109.7K66 C70K66-M68 PolarHBondContact O-N 2.91Å; M68-C70 PolarHBondContact O-N 3.36Å
69Q33.9Very low42.5Very low179 Ų179139 Ų13984%0.83674%0.739SS**  trans-61.7116.2150.5-76.6176.8-6.600105.4T67 P71T67-Q69 VanDerWaalsContact C-N 3.32Å; T67-Q69 PolarHBondContact O-N 3.18Å; Q69-P71 VanDerWaalsContact O-N 3.15Å
70C27Very low44Very low114 Ų114136.9 Ų136.977%0.7772%0.721SS**  trans-43.2125165.9-85.40000107.7M68 K72M68-C70 PolarHBondContact O-N 3.36Å; C70-K72 PolarHBondContact O-N 3.04Å
71P31.2Very low45.9Very low112 Ų112133.9 Ų133.973%0.72770%0.703SS**  trans-51.9122.5166.3-20.631.2000106.4Q69 L73Q69-P71 VanDerWaalsContact O-N 3.15Å; P71-L73 PolarHBondContact O-N 3.39Å
72K33.1Very low47.9Very low203 Ų203129.1 Ų129.188%0.88368%0.677SS**  trans-55.7100.2161.8-79177.6176.2178.10104.7C70 E74C70-K72 PolarHBondContact O-N 3.04Å; K72-E74 PolarHBondContact O-N 3.3Å
73L35.6Very low49.3Very low151 Ų151124.4 Ų124.479%0.79165%0.647SS**  trans-53.7108.9164.3-88.5158.5000104.7P71 D75P71-L73 PolarHBondContact O-N 3.39Å; L73-D75 VanDerWaalsContact C-N 3.28Å; L73-D75 PolarHBondContact O-N 2.85Å
74E34.1Very low50.4Low178 Ų178125.9 Ų125.983%0.83264%0.643SS**  trans-56.398.6167.3-77.2-170.3141.400107.8K72 S76K72-E74 PolarHBondContact O-N 3.3Å; E74-S76 VanDerWaalsContact C-N 3.26Å; E74-S76 PolarHBondContact O-N 2.85Å
75D43.1Very low51.5Low113 Ų113127 Ų12760%0.60464%0.641SS**  trans36.347.5140.3-136.522.7000116.5L73 E77 K78L73-D75 VanDerWaalsContact C-N 3.28Å; L73-D75 PolarHBondContact O-N 2.85Å; D75-E77 PolarHBondContact O-N 3.08Å; D75-K78 WeakPolarHBondContact OD2-CE 3.37Å
76S46.7Very low52.5Low99 Ų99120 Ų12069%0.69262%0.617SS**THydrogen-bonded Turntrans-78.96177.548.80000113.1E74E74-S76 VanDerWaalsContact C-N 3.26Å; E74-S76 PolarHBondContact O-N 2.85Å
77E58.1Low54Low64 Ų64115.8 Ų115.830%0.29961%0.61SS.*THydrogen-bonded Turntrans-123.238.6-177.3-59.5-172.416200111.7D75 E79 R186D75-E77 PolarHBondContact O-N 3.08Å; E77-E79 PolarHBondContact O-N 2.88Å; E77-E79 VanDerWaalsContact O-N 3.09Å; E77-R186 IonicContact OE1-CZ 2.74Å; E77-R186 IonicContact OE1-NH1 3.99Å; E77-R186 PolarHBondContact OE1-NH1 2.91Å; E77-R186 IonicContact OE1-NH2 3.69Å; E77-R186 PolarHBondContact OE1-NH2 3.4Å
78K66.7Low55.9Low143 Ų143114.5 Ų114.562%0.62260%0.604SS**  trans-65.6111.6175.5-71.4178.1-174.4179.50110.2D75 Y80D75-K78 WeakPolarHBondContact OD2-CE 3.37Å; K78-Y80 WeakPolarHBondContact O-CD1 3.43Å
79E77.6Confident58Low47 Ų47110.2 Ų110.222%0.2258%0.584CS.*  trans-65.7136.2172.7-61.8-178.5166.700110E77 K114 R176 V177E77-E79 PolarHBondContact O-N 2.88Å; E77-E79 VanDerWaalsContact O-N 3.09Å; E79-K114 VanDerWaalsContact CD-NZ 3.33Å; E79-K114 IonicContact OE1-NZ 2.88Å; E79-K114 PolarHBondContact OE1-NZ 2.75Å; E79-K114 IonicContact OE2-NZ 2.85Å; E79-K114 PolarHBondContact OE2-NZ 3.2Å; E79-R176 IonicContact OE2-CZ 3.17Å; E79-R176 IonicContact OE2-NE 3.63Å; E79-R176 PolarHBondContact OE2-NE 2.64Å; E79-R176 IonicContact OE2-NH2 2.84Å; E79-R176 PolarHBondContact OE2-NH2 2.84Å; E79-V177 VanDerWaalsContact CB-O 3.3Å; E79-V177 WeakPolarHBondContact CB-O 3.34Å; E79-V177 WeakPolarHBondContact CG-O 3.33Å
80Y77.6Confident60.3Low118 Ų118102.2 Ų102.246%0.46355%0.547SS..  trans-139.9151.9-178.563.9-84.7000111.7K78 L82 R150 V177K78-Y80 WeakPolarHBondContact O-CD1 3.43Å; Y80-L82 HydrophobicContact CD2-CD2 4.12Å; Y80-L82 HydrophobicContact CE2-CD2 3.4Å; Y80-L82 VanDerWaalsContact CE2-CD2 3.4Å; Y80-L82 HydrophobicContact CE2-CG 4.39Å; Y80-R150 PolarHBondContact OH-NH1 2.93Å; Y80-V177 HydrophobicContact CD1-CB 4.32Å; Y80-V177 HydrophobicContact CD2-CG2 4.48Å; Y80-V177 HydrophobicContact CE1-CB 4.06Å; Y80-V177 HydrophobicContact CE1-CG1 4.3Å; Y80-V177 HydrophobicContact CE1-CG2 4.04Å; Y80-V177 HydrophobicContact CE2-CG2 4Å; Y80-V177 PolarHBondContact O-N 3.44Å
81V79.9Confident63Low59 Ų59100.8 Ų100.836%0.35853%0.532SS..BIsolated β-bridgetrans-81.2131.2176.2179.40000108.9D83 T175V81-D83 HydrophobicContact CG1-CB 4.33Å; V81-T175 WeakPolarHBondContact CA-O 3.2Å
82L76.4Confident65.5Low57 Ų5795.5 Ų95.530%0.29850%0.497SS..  trans-84.5-24-179.1-67.6171.1000113.3Y80 V140 T175 V177Y80-L82 HydrophobicContact CD2-CD2 4.12Å; Y80-L82 HydrophobicContact CE2-CD2 3.4Å; Y80-L82 VanDerWaalsContact CE2-CD2 3.4Å; Y80-L82 HydrophobicContact CE2-CG 4.39Å; L82-V140 HydrophobicContact CD1-CG1 3.79Å; L82-T175 WeakPolarHBondContact CB-OG1 3.49Å; L82-T175 PolarHBondContact N-O 2.86Å; L82-V177 HydrophobicContact CD1-CG2 3.74Å; L82-V177 HydrophobicContact CD2-CG2 3.73Å; L82-V177 HydrophobicContact CG-CG2 3.67Å
83D76.3Confident68Low24 Ų2487.4 Ų87.413%0.12846%0.463CS..SBendtrans-72.1137.4-176.1-65.3-68.1000111.9V81 K163 Q174 T175V81-D83 HydrophobicContact CG1-CB 4.33Å; D83-K163 IonicContact OD1-NZ 2.66Å; D83-K163 PolarHBondContact OD1-NZ 3.26Å; D83-Q174 WeakPolarHBondContact OD2-CA 3.43Å; D83-T175 PolarHBondContact OD2-N 3.19Å; D83-T175 PolarHBondContact OD2-OG1 2.94Å
84P69.8Low70.3Confident105 Ų10587.6 Ų87.668%0.68246%0.457SS*.PPolyproline II helixtrans-62.1144.1-179.426.2-33.9000110.8Q104P84-Q104 PolarHBondContact O-NE2 3.45Å
85K65.2Low72.6Confident186 Ų18683 Ų8381%0.80944%0.438SS*.PPolyproline II helixtrans-59.5133.7173.3-68.3-178-179.41790109.2
86P64.3Low74.3Confident67 Ų6780.7 Ų80.744%0.43544%0.441SS..PPolyproline II helixtrans-62.1146-178.725.8-34.4000110.4Q104P86-Q104 VanDerWaalsContact CD-CD 3.49Å; P86-Q104 HydrophobicContact CG-CG 4.48Å
87P67.8Low75.9Confident107 Ų10779.6 Ų79.670%0.69543%0.427SS*.PPolyproline II helixtrans-60.2151.5174.625.8-33000110.5L89P87-L89 PolarHBondContact O-N 3.34Å
88P75Confident76.7Confident109 Ų10979 Ų7971%0.70843%0.425SS*.PPolyproline II helixtrans-58.6140.2179.125.2-34.2000110.8T90P88-T90 PolarHBondContact O-N 2.99Å
89L78.1Confident77Confident80 Ų8074.8 Ų74.842%0.41942%0.423SS..PPolyproline II helixtrans-53.5130-177.8-62.3175.8000111.4P87 Q93 K94 P100 P101P87-L89 PolarHBondContact O-N 3.34Å; L89-Q93 HydrophobicContact CB-CB 4.47Å; L89-K94 HydrophobicContact CB-CG 4.16Å; L89-P100 HydrophobicContact CD2-CB 4.39Å; L89-P101 VanDerWaalsContact CD2-CD 3.48Å; L89-P101 HydrophobicContact CD2-CG 3.99Å
90T83.5Confident76.7Confident10 Ų1076.9 Ų76.96%0.06144%0.44CS..PPolyproline II helixtrans-67.3158174.958.50000111.1H24 P88 A92 Q93 K94H24-T90 PolarHBondContact ND1-OG1 3.27Å; P88-T90 PolarHBondContact O-N 2.99Å; T90-A92 PolarHBondContact O-N 2.82Å; T90-Q93 PolarHBondContact O-N 3.09Å; T90-Q93 VanDerWaalsContact O-N 3.1Å; T90-Q93 VanDerWaalsContact OG1-CG 3.28Å; T90-Q93 WeakPolarHBondContact OG1-CG 3.48Å; T90-Q93 PolarHBondContact OG1-N 3.26Å; T90-Q93 PolarHBondContact OG1-OE1 3.38Å; T90-K94 PolarHBondContact O-N 3.28Å
91L83Confident76.2Confident85 Ų8573.7 Ų73.745%0.44543%0.434SS..Hα-helixtrans-59.1-37.9177.8-174.463.3000111.1A20 Q93 K94 L95A20-L91 HydrophobicContact CB-CB 4.14Å; A20-L91 HydrophobicContact CB-CD2 4.08Å; A20-L91 HydrophobicContact CB-CG 4.03Å; L91-Q93 VanDerWaalsContact C-N 3.34Å; L91-Q93 PolarHBondContact O-N 2.99Å; L91-K94 PolarHBondContact O-N 2.62Å; L91-L95 HydrophobicContact CD1-CD1 4.29Å; L91-L95 HydrophobicContact CD1-CG 4.32Å; L91-L95 HydrophobicContact CG-CD1 3.91Å; L91-L95 HydrophobicContact CG-CG 4.35Å; L91-L95 WeakPolarHBondContact O-CB 3.46Å; L91-L95 VanDerWaalsContact O-CG 3.27Å; L91-L95 WeakPolarHBondContact O-CG 3.48Å; L91-L95 PolarHBondContact O-N 3.4Å
92A84.4Confident75.7Confident0 Ų075.8 Ų75.80%045%0.449CS..Hα-helixtrans-60.8-39.5175.200000113.2A20 H24 T90 L95 G96 L97 I98A20-A92 HydrophobicContact CB-CB 4.16Å; A20-A92 WeakPolarHBondContact O-CB 3.48Å; H24-A92 HydrophobicContact CB-CB 3.83Å; T90-A92 PolarHBondContact O-N 2.82Å; A92-L95 PolarHBondContact O-N 3.47Å; A92-G96 PolarHBondContact O-N 3.09Å; A92-L97 HydrophobicContact CB-CB 4.47Å; A92-L97 PolarHBondContact O-N 3.37Å; A92-I98 HydrophobicContact CB-CD1 4.46Å
93Q84.9Confident75.3Confident34 Ų3478.5 Ų78.516%0.15947%0.47CS..Hα-helixtrans-69.3-38175.7-73.7163.7-29.500111.9H24 L89 T90 L91 L95 G96 I98H24-Q93 PolarHBondContact CE1-NE2 2.8Å; L89-Q93 HydrophobicContact CB-CB 4.47Å; T90-Q93 PolarHBondContact O-N 3.09Å; T90-Q93 VanDerWaalsContact O-N 3.1Å; T90-Q93 VanDerWaalsContact OG1-CG 3.28Å; T90-Q93 WeakPolarHBondContact OG1-CG 3.48Å; T90-Q93 PolarHBondContact OG1-N 3.26Å; T90-Q93 PolarHBondContact OG1-OE1 3.38Å; L91-Q93 VanDerWaalsContact C-N 3.34Å; L91-Q93 PolarHBondContact O-N 2.99Å; Q93-L95 VanDerWaalsContact C-N 3.32Å; Q93-G96 PolarHBondContact O-N 3.25Å; Q93-I98 WeakPolarHBondContact CA-O 3.36Å; Q93-I98 HydrophobicContact CG-CB 4.38Å; Q93-I98 HydrophobicContact CG-CG2 4.38Å
94K83.1Confident75.3Confident155 Ų15580.9 Ų80.967%0.67448%0.48SS*.Hα-helixtrans-67.2-33175.3-69.8-175.6178.7-173.60112.8L89 T90 L91 G96L89-K94 HydrophobicContact CB-CG 4.16Å; T90-K94 PolarHBondContact O-N 3.28Å; L91-K94 PolarHBondContact O-N 2.62Å; K94-G96 VanDerWaalsContact C-N 3.26Å
95L82.7Confident75.7Confident82 Ų8278.3 Ų78.343%0.42946%0.46SS..THydrogen-bonded Turntrans-83-0177.1-65.9175.1000113.1V16 A20 L91 A92 Q93 L97V16-L95 HydrophobicContact CG1-CD1 4.31Å; A20-L95 HydrophobicContact CB-CD1 4.17Å; L91-L95 HydrophobicContact CD1-CD1 4.29Å; L91-L95 HydrophobicContact CD1-CG 4.32Å; L91-L95 HydrophobicContact CG-CD1 3.91Å; L91-L95 HydrophobicContact CG-CG 4.35Å; L91-L95 WeakPolarHBondContact O-CB 3.46Å; L91-L95 VanDerWaalsContact O-CG 3.27Å; L91-L95 WeakPolarHBondContact O-CG 3.48Å; L91-L95 PolarHBondContact O-N 3.4Å; A92-L95 PolarHBondContact O-N 3.47Å; Q93-L95 VanDerWaalsContact C-N 3.32Å; L95-L97 HydrophobicContact CB-CD1 4.36Å; L95-L97 HydrophobicContact CB-CG 4.23Å; L95-L97 PolarHBondContact O-N 2.99Å
96G78.4Confident76.5Confident64 Ų6471.9 Ų71.966%0.6644%0.439SS*.THydrogen-bonded Turntrans71.113.6178.200000114.7A92 Q93 K94 I98A92-G96 PolarHBondContact O-N 3.09Å; Q93-G96 PolarHBondContact O-N 3.25Å; K94-G96 VanDerWaalsContact C-N 3.26Å; G96-I98 VanDerWaalsContact C-N 3.29Å
97L80.4Confident77.4Confident76 Ų7673.1 Ų73.140%0.39845%0.449SS..SBendtrans-72.8-27.1175.7-61172.2000111.6N17 A92 L95N17-L97 HydrophobicContact CB-CD1 3.59Å; N17-L97 HydrophobicContact CB-CD2 4.32Å; A92-L97 HydrophobicContact CB-CB 4.47Å; A92-L97 PolarHBondContact O-N 3.37Å; L95-L97 HydrophobicContact CB-CD1 4.36Å; L95-L97 HydrophobicContact CB-CG 4.23Å; L95-L97 PolarHBondContact O-N 2.99Å
98I75.9Confident78.1Confident50 Ų5073.8 Ų73.826%0.25645%0.447SS..SBendtrans-135.1137.7176.1-63.3178.6000107.8L21 H24 A92 Q93 G96L21-I98 HydrophobicContact CD1-CD1 3.6Å; L21-I98 HydrophobicContact CD1-CG1 4.1Å; H24-I98 HydrophobicContact CB-CD1 4.19Å; H24-I98 WeakPolarHBondContact CD2-CD1 3.36Å; H24-I98 WeakPolarHBondContact NE2-CD1 3.38Å; A92-I98 HydrophobicContact CB-CD1 4.46Å; Q93-I98 WeakPolarHBondContact CA-O 3.36Å; Q93-I98 HydrophobicContact CG-CB 4.38Å; Q93-I98 HydrophobicContact CG-CG2 4.38Å; G96-I98 VanDerWaalsContact C-N 3.29Å
99G73Confident78.7Confident56 Ų5672.5 Ų72.558%0.57743%0.431SS*.PPolyproline II helixtrans-58.4140.417800000112.2
100P70.6Confident79.1Confident91 Ų9169 Ų6959%0.59141%0.412SS*.PPolyproline II helixtrans-61.9150.3173.926.5-33.1000110.7L89L89-P100 HydrophobicContact CD2-CB 4.39Å
101P68.3Low79.2Confident51 Ų5172.1 Ų72.133%0.33143%0.427SS..PPolyproline II helixtrans-61.2153.5175.128.1-33.6000110.4L89L89-P101 VanDerWaalsContact CD2-CD 3.48Å; L89-P101 HydrophobicContact CD2-CG 3.99Å
102P68.9Low79.4Confident103 Ų10374.1 Ų74.167%0.66943%0.433SS*.PPolyproline II helixtrans-53.9132178.1-23.131.8000111
103P68.1Low79.6Confident113 Ų11374.3 Ų74.373%0.73444%0.435SS*.PPolyproline II helixtrans-62.9145.3179.724.1-31.8000111.3Q174P103-Q174 PolarHBondContact O-NE2 2.85Å
104Q75.8Confident79.7Confident75 Ų7573.9 Ų73.935%0.3543%0.432SS..PPolyproline II helixtrans-68.2146.1168.3-71.5-168.6-29.500109.8P84 P86 S106P84-Q104 PolarHBondContact O-NE2 3.45Å; P86-Q104 VanDerWaalsContact CD-CD 3.49Å; P86-Q104 HydrophobicContact CG-CG 4.48Å; Q104-S106 PolarHBondContact O-N 3.18Å
105L77.9Confident79.9Confident50 Ų5070.9 Ų70.926%0.26242%0.421SS..PPolyproline II helixtrans-63.3136.6177.5-69.7178.2000109.8E109 W110 V113L105-E109 WeakPolarHBondContact CA-OE2 3.36Å; L105-E109 HydrophobicContact CB-CB 4.3Å; L105-E109 HydrophobicContact CD2-CB 4.22Å; L105-E109 WeakPolarHBondContact CD2-OE2 3.42Å; L105-W110 HydrophobicContact CB-CG 4.35Å; L105-W110 HydrophobicContact CD1-CD2 4.3Å; L105-W110 HydrophobicContact CD1-CZ2 4.24Å; L105-V113 HydrophobicContact CD1-CG2 4.46Å
106S82.9Confident80.2Confident51 Ų5172.7 Ų72.736%0.35742%0.422SS..PPolyproline II helixtrans-69.2164.6175.8790000111.1Q104 D108 E109 W110Q104-S106 PolarHBondContact O-N 3.18Å; S106-D108 PolarHBondContact O-N 3.22Å; S106-D108 PolarHBondContact OG-N 3.32Å; S106-E109 PolarHBondContact N-OE2 2.92Å; S106-E109 PolarHBondContact O-N 3.14Å; S106-E109 VanDerWaalsContact OG-CG 3.3Å; S106-E109 WeakPolarHBondContact OG-CG 3.36Å; S106-E109 PolarHBondContact OG-N 3.35Å; S106-E109 VanDerWaalsContact OG-N 3.14Å; S106-W110 VanDerWaalsContact O-CD1 3.26Å; S106-W110 PolarHBondContact O-N 3.22Å
107S81.7Confident80.7Confident93 Ų9369.8 Ų69.865%0.6539%0.391SS*.Hα-helixtrans-59.4-35.8175.7-171.10000111.9W110 E111S107-W110 PolarHBondContact O-N 3.34Å; S107-E111 PolarHBondContact O-N 3.23Å; S107-E111 VanDerWaalsContact O-N 3.08Å
108D83.6Confident80.9Confident122 Ų12269.7 Ų69.765%0.65239%0.391SS*.Hα-helixtrans-72.3-42.8-178.9-58.2-26.1000110.9S106 W110 E111 E112S106-D108 PolarHBondContact O-N 3.22Å; S106-D108 PolarHBondContact OG-N 3.32Å; D108-W110 VanDerWaalsContact C-N 3.26Å; D108-W110 PolarHBondContact O-N 2.86Å; D108-E111 WeakPolarHBondContact O-CB 3.22Å; D108-E111 PolarHBondContact O-N 3.19Å; D108-E112 PolarHBondContact O-N 2.88Å
109E86.5Confident81.4Confident82 Ų8274.5 Ų74.538%0.38342%0.416SS..Hα-helixtrans-61.4-36.5173.8-71.8170.3170.900111.7L105 S106 E111 E112 V113L105-E109 WeakPolarHBondContact CA-OE2 3.36Å; L105-E109 HydrophobicContact CB-CB 4.3Å; L105-E109 HydrophobicContact CD2-CB 4.22Å; L105-E109 WeakPolarHBondContact CD2-OE2 3.42Å; S106-E109 PolarHBondContact N-OE2 2.92Å; S106-E109 PolarHBondContact O-N 3.14Å; S106-E109 VanDerWaalsContact OG-CG 3.3Å; S106-E109 WeakPolarHBondContact OG-CG 3.36Å; S106-E109 PolarHBondContact OG-N 3.35Å; S106-E109 VanDerWaalsContact OG-N 3.14Å; E109-E111 VanDerWaalsContact C-N 3.34Å; E109-E112 PolarHBondContact O-N 3.28Å; E109-V113 VanDerWaalsContact O-CG2 3.23Å; E109-V113 WeakPolarHBondContact O-CG2 3.26Å; E109-V113 PolarHBondContact O-N 3.4Å
110W86.6Confident81.9Confident5 Ų577.2 Ų77.22%0.01941%0.414CS..Hα-helixtrans-68.2-33.1174.1-88.9115.1000113.1L105 S106 S107 D108 V113 K114 L141 Q174 R176L105-W110 HydrophobicContact CB-CG 4.35Å; L105-W110 HydrophobicContact CD1-CD2 4.3Å; L105-W110 HydrophobicContact CD1-CZ2 4.24Å; S106-W110 VanDerWaalsContact O-CD1 3.26Å; S106-W110 PolarHBondContact O-N 3.22Å; S107-W110 PolarHBondContact O-N 3.34Å; D108-W110 VanDerWaalsContact C-N 3.26Å; D108-W110 PolarHBondContact O-N 2.86Å; W110-V113 HydrophobicContact CE3-CB 4.35Å; W110-V113 HydrophobicContact CE3-CG1 4.38Å; W110-V113 HydrophobicContact CZ3-CG1 4.36Å; W110-V113 PolarHBondContact O-N 3.22Å; W110-K114 WeakPolarHBondContact O-CB 3.12Å; W110-K114 PolarHBondContact O-N 3.19Å; W110-L141 HydrophobicContact CE3-CD2 4.31Å; W110-L141 HydrophobicContact CZ3-CB 4.48Å; W110-L141 HydrophobicContact CZ3-CD2 4.25Å; W110-L141 HydrophobicContact CZ3-CG 4.11Å; W110-Q174 HydrophobicContact CH2-CB 4.26Å; W110-Q174 WeakPolarHBondContact CH2-O 3.37Å; W110-Q174 HydrophobicContact CZ2-CB 3.67Å; W110-R176 VanDerWaalsContact CB-NH1 3.31Å; W110-R176 HydrophobicContact CD2-CB 4.09Å; W110-R176 HydrophobicContact CE3-CB 3.77Å; W110-R176 HydrophobicContact CE3-CG 4.42Å; W110-R176 HydrophobicContact CH2-CB 3.59Å; W110-R176 HydrophobicContact CZ2-CB 3.91Å; W110-R176 HydrophobicContact CZ3-CB 3.52Å
111E85.6Confident82.5Confident77 Ų7773.9 Ų73.936%0.3640%0.396SS..Hα-helixtrans-65.9-42.7172.4-167.957.1-141.400110.2S107 D108 E109 V113 K114 Q115S107-E111 PolarHBondContact O-N 3.23Å; S107-E111 VanDerWaalsContact O-N 3.08Å; D108-E111 WeakPolarHBondContact O-CB 3.22Å; D108-E111 PolarHBondContact O-N 3.19Å; E109-E111 VanDerWaalsContact C-N 3.34Å; E111-V113 PolarHBondContact O-N 2.79Å; E111-K114 CarbonylContact O-C 3.58Å; E111-K114 WeakPolarHBondContact O-CB 3.32Å; E111-K114 PolarHBondContact O-N 3.37Å; E111-K114 VanDerWaalsContact O-N 3.11Å; E111-Q115 VanDerWaalsContact O-CG 3.32Å; E111-Q115 WeakPolarHBondContact O-CG 3.1Å; E111-Q115 PolarHBondContact O-N 3.18Å; E111-Q115 PolarHBondContact OE1-NE2 3.03Å
112E88.6Confident83.1Confident126 Ų12673.1 Ų73.159%0.58939%0.389SS*.Hα-helixtrans-61.1-40.9174.1-66.5-178.9179.100112.9D108 E109 K114 Q115 R116D108-E112 PolarHBondContact O-N 2.88Å; E109-E112 PolarHBondContact O-N 3.28Å; E112-K114 VanDerWaalsContact C-N 3.31Å; E112-Q115 PolarHBondContact O-N 3.45Å; E112-R116 WeakPolarHBondContact O-CG 3.46Å; E112-R116 PolarHBondContact O-N 2.94Å
113V87.5Confident83.6Confident4 Ų468.7 Ų68.72%0.02436%0.36CS..Hα-helixtrans-62.3-41.8173.8176.40000110.4L105 E109 W110 E111 R116 S117 L141 L142L105-V113 HydrophobicContact CD1-CG2 4.46Å; E109-V113 VanDerWaalsContact O-CG2 3.23Å; E109-V113 WeakPolarHBondContact O-CG2 3.26Å; E109-V113 PolarHBondContact O-N 3.4Å; W110-V113 HydrophobicContact CE3-CB 4.35Å; W110-V113 HydrophobicContact CE3-CG1 4.38Å; W110-V113 HydrophobicContact CZ3-CG1 4.36Å; W110-V113 PolarHBondContact O-N 3.22Å; E111-V113 PolarHBondContact O-N 2.79Å; V113-R116 VanDerWaalsContact CG2-NH2 3.32Å; V113-R116 PolarHBondContact O-N 3.43Å; V113-S117 PolarHBondContact O-N 3.41Å; V113-L141 HydrophobicContact CG1-CD1 4.26Å; V113-L141 HydrophobicContact CG1-CD2 4.01Å; V113-L141 HydrophobicContact CG1-CG 4.09Å; V113-L142 WeakPolarHBondContact CG1-O 3.49Å
114K87.6Confident84.4Confident25 Ų2567.1 Ų67.111%0.10935%0.349CS..Hα-helixtrans-64.7-46.3177.3-173.6176.3-177.9173.70111.5E79 W110 E111 E112 R116 S117 L118 L141 D180E79-K114 VanDerWaalsContact CD-NZ 3.33Å; E79-K114 IonicContact OE1-NZ 2.88Å; E79-K114 PolarHBondContact OE1-NZ 2.75Å; E79-K114 IonicContact OE2-NZ 2.85Å; E79-K114 PolarHBondContact OE2-NZ 3.2Å; W110-K114 WeakPolarHBondContact O-CB 3.12Å; W110-K114 PolarHBondContact O-N 3.19Å; E111-K114 CarbonylContact O-C 3.58Å; E111-K114 WeakPolarHBondContact O-CB 3.32Å; E111-K114 PolarHBondContact O-N 3.37Å; E111-K114 VanDerWaalsContact O-N 3.11Å; E112-K114 VanDerWaalsContact C-N 3.31Å; K114-R116 VanDerWaalsContact C-N 3.31Å; K114-R116 PolarHBondContact O-N 3.04Å; K114-S117 WeakPolarHBondContact O-CB 3.4Å; K114-S117 PolarHBondContact O-N 2.82Å; K114-S117 VanDerWaalsContact O-N 3.14Å; K114-L118 HydrophobicContact CG-CD1 4.29Å; K114-L118 HydrophobicContact CG-CG 4.48Å; K114-L118 WeakPolarHBondContact O-CG 3.13Å; K114-L118 PolarHBondContact O-N 3.41Å; K114-L141 HydrophobicContact CB-CD2 4.02Å; K114-L141 HydrophobicContact CG-CD2 4.48Å; K114-D180 WeakPolarHBondContact CE-OD2 3.49Å; K114-D180 IonicContact NZ-OD1 2.98Å; K114-D180 PolarHBondContact NZ-OD1 2.84Å; K114-D180 IonicContact NZ-OD2 2.86Å
115Q87.3Confident84.9Confident92 Ų9269.1 Ų69.143%0.4336%0.358SS..Hα-helixtrans-59-42.3176.4-67.9-53.5-41.900111.7E111 E112 S117 L118 L119E111-Q115 VanDerWaalsContact O-CG 3.32Å; E111-Q115 WeakPolarHBondContact O-CG 3.1Å; E111-Q115 PolarHBondContact O-N 3.18Å; E111-Q115 PolarHBondContact OE1-NE2 3.03Å; E112-Q115 PolarHBondContact O-N 3.45Å; Q115-S117 PolarHBondContact O-N 3.16Å; Q115-L118 PolarHBondContact O-N 3.48Å; Q115-L119 WeakPolarHBondContact O-CG 3.27Å; Q115-L119 PolarHBondContact O-N 2.92Å
116R89.1Confident85.5Confident121 Ų12169.3 Ų69.346%0.45736%0.362SS..Hα-helixtrans-60.8-44.3174-75.4-174.7-69.9160.5-7.1112.8E112 V113 K114 L118 L119 Q120E112-R116 WeakPolarHBondContact O-CG 3.46Å; E112-R116 PolarHBondContact O-N 2.94Å; V113-R116 VanDerWaalsContact CG2-NH2 3.32Å; V113-R116 PolarHBondContact O-N 3.43Å; K114-R116 VanDerWaalsContact C-N 3.31Å; K114-R116 PolarHBondContact O-N 3.04Å; R116-L118 VanDerWaalsContact C-N 3.34Å; R116-L118 PolarHBondContact O-N 3.2Å; R116-L119 PolarHBondContact O-N 3.03Å; R116-Q120 WeakPolarHBondContact O-CG 3.42Å; R116-Q120 PolarHBondContact O-N 3.04Å
117S88Confident85.9Confident3 Ų366.9 Ų66.92%0.02135%0.345CS..Hα-helixtrans-64.2-38177.2-171.40000112.4V113 K114 Q115 Q120 G121 D122 S145 V147V113-S117 PolarHBondContact O-N 3.41Å; K114-S117 WeakPolarHBondContact O-CB 3.4Å; K114-S117 PolarHBondContact O-N 2.82Å; K114-S117 VanDerWaalsContact O-N 3.14Å; Q115-S117 PolarHBondContact O-N 3.16Å; S117-Q120 PolarHBondContact O-N 3.33Å; S117-G121 PolarHBondContact O-N 3.35Å; S117-D122 PolarHBondContact O-N 2.84Å; S117-D122 PolarHBondContact OG-OD2 2.72Å; S117-S145 WeakPolarHBondContact CB-O 3.37Å; S117-S145 PolarHBondContact OG-O 3.18Å; S117-V147 VanDerWaalsContact OG-CG2 3.26Å; S117-V147 WeakPolarHBondContact OG-CG2 3.33Å
118L85.6Confident86.3Confident74 Ų7465.4 Ų65.439%0.38733%0.333SS..Hα-helixtrans-65-42.2174.7-71.1174000112.3K114 Q115 R116 Q120 G121K114-L118 HydrophobicContact CG-CD1 4.29Å; K114-L118 HydrophobicContact CG-CG 4.48Å; K114-L118 WeakPolarHBondContact O-CG 3.13Å; K114-L118 PolarHBondContact O-N 3.41Å; Q115-L118 PolarHBondContact O-N 3.48Å; R116-L118 VanDerWaalsContact C-N 3.34Å; R116-L118 PolarHBondContact O-N 3.2Å; L118-Q120 VanDerWaalsContact C-N 3.3Å; L118-Q120 PolarHBondContact O-N 3.04Å; L118-G121 PolarHBondContact O-N 3.43Å; L118-G121 VanDerWaalsContact O-N 3.12Å
119L85.8Confident86.7Confident151 Ų15162.6 Ų62.679%0.79132%0.318SS*.Hα-helixtrans-64-36.1175.7-71.2172.2000112.2Q115 R116 G121Q115-L119 WeakPolarHBondContact O-CG 3.27Å; Q115-L119 PolarHBondContact O-N 2.92Å; R116-L119 PolarHBondContact O-N 3.03Å; L119-G121 VanDerWaalsContact C-N 3.27Å
120Q83.1Confident87Confident113 Ų11360.6 Ų60.653%0.52831%0.313SS..Hα-helixtrans-74.6-19.3175.2-71176.2-22.400112.6R116 S117 L118 D122R116-Q120 WeakPolarHBondContact O-CG 3.42Å; R116-Q120 PolarHBondContact O-N 3.04Å; S117-Q120 PolarHBondContact O-N 3.33Å; L118-Q120 VanDerWaalsContact C-N 3.3Å; L118-Q120 PolarHBondContact O-N 3.04Å; Q120-D122 VanDerWaalsContact C-N 3.32Å
121G83.3Confident87.2Confident20 Ų2068.8 Ų68.821%0.20635%0.348CS..THydrogen-bonded Turntrans72.625.2-179.200000113.1S117 L118 L119 S123 V124 Q125S117-G121 PolarHBondContact O-N 3.35Å; L118-G121 PolarHBondContact O-N 3.43Å; L118-G121 VanDerWaalsContact O-N 3.12Å; L119-G121 VanDerWaalsContact C-N 3.27Å; G121-S123 PolarHBondContact O-N 3.09Å; G121-V124 WeakPolarHBondContact O-CB 2.97Å; G121-V124 PolarHBondContact O-N 3.44Å; G121-Q125 PolarHBondContact O-N 2.9Å
122D81.1Confident87.5Confident35 Ų3569.3 Ų69.319%0.18735%0.351CS..THydrogen-bonded Turntrans-59.1-35.2-174.3-72.2-20.7000112.6S117 Q120 V124 Q125 V147S117-D122 PolarHBondContact O-N 2.84Å; S117-D122 PolarHBondContact OG-OD2 2.72Å; Q120-D122 VanDerWaalsContact C-N 3.32Å; D122-V124 PolarHBondContact O-N 2.86Å; D122-Q125 PolarHBondContact O-N 3.19Å; D122-V147 HydrophobicContact CB-CB 4.18Å; D122-V147 HydrophobicContact CB-CG2 3.88Å
123S81.1Confident87.5Confident10 Ų1067.9 Ų67.97%0.0734%0.344CS..THydrogen-bonded Turntrans-72.8-12.8177.3-56.80000114G121G121-S123 PolarHBondContact O-N 3.09Å
124V84Confident87.5Confident81 Ų8168 Ų6849%0.49134%0.344SS..THydrogen-bonded Turntrans-88.4-35.1174.1-178.50000110.5G121 D122 L184G121-V124 WeakPolarHBondContact O-CB 2.97Å; G121-V124 PolarHBondContact O-N 3.44Å; D122-V124 PolarHBondContact O-N 2.86Å; V124-L184 HydrophobicContact CG2-CD1 3.8Å
125Q85.6Confident87.5Confident116 Ų11670.5 Ų70.554%0.54236%0.356SS..SBendtrans-71.4152.8178-61.7-57.6-31.700110.8G121 D122 F134G121-Q125 PolarHBondContact O-N 2.9Å; D122-Q125 PolarHBondContact O-N 3.19Å; Q125-F134 WeakPolarHBondContact O-CD2 3.41Å; Q125-F134 WeakPolarHBondContact O-CE2 3.49Å
126P90.6Very high87.5Confident55 Ų5571.6 Ų71.636%0.35736%0.364SS..PPolyproline II helixtrans-66.4156.3174.828.5-34.7000111.1P128 E132P126-P128 WeakPolarHBondContact O-CD 3.42Å; P126-E132 CarbonylContact C-O 3.58Å; P126-E132 WeakPolarHBondContact CA-O 3.41Å; P126-E132 WeakPolarHBondContact CB-O 3.44Å
127C91.8Very high87.4Confident0 Ų070.3 Ų70.30%036%0.36CS..PPolyproline II helixtrans-58.5126.7177.51790000110.5I129 C130 K131 E132 F134 H149C127-I129 PolarHBondContact O-N 2.98Å; C127-C130 VanDerWaalsContact CB-SG 3.6Å; C127-C130 PolarHBondContact O-N 3.23Å; C127-K131 WeakPolarHBondContact O-CA 3.31Å; C127-K131 PolarHBondContact O-N 3.32Å; C127-E132 PolarHBondContact N-O 3.1Å; C127-F134 HydrophobicContact CB-CD1 4.31Å; C127-F134 HydrophobicContact CB-CE1 3.61Å; C127-F134 HydrophobicContact CB-CZ 3.88Å; C127-H149 VanDerWaalsContact CB-CE1 3.5Å; C127-H149 WeakPolarHBondContact CB-CE1 3.17Å; C127-H149 VanDerWaalsContact CB-ND1 3.3Å; C127-H149 WeakPolarHBondContact CB-ND1 3.2Å
128P90.9Very high87.4Confident61 Ų6173.3 Ų73.340%0.39638%0.379SS..THydrogen-bonded Turntrans-65-16.9-175.6-23.532000115.3P126 F148 L167P126-P128 WeakPolarHBondContact O-CD 3.42Å; P128-F148 HydrophobicContact CB-CE1 4.03Å; P128-F148 HydrophobicContact CG-CD1 4.32Å; P128-F148 HydrophobicContact CG-CE1 3.88Å; P128-L167 HydrophobicContact CB-CD1 4.46Å; P128-L167 HydrophobicContact CB-CD2 4Å; P128-L167 HydrophobicContact CB-CG 4.43Å; P128-L167 HydrophobicContact CG-CD1 3.96Å; P128-L167 HydrophobicContact CG-CD2 4.34Å; P128-L167 HydrophobicContact CG-CG 4.45Å
129I91.8Very high87.6Confident63 Ų6369.8 Ų69.832%0.32336%0.361SS..THydrogen-bonded Turntrans-85-52.9-179.2-59.8168.4000110.9C127 F148 C152 F156 P166C127-I129 PolarHBondContact O-N 2.98Å; I129-F148 HydrophobicContact CD1-CB 4.34Å; I129-F148 HydrophobicContact CD1-CD1 3.58Å; I129-F148 HydrophobicContact CD1-CE1 4.18Å; I129-F148 HydrophobicContact CD1-CG 4.12Å; I129-F148 HydrophobicContact CG1-CD1 3.75Å; I129-F148 HydrophobicContact CG1-CE1 4.06Å; I129-C152 HydrophobicContact CB-CB 3.99Å; I129-C152 HydrophobicContact CD1-CB 3.82Å; I129-C152 HydrophobicContact CG2-CB 4Å; I129-F156 HydrophobicContact CD1-CB 4.4Å; I129-P166 HydrophobicContact CD1-CG 4.05Å; I129-P166 HydrophobicContact CG1-CG 4.34Å
130C92.1Very high87.9Confident41 Ų4162.7 Ų62.728%0.27732%0.323SS..THydrogen-bonded Turntrans-99.6-10.3-176.863.60000114.2C127 E132 H149C127-C130 VanDerWaalsContact CB-SG 3.6Å; C127-C130 PolarHBondContact O-N 3.23Å; C130-E132 PolarHBondContact O-N 3.34Å; C130-H149 PolarHBondContact SG-CE1 3.4Å; C130-H149 PolarHBondContact SG-ND1 2.91Å
131K91Very high88.4Confident176 Ų17657.3 Ų57.377%0.76530%0.298SS*.  trans61.420.9-176.6-52.7-176.7179.3-175.10114.8C127C127-K131 WeakPolarHBondContact O-CA 3.31Å; C127-K131 PolarHBondContact O-N 3.32Å
132E90.9Very high88.8Confident89 Ų8956.4 Ų56.442%0.41629%0.288SS..  trans-102.1152.5177.4-63.7176-170.400111.7P126 C127 C130 R137P126-E132 CarbonylContact C-O 3.58Å; P126-E132 WeakPolarHBondContact CA-O 3.41Å; P126-E132 WeakPolarHBondContact CB-O 3.44Å; C127-E132 PolarHBondContact N-O 3.1Å; C130-E132 PolarHBondContact O-N 3.34Å; E132-R137 IonicContact OE2-CZ 3.15Å; E132-R137 IonicContact OE2-NH1 3.95Å; E132-R137 PolarHBondContact OE2-NH1 3.38Å; E132-R137 IonicContact OE2-NH2 2.64Å; E132-R137 PolarHBondContact OE2-NH2 3.38Å
133E89.7Confident89.2Confident95 Ų9555.5 Ų55.544%0.44429%0.285SS..  trans-60.7152.3171.1-69.5-165.3-15800111.1E135 H149 K188E133-E135 VanDerWaalsContact C-N 3.35Å; E133-E135 HydrophobicContact CB-CG 4.17Å; E133-E135 PolarHBondContact O-N 2.91Å; E133-H149 PolarHBondContact O-NE2 3.23Å; E133-K188 IonicContact OE1-NZ 3.02Å; E133-K188 IonicContact OE2-NZ 2.91Å; E133-K188 PolarHBondContact OE2-NZ 2.97Å
134F88.1Confident89.6Confident6 Ų655.8 Ų55.83%0.02629%0.287CS..  trans-70.6-30.5-177.5-69.7-70000114.2Q125 C127 L136 R137 Q139 V147 H149Q125-F134 WeakPolarHBondContact O-CD2 3.41Å; Q125-F134 WeakPolarHBondContact O-CE2 3.49Å; C127-F134 HydrophobicContact CB-CD1 4.31Å; C127-F134 HydrophobicContact CB-CE1 3.61Å; C127-F134 HydrophobicContact CB-CZ 3.88Å; F134-L136 PolarHBondContact O-N 2.95Å; F134-R137 WeakPolarHBondContact O-CB 3.42Å; F134-R137 PolarHBondContact O-N 3.39Å; F134-Q139 HydrophobicContact CB-CG 3.85Å; F134-Q139 HydrophobicContact CD1-CG 3.43Å; F134-Q139 VanDerWaalsContact CD1-CG 3.43Å; F134-Q139 HydrophobicContact CE1-CG 4.11Å; F134-Q139 HydrophobicContact CG-CG 3.74Å; F134-V147 HydrophobicContact CE1-CG1 4.09Å; F134-V147 HydrophobicContact CE2-CG1 4.17Å; F134-V147 HydrophobicContact CZ-CB 4.3Å; F134-V147 HydrophobicContact CZ-CG1 3.73Å; F134-H149 WeakPolarHBondContact CA-NE2 3.43Å; F134-H149 AromaticContact CD1-CD2 3.57Å; F134-H149 AromaticContact CD1-NE2 3.58Å
135E87.8Confident89.9Confident79 Ų7952.4 Ų52.437%0.36927%0.267SS..THydrogen-bonded Turntrans45.8-132.4178.8-57.2-179.3152.600112E133 R137 A182 F185E133-E135 VanDerWaalsContact C-N 3.35Å; E133-E135 HydrophobicContact CB-CG 4.17Å; E133-E135 PolarHBondContact O-N 2.91Å; E135-R137 IonicContact OE2-NE 3.14Å; E135-R137 IonicContact OE2-NH2 2.86Å; E135-A182 WeakPolarHBondContact O-CA 3.49Å; E135-A182 WeakPolarHBondContact O-CB 3.48Å; E135-A182 PolarHBondContact O-N 3.5Å; E135-F185 HydrophobicContact CB-CD1 4.49Å; E135-F185 HydrophobicContact CB-CD2 4.22Å; E135-F185 HydrophobicContact CB-CE2 4.25Å; E135-F185 HydrophobicContact CB-CG 4.34Å; E135-F185 HydrophobicContact CB-CZ 4.39Å; E135-F185 HydrophobicContact CG-CD2 4.1Å; E135-F185 HydrophobicContact CG-CE2 3.91Å; E135-F185 HydrophobicContact CG-CZ 4.36Å
136L87.4Confident90.1Very high114 Ų11448.6 Ų48.660%0.59725%0.249SC*.THydrogen-bonded Turntrans-90.13.7177.5-61.6175.7000113.5F134 A182 F185 R186F134-L136 PolarHBondContact O-N 2.95Å; L136-A182 HydrophobicContact CD2-CB 4.48Å; L136-F185 HydrophobicContact CD2-CD1 4.01Å; L136-F185 HydrophobicContact CD2-CE1 4.49Å; L136-F185 HydrophobicContact CG-CD1 4.02Å; L136-F185 HydrophobicContact CG-CE1 4.1Å; L136-R186 HydrophobicContact CD2-CG 4.38Å
137R86.1Confident90.2Very high95 Ų9546.1 Ų46.136%0.35823%0.233SC..SBendtrans-76.4146.7-175-59.3-176.1-144.4165.95.4110.5E132 F134 E135 Q139E132-R137 IonicContact OE2-CZ 3.15Å; E132-R137 IonicContact OE2-NH1 3.95Å; E132-R137 PolarHBondContact OE2-NH1 3.38Å; E132-R137 IonicContact OE2-NH2 2.64Å; E132-R137 PolarHBondContact OE2-NH2 3.38Å; F134-R137 WeakPolarHBondContact O-CB 3.42Å; F134-R137 PolarHBondContact O-N 3.39Å; E135-R137 IonicContact OE2-NE 3.14Å; E135-R137 IonicContact OE2-NH2 2.86Å; R137-Q139 PolarHBondContact O-N 3.01Å
138P87.2Confident90.3Very high65 Ų6546.1 Ų46.142%0.42223%0.233SC..  trans-62.6127.4179.824.6-33.2000110.8R150P138-R150 HydrophobicContact CB-CB 4.23Å; P138-R150 HydrophobicContact CG-CB 4.16Å; P138-R150 PolarHBondContact O-N 3.23Å
139Q91.3Very high90.4Very high1 Ų143.4 Ų43.41%0.00522%0.215CC..EExtended strand (participates in β ladder)trans-104.1150.8179.4-72.2152.857.200110.5F134 R137 V147 F148 V177 I178 G181 A182F134-Q139 HydrophobicContact CB-CG 3.85Å; F134-Q139 HydrophobicContact CD1-CG 3.43Å; F134-Q139 VanDerWaalsContact CD1-CG 3.43Å; F134-Q139 HydrophobicContact CE1-CG 4.11Å; F134-Q139 HydrophobicContact CG-CG 3.74Å; R137-Q139 PolarHBondContact O-N 3.01Å; Q139-V147 HydrophobicContact CB-CG1 4.3Å; Q139-F148 CarbonylContact C-O 3.53Å; Q139-F148 WeakPolarHBondContact CA-O 3.15Å; Q139-V177 WeakPolarHBondContact O-CA 3.36Å; Q139-I178 HydrophobicContact CB-CD1 4.37Å; Q139-I178 HydrophobicContact CB-CG1 3.69Å; Q139-I178 WeakPolarHBondContact CB-O 3.39Å; Q139-I178 PolarHBondContact O-N 3.48Å; Q139-G181 VanDerWaalsContact OE1-CA 3.24Å; Q139-A182 VanDerWaalsContact NE2-N 3.18Å
140V92.1Very high90.5Very high1 Ų143.9 Ų43.91%0.00621%0.213CC..EExtended strand (participates in β ladder)trans-127.6131.4176.2-68.50000109.7L82 V147 F148 R150 L153 R176 V177L82-V140 HydrophobicContact CD1-CG1 3.79Å; V140-V147 WeakPolarHBondContact O-CA 3.35Å; V140-F148 HydrophobicContact CG2-CB 4.27Å; V140-F148 WeakPolarHBondContact CG2-O 3.32Å; V140-F148 PolarHBondContact N-O 2.93Å; V140-F148 PolarHBondContact O-N 2.9Å; V140-R150 HydrophobicContact CG1-CB 3.91Å; V140-R150 HydrophobicContact CG1-CG 4.16Å; V140-L153 HydrophobicContact CG2-CB 4.12Å; V140-L153 HydrophobicContact CG2-CD2 3.68Å; V140-R176 CarbonylContact C-O 3.52Å; V140-R176 WeakPolarHBondContact CA-O 3.32Å; V140-V177 HydrophobicContact CG1-CG2 4.33Å
141L92.9Very high90.5Very high1 Ų145.1 Ų45.11%0.00523%0.226CC..EExtended strand (participates in β ladder)trans-98.3128.5171.8179.763.6000108.7W110 V113 K114 S145 V147 R176 I178W110-L141 HydrophobicContact CE3-CD2 4.31Å; W110-L141 HydrophobicContact CZ3-CB 4.48Å; W110-L141 HydrophobicContact CZ3-CD2 4.25Å; W110-L141 HydrophobicContact CZ3-CG 4.11Å; V113-L141 HydrophobicContact CG1-CD1 4.26Å; V113-L141 HydrophobicContact CG1-CD2 4.01Å; V113-L141 HydrophobicContact CG1-CG 4.09Å; K114-L141 HydrophobicContact CB-CD2 4.02Å; K114-L141 HydrophobicContact CG-CD2 4.48Å; L141-S145 WeakPolarHBondContact CD1-O 3.34Å; L141-V147 HydrophobicContact CD1-CG2 3.75Å; L141-R176 PolarHBondContact N-O 2.84Å; L141-R176 PolarHBondContact O-N 3.28Å; L141-I178 HydrophobicContact CB-CD1 4.13Å; L141-I178 HydrophobicContact CB-CG1 4.3Å; L141-I178 HydrophobicContact CB-CG2 3.7Å; L141-I178 HydrophobicContact CD2-CG2 4.19Å
142L92.2Very high90.6Very high0 Ų037.8 Ų37.80%020%0.196CC..EExtended strand (participates in β ladder)trans-89.2156.9175.1-57-167.8000111.2V113 C144 S145 H146 F148 L153 C165 Y173 Q174 T175V113-L142 WeakPolarHBondContact CG1-O 3.49Å; L142-C144 VanDerWaalsContact CB-SG 3.51Å; L142-C144 PolarHBondContact O-N 2.98Å; L142-S145 PolarHBondContact O-N 2.86Å; L142-H146 PolarHBondContact N-O 3.43Å; L142-F148 HydrophobicContact CD1-CD2 4.02Å; L142-F148 HydrophobicContact CD1-CE2 3.63Å; L142-F148 HydrophobicContact CG-CD2 4.19Å; L142-F148 HydrophobicContact CG-CE2 4.16Å; L142-L153 HydrophobicContact CD1-CD1 4.4Å; L142-L153 HydrophobicContact CD2-CD2 3.67Å; L142-C165 HydrophobicContact CD1-CB 4.08Å; L142-Y173 HydrophobicContact CB-CD2 4.5Å; L142-Y173 HydrophobicContact CB-CG 4.49Å; L142-Y173 HydrophobicContact CD1-CD1 4.04Å; L142-Y173 HydrophobicContact CD1-CD2 4.16Å; L142-Y173 HydrophobicContact CD1-CE1 4.06Å; L142-Y173 HydrophobicContact CD1-CE2 4.22Å; L142-Y173 HydrophobicContact CD1-CG 4.08Å; L142-Y173 HydrophobicContact CD2-CD2 3.5Å; L142-Y173 HydrophobicContact CD2-CE2 3.53Å; L142-Y173 HydrophobicContact CD2-CG 4.2Å; L142-Y173 HydrophobicContact CG-CD2 4.27Å; L142-Y173 HydrophobicContact CG-CE2 4.48Å; L142-Q174 CarbonylContact C-O 3.57Å; L142-Q174 WeakPolarHBondContact CA-O 3.28Å; L142-T175 HydrophobicContact CD2-CG2 3.59Å
143S89Confident90.7Very high17 Ų1733.8 Ų33.812%0.11918%0.178CC..THydrogen-bonded Turntrans-60-12.2171.561.50000114.3Y173 Q174S143-Y173 WeakPolarHBondContact OG-CA 3.49Å; S143-Y173 WeakPolarHBondContact OG-CB 3.47Å; S143-Q174 PolarHBondContact N-O 3.29Å; S143-Q174 PolarHBondContact OG-N 3.41Å; S143-Q174 VanDerWaalsContact OG-N 3.16Å
144C89.8Confident90.8Very high15 Ų1533.3 Ų33.310%0.10118%0.175CC..THydrogen-bonded Turntrans-95.824.1171.6650000113.5L142 H146 C165 C168 K170L142-C144 VanDerWaalsContact CB-SG 3.51Å; L142-C144 PolarHBondContact O-N 2.98Å; C144-H146 PolarHBondContact O-CE1 3.26Å; C144-H146 PolarHBondContact O-N 3.42Å; C144-H146 PolarHBondContact O-ND1 3.34Å; C144-H146 PolarHBondContact SG-ND1 2.87Å; C144-C165 PolarHBondContact SG-SG 3.27Å; C144-C168 VanDerWaalsContact CB-SG 3.6Å; C144-C168 VanDerWaalsContact SG-SG 3.62Å; C144-K170 HydrophobicContact CB-CB 4.47Å; C144-K170 HydrophobicContact CB-CD 4.01Å
145S89.8Confident91Very high11 Ų1135.9 Ų35.98%0.07720%0.198CC..SBendtrans62.3-5.1-179.865.60000118.1S117 L141 L142S117-S145 WeakPolarHBondContact CB-O 3.37Å; S117-S145 PolarHBondContact OG-O 3.18Å; L141-S145 WeakPolarHBondContact CD1-O 3.34Å; L142-S145 PolarHBondContact O-N 2.86Å
146H90.8Very high91.2Very high35 Ų3534.6 Ų34.616%0.16219%0.191CC..  trans-78.3144.6178.5-60.8121.2000113.9L142 C144 F148 C165 L167 C168L142-H146 PolarHBondContact N-O 3.43Å; C144-H146 PolarHBondContact O-CE1 3.26Å; C144-H146 PolarHBondContact O-N 3.42Å; C144-H146 PolarHBondContact O-ND1 3.34Å; C144-H146 PolarHBondContact SG-ND1 2.87Å; H146-F148 HydrophobicContact CB-CE2 3.61Å; H146-F148 HydrophobicContact CB-CZ 3.94Å; H146-C165 PolarHBondContact ND1-SG 3.23Å; H146-L167 HydrophobicContact CB-CD1 3.99Å; H146-L167 WeakPolarHBondContact CD2-CD1 3.43Å; H146-C168 VanDerWaalsContact CE1-SG 3.53Å
147V92.7Very high91.5Very high4 Ų431.2 Ų31.22%0.02417%0.172CC..EExtended strand (participates in β ladder)trans-113.4137-178.3-177.20000112.2S117 D122 F134 Q139 V140 L141 I178S117-V147 VanDerWaalsContact OG-CG2 3.26Å; S117-V147 WeakPolarHBondContact OG-CG2 3.33Å; D122-V147 HydrophobicContact CB-CB 4.18Å; D122-V147 HydrophobicContact CB-CG2 3.88Å; F134-V147 HydrophobicContact CE1-CG1 4.09Å; F134-V147 HydrophobicContact CE2-CG1 4.17Å; F134-V147 HydrophobicContact CZ-CB 4.3Å; F134-V147 HydrophobicContact CZ-CG1 3.73Å; Q139-V147 HydrophobicContact CB-CG1 4.3Å; V140-V147 WeakPolarHBondContact O-CA 3.35Å; L141-V147 HydrophobicContact CD1-CG2 3.75Å; V147-I178 HydrophobicContact CG1-CD1 3.88Å; V147-I178 HydrophobicContact CG2-CD1 3.92Å
148F93.3Very high91.7Very high0 Ų034.1 Ų34.10%019%0.188CC..EExtended strand (participates in β ladder)trans-141.6164.6176.5-54.9-83.4000111.7P128 I129 Q139 V140 L142 H146 L153 P166 L167P128-F148 HydrophobicContact CB-CE1 4.03Å; P128-F148 HydrophobicContact CG-CD1 4.32Å; P128-F148 HydrophobicContact CG-CE1 3.88Å; I129-F148 HydrophobicContact CD1-CB 4.34Å; I129-F148 HydrophobicContact CD1-CD1 3.58Å; I129-F148 HydrophobicContact CD1-CE1 4.18Å; I129-F148 HydrophobicContact CD1-CG 4.12Å; I129-F148 HydrophobicContact CG1-CD1 3.75Å; I129-F148 HydrophobicContact CG1-CE1 4.06Å; Q139-F148 CarbonylContact C-O 3.53Å; Q139-F148 WeakPolarHBondContact CA-O 3.15Å; V140-F148 HydrophobicContact CG2-CB 4.27Å; V140-F148 WeakPolarHBondContact CG2-O 3.32Å; V140-F148 PolarHBondContact N-O 2.93Å; V140-F148 PolarHBondContact O-N 2.9Å; L142-F148 HydrophobicContact CD1-CD2 4.02Å; L142-F148 HydrophobicContact CD1-CE2 3.63Å; L142-F148 HydrophobicContact CG-CD2 4.19Å; L142-F148 HydrophobicContact CG-CE2 4.16Å; H146-F148 HydrophobicContact CB-CE2 3.61Å; H146-F148 HydrophobicContact CB-CZ 3.94Å; F148-L153 HydrophobicContact CB-CB 4.32Å; F148-L153 HydrophobicContact CD2-CD1 4.14Å; F148-L153 HydrophobicContact CG-CD1 4.5Å; F148-P166 HydrophobicContact CE1-CB 4.21Å; F148-P166 HydrophobicContact CE1-CG 4.12Å; F148-P166 HydrophobicContact CZ-CB 4.21Å; F148-P166 HydrophobicContact CZ-CG 4.04Å; F148-L167 HydrophobicContact CE1-CD1 4.3Å; F148-L167 HydrophobicContact CE1-CG 4.24Å; F148-L167 HydrophobicContact CZ-CD1 3.89Å; F148-L167 HydrophobicContact CZ-CG 3.88Å
149H93.6Very high92Very high4 Ų439.5 Ų39.52%0.01921%0.205CC..EExtended strand (participates in β ladder)trans-67.5140.9163.6-62113.4000108.9C127 C130 E133 F134 A151 C152 L153C127-H149 VanDerWaalsContact CB-CE1 3.5Å; C127-H149 WeakPolarHBondContact CB-CE1 3.17Å; C127-H149 VanDerWaalsContact CB-ND1 3.3Å; C127-H149 WeakPolarHBondContact CB-ND1 3.2Å; C130-H149 PolarHBondContact SG-CE1 3.4Å; C130-H149 PolarHBondContact SG-ND1 2.91Å; E133-H149 PolarHBondContact O-NE2 3.23Å; F134-H149 WeakPolarHBondContact CA-NE2 3.43Å; F134-H149 AromaticContact CD1-CD2 3.57Å; F134-H149 AromaticContact CD1-NE2 3.58Å; H149-A151 PolarHBondContact O-N 3.47Å; H149-C152 HydrophobicContact CB-CB 4Å; H149-C152 PolarHBondContact O-N 3.3Å; H149-C152 VanDerWaalsContact O-N 3.14Å; H149-L153 PolarHBondContact O-N 2.96Å
150R91.9Very high91.8Very high73 Ų7341.5 Ų41.528%0.27522%0.217SC..Hα-helixtrans-53.5-44.5176-178-179.1171.6137.41.8112Y80 P138 V140 Q154Y80-R150 PolarHBondContact OH-NH1 2.93Å; P138-R150 HydrophobicContact CB-CB 4.23Å; P138-R150 HydrophobicContact CG-CB 4.16Å; P138-R150 PolarHBondContact O-N 3.23Å; V140-R150 HydrophobicContact CG1-CB 3.91Å; V140-R150 HydrophobicContact CG1-CG 4.16Å; R150-Q154 WeakPolarHBondContact O-CB 3.4Å; R150-Q154 WeakPolarHBondContact O-CG 3.22Å; R150-Q154 PolarHBondContact O-N 2.88Å
151A92.9Very high91.6Very high66 Ų6648.3 Ų48.355%0.54525%0.253SS..Hα-helixtrans-65.9-42.5-179.700000112H149 Q154 A155H149-A151 PolarHBondContact O-N 3.47Å; A151-Q154 PolarHBondContact O-N 3.38Å; A151-A155 WeakPolarHBondContact O-CB 3.47Å; A151-A155 PolarHBondContact O-N 2.64Å
152C92.8Very high91.4Very high22 Ų2255.1 Ų55.115%0.14928%0.283CS..Hα-helixtrans-65.5-42.6179-64.20000111.7I129 H149 A155 F156I129-C152 HydrophobicContact CB-CB 3.99Å; I129-C152 HydrophobicContact CD1-CB 3.82Å; I129-C152 HydrophobicContact CG2-CB 4Å; H149-C152 HydrophobicContact CB-CB 4Å; H149-C152 PolarHBondContact O-N 3.3Å; H149-C152 VanDerWaalsContact O-N 3.14Å; C152-A155 PolarHBondContact O-N 2.93Å; C152-F156 WeakPolarHBondContact O-CB 3.5Å; C152-F156 PolarHBondContact O-N 2.85Å
153L92.7Very high91.1Very high6 Ų659.5 Ų59.53%0.03130%0.302CS..Hα-helixtrans-64.3-45.2175.5-171.371.7000111.4V140 L142 F148 H149 A155 F156 E157 P166 Y173 T175V140-L153 HydrophobicContact CG2-CB 4.12Å; V140-L153 HydrophobicContact CG2-CD2 3.68Å; L142-L153 HydrophobicContact CD1-CD1 4.4Å; L142-L153 HydrophobicContact CD2-CD2 3.67Å; F148-L153 HydrophobicContact CB-CB 4.32Å; F148-L153 HydrophobicContact CD2-CD1 4.14Å; F148-L153 HydrophobicContact CG-CD1 4.5Å; H149-L153 PolarHBondContact O-N 2.96Å; L153-A155 VanDerWaalsContact C-N 3.32Å; L153-A155 PolarHBondContact O-N 3.23Å; L153-F156 WeakPolarHBondContact O-CB 3.37Å; L153-F156 PolarHBondContact O-N 3.45Å; L153-E157 WeakPolarHBondContact O-CG 3.26Å; L153-E157 PolarHBondContact O-N 3.47Å; L153-P166 HydrophobicContact CD1-CG 4.47Å; L153-Y173 WeakPolarHBondContact CD1-OH 3.47Å; L153-Y173 HydrophobicContact CD2-CE2 4.16Å; L153-T175 HydrophobicContact CD2-CG2 4.05Å
154Q91.8Very high91.2Very high84 Ų8459.9 Ų59.939%0.39330%0.304SS..Hα-helixtrans-61.3-39176.6-82.4-173.8-33.400112.7R150 A151 K158R150-Q154 WeakPolarHBondContact O-CB 3.4Å; R150-Q154 WeakPolarHBondContact O-CG 3.22Å; R150-Q154 PolarHBondContact O-N 2.88Å; A151-Q154 PolarHBondContact O-N 3.38Å; Q154-K158 WeakPolarHBondContact O-CB 3.49Å; Q154-K158 VanDerWaalsContact O-CG 3.24Å; Q154-K158 WeakPolarHBondContact O-CG 3.38Å; Q154-K158 PolarHBondContact O-N 2.98Å
155A93.4Very high91.3Very high60 Ų6059.2 Ų59.250%0.49630%0.299SS..Hα-helixtrans-64.7-41.6175.500000111.3A151 C152 L153 K158 F159A151-A155 WeakPolarHBondContact O-CB 3.47Å; A151-A155 PolarHBondContact O-N 2.64Å; C152-A155 PolarHBondContact O-N 2.93Å; L153-A155 VanDerWaalsContact C-N 3.32Å; L153-A155 PolarHBondContact O-N 3.23Å; A155-K158 PolarHBondContact O-N 3.35Å; A155-F159 WeakPolarHBondContact O-CB 3.45Å; A155-F159 PolarHBondContact O-N 3.46Å
156F92.4Very high91.4Very high53 Ų5360.6 Ų60.623%0.23231%0.308CS..Hα-helixtrans-64.2-44.5176.8-178.6-90.6000112.6I129 C152 L153 K158 F159 T160 T164 P166I129-F156 HydrophobicContact CD1-CB 4.4Å; C152-F156 WeakPolarHBondContact O-CB 3.5Å; C152-F156 PolarHBondContact O-N 2.85Å; L153-F156 WeakPolarHBondContact O-CB 3.37Å; L153-F156 PolarHBondContact O-N 3.45Å; F156-K158 VanDerWaalsContact C-N 3.33Å; F156-K158 PolarHBondContact O-N 3.07Å; F156-F159 PolarHBondContact O-N 3.24Å; F156-T160 HydrophobicContact CD1-CG2 4.36Å; F156-T160 HydrophobicContact CD2-CG2 4.39Å; F156-T160 HydrophobicContact CE1-CG2 3.88Å; F156-T160 HydrophobicContact CE2-CG2 3.94Å; F156-T160 HydrophobicContact CZ-CG2 3.67Å; F156-T160 PolarHBondContact O-N 3.26Å; F156-T160 PolarHBondContact O-OG1 3.19Å; F156-T164 VanDerWaalsContact CE1-O 3.23Å; F156-T164 WeakPolarHBondContact CE1-O 3.46Å; F156-P166 HydrophobicContact CD1-CG 3.82Å; F156-P166 HydrophobicContact CD2-CG 4.19Å; F156-P166 HydrophobicContact CE1-CG 3.89Å; F156-P166 HydrophobicContact CE2-CB 4.29Å; F156-P166 HydrophobicContact CE2-CG 4.24Å; F156-P166 HydrophobicContact CG-CG 3.98Å; F156-P166 HydrophobicContact CZ-CB 4.26Å; F156-P166 HydrophobicContact CZ-CG 4.08Å
157E92.1Very high91.3Very high42 Ų4263.1 Ų63.120%0.19632%0.322CS..Hα-helixtrans-61.6-41.2176.3-73.1176.3171.400111.6L153 N161 Y173L153-E157 WeakPolarHBondContact O-CG 3.26Å; L153-E157 PolarHBondContact O-N 3.47Å; E157-N161 VanDerWaalsContact O-CA 3.29Å; E157-N161 WeakPolarHBondContact O-CA 3.26Å; E157-N161 PolarHBondContact O-N 3.33Å; E157-Y173 WeakPolarHBondContact CG-OH 3.42Å; E157-Y173 PolarHBondContact OE1-OH 2.88Å
158K91.9Very high91.2Very high157 Ų15765.6 Ų65.668%0.68334%0.339SS*.Hα-helixtrans-65.9-38.5175.8-74.6174.4-179.3-1760112.5Q154 A155 F156 N161Q154-K158 WeakPolarHBondContact O-CB 3.49Å; Q154-K158 VanDerWaalsContact O-CG 3.24Å; Q154-K158 WeakPolarHBondContact O-CG 3.38Å; Q154-K158 PolarHBondContact O-N 2.98Å; A155-K158 PolarHBondContact O-N 3.35Å; F156-K158 VanDerWaalsContact C-N 3.33Å; F156-K158 PolarHBondContact O-N 3.07Å; K158-N161 PolarHBondContact O-OD1 2.75Å
159F92.2Very high91Very high178 Ų17875.5 Ų75.578%0.78138%0.376SS*.Hα-helixtrans-70.7-42.3179.7-179.7-100.9000112.2A155 F156A155-F159 WeakPolarHBondContact O-CB 3.45Å; A155-F159 PolarHBondContact O-N 3.46Å; F156-F159 PolarHBondContact O-N 3.24Å
160T88.6Confident90.6Very high42 Ų4280.7 Ų80.726%0.25840%0.399SS..Hα-helixtrans-86.8-14.8-17756.70000113.5F156 K162F156-T160 HydrophobicContact CD1-CG2 4.36Å; F156-T160 HydrophobicContact CD2-CG2 4.39Å; F156-T160 HydrophobicContact CE1-CG2 3.88Å; F156-T160 HydrophobicContact CE2-CG2 3.94Å; F156-T160 HydrophobicContact CZ-CG2 3.67Å; F156-T160 PolarHBondContact O-N 3.26Å; F156-T160 PolarHBondContact O-OG1 3.19Å; T160-K162 WeakPolarHBondContact O-CG 3.45Å; T160-K162 PolarHBondContact O-N 2.73Å; T160-K162 VanDerWaalsContact O-N 3.07Å; T160-K162 PolarHBondContact OG1-O 3.16Å; T160-K162 VanDerWaalsContact OG1-O 3.11Å
161N87.2Confident90.3Very high144 Ų14482.3 Ų82.377%0.7741%0.413SS*.SBendtrans51.722.7-170.2-67.9-53000113.3E157 K158E157-N161 VanDerWaalsContact O-CA 3.29Å; E157-N161 WeakPolarHBondContact O-CA 3.26Å; E157-N161 PolarHBondContact O-N 3.33Å; K158-N161 PolarHBondContact O-OD1 2.75Å
162K87.6Confident89.6Confident144 Ų14487 Ų8763%0.62642%0.423SS*.SBendtrans-140.2136-178.2-62.9178.5-177.3178.30110.2T160 T164T160-K162 WeakPolarHBondContact O-CG 3.45Å; T160-K162 PolarHBondContact O-N 2.73Å; T160-K162 VanDerWaalsContact O-N 3.07Å; T160-K162 PolarHBondContact OG1-O 3.16Å; T160-K162 VanDerWaalsContact OG1-O 3.11Å; K162-T164 HydrophobicContact CB-CG2 3.84Å; K162-T164 PolarHBondContact O-N 3.01Å
163K87.4Confident89.3Confident92 Ų9286.1 Ų86.140%0.442%0.417SS..  trans-78.782.1171.6-74.1-168.3167.6-170.70110.5D83 Q172D83-K163 IonicContact OD1-NZ 2.66Å; D83-K163 PolarHBondContact OD1-NZ 3.26Å; K163-Q172 PolarHBondContact O-N 3.33Å
164T91.3Very high89.1Confident26 Ų2687.3 Ų87.316%0.1642%0.423CS..BIsolated β-bridgetrans-127.3132.5179.964.60000111.3F156 K162 P166 K170 N171F156-T164 VanDerWaalsContact CE1-O 3.23Å; F156-T164 WeakPolarHBondContact CE1-O 3.46Å; K162-T164 HydrophobicContact CB-CG2 3.84Å; K162-T164 PolarHBondContact O-N 3.01Å; T164-P166 WeakPolarHBondContact O-CD 3.5Å; T164-K170 WeakPolarHBondContact CA-O 3.44Å; T164-N171 WeakPolarHBondContact CG2-OD1 3.12Å
165C91.6Very high89Confident1 Ų183.7 Ų83.71%0.00741%0.406CS..  trans-63.3129.5-179177.80000110.4L142 C144 H146 L167 R169 K170 Y173L142-C165 HydrophobicContact CD1-CB 4.08Å; C144-C165 PolarHBondContact SG-SG 3.27Å; H146-C165 PolarHBondContact ND1-SG 3.23Å; C165-L167 PolarHBondContact O-N 3.42Å; C165-L167 PolarHBondContact SG-N 3.13Å; C165-R169 WeakPolarHBondContact O-CA 3.26Å; C165-R169 PolarHBondContact O-N 3Å; C165-K170 PolarHBondContact N-O 3.41Å; C165-Y173 HydrophobicContact CB-CD1 4.25Å; C165-Y173 HydrophobicContact CB-CE1 4.48Å
166P90.3Very high88.8Confident39 Ų3982.2 Ų82.225%0.25339%0.388SS..THydrogen-bonded Turntrans-59.9-28178-25.633.6000114.5I129 F148 L153 F156 T164I129-P166 HydrophobicContact CD1-CG 4.05Å; I129-P166 HydrophobicContact CG1-CG 4.34Å; F148-P166 HydrophobicContact CE1-CB 4.21Å; F148-P166 HydrophobicContact CE1-CG 4.12Å; F148-P166 HydrophobicContact CZ-CB 4.21Å; F148-P166 HydrophobicContact CZ-CG 4.04Å; L153-P166 HydrophobicContact CD1-CG 4.47Å; F156-P166 HydrophobicContact CD1-CG 3.82Å; F156-P166 HydrophobicContact CD2-CG 4.19Å; F156-P166 HydrophobicContact CE1-CG 3.89Å; F156-P166 HydrophobicContact CE2-CB 4.29Å; F156-P166 HydrophobicContact CE2-CG 4.24Å; F156-P166 HydrophobicContact CG-CG 3.98Å; F156-P166 HydrophobicContact CZ-CB 4.26Å; F156-P166 HydrophobicContact CZ-CG 4.08Å; T164-P166 WeakPolarHBondContact O-CD 3.5Å
167L89.9Confident88.7Confident88 Ų8879.9 Ų79.946%0.46138%0.378SS..THydrogen-bonded Turntrans-90.4-56.7-177.1-70.2176.2000112.6P128 H146 F148 C165P128-L167 HydrophobicContact CB-CD1 4.46Å; P128-L167 HydrophobicContact CB-CD2 4Å; P128-L167 HydrophobicContact CB-CG 4.43Å; P128-L167 HydrophobicContact CG-CD1 3.96Å; P128-L167 HydrophobicContact CG-CD2 4.34Å; P128-L167 HydrophobicContact CG-CG 4.45Å; H146-L167 HydrophobicContact CB-CD1 3.99Å; H146-L167 WeakPolarHBondContact CD2-CD1 3.43Å; F148-L167 HydrophobicContact CE1-CD1 4.3Å; F148-L167 HydrophobicContact CE1-CG 4.24Å; F148-L167 HydrophobicContact CZ-CD1 3.89Å; F148-L167 HydrophobicContact CZ-CG 3.88Å; C165-L167 PolarHBondContact O-N 3.42Å; C165-L167 PolarHBondContact SG-N 3.13Å
168C89.5Confident88.5Confident57 Ų5777.9 Ų77.939%0.38537%0.368SS..THydrogen-bonded Turntrans-103.62.2-17464.30000114.8C144 H146 K170C144-C168 VanDerWaalsContact CB-SG 3.6Å; C144-C168 VanDerWaalsContact SG-SG 3.62Å; H146-C168 VanDerWaalsContact CE1-SG 3.53Å; C168-K170 PolarHBondContact O-N 2.85Å
169R89.3Confident88.3Confident208 Ų20872.8 Ų72.879%0.78535%0.347SS*.  trans55.917179.3-55.2-179.3179.2175.3-0.8114.8C165 N171C165-R169 WeakPolarHBondContact O-CA 3.26Å; C165-R169 PolarHBondContact O-N 3Å; R169-N171 PolarHBondContact O-N 2.99Å
170K86.9Confident88Confident113 Ų11365 Ų6549%0.49131%0.314SS..  trans-63.6125.5174.1-167.7175.6-175.1178.50109.3C144 T164 C165 C168C144-K170 HydrophobicContact CB-CB 4.47Å; C144-K170 HydrophobicContact CB-CD 4.01Å; T164-K170 WeakPolarHBondContact CA-O 3.44Å; C165-K170 PolarHBondContact N-O 3.41Å; C168-K170 PolarHBondContact O-N 2.85Å
171N83.9Confident88Confident107 Ų10763.2 Ų63.257%0.57230%0.303SS*.BIsolated β-bridgetrans-80.5153.9177.4-62.1-39.6000110.7T164 R169 Y173T164-N171 WeakPolarHBondContact CG2-OD1 3.12Å; R169-N171 PolarHBondContact O-N 2.99Å; N171-Y173 VanDerWaalsContact C-N 3.33Å; N171-Y173 PolarHBondContact O-N 3.36Å
172Q79Confident88.1Confident163 Ų16356.5 Ų56.576%0.76227%0.268SS*.SBendtrans54.146.5170.3-59.7177-1.200113K163K163-Q172 PolarHBondContact O-N 3.33Å
173Y87.4Confident88.1Confident5 Ų557.2 Ų57.22%0.0227%0.267CS..  trans-71.6159.3172.156.8-105000111.4L142 S143 L153 E157 C165 N171 T175L142-Y173 HydrophobicContact CB-CD2 4.5Å; L142-Y173 HydrophobicContact CB-CG 4.49Å; L142-Y173 HydrophobicContact CD1-CD1 4.04Å; L142-Y173 HydrophobicContact CD1-CD2 4.16Å; L142-Y173 HydrophobicContact CD1-CE1 4.06Å; L142-Y173 HydrophobicContact CD1-CE2 4.22Å; L142-Y173 HydrophobicContact CD1-CG 4.08Å; L142-Y173 HydrophobicContact CD2-CD2 3.5Å; L142-Y173 HydrophobicContact CD2-CE2 3.53Å; L142-Y173 HydrophobicContact CD2-CG 4.2Å; L142-Y173 HydrophobicContact CG-CD2 4.27Å; L142-Y173 HydrophobicContact CG-CE2 4.48Å; S143-Y173 WeakPolarHBondContact OG-CA 3.49Å; S143-Y173 WeakPolarHBondContact OG-CB 3.47Å; L153-Y173 WeakPolarHBondContact CD1-OH 3.47Å; L153-Y173 HydrophobicContact CD2-CE2 4.16Å; E157-Y173 WeakPolarHBondContact CG-OH 3.42Å; E157-Y173 PolarHBondContact OE1-OH 2.88Å; C165-Y173 HydrophobicContact CB-CD1 4.25Å; C165-Y173 HydrophobicContact CB-CE1 4.48Å; N171-Y173 VanDerWaalsContact C-N 3.33Å; N171-Y173 PolarHBondContact O-N 3.36Å; Y173-T175 HydrophobicContact CD2-CG2 3.66Å; Y173-T175 HydrophobicContact CE2-CG2 3.44Å; Y173-T175 VanDerWaalsContact CE2-CG2 3.44Å
174Q87.3Confident88.2Confident31 Ų3155.9 Ų55.915%0.14526%0.263CS..  trans-99.3156167.2-64.2170.131.300109.5D83 P103 W110 L142 S143D83-Q174 WeakPolarHBondContact OD2-CA 3.43Å; P103-Q174 PolarHBondContact O-NE2 2.85Å; W110-Q174 HydrophobicContact CH2-CB 4.26Å; W110-Q174 WeakPolarHBondContact CH2-O 3.37Å; W110-Q174 HydrophobicContact CZ2-CB 3.67Å; L142-Q174 CarbonylContact C-O 3.57Å; L142-Q174 WeakPolarHBondContact CA-O 3.28Å; S143-Q174 PolarHBondContact N-O 3.29Å; S143-Q174 PolarHBondContact OG-N 3.41Å; S143-Q174 VanDerWaalsContact OG-N 3.16Å
175T89.8Confident88.2Confident7 Ų757.1 Ų57.14%0.04327%0.267CS..EExtended strand (participates in β ladder)trans-126.4125.7-171.348.10000111.2V81 L82 D83 L142 L153 Y173V81-T175 WeakPolarHBondContact CA-O 3.2Å; L82-T175 WeakPolarHBondContact CB-OG1 3.49Å; L82-T175 PolarHBondContact N-O 2.86Å; D83-T175 PolarHBondContact OD2-N 3.19Å; D83-T175 PolarHBondContact OD2-OG1 2.94Å; L142-T175 HydrophobicContact CD2-CG2 3.59Å; L153-T175 HydrophobicContact CD2-CG2 4.05Å; Y173-T175 HydrophobicContact CD2-CG2 3.66Å; Y173-T175 HydrophobicContact CE2-CG2 3.44Å; Y173-T175 VanDerWaalsContact CE2-CG2 3.44Å
176R88.7Confident88.2Confident30 Ų3062.8 Ų62.811%0.11329%0.288CS..EExtended strand (participates in β ladder)trans-119.7131.8174.1-179.4177.3176174.14.2109.4E79 W110 V140 L141 I178E79-R176 IonicContact OE2-CZ 3.17Å; E79-R176 IonicContact OE2-NE 3.63Å; E79-R176 PolarHBondContact OE2-NE 2.64Å; E79-R176 IonicContact OE2-NH2 2.84Å; E79-R176 PolarHBondContact OE2-NH2 2.84Å; W110-R176 VanDerWaalsContact CB-NH1 3.31Å; W110-R176 HydrophobicContact CD2-CB 4.09Å; W110-R176 HydrophobicContact CE3-CB 3.77Å; W110-R176 HydrophobicContact CE3-CG 4.42Å; W110-R176 HydrophobicContact CH2-CB 3.59Å; W110-R176 HydrophobicContact CZ2-CB 3.91Å; W110-R176 HydrophobicContact CZ3-CB 3.52Å; V140-R176 CarbonylContact C-O 3.52Å; V140-R176 WeakPolarHBondContact CA-O 3.32Å; L141-R176 PolarHBondContact N-O 2.84Å; L141-R176 PolarHBondContact O-N 3.28Å; R176-I178 HydrophobicContact CG-CG2 4.5Å
177V89.9Confident88.3Confident3 Ų365.1 Ų65.12%0.01830%0.297CS..EExtended strand (participates in β ladder)trans-74.1129.3172.3-179.20000108.9E79 Y80 L82 Q139 V140E79-V177 VanDerWaalsContact CB-O 3.3Å; E79-V177 WeakPolarHBondContact CB-O 3.34Å; E79-V177 WeakPolarHBondContact CG-O 3.33Å; Y80-V177 HydrophobicContact CD1-CB 4.32Å; Y80-V177 HydrophobicContact CD2-CG2 4.48Å; Y80-V177 HydrophobicContact CE1-CB 4.06Å; Y80-V177 HydrophobicContact CE1-CG1 4.3Å; Y80-V177 HydrophobicContact CE1-CG2 4.04Å; Y80-V177 HydrophobicContact CE2-CG2 4Å; Y80-V177 PolarHBondContact O-N 3.44Å; L82-V177 HydrophobicContact CD1-CG2 3.74Å; L82-V177 HydrophobicContact CD2-CG2 3.73Å; L82-V177 HydrophobicContact CG-CG2 3.67Å; Q139-V177 WeakPolarHBondContact O-CA 3.36Å; V140-V177 HydrophobicContact CG1-CG2 4.33Å
178I89.3Confident88.4Confident1 Ų165.2 Ų65.21%0.00529%0.294CS..EExtended strand (participates in β ladder)trans-122.4158.4176.463.4164000110.5Q139 L141 V147 R176Q139-I178 HydrophobicContact CB-CD1 4.37Å; Q139-I178 HydrophobicContact CB-CG1 3.69Å; Q139-I178 WeakPolarHBondContact CB-O 3.39Å; Q139-I178 PolarHBondContact O-N 3.48Å; L141-I178 HydrophobicContact CB-CD1 4.13Å; L141-I178 HydrophobicContact CB-CG1 4.3Å; L141-I178 HydrophobicContact CB-CG2 3.7Å; L141-I178 HydrophobicContact CD2-CG2 4.19Å; V147-I178 HydrophobicContact CG1-CD1 3.88Å; V147-I178 HydrophobicContact CG2-CD1 3.92Å; R176-I178 HydrophobicContact CG-CG2 4.5Å
179H87.2Confident88.6Confident49 Ų4964.5 Ų64.523%0.22729%0.289CS..  trans-122.112.7179.8-67.8-72.5000113.5G181 A182 R183H179-G181 PolarHBondContact O-N 3.27Å; H179-A182 WeakPolarHBondContact O-CB 3.25Å; H179-A182 PolarHBondContact O-N 2.93Å; H179-A182 VanDerWaalsContact O-N 3.09Å; H179-R183 PolarHBondContact O-N 3.21Å
180D86.9Confident88.9Confident16 Ų1658 Ų589%0.08627%0.273CS..Hα-helixtrans-60.9-45.5-173.3-66.8-31000113K114 A182 R183 L184K114-D180 WeakPolarHBondContact CE-OD2 3.49Å; K114-D180 IonicContact NZ-OD1 2.98Å; K114-D180 PolarHBondContact NZ-OD1 2.84Å; K114-D180 IonicContact NZ-OD2 2.86Å; D180-A182 VanDerWaalsContact C-N 3.27Å; D180-A182 PolarHBondContact O-N 3.4Å; D180-R183 WeakPolarHBondContact O-CB 3.48Å; D180-R183 PolarHBondContact O-N 3.44Å; D180-L184 WeakPolarHBondContact O-CG 3.31Å; D180-L184 PolarHBondContact O-N 3.05Å
181G87.3Confident89.4Confident4 Ų456.4 Ų56.44%0.04127%0.273CS..Hα-helixtrans-64.5-31176.700000113Q139 H179 L184 F185Q139-G181 VanDerWaalsContact OE1-CA 3.24Å; H179-G181 PolarHBondContact O-N 3.27Å; G181-L184 PolarHBondContact O-N 3.41Å; G181-F185 VanDerWaalsContact O-CB 3.27Å; G181-F185 WeakPolarHBondContact O-CB 3.35Å; G181-F185 PolarHBondContact O-N 3.04Å
182A89Confident90Very high3 Ų359.2 Ų59.23%0.02528%0.275CS..Hα-helixtrans-70.5-40.117500000111.4E135 L136 Q139 H179 D180 F185 R186E135-A182 WeakPolarHBondContact O-CA 3.49Å; E135-A182 WeakPolarHBondContact O-CB 3.48Å; E135-A182 PolarHBondContact O-N 3.5Å; L136-A182 HydrophobicContact CD2-CB 4.48Å; Q139-A182 VanDerWaalsContact NE2-N 3.18Å; H179-A182 WeakPolarHBondContact O-CB 3.25Å; H179-A182 PolarHBondContact O-N 2.93Å; H179-A182 VanDerWaalsContact O-N 3.09Å; D180-A182 VanDerWaalsContact C-N 3.27Å; D180-A182 PolarHBondContact O-N 3.4Å; A182-F185 PolarHBondContact O-N 2.97Å; A182-R186 VanDerWaalsContact O-CG 3.31Å; A182-R186 WeakPolarHBondContact O-CG 3.31Å; A182-R186 PolarHBondContact O-N 3.4Å
183R88.8Confident90.8Very high159 Ų15957 Ų5760%0.627%0.267SS*.Hα-helixtrans-60.9-47.7171.7-178.9179.9170-162.7-2.3111.5H179 D180 F185 R186 I187H179-R183 PolarHBondContact O-N 3.21Å; D180-R183 WeakPolarHBondContact O-CB 3.48Å; D180-R183 PolarHBondContact O-N 3.44Å; R183-F185 PolarHBondContact O-N 3.38Å; R183-R186 PolarHBondContact O-N 3.07Å; R183-I187 HydrophobicContact CG-CD1 4.28Å; R183-I187 WeakPolarHBondContact O-CG1 3.48Å; R183-I187 PolarHBondContact O-N 3.36Å
184L89.2Confident91.3Very high64 Ų6460.7 Ų60.734%0.33529%0.285SS..Hα-helixtrans-61.1-43.5177.1-70.3170.5000111.8V124 D180 G181 I187 K188V124-L184 HydrophobicContact CG2-CD1 3.8Å; D180-L184 WeakPolarHBondContact O-CG 3.31Å; D180-L184 PolarHBondContact O-N 3.05Å; G181-L184 PolarHBondContact O-N 3.41Å; L184-I187 WeakPolarHBondContact O-CB 3.5Å; L184-I187 PolarHBondContact O-N 3.28Å; L184-K188 WeakPolarHBondContact O-CG 3.38Å; L184-K188 PolarHBondContact O-N 2.86Å
185F90.9Very high91.8Very high52 Ų5262 Ų6223%0.22830%0.3CS..Hα-helixtrans-61.3-45.1176.4-178.4-104.4000111.9E135 L136 G181 A182 R183 I187 K188 C189E135-F185 HydrophobicContact CB-CD1 4.49Å; E135-F185 HydrophobicContact CB-CD2 4.22Å; E135-F185 HydrophobicContact CB-CE2 4.25Å; E135-F185 HydrophobicContact CB-CG 4.34Å; E135-F185 HydrophobicContact CB-CZ 4.39Å; E135-F185 HydrophobicContact CG-CD2 4.1Å; E135-F185 HydrophobicContact CG-CE2 3.91Å; E135-F185 HydrophobicContact CG-CZ 4.36Å; L136-F185 HydrophobicContact CD2-CD1 4.01Å; L136-F185 HydrophobicContact CD2-CE1 4.49Å; L136-F185 HydrophobicContact CG-CD1 4.02Å; L136-F185 HydrophobicContact CG-CE1 4.1Å; G181-F185 VanDerWaalsContact O-CB 3.27Å; G181-F185 WeakPolarHBondContact O-CB 3.35Å; G181-F185 PolarHBondContact O-N 3.04Å; A182-F185 PolarHBondContact O-N 2.97Å; R183-F185 PolarHBondContact O-N 3.38Å; F185-I187 VanDerWaalsContact C-N 3.31Å; F185-I187 PolarHBondContact O-N 3.01Å; F185-K188 WeakPolarHBondContact O-CB 3.19Å; F185-K188 PolarHBondContact O-N 2.8Å; F185-K188 VanDerWaalsContact O-N 3.14Å; F185-C189 VanDerWaalsContact CE1-SG 3.56Å; F185-C189 PolarHBondContact O-N 3.27Å; F185-C189 PolarHBondContact O-SG 3.04Å
186R91.9Very high92.1Very high119 Ų11969 Ų6945%0.44933%0.327SS..Hα-helixtrans-59.1-41.7174.6-72.5178.3-166.71568.9111.9E77 L136 A182 R183 C189 V190E77-R186 IonicContact OE1-CZ 2.74Å; E77-R186 IonicContact OE1-NH1 3.99Å; E77-R186 PolarHBondContact OE1-NH1 2.91Å; E77-R186 IonicContact OE1-NH2 3.69Å; E77-R186 PolarHBondContact OE1-NH2 3.4Å; L136-R186 HydrophobicContact CD2-CG 4.38Å; A182-R186 VanDerWaalsContact O-CG 3.31Å; A182-R186 WeakPolarHBondContact O-CG 3.31Å; A182-R186 PolarHBondContact O-N 3.4Å; R183-R186 PolarHBondContact O-N 3.07Å; R186-C189 PolarHBondContact O-N 3.05Å; R186-V190 WeakPolarHBondContact O-CB 3.28Å; R186-V190 VanDerWaalsContact O-CG2 3.29Å; R186-V190 WeakPolarHBondContact O-CG2 3.43Å; R186-V190 PolarHBondContact O-N 3.19Å
187I92.1Very high92.5Very high88 Ų8875.6 Ų75.645%0.45135%0.352SS..Hα-helixtrans-61.3-46.7174.9-66.7165.1000110.5R183 L184 F185 C189 V190 T191R183-I187 HydrophobicContact CG-CD1 4.28Å; R183-I187 WeakPolarHBondContact O-CG1 3.48Å; R183-I187 PolarHBondContact O-N 3.36Å; L184-I187 WeakPolarHBondContact O-CB 3.5Å; L184-I187 PolarHBondContact O-N 3.28Å; F185-I187 VanDerWaalsContact C-N 3.31Å; F185-I187 PolarHBondContact O-N 3.01Å; I187-C189 VanDerWaalsContact C-N 3.33Å; I187-C189 PolarHBondContact O-N 3.03Å; I187-V190 PolarHBondContact O-N 3.39Å; I187-T191 PolarHBondContact O-N 3.31Å; I187-T191 PolarHBondContact O-OG1 3.36Å; I187-T191 VanDerWaalsContact O-OG1 3.09Å
188K92.1Very high92.8Very high90 Ų9082.6 Ų82.639%0.39138%0.378SS..Hα-helixtrans-56.3-47175-70.2-178.6-176.5-178.70111.2E133 L184 F185 T191 R192E133-K188 IonicContact OE1-NZ 3.02Å; E133-K188 IonicContact OE2-NZ 2.91Å; E133-K188 PolarHBondContact OE2-NZ 2.97Å; L184-K188 WeakPolarHBondContact O-CG 3.38Å; L184-K188 PolarHBondContact O-N 2.86Å; F185-K188 WeakPolarHBondContact O-CB 3.19Å; F185-K188 PolarHBondContact O-N 2.8Å; F185-K188 VanDerWaalsContact O-N 3.14Å; K188-T191 PolarHBondContact O-N 2.9Å; K188-R192 WeakPolarHBondContact O-CG 3.44Å; K188-R192 PolarHBondContact O-N 3.33Å
189C93.8Very high93.2Very high43 Ų4383.5 Ų83.529%0.29139%0.388SS..Hα-helixtrans-61.3-47.9178.3-68.70000112.1F185 R186 I187 T191 R192 I193F185-C189 VanDerWaalsContact CE1-SG 3.56Å; F185-C189 PolarHBondContact O-N 3.27Å; F185-C189 PolarHBondContact O-SG 3.04Å; R186-C189 PolarHBondContact O-N 3.05Å; I187-C189 VanDerWaalsContact C-N 3.33Å; I187-C189 PolarHBondContact O-N 3.03Å; C189-T191 PolarHBondContact O-N 2.82Å; C189-R192 WeakPolarHBondContact O-CB 3.49Å; C189-R192 PolarHBondContact O-N 3.12Å; C189-I193 WeakPolarHBondContact O-CG1 3.42Å; C189-I193 PolarHBondContact O-N 3.25Å
190V96.1Very high93.6Very high71 Ų7186.5 Ų86.543%0.4340%0.398SS..Hα-helixtrans-59.9-47.4177.9169.80000110.5R186 I187 R192 I193 Q194R186-V190 WeakPolarHBondContact O-CB 3.28Å; R186-V190 VanDerWaalsContact O-CG2 3.29Å; R186-V190 WeakPolarHBondContact O-CG2 3.43Å; R186-V190 PolarHBondContact O-N 3.19Å; I187-V190 PolarHBondContact O-N 3.39Å; V190-R192 VanDerWaalsContact C-N 3.3Å; V190-R192 PolarHBondContact O-N 3.29Å; V190-I193 PolarHBondContact O-N 2.92Å; V190-Q194 HydrophobicContact CG1-CG 4.15Å; V190-Q194 WeakPolarHBondContact O-CB 3.26Å; V190-Q194 VanDerWaalsContact O-CG 3.24Å; V190-Q194 WeakPolarHBondContact O-CG 3.36Å; V190-Q194 PolarHBondContact O-N 2.93Å
191T96.3Very high94.1Very high80 Ų8089.1 Ų89.149%0.49141%0.414SS..Hα-helixtrans-58.4-42.4177.3-61.50000111.6I187 K188 C189 Q194 A195I187-T191 PolarHBondContact O-N 3.31Å; I187-T191 PolarHBondContact O-OG1 3.36Å; I187-T191 VanDerWaalsContact O-OG1 3.09Å; K188-T191 PolarHBondContact O-N 2.9Å; C189-T191 PolarHBondContact O-N 2.82Å; T191-Q194 PolarHBondContact O-N 3.39Å; T191-A195 WeakPolarHBondContact O-CB 3.46Å; T191-A195 PolarHBondContact O-N 3.26Å
192R96.9Very high94.6Very high165 Ų16593.2 Ų93.262%0.62344%0.438SS*.Hα-helixtrans-61-52.7175.5-73.1173.972.1154.62.9111.3K188 C189 V190 Q194 A195 Y196K188-R192 WeakPolarHBondContact O-CG 3.44Å; K188-R192 PolarHBondContact O-N 3.33Å; C189-R192 WeakPolarHBondContact O-CB 3.49Å; C189-R192 PolarHBondContact O-N 3.12Å; V190-R192 VanDerWaalsContact C-N 3.3Å; V190-R192 PolarHBondContact O-N 3.29Å; R192-Q194 VanDerWaalsContact C-N 3.29Å; R192-Q194 PolarHBondContact O-N 2.82Å; R192-A195 PolarHBondContact O-N 3.17Å; R192-A195 VanDerWaalsContact O-N 3.13Å; R192-Y196 WeakPolarHBondContact O-CD2 3.38Å; R192-Y196 PolarHBondContact O-N 3.21Å
193I96.8Very high94.9Very high118 Ų11899.7 Ų99.761%0.60546%0.462SS*.Hα-helixtrans-56.2-47.4179.7-68.4166.5000110.4C189 V190 A195 Y196 W197C189-I193 WeakPolarHBondContact O-CG1 3.42Å; C189-I193 PolarHBondContact O-N 3.25Å; V190-I193 PolarHBondContact O-N 2.92Å; I193-A195 PolarHBondContact O-N 3.37Å; I193-Y196 PolarHBondContact O-N 3.18Å; I193-W197 WeakPolarHBondContact O-CB 3.34Å; I193-W197 PolarHBondContact O-N 3.36Å
194Q96.9Very high95.2Very high81 Ų8198.5 Ų98.538%0.37946%0.461SS..Hα-helixtrans-63.4-40.2178.9-67.8180-3.400112.3V190 T191 R192 W197 R198V190-Q194 HydrophobicContact CG1-CG 4.15Å; V190-Q194 WeakPolarHBondContact O-CB 3.26Å; V190-Q194 VanDerWaalsContact O-CG 3.24Å; V190-Q194 WeakPolarHBondContact O-CG 3.36Å; V190-Q194 PolarHBondContact O-N 2.93Å; T191-Q194 PolarHBondContact O-N 3.39Å; R192-Q194 VanDerWaalsContact C-N 3.29Å; R192-Q194 PolarHBondContact O-N 2.82Å; Q194-W197 PolarHBondContact O-N 3.14Å; Q194-R198 VanDerWaalsContact CB-NH1 3.28Å; Q194-R198 WeakPolarHBondContact O-CB 3.4Å; Q194-R198 VanDerWaalsContact O-CG 3.26Å; Q194-R198 WeakPolarHBondContact O-CG 3.16Å; Q194-R198 PolarHBondContact O-N 3.23Å; Q194-R198 VanDerWaalsContact OE1-NH1 3.13Å
195A97.4Very high95.5Very high58 Ų58103.2 Ų103.248%0.47948%0.475SS..Hα-helixtrans-63.5-43.9176.100000111.8T191 R192 I193 W197 G199T191-A195 WeakPolarHBondContact O-CB 3.46Å; T191-A195 PolarHBondContact O-N 3.26Å; R192-A195 PolarHBondContact O-N 3.17Å; R192-A195 VanDerWaalsContact O-N 3.13Å; I193-A195 PolarHBondContact O-N 3.37Å; A195-W197 PolarHBondContact O-N 2.92Å; A195-G199 PolarHBondContact O-N 2.8Å
196Y96.9Very high95.6Very high155 Ų155107.4 Ų107.461%0.60849%0.49SS*.Hα-helixtrans-61.1-44174.7-83.2-74.1000112R192 I193 G199 Y200R192-Y196 WeakPolarHBondContact O-CD2 3.38Å; R192-Y196 PolarHBondContact O-N 3.21Å; I193-Y196 PolarHBondContact O-N 3.18Å; Y196-G199 PolarHBondContact O-N 3.14Å; Y196-Y200 WeakPolarHBondContact O-CB 3.5Å; Y196-Y200 PolarHBondContact O-N 3.31Å
197W97.3Very high95.6Very high168 Ų168109.9 Ų109.964%0.63650%0.499SS*.Hα-helixtrans-64.1-50.3178.3-177.6-99.8000112.1I193 Q194 A195 G199 Y200 V201I193-W197 WeakPolarHBondContact O-CB 3.34Å; I193-W197 PolarHBondContact O-N 3.36Å; Q194-W197 PolarHBondContact O-N 3.14Å; A195-W197 PolarHBondContact O-N 2.92Å; W197-G199 VanDerWaalsContact C-N 3.28Å; W197-G199 PolarHBondContact O-N 2.96Å; W197-Y200 HydrophobicContact CE3-CD1 4.42Å; W197-Y200 HydrophobicContact CZ3-CD1 4.36Å; W197-Y200 WeakPolarHBondContact O-CB 3.3Å; W197-Y200 PolarHBondContact O-N 3.18Å; W197-V201 HydrophobicContact CZ2-CG2 4.46Å; W197-V201 WeakPolarHBondContact O-CG2 3.16Å; W197-V201 PolarHBondContact O-N 3.39Å
198R96.9Very high95.6Very high150 Ų150110.1 Ų110.157%0.56650%0.502SS*.Hα-helixtrans-55.6-45.5175.4-72.6175.5-176.8115.85.6110.8Q194 Y200 V201 V202Q194-R198 VanDerWaalsContact CB-NH1 3.28Å; Q194-R198 WeakPolarHBondContact O-CB 3.4Å; Q194-R198 VanDerWaalsContact O-CG 3.26Å; Q194-R198 WeakPolarHBondContact O-CG 3.16Å; Q194-R198 PolarHBondContact O-N 3.23Å; Q194-R198 VanDerWaalsContact OE1-NH1 3.13Å; R198-Y200 PolarHBondContact O-N 3Å; R198-V201 PolarHBondContact O-N 2.74Å; R198-V202 WeakPolarHBondContact O-CG2 3.37Å; R198-V202 PolarHBondContact O-N 3.45Å; R198-V202 VanDerWaalsContact O-N 3.14Å
199G96.4Very high95.6Very high20 Ų20108.7 Ų108.721%0.20650%0.498CS..Hα-helixtrans-63.2-39.3175.400000113.5A195 Y196 W197 R203A195-G199 PolarHBondContact O-N 2.8Å; Y196-G199 PolarHBondContact O-N 3.14Å; W197-G199 VanDerWaalsContact C-N 3.28Å; W197-G199 PolarHBondContact O-N 2.96Å; G199-R203 VanDerWaalsContact C-CZ 3.44Å; G199-R203 WeakPolarHBondContact O-CB 3.5Å; G199-R203 VanDerWaalsContact O-CG 3.3Å; G199-R203 WeakPolarHBondContact O-CG 3.45Å; G199-R203 PolarHBondContact O-N 2.96Å; G199-R203 PolarHBondContact O-NH1 3.27Å
200Y96.6Very high95.3Very high113 Ų113114.6 Ų114.644%0.44351%0.514SS..Hα-helixtrans-63.7-46.4176.6170.2-103.1000111.8Y196 W197 R198 V202 R203 K204Y196-Y200 WeakPolarHBondContact O-CB 3.5Å; Y196-Y200 PolarHBondContact O-N 3.31Å; W197-Y200 HydrophobicContact CE3-CD1 4.42Å; W197-Y200 HydrophobicContact CZ3-CD1 4.36Å; W197-Y200 WeakPolarHBondContact O-CB 3.3Å; W197-Y200 PolarHBondContact O-N 3.18Å; R198-Y200 PolarHBondContact O-N 3Å; Y200-V202 PolarHBondContact O-N 3.28Å; Y200-R203 PolarHBondContact O-N 3.33Å; Y200-K204 HydrophobicContact CE1-CD 4.41Å; Y200-K204 WeakPolarHBondContact O-CB 3.44Å; Y200-K204 PolarHBondContact O-N 2.75Å
201V97Very high94.9Very high70 Ų70115.7 Ų115.742%0.42452%0.515SS..Hα-helixtrans-57.3-49.8177.5172.80000110.6W197 R198 K204 W205W197-V201 HydrophobicContact CZ2-CG2 4.46Å; W197-V201 WeakPolarHBondContact O-CG2 3.16Å; W197-V201 PolarHBondContact O-N 3.39Å; R198-V201 PolarHBondContact O-N 2.74Å; V201-K204 PolarHBondContact O-N 3.07Å; V201-W205 WeakPolarHBondContact O-CB 3.37Å; V201-W205 PolarHBondContact O-N 2.66Å
202V96.5Very high94.5Very high90 Ų90116 Ų11655%0.54552%0.517SS..Hα-helixtrans-63.5-43.7178.9175.50000111.6R198 Y200 K204 W205 Y206R198-V202 WeakPolarHBondContact O-CG2 3.37Å; R198-V202 PolarHBondContact O-N 3.45Å; R198-V202 VanDerWaalsContact O-N 3.14Å; Y200-V202 PolarHBondContact O-N 3.28Å; V202-K204 PolarHBondContact O-N 2.84Å; V202-W205 PolarHBondContact O-N 3.39Å; V202-Y206 VanDerWaalsContact O-CB 3.26Å; V202-Y206 WeakPolarHBondContact O-CB 3.42Å; V202-Y206 PolarHBondContact O-N 3.49Å
203R95.3Very high94.2Very high139 Ų139111.8 Ų111.853%0.52551%0.509SS..Hα-helixtrans-64.8-38.2177.7-76-173.8-63.9-89.11.4112.7G199 Y200 R207G199-R203 VanDerWaalsContact C-CZ 3.44Å; G199-R203 WeakPolarHBondContact O-CB 3.5Å; G199-R203 VanDerWaalsContact O-CG 3.3Å; G199-R203 WeakPolarHBondContact O-CG 3.45Å; G199-R203 PolarHBondContact O-N 2.96Å; G199-R203 PolarHBondContact O-NH1 3.27Å; Y200-R203 PolarHBondContact O-N 3.33Å; R203-R207 VanDerWaalsContact O-CB 3.31Å; R203-R207 WeakPolarHBondContact O-CB 3.24Å; R203-R207 PolarHBondContact O-N 3.48Å
204K95.4Very high93.8Very high134 Ų134109.1 Ų109.158%0.58350%0.5SS*.Hα-helixtrans-64.2-46.8175.7-175.8176.7179179.40110.6Y200 V201 V202 R207 N208Y200-K204 HydrophobicContact CE1-CD 4.41Å; Y200-K204 WeakPolarHBondContact O-CB 3.44Å; Y200-K204 PolarHBondContact O-N 2.75Å; V201-K204 PolarHBondContact O-N 3.07Å; V202-K204 PolarHBondContact O-N 2.84Å; K204-R207 PolarHBondContact O-N 3.49Å; K204-N208 PolarHBondContact O-N 2.93Å
205W95.4Very high93.6Very high163 Ų163106.9 Ų106.962%0.61749%0.492SS*.Hα-helixtrans-61.6-48.7175.5175.880.3000112V201 V202 R207 N208 L209V201-W205 WeakPolarHBondContact O-CB 3.37Å; V201-W205 PolarHBondContact O-N 2.66Å; V202-W205 PolarHBondContact O-N 3.39Å; W205-R207 VanDerWaalsContact C-N 3.32Å; W205-R207 PolarHBondContact O-N 3.42Å; W205-N208 PolarHBondContact O-N 3.42Å; W205-L209 HydrophobicContact CH2-CD2 3.88Å; W205-L209 HydrophobicContact CZ2-CD1 4.43Å; W205-L209 HydrophobicContact CZ2-CD2 4.33Å; W205-L209 HydrophobicContact CZ3-CD2 4.2Å; W205-L209 PolarHBondContact O-N 2.93Å
206Y93.3Very high93.2Very high140 Ų140110.9 Ų110.955%0.54951%0.51SS..Hα-helixtrans-63.7-34.8-179.9-175.4-103.7000112.9V202 L209 R210V202-Y206 VanDerWaalsContact O-CB 3.26Å; V202-Y206 WeakPolarHBondContact O-CB 3.42Å; V202-Y206 PolarHBondContact O-N 3.49Å; Y206-L209 HydrophobicContact CD2-CD2 4.35Å; Y206-L209 PolarHBondContact O-N 2.82Å; Y206-R210 WeakPolarHBondContact O-CB 3.29Å; Y206-R210 PolarHBondContact O-N 3.49Å
207R92.2Very high93Very high171 Ų171108.5 Ų108.565%0.64551%0.508SS*.Hα-helixtrans-60.9-47.8173.6-173.4-176-57.2-166.40111.2R203 K204 W205 R210 E211R203-R207 VanDerWaalsContact O-CB 3.31Å; R203-R207 WeakPolarHBondContact O-CB 3.24Å; R203-R207 PolarHBondContact O-N 3.48Å; K204-R207 PolarHBondContact O-N 3.49Å; W205-R207 VanDerWaalsContact C-N 3.32Å; W205-R207 PolarHBondContact O-N 3.42Å; R207-R210 PolarHBondContact O-N 3.07Å; R207-E211 PolarHBondContact O-N 2.92Å
208N92.5Very high92.8Very high94 Ų94104 Ų10450%0.50351%0.507SS..Hα-helixtrans-63.7-41.9177.2-170.223.5000111.5K204 W205 R210 E211 T212K204-N208 PolarHBondContact O-N 2.93Å; W205-N208 PolarHBondContact O-N 3.42Å; N208-R210 VanDerWaalsContact C-N 3.3Å; N208-R210 PolarHBondContact O-N 3.47Å; N208-E211 PolarHBondContact O-N 2.94Å; N208-E211 VanDerWaalsContact O-N 3.14Å; N208-T212 WeakPolarHBondContact O-CG2 3.48Å; N208-T212 PolarHBondContact O-N 3.34Å; N208-T212 VanDerWaalsContact O-N 3.14Å; N208-T212 PolarHBondContact O-OG1 3.47Å
209L90.9Very high92.6Very high60 Ų60105.6 Ų105.631%0.31452%0.518SS..Hα-helixtrans-57.2-44.1174.2-171.275.6000111.5W205 Y206 E211 T212 V213W205-L209 HydrophobicContact CH2-CD2 3.88Å; W205-L209 HydrophobicContact CZ2-CD1 4.43Å; W205-L209 HydrophobicContact CZ2-CD2 4.33Å; W205-L209 HydrophobicContact CZ3-CD2 4.2Å; W205-L209 PolarHBondContact O-N 2.93Å; Y206-L209 HydrophobicContact CD2-CD2 4.35Å; Y206-L209 PolarHBondContact O-N 2.82Å; L209-E211 PolarHBondContact O-N 3.34Å; L209-T212 PolarHBondContact O-N 2.86Å; L209-T212 PolarHBondContact O-OG1 3.3Å; L209-V213 HydrophobicContact CD1-CB 4.24Å; L209-V213 HydrophobicContact CD1-CG2 3.62Å; L209-V213 HydrophobicContact CG-CB 4.41Å; L209-V213 HydrophobicContact CG-CG2 4.29Å; L209-V213 WeakPolarHBondContact O-CB 3.5Å; L209-V213 PolarHBondContact O-N 3.46Å
210R88.9Confident92.3Very high167 Ų167108.7 Ų108.763%0.6353%0.529SS*.Hα-helixtrans-69.7-19.1-179.8-168.5176.4164.7-125.4-3.8113.7Y206 R207 N208 F224Y206-R210 WeakPolarHBondContact O-CB 3.29Å; Y206-R210 PolarHBondContact O-N 3.49Å; R207-R210 PolarHBondContact O-N 3.07Å; N208-R210 VanDerWaalsContact C-N 3.3Å; N208-R210 PolarHBondContact O-N 3.47Å; R210-F224 WeakPolarHBondContact O-CE2 3.3Å
211E87.1Confident92.1Very high94 Ų94109.5 Ų109.544%0.43953%0.532SS..Hα-helixtrans-86.9-23.6174.2-73.5173.7-178.600113R207 N208 L209 F224 K228R207-E211 PolarHBondContact O-N 2.92Å; N208-E211 PolarHBondContact O-N 2.94Å; N208-E211 VanDerWaalsContact O-N 3.14Å; L209-E211 PolarHBondContact O-N 3.34Å; E211-F224 WeakPolarHBondContact O-CE2 3.44Å; E211-K228 WeakPolarHBondContact O-CE 3.4Å
212T88.4Confident91.9Very high87 Ų87113.7 Ų113.753%0.53454%0.544SS..Hα-helixtrans-106.8-37.7-171.948.70000113.1N208 L209N208-T212 WeakPolarHBondContact O-CG2 3.48Å; N208-T212 PolarHBondContact O-N 3.34Å; N208-T212 VanDerWaalsContact O-N 3.14Å; N208-T212 PolarHBondContact O-OG1 3.47Å; L209-T212 PolarHBondContact O-N 2.86Å; L209-T212 PolarHBondContact O-OG1 3.3Å
213V89.3Confident91.7Very high75 Ų75116.2 Ų116.246%0.45555%0.548SS..SBendtrans-105.2127-174.1-1780000110.2L209L209-V213 HydrophobicContact CD1-CB 4.24Å; L209-V213 HydrophobicContact CD1-CG2 3.62Å; L209-V213 HydrophobicContact CG-CB 4.41Å; L209-V213 HydrophobicContact CG-CG2 4.29Å; L209-V213 WeakPolarHBondContact O-CB 3.5Å; L209-V213 PolarHBondContact O-N 3.46Å
214P89.7Confident91.6Very high63 Ų63111 Ų11141%0.40953%0.529SS..  trans-67.1133.1177.225.7-32.3000111R221 F224 F225P214-R221 HydrophobicContact CB-CG 4.47Å; P214-F224 HydrophobicContact CB-CD1 4.03Å; P214-F224 HydrophobicContact CB-CE1 4.01Å; P214-F225 HydrophobicContact CB-CE2 4.42Å; P214-F225 HydrophobicContact CB-CZ 4.05Å
215P91.4Very high91.5Very high33 Ų33110 Ų11021%0.21453%0.525CS..  trans-62.6150.3174.9-23.433.5000113.1L220 R221 F224P215-L220 HydrophobicContact CB-CB 3.84Å; P215-L220 HydrophobicContact CG-CB 4.07Å; P215-R221 WeakPolarHBondContact O-CB 3.44Å; P215-F224 HydrophobicContact CG-CB 4.46Å
216T89.7Confident91.4Very high142 Ų142107.8 Ų107.887%0.87152%0.522SS*.SBendtrans-69.2-37.8175.9-46.50000112.2A218T216-A218 PolarHBondContact O-N 3.14Å
217D93.3Very high91.4Very high105 Ų105107.8 Ų107.856%0.56152%0.524SS*.SBendtrans-65.4127-178.6-65.5-42.7000112K219 L220 R221D217-K219 VanDerWaalsContact C-N 3.31Å; D217-K219 PolarHBondContact O-N 2.98Å; D217-L220 HydrophobicContact CB-CB 4.21Å; D217-L220 HydrophobicContact CB-CD1 4.21Å; D217-L220 HydrophobicContact CB-CG 4.29Å; D217-L220 PolarHBondContact O-N 3.36Å; D217-L220 VanDerWaalsContact O-N 3.12Å; D217-R221 VanDerWaalsContact O-CB 3.28Å; D217-R221 WeakPolarHBondContact O-CB 3.47Å; D217-R221 PolarHBondContact O-N 3.46Å
218A92.9Very high91.5Very high75 Ų75102.9 Ų102.962%0.6251%0.508SS*.Hα-helixtrans-55.6-41.2-175.100000113.8T216 K222T216-A218 PolarHBondContact O-N 3.14Å; A218-K222 PolarHBondContact O-N 2.81Å
219K93.3Very high91.6Very high183 Ų183105.2 Ų105.280%0.79651%0.513SS*.Hα-helixtrans-67.5-42.2179.2-68.2-177.7-178.71770112.4D217 K223D217-K219 VanDerWaalsContact C-N 3.31Å; D217-K219 PolarHBondContact O-N 2.98Å; K219-K223 PolarHBondContact O-N 3.32Å
220L89.6Confident91.8Very high84 Ų84106.4 Ų106.444%0.4452%0.524SS..Hα-helixtrans-73.7-35.6179.1-67.2177.7000111.2P215 D217 K223 F224P215-L220 HydrophobicContact CB-CB 3.84Å; P215-L220 HydrophobicContact CG-CB 4.07Å; D217-L220 HydrophobicContact CB-CB 4.21Å; D217-L220 HydrophobicContact CB-CD1 4.21Å; D217-L220 HydrophobicContact CB-CG 4.29Å; D217-L220 PolarHBondContact O-N 3.36Å; D217-L220 VanDerWaalsContact O-N 3.12Å; L220-K223 PolarHBondContact O-N 3.03Å; L220-F224 WeakPolarHBondContact O-CB 3.47Å; L220-F224 PolarHBondContact O-N 3.11Å
221R92Very high91.9Very high131 Ų131103.5 Ų103.549%0.49452%0.517SS..Hα-helixtrans-60.6-43.2173.3-164.9175.379.7172.13.6112P214 P215 D217 F224 F225P214-R221 HydrophobicContact CB-CG 4.47Å; P215-R221 WeakPolarHBondContact O-CB 3.44Å; D217-R221 VanDerWaalsContact O-CB 3.28Å; D217-R221 WeakPolarHBondContact O-CB 3.47Å; D217-R221 PolarHBondContact O-N 3.46Å; R221-F224 WeakPolarHBondContact O-CB 3.23Å; R221-F224 PolarHBondContact O-N 3.07Å; R221-F225 HydrophobicContact CG-CD2 3.81Å; R221-F225 HydrophobicContact CG-CE2 3.48Å; R221-F225 VanDerWaalsContact CG-CE2 3.48Å; R221-F225 VanDerWaalsContact O-CD2 3.25Å; R221-F225 WeakPolarHBondContact O-CD2 3.11Å; R221-F225 PolarHBondContact O-N 3.46Å
222K92.9Very high92.2Very high157 Ų157102.6 Ų102.668%0.68352%0.515SS*.Hα-helixtrans-57.2-50.4174.1-174.6179.7177.8-1790111.3A218 F224 F225 E226A218-K222 PolarHBondContact O-N 2.81Å; K222-F224 VanDerWaalsContact C-N 3.32Å; K222-F224 PolarHBondContact O-N 2.9Å; K222-F225 PolarHBondContact O-N 3.05Å; K222-E226 WeakPolarHBondContact O-CB 3.42Å; K222-E226 PolarHBondContact O-N 2.89Å
223K91.5Very high92.5Very high143 Ų143100.2 Ų100.262%0.62250%0.502SS*.Hα-helixtrans-62.3-36.5178.1-70.2-175.1176.7-173.80113.1K219 L220 K227K219-K223 PolarHBondContact O-N 3.32Å; L220-K223 PolarHBondContact O-N 3.03Å; K223-K227 PolarHBondContact O-N 3.4Å; K223-K227 VanDerWaalsContact O-N 3.07Å
224F93.4Very high92.6Very high30 Ų30102.5 Ų102.513%0.13251%0.507CS..Hα-helixtrans-61.7-51.5176.1175.6-88.7000111.1R210 E211 P214 P215 L220 R221 K222 K227 K228R210-F224 WeakPolarHBondContact O-CE2 3.3Å; E211-F224 WeakPolarHBondContact O-CE2 3.44Å; P214-F224 HydrophobicContact CB-CD1 4.03Å; P214-F224 HydrophobicContact CB-CE1 4.01Å; P215-F224 HydrophobicContact CG-CB 4.46Å; L220-F224 WeakPolarHBondContact O-CB 3.47Å; L220-F224 PolarHBondContact O-N 3.11Å; R221-F224 WeakPolarHBondContact O-CB 3.23Å; R221-F224 PolarHBondContact O-N 3.07Å; K222-F224 VanDerWaalsContact C-N 3.32Å; K222-F224 PolarHBondContact O-N 2.9Å; F224-K227 PolarHBondContact O-N 2.9Å; F224-K228 HydrophobicContact CD1-CG 4.45Å; F224-K228 HydrophobicContact CE1-CG 4.06Å; F224-K228 HydrophobicContact CZ-CG 4.21Å; F224-K228 WeakPolarHBondContact O-CG 3.5Å; F224-K228 PolarHBondContact O-N 3.39Å
225F93.6Very high92.7Very high112 Ų112107.7 Ų107.749%0.49152%0.518SS..Hα-helixtrans-68.3-36.4179.5-73.2-57.5000112.8P214 R221 K222 K228 F229P214-F225 HydrophobicContact CB-CE2 4.42Å; P214-F225 HydrophobicContact CB-CZ 4.05Å; R221-F225 HydrophobicContact CG-CD2 3.81Å; R221-F225 HydrophobicContact CG-CE2 3.48Å; R221-F225 VanDerWaalsContact CG-CE2 3.48Å; R221-F225 VanDerWaalsContact O-CD2 3.25Å; R221-F225 WeakPolarHBondContact O-CD2 3.11Å; R221-F225 PolarHBondContact O-N 3.46Å; K222-F225 PolarHBondContact O-N 3.05Å; F225-K228 PolarHBondContact O-N 2.99Å; F225-F229 WeakPolarHBondContact O-CB 3.27Å; F225-F229 PolarHBondContact O-N 2.97Å
226E94.3Very high92.6Very high118 Ų118109.6 Ų109.655%0.55153%0.526SS*.Hα-helixtrans-56.2-52.1172.8-177.9-179.5178.200111K222 K228 F229 T230K222-E226 WeakPolarHBondContact O-CB 3.42Å; K222-E226 PolarHBondContact O-N 2.89Å; E226-K228 VanDerWaalsContact C-N 3.32Å; E226-K228 PolarHBondContact O-N 2.82Å; E226-F229 PolarHBondContact O-N 3.4Å; E226-T230 PolarHBondContact O-N 2.92Å; E226-T230 PolarHBondContact O-OG1 3.37Å; E226-T230 VanDerWaalsContact O-OG1 3.04Å
227K92.7Very high92.5Very high140 Ų140108.7 Ų108.761%0.60952%0.515SS*.Hα-helixtrans-59.4-42.6176.9-172.9-178.4178.4-172.80112.1K223 F224 T230 E231K223-K227 PolarHBondContact O-N 3.4Å; K223-K227 VanDerWaalsContact O-N 3.07Å; F224-K227 PolarHBondContact O-N 2.9Å; K227-T230 PolarHBondContact O-N 3.04Å; K227-E231 WeakPolarHBondContact O-CB 3.33Å; K227-E231 PolarHBondContact O-N 3.14Å
228K93.6Very high92Very high67 Ų67107.9 Ų107.929%0.29152%0.517SS..Hα-helixtrans-66-38.5178.2-76.5-71.3168.7-159.40112.4E211 F224 F225 E226 E231 I232E211-K228 WeakPolarHBondContact O-CE 3.4Å; F224-K228 HydrophobicContact CD1-CG 4.45Å; F224-K228 HydrophobicContact CE1-CG 4.06Å; F224-K228 HydrophobicContact CZ-CG 4.21Å; F224-K228 WeakPolarHBondContact O-CG 3.5Å; F224-K228 PolarHBondContact O-N 3.39Å; F225-K228 PolarHBondContact O-N 2.99Å; E226-K228 VanDerWaalsContact C-N 3.32Å; E226-K228 PolarHBondContact O-N 2.82Å; K228-E231 IonicContact NZ-OE1 2.65Å; K228-E231 IonicContact NZ-OE2 3.29Å; K228-E231 PolarHBondContact NZ-OE2 2.88Å; K228-E231 PolarHBondContact O-N 3.31Å; K228-I232 VanDerWaalsContact O-CG1 3.31Å; K228-I232 WeakPolarHBondContact O-CG1 3.24Å; K228-I232 PolarHBondContact O-N 2.87Å
229F94.8Very high91.5Very high143 Ų143108.5 Ų108.563%0.62752%0.516SS*.Hα-helixtrans-64.8-45.1174.9-174-97.5000110.9F225 E226 E231 I232 S233F225-F229 WeakPolarHBondContact O-CB 3.27Å; F225-F229 PolarHBondContact O-N 2.97Å; E226-F229 PolarHBondContact O-N 3.4Å; F229-E231 VanDerWaalsContact C-N 3.33Å; F229-E231 PolarHBondContact O-N 3.14Å; F229-I232 PolarHBondContact O-N 3.25Å; F229-S233 WeakPolarHBondContact CE1-OG 3.49Å; F229-S233 WeakPolarHBondContact O-CB 3.43Å; F229-S233 PolarHBondContact O-N 3.31Å; F229-S233 PolarHBondContact O-OG 3.41Å; F229-S233 VanDerWaalsContact O-OG 3.05Å
230T94.6Very high90.9Very high86 Ų86107 Ų10753%0.52851%0.507SS..Hα-helixtrans-59.5-42.2174.5-51.40000112.1E226 K227 S233 H234E226-T230 PolarHBondContact O-N 2.92Å; E226-T230 PolarHBondContact O-OG1 3.37Å; E226-T230 VanDerWaalsContact O-OG1 3.04Å; K227-T230 PolarHBondContact O-N 3.04Å; T230-S233 PolarHBondContact O-N 3.41Å; T230-H234 VanDerWaalsContact O-CB 3.26Å; T230-H234 WeakPolarHBondContact O-CB 3.45Å; T230-H234 PolarHBondContact O-N 3.42Å
231E93.1Very high89.9Confident105 Ų105109.5 Ų109.549%0.49152%0.521SS..Hα-helixtrans-60.7-45.7176.6-173.2-174.5165.500111.7K227 K228 F229 R235K227-E231 WeakPolarHBondContact O-CB 3.33Å; K227-E231 PolarHBondContact O-N 3.14Å; K228-E231 IonicContact NZ-OE1 2.65Å; K228-E231 IonicContact NZ-OE2 3.29Å; K228-E231 PolarHBondContact NZ-OE2 2.88Å; K228-E231 PolarHBondContact O-N 3.31Å; F229-E231 VanDerWaalsContact C-N 3.33Å; F229-E231 PolarHBondContact O-N 3.14Å; E231-R235 WeakPolarHBondContact O-CB 3.41Å; E231-R235 PolarHBondContact O-N 3.35Å
232I93.3Very high88.9Confident76 Ų76108.2 Ų108.239%0.3953%0.527SS..Hα-helixtrans-65.1-48.1177.2-68165.5000110.7K228 F229 H234 R235 I236K228-I232 VanDerWaalsContact O-CG1 3.31Å; K228-I232 WeakPolarHBondContact O-CG1 3.24Å; K228-I232 PolarHBondContact O-N 2.87Å; F229-I232 PolarHBondContact O-N 3.25Å; I232-H234 VanDerWaalsContact C-N 3.33Å; I232-H234 PolarHBondContact O-N 3.24Å; I232-R235 PolarHBondContact O-N 2.87Å; I232-I236 HydrophobicContact CG2-CD1 3.69Å; I232-I236 HydrophobicContact CG2-CG1 4.34Å; I232-I236 WeakPolarHBondContact O-CB 3.09Å; I232-I236 VanDerWaalsContact O-CG1 3.28Å; I232-I236 WeakPolarHBondContact O-CG1 3.43Å; I232-I236 PolarHBondContact O-N 3.48Å
233S93.8Very high88Confident37 Ų37104 Ų10426%0.25951%0.513SS..Hα-helixtrans-59.6-44.1178.3-65.60000111.4F229 T230 I236 L237F229-S233 WeakPolarHBondContact CE1-OG 3.49Å; F229-S233 WeakPolarHBondContact O-CB 3.43Å; F229-S233 PolarHBondContact O-N 3.31Å; F229-S233 PolarHBondContact O-OG 3.41Å; F229-S233 VanDerWaalsContact O-OG 3.05Å; T230-S233 PolarHBondContact O-N 3.41Å; S233-I236 PolarHBondContact O-N 3.23Å; S233-L237 WeakPolarHBondContact O-CB 3.48Å; S233-L237 VanDerWaalsContact O-CG 3.26Å; S233-L237 WeakPolarHBondContact O-CG 3.33Å; S233-L237 PolarHBondContact O-N 3.3Å
234H90.8Very high87.5Confident122 Ų122101.4 Ų101.457%0.56550%0.504SS*.Hα-helixtrans-62.8-44.1175.3-172.7-78.9000111.5T230 I232 I236 L237 C238T230-H234 VanDerWaalsContact O-CB 3.26Å; T230-H234 WeakPolarHBondContact O-CB 3.45Å; T230-H234 PolarHBondContact O-N 3.42Å; I232-H234 VanDerWaalsContact C-N 3.33Å; I232-H234 PolarHBondContact O-N 3.24Å; H234-I236 VanDerWaalsContact C-N 3.3Å; H234-I236 PolarHBondContact O-N 3.36Å; H234-L237 PolarHBondContact O-N 2.92Å; H234-C238 PolarHBondContact CE1-SG 2.84Å; H234-C238 PolarHBondContact ND1-SG 3.21Å; H234-C238 VanDerWaalsContact ND1-SG 3.42Å; H234-C238 WeakPolarHBondContact O-CB 3.26Å; H234-C238 PolarHBondContact O-N 2.91Å; H234-C238 PolarHBondContact O-SG 3.46Å
235R92Very high87.1Confident172 Ų172106.7 Ų106.765%0.64953%0.529SS*.Hα-helixtrans-60.7-40.8176.1-171.9-179.270.3-170.42.6111.9E231 I232 S239E231-R235 WeakPolarHBondContact O-CB 3.41Å; E231-R235 PolarHBondContact O-N 3.35Å; I232-R235 PolarHBondContact O-N 2.87Å; R235-S239 WeakPolarHBondContact O-CB 3.39Å; R235-S239 PolarHBondContact O-N 3.43Å
236I90.5Very high86.8Confident74 Ų74106.8 Ų106.838%0.37953%0.532SS..Hα-helixtrans-63.5-50.3175.7-72.1170.1000109.8I232 S233 H234 C238 S239 Y240I232-I236 HydrophobicContact CG2-CD1 3.69Å; I232-I236 HydrophobicContact CG2-CG1 4.34Å; I232-I236 WeakPolarHBondContact O-CB 3.09Å; I232-I236 VanDerWaalsContact O-CG1 3.28Å; I232-I236 WeakPolarHBondContact O-CG1 3.43Å; I232-I236 PolarHBondContact O-N 3.48Å; S233-I236 PolarHBondContact O-N 3.23Å; H234-I236 VanDerWaalsContact C-N 3.3Å; H234-I236 PolarHBondContact O-N 3.36Å; I236-C238 VanDerWaalsContact C-N 3.32Å; I236-C238 PolarHBondContact O-N 3.32Å; I236-S239 WeakPolarHBondContact CA-OG 3.41Å; I236-S239 WeakPolarHBondContact O-CB 3.41Å; I236-S239 PolarHBondContact O-N 3.01Å; I236-S239 PolarHBondContact O-OG 3.13Å; I236-Y240 HydrophobicContact CG2-CD2 3.93Å; I236-Y240 HydrophobicContact CG2-CE2 3.37Å; I236-Y240 WeakPolarHBondContact O-CD2 3.44Å; I236-Y240 PolarHBondContact O-N 2.9Å; I236-Y240 VanDerWaalsContact O-N 3.13Å
237L86.4Confident86.5Confident122 Ų122106.2 Ų106.264%0.63953%0.532SS*.Hα-helixtrans-57.6-43.2177.3-71.2172.3000112.1S233 H234 S239 Y240S233-L237 WeakPolarHBondContact O-CB 3.48Å; S233-L237 VanDerWaalsContact O-CG 3.26Å; S233-L237 WeakPolarHBondContact O-CG 3.33Å; S233-L237 PolarHBondContact O-N 3.3Å; H234-L237 PolarHBondContact O-N 2.92Å; L237-S239 VanDerWaalsContact C-N 3.28Å; L237-S239 PolarHBondContact O-N 3.48Å; L237-Y240 PolarHBondContact O-N 3.45Å
238C82.2Confident86.5Confident88 Ų88104.8 Ų104.860%0.59553%0.526SS*.Hα-helixtrans-69.5-23.3175.7-670000113.8H234 I236H234-C238 PolarHBondContact CE1-SG 2.84Å; H234-C238 PolarHBondContact ND1-SG 3.21Å; H234-C238 VanDerWaalsContact ND1-SG 3.42Å; H234-C238 WeakPolarHBondContact O-CB 3.26Å; H234-C238 PolarHBondContact O-N 2.91Å; H234-C238 PolarHBondContact O-SG 3.46Å; I236-C238 VanDerWaalsContact C-N 3.32Å; I236-C238 PolarHBondContact O-N 3.32Å
239S84.1Confident86.5Confident88 Ų88103.2 Ų103.262%0.61553%0.525SS*.Hα-helixtrans-78.9-22.2174.871.60000112.7R235 I236 L237 N241R235-S239 WeakPolarHBondContact O-CB 3.39Å; R235-S239 PolarHBondContact O-N 3.43Å; I236-S239 WeakPolarHBondContact CA-OG 3.41Å; I236-S239 WeakPolarHBondContact O-CB 3.41Å; I236-S239 PolarHBondContact O-N 3.01Å; I236-S239 PolarHBondContact O-OG 3.13Å; L237-S239 VanDerWaalsContact C-N 3.28Å; L237-S239 PolarHBondContact O-N 3.48Å; S239-N241 PolarHBondContact O-N 2.88Å
240Y80Confident86.4Confident153 Ų153100.8 Ų100.860%0.652%0.516SS*.SBendtrans-73.8116.8170.2-73.9-72.7000109.2I236 L237 T242I236-Y240 HydrophobicContact CG2-CD2 3.93Å; I236-Y240 HydrophobicContact CG2-CE2 3.37Å; I236-Y240 WeakPolarHBondContact O-CD2 3.44Å; I236-Y240 PolarHBondContact O-N 2.9Å; I236-Y240 VanDerWaalsContact O-N 3.13Å; L237-Y240 PolarHBondContact O-N 3.45Å; Y240-T242 VanDerWaalsContact C-N 3.31Å; Y240-T242 PolarHBondContact O-N 3.29Å
241N69.1Low86.4Confident136 Ų136100.3 Ų100.373%0.72751%0.51SS*.  trans-78.383.3172.5-169.421.7000109.4S239 N243S239-N241 PolarHBondContact O-N 2.88Å; N241-N243 PolarHBondContact O-N 3.34Å; N241-N243 VanDerWaalsContact O-N 3.16Å
242T70.7Confident86.5Confident103 Ų103100.2 Ų100.263%0.63251%0.512SS*.  trans-83.871.9165.457.10000107.8Y240 I244Y240-T242 VanDerWaalsContact C-N 3.31Å; Y240-T242 PolarHBondContact O-N 3.29Å; T242-I244 PolarHBondContact O-N 2.85Å
243N73.1Confident86.6Confident70 Ų70102.2 Ų102.237%0.37452%0.515SS..  trans-74.760.7177.4-150.43.6000110.1N241 E245 E246 L247N241-N243 PolarHBondContact O-N 3.34Å; N241-N243 VanDerWaalsContact O-N 3.16Å; N243-E245 PolarHBondContact O-N 2.95Å; N243-E246 HydrophobicContact CB-CB 4Å; N243-E246 VanDerWaalsContact CG-CB 3.48Å; N243-E246 WeakPolarHBondContact ND2-CB 3.37Å; N243-E246 PolarHBondContact ND2-OE2 2.55Å; N243-E246 WeakPolarHBondContact O-CB 3.33Å; N243-E246 PolarHBondContact O-N 3.3Å; N243-L247 PolarHBondContact O-N 3.03Å
244I80.8Confident86.6Confident87 Ų87103.1 Ų103.145%0.44652%0.521SS..Hα-helixtrans-61.7-33.1-179.7-63.7168000109.3T242 E246 L247 F248T242-I244 PolarHBondContact O-N 2.85Å; I244-E246 VanDerWaalsContact C-N 3.33Å; I244-E246 PolarHBondContact O-N 2.85Å; I244-L247 WeakPolarHBondContact O-CB 3.37Å; I244-L247 PolarHBondContact O-N 3.01Å; I244-F248 HydrophobicContact CG2-CD2 3.65Å; I244-F248 HydrophobicContact CG2-CE1 4.49Å; I244-F248 HydrophobicContact CG2-CE2 3.2Å; I244-F248 HydrophobicContact CG2-CG 4.47Å; I244-F248 HydrophobicContact CG2-CZ 3.67Å; I244-F248 WeakPolarHBondContact O-CD2 3.46Å; I244-F248 WeakPolarHBondContact O-CG 3.41Å; I244-F248 PolarHBondContact O-N 3.01Å
245E85.1Confident86.8Confident141 Ų141101 Ų10166%0.65951%0.513SS*.Hα-helixtrans-61.4-38.6173.5-63.1-60.2155.100112.5N243 F248 A249N243-E245 PolarHBondContact O-N 2.95Å; E245-F248 PolarHBondContact O-N 3.34Å; E245-A249 VanDerWaalsContact O-CB 3.22Å; E245-A249 WeakPolarHBondContact O-CB 3.49Å; E245-A249 PolarHBondContact O-N 2.86Å
246E88.1Confident86.8Confident115 Ų11595.6 Ų95.654%0.53751%0.505SS..Hα-helixtrans-68.6-39175.8-179.7175.1-163.400111.8N243 I244 A249 E250N243-E246 HydrophobicContact CB-CB 4Å; N243-E246 VanDerWaalsContact CG-CB 3.48Å; N243-E246 WeakPolarHBondContact ND2-CB 3.37Å; N243-E246 PolarHBondContact ND2-OE2 2.55Å; N243-E246 WeakPolarHBondContact O-CB 3.33Å; N243-E246 PolarHBondContact O-N 3.3Å; I244-E246 VanDerWaalsContact C-N 3.33Å; I244-E246 PolarHBondContact O-N 2.85Å; E246-A249 PolarHBondContact O-N 3.46Å; E246-E250 WeakPolarHBondContact O-CB 3.31Å; E246-E250 PolarHBondContact O-N 2.89Å
247L88Confident86.9Confident106 Ų10697 Ų9756%0.55551%0.512SS*.Hα-helixtrans-63.3-45.9173.5177.865.8000111.5N243 I244 E250 I251N243-L247 PolarHBondContact O-N 3.03Å; I244-L247 WeakPolarHBondContact O-CB 3.37Å; I244-L247 PolarHBondContact O-N 3.01Å; L247-E250 PolarHBondContact O-N 3.21Å; L247-I251 HydrophobicContact CD1-CD1 4.42Å; L247-I251 HydrophobicContact CG-CD1 4.18Å; L247-I251 WeakPolarHBondContact O-CG1 3.03Å; L247-I251 PolarHBondContact O-N 3.48Å
248F92.4Very high87.1Confident109 Ų10995.9 Ų95.948%0.47851%0.507SS..Hα-helixtrans-65.6-40.1177-69.9-37.2000111.9I244 E245 E250 I251 D252I244-F248 HydrophobicContact CG2-CD2 3.65Å; I244-F248 HydrophobicContact CG2-CE1 4.49Å; I244-F248 HydrophobicContact CG2-CE2 3.2Å; I244-F248 HydrophobicContact CG2-CG 4.47Å; I244-F248 HydrophobicContact CG2-CZ 3.67Å; I244-F248 WeakPolarHBondContact O-CD2 3.46Å; I244-F248 WeakPolarHBondContact O-CG 3.41Å; I244-F248 PolarHBondContact O-N 3.01Å; E245-F248 PolarHBondContact O-N 3.34Å; F248-E250 VanDerWaalsContact C-N 3.27Å; F248-E250 PolarHBondContact O-N 3.32Å; F248-I251 HydrophobicContact CD1-CD1 4.25Å; F248-I251 PolarHBondContact O-N 3.09Å; F248-D252 PolarHBondContact O-N 3.03Å
249A92.9Very high87.3Confident35 Ų35100.1 Ų100.129%0.28951%0.511SS..Hα-helixtrans-62.1-35.2173.900000112.2E245 E246 R253E245-A249 VanDerWaalsContact O-CB 3.22Å; E245-A249 WeakPolarHBondContact O-CB 3.49Å; E245-A249 PolarHBondContact O-N 2.86Å; E246-A249 PolarHBondContact O-N 3.46Å; A249-R253 WeakPolarHBondContact O-CB 3.49Å; A249-R253 VanDerWaalsContact O-CG 3.26Å; A249-R253 WeakPolarHBondContact O-CG 3.5Å; A249-R253 PolarHBondContact O-N 3.41Å
250E93.3Very high87.4Confident91 Ų9198.3 Ų98.343%0.42550%0.498SS..Hα-helixtrans-69.1-40.7174.3-173.159.3-154.700112.3E246 L247 F248 R253 C254E246-E250 WeakPolarHBondContact O-CB 3.31Å; E246-E250 PolarHBondContact O-N 2.89Å; L247-E250 PolarHBondContact O-N 3.21Å; F248-E250 VanDerWaalsContact C-N 3.27Å; F248-E250 PolarHBondContact O-N 3.32Å; E250-R253 PolarHBondContact O-N 3.23Å; E250-R253 IonicContact OE2-CZ 2.66Å; E250-R253 IonicContact OE2-NE 2.88Å; E250-R253 PolarHBondContact OE2-NE 3.32Å; E250-R253 IonicContact OE2-NH2 3.12Å; E250-R253 PolarHBondContact OE2-NH2 2.94Å; E250-C254 WeakPolarHBondContact O-CB 3.35Å; E250-C254 PolarHBondContact O-N 2.9Å; E250-C254 PolarHBondContact O-SG 3.32Å
251I94.8Very high87.7Confident77 Ų7793.7 Ų93.740%0.39549%0.486SS..Hα-helixtrans-62-46.3174.6-68.5166000110.3L247 F248 R253 C254 L255L247-I251 HydrophobicContact CD1-CD1 4.42Å; L247-I251 HydrophobicContact CG-CD1 4.18Å; L247-I251 WeakPolarHBondContact O-CG1 3.03Å; L247-I251 PolarHBondContact O-N 3.48Å; F248-I251 HydrophobicContact CD1-CD1 4.25Å; F248-I251 PolarHBondContact O-N 3.09Å; I251-R253 PolarHBondContact O-N 3.43Å; I251-C254 WeakPolarHBondContact O-CB 3.35Å; I251-C254 PolarHBondContact O-N 3.5Å; I251-L255 HydrophobicContact CG2-CD1 4.13Å; I251-L255 HydrophobicContact CG2-CG 4.48Å; I251-L255 WeakPolarHBondContact O-CG 3.44Å; I251-L255 PolarHBondContact O-N 3.26Å
252D95.3Very high88.2Confident103 Ų10391.9 Ų91.955%0.55148%0.475SS*.Hα-helixtrans-64.1-39.5178.4-74.2-23.1000112F248 L255 A256F248-D252 PolarHBondContact O-N 3.03Å; D252-L255 PolarHBondContact O-N 2.98Å; D252-A256 WeakPolarHBondContact O-CB 3.35Å; D252-A256 PolarHBondContact O-N 3.21Å
253R94.6Very high88.5Confident117 Ų11792 Ų9244%0.44247%0.468SS..Hα-helixtrans-59.1-48.9171.9-80.5-172.7-66.1-90.98.1111.3A249 E250 I251 L255 A256 I257A249-R253 WeakPolarHBondContact O-CB 3.49Å; A249-R253 VanDerWaalsContact O-CG 3.26Å; A249-R253 WeakPolarHBondContact O-CG 3.5Å; A249-R253 PolarHBondContact O-N 3.41Å; E250-R253 PolarHBondContact O-N 3.23Å; E250-R253 IonicContact OE2-CZ 2.66Å; E250-R253 IonicContact OE2-NE 2.88Å; E250-R253 PolarHBondContact OE2-NE 3.32Å; E250-R253 IonicContact OE2-NH2 3.12Å; E250-R253 PolarHBondContact OE2-NH2 2.94Å; I251-R253 PolarHBondContact O-N 3.43Å; R253-L255 VanDerWaalsContact C-N 3.32Å; R253-L255 PolarHBondContact O-N 2.95Å; R253-A256 PolarHBondContact O-N 3.36Å; R253-I257 WeakPolarHBondContact O-CG1 3.29Å; R253-I257 PolarHBondContact O-N 3.35Å
254C94.7Very high88.7Confident56 Ų5694.4 Ų94.438%0.37848%0.478SS..Hα-helixtrans-57.9-44.8176.8-73.70000111.7E250 I251 I257 N258E250-C254 WeakPolarHBondContact O-CB 3.35Å; E250-C254 PolarHBondContact O-N 2.9Å; E250-C254 PolarHBondContact O-SG 3.32Å; I251-C254 WeakPolarHBondContact O-CB 3.35Å; I251-C254 PolarHBondContact O-N 3.5Å; C254-I257 PolarHBondContact O-N 2.93Å; C254-N258 PolarHBondContact O-N 2.93Å; C254-N258 PolarHBondContact O-ND2 3.32Å
255L94Very high88.3Confident77 Ų7795.5 Ų95.540%0.40348%0.479SS..Hα-helixtrans-65.8-39.6178.1-70.9176.3000112.4I251 D252 R253 N258 R259I251-L255 HydrophobicContact CG2-CD1 4.13Å; I251-L255 HydrophobicContact CG2-CG 4.48Å; I251-L255 WeakPolarHBondContact O-CG 3.44Å; I251-L255 PolarHBondContact O-N 3.26Å; D252-L255 PolarHBondContact O-N 2.98Å; R253-L255 VanDerWaalsContact C-N 3.32Å; R253-L255 PolarHBondContact O-N 2.95Å; L255-N258 PolarHBondContact O-N 3.09Å; L255-R259 WeakPolarHBondContact O-CB 3.48Å; L255-R259 VanDerWaalsContact O-CG 3.32Å; L255-R259 WeakPolarHBondContact O-CG 3.18Å; L255-R259 PolarHBondContact O-N 2.92Å
256A92.7Very high87.3Confident59 Ų5992.1 Ų92.149%0.48846%0.464SS..Hα-helixtrans-64.3-41.6176.700000111.9D252 R253 R259 S260D252-A256 WeakPolarHBondContact O-CB 3.35Å; D252-A256 PolarHBondContact O-N 3.21Å; R253-A256 PolarHBondContact O-N 3.36Å; A256-R259 PolarHBondContact O-N 3.22Å; A256-S260 PolarHBondContact O-N 3.11Å; A256-S260 PolarHBondContact O-OG 2.88Å
257I93Very high86.3Confident104 Ų10493.5 Ų93.553%0.53347%0.47SS..Hα-helixtrans-62.4-46.7174.4-66.9165.4000110.5R253 C254 R259 S260 V261R253-I257 WeakPolarHBondContact O-CG1 3.29Å; R253-I257 PolarHBondContact O-N 3.35Å; C254-I257 PolarHBondContact O-N 2.93Å; I257-R259 VanDerWaalsContact C-N 3.31Å; I257-R259 PolarHBondContact O-N 3.19Å; I257-S260 PolarHBondContact O-N 2.91Å; I257-S260 PolarHBondContact O-OG 2.82Å; I257-V261 HydrophobicContact CG2-CG2 4.49Å; I257-V261 WeakPolarHBondContact O-CG2 3.26Å; I257-V261 PolarHBondContact O-N 2.71Å
258N89.9Confident85.2Confident98 Ų9896.5 Ų96.552%0.52448%0.479SS..Hα-helixtrans-60.6-41.9178.4-73.4-33.4000111.8C254 L255 V261 L262C254-N258 PolarHBondContact O-N 2.93Å; C254-N258 PolarHBondContact O-ND2 3.32Å; L255-N258 PolarHBondContact O-N 3.09Å; N258-V261 PolarHBondContact O-N 2.87Å; N258-L262 WeakPolarHBondContact O-CG 3.3Å; N258-L262 PolarHBondContact O-N 2.78Å; N258-L262 VanDerWaalsContact O-N 3.1Å
259R86.3Confident83.6Confident178 Ų17899.8 Ų99.867%0.67249%0.489SS*.Hα-helixtrans-65.1-40.8175.9-73.5174.6-179.1168.62.6112.6L255 A256 I257 L262 Q263L255-R259 WeakPolarHBondContact O-CB 3.48Å; L255-R259 VanDerWaalsContact O-CG 3.32Å; L255-R259 WeakPolarHBondContact O-CG 3.18Å; L255-R259 PolarHBondContact O-N 2.92Å; A256-R259 PolarHBondContact O-N 3.22Å; I257-R259 VanDerWaalsContact C-N 3.31Å; I257-R259 PolarHBondContact O-N 3.19Å; R259-L262 PolarHBondContact O-N 2.91Å; R259-Q263 WeakPolarHBondContact O-CB 3.36Å; R259-Q263 PolarHBondContact O-N 2.64Å
260S87.2Confident82.1Confident49 Ų4999.7 Ų99.734%0.34349%0.492SS..Hα-helixtrans-68.7-36179.371.10000112.2A256 I257 Q263 Q264A256-S260 PolarHBondContact O-N 3.11Å; A256-S260 PolarHBondContact O-OG 2.88Å; I257-S260 PolarHBondContact O-N 2.91Å; I257-S260 PolarHBondContact O-OG 2.82Å; S260-Q263 PolarHBondContact O-N 3.31Å; S260-Q264 WeakPolarHBondContact O-CG 3.41Å; S260-Q264 PolarHBondContact O-N 3.5Å
261V86.1Confident80.8Confident57 Ų57101.5 Ų101.535%0.34550%0.5SS..Hα-helixtrans-60.8-48.7171.7170.80000110.1I257 N258 Q263 Q264 F265I257-V261 HydrophobicContact CG2-CG2 4.49Å; I257-V261 WeakPolarHBondContact O-CG2 3.26Å; I257-V261 PolarHBondContact O-N 2.71Å; N258-V261 PolarHBondContact O-N 2.87Å; V261-Q263 VanDerWaalsContact C-N 3.31Å; V261-Q263 PolarHBondContact O-N 3.16Å; V261-Q264 PolarHBondContact O-N 3.01Å; V261-F265 HydrophobicContact CG1-CD2 3.75Å; V261-F265 HydrophobicContact CG1-CE2 3.54Å; V261-F265 WeakPolarHBondContact O-CD2 3.49Å; V261-F265 PolarHBondContact O-N 2.92Å
262L78.9Confident79.5Confident97 Ų97105.5 Ų105.551%0.50852%0.517SS..Hα-helixtrans-58.8-42.4176.4-69.9171.9000112.1N258 R259 F265 E266N258-L262 WeakPolarHBondContact O-CG 3.3Å; N258-L262 PolarHBondContact O-N 2.78Å; N258-L262 VanDerWaalsContact O-N 3.1Å; R259-L262 PolarHBondContact O-N 2.91Å; L262-F265 WeakPolarHBondContact O-CB 3.5Å; L262-F265 PolarHBondContact O-N 3.49Å; L262-E266 PolarHBondContact O-N 2.99Å
263Q76.4Confident78.6Confident105 Ų105102.2 Ų102.249%0.49150%0.499SS..Hα-helixtrans-65.3-38.7176.1-171.1178.10.700112.5R259 S260 V261 F265 E266 E267R259-Q263 WeakPolarHBondContact O-CB 3.36Å; R259-Q263 PolarHBondContact O-N 2.64Å; S260-Q263 PolarHBondContact O-N 3.31Å; V261-Q263 VanDerWaalsContact C-N 3.31Å; V261-Q263 PolarHBondContact O-N 3.16Å; Q263-F265 VanDerWaalsContact C-N 3.3Å; Q263-F265 PolarHBondContact O-N 2.93Å; Q263-E266 CarbonylContact O-C 3.54Å; Q263-E266 WeakPolarHBondContact O-CA 3.2Å; Q263-E266 WeakPolarHBondContact O-CB 3.45Å; Q263-E266 PolarHBondContact O-N 2.94Å; Q263-E266 VanDerWaalsContact O-N 3.09Å; Q263-E267 WeakPolarHBondContact O-CG 3.3Å; Q263-E267 PolarHBondContact O-N 3.05Å
264Q78.9Confident77.9Confident122 Ų12299.7 Ų99.757%0.5750%0.497SS*.Hα-helixtrans-64.6-35.6174-75.117611.900112.2S260 V261 E266 K268S260-Q264 WeakPolarHBondContact O-CG 3.41Å; S260-Q264 PolarHBondContact O-N 3.5Å; V261-Q264 PolarHBondContact O-N 3.01Å; Q264-E266 VanDerWaalsContact C-N 3.34Å; Q264-K268 WeakPolarHBondContact O-CB 3.39Å; Q264-K268 PolarHBondContact O-N 3.34Å
265F71.8Confident77.2Confident110 Ų110102.6 Ų102.648%0.48251%0.505SS..Hα-helixtrans-64.9-40.5170.1-82.1-75.2000110.9V261 L262 Q263 K268 Y269V261-F265 HydrophobicContact CG1-CD2 3.75Å; V261-F265 HydrophobicContact CG1-CE2 3.54Å; V261-F265 WeakPolarHBondContact O-CD2 3.49Å; V261-F265 PolarHBondContact O-N 2.92Å; L262-F265 WeakPolarHBondContact O-CB 3.5Å; L262-F265 PolarHBondContact O-N 3.49Å; Q263-F265 VanDerWaalsContact C-N 3.3Å; Q263-F265 PolarHBondContact O-N 2.93Å; F265-K268 PolarHBondContact O-N 3.5Å; F265-Y269 AromaticContact CD1-CD2 3.9Å; F265-Y269 HydrophobicContact CD1-CD2 3.9Å; F265-Y269 AromaticContact CD1-CE2 3.62Å; F265-Y269 HydrophobicContact CD1-CE2 3.62Å; F265-Y269 HydrophobicContact CE1-CE2 4.08Å; F265-Y269 WeakPolarHBondContact O-CB 3.37Å; F265-Y269 VanDerWaalsContact O-CD2 3.31Å; F265-Y269 WeakPolarHBondContact O-CD2 3.36Å; F265-Y269 PolarHBondContact O-N 2.99Å
266E65.1Low76.5Confident70 Ų70105.6 Ų105.633%0.32752%0.517SS..Hα-helixtrans-59.3-47.6174.2-151.3179.3157.200112.2L262 Q263 Q264 K268 Y269 G270 P344 F345L262-E266 PolarHBondContact O-N 2.99Å; Q263-E266 CarbonylContact O-C 3.54Å; Q263-E266 WeakPolarHBondContact O-CA 3.2Å; Q263-E266 WeakPolarHBondContact O-CB 3.45Å; Q263-E266 PolarHBondContact O-N 2.94Å; Q263-E266 VanDerWaalsContact O-N 3.09Å; Q264-E266 VanDerWaalsContact C-N 3.34Å; E266-K268 VanDerWaalsContact C-N 3.34Å; E266-K268 PolarHBondContact O-N 3.12Å; E266-Y269 PolarHBondContact O-N 3.15Å; E266-G270 WeakPolarHBondContact O-CA 3.46Å; E266-G270 PolarHBondContact O-N 3.35Å; E266-P344 VanDerWaalsContact CD-CD 3.42Å; E266-P344 VanDerWaalsContact CG-CD 3.5Å; E266-P344 HydrophobicContact CG-CG 3.41Å; E266-P344 VanDerWaalsContact CG-CG 3.41Å; E266-P344 WeakPolarHBondContact OE1-CD 3.47Å; E266-F345 HydrophobicContact CB-CE2 4.45Å; E266-F345 HydrophobicContact CB-CZ 3.88Å; E266-F345 HydrophobicContact CG-CE2 4.04Å; E266-F345 HydrophobicContact CG-CZ 3.89Å; E266-F345 WeakPolarHBondContact OE2-CE2 3.26Å
267E67.1Low75.9Confident144 Ų144106.1 Ų106.167%0.67351%0.509SS*.Hα-helixtrans-67.1-33.4179-72.4172.4-171.800112.4Q263Q263-E267 WeakPolarHBondContact O-CG 3.3Å; Q263-E267 PolarHBondContact O-N 3.05Å
268K64.3Low75.6Confident169 Ų169101.9 Ų101.974%0.73549%0.486SS*.Hα-helixtrans-77-35.8177.4-102.3-178.5174.41750114.1Q264 F265 E266Q264-K268 WeakPolarHBondContact O-CB 3.39Å; Q264-K268 PolarHBondContact O-N 3.34Å; F265-K268 PolarHBondContact O-N 3.5Å; E266-K268 VanDerWaalsContact C-N 3.34Å; E266-K268 PolarHBondContact O-N 3.12Å
269Y59.2Low75.3Confident177 Ų177103.1 Ų103.169%0.69449%0.489SS*.Hα-helixtrans-113.5-6.5-170.8-65.9-80000113.7F265 E266 H271F265-Y269 AromaticContact CD1-CD2 3.9Å; F265-Y269 HydrophobicContact CD1-CD2 3.9Å; F265-Y269 AromaticContact CD1-CE2 3.62Å; F265-Y269 HydrophobicContact CD1-CE2 3.62Å; F265-Y269 HydrophobicContact CE1-CE2 4.08Å; F265-Y269 WeakPolarHBondContact O-CB 3.37Å; F265-Y269 VanDerWaalsContact O-CD2 3.31Å; F265-Y269 WeakPolarHBondContact O-CD2 3.36Å; F265-Y269 PolarHBondContact O-N 2.99Å; E266-Y269 PolarHBondContact O-N 3.15Å; Y269-H271 PolarHBondContact O-N 3.47Å; Y269-H271 VanDerWaalsContact O-N 3.16Å
270G61.4Low75.2Confident34 Ų34101.4 Ų101.435%0.35149%0.486SS..  trans-79.928172.700000113.8E266 E272E266-G270 WeakPolarHBondContact O-CA 3.46Å; E266-G270 PolarHBondContact O-N 3.35Å; G270-E272 PolarHBondContact O-N 3.35Å
271H65.8Low75.2Confident128 Ų128100.1 Ų100.159%0.59348%0.475SS*.PPolyproline II helixtrans-61.4118173.6-173.860.7000109.5Y269 I273 Q356Y269-H271 PolarHBondContact O-N 3.47Å; Y269-H271 VanDerWaalsContact O-N 3.16Å; H271-I273 PolarHBondContact O-N 2.96Å; H271-Q356 PolarHBondContact O-NE2 3.22Å
272E67.7Low75Confident162 Ų162101.7 Ų101.776%0.75748%0.479SS*.PPolyproline II helixtrans-59.6119.7174.2-69.7-176.616500109.3G270 T274G270-E272 PolarHBondContact O-N 3.35Å; E272-T274 PolarHBondContact O-N 3.24Å
273I75.7Confident75.3Confident33 Ų33100.8 Ų100.817%0.16948%0.477CS..PPolyproline II helixtrans-68.1125.6-177.8-64.2169.9000108.8H271 E277 W278 I281 Q356H271-I273 PolarHBondContact O-N 2.96Å; I273-E277 HydrophobicContact CG2-CB 3.54Å; I273-W278 HydrophobicContact CB-CZ2 4.32Å; I273-W278 HydrophobicContact CD1-CH2 4.44Å; I273-W278 HydrophobicContact CD1-CZ2 4.02Å; I273-W278 HydrophobicContact CG2-CD2 4.02Å; I273-W278 HydrophobicContact CG2-CG 3.91Å; I273-W278 HydrophobicContact CG2-CZ2 4.5Å; I273-W278 PolarHBondContact O-NE1 3.31Å; I273-I281 HydrophobicContact CD1-CD1 4.31Å; I273-I281 HydrophobicContact CG2-CD1 3.96Å; I273-Q356 HydrophobicContact CD1-CB 4.05Å; I273-Q356 HydrophobicContact CD1-CG 4.44Å; I273-Q356 VanDerWaalsContact N-OE1 3.09Å
274T80.5Confident75.6Confident64 Ų64100.2 Ų100.239%0.39348%0.475SS..PPolyproline II helixtrans-69.2156.9179.758.50000111.6E272 E276 E277 W278E272-T274 PolarHBondContact O-N 3.24Å; T274-E276 VanDerWaalsContact C-N 3.26Å; T274-E276 PolarHBondContact O-N 3.27Å; T274-E277 PolarHBondContact N-OE2 3.19Å; T274-E277 WeakPolarHBondContact O-CB 3.36Å; T274-E277 PolarHBondContact O-N 2.97Å; T274-E277 VanDerWaalsContact OG1-CG 3.22Å; T274-E277 WeakPolarHBondContact OG1-CG 3.3Å; T274-E277 PolarHBondContact OG1-OE2 3.41Å; T274-W278 PolarHBondContact O-N 3.34Å
275E78.4Confident75.9Confident117 Ų11794.9 Ų94.955%0.54745%0.451SS..Hα-helixtrans-58.4-37.3179.4-76.5-65.7113.400112.6E277 W278 E279 K358E275-E277 VanDerWaalsContact C-N 3.28Å; E275-E277 PolarHBondContact O-N 3.35Å; E275-W278 WeakPolarHBondContact O-CB 3.14Å; E275-W278 PolarHBondContact O-N 3.19Å; E275-E279 PolarHBondContact O-N 3.05Å; E275-K358 IonicContact OE1-NZ 2.85Å; E275-K358 PolarHBondContact OE1-NZ 3.19Å; E275-K358 IonicContact OE2-NZ 2.65Å; E275-K358 PolarHBondContact OE2-NZ 3.32Å
276E79.4Confident76.3Confident140 Ų14096.4 Ų96.465%0.65446%0.464SS*.Hα-helixtrans-64.1-31.7176-60.9177.9-170.400112.9T274 K280T274-E276 VanDerWaalsContact C-N 3.26Å; T274-E276 PolarHBondContact O-N 3.27Å; E276-K280 WeakPolarHBondContact O-CG 3.4Å; E276-K280 PolarHBondContact O-N 2.98Å
277E81.8Confident77Confident71 Ų71102.5 Ų102.533%0.33248%0.484SS..Hα-helixtrans-76.7-38175.5-71.6168.4148.600111.2I273 T274 E275 E279 K280 I281I273-E277 HydrophobicContact CG2-CB 3.54Å; T274-E277 PolarHBondContact N-OE2 3.19Å; T274-E277 WeakPolarHBondContact O-CB 3.36Å; T274-E277 PolarHBondContact O-N 2.97Å; T274-E277 VanDerWaalsContact OG1-CG 3.22Å; T274-E277 WeakPolarHBondContact OG1-CG 3.3Å; T274-E277 PolarHBondContact OG1-OE2 3.41Å; E275-E277 VanDerWaalsContact C-N 3.28Å; E275-E277 PolarHBondContact O-N 3.35Å; E277-E279 VanDerWaalsContact C-N 3.3Å; E277-E279 PolarHBondContact O-N 3.27Å; E277-K280 WeakPolarHBondContact O-CB 3.39Å; E277-K280 PolarHBondContact O-N 3.44Å; E277-I281 WeakPolarHBondContact O-CD1 3.37Å; E277-I281 WeakPolarHBondContact O-CG1 3.49Å; E277-I281 PolarHBondContact O-N 3.01Å
278W86.3Confident77.5Confident15 Ų15100.9 Ų100.96%0.05747%0.471CS..Hα-helixtrans-59.9-39.5172.6-81.9114.3000112.6I273 T274 E275 I281 Q282 L319 Q356 K358I273-W278 HydrophobicContact CB-CZ2 4.32Å; I273-W278 HydrophobicContact CD1-CH2 4.44Å; I273-W278 HydrophobicContact CD1-CZ2 4.02Å; I273-W278 HydrophobicContact CG2-CD2 4.02Å; I273-W278 HydrophobicContact CG2-CG 3.91Å; I273-W278 HydrophobicContact CG2-CZ2 4.5Å; I273-W278 PolarHBondContact O-NE1 3.31Å; T274-W278 PolarHBondContact O-N 3.34Å; E275-W278 WeakPolarHBondContact O-CB 3.14Å; E275-W278 PolarHBondContact O-N 3.19Å; W278-I281 HydrophobicContact CE3-CB 4.49Å; W278-I281 HydrophobicContact CE3-CD1 4.31Å; W278-I281 HydrophobicContact CE3-CG2 4.38Å; W278-I281 HydrophobicContact CZ3-CG2 4.4Å; W278-I281 PolarHBondContact O-N 2.88Å; W278-Q282 WeakPolarHBondContact O-CB 3.43Å; W278-Q282 PolarHBondContact O-N 2.79Å; W278-L319 HydrophobicContact CE3-CD2 4.05Å; W278-L319 HydrophobicContact CE3-CG 4.39Å; W278-L319 HydrophobicContact CZ3-CD2 4.2Å; W278-L319 HydrophobicContact CZ3-CG 4.03Å; W278-Q356 HydrophobicContact CH2-CB 4.41Å; W278-Q356 WeakPolarHBondContact CH2-O 3.41Å; W278-Q356 HydrophobicContact CZ2-CB 4.04Å; W278-K358 HydrophobicContact CB-CD 4Å; W278-K358 HydrophobicContact CD2-CB 3.96Å; W278-K358 HydrophobicContact CD2-CD 3.73Å; W278-K358 HydrophobicContact CD2-CG 4.49Å; W278-K358 HydrophobicContact CE3-CB 3.82Å; W278-K358 HydrophobicContact CE3-CD 4.06Å; W278-K358 HydrophobicContact CG-CD 3.7Å; W278-K358 HydrophobicContact CH2-CB 3.8Å; W278-K358 HydrophobicContact CZ2-CB 3.95Å; W278-K358 HydrophobicContact CZ3-CB 3.74Å
279E82.9Confident77.6Confident123 Ų12399.7 Ų99.758%0.57547%0.468SS*.Hα-helixtrans-61.2-43.9174.1-71.9178.6179.400111.8E275 E277 I281 Q282 V283E275-E279 PolarHBondContact O-N 3.05Å; E277-E279 VanDerWaalsContact C-N 3.3Å; E277-E279 PolarHBondContact O-N 3.27Å; E279-I281 PolarHBondContact O-N 2.79Å; E279-Q282 PolarHBondContact O-N 2.85Å; E279-V283 WeakPolarHBondContact O-CG2 3.37Å; E279-V283 PolarHBondContact O-N 2.95Å
280K85.2Confident78.3Confident142 Ų14293.7 Ų93.762%0.61745%0.451SS*.Hα-helixtrans-62.6-42.7175.5-68.6168.5-170.8161.40111.7E276 E277 Q282 V283 Q284E276-K280 WeakPolarHBondContact O-CG 3.4Å; E276-K280 PolarHBondContact O-N 2.98Å; E277-K280 WeakPolarHBondContact O-CB 3.39Å; E277-K280 PolarHBondContact O-N 3.44Å; K280-Q282 VanDerWaalsContact C-N 3.33Å; K280-V283 PolarHBondContact O-N 3.04Å; K280-Q284 WeakPolarHBondContact O-CB 3.23Å; K280-Q284 PolarHBondContact O-N 3.24Å
281I85.3Confident79Confident22 Ų2298.4 Ų98.411%0.11346%0.463CS..Hα-helixtrans-64.6-39178-67162.3000110.5I273 E277 W278 E279 Q284 A285 L319I273-I281 HydrophobicContact CD1-CD1 4.31Å; I273-I281 HydrophobicContact CG2-CD1 3.96Å; E277-I281 WeakPolarHBondContact O-CD1 3.37Å; E277-I281 WeakPolarHBondContact O-CG1 3.49Å; E277-I281 PolarHBondContact O-N 3.01Å; W278-I281 HydrophobicContact CE3-CB 4.49Å; W278-I281 HydrophobicContact CE3-CD1 4.31Å; W278-I281 HydrophobicContact CE3-CG2 4.38Å; W278-I281 HydrophobicContact CZ3-CG2 4.4Å; W278-I281 PolarHBondContact O-N 2.88Å; E279-I281 PolarHBondContact O-N 2.79Å; I281-Q284 PolarHBondContact O-N 3.28Å; I281-A285 WeakPolarHBondContact O-CB 3.41Å; I281-A285 PolarHBondContact O-N 3.22Å; I281-L319 HydrophobicContact CG2-CD1 4.26Å; I281-L319 HydrophobicContact CG2-CD2 4.17Å; I281-L319 HydrophobicContact CG2-CG 4.26Å
282Q83.8Confident79.8Confident91 Ų9198 Ų9843%0.42546%0.462SS..Hα-helixtrans-65.9-43.9177.2-171.3176.714.400111.7W278 E279 K280 Q284 A285 L286 L319W278-Q282 WeakPolarHBondContact O-CB 3.43Å; W278-Q282 PolarHBondContact O-N 2.79Å; E279-Q282 PolarHBondContact O-N 2.85Å; K280-Q282 VanDerWaalsContact C-N 3.33Å; Q282-Q284 VanDerWaalsContact C-N 3.28Å; Q282-Q284 PolarHBondContact O-N 3.38Å; Q282-A285 PolarHBondContact O-N 2.66Å; Q282-L286 PolarHBondContact O-N 2.95Å; Q282-L319 HydrophobicContact CB-CD2 3.91Å; Q282-L319 HydrophobicContact CG-CD2 4.33Å
283V83.6Confident80.7Confident78 Ų7890.3 Ų90.347%0.47343%0.426SS..Hα-helixtrans-61-39.7173.3173.10000110.9E279 K280 L286 R287E279-V283 WeakPolarHBondContact O-CG2 3.37Å; E279-V283 PolarHBondContact O-N 2.95Å; K280-V283 PolarHBondContact O-N 3.04Å; V283-L286 PolarHBondContact O-N 3.47Å; V283-R287 WeakPolarHBondContact O-CG 3.41Å; V283-R287 PolarHBondContact O-N 2.65Å
284Q84.6Confident81.2Confident93 Ų9391.6 Ų91.644%0.43544%0.438SS..Hα-helixtrans-66.9-39.9176.7-172.217611.600112.4K280 I281 Q282 L286 R287 R288K280-Q284 WeakPolarHBondContact O-CB 3.23Å; K280-Q284 PolarHBondContact O-N 3.24Å; I281-Q284 PolarHBondContact O-N 3.28Å; Q282-Q284 VanDerWaalsContact C-N 3.28Å; Q282-Q284 PolarHBondContact O-N 3.38Å; Q284-L286 VanDerWaalsContact C-N 3.32Å; Q284-R287 PolarHBondContact O-N 3.11Å; Q284-R288 PolarHBondContact O-N 3.42Å
285A83.9Confident81.4Confident9 Ų991.5 Ų91.57%0.07443%0.434CS..Hα-helixtrans-63.1-40.2175.700000111.5I281 Q282 R287 R288 L319 S323 V325I281-A285 WeakPolarHBondContact O-CB 3.41Å; I281-A285 PolarHBondContact O-N 3.22Å; Q282-A285 PolarHBondContact O-N 2.66Å; A285-R287 VanDerWaalsContact C-N 3.3Å; A285-R287 PolarHBondContact O-N 3.05Å; A285-R288 PolarHBondContact O-N 3.09Å; A285-R288 VanDerWaalsContact O-N 3.12Å; A285-L319 HydrophobicContact CB-CD1 3.62Å; A285-S323 WeakPolarHBondContact CB-O 3.39Å; A285-V325 HydrophobicContact CB-CG2 4.07Å
286L80.7Confident81.8Confident142 Ų14288.3 Ų88.374%0.74342%0.424SS*.Hα-helixtrans-60.9-39.2175.5-13076.3000112.2Q282 V283 Q284 R288 E289Q282-L286 PolarHBondContact O-N 2.95Å; V283-L286 PolarHBondContact O-N 3.47Å; Q284-L286 VanDerWaalsContact C-N 3.32Å; L286-R288 VanDerWaalsContact C-N 3.27Å; L286-R288 PolarHBondContact O-N 3.29Å; L286-E289 PolarHBondContact O-N 2.96Å
287R78.9Confident82.1Confident199 Ų19987.9 Ų87.975%0.75143%0.426SS*.Hα-helixtrans-68.6-21.9176.4-70177.7-175-171.82.1113.9V283 Q284 A285 E289V283-R287 WeakPolarHBondContact O-CG 3.41Å; V283-R287 PolarHBondContact O-N 2.65Å; Q284-R287 PolarHBondContact O-N 3.11Å; A285-R287 VanDerWaalsContact C-N 3.3Å; A285-R287 PolarHBondContact O-N 3.05Å; R287-E289 VanDerWaalsContact C-N 3.27Å
288R78.4Confident82.2Confident109 Ų10985.7 Ų85.741%0.41142%0.42SS..THydrogen-bonded Turntrans-80.2-8.9178.1-70.1-176.5-174.9-153.94.9112.9Q284 A285 L286 T290 S323 H324Q284-R288 PolarHBondContact O-N 3.42Å; A285-R288 PolarHBondContact O-N 3.09Å; A285-R288 VanDerWaalsContact O-N 3.12Å; L286-R288 VanDerWaalsContact C-N 3.27Å; L286-R288 PolarHBondContact O-N 3.29Å; R288-T290 HydrophobicContact CB-CG2 4.3Å; R288-T290 PolarHBondContact O-N 3.41Å; R288-T290 VanDerWaalsContact O-N 3.11Å; R288-S323 PolarHBondContact NE-OG 3.32Å; R288-S323 VanDerWaalsContact NE-OG 3.09Å; R288-S323 PolarHBondContact NH2-OG 3.03Å; R288-H324 PolarHBondContact NH1-CE1 3.05Å; R288-H324 PolarHBondContact NH1-NE2 3.44Å
289E67.3Low82Confident144 Ų14489.2 Ų89.267%0.67344%0.444SS*.THydrogen-bonded Turntrans50.338.2174.8-63.7-179.2-178.400113.2L286 R287 H291L286-E289 PolarHBondContact O-N 2.96Å; R287-E289 VanDerWaalsContact C-N 3.27Å; E289-H291 PolarHBondContact O-CD2 3.47Å; E289-H291 PolarHBondContact O-N 3.02Å; E289-H291 VanDerWaalsContact O-N 3.15Å; E289-H291 PolarHBondContact O-NE2 2.8Å
290T72.6Confident81.6Confident52 Ų5284.2 Ų84.232%0.31942%0.421SS..  trans-78.4102.4176.254.60000109.5R288R288-T290 HydrophobicContact CB-CG2 4.3Å; R288-T290 PolarHBondContact O-N 3.41Å; R288-T290 VanDerWaalsContact O-N 3.11Å
291H75.5Confident80.6Confident133 Ų13381.1 Ų81.162%0.61642%0.418SS*.  trans-93.4-10.3-178.5-61.7-66.9000113.8E289 P299 L300E289-H291 PolarHBondContact O-CD2 3.47Å; E289-H291 PolarHBondContact O-N 3.02Å; E289-H291 VanDerWaalsContact O-N 3.15Å; E289-H291 PolarHBondContact O-NE2 2.8Å; H291-P299 CarbonylContact O-C 3.55Å; H291-P299 VanDerWaalsContact O-CA 3.29Å; H291-P299 WeakPolarHBondContact O-CA 3.35Å; H291-L300 PolarHBondContact O-N 2.96Å
292E83.9Confident79.2Confident120 Ų12086 Ų8656%0.56145%0.451SS*.BIsolated β-bridgetrans-127.6144.5-175.7-64.9178.8172.700111.8S294 L300E292-S294 PolarHBondContact O-N 2.87Å; E292-L300 WeakPolarHBondContact O-CD1 3.46Å
293C86.6Confident77.1Confident0 Ų086.1 Ų86.10%047%0.467CS..  trans-78.7111.9176179.60000109I295 C296 L297 A298 L300 H327C293-I295 PolarHBondContact O-N 3.14Å; C293-C296 PolarHBondContact O-N 3.38Å; C293-C296 VanDerWaalsContact SG-SG 3.63Å; C293-L297 WeakPolarHBondContact O-CA 3.4Å; C293-L297 PolarHBondContact O-N 3.48Å; C293-A298 WeakPolarHBondContact CB-O 3.33Å; C293-A298 PolarHBondContact N-O 3.02Å; C293-L300 HydrophobicContact CB-CD2 3.61Å; C293-L300 HydrophobicContact CB-CG 4.15Å; C293-H327 WeakPolarHBondContact CB-ND1 3.14Å; C293-H327 PolarHBondContact SG-N 3.35Å
294S84.8Confident75Confident60 Ų6085.6 Ų85.642%0.4248%0.477SS..THydrogen-bonded Turntrans-68-8.7-176-41.40000115E292E292-S294 PolarHBondContact O-N 2.87Å
295I85.8Confident72.9Confident61 Ų6185.2 Ų85.231%0.31350%0.498SS..THydrogen-bonded Turntrans-81-42.9176-59.7169.7000110.9C293 F326 C330 L331 L334 P349C293-I295 PolarHBondContact O-N 3.14Å; I295-F326 HydrophobicContact CD1-CB 4.15Å; I295-F326 HydrophobicContact CD1-CD1 3.67Å; I295-F326 HydrophobicContact CD1-CE1 4.3Å; I295-F326 HydrophobicContact CD1-CG 3.95Å; I295-F326 HydrophobicContact CG1-CD1 3.71Å; I295-F326 HydrophobicContact CG1-CE1 4.04Å; I295-F326 HydrophobicContact CG1-CG 4.49Å; I295-C330 HydrophobicContact CB-CB 4Å; I295-C330 HydrophobicContact CD1-CB 4.06Å; I295-C330 HydrophobicContact CG2-CB 3.87Å; I295-L331 HydrophobicContact CD1-CD1 4.42Å; I295-L334 HydrophobicContact CD1-CD2 4.23Å; I295-P349 HydrophobicContact CD1-CG 4.36Å; I295-P349 HydrophobicContact CG1-CG 4.18Å
296C87Confident70.6Confident51 Ų5193.2 Ų93.235%0.34553%0.534SS..THydrogen-bonded Turntrans-117.7-1-175.168.30000114.1C293 A298 H327C293-C296 PolarHBondContact O-N 3.38Å; C293-C296 VanDerWaalsContact SG-SG 3.63Å; C296-A298 PolarHBondContact O-N 3.42Å; C296-H327 PolarHBondContact SG-ND1 2.99Å
297L84.6Confident68.9Low131 Ų13198.9 Ų98.969%0.68655%0.546SS*.  trans60.119.5-180-49.6175.3000114.3C293C293-L297 WeakPolarHBondContact O-CA 3.4Å; C293-L297 PolarHBondContact O-N 3.48Å
298A84.3Confident66.9Low25 Ų2595 Ų9521%0.20754%0.544CS..  trans-102.1152.8-179.400000111.8C293 C296C293-A298 WeakPolarHBondContact CB-O 3.33Å; C293-A298 PolarHBondContact N-O 3.02Å; C296-A298 PolarHBondContact O-N 3.42Å
299P81.9Confident64.9Low88 Ų8892.9 Ų92.957%0.57156%0.556SS**BIsolated β-bridgetrans-63.1142.8-176.123.8-33.8000113.5H291 H327H291-P299 CarbonylContact O-C 3.55Å; H291-P299 VanDerWaalsContact O-CA 3.29Å; H291-P299 WeakPolarHBondContact O-CA 3.35Å; P299-H327 PolarHBondContact O-CE1 2.91Å; P299-H327 PolarHBondContact O-NE2 2.87Å
300L74.2Confident63.6Low18 Ų1891.5 Ų91.59%0.09457%0.569CS.*SBendtrans-86.6-23.5-176.3-71.9168.3000113.8H291 E292 C293 T317 V325H291-L300 PolarHBondContact O-N 2.96Å; E292-L300 WeakPolarHBondContact O-CD1 3.46Å; C293-L300 HydrophobicContact CB-CD2 3.61Å; C293-L300 HydrophobicContact CB-CG 4.15Å; L300-T317 HydrophobicContact CD2-CG2 4.26Å; L300-T317 VanDerWaalsContact O-CG2 3.29Å; L300-T317 WeakPolarHBondContact O-CG2 3.28Å; L300-V325 HydrophobicContact CD1-CB 4.05Å; L300-V325 HydrophobicContact CD1-CG1 4.09Å; L300-V325 WeakPolarHBondContact CD1-O 3.25Å; L300-V325 HydrophobicContact CD2-CG1 4.29Å
301S66.1Low62.3Low78 Ų7892.4 Ų92.455%0.54559%0.589SS.*  trans-131.6138.3177.4-176.10000111.2A303S301-A303 PolarHBondContact O-N 3.4Å; S301-A303 VanDerWaalsContact O-N 3.14Å
302P55Low61Low125 Ų12594.4 Ų94.481%0.81260%0.599SS**  trans-83.234.6175.835.6-34.3000112.5G304P302-G304 PolarHBondContact O-N 3.31Å
303A39.2Very low59.5Low93 Ų9399.6 Ų99.677%0.76961%0.613SS**  trans-95.980.7-17900000111.3S301S301-A303 PolarHBondContact O-N 3.4Å; S301-A303 VanDerWaalsContact O-N 3.14Å
304G38.9Very low58.2Low66 Ų66103.3 Ų103.368%0.6864%0.639SS**SBendtrans177.894.3171.800000109.5P302 Q306P302-G304 PolarHBondContact O-N 3.31Å; G304-Q306 PolarHBondContact O-N 2.96Å; G304-Q306 VanDerWaalsContact O-N 3.1Å
305G41.3Very low57.5Low85 Ų85107.9 Ų107.988%0.87665%0.647SS**  trans-53.7112-164.100000115.2
306Q35.7Very low57.4Low177 Ų177109.9 Ų109.983%0.82766%0.655SS**  trans-144.8104.3148.6-108.916710.300108.1G304 V308G304-Q306 PolarHBondContact O-N 2.96Å; G304-Q306 VanDerWaalsContact O-N 3.1Å; Q306-V308 PolarHBondContact O-N 2.91Å; Q306-V308 VanDerWaalsContact O-N 3.09Å
307R45.6Very low57.4Low261 Ų261108.6 Ų108.699%0.98565%0.645SS**  trans-63.3105.8166.8-76.4179.2168.8176.4-3.1107.8
308V36.3Very low57.6Low117 Ų117102.3 Ų102.371%0.70961%0.613SS**  trans-136.6117.2162.7-167.80000108.8Q306Q306-V308 PolarHBondContact O-N 2.91Å; Q306-V308 VanDerWaalsContact O-N 3.09Å
309G36.5Very low57.8Low65 Ų65101.2 Ų101.267%0.6760%0.603SS**  trans75.5117.9152.900000117.2G311G309-G311 PolarHBondContact O-N 3.4Å
310A41Very low58.1Low115 Ų11597 Ų9795%0.9558%0.576SS**THydrogen-bonded Turntrans-49.8124.5172.300000112.8
311G43.9Very low58.6Low71 Ų7197.7 Ų97.773%0.73258%0.582SS**THydrogen-bonded Turntrans141.6-14.2162.400000117.8G309 R313G309-G311 PolarHBondContact O-N 3.4Å; G311-R313 PolarHBondContact O-N 3.27Å; G311-R313 VanDerWaalsContact O-N 3.11Å
312Q49.3Very low59.5Low176 Ų17695 Ų9582%0.82256%0.563SS**  trans-81.996.6-177.5-88.6170.8-35.200112.2
313R52.3Low61.1Low229 Ų22989.1 Ų89.186%0.86453%0.525SS*.PPolyproline II helixtrans-57.6139.1164.6-70.6-179.7171.8161.5-2.6109.4G311 R315G311-R313 PolarHBondContact O-N 3.27Å; G311-R313 VanDerWaalsContact O-N 3.11Å; R313-R315 PolarHBondContact O-N 3.05Å
314S58.9Low63.4Low77 Ų7785.6 Ų85.654%0.53849%0.492SS..PPolyproline II helixtrans-50.4123.7166.845.10000108.2E316S314-E316 PolarHBondContact O-N 3.17Å
315R70.9Confident65.7Low157 Ų15783.4 Ų83.459%0.59247%0.466SS*.PPolyproline II helixtrans-82.1117.9173.9-68.7-176.4178.5-174.50.3106.8R313 T317R313-R315 PolarHBondContact O-N 3.05Å; R315-T317 PolarHBondContact O-N 3.46Å
316E82.4Confident68Low103 Ų10379.3 Ų79.348%0.48142%0.424SS..PPolyproline II helixtrans-54.1137.7172.7-69.1167.7-168.500110.1S314 H328 I359S314-E316 PolarHBondContact O-N 3.17Å; E316-H328 HydrophobicContact CB-CB 3.95Å; E316-H328 WeakPolarHBondContact O-CB 3.33Å; E316-H328 PolarHBondContact O-N 3.01Å; E316-H328 IonicContact OE2-CD2 3.53Å; E316-I359 HydrophobicContact CB-CG2 4.46Å
317T87.4Confident70.6Confident23 Ų2371.2 Ų71.214%0.14139%0.386CS..EExtended strand (participates in β ladder)trans-108.2142.6177.259.30000109.7L300 R315 F326 L360L300-T317 HydrophobicContact CD2-CG2 4.26Å; L300-T317 VanDerWaalsContact O-CG2 3.29Å; L300-T317 WeakPolarHBondContact O-CG2 3.28Å; R315-T317 PolarHBondContact O-N 3.46Å; T317-F326 CarbonylContact C-O 3.54Å; T317-F326 WeakPolarHBondContact CA-O 3.31Å; T317-L360 PolarHBondContact O-N 3.29Å
318A88.1Confident72.6Confident0 Ų060.1 Ų60.10%035%0.346CS..EExtended strand (participates in β ladder)trans-111.4124.1176.100000108.7V325 F326 H328 L331A318-V325 WeakPolarHBondContact O-CA 3.2Å; A318-F326 PolarHBondContact N-O 3.14Å; A318-F326 PolarHBondContact O-N 3.34Å; A318-H328 HydrophobicContact CB-CB 4.37Å; A318-L331 HydrophobicContact CB-CD2 3.85Å
319L88.4Confident75Confident2 Ų258 Ų581%0.0134%0.34CS..EExtended strand (participates in β ladder)trans-91.1128.3171.3176.764.8000109.1W278 I281 Q282 A285 V325 K357 K358 L360W278-L319 HydrophobicContact CE3-CD2 4.05Å; W278-L319 HydrophobicContact CE3-CG 4.39Å; W278-L319 HydrophobicContact CZ3-CD2 4.2Å; W278-L319 HydrophobicContact CZ3-CG 4.03Å; I281-L319 HydrophobicContact CG2-CD1 4.26Å; I281-L319 HydrophobicContact CG2-CD2 4.17Å; I281-L319 HydrophobicContact CG2-CG 4.26Å; Q282-L319 HydrophobicContact CB-CD2 3.91Å; Q282-L319 HydrophobicContact CG-CD2 4.33Å; A285-L319 HydrophobicContact CB-CD1 3.62Å; L319-V325 HydrophobicContact CD1-CG2 3.67Å; L319-K357 CarbonylContact O-C 3.57Å; L319-K357 WeakPolarHBondContact O-CA 3.18Å; L319-K358 PolarHBondContact N-O 3.49Å; L319-K358 PolarHBondContact O-N 3.4Å; L319-L360 HydrophobicContact CB-CD1 3.92Å; L319-L360 HydrophobicContact CB-CD2 4.29Å; L319-L360 HydrophobicContact CB-CG 4Å; L319-L360 HydrophobicContact CD2-CD2 4.44Å
320L88.6Confident77.5Confident0 Ų056.1 Ų56.10%032%0.316CS..EExtended strand (participates in β ladder)trans-93.2153.3176.1-53.5-165.9000110.9C322 S323 H324 F326 L331 C348 Y355 Q356 K357L320-C322 PolarHBondContact O-N 3.46Å; L320-C322 VanDerWaalsContact O-N 3.08Å; L320-S323 WeakPolarHBondContact O-CA 3.45Å; L320-S323 PolarHBondContact O-N 2.91Å; L320-H324 WeakPolarHBondContact CB-O 3.08Å; L320-H324 PolarHBondContact N-O 3.06Å; L320-F326 HydrophobicContact CD1-CD2 3.76Å; L320-F326 HydrophobicContact CD1-CE2 3.5Å; L320-F326 VanDerWaalsContact CD1-CE2 3.5Å; L320-F326 HydrophobicContact CG-CD2 4.03Å; L320-F326 HydrophobicContact CG-CE2 4.13Å; L320-L331 HydrophobicContact CD1-CD1 4.25Å; L320-L331 HydrophobicContact CD2-CD1 4.2Å; L320-L331 HydrophobicContact CD2-CD2 3.58Å; L320-C348 HydrophobicContact CD1-CB 4Å; L320-Y355 HydrophobicContact CB-CD2 4.27Å; L320-Y355 HydrophobicContact CB-CG 4.19Å; L320-Y355 HydrophobicContact CD1-CD1 3.78Å; L320-Y355 HydrophobicContact CD1-CD2 3.9Å; L320-Y355 HydrophobicContact CD1-CE1 3.99Å; L320-Y355 HydrophobicContact CD1-CE2 4.11Å; L320-Y355 HydrophobicContact CD1-CG 3.71Å; L320-Y355 HydrophobicContact CD2-CD2 3.4Å; L320-Y355 VanDerWaalsContact CD2-CD2 3.4Å; L320-Y355 HydrophobicContact CD2-CE2 3.53Å; L320-Y355 HydrophobicContact CD2-CG 4.06Å; L320-Y355 HydrophobicContact CG-CD2 4.04Å; L320-Y355 HydrophobicContact CG-CE2 4.41Å; L320-Y355 HydrophobicContact CG-CG 4.2Å; L320-Q356 CarbonylContact C-O 3.6Å; L320-Q356 WeakPolarHBondContact CA-O 3.46Å; L320-K357 HydrophobicContact CD2-CB 3.85Å
321S84.9Confident79.7Confident32 Ų3250.6 Ų50.622%0.22427%0.271CS..THydrogen-bonded Turntrans-57.8-24.3175.962.60000114S323 Y355 Q356S321-S323 PolarHBondContact O-N 2.86Å; S321-Y355 VanDerWaalsContact OG-CA 3.26Å; S321-Y355 WeakPolarHBondContact OG-CA 3.44Å; S321-Q356 PolarHBondContact N-O 2.79Å; S321-Q356 PolarHBondContact OG-N 3.31Å
322C86Confident81.8Confident21 Ų2150.6 Ų50.614%0.14225%0.254CS..THydrogen-bonded Turntrans-80.413.6173.361.20000114.1L320 H324 C351L320-C322 PolarHBondContact O-N 3.46Å; L320-C322 VanDerWaalsContact O-N 3.08Å; C322-H324 VanDerWaalsContact C-N 3.27Å; C322-H324 PolarHBondContact O-N 3.38Å; C322-H324 PolarHBondContact O-ND1 3.47Å; C322-H324 PolarHBondContact SG-ND1 3.08Å; C322-C351 VanDerWaalsContact CB-SG 3.57Å; C322-C351 VanDerWaalsContact SG-SG 3.62Å
323S86.7Confident83.6Confident1 Ų144.2 Ų44.21%0.00723%0.231CC..SBendtrans62.123.1-179.364.70000115.5A285 R288 L320 S321A285-S323 WeakPolarHBondContact CB-O 3.39Å; R288-S323 PolarHBondContact NE-OG 3.32Å; R288-S323 VanDerWaalsContact NE-OG 3.09Å; R288-S323 PolarHBondContact NH2-OG 3.03Å; L320-S323 WeakPolarHBondContact O-CA 3.45Å; L320-S323 PolarHBondContact O-N 2.91Å; S321-S323 PolarHBondContact O-N 2.86Å
324H88Confident85.2Confident19 Ų1936.2 Ų36.29%0.08821%0.205CC..  trans-98.8148.4171.4-64108.5000110.7R288 L320 C322 F326 L350 C351R288-H324 PolarHBondContact NH1-CE1 3.05Å; R288-H324 PolarHBondContact NH1-NE2 3.44Å; L320-H324 WeakPolarHBondContact CB-O 3.08Å; L320-H324 PolarHBondContact N-O 3.06Å; C322-H324 VanDerWaalsContact C-N 3.27Å; C322-H324 PolarHBondContact O-N 3.38Å; C322-H324 PolarHBondContact O-ND1 3.47Å; C322-H324 PolarHBondContact SG-ND1 3.08Å; H324-F326 HydrophobicContact CB-CE2 3.7Å; H324-F326 HydrophobicContact CB-CZ 4.09Å; H324-L350 HydrophobicContact CB-CD1 4.26Å; H324-L350 WeakPolarHBondContact CD2-CD1 3.05Å; H324-C351 VanDerWaalsContact CE1-SG 3.55Å
325V88.3Confident86.5Confident20 Ų2033.7 Ų33.712%0.12119%0.185CC..EExtended strand (participates in β ladder)trans-122.7135-176.1-174.50000110A285 L300 A318 L319A285-V325 HydrophobicContact CB-CG2 4.07Å; L300-V325 HydrophobicContact CD1-CB 4.05Å; L300-V325 HydrophobicContact CD1-CG1 4.09Å; L300-V325 WeakPolarHBondContact CD1-O 3.25Å; L300-V325 HydrophobicContact CD2-CG1 4.29Å; A318-V325 WeakPolarHBondContact O-CA 3.2Å; L319-V325 HydrophobicContact CD1-CG2 3.67Å
326F88.9Confident87Confident0 Ų034 Ų340%019%0.193CC..EExtended strand (participates in β ladder)trans-135.7164.7177.5-59.2-80.1000110.6I295 T317 A318 L320 H324 H328 L331 P349 L350I295-F326 HydrophobicContact CD1-CB 4.15Å; I295-F326 HydrophobicContact CD1-CD1 3.67Å; I295-F326 HydrophobicContact CD1-CE1 4.3Å; I295-F326 HydrophobicContact CD1-CG 3.95Å; I295-F326 HydrophobicContact CG1-CD1 3.71Å; I295-F326 HydrophobicContact CG1-CE1 4.04Å; I295-F326 HydrophobicContact CG1-CG 4.49Å; T317-F326 CarbonylContact C-O 3.54Å; T317-F326 WeakPolarHBondContact CA-O 3.31Å; A318-F326 PolarHBondContact N-O 3.14Å; A318-F326 PolarHBondContact O-N 3.34Å; L320-F326 HydrophobicContact CD1-CD2 3.76Å; L320-F326 HydrophobicContact CD1-CE2 3.5Å; L320-F326 VanDerWaalsContact CD1-CE2 3.5Å; L320-F326 HydrophobicContact CG-CD2 4.03Å; L320-F326 HydrophobicContact CG-CE2 4.13Å; H324-F326 HydrophobicContact CB-CE2 3.7Å; H324-F326 HydrophobicContact CB-CZ 4.09Å; F326-H328 PolarHBondContact O-N 2.82Å; F326-L331 HydrophobicContact CB-CB 4.46Å; F326-L331 HydrophobicContact CB-CD1 4.47Å; F326-L331 HydrophobicContact CD2-CD1 4.04Å; F326-L331 HydrophobicContact CG-CD1 4.4Å; F326-P349 HydrophobicContact CE1-CG 3.75Å; F326-P349 HydrophobicContact CE2-CG 4.11Å; F326-P349 HydrophobicContact CZ-CG 3.49Å; F326-P349 VanDerWaalsContact CZ-CG 3.49Å; F326-L350 HydrophobicContact CE1-CD1 4.14Å; F326-L350 HydrophobicContact CE1-CG 4.31Å; F326-L350 HydrophobicContact CZ-CD1 3.71Å; F326-L350 HydrophobicContact CZ-CG 3.88Å
327H89.4Confident86.8Confident6 Ų637.7 Ų37.73%0.02821%0.208CC..EExtended strand (participates in β ladder)trans-65.5134.8163.3-63.1126.2000109.3C293 C296 P299 A329 C330 L331C293-H327 WeakPolarHBondContact CB-ND1 3.14Å; C293-H327 PolarHBondContact SG-N 3.35Å; C296-H327 PolarHBondContact SG-ND1 2.99Å; P299-H327 PolarHBondContact O-CE1 2.91Å; P299-H327 PolarHBondContact O-NE2 2.87Å; H327-A329 VanDerWaalsContact C-N 3.28Å; H327-A329 PolarHBondContact O-N 3.18Å; H327-C330 HydrophobicContact CB-CB 4.11Å; H327-C330 PolarHBondContact O-N 3.29Å; H327-L331 PolarHBondContact O-N 3.39Å
328H88.2Confident86Confident29 Ų2938.4 Ų38.413%0.13421%0.214CC..Hα-helixtrans-55.5-45-179.2-178.451.9000111.7E316 A318 F326 C330 L331 L332E316-H328 HydrophobicContact CB-CB 3.95Å; E316-H328 WeakPolarHBondContact O-CB 3.33Å; E316-H328 PolarHBondContact O-N 3.01Å; E316-H328 IonicContact OE2-CD2 3.53Å; A318-H328 HydrophobicContact CB-CB 4.37Å; F326-H328 PolarHBondContact O-N 2.82Å; H328-C330 PolarHBondContact O-N 3.4Å; H328-L331 PolarHBondContact O-N 3.45Å; H328-L332 WeakPolarHBondContact NE2-CD1 3.32Å; H328-L332 WeakPolarHBondContact O-CG 3.38Å; H328-L332 PolarHBondContact O-N 3.08Å
329A87.9Confident84.3Confident73 Ų7345.2 Ų45.260%0.60326%0.255SS*.Hα-helixtrans-62.9-36.9177.500000113.7H327 A333H327-A329 VanDerWaalsContact C-N 3.28Å; H327-A329 PolarHBondContact O-N 3.18Å; A329-A333 WeakPolarHBondContact O-CB 3.45Å; A329-A333 PolarHBondContact O-N 3.26Å; A329-A333 VanDerWaalsContact O-N 3.11Å
330C87.8Confident82.7Confident24 Ų2448.5 Ų48.516%0.16229%0.289CS..Hα-helixtrans-70.8-37.6177.9-66.10000111.7I295 H327 H328 L334I295-C330 HydrophobicContact CB-CB 4Å; I295-C330 HydrophobicContact CD1-CB 4.06Å; I295-C330 HydrophobicContact CG2-CB 3.87Å; H327-C330 HydrophobicContact CB-CB 4.11Å; H327-C330 PolarHBondContact O-N 3.29Å; H328-C330 PolarHBondContact O-N 3.4Å; C330-L334 PolarHBondContact O-N 3.47Å
331L88Confident81.2Confident0 Ų052.4 Ų52.40%031%0.31CS..Hα-helixtrans-67.3-45175.9-167.976.4000111.3I295 A318 L320 F326 H327 H328 A333 L334 E335 Y355 K357I295-L331 HydrophobicContact CD1-CD1 4.42Å; A318-L331 HydrophobicContact CB-CD2 3.85Å; L320-L331 HydrophobicContact CD1-CD1 4.25Å; L320-L331 HydrophobicContact CD2-CD1 4.2Å; L320-L331 HydrophobicContact CD2-CD2 3.58Å; F326-L331 HydrophobicContact CB-CB 4.46Å; F326-L331 HydrophobicContact CB-CD1 4.47Å; F326-L331 HydrophobicContact CD2-CD1 4.04Å; F326-L331 HydrophobicContact CG-CD1 4.4Å; H327-L331 PolarHBondContact O-N 3.39Å; H328-L331 PolarHBondContact O-N 3.45Å; L331-A333 PolarHBondContact O-N 3.47Å; L331-L334 WeakPolarHBondContact O-CB 3.23Å; L331-L334 PolarHBondContact O-N 3.42Å; L331-E335 WeakPolarHBondContact O-CG 3.3Å; L331-E335 PolarHBondContact O-N 2.86Å; L331-Y355 HydrophobicContact CD1-CE2 4.33Å; L331-Y355 WeakPolarHBondContact CD1-OH 3.42Å; L331-Y355 HydrophobicContact CD2-CE2 4.08Å; L331-K357 HydrophobicContact CD2-CB 4.33Å; L331-K357 HydrophobicContact CD2-CD 3.81Å
332L87.5Confident79.7Confident71 Ų7160.8 Ų60.837%0.37234%0.337SS..Hα-helixtrans-59.4-44.7176.7-75.7176.7000112.4H328 L334 E335 E336H328-L332 WeakPolarHBondContact NE2-CD1 3.32Å; H328-L332 WeakPolarHBondContact O-CG 3.38Å; H328-L332 PolarHBondContact O-N 3.08Å; L332-L334 VanDerWaalsContact C-N 3.28Å; L332-L334 PolarHBondContact O-N 2.98Å; L332-E335 PolarHBondContact O-N 2.93Å; L332-E336 PolarHBondContact O-N 2.92Å
333A87.2Confident78.1Confident42 Ų4264.4 Ų64.435%0.34736%0.36SS..Hα-helixtrans-59.6-42.4176.600000111.2A329 L331 E336 F337A329-A333 WeakPolarHBondContact O-CB 3.45Å; A329-A333 PolarHBondContact O-N 3.26Å; A329-A333 VanDerWaalsContact O-N 3.11Å; L331-A333 PolarHBondContact O-N 3.47Å; A333-E336 PolarHBondContact O-N 3.32Å; A333-F337 WeakPolarHBondContact O-CD2 3.45Å; A333-F337 PolarHBondContact O-N 3.37Å
334L85.7Confident76.6Confident60 Ų6066.2 Ų66.231%0.31437%0.372SS..Hα-helixtrans-63-42.1177.5-175.268.3000112.1I295 C330 L331 L332 F337 S338 P349I295-L334 HydrophobicContact CD1-CD2 4.23Å; C330-L334 PolarHBondContact O-N 3.47Å; L331-L334 WeakPolarHBondContact O-CB 3.23Å; L331-L334 PolarHBondContact O-N 3.42Å; L332-L334 VanDerWaalsContact C-N 3.28Å; L332-L334 PolarHBondContact O-N 2.98Å; L334-F337 PolarHBondContact O-N 2.87Å; L334-S338 PolarHBondContact O-N 3.01Å; L334-S338 PolarHBondContact O-OG 3.1Å; L334-P349 HydrophobicContact CD2-CB 4.18Å; L334-P349 HydrophobicContact CD2-CG 4.09Å
335E85.6Confident75.4Confident24 Ų2467.9 Ų67.911%0.11238%0.379CS..Hα-helixtrans-62.8-40.3176.3-68.3170.1175.800111.7L331 L332 F337 S338 H346 Y355 K357L331-E335 WeakPolarHBondContact O-CG 3.3Å; L331-E335 PolarHBondContact O-N 2.86Å; L332-E335 PolarHBondContact O-N 2.93Å; E335-F337 VanDerWaalsContact C-N 3.34Å; E335-F337 PolarHBondContact O-N 3.31Å; E335-S338 VanDerWaalsContact O-CB 3.27Å; E335-S338 WeakPolarHBondContact O-CB 3.28Å; E335-S338 PolarHBondContact O-N 3.43Å; E335-H346 HydrophobicContact CG-CB 4.41Å; E335-Y355 PolarHBondContact OE1-OH 2.92Å; E335-K357 IonicContact OE1-NZ 2.82Å; E335-K357 PolarHBondContact OE1-NZ 3.38Å; E335-K357 IonicContact OE2-NZ 2.62Å; E335-K357 PolarHBondContact OE2-NZ 3.25Å
336E82.6Confident74.8Confident165 Ų16568.2 Ų68.277%0.77138%0.379SS*.Hα-helixtrans-65.6-34.2179-170.2175.5-172.200113L332 A333 S338L332-E336 PolarHBondContact O-N 2.92Å; A333-E336 PolarHBondContact O-N 3.32Å; E336-S338 PolarHBondContact O-N 3.46Å
337F77.9Confident74.5Confident179 Ų17970.7 Ų70.779%0.78540%0.4SS*.Hα-helixtrans-71.1-16172.9-79.3-71.4000113.4A333 L334 E335 V339A333-F337 WeakPolarHBondContact O-CD2 3.45Å; A333-F337 PolarHBondContact O-N 3.37Å; L334-F337 PolarHBondContact O-N 2.87Å; E335-F337 VanDerWaalsContact C-N 3.34Å; E335-F337 PolarHBondContact O-N 3.31Å; F337-V339 VanDerWaalsContact C-N 3.31Å; F337-V339 PolarHBondContact O-N 3.33Å
338S70.8Confident74.2Confident39 Ų3970.4 Ų70.427%0.27340%0.399SS..  trans-84.367.9-178.5-48.80000110.8L334 E335 E336 G340L334-S338 PolarHBondContact O-N 3.01Å; L334-S338 PolarHBondContact O-OG 3.1Å; E335-S338 VanDerWaalsContact O-CB 3.27Å; E335-S338 WeakPolarHBondContact O-CB 3.28Å; E335-S338 PolarHBondContact O-N 3.43Å; E336-S338 PolarHBondContact O-N 3.46Å; S338-G340 PolarHBondContact O-N 3.41Å
339V53.1Low74Confident142 Ų14271.9 Ų71.986%0.86141%0.41SS*.THydrogen-bonded Turntrans-68.3104.5-177.2-1780000110.8F337F337-V339 VanDerWaalsContact C-N 3.31Å; F337-V339 PolarHBondContact O-N 3.33Å
340G53.7Low73.8Confident71 Ų7172.3 Ų72.373%0.73240%0.402SS*.THydrogen-bonded Turntrans131.2-21.2172.500000114.6S338 R342S338-G340 PolarHBondContact O-N 3.41Å; G340-R342 PolarHBondContact O-N 3.45Å
341D56.6Low73.5Confident82 Ų8273.5 Ų73.544%0.43941%0.41SS..  trans-88.993.9176.9-63.8-32.6000108.7F345 H346D341-F345 HydrophobicContact CB-CB 4.03Å; D341-H346 PolarHBondContact O-CE1 3.41Å
342R54.6Low73.2Confident208 Ų20883.8 Ų83.879%0.78545%0.449SS*.  trans-67.5146.8166.5-70.2-179.6178.1172.2-0.9108.3G340 F345G340-R342 PolarHBondContact O-N 3.45Å; R342-F345 WeakPolarHBondContact O-CD2 3.3Å; R342-F345 PolarHBondContact O-N 3.25Å
343P52.3Low72.8Confident98 Ų9883.1 Ų83.164%0.63645%0.45SS*.THydrogen-bonded Turntrans-51.2128.4169.921.3-32000108.2
344P55Low72.4Confident39 Ų3985 Ų8525%0.25346%0.46SS..THydrogen-bonded Turncis-104.817.725.339.3-36.2000117E266 H346E266-P344 VanDerWaalsContact CD-CD 3.42Å; E266-P344 VanDerWaalsContact CG-CD 3.5Å; E266-P344 HydrophobicContact CG-CG 3.41Å; E266-P344 VanDerWaalsContact CG-CG 3.41Å; E266-P344 WeakPolarHBondContact OE1-CD 3.47Å; P344-H346 VanDerWaalsContact C-N 3.3Å; P344-H346 PolarHBondContact O-N 3.02Å
345F61.7Low72.1Confident54 Ų5482.8 Ų82.824%0.23745%0.448CS..  trans-84.519.3-170.1-62.5-73.9000116.3E266 D341 R342 A347E266-F345 HydrophobicContact CB-CE2 4.45Å; E266-F345 HydrophobicContact CB-CZ 3.88Å; E266-F345 HydrophobicContact CG-CE2 4.04Å; E266-F345 HydrophobicContact CG-CZ 3.89Å; E266-F345 WeakPolarHBondContact OE2-CE2 3.26Å; D341-F345 HydrophobicContact CB-CB 4.03Å; R342-F345 WeakPolarHBondContact O-CD2 3.3Å; R342-F345 PolarHBondContact O-N 3.25Å; F345-A347 PolarHBondContact O-N 2.93Å
346H76.3Confident71.9Confident27 Ų2784.1 Ų84.113%0.12545%0.454CS..PPolyproline II helixtrans-74.1125.6174.4-60.8-50.4000110.8E335 D341 P344 C354 Y355E335-H346 HydrophobicContact CG-CB 4.41Å; D341-H346 PolarHBondContact O-CE1 3.41Å; P344-H346 VanDerWaalsContact C-N 3.3Å; P344-H346 PolarHBondContact O-N 3.02Å; H346-C354 WeakPolarHBondContact O-CA 3.45Å; H346-Y355 HydrophobicContact CB-CE1 3.76Å; H346-Y355 HydrophobicContact CB-CE2 4.29Å; H346-Y355 WeakPolarHBondContact O-CD1 3.27Å; H346-Y355 WeakPolarHBondContact O-CE1 3.44Å; H346-Y355 PolarHBondContact O-N 3.21Å
347A81.8Confident72.1Confident51 Ų5179.9 Ų79.942%0.42143%0.433SS..BIsolated β-bridgetrans-94.8134.8179.700000111.5F345 Y355F345-A347 PolarHBondContact O-N 2.93Å; A347-Y355 VanDerWaalsContact C-CE1 3.43Å
348C84.9Confident72.5Confident1 Ų174 Ų741%0.00741%0.407CS..PPolyproline II helixtrans-65.7133179.2170.40000110L320 L350 R352 S353 Y355L320-C348 HydrophobicContact CD1-CB 4Å; C348-L350 PolarHBondContact O-N 3.37Å; C348-L350 VanDerWaalsContact O-N 3.14Å; C348-L350 PolarHBondContact SG-N 3.46Å; C348-R352 WeakPolarHBondContact O-CA 3.17Å; C348-R352 PolarHBondContact O-N 2.87Å; C348-S353 PolarHBondContact N-O 2.92Å; C348-Y355 HydrophobicContact CB-CD1 3.87Å; C348-Y355 HydrophobicContact CB-CE1 4.4Å; C348-Y355 VanDerWaalsContact N-CD1 3.34Å
349P83.1Confident73.2Confident59 Ų5975.8 Ų75.838%0.38341%0.412SS..THydrogen-bonded Turntrans-64.1-22.4-177.625.1-34.5000113.5I295 F326 L334I295-P349 HydrophobicContact CD1-CG 4.36Å; I295-P349 HydrophobicContact CG1-CG 4.18Å; F326-P349 HydrophobicContact CE1-CG 3.75Å; F326-P349 HydrophobicContact CE2-CG 4.11Å; F326-P349 HydrophobicContact CZ-CG 3.49Å; F326-P349 VanDerWaalsContact CZ-CG 3.49Å; L334-P349 HydrophobicContact CD2-CB 4.18Å; L334-P349 HydrophobicContact CD2-CG 4.09Å
350L83.8Confident74.5Confident83 Ų8370.8 Ų70.844%0.43538%0.381SS..THydrogen-bonded Turntrans-88.3-51.4-179.5-68.8175.4000112.9H324 F326 C348H324-L350 HydrophobicContact CB-CD1 4.26Å; H324-L350 WeakPolarHBondContact CD2-CD1 3.05Å; F326-L350 HydrophobicContact CE1-CD1 4.14Å; F326-L350 HydrophobicContact CE1-CG 4.31Å; F326-L350 HydrophobicContact CZ-CD1 3.71Å; F326-L350 HydrophobicContact CZ-CG 3.88Å; C348-L350 PolarHBondContact O-N 3.37Å; C348-L350 VanDerWaalsContact O-N 3.14Å; C348-L350 PolarHBondContact SG-N 3.46Å
351C82.3Confident75.1Confident49 Ų4976.2 Ų76.233%0.33139%0.387SS..THydrogen-bonded Turntrans-109.6-2.6-173.265.90000114.6C322 H324 S353C322-C351 VanDerWaalsContact CB-SG 3.57Å; C322-C351 VanDerWaalsContact SG-SG 3.62Å; H324-C351 VanDerWaalsContact CE1-SG 3.55Å; C351-S353 PolarHBondContact O-N 3.48Å; C351-S353 PolarHBondContact O-OG 2.92Å; C351-S353 PolarHBondContact SG-OG 3.26Å
352R81.1Confident75Confident216 Ų21679.1 Ų79.182%0.81541%0.414SS*.  trans57.68.1-178.3-57.4-179.2175.3172.9-2.6115.2C348C348-R352 WeakPolarHBondContact O-CA 3.17Å; C348-R352 PolarHBondContact O-N 2.87Å
353S78.3Confident76Confident57 Ų5772.7 Ų72.740%0.39940%0.395SS..  trans-72.2143.2173.6-44.40000109.8C348 C351C348-S353 PolarHBondContact N-O 2.92Å; C351-S353 PolarHBondContact O-N 3.48Å; C351-S353 PolarHBondContact O-OG 2.92Å; C351-S353 PolarHBondContact SG-OG 3.26Å
354C78.4Confident77.2Confident80 Ų8071.3 Ų71.354%0.54138%0.382SS..BIsolated β-bridgetrans-59.7141.3167.5-62.50000109.2H346H346-C354 WeakPolarHBondContact O-CA 3.45Å
355Y79.4Confident78.5Confident15 Ų1573.1 Ų73.16%0.05939%0.39CS..  trans-133.9147.8-176.965.9-95.4000114L320 S321 L331 E335 H346 A347 C348 K357L320-Y355 HydrophobicContact CB-CD2 4.27Å; L320-Y355 HydrophobicContact CB-CG 4.19Å; L320-Y355 HydrophobicContact CD1-CD1 3.78Å; L320-Y355 HydrophobicContact CD1-CD2 3.9Å; L320-Y355 HydrophobicContact CD1-CE1 3.99Å; L320-Y355 HydrophobicContact CD1-CE2 4.11Å; L320-Y355 HydrophobicContact CD1-CG 3.71Å; L320-Y355 HydrophobicContact CD2-CD2 3.4Å; L320-Y355 VanDerWaalsContact CD2-CD2 3.4Å; L320-Y355 HydrophobicContact CD2-CE2 3.53Å; L320-Y355 HydrophobicContact CD2-CG 4.06Å; L320-Y355 HydrophobicContact CG-CD2 4.04Å; L320-Y355 HydrophobicContact CG-CE2 4.41Å; L320-Y355 HydrophobicContact CG-CG 4.2Å; S321-Y355 VanDerWaalsContact OG-CA 3.26Å; S321-Y355 WeakPolarHBondContact OG-CA 3.44Å; L331-Y355 HydrophobicContact CD1-CE2 4.33Å; L331-Y355 WeakPolarHBondContact CD1-OH 3.42Å; L331-Y355 HydrophobicContact CD2-CE2 4.08Å; E335-Y355 PolarHBondContact OE1-OH 2.92Å; H346-Y355 HydrophobicContact CB-CE1 3.76Å; H346-Y355 HydrophobicContact CB-CE2 4.29Å; H346-Y355 WeakPolarHBondContact O-CD1 3.27Å; H346-Y355 WeakPolarHBondContact O-CE1 3.44Å; H346-Y355 PolarHBondContact O-N 3.21Å; A347-Y355 VanDerWaalsContact C-CE1 3.43Å; C348-Y355 HydrophobicContact CB-CD1 3.87Å; C348-Y355 HydrophobicContact CB-CE1 4.4Å; C348-Y355 VanDerWaalsContact N-CD1 3.34Å; Y355-K357 HydrophobicContact CD2-CB 4.35Å; Y355-K357 HydrophobicContact CE2-CB 4.37Å
356Q82.7Confident79.5Confident51 Ų5174.2 Ų74.224%0.23840%0.398CS..  trans-94.1155155.4-67.1174.717.200108.1H271 I273 W278 L320 S321H271-Q356 PolarHBondContact O-NE2 3.22Å; I273-Q356 HydrophobicContact CD1-CB 4.05Å; I273-Q356 HydrophobicContact CD1-CG 4.44Å; I273-Q356 VanDerWaalsContact N-OE1 3.09Å; W278-Q356 HydrophobicContact CH2-CB 4.41Å; W278-Q356 WeakPolarHBondContact CH2-O 3.41Å; W278-Q356 HydrophobicContact CZ2-CB 4.04Å; L320-Q356 CarbonylContact C-O 3.6Å; L320-Q356 WeakPolarHBondContact CA-O 3.46Å; S321-Q356 PolarHBondContact N-O 2.79Å; S321-Q356 PolarHBondContact OG-N 3.31Å
357K85.8Confident79.7Confident77 Ų7777.2 Ų77.234%0.33542%0.416SS..EExtended strand (participates in β ladder)trans-122.9139-17965.4-176.2175.4-170.70111.2L319 L320 L331 E335 Y355L319-K357 CarbonylContact O-C 3.57Å; L319-K357 WeakPolarHBondContact O-CA 3.18Å; L320-K357 HydrophobicContact CD2-CB 3.85Å; L331-K357 HydrophobicContact CD2-CB 4.33Å; L331-K357 HydrophobicContact CD2-CD 3.81Å; E335-K357 IonicContact OE1-NZ 2.82Å; E335-K357 PolarHBondContact OE1-NZ 3.38Å; E335-K357 IonicContact OE2-NZ 2.62Å; E335-K357 PolarHBondContact OE2-NZ 3.25Å; Y355-K357 HydrophobicContact CD2-CB 4.35Å; Y355-K357 HydrophobicContact CE2-CB 4.37Å
358K86.1Confident79.5Confident56 Ų5678.9 Ų78.924%0.24342%0.415CS..EExtended strand (participates in β ladder)trans-117.7124.9169.9-173.9168.5-177162.50108.2E275 W278 L319 L360E275-K358 IonicContact OE1-NZ 2.85Å; E275-K358 PolarHBondContact OE1-NZ 3.19Å; E275-K358 IonicContact OE2-NZ 2.65Å; E275-K358 PolarHBondContact OE2-NZ 3.32Å; W278-K358 HydrophobicContact CB-CD 4Å; W278-K358 HydrophobicContact CD2-CB 3.96Å; W278-K358 HydrophobicContact CD2-CD 3.73Å; W278-K358 HydrophobicContact CD2-CG 4.49Å; W278-K358 HydrophobicContact CE3-CB 3.82Å; W278-K358 HydrophobicContact CE3-CD 4.06Å; W278-K358 HydrophobicContact CG-CD 3.7Å; W278-K358 HydrophobicContact CH2-CB 3.8Å; W278-K358 HydrophobicContact CZ2-CB 3.95Å; W278-K358 HydrophobicContact CZ3-CB 3.74Å; L319-K358 PolarHBondContact N-O 3.49Å; L319-K358 PolarHBondContact O-N 3.4Å; K358-L360 PolarHBondContact O-N 3.28Å
359I86.2Confident79.1Confident75 Ų7584.5 Ų84.539%0.38544%0.444SS..EExtended strand (participates in β ladder)trans-76.9123.2175.4-56.8173.6000106.8E316E316-I359 HydrophobicContact CB-CG2 4.46Å
360L80.8Confident78.8Confident37 Ų3786.5 Ų86.519%0.19445%0.449CS..EExtended strand (participates in β ladder)trans-89.6107.2173.5-59.9178.8000107.2T317 L319 K358T317-L360 PolarHBondContact O-N 3.29Å; L319-L360 HydrophobicContact CB-CD1 3.92Å; L319-L360 HydrophobicContact CB-CD2 4.29Å; L319-L360 HydrophobicContact CB-CG 4Å; L319-L360 HydrophobicContact CD2-CD2 4.44Å; K358-L360 PolarHBondContact O-N 3.28Å
361E65.3Low78.4Confident185 Ų18586.8 Ų86.886%0.86445%0.45SS*.  trans-68.3132.6168.8-65.2-175.4169.600108.9
362S54.6Low78.1Confident143 Ų14390.2 Ų90.2100%146%0.461SS*.  trans-82.20-175.961.90000113.4

Retrieved 362 of 362 residues in 128.3 ms (Link to these results)