A0A096MP38_PAPAN Loading...

Replication factor C subunit 5

Subunit of the replication factor C (RFC) complex which acts during elongation of primed DNA templates by DNA polymerases delta and epsilon, and is necessary for ATP-dependent loading of proliferating cell nuclear antigen (PCNA) onto primed DNA.

AlphaFold DB (F6QMV0), UniProt , Accession A0A096MP38, Species PAPAN (Papio anubis, Olive baboon), Gene RFC5, Length 340 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
1M39.2Very low36.6Very low249 Ų249166.9 Ų166.9100%1.22787%0.869SS**  0890-85.1176.3166.700107
2E31.1Very low36.9Very low200 Ų200160.3 Ų160.394%0.93584%0.844SS**  trans-134.3117.7168.3-83.1-176.8148.900106.8
3T36.4Very low37.9Very low144 Ų144153.9 Ų153.988%0.88383%0.828SS**  trans-87.5113.8-178.131.20000109.2A5T3-A5 PolarHBondContact O-N 3.12Å
4S34.2Very low38.1Very low113 Ų113148.5 Ų148.579%0.7982%0.815SS**  trans-73.1107.1172.857.30000110.4L6S4-L6 PolarHBondContact O-N 3.05Å
5A38.6Very low38.2Very low95 Ų95141.4 Ų141.479%0.78578%0.784SS**  trans-71.7114.6168.600000110T3 K7T3-A5 PolarHBondContact O-N 3.12Å; A5-K7 PolarHBondContact O-N 2.77Å; A5-K7 VanDerWaalsContact O-N 3.15Å
6L34Very low38.6Very low168 Ų168140.1 Ų140.188%0.8877%0.768SS**  trans-66.3106.4171.6-76.8156.1000109.4S4 Q8S4-L6 PolarHBondContact O-N 3.05Å; L6-Q8 PolarHBondContact O-N 3.31Å
7K35.1Very low39.5Very low195 Ų195138.3 Ų138.385%0.84876%0.755SS**  trans-67.7113.4164.6-85.2177173.9176.50108.6A5 Q9A5-K7 PolarHBondContact O-N 2.77Å; A5-K7 VanDerWaalsContact O-N 3.15Å; K7-Q9 PolarHBondContact O-N 3.44Å; K7-Q9 VanDerWaalsContact O-N 3.14Å
8Q36Very low40.4Very low192 Ų192143.1 Ų143.190%0.89776%0.76SS**  trans-62.4110.7163-77.8173-13.600108.1L6 E10L6-Q8 PolarHBondContact O-N 3.31Å; Q8-E10 PolarHBondContact O-N 3.23Å
9Q38.4Very low42.1Very low183 Ų183143.2 Ų143.286%0.85576%0.761SS**PPolyproline II helixtrans-72.8116.1171.7-80.3175.4-2600108.9K7 L11K7-Q9 PolarHBondContact O-N 3.44Å; K7-Q9 VanDerWaalsContact O-N 3.14Å; Q9-L11 PolarHBondContact O-N 2.87Å
10E41.7Very low44.4Very low175 Ų175139.8 Ų139.882%0.81874%0.743SS**PPolyproline II helixtrans-67.9120.9169.9-71.8-171.7128.600110.2Q8Q8-E10 PolarHBondContact O-N 3.23Å
11L38.2Very low46.8Very low122 Ų122136 Ų13664%0.63973%0.726SS**PPolyproline II helixtrans-66.2143.2174.2-76145.1000111.2Q9Q9-L11 PolarHBondContact O-N 2.87Å
12P40.4Very low49.4Very low88 Ų88125 Ų12557%0.57167%0.671SS**PPolyproline II helixtrans-61.1146.6-179.522-30.7000112.5A14 A15 K16P12-A14 PolarHBondContact O-N 3.2Å; P12-A14 VanDerWaalsContact O-N 3.09Å; P12-A15 HydrophobicContact CG-CB 4.19Å; P12-A15 WeakPolarHBondContact O-CA 3.37Å; P12-A15 WeakPolarHBondContact O-CB 3.4Å; P12-A15 PolarHBondContact O-N 3.33Å; P12-K16 PolarHBondContact O-N 3.28Å
13A49.2Very low52.4Low77 Ų77116.6 Ų116.664%0.63663%0.634SS**Hα-helixtrans-54.6-32.8-172.500000114.6K16 I17A13-K16 PolarHBondContact O-N 2.87Å; A13-I17 PolarHBondContact O-N 2.96Å
14A40.5Very low55Low78 Ų78113.3 Ų113.365%0.64561%0.608SS**Hα-helixtrans-69.3-30.3175.800000113.3P12P12-A14 PolarHBondContact O-N 3.2Å; P12-A14 VanDerWaalsContact O-N 3.09Å
15A39.5Very low57.8Low42 Ų42111.9 Ų111.935%0.34759%0.588SS.*Hα-helixtrans-76.1-29.5174.200000112P12 I17 R18P12-A15 HydrophobicContact CG-CB 4.19Å; P12-A15 WeakPolarHBondContact O-CA 3.37Å; P12-A15 WeakPolarHBondContact O-CB 3.4Å; P12-A15 PolarHBondContact O-N 3.33Å; A15-I17 VanDerWaalsContact C-N 3.34Å; A15-I17 PolarHBondContact O-N 3.09Å; A15-R18 PolarHBondContact O-N 3.4Å
16K45.3Very low60.4Low121 Ų121108.2 Ų108.253%0.52655%0.554SS.*Hα-helixtrans-63.9-34.9173.4-79.6-178.7176.4176.30112.8P12 A13P12-K16 PolarHBondContact O-N 3.28Å; A13-K16 PolarHBondContact O-N 2.87Å
17I53.2Low63.2Low109 Ų109103.5 Ų103.556%0.55952%0.524SS*.Hα-helixtrans-72-31179.4-63169000111.7A13 A15 N19 L20A13-I17 PolarHBondContact O-N 2.96Å; A15-I17 VanDerWaalsContact C-N 3.34Å; A15-I17 PolarHBondContact O-N 3.09Å; I17-N19 VanDerWaalsContact C-N 3.28Å; I17-N19 PolarHBondContact O-N 3.42Å; I17-L20 PolarHBondContact O-N 3.37Å
18R56.8Low65.8Low224 Ų22495.6 Ų95.685%0.84549%0.493SS*.Hα-helixtrans-66.5-24.4-177.3-106-178.1171178.3-3.1114.5A15A15-R18 PolarHBondContact O-N 3.4Å
19N72.6Confident68.2Low146 Ų14690.9 Ų90.978%0.78147%0.471SS*.THydrogen-bonded Turntrans-113.413-177.6-77.44.4000113.6I17I17-N19 VanDerWaalsContact C-N 3.28Å; I17-N19 PolarHBondContact O-N 3.42Å
20L87.6Confident70.4Confident75 Ų7585.3 Ų85.339%0.39345%0.449SS..SBendtrans-70.4134.2177.1-140.785.2000109.5I17 W22 E24 K25I17-L20 PolarHBondContact O-N 3.37Å; L20-W22 PolarHBondContact O-N 3.14Å; L20-E24 HydrophobicContact CD2-CB 3.53Å; L20-E24 HydrophobicContact CG-CB 4.1Å; L20-K25 HydrophobicContact CB-CB 4.43Å; L20-K25 HydrophobicContact CD2-CB 4.43Å
21P94.1Very high72.4Confident61 Ų6177.9 Ų77.940%0.39642%0.415SS..  trans-53.2140.5170.4-26.735.4000111.1V23 E24 K25P21-V23 HydrophobicContact CB-CG2 3.76Å; P21-V23 PolarHBondContact O-N 3.49Å; P21-V23 VanDerWaalsContact O-N 3.16Å; P21-E24 PolarHBondContact O-N 3.13Å; P21-K25 PolarHBondContact O-N 3.21Å
22W95Very high74.5Confident16 Ų1679.5 Ų79.56%0.06142%0.424CS..Hα-helixtrans-60.9-30-174.9-69.3-5.7000112.6L20 E24 K25 Y26 V189 E193 V195 L220 Q221 N224L20-W22 PolarHBondContact O-N 3.14Å; W22-E24 PolarHBondContact O-N 3.15Å; W22-K25 PolarHBondContact O-N 2.9Å; W22-Y26 HydrophobicContact CB-CD2 4.02Å; W22-Y26 HydrophobicContact CB-CE2 4.36Å; W22-Y26 HydrophobicContact CG-CD2 4.39Å; W22-Y26 HydrophobicContact CG-CE2 4.24Å; W22-Y26 WeakPolarHBondContact O-CB 3.4Å; W22-Y26 WeakPolarHBondContact O-CD2 3.49Å; W22-Y26 PolarHBondContact O-N 3.41Å; W22-V189 HydrophobicContact CD2-CG1 4.47Å; W22-V189 HydrophobicContact CE3-CG1 4.01Å; W22-V189 HydrophobicContact CZ3-CG1 4.41Å; W22-E193 HydrophobicContact CD2-CG 4.26Å; W22-E193 HydrophobicContact CH2-CB 4.04Å; W22-E193 HydrophobicContact CH2-CG 4.11Å; W22-E193 HydrophobicContact CZ2-CB 3.81Å; W22-E193 HydrophobicContact CZ2-CG 3.61Å; W22-E193 PolarHBondContact NE1-OE1 3.26Å; W22-E193 VanDerWaalsContact NE1-OE1 3.11Å; W22-V195 HydrophobicContact CH2-CG2 3.57Å; W22-V195 HydrophobicContact CZ3-CG2 4.12Å; W22-L220 HydrophobicContact CE3-CD2 4.2Å; W22-L220 HydrophobicContact CE3-CG 4.41Å; W22-L220 HydrophobicContact CZ3-CB 4.37Å; W22-L220 HydrophobicContact CZ3-CD2 3.81Å; W22-L220 HydrophobicContact CZ3-CG 3.79Å; W22-Q221 HydrophobicContact CB-CB 4.44Å; W22-Q221 HydrophobicContact CD2-CB 3.6Å; W22-Q221 HydrophobicContact CD2-CG 3.64Å; W22-Q221 HydrophobicContact CE3-CB 3.45Å; W22-Q221 VanDerWaalsContact CE3-CB 3.45Å; W22-Q221 HydrophobicContact CE3-CG 4Å; W22-Q221 HydrophobicContact CG-CB 4.07Å; W22-Q221 HydrophobicContact CG-CG 3.95Å; W22-Q221 HydrophobicContact CH2-CB 4.44Å; W22-Q221 HydrophobicContact CZ2-CG 4.23Å; W22-Q221 VanDerWaalsContact CZ3-CA 3.47Å; W22-Q221 HydrophobicContact CZ3-CB 3.92Å; W22-Q221 HydrophobicContact CZ3-CG 4.43Å; W22-N224 HydrophobicContact CH2-CB 4.2Å
23V93.8Very high76.6Confident25 Ų2578 Ų7815%0.15241%0.411CS..Hα-helixtrans-57.4-33172.4-68.90000113.7P21 R214 L217 N218P21-V23 HydrophobicContact CB-CG2 3.76Å; P21-V23 PolarHBondContact O-N 3.49Å; P21-V23 VanDerWaalsContact O-N 3.16Å; V23-R214 HydrophobicContact CB-CG 4.2Å; V23-R214 HydrophobicContact CG1-CB 4.39Å; V23-R214 HydrophobicContact CG1-CG 3.67Å; V23-R214 WeakPolarHBondContact CG1-O 3.36Å; V23-L217 HydrophobicContact CG1-CB 3.77Å; V23-L217 HydrophobicContact CG1-CD1 4.45Å; V23-N218 WeakPolarHBondContact CG1-OD1 3.2Å
24E91.4Very high78.3Confident75 Ų7574.8 Ų74.835%0.3538%0.383SS..Hα-helixtrans-91.5-40.4175.8-66.1-52.4139.300111.5L20 P21 W22 Y26 R27L20-E24 HydrophobicContact CD2-CB 3.53Å; L20-E24 HydrophobicContact CG-CB 4.1Å; P21-E24 PolarHBondContact O-N 3.13Å; W22-E24 PolarHBondContact O-N 3.15Å; E24-Y26 VanDerWaalsContact C-N 3.29Å; E24-Y26 PolarHBondContact O-N 3.42Å; E24-R27 VanDerWaalsContact O-CB 3.26Å; E24-R27 WeakPolarHBondContact O-CB 3.41Å; E24-R27 PolarHBondContact O-N 3.34Å; E24-R27 IonicContact OE1-CZ 2.6Å; E24-R27 IonicContact OE1-NE 3.75Å; E24-R27 IonicContact OE1-NH2 2.68Å; E24-R27 PolarHBondContact OE1-NH2 2.84Å; E24-R27 IonicContact OE2-CZ 3.37Å; E24-R27 IonicContact OE2-NE 3.49Å; E24-R27 PolarHBondContact OE2-NE 2.95Å; E24-R27 IonicContact OE2-NH2 2.85Å; E24-R27 PolarHBondContact OE2-NH2 2.89Å
25K93.1Very high80.1Confident82 Ų8273.3 Ų73.336%0.35736%0.364SS..Hα-helixtrans-59.6-41.8-178.9-172.8-177.9174-167.60111.5L20 P21 W22 E193L20-K25 HydrophobicContact CB-CB 4.43Å; L20-K25 HydrophobicContact CD2-CB 4.43Å; P21-K25 PolarHBondContact O-N 3.21Å; W22-K25 PolarHBondContact O-N 2.9Å; K25-E193 WeakPolarHBondContact CD-OE1 3.23Å; K25-E193 WeakPolarHBondContact CE-OE1 3.31Å; K25-E193 VanDerWaalsContact NZ-CD 3.35Å; K25-E193 IonicContact NZ-OE1 3.99Å; K25-E193 PolarHBondContact NZ-OE1 3.08Å; K25-E193 IonicContact NZ-OE2 2.69Å; K25-E193 PolarHBondContact NZ-OE2 3.08Å
26Y92.9Very high82Confident19 Ų1971.8 Ų71.88%0.07535%0.351CS..THydrogen-bonded Turntrans-100.115.5-179.2-64.2-80.2000113.3W22 E24 P28 R185 V189 E192 E193W22-Y26 HydrophobicContact CB-CD2 4.02Å; W22-Y26 HydrophobicContact CB-CE2 4.36Å; W22-Y26 HydrophobicContact CG-CD2 4.39Å; W22-Y26 HydrophobicContact CG-CE2 4.24Å; W22-Y26 WeakPolarHBondContact O-CB 3.4Å; W22-Y26 WeakPolarHBondContact O-CD2 3.49Å; W22-Y26 PolarHBondContact O-N 3.41Å; E24-Y26 VanDerWaalsContact C-N 3.29Å; E24-Y26 PolarHBondContact O-N 3.42Å; Y26-P28 WeakPolarHBondContact O-CD 3.34Å; Y26-R185 PolarHBondContact O-NH2 2.96Å; Y26-V189 HydrophobicContact CD1-CG2 3.72Å; Y26-V189 HydrophobicContact CD2-CG1 4Å; Y26-V189 HydrophobicContact CD2-CG2 3.9Å; Y26-V189 HydrophobicContact CE1-CG2 4.05Å; Y26-V189 HydrophobicContact CE2-CG1 3.77Å; Y26-V189 HydrophobicContact CE2-CG2 4.25Å; Y26-V189 HydrophobicContact CG-CG2 3.64Å; Y26-E192 HydrophobicContact CE1-CB 4.11Å; Y26-E192 HydrophobicContact CE1-CG 4.34Å; Y26-E192 VanDerWaalsContact OH-CB 3.28Å; Y26-E192 WeakPolarHBondContact OH-CB 3.15Å; Y26-E193 HydrophobicContact CE2-CG 4.03Å; Y26-E193 VanDerWaalsContact CE2-OE1 3.3Å; Y26-E193 WeakPolarHBondContact CE2-OE1 3.48Å; Y26-E193 VanDerWaalsContact OH-CD 3.29Å; Y26-E193 VanDerWaalsContact OH-CG 3.29Å; Y26-E193 WeakPolarHBondContact OH-CG 3.5Å; Y26-E193 PolarHBondContact OH-OE1 3.47Å
27R91.9Very high83.9Confident69 Ų6967.9 Ų67.926%0.2634%0.335SS..  trans-58.9125.7174.5-174.4-175.3-76.9-142.6-2.1109.2E24 Q29E24-R27 VanDerWaalsContact O-CB 3.26Å; E24-R27 WeakPolarHBondContact O-CB 3.41Å; E24-R27 PolarHBondContact O-N 3.34Å; E24-R27 IonicContact OE1-CZ 2.6Å; E24-R27 IonicContact OE1-NE 3.75Å; E24-R27 IonicContact OE1-NH2 2.68Å; E24-R27 PolarHBondContact OE1-NH2 2.84Å; E24-R27 IonicContact OE2-CZ 3.37Å; E24-R27 IonicContact OE2-NE 3.49Å; E24-R27 PolarHBondContact OE2-NE 2.95Å; E24-R27 IonicContact OE2-NH2 2.85Å; E24-R27 PolarHBondContact OE2-NH2 2.89Å; R27-Q29 PolarHBondContact O-N 3.43Å; R27-Q29 PolarHBondContact O-NE2 2.87Å
28P89.6Confident85.5Confident28 Ų2868.1 Ų68.118%0.18233%0.333CS..  trans-51.6128.8177.6-30.237.3000111.9Y26 D33 L34Y26-P28 WeakPolarHBondContact O-CD 3.34Å; P28-D33 HydrophobicContact CB-CB 3.84Å; P28-L34 HydrophobicContact CB-CD2 3.78Å; P28-L34 HydrophobicContact CB-CG 4.19Å; P28-L34 HydrophobicContact CG-CD2 3.86Å
29Q86.2Confident87.1Confident94 Ų9463.8 Ų63.844%0.43933%0.327SS..  trans-99.1-28.6-179.3-61.9-58.7-42.600111.7R27 D33R27-Q29 PolarHBondContact O-N 3.43Å; R27-Q29 PolarHBondContact O-NE2 2.87Å; Q29-D33 PolarHBondContact N-OD2 3.37Å
30T86.6Confident88Confident65 Ų6557.9 Ų57.940%0.39930%0.295SS..SBendtrans-122164179.574.30000111N32 D33T30-N32 PolarHBondContact O-N 3.33Å; T30-N32 PolarHBondContact OG1-N 2.93Å; T30-D33 PolarHBondContact N-OD2 2.98Å; T30-D33 PolarHBondContact O-N 3.47Å; T30-D33 PolarHBondContact OG1-N 3.33Å; T30-D33 PolarHBondContact OG1-OD1 3.48Å; T30-D33 PolarHBondContact OG1-OD2 2.89Å
31L82.8Confident88Confident19 Ų1954.8 Ų54.810%0.09928%0.279CS..G310 helixtrans-66-27.4175.6-68.4179.1000112.7D33 L34 L41 T69 A72 C73L31-D33 PolarHBondContact O-N 3.17Å; L31-L34 HydrophobicContact CD2-CD1 3.69Å; L31-L34 WeakPolarHBondContact O-CB 3.45Å; L31-L34 PolarHBondContact O-N 3.49Å; L31-L41 HydrophobicContact CD2-CD2 4.25Å; L31-T69 HydrophobicContact CD2-CG2 4.49Å; L31-A72 HydrophobicContact CD2-CB 3.66Å; L31-A72 HydrophobicContact CG-CB 4.09Å; L31-C73 VanDerWaalsContact CD2-SG 3.51Å
32N82.4Confident87.9Confident156 Ų15655.2 Ų55.283%0.83428%0.283SS*.G310 helixtrans-71-23.4177.9-64.4-17.7000112.1T30 L34T30-N32 PolarHBondContact O-N 3.33Å; T30-N32 PolarHBondContact OG1-N 2.93Å; N32-L34 PolarHBondContact O-N 2.91Å
33D84Confident87.8Confident57 Ų5756.9 Ų56.931%0.30530%0.296SS..G310 helixtrans-77.4-8.5176.3-55.4-38.6000112.5P28 Q29 T30 L31 I35P28-D33 HydrophobicContact CB-CB 3.84Å; Q29-D33 PolarHBondContact N-OD2 3.37Å; T30-D33 PolarHBondContact N-OD2 2.98Å; T30-D33 PolarHBondContact O-N 3.47Å; T30-D33 PolarHBondContact OG1-N 3.33Å; T30-D33 PolarHBondContact OG1-OD1 3.48Å; T30-D33 PolarHBondContact OG1-OD2 2.89Å; L31-D33 PolarHBondContact O-N 3.17Å; D33-I35 PolarHBondContact O-N 3.11Å
34L84.5Confident87.6Confident9 Ų955.8 Ų55.85%0.04729%0.289CS..  trans-83.1112.7177.8-65.4164.3000109.7P28 L31 N32 S36 Q38 L41 T69P28-L34 HydrophobicContact CB-CD2 3.78Å; P28-L34 HydrophobicContact CB-CG 4.19Å; P28-L34 HydrophobicContact CG-CD2 3.86Å; L31-L34 HydrophobicContact CD2-CD1 3.69Å; L31-L34 WeakPolarHBondContact O-CB 3.45Å; L31-L34 PolarHBondContact O-N 3.49Å; N32-L34 PolarHBondContact O-N 2.91Å; L34-S36 VanDerWaalsContact C-N 3.27Å; L34-S36 PolarHBondContact O-N 2.6Å; L34-Q38 PolarHBondContact O-NE2 3.11Å; L34-L41 HydrophobicContact CB-CD1 3.72Å; L34-L41 HydrophobicContact CD1-CD1 4.26Å; L34-L41 HydrophobicContact CD1-CD2 3.75Å; L34-T69 HydrophobicContact CD1-CG2 4.11Å
35I78.5Confident87.5Confident47 Ų4755.2 Ų55.224%0.24129%0.286CS..  trans-73.7-12.6-176.853.5166.2000114.3D33 L177 L181 R185 M213D33-I35 PolarHBondContact O-N 3.11Å; I35-L177 HydrophobicContact CD1-CD1 4.46Å; I35-L181 VanDerWaalsContact CD1-O 3.25Å; I35-L181 WeakPolarHBondContact CD1-O 3.45Å; I35-L181 WeakPolarHBondContact O-CD2 3.43Å; I35-R185 HydrophobicContact CD1-CB 3.99Å; I35-R185 HydrophobicContact CD1-CG 4.41Å; I35-R185 HydrophobicContact CG2-CB 4.15Å; I35-R185 HydrophobicContact CG2-CG 4.49Å; I35-M213 HydrophobicContact CD1-CE 3.67Å
36S80.8Confident87.4Confident10 Ų1057.1 Ų57.17%0.0729%0.294CS..SBendtrans-133165.5-167.6670000114.5L34 Q38 L41 L177L34-S36 VanDerWaalsContact C-N 3.27Å; L34-S36 PolarHBondContact O-N 2.6Å; S36-Q38 PolarHBondContact O-N 3.39Å; S36-L41 WeakPolarHBondContact O-CD1 3.47Å; S36-L177 WeakPolarHBondContact OG-CD2 3.37Å
37H85.1Confident87.3Confident39 Ų3958.8 Ų58.818%0.18130%0.302CS..  trans58.644.9175.5-49.4-58.1000113.9D39 I40 L41 F174 G175H37-D39 PolarHBondContact O-N 2.78Å; H37-D39 VanDerWaalsContact O-N 3.11Å; H37-I40 HydrophobicContact CB-CB 4Å; H37-I40 HydrophobicContact CB-CD1 3.85Å; H37-I40 HydrophobicContact CB-CG1 4.04Å; H37-I40 WeakPolarHBondContact O-CA 3.25Å; H37-I40 WeakPolarHBondContact O-CB 3.28Å; H37-I40 PolarHBondContact O-N 3.39Å; H37-L41 PolarHBondContact O-N 3.07Å; H37-F174 AromaticContact CD2-CD1 3.24Å; H37-F174 WeakPolarHBondContact CD2-CD1 3.29Å; H37-F174 AromaticContact CD2-CE1 3.69Å; H37-F174 AromaticContact CD2-CG 4Å; H37-F174 AromaticContact NE2-CD1 3.65Å; H37-G175 PolarHBondContact CE1-N 3.47Å; H37-G175 VanDerWaalsContact CE1-N 3.34Å; H37-G175 PolarHBondContact CE1-O 3.31Å; H37-G175 PolarHBondContact NE2-O 3.3Å
38Q86Confident87.1Confident114 Ų11456.7 Ų56.753%0.53330%0.296SS..Hα-helixtrans-52.7-35.1-178.9-64.5-58.4-29.400113.3L34 S36 I40 L41 S42L34-Q38 PolarHBondContact O-NE2 3.11Å; S36-Q38 PolarHBondContact O-N 3.39Å; Q38-I40 PolarHBondContact O-N 3.23Å; Q38-L41 PolarHBondContact O-N 2.93Å; Q38-S42 VanDerWaalsContact O-CB 3.26Å; Q38-S42 WeakPolarHBondContact O-CB 3.3Å; Q38-S42 PolarHBondContact O-N 2.92Å; Q38-S42 PolarHBondContact O-OG 2.82Å
39D89.7Confident87Confident134 Ų13459.6 Ų59.672%0.71732%0.317SS*.Hα-helixtrans-65.1-38.6175.3-56.8-30.3000112.5H37 S42 T43H37-D39 PolarHBondContact O-N 2.78Å; H37-D39 VanDerWaalsContact O-N 3.11Å; D39-S42 WeakPolarHBondContact CA-OG 3.49Å; D39-S42 PolarHBondContact O-OG 3.48Å; D39-T43 WeakPolarHBondContact O-CB 3.46Å; D39-T43 PolarHBondContact O-N 3.31Å; D39-T43 VanDerWaalsContact O-N 3.15Å; D39-T43 PolarHBondContact O-OG1 3.37Å
40I91.5Very high87.1Confident21 Ų2159 Ų5911%0.10831%0.314CS..Hα-helixtrans-70.8-46.5176.9-58.5-178.6000109.4H37 Q38 T43 I44 F172 R173 F174H37-I40 HydrophobicContact CB-CB 4Å; H37-I40 HydrophobicContact CB-CD1 3.85Å; H37-I40 HydrophobicContact CB-CG1 4.04Å; H37-I40 WeakPolarHBondContact O-CA 3.25Å; H37-I40 WeakPolarHBondContact O-CB 3.28Å; H37-I40 PolarHBondContact O-N 3.39Å; Q38-I40 PolarHBondContact O-N 3.23Å; I40-T43 PolarHBondContact O-N 3.37Å; I40-I44 HydrophobicContact CG2-CD1 3.73Å; I40-I44 HydrophobicContact CG2-CG1 4.37Å; I40-I44 WeakPolarHBondContact O-CG1 3.34Å; I40-I44 PolarHBondContact O-N 3.35Å; I40-F172 HydrophobicContact CB-CD1 4.29Å; I40-F172 HydrophobicContact CD1-CB 4.27Å; I40-F172 HydrophobicContact CG1-CD1 4.09Å; I40-F172 HydrophobicContact CG2-CB 3.91Å; I40-F172 HydrophobicContact CG2-CD1 3.64Å; I40-F172 HydrophobicContact CG2-CD2 4.38Å; I40-F172 HydrophobicContact CG2-CE1 4.21Å; I40-F172 HydrophobicContact CG2-CG 3.73Å; I40-R173 VanDerWaalsContact CD1-O 3.29Å; I40-R173 WeakPolarHBondContact CD1-O 3.48Å; I40-F174 HydrophobicContact CD1-CD2 4.22Å; I40-F174 HydrophobicContact CD1-CE2 4.06Å; I40-F174 HydrophobicContact CD1-CZ 4.45Å; I40-F174 HydrophobicContact CG2-CE2 4Å; I40-F174 HydrophobicContact CG2-CZ 3.92Å
41L89Confident87Confident11 Ų1161.3 Ų61.36%0.05832%0.324CS..Hα-helixtrans-62-46.3179.8-63.6-179000111.7L31 L34 S36 H37 Q38 T43 I44 Q45 T69L31-L41 HydrophobicContact CD2-CD2 4.25Å; L34-L41 HydrophobicContact CB-CD1 3.72Å; L34-L41 HydrophobicContact CD1-CD1 4.26Å; L34-L41 HydrophobicContact CD1-CD2 3.75Å; S36-L41 WeakPolarHBondContact O-CD1 3.47Å; H37-L41 PolarHBondContact O-N 3.07Å; Q38-L41 PolarHBondContact O-N 2.93Å; L41-T43 VanDerWaalsContact C-N 3.31Å; L41-T43 PolarHBondContact O-N 3.26Å; L41-I44 PolarHBondContact O-N 3.35Å; L41-Q45 WeakPolarHBondContact O-CB 3.42Å; L41-Q45 PolarHBondContact O-N 2.81Å; L41-T69 HydrophobicContact CD2-CG2 3.48Å; L41-T69 VanDerWaalsContact CD2-CG2 3.48Å
42S90.6Very high87.3Confident69 Ų6968.7 Ų68.748%0.48335%0.35SS..Hα-helixtrans-62-38.7176.8590000112.2Q38 D39 K46Q38-S42 VanDerWaalsContact O-CB 3.26Å; Q38-S42 WeakPolarHBondContact O-CB 3.3Å; Q38-S42 PolarHBondContact O-N 2.92Å; Q38-S42 PolarHBondContact O-OG 2.82Å; D39-S42 WeakPolarHBondContact CA-OG 3.49Å; D39-S42 PolarHBondContact O-OG 3.48Å; S42-K46 WeakPolarHBondContact O-CB 3.3Å; S42-K46 PolarHBondContact O-N 3.42Å
43T92.7Very high87.7Confident52 Ų5261.4 Ų61.432%0.31931%0.311SS..Hα-helixtrans-66-47175.7-57.90000111.7D39 I40 L41 Q45 K46 F47 F172D39-T43 WeakPolarHBondContact O-CB 3.46Å; D39-T43 PolarHBondContact O-N 3.31Å; D39-T43 VanDerWaalsContact O-N 3.15Å; D39-T43 PolarHBondContact O-OG1 3.37Å; I40-T43 PolarHBondContact O-N 3.37Å; L41-T43 VanDerWaalsContact C-N 3.31Å; L41-T43 PolarHBondContact O-N 3.26Å; T43-Q45 VanDerWaalsContact C-N 3.35Å; T43-K46 WeakPolarHBondContact O-CB 3.49Å; T43-K46 PolarHBondContact O-N 3.15Å; T43-F47 HydrophobicContact CG2-CD2 4.19Å; T43-F47 HydrophobicContact CG2-CE1 4.43Å; T43-F47 HydrophobicContact CG2-CE2 3.61Å; T43-F47 HydrophobicContact CG2-CZ 3.74Å; T43-F47 WeakPolarHBondContact O-CG 3.36Å; T43-F47 PolarHBondContact O-N 3.33Å; T43-F172 HydrophobicContact CG2-CE1 4.09Å; T43-F172 HydrophobicContact CG2-CZ 3.82Å
44I90.3Very high88.2Confident1 Ų160.4 Ų60.41%0.00531%0.308CS..Hα-helixtrans-63.7-43.4177.6-66.8170.8000110.3I40 L41 K46 F47 I48 L53 T69 C73 F172I40-I44 HydrophobicContact CG2-CD1 3.73Å; I40-I44 HydrophobicContact CG2-CG1 4.37Å; I40-I44 WeakPolarHBondContact O-CG1 3.34Å; I40-I44 PolarHBondContact O-N 3.35Å; L41-I44 PolarHBondContact O-N 3.35Å; I44-K46 VanDerWaalsContact C-N 3.29Å; I44-K46 PolarHBondContact O-N 2.93Å; I44-F47 PolarHBondContact O-N 3Å; I44-F47 VanDerWaalsContact O-N 3.16Å; I44-I48 HydrophobicContact CG2-CD1 3.89Å; I44-I48 HydrophobicContact CG2-CG1 4.4Å; I44-I48 WeakPolarHBondContact O-CG1 3.44Å; I44-I48 PolarHBondContact O-N 3.41Å; I44-L53 HydrophobicContact CG2-CD1 4.42Å; I44-T69 HydrophobicContact CD1-CG2 4.39Å; I44-C73 VanDerWaalsContact CG2-SG 3.53Å; I44-F172 HydrophobicContact CD1-CD2 4.32Å; I44-F172 HydrophobicContact CD1-CE2 4.32Å; I44-F172 HydrophobicContact CG1-CD2 4.39Å; I44-F172 HydrophobicContact CG1-CE2 3.89Å; I44-F172 HydrophobicContact CG1-CZ 4.2Å
45Q89Confident88.9Confident64 Ų6460.6 Ų60.630%0.29931%0.309SS..Hα-helixtrans-59.4-41177-175.161.768.500111.7L41 T43 I48 S49 Q76L41-Q45 WeakPolarHBondContact O-CB 3.42Å; L41-Q45 PolarHBondContact O-N 2.81Å; T43-Q45 VanDerWaalsContact C-N 3.35Å; Q45-I48 PolarHBondContact O-N 2.77Å; Q45-S49 WeakPolarHBondContact O-CB 3.48Å; Q45-S49 PolarHBondContact O-N 2.94Å; Q45-S49 PolarHBondContact O-OG 2.91Å; Q45-Q76 VanDerWaalsContact OE1-OE1 3.06Å
46K91.8Very high89.8Confident122 Ų12258.5 Ų58.553%0.5330%0.298SS..Hα-helixtrans-62.6-47.7174.3-174.9174.9179.1176.80111.3S42 T43 I44 I48 S49 E50S42-K46 WeakPolarHBondContact O-CB 3.3Å; S42-K46 PolarHBondContact O-N 3.42Å; T43-K46 WeakPolarHBondContact O-CB 3.49Å; T43-K46 PolarHBondContact O-N 3.15Å; I44-K46 VanDerWaalsContact C-N 3.29Å; I44-K46 PolarHBondContact O-N 2.93Å; K46-I48 VanDerWaalsContact C-N 3.28Å; K46-I48 PolarHBondContact O-N 3.16Å; K46-S49 WeakPolarHBondContact CA-OG 3.5Å; K46-S49 PolarHBondContact O-N 3.38Å; K46-S49 VanDerWaalsContact O-N 3.15Å; K46-S49 PolarHBondContact O-OG 3.38Å; K46-E50 WeakPolarHBondContact CE-OE1 2.89Å; K46-E50 WeakPolarHBondContact CG-OE1 3.48Å; K46-E50 PolarHBondContact O-N 3Å
47F91.2Very high90.6Very high53 Ų5358 Ų5823%0.23229%0.294CS..Hα-helixtrans-59.8-37.2176.5-67.4-29.8000113.3T43 I44 D51 R52 L53 P54 F172T43-F47 HydrophobicContact CG2-CD2 4.19Å; T43-F47 HydrophobicContact CG2-CE1 4.43Å; T43-F47 HydrophobicContact CG2-CE2 3.61Å; T43-F47 HydrophobicContact CG2-CZ 3.74Å; T43-F47 WeakPolarHBondContact O-CG 3.36Å; T43-F47 PolarHBondContact O-N 3.33Å; I44-F47 PolarHBondContact O-N 3Å; I44-F47 VanDerWaalsContact O-N 3.16Å; F47-D51 PolarHBondContact O-N 3.36Å; F47-R52 PolarHBondContact O-N 3.37Å; F47-L53 HydrophobicContact CB-CD1 4Å; F47-L53 PolarHBondContact O-N 3.3Å; F47-P54 HydrophobicContact CD2-CG 4.26Å; F47-P54 HydrophobicContact CE2-CG 4.2Å; F47-F172 HydrophobicContact CE2-CE2 4.49Å; F47-F172 HydrophobicContact CE2-CZ 4.05Å
48I87Confident91.2Very high25 Ų2556.2 Ų56.213%0.12829%0.286CS..Hα-helixtrans-65.4-47.7174.2-70.3171.9000110.4I44 Q45 K46 E50 D51 L53 C73 L77I44-I48 HydrophobicContact CG2-CD1 3.89Å; I44-I48 HydrophobicContact CG2-CG1 4.4Å; I44-I48 WeakPolarHBondContact O-CG1 3.44Å; I44-I48 PolarHBondContact O-N 3.41Å; Q45-I48 PolarHBondContact O-N 2.77Å; K46-I48 VanDerWaalsContact C-N 3.28Å; K46-I48 PolarHBondContact O-N 3.16Å; I48-E50 VanDerWaalsContact C-N 3.28Å; I48-E50 PolarHBondContact O-N 3.2Å; I48-D51 PolarHBondContact O-N 2.94Å; I48-L53 HydrophobicContact CG1-CD1 4.14Å; I48-C73 HydrophobicContact CD1-CB 4.01Å; I48-L77 HydrophobicContact CB-CD2 4.33Å; I48-L77 HydrophobicContact CD1-CD1 4.19Å; I48-L77 HydrophobicContact CD1-CG 4.17Å; I48-L77 HydrophobicContact CG1-CD1 4.25Å; I48-L77 HydrophobicContact CG1-CD2 4.08Å; I48-L77 HydrophobicContact CG1-CG 4.23Å; I48-L77 HydrophobicContact CG2-CD2 3.61Å; I48-L77 HydrophobicContact CG2-CG 4.19Å
49S86.9Confident91.8Very high89 Ų8952.8 Ų52.862%0.62227%0.269SS*.Hα-helixtrans-65.1-29.8-17868.80000113.8Q45 K46Q45-S49 WeakPolarHBondContact O-CB 3.48Å; Q45-S49 PolarHBondContact O-N 2.94Å; Q45-S49 PolarHBondContact O-OG 2.91Å; K46-S49 WeakPolarHBondContact CA-OG 3.5Å; K46-S49 PolarHBondContact O-N 3.38Å; K46-S49 VanDerWaalsContact O-N 3.15Å; K46-S49 PolarHBondContact O-OG 3.38Å
50E89.4Confident92.1Very high81 Ų8146.6 Ų46.638%0.37924%0.237SC..THydrogen-bonded Turntrans-90.42.8179.1-66.2-176.7-164.200113.5K46 I48 R52K46-E50 WeakPolarHBondContact CE-OE1 2.89Å; K46-E50 WeakPolarHBondContact CG-OE1 3.48Å; K46-E50 PolarHBondContact O-N 3Å; I48-E50 VanDerWaalsContact C-N 3.28Å; I48-E50 PolarHBondContact O-N 3.2Å; E50-R52 HydrophobicContact CB-CB 4.25Å; E50-R52 HydrophobicContact CB-CG 4.29Å; E50-R52 WeakPolarHBondContact O-CG 3.36Å; E50-R52 PolarHBondContact O-N 3.25Å; E50-R52 IonicContact OE2-NH1 3.16Å; E50-R52 PolarHBondContact OE2-NH1 3.33Å
51D84.6Confident92.2Very high114 Ų11448.2 Ų48.261%0.6125%0.248SC*.THydrogen-bonded Turntrans52.337-172.7-161.626.7000113.1F47 I48F47-D51 PolarHBondContact O-N 3.36Å; I48-D51 PolarHBondContact O-N 2.94Å
52R88.2Confident92.4Very high175 Ų17550.6 Ų50.666%0.6627%0.265SS*.  trans-121.823.9-174.3-77.3174.3-179.2-178.5-4.3112.9F47 E50 P54F47-R52 PolarHBondContact O-N 3.37Å; E50-R52 HydrophobicContact CB-CB 4.25Å; E50-R52 HydrophobicContact CB-CG 4.29Å; E50-R52 WeakPolarHBondContact O-CG 3.36Å; E50-R52 PolarHBondContact O-N 3.25Å; E50-R52 IonicContact OE2-NH1 3.16Å; E50-R52 PolarHBondContact OE2-NH1 3.33Å; R52-P54 WeakPolarHBondContact O-CD 3.19Å; R52-P54 VanDerWaalsContact O-N 3.12Å
53L91.3Very high92.5Very high3 Ų347.8 Ų47.82%0.01625%0.247CC..  trans-58.5115.7180-166.970000110.6I44 F47 I48 L56 L77 F119 R150I44-L53 HydrophobicContact CG2-CD1 4.42Å; F47-L53 HydrophobicContact CB-CD1 4Å; F47-L53 PolarHBondContact O-N 3.3Å; I48-L53 HydrophobicContact CG1-CD1 4.14Å; L53-L56 HydrophobicContact CD1-CD1 4.16Å; L53-L77 HydrophobicContact CD2-CD1 3.96Å; L53-F119 HydrophobicContact CB-CE1 4.38Å; L53-F119 HydrophobicContact CB-CZ 3.88Å; L53-F119 HydrophobicContact CD2-CE2 3.85Å; L53-F119 HydrophobicContact CD2-CZ 3.81Å; L53-R150 VanDerWaalsContact O-CD 3.24Å; L53-R150 WeakPolarHBondContact O-CD 3.4Å; L53-R150 PolarHBondContact O-NE 3.28Å
54P95.1Very high92.6Very high36 Ų3645.4 Ų45.423%0.23423%0.232CC..  trans-79.8179.617533.5-33000110.4F47 R52 L56 T170F47-P54 HydrophobicContact CD2-CG 4.26Å; F47-P54 HydrophobicContact CE2-CG 4.2Å; R52-P54 WeakPolarHBondContact O-CD 3.19Å; R52-P54 VanDerWaalsContact O-N 3.12Å; P54-L56 HydrophobicContact CG-CD2 4.07Å; P54-T170 VanDerWaalsContact CG-OG1 3.29Å; P54-T170 WeakPolarHBondContact CG-OG1 3.49Å
55H97.6Very high92.7Very high12 Ų1246.3 Ų46.36%0.05624%0.242CC..  trans-64.9140161.6-51.3-45.8000109.3I142 T146 T149 F151 R168 C169 T170H55-I142 WeakPolarHBondContact CD2-CG2 3.35Å; H55-I142 WeakPolarHBondContact NE2-CG2 3.4Å; H55-T146 PolarHBondContact CE1-OG1 3.13Å; H55-T146 PolarHBondContact NE2-OG1 2.84Å; H55-T149 PolarHBondContact CE1-O 3.11Å; H55-T149 VanDerWaalsContact CE1-O 3.29Å; H55-F151 CarbonylContact C-O 3.48Å; H55-F151 VanDerWaalsContact CA-O 3.24Å; H55-F151 WeakPolarHBondContact CA-O 3.33Å; H55-F151 PolarHBondContact ND1-N 3.23Å; H55-R168 PolarHBondContact CD2-O 3.13Å; H55-C169 HydrophobicContact CB-CB 4.33Å; H55-C169 CarbonylContact O-C 3.51Å; H55-C169 WeakPolarHBondContact O-CA 3.48Å; H55-T170 PolarHBondContact O-N 3.49Å
56L97.9Very high92.9Very high3 Ų343.8 Ų43.82%0.01623%0.23CC..EExtended strand (participates in β ladder)trans-113.3145.2-175.1-60.5-176.9000110.7L53 P54 L58 I70 F151 C152 L153 T170 F172L53-L56 HydrophobicContact CD1-CD1 4.16Å; P54-L56 HydrophobicContact CG-CD2 4.07Å; L56-L58 HydrophobicContact CB-CD2 4.28Å; L56-I70 HydrophobicContact CD1-CD1 4.07Å; L56-F151 PolarHBondContact N-O 3.37Å; L56-C152 HydrophobicContact CB-CB 4.2Å; L56-C152 CarbonylContact O-C 3.53Å; L56-C152 WeakPolarHBondContact O-CA 3.26Å; L56-L153 PolarHBondContact O-N 2.86Å; L56-T170 WeakPolarHBondContact CA-O 3.24Å; L56-F172 HydrophobicContact CD2-CD2 4.12Å; L56-F172 HydrophobicContact CD2-CE2 3.73Å
57L98.3Very high93Very high0 Ų038.9 Ų38.90%021%0.21CC..EExtended strand (participates in β ladder)trans-130.6104.2168.6-168.1168.4000108.1Y59 L153 L158 I161 Q166 C169 T170 R171 F172L57-Y59 HydrophobicContact CD2-CD1 3.83Å; L57-Y59 HydrophobicContact CD2-CG 4.18Å; L57-L153 CarbonylContact C-O 3.53Å; L57-L153 WeakPolarHBondContact CA-O 3.39Å; L57-L153 HydrophobicContact CG-CB 4.37Å; L57-L158 HydrophobicContact CD1-CD1 3.83Å; L57-L158 HydrophobicContact CD2-CD1 3.64Å; L57-L158 HydrophobicContact CG-CD1 4.43Å; L57-I161 HydrophobicContact CD1-CG2 4.18Å; L57-Q166 HydrophobicContact CD1-CB 4.47Å; L57-Q166 HydrophobicContact CD1-CG 4.11Å; L57-C169 HydrophobicContact CB-CB 3.73Å; L57-T170 PolarHBondContact N-O 3.29Å; L57-R171 HydrophobicContact CB-CG 4.27Å; L57-R171 WeakPolarHBondContact O-CA 3.29Å; L57-F172 PolarHBondContact O-N 3.45Å
58L97.9Very high93.1Very high1 Ų137.3 Ų37.31%0.00521%0.205CC..EExtended strand (participates in β ladder)trans-95.6119.5179-44.5-174.9000108.5L56 K66 I70 L153 I154 C155 F172 F174L56-L58 HydrophobicContact CB-CD2 4.28Å; L58-K66 HydrophobicContact CB-CB 4.33Å; L58-I70 HydrophobicContact CD1-CB 4.14Å; L58-L153 PolarHBondContact N-O 3.06Å; L58-I154 WeakPolarHBondContact O-CA 3.41Å; L58-C155 PolarHBondContact O-N 3.42Å; L58-F172 WeakPolarHBondContact CA-O 3.44Å; L58-F172 HydrophobicContact CD2-CB 3.87Å; L58-F172 HydrophobicContact CD2-CD2 3.99Å; L58-F172 HydrophobicContact CD2-CG 4.4Å; L58-F174 HydrophobicContact CB-CD2 4.28Å; L58-F174 HydrophobicContact CB-CE2 4.04Å; L58-F174 HydrophobicContact CD1-CE2 4.39Å; L58-F174 HydrophobicContact CD1-CZ 4.49Å; L58-F174 HydrophobicContact CD2-CE2 3.97Å; L58-F174 HydrophobicContact CG-CE2 4.34Å
59Y97.8Very high93.4Very high42 Ų4236.2 Ų36.217%0.16520%0.2CC..EExtended strand (participates in β ladder)trans-137150.1-176.974.3-77.7000113.4L57 C155 L158 R171 F172 R173 F174L57-Y59 HydrophobicContact CD2-CD1 3.83Å; L57-Y59 HydrophobicContact CD2-CG 4.18Å; Y59-C155 VanDerWaalsContact CA-O 3.26Å; Y59-C155 WeakPolarHBondContact CA-O 3.3Å; Y59-L158 HydrophobicContact CD2-CB 3.77Å; Y59-L158 HydrophobicContact CD2-CD2 4.34Å; Y59-L158 HydrophobicContact CE1-CD2 4.22Å; Y59-L158 HydrophobicContact CE2-CB 4.13Å; Y59-L158 HydrophobicContact CE2-CD2 3.99Å; Y59-L158 HydrophobicContact CG-CB 4.11Å; Y59-L158 HydrophobicContact CG-CD1 4.49Å; Y59-R171 HydrophobicContact CE1-CB 4.15Å; Y59-F172 VanDerWaalsContact CD1-O 3.27Å; Y59-F172 WeakPolarHBondContact CD1-O 3.25Å; Y59-F172 PolarHBondContact N-O 2.84Å; Y59-R173 HydrophobicContact CD2-CG 4.41Å; Y59-R173 HydrophobicContact CE1-CB 3.82Å; Y59-R173 HydrophobicContact CE1-CG 4.42Å; Y59-R173 HydrophobicContact CE2-CB 4.07Å; Y59-R173 HydrophobicContact CE2-CG 3.77Å; Y59-R173 CarbonylContact O-C 3.54Å; Y59-R173 WeakPolarHBondContact O-CA 3.43Å; Y59-F174 PolarHBondContact O-N 2.73Å
60G96.1Very high93.7Very high5 Ų532.1 Ų32.15%0.05217%0.171CC..SBendtrans149-176.717700000113.3K66 C155 N156 F174G60-K66 PolarHBondContact O-NZ 3.29Å; G60-C155 PolarHBondContact N-O 2.84Å; G60-N156 WeakPolarHBondContact O-CA 3.49Å; G60-N156 PolarHBondContact O-OD1 3.23Å; G60-F174 WeakPolarHBondContact CA-O 3.32Å
61P94.4Very high93.8Very high54 Ų5429.2 Ų29.235%0.35116%0.158SC..SBendtrans-56.3159.4-177.3-26.737.9000113.9T64 K66 F174 P176P61-T64 HydrophobicContact CB-CG2 4.17Å; P61-T64 WeakPolarHBondContact O-CG2 3.41Å; P61-T64 PolarHBondContact O-OG1 3.24Å; P61-K66 PolarHBondContact O-NZ 3.23Å; P61-F174 WeakPolarHBondContact CD-O 3.25Å; P61-P176 HydrophobicContact CG-CG 4.12Å
62P93.1Very high94.1Very high61 Ų6124 Ų2440%0.39613%0.131SC..THydrogen-bonded Turntrans-60.8157.8175.327.3-35.2000111.9T64 D212P62-T64 PolarHBondContact O-N 3.42Å; P62-D212 VanDerWaalsContact C-OD2 3.3Å
63G92.4Very high94.2Very high11 Ų1115.7 Ų15.711%0.11310%0.1CC..THydrogen-bonded Turntrans65.612.4174.100000117.2D212 M213G63-D212 VanDerWaalsContact CA-OD1 3.32Å; G63-D212 WeakPolarHBondContact CA-OD1 3.3Å; G63-M213 PolarHBondContact O-N 2.94Å
64T93.4Very high94.1Very high2 Ų215.6 Ų15.61%0.01210%0.099CC..SBendtrans-87.40.2178.551.80000114.1P61 P62 G175P61-T64 HydrophobicContact CB-CG2 4.17Å; P61-T64 WeakPolarHBondContact O-CG2 3.41Å; P61-T64 PolarHBondContact O-OG1 3.24Å; P62-T64 PolarHBondContact O-N 3.42Å; T64-G175 WeakPolarHBondContact CG2-O 3.32Å
65G93Very high93.9Very high19 Ų1917.9 Ų17.920%0.19611%0.105CC..SBendtrans92.913.1174.600000116.2S68 T69G65-S68 PolarHBondContact O-N 3.38Å; G65-T69 VanDerWaalsContact O-CB 3.32Å; G65-T69 WeakPolarHBondContact O-CB 3.41Å; G65-T69 PolarHBondContact O-N 3.19Å; G65-T69 PolarHBondContact O-OG1 3.39Å
66K94.6Very high93.3Very high12 Ų1221.9 Ų21.95%0.05212%0.124CC..Hα-helixtrans-53.2-58.3179.7-55.5-175-63.6-85.50113.3L58 G60 P61 T69 I70 I154 C155 N156 F174L58-K66 HydrophobicContact CB-CB 4.33Å; G60-K66 PolarHBondContact O-NZ 3.29Å; P61-K66 PolarHBondContact O-NZ 3.23Å; K66-T69 WeakPolarHBondContact O-CB 3.45Å; K66-T69 PolarHBondContact O-N 2.84Å; K66-I70 PolarHBondContact O-N 2.96Å; K66-I154 HydrophobicContact CB-CG2 3.65Å; K66-I154 HydrophobicContact CD-CG2 3.91Å; K66-I154 HydrophobicContact CG-CG2 4.41Å; K66-C155 WeakPolarHBondContact CE-O 3.34Å; K66-N156 PolarHBondContact NZ-OD1 2.99Å; K66-F174 HydrophobicContact CD-CB 4.35Å; K66-F174 HydrophobicContact CG-CB 3.83Å; K66-F174 HydrophobicContact CG-CD1 4.07Å; K66-F174 HydrophobicContact CG-CD2 4.16Å; K66-F174 HydrophobicContact CG-CG 3.75Å
67T93.6Very high92.8Very high18 Ų1823.9 Ų23.911%0.1113%0.134CC..Hα-helixtrans-64.6-44-179.2-43.20000111.4T69 I70 L71 D125 I154T67-T69 VanDerWaalsContact C-N 3.28Å; T67-T69 PolarHBondContact O-N 2.95Å; T67-I70 WeakPolarHBondContact O-CG2 3.33Å; T67-I70 PolarHBondContact O-N 3.3Å; T67-L71 HydrophobicContact CG2-CD1 3.95Å; T67-L71 HydrophobicContact CG2-CG 4.42Å; T67-L71 WeakPolarHBondContact O-CB 3.45Å; T67-L71 VanDerWaalsContact O-CG 3.3Å; T67-L71 WeakPolarHBondContact O-CG 3.29Å; T67-L71 PolarHBondContact O-N 3.49Å; T67-D125 WeakPolarHBondContact CG2-OD2 3.28Å; T67-D125 PolarHBondContact OG1-OD2 2.8Å; T67-I154 HydrophobicContact CG2-CD1 4.32Å
68S92.7Very high92.4Very high20 Ų2024.6 Ų24.614%0.1414%0.137CC..Hα-helixtrans-59.4-38.8176.2-54.60000112.2G65 A72G65-S68 PolarHBondContact O-N 3.38Å; S68-A72 VanDerWaalsContact O-CB 3.29Å; S68-A72 WeakPolarHBondContact O-CB 3.39Å; S68-A72 PolarHBondContact O-N 2.81Å
69T93.4Very high91.7Very high3 Ų332.2 Ų32.22%0.01817%0.17CC..Hα-helixtrans-62.7-52.3179.7-59.70000112L31 L34 L41 I44 G65 K66 T67 L71 A72 C73 F174L31-T69 HydrophobicContact CD2-CG2 4.49Å; L34-T69 HydrophobicContact CD1-CG2 4.11Å; L41-T69 HydrophobicContact CD2-CG2 3.48Å; L41-T69 VanDerWaalsContact CD2-CG2 3.48Å; I44-T69 HydrophobicContact CD1-CG2 4.39Å; G65-T69 VanDerWaalsContact O-CB 3.32Å; G65-T69 WeakPolarHBondContact O-CB 3.41Å; G65-T69 PolarHBondContact O-N 3.19Å; G65-T69 PolarHBondContact O-OG1 3.39Å; K66-T69 WeakPolarHBondContact O-CB 3.45Å; K66-T69 PolarHBondContact O-N 2.84Å; T67-T69 VanDerWaalsContact C-N 3.28Å; T67-T69 PolarHBondContact O-N 2.95Å; T69-L71 VanDerWaalsContact C-N 3.35Å; T69-L71 PolarHBondContact O-N 3.06Å; T69-A72 PolarHBondContact O-N 3.31Å; T69-C73 PolarHBondContact O-N 3.45Å; T69-C73 PolarHBondContact O-SG 3.35Å; T69-F174 HydrophobicContact CG2-CE1 4.49Å; T69-F174 HydrophobicContact CG2-CZ 4.16Å
70I93.3Very high91Very high2 Ų236.9 Ų36.91%0.0120%0.198CC..Hα-helixtrans-70.1-34.1-178-170.365.9000112L56 L58 K66 T67 C73 A74 L121 I123 C152 I154L56-I70 HydrophobicContact CD1-CD1 4.07Å; L58-I70 HydrophobicContact CD1-CB 4.14Å; K66-I70 PolarHBondContact O-N 2.96Å; T67-I70 WeakPolarHBondContact O-CG2 3.33Å; T67-I70 PolarHBondContact O-N 3.3Å; I70-C73 HydrophobicContact CD1-CB 4.32Å; I70-C73 WeakPolarHBondContact O-CB 3.42Å; I70-C73 PolarHBondContact O-N 2.93Å; I70-A74 VanDerWaalsContact O-CB 3.3Å; I70-A74 WeakPolarHBondContact O-CB 3.4Å; I70-A74 PolarHBondContact O-N 3.35Å; I70-L121 HydrophobicContact CD1-CD2 4.34Å; I70-L121 HydrophobicContact CG1-CD2 4.43Å; I70-I123 HydrophobicContact CG1-CD1 3.85Å; I70-I123 HydrophobicContact CG1-CG1 4.01Å; I70-I123 HydrophobicContact CG2-CD1 4.08Å; I70-I123 HydrophobicContact CG2-CG2 3.92Å; I70-C152 HydrophobicContact CD1-CB 3.83Å; I70-C152 HydrophobicContact CG1-CB 3.77Å; I70-C152 VanDerWaalsContact CG1-SG 3.52Å; I70-I154 HydrophobicContact CG2-CD1 3.78Å
71L92.1Very high90.4Very high21 Ų2146.3 Ų46.311%0.1124%0.238CC..Hα-helixtrans-66-40.8175.9-72176.1000111.5T67 T69 A74 K75 F83 I123T67-L71 HydrophobicContact CG2-CD1 3.95Å; T67-L71 HydrophobicContact CG2-CG 4.42Å; T67-L71 WeakPolarHBondContact O-CB 3.45Å; T67-L71 VanDerWaalsContact O-CG 3.3Å; T67-L71 WeakPolarHBondContact O-CG 3.29Å; T67-L71 PolarHBondContact O-N 3.49Å; T69-L71 VanDerWaalsContact C-N 3.35Å; T69-L71 PolarHBondContact O-N 3.06Å; L71-A74 PolarHBondContact O-N 2.95Å; L71-K75 WeakPolarHBondContact O-CG 3.47Å; L71-K75 PolarHBondContact O-N 3.47Å; L71-F83 HydrophobicContact CD2-CZ 4.2Å; L71-I123 HydrophobicContact CD2-CD1 4Å
72A90.3Very high90Very high4 Ų446.3 Ų46.33%0.03323%0.233CC..Hα-helixtrans-64-4217300000111.8L31 S68 T69 A74 K75 Q76L31-A72 HydrophobicContact CD2-CB 3.66Å; L31-A72 HydrophobicContact CG-CB 4.09Å; S68-A72 VanDerWaalsContact O-CB 3.29Å; S68-A72 WeakPolarHBondContact O-CB 3.39Å; S68-A72 PolarHBondContact O-N 2.81Å; T69-A72 PolarHBondContact O-N 3.31Å; A72-A74 VanDerWaalsContact C-N 3.33Å; A72-A74 PolarHBondContact O-N 3.01Å; A72-K75 PolarHBondContact O-N 3.17Å; A72-Q76 PolarHBondContact O-N 2.91Å; A72-Q76 VanDerWaalsContact O-N 3.11Å
73C89.6Confident89.7Confident1 Ų145.5 Ų45.51%0.00722%0.223CC..Hα-helixtrans-59.4-43.8172.4-68.10000111.6L31 I44 I48 T69 I70 K75 Q76 L77L31-C73 VanDerWaalsContact CD2-SG 3.51Å; I44-C73 VanDerWaalsContact CG2-SG 3.53Å; I48-C73 HydrophobicContact CD1-CB 4.01Å; T69-C73 PolarHBondContact O-N 3.45Å; T69-C73 PolarHBondContact O-SG 3.35Å; I70-C73 HydrophobicContact CD1-CB 4.32Å; I70-C73 WeakPolarHBondContact O-CB 3.42Å; I70-C73 PolarHBondContact O-N 2.93Å; C73-K75 PolarHBondContact O-N 2.95Å; C73-Q76 WeakPolarHBondContact O-CB 3.44Å; C73-Q76 PolarHBondContact O-N 2.81Å; C73-Q76 VanDerWaalsContact O-N 3.17Å; C73-L77 WeakPolarHBondContact O-CB 3.34Å; C73-L77 WeakPolarHBondContact O-CG 3.44Å; C73-L77 PolarHBondContact O-N 2.81Å
74A90.8Very high89.3Confident0 Ų048.6 Ų48.60%026%0.255CS..Hα-helixtrans-64.7-39.1-179.200000111.9I70 L71 A72 Q76 L77 Y78 F83 V87 L121 I123I70-A74 VanDerWaalsContact O-CB 3.3Å; I70-A74 WeakPolarHBondContact O-CB 3.4Å; I70-A74 PolarHBondContact O-N 3.35Å; L71-A74 PolarHBondContact O-N 2.95Å; A72-A74 VanDerWaalsContact C-N 3.33Å; A72-A74 PolarHBondContact O-N 3.01Å; A74-Q76 VanDerWaalsContact C-N 3.29Å; A74-Q76 PolarHBondContact O-N 2.89Å; A74-L77 PolarHBondContact O-N 3.45Å; A74-Y78 WeakPolarHBondContact O-CD2 3.3Å; A74-Y78 PolarHBondContact O-N 3.28Å; A74-F83 HydrophobicContact CB-CE2 3.67Å; A74-F83 HydrophobicContact CB-CZ 4.27Å; A74-V87 HydrophobicContact CB-CG2 4.19Å; A74-L121 HydrophobicContact CB-CD2 3.76Å; A74-I123 HydrophobicContact CB-CD1 4.46Å
75K89.3Confident89.1Confident84 Ų8450.6 Ų50.637%0.36527%0.269SS..Hα-helixtrans-66.8-28.3173.5-73176.21791780113.4L71 A72 C73 Y78 F83L71-K75 WeakPolarHBondContact O-CG 3.47Å; L71-K75 PolarHBondContact O-N 3.47Å; A72-K75 PolarHBondContact O-N 3.17Å; C73-K75 PolarHBondContact O-N 2.95Å; K75-Y78 CarbonylContact C-O 3.53Å; K75-F83 HydrophobicContact CG-CD2 4.36Å; K75-F83 HydrophobicContact CG-CE2 3.99Å
76Q86.6Confident89Confident96 Ų9649.8 Ų49.845%0.44926%0.26SS..Hα-helixtrans-77.5-37.5173.4-171.9-175.515.800111.9Q45 A72 C73 A74Q45-Q76 VanDerWaalsContact OE1-OE1 3.06Å; A72-Q76 PolarHBondContact O-N 2.91Å; A72-Q76 VanDerWaalsContact O-N 3.11Å; C73-Q76 WeakPolarHBondContact O-CB 3.44Å; C73-Q76 PolarHBondContact O-N 2.81Å; C73-Q76 VanDerWaalsContact O-N 3.17Å; A74-Q76 VanDerWaalsContact C-N 3.29Å; A74-Q76 PolarHBondContact O-N 2.89Å
77L86.9Confident88.9Confident45 Ų4549.7 Ų49.724%0.23626%0.261CS..Hα-helixtrans-71.6-40.5178.7-79.6166.3000112.8I48 L53 C73 A74 F119I48-L77 HydrophobicContact CB-CD2 4.33Å; I48-L77 HydrophobicContact CD1-CD1 4.19Å; I48-L77 HydrophobicContact CD1-CG 4.17Å; I48-L77 HydrophobicContact CG1-CD1 4.25Å; I48-L77 HydrophobicContact CG1-CD2 4.08Å; I48-L77 HydrophobicContact CG1-CG 4.23Å; I48-L77 HydrophobicContact CG2-CD2 3.61Å; I48-L77 HydrophobicContact CG2-CG 4.19Å; L53-L77 HydrophobicContact CD2-CD1 3.96Å; C73-L77 WeakPolarHBondContact O-CB 3.34Å; C73-L77 WeakPolarHBondContact O-CG 3.44Å; C73-L77 PolarHBondContact O-N 2.81Å; A74-L77 PolarHBondContact O-N 3.45Å; L77-F119 HydrophobicContact CD1-CE2 4.42Å; L77-F119 HydrophobicContact CD1-CZ 4.41Å; L77-F119 HydrophobicContact CD2-CZ 4.18Å
78Y88.5Confident89Confident15 Ų1550.5 Ų50.56%0.05926%0.264CS..SBendtrans-122.6135.3-174-51.8-69000110.6A74 K75 M86 V87 F119 L121A74-Y78 WeakPolarHBondContact O-CD2 3.3Å; A74-Y78 PolarHBondContact O-N 3.28Å; K75-Y78 CarbonylContact C-O 3.53Å; Y78-M86 HydrophobicContact CD1-CB 3.57Å; Y78-M86 HydrophobicContact CD1-CE 4.29Å; Y78-M86 HydrophobicContact CD1-CG 3.98Å; Y78-M86 HydrophobicContact CD2-CB 4.37Å; Y78-M86 HydrophobicContact CE1-CB 3.69Å; Y78-M86 HydrophobicContact CE1-CE 3.71Å; Y78-M86 HydrophobicContact CE1-CG 4.2Å; Y78-M86 HydrophobicContact CE2-CB 4.46Å; Y78-M86 HydrophobicContact CG-CB 3.93Å; Y78-V87 HydrophobicContact CD2-CG2 3.33Å; Y78-V87 HydrophobicContact CE2-CG2 3.63Å; Y78-V87 HydrophobicContact CG-CG2 4.23Å; Y78-F119 WeakPolarHBondContact CE1-O 3.42Å; Y78-F119 WeakPolarHBondContact OH-CD2 3.42Å; Y78-F119 WeakPolarHBondContact OH-CE2 3.05Å; Y78-F119 PolarHBondContact OH-O 2.61Å; Y78-L121 HydrophobicContact CE2-CB 3.76Å; Y78-L121 HydrophobicContact CE2-CD2 4.29Å; Y78-L121 PolarHBondContact OH-N 3.45Å
79K84.6Confident89Confident161 Ų16154.1 Ų54.170%0.728%0.279SS*.  trans-65.6156.4172.9-60.8177.1-179177.30110.1K81 E82 F83K79-K81 VanDerWaalsContact C-N 3.25Å; K79-K81 PolarHBondContact O-N 2.75Å; K79-K81 VanDerWaalsContact O-N 3.12Å; K79-E82 HydrophobicContact CB-CG 4.18Å; K79-E82 WeakPolarHBondContact O-CA 3.26Å; K79-E82 WeakPolarHBondContact O-CB 3.3Å; K79-E82 PolarHBondContact O-N 2.84Å; K79-F83 PolarHBondContact O-N 2.91Å
80D83Confident89Confident140 Ų14055.6 Ų55.675%0.74929%0.286SS*.Hα-helixtrans-53-40.2-177.8-62.1-38.8000113.6E82 F83D80-E82 PolarHBondContact O-N 2.81Å; D80-F83 PolarHBondContact O-N 2.81Å
81K83.8Confident88.8Confident203 Ų20358 Ų5888%0.88330%0.299SS*.Hα-helixtrans-66.6-18.7177.1-64.9-174.7179.6-178.40113.5K79K79-K81 VanDerWaalsContact C-N 3.25Å; K79-K81 PolarHBondContact O-N 2.75Å; K79-K81 VanDerWaalsContact O-N 3.12Å
82E85.2Confident88.3Confident54 Ų5457 Ų5725%0.25229%0.294SS..Hα-helixtrans-100.7-24.4-176.6-50.3-170.5119.400112.8K79 D80 G84 S85 M86 K116K79-E82 HydrophobicContact CB-CG 4.18Å; K79-E82 WeakPolarHBondContact O-CA 3.26Å; K79-E82 WeakPolarHBondContact O-CB 3.3Å; K79-E82 PolarHBondContact O-N 2.84Å; D80-E82 PolarHBondContact O-N 2.81Å; E82-G84 PolarHBondContact O-N 3.04Å; E82-S85 PolarHBondContact O-N 2.77Å; E82-S85 PolarHBondContact O-OG 3.28Å; E82-M86 HydrophobicContact CB-CG 4.19Å; E82-M86 WeakPolarHBondContact O-CB 3.37Å; E82-M86 WeakPolarHBondContact O-CG 3.45Å; E82-M86 PolarHBondContact O-N 3.24Å; E82-K116 VanDerWaalsContact CA-NZ 3.33Å; E82-K116 HydrophobicContact CB-CD 4.43Å; E82-K116 VanDerWaalsContact CB-NZ 3.31Å; E82-K116 HydrophobicContact CG-CD 4.3Å; E82-K116 VanDerWaalsContact CG-NZ 3.29Å; E82-K116 WeakPolarHBondContact OE1-CD 3.33Å; E82-K116 WeakPolarHBondContact OE1-CE 3.43Å; E82-K116 IonicContact OE1-NZ 3.13Å
83F86.4Confident87.8Confident45 Ų4559 Ų5920%0.19731%0.308CS..Hα-helixtrans-48.2-54.3-175.9-162.8-86.7000112.1L71 A74 K75 K79 D80 S85 M86 V87L71-F83 HydrophobicContact CD2-CZ 4.2Å; A74-F83 HydrophobicContact CB-CE2 3.67Å; A74-F83 HydrophobicContact CB-CZ 4.27Å; K75-F83 HydrophobicContact CG-CD2 4.36Å; K75-F83 HydrophobicContact CG-CE2 3.99Å; K79-F83 PolarHBondContact O-N 2.91Å; D80-F83 PolarHBondContact O-N 2.81Å; F83-S85 PolarHBondContact O-N 2.87Å; F83-M86 PolarHBondContact O-N 3.11Å; F83-V87 HydrophobicContact CD1-CB 4.21Å; F83-V87 HydrophobicContact CD1-CG2 4.47Å; F83-V87 HydrophobicContact CD2-CB 4.5Å; F83-V87 HydrophobicContact CD2-CG2 3.92Å; F83-V87 HydrophobicContact CE1-CB 4.07Å; F83-V87 HydrophobicContact CE1-CG1 4.09Å; F83-V87 HydrophobicContact CE1-CG2 4.47Å; F83-V87 HydrophobicContact CE2-CB 4.39Å; F83-V87 HydrophobicContact CE2-CG1 4.44Å; F83-V87 HydrophobicContact CE2-CG2 3.94Å; F83-V87 HydrophobicContact CG-CB 4.42Å; F83-V87 HydrophobicContact CG-CG2 4.2Å; F83-V87 HydrophobicContact CZ-CB 4.17Å; F83-V87 HydrophobicContact CZ-CG1 3.94Å; F83-V87 HydrophobicContact CZ-CG2 4.22Å; F83-V87 WeakPolarHBondContact O-CA 3.28Å; F83-V87 WeakPolarHBondContact O-CB 3.2Å; F83-V87 PolarHBondContact O-N 2.8Å
84G85.2Confident87.2Confident75 Ų7565.3 Ų65.377%0.77334%0.342SS*.Hα-helixtrans-65.6-13.9-17900000115.8E82E82-G84 PolarHBondContact O-N 3.04Å
85S87.9Confident86.3Confident44 Ų4468.9 Ų68.931%0.30836%0.361SS..Hα-helixtrans-104.9-21.1177.764.40000113.8E82 F83 K116E82-S85 PolarHBondContact O-N 2.77Å; E82-S85 PolarHBondContact O-OG 3.28Å; F83-S85 PolarHBondContact O-N 2.87Å; S85-K116 PolarHBondContact OG-NZ 3.03Å
86M91Very high85.6Confident3 Ų372.3 Ų72.32%0.01537%0.371CS..Hα-helixtrans-111.9-18.1-173.4-65.3-62.6-69.700112.7Y78 E82 F83 T113 K116 F119 K120 L121Y78-M86 HydrophobicContact CD1-CB 3.57Å; Y78-M86 HydrophobicContact CD1-CE 4.29Å; Y78-M86 HydrophobicContact CD1-CG 3.98Å; Y78-M86 HydrophobicContact CD2-CB 4.37Å; Y78-M86 HydrophobicContact CE1-CB 3.69Å; Y78-M86 HydrophobicContact CE1-CE 3.71Å; Y78-M86 HydrophobicContact CE1-CG 4.2Å; Y78-M86 HydrophobicContact CE2-CB 4.46Å; Y78-M86 HydrophobicContact CG-CB 3.93Å; E82-M86 HydrophobicContact CB-CG 4.19Å; E82-M86 WeakPolarHBondContact O-CB 3.37Å; E82-M86 WeakPolarHBondContact O-CG 3.45Å; E82-M86 PolarHBondContact O-N 3.24Å; F83-M86 PolarHBondContact O-N 3.11Å; M86-T113 HydrophobicContact SD-CG2 3.88Å; M86-T113 PolarHBondContact SD-OG1 2.99Å; M86-T113 VanDerWaalsContact SD-OG1 3.39Å; M86-K116 HydrophobicContact CG-CD 4Å; M86-K116 HydrophobicContact SD-CB 4.23Å; M86-K116 HydrophobicContact SD-CD 3.9Å; M86-F119 VanDerWaalsContact CE-O 3.3Å; M86-F119 WeakPolarHBondContact CE-O 3.4Å; M86-K120 HydrophobicContact CE-CG 4.29Å; M86-K120 CarbonylContact O-C 3.6Å; M86-K120 WeakPolarHBondContact O-CA 3.37Å; M86-K120 HydrophobicContact SD-CG 4.34Å; M86-L121 PolarHBondContact O-N 3Å
87V93.6Very high85.3Confident10 Ų1068.9 Ų68.96%0.06136%0.361CS..EExtended strand (participates in β ladder)trans-118127178.2-173.20000109.3A74 Y78 F83 L121 I123A74-V87 HydrophobicContact CB-CG2 4.19Å; Y78-V87 HydrophobicContact CD2-CG2 3.33Å; Y78-V87 HydrophobicContact CE2-CG2 3.63Å; Y78-V87 HydrophobicContact CG-CG2 4.23Å; F83-V87 HydrophobicContact CD1-CB 4.21Å; F83-V87 HydrophobicContact CD1-CG2 4.47Å; F83-V87 HydrophobicContact CD2-CB 4.5Å; F83-V87 HydrophobicContact CD2-CG2 3.92Å; F83-V87 HydrophobicContact CE1-CB 4.07Å; F83-V87 HydrophobicContact CE1-CG1 4.09Å; F83-V87 HydrophobicContact CE1-CG2 4.47Å; F83-V87 HydrophobicContact CE2-CB 4.39Å; F83-V87 HydrophobicContact CE2-CG1 4.44Å; F83-V87 HydrophobicContact CE2-CG2 3.94Å; F83-V87 HydrophobicContact CG-CB 4.42Å; F83-V87 HydrophobicContact CG-CG2 4.2Å; F83-V87 HydrophobicContact CZ-CB 4.17Å; F83-V87 HydrophobicContact CZ-CG1 3.94Å; F83-V87 HydrophobicContact CZ-CG2 4.22Å; F83-V87 WeakPolarHBondContact O-CA 3.28Å; F83-V87 WeakPolarHBondContact O-CB 3.2Å; F83-V87 PolarHBondContact O-N 2.8Å; V87-L121 CarbonylContact C-O 3.6Å; V87-L121 VanDerWaalsContact CA-O 3.28Å; V87-L121 WeakPolarHBondContact CA-O 3.47Å; V87-L121 HydrophobicContact CG2-CB 4.46Å; V87-I123 HydrophobicContact CG1-CD1 3.9Å; V87-I123 HydrophobicContact CG1-CG1 4.39Å
88L94.1Very high85.3Confident34 Ų3468.7 Ų68.718%0.17836%0.36CS..EExtended strand (participates in β ladder)trans-112.9107.8168.9175.864.2000108.2L90 F108 L121 V122 I123L88-L90 HydrophobicContact CD1-CD1 4.34Å; L88-L90 HydrophobicContact CD1-CD2 4.24Å; L88-L90 HydrophobicContact CD1-CG 4.06Å; L88-L90 HydrophobicContact CD2-CD1 3.84Å; L88-L90 HydrophobicContact CD2-CG 4.39Å; L88-L90 HydrophobicContact CG-CD1 3.98Å; L88-L90 HydrophobicContact CG-CG 3.98Å; L88-F108 HydrophobicContact CB-CD1 3.71Å; L88-F108 HydrophobicContact CB-CD2 4.05Å; L88-F108 HydrophobicContact CB-CE1 3.61Å; L88-F108 HydrophobicContact CB-CE2 3.99Å; L88-F108 HydrophobicContact CB-CG 3.91Å; L88-F108 HydrophobicContact CB-CZ 3.76Å; L88-F108 HydrophobicContact CD2-CB 3.64Å; L88-F108 HydrophobicContact CD2-CD1 3.96Å; L88-F108 HydrophobicContact CD2-CD2 4.36Å; L88-F108 HydrophobicContact CD2-CG 3.74Å; L88-F108 HydrophobicContact CG-CG 4.41Å; L88-L121 PolarHBondContact N-O 3.38Å; L88-V122 HydrophobicContact CB-CG2 4.39Å; L88-V122 CarbonylContact O-C 3.59Å; L88-V122 WeakPolarHBondContact O-CA 3.38Å; L88-I123 PolarHBondContact O-N 2.91Å
89E94.1Very high85.3Confident96 Ų9673.2 Ų73.245%0.44939%0.385SS..EExtended strand (participates in β ladder)trans-94.8126.9171.5-176.7-176.2-178.200109.1
90L92.2Very high85.4Confident35 Ų3566.2 Ų66.218%0.18336%0.355CS..EExtended strand (participates in β ladder)trans-135.4133.6176-69169.5000108.8L88 I100 I105 I123 L124 D125L88-L90 HydrophobicContact CD1-CD1 4.34Å; L88-L90 HydrophobicContact CD1-CD2 4.24Å; L88-L90 HydrophobicContact CD1-CG 4.06Å; L88-L90 HydrophobicContact CD2-CD1 3.84Å; L88-L90 HydrophobicContact CD2-CG 4.39Å; L88-L90 HydrophobicContact CG-CD1 3.98Å; L88-L90 HydrophobicContact CG-CG 3.98Å; L90-I100 HydrophobicContact CB-CD1 4.38Å; L90-I100 HydrophobicContact CD1-CD1 4.11Å; L90-I100 HydrophobicContact CD1-CG1 4.17Å; L90-I100 HydrophobicContact CD2-CD1 4.39Å; L90-I105 HydrophobicContact CD1-CD1 3.96Å; L90-I105 HydrophobicContact CD1-CG1 3.48Å; L90-I105 VanDerWaalsContact CD1-CG1 3.48Å; L90-I123 PolarHBondContact N-O 3.49Å; L90-L124 HydrophobicContact CB-CD2 3.89Å; L90-L124 HydrophobicContact CD1-CD2 4.22Å; L90-L124 WeakPolarHBondContact O-CA 3.5Å; L90-D125 PolarHBondContact O-N 2.93Å
91N90.5Very high85.8Confident52 Ų5259.5 Ų59.528%0.27832%0.32SS..EExtended strand (participates in β ladder)trans-91.3117.6168.1-169.2-8.5000109.2S93 D94N91-S93 PolarHBondContact ND2-OG 3.47Å; N91-S93 PolarHBondContact O-N 2.85Å; N91-S93 PolarHBondContact OD1-N 3.43Å; N91-S93 PolarHBondContact OD1-OG 2.93Å; N91-D94 PolarHBondContact O-N 2.91Å
92A80.6Confident86Confident1 Ų157.1 Ų57.11%0.00831%0.305CS..THydrogen-bonded Turntrans-72.5-9.4-177.400000113.5D94 D95 R96 D125 M130A92-D94 VanDerWaalsContact C-N 3.33Å; A92-D95 CarbonylContact O-C 3.57Å; A92-R96 WeakPolarHBondContact O-CG 3.08Å; A92-D125 VanDerWaalsContact CB-O 3.31Å; A92-D125 WeakPolarHBondContact CB-O 3.19Å; A92-D125 PolarHBondContact N-O 3.47Å; A92-M130 HydrophobicContact CB-CG 3.56Å; A92-M130 HydrophobicContact CB-SD 4.26Å
93S79Confident86.3Confident45 Ų4556 Ų5632%0.31531%0.307SS..THydrogen-bonded Turntrans-68.8-31.8171.164.40000113.2N91 E126N91-S93 PolarHBondContact ND2-OG 3.47Å; N91-S93 PolarHBondContact O-N 2.85Å; N91-S93 PolarHBondContact OD1-N 3.43Å; N91-S93 PolarHBondContact OD1-OG 2.93Å; S93-E126 VanDerWaalsContact CB-OE2 3.31Å; S93-E126 WeakPolarHBondContact CB-OE2 3.25Å
94D77.7Confident86.6Confident134 Ų13456.8 Ų56.872%0.71732%0.317SS*.THydrogen-bonded Turntrans-73.9-36.2-172.8-62.5-16.3000111.2N91 A92N91-D94 PolarHBondContact O-N 2.91Å; A92-D94 VanDerWaalsContact C-N 3.33Å
95D72.3Confident87Confident75 Ų7553.2 Ų53.240%0.40128%0.28SS..  trans-143.4108.4171.4-171.7-8.1000110.5A92 G97 I100A92-D95 CarbonylContact O-C 3.57Å; D95-G97 VanDerWaalsContact C-N 3.32Å; D95-G97 PolarHBondContact OD1-N 3.49Å; D95-I100 HydrophobicContact CB-CD1 4.32Å
96R74.9Confident87.2Confident156 Ų15654 Ų5459%0.58928%0.281SS*.  trans-87.8-3.7-176.5-60.1179.1-68.6174.6-1112.9A92 A129 T131A92-R96 WeakPolarHBondContact O-CG 3.08Å; R96-A129 VanDerWaalsContact CD-O 3.31Å; R96-A129 WeakPolarHBondContact CD-O 3.13Å; R96-A129 HydrophobicContact CG-CB 4.42Å; R96-A129 WeakPolarHBondContact CG-O 3.36Å; R96-T131 PolarHBondContact O-N 3.42Å; R96-T131 PolarHBondContact O-OG1 3.41Å
97G79Confident87.3Confident23 Ų2357.1 Ų57.124%0.23730%0.303CS..SBendtrans-74.7165.8-171.400000113.4D95 D99 I100D95-G97 VanDerWaalsContact C-N 3.32Å; D95-G97 PolarHBondContact OD1-N 3.49Å; G97-D99 PolarHBondContact O-N 2.83Å; G97-I100 VanDerWaalsContact O-CG2 3.31Å; G97-I100 WeakPolarHBondContact O-CG2 3.44Å
98I87.7Confident87.3Confident42 Ų4258.1 Ų58.122%0.21531%0.306CS..Hα-helixtrans-68.1-19.6172.5-169.3164000112.3V101 R102 D133 A137I98-V101 WeakPolarHBondContact O-CB 3.26Å; I98-V101 PolarHBondContact O-N 2.86Å; I98-V101 VanDerWaalsContact O-N 3.16Å; I98-R102 VanDerWaalsContact CD1-CZ 3.48Å; I98-R102 HydrophobicContact CG1-CG 4.3Å; I98-R102 PolarHBondContact O-N 2.9Å; I98-R102 VanDerWaalsContact O-N 3.08Å; I98-D133 HydrophobicContact CD1-CB 4.44Å; I98-A137 HydrophobicContact CD1-CB 3.93Å; I98-A137 HydrophobicContact CG1-CB 3.84Å
99D88Confident87.2Confident109 Ų10956.5 Ų56.558%0.58330%0.298SS*.Hα-helixtrans-71-33.4-173.7-62.8-35.8000112.5G97 V101 R102 G103G97-D99 PolarHBondContact O-N 2.83Å; D99-V101 PolarHBondContact O-N 3.32Å; D99-R102 PolarHBondContact O-N 2.73Å; D99-G103 WeakPolarHBondContact O-CA 3.1Å; D99-G103 PolarHBondContact O-N 3.41Å
100I88.1Confident87Confident14 Ų1454.7 Ų54.77%0.07230%0.296CS..Hα-helixtrans-59-35.3171.5-162.5175.2000111.5L90 D95 G97 P104 I105L90-I100 HydrophobicContact CB-CD1 4.38Å; L90-I100 HydrophobicContact CD1-CD1 4.11Å; L90-I100 HydrophobicContact CD1-CG1 4.17Å; L90-I100 HydrophobicContact CD2-CD1 4.39Å; D95-I100 HydrophobicContact CB-CD1 4.32Å; G97-I100 VanDerWaalsContact O-CG2 3.31Å; G97-I100 WeakPolarHBondContact O-CG2 3.44Å; I100-P104 HydrophobicContact CG1-CG 3.83Å; I100-P104 WeakPolarHBondContact O-CD 3.28Å; I100-P104 VanDerWaalsContact O-CG 3.23Å; I100-P104 WeakPolarHBondContact O-CG 3.43Å; I100-I105 WeakPolarHBondContact O-CG1 3.42Å; I100-I105 PolarHBondContact O-N 3.15Å
101V89.6Confident86.7Confident0 Ų056.5 Ų56.50%031%0.309CS..Iπ-helixtrans-74-44.7178.7-177.20000110.9I98 D99 I105 L106 M130 A134 A137 L138 V141I98-V101 WeakPolarHBondContact O-CB 3.26Å; I98-V101 PolarHBondContact O-N 2.86Å; I98-V101 VanDerWaalsContact O-N 3.16Å; D99-V101 PolarHBondContact O-N 3.32Å; V101-I105 HydrophobicContact CG2-CD1 4.28Å; V101-L106 VanDerWaalsContact O-CB 3.31Å; V101-L106 WeakPolarHBondContact O-CB 3.38Å; V101-L106 PolarHBondContact O-N 2.98Å; V101-L106 VanDerWaalsContact O-N 3.08Å; V101-M130 HydrophobicContact CG2-CE 3.58Å; V101-A134 HydrophobicContact CG2-CB 4.19Å; V101-A137 HydrophobicContact CB-CB 4.33Å; V101-A137 HydrophobicContact CG1-CB 3.87Å; V101-L138 HydrophobicContact CG1-CB 4.02Å; V101-L138 HydrophobicContact CG1-CD1 4.43Å; V101-L138 HydrophobicContact CG2-CB 4.22Å; V101-V141 HydrophobicContact CG1-CG2 4.01Å
102R89.7Confident85.9Confident153 Ų15364 Ų6458%0.57733%0.333SS*.Iπ-helixtrans-77.3-22.3-177.3-69.3179.4175.2172.3-0.3113.6I98 D99I98-R102 VanDerWaalsContact CD1-CZ 3.48Å; I98-R102 HydrophobicContact CG1-CG 4.3Å; I98-R102 PolarHBondContact O-N 2.9Å; I98-R102 VanDerWaalsContact O-N 3.08Å; D99-R102 PolarHBondContact O-N 2.73Å
103G91.6Very high85.3Confident29 Ų2965.9 Ų65.930%0.29935%0.345SS..Iπ-helixtrans-95.8-96.6179.800000112D99 I105 S107D99-G103 WeakPolarHBondContact O-CA 3.1Å; D99-G103 PolarHBondContact O-N 3.41Å; G103-I105 PolarHBondContact O-N 3.03Å; G103-S107 VanDerWaalsContact O-CB 3.26Å; G103-S107 WeakPolarHBondContact O-CB 3.25Å; G103-S107 PolarHBondContact O-N 3.01Å; G103-S107 PolarHBondContact O-OG 3.03Å
104P91.6Very high84.3Confident62 Ų6270.7 Ų70.740%0.40337%0.365SS..Iπ-helixtrans-62.3-44.4-170.721.8-31.7000113I100 S107 F108I100-P104 HydrophobicContact CG1-CG 3.83Å; I100-P104 WeakPolarHBondContact O-CD 3.28Å; I100-P104 VanDerWaalsContact O-CG 3.23Å; I100-P104 WeakPolarHBondContact O-CG 3.43Å; P104-S107 PolarHBondContact O-N 3.28Å; P104-F108 VanDerWaalsContact O-CB 3.25Å; P104-F108 WeakPolarHBondContact O-CB 3.48Å; P104-F108 PolarHBondContact O-N 3.12Å
105I93.1Very high83.4Confident0 Ų073.6 Ų73.60%037%0.372CS..Iπ-helixtrans-65.4-49.9-177.4-62.8175.1000110.9L90 I100 V101 G103 S107 F108 A109 L124 L138 V141 F151L90-I105 HydrophobicContact CD1-CD1 3.96Å; L90-I105 HydrophobicContact CD1-CG1 3.48Å; L90-I105 VanDerWaalsContact CD1-CG1 3.48Å; I100-I105 WeakPolarHBondContact O-CG1 3.42Å; I100-I105 PolarHBondContact O-N 3.15Å; V101-I105 HydrophobicContact CG2-CD1 4.28Å; G103-I105 PolarHBondContact O-N 3.03Å; I105-S107 PolarHBondContact O-N 2.97Å; I105-F108 PolarHBondContact O-N 2.68Å; I105-A109 WeakPolarHBondContact O-CB 3.36Å; I105-A109 PolarHBondContact O-N 2.83Å; I105-L124 HydrophobicContact CD1-CD1 4.2Å; I105-L124 HydrophobicContact CD1-CD2 3.62Å; I105-L124 HydrophobicContact CD1-CG 4.48Å; I105-L138 HydrophobicContact CD1-CD1 4.47Å; I105-L138 HydrophobicContact CG2-CD1 4.13Å; I105-V141 HydrophobicContact CG2-CG1 4.32Å; I105-F151 HydrophobicContact CG2-CE1 3.74Å; I105-F151 HydrophobicContact CG2-CZ 4.24Å
106L93.8Very high82.9Confident60 Ų6072.9 Ų72.931%0.31437%0.365SS..Hα-helixtrans-62.2-41.9178.9179.560.4000112V101 A109 S110 V141 F145V101-L106 VanDerWaalsContact O-CB 3.31Å; V101-L106 WeakPolarHBondContact O-CB 3.38Å; V101-L106 PolarHBondContact O-N 2.98Å; V101-L106 VanDerWaalsContact O-N 3.08Å; L106-A109 PolarHBondContact O-N 2.86Å; L106-S110 VanDerWaalsContact O-CB 3.22Å; L106-S110 WeakPolarHBondContact O-CB 3.4Å; L106-S110 PolarHBondContact O-N 3.45Å; L106-S110 PolarHBondContact O-OG 3.3Å; L106-V141 HydrophobicContact CD1-CG1 4.47Å; L106-V141 HydrophobicContact CD1-CG2 4.23Å; L106-F145 HydrophobicContact CD1-CD2 4.44Å; L106-F145 HydrophobicContact CD1-CE2 3.44Å; L106-F145 VanDerWaalsContact CD1-CE2 3.44Å; L106-F145 HydrophobicContact CD1-CZ 3.96Å
107S93.2Very high82.5Confident69 Ų6975.8 Ų75.848%0.48338%0.382SS..Hα-helixtrans-64.5-41.4178.4-59.50000111.6G103 P104 I105 S110 T111G103-S107 VanDerWaalsContact O-CB 3.26Å; G103-S107 WeakPolarHBondContact O-CB 3.25Å; G103-S107 PolarHBondContact O-N 3.01Å; G103-S107 PolarHBondContact O-OG 3.03Å; P104-S107 PolarHBondContact O-N 3.28Å; I105-S107 PolarHBondContact O-N 2.97Å; S107-S110 PolarHBondContact O-OG 3.17Å; S107-T111 VanDerWaalsContact O-CG2 3.28Å; S107-T111 WeakPolarHBondContact O-CG2 3.43Å; S107-T111 PolarHBondContact O-N 3.43Å; S107-T111 PolarHBondContact O-OG1 3.29Å
108F93Very high82.4Confident31 Ų3177.3 Ų77.314%0.13640%0.398CS..Hα-helixtrans-68.5-44177.8-175-98.6000112.5L88 P104 I105 T111 K120 V122L88-F108 HydrophobicContact CB-CD1 3.71Å; L88-F108 HydrophobicContact CB-CD2 4.05Å; L88-F108 HydrophobicContact CB-CE1 3.61Å; L88-F108 HydrophobicContact CB-CE2 3.99Å; L88-F108 HydrophobicContact CB-CG 3.91Å; L88-F108 HydrophobicContact CB-CZ 3.76Å; L88-F108 HydrophobicContact CD2-CB 3.64Å; L88-F108 HydrophobicContact CD2-CD1 3.96Å; L88-F108 HydrophobicContact CD2-CD2 4.36Å; L88-F108 HydrophobicContact CD2-CG 3.74Å; L88-F108 HydrophobicContact CG-CG 4.41Å; P104-F108 VanDerWaalsContact O-CB 3.25Å; P104-F108 WeakPolarHBondContact O-CB 3.48Å; P104-F108 PolarHBondContact O-N 3.12Å; I105-F108 PolarHBondContact O-N 2.68Å; F108-T111 PolarHBondContact O-OG1 2.73Å; F108-T111 VanDerWaalsContact O-OG1 3.04Å; F108-K120 HydrophobicContact CD1-CD 4.15Å; F108-K120 HydrophobicContact CE1-CB 3.73Å; F108-K120 HydrophobicContact CE1-CD 3.8Å; F108-K120 HydrophobicContact CE1-CG 4.3Å; F108-K120 HydrophobicContact CE2-CD 4.3Å; F108-K120 HydrophobicContact CZ-CB 4.1Å; F108-K120 HydrophobicContact CZ-CD 3.87Å; F108-K120 HydrophobicContact CZ-CG 4.32Å; F108-K120 WeakPolarHBondContact O-CD 3.45Å; F108-K120 PolarHBondContact O-NZ 2.94Å; F108-V122 HydrophobicContact CD1-CG2 3.58Å; F108-V122 HydrophobicContact CE1-CG2 3.8Å
109A91.7Very high82.4Confident0 Ų076 Ų760%039%0.391CS..Hα-helixtrans-70.7-30.9-179.600000113.1I105 L106 V141 F145 N148 T149 F151I105-A109 WeakPolarHBondContact O-CB 3.36Å; I105-A109 PolarHBondContact O-N 2.83Å; L106-A109 PolarHBondContact O-N 2.86Å; A109-V141 HydrophobicContact CB-CG1 4.15Å; A109-F145 HydrophobicContact CB-CB 4.05Å; A109-F145 HydrophobicContact CB-CD2 4.01Å; A109-F145 HydrophobicContact CB-CG 4.03Å; A109-N148 PolarHBondContact O-ND2 3.5Å; A109-T149 WeakPolarHBondContact CA-OG1 3.29Å; A109-T149 HydrophobicContact CB-CG2 4.23Å; A109-T149 PolarHBondContact O-OG1 3.34Å; A109-F151 HydrophobicContact CB-CZ 4.28Å
110S90.1Very high82.7Confident59 Ų5971.4 Ų71.441%0.41337%0.365SS..Hα-helixtrans-81.9-23.1-179.459.50000114.1L106 S107L106-S110 VanDerWaalsContact O-CB 3.22Å; L106-S110 WeakPolarHBondContact O-CB 3.4Å; L106-S110 PolarHBondContact O-N 3.45Å; L106-S110 PolarHBondContact O-OG 3.3Å; S107-S110 PolarHBondContact O-OG 3.17Å
111T86Confident83Confident72 Ų7270.8 Ų70.844%0.44236%0.362SS..  trans-79.7130.7-179.944.70000111.1S107 F108 K120S107-T111 VanDerWaalsContact O-CG2 3.28Å; S107-T111 WeakPolarHBondContact O-CG2 3.43Å; S107-T111 PolarHBondContact O-N 3.43Å; S107-T111 PolarHBondContact O-OG1 3.29Å; F108-T111 PolarHBondContact O-OG1 2.73Å; F108-T111 VanDerWaalsContact O-OG1 3.04Å; T111-K120 WeakPolarHBondContact O-CE 3.2Å; T111-K120 PolarHBondContact O-NZ 3.33Å; T111-K120 PolarHBondContact OG1-NZ 3.48Å
112R73.3Confident83.3Confident209 Ų20970.8 Ų70.879%0.78936%0.362SS*.  trans-88.3131.4169.2-70.6-175.2177.6178.4-1.7109.6I114R112-I114 PolarHBondContact O-N 3.33Å
113T68.3Low83.6Confident42 Ų4263.5 Ų63.526%0.25834%0.335SS..  trans-74.8107.3174.9-5.20000108.4M86 F115 K116 K120M86-T113 HydrophobicContact SD-CG2 3.88Å; M86-T113 PolarHBondContact SD-OG1 2.99Å; M86-T113 VanDerWaalsContact SD-OG1 3.39Å; T113-F115 PolarHBondContact O-N 2.62Å; T113-K116 PolarHBondContact O-N 3.28Å; T113-K120 WeakPolarHBondContact OG1-CE 3.37Å
114I56.9Low83.8Confident146 Ų14662.2 Ų62.275%0.74932%0.321SS*.THydrogen-bonded Turntrans-54-25.3-166.5-64.1171.5000114R112R112-I114 PolarHBondContact O-N 3.33Å
115F58.6Low84Confident194 Ų19460.6 Ų60.685%0.85131%0.309SS*.THydrogen-bonded Turntrans-124.78.1-172.4-61.8-73.9000115.3T113T113-F115 PolarHBondContact O-N 2.62Å
116K63.6Low84.1Confident60 Ų6064.3 Ų64.326%0.26133%0.326SS..  trans-125.3123-174.2-63.7-179.5-178.1173.90111.4E82 S85 M86 T113E82-K116 VanDerWaalsContact CA-NZ 3.33Å; E82-K116 HydrophobicContact CB-CD 4.43Å; E82-K116 VanDerWaalsContact CB-NZ 3.31Å; E82-K116 HydrophobicContact CG-CD 4.3Å; E82-K116 VanDerWaalsContact CG-NZ 3.29Å; E82-K116 WeakPolarHBondContact OE1-CD 3.33Å; E82-K116 WeakPolarHBondContact OE1-CE 3.43Å; E82-K116 IonicContact OE1-NZ 3.13Å; S85-K116 PolarHBondContact OG-NZ 3.03Å; M86-K116 HydrophobicContact CG-CD 4Å; M86-K116 HydrophobicContact SD-CB 4.23Å; M86-K116 HydrophobicContact SD-CD 3.9Å; T113-K116 PolarHBondContact O-N 3.28Å
117K65.4Low84.1Confident217 Ų21761.4 Ų61.494%0.94331%0.311SS*.  trans-78.3131.4169.7-70.5-175176.6-177.40108.6
118G77.7Confident84.2Confident55 Ų5559.1 Ų59.157%0.56729%0.294SS*.SBendtrans136.317217800000112.5
119F87.8Confident84.2Confident16 Ų1659.3 Ų59.37%0.0730%0.301CS..  trans-85.6154.417155.9-95000110.5L53 L77 Y78 M86 N148 R150L53-F119 HydrophobicContact CB-CE1 4.38Å; L53-F119 HydrophobicContact CB-CZ 3.88Å; L53-F119 HydrophobicContact CD2-CE2 3.85Å; L53-F119 HydrophobicContact CD2-CZ 3.81Å; L77-F119 HydrophobicContact CD1-CE2 4.42Å; L77-F119 HydrophobicContact CD1-CZ 4.41Å; L77-F119 HydrophobicContact CD2-CZ 4.18Å; Y78-F119 WeakPolarHBondContact CE1-O 3.42Å; Y78-F119 WeakPolarHBondContact OH-CD2 3.42Å; Y78-F119 WeakPolarHBondContact OH-CE2 3.05Å; Y78-F119 PolarHBondContact OH-O 2.61Å; M86-F119 VanDerWaalsContact CE-O 3.3Å; M86-F119 WeakPolarHBondContact CE-O 3.4Å; F119-N148 CarbonylContact C-O 3.47Å; F119-N148 WeakPolarHBondContact CA-O 3.41Å; F119-R150 HydrophobicContact CB-CG 4.15Å; F119-R150 HydrophobicContact CD1-CG 4.28Å; F119-R150 HydrophobicContact CD2-CB 3.84Å; F119-R150 HydrophobicContact CD2-CG 3.37Å; F119-R150 HydrophobicContact CE2-CB 4.14Å; F119-R150 HydrophobicContact CE2-CG 3.76Å; F119-R150 HydrophobicContact CG-CG 3.67Å; F119-R150 HydrophobicContact CZ-CG 4.37Å
120K92.8Very high84.3Confident11 Ų1159.8 Ų59.85%0.04830%0.303CS..EExtended strand (participates in β ladder)trans-82.7159165.7-65.1-177.7175.8-170.70110.7M86 F108 T111 T113 N148 T149 R150M86-K120 HydrophobicContact CE-CG 4.29Å; M86-K120 CarbonylContact O-C 3.6Å; M86-K120 WeakPolarHBondContact O-CA 3.37Å; M86-K120 HydrophobicContact SD-CG 4.34Å; F108-K120 HydrophobicContact CD1-CD 4.15Å; F108-K120 HydrophobicContact CE1-CB 3.73Å; F108-K120 HydrophobicContact CE1-CD 3.8Å; F108-K120 HydrophobicContact CE1-CG 4.3Å; F108-K120 HydrophobicContact CE2-CD 4.3Å; F108-K120 HydrophobicContact CZ-CB 4.1Å; F108-K120 HydrophobicContact CZ-CD 3.87Å; F108-K120 HydrophobicContact CZ-CG 4.32Å; F108-K120 WeakPolarHBondContact O-CD 3.45Å; F108-K120 PolarHBondContact O-NZ 2.94Å; T111-K120 WeakPolarHBondContact O-CE 3.2Å; T111-K120 PolarHBondContact O-NZ 3.33Å; T111-K120 PolarHBondContact OG1-NZ 3.48Å; T113-K120 WeakPolarHBondContact OG1-CE 3.37Å; K120-N148 PolarHBondContact N-O 2.88Å; K120-T149 HydrophobicContact CB-CG2 4.23Å; K120-T149 CarbonylContact O-C 3.56Å; K120-T149 WeakPolarHBondContact O-CA 3.42Å; K120-R150 PolarHBondContact O-N 3.48Å
121L94.7Very high84.5Confident2 Ų259.9 Ų59.91%0.0130%0.301CS..EExtended strand (participates in β ladder)trans-119.8127.6176.2-175.664.5000110.5I70 A74 Y78 M86 V87 L88 I123 R150 C152I70-L121 HydrophobicContact CD1-CD2 4.34Å; I70-L121 HydrophobicContact CG1-CD2 4.43Å; A74-L121 HydrophobicContact CB-CD2 3.76Å; Y78-L121 HydrophobicContact CE2-CB 3.76Å; Y78-L121 HydrophobicContact CE2-CD2 4.29Å; Y78-L121 PolarHBondContact OH-N 3.45Å; M86-L121 PolarHBondContact O-N 3Å; V87-L121 CarbonylContact C-O 3.6Å; V87-L121 VanDerWaalsContact CA-O 3.28Å; V87-L121 WeakPolarHBondContact CA-O 3.47Å; V87-L121 HydrophobicContact CG2-CB 4.46Å; L88-L121 PolarHBondContact N-O 3.38Å; L121-I123 HydrophobicContact CD2-CD1 4.09Å; L121-I123 HydrophobicContact CD2-CG1 4.1Å; L121-I123 HydrophobicContact CG-CG1 4.05Å; L121-R150 CarbonylContact C-O 3.55Å; L121-R150 WeakPolarHBondContact CA-O 3.24Å; L121-R150 HydrophobicContact CD1-CB 4.18Å; L121-C152 HydrophobicContact CD1-CB 4.46Å
122V96Very high84.9Confident0 Ų063.1 Ų63.10%031%0.312CS..EExtended strand (participates in β ladder)trans-109.8121.9170.3179.10000108L88 F108 L124 T149 R150 F151 C152L88-V122 HydrophobicContact CB-CG2 4.39Å; L88-V122 CarbonylContact O-C 3.59Å; L88-V122 WeakPolarHBondContact O-CA 3.38Å; F108-V122 HydrophobicContact CD1-CG2 3.58Å; F108-V122 HydrophobicContact CE1-CG2 3.8Å; V122-L124 HydrophobicContact CG1-CD1 4.5Å; V122-L124 HydrophobicContact CG1-CD2 4.49Å; V122-L124 HydrophobicContact CG1-CG 4.13Å; V122-T149 HydrophobicContact CG2-CG2 3.7Å; V122-R150 PolarHBondContact N-O 2.97Å; V122-F151 HydrophobicContact CB-CD1 3.69Å; V122-F151 HydrophobicContact CB-CE1 3.81Å; V122-F151 HydrophobicContact CB-CG 4.3Å; V122-F151 HydrophobicContact CG1-CD1 3.88Å; V122-F151 HydrophobicContact CG1-CE1 3.89Å; V122-F151 HydrophobicContact CG2-CD1 4.32Å; V122-F151 HydrophobicContact CG2-CE1 3.97Å; V122-F151 HydrophobicContact CG2-CZ 4.26Å; V122-F151 CarbonylContact O-C 3.58Å; V122-F151 WeakPolarHBondContact O-CA 3.4Å; V122-C152 PolarHBondContact O-N 3.5Å
123I97.1Very high85.9Confident0 Ų058.5 Ų58.50%030%0.303CS..EExtended strand (participates in β ladder)trans-107.8119.1176.5-55.9173.1000107.4I70 L71 A74 V87 L88 L90 L121 C152 I154I70-I123 HydrophobicContact CG1-CD1 3.85Å; I70-I123 HydrophobicContact CG1-CG1 4.01Å; I70-I123 HydrophobicContact CG2-CD1 4.08Å; I70-I123 HydrophobicContact CG2-CG2 3.92Å; L71-I123 HydrophobicContact CD2-CD1 4Å; A74-I123 HydrophobicContact CB-CD1 4.46Å; V87-I123 HydrophobicContact CG1-CD1 3.9Å; V87-I123 HydrophobicContact CG1-CG1 4.39Å; L88-I123 PolarHBondContact O-N 2.91Å; L90-I123 PolarHBondContact N-O 3.49Å; L121-I123 HydrophobicContact CD2-CD1 4.09Å; L121-I123 HydrophobicContact CD2-CG1 4.1Å; L121-I123 HydrophobicContact CG-CG1 4.05Å; I123-C152 WeakPolarHBondContact CA-O 3.32Å; I123-I154 HydrophobicContact CG2-CD1 4.08Å
124L95.8Very high87.2Confident1 Ų156.5 Ų56.51%0.00529%0.29CS..EExtended strand (participates in β ladder)trans-111.7101.6176.1-68.9166.5000108.5L90 I105 V122 L138 C152 L153 I154L90-L124 HydrophobicContact CB-CD2 3.89Å; L90-L124 HydrophobicContact CD1-CD2 4.22Å; L90-L124 WeakPolarHBondContact O-CA 3.5Å; I105-L124 HydrophobicContact CD1-CD1 4.2Å; I105-L124 HydrophobicContact CD1-CD2 3.62Å; I105-L124 HydrophobicContact CD1-CG 4.48Å; V122-L124 HydrophobicContact CG1-CD1 4.5Å; V122-L124 HydrophobicContact CG1-CD2 4.49Å; V122-L124 HydrophobicContact CG1-CG 4.13Å; L124-L138 HydrophobicContact CD1-CD1 3.92Å; L124-L138 HydrophobicContact CD1-CD2 3.43Å; L124-L138 VanDerWaalsContact CD1-CD2 3.43Å; L124-L138 HydrophobicContact CD1-CG 4.33Å; L124-C152 PolarHBondContact N-O 3.29Å; L124-L153 HydrophobicContact CD1-CG 4.48Å; L124-I154 PolarHBondContact O-N 3.3Å
125D95.4Very high89.1Confident28 Ų2849.7 Ų49.715%0.1526%0.255CS..EExtended strand (participates in β ladder)trans-80.2151.5172.9-146-16.5000110.8T67 L90 A92 A127 I154T67-D125 WeakPolarHBondContact CG2-OD2 3.28Å; T67-D125 PolarHBondContact OG1-OD2 2.8Å; L90-D125 PolarHBondContact O-N 2.93Å; A92-D125 VanDerWaalsContact CB-O 3.31Å; A92-D125 WeakPolarHBondContact CB-O 3.19Å; A92-D125 PolarHBondContact N-O 3.47Å; D125-A127 PolarHBondContact O-N 3.16Å; D125-I154 WeakPolarHBondContact OD1-CB 3.47Å; D125-I154 WeakPolarHBondContact OD1-CG2 3.48Å
126E94.1Very high90.9Very high78 Ų7843.3 Ų43.336%0.36423%0.23SC..THydrogen-bonded Turntrans50.540.4-176.4-54.1-168.6-176.500114.1S93 D128 A129 I154S93-E126 VanDerWaalsContact CB-OE2 3.31Å; S93-E126 WeakPolarHBondContact CB-OE2 3.25Å; E126-D128 PolarHBondContact O-N 2.95Å; E126-A129 VanDerWaalsContact O-CB 3.24Å; E126-A129 WeakPolarHBondContact O-CB 3.32Å; E126-A129 PolarHBondContact O-N 2.79Å; E126-I154 PolarHBondContact N-O 3.42Å
127A95.3Very high92.4Very high0 Ų041.2 Ų41.20%022%0.223CC..G310 helixtrans-59.2-18.7-177.800000113.6D125 A129 M130 L153 I154 I161D125-A127 PolarHBondContact O-N 3.16Å; A127-A129 PolarHBondContact O-N 2.84Å; A127-M130 WeakPolarHBondContact O-CB 3.36Å; A127-M130 WeakPolarHBondContact O-CG 3.19Å; A127-M130 PolarHBondContact O-N 3.44Å; A127-L153 HydrophobicContact CB-CB 4.2Å; A127-L153 HydrophobicContact CB-CD2 4.41Å; A127-L153 HydrophobicContact CB-CG 4.37Å; A127-I154 WeakPolarHBondContact CB-O 3.37Å; A127-I154 PolarHBondContact N-O 2.91Å; A127-I161 HydrophobicContact CB-CD1 4.05Å; A127-I161 WeakPolarHBondContact O-CD1 3.46Å
128D94.6Very high93.9Very high21 Ų2130.9 Ų30.911%0.11218%0.179CC..G310 helixtrans-73.5-8.4171.952.4-26.9000114.5E126 C155 N156 Y157 K160 I161E126-D128 PolarHBondContact O-N 2.95Å; D128-C155 HydrophobicContact CB-CB 3.74Å; D128-C155 WeakPolarHBondContact OD1-CB 3.33Å; D128-N156 PolarHBondContact OD2-N 3.33Å; D128-N156 VanDerWaalsContact OD2-N 3.11Å; D128-Y157 WeakPolarHBondContact OD2-CD2 3.15Å; D128-Y157 PolarHBondContact OD2-N 3.29Å; D128-K160 HydrophobicContact CB-CB 3.67Å; D128-K160 HydrophobicContact CB-CD 4.03Å; D128-K160 HydrophobicContact CB-CG 4.46Å; D128-I161 HydrophobicContact CB-CD1 4.29Å
129A93.7Very high94.7Very high34 Ų3432 Ų3228%0.28117%0.166SC..G310 helixtrans-82.8-14.716900000113.1R96 E126 A127R96-A129 VanDerWaalsContact CD-O 3.31Å; R96-A129 WeakPolarHBondContact CD-O 3.13Å; R96-A129 HydrophobicContact CG-CB 4.42Å; R96-A129 WeakPolarHBondContact CG-O 3.36Å; E126-A129 VanDerWaalsContact O-CB 3.24Å; E126-A129 WeakPolarHBondContact O-CB 3.32Å; E126-A129 PolarHBondContact O-N 2.79Å; A127-A129 PolarHBondContact O-N 2.84Å
130M93.3Very high95.1Very high10 Ų1039.9 Ų39.95%0.04920%0.195CC..SBendtrans-69.5140.9-179.2-63.9-177.17300112.2A92 V101 A127 A134 Q135 L138A92-M130 HydrophobicContact CB-CG 3.56Å; A92-M130 HydrophobicContact CB-SD 4.26Å; V101-M130 HydrophobicContact CG2-CE 3.58Å; A127-M130 WeakPolarHBondContact O-CB 3.36Å; A127-M130 WeakPolarHBondContact O-CG 3.19Å; A127-M130 PolarHBondContact O-N 3.44Å; M130-A134 HydrophobicContact CB-CB 4.47Å; M130-A134 HydrophobicContact CE-CB 3.71Å; M130-Q135 HydrophobicContact CB-CG 3.81Å; M130-Q135 PolarHBondContact O-NE2 2.92Å; M130-Q135 VanDerWaalsContact O-NE2 3.16Å; M130-L138 HydrophobicContact CE-CD2 4.21Å; M130-L138 HydrophobicContact SD-CD2 4.18Å
131T94.4Very high95.3Very high62 Ų6240 Ų4038%0.3820%0.197SC..  trans-62.5152.8169.958.30000111.8R96 D133 A134 Q135R96-T131 PolarHBondContact O-N 3.42Å; R96-T131 PolarHBondContact O-OG1 3.41Å; T131-D133 PolarHBondContact O-N 3.14Å; T131-A134 PolarHBondContact O-N 2.94Å; T131-A134 VanDerWaalsContact O-N 3.14Å; T131-A134 WeakPolarHBondContact OG1-CB 3.4Å; T131-A134 PolarHBondContact OG1-N 2.72Å; T131-Q135 WeakPolarHBondContact O-CG 3.42Å; T131-Q135 PolarHBondContact O-N 2.95Å
132Q94.1Very high95.3Very high140 Ų14040 Ų4065%0.65420%0.196SC*.Hα-helixtrans-59.6-34.9179.2-65.5-172.216.500112.3Q135 N136 I162Q132-Q135 PolarHBondContact O-N 3.34Å; Q132-N136 WeakPolarHBondContact O-CB 3.36Å; Q132-N136 PolarHBondContact O-N 2.93Å; Q132-N136 PolarHBondContact O-ND2 2.92Å; Q132-I162 HydrophobicContact CB-CG2 4.43Å; Q132-I162 HydrophobicContact CG-CG2 4.29Å
133D95.1Very high95.3Very high112 Ų11243.1 Ų43.160%0.59921%0.211SC*.Hα-helixtrans-66.2-42.1176.5-68-31.7000112.2I98 T131 N136 A137I98-D133 HydrophobicContact CD1-CB 4.44Å; T131-D133 PolarHBondContact O-N 3.14Å; D133-N136 PolarHBondContact O-N 3.46Å; D133-A137 WeakPolarHBondContact O-CB 3.41Å; D133-A137 PolarHBondContact O-N 3.46Å
134A95.1Very high95.2Very high0 Ų050.8 Ų50.80%024%0.244CC..Hα-helixtrans-62.7-43.1173.400000111.2V101 M130 T131 N136 A137 L138V101-A134 HydrophobicContact CG2-CB 4.19Å; M130-A134 HydrophobicContact CB-CB 4.47Å; M130-A134 HydrophobicContact CE-CB 3.71Å; T131-A134 PolarHBondContact O-N 2.94Å; T131-A134 VanDerWaalsContact O-N 3.14Å; T131-A134 WeakPolarHBondContact OG1-CB 3.4Å; T131-A134 PolarHBondContact OG1-N 2.72Å; A134-N136 PolarHBondContact O-N 2.91Å; A134-A137 PolarHBondContact O-N 3.49Å; A134-L138 WeakPolarHBondContact O-CB 3.48Å; A134-L138 PolarHBondContact O-N 3.24Å
135Q96.6Very high95.1Very high3 Ų352 Ų521%0.01425%0.25CC..Hα-helixtrans-63.4-39.7175.9-66.1-173.93700112.6M130 T131 Q132 L138 R139 K160 I161 I162 L165M130-Q135 HydrophobicContact CB-CG 3.81Å; M130-Q135 PolarHBondContact O-NE2 2.92Å; M130-Q135 VanDerWaalsContact O-NE2 3.16Å; T131-Q135 WeakPolarHBondContact O-CG 3.42Å; T131-Q135 PolarHBondContact O-N 2.95Å; Q132-Q135 PolarHBondContact O-N 3.34Å; Q135-L138 PolarHBondContact O-N 3.46Å; Q135-R139 PolarHBondContact O-N 2.76Å; Q135-K160 PolarHBondContact NE2-O 3.5Å; Q135-I161 VanDerWaalsContact OE1-CA 3.31Å; Q135-I162 HydrophobicContact CB-CD1 3.83Å; Q135-I162 HydrophobicContact CB-CG1 4Å; Q135-I162 HydrophobicContact CB-CG2 4.35Å; Q135-L165 HydrophobicContact CB-CD2 3.99Å; Q135-L165 HydrophobicContact CG-CD2 4.22Å
136N96Very high94.9Very high60 Ų6053.6 Ų53.632%0.32126%0.261SS..Hα-helixtrans-65.2-39.4174.9-83.4-50.7000112.2Q132 D133 A134 R140 I162Q132-N136 WeakPolarHBondContact O-CB 3.36Å; Q132-N136 PolarHBondContact O-N 2.93Å; Q132-N136 PolarHBondContact O-ND2 2.92Å; D133-N136 PolarHBondContact O-N 3.46Å; A134-N136 PolarHBondContact O-N 2.91Å; N136-R140 PolarHBondContact O-N 3.42Å; N136-I162 HydrophobicContact CB-CD1 4.44Å; N136-I162 VanDerWaalsContact OD1-CD1 3.25Å; N136-I162 WeakPolarHBondContact OD1-CD1 3.44Å
137A95.5Very high94.6Very high15 Ų1558 Ų5812%0.12428%0.281CS..Hα-helixtrans-63.8-44.8172.400000111I98 V101 D133 A134 R139 R140 V141I98-A137 HydrophobicContact CD1-CB 3.93Å; I98-A137 HydrophobicContact CG1-CB 3.84Å; V101-A137 HydrophobicContact CB-CB 4.33Å; V101-A137 HydrophobicContact CG1-CB 3.87Å; D133-A137 WeakPolarHBondContact O-CB 3.41Å; D133-A137 PolarHBondContact O-N 3.46Å; A134-A137 PolarHBondContact O-N 3.49Å; A137-R139 VanDerWaalsContact C-N 3.33Å; A137-R139 PolarHBondContact O-N 3.36Å; A137-R140 WeakPolarHBondContact O-CB 3.41Å; A137-R140 PolarHBondContact O-N 3.1Å; A137-R140 VanDerWaalsContact O-N 3.1Å; A137-V141 WeakPolarHBondContact O-CG2 3.25Å; A137-V141 PolarHBondContact O-N 3.13Å; A137-V141 VanDerWaalsContact O-N 3.16Å
138L96.2Very high94.3Very high0 Ų059.9 Ų59.90%029%0.291CS..Hα-helixtrans-62.3-42.2-178.6177.763.6000111V101 I105 L124 M130 A134 Q135 R140 V141 I142 F151 L153 L165V101-L138 HydrophobicContact CG1-CB 4.02Å; V101-L138 HydrophobicContact CG1-CD1 4.43Å; V101-L138 HydrophobicContact CG2-CB 4.22Å; I105-L138 HydrophobicContact CD1-CD1 4.47Å; I105-L138 HydrophobicContact CG2-CD1 4.13Å; L124-L138 HydrophobicContact CD1-CD1 3.92Å; L124-L138 HydrophobicContact CD1-CD2 3.43Å; L124-L138 VanDerWaalsContact CD1-CD2 3.43Å; L124-L138 HydrophobicContact CD1-CG 4.33Å; M130-L138 HydrophobicContact CE-CD2 4.21Å; M130-L138 HydrophobicContact SD-CD2 4.18Å; A134-L138 WeakPolarHBondContact O-CB 3.48Å; A134-L138 PolarHBondContact O-N 3.24Å; Q135-L138 PolarHBondContact O-N 3.46Å; L138-R140 VanDerWaalsContact C-N 3.29Å; L138-R140 PolarHBondContact O-N 2.74Å; L138-V141 WeakPolarHBondContact O-CB 3.43Å; L138-V141 PolarHBondContact O-N 2.99Å; L138-V141 VanDerWaalsContact O-N 3.07Å; L138-I142 HydrophobicContact CD1-CD1 4.25Å; L138-I142 HydrophobicContact CD1-CG1 4.32Å; L138-I142 HydrophobicContact CD2-CD1 4.42Å; L138-I142 HydrophobicContact CG-CD1 3.86Å; L138-I142 HydrophobicContact CG-CG1 4.37Å; L138-I142 WeakPolarHBondContact O-CG1 3.33Å; L138-I142 PolarHBondContact O-N 3.26Å; L138-F151 HydrophobicContact CD1-CD1 4.1Å; L138-F151 HydrophobicContact CD1-CE1 3.8Å; L138-L153 HydrophobicContact CD2-CD2 4.19Å; L138-L165 HydrophobicContact CD2-CD2 4.15Å
139R96.4Very high94.2Very high80 Ų8058.9 Ų58.930%0.30229%0.286SS..Hα-helixtrans-51.6-47.3172.8177-166.7159.9-167.1-5.7111.9Q135 A137 V141 I142 E143 L165Q135-R139 PolarHBondContact O-N 2.76Å; A137-R139 VanDerWaalsContact C-N 3.33Å; A137-R139 PolarHBondContact O-N 3.36Å; R139-V141 VanDerWaalsContact C-N 3.31Å; R139-V141 PolarHBondContact O-N 3.06Å; R139-I142 PolarHBondContact O-N 3.04Å; R139-E143 IonicContact CZ-OE1 3.73Å; R139-E143 IonicContact NE-OE1 2.71Å; R139-E143 PolarHBondContact NE-OE1 3.29Å; R139-E143 IonicContact NH2-OE1 3.27Å; R139-E143 PolarHBondContact NH2-OE1 3.39Å; R139-E143 VanDerWaalsContact NH2-OE1 3.14Å; R139-E143 WeakPolarHBondContact O-CG 3.25Å; R139-E143 PolarHBondContact O-N 3.27Å; R139-L165 HydrophobicContact CB-CD1 4.33Å
140R95.7Very high94.3Very high181 Ų18159.3 Ų59.368%0.68328%0.28SS*.Hα-helixtrans-64.6-37.3179.6-63.7178.7-169.1179.23.2111.7N136 A137 L138 K144N136-R140 PolarHBondContact O-N 3.42Å; A137-R140 WeakPolarHBondContact O-CB 3.41Å; A137-R140 PolarHBondContact O-N 3.1Å; A137-R140 VanDerWaalsContact O-N 3.1Å; L138-R140 VanDerWaalsContact C-N 3.29Å; L138-R140 PolarHBondContact O-N 2.74Å; R140-K144 VanDerWaalsContact O-CB 3.32Å; R140-K144 WeakPolarHBondContact O-CB 3.26Å; R140-K144 PolarHBondContact O-N 2.92Å
141V95.9Very high94.5Very high13 Ų1358.9 Ų58.98%0.07928%0.278CS..Hα-helixtrans-64.8-46.9175.4179.40000110.3V101 I105 L106 A109 A137 L138 R139 E143 K144 F145 F151V101-V141 HydrophobicContact CG1-CG2 4.01Å; I105-V141 HydrophobicContact CG2-CG1 4.32Å; L106-V141 HydrophobicContact CD1-CG1 4.47Å; L106-V141 HydrophobicContact CD1-CG2 4.23Å; A109-V141 HydrophobicContact CB-CG1 4.15Å; A137-V141 WeakPolarHBondContact O-CG2 3.25Å; A137-V141 PolarHBondContact O-N 3.13Å; A137-V141 VanDerWaalsContact O-N 3.16Å; L138-V141 WeakPolarHBondContact O-CB 3.43Å; L138-V141 PolarHBondContact O-N 2.99Å; L138-V141 VanDerWaalsContact O-N 3.07Å; R139-V141 VanDerWaalsContact C-N 3.31Å; R139-V141 PolarHBondContact O-N 3.06Å; V141-E143 PolarHBondContact O-N 2.49Å; V141-K144 PolarHBondContact O-N 3.48Å; V141-F145 HydrophobicContact CG1-CD2 3.76Å; V141-F145 HydrophobicContact CG1-CE2 4.25Å; V141-F145 VanDerWaalsContact O-CD2 3.29Å; V141-F145 WeakPolarHBondContact O-CD2 3.22Å; V141-F145 PolarHBondContact O-N 3.34Å; V141-F151 HydrophobicContact CG1-CZ 3.97Å
142I95.9Very high94.7Very high1 Ų155.9 Ų55.91%0.00526%0.26CS..Hα-helixtrans-57.4-48.5177.1-71.1169.1000111H55 L138 R139 K144 T146 F151 L153 L165 R168H55-I142 WeakPolarHBondContact CD2-CG2 3.35Å; H55-I142 WeakPolarHBondContact NE2-CG2 3.4Å; L138-I142 HydrophobicContact CD1-CD1 4.25Å; L138-I142 HydrophobicContact CD1-CG1 4.32Å; L138-I142 HydrophobicContact CD2-CD1 4.42Å; L138-I142 HydrophobicContact CG-CD1 3.86Å; L138-I142 HydrophobicContact CG-CG1 4.37Å; L138-I142 WeakPolarHBondContact O-CG1 3.33Å; L138-I142 PolarHBondContact O-N 3.26Å; R139-I142 PolarHBondContact O-N 3.04Å; I142-K144 VanDerWaalsContact C-N 3.33Å; I142-K144 PolarHBondContact O-N 3.18Å; I142-T146 WeakPolarHBondContact O-CB 3.29Å; I142-T146 PolarHBondContact O-N 3Å; I142-T146 VanDerWaalsContact O-N 3.14Å; I142-F151 HydrophobicContact CB-CD2 4.41Å; I142-F151 HydrophobicContact CD1-CB 4.24Å; I142-F151 HydrophobicContact CD1-CD1 4.29Å; I142-F151 HydrophobicContact CD1-CG 4.11Å; I142-F151 HydrophobicContact CG1-CB 4.21Å; I142-F151 HydrophobicContact CG1-CD1 3.9Å; I142-F151 HydrophobicContact CG1-CD2 3.6Å; I142-F151 HydrophobicContact CG1-CE1 4.13Å; I142-F151 HydrophobicContact CG1-CE2 3.85Å; I142-F151 HydrophobicContact CG1-CG 3.63Å; I142-F151 HydrophobicContact CG1-CZ 4.11Å; I142-L153 HydrophobicContact CD1-CD1 4.41Å; I142-L165 HydrophobicContact CD1-CD1 3.38Å; I142-R168 HydrophobicContact CG2-CB 4.29Å
143E95.1Very high94.9Very high66 Ų6649.3 Ų49.331%0.30823%0.229SC..Hα-helixtrans-61.6-39.9178.9-72.3174.5-179.900112R139 V141 R168R139-E143 IonicContact CZ-OE1 3.73Å; R139-E143 IonicContact NE-OE1 2.71Å; R139-E143 PolarHBondContact NE-OE1 3.29Å; R139-E143 IonicContact NH2-OE1 3.27Å; R139-E143 PolarHBondContact NH2-OE1 3.39Å; R139-E143 VanDerWaalsContact NH2-OE1 3.14Å; R139-E143 WeakPolarHBondContact O-CG 3.25Å; R139-E143 PolarHBondContact O-N 3.27Å; V141-E143 PolarHBondContact O-N 2.49Å; E143-R168 VanDerWaalsContact CD-NH2 3.27Å; E143-R168 IonicContact OE1-CZ 3.29Å; E143-R168 IonicContact OE1-NE 2.81Å; E143-R168 PolarHBondContact OE1-NE 2.8Å; E143-R168 VanDerWaalsContact OE1-NE 3.16Å; E143-R168 IonicContact OE1-NH2 3.7Å; E143-R168 PolarHBondContact OE1-NH2 2.85Å; E143-R168 IonicContact OE2-NH2 3.75Å
144K95.1Very high95Very high161 Ų16144 Ų4470%0.720%0.201SC*.Hα-helixtrans-74.9-34.8-176.8-176172.6178.6178.70113.9R140 V141 I142R140-K144 VanDerWaalsContact O-CB 3.32Å; R140-K144 WeakPolarHBondContact O-CB 3.26Å; R140-K144 PolarHBondContact O-N 2.92Å; V141-K144 PolarHBondContact O-N 3.48Å; I142-K144 VanDerWaalsContact C-N 3.33Å; I142-K144 PolarHBondContact O-N 3.18Å
145F93.9Very high95.1Very high27 Ų2744 Ų4412%0.11820%0.201CC..THydrogen-bonded Turntrans-114.524-172.3-59.2-72.6000112.8L106 A109 V141 E147 N148 T149L106-F145 HydrophobicContact CD1-CD2 4.44Å; L106-F145 HydrophobicContact CD1-CE2 3.44Å; L106-F145 VanDerWaalsContact CD1-CE2 3.44Å; L106-F145 HydrophobicContact CD1-CZ 3.96Å; A109-F145 HydrophobicContact CB-CB 4.05Å; A109-F145 HydrophobicContact CB-CD2 4.01Å; A109-F145 HydrophobicContact CB-CG 4.03Å; V141-F145 HydrophobicContact CG1-CD2 3.76Å; V141-F145 HydrophobicContact CG1-CE2 4.25Å; V141-F145 VanDerWaalsContact O-CD2 3.29Å; V141-F145 WeakPolarHBondContact O-CD2 3.22Å; V141-F145 PolarHBondContact O-N 3.34Å; F145-E147 PolarHBondContact O-N 3.37Å; F145-N148 WeakPolarHBondContact CA-OD1 3.43Å; F145-N148 WeakPolarHBondContact CB-OD1 3.38Å; F145-N148 PolarHBondContact O-N 3.47Å; F145-N148 PolarHBondContact O-OD1 3.43Å; F145-T149 PolarHBondContact O-N 3.33Å
146T91.7Very high95.1Very high62 Ų6246.5 Ų46.538%0.3821%0.214SC..THydrogen-bonded Turntrans-61.4-32.5-177.3-166.80000112.6H55 I142 R150H55-T146 PolarHBondContact CE1-OG1 3.13Å; H55-T146 PolarHBondContact NE2-OG1 2.84Å; I142-T146 WeakPolarHBondContact O-CB 3.29Å; I142-T146 PolarHBondContact O-N 3Å; I142-T146 VanDerWaalsContact O-N 3.14Å; T146-R150 PolarHBondContact O-NH1 2.88Å
147E87.2Confident95Very high170 Ų17050.3 Ų50.379%0.79423%0.225SC*.THydrogen-bonded Turntrans-67.9-42.5-177.5-66.1-176.6168.300112.4F145 R150F145-E147 PolarHBondContact O-N 3.37Å; E147-R150 PolarHBondContact O-NH1 2.85Å
148N88.5Confident95.1Very high39 Ų3950.9 Ų50.921%0.20923%0.226CC..THydrogen-bonded Turntrans-105-14.7-171.169.4-44.1000114.2A109 F119 K120 F145A109-N148 PolarHBondContact O-ND2 3.5Å; F119-N148 CarbonylContact C-O 3.47Å; F119-N148 WeakPolarHBondContact CA-O 3.41Å; K120-N148 PolarHBondContact N-O 2.88Å; F145-N148 WeakPolarHBondContact CA-OD1 3.43Å; F145-N148 WeakPolarHBondContact CB-OD1 3.38Å; F145-N148 PolarHBondContact O-N 3.47Å; F145-N148 PolarHBondContact O-OD1 3.43Å
149T93.8Very high95.1Very high0 Ų056.1 Ų56.10%026%0.263CS..EExtended strand (participates in β ladder)trans-133.8131.4-177.9-52.90000110.6H55 A109 K120 V122 F145 F151H55-T149 PolarHBondContact CE1-O 3.11Å; H55-T149 VanDerWaalsContact CE1-O 3.29Å; A109-T149 WeakPolarHBondContact CA-OG1 3.29Å; A109-T149 HydrophobicContact CB-CG2 4.23Å; A109-T149 PolarHBondContact O-OG1 3.34Å; K120-T149 HydrophobicContact CB-CG2 4.23Å; K120-T149 CarbonylContact O-C 3.56Å; K120-T149 WeakPolarHBondContact O-CA 3.42Å; V122-T149 HydrophobicContact CG2-CG2 3.7Å; F145-T149 PolarHBondContact O-N 3.33Å; T149-F151 HydrophobicContact CG2-CD2 4.15Å; T149-F151 HydrophobicContact CG2-CE2 3.64Å; T149-F151 HydrophobicContact CG2-CZ 4.02Å
150R95.6Very high95.1Very high43 Ų4358.1 Ų58.116%0.16227%0.273CS..EExtended strand (participates in β ladder)trans-102.5145.4169.2-60.4-55.1-171.6-82.6-9.5109.7L53 F119 K120 L121 V122 T146 E147L53-R150 VanDerWaalsContact O-CD 3.24Å; L53-R150 WeakPolarHBondContact O-CD 3.4Å; L53-R150 PolarHBondContact O-NE 3.28Å; F119-R150 HydrophobicContact CB-CG 4.15Å; F119-R150 HydrophobicContact CD1-CG 4.28Å; F119-R150 HydrophobicContact CD2-CB 3.84Å; F119-R150 HydrophobicContact CD2-CG 3.37Å; F119-R150 HydrophobicContact CE2-CB 4.14Å; F119-R150 HydrophobicContact CE2-CG 3.76Å; F119-R150 HydrophobicContact CG-CG 3.67Å; F119-R150 HydrophobicContact CZ-CG 4.37Å; K120-R150 PolarHBondContact O-N 3.48Å; L121-R150 CarbonylContact C-O 3.55Å; L121-R150 WeakPolarHBondContact CA-O 3.24Å; L121-R150 HydrophobicContact CD1-CB 4.18Å; V122-R150 PolarHBondContact N-O 2.97Å; T146-R150 PolarHBondContact O-NH1 2.88Å; E147-R150 PolarHBondContact O-NH1 2.85Å
151F97.2Very high95.2Very high1 Ų149.6 Ų49.60%0.00424%0.242CC..EExtended strand (participates in β ladder)trans-117.9135.3-178.2-73.2-101000108H55 L56 I105 A109 V122 L138 V141 I142 T149 L153H55-F151 CarbonylContact C-O 3.48Å; H55-F151 VanDerWaalsContact CA-O 3.24Å; H55-F151 WeakPolarHBondContact CA-O 3.33Å; H55-F151 PolarHBondContact ND1-N 3.23Å; L56-F151 PolarHBondContact N-O 3.37Å; I105-F151 HydrophobicContact CG2-CE1 3.74Å; I105-F151 HydrophobicContact CG2-CZ 4.24Å; A109-F151 HydrophobicContact CB-CZ 4.28Å; V122-F151 HydrophobicContact CB-CD1 3.69Å; V122-F151 HydrophobicContact CB-CE1 3.81Å; V122-F151 HydrophobicContact CB-CG 4.3Å; V122-F151 HydrophobicContact CG1-CD1 3.88Å; V122-F151 HydrophobicContact CG1-CE1 3.89Å; V122-F151 HydrophobicContact CG2-CD1 4.32Å; V122-F151 HydrophobicContact CG2-CE1 3.97Å; V122-F151 HydrophobicContact CG2-CZ 4.26Å; V122-F151 CarbonylContact O-C 3.58Å; V122-F151 WeakPolarHBondContact O-CA 3.4Å; L138-F151 HydrophobicContact CD1-CD1 4.1Å; L138-F151 HydrophobicContact CD1-CE1 3.8Å; V141-F151 HydrophobicContact CG1-CZ 3.97Å; I142-F151 HydrophobicContact CB-CD2 4.41Å; I142-F151 HydrophobicContact CD1-CB 4.24Å; I142-F151 HydrophobicContact CD1-CD1 4.29Å; I142-F151 HydrophobicContact CD1-CG 4.11Å; I142-F151 HydrophobicContact CG1-CB 4.21Å; I142-F151 HydrophobicContact CG1-CD1 3.9Å; I142-F151 HydrophobicContact CG1-CD2 3.6Å; I142-F151 HydrophobicContact CG1-CE1 4.13Å; I142-F151 HydrophobicContact CG1-CE2 3.85Å; I142-F151 HydrophobicContact CG1-CG 3.63Å; I142-F151 HydrophobicContact CG1-CZ 4.11Å; T149-F151 HydrophobicContact CG2-CD2 4.15Å; T149-F151 HydrophobicContact CG2-CE2 3.64Å; T149-F151 HydrophobicContact CG2-CZ 4.02Å; F151-L153 HydrophobicContact CB-CD1 3.92Å
152C97.8Very high95.3Very high0 Ų050 Ų500%024%0.243CC..EExtended strand (participates in β ladder)trans-120.9111.1169.3-177.80000108.5L56 I70 L121 V122 I123 L124L56-C152 HydrophobicContact CB-CB 4.2Å; L56-C152 CarbonylContact O-C 3.53Å; L56-C152 WeakPolarHBondContact O-CA 3.26Å; I70-C152 HydrophobicContact CD1-CB 3.83Å; I70-C152 HydrophobicContact CG1-CB 3.77Å; I70-C152 VanDerWaalsContact CG1-SG 3.52Å; L121-C152 HydrophobicContact CD1-CB 4.46Å; V122-C152 PolarHBondContact O-N 3.5Å; I123-C152 WeakPolarHBondContact CA-O 3.32Å; L124-C152 PolarHBondContact N-O 3.29Å
153L98Very high95.3Very high1 Ų154.9 Ų54.91%0.00528%0.275CS..EExtended strand (participates in β ladder)trans-95.6134.1176.7-73.670.3000108.5L56 L57 L58 L124 A127 L138 I142 F151 L165L56-L153 PolarHBondContact O-N 2.86Å; L57-L153 CarbonylContact C-O 3.53Å; L57-L153 WeakPolarHBondContact CA-O 3.39Å; L57-L153 HydrophobicContact CG-CB 4.37Å; L58-L153 PolarHBondContact N-O 3.06Å; L124-L153 HydrophobicContact CD1-CG 4.48Å; A127-L153 HydrophobicContact CB-CB 4.2Å; A127-L153 HydrophobicContact CB-CD2 4.41Å; A127-L153 HydrophobicContact CB-CG 4.37Å; L138-L153 HydrophobicContact CD2-CD2 4.19Å; I142-L153 HydrophobicContact CD1-CD1 4.41Å; F151-L153 HydrophobicContact CB-CD1 3.92Å; L153-L165 HydrophobicContact CD2-CD1 4.14Å; L153-L165 HydrophobicContact CD2-CD2 3.62Å; L153-L165 HydrophobicContact CD2-CG 3.81Å
154I97.8Very high95.4Very high1 Ų153 Ų531%0.00527%0.271CS..EExtended strand (participates in β ladder)trans-118.4132.9176-50.5175.9000108.2L58 K66 T67 I70 I123 L124 D125 E126 A127L58-I154 WeakPolarHBondContact O-CA 3.41Å; K66-I154 HydrophobicContact CB-CG2 3.65Å; K66-I154 HydrophobicContact CD-CG2 3.91Å; K66-I154 HydrophobicContact CG-CG2 4.41Å; T67-I154 HydrophobicContact CG2-CD1 4.32Å; I70-I154 HydrophobicContact CG2-CD1 3.78Å; I123-I154 HydrophobicContact CG2-CD1 4.08Å; L124-I154 PolarHBondContact O-N 3.3Å; D125-I154 WeakPolarHBondContact OD1-CB 3.47Å; D125-I154 WeakPolarHBondContact OD1-CG2 3.48Å; E126-I154 PolarHBondContact N-O 3.42Å; A127-I154 WeakPolarHBondContact CB-O 3.37Å; A127-I154 PolarHBondContact N-O 2.91Å
155C96.8Very high95.4Very high1 Ų145.3 Ų45.31%0.00724%0.237CC..EExtended strand (participates in β ladder)trans-149.1163.3175.660.80000112.2L58 Y59 G60 K66 D128 I161L58-C155 PolarHBondContact O-N 3.42Å; Y59-C155 VanDerWaalsContact CA-O 3.26Å; Y59-C155 WeakPolarHBondContact CA-O 3.3Å; G60-C155 PolarHBondContact N-O 2.84Å; K66-C155 WeakPolarHBondContact CE-O 3.34Å; D128-C155 HydrophobicContact CB-CB 3.74Å; D128-C155 WeakPolarHBondContact OD1-CB 3.33Å; C155-I161 HydrophobicContact CB-CD1 4.3Å; C155-I161 HydrophobicContact CB-CG1 4.38Å
156N96.3Very high95.6Very high55 Ų5545.6 Ų45.629%0.29424%0.239SC..SBendtrans-90-38.3170.9-65.3-39.5000110.8G60 K66 D128G60-N156 WeakPolarHBondContact O-CA 3.49Å; G60-N156 PolarHBondContact O-OD1 3.23Å; K66-N156 PolarHBondContact NZ-OD1 2.99Å; D128-N156 PolarHBondContact OD2-N 3.33Å; D128-N156 VanDerWaalsContact OD2-N 3.11Å
157Y95.3Very high95.8Very high140 Ų14047 Ų4755%0.54925%0.251SS..  trans-115.6105.3-176.8-56.4-78.2000112.1D128 S159 K160D128-Y157 WeakPolarHBondContact OD2-CD2 3.15Å; D128-Y157 PolarHBondContact OD2-N 3.29Å; Y157-S159 PolarHBondContact O-N 2.98Å; Y157-K160 HydrophobicContact CD2-CD 4.4Å; Y157-K160 PolarHBondContact O-N 3.31Å; Y157-K160 VanDerWaalsContact O-N 3.11Å
158L96.5Very high96.3Very high27 Ų2744.4 Ų44.414%0.14123%0.234CC..G310 helixtrans-58.6-32.9175.8-176.964.5000112.3L57 Y59 K160 I161 Q166L57-L158 HydrophobicContact CD1-CD1 3.83Å; L57-L158 HydrophobicContact CD2-CD1 3.64Å; L57-L158 HydrophobicContact CG-CD1 4.43Å; Y59-L158 HydrophobicContact CD2-CB 3.77Å; Y59-L158 HydrophobicContact CD2-CD2 4.34Å; Y59-L158 HydrophobicContact CE1-CD2 4.22Å; Y59-L158 HydrophobicContact CE2-CB 4.13Å; Y59-L158 HydrophobicContact CE2-CD2 3.99Å; Y59-L158 HydrophobicContact CG-CB 4.11Å; Y59-L158 HydrophobicContact CG-CD1 4.49Å; L158-K160 PolarHBondContact O-N 2.94Å; L158-I161 PolarHBondContact O-N 3.32Å; L158-Q166 HydrophobicContact CD1-CG 3.9Å; L158-Q166 PolarHBondContact O-NE2 3.41Å
159S96.4Very high96.7Very high110 Ų11043.2 Ų43.277%0.76923%0.228SC*.G310 helixtrans-62.2-21.117953.90000114.1Y157Y157-S159 PolarHBondContact O-N 2.98Å
160K96.2Very high96.8Very high121 Ų12145.6 Ų45.653%0.52624%0.243SC..G310 helixtrans-85.1-8.7175.8-69.6-173.5175.4-178.80113.4D128 Q135 Y157 L158D128-K160 HydrophobicContact CB-CB 3.67Å; D128-K160 HydrophobicContact CB-CD 4.03Å; D128-K160 HydrophobicContact CB-CG 4.46Å; Q135-K160 PolarHBondContact NE2-O 3.5Å; Y157-K160 HydrophobicContact CD2-CD 4.4Å; Y157-K160 PolarHBondContact O-N 3.31Å; Y157-K160 VanDerWaalsContact O-N 3.11Å; L158-K160 PolarHBondContact O-N 2.94Å
161I97.8Very high96.9Very high3 Ų350.1 Ų50.12%0.01526%0.26CS..SBendtrans-91.3130.1174.4-54.6-58.3000109.2L57 A127 D128 Q135 C155 L158 L165 Q166L57-I161 HydrophobicContact CD1-CG2 4.18Å; A127-I161 HydrophobicContact CB-CD1 4.05Å; A127-I161 WeakPolarHBondContact O-CD1 3.46Å; D128-I161 HydrophobicContact CB-CD1 4.29Å; Q135-I161 VanDerWaalsContact OE1-CA 3.31Å; C155-I161 HydrophobicContact CB-CD1 4.3Å; C155-I161 HydrophobicContact CB-CG1 4.38Å; L158-I161 PolarHBondContact O-N 3.32Å; I161-L165 HydrophobicContact CG2-CB 4.08Å; I161-L165 HydrophobicContact CG2-CD2 4.03Å; I161-L165 HydrophobicContact CG2-CG 4.13Å; I161-Q166 HydrophobicContact CB-CG 4.1Å; I161-Q166 HydrophobicContact CG2-CG 3.78Å; I161-Q166 PolarHBondContact O-NE2 3.21Å
162I97.4Very high96.9Very high20 Ų2051.1 Ų51.110%0.10327%0.265CS..  trans-60.7139.1-179.464.6174.9000110.8Q132 Q135 N136 A164 L165 Q166Q132-I162 HydrophobicContact CB-CG2 4.43Å; Q132-I162 HydrophobicContact CG-CG2 4.29Å; Q135-I162 HydrophobicContact CB-CD1 3.83Å; Q135-I162 HydrophobicContact CB-CG1 4Å; Q135-I162 HydrophobicContact CB-CG2 4.35Å; N136-I162 HydrophobicContact CB-CD1 4.44Å; N136-I162 VanDerWaalsContact OD1-CD1 3.25Å; N136-I162 WeakPolarHBondContact OD1-CD1 3.44Å; I162-A164 HydrophobicContact CD1-CB 4.44Å; I162-A164 PolarHBondContact O-N 2.99Å; I162-L165 HydrophobicContact CD1-CB 4.21Å; I162-L165 HydrophobicContact CG1-CB 3.56Å; I162-L165 PolarHBondContact O-N 3.49Å; I162-Q166 PolarHBondContact O-N 3.46Å
163P97.4Very high96.8Very high104 Ų10459.2 Ų59.268%0.67530%0.295SS*.Hα-helixtrans-54.9-32.9-178.4-28.735.3000113.9L165 Q166 S167P163-L165 VanDerWaalsContact C-N 3.27Å; P163-L165 PolarHBondContact O-N 3.38Å; P163-Q166 PolarHBondContact O-N 2.81Å; P163-S167 PolarHBondContact O-N 2.79Å
164A96.1Very high96.7Very high27 Ų2759.2 Ų59.222%0.22330%0.295CS..Hα-helixtrans-68.8-23.1179.700000114.1I162 S167I162-A164 HydrophobicContact CD1-CB 4.44Å; I162-A164 PolarHBondContact O-N 2.99Å; A164-S167 PolarHBondContact O-OG 2.77Å
165L96.5Very high96.5Very high0 Ų060.1 Ų60.10%030%0.304CS..Hα-helixtrans-87.9-39174.8-176.355.6000110.3Q135 L138 R139 I142 L153 I161 I162 P163 S167 R168 C169Q135-L165 HydrophobicContact CB-CD2 3.99Å; Q135-L165 HydrophobicContact CG-CD2 4.22Å; L138-L165 HydrophobicContact CD2-CD2 4.15Å; R139-L165 HydrophobicContact CB-CD1 4.33Å; I142-L165 HydrophobicContact CD1-CD1 3.38Å; L153-L165 HydrophobicContact CD2-CD1 4.14Å; L153-L165 HydrophobicContact CD2-CD2 3.62Å; L153-L165 HydrophobicContact CD2-CG 3.81Å; I161-L165 HydrophobicContact CG2-CB 4.08Å; I161-L165 HydrophobicContact CG2-CD2 4.03Å; I161-L165 HydrophobicContact CG2-CG 4.13Å; I162-L165 HydrophobicContact CD1-CB 4.21Å; I162-L165 HydrophobicContact CG1-CB 3.56Å; I162-L165 PolarHBondContact O-N 3.49Å; P163-L165 VanDerWaalsContact C-N 3.27Å; P163-L165 PolarHBondContact O-N 3.38Å; L165-S167 VanDerWaalsContact C-N 3.29Å; L165-S167 PolarHBondContact O-N 3.39Å; L165-R168 PolarHBondContact O-N 3.07Å; L165-C169 PolarHBondContact O-SG 3.29Å
166Q97.4Very high96.4Very high33 Ų3363.8 Ų63.815%0.15433%0.328CS..Hα-helixtrans-57.3-40.9173.5-60.7-175.729.600112.2L57 L158 I161 I162 P163 R168 C169L57-Q166 HydrophobicContact CD1-CB 4.47Å; L57-Q166 HydrophobicContact CD1-CG 4.11Å; L158-Q166 HydrophobicContact CD1-CG 3.9Å; L158-Q166 PolarHBondContact O-NE2 3.41Å; I161-Q166 HydrophobicContact CB-CG 4.1Å; I161-Q166 HydrophobicContact CG2-CG 3.78Å; I161-Q166 PolarHBondContact O-NE2 3.21Å; I162-Q166 PolarHBondContact O-N 3.46Å; P163-Q166 PolarHBondContact O-N 2.81Å; Q166-R168 PolarHBondContact O-N 2.82Å; Q166-C169 PolarHBondContact O-N 2.87Å; Q166-C169 VanDerWaalsContact O-O 3.1Å
167S96.6Very high96.3Very high90 Ų9061.6 Ų61.663%0.62932%0.317SS*.THydrogen-bonded Turntrans-67.4-13.8-178.266.30000114.5P163 A164 L165P163-S167 PolarHBondContact O-N 2.79Å; A164-S167 PolarHBondContact O-OG 2.77Å; L165-S167 VanDerWaalsContact C-N 3.29Å; L165-S167 PolarHBondContact O-N 3.39Å
168R96.3Very high96.2Very high117 Ų11758.1 Ų58.144%0.44231%0.31SS..THydrogen-bonded Turntrans-95.5-4.4177.5-58.8-52-171.8141.80.8113.5H55 I142 E143 L165 Q166H55-R168 PolarHBondContact CD2-O 3.13Å; I142-R168 HydrophobicContact CG2-CB 4.29Å; E143-R168 VanDerWaalsContact CD-NH2 3.27Å; E143-R168 IonicContact OE1-CZ 3.29Å; E143-R168 IonicContact OE1-NE 2.81Å; E143-R168 PolarHBondContact OE1-NE 2.8Å; E143-R168 VanDerWaalsContact OE1-NE 3.16Å; E143-R168 IonicContact OE1-NH2 3.7Å; E143-R168 PolarHBondContact OE1-NH2 2.85Å; E143-R168 IonicContact OE2-NH2 3.75Å; L165-R168 PolarHBondContact O-N 3.07Å; Q166-R168 PolarHBondContact O-N 2.82Å
169C96.9Very high96.1Very high13 Ų1360.4 Ų60.49%0.08833%0.326CS..SBendtrans-122.5143.1-175.3-52.40000111.1H55 L57 L165 Q166H55-C169 HydrophobicContact CB-CB 4.33Å; H55-C169 CarbonylContact O-C 3.51Å; H55-C169 WeakPolarHBondContact O-CA 3.48Å; L57-C169 HydrophobicContact CB-CB 3.73Å; L165-C169 PolarHBondContact O-SG 3.29Å; Q166-C169 PolarHBondContact O-N 2.87Å; Q166-C169 VanDerWaalsContact O-O 3.1Å
170T97.3Very high95.9Very high51 Ų5163 Ų6331%0.31333%0.326SS..EExtended strand (participates in β ladder)trans-74.4125.7164.6-59.80000108.4P54 H55 L56 L57 F172P54-T170 VanDerWaalsContact CG-OG1 3.29Å; P54-T170 WeakPolarHBondContact CG-OG1 3.49Å; H55-T170 PolarHBondContact O-N 3.49Å; L56-T170 WeakPolarHBondContact CA-O 3.24Å; L57-T170 PolarHBondContact N-O 3.29Å; T170-F172 HydrophobicContact CG2-CD2 4.48Å; T170-F172 HydrophobicContact CG2-CE2 3.84Å; T170-F172 HydrophobicContact CG2-CZ 3.92Å
171R97.1Very high95.6Very high137 Ų13760.5 Ų60.552%0.51732%0.318SS..EExtended strand (participates in β ladder)trans-97.6130.6-172-62.5175.9-65.5155.95110.5L57 Y59L57-R171 HydrophobicContact CB-CG 4.27Å; L57-R171 WeakPolarHBondContact O-CA 3.29Å; Y59-R171 HydrophobicContact CE1-CB 4.15Å
172F97.2Very high95.5Very high23 Ų2360.4 Ų60.410%0.10132%0.318CS..EExtended strand (participates in β ladder)trans-123.8122.7174.8-71.2-66.3000110.1I40 T43 I44 F47 L56 L57 L58 Y59 T170 F174I40-F172 HydrophobicContact CB-CD1 4.29Å; I40-F172 HydrophobicContact CD1-CB 4.27Å; I40-F172 HydrophobicContact CG1-CD1 4.09Å; I40-F172 HydrophobicContact CG2-CB 3.91Å; I40-F172 HydrophobicContact CG2-CD1 3.64Å; I40-F172 HydrophobicContact CG2-CD2 4.38Å; I40-F172 HydrophobicContact CG2-CE1 4.21Å; I40-F172 HydrophobicContact CG2-CG 3.73Å; T43-F172 HydrophobicContact CG2-CE1 4.09Å; T43-F172 HydrophobicContact CG2-CZ 3.82Å; I44-F172 HydrophobicContact CD1-CD2 4.32Å; I44-F172 HydrophobicContact CD1-CE2 4.32Å; I44-F172 HydrophobicContact CG1-CD2 4.39Å; I44-F172 HydrophobicContact CG1-CE2 3.89Å; I44-F172 HydrophobicContact CG1-CZ 4.2Å; F47-F172 HydrophobicContact CE2-CE2 4.49Å; F47-F172 HydrophobicContact CE2-CZ 4.05Å; L56-F172 HydrophobicContact CD2-CD2 4.12Å; L56-F172 HydrophobicContact CD2-CE2 3.73Å; L57-F172 PolarHBondContact O-N 3.45Å; L58-F172 WeakPolarHBondContact CA-O 3.44Å; L58-F172 HydrophobicContact CD2-CB 3.87Å; L58-F172 HydrophobicContact CD2-CD2 3.99Å; L58-F172 HydrophobicContact CD2-CG 4.4Å; Y59-F172 VanDerWaalsContact CD1-O 3.27Å; Y59-F172 WeakPolarHBondContact CD1-O 3.25Å; Y59-F172 PolarHBondContact N-O 2.84Å; T170-F172 HydrophobicContact CG2-CD2 4.48Å; T170-F172 HydrophobicContact CG2-CE2 3.84Å; T170-F172 HydrophobicContact CG2-CZ 3.92Å; F172-F174 HydrophobicContact CB-CD2 4.5Å; F172-F174 HydrophobicContact CB-CE2 3.98Å
173R96.2Very high95.4Very high170 Ų17061.2 Ų61.264%0.64232%0.324SS*.EExtended strand (participates in β ladder)trans-93.4117.7180-172.8175.4172.7153-2.5110.4I40 Y59I40-R173 VanDerWaalsContact CD1-O 3.29Å; I40-R173 WeakPolarHBondContact CD1-O 3.48Å; Y59-R173 HydrophobicContact CD2-CG 4.41Å; Y59-R173 HydrophobicContact CE1-CB 3.82Å; Y59-R173 HydrophobicContact CE1-CG 4.42Å; Y59-R173 HydrophobicContact CE2-CB 4.07Å; Y59-R173 HydrophobicContact CE2-CG 3.77Å; Y59-R173 CarbonylContact O-C 3.54Å; Y59-R173 WeakPolarHBondContact O-CA 3.43Å
174F95.7Very high95.2Very high0 Ų059.6 Ų59.60%031%0.313CS..  trans-94.4102.3173.7-75.7-112.2000108.2H37 I40 L58 Y59 G60 P61 K66 T69 F172H37-F174 AromaticContact CD2-CD1 3.24Å; H37-F174 WeakPolarHBondContact CD2-CD1 3.29Å; H37-F174 AromaticContact CD2-CE1 3.69Å; H37-F174 AromaticContact CD2-CG 4Å; H37-F174 AromaticContact NE2-CD1 3.65Å; I40-F174 HydrophobicContact CD1-CD2 4.22Å; I40-F174 HydrophobicContact CD1-CE2 4.06Å; I40-F174 HydrophobicContact CD1-CZ 4.45Å; I40-F174 HydrophobicContact CG2-CE2 4Å; I40-F174 HydrophobicContact CG2-CZ 3.92Å; L58-F174 HydrophobicContact CB-CD2 4.28Å; L58-F174 HydrophobicContact CB-CE2 4.04Å; L58-F174 HydrophobicContact CD1-CE2 4.39Å; L58-F174 HydrophobicContact CD1-CZ 4.49Å; L58-F174 HydrophobicContact CD2-CE2 3.97Å; L58-F174 HydrophobicContact CG-CE2 4.34Å; Y59-F174 PolarHBondContact O-N 2.73Å; G60-F174 WeakPolarHBondContact CA-O 3.32Å; P61-F174 WeakPolarHBondContact CD-O 3.25Å; K66-F174 HydrophobicContact CD-CB 4.35Å; K66-F174 HydrophobicContact CG-CB 3.83Å; K66-F174 HydrophobicContact CG-CD1 4.07Å; K66-F174 HydrophobicContact CG-CD2 4.16Å; K66-F174 HydrophobicContact CG-CG 3.75Å; T69-F174 HydrophobicContact CG2-CE1 4.49Å; T69-F174 HydrophobicContact CG2-CZ 4.16Å; F172-F174 HydrophobicContact CB-CD2 4.5Å; F172-F174 HydrophobicContact CB-CE2 3.98Å
175G93.8Very high95.1Very high20 Ų2060.1 Ų60.121%0.20631%0.309CS..PPolyproline II helixtrans-76.6166.6175.200000112.8H37 T64H37-G175 PolarHBondContact CE1-N 3.47Å; H37-G175 VanDerWaalsContact CE1-N 3.34Å; H37-G175 PolarHBondContact CE1-O 3.31Å; H37-G175 PolarHBondContact NE2-O 3.3Å; T64-G175 WeakPolarHBondContact CG2-O 3.32Å
176P94.3Very high95Very high78 Ų7860.1 Ų60.151%0.50631%0.309SS..PPolyproline II helixtrans-52.5146.4167.8-21.231.5000111.6P61P61-P176 HydrophobicContact CG-CG 4.12Å
177L94Very high95Very high10 Ų1063.1 Ų63.15%0.05232%0.323CS..PPolyproline II helixtrans-76.1136.7178.9-58.3169.7000110.4I35 S36 M182 G211 M213I35-L177 HydrophobicContact CD1-CD1 4.46Å; S36-L177 WeakPolarHBondContact OG-CD2 3.37Å; L177-M182 HydrophobicContact CB-CG 3.47Å; L177-M182 VanDerWaalsContact CB-CG 3.47Å; L177-M182 HydrophobicContact CB-SD 3.8Å; L177-M182 HydrophobicContact CD1-CG 4.1Å; L177-M182 HydrophobicContact CD1-SD 4.42Å; L177-M182 HydrophobicContact CG-CG 4.44Å; L177-G211 WeakPolarHBondContact CB-O 3.32Å; L177-G211 WeakPolarHBondContact CG-O 3.24Å; L177-G211 PolarHBondContact N-O 2.69Å; L177-G211 VanDerWaalsContact O-CA 3.3Å; L177-G211 WeakPolarHBondContact O-CA 3.33Å; L177-M213 HydrophobicContact CD1-CB 3.61Å; L177-M213 HydrophobicContact CD1-CE 4.23Å
178T93.7Very high94.9Very high67 Ų6762.4 Ų62.441%0.41131%0.31SS..PPolyproline II helixtrans-74.7150.7173.256.60000110.4E180 L181 M182T178-E180 PolarHBondContact O-N 2.88Å; T178-L181 PolarHBondContact O-N 2.95Å; T178-L181 WeakPolarHBondContact OG1-CG 3.35Å; T178-M182 WeakPolarHBondContact O-CG 3.37Å; T178-M182 PolarHBondContact O-N 3.34Å; T178-M182 VanDerWaalsContact O-N 3.13Å
179P93.6Very high94.8Very high74 Ų7456.9 Ų56.948%0.48129%0.289SS..Hα-helixtrans-48-43174.7-3339.1000113.8L181 M182 V183 V206P179-L181 VanDerWaalsContact C-N 3.25Å; P179-L181 PolarHBondContact O-N 2.7Å; P179-M182 PolarHBondContact O-N 3.02Å; P179-M182 VanDerWaalsContact O-N 3.1Å; P179-V183 VanDerWaalsContact O-CG2 3.29Å; P179-V183 WeakPolarHBondContact O-CG2 3.15Å; P179-V183 PolarHBondContact O-N 2.7Å; P179-V206 HydrophobicContact CB-CG1 3.76Å; P179-V206 HydrophobicContact CG-CG1 3.82Å
180E92.6Very high94.8Very high165 Ų16557.1 Ų57.177%0.77129%0.29SS*.Hα-helixtrans-59.4-32.7-179.3-61.6171.7-158.600113.4T178 P184T178-E180 PolarHBondContact O-N 2.88Å; E180-P184 WeakPolarHBondContact O-CD 3.27Å; E180-P184 WeakPolarHBondContact O-CG 3.31Å
181L90.8Very high94.8Very high68 Ų6861.7 Ų61.736%0.35631%0.308SS..Hα-helixtrans-84.7-32.4176.8-61.7177.6000111.7I35 T178 P179I35-L181 VanDerWaalsContact CD1-O 3.25Å; I35-L181 WeakPolarHBondContact CD1-O 3.45Å; I35-L181 WeakPolarHBondContact O-CD2 3.43Å; T178-L181 PolarHBondContact O-N 2.95Å; T178-L181 WeakPolarHBondContact OG1-CG 3.35Å; P179-L181 VanDerWaalsContact C-N 3.25Å; P179-L181 PolarHBondContact O-N 2.7Å
182M93.8Very high94.7Very high2 Ų261 Ų611%0.0131%0.31CS..Hα-helixtrans-76.1-43.9-176.8-65.4-165.7-62.900113L177 T178 P179 R185 L186 V206 M213L177-M182 HydrophobicContact CB-CG 3.47Å; L177-M182 VanDerWaalsContact CB-CG 3.47Å; L177-M182 HydrophobicContact CB-SD 3.8Å; L177-M182 HydrophobicContact CD1-CG 4.1Å; L177-M182 HydrophobicContact CD1-SD 4.42Å; L177-M182 HydrophobicContact CG-CG 4.44Å; T178-M182 WeakPolarHBondContact O-CG 3.37Å; T178-M182 PolarHBondContact O-N 3.34Å; T178-M182 VanDerWaalsContact O-N 3.13Å; P179-M182 PolarHBondContact O-N 3.02Å; P179-M182 VanDerWaalsContact O-N 3.1Å; M182-R185 PolarHBondContact O-N 2.98Å; M182-R185 VanDerWaalsContact O-N 3.12Å; M182-L186 HydrophobicContact CB-CD1 4.47Å; M182-L186 WeakPolarHBondContact O-CG 3.41Å; M182-L186 PolarHBondContact O-N 3.45Å; M182-V206 HydrophobicContact CE-CB 4.37Å; M182-V206 HydrophobicContact CE-CG1 3.68Å; M182-V206 HydrophobicContact CE-CG2 4.38Å; M182-M213 HydrophobicContact CB-CE 3.61Å; M182-M213 HydrophobicContact CG-CE 3.63Å; M182-M213 HydrophobicContact SD-CE 4.37Å
183V95.3Very high94.6Very high36 Ų3662.3 Ų62.322%0.21832%0.317CS..Hα-helixtrans-56.3-48.7-173.4168.80000112.2P179 R185 L186 E187 M202 V206P179-V183 VanDerWaalsContact O-CG2 3.29Å; P179-V183 WeakPolarHBondContact O-CG2 3.15Å; P179-V183 PolarHBondContact O-N 2.7Å; V183-R185 PolarHBondContact O-N 2.86Å; V183-R185 VanDerWaalsContact O-N 3.17Å; V183-L186 PolarHBondContact O-N 2.92Å; V183-E187 HydrophobicContact CG1-CG 4.1Å; V183-E187 WeakPolarHBondContact CG1-OE1 3.48Å; V183-E187 WeakPolarHBondContact O-CG 3.4Å; V183-E187 PolarHBondContact O-N 3.32Å; V183-M202 HydrophobicContact CG2-CG 4.47Å; V183-V206 HydrophobicContact CG2-CG2 3.9Å
184P94.1Very high94.5Very high70 Ų7063.1 Ų63.146%0.45533%0.325SS..Hα-helixtrans-58.9-34.4179.1-25.835000113.4E180 H188E180-P184 WeakPolarHBondContact O-CD 3.27Å; E180-P184 WeakPolarHBondContact O-CG 3.31Å; P184-H188 PolarHBondContact O-N 3.06Å; P184-H188 VanDerWaalsContact O-N 3.13Å
185R93.5Very high94.5Very high39 Ų3963.7 Ų63.715%0.14733%0.329CS..Hα-helixtrans-72.7-37.9177-170.958.2175-176.6-0.1111.9Y26 I35 M182 V183 V189 M213Y26-R185 PolarHBondContact O-NH2 2.96Å; I35-R185 HydrophobicContact CD1-CB 3.99Å; I35-R185 HydrophobicContact CD1-CG 4.41Å; I35-R185 HydrophobicContact CG2-CB 4.15Å; I35-R185 HydrophobicContact CG2-CG 4.49Å; M182-R185 PolarHBondContact O-N 2.98Å; M182-R185 VanDerWaalsContact O-N 3.12Å; V183-R185 PolarHBondContact O-N 2.86Å; V183-R185 VanDerWaalsContact O-N 3.17Å; R185-V189 WeakPolarHBondContact O-CG2 3.27Å; R185-V189 PolarHBondContact O-N 3Å; R185-M213 HydrophobicContact CB-CE 4.17Å; R185-M213 HydrophobicContact CG-CE 4.43Å; R185-M213 HydrophobicContact CG-SD 4.38Å
186L95.5Very high94.6Very high0 Ų066.6 Ų66.60%034%0.34CS..Hα-helixtrans-68.2-41.4176.6-67.7169.9000111M182 V183 V189 V190 M202 L205 V206 M213 A216 L217M182-L186 HydrophobicContact CB-CD1 4.47Å; M182-L186 WeakPolarHBondContact O-CG 3.41Å; M182-L186 PolarHBondContact O-N 3.45Å; V183-L186 PolarHBondContact O-N 2.92Å; L186-V189 PolarHBondContact O-N 3.17Å; L186-V189 VanDerWaalsContact O-N 3.13Å; L186-V190 WeakPolarHBondContact O-CB 3.5Å; L186-V190 VanDerWaalsContact O-CG2 3.26Å; L186-V190 WeakPolarHBondContact O-CG2 3.32Å; L186-V190 PolarHBondContact O-N 3.41Å; L186-M202 HydrophobicContact CB-CE 3.86Å; L186-M202 HydrophobicContact CB-SD 3.9Å; L186-M202 HydrophobicContact CD1-SD 3.84Å; L186-L205 HydrophobicContact CD1-CD2 4.04Å; L186-L205 HydrophobicContact CD2-CD2 4.24Å; L186-V206 HydrophobicContact CD1-CG2 3.96Å; L186-M213 HydrophobicContact CD2-SD 4.1Å; L186-M213 HydrophobicContact CG-SD 4.41Å; L186-A216 HydrophobicContact CD1-CB 4.35Å; L186-A216 HydrophobicContact CD2-CB 3.99Å; L186-L217 HydrophobicContact CD2-CD2 3.97Å
187E96.3Very high94.7Very high96 Ų9664.6 Ų64.645%0.44932%0.324SS..Hα-helixtrans-58.4-47.2174.3-72.8172.4164.300111.6V183 V189 V190 E191 M202V183-E187 HydrophobicContact CG1-CG 4.1Å; V183-E187 WeakPolarHBondContact CG1-OE1 3.48Å; V183-E187 WeakPolarHBondContact O-CG 3.4Å; V183-E187 PolarHBondContact O-N 3.32Å; E187-V189 VanDerWaalsContact C-N 3.28Å; E187-V189 PolarHBondContact O-N 3.22Å; E187-V190 WeakPolarHBondContact O-CB 3.45Å; E187-V190 PolarHBondContact O-N 2.86Å; E187-V190 VanDerWaalsContact O-N 3.11Å; E187-E191 WeakPolarHBondContact O-CG 3.4Å; E187-E191 PolarHBondContact O-N 2.88Å; E187-M202 HydrophobicContact CG-CE 4.16Å
188H94.9Very high94.8Very high75 Ų7565.5 Ų65.535%0.34733%0.331SS..Hα-helixtrans-55.9-41.7173.9172.8-82.4000112.6P184 E192P184-H188 PolarHBondContact O-N 3.06Å; P184-H188 VanDerWaalsContact O-N 3.13Å; H188-E192 WeakPolarHBondContact O-CB 3.37Å; H188-E192 WeakPolarHBondContact O-CG 3.31Å; H188-E192 PolarHBondContact O-N 3.22Å; H188-E192 VanDerWaalsContact O-N 3.13Å
189V95.4Very high94.9Very high0 Ų071 Ų710%035%0.352CS..Hα-helixtrans-68.8-40.2177.2173.90000111.5W22 Y26 R185 L186 E187 E191 E192 E193 L217 L220W22-V189 HydrophobicContact CD2-CG1 4.47Å; W22-V189 HydrophobicContact CE3-CG1 4.01Å; W22-V189 HydrophobicContact CZ3-CG1 4.41Å; Y26-V189 HydrophobicContact CD1-CG2 3.72Å; Y26-V189 HydrophobicContact CD2-CG1 4Å; Y26-V189 HydrophobicContact CD2-CG2 3.9Å; Y26-V189 HydrophobicContact CE1-CG2 4.05Å; Y26-V189 HydrophobicContact CE2-CG1 3.77Å; Y26-V189 HydrophobicContact CE2-CG2 4.25Å; Y26-V189 HydrophobicContact CG-CG2 3.64Å; R185-V189 WeakPolarHBondContact O-CG2 3.27Å; R185-V189 PolarHBondContact O-N 3Å; L186-V189 PolarHBondContact O-N 3.17Å; L186-V189 VanDerWaalsContact O-N 3.13Å; E187-V189 VanDerWaalsContact C-N 3.28Å; E187-V189 PolarHBondContact O-N 3.22Å; V189-E191 VanDerWaalsContact C-N 3.33Å; V189-E191 PolarHBondContact O-N 2.94Å; V189-E192 PolarHBondContact O-N 3.06Å; V189-E193 HydrophobicContact CG1-CG 4.25Å; V189-E193 WeakPolarHBondContact O-CB 3.42Å; V189-E193 WeakPolarHBondContact O-CG 3.29Å; V189-E193 PolarHBondContact O-N 3.28Å; V189-L217 HydrophobicContact CB-CD2 4.3Å; V189-L217 HydrophobicContact CG1-CD2 4.11Å; V189-L217 HydrophobicContact CG2-CD2 3.89Å; V189-L220 HydrophobicContact CG1-CD2 4.22Å
190V96.5Very high95Very high19 Ų1970.7 Ų70.712%0.11535%0.347CS..Hα-helixtrans-60.2-43.2176.71630000111.1L186 E187 K194 V195 I197 M202 L220L186-V190 WeakPolarHBondContact O-CB 3.5Å; L186-V190 VanDerWaalsContact O-CG2 3.26Å; L186-V190 WeakPolarHBondContact O-CG2 3.32Å; L186-V190 PolarHBondContact O-N 3.41Å; E187-V190 WeakPolarHBondContact O-CB 3.45Å; E187-V190 PolarHBondContact O-N 2.86Å; E187-V190 VanDerWaalsContact O-N 3.11Å; V190-K194 CarbonylContact O-C 3.55Å; V190-K194 VanDerWaalsContact O-CA 3.25Å; V190-K194 WeakPolarHBondContact O-CA 3.41Å; V190-K194 PolarHBondContact O-N 3.23Å; V190-V195 HydrophobicContact CB-CB 4.49Å; V190-V195 HydrophobicContact CG1-CB 4.24Å; V190-V195 HydrophobicContact CG2-CB 4.34Å; V190-V195 PolarHBondContact O-N 3.26Å; V190-I197 HydrophobicContact CB-CG2 4.35Å; V190-I197 HydrophobicContact CG1-CG2 3.52Å; V190-I197 HydrophobicContact CG2-CD1 4.47Å; V190-I197 HydrophobicContact CG2-CG2 3.88Å; V190-M202 HydrophobicContact CG2-CE 4.39Å; V190-L220 HydrophobicContact CG2-CD1 4.4Å; V190-L220 HydrophobicContact CG2-CD2 4.09Å
191E96.3Very high95.1Very high147 Ų14762.9 Ų62.969%0.68731%0.31SS*.Hα-helixtrans-66-47.3177.8-71.9177.1178.600112E187 V189 K194E187-E191 WeakPolarHBondContact O-CG 3.4Å; E187-E191 PolarHBondContact O-N 2.88Å; V189-E191 VanDerWaalsContact C-N 3.33Å; V189-E191 PolarHBondContact O-N 2.94Å; E191-K194 PolarHBondContact O-N 3.16Å
192E95.3Very high95.4Very high121 Ų12160.7 Ų60.757%0.56530%0.298SS*.Hα-helixtrans-64.8-40-179.7-77.3-69.1151.600112.8Y26 H188 V189Y26-E192 HydrophobicContact CE1-CB 4.11Å; Y26-E192 HydrophobicContact CE1-CG 4.34Å; Y26-E192 VanDerWaalsContact OH-CB 3.28Å; Y26-E192 WeakPolarHBondContact OH-CB 3.15Å; H188-E192 WeakPolarHBondContact O-CB 3.37Å; H188-E192 WeakPolarHBondContact O-CG 3.31Å; H188-E192 PolarHBondContact O-N 3.22Å; H188-E192 VanDerWaalsContact O-N 3.13Å; V189-E192 PolarHBondContact O-N 3.06Å
193E94.6Very high95.5Very high52 Ų5267.8 Ų67.824%0.24333%0.329CS..Hα-helixtrans-89.9-6179.2-61.5-67.9-177.700113.3W22 K25 Y26 V189 V195W22-E193 HydrophobicContact CD2-CG 4.26Å; W22-E193 HydrophobicContact CH2-CB 4.04Å; W22-E193 HydrophobicContact CH2-CG 4.11Å; W22-E193 HydrophobicContact CZ2-CB 3.81Å; W22-E193 HydrophobicContact CZ2-CG 3.61Å; W22-E193 PolarHBondContact NE1-OE1 3.26Å; W22-E193 VanDerWaalsContact NE1-OE1 3.11Å; K25-E193 WeakPolarHBondContact CD-OE1 3.23Å; K25-E193 WeakPolarHBondContact CE-OE1 3.31Å; K25-E193 VanDerWaalsContact NZ-CD 3.35Å; K25-E193 IonicContact NZ-OE1 3.99Å; K25-E193 PolarHBondContact NZ-OE1 3.08Å; K25-E193 IonicContact NZ-OE2 2.69Å; K25-E193 PolarHBondContact NZ-OE2 3.08Å; Y26-E193 HydrophobicContact CE2-CG 4.03Å; Y26-E193 VanDerWaalsContact CE2-OE1 3.3Å; Y26-E193 WeakPolarHBondContact CE2-OE1 3.48Å; Y26-E193 VanDerWaalsContact OH-CD 3.29Å; Y26-E193 VanDerWaalsContact OH-CG 3.29Å; Y26-E193 WeakPolarHBondContact OH-CG 3.5Å; Y26-E193 PolarHBondContact OH-OE1 3.47Å; V189-E193 HydrophobicContact CG1-CG 4.25Å; V189-E193 WeakPolarHBondContact O-CB 3.42Å; V189-E193 WeakPolarHBondContact O-CG 3.29Å; V189-E193 PolarHBondContact O-N 3.28Å; E193-V195 HydrophobicContact CB-CG2 3.84Å
194K94.7Very high95.4Very high187 Ų18766.2 Ų66.281%0.81332%0.32SS*.THydrogen-bonded Turntrans5449.1-176.4-56.1179.8-179.1-1790113.2V190 E191V190-K194 CarbonylContact O-C 3.55Å; V190-K194 VanDerWaalsContact O-CA 3.25Å; V190-K194 WeakPolarHBondContact O-CA 3.41Å; V190-K194 PolarHBondContact O-N 3.23Å; E191-K194 PolarHBondContact O-N 3.16Å
195V95.5Very high95.4Very high11 Ų1162.9 Ų62.97%0.06730%0.298CS..  trans-78.6130.8179.9179.90000110.3W22 V190 E193 I197 L220 N224 V230W22-V195 HydrophobicContact CH2-CG2 3.57Å; W22-V195 HydrophobicContact CZ3-CG2 4.12Å; V190-V195 HydrophobicContact CB-CB 4.49Å; V190-V195 HydrophobicContact CG1-CB 4.24Å; V190-V195 HydrophobicContact CG2-CB 4.34Å; V190-V195 PolarHBondContact O-N 3.26Å; E193-V195 HydrophobicContact CB-CG2 3.84Å; V195-I197 HydrophobicContact CG1-CB 4.39Å; V195-I197 PolarHBondContact O-N 2.76Å; V195-L220 HydrophobicContact CG1-CD1 4.43Å; V195-N224 HydrophobicContact CG1-CB 4.16Å; V195-V230 HydrophobicContact CG1-CG2 3.72Å
196D95.8Very high95.5Very high82 Ų8261.8 Ų61.844%0.43930%0.296SS..EExtended strand (participates in β ladder)trans-78.299.9167.4-178.27.5000108.8K229 V230D196-K229 HydrophobicContact CB-CG 4.26Å; D196-K229 WeakPolarHBondContact O-CA 3.42Å; D196-K229 IonicContact OD1-NZ 3.14Å; D196-K229 VanDerWaalsContact OD2-CD 3.28Å; D196-K229 WeakPolarHBondContact OD2-CD 3.45Å; D196-K229 WeakPolarHBondContact OD2-CE 3.39Å; D196-K229 IonicContact OD2-NZ 3.45Å; D196-K229 PolarHBondContact OD2-NZ 2.91Å; D196-V230 PolarHBondContact O-N 3.04Å
197I97.3Very high95.4Very high36 Ų3665.5 Ų65.519%0.18532%0.319CS..EExtended strand (participates in β ladder)trans-120134.9178.1-173.3161.1000110.6V190 V195 M202 L220 V230V190-I197 HydrophobicContact CB-CG2 4.35Å; V190-I197 HydrophobicContact CG1-CG2 3.52Å; V190-I197 HydrophobicContact CG2-CD1 4.47Å; V190-I197 HydrophobicContact CG2-CG2 3.88Å; V195-I197 HydrophobicContact CG1-CB 4.39Å; V195-I197 PolarHBondContact O-N 2.76Å; I197-M202 HydrophobicContact CD1-CB 4.09Å; I197-M202 HydrophobicContact CD1-CE 3.97Å; I197-M202 HydrophobicContact CD1-SD 4.33Å; I197-M202 HydrophobicContact CG1-CB 4.43Å; I197-L220 HydrophobicContact CD1-CD1 3.71Å; I197-V230 WeakPolarHBondContact CA-O 3.3Å; I197-V230 HydrophobicContact CB-CB 4.09Å; I197-V230 HydrophobicContact CD1-CB 4.19Å; I197-V230 HydrophobicContact CD1-CG1 3.81Å; I197-V230 HydrophobicContact CG1-CB 3.91Å; I197-V230 HydrophobicContact CG1-CG1 3.94Å
198S96.7Very high95.1Very high28 Ų2861.5 Ų61.520%0.19630%0.3CS..  trans-92.3159.6172.360.80000111.8D200 G201 M202 V230 T231S198-D200 VanDerWaalsContact C-N 3.32Å; S198-D200 WeakPolarHBondContact CB-OD1 3.15Å; S198-D200 PolarHBondContact O-N 3.49Å; S198-D200 PolarHBondContact OG-OD1 3.16Å; S198-G201 WeakPolarHBondContact O-CA 3.18Å; S198-G201 PolarHBondContact O-N 2.74Å; S198-M202 PolarHBondContact O-N 2.98Å; S198-V230 PolarHBondContact N-O 3.24Å; S198-V230 PolarHBondContact OG-O 3.43Å; S198-T231 WeakPolarHBondContact OG-CA 3.35Å
199E95.3Very high95Very high182 Ų18258 Ų5885%0.8528%0.284SS*.Hα-helixtrans-59.6-40.3-177.4-66.5-174.5174.500112.9M202 K203E199-M202 PolarHBondContact O-N 3.48Å; E199-K203 PolarHBondContact O-N 3.27Å
200D94.7Very high94.9Very high69 Ų6962.1 Ų62.137%0.36931%0.313SS..Hα-helixtrans-65.9-36.3173.564-42.8000111.9S198 K203 A204 E232S198-D200 VanDerWaalsContact C-N 3.32Å; S198-D200 WeakPolarHBondContact CB-OD1 3.15Å; S198-D200 PolarHBondContact O-N 3.49Å; S198-D200 PolarHBondContact OG-OD1 3.16Å; D200-K203 PolarHBondContact O-N 2.87Å; D200-A204 WeakPolarHBondContact O-CB 3.38Å; D200-A204 PolarHBondContact O-N 3.01Å; D200-E232 HydrophobicContact CB-CB 4.15Å; D200-E232 WeakPolarHBondContact OD2-CB 3.27Å; D200-E232 PolarHBondContact OD2-N 2.99Å
201G95.3Very high94.7Very high0 Ų061.5 Ų61.50%031%0.31CS..Hα-helixtrans-62.2-45.1172.800000112.4S198 K203 A204 L205S198-G201 WeakPolarHBondContact O-CA 3.18Å; S198-G201 PolarHBondContact O-N 2.74Å; G201-K203 VanDerWaalsContact C-N 3.35Å; G201-K203 PolarHBondContact O-N 2.78Å; G201-A204 PolarHBondContact O-N 2.79Å; G201-L205 VanDerWaalsContact O-CB 3.3Å; G201-L205 WeakPolarHBondContact O-CB 3.5Å; G201-L205 PolarHBondContact O-N 3.24Å
202M96.6Very high94.7Very high23 Ų2355.6 Ų55.611%0.11328%0.283CS..Hα-helixtrans-61.5-43.2174.6-177.562.580.600111.5V183 L186 E187 V190 I197 S198 E199 L205 V206V183-M202 HydrophobicContact CG2-CG 4.47Å; L186-M202 HydrophobicContact CB-CE 3.86Å; L186-M202 HydrophobicContact CB-SD 3.9Å; L186-M202 HydrophobicContact CD1-SD 3.84Å; E187-M202 HydrophobicContact CG-CE 4.16Å; V190-M202 HydrophobicContact CG2-CE 4.39Å; I197-M202 HydrophobicContact CD1-CB 4.09Å; I197-M202 HydrophobicContact CD1-CE 3.97Å; I197-M202 HydrophobicContact CD1-SD 4.33Å; I197-M202 HydrophobicContact CG1-CB 4.43Å; S198-M202 PolarHBondContact O-N 2.98Å; E199-M202 PolarHBondContact O-N 3.48Å; M202-L205 WeakPolarHBondContact O-CB 3.39Å; M202-L205 PolarHBondContact O-N 3.14Å; M202-L205 HydrophobicContact SD-CD2 4.41Å; M202-V206 WeakPolarHBondContact O-CB 3.31Å; M202-V206 WeakPolarHBondContact O-CG2 3.33Å; M202-V206 PolarHBondContact O-N 2.98Å; M202-V206 HydrophobicContact SD-CG2 4.43Å
203K95.4Very high94.6Very high151 Ų15150.9 Ų50.966%0.65726%0.262SS*.Hα-helixtrans-64.6-42.6177.5-172.4176.6-177.7176.30112.3E199 D200 G201 V206 T207E199-K203 PolarHBondContact O-N 3.27Å; D200-K203 PolarHBondContact O-N 2.87Å; G201-K203 VanDerWaalsContact C-N 3.35Å; G201-K203 PolarHBondContact O-N 2.78Å; K203-V206 PolarHBondContact O-N 3.1Å; K203-T207 WeakPolarHBondContact O-CB 3.39Å; K203-T207 PolarHBondContact O-N 3.1Å; K203-T207 PolarHBondContact O-OG1 3.45Å
204A93.4Very high94.7Very high3 Ų353.9 Ų53.93%0.02527%0.271CS..Hα-helixtrans-62.1-45.4176.100000111.1D200 G201 V206 T207 L208 E232 V235 Y236D200-A204 WeakPolarHBondContact O-CB 3.38Å; D200-A204 PolarHBondContact O-N 3.01Å; G201-A204 PolarHBondContact O-N 2.79Å; A204-V206 PolarHBondContact O-N 3.45Å; A204-T207 PolarHBondContact O-N 3.43Å; A204-L208 WeakPolarHBondContact O-CB 3.39Å; A204-L208 WeakPolarHBondContact O-CG 3.39Å; A204-L208 PolarHBondContact O-N 2.9Å; A204-E232 HydrophobicContact CB-CB 4.25Å; A204-E232 HydrophobicContact CB-CG 4.06Å; A204-V235 HydrophobicContact CB-CB 4.34Å; A204-V235 HydrophobicContact CB-CG1 4.28Å; A204-Y236 HydrophobicContact CB-CD2 4.23Å; A204-Y236 HydrophobicContact CB-CE2 3.86Å
205L95.3Very high94.7Very high0 Ų049.4 Ų49.40%025%0.249CC..Hα-helixtrans-57.7-49.5177.2-17868.4000112.3L186 G201 M202 T207 L208 S209 A216 I219 L220L186-L205 HydrophobicContact CD1-CD2 4.04Å; L186-L205 HydrophobicContact CD2-CD2 4.24Å; G201-L205 VanDerWaalsContact O-CB 3.3Å; G201-L205 WeakPolarHBondContact O-CB 3.5Å; G201-L205 PolarHBondContact O-N 3.24Å; M202-L205 WeakPolarHBondContact O-CB 3.39Å; M202-L205 PolarHBondContact O-N 3.14Å; M202-L205 HydrophobicContact SD-CD2 4.41Å; L205-T207 VanDerWaalsContact C-N 3.32Å; L205-T207 PolarHBondContact O-N 3.02Å; L205-L208 PolarHBondContact O-N 3.14Å; L205-S209 WeakPolarHBondContact O-CB 3.38Å; L205-S209 PolarHBondContact O-N 3.18Å; L205-A216 WeakPolarHBondContact CD1-O 3.46Å; L205-I219 HydrophobicContact CD1-CB 3.57Å; L205-I219 HydrophobicContact CD1-CG2 3.43Å; L205-I219 VanDerWaalsContact CD1-CG2 3.43Å; L205-L220 HydrophobicContact CD1-CB 4.22Å; L205-L220 HydrophobicContact CD2-CB 3.87Å; L205-L220 HydrophobicContact CD2-CD1 3.8Å; L205-L220 HydrophobicContact CD2-CG 4.26Å
206V95.5Very high94.7Very high16 Ų1648.9 Ų48.910%0.09725%0.246CC..Hα-helixtrans-64.1-37.9178.4163.40000111.8P179 M182 V183 L186 M202 K203 A204 S209P179-V206 HydrophobicContact CB-CG1 3.76Å; P179-V206 HydrophobicContact CG-CG1 3.82Å; M182-V206 HydrophobicContact CE-CB 4.37Å; M182-V206 HydrophobicContact CE-CG1 3.68Å; M182-V206 HydrophobicContact CE-CG2 4.38Å; V183-V206 HydrophobicContact CG2-CG2 3.9Å; L186-V206 HydrophobicContact CD1-CG2 3.96Å; M202-V206 WeakPolarHBondContact O-CB 3.31Å; M202-V206 WeakPolarHBondContact O-CG2 3.33Å; M202-V206 PolarHBondContact O-N 2.98Å; M202-V206 HydrophobicContact SD-CG2 4.43Å; K203-V206 PolarHBondContact O-N 3.1Å; A204-V206 PolarHBondContact O-N 3.45Å; V206-S209 PolarHBondContact O-OG 3.45Å
207T91.9Very high94.8Very high78 Ų7845.4 Ų45.448%0.47923%0.227SC..Hα-helixtrans-65.2-50.2177.6-580000110.5K203 A204 L205 S209 S210K203-T207 WeakPolarHBondContact O-CB 3.39Å; K203-T207 PolarHBondContact O-N 3.1Å; K203-T207 PolarHBondContact O-OG1 3.45Å; A204-T207 PolarHBondContact O-N 3.43Å; L205-T207 VanDerWaalsContact C-N 3.32Å; L205-T207 PolarHBondContact O-N 3.02Å; T207-S209 VanDerWaalsContact C-N 3.32Å; T207-S209 PolarHBondContact O-N 2.83Å; T207-S210 PolarHBondContact O-N 2.76Å; T207-S210 PolarHBondContact O-OG 2.9Å
208L91.5Very high94.7Very high12 Ų1246.7 Ų46.76%0.06323%0.234CC..Hα-helixtrans-72.1-24.1-177.9-69.1170.7000113A204 L205 S210 R215 I219 V235 Y236 H241A204-L208 WeakPolarHBondContact O-CB 3.39Å; A204-L208 WeakPolarHBondContact O-CG 3.39Å; A204-L208 PolarHBondContact O-N 2.9Å; L205-L208 PolarHBondContact O-N 3.14Å; L208-S210 VanDerWaalsContact C-N 3.26Å; L208-S210 PolarHBondContact O-N 3.3Å; L208-R215 PolarHBondContact O-NE 3.05Å; L208-R215 VanDerWaalsContact O-NE 3.1Å; L208-R215 PolarHBondContact O-NH1 3.44Å; L208-R215 VanDerWaalsContact O-NH1 3.14Å; L208-R215 PolarHBondContact O-NH2 3.17Å; L208-I219 HydrophobicContact CB-CD1 4.33Å; L208-V235 HydrophobicContact CD1-CG1 3.65Å; L208-Y236 HydrophobicContact CD1-CD1 4.23Å; L208-Y236 HydrophobicContact CD1-CD2 4.31Å; L208-Y236 HydrophobicContact CD1-CE1 4.19Å; L208-Y236 HydrophobicContact CD1-CE2 4.28Å; L208-Y236 HydrophobicContact CD1-CG 4.28Å; L208-Y236 HydrophobicContact CD2-CE1 3.97Å; L208-Y236 HydrophobicContact CG-CE1 4.4Å; L208-H241 HydrophobicContact CD2-CB 3.94Å
209S93.1Very high94.7Very high1 Ų146.1 Ų46.11%0.00723%0.229CC..Hα-helixtrans-70.9-23.4175.177.50000113L205 V206 T207 G211 D212L205-S209 WeakPolarHBondContact O-CB 3.38Å; L205-S209 PolarHBondContact O-N 3.18Å; V206-S209 PolarHBondContact O-OG 3.45Å; T207-S209 VanDerWaalsContact C-N 3.32Å; T207-S209 PolarHBondContact O-N 2.83Å; S209-G211 PolarHBondContact O-N 3.36Å; S209-G211 VanDerWaalsContact O-N 3.16Å; S209-D212 WeakPolarHBondContact O-CB 3.26Å; S209-D212 PolarHBondContact O-N 3.19Å
210S91.4Very high94.7Very high86 Ų8637.5 Ų37.560%0.60119%0.188SC*.THydrogen-bonded Turntrans51.336.3179-51.50000113.6T207 L208T207-S210 PolarHBondContact O-N 2.76Å; T207-S210 PolarHBondContact O-OG 2.9Å; L208-S210 VanDerWaalsContact C-N 3.26Å; L208-S210 PolarHBondContact O-N 3.3Å
211G92.9Very high94.8Very high6 Ų635.6 Ų35.66%0.06218%0.178CC..THydrogen-bonded Turntrans82.410.2179.400000115.3L177 S209L177-G211 WeakPolarHBondContact CB-O 3.32Å; L177-G211 WeakPolarHBondContact CG-O 3.24Å; L177-G211 PolarHBondContact N-O 2.69Å; L177-G211 VanDerWaalsContact O-CA 3.3Å; L177-G211 WeakPolarHBondContact O-CA 3.33Å; S209-G211 PolarHBondContact O-N 3.36Å; S209-G211 VanDerWaalsContact O-N 3.16Å
212D95.7Very high94.8Very high23 Ų2338.4 Ų38.412%0.12320%0.197CC..  trans-98.7111.2172.7-178.3-35.9000110.2P62 G63 S209 R214 R215 A216P62-D212 VanDerWaalsContact C-OD2 3.3Å; G63-D212 VanDerWaalsContact CA-OD1 3.32Å; G63-D212 WeakPolarHBondContact CA-OD1 3.3Å; S209-D212 WeakPolarHBondContact O-CB 3.26Å; S209-D212 PolarHBondContact O-N 3.19Å; D212-R214 VanDerWaalsContact C-N 3.33Å; D212-R214 PolarHBondContact O-N 3.16Å; D212-R214 WeakPolarHBondContact OD1-CA 3.37Å; D212-R214 VanDerWaalsContact OD1-CB 3.25Å; D212-R214 WeakPolarHBondContact OD1-CB 3.4Å; D212-R214 PolarHBondContact OD1-N 3.16Å; D212-R215 HydrophobicContact CB-CB 3.85Å; D212-R215 PolarHBondContact O-N 3.42Å; D212-R215 PolarHBondContact OD1-N 2.76Å; D212-A216 PolarHBondContact O-N 2.86Å
213M94.6Very high94.7Very high22 Ų2237.3 Ų37.311%0.10819%0.192CC..Hα-helixtrans-67.6-33.1-179.7-176.15462.700112.8I35 G63 L177 M182 R185 L186 A216 L217I35-M213 HydrophobicContact CD1-CE 3.67Å; G63-M213 PolarHBondContact O-N 2.94Å; L177-M213 HydrophobicContact CD1-CB 3.61Å; L177-M213 HydrophobicContact CD1-CE 4.23Å; M182-M213 HydrophobicContact CB-CE 3.61Å; M182-M213 HydrophobicContact CG-CE 3.63Å; M182-M213 HydrophobicContact SD-CE 4.37Å; R185-M213 HydrophobicContact CB-CE 4.17Å; R185-M213 HydrophobicContact CG-CE 4.43Å; R185-M213 HydrophobicContact CG-SD 4.38Å; L186-M213 HydrophobicContact CD2-SD 4.1Å; L186-M213 HydrophobicContact CG-SD 4.41Å; M213-A216 PolarHBondContact O-N 3.32Å; M213-A216 HydrophobicContact SD-CB 4.44Å; M213-L217 HydrophobicContact CG-CD1 4.24Å; M213-L217 HydrophobicContact CG-CG 4.49Å; M213-L217 WeakPolarHBondContact O-CG 3.4Å; M213-L217 PolarHBondContact O-N 3.02Å; M213-L217 HydrophobicContact SD-CD1 4.43Å; M213-L217 HydrophobicContact SD-CG 4.15Å
214R95.2Very high94.7Very high116 Ų11631.8 Ų31.844%0.43817%0.17SC..Hα-helixtrans-65.9-44.3178-175.5-170.6-64.7140.7-7.8109.8V23 D212 L217 N218V23-R214 HydrophobicContact CB-CG 4.2Å; V23-R214 HydrophobicContact CG1-CB 4.39Å; V23-R214 HydrophobicContact CG1-CG 3.67Å; V23-R214 WeakPolarHBondContact CG1-O 3.36Å; D212-R214 VanDerWaalsContact C-N 3.33Å; D212-R214 PolarHBondContact O-N 3.16Å; D212-R214 WeakPolarHBondContact OD1-CA 3.37Å; D212-R214 VanDerWaalsContact OD1-CB 3.25Å; D212-R214 WeakPolarHBondContact OD1-CB 3.4Å; D212-R214 PolarHBondContact OD1-N 3.16Å; R214-L217 PolarHBondContact O-N 3.11Å; R214-N218 WeakPolarHBondContact O-CB 3.31Å; R214-N218 PolarHBondContact O-N 3.14Å
215R95.6Very high94.7Very high93 Ų9338.5 Ų38.535%0.35120%0.202SC..Hα-helixtrans-61.7-45.5174.5-173.4174.8179-171.2-2110.9L208 D212 L217 N218 I219L208-R215 PolarHBondContact O-NE 3.05Å; L208-R215 VanDerWaalsContact O-NE 3.1Å; L208-R215 PolarHBondContact O-NH1 3.44Å; L208-R215 VanDerWaalsContact O-NH1 3.14Å; L208-R215 PolarHBondContact O-NH2 3.17Å; D212-R215 HydrophobicContact CB-CB 3.85Å; D212-R215 PolarHBondContact O-N 3.42Å; D212-R215 PolarHBondContact OD1-N 2.76Å; R215-L217 PolarHBondContact O-N 2.82Å; R215-N218 PolarHBondContact O-N 2.85Å; R215-I219 HydrophobicContact CG-CD1 3.73Å; R215-I219 HydrophobicContact CG-CG1 4.36Å; R215-I219 VanDerWaalsContact O-CG1 3.27Å; R215-I219 WeakPolarHBondContact O-CG1 3.39Å; R215-I219 PolarHBondContact O-N 2.99Å
216A96.4Very high94.5Very high0 Ų041.7 Ų41.70%023%0.228CC..Hα-helixtrans-56.5-51.7176.700000112L186 L205 D212 M213 N218 I219 L220L186-A216 HydrophobicContact CD1-CB 4.35Å; L186-A216 HydrophobicContact CD2-CB 3.99Å; L205-A216 WeakPolarHBondContact CD1-O 3.46Å; D212-A216 PolarHBondContact O-N 2.86Å; M213-A216 PolarHBondContact O-N 3.32Å; M213-A216 HydrophobicContact SD-CB 4.44Å; A216-N218 PolarHBondContact O-N 3.1Å; A216-I219 PolarHBondContact O-N 3.36Å; A216-L220 WeakPolarHBondContact O-CB 3.24Å; A216-L220 PolarHBondContact O-N 3.1Å
217L96.4Very high94.4Very high8 Ų845.9 Ų45.94%0.04225%0.245CC..Hα-helixtrans-63.6-39.1179.8-69.4173.7000112.7V23 L186 V189 M213 R214 R215 L220 Q221V23-L217 HydrophobicContact CG1-CB 3.77Å; V23-L217 HydrophobicContact CG1-CD1 4.45Å; L186-L217 HydrophobicContact CD2-CD2 3.97Å; V189-L217 HydrophobicContact CB-CD2 4.3Å; V189-L217 HydrophobicContact CG1-CD2 4.11Å; V189-L217 HydrophobicContact CG2-CD2 3.89Å; M213-L217 HydrophobicContact CG-CD1 4.24Å; M213-L217 HydrophobicContact CG-CG 4.49Å; M213-L217 WeakPolarHBondContact O-CG 3.4Å; M213-L217 PolarHBondContact O-N 3.02Å; M213-L217 HydrophobicContact SD-CD1 4.43Å; M213-L217 HydrophobicContact SD-CG 4.15Å; R214-L217 PolarHBondContact O-N 3.11Å; R215-L217 PolarHBondContact O-N 2.82Å; L217-L220 PolarHBondContact O-N 3.22Å; L217-Q221 WeakPolarHBondContact O-CB 3.35Å; L217-Q221 PolarHBondContact O-N 3.43Å
218N96.1Very high94.3Very high64 Ų6444.4 Ų44.434%0.34225%0.246SC..Hα-helixtrans-64-44.1176.5-81.5-17.2000112.3V23 R214 R215 A216 S222V23-N218 WeakPolarHBondContact CG1-OD1 3.2Å; R214-N218 WeakPolarHBondContact O-CB 3.31Å; R214-N218 PolarHBondContact O-N 3.14Å; R215-N218 PolarHBondContact O-N 2.85Å; A216-N218 PolarHBondContact O-N 3.1Å; N218-S222 VanDerWaalsContact O-CB 3.27Å; N218-S222 WeakPolarHBondContact O-CB 3.46Å; N218-S222 PolarHBondContact O-N 3.42Å; N218-S222 PolarHBondContact O-OG 3.46Å
219I95.7Very high94.5Very high16 Ų1648.1 Ų48.18%0.08226%0.261CS..Hα-helixtrans-65.8-44.8178-65.6168.4000109.9L205 L208 R215 A216 S222 T223 V235 T239L205-I219 HydrophobicContact CD1-CB 3.57Å; L205-I219 HydrophobicContact CD1-CG2 3.43Å; L205-I219 VanDerWaalsContact CD1-CG2 3.43Å; L208-I219 HydrophobicContact CB-CD1 4.33Å; R215-I219 HydrophobicContact CG-CD1 3.73Å; R215-I219 HydrophobicContact CG-CG1 4.36Å; R215-I219 VanDerWaalsContact O-CG1 3.27Å; R215-I219 WeakPolarHBondContact O-CG1 3.39Å; R215-I219 PolarHBondContact O-N 2.99Å; A216-I219 PolarHBondContact O-N 3.36Å; I219-S222 PolarHBondContact O-N 3.07Å; I219-T223 VanDerWaalsContact O-CB 3.31Å; I219-T223 WeakPolarHBondContact O-CB 3.49Å; I219-T223 PolarHBondContact O-N 3.31Å; I219-T223 PolarHBondContact O-OG1 3.46Å; I219-V235 HydrophobicContact CG2-CG1 3.8Å; I219-T239 HydrophobicContact CB-CG2 4.36Å; I219-T239 HydrophobicContact CD1-CG2 3.88Å; I219-T239 HydrophobicContact CG1-CG2 3.77Å; I219-T239 HydrophobicContact CG2-CG2 3.68Å
220L96.9Very high94.6Very high0 Ų048 Ų480%026%0.261CS..Hα-helixtrans-59.1-50178.5-176.171.8000111.2W22 V189 V190 V195 I197 L205 A216 L217 T223 N224 V230W22-L220 HydrophobicContact CE3-CD2 4.2Å; W22-L220 HydrophobicContact CE3-CG 4.41Å; W22-L220 HydrophobicContact CZ3-CB 4.37Å; W22-L220 HydrophobicContact CZ3-CD2 3.81Å; W22-L220 HydrophobicContact CZ3-CG 3.79Å; V189-L220 HydrophobicContact CG1-CD2 4.22Å; V190-L220 HydrophobicContact CG2-CD1 4.4Å; V190-L220 HydrophobicContact CG2-CD2 4.09Å; V195-L220 HydrophobicContact CG1-CD1 4.43Å; I197-L220 HydrophobicContact CD1-CD1 3.71Å; L205-L220 HydrophobicContact CD1-CB 4.22Å; L205-L220 HydrophobicContact CD2-CB 3.87Å; L205-L220 HydrophobicContact CD2-CD1 3.8Å; L205-L220 HydrophobicContact CD2-CG 4.26Å; A216-L220 WeakPolarHBondContact O-CB 3.24Å; A216-L220 PolarHBondContact O-N 3.1Å; L217-L220 PolarHBondContact O-N 3.22Å; L220-T223 PolarHBondContact O-N 3.28Å; L220-N224 VanDerWaalsContact O-CB 3.32Å; L220-N224 WeakPolarHBondContact O-CB 3.42Å; L220-N224 PolarHBondContact O-N 3.16Å; L220-V230 HydrophobicContact CD1-CG1 4.15Å; L220-V230 HydrophobicContact CD1-CG2 4.15Å
221Q96Very high94.8Very high30 Ų3045.4 Ų45.414%0.1424%0.241CC..Hα-helixtrans-60.2-48.4178.6-173.6174.211.900111.4W22 L217 T223 N224 M225W22-Q221 HydrophobicContact CB-CB 4.44Å; W22-Q221 HydrophobicContact CD2-CB 3.6Å; W22-Q221 HydrophobicContact CD2-CG 3.64Å; W22-Q221 HydrophobicContact CE3-CB 3.45Å; W22-Q221 VanDerWaalsContact CE3-CB 3.45Å; W22-Q221 HydrophobicContact CE3-CG 4Å; W22-Q221 HydrophobicContact CG-CB 4.07Å; W22-Q221 HydrophobicContact CG-CG 3.95Å; W22-Q221 HydrophobicContact CH2-CB 4.44Å; W22-Q221 HydrophobicContact CZ2-CG 4.23Å; W22-Q221 VanDerWaalsContact CZ3-CA 3.47Å; W22-Q221 HydrophobicContact CZ3-CB 3.92Å; W22-Q221 HydrophobicContact CZ3-CG 4.43Å; L217-Q221 WeakPolarHBondContact O-CB 3.35Å; L217-Q221 PolarHBondContact O-N 3.43Å; Q221-T223 PolarHBondContact O-N 2.84Å; Q221-N224 PolarHBondContact O-N 3.1Å; Q221-M225 HydrophobicContact CG-CG 4.39Å; Q221-M225 HydrophobicContact CG-SD 3.77Å; Q221-M225 WeakPolarHBondContact O-CB 3.47Å; Q221-M225 VanDerWaalsContact O-CG 3.25Å; Q221-M225 WeakPolarHBondContact O-CG 3.33Å; Q221-M225 PolarHBondContact O-N 2.91Å
222S94.7Very high94.8Very high59 Ų5948.4 Ų48.441%0.41325%0.254SS..Hα-helixtrans-64.4-43-177.2-55.90000111.6N218 I219 M225 A226N218-S222 VanDerWaalsContact O-CB 3.27Å; N218-S222 WeakPolarHBondContact O-CB 3.46Å; N218-S222 PolarHBondContact O-N 3.42Å; N218-S222 PolarHBondContact O-OG 3.46Å; I219-S222 PolarHBondContact O-N 3.07Å; S222-M225 PolarHBondContact O-N 3.34Å; S222-A226 VanDerWaalsContact O-CB 3.25Å; S222-A226 WeakPolarHBondContact O-CB 3.31Å; S222-A226 PolarHBondContact O-N 2.97Å
223T95.2Very high94.6Very high0 Ų053.6 Ų53.60%028%0.277CS..Hα-helixtrans-65.5-46179.3-52.30000110.8I219 L220 Q221 M225 A226 F227 V230 T234 V235 C238I219-T223 VanDerWaalsContact O-CB 3.31Å; I219-T223 WeakPolarHBondContact O-CB 3.49Å; I219-T223 PolarHBondContact O-N 3.31Å; I219-T223 PolarHBondContact O-OG1 3.46Å; L220-T223 PolarHBondContact O-N 3.28Å; Q221-T223 PolarHBondContact O-N 2.84Å; T223-M225 PolarHBondContact O-N 2.84Å; T223-A226 PolarHBondContact O-N 3.29Å; T223-F227 HydrophobicContact CG2-CD2 4.16Å; T223-F227 PolarHBondContact O-N 3.27Å; T223-V230 HydrophobicContact CG2-CB 4.43Å; T223-V230 HydrophobicContact CG2-CG1 4.2Å; T223-V230 HydrophobicContact CG2-CG2 4.13Å; T223-T234 WeakPolarHBondContact CG2-OG1 3.47Å; T223-V235 HydrophobicContact CG2-CG2 4.06Å; T223-C238 HydrophobicContact CG2-CB 4.45Å
224N95.6Very high94.5Very high35 Ų3553.6 Ų53.619%0.18728%0.278CS..Hα-helixtrans-62-43.4176.8-178.560.5000112W22 V195 L220 Q221 A226 G228 V230W22-N224 HydrophobicContact CH2-CB 4.2Å; V195-N224 HydrophobicContact CG1-CB 4.16Å; L220-N224 VanDerWaalsContact O-CB 3.32Å; L220-N224 WeakPolarHBondContact O-CB 3.42Å; L220-N224 PolarHBondContact O-N 3.16Å; Q221-N224 PolarHBondContact O-N 3.1Å; N224-A226 VanDerWaalsContact C-N 3.35Å; N224-A226 PolarHBondContact O-N 3.44Å; N224-G228 WeakPolarHBondContact O-CA 3.41Å; N224-G228 PolarHBondContact O-N 3.02Å; N224-V230 HydrophobicContact CB-CG2 4.07Å
225M92.4Very high94.5Very high143 Ų14348 Ų4870%0.70426%0.257SS*.Hα-helixtrans-67.8-33.3178.6-73.4179.263.200113.1Q221 S222 T223Q221-M225 HydrophobicContact CG-CG 4.39Å; Q221-M225 HydrophobicContact CG-SD 3.77Å; Q221-M225 WeakPolarHBondContact O-CB 3.47Å; Q221-M225 VanDerWaalsContact O-CG 3.25Å; Q221-M225 WeakPolarHBondContact O-CG 3.33Å; Q221-M225 PolarHBondContact O-N 2.91Å; S222-M225 PolarHBondContact O-N 3.34Å; T223-M225 PolarHBondContact O-N 2.84Å
226A91.8Very high94.2Very high67 Ų6744.1 Ų44.155%0.55424%0.243SC*.Hα-helixtrans-81.4-41.5-178.100000113.1S222 T223 N224S222-A226 VanDerWaalsContact O-CB 3.25Å; S222-A226 WeakPolarHBondContact O-CB 3.31Å; S222-A226 PolarHBondContact O-N 2.97Å; T223-A226 PolarHBondContact O-N 3.29Å; N224-A226 VanDerWaalsContact C-N 3.35Å; N224-A226 PolarHBondContact O-N 3.44Å
227F92.8Very high93.8Very high104 Ų10448.1 Ų48.146%0.45627%0.267SS..Hα-helixtrans-118.2-12.7-169.6-60.1-77.2000114.3T223 K229 T234 T237 C238T223-F227 HydrophobicContact CG2-CD2 4.16Å; T223-F227 PolarHBondContact O-N 3.27Å; F227-K229 PolarHBondContact O-N 3.19Å; F227-T234 HydrophobicContact CB-CG2 3.97Å; F227-T234 HydrophobicContact CD1-CG2 4.37Å; F227-T234 HydrophobicContact CD2-CG2 4.34Å; F227-T234 HydrophobicContact CG-CG2 3.98Å; F227-T237 HydrophobicContact CZ-CG2 4.25Å; F227-C238 HydrophobicContact CE2-CB 3.96Å
228G91.2Very high93.4Very high47 Ų4749.9 Ų49.949%0.48528%0.279SS..SBendtrans74-19-17800000115.2N224N224-G228 WeakPolarHBondContact O-CA 3.41Å; N224-G228 PolarHBondContact O-N 3.02Å
229K94Very high93Very high90 Ų9048.7 Ų48.739%0.39128%0.275SS..EExtended strand (participates in β ladder)trans-132.9141.1175.3-175.2172.4-171.2150.10110.5D196 F227 T231 T234D196-K229 HydrophobicContact CB-CG 4.26Å; D196-K229 WeakPolarHBondContact O-CA 3.42Å; D196-K229 IonicContact OD1-NZ 3.14Å; D196-K229 VanDerWaalsContact OD2-CD 3.28Å; D196-K229 WeakPolarHBondContact OD2-CD 3.45Å; D196-K229 WeakPolarHBondContact OD2-CE 3.39Å; D196-K229 IonicContact OD2-NZ 3.45Å; D196-K229 PolarHBondContact OD2-NZ 2.91Å; F227-K229 PolarHBondContact O-N 3.19Å; K229-T231 HydrophobicContact CD-CG2 4.05Å; K229-T231 HydrophobicContact CG-CG2 3.98Å; K229-T234 PolarHBondContact O-OG1 3.37Å
230V96.3Very high92.4Very high0 Ų049.1 Ų49.10%028%0.283CS..EExtended strand (participates in β ladder)trans-107.6100.9-178.8-174.50000110.1V195 D196 I197 S198 L220 T223 N224 V235V195-V230 HydrophobicContact CG1-CG2 3.72Å; D196-V230 PolarHBondContact O-N 3.04Å; I197-V230 WeakPolarHBondContact CA-O 3.3Å; I197-V230 HydrophobicContact CB-CB 4.09Å; I197-V230 HydrophobicContact CD1-CB 4.19Å; I197-V230 HydrophobicContact CD1-CG1 3.81Å; I197-V230 HydrophobicContact CG1-CB 3.91Å; I197-V230 HydrophobicContact CG1-CG1 3.94Å; S198-V230 PolarHBondContact N-O 3.24Å; S198-V230 PolarHBondContact OG-O 3.43Å; L220-V230 HydrophobicContact CD1-CG1 4.15Å; L220-V230 HydrophobicContact CD1-CG2 4.15Å; T223-V230 HydrophobicContact CG2-CB 4.43Å; T223-V230 HydrophobicContact CG2-CG1 4.2Å; T223-V230 HydrophobicContact CG2-CG2 4.13Å; N224-V230 HydrophobicContact CB-CG2 4.07Å; V230-V235 HydrophobicContact CG1-CG2 3.51Å
231T96Very high91.9Very high30 Ų3051 Ų5118%0.18429%0.292CS..  trans-118.2168.7173.769.20000111.5S198 K229 E233 T234 V235S198-T231 WeakPolarHBondContact OG-CA 3.35Å; K229-T231 HydrophobicContact CD-CG2 4.05Å; K229-T231 HydrophobicContact CG-CG2 3.98Å; T231-E233 VanDerWaalsContact C-N 3.3Å; T231-E233 PolarHBondContact O-N 2.78Å; T231-T234 PolarHBondContact N-OG1 2.68Å; T231-T234 PolarHBondContact O-N 3.15Å; T231-T234 PolarHBondContact O-OG1 3.32Å; T231-T234 PolarHBondContact OG1-N 3.04Å; T231-T234 PolarHBondContact OG1-OG1 3.36Å; T231-V235 VanDerWaalsContact O-CG2 3.25Å; T231-V235 WeakPolarHBondContact O-CG2 3.46Å; T231-V235 PolarHBondContact O-N 3.32Å
232E93Very high91.5Very high70 Ų7049.6 Ų49.633%0.32729%0.285SS..Hα-helixtrans-51.3-50.4175.6-179.2172.1-148.300111.2D200 A204 T234 V235 Y236D200-E232 HydrophobicContact CB-CB 4.15Å; D200-E232 WeakPolarHBondContact OD2-CB 3.27Å; D200-E232 PolarHBondContact OD2-N 2.99Å; A204-E232 HydrophobicContact CB-CB 4.25Å; A204-E232 HydrophobicContact CB-CG 4.06Å; E232-T234 PolarHBondContact O-N 3.17Å; E232-V235 PolarHBondContact O-N 3.27Å; E232-Y236 HydrophobicContact CG-CD2 3.86Å; E232-Y236 HydrophobicContact CG-CE2 3.88Å; E232-Y236 VanDerWaalsContact O-CD2 3.31Å; E232-Y236 WeakPolarHBondContact O-CD2 3.25Å; E232-Y236 PolarHBondContact O-N 2.97Å; E232-Y236 VanDerWaalsContact O-N 3.1Å
233E90.6Very high91.2Very high132 Ų13248.4 Ų48.462%0.61727%0.274SS*.Hα-helixtrans-58.9-48.3-179.2-176.1-179.9-176.900113.2T231 V235 Y236 T237T231-E233 VanDerWaalsContact C-N 3.3Å; T231-E233 PolarHBondContact O-N 2.78Å; E233-V235 VanDerWaalsContact C-N 3.32Å; E233-V235 PolarHBondContact O-N 3.02Å; E233-Y236 PolarHBondContact O-N 3.11Å; E233-T237 VanDerWaalsContact O-CB 3.3Å; E233-T237 WeakPolarHBondContact O-CB 3.46Å; E233-T237 PolarHBondContact O-N 3.16Å; E233-T237 PolarHBondContact O-OG1 2.98Å
234T93.2Very high90.8Very high21 Ų2154.3 Ų54.313%0.12930%0.3CS..Hα-helixtrans-65.4-35.9-178.657.50000112T223 F227 K229 T231 E232 C238T223-T234 WeakPolarHBondContact CG2-OG1 3.47Å; F227-T234 HydrophobicContact CB-CG2 3.97Å; F227-T234 HydrophobicContact CD1-CG2 4.37Å; F227-T234 HydrophobicContact CD2-CG2 4.34Å; F227-T234 HydrophobicContact CG-CG2 3.98Å; K229-T234 PolarHBondContact O-OG1 3.37Å; T231-T234 PolarHBondContact N-OG1 2.68Å; T231-T234 PolarHBondContact O-N 3.15Å; T231-T234 PolarHBondContact O-OG1 3.32Å; T231-T234 PolarHBondContact OG1-N 3.04Å; T231-T234 PolarHBondContact OG1-OG1 3.36Å; E232-T234 PolarHBondContact O-N 3.17Å; T234-C238 WeakPolarHBondContact O-CB 3.43Å; T234-C238 PolarHBondContact O-N 3.06Å
235V94.1Very high90.5Very high0 Ų055.9 Ų55.90%031%0.314CS..Hα-helixtrans-67.7-47.8178.61750000110.7A204 L208 I219 T223 V230 T231 E232 E233 C238 T239A204-V235 HydrophobicContact CB-CB 4.34Å; A204-V235 HydrophobicContact CB-CG1 4.28Å; L208-V235 HydrophobicContact CD1-CG1 3.65Å; I219-V235 HydrophobicContact CG2-CG1 3.8Å; T223-V235 HydrophobicContact CG2-CG2 4.06Å; V230-V235 HydrophobicContact CG1-CG2 3.51Å; T231-V235 VanDerWaalsContact O-CG2 3.25Å; T231-V235 WeakPolarHBondContact O-CG2 3.46Å; T231-V235 PolarHBondContact O-N 3.32Å; E232-V235 PolarHBondContact O-N 3.27Å; E233-V235 VanDerWaalsContact C-N 3.32Å; E233-V235 PolarHBondContact O-N 3.02Å; V235-C238 PolarHBondContact O-N 3.36Å; V235-T239 WeakPolarHBondContact O-CG2 3.43Å; V235-T239 PolarHBondContact O-N 2.92Å; V235-T239 VanDerWaalsContact O-N 3.1Å; V235-T239 PolarHBondContact O-OG1 3.06Å
236Y90.7Very high90.4Very high11 Ų1149.5 Ų49.54%0.04328%0.282CS..Hα-helixtrans-63.7-42.7177.7-86.4-87.8000111.3A204 L208 E232 E233 T239 G240 H241 P242 L243A204-Y236 HydrophobicContact CB-CD2 4.23Å; A204-Y236 HydrophobicContact CB-CE2 3.86Å; L208-Y236 HydrophobicContact CD1-CD1 4.23Å; L208-Y236 HydrophobicContact CD1-CD2 4.31Å; L208-Y236 HydrophobicContact CD1-CE1 4.19Å; L208-Y236 HydrophobicContact CD1-CE2 4.28Å; L208-Y236 HydrophobicContact CD1-CG 4.28Å; L208-Y236 HydrophobicContact CD2-CE1 3.97Å; L208-Y236 HydrophobicContact CG-CE1 4.4Å; E232-Y236 HydrophobicContact CG-CD2 3.86Å; E232-Y236 HydrophobicContact CG-CE2 3.88Å; E232-Y236 VanDerWaalsContact O-CD2 3.31Å; E232-Y236 WeakPolarHBondContact O-CD2 3.25Å; E232-Y236 PolarHBondContact O-N 2.97Å; E232-Y236 VanDerWaalsContact O-N 3.1Å; E233-Y236 PolarHBondContact O-N 3.11Å; Y236-T239 PolarHBondContact O-N 2.88Å; Y236-T239 PolarHBondContact O-OG1 3.15Å; Y236-G240 PolarHBondContact O-N 2.95Å; Y236-H241 HydrophobicContact CD1-CB 3.71Å; Y236-H241 HydrophobicContact CE1-CB 4.16Å; Y236-H241 PolarHBondContact O-N 3.44Å; Y236-H241 VanDerWaalsContact O-N 3.1Å; Y236-P242 WeakPolarHBondContact CD1-O 3.38Å; Y236-P242 WeakPolarHBondContact CE1-O 3.33Å; Y236-L243 HydrophobicContact CD1-CD2 4.33Å; Y236-L243 HydrophobicContact CD2-CD2 3.88Å; Y236-L243 HydrophobicContact CG-CD2 3.68Å
237T86.9Confident90.5Very high83 Ų8346.6 Ų46.651%0.50926%0.258SS..Hα-helixtrans-64.5-43.2177.2-55.20000111.9F227 E233 T239 G240F227-T237 HydrophobicContact CZ-CG2 4.25Å; E233-T237 VanDerWaalsContact O-CB 3.3Å; E233-T237 WeakPolarHBondContact O-CB 3.46Å; E233-T237 PolarHBondContact O-N 3.16Å; E233-T237 PolarHBondContact O-OG1 2.98Å; T237-T239 VanDerWaalsContact C-N 3.27Å; T237-T239 PolarHBondContact O-N 3.34Å; T237-G240 PolarHBondContact O-N 3.4Å
238C88.4Confident90.4Very high45 Ų4543.9 Ų43.930%0.30425%0.254SS..Hα-helixtrans-63.1-33.9178.3-1720000112.5T223 F227 T234 V235T223-C238 HydrophobicContact CG2-CB 4.45Å; F227-C238 HydrophobicContact CE2-CB 3.96Å; T234-C238 WeakPolarHBondContact O-CB 3.43Å; T234-C238 PolarHBondContact O-N 3.06Å; V235-C238 PolarHBondContact O-N 3.36Å
239T87.8Confident90.5Very high40 Ų4045.1 Ų45.125%0.24525%0.25CC..Hα-helixtrans-91.4-7.9-177.755.60000113.4I219 V235 Y236 T237 H241I219-T239 HydrophobicContact CB-CG2 4.36Å; I219-T239 HydrophobicContact CD1-CG2 3.88Å; I219-T239 HydrophobicContact CG1-CG2 3.77Å; I219-T239 HydrophobicContact CG2-CG2 3.68Å; V235-T239 WeakPolarHBondContact O-CG2 3.43Å; V235-T239 PolarHBondContact O-N 2.92Å; V235-T239 VanDerWaalsContact O-N 3.1Å; V235-T239 PolarHBondContact O-OG1 3.06Å; Y236-T239 PolarHBondContact O-N 2.88Å; Y236-T239 PolarHBondContact O-OG1 3.15Å; T237-T239 VanDerWaalsContact C-N 3.27Å; T237-T239 PolarHBondContact O-N 3.34Å; T239-H241 PolarHBondContact O-N 3.14Å
240G83.9Confident90.5Very high25 Ų2540.9 Ų40.926%0.25823%0.232SC..THydrogen-bonded Turntrans66.416.4-173.700000113.5Y236 T237 L275Y236-G240 PolarHBondContact O-N 2.95Å; T237-G240 PolarHBondContact O-N 3.4Å; G240-L275 WeakPolarHBondContact O-CD2 3.31Å
241H86.1Confident90.3Very high38 Ų3841.3 Ų41.318%0.17623%0.234CC..PPolyproline II helixtrans-82.1140.9177.5-90.3-89.6000110.4L208 Y236 T239 D279L208-H241 HydrophobicContact CD2-CB 3.94Å; Y236-H241 HydrophobicContact CD1-CB 3.71Å; Y236-H241 HydrophobicContact CE1-CB 4.16Å; Y236-H241 PolarHBondContact O-N 3.44Å; Y236-H241 VanDerWaalsContact O-N 3.1Å; T239-H241 PolarHBondContact O-N 3.14Å; H241-D279 IonicContact CE1-OD1 3.07Å; H241-D279 PolarHBondContact CE1-OD1 3.26Å; H241-D279 VanDerWaalsContact CE1-OD1 3.27Å; H241-D279 IonicContact NE2-OD1 3.62Å
242P87.6Confident90.1Very high2 Ų243.1 Ų43.11%0.01324%0.242CC..PPolyproline II helixtrans-70.3139.2179.928.1-33.5000111.6Y236 I247 L275 D279 E283Y236-P242 WeakPolarHBondContact CD1-O 3.38Å; Y236-P242 WeakPolarHBondContact CE1-O 3.33Å; P242-I247 HydrophobicContact CB-CD1 3.67Å; P242-I247 HydrophobicContact CB-CG1 3.94Å; P242-I247 HydrophobicContact CG-CD1 3.7Å; P242-I247 HydrophobicContact CG-CG1 4.12Å; P242-L275 HydrophobicContact CB-CD1 4.02Å; P242-L275 HydrophobicContact CB-CD2 3.91Å; P242-D279 HydrophobicContact CG-CB 4.2Å; P242-E283 HydrophobicContact CG-CG 3.95Å
243L87.6Confident90.2Very high33 Ų3342 Ų4217%0.17324%0.235CC..PPolyproline II helixtrans-70.6154172.1-67.6164.7000110.4Y236 S245 D246 I247Y236-L243 HydrophobicContact CD1-CD2 4.33Å; Y236-L243 HydrophobicContact CD2-CD2 3.88Å; Y236-L243 HydrophobicContact CG-CD2 3.68Å; L243-S245 PolarHBondContact O-N 2.98Å; L243-D246 HydrophobicContact CB-CB 4.47Å; L243-D246 WeakPolarHBondContact O-CB 3.37Å; L243-D246 PolarHBondContact O-N 3.26Å; L243-I247 PolarHBondContact O-N 2.98Å; L243-I247 VanDerWaalsContact O-N 3.09Å
244K86.2Confident90.4Very high124 Ų12435.7 Ų35.754%0.53921%0.206SC..Hα-helixtrans-57.5-36.4176-68.9174.8-174152.80112.9D246 I247 A248K244-D246 VanDerWaalsContact C-N 3.33Å; K244-I247 PolarHBondContact O-N 3.42Å; K244-A248 WeakPolarHBondContact O-CB 3.45Å; K244-A248 PolarHBondContact O-N 3.22Å
245S89.4Confident90.2Very high69 Ų6936.3 Ų36.348%0.48321%0.208SC..Hα-helixtrans-64.7-37.3175.454.60000112.3L243 A248 N249L243-S245 PolarHBondContact O-N 2.98Å; S245-A248 PolarHBondContact O-N 3.09Å; S245-N249 VanDerWaalsContact O-CG 3.25Å; S245-N249 PolarHBondContact O-N 3.46Å; S245-N249 PolarHBondContact O-ND2 2.84Å
246D91.3Very high90Very high8 Ų841 Ų414%0.04323%0.233CC..Hα-helixtrans-67.6-43.3178-66-30.9000110.7L243 K244 N249 I250 L269 K273L243-D246 HydrophobicContact CB-CB 4.47Å; L243-D246 WeakPolarHBondContact O-CB 3.37Å; L243-D246 PolarHBondContact O-N 3.26Å; K244-D246 VanDerWaalsContact C-N 3.33Å; D246-N249 PolarHBondContact O-N 3.31Å; D246-I250 VanDerWaalsContact O-CG1 3.28Å; D246-I250 WeakPolarHBondContact O-CG1 3.39Å; D246-I250 PolarHBondContact O-N 3.45Å; D246-L269 HydrophobicContact CB-CD2 4.13Å; D246-K273 IonicContact OD1-NZ 3.52Å; D246-K273 PolarHBondContact OD1-NZ 2.71Å; D246-K273 WeakPolarHBondContact OD2-CD 3.1Å; D246-K273 IonicContact OD2-NZ 2.91Å; D246-K273 PolarHBondContact OD2-NZ 2.99Å
247I92.4Very high90.1Very high7 Ų744 Ų444%0.03625%0.248CC..Hα-helixtrans-64.4-40.5176.3-61.6-61.5000111.5P242 L243 K244 N249 I250 L251 I280 E283 I284P242-I247 HydrophobicContact CB-CD1 3.67Å; P242-I247 HydrophobicContact CB-CG1 3.94Å; P242-I247 HydrophobicContact CG-CD1 3.7Å; P242-I247 HydrophobicContact CG-CG1 4.12Å; L243-I247 PolarHBondContact O-N 2.98Å; L243-I247 VanDerWaalsContact O-N 3.09Å; K244-I247 PolarHBondContact O-N 3.42Å; I247-N249 VanDerWaalsContact C-N 3.35Å; I247-N249 PolarHBondContact O-N 3.21Å; I247-I250 HydrophobicContact CD1-CD1 4.32Å; I247-I250 PolarHBondContact O-N 3.02Å; I247-L251 WeakPolarHBondContact O-CB 3.32Å; I247-L251 PolarHBondContact O-N 3.02Å; I247-I280 HydrophobicContact CD1-CG1 4.48Å; I247-I280 HydrophobicContact CD1-CG2 4.45Å; I247-E283 HydrophobicContact CB-CB 4.45Å; I247-E283 HydrophobicContact CD1-CB 3.65Å; I247-E283 HydrophobicContact CD1-CG 4.3Å; I247-E283 HydrophobicContact CG1-CB 3.62Å; I247-E283 HydrophobicContact CG1-CG 4.16Å; I247-E283 HydrophobicContact CG2-CB 4.09Å; I247-I284 HydrophobicContact CG2-CG1 4.16Å
248A91Very high90.5Very high47 Ų4743.9 Ų43.939%0.38824%0.244SC..Hα-helixtrans-60.6-43.7174.800000111.7K244 S245 L251 D252K244-A248 WeakPolarHBondContact O-CB 3.45Å; K244-A248 PolarHBondContact O-N 3.22Å; S245-A248 PolarHBondContact O-N 3.09Å; A248-L251 PolarHBondContact O-N 3.43Å; A248-D252 WeakPolarHBondContact O-CB 3.4Å; A248-D252 PolarHBondContact O-N 3.05Å
249N93.5Very high90.8Very high73 Ų7345.6 Ų45.639%0.3925%0.246SC..Hα-helixtrans-63.8-44.9175.4-70.6-25.4000112.1S245 D246 I247 L251 D252 W253S245-N249 VanDerWaalsContact O-CG 3.25Å; S245-N249 PolarHBondContact O-N 3.46Å; S245-N249 PolarHBondContact O-ND2 2.84Å; D246-N249 PolarHBondContact O-N 3.31Å; I247-N249 VanDerWaalsContact C-N 3.35Å; I247-N249 PolarHBondContact O-N 3.21Å; N249-L251 VanDerWaalsContact C-N 3.27Å; N249-L251 PolarHBondContact O-N 3.36Å; N249-D252 PolarHBondContact O-N 3Å; N249-W253 HydrophobicContact CB-CH2 4.12Å; N249-W253 HydrophobicContact CB-CZ2 3.93Å; N249-W253 PolarHBondContact O-N 3.38Å
250I94.8Very high91.2Very high1 Ų148.6 Ų48.61%0.00526%0.264CS..Hα-helixtrans-57.6-44.9177.5-72.3167000110.4D246 I247 W253 M254 I266 L269 I280 I284D246-I250 VanDerWaalsContact O-CG1 3.28Å; D246-I250 WeakPolarHBondContact O-CG1 3.39Å; D246-I250 PolarHBondContact O-N 3.45Å; I247-I250 HydrophobicContact CD1-CD1 4.32Å; I247-I250 PolarHBondContact O-N 3.02Å; I250-W253 HydrophobicContact CG1-CE3 4.35Å; I250-W253 HydrophobicContact CG1-CZ3 4.23Å; I250-W253 PolarHBondContact O-N 3.3Å; I250-M254 HydrophobicContact CG2-CE 3.65Å; I250-M254 HydrophobicContact CG2-SD 4.25Å; I250-M254 WeakPolarHBondContact O-CG 3.04Å; I250-M254 PolarHBondContact O-N 2.93Å; I250-I266 HydrophobicContact CG1-CG1 4.4Å; I250-I266 HydrophobicContact CG1-CG2 4.42Å; I250-I266 HydrophobicContact CG2-CD1 4.2Å; I250-I266 HydrophobicContact CG2-CG1 4.12Å; I250-I266 HydrophobicContact CG2-CG2 4.41Å; I250-L269 HydrophobicContact CD1-CD2 4.03Å; I250-L269 HydrophobicContact CG1-CD2 3.86Å; I250-I280 HydrophobicContact CD1-CD1 3.98Å; I250-I280 HydrophobicContact CD1-CG1 4.04Å; I250-I280 HydrophobicContact CD1-CG2 4.06Å; I250-I280 HydrophobicContact CG2-CG2 4.17Å; I250-I284 HydrophobicContact CG2-CD1 3.87Å
251L92.1Very high91.8Very high8 Ų848.9 Ų48.94%0.04226%0.261CS..Hα-helixtrans-68.6-42.8180-171.976.1000112.4I247 A248 N249 W253 M254 L255 F287 F329I247-L251 WeakPolarHBondContact O-CB 3.32Å; I247-L251 PolarHBondContact O-N 3.02Å; A248-L251 PolarHBondContact O-N 3.43Å; N249-L251 VanDerWaalsContact C-N 3.27Å; N249-L251 PolarHBondContact O-N 3.36Å; L251-W253 VanDerWaalsContact C-N 3.26Å; L251-W253 PolarHBondContact O-N 3.48Å; L251-M254 PolarHBondContact O-N 3.4Å; L251-M254 VanDerWaalsContact O-N 3.1Å; L251-L255 HydrophobicContact CD1-CD1 4.1Å; L251-L255 HydrophobicContact CD1-CG 4.33Å; L251-L255 HydrophobicContact CD2-CD1 4.06Å; L251-L255 HydrophobicContact CG-CD1 3.75Å; L251-L255 HydrophobicContact CG-CG 4.26Å; L251-L255 WeakPolarHBondContact O-CB 2.97Å; L251-L255 PolarHBondContact O-N 2.96Å; L251-F287 HydrophobicContact CD2-CD1 3.14Å; L251-F287 HydrophobicContact CD2-CD2 4.47Å; L251-F287 HydrophobicContact CD2-CE1 2.88Å; L251-F287 HydrophobicContact CD2-CE2 4.3Å; L251-F287 HydrophobicContact CD2-CG 3.94Å; L251-F287 HydrophobicContact CD2-CZ 3.55Å; L251-F287 HydrophobicContact CG-CD1 4.47Å; L251-F287 HydrophobicContact CG-CE1 4.37Å; L251-F329 HydrophobicContact CD1-CD1 4.03Å; L251-F329 HydrophobicContact CD1-CE1 3.46Å; L251-F329 VanDerWaalsContact CD1-CE1 3.46Å; L251-F329 HydrophobicContact CD1-CZ 3.98Å
252D92Very high92.3Very high69 Ų6947 Ų4737%0.36925%0.253SS..Hα-helixtrans-55-45.4173.9177.369.9000110.8A248 N249 M254 L255 N256A248-D252 WeakPolarHBondContact O-CB 3.4Å; A248-D252 PolarHBondContact O-N 3.05Å; N249-D252 PolarHBondContact O-N 3Å; D252-M254 PolarHBondContact O-N 3.45Å; D252-L255 PolarHBondContact O-N 3.2Å; D252-N256 VanDerWaalsContact O-CB 3.31Å; D252-N256 WeakPolarHBondContact O-CB 3.5Å; D252-N256 PolarHBondContact O-N 2.98Å; D252-N256 PolarHBondContact OD1-ND2 2.88Å
253W95.3Very high92.7Very high46 Ų4649.6 Ų49.617%0.17426%0.263CS..Hα-helixtrans-62.9-41.6175.7-58.7-23.7000112.4N249 I250 L251 L255 Q257 A262 N265 I266 L269N249-W253 HydrophobicContact CB-CH2 4.12Å; N249-W253 HydrophobicContact CB-CZ2 3.93Å; N249-W253 PolarHBondContact O-N 3.38Å; I250-W253 HydrophobicContact CG1-CE3 4.35Å; I250-W253 HydrophobicContact CG1-CZ3 4.23Å; I250-W253 PolarHBondContact O-N 3.3Å; L251-W253 VanDerWaalsContact C-N 3.26Å; L251-W253 PolarHBondContact O-N 3.48Å; W253-L255 PolarHBondContact O-N 3.05Å; W253-Q257 HydrophobicContact CB-CG 4.44Å; W253-Q257 WeakPolarHBondContact O-CB 3.46Å; W253-Q257 PolarHBondContact O-N 3.36Å; W253-A262 HydrophobicContact CB-CB 4.28Å; W253-A262 VanDerWaalsContact O-CB 3.32Å; W253-A262 WeakPolarHBondContact O-CB 3.32Å; W253-N265 HydrophobicContact CD2-CB 3.66Å; W253-N265 HydrophobicContact CE3-CB 3.62Å; W253-N265 HydrophobicContact CG-CB 4.24Å; W253-N265 HydrophobicContact CH2-CB 4.14Å; W253-N265 HydrophobicContact CZ2-CB 4.2Å; W253-N265 HydrophobicContact CZ3-CB 3.86Å; W253-I266 HydrophobicContact CE3-CG1 3.71Å; W253-I266 HydrophobicContact CZ3-CG1 4.37Å; W253-L269 HydrophobicContact CH2-CB 4.26Å; W253-L269 HydrophobicContact CH2-CD2 3.91Å; W253-L269 HydrophobicContact CZ3-CB 4.1Å; W253-L269 HydrophobicContact CZ3-CD2 3.76Å
254M93.3Very high93.2Very high0 Ų055.3 Ų55.30%028%0.282CS..Hα-helixtrans-66-34.7177.8-72.8-176.6-178.300113.4I250 L251 D252 I266 I284 L325 I326 F329 Q330I250-M254 HydrophobicContact CG2-CE 3.65Å; I250-M254 HydrophobicContact CG2-SD 4.25Å; I250-M254 WeakPolarHBondContact O-CG 3.04Å; I250-M254 PolarHBondContact O-N 2.93Å; L251-M254 PolarHBondContact O-N 3.4Å; L251-M254 VanDerWaalsContact O-N 3.1Å; D252-M254 PolarHBondContact O-N 3.45Å; M254-I266 HydrophobicContact CE-CD1 3.63Å; M254-I266 HydrophobicContact CG-CD1 3.79Å; M254-I284 HydrophobicContact CE-CD1 4.02Å; M254-I284 HydrophobicContact SD-CD1 4.04Å; M254-L325 HydrophobicContact CE-CD2 3.66Å; M254-L325 HydrophobicContact CE-CG 3.79Å; M254-L325 HydrophobicContact SD-CG 4.29Å; M254-I326 HydrophobicContact CE-CG1 4.04Å; M254-I326 HydrophobicContact CG-CG1 4.27Å; M254-F329 HydrophobicContact CB-CB 3.86Å; M254-F329 HydrophobicContact CB-CD1 4.46Å; M254-F329 HydrophobicContact CB-CG 4.03Å; M254-F329 HydrophobicContact SD-CD2 3.58Å; M254-F329 VanDerWaalsContact SD-CD2 3.58Å; M254-F329 HydrophobicContact SD-CE2 3.95Å; M254-F329 HydrophobicContact SD-CG 4.04Å; M254-Q330 PolarHBondContact O-NE2 3.35Å; M254-Q330 VanDerWaalsContact O-NE2 3.13Å
255L89.3Confident93.7Very high34 Ų3451 Ų5118%0.17827%0.265CS..Hα-helixtrans-92.2-31-175-71.8175.3000113.8L251 D252 W253 F293 F329 R333L251-L255 HydrophobicContact CD1-CD1 4.1Å; L251-L255 HydrophobicContact CD1-CG 4.33Å; L251-L255 HydrophobicContact CD2-CD1 4.06Å; L251-L255 HydrophobicContact CG-CD1 3.75Å; L251-L255 HydrophobicContact CG-CG 4.26Å; L251-L255 WeakPolarHBondContact O-CB 2.97Å; L251-L255 PolarHBondContact O-N 2.96Å; D252-L255 PolarHBondContact O-N 3.2Å; W253-L255 PolarHBondContact O-N 3.05Å; L255-F293 HydrophobicContact CD1-CZ 4.37Å; L255-F329 HydrophobicContact CD2-CD1 3.89Å; L255-F329 HydrophobicContact CG-CD1 4.35Å; L255-R333 WeakPolarHBondContact O-CD 3.39Å; L255-R333 PolarHBondContact O-NE 3.11Å
256N90.2Very high94Very high98 Ų9847.8 Ų47.852%0.52424%0.242SC..Hα-helixtrans-115.3-20.4-168.3-64.3-40.5000114.2D252D252-N256 VanDerWaalsContact O-CB 3.31Å; D252-N256 WeakPolarHBondContact O-CB 3.5Å; D252-N256 PolarHBondContact O-N 2.98Å; D252-N256 PolarHBondContact OD1-ND2 2.88Å
257Q93.6Very high94.2Very high75 Ų7549.5 Ų49.535%0.3525%0.253SS..SBendtrans-97.5166.9-179.3-58.4-68-26.600112.2W253 T261 A262 Q330 R333W253-Q257 HydrophobicContact CB-CG 4.44Å; W253-Q257 WeakPolarHBondContact O-CB 3.46Å; W253-Q257 PolarHBondContact O-N 3.36Å; Q257-T261 HydrophobicContact CB-CG2 4.36Å; Q257-A262 HydrophobicContact CB-CB 4.4Å; Q257-Q330 PolarHBondContact O-NE2 2.6Å; Q257-R333 PolarHBondContact O-NH1 2.86Å
258D94.2Very high94.3Very high80 Ų8055.2 Ų55.243%0.42828%0.279SS..  trans-70.5158.2168.570.8-77.2000111.2T260 T261 A262D258-T260 VanDerWaalsContact C-N 3.31Å; D258-T260 PolarHBondContact O-N 3.42Å; D258-T260 PolarHBondContact OD2-N 3.4Å; D258-T261 PolarHBondContact O-N 3.3Å; D258-T261 WeakPolarHBondContact OD1-CB 3.4Å; D258-T261 PolarHBondContact OD1-OG1 2.95Å; D258-T261 PolarHBondContact OD2-N 3.27Å; D258-T261 PolarHBondContact OD2-OG1 3.3Å; D258-A262 WeakPolarHBondContact O-CB 3.28Å; D258-A262 PolarHBondContact O-N 3.37Å
259F94.5Very high94.4Very high81 Ų8154 Ų5436%0.35527%0.266SS..Hα-helixtrans-54.3-44.7-175-177.3-84.2000113Y263 S323 I326 A327 Q330F259-Y263 VanDerWaalsContact O-CB 3.3Å; F259-Y263 WeakPolarHBondContact O-CB 3.4Å; F259-Y263 PolarHBondContact O-N 2.96Å; F259-S323 WeakPolarHBondContact CE2-O 3.47Å; F259-I326 HydrophobicContact CD2-CB 4.27Å; F259-I326 HydrophobicContact CD2-CG2 3.6Å; F259-I326 HydrophobicContact CE2-CB 3.94Å; F259-I326 HydrophobicContact CE2-CG2 3.8Å; F259-I326 HydrophobicContact CG-CG2 4.33Å; F259-A327 HydrophobicContact CE2-CB 4.11Å; F259-Q330 HydrophobicContact CD2-CG 4.49Å
260T96.5Very high94.4Very high102 Ų10251.8 Ų51.863%0.62625%0.253SS*.Hα-helixtrans-70.4-43.4-175.3-58.80000111.2D258 Y263 R264D258-T260 VanDerWaalsContact C-N 3.31Å; D258-T260 PolarHBondContact O-N 3.42Å; D258-T260 PolarHBondContact OD2-N 3.4Å; T260-Y263 PolarHBondContact O-N 2.93Å; T260-R264 PolarHBondContact O-N 3.45Å
261T96.4Very high94.2Very high31 Ų3157.1 Ų57.119%0.1929%0.286CS..Hα-helixtrans-64.1-46175.6-60.70000111.5Q257 D258 Y263 R264 N265Q257-T261 HydrophobicContact CB-CG2 4.36Å; D258-T261 PolarHBondContact O-N 3.3Å; D258-T261 WeakPolarHBondContact OD1-CB 3.4Å; D258-T261 PolarHBondContact OD1-OG1 2.95Å; D258-T261 PolarHBondContact OD2-N 3.27Å; D258-T261 PolarHBondContact OD2-OG1 3.3Å; T261-Y263 PolarHBondContact O-N 3.35Å; T261-R264 PolarHBondContact O-N 3.33Å; T261-N265 VanDerWaalsContact O-CG 3.23Å; T261-N265 PolarHBondContact O-N 2.9Å; T261-N265 PolarHBondContact O-OD1 3.28Å
262A96.3Very high94Very high0 Ų063.4 Ų63.40%032%0.319CS..Hα-helixtrans-58.3-48.6176.900000111.2W253 Q257 D258 R264 N265 I266 I326W253-A262 HydrophobicContact CB-CB 4.28Å; W253-A262 VanDerWaalsContact O-CB 3.32Å; W253-A262 WeakPolarHBondContact O-CB 3.32Å; Q257-A262 HydrophobicContact CB-CB 4.4Å; D258-A262 WeakPolarHBondContact O-CB 3.28Å; D258-A262 PolarHBondContact O-N 3.37Å; A262-R264 VanDerWaalsContact C-N 3.35Å; A262-R264 PolarHBondContact O-N 3.49Å; A262-N265 PolarHBondContact O-N 3.29Å; A262-I266 HydrophobicContact CB-CD1 4.49Å; A262-I266 WeakPolarHBondContact O-CB 3.24Å; A262-I266 WeakPolarHBondContact O-CD1 3.35Å; A262-I266 WeakPolarHBondContact O-CG1 3.37Å; A262-I266 PolarHBondContact O-N 2.93Å; A262-I326 HydrophobicContact CB-CG2 4.16Å
263Y96.8Very high93.8Very high56 Ų5664.3 Ų64.322%0.2232%0.319CS..Hα-helixtrans-58.2-45.4178.4179.7-89000112.3F259 T260 T261 T267 L322 S323 I326F259-Y263 VanDerWaalsContact O-CB 3.3Å; F259-Y263 WeakPolarHBondContact O-CB 3.4Å; F259-Y263 PolarHBondContact O-N 2.96Å; T260-Y263 PolarHBondContact O-N 2.93Å; T261-Y263 PolarHBondContact O-N 3.35Å; Y263-T267 VanDerWaalsContact O-CB 3.23Å; Y263-T267 WeakPolarHBondContact O-CB 3.4Å; Y263-T267 PolarHBondContact O-N 2.99Å; Y263-T267 PolarHBondContact O-OG1 3.41Å; Y263-L322 HydrophobicContact CD2-CD2 4.22Å; Y263-L322 HydrophobicContact CD2-CG 4.24Å; Y263-L322 HydrophobicContact CE2-CD2 4.03Å; Y263-L322 HydrophobicContact CE2-CG 4.22Å; Y263-S323 WeakPolarHBondContact CD2-OG 3.34Å; Y263-S323 VanDerWaalsContact CE2-OG 3.26Å; Y263-S323 WeakPolarHBondContact CE2-OG 3.5Å; Y263-I326 HydrophobicContact CD2-CD1 3.9Å; Y263-I326 HydrophobicContact CG-CD1 4.32Å
264R97.4Very high93.4Very high152 Ų15265 Ų6557%0.57434%0.341SS*.Hα-helixtrans-62-51178.7-176.5-179.262.4-165.3-6.2111.3T260 T261 A262 I266 T267 E268T260-R264 PolarHBondContact O-N 3.45Å; T261-R264 PolarHBondContact O-N 3.33Å; A262-R264 VanDerWaalsContact C-N 3.35Å; A262-R264 PolarHBondContact O-N 3.49Å; R264-I266 PolarHBondContact O-N 2.88Å; R264-T267 PolarHBondContact O-N 2.9Å; R264-E268 WeakPolarHBondContact O-CB 3.46Å; R264-E268 PolarHBondContact O-N 3.44Å
265N96.8Very high93.2Very high35 Ų3565.5 Ų65.519%0.18734%0.344CS..Hα-helixtrans-62.8-44.2-176.8-65.20.5000111.6W253 T261 A262 E268 L269W253-N265 HydrophobicContact CD2-CB 3.66Å; W253-N265 HydrophobicContact CE3-CB 3.62Å; W253-N265 HydrophobicContact CG-CB 4.24Å; W253-N265 HydrophobicContact CH2-CB 4.14Å; W253-N265 HydrophobicContact CZ2-CB 4.2Å; W253-N265 HydrophobicContact CZ3-CB 3.86Å; T261-N265 VanDerWaalsContact O-CG 3.23Å; T261-N265 PolarHBondContact O-N 2.9Å; T261-N265 PolarHBondContact O-OD1 3.28Å; A262-N265 PolarHBondContact O-N 3.29Å; N265-E268 PolarHBondContact O-N 3.3Å; N265-L269 WeakPolarHBondContact O-CB 3.3Å; N265-L269 PolarHBondContact O-N 3.48Å
266I95.9Very high93.3Very high0 Ų065.7 Ų65.70%035%0.35CS..Hα-helixtrans-65.3-42.5177.9-59.7161000110.4I250 W253 M254 A262 R264 E268 L269 K270 L322 I326I250-I266 HydrophobicContact CG1-CG1 4.4Å; I250-I266 HydrophobicContact CG1-CG2 4.42Å; I250-I266 HydrophobicContact CG2-CD1 4.2Å; I250-I266 HydrophobicContact CG2-CG1 4.12Å; I250-I266 HydrophobicContact CG2-CG2 4.41Å; W253-I266 HydrophobicContact CE3-CG1 3.71Å; W253-I266 HydrophobicContact CZ3-CG1 4.37Å; M254-I266 HydrophobicContact CE-CD1 3.63Å; M254-I266 HydrophobicContact CG-CD1 3.79Å; A262-I266 HydrophobicContact CB-CD1 4.49Å; A262-I266 WeakPolarHBondContact O-CB 3.24Å; A262-I266 WeakPolarHBondContact O-CD1 3.35Å; A262-I266 WeakPolarHBondContact O-CG1 3.37Å; A262-I266 PolarHBondContact O-N 2.93Å; R264-I266 PolarHBondContact O-N 2.88Å; I266-E268 PolarHBondContact O-N 3.34Å; I266-L269 PolarHBondContact O-N 3.36Å; I266-K270 WeakPolarHBondContact O-CB 3.43Å; I266-K270 PolarHBondContact O-N 2.92Å; I266-L322 HydrophobicContact CB-CD1 4.42Å; I266-L322 HydrophobicContact CG2-CD1 3.68Å; I266-L322 HydrophobicContact CG2-CD2 4.17Å; I266-I326 HydrophobicContact CD1-CD1 3.8Å; I266-I326 HydrophobicContact CD1-CG1 3.82Å
267T95.9Very high93.4Very high44 Ų4461 Ų6127%0.2733%0.325SS..Hα-helixtrans-63.2-41.9179-59.90000111.9Y263 R264 T271Y263-T267 VanDerWaalsContact O-CB 3.23Å; Y263-T267 WeakPolarHBondContact O-CB 3.4Å; Y263-T267 PolarHBondContact O-N 2.99Å; Y263-T267 PolarHBondContact O-OG1 3.41Å; R264-T267 PolarHBondContact O-N 2.9Å; T267-T271 WeakPolarHBondContact O-CB 3.44Å; T267-T271 PolarHBondContact O-N 2.84Å; T267-T271 PolarHBondContact O-OG1 3.34Å
268E95.4Very high93.3Very high128 Ų12861.6 Ų61.660%0.59833%0.328SS*.Hα-helixtrans-64-50.7177.5-176.3171.9-173.400111.1R264 N265 I266 K270 T271 L272R264-E268 WeakPolarHBondContact O-CB 3.46Å; R264-E268 PolarHBondContact O-N 3.44Å; N265-E268 PolarHBondContact O-N 3.3Å; I266-E268 PolarHBondContact O-N 3.34Å; E268-K270 VanDerWaalsContact C-N 3.3Å; E268-K270 PolarHBondContact O-N 3Å; E268-T271 PolarHBondContact O-N 2.93Å; E268-L272 WeakPolarHBondContact O-CB 3.37Å; E268-L272 PolarHBondContact O-N 2.67Å
269L92.8Very high93.1Very high21 Ų2159.4 Ų59.411%0.1132%0.316CS..Hα-helixtrans-58.5-44177.3-177.264.4000111.7D246 I250 W253 N265 I266 T271 L272 K273D246-L269 HydrophobicContact CB-CD2 4.13Å; I250-L269 HydrophobicContact CD1-CD2 4.03Å; I250-L269 HydrophobicContact CG1-CD2 3.86Å; W253-L269 HydrophobicContact CH2-CB 4.26Å; W253-L269 HydrophobicContact CH2-CD2 3.91Å; W253-L269 HydrophobicContact CZ3-CB 4.1Å; W253-L269 HydrophobicContact CZ3-CD2 3.76Å; N265-L269 WeakPolarHBondContact O-CB 3.3Å; N265-L269 PolarHBondContact O-N 3.48Å; I266-L269 PolarHBondContact O-N 3.36Å; L269-T271 VanDerWaalsContact C-N 3.32Å; L269-T271 PolarHBondContact O-N 3.43Å; L269-L272 PolarHBondContact O-N 3.05Å; L269-K273 HydrophobicContact CD1-CD 3.89Å; L269-K273 HydrophobicContact CD1-CG 4.35Å; L269-K273 PolarHBondContact O-N 3.16Å
270K92.3Very high93.1Very high27 Ų2755.5 Ų55.512%0.11730%0.299CS..Hα-helixtrans-63.5-38.6-179.9-167-176164.8-159.70111.8I266 E268 G274 L275 I280 E318I266-K270 WeakPolarHBondContact O-CB 3.43Å; I266-K270 PolarHBondContact O-N 2.92Å; E268-K270 VanDerWaalsContact C-N 3.3Å; E268-K270 PolarHBondContact O-N 3Å; K270-G274 CarbonylContact O-C 3.56Å; K270-G274 VanDerWaalsContact O-CA 3.32Å; K270-G274 WeakPolarHBondContact O-CA 3.46Å; K270-G274 PolarHBondContact O-N 3.17Å; K270-L275 WeakPolarHBondContact CE-O 3.48Å; K270-L275 HydrophobicContact CG-CB 4.11Å; K270-L275 WeakPolarHBondContact CG-O 3.45Å; K270-L275 PolarHBondContact O-N 3.38Å; K270-I280 HydrophobicContact CD-CD1 4.18Å; K270-I280 HydrophobicContact CG-CD1 4.12Å; K270-E318 IonicContact NZ-OE2 2.72Å; K270-E318 PolarHBondContact NZ-OE2 3.48Å
271T90.9Very high93Very high112 Ų11250.8 Ų50.869%0.68727%0.27SS*.Hα-helixtrans-74.5-41.1177.3-59.50000111.6T267 E268 L269T267-T271 WeakPolarHBondContact O-CB 3.44Å; T267-T271 PolarHBondContact O-N 2.84Å; T267-T271 PolarHBondContact O-OG1 3.34Å; E268-T271 PolarHBondContact O-N 2.93Å; L269-T271 VanDerWaalsContact C-N 3.32Å; L269-T271 PolarHBondContact O-N 3.43Å
272L88.7Confident92.8Very high140 Ų14052 Ų5273%0.73328%0.277SS*.Hα-helixtrans-63.2-42.9179.7-176.370.5000111.9E268 L269E268-L272 WeakPolarHBondContact O-CB 3.37Å; E268-L272 PolarHBondContact O-N 2.67Å; L269-L272 PolarHBondContact O-N 3.05Å
273K87Confident92.5Very high88 Ų8854.2 Ų54.238%0.38329%0.287SS..Hα-helixtrans-100.4-1.8-175.7-67.3-171.4169.3-174.90114.5D246 L269 L275D246-K273 IonicContact OD1-NZ 3.52Å; D246-K273 PolarHBondContact OD1-NZ 2.71Å; D246-K273 WeakPolarHBondContact OD2-CD 3.1Å; D246-K273 IonicContact OD2-NZ 2.91Å; D246-K273 PolarHBondContact OD2-NZ 2.99Å; L269-K273 HydrophobicContact CD1-CD 3.89Å; L269-K273 HydrophobicContact CD1-CG 4.35Å; L269-K273 PolarHBondContact O-N 3.16Å; K273-L275 VanDerWaalsContact C-N 3.33Å; K273-L275 HydrophobicContact CB-CD1 4.22Å; K273-L275 HydrophobicContact CB-CD2 4.35Å; K273-L275 HydrophobicContact CB-CG 3.89Å; K273-L275 PolarHBondContact O-N 2.97Å
274G86.9Confident92.3Very high62 Ų6251.5 Ų51.564%0.63928%0.277SS*.THydrogen-bonded Turntrans65.531.4179.500000114.4K270K270-G274 CarbonylContact O-C 3.56Å; K270-G274 VanDerWaalsContact O-CA 3.32Å; K270-G274 WeakPolarHBondContact O-CA 3.46Å; K270-G274 PolarHBondContact O-N 3.17Å
275L89.8Confident92.2Very high10 Ų1047.8 Ų47.85%0.05227%0.266CS..  trans-77.4138.3-175.4-59.1173.5000111.6G240 P242 K270 K273 I280G240-L275 WeakPolarHBondContact O-CD2 3.31Å; P242-L275 HydrophobicContact CB-CD1 4.02Å; P242-L275 HydrophobicContact CB-CD2 3.91Å; K270-L275 WeakPolarHBondContact CE-O 3.48Å; K270-L275 HydrophobicContact CG-CB 4.11Å; K270-L275 WeakPolarHBondContact CG-O 3.45Å; K270-L275 PolarHBondContact O-N 3.38Å; K273-L275 VanDerWaalsContact C-N 3.33Å; K273-L275 HydrophobicContact CB-CD1 4.22Å; K273-L275 HydrophobicContact CB-CD2 4.35Å; K273-L275 HydrophobicContact CB-CG 3.89Å; K273-L275 PolarHBondContact O-N 2.97Å; L275-I280 HydrophobicContact CB-CD1 4.19Å; L275-I280 HydrophobicContact CB-CG1 4.44Å
276A90.3Very high91.8Very high37 Ų3749.5 Ų49.531%0.30627%0.274SS..  trans-82.2149.5170.700000111H278 D279 I280A276-H278 PolarHBondContact O-N 3.31Å; A276-D279 WeakPolarHBondContact CB-OD2 3.19Å; A276-D279 PolarHBondContact O-N 3.31Å; A276-I280 PolarHBondContact O-N 3.1Å
277L92.2Very high91.4Very high0 Ų052.4 Ų52.40%029%0.287CS..Hα-helixtrans-65.4-30.3176.8-176.357.5000111.8I280 L281 L312 Q321 L322 L325L277-I280 PolarHBondContact O-N 2.98Å; L277-L281 VanDerWaalsContact O-CB 3.3Å; L277-L281 WeakPolarHBondContact O-CB 3.33Å; L277-L281 PolarHBondContact O-N 2.84Å; L277-L312 HydrophobicContact CB-CD1 4.31Å; L277-L312 HydrophobicContact CD2-CD1 3.94Å; L277-L312 HydrophobicContact CD2-CD2 4.11Å; L277-L312 HydrophobicContact CG-CD1 3.95Å; L277-Q321 HydrophobicContact CD2-CB 3.69Å; L277-L322 HydrophobicContact CD1-CB 4.47Å; L277-L322 HydrophobicContact CD1-CD1 4.05Å; L277-L322 HydrophobicContact CD2-CB 4.16Å; L277-L325 HydrophobicContact CD1-CD2 4.01Å
278H91.9Very high91.1Very high88 Ų8850.3 Ų50.341%0.40727%0.274SS..Hα-helixtrans-62.8-42.8177.2-177.865.5000112.5A276 L281 T282 E309A276-H278 PolarHBondContact O-N 3.31Å; H278-L281 PolarHBondContact O-N 3.32Å; H278-T282 PolarHBondContact O-N 2.89Å; H278-T282 PolarHBondContact O-OG1 3.46Å; H278-E309 IonicContact CE1-OE1 2.67Å
279D90.5Very high90.7Very high33 Ų3349 Ų4918%0.17627%0.268CS..Hα-helixtrans-67.2-42.4177.7-59.3-51.3000111H241 P242 A276 L281 T282 E283H241-D279 IonicContact CE1-OD1 3.07Å; H241-D279 PolarHBondContact CE1-OD1 3.26Å; H241-D279 VanDerWaalsContact CE1-OD1 3.27Å; H241-D279 IonicContact NE2-OD1 3.62Å; P242-D279 HydrophobicContact CG-CB 4.2Å; A276-D279 WeakPolarHBondContact CB-OD2 3.19Å; A276-D279 PolarHBondContact O-N 3.31Å; D279-L281 VanDerWaalsContact C-N 3.33Å; D279-L281 PolarHBondContact O-N 2.76Å; D279-T282 PolarHBondContact O-N 3.12Å; D279-E283 PolarHBondContact O-N 3.45Å
280I93.4Very high90.4Very high0 Ų056.6 Ų56.60%030%0.295CS..Hα-helixtrans-58.2-46.7174.1-66.5169.1000110.6I247 I250 K270 L275 A276 L277 T282 E283 I284I247-I280 HydrophobicContact CD1-CG1 4.48Å; I247-I280 HydrophobicContact CD1-CG2 4.45Å; I250-I280 HydrophobicContact CD1-CD1 3.98Å; I250-I280 HydrophobicContact CD1-CG1 4.04Å; I250-I280 HydrophobicContact CD1-CG2 4.06Å; I250-I280 HydrophobicContact CG2-CG2 4.17Å; K270-I280 HydrophobicContact CD-CD1 4.18Å; K270-I280 HydrophobicContact CG-CD1 4.12Å; L275-I280 HydrophobicContact CB-CD1 4.19Å; L275-I280 HydrophobicContact CB-CG1 4.44Å; A276-I280 PolarHBondContact O-N 3.1Å; L277-I280 PolarHBondContact O-N 2.98Å; I280-T282 VanDerWaalsContact C-N 3.33Å; I280-T282 PolarHBondContact O-N 3.37Å; I280-E283 PolarHBondContact O-N 3.4Å; I280-I284 HydrophobicContact CG2-CD1 3.61Å; I280-I284 HydrophobicContact CG2-CG1 4.27Å; I280-I284 WeakPolarHBondContact O-CB 3.34Å; I280-I284 VanDerWaalsContact O-CG1 3.24Å; I280-I284 WeakPolarHBondContact O-CG1 3.16Å; I280-I284 PolarHBondContact O-N 2.96Å
281L94.6Very high90Very high3 Ų357.8 Ų57.82%0.01631%0.305CS..Hα-helixtrans-62.5-41-179-170.868.8000111.9L277 H278 D279 H285 M305 I308 E309 L312 L325L277-L281 VanDerWaalsContact O-CB 3.3Å; L277-L281 WeakPolarHBondContact O-CB 3.33Å; L277-L281 PolarHBondContact O-N 2.84Å; H278-L281 PolarHBondContact O-N 3.32Å; D279-L281 VanDerWaalsContact C-N 3.33Å; D279-L281 PolarHBondContact O-N 2.76Å; L281-H285 WeakPolarHBondContact O-CB 3.46Å; L281-H285 PolarHBondContact O-N 3.39Å; L281-M305 HydrophobicContact CD1-CB 3.92Å; L281-M305 HydrophobicContact CD1-CE 3.94Å; L281-M305 HydrophobicContact CD1-CG 3.83Å; L281-M305 HydrophobicContact CG-CE 4.39Å; L281-M305 WeakPolarHBondContact O-CE 3.3Å; L281-I308 HydrophobicContact CD2-CB 4.49Å; L281-I308 HydrophobicContact CD2-CG2 4.16Å; L281-E309 HydrophobicContact CD2-CB 3.61Å; L281-E309 HydrophobicContact CD2-CG 4.17Å; L281-L312 HydrophobicContact CD2-CD1 4.45Å; L281-L325 HydrophobicContact CD1-CD1 3.65Å; L281-L325 HydrophobicContact CD1-CD2 4.06Å; L281-L325 HydrophobicContact CD1-CG 4.49Å
282T92.1Very high89.7Confident55 Ų5559.5 Ų59.534%0.33731%0.31SS..Hα-helixtrans-64.1-45.6178.3-58.40000111.5H278 D279 I280 H285 L286H278-T282 PolarHBondContact O-N 2.89Å; H278-T282 PolarHBondContact O-OG1 3.46Å; D279-T282 PolarHBondContact O-N 3.12Å; I280-T282 VanDerWaalsContact C-N 3.33Å; I280-T282 PolarHBondContact O-N 3.37Å; T282-H285 WeakPolarHBondContact O-CB 3.44Å; T282-H285 PolarHBondContact O-N 3.45Å; T282-L286 PolarHBondContact O-N 3.29Å
283E91.4Very high89.5Confident47 Ų4753.6 Ų53.622%0.2228%0.278CS..Hα-helixtrans-71.9-37179.1-69.7-58128.900112.6P242 I247 D279 I280 H285 L286 F287P242-E283 HydrophobicContact CG-CG 3.95Å; I247-E283 HydrophobicContact CB-CB 4.45Å; I247-E283 HydrophobicContact CD1-CB 3.65Å; I247-E283 HydrophobicContact CD1-CG 4.3Å; I247-E283 HydrophobicContact CG1-CB 3.62Å; I247-E283 HydrophobicContact CG1-CG 4.16Å; I247-E283 HydrophobicContact CG2-CB 4.09Å; D279-E283 PolarHBondContact O-N 3.45Å; I280-E283 PolarHBondContact O-N 3.4Å; E283-H285 VanDerWaalsContact C-N 3.25Å; E283-H285 PolarHBondContact O-N 3.03Å; E283-L286 PolarHBondContact O-N 3.29Å; E283-F287 PolarHBondContact O-N 3.44Å; E283-F287 VanDerWaalsContact O-N 3.11Å
284I92.8Very high89.6Confident0 Ų051.9 Ų51.90%028%0.276CS..Hα-helixtrans-61.4-37.7171.9-72176.9000110.3I247 I250 M254 I280 L286 F287 V288 M305 L325 F329I247-I284 HydrophobicContact CG2-CG1 4.16Å; I250-I284 HydrophobicContact CG2-CD1 3.87Å; M254-I284 HydrophobicContact CE-CD1 4.02Å; M254-I284 HydrophobicContact SD-CD1 4.04Å; I280-I284 HydrophobicContact CG2-CD1 3.61Å; I280-I284 HydrophobicContact CG2-CG1 4.27Å; I280-I284 WeakPolarHBondContact O-CB 3.34Å; I280-I284 VanDerWaalsContact O-CG1 3.24Å; I280-I284 WeakPolarHBondContact O-CG1 3.16Å; I280-I284 PolarHBondContact O-N 2.96Å; I284-L286 VanDerWaalsContact C-N 3.33Å; I284-L286 PolarHBondContact O-N 3.47Å; I284-F287 WeakPolarHBondContact O-CA 3.48Å; I284-F287 WeakPolarHBondContact O-CB 3.5Å; I284-F287 PolarHBondContact O-N 3.4Å; I284-V288 HydrophobicContact CG2-CG2 4.17Å; I284-V288 WeakPolarHBondContact O-CG2 3.34Å; I284-V288 PolarHBondContact O-N 3.35Å; I284-M305 HydrophobicContact CB-CE 4.47Å; I284-M305 HydrophobicContact CG2-CE 4.04Å; I284-M305 HydrophobicContact CG2-SD 4.1Å; I284-L325 HydrophobicContact CD1-CD2 4.38Å; I284-F329 HydrophobicContact CG2-CE1 4.49Å; I284-F329 HydrophobicContact CG2-CE2 3.88Å; I284-F329 HydrophobicContact CG2-CZ 3.44Å; I284-F329 VanDerWaalsContact CG2-CZ 3.44Å
285H93.9Very high89.7Confident73 Ų7353.2 Ų53.234%0.33828%0.275SS..Hα-helixtrans-59.6-45.1177.8169.763.9000111.5L281 T282 E283 F287 V288 H289 L302 M305L281-H285 WeakPolarHBondContact O-CB 3.46Å; L281-H285 PolarHBondContact O-N 3.39Å; T282-H285 WeakPolarHBondContact O-CB 3.44Å; T282-H285 PolarHBondContact O-N 3.45Å; E283-H285 VanDerWaalsContact C-N 3.25Å; E283-H285 PolarHBondContact O-N 3.03Å; H285-F287 PolarHBondContact O-N 2.89Å; H285-V288 PolarHBondContact O-N 2.98Å; H285-H289 AromaticContact CE1-CD2 3.31Å; H285-H289 PolarHBondContact CE1-CD2 3.26Å; H285-H289 AromaticContact CE1-NE2 3.12Å; H285-H289 PolarHBondContact CE1-NE2 2.97Å; H285-H289 AromaticContact ND1-CD2 3.77Å; H285-H289 AromaticContact ND1-NE2 3.83Å; H285-H289 AromaticContact NE2-CD2 3.72Å; H285-H289 AromaticContact NE2-NE2 3.78Å; H285-H289 PolarHBondContact O-CD2 3.46Å; H285-H289 PolarHBondContact O-N 3.19Å; H285-L302 WeakPolarHBondContact ND1-CD2 3.34Å; H285-M305 HydrophobicContact CB-CE 3.48Å; H285-M305 VanDerWaalsContact CB-CE 3.48Å
286L89.9Confident89.6Confident71 Ų7155 Ų5537%0.37229%0.289SS..Hα-helixtrans-60.9-37174.6-63.4178000111.7T282 E283 I284 H289 R290T282-L286 PolarHBondContact O-N 3.29Å; E283-L286 PolarHBondContact O-N 3.29Å; I284-L286 VanDerWaalsContact C-N 3.33Å; I284-L286 PolarHBondContact O-N 3.47Å; L286-H289 PolarHBondContact O-N 2.99Å; L286-R290 WeakPolarHBondContact O-CG 3.37Å; L286-R290 PolarHBondContact O-N 3.03Å
287F87.1Confident89.6Confident62 Ų6253.3 Ų53.327%0.27228%0.275SS..Hα-helixtrans-69.8-43178.3-165.7-81000112.9L251 E283 I284 H285 H289 R290 V291L251-F287 HydrophobicContact CD2-CD1 3.14Å; L251-F287 HydrophobicContact CD2-CD2 4.47Å; L251-F287 HydrophobicContact CD2-CE1 2.88Å; L251-F287 HydrophobicContact CD2-CE2 4.3Å; L251-F287 HydrophobicContact CD2-CG 3.94Å; L251-F287 HydrophobicContact CD2-CZ 3.55Å; L251-F287 HydrophobicContact CG-CD1 4.47Å; L251-F287 HydrophobicContact CG-CE1 4.37Å; E283-F287 PolarHBondContact O-N 3.44Å; E283-F287 VanDerWaalsContact O-N 3.11Å; I284-F287 WeakPolarHBondContact O-CA 3.48Å; I284-F287 WeakPolarHBondContact O-CB 3.5Å; I284-F287 PolarHBondContact O-N 3.4Å; H285-F287 PolarHBondContact O-N 2.89Å; F287-H289 PolarHBondContact O-N 3.43Å; F287-H289 VanDerWaalsContact O-N 3.17Å; F287-R290 WeakPolarHBondContact O-CA 3.23Å; F287-R290 PolarHBondContact O-N 2.69Å; F287-V291 HydrophobicContact CD1-CB 4.34Å; F287-V291 HydrophobicContact CD1-CG2 3.76Å; F287-V291 HydrophobicContact CE1-CB 3.94Å; F287-V291 HydrophobicContact CE1-CG2 3.05Å; F287-V291 HydrophobicContact CE2-CG2 4.36Å; F287-V291 HydrophobicContact CZ-CG2 3.43Å; F287-V291 VanDerWaalsContact CZ-CG2 3.43Å; F287-V291 PolarHBondContact O-N 2.81Å
288V89.6Confident89.6Confident0 Ų056.6 Ų56.60%029%0.287CS..Hα-helixtrans-57.5-30.6176.4170.30000111.5I284 H285 R298 L301 L302 M305 F329I284-V288 HydrophobicContact CG2-CG2 4.17Å; I284-V288 WeakPolarHBondContact O-CG2 3.34Å; I284-V288 PolarHBondContact O-N 3.35Å; H285-V288 PolarHBondContact O-N 2.98Å; V288-R298 HydrophobicContact CG1-CG 4.21Å; V288-L301 HydrophobicContact CG1-CB 4.23Å; V288-L301 HydrophobicContact CG1-CD1 4.22Å; V288-L301 HydrophobicContact CG2-CD1 4.14Å; V288-L302 HydrophobicContact CG1-CD2 4.37Å; V288-M305 HydrophobicContact CG2-SD 4.14Å; V288-F329 HydrophobicContact CG2-CE1 4.33Å; V288-F329 HydrophobicContact CG2-CZ 4.02Å
289H87.6Confident89.6Confident99 Ų9957.6 Ų57.646%0.45829%0.294SS..Hα-helixtrans-78.2-24.9173.1-82-65.6000114.7H285 L286 F287H285-H289 AromaticContact CE1-CD2 3.31Å; H285-H289 PolarHBondContact CE1-CD2 3.26Å; H285-H289 AromaticContact CE1-NE2 3.12Å; H285-H289 PolarHBondContact CE1-NE2 2.97Å; H285-H289 AromaticContact ND1-CD2 3.77Å; H285-H289 AromaticContact ND1-NE2 3.83Å; H285-H289 AromaticContact NE2-CD2 3.72Å; H285-H289 AromaticContact NE2-NE2 3.78Å; H285-H289 PolarHBondContact O-CD2 3.46Å; H285-H289 PolarHBondContact O-N 3.19Å; L286-H289 PolarHBondContact O-N 2.99Å; F287-H289 PolarHBondContact O-N 3.43Å; F287-H289 VanDerWaalsContact O-N 3.17Å
290R86.3Confident89.7Confident181 Ų18158.3 Ų58.368%0.68330%0.297SS*.Hα-helixtrans-84.9-32.7-179.7-73.8176.1-176.9168.26.9112.9L286 F287L286-R290 WeakPolarHBondContact O-CG 3.37Å; L286-R290 PolarHBondContact O-N 3.03Å; F287-R290 WeakPolarHBondContact O-CA 3.23Å; F287-R290 PolarHBondContact O-N 2.69Å
291V83.4Confident89.8Confident52 Ų5258.3 Ų58.332%0.31530%0.297SS..SBendtrans-87.2140.6179.7169.80000111.4F287 F293F287-V291 HydrophobicContact CD1-CB 4.34Å; F287-V291 HydrophobicContact CD1-CG2 3.76Å; F287-V291 HydrophobicContact CE1-CB 3.94Å; F287-V291 HydrophobicContact CE1-CG2 3.05Å; F287-V291 HydrophobicContact CE2-CG2 4.36Å; F287-V291 HydrophobicContact CZ-CG2 3.43Å; F287-V291 VanDerWaalsContact CZ-CG2 3.43Å; F287-V291 PolarHBondContact O-N 2.81Å; V291-F293 VanDerWaalsContact C-N 3.33Å; V291-F293 HydrophobicContact CB-CD2 4.16Å; V291-F293 HydrophobicContact CB-CE2 3.84Å; V291-F293 HydrophobicContact CG1-CD2 3.95Å; V291-F293 HydrophobicContact CG1-CE1 4.46Å; V291-F293 HydrophobicContact CG1-CE2 3.65Å; V291-F293 HydrophobicContact CG1-CG 4.47Å; V291-F293 HydrophobicContact CG1-CZ 3.94Å; V291-F293 PolarHBondContact O-N 3.29Å
292D83.4Confident89.8Confident149 Ų14960.5 Ų60.580%0.79731%0.308SS*.  trans-79.882.7-179.1-159.621.1000111R298D292-R298 IonicContact OD1-NH2 3.42Å; D292-R298 PolarHBondContact OD1-NH2 3.45Å
293F84.6Confident90Very high16 Ų1661.3 Ų61.37%0.0731%0.313CS..  trans-86.7147.4168.7-72-71.8000111.2L255 V291 V297 R298 L301 I336L255-F293 HydrophobicContact CD1-CZ 4.37Å; V291-F293 VanDerWaalsContact C-N 3.33Å; V291-F293 HydrophobicContact CB-CD2 4.16Å; V291-F293 HydrophobicContact CB-CE2 3.84Å; V291-F293 HydrophobicContact CG1-CD2 3.95Å; V291-F293 HydrophobicContact CG1-CE1 4.46Å; V291-F293 HydrophobicContact CG1-CE2 3.65Å; V291-F293 HydrophobicContact CG1-CG 4.47Å; V291-F293 HydrophobicContact CG1-CZ 3.94Å; V291-F293 PolarHBondContact O-N 3.29Å; F293-V297 HydrophobicContact CB-CB 4.45Å; F293-V297 HydrophobicContact CB-CG1 4.16Å; F293-V297 HydrophobicContact CD1-CG1 3.83Å; F293-V297 HydrophobicContact CG-CG1 4.21Å; F293-R298 HydrophobicContact CB-CB 4.29Å; F293-R298 PolarHBondContact O-NH2 3.16Å; F293-L301 HydrophobicContact CE2-CD1 4.46Å; F293-I336 HydrophobicContact CD1-CD1 4.29Å; F293-I336 HydrophobicContact CE1-CD1 4.39Å
294P89.6Confident90.2Very high51 Ų5162.8 Ų62.833%0.33132%0.319SS..  trans-50.4145.9165-25.233.9000111.8S296 V297 R298 E339P294-S296 VanDerWaalsContact C-N 3.3Å; P294-S296 PolarHBondContact O-N 3.39Å; P294-V297 HydrophobicContact CB-CB 4.34Å; P294-V297 HydrophobicContact CB-CG2 4.1Å; P294-V297 HydrophobicContact CG-CG2 4.23Å; P294-V297 WeakPolarHBondContact O-CB 3.31Å; P294-V297 PolarHBondContact O-N 3.41Å; P294-V297 VanDerWaalsContact O-N 3.16Å; P294-R298 PolarHBondContact O-N 2.75Å; P294-E339 WeakPolarHBondContact CB-OE2 3.43Å
295S89.4Confident90.3Very high90 Ų9063 Ų6363%0.62932%0.32SS*.Hα-helixtrans-58.3-40.2-174-62.60000113.1R298 I299S295-R298 PolarHBondContact O-N 3.46Å; S295-I299 WeakPolarHBondContact O-CB 3.36Å; S295-I299 WeakPolarHBondContact O-CD1 3.47Å; S295-I299 WeakPolarHBondContact O-CG1 3.22Å; S295-I299 PolarHBondContact O-N 3.05Å
296S88.4Confident90.5Very high49 Ų4962.2 Ų62.234%0.34333%0.326SS..Hα-helixtrans-59.3-48.1176.550.60000111.9P294 I299 H300 E339P294-S296 VanDerWaalsContact C-N 3.3Å; P294-S296 PolarHBondContact O-N 3.39Å; S296-I299 PolarHBondContact O-N 2.64Å; S296-H300 PolarHBondContact O-N 3.09Å; S296-E339 VanDerWaalsContact CB-OE1 3.27Å; S296-E339 WeakPolarHBondContact CB-OE1 3.37Å; S296-E339 PolarHBondContact OG-OE1 3.23Å; S296-E339 PolarHBondContact OG-OE2 2.88Å
297V89.6Confident90.8Very high0 Ų061.8 Ų61.80%032%0.324CS..Hα-helixtrans-63-47.2178173.10000110.9F293 P294 I299 H300 L301 T332 L335 I336F293-V297 HydrophobicContact CB-CB 4.45Å; F293-V297 HydrophobicContact CB-CG1 4.16Å; F293-V297 HydrophobicContact CD1-CG1 3.83Å; F293-V297 HydrophobicContact CG-CG1 4.21Å; P294-V297 HydrophobicContact CB-CB 4.34Å; P294-V297 HydrophobicContact CB-CG2 4.1Å; P294-V297 HydrophobicContact CG-CG2 4.23Å; P294-V297 WeakPolarHBondContact O-CB 3.31Å; P294-V297 PolarHBondContact O-N 3.41Å; P294-V297 VanDerWaalsContact O-N 3.16Å; V297-I299 PolarHBondContact O-N 2.95Å; V297-H300 WeakPolarHBondContact O-CB 3.44Å; V297-H300 PolarHBondContact O-N 2.91Å; V297-L301 HydrophobicContact CG1-CD1 4.27Å; V297-L301 PolarHBondContact O-N 3.44Å; V297-T332 HydrophobicContact CG1-CG2 3.7Å; V297-L335 HydrophobicContact CG2-CB 4.23Å; V297-I336 HydrophobicContact CG1-CD1 4.28Å; V297-I336 HydrophobicContact CG1-CG1 4.35Å; V297-I336 HydrophobicContact CG2-CD1 4.49Å; V297-I336 HydrophobicContact CG2-CG1 3.69Å
298R91.3Very high91.2Very high69 Ų6958.9 Ų58.926%0.2631%0.311SS..Hα-helixtrans-61-44.8178.7-167-178-56.5175.24.8111.6V288 D292 F293 P294 S295 H300 L301 L302V288-R298 HydrophobicContact CG1-CG 4.21Å; D292-R298 IonicContact OD1-NH2 3.42Å; D292-R298 PolarHBondContact OD1-NH2 3.45Å; F293-R298 HydrophobicContact CB-CB 4.29Å; F293-R298 PolarHBondContact O-NH2 3.16Å; P294-R298 PolarHBondContact O-N 2.75Å; S295-R298 PolarHBondContact O-N 3.46Å; R298-H300 VanDerWaalsContact C-N 3.32Å; R298-H300 PolarHBondContact O-N 3.2Å; R298-L301 PolarHBondContact O-N 2.92Å; R298-L302 HydrophobicContact CG-CD1 4.06Å; R298-L302 WeakPolarHBondContact O-CB 3.09Å; R298-L302 VanDerWaalsContact O-CG 3.26Å; R298-L302 WeakPolarHBondContact O-CG 3.46Å; R298-L302 PolarHBondContact O-N 3Å
299I92.6Very high91.5Very high110 Ų11063.3 Ų63.356%0.56433%0.332SS*.Hα-helixtrans-60.1-44.2176.6-71164.9000110.5S295 S296 V297 T303S295-I299 WeakPolarHBondContact O-CB 3.36Å; S295-I299 WeakPolarHBondContact O-CD1 3.47Å; S295-I299 WeakPolarHBondContact O-CG1 3.22Å; S295-I299 PolarHBondContact O-N 3.05Å; S296-I299 PolarHBondContact O-N 2.64Å; V297-I299 PolarHBondContact O-N 2.95Å; I299-T303 WeakPolarHBondContact O-CB 3.26Å; I299-T303 PolarHBondContact O-N 3.17Å; I299-T303 PolarHBondContact O-OG1 3.2Å
300H93.3Very high91.9Very high48 Ų4866.5 Ų66.522%0.22234%0.341CS..Hα-helixtrans-59.5-51.5177.3-175.685000112.2S296 V297 R298 L302 T303 K304S296-H300 PolarHBondContact O-N 3.09Å; V297-H300 WeakPolarHBondContact O-CB 3.44Å; V297-H300 PolarHBondContact O-N 2.91Å; R298-H300 VanDerWaalsContact C-N 3.32Å; R298-H300 PolarHBondContact O-N 3.2Å; H300-L302 PolarHBondContact O-N 3.48Å; H300-T303 PolarHBondContact O-N 3.42Å; H300-K304 WeakPolarHBondContact O-CG 3.41Å; H300-K304 PolarHBondContact O-N 2.97Å
301L94Very high92.4Very high0 Ų062.6 Ų62.60%033%0.326CS..Hα-helixtrans-59.7-48.7179.9-69.9174.2000111.5V288 F293 V297 R298 T303 K304 M305 F329 T332V288-L301 HydrophobicContact CG1-CB 4.23Å; V288-L301 HydrophobicContact CG1-CD1 4.22Å; V288-L301 HydrophobicContact CG2-CD1 4.14Å; F293-L301 HydrophobicContact CE2-CD1 4.46Å; V297-L301 HydrophobicContact CG1-CD1 4.27Å; V297-L301 PolarHBondContact O-N 3.44Å; R298-L301 PolarHBondContact O-N 2.92Å; L301-T303 VanDerWaalsContact C-N 3.3Å; L301-T303 PolarHBondContact O-N 2.91Å; L301-K304 PolarHBondContact O-N 3.46Å; L301-M305 VanDerWaalsContact O-CB 3.3Å; L301-M305 WeakPolarHBondContact O-CB 3.32Å; L301-M305 WeakPolarHBondContact O-CG 3.41Å; L301-M305 PolarHBondContact O-N 2.76Å; L301-F329 HydrophobicContact CD1-CD1 4.4Å; L301-F329 HydrophobicContact CD1-CE1 3.9Å; L301-F329 HydrophobicContact CD1-CZ 4.36Å; L301-F329 HydrophobicContact CD2-CD1 3.92Å; L301-F329 HydrophobicContact CD2-CD2 4.16Å; L301-F329 HydrophobicContact CD2-CE1 3.89Å; L301-F329 HydrophobicContact CD2-CE2 4.13Å; L301-F329 HydrophobicContact CD2-CG 4.05Å; L301-F329 HydrophobicContact CD2-CZ 3.99Å; L301-T332 HydrophobicContact CD1-CG2 4.18Å; L301-T332 HydrophobicContact CD2-CG2 3.49Å; L301-T332 VanDerWaalsContact CD2-CG2 3.49Å; L301-T332 HydrophobicContact CG-CG2 3.63Å
302L95Very high92.8Very high49 Ų4961.4 Ų61.426%0.25732%0.318SS..Hα-helixtrans-59.3-41.8179.2-69.7174000111.8H285 V288 R298 H300 A306H285-L302 WeakPolarHBondContact ND1-CD2 3.34Å; V288-L302 HydrophobicContact CG1-CD2 4.37Å; R298-L302 HydrophobicContact CG-CD1 4.06Å; R298-L302 WeakPolarHBondContact O-CB 3.09Å; R298-L302 VanDerWaalsContact O-CG 3.26Å; R298-L302 WeakPolarHBondContact O-CG 3.46Å; R298-L302 PolarHBondContact O-N 3Å; H300-L302 PolarHBondContact O-N 3.48Å; L302-A306 WeakPolarHBondContact O-CB 3.4Å; L302-A306 PolarHBondContact O-N 3.13Å
303T96.2Very high93.3Very high71 Ų7158.7 Ų58.744%0.43631%0.311SS..Hα-helixtrans-63.1-48.6177-55.90000111.2I299 H300 L301 A306 D307I299-T303 WeakPolarHBondContact O-CB 3.26Å; I299-T303 PolarHBondContact O-N 3.17Å; I299-T303 PolarHBondContact O-OG1 3.2Å; H300-T303 PolarHBondContact O-N 3.42Å; L301-T303 VanDerWaalsContact C-N 3.3Å; L301-T303 PolarHBondContact O-N 2.91Å; T303-A306 PolarHBondContact O-N 2.99Å; T303-D307 PolarHBondContact O-N 3.4Å
304K96.4Very high93.7Very high79 Ų7962.7 Ų62.734%0.34334%0.336SS..Hα-helixtrans-67.9-38.9-178.3-66.3-57.6179.1-170.50112.7H300 L301 D307 I308 A328H300-K304 WeakPolarHBondContact O-CG 3.41Å; H300-K304 PolarHBondContact O-N 2.97Å; L301-K304 PolarHBondContact O-N 3.46Å; K304-D307 PolarHBondContact O-N 3.44Å; K304-I308 WeakPolarHBondContact O-CD1 3.35Å; K304-I308 WeakPolarHBondContact O-CG1 3.37Å; K304-I308 PolarHBondContact O-N 3.46Å; K304-A328 HydrophobicContact CB-CB 3.69Å; K304-A328 HydrophobicContact CG-CB 3.98Å
305M95.8Very high93.5Very high5 Ų563.6 Ų63.63%0.02535%0.354CS..Hα-helixtrans-65.6-43177.3-71.5174.851.100111.6L281 I284 H285 V288 L301 D307 I308 E309 L325 F329L281-M305 HydrophobicContact CD1-CB 3.92Å; L281-M305 HydrophobicContact CD1-CE 3.94Å; L281-M305 HydrophobicContact CD1-CG 3.83Å; L281-M305 HydrophobicContact CG-CE 4.39Å; L281-M305 WeakPolarHBondContact O-CE 3.3Å; I284-M305 HydrophobicContact CB-CE 4.47Å; I284-M305 HydrophobicContact CG2-CE 4.04Å; I284-M305 HydrophobicContact CG2-SD 4.1Å; H285-M305 HydrophobicContact CB-CE 3.48Å; H285-M305 VanDerWaalsContact CB-CE 3.48Å; V288-M305 HydrophobicContact CG2-SD 4.14Å; L301-M305 VanDerWaalsContact O-CB 3.3Å; L301-M305 WeakPolarHBondContact O-CB 3.32Å; L301-M305 WeakPolarHBondContact O-CG 3.41Å; L301-M305 PolarHBondContact O-N 2.76Å; M305-D307 VanDerWaalsContact C-N 3.35Å; M305-D307 PolarHBondContact O-N 3Å; M305-I308 PolarHBondContact O-N 2.86Å; M305-E309 PolarHBondContact O-N 3.46Å; M305-L325 HydrophobicContact CG-CD1 3.98Å; M305-F329 HydrophobicContact SD-CE2 4.38Å; M305-F329 HydrophobicContact SD-CZ 4.32Å
306A96.6Very high93.6Very high56 Ų5661.9 Ų61.946%0.46334%0.341SS..Hα-helixtrans-61.4-42.1175.100000112.1L302 T303 I308 E309 Y310L302-A306 WeakPolarHBondContact O-CB 3.4Å; L302-A306 PolarHBondContact O-N 3.13Å; T303-A306 PolarHBondContact O-N 2.99Å; A306-I308 VanDerWaalsContact C-N 3.32Å; A306-I308 PolarHBondContact O-N 3.25Å; A306-E309 PolarHBondContact O-N 3.23Å; A306-Y310 WeakPolarHBondContact O-CB 3.41Å; A306-Y310 PolarHBondContact O-N 3.17Å
307D96.2Very high93.8Very high61 Ų6163.9 Ų63.933%0.32635%0.347SS..Hα-helixtrans-60.1-41.5174.5-76.9-15.2000112.1T303 K304 M305 R311T303-D307 PolarHBondContact O-N 3.4Å; K304-D307 PolarHBondContact O-N 3.44Å; M305-D307 VanDerWaalsContact C-N 3.35Å; M305-D307 PolarHBondContact O-N 3Å; D307-R311 VanDerWaalsContact O-CG 3.24Å; D307-R311 WeakPolarHBondContact O-CG 3.03Å; D307-R311 PolarHBondContact O-N 3.49Å; D307-R311 IonicContact OD2-NH2 3.7Å
308I96.3Very high93.9Very high2 Ų267.8 Ų67.81%0.0137%0.366CS..Hα-helixtrans-68.3-44.4179.9-69.8164000110.5L281 K304 M305 A306 Y310 R311 L312 Q321 S324 L325L281-I308 HydrophobicContact CD2-CB 4.49Å; L281-I308 HydrophobicContact CD2-CG2 4.16Å; K304-I308 WeakPolarHBondContact O-CD1 3.35Å; K304-I308 WeakPolarHBondContact O-CG1 3.37Å; K304-I308 PolarHBondContact O-N 3.46Å; M305-I308 PolarHBondContact O-N 2.86Å; A306-I308 VanDerWaalsContact C-N 3.32Å; A306-I308 PolarHBondContact O-N 3.25Å; I308-Y310 VanDerWaalsContact C-N 3.32Å; I308-Y310 PolarHBondContact O-N 2.84Å; I308-R311 PolarHBondContact O-N 2.96Å; I308-L312 HydrophobicContact CG2-CD1 3.97Å; I308-L312 HydrophobicContact CG2-CG 4.42Å; I308-L312 WeakPolarHBondContact O-CG 3.43Å; I308-L312 PolarHBondContact O-N 2.6Å; I308-Q321 HydrophobicContact CG2-CB 4.15Å; I308-S324 WeakPolarHBondContact CD1-OG 3.36Å; I308-S324 WeakPolarHBondContact CG1-OG 3.3Å; I308-L325 HydrophobicContact CD1-CB 3.91Å; I308-L325 HydrophobicContact CD1-CD1 4.08Å
309E96.3Very high94Very high92 Ų9271.1 Ų71.143%0.4338%0.382SS..Hα-helixtrans-57.6-46.7175.8-166.3179.1173.600111.1H278 L281 M305 A306 R311 L312 S313H278-E309 IonicContact CE1-OE1 2.67Å; L281-E309 HydrophobicContact CD2-CB 3.61Å; L281-E309 HydrophobicContact CD2-CG 4.17Å; M305-E309 PolarHBondContact O-N 3.46Å; A306-E309 PolarHBondContact O-N 3.23Å; E309-R311 PolarHBondContact O-N 3.35Å; E309-L312 PolarHBondContact O-N 3.36Å; E309-S313 PolarHBondContact O-N 3.48Å
310Y96.1Very high94.1Very high167 Ų16771 Ų7166%0.65538%0.381SS*.Hα-helixtrans-60.2-45.9175.9178.8-109.6000111.7A306 I308 L312 S313A306-Y310 WeakPolarHBondContact O-CB 3.41Å; A306-Y310 PolarHBondContact O-N 3.17Å; I308-Y310 VanDerWaalsContact C-N 3.32Å; I308-Y310 PolarHBondContact O-N 2.84Å; Y310-L312 VanDerWaalsContact C-N 3.31Å; Y310-L312 PolarHBondContact O-N 3.04Å; Y310-S313 WeakPolarHBondContact O-CB 3.24Å; Y310-S313 PolarHBondContact O-N 2.91Å; Y310-S313 VanDerWaalsContact O-N 3.16Å; Y310-S313 PolarHBondContact O-OG 3.24Å
311R95.3Very high94.3Very high98 Ų9869.2 Ų69.237%0.3737%0.373SS..Hα-helixtrans-63.3-35.6177.2-71.1169.4-163.3147.310112.7D307 I308 E309 S313 V314 T316D307-R311 VanDerWaalsContact O-CG 3.24Å; D307-R311 WeakPolarHBondContact O-CG 3.03Å; D307-R311 PolarHBondContact O-N 3.49Å; D307-R311 IonicContact OD2-NH2 3.7Å; I308-R311 PolarHBondContact O-N 2.96Å; E309-R311 PolarHBondContact O-N 3.35Å; R311-S313 VanDerWaalsContact C-N 3.32Å; R311-V314 PolarHBondContact O-N 3.28Å; R311-T316 HydrophobicContact CB-CG2 4.45Å; R311-T316 WeakPolarHBondContact O-CB 3.46Å; R311-T316 WeakPolarHBondContact O-CG2 3.18Å; R311-T316 PolarHBondContact O-OG1 3.07Å
312L93.4Very high94.4Very high28 Ų2869.4 Ų69.415%0.14737%0.374CS..Hα-helixtrans-65.3-38175.4-74.4168.1000111.3L277 L281 I308 E309 Y310 V314 G315 E318 Q321L277-L312 HydrophobicContact CB-CD1 4.31Å; L277-L312 HydrophobicContact CD2-CD1 3.94Å; L277-L312 HydrophobicContact CD2-CD2 4.11Å; L277-L312 HydrophobicContact CG-CD1 3.95Å; L281-L312 HydrophobicContact CD2-CD1 4.45Å; I308-L312 HydrophobicContact CG2-CD1 3.97Å; I308-L312 HydrophobicContact CG2-CG 4.42Å; I308-L312 WeakPolarHBondContact O-CG 3.43Å; I308-L312 PolarHBondContact O-N 2.6Å; E309-L312 PolarHBondContact O-N 3.36Å; Y310-L312 VanDerWaalsContact C-N 3.31Å; Y310-L312 PolarHBondContact O-N 3.04Å; L312-V314 PolarHBondContact O-N 3.32Å; L312-V314 VanDerWaalsContact O-N 3.16Å; L312-G315 PolarHBondContact O-N 2.94Å; L312-E318 HydrophobicContact CD2-CG 4.17Å; L312-Q321 HydrophobicContact CD2-CB 3.84Å; L312-Q321 HydrophobicContact CD2-CG 3.73Å; L312-Q321 HydrophobicContact CG-CB 4.19Å; L312-Q321 HydrophobicContact CG-CG 4.07Å
313S92.9Very high94.5Very high92 Ų9268.6 Ų68.664%0.64337%0.373SS*.Hα-helixtrans-62.1-23.1178.580.20000114.4E309 Y310 R311 G315E309-S313 PolarHBondContact O-N 3.48Å; Y310-S313 WeakPolarHBondContact O-CB 3.24Å; Y310-S313 PolarHBondContact O-N 2.91Å; Y310-S313 VanDerWaalsContact O-N 3.16Å; Y310-S313 PolarHBondContact O-OG 3.24Å; R311-S313 VanDerWaalsContact C-N 3.32Å; S313-G315 VanDerWaalsContact C-N 3.34Å
314V93.6Very high94.5Very high99 Ų9966.7 Ų66.760%0.636%0.362SS*.THydrogen-bonded Turntrans-91.24.8179.3-169.90000112.1R311 L312R311-V314 PolarHBondContact O-N 3.28Å; L312-V314 PolarHBondContact O-N 3.32Å; L312-V314 VanDerWaalsContact O-N 3.16Å
315G84.8Confident94.5Very high70 Ų7063 Ų6372%0.72235%0.346SS*.THydrogen-bonded Turntrans7935.717600000114.1L312 S313L312-G315 PolarHBondContact O-N 2.94Å; S313-G315 VanDerWaalsContact C-N 3.34Å
316T90.7Very high94.5Very high55 Ų5562.7 Ų62.734%0.33735%0.345SS..  trans-78.6167.8177.961.20000113R311 E318 Q321R311-T316 HydrophobicContact CB-CG2 4.45Å; R311-T316 WeakPolarHBondContact O-CB 3.46Å; R311-T316 WeakPolarHBondContact O-CG2 3.18Å; R311-T316 PolarHBondContact O-OG1 3.07Å; T316-E318 PolarHBondContact O-N 3.36Å; T316-Q321 WeakPolarHBondContact OG1-CG 3.47Å; T316-Q321 PolarHBondContact OG1-NE2 2.99Å
317N93.5Very high94.4Very high90 Ų9061.9 Ų61.948%0.48134%0.338SS..  trans-68.1114.2-179.4-173.1-27.2000111.6K319 I320 Q321N317-K319 PolarHBondContact O-N 2.92Å; N317-K319 WeakPolarHBondContact OD1-CB 3.26Å; N317-K319 PolarHBondContact OD1-N 3.46Å; N317-I320 HydrophobicContact CB-CD1 4.1Å; N317-I320 HydrophobicContact CB-CG1 4.22Å; N317-I320 PolarHBondContact O-N 3.26Å; N317-I320 VanDerWaalsContact O-N 3.09Å; N317-Q321 PolarHBondContact O-N 3.14Å
318E91.4Very high94.4Very high83 Ų8359.2 Ų59.239%0.38832%0.324SS..Hα-helixtrans-58.1-29.5-179.5-68.2-160.6147.800114.2K270 L312 T316 I320 Q321 L322K270-E318 IonicContact NZ-OE2 2.72Å; K270-E318 PolarHBondContact NZ-OE2 3.48Å; L312-E318 HydrophobicContact CD2-CG 4.17Å; T316-E318 PolarHBondContact O-N 3.36Å; E318-I320 VanDerWaalsContact C-N 3.31Å; E318-I320 PolarHBondContact O-N 3.38Å; E318-Q321 PolarHBondContact O-N 3.46Å; E318-L322 WeakPolarHBondContact O-CB 3.5Å; E318-L322 PolarHBondContact O-N 3Å
319K93.8Very high94.2Very high139 Ų13959.1 Ų59.160%0.60432%0.324SS*.Hα-helixtrans-63.4-41177.7-66.1-176.2177.7-178.80111.2N317 S323N317-K319 PolarHBondContact O-N 2.92Å; N317-K319 WeakPolarHBondContact OD1-CB 3.26Å; N317-K319 PolarHBondContact OD1-N 3.46Å; K319-S323 WeakPolarHBondContact O-CB 3.41Å; K319-S323 PolarHBondContact O-N 3.02Å; K319-S323 VanDerWaalsContact O-N 3.09Å; K319-S323 PolarHBondContact O-OG 3Å; K319-S323 VanDerWaalsContact O-OG 3.12Å
320I95.6Very high93.9Very high106 Ų10656.2 Ų56.254%0.54431%0.31SS..Hα-helixtrans-70.1-39.6178-58.4177.9000109.8N317 E318 S323 S324N317-I320 HydrophobicContact CB-CD1 4.1Å; N317-I320 HydrophobicContact CB-CG1 4.22Å; N317-I320 PolarHBondContact O-N 3.26Å; N317-I320 VanDerWaalsContact O-N 3.09Å; E318-I320 VanDerWaalsContact C-N 3.31Å; E318-I320 PolarHBondContact O-N 3.38Å; I320-S323 PolarHBondContact O-N 3.4Å; I320-S324 WeakPolarHBondContact O-CB 3.21Å; I320-S324 PolarHBondContact O-N 3.12Å; I320-S324 PolarHBondContact O-OG 2.99Å
321Q96.2Very high93.5Very high12 Ų1251.3 Ų51.36%0.05630%0.297CS..Hα-helixtrans-70.1-34.3178.7-58.2-45.6-29.300113.1L277 I308 L312 T316 N317 E318 S324 L325L277-Q321 HydrophobicContact CD2-CB 3.69Å; I308-Q321 HydrophobicContact CG2-CB 4.15Å; L312-Q321 HydrophobicContact CD2-CB 3.84Å; L312-Q321 HydrophobicContact CD2-CG 3.73Å; L312-Q321 HydrophobicContact CG-CB 4.19Å; L312-Q321 HydrophobicContact CG-CG 4.07Å; T316-Q321 WeakPolarHBondContact OG1-CG 3.47Å; T316-Q321 PolarHBondContact OG1-NE2 2.99Å; N317-Q321 PolarHBondContact O-N 3.14Å; E318-Q321 PolarHBondContact O-N 3.46Å; Q321-S324 WeakPolarHBondContact CA-OG 3.48Å; Q321-S324 PolarHBondContact O-N 3.38Å; Q321-S324 PolarHBondContact O-OG 3.22Å; Q321-S324 PolarHBondContact OE1-OG 3.39Å; Q321-L325 WeakPolarHBondContact O-CB 3.45Å; Q321-L325 PolarHBondContact O-N 3.09Å
322L96.2Very high92.9Very high4 Ų446.6 Ų46.62%0.02128%0.28CS..Hα-helixtrans-65.3-46.3171.8175.158.8000110.7Y263 I266 L277 E318 S324 L325 I326Y263-L322 HydrophobicContact CD2-CD2 4.22Å; Y263-L322 HydrophobicContact CD2-CG 4.24Å; Y263-L322 HydrophobicContact CE2-CD2 4.03Å; Y263-L322 HydrophobicContact CE2-CG 4.22Å; I266-L322 HydrophobicContact CB-CD1 4.42Å; I266-L322 HydrophobicContact CG2-CD1 3.68Å; I266-L322 HydrophobicContact CG2-CD2 4.17Å; L277-L322 HydrophobicContact CD1-CB 4.47Å; L277-L322 HydrophobicContact CD1-CD1 4.05Å; L277-L322 HydrophobicContact CD2-CB 4.16Å; E318-L322 WeakPolarHBondContact O-CB 3.5Å; E318-L322 PolarHBondContact O-N 3Å; L322-S324 VanDerWaalsContact C-N 3.29Å; L322-S324 PolarHBondContact O-N 3.42Å; L322-L325 WeakPolarHBondContact O-CB 3.27Å; L322-L325 PolarHBondContact O-N 2.87Å; L322-I326 HydrophobicContact CD1-CD1 4.07Å; L322-I326 HydrophobicContact CD1-CG1 4.29Å; L322-I326 HydrophobicContact CG-CD1 4.04Å; L322-I326 WeakPolarHBondContact O-CG1 3.45Å; L322-I326 PolarHBondContact O-N 3.49Å
323S96.6Very high92.2Very high32 Ų3249.1 Ų49.122%0.22429%0.287CS..Hα-helixtrans-58.6-40.5175-69.60000112.4F259 Y263 K319 I320 I326 A327F259-S323 WeakPolarHBondContact CE2-O 3.47Å; Y263-S323 WeakPolarHBondContact CD2-OG 3.34Å; Y263-S323 VanDerWaalsContact CE2-OG 3.26Å; Y263-S323 WeakPolarHBondContact CE2-OG 3.5Å; K319-S323 WeakPolarHBondContact O-CB 3.41Å; K319-S323 PolarHBondContact O-N 3.02Å; K319-S323 VanDerWaalsContact O-N 3.09Å; K319-S323 PolarHBondContact O-OG 3Å; K319-S323 VanDerWaalsContact O-OG 3.12Å; I320-S323 PolarHBondContact O-N 3.4Å; S323-I326 PolarHBondContact O-N 3.46Å; S323-A327 WeakPolarHBondContact O-CB 3.4Å; S323-A327 PolarHBondContact O-N 3.16Å
324S96.1Very high91.5Very high31 Ų3150.2 Ų50.222%0.21729%0.286CS..Hα-helixtrans-69.4-34.6178.472.60000112.3I308 I320 Q321 L322 A327 A328I308-S324 WeakPolarHBondContact CD1-OG 3.36Å; I308-S324 WeakPolarHBondContact CG1-OG 3.3Å; I320-S324 WeakPolarHBondContact O-CB 3.21Å; I320-S324 PolarHBondContact O-N 3.12Å; I320-S324 PolarHBondContact O-OG 2.99Å; Q321-S324 WeakPolarHBondContact CA-OG 3.48Å; Q321-S324 PolarHBondContact O-N 3.38Å; Q321-S324 PolarHBondContact O-OG 3.22Å; Q321-S324 PolarHBondContact OE1-OG 3.39Å; L322-S324 VanDerWaalsContact C-N 3.29Å; L322-S324 PolarHBondContact O-N 3.42Å; S324-A327 PolarHBondContact O-N 3.04Å; S324-A328 PolarHBondContact O-N 2.89Å
325L96.4Very high90.8Very high0 Ų048.6 Ų48.60%027%0.273CS..Hα-helixtrans-62.6-50.8172.4-176.359.2000111M254 L277 L281 I284 M305 I308 Q321 L322 A327 A328 F329M254-L325 HydrophobicContact CE-CD2 3.66Å; M254-L325 HydrophobicContact CE-CG 3.79Å; M254-L325 HydrophobicContact SD-CG 4.29Å; L277-L325 HydrophobicContact CD1-CD2 4.01Å; L281-L325 HydrophobicContact CD1-CD1 3.65Å; L281-L325 HydrophobicContact CD1-CD2 4.06Å; L281-L325 HydrophobicContact CD1-CG 4.49Å; I284-L325 HydrophobicContact CD1-CD2 4.38Å; M305-L325 HydrophobicContact CG-CD1 3.98Å; I308-L325 HydrophobicContact CD1-CB 3.91Å; I308-L325 HydrophobicContact CD1-CD1 4.08Å; Q321-L325 WeakPolarHBondContact O-CB 3.45Å; Q321-L325 PolarHBondContact O-N 3.09Å; L322-L325 WeakPolarHBondContact O-CB 3.27Å; L322-L325 PolarHBondContact O-N 2.87Å; L325-A327 VanDerWaalsContact C-N 3.3Å; L325-A327 PolarHBondContact O-N 2.56Å; L325-A328 WeakPolarHBondContact O-CB 3.32Å; L325-A328 PolarHBondContact O-N 3.2Å; L325-A328 VanDerWaalsContact O-N 3.14Å; L325-F329 HydrophobicContact CD1-CD2 4.16Å; L325-F329 HydrophobicContact CD1-CE2 3.81Å; L325-F329 HydrophobicContact CG-CD2 4.46Å; L325-F329 HydrophobicContact CG-CE2 4.41Å; L325-F329 WeakPolarHBondContact O-CD2 3.44Å; L325-F329 PolarHBondContact O-N 3.27Å
326I96.1Very high90.5Very high0 Ų048 Ų480%025%0.253CS..Hα-helixtrans-60.2-43.4178-61.7163.8000110.2M254 F259 A262 Y263 I266 L322 S323 A328 F329 Q330M254-I326 HydrophobicContact CE-CG1 4.04Å; M254-I326 HydrophobicContact CG-CG1 4.27Å; F259-I326 HydrophobicContact CD2-CB 4.27Å; F259-I326 HydrophobicContact CD2-CG2 3.6Å; F259-I326 HydrophobicContact CE2-CB 3.94Å; F259-I326 HydrophobicContact CE2-CG2 3.8Å; F259-I326 HydrophobicContact CG-CG2 4.33Å; A262-I326 HydrophobicContact CB-CG2 4.16Å; Y263-I326 HydrophobicContact CD2-CD1 3.9Å; Y263-I326 HydrophobicContact CG-CD1 4.32Å; I266-I326 HydrophobicContact CD1-CD1 3.8Å; I266-I326 HydrophobicContact CD1-CG1 3.82Å; L322-I326 HydrophobicContact CD1-CD1 4.07Å; L322-I326 HydrophobicContact CD1-CG1 4.29Å; L322-I326 HydrophobicContact CG-CD1 4.04Å; L322-I326 WeakPolarHBondContact O-CG1 3.45Å; L322-I326 PolarHBondContact O-N 3.49Å; S323-I326 PolarHBondContact O-N 3.46Å; I326-A328 VanDerWaalsContact C-N 3.3Å; I326-A328 PolarHBondContact O-N 2.99Å; I326-F329 PolarHBondContact O-N 2.97Å; I326-Q330 HydrophobicContact CG2-CG 4.23Å; I326-Q330 WeakPolarHBondContact O-CG 3.49Å; I326-Q330 PolarHBondContact O-N 3.36Å
327A95.4Very high89.8Confident38 Ų3850.7 Ų50.731%0.31427%0.269SS..Hα-helixtrans-59.5-39.7177.400000112.3F259 S323 S324 L325 F329 Q330 V331F259-A327 HydrophobicContact CE2-CB 4.11Å; S323-A327 WeakPolarHBondContact O-CB 3.4Å; S323-A327 PolarHBondContact O-N 3.16Å; S324-A327 PolarHBondContact O-N 3.04Å; L325-A327 VanDerWaalsContact C-N 3.3Å; L325-A327 PolarHBondContact O-N 2.56Å; A327-F329 VanDerWaalsContact C-N 3.34Å; A327-F329 PolarHBondContact O-N 2.99Å; A327-Q330 PolarHBondContact O-N 3.43Å; A327-V331 WeakPolarHBondContact O-CG2 3.18Å; A327-V331 PolarHBondContact O-N 3.26Å
328A94.8Very high88.6Confident6 Ų650.4 Ų50.45%0.0528%0.28CS..Hα-helixtrans-60.3-43.1176.100000111.9K304 S324 L325 I326 T332K304-A328 HydrophobicContact CB-CB 3.69Å; K304-A328 HydrophobicContact CG-CB 3.98Å; S324-A328 PolarHBondContact O-N 2.89Å; L325-A328 WeakPolarHBondContact O-CB 3.32Å; L325-A328 PolarHBondContact O-N 3.2Å; L325-A328 VanDerWaalsContact O-N 3.14Å; I326-A328 VanDerWaalsContact C-N 3.3Å; I326-A328 PolarHBondContact O-N 2.99Å; A328-T332 WeakPolarHBondContact O-CG2 3.47Å; A328-T332 PolarHBondContact O-N 3.23Å
329F92.6Very high87.3Confident0 Ų051.6 Ų51.60%029%0.285CS..Hα-helixtrans-69.7-34.1176.2-82-87.1000113.2L251 M254 L255 I284 V288 L301 M305 L325 I326 A327 T332 R333L251-F329 HydrophobicContact CD1-CD1 4.03Å; L251-F329 HydrophobicContact CD1-CE1 3.46Å; L251-F329 VanDerWaalsContact CD1-CE1 3.46Å; L251-F329 HydrophobicContact CD1-CZ 3.98Å; M254-F329 HydrophobicContact CB-CB 3.86Å; M254-F329 HydrophobicContact CB-CD1 4.46Å; M254-F329 HydrophobicContact CB-CG 4.03Å; M254-F329 HydrophobicContact SD-CD2 3.58Å; M254-F329 VanDerWaalsContact SD-CD2 3.58Å; M254-F329 HydrophobicContact SD-CE2 3.95Å; M254-F329 HydrophobicContact SD-CG 4.04Å; L255-F329 HydrophobicContact CD2-CD1 3.89Å; L255-F329 HydrophobicContact CG-CD1 4.35Å; I284-F329 HydrophobicContact CG2-CE1 4.49Å; I284-F329 HydrophobicContact CG2-CE2 3.88Å; I284-F329 HydrophobicContact CG2-CZ 3.44Å; I284-F329 VanDerWaalsContact CG2-CZ 3.44Å; V288-F329 HydrophobicContact CG2-CE1 4.33Å; V288-F329 HydrophobicContact CG2-CZ 4.02Å; L301-F329 HydrophobicContact CD1-CD1 4.4Å; L301-F329 HydrophobicContact CD1-CE1 3.9Å; L301-F329 HydrophobicContact CD1-CZ 4.36Å; L301-F329 HydrophobicContact CD2-CD1 3.92Å; L301-F329 HydrophobicContact CD2-CD2 4.16Å; L301-F329 HydrophobicContact CD2-CE1 3.89Å; L301-F329 HydrophobicContact CD2-CE2 4.13Å; L301-F329 HydrophobicContact CD2-CG 4.05Å; L301-F329 HydrophobicContact CD2-CZ 3.99Å; M305-F329 HydrophobicContact SD-CE2 4.38Å; M305-F329 HydrophobicContact SD-CZ 4.32Å; L325-F329 HydrophobicContact CD1-CD2 4.16Å; L325-F329 HydrophobicContact CD1-CE2 3.81Å; L325-F329 HydrophobicContact CG-CD2 4.46Å; L325-F329 HydrophobicContact CG-CE2 4.41Å; L325-F329 WeakPolarHBondContact O-CD2 3.44Å; L325-F329 PolarHBondContact O-N 3.27Å; I326-F329 PolarHBondContact O-N 2.97Å; A327-F329 VanDerWaalsContact C-N 3.34Å; A327-F329 PolarHBondContact O-N 2.99Å; F329-T332 WeakPolarHBondContact CA-OG1 3.33Å; F329-T332 PolarHBondContact O-N 3.28Å; F329-T332 PolarHBondContact O-OG1 2.98Å; F329-R333 PolarHBondContact O-N 2.94Å
330Q89.9Confident85.5Confident30 Ų3051.5 Ų51.514%0.1431%0.311CS..Hα-helixtrans-68.2-42.1176-65.7-69.1-14.600111.6M254 Q257 F259 I326 A327 T332 R333 D334M254-Q330 PolarHBondContact O-NE2 3.35Å; M254-Q330 VanDerWaalsContact O-NE2 3.13Å; Q257-Q330 PolarHBondContact O-NE2 2.6Å; F259-Q330 HydrophobicContact CD2-CG 4.49Å; I326-Q330 HydrophobicContact CG2-CG 4.23Å; I326-Q330 WeakPolarHBondContact O-CG 3.49Å; I326-Q330 PolarHBondContact O-N 3.36Å; A327-Q330 PolarHBondContact O-N 3.43Å; Q330-T332 PolarHBondContact O-N 3.22Å; Q330-R333 WeakPolarHBondContact O-CB 3.35Å; Q330-R333 PolarHBondContact O-N 3.27Å; Q330-D334 PolarHBondContact O-N 3.14Å
331V87.6Confident85Confident64 Ų6448.8 Ų48.839%0.38830%0.299SS..Hα-helixtrans-58.3-34.9173.9170.40000111.3A327 R333 D334 L335A327-V331 WeakPolarHBondContact O-CG2 3.18Å; A327-V331 PolarHBondContact O-N 3.26Å; V331-R333 VanDerWaalsContact C-N 3.31Å; V331-R333 PolarHBondContact O-N 3.18Å; V331-D334 PolarHBondContact O-N 3.29Å; V331-L335 HydrophobicContact CG1-CD1 4.16Å; V331-L335 HydrophobicContact CG1-CG 4.43Å; V331-L335 WeakPolarHBondContact O-CG 3.42Å; V331-L335 PolarHBondContact O-N 3.08Å; V331-L335 VanDerWaalsContact O-N 3.08Å
332T82.8Confident84.5Confident0 Ų050.7 Ų50.70%031%0.312CS..Hα-helixtrans-67.1-29.3175.854.80000114.4V297 L301 A328 F329 Q330 D334 L335 I336V297-T332 HydrophobicContact CG1-CG2 3.7Å; L301-T332 HydrophobicContact CD1-CG2 4.18Å; L301-T332 HydrophobicContact CD2-CG2 3.49Å; L301-T332 VanDerWaalsContact CD2-CG2 3.49Å; L301-T332 HydrophobicContact CG-CG2 3.63Å; A328-T332 WeakPolarHBondContact O-CG2 3.47Å; A328-T332 PolarHBondContact O-N 3.23Å; F329-T332 WeakPolarHBondContact CA-OG1 3.33Å; F329-T332 PolarHBondContact O-N 3.28Å; F329-T332 PolarHBondContact O-OG1 2.98Å; Q330-T332 PolarHBondContact O-N 3.22Å; T332-D334 VanDerWaalsContact C-N 3.32Å; T332-L335 PolarHBondContact O-N 3.03Å; T332-I336 WeakPolarHBondContact O-CD1 3.42Å; T332-I336 WeakPolarHBondContact O-CG1 3.34Å; T332-I336 PolarHBondContact O-N 3.04Å
333R78.9Confident83.8Confident81 Ų8153.3 Ų53.331%0.30633%0.328SS..Hα-helixtrans-62.5-44.9173.7-61.3171.47017411.9110.4L255 Q257 F329 Q330 V331 L335 I336 V337L255-R333 WeakPolarHBondContact O-CD 3.39Å; L255-R333 PolarHBondContact O-NE 3.11Å; Q257-R333 PolarHBondContact O-NH1 2.86Å; F329-R333 PolarHBondContact O-N 2.94Å; Q330-R333 WeakPolarHBondContact O-CB 3.35Å; Q330-R333 PolarHBondContact O-N 3.27Å; V331-R333 VanDerWaalsContact C-N 3.31Å; V331-R333 PolarHBondContact O-N 3.18Å; R333-L335 VanDerWaalsContact C-N 3.31Å; R333-L335 PolarHBondContact O-N 3.43Å; R333-I336 PolarHBondContact O-N 3.24Å; R333-V337 VanDerWaalsContact O-CG2 3.32Å; R333-V337 WeakPolarHBondContact O-CG2 3.32Å; R333-V337 PolarHBondContact O-N 3.48Å
334D78.8Confident83.1Confident115 Ų11554.6 Ų54.662%0.61533%0.334SS*.Hα-helixtrans-63.7-39.4178.8-60.6-24000111.4Q330 V331 T332 V337 A338Q330-D334 PolarHBondContact O-N 3.14Å; V331-D334 PolarHBondContact O-N 3.29Å; T332-D334 VanDerWaalsContact C-N 3.32Å; D334-V337 PolarHBondContact O-N 3.01Å; D334-A338 WeakPolarHBondContact O-CB 3.41Å; D334-A338 PolarHBondContact O-N 3.31Å
335L78.9Confident82.2Confident64 Ų6456.1 Ų56.134%0.33534%0.341SS..Hα-helixtrans-66.2-42176-69.8172.8000112.7V297 V331 T332 R333 V337 A338 E339V297-L335 HydrophobicContact CG2-CB 4.23Å; V331-L335 HydrophobicContact CG1-CD1 4.16Å; V331-L335 HydrophobicContact CG1-CG 4.43Å; V331-L335 WeakPolarHBondContact O-CG 3.42Å; V331-L335 PolarHBondContact O-N 3.08Å; V331-L335 VanDerWaalsContact O-N 3.08Å; T332-L335 PolarHBondContact O-N 3.03Å; R333-L335 VanDerWaalsContact C-N 3.31Å; R333-L335 PolarHBondContact O-N 3.43Å; L335-V337 VanDerWaalsContact C-N 3.34Å; L335-A338 PolarHBondContact O-N 2.92Å; L335-E339 PolarHBondContact O-N 3.08Å; L335-E339 VanDerWaalsContact O-N 3.08Å
336I78.3Confident81.3Confident58 Ų5859.8 Ų59.830%0.29736%0.364SS..Hα-helixtrans-63.9-42.1177.2-68.9165000110.4F293 V297 T332 R333 A338 E339 A340F293-I336 HydrophobicContact CD1-CD1 4.29Å; F293-I336 HydrophobicContact CE1-CD1 4.39Å; V297-I336 HydrophobicContact CG1-CD1 4.28Å; V297-I336 HydrophobicContact CG1-CG1 4.35Å; V297-I336 HydrophobicContact CG2-CD1 4.49Å; V297-I336 HydrophobicContact CG2-CG1 3.69Å; T332-I336 WeakPolarHBondContact O-CD1 3.42Å; T332-I336 WeakPolarHBondContact O-CG1 3.34Å; T332-I336 PolarHBondContact O-N 3.04Å; R333-I336 PolarHBondContact O-N 3.24Å; I336-A338 VanDerWaalsContact C-N 3.28Å; I336-A338 PolarHBondContact O-N 3.45Å; I336-E339 PolarHBondContact O-N 3.44Å; I336-A340 WeakPolarHBondContact O-CB 3.43Å; I336-A340 PolarHBondContact O-N 3.29Å; I336-A340 VanDerWaalsContact O-N 3.14Å
337V76.1Confident80.2Confident111 Ų11164.1 Ų64.167%0.67339%0.39SS*.Hα-helixtrans-64.9-32.9176.6172.60000111.7R333 D334 L335R333-V337 VanDerWaalsContact O-CG2 3.32Å; R333-V337 WeakPolarHBondContact O-CG2 3.32Å; R333-V337 PolarHBondContact O-N 3.48Å; D334-V337 PolarHBondContact O-N 3.01Å; L335-V337 VanDerWaalsContact C-N 3.34Å
338A68.6Low79.1Confident85 Ų8566.1 Ų66.170%0.70240%0.396SS*.Hα-helixtrans-76.6-22.7177.600000113.9D334 L335 I336D334-A338 WeakPolarHBondContact O-CB 3.41Å; D334-A338 PolarHBondContact O-N 3.31Å; L335-A338 PolarHBondContact O-N 2.92Å; I336-A338 VanDerWaalsContact C-N 3.28Å; I336-A338 PolarHBondContact O-N 3.45Å
339E63.6Low77.8Confident107 Ų10771.1 Ų71.150%0.543%0.425SS..Hα-helixtrans-93.6-12.8178.1-73.2-175.2172.200114P294 S296 L335 I336P294-E339 WeakPolarHBondContact CB-OE2 3.43Å; S296-E339 VanDerWaalsContact CB-OE1 3.27Å; S296-E339 WeakPolarHBondContact CB-OE1 3.37Å; S296-E339 PolarHBondContact OG-OE1 3.23Å; S296-E339 PolarHBondContact OG-OE2 2.88Å; L335-E339 PolarHBondContact O-N 3.08Å; L335-E339 VanDerWaalsContact O-N 3.08Å; I336-E339 PolarHBondContact O-N 3.44Å
340A57Low76.4Confident138 Ų13877.5 Ų77.5100%1.14146%0.463SS*.  trans-88.70-18000000113.2I336I336-A340 WeakPolarHBondContact O-CB 3.43Å; I336-A340 PolarHBondContact O-N 3.29Å; I336-A340 VanDerWaalsContact O-N 3.14Å

Retrieved 340 of 340 residues in 81.4 ms (Link to these results)

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