A0A087XBP1_POEFO Loading...

Folliculogenesis specific bHLH transcription factor

AlphaFold DB , UniProt , Accession A0A087XBP1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 195 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
1M64.8Low76.3Confident245 Ų245131.4 Ų131.4100%1.20768%0.68SS**  01320-63.6-167.9-152.900107.9
2K73.2Confident76.8Confident206 Ų206124.1 Ų124.190%0.89664%0.642SS**PPolyproline II helixtrans-85.5122179.9-153.9174.2-175.3-175.80107.6
3V70.4Confident76.7Confident129 Ų129118.3 Ų118.378%0.78261%0.612SS**PPolyproline II helixtrans-64.8129.7177.9178.70000107.8
4P77.1Confident77Confident112 Ų112116.6 Ų116.673%0.72760%0.598SS**PPolyproline II helixtrans-60.1144.8176.1-20.831.9000111
5E80.1Confident77.4Confident164 Ų164119.1 Ų119.177%0.76660%0.597SS**PPolyproline II helixtrans-60.3140.8175.2-72.2-65.8139.400110.4E7E5-E7 PolarHBondContact O-N 3.47Å; E5-E7 VanDerWaalsContact O-N 3.11Å
6P78.6Confident77.6Confident116 Ų116119.9 Ų119.975%0.75360%0.603SS**  trans-66.2111.3-179.726.3-32.4000110.4
7E81Confident77.6Confident116 Ų116117.9 Ų117.954%0.54260%0.598SS.*  trans-75.3134.1171-69.4-161.2143.600110.3E5 I12 R15E5-E7 PolarHBondContact O-N 3.47Å; E5-E7 VanDerWaalsContact O-N 3.11Å; E7-I12 HydrophobicContact CB-CD1 3.99Å; E7-I12 HydrophobicContact CB-CG1 4.16Å; E7-I12 WeakPolarHBondContact OE2-CG1 3.28Å; E7-R15 IonicContact OE1-CZ 3.98Å; E7-R15 IonicContact OE1-NH1 3.17Å; E7-R15 PolarHBondContact OE1-NH1 3.01Å; E7-R15 VanDerWaalsContact OE1-NH1 3.08Å; E7-R15 IonicContact OE1-NH2 3.91Å; E7-R15 PolarHBondContact OE1-NH2 3.33Å; E7-R15 IonicContact OE2-CZ 2.75Å; E7-R15 IonicContact OE2-NH1 3.52Å; E7-R15 IonicContact OE2-NH2 3.08Å; E7-R15 PolarHBondContact OE2-NH2 2.91Å
8Q81.4Confident77.4Confident127 Ų127115.3 Ų115.359%0.59361%0.606SS**  trans-74.1135.9171.5-63.8-156.6-16.200110.5S10 D11 I12Q8-S10 WeakPolarHBondContact CB-OG 3.26Å; Q8-S10 PolarHBondContact O-N 3.26Å; Q8-S10 VanDerWaalsContact O-N 3.13Å; Q8-S10 PolarHBondContact OE1-OG 3.07Å; Q8-D11 WeakPolarHBondContact O-CB 3.28Å; Q8-D11 PolarHBondContact O-N 3.22Å; Q8-I12 PolarHBondContact O-N 3.14Å
9M78.3Confident77Confident130 Ų130116.2 Ų116.264%0.6461%0.606SS**Hα-helixtrans-54.3-33.3175.8-171.965.869.100112.2D11 I12 L13M9-D11 VanDerWaalsContact C-N 3.29Å; M9-D11 PolarHBondContact O-N 3.33Å; M9-I12 PolarHBondContact O-N 3.24Å; M9-L13 HydrophobicContact CG-CD1 3.98Å; M9-L13 HydrophobicContact CG-CG 4.33Å; M9-L13 WeakPolarHBondContact O-CB 3.5Å; M9-L13 WeakPolarHBondContact O-CG 3.4Å; M9-L13 PolarHBondContact O-N 2.88Å
10S74.3Confident76.3Confident22 Ų22114.8 Ų114.815%0.15461%0.607CS.*Hα-helixtrans-58.2-39.8173.347.60000113.1Q8 K14Q8-S10 WeakPolarHBondContact CB-OG 3.26Å; Q8-S10 PolarHBondContact O-N 3.26Å; Q8-S10 VanDerWaalsContact O-N 3.13Å; Q8-S10 PolarHBondContact OE1-OG 3.07Å; S10-K14 WeakPolarHBondContact O-CB 3.44Å; S10-K14 WeakPolarHBondContact O-CG 3.28Å; S10-K14 PolarHBondContact O-N 2.91Å
11D80.6Confident75.9Confident78 Ų78112.6 Ų112.642%0.41761%0.606SS.*Hα-helixtrans-78.9-35.8-175.1-58.5-23.4000110.5Q8 M9 R15Q8-D11 WeakPolarHBondContact O-CB 3.28Å; Q8-D11 PolarHBondContact O-N 3.22Å; M9-D11 VanDerWaalsContact C-N 3.29Å; M9-D11 PolarHBondContact O-N 3.33Å; D11-R15 VanDerWaalsContact O-CB 3.28Å; D11-R15 WeakPolarHBondContact O-CB 3.4Å; D11-R15 PolarHBondContact O-N 3.12Å
12I81.6Confident75.8Confident44 Ų44106.1 Ų106.123%0.22658%0.575CS.*Hα-helixtrans-61.1-49.2170.8-62.7168.5000110.1E7 Q8 M9 R15 L16E7-I12 HydrophobicContact CB-CD1 3.99Å; E7-I12 HydrophobicContact CB-CG1 4.16Å; E7-I12 WeakPolarHBondContact OE2-CG1 3.28Å; Q8-I12 PolarHBondContact O-N 3.14Å; M9-I12 PolarHBondContact O-N 3.24Å; I12-R15 PolarHBondContact O-N 3.48Å; I12-L16 HydrophobicContact CG2-CD1 3.77Å; I12-L16 HydrophobicContact CG2-CG 4.49Å; I12-L16 WeakPolarHBondContact O-CB 3.29Å; I12-L16 WeakPolarHBondContact O-CG 3.14Å; I12-L16 PolarHBondContact O-N 3.04Å
13L76.3Confident75.6Confident49 Ų49101.2 Ų101.226%0.25756%0.564SS.*Hα-helixtrans-63.5-48.7-179.9-71.5171.7000111.1M9 R15 L16 T17 L22 P23M9-L13 HydrophobicContact CG-CD1 3.98Å; M9-L13 HydrophobicContact CG-CG 4.33Å; M9-L13 WeakPolarHBondContact O-CB 3.5Å; M9-L13 WeakPolarHBondContact O-CG 3.4Å; M9-L13 PolarHBondContact O-N 2.88Å; L13-R15 VanDerWaalsContact C-N 3.27Å; L13-R15 PolarHBondContact O-N 3.41Å; L13-L16 PolarHBondContact O-N 3.23Å; L13-L16 VanDerWaalsContact O-N 3.09Å; L13-T17 PolarHBondContact O-N 2.89Å; L13-T17 PolarHBondContact O-OG1 3.43Å; L13-L22 HydrophobicContact CD1-CD2 4.46Å; L13-P23 HydrophobicContact CD1-CG 4.34Å
14K80.1Confident75.5Confident94 Ų94102.7 Ų102.741%0.40957%0.567SS.*Hα-helixtrans-53.5-43175.1-79.5170.4-176.9178.30112.9S10 G18 S20S10-K14 WeakPolarHBondContact O-CB 3.44Å; S10-K14 WeakPolarHBondContact O-CG 3.28Å; S10-K14 PolarHBondContact O-N 2.91Å; K14-G18 VanDerWaalsContact O-CA 3.28Å; K14-G18 WeakPolarHBondContact O-CA 3.3Å; K14-G18 PolarHBondContact O-N 3.35Å; K14-S20 VanDerWaalsContact CE-OG 3.26Å; K14-S20 WeakPolarHBondContact CE-OG 3.49Å
15R82.9Confident74.8Confident154 Ų154108 Ų10858%0.58157%0.574SS**Hα-helixtrans-68.5-34.5-180-177.5170.559-148.5-0.1112.6E7 D11 I12 L13E7-R15 IonicContact OE1-CZ 3.98Å; E7-R15 IonicContact OE1-NH1 3.17Å; E7-R15 PolarHBondContact OE1-NH1 3.01Å; E7-R15 VanDerWaalsContact OE1-NH1 3.08Å; E7-R15 IonicContact OE1-NH2 3.91Å; E7-R15 PolarHBondContact OE1-NH2 3.33Å; E7-R15 IonicContact OE2-CZ 2.75Å; E7-R15 IonicContact OE2-NH1 3.52Å; E7-R15 IonicContact OE2-NH2 3.08Å; E7-R15 PolarHBondContact OE2-NH2 2.91Å; D11-R15 VanDerWaalsContact O-CB 3.28Å; D11-R15 WeakPolarHBondContact O-CB 3.4Å; D11-R15 PolarHBondContact O-N 3.12Å; I12-R15 PolarHBondContact O-N 3.48Å; L13-R15 VanDerWaalsContact C-N 3.27Å; L13-R15 PolarHBondContact O-N 3.41Å
16L81.4Confident74.1Confident133 Ų133104.9 Ų104.970%0.69657%0.57SS**Hα-helixtrans-88.9-39.7-175.9-69.8175.1000113.6I12 L13I12-L16 HydrophobicContact CG2-CD1 3.77Å; I12-L16 HydrophobicContact CG2-CG 4.49Å; I12-L16 WeakPolarHBondContact O-CB 3.29Å; I12-L16 WeakPolarHBondContact O-CG 3.14Å; I12-L16 PolarHBondContact O-N 3.04Å; L13-L16 PolarHBondContact O-N 3.23Å; L13-L16 VanDerWaalsContact O-N 3.09Å
17T76.8Confident73.9Confident85 Ų85101.9 Ų101.952%0.52155%0.551SS.*Hα-helixtrans-104.8-14.5-174.559.40000113.4L13 E19L13-T17 PolarHBondContact O-N 2.89Å; L13-T17 PolarHBondContact O-OG1 3.43Å; T17-E19 PolarHBondContact O-N 3.33Å; T17-E19 VanDerWaalsContact O-N 3.12Å
18G74.5Confident73.6Confident72 Ų72104.6 Ų104.674%0.74257%0.568SS**SBendtrans71.7-5.6-175.500000114K14K14-G18 VanDerWaalsContact O-CA 3.28Å; K14-G18 WeakPolarHBondContact O-CA 3.3Å; K14-G18 PolarHBondContact O-N 3.35Å
19E70Confident73.6Confident131 Ų131102.2 Ų102.261%0.61256%0.557SS**  trans-96.3126.1179.3-65.6-175.1173.600110.2T17 A21T17-E19 PolarHBondContact O-N 3.33Å; T17-E19 VanDerWaalsContact O-N 3.12Å; E19-A21 PolarHBondContact O-N 2.87Å
20S63.6Low73.8Confident88 Ų88101.3 Ų101.362%0.61555%0.549SS*.  trans-74.6-4.7172.3-177.80000113.1K14 L22K14-S20 VanDerWaalsContact CE-OG 3.26Å; K14-S20 WeakPolarHBondContact CE-OG 3.49Å; S20-L22 PolarHBondContact O-N 3.09Å
21A66.3Low74.2Confident70 Ų70105.8 Ų105.858%0.57957%0.566SS**  trans-74.9110.2-179.500000108.9E19E19-A21 PolarHBondContact O-N 2.87Å
22L64.1Low74.6Confident108 Ų108108 Ų10857%0.56557%0.572SS**PPolyproline II helixtrans-57.5146.3161.8-72.5170.7000108.5L13 S20 L24L13-L22 HydrophobicContact CD1-CD2 4.46Å; S20-L22 PolarHBondContact O-N 3.09Å; L22-L24 PolarHBondContact O-N 3.49Å
23P68.4Low75Confident104 Ų104113.7 Ų113.768%0.67559%0.59SS**PPolyproline II helixtrans-48120.6171.4-25.132.7000109.3L13 Y25L13-P23 HydrophobicContact CD1-CG 4.34Å; P23-Y25 PolarHBondContact O-N 3.03Å
24L68.5Low75.7Confident160 Ų160113.3 Ų113.384%0.83859%0.592SS**PPolyproline II helixtrans-59126.8175-81.8161.6000107.5L22 C26L22-L24 PolarHBondContact O-N 3.49Å; L24-C26 VanDerWaalsContact C-N 3.34Å; L24-C26 PolarHBondContact O-N 2.91Å
25Y62.9Low76.2Confident223 Ų223120.7 Ų120.788%0.87562%0.617SS**  trans-65.6101.4171.9-170.3-91.4000107.7P23P23-Y25 PolarHBondContact O-N 3.03Å
26C65.4Low76.6Confident99 Ų99119.6 Ų119.667%0.66962%0.622SS**  trans-99.6144170.953.50000109.4L24 I28L24-C26 VanDerWaalsContact C-N 3.34Å; L24-C26 PolarHBondContact O-N 2.91Å; C26-I28 PolarHBondContact O-N 3.3Å
27S72.9Confident77.1Confident52 Ų52114.6 Ų114.636%0.36460%0.603SS.*  trans-59.2133.7171.4-56.50000109.2E29S27-E29 VanDerWaalsContact C-N 3.35Å; S27-E29 PolarHBondContact O-N 2.99Å
28I75.9Confident77.7Confident174 Ų174116.4 Ų116.489%0.89261%0.609SS**  trans-69.997.6171.4-58175.2000107.6C26C26-I28 PolarHBondContact O-N 3.3Å
29E81Confident78.2Confident77 Ų77120.4 Ų120.436%0.3660%0.603SS.*PPolyproline II helixtrans-89.4143.3176.8-71.8174.4-173.400110.3S27 F31 V41S27-E29 VanDerWaalsContact C-N 3.35Å; S27-E29 PolarHBondContact O-N 2.99Å; E29-F31 HydrophobicContact CB-CD2 4.25Å; E29-F31 HydrophobicContact CB-CE2 3.61Å; E29-F31 HydrophobicContact CB-CZ 4.05Å; E29-F31 VanDerWaalsContact O-CD2 3.32Å; E29-F31 WeakPolarHBondContact O-CD2 3.46Å; E29-F31 PolarHBondContact O-N 2.8Å; E29-V41 HydrophobicContact CB-CG1 4.44Å; E29-V41 WeakPolarHBondContact OE2-CG2 3.44Å
30K82.2Confident78.9Confident111 Ų111119.1 Ų119.148%0.48359%0.593SS.*PPolyproline II helixtrans-79.5120171.6-67.1-177.4-170.3164.20107.7A42 E43K30-A42 HydrophobicContact CB-CB 4.22Å; K30-A42 VanDerWaalsContact O-CB 3.25Å; K30-A42 WeakPolarHBondContact O-CB 3.24Å; K30-A42 PolarHBondContact O-N 3.39Å; K30-E43 VanDerWaalsContact NZ-CD 3.34Å; K30-E43 IonicContact NZ-OE1 3.9Å; K30-E43 PolarHBondContact NZ-OE1 3.27Å; K30-E43 IonicContact NZ-OE2 2.98Å; K30-E43 PolarHBondContact NZ-OE2 3.39Å; K30-E43 VanDerWaalsContact NZ-OE2 3.17Å
31F83.7Confident79.9Confident116 Ų116118.1 Ų118.151%0.50958%0.583SS.*EExtended strand (participates in β ladder)trans-102143.2173.2-70.3-92.6000110.7E29 Y39 Y40 V41E29-F31 HydrophobicContact CB-CD2 4.25Å; E29-F31 HydrophobicContact CB-CE2 3.61Å; E29-F31 HydrophobicContact CB-CZ 4.05Å; E29-F31 VanDerWaalsContact O-CD2 3.32Å; E29-F31 WeakPolarHBondContact O-CD2 3.46Å; E29-F31 PolarHBondContact O-N 2.8Å; F31-Y39 HydrophobicContact CB-CD1 4.03Å; F31-Y40 CarbonylContact C-O 3.53Å; F31-Y40 VanDerWaalsContact CA-O 3.26Å; F31-Y40 WeakPolarHBondContact CA-O 3.25Å; F31-V41 HydrophobicContact CD1-CG2 4.22Å; F31-V41 HydrophobicContact CE1-CG2 3.55Å; F31-V41 HydrophobicContact CZ-CG2 3.92Å
32K87.4Confident80.6Confident123 Ų123117 Ų11754%0.53557%0.573SS.*EExtended strand (participates in β ladder)trans-117.4137.6173.2-176.6170.1171.6-172.50109.3Y39 Y40 A42K32-Y39 WeakPolarHBondContact O-CA 3.23Å; K32-Y40 HydrophobicContact CB-CE1 4.27Å; K32-Y40 HydrophobicContact CB-CE2 3.98Å; K32-Y40 HydrophobicContact CD-CE2 4.41Å; K32-Y40 VanDerWaalsContact CD-OH 3.27Å; K32-Y40 WeakPolarHBondContact CD-OH 3.27Å; K32-Y40 HydrophobicContact CG-CE1 4.36Å; K32-Y40 HydrophobicContact CG-CE2 4.46Å; K32-Y40 PolarHBondContact N-O 3.27Å; K32-Y40 VanDerWaalsContact O-CD1 3.23Å; K32-Y40 WeakPolarHBondContact O-CD1 3.47Å; K32-Y40 WeakPolarHBondContact O-CE1 3.41Å; K32-Y40 PolarHBondContact O-N 3.02Å; K32-A42 HydrophobicContact CB-CB 3.84Å
33R91.3Very high81.3Confident165 Ų165115.5 Ų115.562%0.62356%0.564SS**EExtended strand (participates in β ladder)trans-83.5127.5178.2-167.1178.7175.4-155-4.4110.1Y39R33-Y39 HydrophobicContact CB-CD1 4.25Å; R33-Y39 HydrophobicContact CB-CE1 3.94Å; R33-Y39 HydrophobicContact CG-CE1 4.34Å; R33-Y39 HydrophobicContact CG-CE2 4.47Å
34S90.3Very high82.1Confident40 Ų40115 Ų11528%0.2856%0.556SS.*  trans-78.2165.7170.1-169.80000111.2D36 G37 L38S34-D36 PolarHBondContact O-N 2.76Å; S34-D36 PolarHBondContact OG-OD2 3.24Å; S34-G37 PolarHBondContact O-N 2.85Å; S34-L38 PolarHBondContact N-O 3.31Å
35R91.8Very high82.7Confident250 Ų250112.5 Ų112.594%0.94354%0.538SS*.THydrogen-bonded Turntrans-61.4-25.4172.1-70.1-168-74.4-164.6-2.6112.6G37R35-G37 PolarHBondContact O-N 3.03Å
36D90.8Very high83.8Confident130 Ų130104.4 Ų104.470%0.69551%0.514SS*.THydrogen-bonded Turntrans-78.62.8176.7-40.8-61000112.8S34 L38S34-D36 PolarHBondContact O-N 2.76Å; S34-D36 PolarHBondContact OG-OD2 3.24Å; D36-L38 PolarHBondContact O-N 2.8Å
37G90.9Very high84.8Confident28 Ų28104.6 Ų104.629%0.28951%0.505SS..SBendtrans81.9-8.6-179.300000115.1S34 R35S34-G37 PolarHBondContact O-N 2.85Å; R35-G37 PolarHBondContact O-N 3.03Å
38L89.6Confident85.5Confident124 Ų124102.9 Ų102.965%0.64949%0.493SS*.  trans-77.2146.6178.6-63.1172.3000112.3S34 D36S34-L38 PolarHBondContact N-O 3.31Å; D36-L38 PolarHBondContact O-N 2.8Å
39Y85.4Confident86.1Confident155 Ų15596.7 Ų96.761%0.60846%0.463SS*.EExtended strand (participates in β ladder)trans-98.5136.7174.4-71.9-92.8000110.5F31 K32 R33F31-Y39 HydrophobicContact CB-CD1 4.03Å; K32-Y39 WeakPolarHBondContact O-CA 3.23Å; R33-Y39 HydrophobicContact CB-CD1 4.25Å; R33-Y39 HydrophobicContact CB-CE1 3.94Å; R33-Y39 HydrophobicContact CG-CE1 4.34Å; R33-Y39 HydrophobicContact CG-CE2 4.47Å
40Y83.9Confident86.6Confident105 Ų10599.2 Ų99.241%0.41247%0.472SS..EExtended strand (participates in β ladder)trans-131.5154.4173.360.7-88.5000110.6F31 K32 A42F31-Y40 CarbonylContact C-O 3.53Å; F31-Y40 VanDerWaalsContact CA-O 3.26Å; F31-Y40 WeakPolarHBondContact CA-O 3.25Å; K32-Y40 HydrophobicContact CB-CE1 4.27Å; K32-Y40 HydrophobicContact CB-CE2 3.98Å; K32-Y40 HydrophobicContact CD-CE2 4.41Å; K32-Y40 VanDerWaalsContact CD-OH 3.27Å; K32-Y40 WeakPolarHBondContact CD-OH 3.27Å; K32-Y40 HydrophobicContact CG-CE1 4.36Å; K32-Y40 HydrophobicContact CG-CE2 4.46Å; K32-Y40 PolarHBondContact N-O 3.27Å; K32-Y40 VanDerWaalsContact O-CD1 3.23Å; K32-Y40 WeakPolarHBondContact O-CD1 3.47Å; K32-Y40 WeakPolarHBondContact O-CE1 3.41Å; K32-Y40 PolarHBondContact O-N 3.02Å; Y40-A42 PolarHBondContact O-N 3.06Å
41V85.4Confident87Confident67 Ų6799.8 Ų99.841%0.40648%0.475SS..EExtended strand (participates in β ladder)trans-64119.8176.3-1780000108.7E29 F31 E43E29-V41 HydrophobicContact CB-CG1 4.44Å; E29-V41 WeakPolarHBondContact OE2-CG2 3.44Å; F31-V41 HydrophobicContact CD1-CG2 4.22Å; F31-V41 HydrophobicContact CE1-CG2 3.55Å; F31-V41 HydrophobicContact CZ-CG2 3.92Å; V41-E43 VanDerWaalsContact CG1-O 3.24Å; V41-E43 WeakPolarHBondContact CG1-O 3.38Å
42A81.3Confident87.4Confident45 Ų45101.1 Ų101.137%0.37248%0.477SS..  trans-81.1-22.6-170.800000113.5K30 K32 Y40K30-A42 HydrophobicContact CB-CB 4.22Å; K30-A42 VanDerWaalsContact O-CB 3.25Å; K30-A42 WeakPolarHBondContact O-CB 3.24Å; K30-A42 PolarHBondContact O-N 3.39Å; K32-A42 HydrophobicContact CB-CB 3.84Å; Y40-A42 PolarHBondContact O-N 3.06Å
43E79.3Confident87.8Confident77 Ų77100.8 Ų100.836%0.3648%0.477SS..SBendtrans-140.7139.5-176.9-65.2175.5-173.200110.1K30 V41 F45 T48K30-E43 VanDerWaalsContact NZ-CD 3.34Å; K30-E43 IonicContact NZ-OE1 3.9Å; K30-E43 PolarHBondContact NZ-OE1 3.27Å; K30-E43 IonicContact NZ-OE2 2.98Å; K30-E43 PolarHBondContact NZ-OE2 3.39Å; K30-E43 VanDerWaalsContact NZ-OE2 3.17Å; V41-E43 VanDerWaalsContact CG1-O 3.24Å; V41-E43 WeakPolarHBondContact CG1-O 3.38Å; E43-F45 PolarHBondContact O-N 3.4Å; E43-T48 WeakPolarHBondContact CB-OG1 3.28Å; E43-T48 PolarHBondContact OE2-OG1 2.84Å
44D83.9Confident88.1Confident95 Ų9599.1 Ų99.151%0.50848%0.48SS..  trans-64.2121.3167.9-178.9-11.7000109.2S46 E47 T48D44-S46 PolarHBondContact O-N 2.89Å; D44-S46 WeakPolarHBondContact OD1-CB 3.21Å; D44-S46 PolarHBondContact OD1-N 3.13Å; D44-E47 HydrophobicContact CB-CB 4.3Å; D44-E47 HydrophobicContact CB-CG 4.08Å; D44-E47 PolarHBondContact O-N 3.02Å; D44-E47 VanDerWaalsContact O-N 3.14Å; D44-T48 PolarHBondContact O-N 3.33Å; D44-T48 PolarHBondContact O-OG1 2.95Å
45F81.8Confident88.4Confident107 Ų107101.7 Ų101.747%0.46949%0.493SS..Hα-helixtrans-52-41.8178.6178.6-100.5000112.2E43 E47 T48 V49E43-F45 PolarHBondContact O-N 3.4Å; F45-E47 PolarHBondContact O-N 3.24Å; F45-T48 PolarHBondContact O-N 3.09Å; F45-V49 HydrophobicContact CD1-CG2 4.18Å; F45-V49 HydrophobicContact CD2-CG2 4.34Å; F45-V49 HydrophobicContact CE1-CG2 3.77Å; F45-V49 HydrophobicContact CE2-CG2 3.95Å; F45-V49 HydrophobicContact CG-CG2 4.45Å; F45-V49 HydrophobicContact CZ-CG2 3.65Å; F45-V49 VanDerWaalsContact O-CG2 3.29Å; F45-V49 WeakPolarHBondContact O-CG2 3.47Å; F45-V49 PolarHBondContact O-N 3.42Å
46S85.9Confident88.7Confident53 Ų5393.8 Ų93.837%0.37147%0.47SS..Hα-helixtrans-62.8-43.4-179.3-174.80000111.7D44 K50D44-S46 PolarHBondContact O-N 2.89Å; D44-S46 WeakPolarHBondContact OD1-CB 3.21Å; D44-S46 PolarHBondContact OD1-N 3.13Å; S46-K50 VanDerWaalsContact O-CG 3.28Å; S46-K50 WeakPolarHBondContact O-CG 3.34Å; S46-K50 PolarHBondContact O-N 2.95Å; S46-K50 VanDerWaalsContact O-N 3.07Å
47E86.9Confident89.1Confident102 Ų10289.6 Ų89.648%0.47745%0.454SS..Hα-helixtrans-67.8-41.5176.4-66.2-166.2169.800112.3D44 F45 V49 K50 K51D44-E47 HydrophobicContact CB-CB 4.3Å; D44-E47 HydrophobicContact CB-CG 4.08Å; D44-E47 PolarHBondContact O-N 3.02Å; D44-E47 VanDerWaalsContact O-N 3.14Å; F45-E47 PolarHBondContact O-N 3.24Å; E47-V49 VanDerWaalsContact C-N 3.33Å; E47-V49 PolarHBondContact O-N 3.37Å; E47-K50 PolarHBondContact O-N 3.02Å; E47-K51 WeakPolarHBondContact O-CB 3.36Å; E47-K51 VanDerWaalsContact O-CG 3.3Å; E47-K51 WeakPolarHBondContact O-CG 3.38Å; E47-K51 PolarHBondContact O-N 3.28Å; E47-K51 IonicContact OE2-NZ 2.83Å
48T86.6Confident89.4Confident17 Ų1796.1 Ų96.110%0.10447%0.474CS..Hα-helixtrans-65.3-38.8179.6-66.70000111.4E43 D44 F45 R52E43-T48 WeakPolarHBondContact CB-OG1 3.28Å; E43-T48 PolarHBondContact OE2-OG1 2.84Å; D44-T48 PolarHBondContact O-N 3.33Å; D44-T48 PolarHBondContact O-OG1 2.95Å; F45-T48 PolarHBondContact O-N 3.09Å; T48-R52 WeakPolarHBondContact O-CB 3.34Å; T48-R52 VanDerWaalsContact O-CG 3.28Å; T48-R52 WeakPolarHBondContact O-CG 3.46Å; T48-R52 PolarHBondContact O-N 2.85Å
49V88.3Confident89.8Confident44 Ų4494.1 Ų94.127%0.26746%0.461SS..Hα-helixtrans-62.9-50.2172.8171.80000110.8F45 E47 K51 R52 E53F45-V49 HydrophobicContact CD1-CG2 4.18Å; F45-V49 HydrophobicContact CD2-CG2 4.34Å; F45-V49 HydrophobicContact CE1-CG2 3.77Å; F45-V49 HydrophobicContact CE2-CG2 3.95Å; F45-V49 HydrophobicContact CG-CG2 4.45Å; F45-V49 HydrophobicContact CZ-CG2 3.65Å; F45-V49 VanDerWaalsContact O-CG2 3.29Å; F45-V49 WeakPolarHBondContact O-CG2 3.47Å; F45-V49 PolarHBondContact O-N 3.42Å; E47-V49 VanDerWaalsContact C-N 3.33Å; E47-V49 PolarHBondContact O-N 3.37Å; V49-K51 VanDerWaalsContact C-N 3.33Å; V49-K51 PolarHBondContact O-N 2.84Å; V49-R52 WeakPolarHBondContact O-CB 3.44Å; V49-R52 PolarHBondContact O-N 3.26Å; V49-R52 VanDerWaalsContact O-N 3.09Å; V49-E53 HydrophobicContact CG1-CG 4.32Å; V49-E53 WeakPolarHBondContact O-CG 3.32Å; V49-E53 PolarHBondContact O-N 2.98Å
50K91.4Very high90.5Very high129 Ų12993.9 Ų93.956%0.56146%0.459SS*.Hα-helixtrans-57.7-43178.3-72.4171.2-174.31740112.6S46 E47 E53 L54S46-K50 VanDerWaalsContact O-CG 3.28Å; S46-K50 WeakPolarHBondContact O-CG 3.34Å; S46-K50 PolarHBondContact O-N 2.95Å; S46-K50 VanDerWaalsContact O-N 3.07Å; E47-K50 PolarHBondContact O-N 3.02Å; K50-E53 PolarHBondContact O-N 3.48Å; K50-L54 WeakPolarHBondContact O-CB 3.26Å; K50-L54 PolarHBondContact O-N 3.47Å
51K91.2Very high91.2Very high123 Ų12392.5 Ų92.554%0.53546%0.459SS..Hα-helixtrans-61-45.5175.8-73.5169.1-171.2162.10111E47 V49 L54 V55E47-K51 WeakPolarHBondContact O-CB 3.36Å; E47-K51 VanDerWaalsContact O-CG 3.3Å; E47-K51 WeakPolarHBondContact O-CG 3.38Å; E47-K51 PolarHBondContact O-N 3.28Å; E47-K51 IonicContact OE2-NZ 2.83Å; V49-K51 VanDerWaalsContact C-N 3.33Å; V49-K51 PolarHBondContact O-N 2.84Å; K51-L54 PolarHBondContact O-N 3.38Å; K51-V55 WeakPolarHBondContact O-CG2 3.33Å; K51-V55 PolarHBondContact O-N 2.96Å
52R92.6Very high91.8Very high145 Ų14595.7 Ų95.755%0.54746%0.463SS..Hα-helixtrans-62.1-43.7176.5-74.8173175.4179.80.2111.9T48 V49 L54 V55 N56T48-R52 WeakPolarHBondContact O-CB 3.34Å; T48-R52 VanDerWaalsContact O-CG 3.28Å; T48-R52 WeakPolarHBondContact O-CG 3.46Å; T48-R52 PolarHBondContact O-N 2.85Å; V49-R52 WeakPolarHBondContact O-CB 3.44Å; V49-R52 PolarHBondContact O-N 3.26Å; V49-R52 VanDerWaalsContact O-N 3.09Å; R52-L54 PolarHBondContact O-N 2.89Å; R52-V55 PolarHBondContact O-N 3.38Å; R52-N56 VanDerWaalsContact O-CB 3.28Å; R52-N56 WeakPolarHBondContact O-CB 3.28Å; R52-N56 PolarHBondContact O-N 3.44Å; R52-N56 PolarHBondContact O-ND2 3.08Å
53E96.3Very high92.6Very high116 Ų11696.3 Ų96.354%0.54246%0.46SS..Hα-helixtrans-60.2-44.9177.7-73.5177.216600112.2V49 K50 N56 A57V49-E53 HydrophobicContact CG1-CG 4.32Å; V49-E53 WeakPolarHBondContact O-CG 3.32Å; V49-E53 PolarHBondContact O-N 2.98Å; K50-E53 PolarHBondContact O-N 3.48Å; E53-N56 PolarHBondContact O-N 3.17Å; E53-A57 WeakPolarHBondContact O-CB 3.33Å; E53-A57 PolarHBondContact O-N 3.04Å
54L97.1Very high93.5Very high130 Ų130100.1 Ų100.168%0.68147%0.471SS*.Hα-helixtrans-61.2-48.5177-179.265.9000111.8K50 K51 R52 N56 A57 K58K50-L54 WeakPolarHBondContact O-CB 3.26Å; K50-L54 PolarHBondContact O-N 3.47Å; K51-L54 PolarHBondContact O-N 3.38Å; R52-L54 PolarHBondContact O-N 2.89Å; L54-N56 VanDerWaalsContact C-N 3.34Å; L54-N56 PolarHBondContact O-N 2.75Å; L54-A57 PolarHBondContact O-N 2.93Å; L54-K58 PolarHBondContact O-N 3.05Å
55V96.8Very high94.1Very high93 Ų93100.1 Ų100.156%0.56447%0.471SS*.Hα-helixtrans-61.5-43.7178.1172.50000110.8K51 R52 A57 K58 E59K51-V55 WeakPolarHBondContact O-CG2 3.33Å; K51-V55 PolarHBondContact O-N 2.96Å; R52-V55 PolarHBondContact O-N 3.38Å; V55-A57 PolarHBondContact O-N 3.46Å; V55-K58 WeakPolarHBondContact O-CB 3.48Å; V55-K58 PolarHBondContact O-N 3.21Å; V55-E59 PolarHBondContact O-N 3.06Å
56N98.1Very high94.9Very high84 Ų8499 Ų9945%0.44947%0.469SS..Hα-helixtrans-64.9-39.3177.7-71.5-13.1000112R52 E53 L54 K58 E59 R60R52-N56 VanDerWaalsContact O-CB 3.28Å; R52-N56 WeakPolarHBondContact O-CB 3.28Å; R52-N56 PolarHBondContact O-N 3.44Å; R52-N56 PolarHBondContact O-ND2 3.08Å; E53-N56 PolarHBondContact O-N 3.17Å; L54-N56 VanDerWaalsContact C-N 3.34Å; L54-N56 PolarHBondContact O-N 2.75Å; N56-K58 VanDerWaalsContact C-N 3.34Å; N56-E59 PolarHBondContact O-N 2.86Å; N56-R60 WeakPolarHBondContact O-CB 3.5Å; N56-R60 WeakPolarHBondContact O-CG 3.21Å; N56-R60 PolarHBondContact O-N 2.84Å
57A98.1Very high95.4Very high43 Ų4399.3 Ų99.336%0.35547%0.467SS..Hα-helixtrans-63.1-41.7175.200000111.5E53 L54 V55 R60 L61E53-A57 WeakPolarHBondContact O-CB 3.33Å; E53-A57 PolarHBondContact O-N 3.04Å; L54-A57 PolarHBondContact O-N 2.93Å; V55-A57 PolarHBondContact O-N 3.46Å; A57-R60 PolarHBondContact O-N 3.48Å; A57-L61 PolarHBondContact O-N 3.19Å
58K98.3Very high95.9Very high165 Ų16597.3 Ų97.372%0.71747%0.468SS*.Hα-helixtrans-61.9-46.6175.1-175.1178.1178.51790111.8L54 V55 N56 R60 L61 R62L54-K58 PolarHBondContact O-N 3.05Å; V55-K58 WeakPolarHBondContact O-CB 3.48Å; V55-K58 PolarHBondContact O-N 3.21Å; N56-K58 VanDerWaalsContact C-N 3.34Å; K58-R60 PolarHBondContact O-N 3.43Å; K58-L61 WeakPolarHBondContact O-CB 3.31Å; K58-L61 PolarHBondContact O-N 2.96Å; K58-R62 PolarHBondContact O-N 3.17Å
59E98.3Very high96.4Very high82 Ų82102.2 Ų102.238%0.38349%0.491SS..Hα-helixtrans-66.4-38.6179.1-178.256.3-164.700112V55 N56 L61 R62 I63V55-E59 PolarHBondContact O-N 3.06Å; N56-E59 PolarHBondContact O-N 2.86Å; E59-L61 VanDerWaalsContact C-N 3.3Å; E59-L61 PolarHBondContact O-N 3.34Å; E59-R62 VanDerWaalsContact CD-NE 3.29Å; E59-R62 WeakPolarHBondContact O-CB 3.44Å; E59-R62 PolarHBondContact O-N 2.96Å; E59-R62 IonicContact OE1-CZ 2.88Å; E59-R62 VanDerWaalsContact OE1-CZ 3.28Å; E59-R62 IonicContact OE1-NE 3.98Å; E59-R62 PolarHBondContact OE1-NE 3.38Å; E59-R62 IonicContact OE1-NH2 3.84Å; E59-R62 PolarHBondContact OE1-NH2 2.92Å; E59-R62 WeakPolarHBondContact OE2-CD 3.43Å; E59-R62 IonicContact OE2-CZ 3.7Å; E59-R62 IonicContact OE2-NE 3.28Å; E59-R62 PolarHBondContact OE2-NE 3.17Å; E59-R62 IonicContact OE2-NH2 3.31Å; E59-I63 HydrophobicContact CG-CG1 4.48Å; E59-I63 WeakPolarHBondContact O-CG1 3.4Å; E59-I63 PolarHBondContact O-N 2.96Å
60R98.6Very high96.7Very high149 Ų149101.6 Ų101.656%0.56249%0.485SS*.Hα-helixtrans-58.9-41.1171.8-76.8-172-67.3-98.33.2112N56 A57 K58 R64N56-R60 WeakPolarHBondContact O-CB 3.5Å; N56-R60 WeakPolarHBondContact O-CG 3.21Å; N56-R60 PolarHBondContact O-N 2.84Å; A57-R60 PolarHBondContact O-N 3.48Å; K58-R60 PolarHBondContact O-N 3.43Å; R60-R64 WeakPolarHBondContact O-CB 3.42Å; R60-R64 VanDerWaalsContact O-CG 3.31Å; R60-R64 WeakPolarHBondContact O-CG 3.47Å; R60-R64 PolarHBondContact O-N 2.76Å
61L98.3Very high96.7Very high77 Ų7798 Ų9840%0.40348%0.476SS..Hα-helixtrans-63.5-45.2174.7177.563.2000111.5A57 K58 E59 I63 R64 N65A57-L61 PolarHBondContact O-N 3.19Å; K58-L61 WeakPolarHBondContact O-CB 3.31Å; K58-L61 PolarHBondContact O-N 2.96Å; E59-L61 VanDerWaalsContact C-N 3.3Å; E59-L61 PolarHBondContact O-N 3.34Å; L61-I63 PolarHBondContact O-N 3.42Å; L61-R64 PolarHBondContact O-N 2.89Å; L61-N65 PolarHBondContact O-N 3.11Å
62R98.4Very high96.8Very high133 Ų13398.6 Ų98.650%0.50248%0.475SS..Hα-helixtrans-56.4-48.9177-167.5-166.473.990.2-3.7111.6K58 E59 N65 L66K58-R62 PolarHBondContact O-N 3.17Å; E59-R62 VanDerWaalsContact CD-NE 3.29Å; E59-R62 WeakPolarHBondContact O-CB 3.44Å; E59-R62 PolarHBondContact O-N 2.96Å; E59-R62 IonicContact OE1-CZ 2.88Å; E59-R62 VanDerWaalsContact OE1-CZ 3.28Å; E59-R62 IonicContact OE1-NE 3.98Å; E59-R62 PolarHBondContact OE1-NE 3.38Å; E59-R62 IonicContact OE1-NH2 3.84Å; E59-R62 PolarHBondContact OE1-NH2 2.92Å; E59-R62 WeakPolarHBondContact OE2-CD 3.43Å; E59-R62 IonicContact OE2-CZ 3.7Å; E59-R62 IonicContact OE2-NE 3.28Å; E59-R62 PolarHBondContact OE2-NE 3.17Å; E59-R62 IonicContact OE2-NH2 3.31Å; R62-N65 PolarHBondContact O-N 2.88Å; R62-L66 PolarHBondContact O-N 3.31Å
63I98.3Very high96.9Very high58 Ų5894.1 Ų94.130%0.29746%0.462SS..Hα-helixtrans-66.1-37.3178.8-65.3-63000111.8E59 L61 L66 N67E59-I63 HydrophobicContact CG-CG1 4.48Å; E59-I63 WeakPolarHBondContact O-CG1 3.4Å; E59-I63 PolarHBondContact O-N 2.96Å; L61-I63 PolarHBondContact O-N 3.42Å; I63-L66 HydrophobicContact CD1-CD2 4.46Å; I63-L66 PolarHBondContact O-N 2.8Å; I63-N67 WeakPolarHBondContact O-CB 3.41Å; I63-N67 VanDerWaalsContact O-CG 3.23Å; I63-N67 PolarHBondContact O-N 3.32Å; I63-N67 PolarHBondContact O-ND2 3.41Å
64R98.1Very high96.6Very high157 Ų15792.3 Ų92.359%0.59245%0.452SS*.Hα-helixtrans-60.2-47.4173.3-79.9-171.5-64143.4-5.6111.8R60 L61 L66 N67 A68R60-R64 WeakPolarHBondContact O-CB 3.42Å; R60-R64 VanDerWaalsContact O-CG 3.31Å; R60-R64 WeakPolarHBondContact O-CG 3.47Å; R60-R64 PolarHBondContact O-N 2.76Å; L61-R64 PolarHBondContact O-N 2.89Å; R64-L66 VanDerWaalsContact C-N 3.35Å; R64-L66 PolarHBondContact O-N 2.99Å; R64-N67 PolarHBondContact O-N 3.06Å; R64-A68 PolarHBondContact O-N 2.92Å
65N97.9Very high96.3Very high96 Ų9695.8 Ų95.851%0.51346%0.456SS..Hα-helixtrans-61.1-44.3177.7-70.2-10.4000111.4L61 R62 N67 A68 M69L61-N65 PolarHBondContact O-N 3.11Å; R62-N65 PolarHBondContact O-N 2.88Å; N65-N67 PolarHBondContact O-N 3.16Å; N65-A68 WeakPolarHBondContact O-CB 3.42Å; N65-A68 PolarHBondContact O-N 2.93Å; N65-M69 WeakPolarHBondContact O-CG 3.47Å; N65-M69 PolarHBondContact O-N 3.25Å
66L97.8Very high96Very high82 Ų8296.7 Ų96.743%0.42946%0.456SS..Hα-helixtrans-58.3-47.4174.9178.463.9000111.8R62 I63 R64 A68 M69 F70R62-L66 PolarHBondContact O-N 3.31Å; I63-L66 HydrophobicContact CD1-CD2 4.46Å; I63-L66 PolarHBondContact O-N 2.8Å; R64-L66 VanDerWaalsContact C-N 3.35Å; R64-L66 PolarHBondContact O-N 2.99Å; L66-A68 VanDerWaalsContact C-N 3.3Å; L66-A68 PolarHBondContact O-N 3.49Å; L66-M69 PolarHBondContact O-N 2.91Å; L66-F70 WeakPolarHBondContact O-CB 3.41Å; L66-F70 PolarHBondContact O-N 2.82Å
67N96.5Very high95.6Very high61 Ų6193 Ų9333%0.32644%0.436SS..Hα-helixtrans-67.1-30.3179.8-70.4-26000112.5I63 R64 N65 F70 S71 K88I63-N67 WeakPolarHBondContact O-CB 3.41Å; I63-N67 VanDerWaalsContact O-CG 3.23Å; I63-N67 PolarHBondContact O-N 3.32Å; I63-N67 PolarHBondContact O-ND2 3.41Å; R64-N67 PolarHBondContact O-N 3.06Å; N65-N67 PolarHBondContact O-N 3.16Å; N67-F70 PolarHBondContact O-N 3.43Å; N67-S71 WeakPolarHBondContact O-CB 3.4Å; N67-S71 PolarHBondContact O-N 2.97Å; N67-S71 PolarHBondContact O-OG 3.47Å; N67-K88 PolarHBondContact OD1-NZ 3.24Å
68A96.4Very high94.7Very high60 Ų6094.9 Ų94.950%0.49644%0.444SS..Hα-helixtrans-65.7-47.6173.100000111.3R64 N65 L66 F70 S71 R72R64-A68 PolarHBondContact O-N 2.92Å; N65-A68 WeakPolarHBondContact O-CB 3.42Å; N65-A68 PolarHBondContact O-N 2.93Å; L66-A68 VanDerWaalsContact C-N 3.3Å; L66-A68 PolarHBondContact O-N 3.49Å; A68-F70 VanDerWaalsContact C-N 3.3Å; A68-F70 PolarHBondContact O-N 2.91Å; A68-S71 PolarHBondContact O-N 3.29Å; A68-S71 VanDerWaalsContact O-N 3.16Å; A68-R72 PolarHBondContact O-N 3.27Å
69M96.9Very high93.2Very high120 Ų12092.5 Ų92.559%0.59144%0.439SS*.Hα-helixtrans-61.3-40.6174.4-65.5-56.6-7100111.7N65 L66 S71 R72 L73N65-M69 WeakPolarHBondContact O-CG 3.47Å; N65-M69 PolarHBondContact O-N 3.25Å; L66-M69 PolarHBondContact O-N 2.91Å; M69-S71 VanDerWaalsContact C-N 3.31Å; M69-S71 PolarHBondContact O-N 3.45Å; M69-R72 WeakPolarHBondContact O-CB 3.48Å; M69-R72 PolarHBondContact O-N 3.4Å; M69-L73 PolarHBondContact O-N 2.73Å
70F95.5Very high91.8Very high30 Ų3091.1 Ų91.113%0.13243%0.433CS..Hα-helixtrans-62.7-37.9175.4-158.4-91.9000112.6L66 N67 A68 R72 L73 K74 K88 T91 L92L66-F70 WeakPolarHBondContact O-CB 3.41Å; L66-F70 PolarHBondContact O-N 2.82Å; N67-F70 PolarHBondContact O-N 3.43Å; A68-F70 VanDerWaalsContact C-N 3.3Å; A68-F70 PolarHBondContact O-N 2.91Å; F70-R72 VanDerWaalsContact C-N 3.35Å; F70-L73 WeakPolarHBondContact O-CB 3.37Å; F70-L73 PolarHBondContact O-N 2.83Å; F70-K74 HydrophobicContact CD1-CD 4.3Å; F70-K74 HydrophobicContact CD1-CG 4.33Å; F70-K74 HydrophobicContact CE1-CD 4.17Å; F70-K74 HydrophobicContact CE1-CG 4.14Å; F70-K74 PolarHBondContact O-N 2.98Å; F70-K88 HydrophobicContact CD1-CG 4.46Å; F70-K88 HydrophobicContact CE1-CB 4.27Å; F70-K88 HydrophobicContact CE1-CG 3.97Å; F70-K88 HydrophobicContact CE2-CB 4.19Å; F70-K88 HydrophobicContact CE2-CG 4.33Å; F70-K88 HydrophobicContact CZ-CB 3.77Å; F70-K88 HydrophobicContact CZ-CG 3.92Å; F70-K88 VanDerWaalsContact CZ-O 3.27Å; F70-K88 WeakPolarHBondContact CZ-O 3.5Å; F70-T91 HydrophobicContact CE1-CG2 4.08Å; F70-T91 HydrophobicContact CZ-CG2 3.91Å; F70-L92 HydrophobicContact CE2-CD2 4.18Å; F70-L92 HydrophobicContact CE2-CG 4.1Å
71S92.3Very high90.4Very high55 Ų5593 Ų9339%0.38544%0.44SS..Hα-helixtrans-70.3-32.5175.9-590000112.2N67 A68 M69 R75N67-S71 WeakPolarHBondContact O-CB 3.4Å; N67-S71 PolarHBondContact O-N 2.97Å; N67-S71 PolarHBondContact O-OG 3.47Å; A68-S71 PolarHBondContact O-N 3.29Å; A68-S71 VanDerWaalsContact O-N 3.16Å; M69-S71 VanDerWaalsContact C-N 3.31Å; M69-S71 PolarHBondContact O-N 3.45Å; S71-R75 PolarHBondContact O-N 3.02Å
72R93.3Very high88.6Confident135 Ų13595.8 Ų95.851%0.50946%0.463SS..Hα-helixtrans-64-45.6169.7-174.5173.7-178.7-108.62.1111.1A68 M69 F70 K74 R75 M76A68-R72 PolarHBondContact O-N 3.27Å; M69-R72 WeakPolarHBondContact O-CB 3.48Å; M69-R72 PolarHBondContact O-N 3.4Å; F70-R72 VanDerWaalsContact C-N 3.35Å; R72-K74 PolarHBondContact O-N 3.37Å; R72-R75 PolarHBondContact O-N 2.91Å; R72-R75 VanDerWaalsContact O-N 3.15Å; R72-M76 HydrophobicContact CG-SD 4.5Å; R72-M76 PolarHBondContact O-N 3Å
73L93.8Very high87.1Confident51 Ų5195.8 Ų95.827%0.26747%0.473SS..Hα-helixtrans-56.5-49.2176-178.563.4000111.6M69 F70 R75 M76 V77 T91 L92 A95M69-L73 PolarHBondContact O-N 2.73Å; F70-L73 WeakPolarHBondContact O-CB 3.37Å; F70-L73 PolarHBondContact O-N 2.83Å; L73-R75 PolarHBondContact O-N 3.23Å; L73-R75 VanDerWaalsContact O-N 3.13Å; L73-M76 PolarHBondContact O-N 3.15Å; L73-V77 HydrophobicContact CD1-CG2 4.28Å; L73-V77 HydrophobicContact CG-CG2 4.45Å; L73-V77 WeakPolarHBondContact O-CG2 2.98Å; L73-V77 PolarHBondContact O-N 3.09Å; L73-T91 HydrophobicContact CD2-CG2 4.06Å; L73-T91 HydrophobicContact CG-CG2 4.05Å; L73-L92 HydrophobicContact CD2-CD2 3.94Å; L73-A95 HydrophobicContact CD1-CB 3.87Å; L73-A95 HydrophobicContact CD2-CB 4.32Å; L73-A95 HydrophobicContact CG-CB 4.36Å
74K91Very high85.8Confident77 Ų77100.2 Ų100.234%0.33549%0.486SS..Hα-helixtrans-54.1-34.6177.3-75.6-173.5-64.8175.60114F70 R72 P86 T91F70-K74 HydrophobicContact CD1-CD 4.3Å; F70-K74 HydrophobicContact CD1-CG 4.33Å; F70-K74 HydrophobicContact CE1-CD 4.17Å; F70-K74 HydrophobicContact CE1-CG 4.14Å; F70-K74 PolarHBondContact O-N 2.98Å; R72-K74 PolarHBondContact O-N 3.37Å; K74-P86 HydrophobicContact CD-CG 3.89Å; K74-P86 HydrophobicContact CG-CG 4.33Å; K74-T91 HydrophobicContact CB-CG2 4.38Å; K74-T91 HydrophobicContact CG-CG2 3.5Å; K74-T91 VanDerWaalsContact CG-CG2 3.5Å
75R89.4Confident84.8Confident203 Ų203102.4 Ų102.477%0.76650%0.5SS*.Hα-helixtrans-74.6-26178.2-71.7-171.5-64.5140.2-3.2113.2S71 R72 L73S71-R75 PolarHBondContact O-N 3.02Å; R72-R75 PolarHBondContact O-N 2.91Å; R72-R75 VanDerWaalsContact O-N 3.15Å; L73-R75 PolarHBondContact O-N 3.23Å; L73-R75 VanDerWaalsContact O-N 3.13Å
76M91.3Very high83.9Confident113 Ų11399.1 Ų99.156%0.55748%0.483SS*.Hα-helixtrans-83.9-23.7-179-67.2-179.56800112.8R72 L73 P78R72-M76 HydrophobicContact CG-SD 4.5Å; R72-M76 PolarHBondContact O-N 3Å; L73-M76 PolarHBondContact O-N 3.15Å; M76-P78 VanDerWaalsContact O-CD 3.28Å; M76-P78 WeakPolarHBondContact O-CD 3.32Å
77V89.4Confident83.5Confident7 Ų797.7 Ų97.74%0.04248%0.48CS..  trans-82.8112.6-177.3179.20000110.2L73 L79 M80 A94 A95L73-V77 HydrophobicContact CD1-CG2 4.28Å; L73-V77 HydrophobicContact CG-CG2 4.45Å; L73-V77 WeakPolarHBondContact O-CG2 2.98Å; L73-V77 PolarHBondContact O-N 3.09Å; V77-L79 VanDerWaalsContact C-N 3.33Å; V77-L79 PolarHBondContact O-N 3.08Å; V77-M80 HydrophobicContact CB-CG 4.13Å; V77-M80 HydrophobicContact CG1-CG 3.9Å; V77-A94 HydrophobicContact CG1-CB 3.63Å; V77-A95 HydrophobicContact CG2-CB 3.79Å
78P79.3Confident83.3Confident81 Ų81100.1 Ų100.153%0.52649%0.488SS..THydrogen-bonded Turntrans-73.7-15.5-167.9-19.533.3000116M76 M80 Y98M76-P78 VanDerWaalsContact O-CD 3.28Å; M76-P78 WeakPolarHBondContact O-CD 3.32Å; P78-M80 VanDerWaalsContact C-N 3.35Å; P78-Y98 HydrophobicContact CG-CD1 4.34Å; P78-Y98 HydrophobicContact CG-CD2 4Å; P78-Y98 HydrophobicContact CG-CE1 3.83Å; P78-Y98 HydrophobicContact CG-CE2 3.49Å; P78-Y98 VanDerWaalsContact CG-CE2 3.49Å; P78-Y98 HydrophobicContact CG-CG 4.41Å
79L67Low83Confident115 Ų115101.2 Ų101.260%0.60249%0.488SS*.THydrogen-bonded Turntrans-92.36.5-171.5-59.7175000113.7V77 R81V77-L79 VanDerWaalsContact C-N 3.33Å; V77-L79 PolarHBondContact O-N 3.08Å; L79-R81 PolarHBondContact O-N 3.04Å
80M69.3Low82.6Confident53 Ų5398.4 Ų98.426%0.26148%0.476SS..  trans-89.8110.5-175.8-59.3-94.365.700109.6V77 P78 P86V77-M80 HydrophobicContact CB-CG 4.13Å; V77-M80 HydrophobicContact CG1-CG 3.9Å; P78-M80 VanDerWaalsContact C-N 3.35Å; M80-P86 HydrophobicContact CE-CB 3.57Å; M80-P86 HydrophobicContact CE-CG 4.2Å; M80-P86 HydrophobicContact SD-CB 3.33Å; M80-P86 WeakPolarHBondContact SD-CB 3.25Å; M80-P86 HydrophobicContact SD-CG 3.42Å; M80-P86 WeakPolarHBondContact SD-CG 3.28Å
81R68.1Low82.4Confident188 Ų18897 Ų9771%0.70947%0.469SS*.  trans-51.7121169.5-94.7-172.5164.9153.1-2.4110.4L79 D83 R84L79-R81 PolarHBondContact O-N 3.04Å; R81-D83 WeakPolarHBondContact CB-OD1 3.42Å; R81-D83 PolarHBondContact O-N 3.11Å; R81-R84 HydrophobicContact CB-CB 4.17Å; R81-R84 PolarHBondContact O-N 3.13Å; R81-R84 VanDerWaalsContact O-N 3.13Å; R81-R84 VanDerWaalsContact O-O 3.13Å
82P60.3Low82.4Confident136 Ų13698.5 Ų98.588%0.88347%0.473SS*.THydrogen-bonded Turntrans-66-20.1-172.723.1-31.5000113.8
83D67.2Low82.2Confident133 Ų13396.5 Ų96.571%0.71147%0.468SS*.THydrogen-bonded Turntrans-86.4-21177.660.1-42.1000113.7R81R81-D83 WeakPolarHBondContact CB-OD1 3.42Å; R81-D83 PolarHBondContact O-N 3.11Å
84R70.8Confident81.9Confident152 Ų15294.9 Ų94.957%0.57446%0.462SS*.SBendtrans-94132.8175.7-168.6174176.5-177.6-0.9109.3R81 P86 E130R81-R84 HydrophobicContact CB-CB 4.17Å; R81-R84 PolarHBondContact O-N 3.13Å; R81-R84 VanDerWaalsContact O-N 3.13Å; R81-R84 VanDerWaalsContact O-O 3.13Å; R84-P86 WeakPolarHBondContact O-CD 3.33Å; R84-E130 IonicContact NH1-OE1 2.73Å
85K77.4Confident81.9Confident203 Ų20391.7 Ų91.788%0.88345%0.45SS*.  trans-8497.7170-68.3178.9-176.7173.40108.4
86P79.1Confident82Confident26 Ų2684.4 Ų84.417%0.16943%0.428CS..  trans-63.5143.5-179.730.2-39000110.4K74 M80 R84 D90K74-P86 HydrophobicContact CD-CG 3.89Å; K74-P86 HydrophobicContact CG-CG 4.33Å; M80-P86 HydrophobicContact CE-CB 3.57Å; M80-P86 HydrophobicContact CE-CG 4.2Å; M80-P86 HydrophobicContact SD-CB 3.33Å; M80-P86 WeakPolarHBondContact SD-CB 3.25Å; M80-P86 HydrophobicContact SD-CG 3.42Å; M80-P86 WeakPolarHBondContact SD-CG 3.28Å; R84-P86 WeakPolarHBondContact O-CD 3.33Å; P86-D90 HydrophobicContact CB-CB 4.48Å
87S89.1Confident81.7Confident52 Ų5282.1 Ų82.136%0.36442%0.416SS..  trans-67.8167174.681.20000110.7V89 D90 T91S87-V89 PolarHBondContact O-N 3.36Å; S87-V89 PolarHBondContact OG-N 2.94Å; S87-D90 VanDerWaalsContact CB-OD2 3.25Å; S87-D90 WeakPolarHBondContact CB-OD2 3.47Å; S87-D90 PolarHBondContact N-OD2 3.15Å; S87-D90 PolarHBondContact O-N 3.45Å; S87-D90 PolarHBondContact OG-N 3.41Å; S87-D90 VanDerWaalsContact OG-N 3.12Å; S87-D90 PolarHBondContact OG-OD1 3.42Å; S87-D90 PolarHBondContact OG-OD2 3.13Å; S87-T91 PolarHBondContact O-N 3.03Å; S87-T91 VanDerWaalsContact O-N 3.1Å; S87-T91 PolarHBondContact O-OG1 3.45Å
88K92.1Very high81.8Confident113 Ų11385.1 Ų85.149%0.49143%0.427SS..Hα-helixtrans-60.8-38.1176.7-69.6-169.1-179-1730111.8N67 F70 L92N67-K88 PolarHBondContact OD1-NZ 3.24Å; F70-K88 HydrophobicContact CD1-CG 4.46Å; F70-K88 HydrophobicContact CE1-CB 4.27Å; F70-K88 HydrophobicContact CE1-CG 3.97Å; F70-K88 HydrophobicContact CE2-CB 4.19Å; F70-K88 HydrophobicContact CE2-CG 4.33Å; F70-K88 HydrophobicContact CZ-CB 3.77Å; F70-K88 HydrophobicContact CZ-CG 3.92Å; F70-K88 VanDerWaalsContact CZ-O 3.27Å; F70-K88 WeakPolarHBondContact CZ-O 3.5Å; K88-L92 VanDerWaalsContact O-CG 3.31Å; K88-L92 WeakPolarHBondContact O-CG 3.31Å; K88-L92 PolarHBondContact O-N 3.33Å
89V91.4Very high82.4Confident82 Ų8286.1 Ų86.150%0.49743%0.427SS..Hα-helixtrans-70-44179.91770000110.5S87 T91 L92 K93S87-V89 PolarHBondContact O-N 3.36Å; S87-V89 PolarHBondContact OG-N 2.94Å; V89-T91 VanDerWaalsContact C-N 3.34Å; V89-T91 PolarHBondContact O-N 3.18Å; V89-L92 PolarHBondContact O-N 3.32Å; V89-K93 HydrophobicContact CG1-CD 4.27Å; V89-K93 WeakPolarHBondContact O-CG 3.27Å; V89-K93 PolarHBondContact O-N 3.18Å
90D87.4Confident83.3Confident61 Ų6185.1 Ų85.133%0.32642%0.415SS..Hα-helixtrans-65-39.7-177.4-55.9-32.5000111.8P86 S87 L92 K93 A94P86-D90 HydrophobicContact CB-CB 4.48Å; S87-D90 VanDerWaalsContact CB-OD2 3.25Å; S87-D90 WeakPolarHBondContact CB-OD2 3.47Å; S87-D90 PolarHBondContact N-OD2 3.15Å; S87-D90 PolarHBondContact O-N 3.45Å; S87-D90 PolarHBondContact OG-N 3.41Å; S87-D90 VanDerWaalsContact OG-N 3.12Å; S87-D90 PolarHBondContact OG-OD1 3.42Å; S87-D90 PolarHBondContact OG-OD2 3.13Å; D90-L92 VanDerWaalsContact C-N 3.31Å; D90-L92 PolarHBondContact O-N 3.04Å; D90-K93 PolarHBondContact O-N 3.48Å; D90-A94 WeakPolarHBondContact O-CB 3.34Å; D90-A94 PolarHBondContact O-N 3.08Å
91T90.9Very high84.1Confident0 Ų085.1 Ų85.10%042%0.416CS..Hα-helixtrans-63.3-40.2176.6-49.40000111F70 L73 K74 S87 V89 A95F70-T91 HydrophobicContact CE1-CG2 4.08Å; F70-T91 HydrophobicContact CZ-CG2 3.91Å; L73-T91 HydrophobicContact CD2-CG2 4.06Å; L73-T91 HydrophobicContact CG-CG2 4.05Å; K74-T91 HydrophobicContact CB-CG2 4.38Å; K74-T91 HydrophobicContact CG-CG2 3.5Å; K74-T91 VanDerWaalsContact CG-CG2 3.5Å; S87-T91 PolarHBondContact O-N 3.03Å; S87-T91 VanDerWaalsContact O-N 3.1Å; S87-T91 PolarHBondContact O-OG1 3.45Å; V89-T91 VanDerWaalsContact C-N 3.34Å; V89-T91 PolarHBondContact O-N 3.18Å; T91-A95 WeakPolarHBondContact O-CB 3.5Å; T91-A95 PolarHBondContact O-N 2.94Å
92L94Very high85.1Confident88 Ų8879.8 Ų79.846%0.46140%0.401SS..Hα-helixtrans-66.6-43.9178.1-69.1172.8000111.2F70 L73 K88 V89 D90 A95 T96F70-L92 HydrophobicContact CE2-CD2 4.18Å; F70-L92 HydrophobicContact CE2-CG 4.1Å; L73-L92 HydrophobicContact CD2-CD2 3.94Å; K88-L92 VanDerWaalsContact O-CG 3.31Å; K88-L92 WeakPolarHBondContact O-CG 3.31Å; K88-L92 PolarHBondContact O-N 3.33Å; V89-L92 PolarHBondContact O-N 3.32Å; D90-L92 VanDerWaalsContact C-N 3.31Å; D90-L92 PolarHBondContact O-N 3.04Å; L92-A95 PolarHBondContact O-N 3.1Å; L92-T96 PolarHBondContact O-N 3.42Å; L92-T96 PolarHBondContact O-OG1 3.33Å
93K87.8Confident86.4Confident92 Ų9277.4 Ų77.440%0.438%0.381SS..Hα-helixtrans-56.1-52.8173.5-75178.1172.8-174.70111.6V89 D90 A95 T96 E97 W137V89-K93 HydrophobicContact CG1-CD 4.27Å; V89-K93 WeakPolarHBondContact O-CG 3.27Å; V89-K93 PolarHBondContact O-N 3.18Å; D90-K93 PolarHBondContact O-N 3.48Å; K93-A95 VanDerWaalsContact C-N 3.27Å; K93-A95 PolarHBondContact O-N 3.35Å; K93-T96 PolarHBondContact O-N 3.25Å; K93-E97 PolarHBondContact O-N 2.95Å; K93-W137 HydrophobicContact CD-CZ2 4.29Å; K93-W137 HydrophobicContact CG-CH2 4.25Å; K93-W137 HydrophobicContact CG-CZ2 3.44Å; K93-W137 VanDerWaalsContact CG-CZ2 3.44Å
94A86.8Confident87Confident17 Ų1771.8 Ų71.814%0.1435%0.352CS..Hα-helixtrans-63.8-33.1-178.400000112.4V77 D90 Y98V77-A94 HydrophobicContact CG1-CB 3.63Å; D90-A94 WeakPolarHBondContact O-CB 3.34Å; D90-A94 PolarHBondContact O-N 3.08Å; A94-Y98 VanDerWaalsContact O-CB 3.26Å; A94-Y98 WeakPolarHBondContact O-CB 3.26Å; A94-Y98 PolarHBondContact O-N 3.29Å
95A92.7Very high87.7Confident11 Ų1167.4 Ų67.49%0.09134%0.342CS..Hα-helixtrans-66.4-44173.600000112.4L73 V77 T91 L92 K93 Y98 I99L73-A95 HydrophobicContact CD1-CB 3.87Å; L73-A95 HydrophobicContact CD2-CB 4.32Å; L73-A95 HydrophobicContact CG-CB 4.36Å; V77-A95 HydrophobicContact CG2-CB 3.79Å; T91-A95 WeakPolarHBondContact O-CB 3.5Å; T91-A95 PolarHBondContact O-N 2.94Å; L92-A95 PolarHBondContact O-N 3.1Å; K93-A95 VanDerWaalsContact C-N 3.27Å; K93-A95 PolarHBondContact O-N 3.35Å; A95-Y98 PolarHBondContact O-N 2.63Å; A95-I99 WeakPolarHBondContact O-CG1 3.34Å; A95-I99 PolarHBondContact O-N 3.36Å
96T89.9Confident88.1Confident50 Ų5062.3 Ų62.331%0.30732%0.324SS..Hα-helixtrans-60.7-47.4176.5-58.80000111.3L92 K93 Y98 I99 R100L92-T96 PolarHBondContact O-N 3.42Å; L92-T96 PolarHBondContact O-OG1 3.33Å; K93-T96 PolarHBondContact O-N 3.25Å; T96-Y98 VanDerWaalsContact C-N 3.28Å; T96-Y98 PolarHBondContact O-N 3.41Å; T96-I99 PolarHBondContact O-N 2.9Å; T96-R100 WeakPolarHBondContact O-CG 3.38Å; T96-R100 PolarHBondContact O-N 3.37Å
97E86.3Confident88.2Confident65 Ų6568.6 Ų68.630%0.30435%0.345SS..Hα-helixtrans-62-38.2176.3-67.8-49.713000112K93 I99 R100 L101K93-E97 PolarHBondContact O-N 2.95Å; E97-I99 PolarHBondContact O-N 3.33Å; E97-R100 PolarHBondContact O-N 3.33Å; E97-R100 IonicContact OE1-CZ 3.77Å; E97-R100 IonicContact OE1-NH1 2.7Å; E97-R100 PolarHBondContact OE1-NH1 3.41Å; E97-L101 WeakPolarHBondContact O-CB 3.43Å; E97-L101 PolarHBondContact O-N 3.49Å
98Y91.1Very high87.5Confident69 Ų6968.9 Ų68.927%0.27134%0.342SS..Hα-helixtrans-65.3-39.9177.2-174.8-130.6000112.5P78 A94 A95 T96 L101 L102P78-Y98 HydrophobicContact CG-CD1 4.34Å; P78-Y98 HydrophobicContact CG-CD2 4Å; P78-Y98 HydrophobicContact CG-CE1 3.83Å; P78-Y98 HydrophobicContact CG-CE2 3.49Å; P78-Y98 VanDerWaalsContact CG-CE2 3.49Å; P78-Y98 HydrophobicContact CG-CG 4.41Å; A94-Y98 VanDerWaalsContact O-CB 3.26Å; A94-Y98 WeakPolarHBondContact O-CB 3.26Å; A94-Y98 PolarHBondContact O-N 3.29Å; A95-Y98 PolarHBondContact O-N 2.63Å; T96-Y98 VanDerWaalsContact C-N 3.28Å; T96-Y98 PolarHBondContact O-N 3.41Å; Y98-L101 HydrophobicContact CD2-CD2 4.27Å; Y98-L101 PolarHBondContact O-N 3.45Å; Y98-L102 HydrophobicContact CD1-CD1 4.2Å; Y98-L102 HydrophobicContact CD2-CG 4.28Å; Y98-L102 HydrophobicContact CE1-CD1 3.76Å; Y98-L102 HydrophobicContact CE1-CG 4.46Å; Y98-L102 HydrophobicContact CE2-CD1 4.08Å; Y98-L102 HydrophobicContact CE2-CD2 3.92Å; Y98-L102 HydrophobicContact CE2-CG 3.88Å; Y98-L102 WeakPolarHBondContact O-CG 3.33Å; Y98-L102 PolarHBondContact O-N 3.18Å
99I91.7Very high86.4Confident103 Ų10368.4 Ų68.453%0.52835%0.349SS..Hα-helixtrans-62-46.5173.9-66.9164.8000110.5A95 T96 E97 L101 L102 L103A95-I99 WeakPolarHBondContact O-CG1 3.34Å; A95-I99 PolarHBondContact O-N 3.36Å; T96-I99 PolarHBondContact O-N 2.9Å; E97-I99 PolarHBondContact O-N 3.33Å; I99-L101 VanDerWaalsContact C-N 3.32Å; I99-L101 PolarHBondContact O-N 3.44Å; I99-L102 PolarHBondContact O-N 3.05Å; I99-L103 HydrophobicContact CG2-CD1 4.09Å; I99-L103 HydrophobicContact CG2-CG 4.44Å; I99-L103 WeakPolarHBondContact O-CG 3.33Å; I99-L103 PolarHBondContact O-N 3.31Å
100R86.7Confident85.3Confident94 Ų9471.4 Ų71.436%0.35536%0.357SS..Hα-helixtrans-58-44.3177.6-71.4172.3174170.8-9.5111.9T96 E97 L103 A104T96-R100 WeakPolarHBondContact O-CG 3.38Å; T96-R100 PolarHBondContact O-N 3.37Å; E97-R100 PolarHBondContact O-N 3.33Å; E97-R100 IonicContact OE1-CZ 3.77Å; E97-R100 IonicContact OE1-NH1 2.7Å; E97-R100 PolarHBondContact OE1-NH1 3.41Å; R100-L103 PolarHBondContact O-N 2.94Å; R100-A104 PolarHBondContact O-N 2.95Å
101L85.7Confident84.1Confident53 Ų5373.6 Ų73.628%0.27737%0.369SS..Hα-helixtrans-58.7-49.8176.2179.870000111.6E97 Y98 I99 L103 A104 V105 L120E97-L101 WeakPolarHBondContact O-CB 3.43Å; E97-L101 PolarHBondContact O-N 3.49Å; Y98-L101 HydrophobicContact CD2-CD2 4.27Å; Y98-L101 PolarHBondContact O-N 3.45Å; I99-L101 VanDerWaalsContact C-N 3.32Å; I99-L101 PolarHBondContact O-N 3.44Å; L101-L103 VanDerWaalsContact C-N 3.32Å; L101-L103 PolarHBondContact O-N 3.12Å; L101-A104 PolarHBondContact O-N 2.96Å; L101-V105 WeakPolarHBondContact O-CG2 3.38Å; L101-V105 PolarHBondContact O-N 3.18Å; L101-L120 HydrophobicContact CD1-CD2 3.32Å
102L88.4Confident82.5Confident75 Ų7581.3 Ų81.339%0.39341%0.411SS..Hα-helixtrans-62.3-39.9-179.9-69.4176.8000111.8Y98 I99 V105 L106Y98-L102 HydrophobicContact CD1-CD1 4.2Å; Y98-L102 HydrophobicContact CD2-CG 4.28Å; Y98-L102 HydrophobicContact CE1-CD1 3.76Å; Y98-L102 HydrophobicContact CE1-CG 4.46Å; Y98-L102 HydrophobicContact CE2-CD1 4.08Å; Y98-L102 HydrophobicContact CE2-CD2 3.92Å; Y98-L102 HydrophobicContact CE2-CG 3.88Å; Y98-L102 WeakPolarHBondContact O-CG 3.33Å; Y98-L102 PolarHBondContact O-N 3.18Å; I99-L102 PolarHBondContact O-N 3.05Å; L102-V105 PolarHBondContact O-N 3.33Å; L102-L106 WeakPolarHBondContact O-CG 3.38Å; L102-L106 PolarHBondContact O-N 3.49Å
103L87.7Confident80.7Confident87 Ų8783.6 Ų83.646%0.45542%0.423SS..Hα-helixtrans-63.2-40.8175.4-70.7173.4000112.2I99 R100 L101 L106 R107I99-L103 HydrophobicContact CG2-CD1 4.09Å; I99-L103 HydrophobicContact CG2-CG 4.44Å; I99-L103 WeakPolarHBondContact O-CG 3.33Å; I99-L103 PolarHBondContact O-N 3.31Å; R100-L103 PolarHBondContact O-N 2.94Å; L101-L103 VanDerWaalsContact C-N 3.32Å; L101-L103 PolarHBondContact O-N 3.12Å; L103-L106 PolarHBondContact O-N 2.91Å; L103-R107 WeakPolarHBondContact O-CG 3.36Å; L103-R107 PolarHBondContact O-N 3.01Å; L103-R107 VanDerWaalsContact O-N 3.11Å
104A80.6Confident79.1Confident14 Ų1483.1 Ų83.112%0.11644%0.444CS..Hα-helixtrans-63.9-45.9175.800000111.5R100 L101 L106 R107 D108 F119R100-A104 PolarHBondContact O-N 2.95Å; L101-A104 PolarHBondContact O-N 2.96Å; A104-L106 VanDerWaalsContact C-N 3.29Å; A104-L106 PolarHBondContact O-N 3.03Å; A104-R107 PolarHBondContact O-N 3.17Å; A104-R107 VanDerWaalsContact O-N 3.17Å; A104-D108 PolarHBondContact O-N 2.97Å; A104-F119 HydrophobicContact CB-CD1 3.96Å; A104-F119 HydrophobicContact CB-CE1 3.92Å
105V84.8Confident77.6Confident60 Ų6089.2 Ų89.236%0.36447%0.471SS..Hα-helixtrans-57.4-42.7176.2171.40000111.3L101 L102 D108 T109 L120L101-V105 WeakPolarHBondContact O-CG2 3.38Å; L101-V105 PolarHBondContact O-N 3.18Å; L102-V105 PolarHBondContact O-N 3.33Å; V105-D108 PolarHBondContact O-N 3.4Å; V105-T109 VanDerWaalsContact O-CG2 3.3Å; V105-T109 WeakPolarHBondContact O-CG2 3.15Å; V105-T109 PolarHBondContact O-N 3.24Å; V105-T109 VanDerWaalsContact O-N 3.07Å; V105-T109 PolarHBondContact O-OG1 3.3Å; V105-L120 HydrophobicContact CG2-CD2 4.07Å
106L86.3Confident75.8Confident96 Ų9689.3 Ų89.350%0.50347%0.473SS..Hα-helixtrans-62.6-45.7177.2-70.5171.4000111.9L102 L103 A104 D108 T109 E110L102-L106 WeakPolarHBondContact O-CG 3.38Å; L102-L106 PolarHBondContact O-N 3.49Å; L103-L106 PolarHBondContact O-N 2.91Å; A104-L106 VanDerWaalsContact C-N 3.29Å; A104-L106 PolarHBondContact O-N 3.03Å; L106-D108 PolarHBondContact O-N 2.7Å; L106-T109 PolarHBondContact O-N 3.41Å; L106-T109 VanDerWaalsContact O-N 3.14Å; L106-T109 PolarHBondContact O-OG1 2.97Å; L106-E110 WeakPolarHBondContact O-CG 3.45Å; L106-E110 PolarHBondContact O-N 3.22Å
107R80.6Confident74.1Confident158 Ų15891.1 Ų91.160%0.59649%0.485SS*.Hα-helixtrans-62.8-39.9177.6-68.1174.1-172.5-1630.4113L103 A104 T109 E110 N111L103-R107 WeakPolarHBondContact O-CG 3.36Å; L103-R107 PolarHBondContact O-N 3.01Å; L103-R107 VanDerWaalsContact O-N 3.11Å; A104-R107 PolarHBondContact O-N 3.17Å; A104-R107 VanDerWaalsContact O-N 3.17Å; R107-T109 VanDerWaalsContact C-N 3.26Å; R107-T109 PolarHBondContact O-N 3.39Å; R107-E110 PolarHBondContact O-N 3.43Å; R107-N111 PolarHBondContact O-N 3.33Å
108D73.7Confident72.9Confident59 Ų5992 Ų9232%0.31649%0.491SS..Hα-helixtrans-67.1-29.2176.8-70.5-14.8000111.8A104 V105 L106 E110 N111 G116A104-D108 PolarHBondContact O-N 2.97Å; V105-D108 PolarHBondContact O-N 3.4Å; L106-D108 PolarHBondContact O-N 2.7Å; D108-E110 VanDerWaalsContact C-N 3.32Å; D108-N111 CarbonylContact O-C 3.56Å; D108-G116 VanDerWaalsContact OD2-CA 3.27Å; D108-G116 WeakPolarHBondContact OD2-CA 3.41Å
109T70.3Confident71.3Confident102 Ų10294.2 Ų94.263%0.62650%0.503SS*.Hα-helixtrans-74.8-23.6174.157.80000113.3V105 L106 R107V105-T109 VanDerWaalsContact O-CG2 3.3Å; V105-T109 WeakPolarHBondContact O-CG2 3.15Å; V105-T109 PolarHBondContact O-N 3.24Å; V105-T109 VanDerWaalsContact O-N 3.07Å; V105-T109 PolarHBondContact O-OG1 3.3Å; L106-T109 PolarHBondContact O-N 3.41Å; L106-T109 VanDerWaalsContact O-N 3.14Å; L106-T109 PolarHBondContact O-OG1 2.97Å; R107-T109 VanDerWaalsContact C-N 3.26Å; R107-T109 PolarHBondContact O-N 3.39Å
110E68.8Low69.9Low145 Ų14591.6 Ų91.668%0.67849%0.489SS*.Hα-helixtrans-82.7-36.7177.2-64.5166.5-157.600111.4L106 R107 D108L106-E110 WeakPolarHBondContact O-CG 3.45Å; L106-E110 PolarHBondContact O-N 3.22Å; R107-E110 PolarHBondContact O-N 3.43Å; D108-E110 VanDerWaalsContact C-N 3.32Å
111N61.4Low68.6Low108 Ų10893.6 Ų93.658%0.57850%0.501SS*.SBendtrans-9994.2176.1-67.6-30.3000109.8R107 D108 D113R107-N111 PolarHBondContact O-N 3.33Å; D108-N111 CarbonylContact O-C 3.56Å; N111-D113 PolarHBondContact O-N 2.98Å
112N57.6Low67.3Low162 Ų16296 Ų9687%0.86651%0.514SS*.  trans-68.533.6-179.6-159.519.4000114.3
113D55.7Low65.8Low136 Ų13694 Ų9473%0.72751%0.508SS*.SBendtrans-110.4107.9178.5-69.4-30.3000107.5N111 M115N111-D113 PolarHBondContact O-N 2.98Å; D113-M115 PolarHBondContact O-N 3.36Å
114G54.9Low64.3Low81 Ų8194.7 Ų94.784%0.83551%0.511SS*.THydrogen-bonded Turntrans-60.835.7-168.500000118.8
115M55.8Low63.1Low145 Ų14597.8 Ų97.871%0.71453%0.529SS*.THydrogen-bonded Turntrans-87.3-16.4174.5-16669.710300113D113 T117 D118D113-M115 PolarHBondContact O-N 3.36Å; M115-T117 PolarHBondContact O-N 3.24Å; M115-T117 VanDerWaalsContact O-N 3.08Å; M115-D118 PolarHBondContact O-N 3.03Å
116G53.4Low61.5Low13 Ų13101.1 Ų101.113%0.13454%0.539CS..THydrogen-bonded Turntrans-62.2-18.3-172.900000116.7D108 D118D108-G116 VanDerWaalsContact OD2-CA 3.27Å; D108-G116 WeakPolarHBondContact OD2-CA 3.41Å; G116-D118 VanDerWaalsContact C-N 3.27Å; G116-D118 PolarHBondContact O-N 3.41Å
117T55.5Low59.5Low89 Ų89100.4 Ų100.455%0.54654%0.542SS..Hα-helixtrans-71.2-20.7-176.370.20000114.2M115 K121M115-T117 PolarHBondContact O-N 3.24Å; M115-T117 VanDerWaalsContact O-N 3.08Å; T117-K121 PolarHBondContact O-N 3.25Å
118D60.6Low57.9Low82 Ų82100.3 Ų100.344%0.43955%0.548SS..Hα-helixtrans-79.3-32.2-176.6-63-25.3000112M115 G116 N122M115-D118 PolarHBondContact O-N 3.03Å; G116-D118 VanDerWaalsContact C-N 3.27Å; G116-D118 PolarHBondContact O-N 3.41Å; D118-N122 PolarHBondContact O-N 2.79Å; D118-N122 PolarHBondContact O-ND2 3.4Å
119F58.3Low56.4Low117 Ų117101.7 Ų101.751%0.51356%0.559SS.*Hα-helixtrans-73.4-41.4175.2-173.6-97.5000112A104 K121 N122 A123A104-F119 HydrophobicContact CB-CD1 3.96Å; A104-F119 HydrophobicContact CB-CE1 3.92Å; F119-K121 VanDerWaalsContact C-N 3.28Å; F119-K121 PolarHBondContact O-N 3.23Å; F119-N122 PolarHBondContact O-N 2.7Å; F119-A123 PolarHBondContact O-N 3.2Å
120L60.8Low55.1Low47 Ų47105.3 Ų105.325%0.24657%0.568CS.*Hα-helixtrans-60.5-38.5174.5-64.6176.3000111.5L101 V105 A123 I124L101-L120 HydrophobicContact CD1-CD2 3.32Å; V105-L120 HydrophobicContact CG2-CD2 4.07Å; L120-A123 PolarHBondContact O-N 3.05Å; L120-I124 WeakPolarHBondContact O-CB 3.3Å; L120-I124 WeakPolarHBondContact O-CD1 3.37Å; L120-I124 WeakPolarHBondContact O-CG1 3.35Å; L120-I124 PolarHBondContact O-N 3.1Å
121K60.6Low53.8Low136 Ų136101.3 Ų101.359%0.59157%0.567SS**Hα-helixtrans-59.3-45.5170.6-94.6176.8176.5170.80111.9T117 F119 I124 T125T117-K121 PolarHBondContact O-N 3.25Å; F119-K121 VanDerWaalsContact C-N 3.28Å; F119-K121 PolarHBondContact O-N 3.23Å; K121-I124 PolarHBondContact O-N 3.47Å; K121-T125 WeakPolarHBondContact O-CB 3.4Å; K121-T125 PolarHBondContact O-N 2.92Å; K121-T125 PolarHBondContact O-OG1 3.39Å
122N58.3Low52.8Low103 Ų103103.9 Ų103.955%0.55158%0.579SS**Hα-helixtrans-65.6-40179.2-69.2-20.7000112.4D118 F119 T125 F126D118-N122 PolarHBondContact O-N 2.79Å; D118-N122 PolarHBondContact O-ND2 3.4Å; F119-N122 PolarHBondContact O-N 2.7Å; N122-T125 PolarHBondContact O-N 3.39Å; N122-F126 PolarHBondContact O-N 3.41Å; N122-F126 VanDerWaalsContact O-N 3.09Å
123A55.4Low52.2Low33 Ų33100.3 Ų100.327%0.27358%0.58SS.*Hα-helixtrans-66.1-39.6175.500000112.6F119 L120 F126F119-A123 PolarHBondContact O-N 3.2Å; L120-A123 PolarHBondContact O-N 3.05Å; A123-F126 WeakPolarHBondContact O-CB 3.39Å; A123-F126 PolarHBondContact O-N 3.41Å
124I56.3Low51.6Low102 Ų10298.4 Ų98.452%0.52358%0.578SS.*Hα-helixtrans-68.3-38.9175.7-67.3164000110.7L120 K121 F126 S127L120-I124 WeakPolarHBondContact O-CB 3.3Å; L120-I124 WeakPolarHBondContact O-CD1 3.37Å; L120-I124 WeakPolarHBondContact O-CG1 3.35Å; L120-I124 PolarHBondContact O-N 3.1Å; K121-I124 PolarHBondContact O-N 3.47Å; I124-F126 VanDerWaalsContact C-N 3.28Å; I124-F126 PolarHBondContact O-N 3.3Å; I124-S127 PolarHBondContact O-N 3.19Å; I124-S127 PolarHBondContact O-OG 3.43Å
125T57Low51.1Low79 Ų79100.2 Ų100.249%0.48557%0.569SS.*Hα-helixtrans-64.6-33.9177.5-47.90000111.5K121 N122 S127 Q128K121-T125 WeakPolarHBondContact O-CB 3.4Å; K121-T125 PolarHBondContact O-N 2.92Å; K121-T125 PolarHBondContact O-OG1 3.39Å; N122-T125 PolarHBondContact O-N 3.39Å; T125-S127 VanDerWaalsContact C-N 3.25Å; T125-S127 PolarHBondContact O-N 2.94Å; T125-Q128 PolarHBondContact O-N 3.09Å; T125-Q128 VanDerWaalsContact O-N 3.1Å
126F50.6Low50.8Low130 Ų13097.3 Ų97.357%0.5756%0.555SS**Hα-helixtrans-60.9-29.8175-122.5-87.1000113.8N122 A123 I124 Q128 L136N122-F126 PolarHBondContact O-N 3.41Å; N122-F126 VanDerWaalsContact O-N 3.09Å; A123-F126 WeakPolarHBondContact O-CB 3.39Å; A123-F126 PolarHBondContact O-N 3.41Å; I124-F126 VanDerWaalsContact C-N 3.28Å; I124-F126 PolarHBondContact O-N 3.3Å; F126-Q128 VanDerWaalsContact C-N 3.29Å; F126-Q128 PolarHBondContact O-N 3.41Å; F126-L136 HydrophobicContact CE1-CD1 3.67Å; F126-L136 HydrophobicContact CE1-CD2 4.18Å; F126-L136 HydrophobicContact CZ-CD1 3.89Å
127S44.8Very low50.6Low81 Ų81103.2 Ų103.257%0.56657%0.574SS**THydrogen-bonded Turntrans-74.1-18.7176.776.80000113.8I124 T125I124-S127 PolarHBondContact O-N 3.19Å; I124-S127 PolarHBondContact O-OG 3.43Å; T125-S127 VanDerWaalsContact C-N 3.25Å; T125-S127 PolarHBondContact O-N 2.94Å
128Q45.7Very low50.5Low157 Ų157106.9 Ų106.973%0.73458%0.578SS**THydrogen-bonded Turntrans-98.2-11.2-169.4-135.9172.688.400113.2T125 F126 E130T125-Q128 PolarHBondContact O-N 3.09Å; T125-Q128 VanDerWaalsContact O-N 3.1Å; F126-Q128 VanDerWaalsContact C-N 3.29Å; F126-Q128 PolarHBondContact O-N 3.41Å; Q128-E130 PolarHBondContact O-N 3.41Å
129T43.3Very low49.7Very low88 Ų88109.1 Ų109.154%0.5459%0.587SS.*  trans-89.382.7178.377.10000110.2G131T129-G131 PolarHBondContact O-N 3.07Å
130E41.7Very low49.2Very low177 Ų177107.5 Ų107.583%0.82758%0.584SS**THydrogen-bonded Turntrans-67.231.4172.4-69.6-125.5147.100113.5R84 Q128R84-E130 IonicContact NH1-OE1 2.73Å; Q128-E130 PolarHBondContact O-N 3.41Å
131G41.6Very low48.6Very low62 Ų62110.1 Ų110.164%0.63960%0.598SS**THydrogen-bonded Turntrans-136.72-16000000118.9T129T129-G131 PolarHBondContact O-N 3.07Å
132L41.4Very low48.1Very low162 Ų162109 Ų10985%0.84860%0.597SS**  trans-141.677.1177.3-149.974.6000112.5S134L132-S134 PolarHBondContact O-N 3.45Å
133G45.2Very low47.6Very low86 Ų86110.3 Ų110.389%0.88760%0.604SS**  trans-70.4102.7160.500000109.4
134S43.4Very low47.1Very low96 Ų96115.1 Ų115.167%0.67163%0.625SS**SBendtrans-164.4-46.8146.6-167.80000114L132L132-S134 PolarHBondContact O-N 3.45Å
135D44.1Very low46.8Very low120 Ų120117.3 Ų117.364%0.64264%0.636SS**  trans-116.916.9-150-76.9-0.4000118.5W137D135-W137 PolarHBondContact O-N 2.93Å
136L48.2Very low46Very low83 Ų83119 Ų11944%0.43564%0.643SS.*THydrogen-bonded Turntrans-86.74.7-177.1-151.173.5000115.4F126F126-L136 HydrophobicContact CE1-CD1 3.67Å; F126-L136 HydrophobicContact CE1-CD2 4.18Å; F126-L136 HydrophobicContact CZ-CD1 3.89Å
137W49.8Very low45.5Very low137 Ų137119.4 Ų119.452%0.51965%0.65SS.*THydrogen-bonded Turntrans-116.420.6179.9-65.9119.1000113.6K93 D135 M139K93-W137 HydrophobicContact CD-CZ2 4.29Å; K93-W137 HydrophobicContact CG-CH2 4.25Å; K93-W137 HydrophobicContact CG-CZ2 3.44Å; K93-W137 VanDerWaalsContact CG-CZ2 3.44Å; D135-W137 PolarHBondContact O-N 2.93Å; W137-M139 PolarHBondContact O-N 3.45Å; W137-M139 VanDerWaalsContact O-N 3.14Å
138R53.2Low45.2Very low167 Ų167124.5 Ų124.563%0.6367%0.665SS**  trans-59.3123.1166.9-73.9-173.661.5-179-2107.8D140 D141R138-D140 IonicContact CZ-OD2 3.25Å; R138-D140 VanDerWaalsContact CZ-OD2 3.25Å; R138-D140 IonicContact NE-OD2 3.02Å; R138-D140 PolarHBondContact NE-OD2 2.93Å; R138-D140 IonicContact NH2-OD2 2.71Å; R138-D140 PolarHBondContact NH2-OD2 3.14Å; R138-D140 PolarHBondContact O-N 3.17Å; R138-D141 PolarHBondContact O-N 3.01Å
139M43.3Very low45.1Very low129 Ų129125 Ų12564%0.63567%0.672SS**G310 helixtrans-57.6-10.6179.1-69.9-77.5121.200113W137W137-M139 PolarHBondContact O-N 3.45Å; W137-M139 VanDerWaalsContact O-N 3.14Å
140D47.9Very low45.2Very low83 Ų83129.8 Ų129.844%0.44469%0.688SS.*G310 helixtrans-67-32-177.9-58.6-43.2000113.5R138 L142 L143R138-D140 IonicContact CZ-OD2 3.25Å; R138-D140 VanDerWaalsContact CZ-OD2 3.25Å; R138-D140 IonicContact NE-OD2 3.02Å; R138-D140 PolarHBondContact NE-OD2 2.93Å; R138-D140 IonicContact NH2-OD2 2.71Å; R138-D140 PolarHBondContact NH2-OD2 3.14Å; R138-D140 PolarHBondContact O-N 3.17Å; D140-L142 VanDerWaalsContact C-N 3.32Å; D140-L142 PolarHBondContact O-N 3.19Å; D140-L143 PolarHBondContact O-N 3.22Å
141D49.8Very low45.2Very low101 Ų101128.6 Ų128.654%0.5469%0.687SS.*G310 helixtrans-78.7-13.3-178.5-74.7-16.3000114R138R138-D141 PolarHBondContact O-N 3.01Å
142L48.5Very low45.1Very low112 Ų112128.4 Ų128.459%0.58669%0.685SS**G310 helixtrans-84.1-19173.2-72.5169.1000112.3D140D140-L142 VanDerWaalsContact C-N 3.32Å; D140-L142 PolarHBondContact O-N 3.19Å
143L48.2Very low44.5Very low131 Ų131130 Ų13069%0.68669%0.686SS**SBendtrans-89-10.8179.7-62.6175.5000112.5D140D140-L143 PolarHBondContact O-N 3.22Å
144N45.8Very low44.2Very low134 Ų134132 Ų13272%0.71768%0.681SS**  trans-93.610179.8-124.723.1000113.7D146N144-D146 PolarHBondContact O-N 2.65Å; N144-D146 VanDerWaalsContact O-N 3.15Å
145I48.6Very low44Very low149 Ų149134.3 Ų134.376%0.76469%0.685SS**SBendtrans-82.970.4157.8-54.2-173.6000106.1
146D40.9Very low43.7Very low115 Ų115133.6 Ų133.662%0.61569%0.687SS**  trans-84132.7-173.1-162.840.9000111.7N144 H148N144-D146 PolarHBondContact O-N 2.65Å; N144-D146 VanDerWaalsContact O-N 3.15Å; D146-H148 PolarHBondContact O-N 3.43Å
147D40.1Very low43.4Very low137 Ų137135.8 Ų135.873%0.73371%0.706SS**SBendtrans62.312.6137.9-104.111000124.9
148H38.6Very low43.1Very low188 Ų188138.2 Ų138.287%0.8772%0.723SS**  trans-123.729.1179-89.3-52.1000118.2D146D146-H148 PolarHBondContact O-N 3.43Å
149L42.9Very low42.2Very low168 Ų168134.9 Ų134.988%0.8873%0.731SS**  trans-121.954166.7-161.467.9000112.5
150E46.5Very low42.1Very low189 Ų189133 Ų13388%0.88374%0.736SS**  trans-95.589157.3-80.4-70.4152.900108
151D40.6Very low42.1Very low152 Ų152134.4 Ų134.481%0.81375%0.75SS**SBendtrans-169.1124.4133.9-149.80.8000111.6
152G39.7Very low41.7Very low58 Ų58137.5 Ų137.560%0.59876%0.761SS**  trans63.681.9147.900000120.6
153F28.8Very low41.5Very low194 Ų194140 Ų14085%0.85178%0.775SS**  trans-104.875.3147.5-145.4-89.5000109.9L155F153-L155 PolarHBondContact O-N 3.14Å
154T39.1Very low41.2Very low128 Ų128137 Ų13779%0.78578%0.776SS**  trans-77.7111.5167-35.30000108
155L40.3Very low41.2Very low145 Ų145140.3 Ų140.376%0.75979%0.787SS**PPolyproline II helixtrans-56.9126.2173.3-85.6142.4000110.4F153F153-L155 PolarHBondContact O-N 3.14Å
156P37.5Very low41Very low106 Ų106141.1 Ų141.169%0.68879%0.79SS**PPolyproline II helixtrans-72.3145.1167.4-7.323.5000109.9
157P40.8Very low41.1Very low128 Ų128140.9 Ų140.983%0.83179%0.794SS**PPolyproline II helixtrans-69.1141176.529.8-33.1000111.1
158E43.6Very low41.2Very low188 Ų188145.2 Ų145.288%0.87980%0.8SS**PPolyproline II helixtrans-53.8126.1-178-143.6175.1-176.500112.2
159A34.9Very low41.7Very low97 Ų97143.8 Ų143.880%0.80280%0.799SS**  trans-128.3107.216200000108.5
160A41.9Very low41.7Very low89 Ų89141.7 Ų141.774%0.73679%0.792SS**  trans-70.3153.2158.100000108.3
161P48Very low41.8Very low113 Ų113140.5 Ų140.573%0.73479%0.791SS**  -151.8-176.563.337.4-14000116.6
162E40.4Very low42Very low166 Ų166141.1 Ų141.178%0.77679%0.789SS**  trans88.5104.4158.6-56-63.9105.900120.2
163D44.3Very low42.1Very low165 Ų165145 Ų14588%0.88280%0.796SS**  trans47.1109.1139.7-96.2-7000121.4
164G41Very low42.4Very low68 Ų68141.2 Ų141.270%0.70179%0.792SS**  trans17798.8161.500000109.1M166G164-M166 PolarHBondContact O-N 3.04Å
165E46.1Very low42.7Very low203 Ų203141.2 Ų141.295%0.94979%0.792SS**  trans-54.797.9176.8-72.7-174.6148.700111.3
166M44.2Very low42.6Very low167 Ų167141.2 Ų141.282%0.82379%0.79SS**  trans-113.3121.1159.9-93.4-72.3-174.900106.9G164 R168G164-M166 PolarHBondContact O-N 3.04Å; M166-R168 PolarHBondContact O-N 3.42Å
167P43.5Very low42.7Very low109 Ų109140.2 Ų140.271%0.70878%0.783SS**  trans-65107.4178.726.6-30.8000107.8L169P167-L169 VanDerWaalsContact C-N 3.29Å; P167-L169 PolarHBondContact O-N 3.11Å
168R43.4Very low42.9Very low228 Ų228138.8 Ų138.886%0.8678%0.783SS**  trans-52.894.8167.4-100.5-173.6149.2162.1-2.6107.9M166 V170M166-R168 PolarHBondContact O-N 3.42Å; R168-V170 VanDerWaalsContact C-N 3.25Å; R168-V170 PolarHBondContact O-N 3.41Å
169L47.8Very low42.6Very low159 Ų159139.4 Ų139.483%0.83278%0.778SS**  trans-68.295.6165.8-69176.3000106.2P167 L171P167-L169 VanDerWaalsContact C-N 3.29Å; P167-L169 PolarHBondContact O-N 3.11Å; L169-L171 PolarHBondContact O-N 3.32Å
170V44.3Very low43Very low123 Ų123143.1 Ų143.175%0.74578%0.779SS**  trans-46.2111.1170.2-174.30000107.2R168 Q172R168-V170 VanDerWaalsContact C-N 3.25Å; R168-V170 PolarHBondContact O-N 3.41Å; V170-Q172 PolarHBondContact O-N 2.61Å
171L48.3Very low42.9Very low164 Ų164146.3 Ų146.386%0.85978%0.783SS**  trans-62.185.5163.3-99.9123000106.5L169 N173L169-L171 PolarHBondContact O-N 3.32Å; L171-N173 PolarHBondContact O-N 3.38Å; L171-N173 VanDerWaalsContact O-N 3.11Å
172Q44.1Very low42.8Very low166 Ų166146.9 Ų146.978%0.77678%0.778SS**  trans-75.2103.2173.2-168.6155.319.800106.7V170 C174V170-Q172 PolarHBondContact O-N 2.61Å; Q172-C174 PolarHBondContact O-N 3.24Å
173N41.3Very low43.1Very low139 Ų139145.8 Ų145.874%0.74378%0.776SS**  trans-41.5112.2175-73.7-9.5000110.3L171 V175L171-N173 PolarHBondContact O-N 3.38Å; L171-N173 VanDerWaalsContact O-N 3.11Å; N173-V175 VanDerWaalsContact C-N 3.29Å; N173-V175 PolarHBondContact O-N 3.05Å
174C35.6Very low42.8Very low114 Ų114146.4 Ų146.477%0.7777%0.774SS**  trans-70.985.6173.4-74.70000108.9Q172 M176Q172-C174 PolarHBondContact O-N 3.24Å; C174-M176 HydrophobicContact CB-CE 4.29Å; C174-M176 PolarHBondContact O-N 2.9Å
175V44.6Very low42.8Very low128 Ų128149 Ų14978%0.77678%0.776SS**  trans-71.4111.6165.1-176.10000107.2N173N173-V175 VanDerWaalsContact C-N 3.29Å; N173-V175 PolarHBondContact O-N 3.05Å
176M38.2Very low42.6Very low145 Ų145143.2 Ų143.271%0.71476%0.763SS**  trans-64.2127.8172.1-72.4-6996.800109.5C174 A178C174-M176 HydrophobicContact CB-CE 4.29Å; C174-M176 PolarHBondContact O-N 2.9Å; M176-A178 PolarHBondContact O-N 3.08Å; M176-A178 VanDerWaalsContact O-N 3.15Å
177P41.3Very low42.6Very low85 Ų85141.2 Ų141.255%0.55276%0.762SS**  trans-66116.1169.5-9.323.4000108Y179P177-Y179 WeakPolarHBondContact O-CD2 3.27Å; P177-Y179 PolarHBondContact O-N 3.17Å; P177-Y179 VanDerWaalsContact O-N 3.09Å
178A43Very low42.5Very low99 Ų99143.7 Ų143.782%0.81877%0.77SS**  trans-66.8106.4167.400000107.8M176 Q180M176-A178 PolarHBondContact O-N 3.08Å; M176-A178 VanDerWaalsContact O-N 3.15Å; A178-Q180 PolarHBondContact O-N 3.45Å; A178-Q180 VanDerWaalsContact O-N 3.08Å
179Y37.7Very low42.5Very low200 Ų200141.5 Ų141.578%0.78477%0.769SS**  trans-71.6102.1170.7-65.9-80.8000108.1P177 L181P177-Y179 WeakPolarHBondContact O-CD2 3.27Å; P177-Y179 PolarHBondContact O-N 3.17Å; P177-Y179 VanDerWaalsContact O-N 3.09Å; Y179-L181 PolarHBondContact O-N 3.28Å
180Q43.7Very low42.3Very low175 Ų175138.3 Ų138.382%0.81877%0.766SS**  trans-74.893.9170.3-160.4153.70.800107.8A178 I182A178-Q180 PolarHBondContact O-N 3.45Å; A178-Q180 VanDerWaalsContact O-N 3.08Å; Q180-I182 HydrophobicContact CG-CG1 4.34Å; Q180-I182 PolarHBondContact O-N 3.37Å
181L39.8Very low42.5Very low157 Ų157138.2 Ų138.282%0.82277%0.768SS**  trans-63.4102.3168.8-71.7164.6000107.9Y179 I183Y179-L181 PolarHBondContact O-N 3.28Å; L181-I183 PolarHBondContact O-N 3.02Å
182I46.8Very low42Very low124 Ų124138.4 Ų138.464%0.63677%0.766SS**  trans-93.592.6168.5-60.7174.1000106.8Q180 Q184Q180-I182 HydrophobicContact CG-CG1 4.34Å; Q180-I182 PolarHBondContact O-N 3.37Å; I182-Q184 HydrophobicContact CG2-CG 3.77Å; I182-Q184 PolarHBondContact O-N 2.71Å
183I45.8Very low42.2Very low143 Ų143136.2 Ų136.273%0.73377%0.769SS**  trans-81.298.1157.1-61.8171.1000105.2L181 V185L181-I183 PolarHBondContact O-N 3.02Å; I183-V185 HydrophobicContact CG2-CG2 3.96Å; I183-V185 PolarHBondContact O-N 2.75Å; I183-V185 VanDerWaalsContact O-N 3.08Å
184Q38.3Very low42.2Very low179 Ų179137.7 Ų137.784%0.83677%0.772SS**  trans-72.595166.7-93.6172.4-900108I182I182-Q184 HydrophobicContact CG2-CG 3.77Å; I182-Q184 PolarHBondContact O-N 2.71Å
185V41.2Very low43.2Very low123 Ų123141.9 Ų141.975%0.74580%0.797SS**PPolyproline II helixtrans-73.5127.1158.2-171.50000106.4I183I183-V185 HydrophobicContact CG2-CG2 3.96Å; I183-V185 PolarHBondContact O-N 2.75Å; I183-V185 VanDerWaalsContact O-N 3.08Å
186A42.4Very low43.1Very low81 Ų81142.6 Ų142.667%0.66980%0.798SS**PPolyproline II helixtrans-55.2143.6179.100000111D188A186-D188 PolarHBondContact O-N 3.15Å
187P43.3Very low43.4Very low124 Ų124142.4 Ų142.481%0.80580%0.803SS**PPolyproline II helixtrans-68.8130.3171.927.7-30.4000109.6
188D42.6Very low43.5Very low162 Ų162145.6 Ų145.687%0.86682%0.817SS**PPolyproline II helixtrans-53.6134.7174-150.8-0.7000110.2A186 A190A186-D188 PolarHBondContact O-N 3.15Å; D188-A190 PolarHBondContact O-N 3.21Å
189Q43.2Very low43.5Very low181 Ų181148.4 Ų148.485%0.84682%0.817SS**PPolyproline II helixtrans-73.7118.3178.2-66.4-155.418.200109.3
190A42.3Very low43.9Very low92 Ų92145.1 Ų145.176%0.7682%0.819SS**PPolyproline II helixtrans-66.8134.4167.200000109.8D188D188-A190 PolarHBondContact O-N 3.21Å
191P48.3Very low43.9Very low122 Ų122143.1 Ų143.179%0.79282%0.819SS**PPolyproline II helixtrans-72138.7-18027.9-31.7000111.4S193P191-S193 PolarHBondContact O-N 2.68Å
192M39.6Very low44.2Very low167 Ų167142.1 Ų142.182%0.82382%0.818SS**  trans-42.3125.2170.1-64.6-102.4-74.300113.1
193S46.8Very low44Very low121 Ų121143.5 Ų143.585%0.84683%0.833SS**  trans-115.2115.4156.9-58.30000108.2P191P191-S193 PolarHBondContact O-N 2.68Å
194Q42.1Very low43.8Very low170 Ų170143.6 Ų143.679%0.79484%0.841SS**  trans-145.9161.1162.5-78.4-169.7-8.900107.8
195P56Low44.3Very low201 Ų201140.4 Ų140.4100%1.30584%0.841SS**  -101.50-58.526.6-12.6000112.1

Retrieved 195 of 195 residues in 75.1 ms (Link to these results)

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