A0A077ZCF0_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZCF0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 124 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
1M51.7Low61.2Low233 Ų233149.1 Ų149.1100%1.14884%0.84SS**  01010-71.6-151.5173.400108.8
2T60.7Low61.7Low123 Ų123145.5 Ų145.576%0.75583%0.832SS**  trans-152.891.4167.340.90000107.5N4T2-N4 PolarHBondContact O-N 2.95Å
3H61.4Low62.3Low182 Ų182143.6 Ų143.684%0.84382%0.824SS**  trans-81.2104.2170.6-72.5-76000108S5H3-S5 PolarHBondContact O-N 3.05Å
4N64.1Low62.8Low162 Ų162140.6 Ų140.687%0.86681%0.812SS**  trans-74.986.8173.1-65.8-25.1000109.2T2T2-N4 PolarHBondContact O-N 2.95Å
5S61.9Low63.3Low112 Ų112142.3 Ų142.378%0.78382%0.817SS**  trans-103.696.4168.856.50000109H3H3-S5 PolarHBondContact O-N 3.05Å
6S64.6Low64Low116 Ų116138.8 Ų138.881%0.81181%0.811SS**  trans-149.17.1171.9-165.80000116.8
7E59.5Low65.2Low185 Ų185144.7 Ų144.786%0.86482%0.816SS**SBendtrans-118.70-179.3-68.3-172.4178.400115.1
8A60.1Low66.3Low97 Ų97139.5 Ų139.580%0.80279%0.789SS**THydrogen-bonded Turntrans-81.2-14.2-176.800000115V10A8-V10 PolarHBondContact O-N 2.85Å
9D60.9Low67.6Low152 Ų152135.9 Ų135.981%0.81377%0.774SS**THydrogen-bonded Turntrans-95.819.3-172.8-75-20.4000114.7L11D9-L11 PolarHBondContact O-N 3.31Å
10V63.7Low68.9Low125 Ų125139.6 Ų139.676%0.75878%0.775SS**  trans-74.583.1159.4-171.70000106.7A8 S12A8-V10 PolarHBondContact O-N 2.85Å; V10-S12 VanDerWaalsContact C-N 3.32Å; V10-S12 PolarHBondContact O-N 3.25Å
11L64Low70.2Confident153 Ų153141.9 Ų141.980%0.80177%0.772SS**  trans-47.1103.7166.1-72.2170000107D9 V13D9-L11 PolarHBondContact O-N 3.31Å; L11-V13 PolarHBondContact O-N 3.02Å
12S67.8Low72.2Confident106 Ų106132.4 Ų132.474%0.74173%0.73SS**  trans-59.897.3173.4-179.80000105.4V10 P14V10-S12 VanDerWaalsContact C-N 3.32Å; V10-S12 PolarHBondContact O-N 3.25Å; S12-P14 WeakPolarHBondContact O-CD 3.49Å
13V69.8Low73.9Confident121 Ų121129.4 Ų129.473%0.73371%0.71SS**  trans-55.6108.9174.6177.40000103.8L11 N15L11-V13 PolarHBondContact O-N 3.02Å; V13-N15 PolarHBondContact O-N 2.72Å
14P68.4Low75.6Confident101 Ų101128 Ų12866%0.65670%0.697SS**  trans-57.5135.1-174.520.4-29.2000106.1S12 A16S12-P14 WeakPolarHBondContact O-CD 3.49Å; P14-A16 WeakPolarHBondContact O-CA 3.29Å; P14-A16 PolarHBondContact O-N 2.89Å
15N70.1Confident77.2Confident166 Ų166123.4 Ų123.489%0.88867%0.673SS**  trans-51.685.3176.3-84.3-42.4000108.9V13 R17V13-N15 PolarHBondContact O-N 2.72Å; N15-R17 PolarHBondContact O-N 2.92Å
16A75.5Confident78.8Confident86 Ų86124.5 Ų124.571%0.71166%0.66SS**  trans-72.7107.2-165.200000105.7P14 P18P14-A16 WeakPolarHBondContact O-CA 3.29Å; P14-A16 PolarHBondContact O-N 2.89Å; A16-P18 WeakPolarHBondContact O-CD 3.18Å
17R83.8Confident80.4Confident240 Ų240128.1 Ų128.191%0.90666%0.656SS**PPolyproline II helixtrans-53121.9176.6-76.4-176.6173.4-175.2-1107.1N15 S19N15-R17 PolarHBondContact O-N 2.92Å; R17-S19 PolarHBondContact O-N 2.73Å
18P85.3Confident82.2Confident51 Ų51126.9 Ų126.933%0.33164%0.643SS.*PPolyproline II helixtrans-59.8129.9-176.921.8-31.9000109A16 A22 N23A16-P18 WeakPolarHBondContact O-CD 3.18Å; P18-A22 HydrophobicContact CB-CB 4.19Å; P18-N23 WeakPolarHBondContact CG-OD1 3.46Å; P18-N23 PolarHBondContact O-ND2 3.3Å
19S91.7Very high84Confident71 Ų71126.4 Ų126.450%0.49763%0.627SS.*PPolyproline II helixtrans-56.9157.3178.172.40000111.3R17 R21 A22 N23R17-S19 PolarHBondContact O-N 2.73Å; S19-R21 PolarHBondContact O-N 3.45Å; S19-R21 VanDerWaalsContact O-N 3.15Å; S19-A22 WeakPolarHBondContact O-CB 3.44Å; S19-A22 PolarHBondContact O-N 3.32Å; S19-A22 PolarHBondContact OG-N 3.26Å; S19-A22 VanDerWaalsContact OG-N 3.17Å; S19-N23 PolarHBondContact O-N 2.95Å
20R93.2Very high85.7Confident210 Ų210127 Ų12779%0.79262%0.618SS**Hα-helixtrans-52.7-37.7174.5-70.4178.9176.2144.1-2.7111.6N23 R24R20-N23 PolarHBondContact O-N 2.75Å; R20-R24 WeakPolarHBondContact O-CG 3.36Å; R20-R24 PolarHBondContact O-N 3.23Å
21R95.7Very high87.4Confident187 Ų187126.2 Ų126.271%0.70661%0.605SS**Hα-helixtrans-65.3-45.2176.1-169.4175.2-176.2175.10.1111.9S19 N23 R24 N25S19-R21 PolarHBondContact O-N 3.45Å; S19-R21 VanDerWaalsContact O-N 3.15Å; R21-N23 VanDerWaalsContact C-N 3.33Å; R21-N23 PolarHBondContact O-N 3.47Å; R21-R24 PolarHBondContact O-N 3.35Å; R21-N25 PolarHBondContact O-N 3.48Å
22A94.6Very high89Confident34 Ų34123.5 Ų123.528%0.28159%0.591SS.*Hα-helixtrans-60.1-43.1175.700000111.8P18 S19 N25 R26P18-A22 HydrophobicContact CB-CB 4.19Å; S19-A22 WeakPolarHBondContact O-CB 3.44Å; S19-A22 PolarHBondContact O-N 3.32Å; S19-A22 PolarHBondContact OG-N 3.26Å; S19-A22 VanDerWaalsContact OG-N 3.17Å; A22-N25 PolarHBondContact O-N 3.48Å; A22-R26 WeakPolarHBondContact O-CG 3.48Å; A22-R26 PolarHBondContact O-N 3.38Å
23N95.9Very high90.4Very high61 Ų61127.6 Ų127.633%0.32659%0.59SS.*Hα-helixtrans-66-40.8177.3-75.6-30.3000113.1P18 S19 R20 R21 R26 R27P18-N23 WeakPolarHBondContact CG-OD1 3.46Å; P18-N23 PolarHBondContact O-ND2 3.3Å; S19-N23 PolarHBondContact O-N 2.95Å; R20-N23 PolarHBondContact O-N 2.75Å; R21-N23 VanDerWaalsContact C-N 3.33Å; R21-N23 PolarHBondContact O-N 3.47Å; N23-R26 PolarHBondContact O-N 3.4Å; N23-R27 WeakPolarHBondContact O-CG 3.35Å; N23-R27 PolarHBondContact O-N 3.16Å
24R96.9Very high91.7Very high151 Ų151130.9 Ų130.957%0.5759%0.59SS**Hα-helixtrans-60.2-45.3172.6-71.7175.8-161.31562111.3R20 R21 R26 R27 R28R20-R24 WeakPolarHBondContact O-CG 3.36Å; R20-R24 PolarHBondContact O-N 3.23Å; R21-R24 PolarHBondContact O-N 3.35Å; R24-R26 PolarHBondContact O-N 3.38Å; R24-R27 PolarHBondContact O-N 3.48Å; R24-R28 WeakPolarHBondContact O-CG 3.46Å; R24-R28 PolarHBondContact O-N 2.99Å
25N97.1Very high93.1Very high67 Ų67130.9 Ų130.936%0.35858%0.581SS.*Hα-helixtrans-63.3-42177.8-73.5-8000111.9R21 A22 R27 R28 N29R21-N25 PolarHBondContact O-N 3.48Å; A22-N25 PolarHBondContact O-N 3.48Å; N25-R27 VanDerWaalsContact C-N 3.35Å; N25-R27 PolarHBondContact O-N 3.5Å; N25-R28 PolarHBondContact O-N 2.99Å; N25-N29 WeakPolarHBondContact O-CB 3.49Å; N25-N29 VanDerWaalsContact O-CG 3.23Å; N25-N29 PolarHBondContact O-N 3.3Å; N25-N29 PolarHBondContact O-ND2 3.5Å
26R96.4Very high94.4Very high134 Ų134130.4 Ų130.451%0.50657%0.571SS.*Hα-helixtrans-58.7-44.2173.4-73.7174.3-177.9177.3-1.5111.9A22 N23 R24 N29 R30A22-R26 WeakPolarHBondContact O-CG 3.48Å; A22-R26 PolarHBondContact O-N 3.38Å; N23-R26 PolarHBondContact O-N 3.4Å; R24-R26 PolarHBondContact O-N 3.38Å; R26-N29 PolarHBondContact O-N 2.98Å; R26-R30 VanDerWaalsContact O-CG 3.3Å; R26-R30 WeakPolarHBondContact O-CG 3.46Å; R26-R30 PolarHBondContact O-N 3.08Å
27R97.1Very high95.5Very high193 Ų193132.2 Ų132.273%0.72856%0.563SS**Hα-helixtrans-63.1-46.8176.8-71.3178.3-176.8-171.31111.7N23 R24 N25 R30 H31N23-R27 WeakPolarHBondContact O-CG 3.35Å; N23-R27 PolarHBondContact O-N 3.16Å; R24-R27 PolarHBondContact O-N 3.48Å; N25-R27 VanDerWaalsContact C-N 3.35Å; N25-R27 PolarHBondContact O-N 3.5Å; R27-R30 PolarHBondContact O-N 3.24Å; R27-H31 PolarHBondContact O-N 2.81Å
28R97.4Very high96.2Very high158 Ų158126.8 Ų126.860%0.59655%0.547SS*.Hα-helixtrans-58.4-48.6175.2-72176.3-177.1168.3-4111.5R24 N25 R30 H31 L32R24-R28 WeakPolarHBondContact O-CG 3.46Å; R24-R28 PolarHBondContact O-N 2.99Å; N25-R28 PolarHBondContact O-N 2.99Å; R28-R30 VanDerWaalsContact C-N 3.34Å; R28-R30 PolarHBondContact O-N 2.93Å; R28-H31 WeakPolarHBondContact O-CB 3.38Å; R28-H31 PolarHBondContact O-N 2.91Å; R28-H31 VanDerWaalsContact O-N 3.09Å; R28-L32 WeakPolarHBondContact O-CG 3.3Å; R28-L32 PolarHBondContact O-N 2.69Å
29N97.9Very high96.8Very high87 Ų87129 Ų12947%0.46556%0.556SS.*Hα-helixtrans-61.9-39.9179.1-72.5-13.8000112.4N25 R26 L32 R33N25-N29 WeakPolarHBondContact O-CB 3.49Å; N25-N29 VanDerWaalsContact O-CG 3.23Å; N25-N29 PolarHBondContact O-N 3.3Å; N25-N29 PolarHBondContact O-ND2 3.5Å; R26-N29 PolarHBondContact O-N 2.98Å; N29-L32 PolarHBondContact O-N 3.13Å; N29-R33 WeakPolarHBondContact O-CB 3.48Å; N29-R33 VanDerWaalsContact O-CG 3.23Å; N29-R33 WeakPolarHBondContact O-CG 3.37Å; N29-R33 PolarHBondContact O-N 2.79Å
30R97.9Very high97Very high166 Ų166128.9 Ų128.963%0.62655%0.553SS**Hα-helixtrans-62-43.5173.1-74.1175.5-173.9178.41.6111.6R26 R27 R28 R33 R34R26-R30 VanDerWaalsContact O-CG 3.3Å; R26-R30 WeakPolarHBondContact O-CG 3.46Å; R26-R30 PolarHBondContact O-N 3.08Å; R27-R30 PolarHBondContact O-N 3.24Å; R28-R30 VanDerWaalsContact C-N 3.34Å; R28-R30 PolarHBondContact O-N 2.93Å; R30-R33 PolarHBondContact O-N 3.19Å; R30-R34 WeakPolarHBondContact O-CG 3.37Å; R30-R34 PolarHBondContact O-N 2.88Å; R30-R34 VanDerWaalsContact O-N 3.09Å
31H98.1Very high97.3Very high107 Ų107126.6 Ų126.650%0.49554%0.544SS..Hα-helixtrans-63.3-48.2177.4-174.474.1000111.8R27 R28 R33 R34 Q35R27-H31 PolarHBondContact O-N 2.81Å; R28-H31 WeakPolarHBondContact O-CB 3.38Å; R28-H31 PolarHBondContact O-N 2.91Å; R28-H31 VanDerWaalsContact O-N 3.09Å; H31-R33 VanDerWaalsContact C-N 3.33Å; H31-R33 PolarHBondContact O-N 3.29Å; H31-R34 WeakPolarHBondContact O-CB 3.42Å; H31-R34 PolarHBondContact O-N 3.32Å; H31-R34 VanDerWaalsContact O-N 3.09Å; H31-Q35 PolarHBondContact NE2-NE2 2.83Å; H31-Q35 PolarHBondContact O-N 3.29Å
32L98Very high97.4Very high97 Ų97124.8 Ų124.851%0.50854%0.537SS..Hα-helixtrans-59.3-41.7176.6-69.7172.6000112.1R28 N29 R34 Q35 K36R28-L32 WeakPolarHBondContact O-CG 3.3Å; R28-L32 PolarHBondContact O-N 2.69Å; N29-L32 PolarHBondContact O-N 3.13Å; L32-R34 VanDerWaalsContact C-N 3.34Å; L32-R34 PolarHBondContact O-N 3.34Å; L32-Q35 PolarHBondContact O-N 3.1Å; L32-K36 WeakPolarHBondContact O-CB 3.37Å; L32-K36 PolarHBondContact O-N 3.26Å
33R98Very high97.5Very high191 Ų191127.7 Ų127.772%0.72155%0.547SS*.Hα-helixtrans-60.3-42.4174.4-75.1175.2-172-160.22.7111.9N29 R30 H31 K37N29-R33 WeakPolarHBondContact O-CB 3.48Å; N29-R33 VanDerWaalsContact O-CG 3.23Å; N29-R33 WeakPolarHBondContact O-CG 3.37Å; N29-R33 PolarHBondContact O-N 2.79Å; R30-R33 PolarHBondContact O-N 3.19Å; H31-R33 VanDerWaalsContact C-N 3.33Å; H31-R33 PolarHBondContact O-N 3.29Å; R33-K37 WeakPolarHBondContact O-CB 3.45Å; R33-K37 PolarHBondContact O-N 3.1Å
34R97.8Very high97.6Very high190 Ų190129 Ų12972%0.71755%0.554SS**Hα-helixtrans-65.4-45.2176.6-71.2176.1-179.6-174.3-0.7111.6R30 H31 L32 K37 H38R30-R34 WeakPolarHBondContact O-CG 3.37Å; R30-R34 PolarHBondContact O-N 2.88Å; R30-R34 VanDerWaalsContact O-N 3.09Å; H31-R34 WeakPolarHBondContact O-CB 3.42Å; H31-R34 PolarHBondContact O-N 3.32Å; H31-R34 VanDerWaalsContact O-N 3.09Å; L32-R34 VanDerWaalsContact C-N 3.34Å; L32-R34 PolarHBondContact O-N 3.34Å; R34-K37 PolarHBondContact O-N 3.36Å; R34-H38 WeakPolarHBondContact O-CB 3.4Å; R34-H38 PolarHBondContact O-N 2.96Å
35Q97.8Very high97.6Very high101 Ų101130.3 Ų130.347%0.47256%0.559SS.*Hα-helixtrans-60.9-48.9176.7-74-173-25.300111.8H31 L32 K37 H38 L39H31-Q35 PolarHBondContact NE2-NE2 2.83Å; H31-Q35 PolarHBondContact O-N 3.29Å; L32-Q35 PolarHBondContact O-N 3.1Å; Q35-K37 PolarHBondContact O-N 3.2Å; Q35-H38 PolarHBondContact O-N 3.1Å; Q35-L39 WeakPolarHBondContact O-CB 3.36Å; Q35-L39 PolarHBondContact O-N 2.87Å
36K97.5Very high97.6Very high157 Ų157131.9 Ų131.968%0.68356%0.563SS**Hα-helixtrans-56.4-48.9176.5-174.7175.6-179.6176.70111.1L32 H38 L39 T40L32-K36 WeakPolarHBondContact O-CB 3.37Å; L32-K36 PolarHBondContact O-N 3.26Å; K36-H38 VanDerWaalsContact C-N 3.34Å; K36-H38 PolarHBondContact O-N 2.9Å; K36-L39 PolarHBondContact O-N 3.3Å; K36-T40 PolarHBondContact O-N 2.91Å; K36-T40 PolarHBondContact O-OG1 3.46Å
37K97.3Very high97.7Very high124 Ų124131.9 Ų131.954%0.53957%0.567SS.*Hα-helixtrans-58.6-43.4177.1-175.9176.7-177.2176.30112.2R33 R34 Q35 R41R33-K37 WeakPolarHBondContact O-CB 3.45Å; R33-K37 PolarHBondContact O-N 3.1Å; R34-K37 PolarHBondContact O-N 3.36Å; Q35-K37 PolarHBondContact O-N 3.2Å; K37-R41 WeakPolarHBondContact O-CG 3.37Å; K37-R41 PolarHBondContact O-N 3.44Å; K37-R41 VanDerWaalsContact O-N 3.12Å
38H97.7Very high97.7Very high125 Ų125126.1 Ų126.158%0.57955%0.55SS*.Hα-helixtrans-65.4-45178.1-177.278.4000111.8R34 Q35 K36 R41 R42R34-H38 WeakPolarHBondContact O-CB 3.4Å; R34-H38 PolarHBondContact O-N 2.96Å; Q35-H38 PolarHBondContact O-N 3.1Å; K36-H38 VanDerWaalsContact C-N 3.34Å; K36-H38 PolarHBondContact O-N 2.9Å; H38-R41 PolarHBondContact O-N 2.89Å; H38-R42 WeakPolarHBondContact O-CB 3.42Å; H38-R42 PolarHBondContact O-N 3.32Å
39L98.2Very high97.7Very high99 Ų99121.8 Ų121.852%0.51854%0.538SS..Hα-helixtrans-59.9-48.6178-178.360.4000111.3Q35 K36 R41 R42 L43Q35-L39 WeakPolarHBondContact O-CB 3.36Å; Q35-L39 PolarHBondContact O-N 2.87Å; K36-L39 PolarHBondContact O-N 3.3Å; L39-R41 VanDerWaalsContact C-N 3.34Å; L39-R41 PolarHBondContact O-N 3.11Å; L39-R42 PolarHBondContact O-N 3.1Å; L39-R42 VanDerWaalsContact O-N 3.15Å; L39-L43 HydrophobicContact CD1-CD1 4.31Å; L39-L43 HydrophobicContact CD1-CG 4.3Å; L39-L43 HydrophobicContact CG-CD1 4.18Å; L39-L43 WeakPolarHBondContact O-CG 3.33Å; L39-L43 PolarHBondContact O-N 3.2Å
40T97.3Very high97.6Very high68 Ų68125.8 Ų125.842%0.41755%0.547SS..Hα-helixtrans-57.9-45.1176.9-550000111.7K36 R42 L43 N44K36-T40 PolarHBondContact O-N 2.91Å; K36-T40 PolarHBondContact O-OG1 3.46Å; T40-R42 PolarHBondContact O-N 3.05Å; T40-L43 PolarHBondContact O-N 3.2Å; T40-N44 WeakPolarHBondContact O-CB 3.35Å; T40-N44 VanDerWaalsContact O-CG 3.27Å; T40-N44 PolarHBondContact O-N 3.26Å
41R97.9Very high97.6Very high162 Ų162122.4 Ų122.461%0.61154%0.539SS*.Hα-helixtrans-60.9-43.3175.9-75.6175.7172.7-172.5-7.4112.2K37 H38 L39 N44 R45K37-R41 WeakPolarHBondContact O-CG 3.37Å; K37-R41 PolarHBondContact O-N 3.44Å; K37-R41 VanDerWaalsContact O-N 3.12Å; H38-R41 PolarHBondContact O-N 2.89Å; L39-R41 VanDerWaalsContact C-N 3.34Å; L39-R41 PolarHBondContact O-N 3.11Å; R41-N44 PolarHBondContact O-N 3.08Å; R41-R45 WeakPolarHBondContact O-CB 3.39Å; R41-R45 PolarHBondContact O-N 3.44Å
42R97.9Very high97.5Very high148 Ų148124.7 Ų124.756%0.55854%0.544SS*.Hα-helixtrans-63.3-43.5179.1-171.2176.4-176.8-174.8-0.8111.4H38 L39 T40 K46H38-R42 WeakPolarHBondContact O-CB 3.42Å; H38-R42 PolarHBondContact O-N 3.32Å; L39-R42 PolarHBondContact O-N 3.1Å; L39-R42 VanDerWaalsContact O-N 3.15Å; T40-R42 PolarHBondContact O-N 3.05Å; R42-K46 WeakPolarHBondContact O-CG 3.48Å; R42-K46 PolarHBondContact O-N 3.34Å
43L97.6Very high97.4Very high95 Ų95127.7 Ų127.750%0.49755%0.552SS.*Hα-helixtrans-65.5-44.9177-67.3176.3000111.7L39 T40 R45 K46 K47L39-L43 HydrophobicContact CD1-CD1 4.31Å; L39-L43 HydrophobicContact CD1-CG 4.3Å; L39-L43 HydrophobicContact CG-CD1 4.18Å; L39-L43 WeakPolarHBondContact O-CG 3.33Å; L39-L43 PolarHBondContact O-N 3.2Å; T40-L43 PolarHBondContact O-N 3.2Å; L43-R45 PolarHBondContact O-N 3.02Å; L43-K46 WeakPolarHBondContact O-CB 3.41Å; L43-K46 PolarHBondContact O-N 2.93Å; L43-K47 PolarHBondContact O-N 3.48Å
44N97.5Very high97.3Very high89 Ų89127.6 Ų127.648%0.47655%0.552SS.*Hα-helixtrans-61-44.5176.9-73.1-8.5000111.8T40 R41 K46 K47 I48T40-N44 WeakPolarHBondContact O-CB 3.35Å; T40-N44 VanDerWaalsContact O-CG 3.27Å; T40-N44 PolarHBondContact O-N 3.26Å; R41-N44 PolarHBondContact O-N 3.08Å; N44-K46 VanDerWaalsContact C-N 3.33Å; N44-K46 PolarHBondContact O-N 3.44Å; N44-K47 PolarHBondContact O-N 3.05Å; N44-I48 WeakPolarHBondContact O-CG1 3.41Å; N44-I48 PolarHBondContact O-N 3.16Å
45R98Very high97.2Very high179 Ų179124.1 Ų124.168%0.67555%0.547SS*.Hα-helixtrans-60.2-43174.9-172.4176.5-179.2-173.9-0.8111.6R41 L43 I48 N49R41-R45 WeakPolarHBondContact O-CB 3.39Å; R41-R45 PolarHBondContact O-N 3.44Å; L43-R45 PolarHBondContact O-N 3.02Å; R45-I48 PolarHBondContact O-N 3.01Å; R45-N49 WeakPolarHBondContact O-CB 3.49Å; R45-N49 PolarHBondContact O-N 2.94Å
46K97.1Very high97Very high100 Ų100125.2 Ų125.244%0.43556%0.556SS.*Hα-helixtrans-61.7-43.1175.1-77-177.7176.7-173.40111.8R42 L43 N44 N49 R50R42-K46 WeakPolarHBondContact O-CG 3.48Å; R42-K46 PolarHBondContact O-N 3.34Å; L43-K46 WeakPolarHBondContact O-CB 3.41Å; L43-K46 PolarHBondContact O-N 2.93Å; N44-K46 VanDerWaalsContact C-N 3.33Å; N44-K46 PolarHBondContact O-N 3.44Å; K46-N49 PolarHBondContact O-N 3.44Å; K46-R50 WeakPolarHBondContact O-CG 3.37Å; K46-R50 PolarHBondContact O-N 2.87Å
47K97.5Very high96.9Very high134 Ų134123.8 Ų123.858%0.58355%0.549SS*.Hα-helixtrans-60.9-50.4176.7-174177.8179.2-179.80111.2L43 N44 N49 R50 M51L43-K47 PolarHBondContact O-N 3.48Å; N44-K47 PolarHBondContact O-N 3.05Å; K47-N49 VanDerWaalsContact C-N 3.34Å; K47-N49 PolarHBondContact O-N 3.41Å; K47-R50 PolarHBondContact O-N 3.17Å; K47-M51 WeakPolarHBondContact O-CG 3.36Å; K47-M51 PolarHBondContact O-N 3.43Å
48I97.2Very high96.5Very high72 Ų72124.1 Ų124.137%0.36955%0.551SS.*Hα-helixtrans-58.7-45.5177.5-67.3166.8000111N44 R45 R50 M51 R52N44-I48 WeakPolarHBondContact O-CG1 3.41Å; N44-I48 PolarHBondContact O-N 3.16Å; R45-I48 PolarHBondContact O-N 3.01Å; I48-R50 VanDerWaalsContact C-N 3.34Å; I48-R50 PolarHBondContact O-N 3.02Å; I48-M51 HydrophobicContact CG1-CE 4.2Å; I48-M51 PolarHBondContact O-N 3.47Å; I48-R52 HydrophobicContact CG2-CG 4.35Å; I48-R52 WeakPolarHBondContact O-CG 3.46Å; I48-R52 PolarHBondContact O-N 2.93Å
49N97.2Very high96.1Very high67 Ų67123.7 Ų123.736%0.35855%0.549SS..Hα-helixtrans-63.1-39.5178.4-73.6-6.3000112.4R45 K46 K47 K53R45-N49 WeakPolarHBondContact O-CB 3.49Å; R45-N49 PolarHBondContact O-N 2.94Å; K46-N49 PolarHBondContact O-N 3.44Å; K47-N49 VanDerWaalsContact C-N 3.34Å; K47-N49 PolarHBondContact O-N 3.41Å; N49-K53 WeakPolarHBondContact O-CG 3.38Å; N49-K53 PolarHBondContact O-N 2.95Å
50R97Very high95.6Very high171 Ų171125.2 Ų125.265%0.64555%0.551SS**Hα-helixtrans-63.4-44174.2-74174.7179-179.3-1.9111.4K46 K47 I48 K53 R54K46-R50 WeakPolarHBondContact O-CG 3.37Å; K46-R50 PolarHBondContact O-N 2.87Å; K47-R50 PolarHBondContact O-N 3.17Å; I48-R50 VanDerWaalsContact C-N 3.34Å; I48-R50 PolarHBondContact O-N 3.02Å; R50-K53 PolarHBondContact O-N 2.96Å; R50-R54 WeakPolarHBondContact O-CG 3.45Å; R50-R54 PolarHBondContact O-N 3.19Å
51M97Very high95.1Very high94 Ų94129.3 Ų129.346%0.46356%0.559SS.*Hα-helixtrans-62.6-47.3176.9-67.5-172.2-5200111.5K47 I48 K53 R54 L55K47-M51 WeakPolarHBondContact O-CG 3.36Å; K47-M51 PolarHBondContact O-N 3.43Å; I48-M51 HydrophobicContact CG1-CE 4.2Å; I48-M51 PolarHBondContact O-N 3.47Å; M51-K53 PolarHBondContact O-N 3.43Å; M51-R54 PolarHBondContact O-N 3.42Å; M51-R54 VanDerWaalsContact O-N 3.16Å; M51-L55 WeakPolarHBondContact O-CG 3.47Å; M51-L55 PolarHBondContact O-N 3.23Å
52R96.1Very high94.5Very high156 Ų156126.8 Ų126.859%0.58955%0.554SS**Hα-helixtrans-57.6-46.1176.5-72.7177-179.9179.2-1.2112.2I48 R54 L55 L56I48-R52 HydrophobicContact CG2-CG 4.35Å; I48-R52 WeakPolarHBondContact O-CG 3.46Å; I48-R52 PolarHBondContact O-N 2.93Å; R52-R54 VanDerWaalsContact C-N 3.34Å; R52-R54 PolarHBondContact O-N 3.41Å; R52-L55 PolarHBondContact O-N 2.94Å; R52-L56 WeakPolarHBondContact O-CB 3.43Å; R52-L56 VanDerWaalsContact O-CG 3.3Å; R52-L56 WeakPolarHBondContact O-CG 3.34Å; R52-L56 PolarHBondContact O-N 3.45Å
53K96.3Very high93.7Very high159 Ų159122.1 Ų122.169%0.69154%0.542SS*.Hα-helixtrans-60.7-41.3176.4-75.6-173.9176.7-165.50112.4N49 R50 M51 K57N49-K53 WeakPolarHBondContact O-CG 3.38Å; N49-K53 PolarHBondContact O-N 2.95Å; R50-K53 PolarHBondContact O-N 2.96Å; M51-K53 PolarHBondContact O-N 3.43Å; K53-K57 PolarHBondContact O-N 2.88Å
54R95.5Very high92.8Very high189 Ų189120.8 Ų120.871%0.71354%0.535SS*.Hα-helixtrans-65.2-44.2177.1-73.4177179.3-175.1-2.6112R50 M51 R52 K57 K58R50-R54 WeakPolarHBondContact O-CG 3.45Å; R50-R54 PolarHBondContact O-N 3.19Å; M51-R54 PolarHBondContact O-N 3.42Å; M51-R54 VanDerWaalsContact O-N 3.16Å; R52-R54 VanDerWaalsContact C-N 3.34Å; R52-R54 PolarHBondContact O-N 3.41Å; R54-K57 PolarHBondContact O-N 3.38Å; R54-K58 PolarHBondContact O-N 2.92Å
55L95Very high91.7Very high117 Ų117120.1 Ų120.161%0.61354%0.535SS*.Hα-helixtrans-63.7-43.7177.7-69.8173000111.9M51 R52 K57 K58 H59M51-L55 WeakPolarHBondContact O-CG 3.47Å; M51-L55 PolarHBondContact O-N 3.23Å; R52-L55 PolarHBondContact O-N 2.94Å; L55-K57 VanDerWaalsContact C-N 3.33Å; L55-K57 PolarHBondContact O-N 2.93Å; L55-K58 PolarHBondContact O-N 2.92Å; L55-H59 PolarHBondContact O-N 3.46Å
56L95Very high90.4Very high125 Ų125113.8 Ų113.865%0.65452%0.521SS*.Hα-helixtrans-60.5-41.8175-72169.6000112R52 H59 K60R52-L56 WeakPolarHBondContact O-CB 3.43Å; R52-L56 VanDerWaalsContact O-CG 3.3Å; R52-L56 WeakPolarHBondContact O-CG 3.34Å; R52-L56 PolarHBondContact O-N 3.45Å; L56-H59 PolarHBondContact O-N 2.94Å; L56-K60 WeakPolarHBondContact O-CB 3.3Å; L56-K60 PolarHBondContact O-N 3.43Å
57K94.2Very high89Confident127 Ų127113.2 Ų113.255%0.55252%0.522SS*.Hα-helixtrans-65.2-38.8175.7-172.1177-177.9179.50112.2K53 R54 L55 R61K53-K57 PolarHBondContact O-N 2.88Å; R54-K57 PolarHBondContact O-N 3.38Å; L55-K57 VanDerWaalsContact C-N 3.33Å; L55-K57 PolarHBondContact O-N 2.93Å; K57-R61 WeakPolarHBondContact O-CG 3.41Å; K57-R61 PolarHBondContact O-N 3.2Å; K57-R61 VanDerWaalsContact O-N 3.08Å
58K90Very high87.3Confident131 Ų131113.2 Ų113.257%0.5753%0.525SS*.Hα-helixtrans-64.5-47.2175.7-174.2-179.4178.8-176.70111R54 L55 K60 R61 Q62R54-K58 PolarHBondContact O-N 2.92Å; L55-K58 PolarHBondContact O-N 2.92Å; K58-K60 VanDerWaalsContact C-N 3.33Å; K58-K60 PolarHBondContact O-N 3.29Å; K58-R61 PolarHBondContact O-N 2.93Å; K58-Q62 WeakPolarHBondContact O-CG 3.35Å; K58-Q62 PolarHBondContact O-N 3.39Å
59H89.2Confident85.6Confident115 Ų115117.2 Ų117.253%0.53254%0.542SS..Hα-helixtrans-61-42.5176.9-174.9-67.6000111.5L55 L56 R61 Q62 T63L55-H59 PolarHBondContact O-N 3.46Å; L56-H59 PolarHBondContact O-N 2.94Å; H59-R61 PolarHBondContact O-N 3.15Å; H59-Q62 PolarHBondContact O-N 3.18Å; H59-T63 VanDerWaalsContact CE1-CG2 3.48Å; H59-T63 WeakPolarHBondContact CE1-CG2 3.39Å; H59-T63 PolarHBondContact O-N 3.42Å; H59-T63 PolarHBondContact O-OG1 3.33Å
60K87.3Confident83.7Confident132 Ų132121.1 Ų121.157%0.57456%0.559SS**Hα-helixtrans-58.7-47.9175.9-172-178.1175.2-176.60111.4L56 K58 Q62 T63 D64L56-K60 WeakPolarHBondContact O-CB 3.3Å; L56-K60 PolarHBondContact O-N 3.43Å; K58-K60 VanDerWaalsContact C-N 3.33Å; K58-K60 PolarHBondContact O-N 3.29Å; K60-Q62 VanDerWaalsContact C-N 3.26Å; K60-Q62 PolarHBondContact O-N 3.12Å; K60-T63 WeakPolarHBondContact CA-OG1 3.35Å; K60-T63 PolarHBondContact O-N 3.4Å; K60-T63 PolarHBondContact O-OG1 2.89Å; K60-D64 WeakPolarHBondContact O-CB 3.36Å; K60-D64 PolarHBondContact O-N 3.04Å
61R86.3Confident81.9Confident154 Ų154119.4 Ų119.458%0.58156%0.563SS**Hα-helixtrans-59.1-37.9176.4-72172.3173.2-168.3-8.7112.9K57 K58 H59 T65K57-R61 WeakPolarHBondContact O-CG 3.41Å; K57-R61 PolarHBondContact O-N 3.2Å; K57-R61 VanDerWaalsContact O-N 3.08Å; K58-R61 PolarHBondContact O-N 2.93Å; H59-R61 PolarHBondContact O-N 3.15Å; R61-T65 WeakPolarHBondContact O-CG2 3.23Å; R61-T65 PolarHBondContact O-N 3.28Å; R61-T65 VanDerWaalsContact O-N 3.1Å; R61-T65 PolarHBondContact O-OG1 2.9Å; R61-T65 VanDerWaalsContact O-OG1 3.11Å
62Q85.3Confident80.1Confident108 Ų108119.6 Ų119.651%0.50557%0.57SS.*Hα-helixtrans-69.8-37.2178.4-73.5176.4-37.100112.5K58 H59 K60 T65 A66K58-Q62 WeakPolarHBondContact O-CG 3.35Å; K58-Q62 PolarHBondContact O-N 3.39Å; H59-Q62 PolarHBondContact O-N 3.18Å; K60-Q62 VanDerWaalsContact C-N 3.26Å; K60-Q62 PolarHBondContact O-N 3.12Å; Q62-T65 WeakPolarHBondContact CA-OG1 3.35Å; Q62-T65 PolarHBondContact O-OG1 2.95Å; Q62-A66 WeakPolarHBondContact O-CB 3.42Å; Q62-A66 PolarHBondContact O-N 3.39Å; Q62-A66 VanDerWaalsContact O-N 3.1Å
63T81.4Confident78.3Confident50 Ų50118.5 Ų118.531%0.30758%0.575SS.*Hα-helixtrans-70.9-42174.450.60000111.4H59 K60 T65 A66 D67H59-T63 VanDerWaalsContact CE1-CG2 3.48Å; H59-T63 WeakPolarHBondContact CE1-CG2 3.39Å; H59-T63 PolarHBondContact O-N 3.42Å; H59-T63 PolarHBondContact O-OG1 3.33Å; K60-T63 WeakPolarHBondContact CA-OG1 3.35Å; K60-T63 PolarHBondContact O-N 3.4Å; K60-T63 PolarHBondContact O-OG1 2.89Å; T63-T65 VanDerWaalsContact C-N 3.29Å; T63-T65 PolarHBondContact O-N 3.02Å; T63-A66 PolarHBondContact O-N 2.87Å; T63-A66 VanDerWaalsContact O-N 3.1Å; T63-D67 PolarHBondContact O-N 3.09Å
64D79.1Confident76.4Confident67 Ų67117.7 Ų117.736%0.35858%0.578SS.*Hα-helixtrans-58.5-43.3177.6-60.1-13000110.1K60 E68K60-D64 WeakPolarHBondContact O-CB 3.36Å; K60-D64 PolarHBondContact O-N 3.04Å; D64-E68 WeakPolarHBondContact O-CG 3.45Å; D64-E68 PolarHBondContact O-N 2.97Å; D64-E68 VanDerWaalsContact O-N 3.1Å
65T73.4Confident74.4Confident75 Ų75114.2 Ų114.246%0.4658%0.577SS.*Hα-helixtrans-70.9-28.8175.952.80000114.6R61 Q62 T63 Q69R61-T65 WeakPolarHBondContact O-CG2 3.23Å; R61-T65 PolarHBondContact O-N 3.28Å; R61-T65 VanDerWaalsContact O-N 3.1Å; R61-T65 PolarHBondContact O-OG1 2.9Å; R61-T65 VanDerWaalsContact O-OG1 3.11Å; Q62-T65 WeakPolarHBondContact CA-OG1 3.35Å; Q62-T65 PolarHBondContact O-OG1 2.95Å; T63-T65 VanDerWaalsContact C-N 3.29Å; T63-T65 PolarHBondContact O-N 3.02Å; T65-Q69 WeakPolarHBondContact O-CG 3.48Å; T65-Q69 PolarHBondContact O-N 3.38Å
66A72.4Confident72.6Confident46 Ų46114 Ų11438%0.3858%0.576SS.*Hα-helixtrans-77.9-38179.200000111.1Q62 T63 Q69 M70Q62-A66 WeakPolarHBondContact O-CB 3.42Å; Q62-A66 PolarHBondContact O-N 3.39Å; Q62-A66 VanDerWaalsContact O-N 3.1Å; T63-A66 PolarHBondContact O-N 2.87Å; T63-A66 VanDerWaalsContact O-N 3.1Å; A66-Q69 PolarHBondContact O-N 3.32Å; A66-M70 WeakPolarHBondContact O-CG 3.33Å; A66-M70 PolarHBondContact O-N 2.99Å
67D66.7Low70.3Confident88 Ų88112.3 Ų112.347%0.47157%0.572SS.*Hα-helixtrans-65.1-42.2173.7-68.7-16.8000109.7T63 Q69 M70 D71T63-D67 PolarHBondContact O-N 3.09Å; D67-Q69 VanDerWaalsContact C-N 3.3Å; D67-Q69 PolarHBondContact O-N 3.09Å; D67-M70 PolarHBondContact O-N 3.44Å; D67-D71 PolarHBondContact O-N 3.46Å; D67-D71 VanDerWaalsContact O-N 3.13Å
68E62.7Low68.3Low135 Ų135112.2 Ų112.263%0.63158%0.582SS**Hα-helixtrans-60.8-31.1174.2-76.9173.2-171.400114.1D64D64-E68 WeakPolarHBondContact O-CG 3.45Å; D64-E68 PolarHBondContact O-N 2.97Å; D64-E68 VanDerWaalsContact O-N 3.1Å
69Q60.7Low66.3Low155 Ų155112 Ų11272%0.72459%0.588SS**Hα-helixtrans-77.1-26.2177.4-79.7-179.2-1300113.6T65 A66 D67T65-Q69 WeakPolarHBondContact O-CG 3.48Å; T65-Q69 PolarHBondContact O-N 3.38Å; A66-Q69 PolarHBondContact O-N 3.32Å; D67-Q69 VanDerWaalsContact C-N 3.3Å; D67-Q69 PolarHBondContact O-N 3.09Å
70M57.4Low64.3Low149 Ų149113.8 Ų113.873%0.73460%0.601SS**Hα-helixtrans-83.2-29.1177.3-62.8-63.1-60.300111.8A66 D67 V72A66-M70 WeakPolarHBondContact O-CG 3.33Å; A66-M70 PolarHBondContact O-N 2.99Å; D67-M70 PolarHBondContact O-N 3.44Å; M70-V72 VanDerWaalsContact C-N 3.29Å
71D58.2Low62.4Low135 Ų135113.5 Ų113.572%0.72261%0.61SS**SBendtrans-82.2-3.8178.9-71.6-11.6000113.4D67 D73D67-D71 PolarHBondContact O-N 3.46Å; D67-D71 VanDerWaalsContact O-N 3.13Å; D71-D73 PolarHBondContact O-N 2.93Å
72V60.3Low60.6Low99 Ų99114.6 Ų114.660%0.662%0.621SS**  trans-75.478.5157.5-172.80000106.1M70 L74M70-V72 VanDerWaalsContact C-N 3.29Å; V72-L74 PolarHBondContact O-N 2.84Å
73D58.2Low58.5Low133 Ų133118 Ų11871%0.71164%0.638SS**  trans-49102.2148.7-79-28000104.6D71 V75D71-D73 PolarHBondContact O-N 2.93Å; D73-V75 HydrophobicContact CB-CG2 4.29Å; D73-V75 PolarHBondContact O-N 3.09Å
74L56.7Low56.7Low141 Ų141121.1 Ų121.174%0.73866%0.658SS**  trans-54.984.2148.5-92.6123.3000104.3V72 I76V72-L74 PolarHBondContact O-N 2.84Å; L74-I76 HydrophobicContact CB-CG1 4.17Å; L74-I76 HydrophobicContact CD2-CG1 4.07Å; L74-I76 PolarHBondContact O-N 3.5Å
75V54.1Low55.1Low116 Ų116122 Ų12270%0.70368%0.676SS**  trans-62.377.6145.6-173.80000103.1D73 P77D73-V75 HydrophobicContact CB-CG2 4.29Å; D73-V75 PolarHBondContact O-N 3.09Å; V75-P77 VanDerWaalsContact C-N 3.35Å; V75-P77 WeakPolarHBondContact O-CD 3.44Å; V75-P77 VanDerWaalsContact O-N 3.15Å
76I55.9Low53.6Low114 Ų114125.9 Ų125.959%0.58569%0.693SS**  trans-54.1115.1147.9-60.5176.9000101.3L74 T78L74-I76 HydrophobicContact CB-CG1 4.17Å; L74-I76 HydrophobicContact CD2-CG1 4.07Å; L74-I76 PolarHBondContact O-N 3.5Å; I76-T78 PolarHBondContact O-N 2.85Å
77P47.5Very low51.9Low89 Ų89131.7 Ų131.758%0.57872%0.718SS**  trans-57.8101.1168.2-14.529.1000104.3V75 D79V75-P77 VanDerWaalsContact C-N 3.35Å; V75-P77 WeakPolarHBondContact O-CD 3.44Å; V75-P77 VanDerWaalsContact O-N 3.15Å; P77-D79 PolarHBondContact O-N 2.97Å
78T51.3Low50.7Low125 Ų125131.7 Ų131.777%0.76773%0.73SS**  trans-74.265.4156.1550000104.2I76 N80I76-T78 PolarHBondContact O-N 2.85Å; T78-N80 PolarHBondContact O-N 3.01Å
79D48.1Very low49.6Very low127 Ų127133 Ų13368%0.67974%0.741SS**  trans-55.3115.6162.3-79.1-25.3000104.2P77 V81P77-D79 PolarHBondContact O-N 2.97Å; D79-V81 VanDerWaalsContact C-N 3.29Å; D79-V81 WeakPolarHBondContact O-CG2 3.37Å; D79-V81 PolarHBondContact O-N 3.38Å
80N47.5Very low48.7Very low152 Ų152133.6 Ų133.681%0.81375%0.746SS**  trans-15.687.5165.1-60.3-41.1000111.5T78 E82T78-N80 PolarHBondContact O-N 3.01Å; N80-E82 PolarHBondContact O-N 3.32Å
81V47.3Very low47.9Very low125 Ų125134 Ų13476%0.75874%0.744SS**  trans-77.879.4161.2-176.40000103.4D79 Q83D79-V81 VanDerWaalsContact C-N 3.29Å; D79-V81 WeakPolarHBondContact O-CG2 3.37Å; D79-V81 PolarHBondContact O-N 3.38Å; V81-Q83 PolarHBondContact O-N 2.93Å
82E48.1Very low47Very low177 Ų177134.6 Ų134.683%0.82774%0.742SS**  trans-48.1116.1154.2-73.6-175.9166.400105.8N80N80-E82 PolarHBondContact O-N 3.32Å
83Q41.9Very low46Very low181 Ų181135.6 Ų135.685%0.84675%0.749SS**  trans-44.4123.7-178.4-66.2164.6-63.800109.4V81 A85V81-Q83 PolarHBondContact O-N 2.93Å; Q83-A85 PolarHBondContact O-N 3.43Å
84P43.6Very low45.1Very low114 Ų114135.5 Ų135.574%0.7475%0.753SS**  trans-66.499.115826.5-28.3000106.2N86P84-N86 VanDerWaalsContact C-N 3.33Å; P84-N86 PolarHBondContact O-N 3.23Å
85A45.5Very low44.2Very low87 Ų87136.3 Ų136.372%0.71976%0.758SS**  trans-51.7104.1157.500000106.9Q83Q83-A85 PolarHBondContact O-N 3.43Å
86N41.6Very low43.7Very low155 Ų155136 Ų13683%0.82976%0.761SS**  trans-161.697.7151.7-91.6-28000108.3P84 A88P84-N86 VanDerWaalsContact C-N 3.33Å; P84-N86 PolarHBondContact O-N 3.23Å; N86-A88 PolarHBondContact O-N 3.48Å
87D37.5Very low43Very low169 Ų169139.9 Ų139.990%0.90478%0.777SS**  trans-43.7117.5151.6-64.3-54.2000110.4
88A40.3Very low43Very low88 Ų88141.7 Ų141.773%0.72779%0.788SS**  trans-172.279.7152.900000110.2N86 M90N86-A88 PolarHBondContact O-N 3.48Å; A88-M90 PolarHBondContact O-N 2.85Å
89D41.1Very low42.7Very low162 Ų162138.8 Ų138.887%0.86678%0.783SS**  trans20.687.6132.7-152.114.2000117.2
90M41.5Very low42.4Very low167 Ų167139.2 Ų139.282%0.82379%0.79SS**  trans-151.1100.8154.7-83-56.1177.500111.4A88A88-M90 PolarHBondContact O-N 2.85Å
91K39.1Very low42.7Very low158 Ų158140.3 Ų140.369%0.68779%0.79SS**  66.2111127.6-69.6-81.4-175.3177.70120.8
92E40.3Very low42.7Very low147 Ų147140.2 Ų140.269%0.68779%0.794SS**  63.8106.6127.1-84.2176.7125.600120.5
93T38.1Very low42.5Very low121 Ų121139.3 Ų139.374%0.74279%0.794SS**  trans54.4117.9130.960.40000119.2
94V39.2Very low42.7Very low131 Ų131135 Ų13579%0.79479%0.79SS**  -157.9131.8109.7-174.20000108.9
95N39.7Very low42.9Very low158 Ų158135.2 Ų135.285%0.84579%0.788SS**  trans-42.8132.1174-49.7-60.1000114.4
96S43.6Very low43.3Very low109 Ų109134.7 Ų134.776%0.76278%0.779SS**  trans-146.7108.6149.540.70000108.8P98S96-P98 VanDerWaalsContact O-CD 3.29Å; S96-P98 WeakPolarHBondContact O-CD 3.08Å
97E41.3Very low44.1Very low196 Ų196135.5 Ų135.592%0.91678%0.775SS**  trans-77.2117.7158.1-67.5-178.316400107.2
98P45.6Very low44.8Very low127 Ų127133.5 Ų133.583%0.82577%0.765SS**  trans-95109.515528.3-14.4000105.8S96S96-P98 VanDerWaalsContact O-CD 3.29Å; S96-P98 WeakPolarHBondContact O-CD 3.08Å
99G45.8Very low45.5Very low64 Ų64132 Ų13266%0.6675%0.752SS**  115.696.66500000106E101G99-E101 PolarHBondContact O-N 3.5Å; G99-E101 VanDerWaalsContact O-N 3.08Å
100V41.9Very low46.2Very low136 Ų136131.8 Ų131.882%0.82474%0.744SS**  trans-43.5112.4-177.8179.50000111.1C102V100-C102 PolarHBondContact O-N 3.47Å
101E52.9Low46.8Very low175 Ų175130.5 Ų130.582%0.81874%0.735SS**  trans-57.8107.9172.3-71.9-175.1164.100109.2G99 L103G99-E101 PolarHBondContact O-N 3.5Å; G99-E101 VanDerWaalsContact O-N 3.08Å; E101-L103 VanDerWaalsContact C-N 3.33Å; E101-L103 PolarHBondContact O-N 3.38Å
102C48Very low47.6Very low123 Ų123132.7 Ų132.783%0.83174%0.739SS**  trans-68.894.4169.9-680000108.1V100 A104V100-C102 PolarHBondContact O-N 3.47Å; C102-A104 PolarHBondContact O-N 2.9Å
103L43.7Very low48.3Very low157 Ų157134 Ų13482%0.82274%0.743SS**  trans-47.4112.7172.9-78.7165.5000110E101 V105E101-L103 VanDerWaalsContact C-N 3.33Å; E101-L103 PolarHBondContact O-N 3.38Å; L103-V105 PolarHBondContact O-N 3.32Å
104A47.3Very low49.2Very low92 Ų92137 Ų13776%0.7674%0.74SS**  trans-57.5108177.900000109.6C102 S106C102-A104 PolarHBondContact O-N 2.9Å; A104-S106 PolarHBondContact O-N 3Å
105V47.1Very low50.1Low118 Ų118138.4 Ų138.472%0.71574%0.736SS**  trans-68.689.7169.7-178.90000107.4L103 K107L103-V105 PolarHBondContact O-N 3.32Å; V105-K107 PolarHBondContact O-N 3.44Å
106S53.6Low50.9Low75 Ų75138 Ų13852%0.52473%0.726SS.*  trans-53.1132.3179.355.20000110.7A104 D108 A109A104-S106 PolarHBondContact O-N 3Å; S106-D108 PolarHBondContact O-N 2.96Å; S106-A109 PolarHBondContact O-N 3.33Å
107K58.2Low51.5Low173 Ų173138.5 Ų138.575%0.75272%0.717SS**THydrogen-bonded Turntrans-57.3-16.7-174.2-68.8172.5-179.6167.20112.9V105V105-K107 PolarHBondContact O-N 3.44Å
108D52.9Low52.2Low126 Ų126139.1 Ų139.167%0.67471%0.711SS**Hα-helixtrans-71.9-27.9-178.6-70.6-23.8000114.6S106 K110 H111 R112S106-D108 PolarHBondContact O-N 2.96Å; D108-K110 VanDerWaalsContact C-N 3.27Å; D108-K110 PolarHBondContact O-N 3.15Å; D108-H111 PolarHBondContact O-N 3.45Å; D108-R112 PolarHBondContact O-N 3.02Å
109A55.6Low52.7Low56 Ų56139.1 Ų139.146%0.46370%0.7SS.*Hα-helixtrans-65.3-3217900000112.3S106S106-A109 PolarHBondContact O-N 3.33Å
110K55.1Low53.1Low159 Ų159143.1 Ų143.169%0.69170%0.701SS**Hα-helixtrans-72.9-27.8179.5-69.7-177.7-178.4172.90112.5D108D108-K110 VanDerWaalsContact C-N 3.27Å; D108-K110 PolarHBondContact O-N 3.15Å
111H53.5Low53.7Low139 Ų139146 Ų14664%0.64470%0.697SS**Hα-helixtrans-77.2-32.4178.5-106.2-78.7000113.1D108 K113 R114D108-H111 PolarHBondContact O-N 3.45Å; H111-K113 PolarHBondContact O-N 3.29Å; H111-R114 PolarHBondContact O-N 2.98Å
112R55.6Low54Low205 Ų205142 Ų14277%0.77469%0.688SS**Hα-helixtrans-66.7-34.4178.8-81.5-176160.2-169.3-4.3113.6D108 R114 K115D108-R112 PolarHBondContact O-N 3.02Å; R112-R114 PolarHBondContact O-N 3.17Å; R112-K115 PolarHBondContact O-N 3.21Å
113K55.6Low54.3Low175 Ų175143.3 Ų143.376%0.76169%0.686SS**Hα-helixtrans-65.5-39.6177.9-70.9-164.1177.2-174.80112.8H111 K115 K116 E117H111-K113 PolarHBondContact O-N 3.29Å; K113-K115 VanDerWaalsContact C-N 3.33Å; K113-K115 PolarHBondContact O-N 2.92Å; K113-K116 PolarHBondContact O-N 3.18Å; K113-E117 PolarHBondContact O-N 2.87Å
114R57.7Low54.5Low183 Ų183147.9 Ų147.969%0.69170%0.699SS**Hα-helixtrans-69.2-27.5-178.3-69-176.7173.5-179.2-0.2113.8H111 R112H111-R114 PolarHBondContact O-N 2.98Å; R112-R114 PolarHBondContact O-N 3.17Å
115K56.8Low54.9Low161 Ų161150.7 Ų150.770%0.770%0.696SS**Hα-helixtrans-76.6-38.9179.8-144.1179.2-175.6-176.30111.8R112 K113 R118R112-K115 PolarHBondContact O-N 3.21Å; K113-K115 VanDerWaalsContact C-N 3.33Å; K113-K115 PolarHBondContact O-N 2.92Å; K115-R118 PolarHBondContact O-N 2.58Å
116K57.2Low55.3Low149 Ų149152.4 Ų152.465%0.64870%0.695SS**Hα-helixtrans-66.7-37.9175.3-70-168175.9-171.60112.5K113 R118 Q119 H120K113-K116 PolarHBondContact O-N 3.18Å; K116-R118 VanDerWaalsContact C-N 3.3Å; K116-R118 PolarHBondContact O-N 2.76Å; K116-Q119 PolarHBondContact O-N 3.48Å; K116-H120 PolarHBondContact O-CD2 2.77Å; K116-H120 PolarHBondContact O-N 3.06Å
117E55.7Low55.4Low119 Ų119156.7 Ų156.756%0.55671%0.705SS**Hα-helixtrans-66.2-31.1-179.8-136.7-175.7171.600113.2K113K113-E117 PolarHBondContact O-N 2.87Å
118R56.4Low55.2Low209 Ų209155.8 Ų155.879%0.78970%0.702SS**Hα-helixtrans-72.7-32175.7-76.7-174.1170-166.2-3113.1K115 K116K115-R118 PolarHBondContact O-N 2.58Å; K116-R118 VanDerWaalsContact C-N 3.3Å; K116-R118 PolarHBondContact O-N 2.76Å
119Q57.2Low55.4Low128 Ų128157.6 Ų157.660%0.59870%0.704SS**Hα-helixtrans-74-33178.6-71.1-175-23.600112.4K116 R121 S122K116-Q119 PolarHBondContact O-N 3.48Å; Q119-R121 VanDerWaalsContact C-N 3.35Å; Q119-S122 PolarHBondContact O-OG 3.36Å
120H52.7Low55.4Low147 Ų147164.4 Ų164.468%0.68172%0.72SS**Hα-helixtrans-75.5-19.5176.3-76.6-69.1000114.3K116K116-H120 PolarHBondContact O-CD2 2.77Å; K116-H120 PolarHBondContact O-N 3.06Å
121R56Low55.4Low198 Ų198164.8 Ų164.875%0.74772%0.722SS**THydrogen-bonded Turntrans-83.2-13.8176.1-75.3-171.6-177.4-162.71.8114.2Q119Q119-R121 VanDerWaalsContact C-N 3.35Å
122S58.3Low55.5Low90 Ų90166.8 Ų166.863%0.62973%0.728SS**SBendtrans-97.4-0.2178.4580000114.1Q119Q119-S122 PolarHBondContact O-OG 3.36Å
123L53.8Low55.5Low151 Ų151163.6 Ų163.679%0.79172%0.724SS**  trans-114.219179.9-72.1171.2000113.1
124K48.8Very low55.5Low253 Ų253162.5 Ų162.5100%1.172%0.721SS**  trans-129.30165.4-81.6-172.1177.1-1760108.4

Retrieved 124 of 124 residues in 43.8 ms (Link to these results)