A0A077Z4J0_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z4J0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 202 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
1M41.5Very low55.6Low244 Ų244132.7 Ų132.7100%1.20276%0.758SS**  0118.70-81.1172.1148.800106.7
2E41.9Very low57.7Low183 Ų183128.2 Ų128.286%0.85573%0.728SS**  trans-56.9129.3-157.9-74.4138.7112.900114.8S4E2-S4 PolarHBondContact O-N 3.44Å
3S43.4Very low59.5Low109 Ų109123.4 Ų123.476%0.76270%0.703SS**  trans-71.185.7170.647.50000110.4H5S3-H5 VanDerWaalsContact C-N 3.26Å; S3-H5 PolarHBondContact O-N 2.99Å
4S46.9Very low61.1Low108 Ų108121.1 Ų121.176%0.75569%0.692SS**  trans-77.972.4172.6-65.40000111.1E2 A6E2-S4 PolarHBondContact O-N 3.44Å; S4-A6 PolarHBondContact O-N 3.43Å
5H49.8Very low62.6Low184 Ų184116.3 Ų116.385%0.85267%0.673SS**  trans-70.779.8157.1-81.4-71000108.1S3 G7S3-H5 VanDerWaalsContact C-N 3.26Å; S3-H5 PolarHBondContact O-N 2.99Å; H5-G7 PolarHBondContact O-N 3.15Å
6A53.4Low64.1Low85 Ų85115.8 Ų115.870%0.70267%0.666SS**  trans-66.295.9171.900000108.6S4 Y8S4-A6 PolarHBondContact O-N 3.43Å; A6-Y8 PolarHBondContact O-N 2.91Å
7G55.9Low65.3Low72 Ų72116.1 Ų116.174%0.74266%0.664SS**PPolyproline II helixtrans-56.6123.217400000110H5 S9H5-G7 PolarHBondContact O-N 3.15Å; G7-S9 PolarHBondContact O-N 3.06Å
8Y63.4Low66.6Low180 Ų180117.2 Ų117.271%0.70666%0.66SS**PPolyproline II helixtrans-55.6125.5170.4-66.6-84000108.5A6 L10 I12A6-Y8 PolarHBondContact O-N 2.91Å; Y8-L10 PolarHBondContact O-N 3.04Å; Y8-I12 HydrophobicContact CD1-CG2 4.39Å
9S72.4Confident67.8Low59 Ų59116.1 Ų116.141%0.41366%0.656SS.*PPolyproline II helixtrans-60.3132.2174.854.40000108.5G7 P11 I12 V13G7-S9 PolarHBondContact O-N 3.06Å; S9-P11 WeakPolarHBondContact O-CD 3.25Å; S9-I12 WeakPolarHBondContact O-CB 3.46Å; S9-I12 PolarHBondContact O-N 3.47Å; S9-I12 WeakPolarHBondContact OG-CD1 3.35Å; S9-I12 WeakPolarHBondContact OG-CG1 3.49Å; S9-V13 PolarHBondContact O-N 2.95Å
10L65.6Low69Low145 Ų145113.5 Ų113.576%0.75964%0.644SS**Hα-helixtrans-38.7-41.6177.2-76.3164.4000115.1Y8 I12 V13 V14Y8-L10 PolarHBondContact O-N 3.04Å; L10-I12 VanDerWaalsContact C-N 3.29Å; L10-I12 PolarHBondContact O-N 3.26Å; L10-V13 PolarHBondContact O-N 3.23Å; L10-V14 WeakPolarHBondContact O-CG2 3.21Å; L10-V14 PolarHBondContact O-N 3.25Å; L10-V14 VanDerWaalsContact O-N 3.07Å
11P77.9Confident70.1Confident91 Ų91110.9 Ų110.959%0.59164%0.637SS**Hα-helixtrans-61.6-32.1176.323.7-37.1000114.2S9 A15S9-P11 WeakPolarHBondContact O-CD 3.25Å; P11-A15 VanDerWaalsContact O-CB 3.32Å; P11-A15 WeakPolarHBondContact O-CB 3.22Å; P11-A15 PolarHBondContact O-N 3.34Å
12I80.1Confident72.5Confident78 Ų78102 Ų10240%0.460%0.596SS.*Hα-helixtrans-69.4-44178.9-63.5174.3000109.9Y8 S9 L10 V14 A15 I16Y8-I12 HydrophobicContact CD1-CG2 4.39Å; S9-I12 WeakPolarHBondContact O-CB 3.46Å; S9-I12 PolarHBondContact O-N 3.47Å; S9-I12 WeakPolarHBondContact OG-CD1 3.35Å; S9-I12 WeakPolarHBondContact OG-CG1 3.49Å; L10-I12 VanDerWaalsContact C-N 3.29Å; L10-I12 PolarHBondContact O-N 3.26Å; I12-V14 VanDerWaalsContact C-N 3.34Å; I12-V14 PolarHBondContact O-N 2.8Å; I12-A15 PolarHBondContact O-N 3.1Å; I12-I16 HydrophobicContact CG2-CD1 3.7Å; I12-I16 HydrophobicContact CG2-CG1 4.37Å; I12-I16 WeakPolarHBondContact O-CB 3.44Å; I12-I16 WeakPolarHBondContact O-CG1 3.45Å; I12-I16 PolarHBondContact O-N 3.44Å
13V81Confident75Confident66 Ų6698.3 Ų98.340%0.458%0.582SS.*Hα-helixtrans-63.8-42.3178.1-176.70000110.7S9 L10 I16 L17S9-V13 PolarHBondContact O-N 2.95Å; L10-V13 PolarHBondContact O-N 3.23Å; V13-I16 PolarHBondContact O-N 2.81Å; V13-L17 HydrophobicContact CG1-CD1 4.41Å; V13-L17 PolarHBondContact O-N 3.05Å; V13-L17 VanDerWaalsContact O-N 3.14Å
14V82.4Confident77.4Confident91 Ų9197.1 Ų97.155%0.55257%0.57SS**Hα-helixtrans-63.8-44176.2175.40000111L10 I12 I16 L17 F18L10-V14 WeakPolarHBondContact O-CG2 3.21Å; L10-V14 PolarHBondContact O-N 3.25Å; L10-V14 VanDerWaalsContact O-N 3.07Å; I12-V14 VanDerWaalsContact C-N 3.34Å; I12-V14 PolarHBondContact O-N 2.8Å; V14-I16 PolarHBondContact O-N 3.02Å; V14-L17 PolarHBondContact O-N 3.45Å; V14-F18 WeakPolarHBondContact O-CB 3.33Å; V14-F18 PolarHBondContact O-N 3.14Å
15A83.4Confident79.6Confident49 Ų4998.3 Ų98.341%0.40556%0.561SS.*Hα-helixtrans-62-43177.100000112P11 I12 L17 F18 V19P11-A15 VanDerWaalsContact O-CB 3.32Å; P11-A15 WeakPolarHBondContact O-CB 3.22Å; P11-A15 PolarHBondContact O-N 3.34Å; I12-A15 PolarHBondContact O-N 3.1Å; A15-L17 VanDerWaalsContact C-N 3.27Å; A15-L17 PolarHBondContact O-N 2.8Å; A15-F18 PolarHBondContact O-N 2.71Å; A15-V19 WeakPolarHBondContact O-CB 3.28Å; A15-V19 WeakPolarHBondContact O-CG2 3.49Å; A15-V19 PolarHBondContact O-N 2.79Å
16I86.3Confident81.6Confident109 Ų10994.2 Ų94.256%0.55955%0.545SS*.Hα-helixtrans-62.4-33.8178.9-70167.5000111.8I12 V13 V14 P20I12-I16 HydrophobicContact CG2-CD1 3.7Å; I12-I16 HydrophobicContact CG2-CG1 4.37Å; I12-I16 WeakPolarHBondContact O-CB 3.44Å; I12-I16 WeakPolarHBondContact O-CG1 3.45Å; I12-I16 PolarHBondContact O-N 3.44Å; V13-I16 PolarHBondContact O-N 2.81Å; V14-I16 PolarHBondContact O-N 3.02Å; I16-P20 WeakPolarHBondContact O-CD 3.45Å; I16-P20 WeakPolarHBondContact O-CG 3.31Å
17L85.6Confident83.5Confident121 Ų12195.4 Ų95.463%0.63454%0.539SS*.Hα-helixtrans-85-36.6177.5-68.4175.6000113.3V13 V14 A15 P20V13-L17 HydrophobicContact CG1-CD1 4.41Å; V13-L17 PolarHBondContact O-N 3.05Å; V13-L17 VanDerWaalsContact O-N 3.14Å; V14-L17 PolarHBondContact O-N 3.45Å; A15-L17 VanDerWaalsContact C-N 3.27Å; A15-L17 PolarHBondContact O-N 2.8Å; L17-P20 WeakPolarHBondContact O-CD 3.48Å; L17-P20 WeakPolarHBondContact O-CG 3.34Å
18F88.4Confident85.2Confident136 Ų13696.4 Ų96.460%0.59653%0.527SS*.Hα-helixtrans-75.2-40.6-174.4-170.8-103.5000112.4V14 A15 A21 V22V14-F18 WeakPolarHBondContact O-CB 3.33Å; V14-F18 PolarHBondContact O-N 3.14Å; A15-F18 PolarHBondContact O-N 2.71Å; F18-A21 PolarHBondContact O-N 2.86Å; F18-V22 HydrophobicContact CD1-CG2 3.85Å; F18-V22 HydrophobicContact CD2-CG2 4.5Å; F18-V22 HydrophobicContact CE1-CG2 3.47Å; F18-V22 VanDerWaalsContact CE1-CG2 3.47Å; F18-V22 HydrophobicContact CE2-CG2 4.17Å; F18-V22 HydrophobicContact CG-CG2 4.35Å; F18-V22 HydrophobicContact CZ-CG2 3.65Å; F18-V22 WeakPolarHBondContact O-CG2 3.29Å; F18-V22 PolarHBondContact O-N 3.46Å
19V89.6Confident86.4Confident96 Ų9690.2 Ų90.258%0.58251%0.509SS*.Hα-helixtrans-56.6-51179.8172.40000113A15 A21 V22 L23A15-V19 WeakPolarHBondContact O-CB 3.28Å; A15-V19 WeakPolarHBondContact O-CG2 3.49Å; A15-V19 PolarHBondContact O-N 2.79Å; V19-A21 VanDerWaalsContact C-N 3.35Å; V19-A21 PolarHBondContact O-N 2.98Å; V19-V22 PolarHBondContact O-N 2.99Å; V19-L23 WeakPolarHBondContact O-CB 3.4Å; V19-L23 PolarHBondContact O-N 2.8Å
20P91.9Very high87.2Confident63 Ų6391.2 Ų91.241%0.40951%0.512SS..Hα-helixtrans-66.7-34.7178.323.9-32.4000112.6I16 L17 L23 V24I16-P20 WeakPolarHBondContact O-CD 3.45Å; I16-P20 WeakPolarHBondContact O-CG 3.31Å; L17-P20 WeakPolarHBondContact O-CD 3.48Å; L17-P20 WeakPolarHBondContact O-CG 3.34Å; P20-L23 PolarHBondContact O-N 2.88Å; P20-V24 VanDerWaalsContact O-CG2 3.32Å; P20-V24 WeakPolarHBondContact O-CG2 3.21Å; P20-V24 PolarHBondContact O-N 3.3Å
21A90.6Very high88.1Confident60 Ų6087.2 Ų87.250%0.49650%0.5SS..Hα-helixtrans-63.1-44.8177.500000111.9F18 V19 V24 F25F18-A21 PolarHBondContact O-N 2.86Å; V19-A21 VanDerWaalsContact C-N 3.35Å; V19-A21 PolarHBondContact O-N 2.98Å; A21-V24 PolarHBondContact O-N 3.41Å; A21-F25 PolarHBondContact O-N 2.87Å
22V93.2Very high88.3Confident57 Ų5786.2 Ų86.235%0.34550%0.495SS..Hα-helixtrans-64.8-40.8175.61760000111F18 V19 V24 F25 L26F18-V22 HydrophobicContact CD1-CG2 3.85Å; F18-V22 HydrophobicContact CD2-CG2 4.5Å; F18-V22 HydrophobicContact CE1-CG2 3.47Å; F18-V22 VanDerWaalsContact CE1-CG2 3.47Å; F18-V22 HydrophobicContact CE2-CG2 4.17Å; F18-V22 HydrophobicContact CG-CG2 4.35Å; F18-V22 HydrophobicContact CZ-CG2 3.65Å; F18-V22 WeakPolarHBondContact O-CG2 3.29Å; F18-V22 PolarHBondContact O-N 3.46Å; V19-V22 PolarHBondContact O-N 2.99Å; V22-V24 PolarHBondContact O-N 3.33Å; V22-F25 PolarHBondContact O-N 3.49Å; V22-L26 HydrophobicContact CG1-CD1 4.13Å; V22-L26 HydrophobicContact CG1-CG 4.38Å; V22-L26 WeakPolarHBondContact O-CG 3.33Å; V22-L26 PolarHBondContact O-N 2.85Å
23L93.4Very high88.2Confident106 Ų10686.1 Ų86.156%0.55550%0.501SS*.Hα-helixtrans-61.1-45.4177.7-171.371.2000111.8V19 P20 L26 L27V19-L23 WeakPolarHBondContact O-CB 3.4Å; V19-L23 PolarHBondContact O-N 2.8Å; P20-L23 PolarHBondContact O-N 2.88Å; L23-L26 PolarHBondContact O-N 3.37Å; L23-L27 WeakPolarHBondContact O-CG 3.29Å; L23-L27 PolarHBondContact O-N 3.44Å
24V93.8Very high87.7Confident84 Ų8491.9 Ų91.951%0.50952%0.515SS..Hα-helixtrans-62.2-43.6176.6172.20000111P20 A21 V22 L26 L27 I28P20-V24 VanDerWaalsContact O-CG2 3.32Å; P20-V24 WeakPolarHBondContact O-CG2 3.21Å; P20-V24 PolarHBondContact O-N 3.3Å; A21-V24 PolarHBondContact O-N 3.41Å; V22-V24 PolarHBondContact O-N 3.33Å; V24-L26 PolarHBondContact O-N 3.41Å; V24-L27 PolarHBondContact O-N 3.07Å; V24-I28 HydrophobicContact CG1-CD1 3.96Å; V24-I28 WeakPolarHBondContact O-CG1 3.44Å; V24-I28 PolarHBondContact O-N 2.8Å
25F93.2Very high86.5Confident133 Ų13391.2 Ų91.258%0.58352%0.515SS*.Hα-helixtrans-60.3-45.5176.9-175-98.3000112A21 V22 L27 I28 C29A21-F25 PolarHBondContact O-N 2.87Å; V22-F25 PolarHBondContact O-N 3.49Å; F25-L27 PolarHBondContact O-N 3.08Å; F25-I28 PolarHBondContact O-N 3.02Å; F25-C29 PolarHBondContact O-N 2.79Å; F25-C29 PolarHBondContact O-SG 3Å
26L92.7Very high85.2Confident97 Ų9797.3 Ų97.351%0.50853%0.532SS..Hα-helixtrans-62.3-40.8176.5-71175.9000112.4V22 L23 V24 I28 C29 V30V22-L26 HydrophobicContact CG1-CD1 4.13Å; V22-L26 HydrophobicContact CG1-CG 4.38Å; V22-L26 WeakPolarHBondContact O-CG 3.33Å; V22-L26 PolarHBondContact O-N 2.85Å; L23-L26 PolarHBondContact O-N 3.37Å; V24-L26 PolarHBondContact O-N 3.41Å; L26-I28 VanDerWaalsContact C-N 3.34Å; L26-I28 PolarHBondContact O-N 3.28Å; L26-C29 PolarHBondContact O-N 3.41Å; L26-V30 WeakPolarHBondContact O-CG2 3.44Å; L26-V30 PolarHBondContact O-N 3.27Å
27L92.9Very high83.5Confident111 Ų11197.7 Ų97.758%0.58154%0.54SS*.Hα-helixtrans-62.3-40.9176-71.7174000112L23 V24 F25 V30 A31L23-L27 WeakPolarHBondContact O-CG 3.29Å; L23-L27 PolarHBondContact O-N 3.44Å; V24-L27 PolarHBondContact O-N 3.07Å; F25-L27 PolarHBondContact O-N 3.08Å; L27-V30 PolarHBondContact O-N 3.46Å; L27-A31 WeakPolarHBondContact O-CB 3.49Å; L27-A31 PolarHBondContact O-N 3.01Å
28I91Very high81.8Confident93 Ų93103 Ų10348%0.47755%0.551SS.*Hα-helixtrans-63.2-46.9174.8-65.8165.4000110.2V24 F25 L26 V30 A31 C32V24-I28 HydrophobicContact CG1-CD1 3.96Å; V24-I28 WeakPolarHBondContact O-CG1 3.44Å; V24-I28 PolarHBondContact O-N 2.8Å; F25-I28 PolarHBondContact O-N 3.02Å; L26-I28 VanDerWaalsContact C-N 3.34Å; L26-I28 PolarHBondContact O-N 3.28Å; I28-V30 VanDerWaalsContact C-N 3.32Å; I28-V30 PolarHBondContact O-N 2.89Å; I28-A31 PolarHBondContact O-N 3.45Å; I28-C32 WeakPolarHBondContact O-CB 3.3Å; I28-C32 PolarHBondContact O-N 3.22Å; I28-C32 PolarHBondContact O-SG 3.31Å
29C89Confident79.9Confident49 Ų49106.1 Ų106.133%0.33157%0.565SS.*Hα-helixtrans-59-41.5177.6-68.30000112.5F25 L26 S33F25-C29 PolarHBondContact O-N 2.79Å; F25-C29 PolarHBondContact O-SG 3Å; L26-C29 PolarHBondContact O-N 3.41Å; C29-S33 VanDerWaalsContact O-CB 3.31Å; C29-S33 WeakPolarHBondContact O-CB 3.22Å; C29-S33 PolarHBondContact O-N 3.23Å; C29-S33 PolarHBondContact O-OG 3.47Å
30V88.7Confident77.7Confident80 Ų80104.9 Ų104.949%0.48557%0.571SS.*Hα-helixtrans-66.6-42.8176.3172.40000111.2L26 L27 I28 S33 R34L26-V30 WeakPolarHBondContact O-CG2 3.44Å; L26-V30 PolarHBondContact O-N 3.27Å; L27-V30 PolarHBondContact O-N 3.46Å; I28-V30 VanDerWaalsContact C-N 3.32Å; I28-V30 PolarHBondContact O-N 2.89Å; V30-S33 PolarHBondContact O-N 2.67Å; V30-R34 WeakPolarHBondContact O-CB 3.46Å; V30-R34 WeakPolarHBondContact O-CG 3.26Å; V30-R34 PolarHBondContact O-N 2.85Å
31A84.9Confident75.2Confident62 Ų62111.9 Ų111.951%0.51260%0.595SS.*Hα-helixtrans-61.7-45.4175.900000111.7L27 I28 S33 R34 S35L27-A31 WeakPolarHBondContact O-CB 3.49Å; L27-A31 PolarHBondContact O-N 3.01Å; I28-A31 PolarHBondContact O-N 3.45Å; A31-S33 PolarHBondContact O-N 2.87Å; A31-R34 PolarHBondContact O-N 2.86Å; A31-S35 PolarHBondContact O-N 2.85Å; A31-S35 VanDerWaalsContact O-N 3.12Å
32C82Confident72.7Confident69 Ų69113.4 Ų113.447%0.46661%0.608SS.*Hα-helixtrans-62.6-41.7176-68.60000111.8I28 S35I28-C32 WeakPolarHBondContact O-CB 3.3Å; I28-C32 PolarHBondContact O-N 3.22Å; I28-C32 PolarHBondContact O-SG 3.31Å; C32-S35 PolarHBondContact O-N 3.41Å; C32-S35 PolarHBondContact O-OG 2.97Å
33S79.1Confident70Confident76 Ų76116.9 Ų116.953%0.53163%0.629SS.*Hα-helixtrans-68.4-38.2179.4-59.20000112.7C29 V30 A31 S35 K36 T37C29-S33 VanDerWaalsContact O-CB 3.31Å; C29-S33 WeakPolarHBondContact O-CB 3.22Å; C29-S33 PolarHBondContact O-N 3.23Å; C29-S33 PolarHBondContact O-OG 3.47Å; V30-S33 PolarHBondContact O-N 2.67Å; A31-S33 PolarHBondContact O-N 2.87Å; S33-S35 VanDerWaalsContact C-N 3.31Å; S33-S35 PolarHBondContact O-N 3.24Å; S33-K36 PolarHBondContact O-N 3.31Å; S33-T37 PolarHBondContact O-OG1 3.05Å
34R70.2Confident67.4Low187 Ų187118 Ų11871%0.70664%0.64SS**Hα-helixtrans-68.9-27.8175.2-77-169.8169.4-175.5-1.1113.3V30 A31 K36 T37V30-R34 WeakPolarHBondContact O-CB 3.46Å; V30-R34 WeakPolarHBondContact O-CG 3.26Å; V30-R34 PolarHBondContact O-N 2.85Å; A31-R34 PolarHBondContact O-N 2.86Å; R34-K36 VanDerWaalsContact C-N 3.32Å; R34-K36 PolarHBondContact O-N 3.4Å; R34-T37 PolarHBondContact O-OG1 2.91Å
35S57.2Low64.8Low77 Ų77121 Ų12154%0.53865%0.653SS.*Hα-helixtrans-69.4-29.7177.377.20000113.2A31 C32 S33A31-S35 PolarHBondContact O-N 2.85Å; A31-S35 VanDerWaalsContact O-N 3.12Å; C32-S35 PolarHBondContact O-N 3.41Å; C32-S35 PolarHBondContact O-OG 2.97Å; S33-S35 VanDerWaalsContact C-N 3.31Å; S33-S35 PolarHBondContact O-N 3.24Å
36K55.4Low61.9Low178 Ų178122.4 Ų122.477%0.77467%0.667SS**Hα-helixtrans-82.2-24.2-178-70.1-176.4178.2179.80113.6S33 R34S33-K36 PolarHBondContact O-N 3.31Å; R34-K36 VanDerWaalsContact C-N 3.32Å; R34-K36 PolarHBondContact O-N 3.4Å
37T50.7Low59.1Low116 Ų116120.8 Ų120.871%0.71267%0.674SS**THydrogen-bonded Turntrans-86.1-5.3-175.740.30000115.1S33 R34S33-T37 PolarHBondContact O-OG1 3.05Å; R34-T37 PolarHBondContact O-OG1 2.91Å
38R49.6Very low56.5Low232 Ų232124.2 Ų124.288%0.87569%0.686SS**THydrogen-bonded Turntrans-95.9-0.2-178-94.8-171.6176.8-164.6-0.3116.6
39K48Very low53.8Low203 Ų203129.6 Ų129.688%0.88371%0.706SS**SBendtrans-111.814.7-171.8-76.1-170.7174.8-179.50116.9
40G43.2Very low51.5Low70 Ų70133.2 Ų133.272%0.72273%0.727SS**  trans-14756-173.600000115.5
41K39.9Very low48.9Very low210 Ų210136.7 Ų136.791%0.91374%0.742SS**  trans-101.178.5157.5-87.2-173173.4-175.10108V43K41-V43 PolarHBondContact O-N 2.88Å
42A37.6Very low46.4Very low92 Ų92138 Ų13876%0.7676%0.762SS**  trans-77.2109.1164.100000107V44A42-V44 PolarHBondContact O-N 2.9Å
43V37.3Very low43.9Very low130 Ų130137.9 Ų137.979%0.78877%0.773SS**  trans-60.1113.3169.7174.40000107K41 D45K41-V43 PolarHBondContact O-N 2.88Å; V43-D45 PolarHBondContact O-N 3.24Å
44V40Very low41.7Very low129 Ų129140.4 Ų140.478%0.78278%0.78SS**  trans-81100.7166.21780000105.2A42 D46A42-V44 PolarHBondContact O-N 2.9Å; V44-D46 PolarHBondContact O-N 3.1Å
45D37.5Very low40Very low148 Ų148137.7 Ų137.779%0.79179%0.789SS**  trans-76113.4170.2-159.328.8000107.3V43 G47V43-D45 PolarHBondContact O-N 3.24Å; D45-G47 PolarHBondContact O-N 3.31Å
46D33.6Very low38.9Very low162 Ų162138.7 Ų138.787%0.86680%0.795SS**  trans-86.694.5-175-142.2-14.3000106.9V44V44-D46 PolarHBondContact O-N 3.1Å
47G34.2Very low37.8Very low63 Ų63137.8 Ų137.865%0.64979%0.792SS**  trans-164.5104.9-168.600000114.6D45D45-G47 PolarHBondContact O-N 3.31Å
48E37.2Very low37.1Very low182 Ų182138.1 Ų138.185%0.8579%0.793SS**  trans95104.8151.1-143.1170.8132.800118.1V50E48-V50 PolarHBondContact O-N 3.48Å
49K34.9Very low36.2Very low207 Ų207133.4 Ų133.490%0.978%0.781SS**  trans-52111.4165.6-65169.4175.61750110.6
50V40.6Very low35.7Very low125 Ų125129.8 Ų129.876%0.75877%0.77SS**  trans-123.7116.9161.4-173.40000108.9E48E48-V50 PolarHBondContact O-N 3.48Å
51N33.6Very low35.4Very low152 Ų152134.2 Ų134.281%0.81377%0.77SS**  trans-53.3149.7177.9-70.3-44000112.1G53N51-G53 PolarHBondContact O-N 3.48Å
52G32Very low35.1Very low90 Ų90131.7 Ų131.793%0.92877%0.767SS**SBendtrans-14.9110.8-179.600000117
53G30.2Very low35Very low67 Ų67136.1 Ų136.169%0.69177%0.765SS**  trans-154.4122.617600000111N51N51-G53 PolarHBondContact O-N 3.48Å
54D32Very low34.8Very low129 Ų129140.8 Ų140.869%0.6977%0.768SS**  trans3093.4156.3-80.5-34.6000118.3S56D54-S56 PolarHBondContact O-N 2.87Å; D54-S56 VanDerWaalsContact O-N 3.08Å
55C35.1Very low34.4Very low130 Ų130143.3 Ų143.388%0.87878%0.776SS**THydrogen-bonded Turntrans-69.66.3164.3-62.50000113.8K57C55-K57 VanDerWaalsContact C-N 3.32Å; C55-K57 PolarHBondContact O-N 2.9Å
56S34.7Very low34.4Very low97 Ų97142.9 Ų142.968%0.67877%0.774SS**THydrogen-bonded Turntrans-86.64-178.978.50000114.5D54D54-S56 PolarHBondContact O-N 2.87Å; D54-S56 VanDerWaalsContact O-N 3.08Å
57K33Very low34.4Very low160 Ų160140.3 Ų140.370%0.69677%0.766SS**  trans-128.754.3-178.9-70-178.8-179.4168.80112.8C55 Q59C55-K57 VanDerWaalsContact C-N 3.32Å; C55-K57 PolarHBondContact O-N 2.9Å; K57-Q59 PolarHBondContact O-N 2.73Å
58V34.6Very low34.2Very low123 Ų123146.2 Ų146.275%0.74578%0.776SS**  trans-75.488.5157.6-173.40000106.9L60V58-L60 PolarHBondContact O-N 2.77Å
59Q31.5Very low34.2Very low133 Ų133143.9 Ų143.962%0.62177%0.768SS**  trans-62110.5169.3-76-174.82500107.9K57 K61K57-Q59 PolarHBondContact O-N 2.73Å; Q59-K61 HydrophobicContact CB-CG 4.42Å; Q59-K61 PolarHBondContact O-N 2.98Å
60L37.7Very low33.8Very low126 Ų126142.1 Ų142.166%0.6676%0.763SS**  trans-70.362.3165.5-70.8161.8000109.4V58 N62 Y63V58-L60 PolarHBondContact O-N 2.77Å; L60-N62 PolarHBondContact O-N 2.83Å; L60-Y63 HydrophobicContact CB-CD2 3.99Å; L60-Y63 HydrophobicContact CB-CE2 3.84Å; L60-Y63 HydrophobicContact CD1-CE2 4.21Å; L60-Y63 HydrophobicContact CD2-CE2 3.62Å; L60-Y63 HydrophobicContact CG-CE2 4.07Å
61K36.1Very low33.6Very low163 Ų163143 Ų14371%0.70976%0.762SS**  trans-76.776.8165.1-88-179.2172.8172.70107.1Q59Q59-K61 HydrophobicContact CB-CG 4.42Å; Q59-K61 PolarHBondContact O-N 2.98Å
62N33.7Very low33.3Very low158 Ų158141.7 Ų141.785%0.84576%0.76SS**  trans171.760.9158.7-84.6-27000109.9L60L60-N62 PolarHBondContact O-N 2.83Å
63Y36.5Very low33.4Very low185 Ų185148.6 Ų148.673%0.72576%0.758SS**SBendtrans-117.6127.2158-74.1-91000108.2L60L60-Y63 HydrophobicContact CB-CD2 3.99Å; L60-Y63 HydrophobicContact CB-CE2 3.84Å; L60-Y63 HydrophobicContact CD1-CE2 4.21Å; L60-Y63 HydrophobicContact CD2-CE2 3.62Å; L60-Y63 HydrophobicContact CG-CE2 4.07Å
64R33.1Very low33.3Very low228 Ų228151.7 Ų151.786%0.8676%0.763SS**  trans-12.9125.6170.7-94170.9166.5172.3-5.1113.3L66R64-L66 VanDerWaalsContact C-N 3.27Å; R64-L66 PolarHBondContact O-N 2.72Å
65L30.5Very low33.2Very low181 Ų181151.2 Ų151.295%0.94877%0.767SS**  trans-47.899.7151-104.286.6000107.6
66L37.6Very low33Very low140 Ų140149.9 Ų149.973%0.73376%0.759SS**  trans-71.4146.5154.5-80.6105.8000106.8R64 E68R64-L66 VanDerWaalsContact C-N 3.27Å; R64-L66 PolarHBondContact O-N 2.72Å; L66-E68 PolarHBondContact O-N 3.49Å
67P34.5Very low32.6Very low108 Ų108150.8 Ų150.870%0.70177%0.765SS**  trans-52.9136.3178.922.3-31.7000109.6I69P67-I69 VanDerWaalsContact C-N 3.34Å; P67-I69 PolarHBondContact O-N 3.42Å
68E30.2Very low32.5Very low187 Ų187147.2 Ų147.287%0.87477%0.766SS**  trans-60.188.7-174.9-167.9174.9-163.300110.6L66 Q70L66-E68 PolarHBondContact O-N 3.49Å; E68-Q70 PolarHBondContact O-N 2.92Å
69I35.8Very low32.3Very low133 Ų133145.9 Ų145.968%0.68277%0.768SS**  trans-85.1109.2170.1-61.9167000106P67 I71P67-I69 VanDerWaalsContact C-N 3.34Å; P67-I69 PolarHBondContact O-N 3.42Å; I69-I71 HydrophobicContact CG2-CG1 4.3Å; I69-I71 PolarHBondContact O-N 3.44Å
70Q26.3Very low32.3Very low170 Ų170145.4 Ų145.479%0.79477%0.774SS**  trans-61.8104.5173-69.8-178.318.300109.5E68E68-Q70 PolarHBondContact O-N 2.92Å
71I36.7Very low31.8Very low143 Ų143148.4 Ų148.473%0.73379%0.785SS**  trans-98.499.4170.6-57.5173000107.5I69 R73I69-I71 HydrophobicContact CG2-CG1 4.3Å; I69-I71 PolarHBondContact O-N 3.44Å; I71-R73 PolarHBondContact O-N 3.3Å; I71-R73 VanDerWaalsContact O-N 3.15Å
72T28.6Very low31.6Very low124 Ų124147.5 Ų147.576%0.76179%0.793SS**  trans-66.4106.4171.3-33.90000108.7V74T72-V74 PolarHBondContact O-N 3.28Å
73R32.6Very low31.4Very low235 Ų235151.6 Ų151.689%0.88780%0.797SS**PPolyproline II helixtrans-74.2119173.2-79.2-176.5178.1158.3-0.3109.8I71I71-R73 PolarHBondContact O-N 3.3Å; I71-R73 VanDerWaalsContact O-N 3.15Å
74V29.4Very low31Very low133 Ų133147.9 Ų147.981%0.80680%0.797SS**PPolyproline II helixtrans-97.6122.9164.1-175.50000108.1T72T72-V74 PolarHBondContact O-N 3.28Å
75P28.5Very low30.7Very low118 Ų118141.6 Ų141.677%0.76679%0.789SS**PPolyproline II helixtrans-92.9135.6-179.534.6-28.9000111.1
76S31.7Very low30.6Very low102 Ų102140.6 Ų140.671%0.71378%0.784SS**  trans-165.3111.6162.3169.20000105.6
77S26.7Very low30.2Very low116 Ų116141 Ų14181%0.81179%0.792SS**  cis58.873.242.587.60000114.2
78A30.5Very low30Very low85 Ų85140.4 Ų140.470%0.70279%0.791SS**  trans-167.3114.1149.500000106.2
79A31.2Very low30Very low95 Ų95139.3 Ų139.379%0.78579%0.79SS**  73.4126.696.700000111.2
80T30.4Very low29.6Very low124 Ų124143 Ų14376%0.76180%0.795SS**  cis-163.1152.23.9-57.50000106.4T82T80-T82 PolarHBondContact O-N 3.41Å
81Q27.6Very low29.8Very low189 Ų189141.1 Ų141.188%0.88380%0.795SS**  trans-51119.9172.2-164.817651.800112.7
82T31.2Very low29.7Very low143 Ų143140.5 Ų140.588%0.87780%0.798SS**  trans-139.9132.7160-5.70000111.2T80T80-T82 PolarHBondContact O-N 3.41Å
83R29.2Very low29.8Very low245 Ų245143.3 Ų143.393%0.92580%0.802SS**  trans-80.6145.5-167.3-144.6176.7-175.4173.9-0.5109.7
84S28.7Very low29.8Very low106 Ų106141.5 Ų141.574%0.74180%0.801SS**SBendtrans78.3103.7163.5-1400000117.3
85S27.2Very low30.2Very low97 Ų97142.3 Ų142.368%0.67881%0.806SS**  trans38.889.1133.660.90000117.2
86D28.8Very low30.3Very low160 Ų160143.8 Ų143.886%0.85681%0.807SS**  trans-171.8104.4137.2-95.6-28.6000108.5S88D86-S88 VanDerWaalsContact C-N 3.26Å; D86-S88 PolarHBondContact O-N 2.88Å
87V29.1Very low30.6Very low149 Ų149147.8 Ų147.890%0.90382%0.815SS**  trans-72.489.1172.6176.60000107.2L89V87-L89 PolarHBondContact O-N 2.92Å
88S29.2Very low30.9Very low95 Ų95150.6 Ų150.666%0.66482%0.819SS**  trans-68.296.7172.51660000110.1D86 R90D86-S88 VanDerWaalsContact C-N 3.26Å; D86-S88 PolarHBondContact O-N 2.88Å; S88-R90 PolarHBondContact O-N 3.36Å
89L30.2Very low30.9Very low164 Ų164149.9 Ų149.986%0.85982%0.82SS**  trans-43.598.5145.8-86.6143.3000110.1V87V87-L89 PolarHBondContact O-N 2.92Å
90R28.9Very low31.1Very low210 Ų210154.1 Ų154.179%0.79283%0.829SS**  trans-165.2126.1158.2-111.2167.7-170.2-179.24107.6S88S88-R90 PolarHBondContact O-N 3.36Å
91T30.1Very low31.1Very low130 Ų130151.8 Ų151.880%0.79883%0.83SS**  trans69.1121.9161.762.50000112.5
92V35Very low31.5Very low131 Ų131146.2 Ų146.279%0.79482%0.823SS**  -157.4102.566172.70000107.6
93H29.1Very low31.9Very low183 Ų183145.6 Ų145.685%0.84781%0.814SS**  trans-36.9147.7146.5-87.2-97.6000110.5
94K33.5Very low32.5Very low197 Ų197137.7 Ų137.786%0.85779%0.794SS**  trans107.942.8158.3-147.7-176.6-162.1-177.60117.7
95V37.3Very low33.4Very low150 Ų150136.1 Ų136.191%0.90979%0.787SS**  trans-129.948.2155.6-159.40000110.5
96D31.9Very low34.1Very low148 Ų148137.6 Ų137.679%0.79179%0.788SS**  trans-111.790.4164-169.722.8000104.8
97Q36.1Very low34.7Very low187 Ų187132.3 Ų132.387%0.87476%0.763SS**SBendtrans-177.8-7.2160.2-106.9163.959.500118
98L34Very low35.5Very low174 Ų174130.1 Ų130.191%0.91175%0.746SS**SBendtrans-136.779.2-176.7-81.7152.6000112.6
99G29.5Very low36.5Very low70 Ų70129.6 Ų129.672%0.72274%0.739SS**SBendtrans53.1108.314600000119
100L35.5Very low37.3Very low184 Ų184127.9 Ų127.996%0.96372%0.722SS**SBendtrans71.654.4171.7-63.6134.2000113.8G102L100-G102 PolarHBondContact O-N 3.41Å
101G31.4Very low38.3Very low76 Ų76123.2 Ų123.278%0.78471%0.709SS**  trans-58.5115.7176.900000112.5L103G101-L103 PolarHBondContact O-N 3.33Å
102G35Very low39.4Very low71 Ų71121.1 Ų121.173%0.73269%0.692SS**PPolyproline II helixtrans-53.9120.616700000109.6L100 P104L100-G102 PolarHBondContact O-N 3.41Å; G102-P104 WeakPolarHBondContact O-CD 3.17Å; G102-P104 VanDerWaalsContact O-N 3.13Å
103L40.5Very low40.4Very low131 Ų131118.9 Ų118.969%0.68667%0.673SS**PPolyproline II helixtrans-52.1120.3168.8-82.4157.9000107.1G101 A105G101-L103 PolarHBondContact O-N 3.33Å; L103-A105 PolarHBondContact O-N 3.37Å
104P42.5Very low41.7Very low78 Ų78114.5 Ų114.551%0.50665%0.653SS.*PPolyproline II helixtrans-56.8132.8176.621.3-28.3000107.2G102 D106 S107G102-P104 WeakPolarHBondContact O-CD 3.17Å; G102-P104 VanDerWaalsContact O-N 3.13Å; P104-D106 HydrophobicContact CB-CB 4.45Å; P104-D106 PolarHBondContact O-N 3.12Å; P104-S107 WeakPolarHBondContact O-CB 3.47Å; P104-S107 PolarHBondContact O-N 3.39Å
105A45.7Very low42.8Very low74 Ų74108.9 Ų108.961%0.61264%0.635SS**Hα-helixtrans-52.1-24.2176.200000111.6L103 L108 T109L103-A105 PolarHBondContact O-N 3.37Å; A105-L108 PolarHBondContact O-N 2.91Å; A105-T109 PolarHBondContact O-N 3.1Å; A105-T109 PolarHBondContact O-OG1 3.13Å
106D43.6Very low43.8Very low128 Ų128108.6 Ų108.668%0.68462%0.624SS**Hα-helixtrans-68.2-31.4175.4-53.2-15.2000113.1P104 T109 Y110P104-D106 HydrophobicContact CB-CB 4.45Å; P104-D106 PolarHBondContact O-N 3.12Å; D106-T109 WeakPolarHBondContact CA-OG1 3.23Å; D106-T109 PolarHBondContact O-OG1 3.06Å; D106-Y110 VanDerWaalsContact O-CB 3.25Å; D106-Y110 WeakPolarHBondContact O-CB 3.22Å; D106-Y110 PolarHBondContact O-N 3.29Å
107S41Very low44.8Very low49 Ų49108.1 Ų108.134%0.34361%0.611SS.*Hα-helixtrans-75.2-34.9175.6-176.90000111.8P104 E111P104-S107 WeakPolarHBondContact O-CB 3.47Å; P104-S107 PolarHBondContact O-N 3.39Å; S107-E111 WeakPolarHBondContact O-CB 3.2Å; S107-E111 VanDerWaalsContact O-CG 3.22Å; S107-E111 WeakPolarHBondContact O-CG 3.41Å; S107-E111 PolarHBondContact O-N 3.03Å
108L45.5Very low45.6Very low103 Ų103102.9 Ų102.954%0.53960%0.595SS.*Hα-helixtrans-78.2-33.4-179.1-148.6143.6000111.2A105 L112A105-L108 PolarHBondContact O-N 2.91Å; L108-L112 HydrophobicContact CD2-CD1 3.87Å; L108-L112 WeakPolarHBondContact O-CB 3.16Å; L108-L112 WeakPolarHBondContact O-CG 3.33Å; L108-L112 PolarHBondContact O-N 3.34Å
109T49.3Very low46.3Very low84 Ų84100.1 Ų100.152%0.51558%0.581SS.*Hα-helixtrans-69.1-38.6169.137.90000112.1A105 D106 L112 E113A105-T109 PolarHBondContact O-N 3.1Å; A105-T109 PolarHBondContact O-OG1 3.13Å; D106-T109 WeakPolarHBondContact CA-OG1 3.23Å; D106-T109 PolarHBondContact O-OG1 3.06Å; T109-L112 PolarHBondContact O-N 2.7Å; T109-E113 VanDerWaalsContact O-CB 3.31Å; T109-E113 WeakPolarHBondContact O-CB 3.3Å; T109-E113 PolarHBondContact O-N 3.25Å
110Y48.5Very low47.2Very low128 Ų128100.2 Ų100.250%0.50258%0.575SS.*Hα-helixtrans-64.4-43.7174.3-174.6-99000112.7D106 E113 Q114D106-Y110 VanDerWaalsContact O-CB 3.25Å; D106-Y110 WeakPolarHBondContact O-CB 3.22Å; D106-Y110 PolarHBondContact O-N 3.29Å; Y110-E113 PolarHBondContact O-N 3.42Å; Y110-Q114 HydrophobicContact CD1-CG 4.37Å; Y110-Q114 HydrophobicContact CE1-CG 3.97Å; Y110-Q114 WeakPolarHBondContact O-CB 3.36Å; Y110-Q114 PolarHBondContact O-N 3.27Å; Y110-Q114 PolarHBondContact OH-NE2 3.27Å; Y110-Q114 VanDerWaalsContact OH-NE2 3.1Å
111E48.4Very low47.8Very low112 Ų11299.2 Ų99.252%0.52357%0.565SS.*Hα-helixtrans-62.1-44.6173.9-74.3-82145.800111.4S107 E113 Q114 V115S107-E111 WeakPolarHBondContact O-CB 3.2Å; S107-E111 VanDerWaalsContact O-CG 3.22Å; S107-E111 WeakPolarHBondContact O-CG 3.41Å; S107-E111 PolarHBondContact O-N 3.03Å; E111-E113 VanDerWaalsContact C-N 3.34Å; E111-E113 PolarHBondContact O-N 3.22Å; E111-Q114 PolarHBondContact O-N 3.45Å; E111-V115 WeakPolarHBondContact O-CB 3.39Å; E111-V115 VanDerWaalsContact O-CG2 3.28Å; E111-V115 WeakPolarHBondContact O-CG2 3.39Å; E111-V115 PolarHBondContact O-N 2.96Å
112L54.1Low48.4Very low85 Ų8599.2 Ų99.245%0.44555%0.553SS.*Hα-helixtrans-61.8-41.1174.7-87.8163.1000112.3L108 T109 V115 Q116 L145L108-L112 HydrophobicContact CD2-CD1 3.87Å; L108-L112 WeakPolarHBondContact O-CB 3.16Å; L108-L112 WeakPolarHBondContact O-CG 3.33Å; L108-L112 PolarHBondContact O-N 3.34Å; T109-L112 PolarHBondContact O-N 2.7Å; L112-V115 PolarHBondContact O-N 3.05Å; L112-Q116 WeakPolarHBondContact O-CB 3.39Å; L112-Q116 PolarHBondContact O-N 2.99Å; L112-L145 HydrophobicContact CD2-CD1 4.31Å
113E55.3Low48.7Very low85 Ų85102.3 Ų102.340%0.39755%0.553SS.*Hα-helixtrans-69.8-35.1178.4-152-168.2-166.500111.4T109 Y110 E111 R117T109-E113 VanDerWaalsContact O-CB 3.31Å; T109-E113 WeakPolarHBondContact O-CB 3.3Å; T109-E113 PolarHBondContact O-N 3.25Å; Y110-E113 PolarHBondContact O-N 3.42Å; E111-E113 VanDerWaalsContact C-N 3.34Å; E111-E113 PolarHBondContact O-N 3.22Å; E113-R117 WeakPolarHBondContact O-CB 3.03Å; E113-R117 WeakPolarHBondContact O-CG 3.32Å; E113-R117 PolarHBondContact O-N 2.85Å; E113-R117 IonicContact OE1-CZ 3.51Å; E113-R117 IonicContact OE1-NH1 3.62Å; E113-R117 IonicContact OE1-NH2 2.81Å; E113-R117 PolarHBondContact OE1-NH2 3.42Å; E113-R117 IonicContact OE2-CZ 3.57Å; E113-R117 IonicContact OE2-NH1 2.88Å; E113-R117 PolarHBondContact OE2-NH1 3.48Å; E113-R117 IonicContact OE2-NH2 3.44Å; E113-R117 PolarHBondContact OE2-NH2 3.5Å
114Q57.9Low48.5Very low91 Ų91104.4 Ų104.443%0.42556%0.559SS.*Hα-helixtrans-66.3-46.1171.7-85.4-154.27.600112.2Y110 E111 Q116 R117 S118Y110-Q114 HydrophobicContact CD1-CG 4.37Å; Y110-Q114 HydrophobicContact CE1-CG 3.97Å; Y110-Q114 WeakPolarHBondContact O-CB 3.36Å; Y110-Q114 PolarHBondContact O-N 3.27Å; Y110-Q114 PolarHBondContact OH-NE2 3.27Å; Y110-Q114 VanDerWaalsContact OH-NE2 3.1Å; E111-Q114 PolarHBondContact O-N 3.45Å; Q114-Q116 VanDerWaalsContact C-N 3.28Å; Q114-Q116 PolarHBondContact O-N 3.2Å; Q114-R117 PolarHBondContact O-N 3.16Å; Q114-S118 WeakPolarHBondContact O-CB 3.34Å; Q114-S118 PolarHBondContact O-N 3.1Å
115V56.1Low48.1Very low79 Ų79105.8 Ų105.848%0.47957%0.565SS.*Hα-helixtrans-63.2-39.7177.2172.30000110.1E111 L112 S118 L119E111-V115 WeakPolarHBondContact O-CB 3.39Å; E111-V115 VanDerWaalsContact O-CG2 3.28Å; E111-V115 WeakPolarHBondContact O-CG2 3.39Å; E111-V115 PolarHBondContact O-N 2.96Å; L112-V115 PolarHBondContact O-N 3.05Å; V115-S118 PolarHBondContact O-N 3.47Å; V115-L119 HydrophobicContact CG1-CD1 4.05Å; V115-L119 WeakPolarHBondContact O-CB 3.31Å; V115-L119 WeakPolarHBondContact O-CD1 3.46Å; V115-L119 PolarHBondContact O-N 3.34Å
116Q57.2Low47.3Very low143 Ų143108.5 Ų108.567%0.66858%0.575SS**Hα-helixtrans-67.2-39.8176.3-168.5175.9-3.600112.4L112 Q114 A120L112-Q116 WeakPolarHBondContact O-CB 3.39Å; L112-Q116 PolarHBondContact O-N 2.99Å; Q114-Q116 VanDerWaalsContact C-N 3.28Å; Q114-Q116 PolarHBondContact O-N 3.2Å; Q116-A120 VanDerWaalsContact O-CB 3.29Å; Q116-A120 WeakPolarHBondContact O-CB 3.46Å; Q116-A120 PolarHBondContact O-N 3.28Å
117R52.7Low46.6Very low138 Ų138106.3 Ų106.352%0.52158%0.575SS.*Hα-helixtrans-65.9-43.5172.4-77.8-177-177.7111.38.9111.6E113 Q114 L119 A120 E121E113-R117 WeakPolarHBondContact O-CB 3.03Å; E113-R117 WeakPolarHBondContact O-CG 3.32Å; E113-R117 PolarHBondContact O-N 2.85Å; E113-R117 IonicContact OE1-CZ 3.51Å; E113-R117 IonicContact OE1-NH1 3.62Å; E113-R117 IonicContact OE1-NH2 2.81Å; E113-R117 PolarHBondContact OE1-NH2 3.42Å; E113-R117 IonicContact OE2-CZ 3.57Å; E113-R117 IonicContact OE2-NH1 2.88Å; E113-R117 PolarHBondContact OE2-NH1 3.48Å; E113-R117 IonicContact OE2-NH2 3.44Å; E113-R117 PolarHBondContact OE2-NH2 3.5Å; Q114-R117 PolarHBondContact O-N 3.16Å; R117-L119 VanDerWaalsContact C-N 3.35Å; R117-L119 PolarHBondContact O-N 3.12Å; R117-A120 PolarHBondContact O-N 3.42Å; R117-E121 VanDerWaalsContact O-CB 3.29Å; R117-E121 WeakPolarHBondContact O-CB 3.46Å; R117-E121 PolarHBondContact O-N 2.93Å
118S53.5Low45.9Very low77 Ų77113 Ų11354%0.53860%0.601SS.*Hα-helixtrans-65.1-36.3178.6-174.30000112.5Q114 V115 S122Q114-S118 WeakPolarHBondContact O-CB 3.34Å; Q114-S118 PolarHBondContact O-N 3.1Å; V115-S118 PolarHBondContact O-N 3.47Å; S118-S122 VanDerWaalsContact O-CB 3.23Å; S118-S122 WeakPolarHBondContact O-CB 3.36Å; S118-S122 PolarHBondContact O-N 3.31Å; S118-S122 VanDerWaalsContact O-N 3.1Å
119L49.3Very low45Very low117 Ų117113.2 Ų113.261%0.61361%0.609SS**Hα-helixtrans-71.7-39.8173.7-101.976.5000111.9V115 R117 E121 S122V115-L119 HydrophobicContact CG1-CD1 4.05Å; V115-L119 WeakPolarHBondContact O-CB 3.31Å; V115-L119 WeakPolarHBondContact O-CD1 3.46Å; V115-L119 PolarHBondContact O-N 3.34Å; R117-L119 VanDerWaalsContact C-N 3.35Å; R117-L119 PolarHBondContact O-N 3.12Å; L119-E121 VanDerWaalsContact C-N 3.31Å; L119-E121 PolarHBondContact O-N 3.34Å; L119-S122 PolarHBondContact O-N 2.92Å
120A47.3Very low44Very low72 Ų72114.2 Ų114.260%0.59563%0.626SS**Hα-helixtrans-70.3-26.3177.600000113.2Q116 R117Q116-A120 VanDerWaalsContact O-CB 3.29Å; Q116-A120 WeakPolarHBondContact O-CB 3.46Å; Q116-A120 PolarHBondContact O-N 3.28Å; R117-A120 PolarHBondContact O-N 3.42Å
121E48.6Very low43.1Very low162 Ų162115.6 Ų115.676%0.75764%0.642SS**Hα-helixtrans-85.6-20.7174.8-163162.9-163.100112.1R117 L119 D123R117-E121 VanDerWaalsContact O-CB 3.29Å; R117-E121 WeakPolarHBondContact O-CB 3.46Å; R117-E121 PolarHBondContact O-N 2.93Å; L119-E121 VanDerWaalsContact C-N 3.31Å; L119-E121 PolarHBondContact O-N 3.34Å; E121-D123 VanDerWaalsContact C-N 3.34Å; E121-D123 PolarHBondContact O-N 3.35Å
122S45.2Very low42.3Very low76 Ų76116.1 Ų116.153%0.53165%0.653SS.*G310 helixtrans-78.9-7.6176.6-178.50000114.5S118 L119 H124S118-S122 VanDerWaalsContact O-CB 3.23Å; S118-S122 WeakPolarHBondContact O-CB 3.36Å; S118-S122 PolarHBondContact O-N 3.31Å; S118-S122 VanDerWaalsContact O-N 3.1Å; L119-S122 PolarHBondContact O-N 2.92Å; S122-H124 PolarHBondContact O-N 3.36Å
123D40.8Very low41Very low136 Ų136116.8 Ų116.873%0.72766%0.664SS**G310 helixtrans-71.43178.7-88.7-22000113.7E121E121-D123 VanDerWaalsContact C-N 3.34Å; E121-D123 PolarHBondContact O-N 3.35Å
124H36.6Very low39.9Very low175 Ų175120.2 Ų120.281%0.8168%0.68SS**G310 helixtrans-129.144.3176.2-68.8-25.8000113.7S122S122-H124 PolarHBondContact O-N 3.36Å
125V33.4Very low38.8Very low107 Ų107121.5 Ų121.565%0.64869%0.694SS**  trans-135.387.2159.7-171.20000110.4
126T28.5Very low37.7Very low132 Ų132125.7 Ų125.781%0.8171%0.706SS**  trans-46.8132.3149.441.40000111.4
127A28.8Very low36.6Very low82 Ų82123 Ų12368%0.67870%0.696SS**SBendtrans68.1132.9160.800000116.9
128E25.9Very low35.6Very low190 Ų190119.6 Ų119.689%0.88869%0.693SS**  trans67.575.8165.5-60.7-175.9150.200117.8
129C28.4Very low34.9Very low106 Ų106120.6 Ų120.672%0.71670%0.698SS**  trans-142.872.4153.6-93.50000110.6N131C129-N131 PolarHBondContact O-N 3.15Å; C129-N131 VanDerWaalsContact O-N 3.12Å
130A28Very low34.4Very low105 Ų105124.8 Ų124.887%0.86871%0.706SS**THydrogen-bonded Turntrans-76.323.6175.100000113.9
131N29.3Very low34.2Very low157 Ų157125.9 Ų125.984%0.8470%0.701SS**THydrogen-bonded Turntrans-139.717.4-169.5-92.7-12.7000115C129 S133C129-N131 PolarHBondContact O-N 3.15Å; C129-N131 VanDerWaalsContact O-N 3.12Å; N131-S133 PolarHBondContact O-N 3Å; N131-S133 VanDerWaalsContact O-N 3.13Å
132V30.7Very low34.1Very low124 Ų124123.9 Ų123.975%0.75269%0.692SS**  trans-81.199.8168.9-170.90000107.5E134V132-E134 PolarHBondContact O-N 2.98Å
133S28.3Very low34Very low99 Ų99124.4 Ų124.469%0.69269%0.694SS**  trans-43.3131.4175.5-61.60000111N131 V135N131-S133 PolarHBondContact O-N 3Å; N131-S133 VanDerWaalsContact O-N 3.13Å; S133-V135 VanDerWaalsContact C-N 3.29Å; S133-V135 PolarHBondContact O-N 3.45Å
134E31.7Very low34.2Very low156 Ų156122.7 Ų122.773%0.72969%0.685SS**  trans-50.394.8165.8-73.5175.5143.400108.8V132 F136V132-E134 PolarHBondContact O-N 2.98Å; E134-F136 HydrophobicContact CB-CD2 3.89Å; E134-F136 HydrophobicContact CB-CE2 3.64Å; E134-F136 HydrophobicContact CB-CZ 4.3Å; E134-F136 HydrophobicContact CG-CE2 4.43Å; E134-F136 WeakPolarHBondContact O-CD2 3.48Å; E134-F136 PolarHBondContact O-N 3.07Å; E134-F136 VanDerWaalsContact OE2-CE2 3.3Å; E134-F136 WeakPolarHBondContact OE2-CE2 3.34Å; E134-F136 WeakPolarHBondContact OE2-CZ 3.32Å
135V35.2Very low34.9Very low119 Ų119118.3 Ų118.372%0.72167%0.667SS**  trans-70.292.6160.2179.10000103.9S133 L137S133-V135 VanDerWaalsContact C-N 3.29Å; S133-V135 PolarHBondContact O-N 3.45Å; V135-L137 PolarHBondContact O-N 2.96Å
136F31.8Very low35.8Very low167 Ų167116 Ų11673%0.73266%0.659SS**  trans-58.787.5170.7-80.4-89.4000108.1E134 S138E134-F136 HydrophobicContact CB-CD2 3.89Å; E134-F136 HydrophobicContact CB-CE2 3.64Å; E134-F136 HydrophobicContact CB-CZ 4.3Å; E134-F136 HydrophobicContact CG-CE2 4.43Å; E134-F136 WeakPolarHBondContact O-CD2 3.48Å; E134-F136 PolarHBondContact O-N 3.07Å; E134-F136 VanDerWaalsContact OE2-CE2 3.3Å; E134-F136 WeakPolarHBondContact OE2-CE2 3.34Å; E134-F136 WeakPolarHBondContact OE2-CZ 3.32Å; F136-S138 PolarHBondContact O-N 3.25Å
137L35Very low37Very low86 Ų86115.4 Ų115.445%0.4565%0.65SS.*  trans-62.6105.1163.5-74.3164.3000105.6V135 L141 E142V135-L137 PolarHBondContact O-N 2.96Å; L137-L141 HydrophobicContact CD2-CB 4.23Å; L137-L141 HydrophobicContact CD2-CD2 3.22Å; L137-L141 HydrophobicContact CD2-CG 4.31Å; L137-E142 HydrophobicContact CB-CG 4.4Å
138S30.6Very low38.1Very low66 Ų66114.1 Ų114.146%0.46264%0.64SS.*  trans-48.3139.3175.456.50000109.2F136 R140 L141F136-S138 PolarHBondContact O-N 3.25Å; S138-R140 CarbonylContact O-C 3.56Å; S138-R140 PolarHBondContact O-N 3.31Å; S138-L141 WeakPolarHBondContact O-CA 3.42Å; S138-L141 WeakPolarHBondContact O-CB 3.4Å; S138-L141 PolarHBondContact O-N 3.25Å
139P40.2Very low39.4Very low99 Ų99108.1 Ų108.164%0.64361%0.613SS**Hα-helixtrans-58.4-13-173.916.5-29.3000114.2C143P139-C143 PolarHBondContact O-N 3.28Å
140R37.6Very low40.5Very low205 Ų205106.6 Ų106.677%0.77461%0.608SS**Hα-helixtrans-69.8-41.8167.3-79.7-173.4167.8173-2.7113S138 E142 C143 D144S138-R140 CarbonylContact O-C 3.56Å; S138-R140 PolarHBondContact O-N 3.31Å; R140-E142 VanDerWaalsContact C-N 3.35Å; R140-C143 PolarHBondContact O-N 3.48Å; R140-D144 PolarHBondContact O-N 3.19Å
141L44.3Very low41.6Very low94 Ų94107.6 Ų107.649%0.49260%0.599SS.*Hα-helixtrans-66.5-37.3178.5-13389.3000111.6L137 S138 C143 D144 L145L137-L141 HydrophobicContact CD2-CB 4.23Å; L137-L141 HydrophobicContact CD2-CD2 3.22Å; L137-L141 HydrophobicContact CD2-CG 4.31Å; S138-L141 WeakPolarHBondContact O-CA 3.42Å; S138-L141 WeakPolarHBondContact O-CB 3.4Å; S138-L141 PolarHBondContact O-N 3.25Å; L141-C143 VanDerWaalsContact C-N 3.33Å; L141-C143 PolarHBondContact O-N 3.03Å; L141-D144 PolarHBondContact O-N 3.47Å; L141-L145 WeakPolarHBondContact O-CB 2.96Å; L141-L145 PolarHBondContact O-N 3.41Å
142E46.8Very low42.4Very low121 Ų121103.6 Ų103.657%0.56558%0.578SS**Hα-helixtrans-62.8-40.4174.2-69.2-175.5157.400111.9L137 R140 A146L137-E142 HydrophobicContact CB-CG 4.4Å; R140-E142 VanDerWaalsContact C-N 3.35Å; E142-A146 WeakPolarHBondContact O-CB 3.17Å; E142-A146 PolarHBondContact O-N 2.75Å
143C42.9Very low43.1Very low86 Ų86105.9 Ų105.958%0.58158%0.58SS**Hα-helixtrans-69.4-42.8175.9-79.40000112.7P139 R140 L141 L145 A146 L147P139-C143 PolarHBondContact O-N 3.28Å; R140-C143 PolarHBondContact O-N 3.48Å; L141-C143 VanDerWaalsContact C-N 3.33Å; L141-C143 PolarHBondContact O-N 3.03Å; C143-L145 VanDerWaalsContact C-N 3.34Å; C143-A146 PolarHBondContact O-N 2.93Å; C143-L147 VanDerWaalsContact O-CB 3.26Å; C143-L147 WeakPolarHBondContact O-CB 3.35Å; C143-L147 PolarHBondContact O-N 3.34Å
144D44.9Very low43.7Very low101 Ų101105 Ų10554%0.5457%0.571SS.*Hα-helixtrans-68.8-35.5179.1-70.4-21.7000111.1R140 L141 L147 A148R140-D144 PolarHBondContact O-N 3.19Å; L141-D144 PolarHBondContact O-N 3.47Å; D144-L147 PolarHBondContact O-N 2.93Å; D144-A148 VanDerWaalsContact O-CB 3.3Å; D144-A148 WeakPolarHBondContact O-CB 3.48Å; D144-A148 PolarHBondContact O-N 3.36Å
145L50.3Low44Very low82 Ų82103.8 Ų103.843%0.42958%0.578SS.*Hα-helixtrans-69.3-44.3173.7-17171.1000111.6L112 L141 C143 L147 A148 I149L112-L145 HydrophobicContact CD2-CD1 4.31Å; L141-L145 WeakPolarHBondContact O-CB 2.96Å; L141-L145 PolarHBondContact O-N 3.41Å; C143-L145 VanDerWaalsContact C-N 3.34Å; L145-L147 VanDerWaalsContact C-N 3.28Å; L145-L147 PolarHBondContact O-N 2.94Å; L145-A148 PolarHBondContact O-N 3.29Å; L145-I149 HydrophobicContact CG-CD1 3.96Å; L145-I149 WeakPolarHBondContact O-CB 3.39Å; L145-I149 VanDerWaalsContact O-CG1 3.22Å; L145-I149 WeakPolarHBondContact O-CG1 3.17Å; L145-I149 PolarHBondContact O-N 3.43Å
146A53.1Low44.2Very low58 Ų58108.4 Ų108.448%0.47958%0.583SS.*Hα-helixtrans-62.7-36.8174.700000111.8E142 C143 A150E142-A146 WeakPolarHBondContact O-CB 3.17Å; E142-A146 PolarHBondContact O-N 2.75Å; C143-A146 PolarHBondContact O-N 2.93Å; A146-A150 WeakPolarHBondContact O-CB 3.15Å; A146-A150 PolarHBondContact O-N 3.05Å
147L53.2Low44.6Very low120 Ų120102.7 Ų102.763%0.62856%0.56SS**Hα-helixtrans-69.4-39.7174.6-161.578.5000111.4C143 D144 L145 A150 N151C143-L147 VanDerWaalsContact O-CB 3.26Å; C143-L147 WeakPolarHBondContact O-CB 3.35Å; C143-L147 PolarHBondContact O-N 3.34Å; D144-L147 PolarHBondContact O-N 2.93Å; L145-L147 VanDerWaalsContact C-N 3.28Å; L145-L147 PolarHBondContact O-N 2.94Å; L147-A150 PolarHBondContact O-N 3.07Å; L147-N151 WeakPolarHBondContact O-CB 3.37Å; L147-N151 PolarHBondContact O-N 3.3Å
148A51.5Low44.7Very low56 Ų56103 Ų10346%0.46357%0.569SS.*Hα-helixtrans-64.3-43.9175.200000111.7D144 L145 N151 D152D144-A148 VanDerWaalsContact O-CB 3.3Å; D144-A148 WeakPolarHBondContact O-CB 3.48Å; D144-A148 PolarHBondContact O-N 3.36Å; L145-A148 PolarHBondContact O-N 3.29Å; A148-N151 PolarHBondContact O-N 3.01Å; A148-D152 PolarHBondContact O-N 3.45Å
149I53.8Low45.1Very low63 Ų63103.6 Ų103.632%0.32357%0.57SS.*Hα-helixtrans-65.8-38.6175.9-66165.2000111L145 N151L145-I149 HydrophobicContact CG-CD1 3.96Å; L145-I149 WeakPolarHBondContact O-CB 3.39Å; L145-I149 VanDerWaalsContact O-CG1 3.22Å; L145-I149 WeakPolarHBondContact O-CG1 3.17Å; L145-I149 PolarHBondContact O-N 3.43Å; I149-N151 VanDerWaalsContact C-N 3.35Å
150A51.6Low45.1Very low74 Ų74104.8 Ų104.861%0.61257%0.565SS**Hα-helixtrans-72.3-27.3177.100000113.3A146 L147A146-A150 WeakPolarHBondContact O-CB 3.15Å; A146-A150 PolarHBondContact O-N 3.05Å; L147-A150 PolarHBondContact O-N 3.07Å
151N50.1Low45.3Very low127 Ų127100 Ų10068%0.67956%0.555SS**Hα-helixtrans-90.7-14.5179.9-157.831.4000112.9L147 A148 I149 Q153L147-N151 WeakPolarHBondContact O-CB 3.37Å; L147-N151 PolarHBondContact O-N 3.3Å; A148-N151 PolarHBondContact O-N 3.01Å; I149-N151 VanDerWaalsContact C-N 3.35Å; N151-Q153 PolarHBondContact O-N 2.94Å
152D47Very low45Very low73 Ų7398.1 Ų98.139%0.3955%0.549SS..  trans-71.184.1167.8-170.612.2000109.6A148 T154 N157A148-D152 PolarHBondContact O-N 3.45Å; D152-T154 VanDerWaalsContact CG-OG1 3.26Å; D152-T154 PolarHBondContact O-N 3.49Å; D152-T154 WeakPolarHBondContact OD1-CB 3.32Å; D152-T154 WeakPolarHBondContact OD1-CG2 3.21Å; D152-T154 PolarHBondContact OD1-N 3.26Å; D152-T154 PolarHBondContact OD1-OG1 3.46Å; D152-T154 PolarHBondContact OD2-OG1 3.3Å; D152-N157 PolarHBondContact OD2-ND2 3Å
153Q46.3Very low44.6Very low172 Ų17298.4 Ų98.480%0.80455%0.55SS**  trans-68.910.8176.8-75.3-164.6-1400113.7N151 C155N151-Q153 PolarHBondContact O-N 2.94Å; Q153-C155 PolarHBondContact O-N 2.87Å
154T40.8Very low44.6Very low79 Ų79100.4 Ų100.449%0.48556%0.555SS.*  trans-69.7121.4170.760.90000108.5D152 R156D152-T154 VanDerWaalsContact CG-OG1 3.26Å; D152-T154 PolarHBondContact O-N 3.49Å; D152-T154 WeakPolarHBondContact OD1-CB 3.32Å; D152-T154 WeakPolarHBondContact OD1-CG2 3.21Å; D152-T154 PolarHBondContact OD1-N 3.26Å; D152-T154 PolarHBondContact OD1-OG1 3.46Å; D152-T154 PolarHBondContact OD2-OG1 3.3Å; T154-R156 PolarHBondContact O-N 2.95Å
155C37.9Very low44.5Very low132 Ų132100 Ų10089%0.89257%0.565SS**THydrogen-bonded Turntrans-61.523.3-174.1-61.20000115.6Q153Q153-C155 PolarHBondContact O-N 2.87Å
156R39.4Very low44Very low216 Ų216106 Ų10682%0.81558%0.582SS**THydrogen-bonded Turntrans-104.2-11.4-176.5-72.4-173.7172.5-175.4-2.2114.3T154T154-R156 PolarHBondContact O-N 2.95Å
157N39.1Very low43.1Very low47 Ų47107.6 Ų107.625%0.25159%0.589SS.*  trans-104.115.9-171.1-68.8-21000116.2D152 V159 F160D152-N157 PolarHBondContact OD2-ND2 3Å; N157-V159 PolarHBondContact O-N 3.31Å; N157-F160 PolarHBondContact O-N 3.35Å
158S37.5Very low42.5Very low92 Ų92106.9 Ų106.964%0.64359%0.592SS**Hα-helixtrans-67.4-20.8173.961.10000113.7S162S158-S162 PolarHBondContact O-OG 3.29Å
159V39.7Very low41.8Very low79 Ų79111 Ų11148%0.47961%0.612SS.*Hα-helixtrans-80.4-28176.9-176.50000111.6N157 S162 Q163N157-V159 PolarHBondContact O-N 3.31Å; V159-S162 WeakPolarHBondContact CA-OG 3.44Å; V159-S162 PolarHBondContact O-OG 3.36Å; V159-Q163 WeakPolarHBondContact O-CG 3.37Å; V159-Q163 PolarHBondContact O-N 3.04Å
160F40.5Very low41Very low123 Ų123113.2 Ų113.254%0.53963%0.628SS.*Hα-helixtrans-74.2-41.7-178.5-94.7-86.2000113N157 S162 Q163 L164N157-F160 PolarHBondContact O-N 3.35Å; F160-S162 VanDerWaalsContact C-N 3.29Å; F160-S162 PolarHBondContact O-N 3.4Å; F160-Q163 PolarHBondContact O-N 2.84Å; F160-L164 PolarHBondContact O-N 3.34Å; F160-L164 VanDerWaalsContact O-N 3.1Å
161L40.2Very low40Very low106 Ų106119.3 Ų119.356%0.55564%0.641SS**Hα-helixtrans-69.5-28.3176.6-71.6173.8000112.8A165L161-A165 WeakPolarHBondContact O-CB 3.14Å; L161-A165 PolarHBondContact O-N 3.32Å
162S39.4Very low39.2Very low53 Ų53124.8 Ų124.837%0.37165%0.652SS.*Hα-helixtrans-80.2-16.8176.450.70000113.5S158 V159 F160 R166S158-S162 PolarHBondContact O-OG 3.29Å; V159-S162 WeakPolarHBondContact CA-OG 3.44Å; V159-S162 PolarHBondContact O-OG 3.36Å; F160-S162 VanDerWaalsContact C-N 3.29Å; F160-S162 PolarHBondContact O-N 3.4Å; S162-R166 WeakPolarHBondContact O-CB 3.33Å
163Q38.2Very low38.4Very low128 Ų128130.5 Ų130.560%0.59868%0.676SS**Hα-helixtrans-88.5-35.3171.3-71.7-177.912.300112.3V159 F160 A165 R166V159-Q163 WeakPolarHBondContact O-CG 3.37Å; V159-Q163 PolarHBondContact O-N 3.04Å; F160-Q163 PolarHBondContact O-N 2.84Å; Q163-A165 VanDerWaalsContact C-N 3.31Å; Q163-A165 PolarHBondContact O-N 3.14Å; Q163-R166 PolarHBondContact O-N 3.06Å
164L42.5Very low37.7Very low128 Ų128126.7 Ų126.767%0.6767%0.668SS**Hα-helixtrans-64.8-32.9171.4-88.6152.4000112.9F160F160-L164 PolarHBondContact O-N 3.34Å; F160-L164 VanDerWaalsContact O-N 3.1Å
165A42.3Very low37.6Very low91 Ų91130.8 Ų130.875%0.75269%0.686SS**THydrogen-bonded Turntrans-84-4.8177.300000114.4L161 Q163L161-A165 WeakPolarHBondContact O-CB 3.14Å; L161-A165 PolarHBondContact O-N 3.32Å; Q163-A165 VanDerWaalsContact C-N 3.31Å; Q163-A165 PolarHBondContact O-N 3.14Å
166R41Very low37.5Very low210 Ų210132.2 Ų132.279%0.79268%0.684SS**  trans-127.116.4-166-149.5174.7-159.6173.94113.7S162 Q163S162-R166 WeakPolarHBondContact O-CB 3.33Å; Q163-R166 PolarHBondContact O-N 3.06Å
167S34.2Very low37.2Very low91 Ų91126.7 Ų126.764%0.63668%0.679SS**SBendtrans-70.4147172.683.60000111.3T169S167-T169 PolarHBondContact O-N 3.33Å
168P39.9Very low37Very low104 Ų104130.4 Ų130.468%0.67570%0.704SS**  trans-81.9115.8-137.228.7-33.7000113.9T170P168-T170 PolarHBondContact O-N 3.07Å
169T36.3Very low36.6Very low144 Ų144131 Ų13188%0.88371%0.708SS**  trans-68.276.515753.40000109.7S167S167-T169 PolarHBondContact O-N 3.33Å
170T37Very low36.3Very low108 Ų108134 Ų13466%0.66373%0.726SS**  trans-139.7109.4174.254.40000112.4P168P168-T170 PolarHBondContact O-N 3.07Å
171K30.5Very low35.9Very low203 Ų203133.6 Ų133.688%0.88374%0.735SS**  trans45.797.9145.7-64.1-175.4176.8-177.30117.4
172R34Very low35.6Very low242 Ų242136.3 Ų136.391%0.91375%0.749SS**  trans-133.767.2152.6-134.7175.2-172.71450.3110S174R172-S174 PolarHBondContact O-N 3.47Å
173E30.3Very low35.3Very low193 Ų193141.9 Ų141.990%0.90277%0.774SS**  trans-71102.2151.5-73.6178.1163.900106.9
174S32.2Very low34.9Very low91 Ų91140.9 Ų140.964%0.63678%0.781SS**  trans165.7141.6149.646.80000109.2R172R172-S174 PolarHBondContact O-N 3.47Å
175L37.1Very low34.6Very low165 Ų165140.8 Ų140.886%0.86479%0.788SS**  trans93.776.6173.5-46.8-177.3000114.7
176L36.2Very low34.2Very low162 Ų162144.4 Ų144.485%0.84879%0.793SS**  trans-40.2139.7157.3-84.5109.4000114.6
177S33.8Very low33.9Very low100 Ų100138.8 Ų138.870%0.69979%0.792SS**  trans70.3113.3143.4-47.50000116.4
178T34.8Very low34Very low126 Ų126140.1 Ų140.177%0.77380%0.796SS**  -173.2113.250.8-48.40000110
179S29.2Very low33.7Very low104 Ų104139.4 Ų139.473%0.72779%0.791SS**  trans49.588.6145.269.50000123.2
180V32.9Very low34Very low141 Ų141137.5 Ų137.586%0.85579%0.79SS**  trans-159.1163.7136-133.10000109.2
181P33Very low34Very low115 Ų115139.5 Ų139.575%0.74780%0.797SS**  -111.1138.3-116.635.3-16000113.6
182I33.7Very low34.3Very low164 Ų164135.5 Ų135.584%0.84178%0.784SS**  trans-134.1118172.9-56.1179.7000110.1S184I182-S184 PolarHBondContact O-N 3.47Å
183L31.6Very low34.2Very low170 Ų170133.4 Ų133.489%0.8978%0.782SS**PPolyproline II helixtrans-48.2123174.2-76.9127.1000110.7
184S30Very low34.7Very low107 Ų107131 Ų13175%0.74877%0.773SS**PPolyproline II helixtrans-51.8136.5174.9-49.20000111.4I182 L186I182-S184 PolarHBondContact O-N 3.47Å; S184-L186 PolarHBondContact O-N 2.93Å; S184-L186 VanDerWaalsContact O-N 3.15Å
185P37.4Very low34.8Very low125 Ų125132.7 Ų132.781%0.81278%0.78SS**PPolyproline II helixtrans-63.5121.5171.926.7-30.1000107.9A187P185-A187 PolarHBondContact O-N 3.38Å
186L33.3Very low35.1Very low167 Ų167129.1 Ų129.187%0.87477%0.774SS**  trans-54.3114.3177.7-162.571.8000108.3S184 V188S184-L186 PolarHBondContact O-N 2.93Å; S184-L186 VanDerWaalsContact O-N 3.15Å; L186-V188 PolarHBondContact O-N 3.3Å
187A34.2Very low35.2Very low93 Ų93130 Ų13077%0.76977%0.771SS**  trans-52.6109177.600000109.9P185P185-A187 PolarHBondContact O-N 3.38Å
188V36.5Very low35.5Very low118 Ų118133.9 Ų133.972%0.71578%0.778SS**  trans-64.3127.1166.4178.60000106.7L186 A190L186-V188 PolarHBondContact O-N 3.3Å; V188-A190 PolarHBondContact O-N 2.92Å
189P34.7Very low35.9Very low89 Ų89138.6 Ų138.658%0.57878%0.781SS**  trans-56130179-21.531.1000110.3D191P189-D191 PolarHBondContact O-N 3.33Å
190A41.7Very low36.3Very low104 Ų104140.1 Ų140.186%0.8679%0.787SS**THydrogen-bonded Turntrans-65.28.3-176.800000115V188V188-A190 PolarHBondContact O-N 2.92Å
191D36.8Very low36.5Very low151 Ų151141.4 Ų141.481%0.80779%0.788SS**THydrogen-bonded Turntrans-108.76.5-170-71.8-30.8000114.9P189 K193P189-D191 PolarHBondContact O-N 3.33Å; D191-K193 PolarHBondContact O-N 3.5Å
192I36.2Very low36.8Very low119 Ų119147.7 Ų147.761%0.6181%0.814SS**  trans-91.287.5174.8-49178.6000109.4I194I192-I194 VanDerWaalsContact C-N 3.34Å; I192-I194 HydrophobicContact CG2-CG1 3.85Å; I192-I194 PolarHBondContact O-N 2.81Å
193K33.6Very low37Very low197 Ų197146.9 Ų146.986%0.85781%0.812SS**  trans-66.492.6162.1-86-177.3176.6176.90108.9D191 V195D191-K193 PolarHBondContact O-N 3.5Å; K193-V195 PolarHBondContact O-N 3Å
194I40.5Very low37.3Very low143 Ų143145.6 Ų145.673%0.73381%0.808SS**  trans-72.898.1164.9-56.2178.3000106.9I192 A196I192-I194 VanDerWaalsContact C-N 3.34Å; I192-I194 HydrophobicContact CG2-CG1 3.85Å; I192-I194 PolarHBondContact O-N 2.81Å; I194-A196 VanDerWaalsContact C-N 3.27Å; I194-A196 PolarHBondContact O-N 2.96Å
195V34.6Very low37.7Very low127 Ų127147.8 Ų147.877%0.7781%0.812SS**  trans-73.587.2168.3-178.50000107.2K193 K197K193-V195 PolarHBondContact O-N 3Å; V195-K197 PolarHBondContact O-N 2.93Å
196A41.6Very low37.7Very low89 Ų89149.1 Ų149.174%0.73681%0.812SS**  trans-69.2100.216600000107.6I194 E198I194-A196 VanDerWaalsContact C-N 3.27Å; I194-A196 PolarHBondContact O-N 2.96Å; A196-E198 PolarHBondContact O-N 3.27Å; A196-E198 VanDerWaalsContact O-N 3.1Å
197K38.9Very low38Very low181 Ų181148 Ų14879%0.78781%0.808SS**  trans-69.8101.2172.6-175.3171.9-177.8172.70108.2V195 R199V195-K197 PolarHBondContact O-N 2.93Å; K197-R199 PolarHBondContact O-N 3.22Å; K197-R199 VanDerWaalsContact O-N 3.16Å
198E41.1Very low38.2Very low181 Ų181151.7 Ų151.785%0.84681%0.81SS**  trans-56.9114.7165.9-123.2175.9174.900108.2A196A196-E198 PolarHBondContact O-N 3.27Å; A196-E198 VanDerWaalsContact O-N 3.1Å
199R42.2Very low38.3Very low225 Ų225154.1 Ų154.185%0.84982%0.817SS**  trans-87.5101.4161.9-81.9-172.8176.1170.5-0.5106.5K197 L201K197-R199 PolarHBondContact O-N 3.22Å; K197-R199 VanDerWaalsContact O-N 3.16Å; R199-L201 PolarHBondContact O-N 3.07Å
200T37.6Very low38.6Very low136 Ų136159.1 Ų159.183%0.83484%0.835SS**  trans-55.2122.1163.3-7.60000108.6
201L38.2Very low38.4Very low168 Ų168163.7 Ų163.788%0.8883%0.833SS**  trans-86.2102.3168.9-77.5164.1000107.8R199R199-L201 PolarHBondContact O-N 3.07Å
202L39Very low38.5Very low247 Ų247164.8 Ų164.8100%1.29384%0.836SS**  trans-169.50150.5-100.5159.6000108.6

Retrieved 202 of 202 residues in 323.9 ms (Link to these results)