A0A087WRS1_MOUSE Loading...

Kinectin 1

AlphaFold DB , UniProt , Accession A0A087WRS1, Species MOUSE (Mus musculus, Mouse), Gene Ktn1, Length 1,275 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
1M41.8Very low50.2Low233 Ų233154.7 Ų154.7100%1.14876%0.759SS**  085.60-75.7174.917300106.8
2E40.8Very low51.6Low184 Ų184150.2 Ų150.286%0.8674%0.74SS**  trans-127.257.6-157.8-66.8159.2135.200111.6
3L40.6Very low53.1Low153 Ų153146.2 Ų146.280%0.80172%0.722SS**SBendtrans-133.810.6178.4-72176.2000113.9
4Y48.8Very low54.7Low233 Ų233140.3 Ų140.391%0.91470%0.7SS**SBendtrans-107.3-5.6-176.6-97.4-83.6000115.4
5E49.7Very low55.9Low191 Ų191134.6 Ų134.689%0.89368%0.679SS**  trans-103.312.6-178.2-67.4-174.6128.200114.2T7E5-T7 PolarHBondContact O-N 2.56Å
6S44.8Very low57.3Low64 Ų64130.8 Ų130.845%0.44866%0.664SS.*  trans-81.5109.3177.9-169.60000111.5Y8 F9S6-Y8 PolarHBondContact O-N 2.81Å; S6-F9 PolarHBondContact O-N 2.83Å; S6-F9 VanDerWaalsContact O-N 3.07Å
7T50.3Low58.8Low114 Ų114127.5 Ų127.570%0.69965%0.652SS**THydrogen-bonded Turntrans-52-23.6-177.6-31.70000113.9E5 F9 V10E5-T7 PolarHBondContact O-N 2.56Å; T7-F9 PolarHBondContact O-N 3.09Å; T7-V10 PolarHBondContact O-N 2.65Å
8Y54Low60.1Low191 Ų191125.8 Ų125.875%0.74964%0.643SS**Hα-helixtrans-55.1-32.9175.7-74.5-90.7000113.7S6 V10 V11 L12S6-Y8 PolarHBondContact O-N 2.81Å; Y8-V10 VanDerWaalsContact C-N 3.3Å; Y8-V10 PolarHBondContact O-N 2.94Å; Y8-V11 PolarHBondContact O-N 3.1Å; Y8-L12 VanDerWaalsContact O-CB 3.27Å; Y8-L12 WeakPolarHBondContact O-CB 3.41Å; Y8-L12 PolarHBondContact O-N 3Å
9F55.9Low61.1Low127 Ų127123.2 Ų123.256%0.55763%0.634SS**Hα-helixtrans-64.3-33.2-177.9-105.4-78.4000113.5S6 T7 V11 L12 I13S6-F9 PolarHBondContact O-N 2.83Å; S6-F9 VanDerWaalsContact O-N 3.07Å; T7-F9 PolarHBondContact O-N 3.09Å; F9-V11 VanDerWaalsContact C-N 3.27Å; F9-V11 PolarHBondContact O-N 3.19Å; F9-L12 PolarHBondContact O-N 3.48Å; F9-I13 HydrophobicContact CD1-CD1 3.93Å; F9-I13 HydrophobicContact CD1-CG1 4.12Å; F9-I13 PolarHBondContact O-N 2.73Å; F9-I13 VanDerWaalsContact O-N 3.14Å
10V61.3Low62Low114 Ų114121.4 Ų121.469%0.69163%0.628SS**Hα-helixtrans-67-28.7179.2-176.90000111.8T7 Y8 P14T7-V10 PolarHBondContact O-N 2.65Å; Y8-V10 VanDerWaalsContact C-N 3.3Å; Y8-V10 PolarHBondContact O-N 2.94Å; V10-P14 WeakPolarHBondContact O-CD 3.46Å; V10-P14 VanDerWaalsContact O-CG 3.3Å; V10-P14 WeakPolarHBondContact O-CG 3.1Å
11V64.1Low62.7Low98 Ų98119.5 Ų119.559%0.59462%0.618SS**Hα-helixtrans-93.5-33.4177.5-175.70000111.8Y8 F9 S15Y8-V11 PolarHBondContact O-N 3.1Å; F9-V11 VanDerWaalsContact C-N 3.27Å; F9-V11 PolarHBondContact O-N 3.19Å; V11-S15 WeakPolarHBondContact O-CB 3.25Å; V11-S15 PolarHBondContact O-N 2.95Å; V11-S15 PolarHBondContact O-OG 3.47Å
12L67.6Low64.3Low100 Ų100115.6 Ų115.652%0.52460%0.596SS.*Hα-helixtrans-71.4-39.6-176.6-162.373.9000112.2Y8 F9 S15 V16Y8-L12 VanDerWaalsContact O-CB 3.27Å; Y8-L12 WeakPolarHBondContact O-CB 3.41Å; Y8-L12 PolarHBondContact O-N 3Å; F9-L12 PolarHBondContact O-N 3.48Å; L12-S15 PolarHBondContact O-N 2.78Å; L12-V16 HydrophobicContact CG-CG2 4.33Å; L12-V16 WeakPolarHBondContact O-CB 3.45Å; L12-V16 VanDerWaalsContact O-CG2 3.32Å; L12-V16 WeakPolarHBondContact O-CG2 3.24Å; L12-V16 PolarHBondContact O-N 3.24Å
13I70.4Confident65.8Low99 Ų99111 Ų11151%0.50858%0.577SS.*Hα-helixtrans-62.2-52.6179.1-70.2170.4000111.5F9 S15 V16 V17F9-I13 HydrophobicContact CD1-CD1 3.93Å; F9-I13 HydrophobicContact CD1-CG1 4.12Å; F9-I13 PolarHBondContact O-N 2.73Å; F9-I13 VanDerWaalsContact O-N 3.14Å; I13-S15 VanDerWaalsContact C-N 3.31Å; I13-S15 PolarHBondContact O-N 3.3Å; I13-V16 PolarHBondContact O-N 3.45Å; I13-V17 HydrophobicContact CG2-CG2 4.46Å; I13-V17 WeakPolarHBondContact O-CG2 3.34Å; I13-V17 PolarHBondContact O-N 3.11Å
14P76.1Confident67.3Low63 Ų63110.3 Ų110.341%0.40957%0.567SS.*Hα-helixtrans-56.9-41.8173.2-2735.8000112.9V10 V16 V17 I18V10-P14 WeakPolarHBondContact O-CD 3.46Å; V10-P14 VanDerWaalsContact O-CG 3.3Å; V10-P14 WeakPolarHBondContact O-CG 3.1Å; P14-V16 PolarHBondContact O-N 3.26Å; P14-V17 PolarHBondContact O-N 3.14Å; P14-I18 WeakPolarHBondContact O-CB 3.49Å; P14-I18 WeakPolarHBondContact O-CD1 3.42Å; P14-I18 WeakPolarHBondContact O-CG1 3.43Å; P14-I18 PolarHBondContact O-N 2.91Å
15S72Confident68Low55 Ų55105.4 Ų105.439%0.38555%0.551SS.*Hα-helixtrans-62.4-44.9178.6-60.20000112.2V11 L12 I13 I18 T19V11-S15 WeakPolarHBondContact O-CB 3.25Å; V11-S15 PolarHBondContact O-N 2.95Å; V11-S15 PolarHBondContact O-OG 3.47Å; L12-S15 PolarHBondContact O-N 2.78Å; I13-S15 VanDerWaalsContact C-N 3.31Å; I13-S15 PolarHBondContact O-N 3.3Å; S15-I18 PolarHBondContact O-N 3.44Å; S15-T19 WeakPolarHBondContact O-CG2 3.4Å; S15-T19 PolarHBondContact O-N 2.95Å; S15-T19 PolarHBondContact O-OG1 2.77Å
16V78.4Confident68.6Low74 Ų74104.2 Ų104.245%0.44854%0.538SS..Hα-helixtrans-63.6-47.3176.5169.90000110.3L12 I13 P14 I18 T19 V20L12-V16 HydrophobicContact CG-CG2 4.33Å; L12-V16 WeakPolarHBondContact O-CB 3.45Å; L12-V16 VanDerWaalsContact O-CG2 3.32Å; L12-V16 WeakPolarHBondContact O-CG2 3.24Å; L12-V16 PolarHBondContact O-N 3.24Å; I13-V16 PolarHBondContact O-N 3.45Å; P14-V16 PolarHBondContact O-N 3.26Å; V16-I18 VanDerWaalsContact C-N 3.34Å; V16-I18 PolarHBondContact O-N 2.78Å; V16-T19 WeakPolarHBondContact CA-OG1 3.11Å; V16-T19 PolarHBondContact O-N 3.47Å; V16-T19 VanDerWaalsContact O-N 3.13Å; V16-T19 PolarHBondContact O-OG1 3.41Å; V16-V20 HydrophobicContact CG1-CG2 4.34Å; V16-V20 WeakPolarHBondContact O-CG2 3.1Å; V16-V20 PolarHBondContact O-N 3.31Å
17V82.9Confident69.4Low75 Ų75107 Ų10746%0.45555%0.547SS..Hα-helixtrans-58.7-44.3176.6170.60000111.4I13 P14 T19 V20 I21I13-V17 HydrophobicContact CG2-CG2 4.46Å; I13-V17 WeakPolarHBondContact O-CG2 3.34Å; I13-V17 PolarHBondContact O-N 3.11Å; P14-V17 PolarHBondContact O-N 3.14Å; V17-T19 PolarHBondContact O-N 2.72Å; V17-V20 PolarHBondContact O-N 3.32Å; V17-I21 HydrophobicContact CG1-CD1 3.75Å; V17-I21 HydrophobicContact CG1-CG1 4.47Å; V17-I21 WeakPolarHBondContact O-CB 3.44Å; V17-I21 VanDerWaalsContact O-CG1 3.29Å; V17-I21 WeakPolarHBondContact O-CG1 3.45Å; V17-I21 PolarHBondContact O-N 2.95Å
18I82.2Confident69.3Low96 Ų96109 Ų10949%0.49255%0.547SS..Hα-helixtrans-62-42.6175.3-70.5164000111.1P14 S15 V16 I21 F22P14-I18 WeakPolarHBondContact O-CB 3.49Å; P14-I18 WeakPolarHBondContact O-CD1 3.42Å; P14-I18 WeakPolarHBondContact O-CG1 3.43Å; P14-I18 PolarHBondContact O-N 2.91Å; S15-I18 PolarHBondContact O-N 3.44Å; V16-I18 VanDerWaalsContact C-N 3.34Å; V16-I18 PolarHBondContact O-N 2.78Å; I18-I21 PolarHBondContact O-N 3.3Å; I18-F22 HydrophobicContact CG2-CD2 4.04Å; I18-F22 HydrophobicContact CG2-CE2 4.44Å; I18-F22 WeakPolarHBondContact O-CB 3.41Å; I18-F22 PolarHBondContact O-N 3.31Å
19T78.5Confident69.2Low77 Ų77106.9 Ų106.947%0.47255%0.545SS..Hα-helixtrans-67.9-33.817657.30000113.5S15 V16 V17 F22 L23S15-T19 WeakPolarHBondContact O-CG2 3.4Å; S15-T19 PolarHBondContact O-N 2.95Å; S15-T19 PolarHBondContact O-OG1 2.77Å; V16-T19 WeakPolarHBondContact CA-OG1 3.11Å; V16-T19 PolarHBondContact O-N 3.47Å; V16-T19 VanDerWaalsContact O-N 3.13Å; V16-T19 PolarHBondContact O-OG1 3.41Å; V17-T19 PolarHBondContact O-N 2.72Å; T19-F22 PolarHBondContact O-N 2.89Å; T19-L23 WeakPolarHBondContact O-CB 3.46Å; T19-L23 WeakPolarHBondContact O-CG 3.45Å; T19-L23 PolarHBondContact O-N 3.42Å
20V79.1Confident68.8Low86 Ų86107.6 Ų107.652%0.52155%0.548SS..Hα-helixtrans-67.7-42.8174.2170.50000110.4V16 V17 L23 F24V16-V20 HydrophobicContact CG1-CG2 4.34Å; V16-V20 WeakPolarHBondContact O-CG2 3.1Å; V16-V20 PolarHBondContact O-N 3.31Å; V17-V20 PolarHBondContact O-N 3.32Å; V20-L23 PolarHBondContact O-N 3.05Å; V20-F24 WeakPolarHBondContact O-CB 3.38Å; V20-F24 PolarHBondContact O-N 3.1Å
21I77.2Confident68.3Low82 Ų82110.5 Ų110.542%0.42155%0.554SS.*Hα-helixtrans-62.6-44173.4-69.9167.3000110.6V17 I18 F24 F25V17-I21 HydrophobicContact CG1-CD1 3.75Å; V17-I21 HydrophobicContact CG1-CG1 4.47Å; V17-I21 WeakPolarHBondContact O-CB 3.44Å; V17-I21 VanDerWaalsContact O-CG1 3.29Å; V17-I21 WeakPolarHBondContact O-CG1 3.45Å; V17-I21 PolarHBondContact O-N 2.95Å; I18-I21 PolarHBondContact O-N 3.3Å; I21-F24 WeakPolarHBondContact O-CB 3.39Å; I21-F24 PolarHBondContact O-N 3.5Å; I21-F25 HydrophobicContact CG2-CD2 3.73Å; I21-F25 HydrophobicContact CG2-CE2 3.81Å; I21-F25 WeakPolarHBondContact O-CD2 3.49Å; I21-F25 PolarHBondContact O-N 3.45Å
22F74.7Confident67.7Low152 Ų152111 Ų11167%0.66756%0.557SS**Hα-helixtrans-63.8-39.3175.1-104.9-84000112.9I18 T19 W26I18-F22 HydrophobicContact CG2-CD2 4.04Å; I18-F22 HydrophobicContact CG2-CE2 4.44Å; I18-F22 WeakPolarHBondContact O-CB 3.41Å; I18-F22 PolarHBondContact O-N 3.31Å; T19-F22 PolarHBondContact O-N 2.89Å; F22-W26 WeakPolarHBondContact O-CB 3.33Å; F22-W26 PolarHBondContact O-N 3.4Å
23L72.5Confident66.8Low88 Ų88112.3 Ų112.346%0.46156%0.564SS.*Hα-helixtrans-64.8-40.9173.4-83.3160.5000111.5T19 V20 W26 L27T19-L23 WeakPolarHBondContact O-CB 3.46Å; T19-L23 WeakPolarHBondContact O-CG 3.45Å; T19-L23 PolarHBondContact O-N 3.42Å; V20-L23 PolarHBondContact O-N 3.05Å; L23-W26 HydrophobicContact CD2-CE3 4.11Å; L23-W26 HydrophobicContact CD2-CZ3 4.44Å; L23-W26 PolarHBondContact O-N 3.38Å; L23-L27 WeakPolarHBondContact O-CB 3.35Å; L23-L27 WeakPolarHBondContact O-CG 3.46Å; L23-L27 PolarHBondContact O-N 2.82Å
24F73.1Confident65.6Low138 Ų138117.5 Ų117.561%0.60558%0.579SS**Hα-helixtrans-61.8-51.4175.8-160.9-93000110.8V20 I21 W26 L27 F28V20-F24 WeakPolarHBondContact O-CB 3.38Å; V20-F24 PolarHBondContact O-N 3.1Å; I21-F24 WeakPolarHBondContact O-CB 3.39Å; I21-F24 PolarHBondContact O-N 3.5Å; F24-W26 PolarHBondContact O-N 2.93Å; F24-L27 PolarHBondContact O-N 3.35Å; F24-F28 WeakPolarHBondContact O-CB 3.2Å; F24-F28 PolarHBondContact O-N 2.87Å
25F63.7Low64.3Low129 Ų129120.6 Ų120.657%0.56659%0.592SS**Hα-helixtrans-61-39.5173.8-85.7-71.3000112.9I21 L27 F28 M29I21-F25 HydrophobicContact CG2-CD2 3.73Å; I21-F25 HydrophobicContact CG2-CE2 3.81Å; I21-F25 WeakPolarHBondContact O-CD2 3.49Å; I21-F25 PolarHBondContact O-N 3.45Å; F25-L27 PolarHBondContact O-N 3.49Å; F25-F28 PolarHBondContact O-N 3.12Å; F25-M29 WeakPolarHBondContact O-CB 3.49Å; F25-M29 WeakPolarHBondContact O-CG 3.43Å; F25-M29 PolarHBondContact O-N 2.95Å
26W62.3Low63.3Low167 Ų167123.4 Ų123.463%0.63360%0.599SS**Hα-helixtrans-71.1-29.4-178.4-173.642.5000113.4F22 L23 F24F22-W26 WeakPolarHBondContact O-CB 3.33Å; F22-W26 PolarHBondContact O-N 3.4Å; L23-W26 HydrophobicContact CD2-CE3 4.11Å; L23-W26 HydrophobicContact CD2-CZ3 4.44Å; L23-W26 PolarHBondContact O-N 3.38Å; F24-W26 PolarHBondContact O-N 2.93Å
27L61.5Low62.3Low121 Ų121124.4 Ų124.463%0.63461%0.605SS**Hα-helixtrans-75.8-51.5170.1-71.7166.5000111L23 F24 F25 M29 K30L23-L27 WeakPolarHBondContact O-CB 3.35Å; L23-L27 WeakPolarHBondContact O-CG 3.46Å; L23-L27 PolarHBondContact O-N 2.82Å; F24-L27 PolarHBondContact O-N 3.35Å; F25-L27 PolarHBondContact O-N 3.49Å; L27-M29 PolarHBondContact O-N 3.07Å; L27-K30 WeakPolarHBondContact O-CB 3.4Å; L27-K30 PolarHBondContact O-N 3.13Å; L27-K30 VanDerWaalsContact O-N 3.09Å
28F48.3Very low61Low157 Ų157125.1 Ų125.169%0.68961%0.606SS**Hα-helixtrans-69.1-32.4-173.9-135.3-98.3000113.5F24 F25 K30F24-F28 WeakPolarHBondContact O-CB 3.2Å; F24-F28 PolarHBondContact O-N 2.87Å; F25-F28 PolarHBondContact O-N 3.12Å; F28-K30 PolarHBondContact O-N 2.98Å
29M51.7Low59.8Low147 Ų147122.4 Ų122.472%0.72460%0.598SS**THydrogen-bonded Turntrans-74-3.5174-69.5-74.4-71.100113.6F25 L27F25-M29 WeakPolarHBondContact O-CB 3.49Å; F25-M29 WeakPolarHBondContact O-CG 3.43Å; F25-M29 PolarHBondContact O-N 2.95Å; L27-M29 PolarHBondContact O-N 3.07Å
30K47.5Very low58.4Low141 Ų141123.9 Ų123.961%0.61360%0.598SS**THydrogen-bonded Turntrans-96.3-12.9-175.6-125.8178.7179.1-177.80114.8L27 F28L27-K30 WeakPolarHBondContact O-CB 3.4Å; L27-K30 PolarHBondContact O-N 3.13Å; L27-K30 VanDerWaalsContact O-N 3.09Å; F28-K30 PolarHBondContact O-N 2.98Å
31E50.8Low56.8Low176 Ų176125.7 Ų125.782%0.82260%0.6SS**SBendtrans-101.122.3-177.2-66.2-161.3135.100114.6
32T50.5Low55.4Low107 Ų107129.1 Ų129.166%0.65661%0.612SS**  trans-128.271.4166.6450000112.1Y34T32-Y34 PolarHBondContact O-N 3.48Å; T32-Y34 VanDerWaalsContact O-N 3.17Å
33L48.6Very low54.2Low128 Ų128130.4 Ų130.467%0.6761%0.613SS**  trans-62.8115.4167.4-81.4167.9000110D35 E36L33-D35 PolarHBondContact O-N 3.3Å; L33-E36 PolarHBondContact O-N 2.91Å
34Y46Very low52.6Low209 Ų209133.4 Ų133.482%0.8262%0.624SS**Hα-helixtrans-53.6-30.2-175.9-123.8-102.1000113.6T32 E36 V37 L38T32-Y34 PolarHBondContact O-N 3.48Å; T32-Y34 VanDerWaalsContact O-N 3.17Å; Y34-E36 VanDerWaalsContact C-N 3.34Å; Y34-E36 PolarHBondContact O-N 2.79Å; Y34-V37 PolarHBondContact O-N 3.44Å; Y34-L38 PolarHBondContact O-N 3.5Å
35D48.6Very low50.9Low127 Ų127135 Ų13568%0.67963%0.634SS**Hα-helixtrans-64.4-31.2176.8-71.5-51000113.6L33 L38 A39L33-D35 PolarHBondContact O-N 3.3Å; D35-L38 PolarHBondContact O-N 2.88Å; D35-A39 VanDerWaalsContact O-CB 3.28Å; D35-A39 WeakPolarHBondContact O-CB 3.37Å; D35-A39 PolarHBondContact O-N 3.31Å
36E50.7Low49.5Very low114 Ų114137.3 Ų137.353%0.53364%0.644SS.*Hα-helixtrans-73-38.3-179.7-164-173.6137.700111.7L33 Y34 L38 A39 K40L33-E36 PolarHBondContact O-N 2.91Å; Y34-E36 VanDerWaalsContact C-N 3.34Å; Y34-E36 PolarHBondContact O-N 2.79Å; E36-L38 VanDerWaalsContact C-N 3.32Å; E36-L38 PolarHBondContact O-N 2.95Å; E36-A39 CarbonylContact O-C 3.58Å; E36-A39 PolarHBondContact O-N 2.91Å; E36-A39 VanDerWaalsContact O-N 3.16Å; E36-K40 PolarHBondContact O-N 2.86Å; E36-K40 WeakPolarHBondContact OE1-CE 3.25Å; E36-K40 IonicContact OE1-NZ 2.66Å; E36-K40 PolarHBondContact OE1-NZ 3.13Å
37V58.1Low48.4Very low95 Ų95136.4 Ų136.458%0.57665%0.65SS**Hα-helixtrans-61.1-44.7174-177.60000109.9Y34 A39 K40 Q41Y34-V37 PolarHBondContact O-N 3.44Å; V37-A39 VanDerWaalsContact C-N 3.29Å; V37-A39 PolarHBondContact O-N 3.37Å; V37-K40 PolarHBondContact O-N 3.4Å; V37-Q41 PolarHBondContact O-N 3.01Å
38L55Low46.9Very low91 Ų91139 Ų13948%0.47666%0.663SS.*Hα-helixtrans-66.1-30.7176.5-150.473.3000112.6Y34 D35 E36 K42Y34-L38 PolarHBondContact O-N 3.5Å; D35-L38 PolarHBondContact O-N 2.88Å; E36-L38 VanDerWaalsContact C-N 3.32Å; E36-L38 PolarHBondContact O-N 2.95Å; L38-K42 PolarHBondContact O-N 3.31Å
39A56.4Low45.9Very low38 Ų38136.8 Ų136.831%0.31467%0.667SS.*Hα-helixtrans-77.8-24.3175.400000114.1D35 E36 V37 R43D35-A39 VanDerWaalsContact O-CB 3.28Å; D35-A39 WeakPolarHBondContact O-CB 3.37Å; D35-A39 PolarHBondContact O-N 3.31Å; E36-A39 CarbonylContact O-C 3.58Å; E36-A39 PolarHBondContact O-N 2.91Å; E36-A39 VanDerWaalsContact O-N 3.16Å; V37-A39 VanDerWaalsContact C-N 3.29Å; V37-A39 PolarHBondContact O-N 3.37Å; A39-R43 PolarHBondContact O-NH1 3.44Å
40K49.9Very low44.9Very low108 Ų108135.6 Ų135.647%0.4767%0.668SS.*Hα-helixtrans-74.7-49.2169.1-81.5168.8170.3151.10110.8E36 V37 K42 R43 E44E36-K40 PolarHBondContact O-N 2.86Å; E36-K40 WeakPolarHBondContact OE1-CE 3.25Å; E36-K40 IonicContact OE1-NZ 2.66Å; E36-K40 PolarHBondContact OE1-NZ 3.13Å; V37-K40 PolarHBondContact O-N 3.4Å; K40-K42 VanDerWaalsContact C-N 3.26Å; K40-K42 PolarHBondContact O-N 3.36Å; K40-R43 WeakPolarHBondContact O-CB 3.5Å; K40-R43 PolarHBondContact O-N 3.39Å; K40-E44 PolarHBondContact O-N 3Å
41Q46.1Very low44.1Very low124 Ų124138.9 Ų138.958%0.57968%0.682SS**Hα-helixtrans-56.5-37.5177.8-162.2178.424.100112.8V37 R43 Q45V37-Q41 PolarHBondContact O-N 3.01Å; Q41-R43 PolarHBondContact O-N 2.94Å; Q41-Q45 PolarHBondContact O-N 2.87Å
42K48Very low43.1Very low154 Ų154136.8 Ų136.867%0.6768%0.682SS**Hα-helixtrans-73.7-14.6174.7-83.7-179.9177.1170.30115.8L38 K40L38-K42 PolarHBondContact O-N 3.31Å; K40-K42 VanDerWaalsContact C-N 3.26Å; K40-K42 PolarHBondContact O-N 3.36Å
43R47.9Very low42Very low180 Ų180137.7 Ų137.768%0.67968%0.682SS**Hα-helixtrans-84.3-46.7171.4-78.2-175.3177.792-11111.2A39 K40 Q41 Q45 K46A39-R43 PolarHBondContact O-NH1 3.44Å; K40-R43 WeakPolarHBondContact O-CB 3.5Å; K40-R43 PolarHBondContact O-N 3.39Å; Q41-R43 PolarHBondContact O-N 2.94Å; R43-Q45 PolarHBondContact O-N 3.48Å; R43-K46 PolarHBondContact O-N 3.31Å
44E39.1Very low41.1Very low150 Ų150138.9 Ų138.970%0.70168%0.682SS**Hα-helixtrans-69.9-34.3-173.8-72.8161.3-160.900112.3K40 K46K40-E44 PolarHBondContact O-N 3Å; E44-K46 PolarHBondContact O-N 2.94Å
45Q38.8Very low40.5Very low172 Ų172137.5 Ų137.580%0.80468%0.68SS**THydrogen-bonded Turntrans-70.812.8175.8-150.6178.736.400114.6Q41 R43Q41-Q45 PolarHBondContact O-N 2.87Å; R43-Q45 PolarHBondContact O-N 3.48Å
46K34.8Very low39.6Very low178 Ų178140.7 Ų140.777%0.77469%0.688SS**THydrogen-bonded Turntrans-126.14.7-175-120.3-177.6-177.6-176.10116.8R43 E44R43-K46 PolarHBondContact O-N 3.31Å; E44-K46 PolarHBondContact O-N 2.94Å
47L38.3Very low38.6Very low148 Ų148139.5 Ų139.578%0.77570%0.698SS**  trans-121.690.8167.1-87.389.2000111.7
48I30Very low37.1Very low175 Ų175142 Ų14290%0.89770%0.703SS**  trans-173106.4133.4-92148.5000107.2
49S27.5Very low35.8Very low110 Ų110145 Ų14577%0.76971%0.713SS**  trans-161.5106161.7-159.40000110.6
50T30.8Very low34.7Very low123 Ų123152.4 Ų152.476%0.75574%0.738SS**  trans28.4123.1157.455.10000121.2
51K29.7Very low33.8Very low210 Ų210156.4 Ų156.491%0.91376%0.755SS**  trans-85128.8159.3-67.2176.6178.5174.10111.2
52T30.7Very low33.1Very low131 Ų131157.2 Ų157.280%0.80476%0.764SS**  trans-153.691.116113.30000113.2
53D26.9Very low32.3Very low126 Ų126158.6 Ų158.667%0.67477%0.769SS**  trans29.4148.7141-147.12000124.9
54K30.9Very low31.7Very low153 Ų153156.9 Ų156.967%0.66577%0.767SS**  trans78.8105.2157.5-77.9137.3-174.4150.60123.9
55K32Very low31.4Very low180 Ų180157.1 Ų157.178%0.78377%0.766SS**  86.8123.2121.9-72.3-178.9177.51750123.7
56K31.2Very low31Very low195 Ų195154.6 Ų154.685%0.84875%0.754SS**  trans78.1106.7133.3-77-166.4171.8-168.30123
57A29.8Very low30.9Very low89 Ų89152.4 Ų152.474%0.73675%0.749SS**  93.4127.6105.400000124
58E25.4Very low30.5Very low146 Ų146152.2 Ų152.268%0.68274%0.744SS**  trans81.1130.3139.4-70.4-127.3105.900125.3
59K28.8Very low30.3Very low155 Ų155150.8 Ų150.867%0.67474%0.738SS**  trans59.5120.6143.5-69167.8176.7138.70120.1
60K32.4Very low30.4Very low194 Ų194148.6 Ų148.684%0.84373%0.734SS**  68.3104.465-84-172.6169.1175.20116.5
61K31.2Very low30.1Very low191 Ų191149.7 Ų149.783%0.8374%0.74SS**  -179.8127.4122.2-97.1164.1-177.7177.20108.7
62N31.9Very low30Very low142 Ų142146.3 Ų146.376%0.75973%0.731SS**  72.4148.979.2-62.34.7000112.4
63K30.9Very low29.8Very low182 Ų182149.3 Ų149.379%0.79173%0.728SS**  cis-169.5133.632.4-160.2-171.7-178.6-175.40114.1
64K34.5Very low29.7Very low144 Ų144149.8 Ų149.863%0.62673%0.726SS**  trans52.1169.9148.8-75.1-162.3156.7-1530119.1E66K64-E66 IonicContact NZ-OE1 2.76Å; K64-E66 PolarHBondContact NZ-OE1 2.81Å; K64-E66 IonicContact NZ-OE2 3.98Å; K64-E66 PolarHBondContact NZ-OE2 3.35Å
65K33.2Very low29.7Very low155 Ų155147 Ų14767%0.67473%0.726SS**  cis-150.4128.813.9-142.4147-176.6-63.80107.4
66E30Very low29.4Very low119 Ų119145.4 Ų145.456%0.55673%0.726SS**  86.8157.357.2-176.5-177.6-128.300113.3K64K64-E66 IonicContact NZ-OE1 2.76Å; K64-E66 PolarHBondContact NZ-OE1 2.81Å; K64-E66 IonicContact NZ-OE2 3.98Å; K64-E66 PolarHBondContact NZ-OE2 3.35Å
67I32.2Very low29.3Very low132 Ų132140.6 Ų140.668%0.67772%0.717SS**  trans94.8125.4-175.1-59.7171.1000112.1
68Q31.6Very low28.9Very low145 Ų145142.6 Ų142.668%0.67871%0.711SS**  cis-161.2166.9-13.4-124.2-179.9-99.600112.2
69N25.8Very low28.8Very low144 Ų144139.9 Ų139.977%0.7770%0.698SS**  trans61.2133.8160.3-56.6-6.4000119.1
70G28.7Very low29Very low65 Ų65137 Ų13767%0.6769%0.693SS**  cis165164-8.300000113.3
71T24.6Very low29.1Very low145 Ų145133.8 Ų133.889%0.8969%0.692SS**  trans74.2139167.8-49.40000116.5
72L26.9Very low29.1Very low139 Ų139130.3 Ų130.373%0.72867%0.674SS**  cis-173.2133.6-23.7178.180.4000109.7
73R27Very low28.7Very low194 Ų194130.1 Ų130.173%0.73267%0.673SS**  trans61.2156.7160.1-84.7-173-178.2-124.4-3.9118.8
74E25.7Very low28.3Very low137 Ų137128.9 Ų128.964%0.6467%0.668SS**  cis-157.4-168.7-21.6-146.2152.9-141.200111.1
75S30.6Very low28Very low93 Ų93129.9 Ų129.965%0.6567%0.672SS**  trans-61.9148.4-168.5-85.80000120.3
76D24.8Very low27.7Very low148 Ų148129.3 Ų129.379%0.79168%0.676SS**  41.9156.3120.6-46.6-59.9000124.1
77S28.5Very low27.5Very low94 Ų94128.5 Ų128.566%0.65768%0.683SS**  trans98.8121.7142.9146.30000121.6
78E23Very low27.1Very low130 Ų130129.5 Ų129.561%0.60769%0.69SS**  71.3116.6129.7-66.8169.211800125.7
79H22.6Very low26.7Very low90 Ų90127.2 Ų127.242%0.41770%0.695SS.*  87136.5113.4-151.5-88.4000122.7Q587 F591H79-Q587 VanDerWaalsContact CD2-CD 3.42Å; H79-Q587 PolarHBondContact CD2-OE1 3.48Å; H79-Q587 PolarHBondContact NE2-OE1 3.14Å; H79-F591 AromaticContact NE2-CE2 3.36Å; H79-F591 WeakPolarHBondContact NE2-CE2 3.21Å; H79-F591 AromaticContact NE2-CZ 3.44Å; H79-F591 WeakPolarHBondContact NE2-CZ 3.46Å
80V33.5Very low26.8Very low93 Ų93125.7 Ų125.756%0.56470%0.696SS**  trans-55147.6170.6167.30000112.7
81P33.6Very low27.5Very low127 Ų127128.3 Ų128.383%0.82570%0.701SS**  -122.5156.7117.7-6.526.3000114.9
82R32.6Very low27.8Very low119 Ų119125.1 Ų125.145%0.44969%0.69SS.*  trans-95.9156.5167-178.1-165.4-71.9-156-4.1108.1Q594R82-Q594 VanDerWaalsContact CZ-CD 3.43Å; R82-Q594 VanDerWaalsContact CZ-OE1 3.27Å
83D22.2Very low27.9Very low138 Ų138127.3 Ų127.374%0.73870%0.696SS**  trans-178.8-166131-90-7.3000114
84F22.8Very low28.3Very low155 Ų155125.3 Ų125.368%0.6870%0.7SS**  -141134-126.8-126.4-125.6000114.6
85K27.2Very low28.5Very low166 Ų166125.7 Ų125.772%0.72270%0.702SS**  trans59.6119.1133.9-130.4-171.2-165.5-1780121.4
86L27.6Very low28.3Very low143 Ų143127.6 Ų127.675%0.74970%0.7SS**  154.8141.7113.3-84.8166.8000116.7
87S26.7Very low28.3Very low101 Ų101128.5 Ų128.571%0.70670%0.698SS**  trans59.6161.9150.6-52.50000120.4
88D23.4Very low28Very low154 Ų154130 Ų13082%0.82470%0.703SS**  cis-156.7176.80.4-140.3-31.7000114.3
89A23.5Very low29.1Very low96 Ų96129.9 Ų129.979%0.79371%0.713SS**  trans82.9161.1150.900000123.5
90S27.8Very low29.1Very low112 Ų112129.7 Ų129.778%0.78373%0.727SS**  trans-136-156.9-164.970.90000111.7
91P43.6Very low30.1Very low121 Ų121131.1 Ų131.179%0.78674%0.738SS**  cis-121.1-140.510.728.7-0.9000112.8
92A29.7Very low30Very low78 Ų78132.9 Ų132.965%0.64574%0.74SS**  cis-162.7167.15.300000114.5
93E29.8Very low30Very low184 Ų184133.6 Ų133.686%0.8675%0.752SS**  trans30.1157.5142.1-65.8166.6-161.700125.1
94D34.5Very low30.2Very low152 Ų152132.8 Ų132.881%0.81375%0.752SS**  cis-170.7-178.2-42-137.2-44.6000113.6
95E29.5Very low30.6Very low145 Ų145128.6 Ų128.668%0.67875%0.746SS**  trans93.9115.3155.6-65.5-127.3106.600126.1
96Q27.4Very low30.6Very low133 Ų133129.2 Ų129.262%0.62175%0.752SS**  96136.5125.3-75-171.61700129.4
97F23.9Very low30.6Very low168 Ų168128.5 Ų128.574%0.73775%0.753SS**  trans52.9118.1156.9-68.2-61.4000123.9
98V22.4Very low30.7Very low126 Ų126128.5 Ų128.576%0.76475%0.754SS**  73.1143.467.8169.70000114
99P46Very low30.6Very low126 Ų126126.1 Ų126.182%0.81875%0.749SS**  cis-131.8-172.422.623.93000118.5
100A24.2Very low30.7Very low86 Ų86127 Ų12771%0.71175%0.749SS**  trans-110.9-157.1-176.500000114.5
101P53.5Low30.6Very low123 Ų123127.5 Ų127.580%0.79975%0.747SS**  -136.9-110.994.729.8-9.2000117.6
102L31.9Very low29.8Very low164 Ų164131.5 Ų131.586%0.85975%0.747SS**  trans-157.1162.5-143.2-72.7173.8000112.2
103N31.8Very low29.6Very low134 Ų134134.8 Ų134.872%0.71775%0.749SS**  cis-144.3-130.2-18.5-173.515.5000107.5
104V27.5Very low29.6Very low122 Ų122137.8 Ų137.874%0.73975%0.752SS**  cis-151.4123.91.6177.70000104.7
105A30.2Very low29.2Very low67 Ų67140.9 Ų140.955%0.55476%0.758SS**  71.5141.876.900000115.8
106E28Very low29.3Very low178 Ų178143.3 Ų143.383%0.83277%0.767SS**  cis-144-153.812.4-147.6152.8-113.200115.4
107T27.5Very low29.4Very low128 Ų128144.9 Ų144.979%0.78577%0.772SS**  trans-113.9-174.9-139.558.80000115.5
108S27.9Very low29.6Very low102 Ų102142.3 Ų142.371%0.71376%0.762SS**  cis-165.9174.322.375.50000111.5
109S23Very low30Very low104 Ų104143.9 Ų143.973%0.72776%0.759SS**  cis-172.5166.9-33.560.50000111.4
110S25.3Very low29.5Very low114 Ų114147 Ų14780%0.79776%0.759SS**  trans70.1146.3165.4-119.90000118
111V24.8Very low29.7Very low122 Ų122151.1 Ų151.174%0.73976%0.764SS**  cis-136.2124.416.6173.30000112.2
112R26.1Very low28.4Very low205 Ų205152.1 Ų152.177%0.77476%0.755SS**  trans43.1133.4131.4-138.8164.7-168.7159.614.1121.1
113E25.8Very low28.4Very low148 Ų148150.3 Ų150.369%0.69275%0.754SS**  cis-157165.6-3.4-126.3161.7-145.100112
114R30.3Very low28.1Very low247 Ų247147.4 Ų147.493%0.93274%0.744SS**  trans-147.5160.3170.3-81.2178.8168.9159.7-5.6109.7
115K25.9Very low28Very low216 Ų216149.9 Ų149.994%0.93975%0.752SS**  trans-136.3171.9172-122.9179-177.9-179.80115.7
116K32.7Very low27.9Very low197 Ų197155.2 Ų155.286%0.85777%0.766SS**  trans-147.4161.2-155.2-92.4177.3176.9177.10110.4
117K29.1Very low27.8Very low166 Ų166155.6 Ų155.672%0.72277%0.767SS**  cis-155175.7-6.1-148.2-154.1177.3-151.90110.6
118E26.9Very low27.8Very low114 Ų114157.6 Ų157.653%0.53377%0.768SS.*  trans-18130.3156.8-87-170.5112.100121.4
119K32.5Very low27.5Very low159 Ų159158.5 Ų158.569%0.69177%0.768SS**  73.9121.6102.3-161.3-178.9179.3178.60122.9
120K35.2Very low27.5Very low190 Ų190161 Ų16183%0.82677%0.772SS**  trans55.6126.5148-72.5-170.5172.1-1670122.2
121Q28.3Very low27.4Very low173 Ų173163.2 Ų163.281%0.80877%0.767SS**  -176.5168.5128.9-110.6-168.710600110.6
122K24.9Very low27.2Very low144 Ų144164.4 Ų164.463%0.62677%0.765SS**  cis-120.3-107.9-14-163.5-171-169.4-164.70109.3S124K122-S124 VanDerWaalsContact CE-OG 3.32Å; K122-S124 WeakPolarHBondContact CE-OG 3.48Å; K122-S124 PolarHBondContact NZ-OG 3.36Å
123P33.6Very low27.1Very low127 Ų127160.3 Ų160.383%0.82577%0.768SS**  cis-96.8-165.2-23.441.8-33.2000112.8
124S23.9Very low26.8Very low73 Ų73160.9 Ų160.951%0.5178%0.775SS.*  trans-171.3156.7-17757.10000112.4K122K122-S124 VanDerWaalsContact CE-OG 3.32Å; K122-S124 WeakPolarHBondContact CE-OG 3.48Å; K122-S124 PolarHBondContact NZ-OG 3.36Å
125L27.1Very low26.6Very low173 Ų173153 Ų15391%0.90676%0.763SS**  trans-157.1168.6153.3-115.2160.8000111
126E26.9Very low26.6Very low180 Ų180147.4 Ų147.484%0.84175%0.751SS**  trans-125.2-174.5-162.3-68176.990.400112.9
127E25.2Very low26.2Very low186 Ų186147.1 Ų147.187%0.86975%0.75SS**  trans85.2160.1164-148.3171.9-141.100118.4
128Q27.6Very low26.2Very low170 Ų170146 Ų14679%0.79475%0.75SS**  -159.1164.5-77.9-149.7178.191.600109.6
129V21.7Very low27.2Very low120 Ų120146.7 Ų146.773%0.72777%0.765SS**  trans76.7158.1163.7-173.20000118.1
130I23Very low26.9Very low157 Ų157142.6 Ų142.681%0.80577%0.768SS**  trans78.299.8-173.6-47.7177.3000112.7
131K24.4Very low26.5Very low160 Ų160143.1 Ų143.170%0.69677%0.77SS**  cis89119.928.3-155.8176.5-173-88.20114.5
132E21.1Very low26.2Very low147 Ų147144.2 Ų144.269%0.68777%0.772SS**  trans74.6127.3160.5-86.2156.2-148.300122.9
133S22.5Very low26.2Very low119 Ų119143.1 Ų143.183%0.83278%0.778SS**  trans73.2163.214073.10000121.1
134D20.9Very low25.4Very low160 Ų160145.4 Ų145.486%0.85678%0.777SS**  cis-157.6174.8-49.4-162.66.3000108.6
135A25.6Very low26.9Very low81 Ų81146.7 Ų146.767%0.66978%0.784SS**  trans-75.2149.7-163.300000118
136S26.5Very low26.6Very low100 Ų100144.5 Ų144.570%0.69978%0.777SS**  trans-153.3124.8135.2-156.60000109.5
137K24.5Very low26.5Very low190 Ų190143 Ų14383%0.82677%0.774SS**  cis87.8156.526-159.3175.2-172.4170.50113.9
138I29Very low26.5Very low142 Ų142139.7 Ų139.773%0.72877%0.767SS**  trans112.4140.8164.9-62.7158000113.7
139P46.4Very low26.4Very low130 Ų130136.9 Ų136.984%0.84476%0.761SS**  cis-96.1179.6-13.27.815000111.4
140G26.4Very low26.5Very low73 Ų73139.9 Ų139.975%0.75376%0.764SS**  cis148.2146.63.800000108.5
141K26.8Very low26.7Very low200 Ų200140.8 Ų140.887%0.8777%0.765SS**  cis-169.3137.116.3-173.8-177.9-172.71780111.8
142K21.6Very low27.7Very low196 Ų196137.9 Ų137.985%0.85276%0.763SS**  trans71.3174157.9-90.3-162.5170.7-160.30121.8
143V24.8Very low28Very low122 Ų122135.5 Ų135.574%0.73977%0.768SS**  trans-150.1152.8-159.2161.50000108.9
144E18.5Very low29.4Very low175 Ų175135.4 Ų135.482%0.81876%0.764SS**  trans64.7162.7168.7-82.5-170123.700119.1
145P53.6Low30.6Very low100 Ų100133.1 Ų133.165%0.64976%0.759SS**  cis-142.9-170.3-48.141.4-23.1000114.4
146V22.5Very low32Very low126 Ų126135.2 Ų135.276%0.76477%0.765SS**  trans79.8134145.9155.70000122.8
147L24.7Very low33.3Very low148 Ų148135.2 Ų135.278%0.77576%0.763SS**  trans60.6111.9156-10179.9000125.6
148V24.6Very low33.4Very low118 Ų118133.2 Ų133.272%0.71576%0.761SS**  83144.9110.9153.70000125.6
149T24.5Very low33.3Very low111 Ų111134.4 Ų134.468%0.68176%0.763SS**  trans86.6123.9158.935.40000124.9
150K25.6Very low32.3Very low182 Ų182132.2 Ų132.279%0.79176%0.756SS**  trans71.4111135-68.5170-179.81770122.9
151Q27.1Very low32.3Very low177 Ų177133.5 Ų133.583%0.82776%0.759SS**  30.8161.8102.3-82-167.1-3000121.5
152P45.5Very low32.1Very low99 Ų99128.3 Ų128.364%0.64375%0.754SS**  cis-148.8159.8-28.639.4-21000117.8
153A26.5Very low32.3Very low96 Ų96126 Ų12679%0.79375%0.75SS**  trans50.9-154.4144.100000117.3
154P51.6Low32.2Very low117 Ų117128.9 Ų128.976%0.7675%0.753SS**  cis-123.9-155.2-24.243.2-25.2000110.8
155P46.1Very low32.6Very low113 Ų113129.9 Ų129.973%0.73475%0.754SS**  cis-126.7179-5.440.8-21.4000116.3
156P55.8Low31.2Very low124 Ų124135 Ų13581%0.80577%0.766SS**  trans-86.4-112.2-162.633.4-27.7000116.5
157P52.4Low31.4Very low101 Ų101134.1 Ų134.166%0.65677%0.772SS**  cis-137.9156.2943-23.5000119.3
158L26.7Very low31.4Very low148 Ų148130.3 Ų130.378%0.77577%0.768SS**  trans60.1157.6140.5-62.3168.9000122.2
159E26.9Very low31.6Very low167 Ų167132.7 Ų132.778%0.7877%0.772SS**  cis-168.8167.3-32.5-152172.9-139.900111.5
160A26.7Very low31.7Very low83 Ų83135.5 Ų135.569%0.68677%0.774SS**  trans55.9117149.900000125
161A25.6Very low31.7Very low100 Ų100136 Ų13683%0.82678%0.777SS**  75.2146.8122.400000125.7
162A23.9Very low31.7Very low92 Ų92132.9 Ų132.976%0.7678%0.775SS**  trans79.3106.4144.300000124.1
163L24.9Very low30.9Very low147 Ų147136.2 Ų136.277%0.7778%0.779SS**  39.7133.4129.3-95.369.8000124.4
164K23.5Very low30.9Very low183 Ų183138 Ų13880%0.79678%0.775SS**  trans92.7143.6134.3-81.1173.8178.3165.20122.6
165K25.2Very low29.7Very low195 Ų195135.9 Ų135.985%0.84878%0.775SS**  trans86.695.9153.6-78.7-179.7175.2-178.90121.9
166K25.6Very low28.8Very low208 Ų208135 Ų13590%0.90477%0.771SS**  21.2127.5122.4-73.9-175.9171.3-179.10119.8
167A25.8Very low27.3Very low108 Ų108136.8 Ų136.889%0.89377%0.768SS**  156.5148.1102.400000112.1
168G25.6Very low26Very low67 Ų67139 Ų13969%0.69177%0.77SS**  cis160.7-178.8-8.500000113.9
169Q28.8Very low26.1Very low169 Ų169138.9 Ų138.979%0.7977%0.766SS**  trans74146.1175.1-57.5-166.225.500116.7
170K25.6Very low26Very low169 Ų169135.5 Ų135.574%0.73575%0.753SS**  cis-141.7139.40.5-111.5146.2174.1165.60107.8
171K26.5Very low26.4Very low193 Ų193139.8 Ų139.884%0.83976%0.756SS**  52.214188.4-74.4-172.8172.7-1770114.7
172S27.4Very low26.5Very low112 Ų112143.9 Ų143.978%0.78376%0.755SS**  cis-114.8158.422.440.90000115
173K27.8Very low26.7Very low168 Ų168145 Ų14573%0.7375%0.752SS**  cis79.6135.941.6-143.7-163.8178.2-95.90111.8
174N26.4Very low26.7Very low135 Ų135145.5 Ų145.572%0.72275%0.751SS**  cis-116.3-17510-44.7-73.1000111.2
175G27Very low26.9Very low72 Ų72143.2 Ų143.274%0.74275%0.745SS**  cis142154.88.300000108.6
176S26.1Very low26.8Very low95 Ų95140.5 Ų140.566%0.66474%0.738SS**  cis-164.4167.75.8-129.40000111.1
177E24.2Very low26.8Very low160 Ų160138.1 Ų138.175%0.74873%0.733SS**  trans35.3149.3146.9-71.6126.2-175.100123.1
178E25.1Very low27.2Very low147 Ų147137.4 Ų137.469%0.68773%0.727SS**  cis-168.8166.9-13.2-115-168.2143.500112.3
179Q28.7Very low27.6Very low146 Ų146140.3 Ų140.368%0.68273%0.733SS**  trans36.3146.6143.5-65.9-170.545.100122.7
180D26.1Very low27.5Very low96 Ų96138 Ų13851%0.51374%0.736SS.*  cis-165.2154.30.3-136.3-21.2000114.5
181K35.2Very low27.7Very low173 Ų173139.8 Ų139.875%0.75274%0.744SS**  trans49.4152.2154.7-70.9144.3-164.1156.30120.5
182K27.4Very low27.6Very low187 Ų187140.2 Ų140.281%0.81375%0.748SS**  cis-152.4121.618.1-164.7-177.7175.5-170.40107.9
183V28.8Very low27.5Very low114 Ų114143 Ų14369%0.69175%0.749SS**  5312287.1-175.60000112.1
184E24.8Very low27.3Very low158 Ų158142.2 Ų142.274%0.73875%0.753SS**  cis-153.4138.848.1-149.8152.2-167.700109.6
185M26.1Very low27.2Very low136 Ų136141.1 Ų141.167%0.6775%0.751SS**  68.213663.1-134.6166.659.600112.8
186L24.2Very low27Very low137 Ų137144.9 Ų144.972%0.71775%0.753SS**  cis-130.7142.427-96.586.8000112.7
187M26.2Very low26.8Very low159 Ų159148.1 Ų148.178%0.78376%0.762SS**  71.6136.385.3-59.2-81.2-16900117.4
188A34.1Very low26.7Very low93 Ų93144.6 Ų144.677%0.76976%0.755SS**  trans-124.6147.2160.100000109.8
189P33Very low26.6Very low128 Ų128145.3 Ų145.383%0.83176%0.758SS**  trans-135.8179.3154.936.5-20.8000114.1
190S26.8Very low26.5Very low120 Ų120145.5 Ų145.584%0.83976%0.759SS**  trans-93169.7-166.2-620000115.9
191K31.2Very low26.4Very low207 Ų207147 Ų14790%0.977%0.767SS**  trans-22.2146.1163.8-56.7175177.2-179.80117.5
192E24.3Very low25.9Very low201 Ų201144.1 Ų144.194%0.93976%0.764SS**  trans-144.3-178.2138.2-144.2158.7-13500110.6
193Q25.1Very low25.8Very low171 Ų171144.2 Ų144.280%0.79977%0.765SS**  trans-151.7132.1-153.7169.5-174.8-17.600113.5
194D22.3Very low25.8Very low152 Ų152147.7 Ų147.781%0.81377%0.773SS**  trans-174.2176.4156.8-106.4-13.2000111.1
195V24.4Very low25.9Very low111 Ų111149.7 Ų149.767%0.67378%0.783SS**  -161.9143.1-74.1136.20000111.5
196L23.8Very low26Very low152 Ų152146.7 Ų146.780%0.79679%0.786SS**  trans59.6116.2160-16375.5000121.7
197L22.3Very low26.1Very low163 Ų163143.1 Ų143.185%0.85378%0.783SS**  trans155.1121.1146.1-88.1160.7000107.4
198S21.1Very low26.2Very low86 Ų86144.2 Ų144.260%0.60179%0.791SS**  cis96.5106.216.4-151.60000115.2
199H23.5Very low25.8Very low161 Ų161143.1 Ų143.175%0.74579%0.789SS**  trans68.5143.2166.2-77-87.7000118.2
200Q25.2Very low25.5Very low150 Ų150146 Ų14670%0.70179%0.788SS**  cis-159.9-175.6-7.5-156.7166.3-38.300111.7
201D25.1Very low25.5Very low129 Ų129149.1 Ų149.169%0.6979%0.787SS**  trans90.5141156.6-64.1-21.1000119
202T25Very low25.3Very low112 Ų112148.9 Ų148.969%0.68779%0.785SS**  cis-151.8158.1-2.52.50000113.8
203K23.8Very low25.4Very low189 Ų189142.7 Ų142.782%0.82278%0.776SS**  trans63.3144.6161.7-64.8175.4-177.6-1770117
204Q30Very low25.3Very low187 Ų187142.3 Ų142.387%0.87478%0.778SS**  cis62.396.2-1.3-164.6177.761.400119.1
205E27.5Very low25.4Very low200 Ų200140 Ų14094%0.93577%0.774SS**  -167137.8120.5-165.2165.4-139.100107.4
206G27.5Very low25.4Very low72 Ų72144.1 Ų144.174%0.74278%0.783SS**  cis-175158.2-11.800000108.7
207G26.8Very low25.5Very low63 Ų63145.4 Ų145.465%0.64978%0.782SS**  cis172.9-179.9-5.200000112.4
208L27.1Very low25.7Very low182 Ų182144.5 Ų144.595%0.95377%0.773SS**  trans62.9138.3170.7-56.9101.1000119
209G26.2Very low25.9Very low70 Ų70149 Ų14972%0.72278%0.782SS**  cis159.3142-18.300000117.5
210K26.9Very low26Very low188 Ų188145.6 Ų145.682%0.81778%0.777SS**  trans82.7120.3148.9-64.5172.7-179.3166.80121.8
211K26.9Very low25.8Very low186 Ų186147.5 Ų147.581%0.80979%0.786SS**  90.1129.1128.8-80-178.5175.3-176.80121.9
212K26.7Very low25.9Very low201 Ų201148.8 Ų148.887%0.87479%0.792SS**  trans32119.1138.6-68.7-168.4171.3-168.10118.8
213G26.1Very low25.9Very low71 Ų71149.7 Ų149.773%0.73280%0.798SS**  trans-77.116115900000113.8
214L22.3Very low26Very low163 Ų163144.8 Ų144.885%0.85379%0.792SS**  trans-163142.7165.9-147.681.4000110
215S24.2Very low25.8Very low104 Ų104141.5 Ų141.573%0.72779%0.785SS**  trans57129.2163.1-57.30000118.9
216K25.5Very low25.9Very low197 Ų197139.4 Ų139.486%0.85778%0.779SS**  cis79.3134.838.5-166.3175.2-177.7173.80113.9
217K25.4Very low25.9Very low179 Ų179141.4 Ų141.478%0.77878%0.776SS**  trans81.1146.4-169-69.5-177.4150-142.60113.2
218Q26.5Very low25.9Very low144 Ų144145.9 Ų145.967%0.67379%0.785SS**  cis-150.5139.5-0.7-137.1168.5-102.300108.8
219K25.3Very low25.9Very low181 Ų181145.7 Ų145.779%0.78778%0.78SS**  19.7132.195-90.5-155.2174.4-170.70114.9
220S25.1Very low26.7Very low90 Ų90147.1 Ų147.163%0.62978%0.776SS**  cis172159.24.4400000107.9
221E22.8Very low26.7Very low190 Ų190145 Ų14589%0.88877%0.773SS**  trans-162.8159.7130.7-114.8163.4169.900113.5
222N26.3Very low26.8Very low155 Ų155142.5 Ų142.583%0.82977%0.767SS**  trans-125.3164.3179.7-72.1-28.3000108.9
223V24.3Very low26.8Very low132 Ų132141 Ų14180%0.876%0.763SS**  trans165.8111.2141.7151.50000104.8
224A27.2Very low27Very low86 Ų86142 Ų14271%0.71176%0.764SS**  70.5148.255.700000111.6
225V24.5Very low27.2Very low118 Ų118141.1 Ų141.172%0.71577%0.766SS**  cis-163.6152.240.9171.50000110.5
226L29.7Very low27.4Very low156 Ų156142.4 Ų142.482%0.81777%0.77SS**  trans61.6121.9158.9-77.4165.5000122
227V27.5Very low27.5Very low113 Ų113143.4 Ų143.469%0.68577%0.77SS**  160.1138.389.8125.20000114
228D27.5Very low27.8Very low157 Ų157141.2 Ų141.284%0.8477%0.765SS**  trans56.5149.9159.3-60.3-2.8000125.9
229E26.6Very low28.2Very low178 Ų178139.8 Ų139.883%0.83277%0.768SS**  trans-131.4158.9179.9159.2-179.4-155.100105.7
230P43.9Very low28.3Very low100 Ų100137.9 Ų137.965%0.64977%0.766SS**  cis-131.1-170.711.624.51.4000115.4
231L26.6Very low28.6Very low143 Ų143140.2 Ų140.275%0.74977%0.771SS**  135.5113.4112.4-157.568.6000117.6
232I28.3Very low28.8Very low135 Ų135138 Ų13869%0.69277%0.766SS**  trans77.8124.1146.8-77.7173.3000122.9
233H27.1Very low29Very low168 Ų168134.2 Ų134.278%0.77876%0.756SS**  trans40.8107.2153.4-71.4-65000124.2
234A30.4Very low29.3Very low92 Ų92134.9 Ų134.976%0.7676%0.755SS**  58.4121.2113.200000121.6
235T26.6Very low29.4Very low146 Ų146135.6 Ų135.690%0.89675%0.754SS**  trans-135.7151.6165.3-62.40000110.7
236T29.3Very low29.5Very low130 Ų130136.6 Ų136.680%0.79876%0.756SS**  trans-68.9158.6-170.5-53.60000115.9
237Y27.4Very low29.5Very low218 Ų218136.3 Ų136.386%0.85576%0.755SS**  trans-50.4154.6174.7-150.2-104.4000115.8
238I30.4Very low29.4Very low134 Ų134139.4 Ų139.469%0.68776%0.764SS**  trans-112129.6177.2-60168.9000109.8
239P35Very low29.4Very low114 Ų114140.5 Ų140.574%0.7477%0.766SS**  trans-101.4138.5164.535.5-28.3000111.9
240L28.7Very low29.5Very low140 Ų140136.9 Ų136.973%0.73375%0.752SS**  trans-154.4128.7171.8-102.2168.2000111.1
241D30.4Very low28.9Very low139 Ų139138.3 Ų138.374%0.74375%0.748SS**  trans55.4155.4154.8-58.3-11.3000120
242N27.1Very low29.2Very low145 Ų145140 Ų14078%0.77574%0.744SS**  cis-143.71682.7-152.7-18.7000111.2
243A30.6Very low29.5Very low75 Ų75139.6 Ų139.662%0.6274%0.74SS**  trans-105.7177.9175.700000113.2
244N30.4Very low29.5Very low146 Ų146138.5 Ų138.578%0.78174%0.738SS**  trans122.7145.3167.1-69.3-60000113.2
245S30.4Very low29.6Very low100 Ų100141.2 Ų141.270%0.69974%0.738SS**  cis-146.4143.413.257.90000115
246N26.8Very low29.6Very low139 Ų139141 Ų14174%0.74373%0.732SS**  trans31.3130.7143.9-58.1-31.1000121.4
247L28.1Very low29.6Very low151 Ų151141.8 Ų141.879%0.79173%0.728SS**  cis96.6107.435.8-172.1131.9000115
248M25.8Very low29.7Very low178 Ų178139.5 Ų139.588%0.87773%0.729SS**  trans-147.6141.2154.4-91-80.217300104.4
249M27.9Very low29.6Very low180 Ų180141.9 Ų141.989%0.88773%0.734SS**  cis-135.7137.127.6-168.2171.4-169.800112
250D27.8Very low29.7Very low102 Ų102141.5 Ų141.555%0.54573%0.732SS.*  trans-93.5149.6169-153.32000106.5
251K31.8Very low29.6Very low130 Ų130141.9 Ų141.957%0.56574%0.735SS**  cis-173.3172.949.9-141.4139.7-168.5132.30106.6
252R32.9Very low29.6Very low177 Ų177143.1 Ų143.167%0.66874%0.736SS**  cis-167.3124.428.8164.7141.5-89.3172.5-13.8111.5
253E34.4Very low29.7Very low128 Ų128142.3 Ų142.360%0.59874%0.736SS**  trans46.8153.1144-58.6140.9-144.600119.3
254I28.1Very low29.7Very low145 Ų145147.1 Ų147.174%0.74475%0.745SS**  cis-153.7131.548.5-80.9176.6000111.2
255I31.2Very low29.4Very low148 Ų148143.8 Ų143.876%0.75975%0.746SS**  trans50.4111.6148.4-62.5172.7000117.9
256D27.7Very low29.5Very low143 Ų143145.9 Ų145.977%0.76575%0.747SS**  61.214676.9-95.5-8.9000115.1
257M29.3Very low29.6Very low145 Ų145146.2 Ų146.271%0.71475%0.745SS**  cis-166.3126.8-11.3-179179.559.600109.3
258I28.7Very low29.5Very low171 Ų171147 Ų14788%0.87774%0.742SS**  trans-140.1131.8152.6-65.7-171.8000108.4
259K29.4Very low29.5Very low183 Ų183144.7 Ų144.780%0.79674%0.743SS**  trans-101161.6173.9-98.9-173.1175.8-178.10111.5
260P35.9Very low29.3Very low106 Ų106139.9 Ų139.969%0.68874%0.739SS**  trans-89.5-163.1-167.239.6-39.9000113.6
261D26.5Very low29.2Very low148 Ų148141.2 Ų141.279%0.79175%0.752SS**  trans100.9133.2168-63.1-16.8000116.1
262H31.2Very low29Very low166 Ų166143.7 Ų143.777%0.76976%0.763SS**  cis-153.7167-14.5-174.3-88.3000109.3E264H262-E264 PolarHBondContact O-N 3.31Å
263V29.3Very low28.9Very low128 Ų128144.5 Ų144.578%0.77677%0.771SS**  trans-54.5130.6174.5178.80000111.8
264E29.3Very low28.7Very low175 Ų175145.9 Ų145.982%0.81878%0.782SS**  trans-88.5140.9-178.7-174.3176.1-153.900113.2H262H262-E264 PolarHBondContact O-N 3.31Å
265G25.7Very low28.7Very low77 Ų77148.2 Ų148.279%0.79479%0.786SS**  trans-115.2105.5173.900000112
266I32.1Very low28.6Very low143 Ų143147.1 Ų147.173%0.73378%0.781SS**  trans-63.5134.8-168.5-58.9157.6000113.9
267Q27.5Very low28.6Very low147 Ų147149.6 Ų149.669%0.68779%0.787SS**  -173.4123122-102.517885.400118.3
268K27.7Very low28.9Very low166 Ų166147.9 Ų147.972%0.72279%0.786SS**  trans78.7125.1135.8-76.8169.5-179160.50123.6
269S25.8Very low28.9Very low131 Ų131145.3 Ų145.392%0.91677%0.774SS**  trans87.7146.913779.90000119.7
270G24.1Very low29.3Very low78 Ų78144.7 Ų144.780%0.80477%0.771SS**  trans13881.1171.500000115.7
271T25.7Very low29.1Very low131 Ų131148.2 Ų148.280%0.80478%0.778SS**  trans-81.4134175.7-32.20000112.1
272K27Very low29.3Very low182 Ų182148.6 Ų148.679%0.79178%0.78SS**  155.7149.8128.8-85.9153.1-171.6166.30116.7
273K29.3Very low29.6Very low194 Ų194144.9 Ų144.984%0.84378%0.778SS**  trans75.289.1148.5-75.6173.3176.7-1740121.2
274L30.3Very low30.1Very low157 Ų157147.4 Ų147.482%0.82278%0.781SS**  6.5125.5116.4-85.2157.7000119.1I276L274-I276 HydrophobicContact CD2-CG1 4.43Å
275K28.9Very low30.8Very low194 Ų194144.4 Ų144.484%0.84378%0.775SS**  trans-161.4103.1134.7-137.3177.7178.3-164.80107.2
276I28.6Very low32.4Very low125 Ų125148 Ų14864%0.64177%0.768SS**  54.7106.683.1-55.4169.3000112.3L274L274-I276 HydrophobicContact CD2-CG1 4.43Å
277E28.6Very low33.5Very low194 Ų194148.5 Ų148.591%0.90777%0.766SS**  trans-142.4153.3132.2-151.1149.6-116.800108.2
278T35.3Very low35.2Very low110 Ų110149 Ų14968%0.67577%0.766SS**  trans-158134.8-163-47.50000110.7
279D28Very low36.7Very low117 Ų117144.2 Ų144.263%0.62675%0.748SS**  trans-166125.9145.4-98.1-5.8000109.9
280K37.5Very low38.7Very low169 Ų169143.4 Ų143.474%0.73573%0.728SS**  65.4130.999.9-61177-163.21230112.6
281E33.3Very low40.8Very low180 Ų180143.7 Ų143.784%0.84171%0.711SS**  cis-148.5-167.740.3-143.9167.9-173.400114.2
282N29.9Very low42.9Very low157 Ų157142.1 Ų142.184%0.8470%0.697SS**  trans-83.8175-173.8-48.9-73.1000112.4
283A37.9Very low44.7Very low87 Ų87136.7 Ų136.772%0.71968%0.682SS**  cis-157.5-178.314.800000113.1
284E39.9Very low46.5Very low181 Ų181131.2 Ų131.285%0.84666%0.662SS**  trans58.765.2163.1-60-160.8145.900119.1
285V42.8Very low48.3Very low113 Ų113132.3 Ų132.369%0.68566%0.659SS**  trans-69.1124.1164.9178.80000110.5D289V285-D289 HydrophobicContact CG1-CB 3.69Å
286K60.3Low50.1Low151 Ų151128.5 Ų128.566%0.65765%0.653SS**  trans-82.4160.7179.1-62.9158.4-175.2164.40110.4K288 D289 F290K286-K288 PolarHBondContact O-N 2.91Å; K286-K288 VanDerWaalsContact O-N 3.07Å; K286-D289 WeakPolarHBondContact CB-OD2 3.38Å; K286-D289 PolarHBondContact N-OD2 2.7Å; K286-D289 VanDerWaalsContact N-OD2 3.11Å; K286-D289 WeakPolarHBondContact O-CA 3.29Å; K286-D289 WeakPolarHBondContact O-CB 3.31Å; K286-D289 PolarHBondContact O-N 3.14Å; K286-F290 PolarHBondContact O-N 3.22Å
287F55.2Low51.9Low154 Ų154127.5 Ų127.568%0.67565%0.647SS**Hα-helixtrans-54.9-32-179.3-178.3-104.9000113.7D289 L291F287-D289 VanDerWaalsContact C-N 3.32Å; F287-L291 HydrophobicContact CD1-CD1 4.07Å; F287-L291 HydrophobicContact CE1-CD1 3.61Å; F287-L291 HydrophobicContact CE1-CG 4.29Å; F287-L291 HydrophobicContact CZ-CD1 4.09Å; F287-L291 HydrophobicContact CZ-CG 4.38Å; F287-L291 WeakPolarHBondContact O-CG 3.28Å; F287-L291 PolarHBondContact O-N 2.93Å; F287-L291 VanDerWaalsContact O-N 3.09Å
288K63.9Low53.1Low158 Ų158126.8 Ų126.869%0.68765%0.646SS**Hα-helixtrans-65.1-35.2173.7-167.3178.5-176.6-177.40112.7K286 L291 L292K286-K288 PolarHBondContact O-N 2.91Å; K286-K288 VanDerWaalsContact O-N 3.07Å; K288-L291 PolarHBondContact O-N 2.81Å; K288-L292 WeakPolarHBondContact O-CG 3.33Å; K288-L292 PolarHBondContact O-N 3.27Å
289D57.6Low54.6Low65 Ų65125.3 Ų125.335%0.34863%0.63SS.*Hα-helixtrans-81.8-32.1-178.6-48-38.5000110.6V285 K286 F287 L292 S293V285-D289 HydrophobicContact CG1-CB 3.69Å; K286-D289 WeakPolarHBondContact CB-OD2 3.38Å; K286-D289 PolarHBondContact N-OD2 2.7Å; K286-D289 VanDerWaalsContact N-OD2 3.11Å; K286-D289 WeakPolarHBondContact O-CA 3.29Å; K286-D289 WeakPolarHBondContact O-CB 3.31Å; K286-D289 PolarHBondContact O-N 3.14Å; F287-D289 VanDerWaalsContact C-N 3.32Å; D289-L292 PolarHBondContact O-N 3.04Å; D289-S293 WeakPolarHBondContact O-CB 3.49Å; D289-S293 PolarHBondContact O-N 3.42Å
290F67.9Low56.7Low114 Ų114122.4 Ų122.450%0.562%0.619SS.*Hα-helixtrans-58.9-45.8165.1174.7-99.8000111.5K286 L292 S293 L294K286-F290 PolarHBondContact O-N 3.22Å; F290-L292 PolarHBondContact O-N 3.46Å; F290-S293 PolarHBondContact O-N 2.89Å; F290-L294 WeakPolarHBondContact O-CB 3.35Å; F290-L294 PolarHBondContact O-N 3.44Å
291L68.3Low57.9Low84 Ų84122.2 Ų122.244%0.4462%0.62SS.*Hα-helixtrans-66.8-32.8175.8-71.9174.6000113.3F287 K288 K295F287-L291 HydrophobicContact CD1-CD1 4.07Å; F287-L291 HydrophobicContact CE1-CD1 3.61Å; F287-L291 HydrophobicContact CE1-CG 4.29Å; F287-L291 HydrophobicContact CZ-CD1 4.09Å; F287-L291 HydrophobicContact CZ-CG 4.38Å; F287-L291 WeakPolarHBondContact O-CG 3.28Å; F287-L291 PolarHBondContact O-N 2.93Å; F287-L291 VanDerWaalsContact O-N 3.09Å; K288-L291 PolarHBondContact O-N 2.81Å; L291-K295 WeakPolarHBondContact O-CB 3.29Å; L291-K295 PolarHBondContact O-N 3Å; L291-K295 VanDerWaalsContact O-N 3.15Å
292L70.3Confident59.7Low98 Ų98119.6 Ų119.651%0.51361%0.612SS.*Hα-helixtrans-68.5-42.9172.2-80.1162.5000111.7K288 D289 F290 K295 T296K288-L292 WeakPolarHBondContact O-CG 3.33Å; K288-L292 PolarHBondContact O-N 3.27Å; D289-L292 PolarHBondContact O-N 3.04Å; F290-L292 PolarHBondContact O-N 3.46Å; L292-K295 WeakPolarHBondContact O-CA 3.47Å; L292-K295 WeakPolarHBondContact O-CB 3.43Å; L292-K295 PolarHBondContact O-N 3.4Å; L292-K295 VanDerWaalsContact O-N 3.11Å; L292-T296 PolarHBondContact O-N 3.05Å; L292-T296 VanDerWaalsContact O-N 3.1Å; L292-T296 PolarHBondContact O-OG1 2.91Å
293S65.8Low61.8Low68 Ų68116.7 Ų116.748%0.47659%0.594SS.*Hα-helixtrans-64-42.4175.8-167.80000112D289 F290 K295 T296 M297D289-S293 WeakPolarHBondContact O-CB 3.49Å; D289-S293 PolarHBondContact O-N 3.42Å; F290-S293 PolarHBondContact O-N 2.89Å; S293-K295 PolarHBondContact O-N 2.85Å; S293-T296 PolarHBondContact O-N 3.23Å; S293-T296 VanDerWaalsContact O-N 3.12Å; S293-T296 PolarHBondContact O-OG1 3.06Å; S293-M297 WeakPolarHBondContact O-CB 3.42Å; S293-M297 PolarHBondContact O-N 3.35Å
294L67.1Low63.4Low80 Ų80114.3 Ų114.342%0.41957%0.574SS.*Hα-helixtrans-63.3-24.8173.5-159.577.2000112.6F290 F299F290-L294 WeakPolarHBondContact O-CB 3.35Å; F290-L294 PolarHBondContact O-N 3.44Å; L294-F299 HydrophobicContact CD1-CZ 4.04Å
295K68.1Low64.9Low179 Ų179109.9 Ų109.978%0.77856%0.556SS**Hα-helixtrans-83.8-21.1175.9-177.7176.5176.4-177.20113.3L291 L292 S293L291-K295 WeakPolarHBondContact O-CB 3.29Å; L291-K295 PolarHBondContact O-N 3Å; L291-K295 VanDerWaalsContact O-N 3.15Å; L292-K295 WeakPolarHBondContact O-CA 3.47Å; L292-K295 WeakPolarHBondContact O-CB 3.43Å; L292-K295 PolarHBondContact O-N 3.4Å; L292-K295 VanDerWaalsContact O-N 3.11Å; S293-K295 PolarHBondContact O-N 2.85Å
296T66.4Low66.5Low115 Ų115108.9 Ų108.971%0.70655%0.552SS**Hα-helixtrans-103.9-9175.847.40000114.2L292 S293 M298L292-T296 PolarHBondContact O-N 3.05Å; L292-T296 VanDerWaalsContact O-N 3.1Å; L292-T296 PolarHBondContact O-OG1 2.91Å; S293-T296 PolarHBondContact O-N 3.23Å; S293-T296 VanDerWaalsContact O-N 3.12Å; S293-T296 PolarHBondContact O-OG1 3.06Å; T296-M298 PolarHBondContact O-N 2.94Å
297M66.1Low67Low104 Ų104104.7 Ų104.751%0.51254%0.539SS..  trans-75.8113.9175.5-170.4168.5-173.100111.1S293 F299S293-M297 WeakPolarHBondContact O-CB 3.42Å; S293-M297 PolarHBondContact O-N 3.35Å; M297-F299 PolarHBondContact O-N 3.38Å
298M53.7Low67.8Low179 Ų179100.5 Ų100.588%0.88253%0.526SS*.  trans-79.6111.2168-61.9-138.2-54.200109.6T296T296-M298 PolarHBondContact O-N 2.94Å
299F67.4Low68.4Low79 Ų7997 Ų9735%0.34652%0.515SS..  trans-72143169.8-59.5-87000110.5L294 M297 E303 A304 V307L294-F299 HydrophobicContact CD1-CZ 4.04Å; M297-F299 PolarHBondContact O-N 3.38Å; F299-E303 HydrophobicContact CB-CB 4.38Å; F299-E303 HydrophobicContact CD1-CB 4.25Å; F299-A304 HydrophobicContact CB-CB 3.89Å; F299-A304 HydrophobicContact CG-CB 4.43Å; F299-V307 HydrophobicContact CD1-CG2 4.46Å; F299-V307 HydrophobicContact CE1-CG2 3.96Å
300S72.2Confident69.2Low56 Ų5698.7 Ų98.739%0.39252%0.523SS..  trans-68.4161.6154.264.20000110.5D302 E303 A304S300-D302 VanDerWaalsContact C-N 3.28Å; S300-D302 PolarHBondContact O-N 3.05Å; S300-E303 VanDerWaalsContact CB-OE2 3.3Å; S300-E303 WeakPolarHBondContact CB-OE2 3.33Å; S300-E303 PolarHBondContact N-OE2 2.98Å; S300-E303 PolarHBondContact O-N 3.25Å; S300-E303 VanDerWaalsContact OG-CG 3.24Å; S300-E303 WeakPolarHBondContact OG-CG 3.26Å; S300-E303 PolarHBondContact OG-N 3.41Å; S300-E303 PolarHBondContact OG-OE2 3.31Å; S300-A304 WeakPolarHBondContact O-CB 3.49Å; S300-A304 PolarHBondContact O-N 3.07Å
301E62.7Low69.3Low164 Ų16498.6 Ų98.677%0.76653%0.528SS*.Hα-helixtrans-60-38.5-177.3-166.1166.3-168.200112L305E301-L305 VanDerWaalsContact O-CG 3.29Å; E301-L305 WeakPolarHBondContact O-CG 3.44Å; E301-L305 PolarHBondContact O-N 3.08Å
302D70.4Confident69.5Low126 Ų126100.5 Ų100.567%0.67453%0.532SS*.Hα-helixtrans-66.9-42174.9-64.4-45.8000112.8S300 L305 C306S300-D302 VanDerWaalsContact C-N 3.28Å; S300-D302 PolarHBondContact O-N 3.05Å; D302-L305 PolarHBondContact O-N 3.4Å; D302-C306 PolarHBondContact O-N 2.93Å
303E73.4Confident69.5Low96 Ų96102.3 Ų102.345%0.44954%0.538SS..Hα-helixtrans-67.6-39177.6-71.1165.9132.500111.8F299 S300 L305 C306 V307F299-E303 HydrophobicContact CB-CB 4.38Å; F299-E303 HydrophobicContact CD1-CB 4.25Å; S300-E303 VanDerWaalsContact CB-OE2 3.3Å; S300-E303 WeakPolarHBondContact CB-OE2 3.33Å; S300-E303 PolarHBondContact N-OE2 2.98Å; S300-E303 PolarHBondContact O-N 3.25Å; S300-E303 VanDerWaalsContact OG-CG 3.24Å; S300-E303 WeakPolarHBondContact OG-CG 3.26Å; S300-E303 PolarHBondContact OG-N 3.41Å; S300-E303 PolarHBondContact OG-OE2 3.31Å; E303-L305 VanDerWaalsContact C-N 3.33Å; E303-C306 PolarHBondContact O-N 3.46Å; E303-V307 WeakPolarHBondContact O-CG2 3.39Å; E303-V307 PolarHBondContact O-N 2.89Å
304A71.9Confident69.4Low36 Ų36105.5 Ų105.530%0.29854%0.543SS..Hα-helixtrans-61.5-42173.700000111.2F299 S300 V307 V308F299-A304 HydrophobicContact CB-CB 3.89Å; F299-A304 HydrophobicContact CG-CB 4.43Å; S300-A304 WeakPolarHBondContact O-CB 3.49Å; S300-A304 PolarHBondContact O-N 3.07Å; A304-V307 PolarHBondContact O-N 3.33Å; A304-V308 WeakPolarHBondContact O-CB 3.36Å; A304-V308 VanDerWaalsContact O-CG2 3.3Å; A304-V308 WeakPolarHBondContact O-CG2 3.45Å; A304-V308 PolarHBondContact O-N 2.96Å
305L72.2Confident69.1Low89 Ų89104 Ų10447%0.46654%0.539SS..Hα-helixtrans-63.5-45.8174.8-74.8167.4000111.9E301 D302 E303 V307 V308 D309E301-L305 VanDerWaalsContact O-CG 3.29Å; E301-L305 WeakPolarHBondContact O-CG 3.44Å; E301-L305 PolarHBondContact O-N 3.08Å; D302-L305 PolarHBondContact O-N 3.4Å; E303-L305 VanDerWaalsContact C-N 3.33Å; L305-V307 VanDerWaalsContact C-N 3.35Å; L305-V307 PolarHBondContact O-N 3.03Å; L305-V308 PolarHBondContact O-N 3.48Å; L305-D309 WeakPolarHBondContact O-CB 3.39Å; L305-D309 PolarHBondContact O-N 2.98Å
306C74.8Confident69Low91 Ų9197.2 Ų97.262%0.61552%0.521SS*.Hα-helixtrans-59.9-40.6175.3-780000113.1D302 E303 D309 L310D302-C306 PolarHBondContact O-N 2.93Å; E303-C306 PolarHBondContact O-N 3.46Å; C306-D309 PolarHBondContact O-N 3.2Å; C306-L310 WeakPolarHBondContact O-CB 3.48Å; C306-L310 PolarHBondContact O-N 3.44Å
307V71Confident68.7Low63 Ų6396.4 Ų96.438%0.38252%0.516SS..Hα-helixtrans-66.6-42.2175.31710000111.2F299 E303 A304 L305 L311F299-V307 HydrophobicContact CD1-CG2 4.46Å; F299-V307 HydrophobicContact CE1-CG2 3.96Å; E303-V307 WeakPolarHBondContact O-CG2 3.39Å; E303-V307 PolarHBondContact O-N 2.89Å; A304-V307 PolarHBondContact O-N 3.33Å; L305-V307 VanDerWaalsContact C-N 3.35Å; L305-V307 PolarHBondContact O-N 3.03Å; V307-L311 HydrophobicContact CG1-CD1 3.99Å; V307-L311 WeakPolarHBondContact O-CB 3.49Å; V307-L311 VanDerWaalsContact O-CG 3.24Å; V307-L311 WeakPolarHBondContact O-CG 3.45Å; V307-L311 PolarHBondContact O-N 3.42Å
308V72.5Confident68.2Low67 Ų6797 Ų9741%0.40652%0.519SS..Hα-helixtrans-63.1-40.3176.3162.90000111.8A304 L305 L311 K312A304-V308 WeakPolarHBondContact O-CB 3.36Å; A304-V308 VanDerWaalsContact O-CG2 3.3Å; A304-V308 WeakPolarHBondContact O-CG2 3.45Å; A304-V308 PolarHBondContact O-N 2.96Å; L305-V308 PolarHBondContact O-N 3.48Å; V308-L311 PolarHBondContact O-N 2.83Å; V308-K312 HydrophobicContact CG1-CD 4.48Å; V308-K312 WeakPolarHBondContact O-CG 3.33Å; V308-K312 PolarHBondContact O-N 2.88Å
309D76.9Confident68.2Low83 Ų8395.4 Ų95.444%0.44451%0.508SS..Hα-helixtrans-74.4-37.5179.8-74.8-16.7000112.6L305 C306 L311 K312 E313L305-D309 WeakPolarHBondContact O-CB 3.39Å; L305-D309 PolarHBondContact O-N 2.98Å; C306-D309 PolarHBondContact O-N 3.2Å; D309-L311 VanDerWaalsContact C-N 3.28Å; D309-L311 PolarHBondContact O-N 2.97Å; D309-K312 WeakPolarHBondContact O-CB 3.44Å; D309-K312 PolarHBondContact O-N 3.42Å; D309-K312 VanDerWaalsContact O-N 3.15Å; D309-K312 WeakPolarHBondContact OD1-CD 3.36Å; D309-K312 WeakPolarHBondContact OD1-CE 3.43Å; D309-K312 IonicContact OD1-NZ 2.61Å; D309-K312 PolarHBondContact OD1-NZ 3.42Å; D309-E313 PolarHBondContact O-N 3.37Å
310L74.4Confident67.7Low101 Ų10198.9 Ų98.953%0.52953%0.525SS..Hα-helixtrans-62.5-35.9170.1-171.267.6000111.6C306 E313 K314C306-L310 WeakPolarHBondContact O-CB 3.48Å; C306-L310 PolarHBondContact O-N 3.44Å; L310-E313 PolarHBondContact O-N 2.95Å; L310-K314 WeakPolarHBondContact O-CG 3.48Å; L310-K314 PolarHBondContact O-N 3.38Å
311L70.4Confident66.7Low113 Ų113100 Ų10059%0.59254%0.537SS*.Hα-helixtrans-70.2-35.3172.5-73.8169.7000112.6V307 V308 D309 S315V307-L311 HydrophobicContact CG1-CD1 3.99Å; V307-L311 WeakPolarHBondContact O-CB 3.49Å; V307-L311 VanDerWaalsContact O-CG 3.24Å; V307-L311 WeakPolarHBondContact O-CG 3.45Å; V307-L311 PolarHBondContact O-N 3.42Å; V308-L311 PolarHBondContact O-N 2.83Å; D309-L311 VanDerWaalsContact C-N 3.28Å; D309-L311 PolarHBondContact O-N 2.97Å; L311-S315 WeakPolarHBondContact O-CB 3.46Å; L311-S315 PolarHBondContact O-N 3.34Å
312K71Confident66.2Low124 Ų12498.8 Ų98.854%0.53954%0.536SS..Hα-helixtrans-64.4-43.2171.1-71.9170.3-163.6155.80111.4V308 D309 S315 G316V308-K312 HydrophobicContact CG1-CD 4.48Å; V308-K312 WeakPolarHBondContact O-CG 3.33Å; V308-K312 PolarHBondContact O-N 2.88Å; D309-K312 WeakPolarHBondContact O-CB 3.44Å; D309-K312 PolarHBondContact O-N 3.42Å; D309-K312 VanDerWaalsContact O-N 3.15Å; D309-K312 WeakPolarHBondContact OD1-CD 3.36Å; D309-K312 WeakPolarHBondContact OD1-CE 3.43Å; D309-K312 IonicContact OD1-NZ 2.61Å; D309-K312 PolarHBondContact OD1-NZ 3.42Å; K312-S315 WeakPolarHBondContact O-CB 3.47Å; K312-S315 PolarHBondContact O-N 2.78Å; K312-G316 PolarHBondContact O-N 2.79Å
313E71.8Confident65.2Low136 Ų136101.7 Ų101.764%0.63654%0.542SS*.Hα-helixtrans-60.3-48.5177.6-170.7-177.9-15500111D309 L310 S315 G316D309-E313 PolarHBondContact O-N 3.37Å; L310-E313 PolarHBondContact O-N 2.95Å; E313-S315 VanDerWaalsContact C-N 3.34Å; E313-S315 PolarHBondContact O-N 3.17Å; E313-G316 PolarHBondContact O-N 3.38Å
314K63.1Low64.1Low134 Ų134106.8 Ų106.858%0.58356%0.563SS**Hα-helixtrans-64.7-34.2173.2-66.1-66.5179.3-175.10113L310 G316 V317 I318L310-K314 WeakPolarHBondContact O-CG 3.48Å; L310-K314 PolarHBondContact O-N 3.38Å; K314-G316 VanDerWaalsContact C-N 3.27Å; K314-G316 PolarHBondContact O-N 3.26Å; K314-V317 PolarHBondContact O-N 2.65Å; K314-I318 PolarHBondContact O-N 3.24Å
315S61.3Low62.8Low48 Ų48109.9 Ų109.934%0.33658%0.582SS.*Hα-helixtrans-63-32.8174.3-1730000112.4L311 K312 E313 I318 K319L311-S315 WeakPolarHBondContact O-CB 3.46Å; L311-S315 PolarHBondContact O-N 3.34Å; K312-S315 WeakPolarHBondContact O-CB 3.47Å; K312-S315 PolarHBondContact O-N 2.78Å; E313-S315 VanDerWaalsContact C-N 3.34Å; E313-S315 PolarHBondContact O-N 3.17Å; S315-I318 PolarHBondContact O-N 3.47Å; S315-K319 WeakPolarHBondContact O-CB 3.32Å; S315-K319 WeakPolarHBondContact O-CG 3.4Å; S315-K319 PolarHBondContact O-N 2.91Å
316G64.7Low61.3Low38 Ų38113 Ų11339%0.39260%0.599SS.*Hα-helixtrans-56.8-49.7173.600000112.4K312 E313 K314 I318 K319 E320K312-G316 PolarHBondContact O-N 2.79Å; E313-G316 PolarHBondContact O-N 3.38Å; K314-G316 VanDerWaalsContact C-N 3.27Å; K314-G316 PolarHBondContact O-N 3.26Å; G316-I318 VanDerWaalsContact C-N 3.33Å; G316-I318 PolarHBondContact O-N 3.25Å; G316-K319 PolarHBondContact O-N 3.09Å; G316-E320 PolarHBondContact O-N 3.36Å
317V60.3Low60.1Low98 Ų98118.3 Ų118.359%0.59461%0.612SS**Hα-helixtrans-62.1-39.5179-174.40000111.7K314 E320 A321K314-V317 PolarHBondContact O-N 2.65Å; V317-E320 PolarHBondContact O-N 3.21Å; V317-A321 PolarHBondContact O-N 3.31Å
318I56.4Low59.3Low115 Ų115118.4 Ų118.459%0.5963%0.626SS**Hα-helixtrans-67.3-41.8176.5-63.2169.9000111K314 S315 G316 E320 A321 L322K314-I318 PolarHBondContact O-N 3.24Å; S315-I318 PolarHBondContact O-N 3.47Å; G316-I318 VanDerWaalsContact C-N 3.33Å; G316-I318 PolarHBondContact O-N 3.25Å; I318-E320 VanDerWaalsContact C-N 3.33Å; I318-E320 PolarHBondContact O-N 3.33Å; I318-A321 PolarHBondContact O-N 2.69Å; I318-L322 PolarHBondContact O-N 2.85Å; I318-L322 VanDerWaalsContact O-N 3.08Å
319K54.4Low58.3Low147 Ų147122.7 Ų122.764%0.63964%0.642SS**Hα-helixtrans-64.8-35.1175.8-79.9178.5175.11760112.7S315 G316 L322 K323S315-K319 WeakPolarHBondContact O-CB 3.32Å; S315-K319 WeakPolarHBondContact O-CG 3.4Å; S315-K319 PolarHBondContact O-N 2.91Å; G316-K319 PolarHBondContact O-N 3.09Å; K319-L322 PolarHBondContact O-N 3.46Å; K319-K323 PolarHBondContact O-N 3.14Å
320E55.5Low57.3Low152 Ų152124.9 Ų124.971%0.7165%0.653SS**Hα-helixtrans-73.1-38.1178.3-163.6165.1-135.900112G316 V317 I318 L322 K323G316-E320 PolarHBondContact O-N 3.36Å; V317-E320 PolarHBondContact O-N 3.21Å; I318-E320 VanDerWaalsContact C-N 3.33Å; I318-E320 PolarHBondContact O-N 3.33Å; E320-L322 VanDerWaalsContact C-N 3.35Å; E320-L322 PolarHBondContact O-N 3.29Å; E320-K323 PolarHBondContact O-N 3.31Å
321A52.1Low56.8Low78 Ų78124.7 Ų124.765%0.64566%0.66SS**Hα-helixtrans-60.8-40.8170.800000112.6V317 I318 K323V317-A321 PolarHBondContact O-N 3.31Å; I318-A321 PolarHBondContact O-N 2.69Å; A321-K323 VanDerWaalsContact C-N 3.28Å; A321-K323 PolarHBondContact O-N 3.11Å
322L51.2Low56.7Low140 Ų140121.5 Ų121.573%0.73365%0.654SS**Hα-helixtrans-67.6-26.3179.3-138.176.4000113.3I318 K319 E320 K324I318-L322 PolarHBondContact O-N 2.85Å; I318-L322 VanDerWaalsContact O-N 3.08Å; K319-L322 PolarHBondContact O-N 3.46Å; E320-L322 VanDerWaalsContact C-N 3.35Å; E320-L322 PolarHBondContact O-N 3.29Å; L322-K324 PolarHBondContact O-N 2.9Å; L322-K324 VanDerWaalsContact O-N 3.13Å
323K50.6Low56.6Low187 Ų187120.6 Ų120.681%0.81365%0.654SS**THydrogen-bonded Turntrans-77.86.8-171.5-144.4172.8-175.3179.90114.9K319 E320 A321K319-K323 PolarHBondContact O-N 3.14Å; E320-K323 PolarHBondContact O-N 3.31Å; A321-K323 VanDerWaalsContact C-N 3.28Å; A321-K323 PolarHBondContact O-N 3.11Å
324K50.5Low56.5Low202 Ų202119.3 Ų119.388%0.87865%0.651SS**THydrogen-bonded Turntrans-104.44.3179.4-104.2176.9178.6172.90115L322L322-K324 PolarHBondContact O-N 2.9Å; L322-K324 VanDerWaalsContact O-N 3.13Å
325S44Very low57.1Low101 Ų101118.9 Ų118.971%0.70665%0.651SS**SBendtrans-94.2167.9174.7-161.10000113.3
326N41.5Very low57.7Low155 Ų155122.5 Ų122.583%0.82966%0.663SS**  trans-53.4144.8-161.2-74.2-32.9000117G328N326-G328 PolarHBondContact O-N 2.85Å
327K48.5Very low58.2Low203 Ų203126.1 Ų126.188%0.88367%0.672SS**THydrogen-bonded Turntrans-72.330.6-179.9-70.7-176.4170.3-179.30115.6
328G53.6Low59.1Low65 Ų65127.1 Ų127.167%0.6767%0.671SS**THydrogen-bonded Turntrans-83.7-51.4-172.400000115.5N326 L330N326-G328 PolarHBondContact O-N 2.85Å; G328-L330 PolarHBondContact O-N 3.47Å
329E52.4Low60.1Low157 Ų157125.6 Ų125.673%0.73466%0.661SS**SBendtrans-100.718.9-155-58.9-179.2135.500114.8S331 L333E329-S331 VanDerWaalsContact C-N 3.33Å; E329-S331 PolarHBondContact O-N 3.17Å; E329-L333 HydrophobicContact CB-CD1 4.32Å
330L55Low61.3Low129 Ų129125.8 Ų125.868%0.67566%0.662SS**Hα-helixtrans-69.7-22.3-165-123.9161.8000114.8G328 L334G328-L330 PolarHBondContact O-N 3.47Å; L330-L334 WeakPolarHBondContact O-CB 2.86Å
331S64.3Low62.6Low97 Ų97124.6 Ų124.668%0.67866%0.657SS**Hα-helixtrans-80-54-178.3-177.80000112.9E329 L333 L334 H335E329-S331 VanDerWaalsContact C-N 3.33Å; E329-S331 PolarHBondContact O-N 3.17Å; S331-L333 VanDerWaalsContact C-N 3.33Å; S331-L333 PolarHBondContact O-N 3.41Å; S331-L334 WeakPolarHBondContact O-CB 3.42Å; S331-L334 PolarHBondContact O-N 3.39Å; S331-L334 VanDerWaalsContact O-N 3.12Å; S331-H335 PolarHBondContact O-N 2.87Å; S331-H335 VanDerWaalsContact O-N 3.1Å
332G68.1Low64.3Low46 Ų46127.8 Ų127.847%0.47465%0.652SS.*Hα-helixtrans-63.2-37.5-177.500000113H335 Q336G332-H335 PolarHBondContact O-N 2.89Å; G332-Q336 PolarHBondContact O-N 3Å
333L69.4Low65.9Low104 Ų104125.2 Ų125.255%0.54564%0.638SS.*Hα-helixtrans-68.4-32.9175-71.6172.4000112.9E329 S331 L337E329-L333 HydrophobicContact CB-CD1 4.32Å; S331-L333 VanDerWaalsContact C-N 3.33Å; S331-L333 PolarHBondContact O-N 3.41Å; L333-L337 VanDerWaalsContact O-CB 3.31Å; L333-L337 WeakPolarHBondContact O-CB 3.3Å; L333-L337 PolarHBondContact O-N 2.67Å
334L70.7Confident67.5Low109 Ų109120.9 Ų120.957%0.57162%0.623SS**Hα-helixtrans-66.3-44.5173.9-164.797.8000110.8L330 S331 L337 Q338L330-L334 WeakPolarHBondContact O-CB 2.86Å; S331-L334 WeakPolarHBondContact O-CB 3.42Å; S331-L334 PolarHBondContact O-N 3.39Å; S331-L334 VanDerWaalsContact O-N 3.12Å; L334-L337 WeakPolarHBondContact O-CB 3.46Å; L334-L337 PolarHBondContact O-N 2.61Å; L334-Q338 PolarHBondContact O-N 2.93Å
335H74.1Confident69Low125 Ų125114.2 Ų114.258%0.57960%0.603SS**Hα-helixtrans-65.7-40.3178.2-130.5-62.7000112S331 G332 Q338 E339S331-H335 PolarHBondContact O-N 2.87Å; S331-H335 VanDerWaalsContact O-N 3.1Å; G332-H335 PolarHBondContact O-N 2.89Å; H335-Q338 PolarHBondContact O-N 2.88Å; H335-E339 WeakPolarHBondContact O-CB 3.29Å; H335-E339 PolarHBondContact O-N 3.44Å
336Q74.4Confident70.9Confident125 Ų125111.2 Ų111.258%0.58458%0.584SS**Hα-helixtrans-65.4-35.4172.5-77.8-170.2-700113.1G332 K340G332-Q336 PolarHBondContact O-N 3Å; Q336-K340 WeakPolarHBondContact O-CB 3.47Å; Q336-K340 WeakPolarHBondContact O-CG 3.28Å; Q336-K340 PolarHBondContact O-N 2.76Å
337L76.1Confident72.8Confident113 Ų113110.4 Ų110.459%0.59258%0.577SS**Hα-helixtrans-65-47.9175.5-17271.2000110.4L333 L334 E339 K340 E341L333-L337 VanDerWaalsContact O-CB 3.31Å; L333-L337 WeakPolarHBondContact O-CB 3.3Å; L333-L337 PolarHBondContact O-N 2.67Å; L334-L337 WeakPolarHBondContact O-CB 3.46Å; L334-L337 PolarHBondContact O-N 2.61Å; L337-E339 PolarHBondContact O-N 3.28Å; L337-K340 PolarHBondContact O-N 3.31Å; L337-E341 WeakPolarHBondContact O-CB 3.44Å; L337-E341 PolarHBondContact O-N 3.27Å
338Q78.3Confident74.6Confident120 Ų120107.5 Ų107.556%0.56156%0.564SS**Hα-helixtrans-62.6-39.9177.6-173176-6.300112.2L334 H335 E341 R342L334-Q338 PolarHBondContact O-N 2.93Å; H335-Q338 PolarHBondContact O-N 2.88Å; Q338-E341 PolarHBondContact O-N 3.46Å; Q338-R342 WeakPolarHBondContact O-CB 3.4Å; Q338-R342 PolarHBondContact O-N 2.85Å
339E76.6Confident76.2Confident82 Ų82111.4 Ų111.438%0.38357%0.565SS.*Hα-helixtrans-62.7-42.5174.3-164.665.9-116.600111.7H335 L337 R342 L343H335-E339 WeakPolarHBondContact O-CB 3.29Å; H335-E339 PolarHBondContact O-N 3.44Å; L337-E339 PolarHBondContact O-N 3.28Å; E339-R342 PolarHBondContact O-N 3.45Å; E339-R342 IonicContact OE1-CZ 3.16Å; E339-R342 IonicContact OE1-NE 2.79Å; E339-R342 PolarHBondContact OE1-NE 2.91Å; E339-R342 IonicContact OE1-NH2 2.68Å; E339-R342 PolarHBondContact OE1-NH2 3.36Å; E339-L343 WeakPolarHBondContact O-CG 3.37Å; E339-L343 PolarHBondContact O-N 2.84Å
340K79.6Confident77.6Confident151 Ų151108.4 Ų108.466%0.65755%0.554SS**Hα-helixtrans-70.2-32.3175.2-75.6-170.3175.5-173.90113Q336 L337 L343 L344Q336-K340 WeakPolarHBondContact O-CB 3.47Å; Q336-K340 WeakPolarHBondContact O-CG 3.28Å; Q336-K340 PolarHBondContact O-N 2.76Å; L337-K340 PolarHBondContact O-N 3.31Å; K340-L343 PolarHBondContact O-N 2.95Å; K340-L344 WeakPolarHBondContact O-CB 3.25Å; K340-L344 PolarHBondContact O-N 2.7Å
341E82.7Confident79Confident128 Ų128105.1 Ų105.160%0.59855%0.545SS*.Hα-helixtrans-72-34.9176.2-166.3154.2-131.400111.6L337 Q338 S345L337-E341 WeakPolarHBondContact O-CB 3.44Å; L337-E341 PolarHBondContact O-N 3.27Å; Q338-E341 PolarHBondContact O-N 3.46Å; E341-S345 WeakPolarHBondContact O-CB 3.43Å; E341-S345 PolarHBondContact O-N 3Å; E341-S345 PolarHBondContact O-OG 3.19Å
342R87.9Confident80.1Confident144 Ų144103.2 Ų103.254%0.54354%0.535SS..Hα-helixtrans-61.2-50.5167.4-171.8-173.171.779.1-2.9111.5Q338 E339 L344 S345 A346Q338-R342 WeakPolarHBondContact O-CB 3.4Å; Q338-R342 PolarHBondContact O-N 2.85Å; E339-R342 PolarHBondContact O-N 3.45Å; E339-R342 IonicContact OE1-CZ 3.16Å; E339-R342 IonicContact OE1-NE 2.79Å; E339-R342 PolarHBondContact OE1-NE 2.91Å; E339-R342 IonicContact OE1-NH2 2.68Å; E339-R342 PolarHBondContact OE1-NH2 3.36Å; R342-L344 PolarHBondContact O-N 2.87Å; R342-S345 WeakPolarHBondContact O-CB 3.46Å; R342-S345 PolarHBondContact O-N 2.93Å; R342-A346 PolarHBondContact O-N 3.31Å
343L86.1Confident81Confident87 Ų87102.7 Ų102.746%0.45553%0.527SS..Hα-helixtrans-63.8-37.8178.1-72.1169.2000112.8E339 K340 S345 A346 M347E339-L343 WeakPolarHBondContact O-CG 3.37Å; E339-L343 PolarHBondContact O-N 2.84Å; K340-L343 PolarHBondContact O-N 2.95Å; L343-S345 VanDerWaalsContact C-N 3.31Å; L343-A346 PolarHBondContact O-N 3.11Å; L343-M347 WeakPolarHBondContact O-CB 3.31Å; L343-M347 WeakPolarHBondContact O-CG 3.48Å; L343-M347 PolarHBondContact O-N 3.15Å
344L82.9Confident81.6Confident95 Ų95100.4 Ų100.450%0.49752%0.519SS..Hα-helixtrans-69.4-29.3175.8-174.4147.5000112.2K340 R342 K348K340-L344 WeakPolarHBondContact O-CB 3.25Å; K340-L344 PolarHBondContact O-N 2.7Å; R342-L344 PolarHBondContact O-N 2.87Å; L344-K348 HydrophobicContact CD2-CD 4Å; L344-K348 VanDerWaalsContact CD2-CE 3.5Å; L344-K348 WeakPolarHBondContact O-CG 3.48Å; L344-K348 PolarHBondContact O-N 3.42Å; L344-K348 VanDerWaalsContact O-N 3.15Å
345S83.6Confident82.6Confident63 Ų63102.3 Ų102.344%0.44152%0.523SS..Hα-helixtrans-71.3-46.4172.3-57.90000111.3E341 R342 L343 M347 K348 E349E341-S345 WeakPolarHBondContact O-CB 3.43Å; E341-S345 PolarHBondContact O-N 3Å; E341-S345 PolarHBondContact O-OG 3.19Å; R342-S345 WeakPolarHBondContact O-CB 3.46Å; R342-S345 PolarHBondContact O-N 2.93Å; L343-S345 VanDerWaalsContact C-N 3.31Å; S345-M347 PolarHBondContact O-N 2.76Å; S345-K348 WeakPolarHBondContact O-CB 3.5Å; S345-K348 PolarHBondContact O-N 2.98Å; S345-K348 VanDerWaalsContact O-N 3.11Å; S345-E349 PolarHBondContact O-N 3.5Å
346A83.3Confident83.4Confident37 Ų37100.3 Ų100.331%0.30651%0.514SS..Hα-helixtrans-58.9-45.5173.500000112R342 L343 K348 E349 D350R342-A346 PolarHBondContact O-N 3.31Å; L343-A346 PolarHBondContact O-N 3.11Å; A346-K348 VanDerWaalsContact C-N 3.27Å; A346-K348 PolarHBondContact O-N 3.44Å; A346-E349 WeakPolarHBondContact O-CB 3.29Å; A346-E349 PolarHBondContact O-N 2.84Å; A346-D350 PolarHBondContact O-N 3.39Å
347M82.3Confident84.1Confident139 Ų139101.3 Ų101.369%0.68551%0.512SS*.Hα-helixtrans-59.8-32.3174.5-80-92.5152.600113.5L343 S345 A351L343-M347 WeakPolarHBondContact O-CB 3.31Å; L343-M347 WeakPolarHBondContact O-CG 3.48Å; L343-M347 PolarHBondContact O-N 3.15Å; S345-M347 PolarHBondContact O-N 2.76Å; M347-A351 WeakPolarHBondContact O-CB 3.4Å; M347-A351 PolarHBondContact O-N 3.42Å
348K85.3Confident84.7Confident141 Ų14199.7 Ų99.761%0.61351%0.51SS*.Hα-helixtrans-72.5-36.3172.6-78.9171.2175.6172.10112.3L344 S345 A346 A352L344-K348 HydrophobicContact CD2-CD 4Å; L344-K348 VanDerWaalsContact CD2-CE 3.5Å; L344-K348 WeakPolarHBondContact O-CG 3.48Å; L344-K348 PolarHBondContact O-N 3.42Å; L344-K348 VanDerWaalsContact O-N 3.15Å; S345-K348 WeakPolarHBondContact O-CB 3.5Å; S345-K348 PolarHBondContact O-N 2.98Å; S345-K348 VanDerWaalsContact O-N 3.11Å; A346-K348 VanDerWaalsContact C-N 3.27Å; A346-K348 PolarHBondContact O-N 3.44Å; K348-A352 WeakPolarHBondContact O-CB 3.3Å; K348-A352 PolarHBondContact O-N 3.1Å
349E86.4Confident85.4Confident147 Ų14799 Ų9969%0.68751%0.505SS*.Hα-helixtrans-69.3-45.2176.7-168.3168-172.300111.2S345 A346 A351 A352 A353S345-E349 PolarHBondContact O-N 3.5Å; A346-E349 WeakPolarHBondContact O-CB 3.29Å; A346-E349 PolarHBondContact O-N 2.84Å; E349-A351 VanDerWaalsContact C-N 3.35Å; E349-A351 PolarHBondContact O-N 3.44Å; E349-A352 WeakPolarHBondContact O-CB 3.44Å; E349-A352 PolarHBondContact O-N 3.25Å; E349-A352 VanDerWaalsContact O-N 3.16Å; E349-A353 WeakPolarHBondContact O-CB 3.3Å; E349-A353 PolarHBondContact O-N 3.3Å
350D81.9Confident86Confident95 Ų9599.9 Ų99.951%0.50851%0.509SS..Hα-helixtrans-61.5-39.9172.1-81.1-38.6000112.3A346 S354A346-D350 PolarHBondContact O-N 3.39Å; D350-S354 VanDerWaalsContact O-CB 3.25Å; D350-S354 WeakPolarHBondContact O-CB 3.41Å; D350-S354 PolarHBondContact O-N 2.89Å; D350-S354 PolarHBondContact O-OG 3.15Å
351A84.8Confident86.4Confident59 Ų5998 Ų9849%0.48851%0.505SS..Hα-helixtrans-66.5-37.3173.900000112.3M347 E349 K355M347-A351 WeakPolarHBondContact O-CB 3.4Å; M347-A351 PolarHBondContact O-N 3.42Å; E349-A351 VanDerWaalsContact C-N 3.35Å; E349-A351 PolarHBondContact O-N 3.44Å; A351-K355 VanDerWaalsContact O-CB 3.3Å; A351-K355 WeakPolarHBondContact O-CB 3.32Å; A351-K355 PolarHBondContact O-N 3.22Å
352A87.6Confident86.7Confident57 Ų5795.6 Ų95.647%0.47150%0.499SS..Hα-helixtrans-67.8-45.3174.500000111.6K348 E349 S354 K355 E356K348-A352 WeakPolarHBondContact O-CB 3.3Å; K348-A352 PolarHBondContact O-N 3.1Å; E349-A352 WeakPolarHBondContact O-CB 3.44Å; E349-A352 PolarHBondContact O-N 3.25Å; E349-A352 VanDerWaalsContact O-N 3.16Å; A352-S354 VanDerWaalsContact C-N 3.34Å; A352-S354 PolarHBondContact O-N 3.17Å; A352-K355 WeakPolarHBondContact O-CB 3.37Å; A352-K355 PolarHBondContact O-N 3.08Å; A352-E356 PolarHBondContact O-N 3.05Å
353A87.8Confident86.9Confident36 Ų3695.2 Ų95.230%0.29850%0.504SS..Hα-helixtrans-61.6-40.8175.100000111.9E349 E356 R357E349-A353 WeakPolarHBondContact O-CB 3.3Å; E349-A353 PolarHBondContact O-N 3.3Å; A353-E356 PolarHBondContact O-N 2.79Å; A353-R357 WeakPolarHBondContact O-CG 3.49Å; A353-R357 PolarHBondContact O-N 3.29Å
354S81.9Confident87Confident56 Ų5696.7 Ų96.739%0.39251%0.509SS..Hα-helixtrans-66.7-38.6175.5-58.30000112.2D350 A352 C358D350-S354 VanDerWaalsContact O-CB 3.25Å; D350-S354 WeakPolarHBondContact O-CB 3.41Å; D350-S354 PolarHBondContact O-N 2.89Å; D350-S354 PolarHBondContact O-OG 3.15Å; A352-S354 VanDerWaalsContact C-N 3.34Å; A352-S354 PolarHBondContact O-N 3.17Å; S354-C358 PolarHBondContact O-N 2.85Å; S354-C358 PolarHBondContact O-SG 3.27Å
355K90.8Very high87.4Confident149 Ų14997.9 Ų97.965%0.64851%0.513SS*.Hα-helixtrans-64.8-38.2172.5-174.1173-176.9173.50111.9A351 A352 C358 K359A351-K355 VanDerWaalsContact O-CB 3.3Å; A351-K355 WeakPolarHBondContact O-CB 3.32Å; A351-K355 PolarHBondContact O-N 3.22Å; A352-K355 WeakPolarHBondContact O-CB 3.37Å; A352-K355 PolarHBondContact O-N 3.08Å; K355-C358 WeakPolarHBondContact O-CB 3.35Å; K355-C358 PolarHBondContact O-N 3.45Å; K355-K359 PolarHBondContact O-N 2.96Å; K355-K359 VanDerWaalsContact O-N 3.14Å
356E90.7Very high87.8Confident82 Ų8299.2 Ų99.238%0.38351%0.513SS..Hα-helixtrans-69.9-43.2177.4-151.561.9-141.100112A352 A353 C358 K359 Q360A352-E356 PolarHBondContact O-N 3.05Å; A353-E356 PolarHBondContact O-N 2.79Å; E356-C358 VanDerWaalsContact C-N 3.28Å; E356-C358 PolarHBondContact O-N 2.88Å; E356-K359 WeakPolarHBondContact O-CB 3.34Å; E356-K359 PolarHBondContact O-N 2.94Å; E356-K359 WeakPolarHBondContact OE1-CD 3.46Å; E356-K359 IonicContact OE1-NZ 2.8Å; E356-K359 PolarHBondContact OE1-NZ 3.4Å; E356-K359 VanDerWaalsContact OE2-CE 3.27Å; E356-K359 WeakPolarHBondContact OE2-CE 3.42Å; E356-K359 IonicContact OE2-NZ 2.81Å; E356-K359 PolarHBondContact OE2-NZ 3.04Å; E356-Q360 WeakPolarHBondContact O-CG 3.39Å; E356-Q360 PolarHBondContact O-N 3.41Å
357R90.3Very high88Confident146 Ų14699.5 Ų99.555%0.55151%0.511SS*.Hα-helixtrans-56.7-40.8171.2-71.1172.2-172.4137.71.3111.9A353 K359 Q360 L361A353-R357 WeakPolarHBondContact O-CG 3.49Å; A353-R357 PolarHBondContact O-N 3.29Å; R357-K359 PolarHBondContact O-N 3.41Å; R357-Q360 PolarHBondContact O-N 3.26Å; R357-L361 PolarHBondContact O-N 3.42Å
358C86.9Confident88.1Confident80 Ų8097.8 Ų97.854%0.54150%0.502SS..Hα-helixtrans-61.8-39.5173.7-78.40000112.8S354 K355 E356 T362S354-C358 PolarHBondContact O-N 2.85Å; S354-C358 PolarHBondContact O-SG 3.27Å; K355-C358 WeakPolarHBondContact O-CB 3.35Å; K355-C358 PolarHBondContact O-N 3.45Å; E356-C358 VanDerWaalsContact C-N 3.28Å; E356-C358 PolarHBondContact O-N 2.88Å; C358-T362 WeakPolarHBondContact O-CB 3.23Å; C358-T362 PolarHBondContact O-N 2.7Å; C358-T362 PolarHBondContact O-OG1 3.43Å
359K93Very high88.4Confident104 Ų10498 Ų9845%0.45250%0.503SS..Hα-helixtrans-65-44.6173.4-62.7-172.7-145.1152.90111.6K355 E356 R357 T362 Q363K355-K359 PolarHBondContact O-N 2.96Å; K355-K359 VanDerWaalsContact O-N 3.14Å; E356-K359 WeakPolarHBondContact O-CB 3.34Å; E356-K359 PolarHBondContact O-N 2.94Å; E356-K359 WeakPolarHBondContact OE1-CD 3.46Å; E356-K359 IonicContact OE1-NZ 2.8Å; E356-K359 PolarHBondContact OE1-NZ 3.4Å; E356-K359 VanDerWaalsContact OE2-CE 3.27Å; E356-K359 WeakPolarHBondContact OE2-CE 3.42Å; E356-K359 IonicContact OE2-NZ 2.81Å; E356-K359 PolarHBondContact OE2-NZ 3.04Å; R357-K359 PolarHBondContact O-N 3.41Å; K359-T362 WeakPolarHBondContact O-CB 3.48Å; K359-T362 PolarHBondContact O-N 3.04Å; K359-Q363 WeakPolarHBondContact O-CB 3.4Å; K359-Q363 PolarHBondContact O-N 3.02Å
360Q89.4Confident88.6Confident101 Ų10196.8 Ų96.847%0.47250%0.497SS..Hα-helixtrans-59.1-51.9-179.8-72.6170.7-19.400110.7E356 R357 T362 Q363 E364E356-Q360 WeakPolarHBondContact O-CG 3.39Å; E356-Q360 PolarHBondContact O-N 3.41Å; R357-Q360 PolarHBondContact O-N 3.26Å; Q360-T362 VanDerWaalsContact C-N 3.3Å; Q360-T362 PolarHBondContact O-N 2.97Å; Q360-Q363 PolarHBondContact O-N 2.79Å; Q360-Q363 VanDerWaalsContact O-N 3.08Å; Q360-E364 WeakPolarHBondContact O-CB 3.48Å; Q360-E364 WeakPolarHBondContact O-CG 3.23Å; Q360-E364 PolarHBondContact O-N 3.43Å
361L89.6Confident89.1Confident111 Ų11198.6 Ų98.658%0.58150%0.497SS*.Hα-helixtrans-57.8-39.5173.8-77.3164.6000112.9R357 M365R357-L361 PolarHBondContact O-N 3.42Å; L361-M365 VanDerWaalsContact O-CB 3.22Å; L361-M365 WeakPolarHBondContact O-CB 3.39Å; L361-M365 PolarHBondContact O-N 3.29Å
362T87.9Confident89.2Confident78 Ų7898.6 Ų98.648%0.47949%0.493SS..Hα-helixtrans-65.3-39.8176.2-56.70000111.7C358 K359 Q360 M365 M366C358-T362 WeakPolarHBondContact O-CB 3.23Å; C358-T362 PolarHBondContact O-N 2.7Å; C358-T362 PolarHBondContact O-OG1 3.43Å; K359-T362 WeakPolarHBondContact O-CB 3.48Å; K359-T362 PolarHBondContact O-N 3.04Å; Q360-T362 VanDerWaalsContact C-N 3.3Å; Q360-T362 PolarHBondContact O-N 2.97Å; T362-M365 HydrophobicContact CG2-CE 4.36Å; T362-M366 VanDerWaalsContact O-CG 3.31Å; T362-M366 WeakPolarHBondContact O-CG 3.44Å; T362-M366 PolarHBondContact O-N 3.44Å; T362-M366 VanDerWaalsContact O-N 3.09Å
363Q91.5Very high89.4Confident137 Ų13799.5 Ų99.564%0.6450%0.496SS*.Hα-helixtrans-71.6-42.8178.2-175.6172.7-7.100111.6K359 Q360 M366 T367K359-Q363 WeakPolarHBondContact O-CB 3.4Å; K359-Q363 PolarHBondContact O-N 3.02Å; Q360-Q363 PolarHBondContact O-N 2.79Å; Q360-Q363 VanDerWaalsContact O-N 3.08Å; Q363-M366 PolarHBondContact O-N 2.82Å; Q363-T367 WeakPolarHBondContact O-CG2 3.39Å; Q363-T367 PolarHBondContact O-N 3.3Å
364E88.4Confident89.6Confident118 Ų118101.2 Ų101.255%0.55150%0.503SS*.Hα-helixtrans-58.5-51.4174.2-74.3170.8176.800110.7Q360 M366 T367 E368Q360-E364 WeakPolarHBondContact O-CB 3.48Å; Q360-E364 WeakPolarHBondContact O-CG 3.23Å; Q360-E364 PolarHBondContact O-N 3.43Å; E364-M366 VanDerWaalsContact C-N 3.28Å; E364-M366 PolarHBondContact O-N 3.24Å; E364-T367 PolarHBondContact O-N 2.85Å; E364-T367 VanDerWaalsContact O-N 3.09Å; E364-T367 PolarHBondContact O-OG1 3.22Å; E364-E368 PolarHBondContact O-N 3.37Å
365M92.2Very high90Very high120 Ų120102 Ų10259%0.59151%0.505SS*.Hα-helixtrans-53.9-41.3174.1179.4-169.267.300112.5L361 T362 E368 K369L361-M365 VanDerWaalsContact O-CB 3.22Å; L361-M365 WeakPolarHBondContact O-CB 3.39Å; L361-M365 PolarHBondContact O-N 3.29Å; T362-M365 HydrophobicContact CG2-CE 4.36Å; M365-E368 PolarHBondContact O-N 2.85Å; M365-K369 WeakPolarHBondContact O-CB 3.37Å; M365-K369 PolarHBondContact O-N 3.01Å
366M90.8Very high89.9Confident90 Ų9099.1 Ų99.144%0.44350%0.496SS..Hα-helixtrans-66.2-45.4176-76.6-65.8-63.100112T362 Q363 E364 E368 K369 E370T362-M366 VanDerWaalsContact O-CG 3.31Å; T362-M366 WeakPolarHBondContact O-CG 3.44Å; T362-M366 PolarHBondContact O-N 3.44Å; T362-M366 VanDerWaalsContact O-N 3.09Å; Q363-M366 PolarHBondContact O-N 2.82Å; E364-M366 VanDerWaalsContact C-N 3.28Å; E364-M366 PolarHBondContact O-N 3.24Å; M366-E368 VanDerWaalsContact C-N 3.28Å; M366-E368 PolarHBondContact O-N 3.45Å; M366-K369 PolarHBondContact O-N 3.22Å; M366-E370 WeakPolarHBondContact O-CG 3.28Å; M366-E370 PolarHBondContact O-N 2.95Å
367T88.4Confident90Very high43 Ų4397.4 Ų97.426%0.26450%0.496SS..Hα-helixtrans-64.5-33.4175.666.50000112.4Q363 E364 E370 R371Q363-T367 WeakPolarHBondContact O-CG2 3.39Å; Q363-T367 PolarHBondContact O-N 3.3Å; E364-T367 PolarHBondContact O-N 2.85Å; E364-T367 VanDerWaalsContact O-N 3.09Å; E364-T367 PolarHBondContact O-OG1 3.22Å; T367-E370 WeakPolarHBondContact O-CB 3.47Å; T367-E370 PolarHBondContact O-N 2.8Å; T367-R371 WeakPolarHBondContact O-CG 3.36Å; T367-R371 PolarHBondContact O-N 2.75Å; T367-R371 PolarHBondContact OG1-NH1 2.8Å; T367-R371 PolarHBondContact OG1-NH2 3Å
368E83.9Confident90.1Very high104 Ų10498.6 Ų98.649%0.48650%0.5SS..Hα-helixtrans-75.9-34.2179.6-160.253-136.500112E364 M365 M366 E370 R371 S372E364-E368 PolarHBondContact O-N 3.37Å; M365-E368 PolarHBondContact O-N 2.85Å; M366-E368 VanDerWaalsContact C-N 3.28Å; M366-E368 PolarHBondContact O-N 3.45Å; E368-E370 VanDerWaalsContact C-N 3.29Å; E368-E370 PolarHBondContact O-N 3.13Å; E368-R371 PolarHBondContact O-N 3.45Å; E368-R371 WeakPolarHBondContact OE2-CD 3.26Å; E368-R371 IonicContact OE2-CZ 3.68Å; E368-R371 IonicContact OE2-NE 3.35Å; E368-R371 IonicContact OE2-NH1 3.26Å; E368-R371 PolarHBondContact OE2-NH1 3.15Å; E368-S372 WeakPolarHBondContact O-CB 3.39Å; E368-S372 PolarHBondContact O-N 2.99Å
369K92.8Very high90.3Very high145 Ų145100.4 Ų100.463%0.6350%0.502SS*.Hα-helixtrans-60-39.6167.2-176.5179.2178.9-179.70111.7M365 M366 S373M365-K369 WeakPolarHBondContact O-CB 3.37Å; M365-K369 PolarHBondContact O-N 3.01Å; M366-K369 PolarHBondContact O-N 3.22Å; K369-S373 WeakPolarHBondContact O-CB 3.49Å; K369-S373 PolarHBondContact O-N 2.87Å
370E91.1Very high90.2Very high122 Ų122102.3 Ų102.357%0.5751%0.51SS*.Hα-helixtrans-68-45.7175-72171.9179.100112M366 T367 E368 S372 S373 V374M366-E370 WeakPolarHBondContact O-CG 3.28Å; M366-E370 PolarHBondContact O-N 2.95Å; T367-E370 WeakPolarHBondContact O-CB 3.47Å; T367-E370 PolarHBondContact O-N 2.8Å; E368-E370 VanDerWaalsContact C-N 3.29Å; E368-E370 PolarHBondContact O-N 3.13Å; E370-S372 PolarHBondContact O-N 2.85Å; E370-S373 PolarHBondContact O-N 3.39Å; E370-V374 WeakPolarHBondContact O-CG2 3.26Å; E370-V374 PolarHBondContact O-N 3.25Å
371R92Very high90.4Very high132 Ų132102.9 Ų102.950%0.49852%0.517SS..Hα-helixtrans-57.8-48.5173.3-70.9-176.1-16190.512.3111.6T367 E368 S373 V374 V375T367-R371 WeakPolarHBondContact O-CG 3.36Å; T367-R371 PolarHBondContact O-N 2.75Å; T367-R371 PolarHBondContact OG1-NH1 2.8Å; T367-R371 PolarHBondContact OG1-NH2 3Å; E368-R371 PolarHBondContact O-N 3.45Å; E368-R371 WeakPolarHBondContact OE2-CD 3.26Å; E368-R371 IonicContact OE2-CZ 3.68Å; E368-R371 IonicContact OE2-NE 3.35Å; E368-R371 IonicContact OE2-NH1 3.26Å; E368-R371 PolarHBondContact OE2-NH1 3.15Å; R371-S373 VanDerWaalsContact C-N 3.34Å; R371-S373 PolarHBondContact O-N 3.36Å; R371-V374 PolarHBondContact O-N 3.49Å; R371-V374 VanDerWaalsContact O-N 3.14Å; R371-V375 WeakPolarHBondContact O-CG2 3.17Å; R371-V375 PolarHBondContact O-N 3.1Å
372S87.1Confident90.5Very high60 Ų60103.4 Ų103.442%0.4251%0.511SS..Hα-helixtrans-57.7-44.9176-176.10000111.7E368 E370 V374 V375 I376E368-S372 WeakPolarHBondContact O-CB 3.39Å; E368-S372 PolarHBondContact O-N 2.99Å; E370-S372 PolarHBondContact O-N 2.85Å; S372-V374 VanDerWaalsContact C-N 3.32Å; S372-V374 PolarHBondContact O-N 3.37Å; S372-V375 PolarHBondContact O-N 3.49Å; S372-I376 VanDerWaalsContact O-CG1 3.31Å; S372-I376 WeakPolarHBondContact O-CG1 3.32Å; S372-I376 PolarHBondContact O-N 3.43Å
373S90.4Very high90.5Very high76 Ų76104 Ų10453%0.53151%0.51SS..Hα-helixtrans-61.2-37.1175.8-1690000112.9K369 E370 R371 A377K369-S373 WeakPolarHBondContact O-CB 3.49Å; K369-S373 PolarHBondContact O-N 2.87Å; E370-S373 PolarHBondContact O-N 3.39Å; R371-S373 VanDerWaalsContact C-N 3.34Å; R371-S373 PolarHBondContact O-N 3.36Å; S373-A377 WeakPolarHBondContact O-CB 3.47Å; S373-A377 PolarHBondContact O-N 3.5Å
374V92.4Very high90.6Very high72 Ų7298.2 Ų98.244%0.43649%0.487SS..Hα-helixtrans-70.1-37.8175.3171.50000111.6E370 R371 S372 A377 R378E370-V374 WeakPolarHBondContact O-CG2 3.26Å; E370-V374 PolarHBondContact O-N 3.25Å; R371-V374 PolarHBondContact O-N 3.49Å; R371-V374 VanDerWaalsContact O-N 3.14Å; S372-V374 VanDerWaalsContact C-N 3.32Å; S372-V374 PolarHBondContact O-N 3.37Å; V374-A377 PolarHBondContact O-N 3.39Å; V374-R378 WeakPolarHBondContact O-CG 3.36Å; V374-R378 PolarHBondContact O-N 2.9Å
375V90.3Very high90.7Very high73 Ų7395.1 Ų95.144%0.44248%0.477SS..Hα-helixtrans-64.7-45.5173.5173.60000110.7R371 S372 A377 R378 M379R371-V375 WeakPolarHBondContact O-CG2 3.17Å; R371-V375 PolarHBondContact O-N 3.1Å; S372-V375 PolarHBondContact O-N 3.49Å; V375-A377 VanDerWaalsContact C-N 3.31Å; V375-A377 PolarHBondContact O-N 3.42Å; V375-R378 PolarHBondContact O-N 3.19Å; V375-M379 HydrophobicContact CG1-CG 4.37Å; V375-M379 WeakPolarHBondContact O-CG 3.47Å; V375-M379 PolarHBondContact O-N 3.31Å
376I89Confident90.5Very high87 Ų8793.3 Ų93.345%0.44647%0.469SS..Hα-helixtrans-60.9-39.9177-68.7164.5000111.2S372 M379 K380S372-I376 VanDerWaalsContact O-CG1 3.31Å; S372-I376 WeakPolarHBondContact O-CG1 3.32Å; S372-I376 PolarHBondContact O-N 3.43Å; I376-M379 PolarHBondContact O-N 3.08Å; I376-K380 HydrophobicContact CG2-CD 4.41Å; I376-K380 WeakPolarHBondContact O-CG 3.47Å; I376-K380 PolarHBondContact O-N 3.13Å
377A92.4Very high90.4Very high46 Ų4694.5 Ų94.538%0.3847%0.473SS..Hα-helixtrans-61.2-51.4174.200000111.7S373 V374 V375 M379 K380 D381S373-A377 WeakPolarHBondContact O-CB 3.47Å; S373-A377 PolarHBondContact O-N 3.5Å; V374-A377 PolarHBondContact O-N 3.39Å; V375-A377 VanDerWaalsContact C-N 3.31Å; V375-A377 PolarHBondContact O-N 3.42Å; A377-M379 VanDerWaalsContact C-N 3.29Å; A377-M379 PolarHBondContact O-N 3.01Å; A377-K380 WeakPolarHBondContact O-CB 3.27Å; A377-K380 PolarHBondContact O-N 3.47Å; A377-K380 VanDerWaalsContact O-N 3.11Å; A377-D381 PolarHBondContact O-N 3.08Å
378R93.1Very high90.6Very high171 Ų17199.2 Ų99.265%0.64549%0.49SS*.Hα-helixtrans-58.9-37.7177.5-70.4173-175.9174.52.4113V374 V375 D381 R382V374-R378 WeakPolarHBondContact O-CG 3.36Å; V374-R378 PolarHBondContact O-N 2.9Å; V375-R378 PolarHBondContact O-N 3.19Å; R378-D381 PolarHBondContact O-N 3.05Å; R378-R382 PolarHBondContact O-N 3.49Å
379M90.4Very high90.8Very high119 Ų11998.8 Ų98.859%0.58649%0.488SS*.Hα-helixtrans-68.6-40.2176.6-69.1-61.2177.300111.7V375 I376 A377 R382 I383V375-M379 HydrophobicContact CG1-CG 4.37Å; V375-M379 WeakPolarHBondContact O-CG 3.47Å; V375-M379 PolarHBondContact O-N 3.31Å; I376-M379 PolarHBondContact O-N 3.08Å; A377-M379 VanDerWaalsContact C-N 3.29Å; A377-M379 PolarHBondContact O-N 3.01Å; M379-R382 PolarHBondContact O-N 3.39Å; M379-I383 WeakPolarHBondContact O-CB 3.49Å; M379-I383 WeakPolarHBondContact O-CD1 3.24Å; M379-I383 VanDerWaalsContact O-CG1 3.25Å; M379-I383 WeakPolarHBondContact O-CG1 3.33Å; M379-I383 PolarHBondContact O-N 3.44Å
380K92.1Very high90.6Very high144 Ų14497.3 Ų97.363%0.62648%0.483SS*.Hα-helixtrans-63.1-42.4172.6-74179.5178.6-1740112.2I376 A377 I383 G384I376-K380 HydrophobicContact CG2-CD 4.41Å; I376-K380 WeakPolarHBondContact O-CG 3.47Å; I376-K380 PolarHBondContact O-N 3.13Å; A377-K380 WeakPolarHBondContact O-CB 3.27Å; A377-K380 PolarHBondContact O-N 3.47Å; A377-K380 VanDerWaalsContact O-N 3.11Å; K380-I383 PolarHBondContact O-N 3.07Å; K380-G384 PolarHBondContact O-N 2.96Å
381D92.6Very high90.6Very high113 Ų11395.5 Ų95.560%0.60448%0.478SS*.Hα-helixtrans-62.4-43.3175.1-68.7-28.3000111.3A377 R378 G384 T385A377-D381 PolarHBondContact O-N 3.08Å; R378-D381 PolarHBondContact O-N 3.05Å; D381-G384 CarbonylContact O-C 3.57Å; D381-G384 PolarHBondContact O-N 2.92Å; D381-T385 PolarHBondContact O-N 3.22Å
382R91.5Very high90.6Very high122 Ų12293.9 Ų93.946%0.4648%0.478SS..Hα-helixtrans-65.2-43177-173.263.5-172.4130.6-4111.9R378 M379 G384 T385 L386 E389R378-R382 PolarHBondContact O-N 3.49Å; M379-R382 PolarHBondContact O-N 3.39Å; R382-G384 VanDerWaalsContact C-N 3.34Å; R382-G384 PolarHBondContact O-N 3.46Å; R382-T385 WeakPolarHBondContact CA-OG1 3.5Å; R382-T385 WeakPolarHBondContact CD-OG1 3.39Å; R382-T385 PolarHBondContact NH1-OG1 3.22Å; R382-T385 PolarHBondContact O-N 2.99Å; R382-T385 VanDerWaalsContact O-N 3.13Å; R382-T385 PolarHBondContact O-OG1 3.28Å; R382-L386 HydrophobicContact CG-CD1 4.14Å; R382-L386 WeakPolarHBondContact O-CG 3.3Å; R382-L386 PolarHBondContact O-N 3.36Å; R382-E389 IonicContact NH1-OE1 3.65Å; R382-E389 PolarHBondContact NH1-OE1 2.85Å; R382-E389 IonicContact NH1-OE2 2.62Å; R382-E389 IonicContact NH2-OE2 2.73Å
383I88.6Confident90.8Very high89 Ų8997 Ų9746%0.45648%0.484SS..Hα-helixtrans-56.5-49.5172.5-69.7163.1000109.8M379 K380 T385 L386 E387M379-I383 WeakPolarHBondContact O-CB 3.49Å; M379-I383 WeakPolarHBondContact O-CD1 3.24Å; M379-I383 VanDerWaalsContact O-CG1 3.25Å; M379-I383 WeakPolarHBondContact O-CG1 3.33Å; M379-I383 PolarHBondContact O-N 3.44Å; K380-I383 PolarHBondContact O-N 3.07Å; I383-T385 PolarHBondContact O-N 2.94Å; I383-L386 PolarHBondContact O-N 2.89Å; I383-E387 HydrophobicContact CG2-CG 4.23Å; I383-E387 WeakPolarHBondContact CG2-OE1 3.35Å; I383-E387 WeakPolarHBondContact O-CG 3.5Å; I383-E387 PolarHBondContact O-N 3.23Å
384G92.3Very high90.8Very high16 Ų1698.5 Ų98.517%0.16548%0.483CS..Hα-helixtrans-65.1-18.7177.600000115.3K380 D381 R382 K388K380-G384 PolarHBondContact O-N 2.96Å; D381-G384 CarbonylContact O-C 3.57Å; D381-G384 PolarHBondContact O-N 2.92Å; R382-G384 VanDerWaalsContact C-N 3.34Å; R382-G384 PolarHBondContact O-N 3.46Å; G384-K388 VanDerWaalsContact O-CD 3.22Å; G384-K388 WeakPolarHBondContact O-CD 3.35Å; G384-K388 WeakPolarHBondContact O-CE 3.46Å; G384-K388 VanDerWaalsContact O-CG 3.27Å; G384-K388 WeakPolarHBondContact O-CG 3.3Å
385T91.1Very high90.7Very high53 Ų53100.2 Ų100.233%0.32549%0.489SS..Hα-helixtrans-79.8-45.316655.40000112.1D381 R382 I383 E387 K388 E389D381-T385 PolarHBondContact O-N 3.22Å; R382-T385 WeakPolarHBondContact CA-OG1 3.5Å; R382-T385 WeakPolarHBondContact CD-OG1 3.39Å; R382-T385 PolarHBondContact NH1-OG1 3.22Å; R382-T385 PolarHBondContact O-N 2.99Å; R382-T385 VanDerWaalsContact O-N 3.13Å; R382-T385 PolarHBondContact O-OG1 3.28Å; I383-T385 PolarHBondContact O-N 2.94Å; T385-E387 VanDerWaalsContact C-N 3.33Å; T385-E387 PolarHBondContact O-N 2.89Å; T385-K388 PolarHBondContact O-N 3.18Å; T385-K388 VanDerWaalsContact O-N 3.1Å; T385-E389 WeakPolarHBondContact O-CB 3.33Å; T385-E389 VanDerWaalsContact O-CG 3.31Å; T385-E389 WeakPolarHBondContact O-CG 3.39Å; T385-E389 PolarHBondContact O-N 3.44Å
386L88.6Confident90.9Very high83 Ų83103.7 Ų103.744%0.43550%0.499SS..Hα-helixtrans-62.6-37.9178.5-71.1167.2000112.1R382 I383 K388 E389 H390R382-L386 HydrophobicContact CG-CD1 4.14Å; R382-L386 WeakPolarHBondContact O-CG 3.3Å; R382-L386 PolarHBondContact O-N 3.36Å; I383-L386 PolarHBondContact O-N 2.89Å; L386-K388 VanDerWaalsContact C-N 3.35Å; L386-K388 PolarHBondContact O-N 3.06Å; L386-E389 PolarHBondContact O-N 3.39Å; L386-H390 VanDerWaalsContact O-CB 3.3Å; L386-H390 WeakPolarHBondContact O-CB 3.44Å; L386-H390 PolarHBondContact O-N 3.4Å
387E88.3Confident90.8Very high114 Ų114104.9 Ų104.953%0.53350%0.504SS..Hα-helixtrans-61.4-41.3172.9-72.9171.9166.700111.8I383 T385 N391I383-E387 HydrophobicContact CG2-CG 4.23Å; I383-E387 WeakPolarHBondContact CG2-OE1 3.35Å; I383-E387 WeakPolarHBondContact O-CG 3.5Å; I383-E387 PolarHBondContact O-N 3.23Å; T385-E387 VanDerWaalsContact C-N 3.33Å; T385-E387 PolarHBondContact O-N 2.89Å; E387-N391 WeakPolarHBondContact O-CB 3.47Å; E387-N391 PolarHBondContact O-N 3.48Å; E387-N391 PolarHBondContact O-ND2 2.83Å
388K93Very high90.7Very high143 Ų143108.7 Ų108.762%0.62251%0.513SS*.Hα-helixtrans-70.2-43.3176.5-69.8168.3-168.61660111.5G384 T385 L386 H390 N391 I392G384-K388 VanDerWaalsContact O-CD 3.22Å; G384-K388 WeakPolarHBondContact O-CD 3.35Å; G384-K388 WeakPolarHBondContact O-CE 3.46Å; G384-K388 VanDerWaalsContact O-CG 3.27Å; G384-K388 WeakPolarHBondContact O-CG 3.3Å; T385-K388 PolarHBondContact O-N 3.18Å; T385-K388 VanDerWaalsContact O-N 3.1Å; L386-K388 VanDerWaalsContact C-N 3.35Å; L386-K388 PolarHBondContact O-N 3.06Å; K388-H390 VanDerWaalsContact C-N 3.32Å; K388-H390 PolarHBondContact O-N 3.19Å; K388-N391 PolarHBondContact O-N 3.25Å; K388-I392 WeakPolarHBondContact O-CB 3.38Å; K388-I392 WeakPolarHBondContact O-CD1 3.14Å; K388-I392 VanDerWaalsContact O-CG1 3.23Å; K388-I392 WeakPolarHBondContact O-CG1 3.15Å; K388-I392 PolarHBondContact O-N 3.29Å
389E88.4Confident90.5Very high94 Ų94102.5 Ų102.544%0.43950%0.499SS..Hα-helixtrans-57.3-45174.1-71.3162.2-148.500110.6R382 T385 L386 I392 F393R382-E389 IonicContact NH1-OE1 3.65Å; R382-E389 PolarHBondContact NH1-OE1 2.85Å; R382-E389 IonicContact NH1-OE2 2.62Å; R382-E389 IonicContact NH2-OE2 2.73Å; T385-E389 WeakPolarHBondContact O-CB 3.33Å; T385-E389 VanDerWaalsContact O-CG 3.31Å; T385-E389 WeakPolarHBondContact O-CG 3.39Å; T385-E389 PolarHBondContact O-N 3.44Å; L386-E389 PolarHBondContact O-N 3.39Å; E389-I392 PolarHBondContact O-N 3.5Å; E389-F393 WeakPolarHBondContact O-CB 3.4Å; E389-F393 PolarHBondContact O-N 3.31Å
390H88.9Confident90.3Very high114 Ų11499.9 Ų99.953%0.52849%0.492SS..Hα-helixtrans-64.1-46.4176.2-173.281.8000112.8L386 K388 I392 F393 Q394L386-H390 VanDerWaalsContact O-CB 3.3Å; L386-H390 WeakPolarHBondContact O-CB 3.44Å; L386-H390 PolarHBondContact O-N 3.4Å; K388-H390 VanDerWaalsContact C-N 3.32Å; K388-H390 PolarHBondContact O-N 3.19Å; H390-I392 VanDerWaalsContact C-N 3.33Å; H390-I392 PolarHBondContact O-N 2.92Å; H390-F393 PolarHBondContact O-N 2.82Å; H390-Q394 WeakPolarHBondContact O-CB 3.34Å; H390-Q394 PolarHBondContact O-N 3.07Å
391N89.4Confident90.3Very high85 Ų8599.6 Ų99.646%0.45549%0.488SS..Hα-helixtrans-62.4-39.1175.8-83.9-86.6000112E387 K388 N395E387-N391 WeakPolarHBondContact O-CB 3.47Å; E387-N391 PolarHBondContact O-N 3.48Å; E387-N391 PolarHBondContact O-ND2 2.83Å; K388-N391 PolarHBondContact O-N 3.25Å; N391-N395 WeakPolarHBondContact O-CB 3.31Å; N391-N395 PolarHBondContact O-N 3.41Å; N391-N395 PolarHBondContact O-ND2 2.96Å
392I92Very high90.3Very high97 Ų97100.3 Ų100.350%0.49749%0.488SS..Hα-helixtrans-65.3-42.4175-70.1164000110.5K388 E389 H390 N395 K396K388-I392 WeakPolarHBondContact O-CB 3.38Å; K388-I392 WeakPolarHBondContact O-CD1 3.14Å; K388-I392 VanDerWaalsContact O-CG1 3.23Å; K388-I392 WeakPolarHBondContact O-CG1 3.15Å; K388-I392 PolarHBondContact O-N 3.29Å; E389-I392 PolarHBondContact O-N 3.5Å; H390-I392 VanDerWaalsContact C-N 3.33Å; H390-I392 PolarHBondContact O-N 2.92Å; I392-N395 PolarHBondContact O-N 3.4Å; I392-K396 HydrophobicContact CG2-CD 4.33Å; I392-K396 WeakPolarHBondContact O-CB 3.36Å; I392-K396 WeakPolarHBondContact O-CG 3.38Å; I392-K396 PolarHBondContact O-N 3.05Å
393F92.8Very high90.1Very high126 Ų126100.8 Ų100.855%0.55350%0.495SS*.Hα-helixtrans-64.1-44.5176.8-178.6-106.2000112.3E389 H390 N395 K396 M397E389-F393 WeakPolarHBondContact O-CB 3.4Å; E389-F393 PolarHBondContact O-N 3.31Å; H390-F393 PolarHBondContact O-N 2.82Å; F393-N395 PolarHBondContact O-N 2.88Å; F393-K396 PolarHBondContact O-N 3.17Å; F393-M397 HydrophobicContact CD1-CE 4.06Å; F393-M397 HydrophobicContact CE1-CE 3.36Å; F393-M397 HydrophobicContact CZ-CE 3.87Å; F393-M397 WeakPolarHBondContact O-CB 3.44Å; F393-M397 PolarHBondContact O-N 3.16Å
394Q89.7Confident90Very high107 Ų107100.2 Ų100.250%0.550%0.496SS..Hα-helixtrans-61.3-44176.3-170.1178.928.500111.8H390 M397 H398H390-Q394 WeakPolarHBondContact O-CB 3.34Å; H390-Q394 PolarHBondContact O-N 3.07Å; Q394-M397 PolarHBondContact O-N 3.25Å; Q394-H398 PolarHBondContact O-N 3.48Å
395N91.2Very high89.9Confident108 Ų108103.7 Ų103.758%0.57851%0.508SS*.Hα-helixtrans-64.6-41.8175.4-75.5-47000112.3N391 I392 F393 H398 A399N391-N395 WeakPolarHBondContact O-CB 3.31Å; N391-N395 PolarHBondContact O-N 3.41Å; N391-N395 PolarHBondContact O-ND2 2.96Å; I392-N395 PolarHBondContact O-N 3.4Å; F393-N395 PolarHBondContact O-N 2.88Å; N395-H398 PolarHBondContact O-N 3.24Å; N395-A399 WeakPolarHBondContact O-CB 3.15Å; N395-A399 PolarHBondContact O-N 3.45Å
396K93.3Very high89.8Confident147 Ų147106.7 Ų106.764%0.63952%0.518SS*.Hα-helixtrans-61.5-42.5173.5-78.3-179.3175.4-171.60112.2I392 F393 A399 S400I392-K396 HydrophobicContact CG2-CD 4.33Å; I392-K396 WeakPolarHBondContact O-CB 3.36Å; I392-K396 WeakPolarHBondContact O-CG 3.38Å; I392-K396 PolarHBondContact O-N 3.05Å; F393-K396 PolarHBondContact O-N 3.17Å; K396-A399 PolarHBondContact O-N 2.91Å; K396-S400 VanDerWaalsContact O-CB 3.27Å; K396-S400 WeakPolarHBondContact O-CB 3.35Å; K396-S400 PolarHBondContact O-N 2.72Å
397M86.3Confident89.9Confident112 Ų112109.1 Ų109.155%0.55253%0.529SS*.Hα-helixtrans-62.4-43.6177.1-172.2-168.5-60.900111.3F393 Q394 Y401F393-M397 HydrophobicContact CD1-CE 4.06Å; F393-M397 HydrophobicContact CE1-CE 3.36Å; F393-M397 HydrophobicContact CZ-CE 3.87Å; F393-M397 WeakPolarHBondContact O-CB 3.44Å; F393-M397 PolarHBondContact O-N 3.16Å; Q394-M397 PolarHBondContact O-N 3.25Å; M397-Y401 WeakPolarHBondContact O-CB 3.36Å; M397-Y401 PolarHBondContact O-N 3.42Å
398H90.3Very high89.8Confident126 Ų126110 Ų11058%0.58353%0.533SS*.Hα-helixtrans-67.4-41.5177.8-16761.2000112.5Q394 N395 Y401 Q402Q394-H398 PolarHBondContact O-N 3.48Å; N395-H398 PolarHBondContact O-N 3.24Å; H398-Y401 PolarHBondContact O-N 3.34Å; H398-Q402 PolarHBondContact O-N 3.27Å
399A89.1Confident89.7Confident41 Ų41109.2 Ų109.234%0.33953%0.533SS..Hα-helixtrans-62.8-47.4174.300000111.8N395 K396 Y401 Q402 E403N395-A399 WeakPolarHBondContact O-CB 3.15Å; N395-A399 PolarHBondContact O-N 3.45Å; K396-A399 PolarHBondContact O-N 2.91Å; A399-Y401 VanDerWaalsContact C-N 3.31Å; A399-Y401 PolarHBondContact O-N 3.45Å; A399-Q402 WeakPolarHBondContact O-CB 3.29Å; A399-Q402 PolarHBondContact O-N 2.89Å; A399-Q402 VanDerWaalsContact O-N 3.1Å; A399-E403 WeakPolarHBondContact O-CG 3.43Å; A399-E403 PolarHBondContact O-N 3.02Å
400S86Confident89.9Confident64 Ų64110 Ų11045%0.44854%0.535SS..Hα-helixtrans-60.9-37.9176.7179.50000112.3K396 E403 T404K396-S400 VanDerWaalsContact O-CB 3.27Å; K396-S400 WeakPolarHBondContact O-CB 3.35Å; K396-S400 PolarHBondContact O-N 2.72Å; S400-E403 PolarHBondContact O-N 2.85Å; S400-T404 WeakPolarHBondContact O-CB 3.44Å; S400-T404 PolarHBondContact O-N 3.48Å; S400-T404 PolarHBondContact O-OG1 3.12Å
401Y93Very high89.9Confident138 Ų138111.5 Ų111.554%0.54154%0.54SS..Hα-helixtrans-63.8-42.6172.3-177.5-102.4000112.2M397 H398 A399 T404 Q405M397-Y401 WeakPolarHBondContact O-CB 3.36Å; M397-Y401 PolarHBondContact O-N 3.42Å; H398-Y401 PolarHBondContact O-N 3.34Å; A399-Y401 VanDerWaalsContact C-N 3.31Å; A399-Y401 PolarHBondContact O-N 3.45Å; Y401-T404 WeakPolarHBondContact O-CB 3.47Å; Y401-T404 PolarHBondContact O-N 2.83Å; Y401-Q405 HydrophobicContact CE1-CG 4.24Å; Y401-Q405 VanDerWaalsContact CZ-NE2 3.34Å; Y401-Q405 PolarHBondContact O-N 3.43Å; Y401-Q405 PolarHBondContact OH-NE2 2.92Å; Y401-Q405 VanDerWaalsContact OH-NE2 3.11Å
402Q92.1Very high90.1Very high128 Ų128112 Ų11260%0.59854%0.54SS*.Hα-helixtrans-66.4-40176.5-170.1178.216.600112.3H398 A399 Q405 Q406H398-Q402 PolarHBondContact O-N 3.27Å; A399-Q402 WeakPolarHBondContact O-CB 3.29Å; A399-Q402 PolarHBondContact O-N 2.89Å; A399-Q402 VanDerWaalsContact O-N 3.1Å; Q402-Q405 PolarHBondContact O-N 2.98Å; Q402-Q406 PolarHBondContact O-N 2.83Å
403E87.4Confident90.1Very high132 Ų132113.7 Ų113.762%0.61755%0.546SS*.Hα-helixtrans-64.2-40.2172.9-73176.5177.700111.7A399 S400 Q406 M407A399-E403 WeakPolarHBondContact O-CG 3.43Å; A399-E403 PolarHBondContact O-N 3.02Å; S400-E403 PolarHBondContact O-N 2.85Å; E403-Q406 PolarHBondContact O-N 3.1Å; E403-M407 WeakPolarHBondContact O-CB 3.49Å; E403-M407 PolarHBondContact O-N 2.85Å
404T87.3Confident90Very high76 Ų76112.1 Ų112.147%0.46655%0.546SS..Hα-helixtrans-62.1-45.9175.1-58.80000111.2S400 Y401 Q406 M407 Q408S400-T404 WeakPolarHBondContact O-CB 3.44Å; S400-T404 PolarHBondContact O-N 3.48Å; S400-T404 PolarHBondContact O-OG1 3.12Å; Y401-T404 WeakPolarHBondContact O-CB 3.47Å; Y401-T404 PolarHBondContact O-N 2.83Å; T404-Q406 PolarHBondContact O-N 3.28Å; T404-M407 PolarHBondContact O-N 3.42Å; T404-Q408 WeakPolarHBondContact O-CB 3.28Å; T404-Q408 PolarHBondContact O-N 3.38Å
405Q89.2Confident90Very high90 Ų90110.8 Ų110.842%0.42154%0.54SS..Hα-helixtrans-60.5-42.6173.1-73.8-171-14.300112Y401 Q402 M407 Q408 M409Y401-Q405 HydrophobicContact CE1-CG 4.24Å; Y401-Q405 VanDerWaalsContact CZ-NE2 3.34Å; Y401-Q405 PolarHBondContact O-N 3.43Å; Y401-Q405 PolarHBondContact OH-NE2 2.92Å; Y401-Q405 VanDerWaalsContact OH-NE2 3.11Å; Q402-Q405 PolarHBondContact O-N 2.98Å; Q405-M407 VanDerWaalsContact C-N 3.33Å; Q405-M407 PolarHBondContact O-N 3.35Å; Q405-Q408 PolarHBondContact O-N 3.01Å; Q405-M409 WeakPolarHBondContact O-CG 3.44Å; Q405-M409 PolarHBondContact O-N 3.27Å
406Q90.5Very high90.1Very high116 Ų116111 Ų11154%0.54254%0.537SS..Hα-helixtrans-65.6-37177.6-161.9-163.277.700111.9Q402 E403 T404 K410Q402-Q406 PolarHBondContact O-N 2.83Å; E403-Q406 PolarHBondContact O-N 3.1Å; T404-Q406 PolarHBondContact O-N 3.28Å; Q406-K410 VanDerWaalsContact O-CG 3.31Å; Q406-K410 WeakPolarHBondContact O-CG 3.29Å; Q406-K410 PolarHBondContact O-N 2.81Å
407M89.5Confident90.1Very high133 Ų133110.1 Ų110.166%0.65554%0.536SS*.Hα-helixtrans-67.6-41.4175.2-167.2-175.7-58.600111.4E403 T404 Q405 K410 F411E403-M407 WeakPolarHBondContact O-CB 3.49Å; E403-M407 PolarHBondContact O-N 2.85Å; T404-M407 PolarHBondContact O-N 3.42Å; Q405-M407 VanDerWaalsContact C-N 3.33Å; Q405-M407 PolarHBondContact O-N 3.35Å; M407-K410 PolarHBondContact O-N 3.43Å; M407-F411 WeakPolarHBondContact O-CB 3.22Å; M407-F411 PolarHBondContact O-N 2.87Å
408Q86.3Confident90.3Very high132 Ų132109.8 Ų109.862%0.61753%0.534SS*.Hα-helixtrans-62.6-43.9176-169.7173.415.600111.7T404 Q405 K410 F411 Q412T404-Q408 WeakPolarHBondContact O-CB 3.28Å; T404-Q408 PolarHBondContact O-N 3.38Å; Q405-Q408 PolarHBondContact O-N 3.01Å; Q408-K410 PolarHBondContact O-N 2.89Å; Q408-F411 PolarHBondContact O-N 2.99Å; Q408-Q412 PolarHBondContact O-N 3.46Å
409M90.5Very high90.4Very high128 Ų128108.9 Ų108.963%0.63153%0.53SS*.Hα-helixtrans-61.6-41.7173.4-73.1-61.2-56.600112.5Q405 Q412 Q413Q405-M409 WeakPolarHBondContact O-CG 3.44Å; Q405-M409 PolarHBondContact O-N 3.27Å; M409-Q412 PolarHBondContact O-N 3.42Å; M409-Q413 WeakPolarHBondContact O-CB 3.42Å; M409-Q413 PolarHBondContact O-N 3.37Å
410K92.3Very high90.6Very high110 Ų110109.9 Ų109.948%0.47854%0.538SS..Hα-helixtrans-64.6-41.4174.9-76.2166.2173.2170.90112.1Q406 M407 Q408 Q413 V414Q406-K410 VanDerWaalsContact O-CG 3.31Å; Q406-K410 WeakPolarHBondContact O-CG 3.29Å; Q406-K410 PolarHBondContact O-N 2.81Å; M407-K410 PolarHBondContact O-N 3.43Å; Q408-K410 PolarHBondContact O-N 2.89Å; K410-Q413 PolarHBondContact O-N 3.47Å; K410-V414 WeakPolarHBondContact O-CG2 3.44Å; K410-V414 PolarHBondContact O-N 3.22Å
411F89.6Confident91Very high146 Ų146112.5 Ų112.564%0.6454%0.544SS*.Hα-helixtrans-62.2-46.6176.4-177.1-89.3000111M407 Q408 Q413 V414 Q415M407-F411 WeakPolarHBondContact O-CB 3.22Å; M407-F411 PolarHBondContact O-N 2.87Å; Q408-F411 PolarHBondContact O-N 2.99Å; F411-Q413 PolarHBondContact O-N 2.82Å; F411-V414 PolarHBondContact O-N 3.09Å; F411-Q415 PolarHBondContact O-N 3.25Å
412Q93.5Very high91Very high95 Ų95109.3 Ų109.344%0.44454%0.535SS..Hα-helixtrans-62.4-41.7176-177171.2-19.500112Q408 M409 V414 Q415 E416Q408-Q412 PolarHBondContact O-N 3.46Å; M409-Q412 PolarHBondContact O-N 3.42Å; Q412-V414 VanDerWaalsContact C-N 3.33Å; Q412-V414 PolarHBondContact O-N 2.82Å; Q412-Q415 WeakPolarHBondContact O-CB 3.47Å; Q412-Q415 PolarHBondContact O-N 3.32Å; Q412-E416 HydrophobicContact CG-CG 4.42Å; Q412-E416 WeakPolarHBondContact CG-OE1 3.44Å; Q412-E416 PolarHBondContact NE2-OE1 3Å; Q412-E416 WeakPolarHBondContact O-CG 3.31Å; Q412-E416 PolarHBondContact O-N 2.89Å
413Q92.4Very high90.9Very high132 Ų132105.7 Ų105.762%0.61753%0.527SS*.Hα-helixtrans-61.2-39.9175.5-172.8179.210.500112.5M409 K410 F411 Q417M409-Q413 WeakPolarHBondContact O-CB 3.42Å; M409-Q413 PolarHBondContact O-N 3.37Å; K410-Q413 PolarHBondContact O-N 3.47Å; F411-Q413 PolarHBondContact O-N 2.82Å; Q413-Q417 WeakPolarHBondContact O-CB 3.43Å; Q413-Q417 PolarHBondContact O-N 2.93Å
414V91.1Very high91.3Very high93 Ų93104.3 Ų104.356%0.56452%0.521SS*.Hα-helixtrans-69.1-37175.2170.40000111.4K410 F411 Q412 Q417 M418K410-V414 WeakPolarHBondContact O-CG2 3.44Å; K410-V414 PolarHBondContact O-N 3.22Å; F411-V414 PolarHBondContact O-N 3.09Å; Q412-V414 VanDerWaalsContact C-N 3.33Å; Q412-V414 PolarHBondContact O-N 2.82Å; V414-Q417 PolarHBondContact O-N 3.37Å; V414-M418 WeakPolarHBondContact O-CB 3.4Å; V414-M418 PolarHBondContact O-N 3.48Å
415Q90.1Very high91.6Very high80 Ų80104.8 Ų104.837%0.37452%0.52SS..Hα-helixtrans-63.3-48.6173.2-178.4-179.7-20.600111.2F411 Q412 Q417 M418 E419F411-Q415 PolarHBondContact O-N 3.25Å; Q412-Q415 WeakPolarHBondContact O-CB 3.47Å; Q412-Q415 PolarHBondContact O-N 3.32Å; Q415-Q417 VanDerWaalsContact C-N 3.31Å; Q415-Q417 PolarHBondContact O-N 3.2Å; Q415-M418 PolarHBondContact O-N 3.47Å; Q415-M418 VanDerWaalsContact O-N 3.17Å; Q415-E419 HydrophobicContact CG-CG 4.44Å; Q415-E419 WeakPolarHBondContact CG-OE1 3.2Å; Q415-E419 PolarHBondContact NE2-OE1 3.43Å; Q415-E419 WeakPolarHBondContact O-CB 3.35Å; Q415-E419 WeakPolarHBondContact O-CG 3.45Å; Q415-E419 PolarHBondContact O-N 2.94Å
416E93.6Very high91.7Very high111 Ų111107.3 Ų107.352%0.51953%0.529SS..Hα-helixtrans-60.3-39.4177.3-73.1173.5-165.600111.7Q412 E419 A420Q412-E416 HydrophobicContact CG-CG 4.42Å; Q412-E416 WeakPolarHBondContact CG-OE1 3.44Å; Q412-E416 PolarHBondContact NE2-OE1 3Å; Q412-E416 WeakPolarHBondContact O-CG 3.31Å; Q412-E416 PolarHBondContact O-N 2.89Å; E416-E419 PolarHBondContact O-N 3.07Å; E416-A420 WeakPolarHBondContact O-CB 3.36Å; E416-A420 PolarHBondContact O-N 3.35Å
417Q91.4Very high91.9Very high129 Ų129108 Ų10860%0.60353%0.533SS*.Hα-helixtrans-63.6-45.7173.3-177.4176.6-1200112.1Q413 V414 Q415 A420 E421Q413-Q417 WeakPolarHBondContact O-CB 3.43Å; Q413-Q417 PolarHBondContact O-N 2.93Å; V414-Q417 PolarHBondContact O-N 3.37Å; Q415-Q417 VanDerWaalsContact C-N 3.31Å; Q415-Q417 PolarHBondContact O-N 3.2Å; Q417-A420 PolarHBondContact O-N 3.35Å; Q417-E421 PolarHBondContact O-N 3.33Å
418M92.1Very high92.1Very high105 Ų105105.6 Ų105.652%0.51752%0.519SS..Hα-helixtrans-64.9-39.6177.7-178.3-178.76300111.8V414 Q415 E421 I422V414-M418 WeakPolarHBondContact O-CB 3.4Å; V414-M418 PolarHBondContact O-N 3.48Å; Q415-M418 PolarHBondContact O-N 3.47Å; Q415-M418 VanDerWaalsContact O-N 3.17Å; M418-E421 PolarHBondContact O-N 3.42Å; M418-I422 HydrophobicContact CG-CD1 3.89Å; M418-I422 WeakPolarHBondContact O-CB 3.4Å; M418-I422 VanDerWaalsContact O-CG1 3.23Å; M418-I422 WeakPolarHBondContact O-CG1 3.45Å; M418-I422 PolarHBondContact O-N 3.09Å
419E92.7Very high92.3Very high107 Ų107103.4 Ų103.450%0.551%0.512SS..Hα-helixtrans-66.3-38.3175.9-74.5-176.7-154.400111.9Q415 E416 I422 A423Q415-E419 HydrophobicContact CG-CG 4.44Å; Q415-E419 WeakPolarHBondContact CG-OE1 3.2Å; Q415-E419 PolarHBondContact NE2-OE1 3.43Å; Q415-E419 WeakPolarHBondContact O-CB 3.35Å; Q415-E419 WeakPolarHBondContact O-CG 3.45Å; Q415-E419 PolarHBondContact O-N 2.94Å; E416-E419 PolarHBondContact O-N 3.07Å; E419-I422 PolarHBondContact O-N 2.82Å; E419-A423 WeakPolarHBondContact O-CB 3.37Å; E419-A423 PolarHBondContact O-N 2.95Å
420A92.9Very high92.5Very high62 Ų6298.2 Ų98.251%0.51249%0.491SS..Hα-helixtrans-65-41.317300000112.6E416 Q417 A423 H424E416-A420 WeakPolarHBondContact O-CB 3.36Å; E416-A420 PolarHBondContact O-N 3.35Å; Q417-A420 PolarHBondContact O-N 3.35Å; A420-A423 WeakPolarHBondContact O-CB 3.3Å; A420-A423 PolarHBondContact O-N 3.5Å; A420-H424 PolarHBondContact O-N 3.5Å
421E93.5Very high92.6Very high120 Ų12097.7 Ų97.756%0.56149%0.493SS*.Hα-helixtrans-69.1-38.6176.5-170.5164.1-157.800111.9Q417 M418 A423 H424 L425Q417-E421 PolarHBondContact O-N 3.33Å; M418-E421 PolarHBondContact O-N 3.42Å; E421-A423 VanDerWaalsContact C-N 3.3Å; E421-A423 PolarHBondContact O-N 2.91Å; E421-H424 WeakPolarHBondContact O-CB 3.43Å; E421-H424 PolarHBondContact O-N 2.93Å; E421-L425 HydrophobicContact CG-CD1 4.35Å; E421-L425 WeakPolarHBondContact O-CB 3.29Å; E421-L425 WeakPolarHBondContact O-CG 3.46Å; E421-L425 PolarHBondContact O-N 3.38Å
422I92.4Very high92.8Very high71 Ų7195.9 Ų95.936%0.36449%0.489SS..Hα-helixtrans-62.3-37.4170.1-72.4167.5000111.2M418 E419 K426M418-I422 HydrophobicContact CG-CD1 3.89Å; M418-I422 WeakPolarHBondContact O-CB 3.4Å; M418-I422 VanDerWaalsContact O-CG1 3.23Å; M418-I422 WeakPolarHBondContact O-CG1 3.45Å; M418-I422 PolarHBondContact O-N 3.09Å; E419-I422 PolarHBondContact O-N 2.82Å; I422-K426 HydrophobicContact CG2-CD 4.03Å; I422-K426 VanDerWaalsContact CG2-CE 3.48Å; I422-K426 WeakPolarHBondContact O-CB 3.49Å; I422-K426 WeakPolarHBondContact O-CD 3.36Å; I422-K426 WeakPolarHBondContact O-CG 3.38Å; I422-K426 PolarHBondContact O-N 3.39Å
423A91.9Very high92.8Very high52 Ų5299.3 Ų99.343%0.4350%0.498SS..Hα-helixtrans-67.4-42174.700000111.9E419 A420 E421 K426 Q427E419-A423 WeakPolarHBondContact O-CB 3.37Å; E419-A423 PolarHBondContact O-N 2.95Å; A420-A423 WeakPolarHBondContact O-CB 3.3Å; A420-A423 PolarHBondContact O-N 3.5Å; E421-A423 VanDerWaalsContact C-N 3.3Å; E421-A423 PolarHBondContact O-N 2.91Å; A423-K426 PolarHBondContact O-N 2.89Å; A423-Q427 PolarHBondContact O-N 2.77Å
424H94.8Very high92.9Very high103 Ų10397.8 Ų97.848%0.47749%0.494SS..Hα-helixtrans-59.6-51.8174.1-170.8-89.2000111.5A420 E421 K426 Q427 E428A420-H424 PolarHBondContact O-N 3.5Å; E421-H424 WeakPolarHBondContact O-CB 3.43Å; E421-H424 PolarHBondContact O-N 2.93Å; H424-K426 VanDerWaalsContact C-N 3.28Å; H424-K426 PolarHBondContact O-N 3.18Å; H424-Q427 CarbonylContact O-C 3.55Å; H424-Q427 WeakPolarHBondContact O-CA 3.32Å; H424-Q427 WeakPolarHBondContact O-CB 3.42Å; H424-Q427 PolarHBondContact O-N 2.91Å; H424-E428 IonicContact CE1-OE1 2.72Å; H424-E428 PolarHBondContact CE1-OE1 3.23Å; H424-E428 IonicContact CE1-OE2 2.7Å; H424-E428 PolarHBondContact CE1-OE2 2.84Å; H424-E428 VanDerWaalsContact ND1-CD 3.34Å; H424-E428 IonicContact ND1-OE1 3.37Å; H424-E428 IonicContact ND1-OE2 3.62Å; H424-E428 PolarHBondContact ND1-OE2 2.82Å; H424-E428 PolarHBondContact O-N 3.45Å
425L93.4Very high93Very high85 Ų8595.6 Ų95.645%0.44549%0.486SS..Hα-helixtrans-61.3-35.4177.7-70.5168.3000112E421 N429E421-L425 HydrophobicContact CG-CD1 4.35Å; E421-L425 WeakPolarHBondContact O-CB 3.29Å; E421-L425 WeakPolarHBondContact O-CG 3.46Å; E421-L425 PolarHBondContact O-N 3.38Å; L425-N429 WeakPolarHBondContact O-CB 3.45Å; L425-N429 PolarHBondContact O-N 2.66Å; L425-N429 PolarHBondContact O-ND2 3.03Å
426K91.6Very high93.1Very high144 Ų14496.1 Ų96.163%0.62649%0.494SS*.Hα-helixtrans-64.7-38.5171.8-78.1166.7-177.7169.60112.2I422 A423 H424 G430I422-K426 HydrophobicContact CG2-CD 4.03Å; I422-K426 VanDerWaalsContact CG2-CE 3.48Å; I422-K426 WeakPolarHBondContact O-CB 3.49Å; I422-K426 WeakPolarHBondContact O-CD 3.36Å; I422-K426 WeakPolarHBondContact O-CG 3.38Å; I422-K426 PolarHBondContact O-N 3.39Å; A423-K426 PolarHBondContact O-N 2.89Å; H424-K426 VanDerWaalsContact C-N 3.28Å; H424-K426 PolarHBondContact O-N 3.18Å; K426-G430 PolarHBondContact O-N 2.96Å
427Q95.6Very high93.1Very high131 Ų13193.5 Ų93.561%0.61249%0.488SS*.Hα-helixtrans-68.6-45.5176.1-178.5177.1-13.100111.8A423 H424 N429 G430 I431A423-Q427 PolarHBondContact O-N 2.77Å; H424-Q427 CarbonylContact O-C 3.55Å; H424-Q427 WeakPolarHBondContact O-CA 3.32Å; H424-Q427 WeakPolarHBondContact O-CB 3.42Å; H424-Q427 PolarHBondContact O-N 2.91Å; Q427-N429 PolarHBondContact O-N 2.97Å; Q427-G430 CarbonylContact O-C 3.54Å; Q427-G430 VanDerWaalsContact O-CA 3.3Å; Q427-G430 WeakPolarHBondContact O-CA 3.42Å; Q427-G430 PolarHBondContact O-N 2.9Å; Q427-I431 HydrophobicContact CG-CD1 4.21Å; Q427-I431 WeakPolarHBondContact O-CG1 3.46Å; Q427-I431 PolarHBondContact O-N 3.46Å
428E92.1Very high93.2Very high81 Ų8192.5 Ų92.538%0.37949%0.487SS..Hα-helixtrans-61.2-44174.9-70.7-178122.600111.7H424 G430 I431 L432H424-E428 IonicContact CE1-OE1 2.72Å; H424-E428 PolarHBondContact CE1-OE1 3.23Å; H424-E428 IonicContact CE1-OE2 2.7Å; H424-E428 PolarHBondContact CE1-OE2 2.84Å; H424-E428 VanDerWaalsContact ND1-CD 3.34Å; H424-E428 IonicContact ND1-OE1 3.37Å; H424-E428 IonicContact ND1-OE2 3.62Å; H424-E428 PolarHBondContact ND1-OE2 2.82Å; H424-E428 PolarHBondContact O-N 3.45Å; E428-G430 PolarHBondContact O-N 3.38Å; E428-I431 PolarHBondContact O-N 3.36Å; E428-L432 WeakPolarHBondContact O-CB 3.32Å; E428-L432 WeakPolarHBondContact O-CG 3.46Å; E428-L432 PolarHBondContact O-N 3.04Å
429N91.5Very high93.1Very high86 Ų8691.6 Ų91.646%0.4649%0.487SS..Hα-helixtrans-65.4-21.4172.2-80.8-81.3000112.9L425 Q427 R433L425-N429 WeakPolarHBondContact O-CB 3.45Å; L425-N429 PolarHBondContact O-N 2.66Å; L425-N429 PolarHBondContact O-ND2 3.03Å; Q427-N429 PolarHBondContact O-N 2.97Å; N429-R433 WeakPolarHBondContact O-CG 3.19Å; N429-R433 PolarHBondContact O-N 3.27Å; N429-R433 PolarHBondContact O-NE 3.5Å; N429-R433 PolarHBondContact O-NH2 2.68Å
430G95.1Very high93.1Very high19 Ų1989.4 Ų89.420%0.19648%0.482CS..Hα-helixtrans-66.9-60165.200000110.9K426 Q427 E428 L432 R433 D434K426-G430 PolarHBondContact O-N 2.96Å; Q427-G430 CarbonylContact O-C 3.54Å; Q427-G430 VanDerWaalsContact O-CA 3.3Å; Q427-G430 WeakPolarHBondContact O-CA 3.42Å; Q427-G430 PolarHBondContact O-N 2.9Å; E428-G430 PolarHBondContact O-N 3.38Å; G430-L432 VanDerWaalsContact C-N 3.27Å; G430-L432 PolarHBondContact O-N 3.19Å; G430-R433 WeakPolarHBondContact O-CA 3.31Å; G430-R433 PolarHBondContact O-N 2.86Å; G430-D434 PolarHBondContact O-N 3.15Å
431I93.6Very high92.9Very high100 Ų10090.5 Ų90.551%0.51348%0.479SS..Hα-helixtrans-54.9-40.7-179.3-63.8165.4000111.8Q427 E428 D434 A435Q427-I431 HydrophobicContact CG-CD1 4.21Å; Q427-I431 WeakPolarHBondContact O-CG1 3.46Å; Q427-I431 PolarHBondContact O-N 3.46Å; E428-I431 PolarHBondContact O-N 3.36Å; I431-D434 PolarHBondContact O-N 3.24Å; I431-A435 VanDerWaalsContact O-CB 3.29Å; I431-A435 WeakPolarHBondContact O-CB 3.47Å; I431-A435 PolarHBondContact O-N 3.11Å
432L93.3Very high92.8Very high107 Ų10790 Ų9056%0.5648%0.476SS*.Hα-helixtrans-66.3-39.1176.4-71.1172.4000112.4E428 G430 A435 V436E428-L432 WeakPolarHBondContact O-CB 3.32Å; E428-L432 WeakPolarHBondContact O-CG 3.46Å; E428-L432 PolarHBondContact O-N 3.04Å; G430-L432 VanDerWaalsContact C-N 3.27Å; G430-L432 PolarHBondContact O-N 3.19Å; L432-A435 PolarHBondContact O-N 3.41Å; L432-V436 WeakPolarHBondContact O-CB 3.44Å; L432-V436 VanDerWaalsContact O-CG2 3.28Å; L432-V436 WeakPolarHBondContact O-CG2 3.4Å; L432-V436 PolarHBondContact O-N 3.32Å
433R94.3Very high92.7Very high167 Ų16791.1 Ų91.163%0.6348%0.483SS*.Hα-helixtrans-68-38.7173.7-80.3176.4-69-169.2-0.8111.8N429 G430 V436 S437N429-R433 WeakPolarHBondContact O-CG 3.19Å; N429-R433 PolarHBondContact O-N 3.27Å; N429-R433 PolarHBondContact O-NE 3.5Å; N429-R433 PolarHBondContact O-NH2 2.68Å; G430-R433 WeakPolarHBondContact O-CA 3.31Å; G430-R433 PolarHBondContact O-N 2.86Å; R433-V436 PolarHBondContact O-N 3.4Å; R433-S437 WeakPolarHBondContact O-CB 3.42Å; R433-S437 PolarHBondContact O-N 3.17Å
434D94.3Very high92.6Very high101 Ų10193.8 Ų93.854%0.5449%0.486SS..Hα-helixtrans-68.2-35.9175.9-66.1-22.7000111.6G430 I431 N438G430-D434 PolarHBondContact O-N 3.15Å; I431-D434 PolarHBondContact O-N 3.24Å; D434-N438 VanDerWaalsContact O-CB 3.3Å; D434-N438 WeakPolarHBondContact O-CB 3.45Å; D434-N438 PolarHBondContact O-N 3.15Å; D434-N438 PolarHBondContact O-ND2 2.8Å
435A93.6Very high92.4Very high47 Ų4792.5 Ų92.539%0.38849%0.489SS..Hα-helixtrans-68.5-43.8173.400000112.1I431 L432 N438 T439I431-A435 VanDerWaalsContact O-CB 3.29Å; I431-A435 WeakPolarHBondContact O-CB 3.47Å; I431-A435 PolarHBondContact O-N 3.11Å; L432-A435 PolarHBondContact O-N 3.41Å; A435-N438 PolarHBondContact O-N 3.06Å; A435-T439 WeakPolarHBondContact O-CB 3.32Å; A435-T439 WeakPolarHBondContact O-CG2 3.5Å; A435-T439 PolarHBondContact O-N 2.92Å; A435-T439 PolarHBondContact O-OG1 2.86Å
436V91.9Very high92.3Very high90 Ų9093.9 Ų93.955%0.54549%0.491SS..Hα-helixtrans-62-46.2173.2169.50000110.6L432 R433 N438 T439 T440L432-V436 WeakPolarHBondContact O-CB 3.44Å; L432-V436 VanDerWaalsContact O-CG2 3.28Å; L432-V436 WeakPolarHBondContact O-CG2 3.4Å; L432-V436 PolarHBondContact O-N 3.32Å; R433-V436 PolarHBondContact O-N 3.4Å; V436-N438 PolarHBondContact O-N 2.84Å; V436-T439 WeakPolarHBondContact CA-OG1 3.41Å; V436-T439 PolarHBondContact O-N 3.4Å; V436-T439 PolarHBondContact O-OG1 3.27Å; V436-T440 WeakPolarHBondContact O-CB 3.19Å; V436-T440 PolarHBondContact O-N 2.79Å; V436-T440 PolarHBondContact O-OG1 3.02Å
437S93.4Very high92.3Very high57 Ų5792.3 Ų92.340%0.39949%0.486SS..Hα-helixtrans-60.2-46.6175.4-174.20000112R433 T439 T440 N441R433-S437 WeakPolarHBondContact O-CB 3.42Å; R433-S437 PolarHBondContact O-N 3.17Å; S437-T439 PolarHBondContact O-N 3.28Å; S437-T440 PolarHBondContact O-N 3.11Å; S437-N441 WeakPolarHBondContact O-CB 3.49Å; S437-N441 PolarHBondContact O-N 3.16Å; S437-N441 PolarHBondContact O-ND2 2.84Å; S437-N441 VanDerWaalsContact O-ND2 3.12Å; S437-N441 PolarHBondContact OG-ND2 3.48Å
438N92.4Very high92Very high107 Ų10789.2 Ų89.257%0.57248%0.479SS*.Hα-helixtrans-64.4-37.9177.8-83.5-61.1000113.1D434 A435 V436 Q442D434-N438 VanDerWaalsContact O-CB 3.3Å; D434-N438 WeakPolarHBondContact O-CB 3.45Å; D434-N438 PolarHBondContact O-N 3.15Å; D434-N438 PolarHBondContact O-ND2 2.8Å; A435-N438 PolarHBondContact O-N 3.06Å; V436-N438 PolarHBondContact O-N 2.84Å; N438-Q442 VanDerWaalsContact O-CB 3.24Å; N438-Q442 WeakPolarHBondContact O-CB 3.39Å; N438-Q442 PolarHBondContact O-N 3.4Å
439T91Very high92Very high86 Ų8688.2 Ų88.253%0.52849%0.485SS..Hα-helixtrans-70.7-38.1175.847.60000112.2A435 V436 S437 Q442 L443A435-T439 WeakPolarHBondContact O-CB 3.32Å; A435-T439 WeakPolarHBondContact O-CG2 3.5Å; A435-T439 PolarHBondContact O-N 2.92Å; A435-T439 PolarHBondContact O-OG1 2.86Å; V436-T439 WeakPolarHBondContact CA-OG1 3.41Å; V436-T439 PolarHBondContact O-N 3.4Å; V436-T439 PolarHBondContact O-OG1 3.27Å; S437-T439 PolarHBondContact O-N 3.28Å; T439-Q442 PolarHBondContact O-N 2.83Å; T439-L443 WeakPolarHBondContact O-CB 3.45Å; T439-L443 PolarHBondContact O-N 3.31Å
440T91.6Very high92Very high62 Ų6290.6 Ų90.638%0.3849%0.493SS..Hα-helixtrans-61.3-52.6170.6-61.70000111.3V436 S437 Q442 L443 E444V436-T440 WeakPolarHBondContact O-CB 3.19Å; V436-T440 PolarHBondContact O-N 2.79Å; V436-T440 PolarHBondContact O-OG1 3.02Å; S437-T440 PolarHBondContact O-N 3.11Å; T440-Q442 VanDerWaalsContact C-N 3.26Å; T440-Q442 PolarHBondContact O-N 3.27Å; T440-L443 WeakPolarHBondContact O-CA 3.25Å; T440-L443 WeakPolarHBondContact O-CB 3.4Å; T440-L443 PolarHBondContact O-N 2.86Å; T440-E444 HydrophobicContact CG2-CG 4.49Å; T440-E444 PolarHBondContact O-N 2.84Å
441N90.6Very high91.9Very high84 Ų8493.9 Ų93.945%0.44951%0.506SS..Hα-helixtrans-58.4-38.2177.7-66.5-25.4000111.8S437 S445S437-N441 WeakPolarHBondContact O-CB 3.49Å; S437-N441 PolarHBondContact O-N 3.16Å; S437-N441 PolarHBondContact O-ND2 2.84Å; S437-N441 VanDerWaalsContact O-ND2 3.12Å; S437-N441 PolarHBondContact OG-ND2 3.48Å; N441-S445 WeakPolarHBondContact O-CB 3.43Å; N441-S445 PolarHBondContact O-N 3.44Å
442Q91Very high91.8Very high109 Ų10993.5 Ų93.551%0.50951%0.505SS..Hα-helixtrans-70.1-36.4175.4-165.8-169.5103.700112.1N438 T439 T440 K446N438-Q442 VanDerWaalsContact O-CB 3.24Å; N438-Q442 WeakPolarHBondContact O-CB 3.39Å; N438-Q442 PolarHBondContact O-N 3.4Å; T439-Q442 PolarHBondContact O-N 2.83Å; T440-Q442 VanDerWaalsContact C-N 3.26Å; T440-Q442 PolarHBondContact O-N 3.27Å; Q442-K446 HydrophobicContact CG-CD 4.38Å; Q442-K446 WeakPolarHBondContact O-CB 3.38Å; Q442-K446 VanDerWaalsContact O-CG 3.26Å; Q442-K446 WeakPolarHBondContact O-CG 2.77Å; Q442-K446 PolarHBondContact O-N 2.98Å
443L90.6Very high91.8Very high95 Ų9594.6 Ų94.650%0.49751%0.505SS..Hα-helixtrans-67.9-46.8175.8-179.161.9000111.4T439 T440 S445 K446 Q447T439-L443 WeakPolarHBondContact O-CB 3.45Å; T439-L443 PolarHBondContact O-N 3.31Å; T440-L443 WeakPolarHBondContact O-CA 3.25Å; T440-L443 WeakPolarHBondContact O-CB 3.4Å; T440-L443 PolarHBondContact O-N 2.86Å; L443-S445 VanDerWaalsContact C-N 3.31Å; L443-S445 PolarHBondContact O-N 2.89Å; L443-K446 PolarHBondContact O-N 2.85Å; L443-Q447 HydrophobicContact CD1-CG 4.43Å; L443-Q447 WeakPolarHBondContact O-CB 3.38Å; L443-Q447 WeakPolarHBondContact O-CG 3.25Å; L443-Q447 PolarHBondContact O-N 2.97Å
444E88.3Confident91.7Very high109 Ų10992.1 Ų92.151%0.50950%0.504SS..Hα-helixtrans-61.8-39.1175.4-70.5-177.1-176.700111.9T440 S448T440-E444 HydrophobicContact CG2-CG 4.49Å; T440-E444 PolarHBondContact O-N 2.84Å; E444-S448 VanDerWaalsContact O-CB 3.23Å; E444-S448 WeakPolarHBondContact O-CB 3.33Å; E444-S448 PolarHBondContact O-N 3.35Å; E444-S448 PolarHBondContact O-OG 3.42Å
445S91.6Very high91.7Very high76 Ų7695.4 Ų95.453%0.53151%0.509SS..Hα-helixtrans-64-44.2173.3-178.10000112.1N441 L443 S448 A449N441-S445 WeakPolarHBondContact O-CB 3.43Å; N441-S445 PolarHBondContact O-N 3.44Å; L443-S445 VanDerWaalsContact C-N 3.31Å; L443-S445 PolarHBondContact O-N 2.89Å; S445-S448 PolarHBondContact O-N 2.88Å; S445-A449 WeakPolarHBondContact O-CB 3.19Å; S445-A449 PolarHBondContact O-N 2.96Å
446K91.9Very high91.6Very high114 Ų11498.6 Ų98.650%0.49652%0.515SS..Hα-helixtrans-62-48.7174.2-78.5167.4172.1171.80111.9Q442 L443 S448 A449 E450Q442-K446 HydrophobicContact CG-CD 4.38Å; Q442-K446 WeakPolarHBondContact O-CB 3.38Å; Q442-K446 VanDerWaalsContact O-CG 3.26Å; Q442-K446 WeakPolarHBondContact O-CG 2.77Å; Q442-K446 PolarHBondContact O-N 2.98Å; L443-K446 PolarHBondContact O-N 2.85Å; K446-S448 VanDerWaalsContact C-N 3.31Å; K446-S448 PolarHBondContact O-N 3.01Å; K446-A449 WeakPolarHBondContact O-CB 3.33Å; K446-A449 PolarHBondContact O-N 3.35Å; K446-A449 VanDerWaalsContact O-N 3.15Å; K446-E450 PolarHBondContact O-N 3.25Å
447Q90.5Very high91.5Very high111 Ų11196.8 Ų96.852%0.51950%0.503SS..Hα-helixtrans-59.7-41.4175.9-73.1178.5-3.600111.5L443 A449 E450 L451L443-Q447 HydrophobicContact CD1-CG 4.43Å; L443-Q447 WeakPolarHBondContact O-CB 3.38Å; L443-Q447 WeakPolarHBondContact O-CG 3.25Å; L443-Q447 PolarHBondContact O-N 2.97Å; Q447-A449 PolarHBondContact O-N 3.01Å; Q447-E450 PolarHBondContact O-N 3.5Å; Q447-L451 VanDerWaalsContact O-CB 3.23Å; Q447-L451 WeakPolarHBondContact O-CB 3.38Å; Q447-L451 PolarHBondContact O-N 3.27Å
448S90Very high91.4Very high65 Ų6597.5 Ų97.546%0.45551%0.507SS..Hα-helixtrans-64.1-38.8175.2-630000112.4E444 S445 K446 N452E444-S448 VanDerWaalsContact O-CB 3.23Å; E444-S448 WeakPolarHBondContact O-CB 3.33Å; E444-S448 PolarHBondContact O-N 3.35Å; E444-S448 PolarHBondContact O-OG 3.42Å; S445-S448 PolarHBondContact O-N 2.88Å; K446-S448 VanDerWaalsContact C-N 3.31Å; K446-S448 PolarHBondContact O-N 3.01Å; S448-N452 WeakPolarHBondContact O-CB 3.38Å; S448-N452 VanDerWaalsContact O-CG 3.29Å; S448-N452 PolarHBondContact O-N 2.95Å; S448-N452 PolarHBondContact O-ND2 2.99Å
449A91.8Very high91.4Very high61 Ų6194.2 Ų94.250%0.50450%0.498SS..Hα-helixtrans-67.7-42.1175.200000112.1S445 K446 Q447 N452 K453S445-A449 WeakPolarHBondContact O-CB 3.19Å; S445-A449 PolarHBondContact O-N 2.96Å; K446-A449 WeakPolarHBondContact O-CB 3.33Å; K446-A449 PolarHBondContact O-N 3.35Å; K446-A449 VanDerWaalsContact O-N 3.15Å; Q447-A449 PolarHBondContact O-N 3.01Å; A449-N452 PolarHBondContact O-N 3.48Å; A449-K453 WeakPolarHBondContact O-CB 3.45Å; A449-K453 PolarHBondContact O-N 3.37Å
450E92.1Very high91.4Very high136 Ų13695.1 Ų95.164%0.63649%0.492SS*.Hα-helixtrans-66.4-41175.1-73-173.8168.500112.3K446 Q447 N452 K453 L454K446-E450 PolarHBondContact O-N 3.25Å; Q447-E450 PolarHBondContact O-N 3.5Å; E450-N452 VanDerWaalsContact C-N 3.35Å; E450-N452 PolarHBondContact O-N 3.24Å; E450-K453 WeakPolarHBondContact O-CB 3.46Å; E450-K453 PolarHBondContact O-N 2.63Å; E450-L454 WeakPolarHBondContact O-CB 3.28Å; E450-L454 PolarHBondContact O-N 3.01Å
451L92.7Very high91.4Very high87 Ų8797 Ų9746%0.45550%0.499SS..Hα-helixtrans-63.9-41.1175.9-160.7166.1000110.7Q447 L454 R455Q447-L451 VanDerWaalsContact O-CB 3.23Å; Q447-L451 WeakPolarHBondContact O-CB 3.38Å; Q447-L451 PolarHBondContact O-N 3.27Å; L451-L454 PolarHBondContact O-N 2.9Å; L451-R455 HydrophobicContact CD2-CG 4.21Å; L451-R455 WeakPolarHBondContact O-CG 3.46Å; L451-R455 PolarHBondContact O-N 3.27Å
452N90.8Very high91.5Very high93 Ų9397 Ų9750%0.49750%0.501SS..Hα-helixtrans-67.3-37.8172.9-76.3-36.8000112.8S448 A449 E450 R455 Q456S448-N452 WeakPolarHBondContact O-CB 3.38Å; S448-N452 VanDerWaalsContact O-CG 3.29Å; S448-N452 PolarHBondContact O-N 2.95Å; S448-N452 PolarHBondContact O-ND2 2.99Å; A449-N452 PolarHBondContact O-N 3.48Å; E450-N452 VanDerWaalsContact C-N 3.35Å; E450-N452 PolarHBondContact O-N 3.24Å; N452-R455 PolarHBondContact O-N 3.41Å; N452-Q456 PolarHBondContact O-N 2.88Å
453K93.8Very high91.5Very high129 Ų12995.1 Ų95.156%0.56150%0.501SS*.Hα-helixtrans-62.7-45.7172.5-177.3-174.2173.3-170.70111.1A449 E450 R455 Q456 D457A449-K453 WeakPolarHBondContact O-CB 3.45Å; A449-K453 PolarHBondContact O-N 3.37Å; E450-K453 WeakPolarHBondContact O-CB 3.46Å; E450-K453 PolarHBondContact O-N 2.63Å; K453-R455 VanDerWaalsContact C-N 3.35Å; K453-R455 PolarHBondContact O-N 3.45Å; K453-Q456 CarbonylContact O-C 3.6Å; K453-Q456 WeakPolarHBondContact O-CA 3.22Å; K453-Q456 VanDerWaalsContact O-CB 3.3Å; K453-Q456 WeakPolarHBondContact O-CB 3.35Å; K453-Q456 PolarHBondContact O-N 2.79Å; K453-D457 PolarHBondContact O-N 2.86Å
454L92.6Very high91.5Very high115 Ų11594.9 Ų94.960%0.60250%0.497SS*.Hα-helixtrans-62.5-41177.7-167.770.7000111.4E450 L451 Q456 D457 C458E450-L454 WeakPolarHBondContact O-CB 3.28Å; E450-L454 PolarHBondContact O-N 3.01Å; L451-L454 PolarHBondContact O-N 2.9Å; L454-Q456 VanDerWaalsContact C-N 3.31Å; L454-Q456 PolarHBondContact O-N 3.37Å; L454-D457 PolarHBondContact O-N 3.34Å; L454-C458 PolarHBondContact O-N 3.37Å; L454-C458 PolarHBondContact O-SG 2.79Å
455R92.7Very high91.6Very high171 Ų17194.7 Ų94.765%0.64550%0.499SS*.Hα-helixtrans-59.3-40.2170.1-74.7173.4176.2-176.51.8112.2L451 N452 K453 G459L451-R455 HydrophobicContact CD2-CG 4.21Å; L451-R455 WeakPolarHBondContact O-CG 3.46Å; L451-R455 PolarHBondContact O-N 3.27Å; N452-R455 PolarHBondContact O-N 3.41Å; K453-R455 VanDerWaalsContact C-N 3.35Å; K453-R455 PolarHBondContact O-N 3.45Å; R455-G459 PolarHBondContact O-N 2.87Å
456Q92.1Very high91.4Very high114 Ų11496.1 Ų96.153%0.53350%0.501SS..Hα-helixtrans-67.7-38175.9-161.3-169.349.900112.2N452 K453 L454 G459 R460N452-Q456 PolarHBondContact O-N 2.88Å; K453-Q456 CarbonylContact O-C 3.6Å; K453-Q456 WeakPolarHBondContact O-CA 3.22Å; K453-Q456 VanDerWaalsContact O-CB 3.3Å; K453-Q456 WeakPolarHBondContact O-CB 3.35Å; K453-Q456 PolarHBondContact O-N 2.79Å; L454-Q456 VanDerWaalsContact C-N 3.31Å; L454-Q456 PolarHBondContact O-N 3.37Å; Q456-G459 PolarHBondContact O-N 3.08Å; Q456-R460 PolarHBondContact O-N 3.1Å; Q456-R460 VanDerWaalsContact OE1-CZ 3.28Å
457D90.9Very high91.4Very high52 Ų5296.1 Ų96.128%0.27850%0.502SS..Hα-helixtrans-69.2-39.6175-76.2-44.1000112.2K453 L454 G459 R460 L461K453-D457 PolarHBondContact O-N 2.86Å; L454-D457 PolarHBondContact O-N 3.34Å; D457-G459 VanDerWaalsContact C-N 3.3Å; D457-G459 PolarHBondContact O-N 2.9Å; D457-R460 VanDerWaalsContact CG-NH2 3.32Å; D457-R460 PolarHBondContact O-N 3.05Å; D457-R460 IonicContact OD1-CZ 2.78Å; D457-R460 IonicContact OD1-NE 3.73Å; D457-R460 PolarHBondContact OD1-NE 3.31Å; D457-R460 IonicContact OD1-NH2 2.76Å; D457-R460 PolarHBondContact OD1-NH2 3.02Å; D457-R460 IonicContact OD2-NH2 3.15Å; D457-L461 WeakPolarHBondContact O-CB 3.45Å; D457-L461 VanDerWaalsContact O-CG 3.32Å; D457-L461 WeakPolarHBondContact O-CG 3.12Å; D457-L461 PolarHBondContact O-N 2.96Å
458C89.8Confident91.4Very high72 Ų7296.4 Ų96.449%0.48650%0.502SS..Hα-helixtrans-58.7-42.8167.7-67.60000111.4L454 L461 V462L454-C458 PolarHBondContact O-N 3.37Å; L454-C458 PolarHBondContact O-SG 2.79Å; C458-L461 PolarHBondContact O-N 2.82Å; C458-V462 WeakPolarHBondContact O-CB 3.34Å; C458-V462 VanDerWaalsContact O-CG2 3.3Å; C458-V462 WeakPolarHBondContact O-CG2 3.27Å; C458-V462 PolarHBondContact O-N 2.69Å
459G92.9Very high91.3Very high37 Ų3797.2 Ų97.238%0.38150%0.504SS..Hα-helixtrans-59.5-47.317400000112.9R455 Q456 D457 V462 S463R455-G459 PolarHBondContact O-N 2.87Å; Q456-G459 PolarHBondContact O-N 3.08Å; D457-G459 VanDerWaalsContact C-N 3.3Å; D457-G459 PolarHBondContact O-N 2.9Å; G459-V462 PolarHBondContact O-N 2.81Å; G459-S463 PolarHBondContact O-N 3.41Å; G459-S463 PolarHBondContact O-OG 3.49Å; G459-S463 VanDerWaalsContact O-OG 3.11Å
460R91.9Very high91.2Very high106 Ų10696 Ų9640%0.450%0.497SS..Hα-helixtrans-57.3-50.4174-80.3-173.8-87.4-89.7-1.8111.8Q456 D457 V462 S463 E464Q456-R460 PolarHBondContact O-N 3.1Å; Q456-R460 VanDerWaalsContact OE1-CZ 3.28Å; D457-R460 VanDerWaalsContact CG-NH2 3.32Å; D457-R460 PolarHBondContact O-N 3.05Å; D457-R460 IonicContact OD1-CZ 2.78Å; D457-R460 IonicContact OD1-NE 3.73Å; D457-R460 PolarHBondContact OD1-NE 3.31Å; D457-R460 IonicContact OD1-NH2 2.76Å; D457-R460 PolarHBondContact OD1-NH2 3.02Å; D457-R460 IonicContact OD2-NH2 3.15Å; R460-V462 PolarHBondContact O-N 3.21Å; R460-S463 WeakPolarHBondContact O-CB 3.27Å; R460-S463 PolarHBondContact O-N 3.49Å; R460-S463 VanDerWaalsContact O-N 3.15Å; R460-E464 PolarHBondContact O-N 3.34Å
461L91.6Very high91.1Very high100 Ų10094.5 Ų94.552%0.52449%0.489SS..Hα-helixtrans-64.4-37.7-178.3-71.2169.9000112.3D457 C458 E464 L465D457-L461 WeakPolarHBondContact O-CB 3.45Å; D457-L461 VanDerWaalsContact O-CG 3.32Å; D457-L461 WeakPolarHBondContact O-CG 3.12Å; D457-L461 PolarHBondContact O-N 2.96Å; C458-L461 PolarHBondContact O-N 2.82Å; L461-E464 PolarHBondContact O-N 3.02Å; L461-L465 WeakPolarHBondContact O-CB 3.06Å; L461-L465 VanDerWaalsContact O-CG 3.25Å; L461-L465 WeakPolarHBondContact O-CG 3.32Å; L461-L465 PolarHBondContact O-N 3.3Å
462V92.1Very high90.7Very high84 Ų8496.1 Ų96.151%0.50950%0.497SS..Hα-helixtrans-64.6-42172.3168.50000111.2C458 G459 R460 L465 N466C458-V462 WeakPolarHBondContact O-CB 3.34Å; C458-V462 VanDerWaalsContact O-CG2 3.3Å; C458-V462 WeakPolarHBondContact O-CG2 3.27Å; C458-V462 PolarHBondContact O-N 2.69Å; G459-V462 PolarHBondContact O-N 2.81Å; R460-V462 PolarHBondContact O-N 3.21Å; V462-L465 PolarHBondContact O-N 3.32Å; V462-N466 WeakPolarHBondContact O-CB 3.46Å; V462-N466 VanDerWaalsContact O-CG 3.27Å; V462-N466 PolarHBondContact O-N 3.43Å; V462-N466 PolarHBondContact O-ND2 3.35Å
463S90.3Very high90.3Very high71 Ų7198.6 Ų98.650%0.49751%0.506SS..Hα-helixtrans-62.8-44.4174.1-62.70000112.4G459 R460 L465 N466 E467G459-S463 PolarHBondContact O-N 3.41Å; G459-S463 PolarHBondContact O-OG 3.49Å; G459-S463 VanDerWaalsContact O-OG 3.11Å; R460-S463 WeakPolarHBondContact O-CB 3.27Å; R460-S463 PolarHBondContact O-N 3.49Å; R460-S463 VanDerWaalsContact O-N 3.15Å; S463-L465 PolarHBondContact O-N 2.86Å; S463-N466 PolarHBondContact O-N 3.33Å; S463-E467 PolarHBondContact O-N 3.32Å
464E92Very high89.9Confident89 Ų8998.2 Ų98.242%0.41651%0.506SS..Hα-helixtrans-62.8-39.6174.9-81.8-167.1-136.100113R460 L461 E467 K468R460-E464 PolarHBondContact O-N 3.34Å; L461-E464 PolarHBondContact O-N 3.02Å; E464-E467 PolarHBondContact O-N 2.97Å; E464-K468 VanDerWaalsContact O-CB 3.31Å; E464-K468 WeakPolarHBondContact O-CB 3.46Å; E464-K468 WeakPolarHBondContact O-CD 3.19Å; E464-K468 VanDerWaalsContact O-CG 3.29Å; E464-K468 WeakPolarHBondContact O-CG 3.43Å; E464-K468 PolarHBondContact O-N 3.45Å; E464-K468 IonicContact OE2-NZ 2.65Å; E464-K468 PolarHBondContact OE2-NZ 2.87Å
465L89.4Confident89.4Confident106 Ų10698.6 Ų98.656%0.55551%0.505SS*.Hα-helixtrans-66.6-39.8176.1-76.7169.1000111.3L461 V462 S463 K468 T469L461-L465 WeakPolarHBondContact O-CB 3.06Å; L461-L465 VanDerWaalsContact O-CG 3.25Å; L461-L465 WeakPolarHBondContact O-CG 3.32Å; L461-L465 PolarHBondContact O-N 3.3Å; V462-L465 PolarHBondContact O-N 3.32Å; S463-L465 PolarHBondContact O-N 2.86Å; L465-K468 PolarHBondContact O-N 3.36Å; L465-T469 VanDerWaalsContact O-CB 3.29Å; L465-T469 WeakPolarHBondContact O-CB 3.35Å; L465-T469 PolarHBondContact O-N 2.83Å; L465-T469 PolarHBondContact O-OG1 3.19Å
466N88.1Confident88.9Confident106 Ų10692 Ų9257%0.56749%0.491SS*.Hα-helixtrans-65-43.2173.6-72.5-25.9000111.5V462 S463 T469 G470V462-N466 WeakPolarHBondContact O-CB 3.46Å; V462-N466 VanDerWaalsContact O-CG 3.27Å; V462-N466 PolarHBondContact O-N 3.43Å; V462-N466 PolarHBondContact O-ND2 3.35Å; S463-N466 PolarHBondContact O-N 3.33Å; N466-T469 PolarHBondContact O-N 3.12Å; N466-G470 PolarHBondContact O-N 2.98Å
467E91.4Very high88.6Confident114 Ų11490.5 Ų90.553%0.53349%0.489SS..Hα-helixtrans-61-47173.1-87.7-161.8-148.600112.6S463 E464 T469 G470 K471S463-E467 PolarHBondContact O-N 3.32Å; E464-E467 PolarHBondContact O-N 2.97Å; E467-T469 VanDerWaalsContact C-N 3.3Å; E467-T469 PolarHBondContact O-N 2.9Å; E467-G470 PolarHBondContact O-N 2.82Å; E467-K471 WeakPolarHBondContact O-CB 3.34Å; E467-K471 WeakPolarHBondContact O-CD 3.46Å; E467-K471 VanDerWaalsContact O-CG 3.3Å; E467-K471 WeakPolarHBondContact O-CG 3.45Å; E467-K471 PolarHBondContact O-N 3.23Å; E467-K471 IonicContact OE2-NZ 2.7Å; E467-K471 PolarHBondContact OE2-NZ 3.31Å
468K89.8Confident88.2Confident117 Ų11793.9 Ų93.951%0.50950%0.503SS..Hα-helixtrans-63.5-37.1177.8-76.6162.9178.7154.40111.1E464 L465 K471 L472E464-K468 VanDerWaalsContact O-CB 3.31Å; E464-K468 WeakPolarHBondContact O-CB 3.46Å; E464-K468 WeakPolarHBondContact O-CD 3.19Å; E464-K468 VanDerWaalsContact O-CG 3.29Å; E464-K468 WeakPolarHBondContact O-CG 3.43Å; E464-K468 PolarHBondContact O-N 3.45Å; E464-K468 IonicContact OE2-NZ 2.65Å; E464-K468 PolarHBondContact OE2-NZ 2.87Å; L465-K468 PolarHBondContact O-N 3.36Å; K468-K471 PolarHBondContact O-N 2.87Å; K468-L472 VanDerWaalsContact O-CB 3.28Å; K468-L472 WeakPolarHBondContact O-CB 3.38Å; K468-L472 PolarHBondContact O-N 3.48Å
469T89.4Confident88.1Confident82 Ų8296.7 Ų96.750%0.50351%0.507SS..Hα-helixtrans-64.3-45.6173.7-580000111.2L465 N466 E467 L472 Q473L465-T469 VanDerWaalsContact O-CB 3.29Å; L465-T469 WeakPolarHBondContact O-CB 3.35Å; L465-T469 PolarHBondContact O-N 2.83Å; L465-T469 PolarHBondContact O-OG1 3.19Å; N466-T469 PolarHBondContact O-N 3.12Å; E467-T469 VanDerWaalsContact C-N 3.3Å; E467-T469 PolarHBondContact O-N 2.9Å; T469-L472 PolarHBondContact O-N 3.28Å; T469-Q473 WeakPolarHBondContact O-CB 3.28Å; T469-Q473 PolarHBondContact O-N 3.43Å
470G89.4Confident87.7Confident35 Ų35101.5 Ų101.536%0.36152%0.517SS..Hα-helixtrans-62.8-42.317500000113.2N466 E467 Q473 Q474N466-G470 PolarHBondContact O-N 2.98Å; E467-G470 PolarHBondContact O-N 2.82Å; G470-Q473 PolarHBondContact O-N 3.24Å; G470-Q474 WeakPolarHBondContact O-CB 3.37Å; G470-Q474 PolarHBondContact O-N 3.06Å
471K89.1Confident87.4Confident105 Ų105100.9 Ų100.946%0.45752%0.522SS..Hα-helixtrans-63.7-44.8175.5-73.8161.4178.4165.50111.6E467 K468 Q473 Q474 E475E467-K471 WeakPolarHBondContact O-CB 3.34Å; E467-K471 WeakPolarHBondContact O-CD 3.46Å; E467-K471 VanDerWaalsContact O-CG 3.3Å; E467-K471 WeakPolarHBondContact O-CG 3.45Å; E467-K471 PolarHBondContact O-N 3.23Å; E467-K471 IonicContact OE2-NZ 2.7Å; E467-K471 PolarHBondContact OE2-NZ 3.31Å; K468-K471 PolarHBondContact O-N 2.87Å; K471-Q473 VanDerWaalsContact C-N 3.31Å; K471-Q473 PolarHBondContact O-N 3.16Å; K471-Q474 WeakPolarHBondContact O-CB 3.38Å; K471-Q474 PolarHBondContact O-N 3.07Å; K471-Q474 VanDerWaalsContact O-N 3.17Å; K471-E475 WeakPolarHBondContact O-CG 3.5Å; K471-E475 PolarHBondContact O-N 2.88Å
472L84.1Confident87Confident121 Ų12199 Ų9963%0.63452%0.521SS*.Hα-helixtrans-61-39.2173.9-169.580.4000111.9K468 T469 E475 G476K468-L472 VanDerWaalsContact O-CB 3.28Å; K468-L472 WeakPolarHBondContact O-CB 3.38Å; K468-L472 PolarHBondContact O-N 3.48Å; T469-L472 PolarHBondContact O-N 3.28Å; L472-E475 PolarHBondContact O-N 3.44Å; L472-G476 PolarHBondContact O-N 3.07Å
473Q82.1Confident86.7Confident144 Ų14499.6 Ų99.667%0.67352%0.518SS*.Hα-helixtrans-67.6-37.4175.8-168.3172.75.300111.7T469 G470 K471 G476 V477T469-Q473 WeakPolarHBondContact O-CB 3.28Å; T469-Q473 PolarHBondContact O-N 3.43Å; G470-Q473 PolarHBondContact O-N 3.24Å; K471-Q473 VanDerWaalsContact C-N 3.31Å; K471-Q473 PolarHBondContact O-N 3.16Å; Q473-G476 PolarHBondContact O-N 3.09Å; Q473-V477 PolarHBondContact O-N 2.79Å; Q473-V477 VanDerWaalsContact O-N 3.09Å
474Q85.3Confident86.4Confident121 Ų121102.3 Ų102.357%0.56552%0.523SS*.Hα-helixtrans-66.5-43.8173.4-171.5178.614.200112.1G470 K471 G476 V477 Q478G470-Q474 WeakPolarHBondContact O-CB 3.37Å; G470-Q474 PolarHBondContact O-N 3.06Å; K471-Q474 WeakPolarHBondContact O-CB 3.38Å; K471-Q474 PolarHBondContact O-N 3.07Å; K471-Q474 VanDerWaalsContact O-N 3.17Å; Q474-G476 VanDerWaalsContact C-N 3.3Å; Q474-G476 PolarHBondContact O-N 2.98Å; Q474-V477 PolarHBondContact O-N 3.23Å; Q474-V477 VanDerWaalsContact O-N 3.17Å; Q474-Q478 PolarHBondContact O-N 2.88Å
475E82.4Confident86.2Confident123 Ų123100.4 Ų100.458%0.57552%0.522SS*.Hα-helixtrans-60.8-39.2171.6-74178.6179.400111.5K471 L472 V477 Q478 K479K471-E475 WeakPolarHBondContact O-CG 3.5Å; K471-E475 PolarHBondContact O-N 2.88Å; L472-E475 PolarHBondContact O-N 3.44Å; E475-V477 VanDerWaalsContact C-N 3.3Å; E475-V477 PolarHBondContact O-N 2.98Å; E475-Q478 PolarHBondContact O-N 3.29Å; E475-K479 WeakPolarHBondContact O-CB 3.44Å; E475-K479 PolarHBondContact O-N 2.93Å
476G82.4Confident85.9Confident34 Ų3498 Ų9835%0.35152%0.518SS..Hα-helixtrans-61.4-33.8173.400000113.7L472 Q473 Q474 K480L472-G476 PolarHBondContact O-N 3.07Å; Q473-G476 PolarHBondContact O-N 3.09Å; Q474-G476 VanDerWaalsContact C-N 3.3Å; Q474-G476 PolarHBondContact O-N 2.98Å; G476-K480 WeakPolarHBondContact O-CG 3.45Å; G476-K480 PolarHBondContact O-N 2.97Å
477V86.8Confident85.8Confident82 Ų8297.3 Ų97.350%0.49752%0.517SS..Hα-helixtrans-73.8-45.6171.8172.90000111Q473 Q474 E475 K479 K480 N481Q473-V477 PolarHBondContact O-N 2.79Å; Q473-V477 VanDerWaalsContact O-N 3.09Å; Q474-V477 PolarHBondContact O-N 3.23Å; Q474-V477 VanDerWaalsContact O-N 3.17Å; E475-V477 VanDerWaalsContact C-N 3.3Å; E475-V477 PolarHBondContact O-N 2.98Å; V477-K479 VanDerWaalsContact C-N 3.3Å; V477-K479 PolarHBondContact O-N 3.33Å; V477-K480 PolarHBondContact O-N 3.24Å; V477-N481 VanDerWaalsContact O-CG 3.32Å; V477-N481 PolarHBondContact O-N 2.95Å; V477-N481 PolarHBondContact O-OD1 2.95Å
478Q82.3Confident85.5Confident123 Ų12398.3 Ų98.358%0.57552%0.522SS*.Hα-helixtrans-60.8-39.5176.8-71.7-170.43.200112.2Q474 E475 N481 A482Q474-Q478 PolarHBondContact O-N 2.88Å; E475-Q478 PolarHBondContact O-N 3.29Å; Q478-N481 PolarHBondContact O-N 3.18Å; Q478-A482 WeakPolarHBondContact O-CB 3.09Å; Q478-A482 PolarHBondContact O-N 2.64Å
479K86.4Confident85.4Confident131 Ų13198 Ų9857%0.5753%0.525SS*.Hα-helixtrans-60.2-46.4174.5179.8175.7169179.60111.6E475 V477 N481 A482 E483E475-K479 WeakPolarHBondContact O-CB 3.44Å; E475-K479 PolarHBondContact O-N 2.93Å; V477-K479 VanDerWaalsContact C-N 3.3Å; V477-K479 PolarHBondContact O-N 3.33Å; K479-N481 VanDerWaalsContact C-N 3.32Å; K479-N481 PolarHBondContact O-N 3.2Å; K479-A482 PolarHBondContact O-N 2.94Å; K479-E483 WeakPolarHBondContact CE-OE1 3.4Å; K479-E483 HydrophobicContact CG-CG 4.41Å; K479-E483 IonicContact NZ-OE1 2.85Å; K479-E483 WeakPolarHBondContact O-CB 3.45Å; K479-E483 WeakPolarHBondContact O-CG 3.49Å; K479-E483 PolarHBondContact O-N 3.47Å
480K86.3Confident85.3Confident138 Ų138101 Ų10160%0.653%0.532SS*.Hα-helixtrans-60.2-40.9175.5-75.8177.8177.8-177.90112.2G476 V477 E483 Q484G476-K480 WeakPolarHBondContact O-CG 3.45Å; G476-K480 PolarHBondContact O-N 2.97Å; V477-K480 PolarHBondContact O-N 3.24Å; K480-E483 PolarHBondContact O-N 3.12Å; K480-Q484 WeakPolarHBondContact O-CG 3.38Å; K480-Q484 PolarHBondContact O-N 2.92Å
481N85.7Confident85.4Confident92 Ų92103.5 Ų103.549%0.49254%0.54SS..Hα-helixtrans-66.1-39.1176.8-63.8-3.3000111.5V477 Q478 K479 Q484 A485V477-N481 VanDerWaalsContact O-CG 3.32Å; V477-N481 PolarHBondContact O-N 2.95Å; V477-N481 PolarHBondContact O-OD1 2.95Å; Q478-N481 PolarHBondContact O-N 3.18Å; K479-N481 VanDerWaalsContact C-N 3.32Å; K479-N481 PolarHBondContact O-N 3.2Å; N481-Q484 PolarHBondContact O-N 2.86Å; N481-A485 PolarHBondContact O-N 3.29Å
482A81.8Confident85.1Confident60 Ų60103.9 Ų103.950%0.49654%0.543SS..Hα-helixtrans-68.4-37.9174.900000112.5Q478 K479 A485 A486Q478-A482 WeakPolarHBondContact O-CB 3.09Å; Q478-A482 PolarHBondContact O-N 2.64Å; K479-A482 PolarHBondContact O-N 2.94Å; A482-A485 PolarHBondContact O-N 2.85Å; A482-A486 WeakPolarHBondContact O-CB 3.41Å; A482-A486 PolarHBondContact O-N 3.5Å
483E85.9Confident85.2Confident98 Ų98103 Ų10346%0.45854%0.539SS..Hα-helixtrans-64.1-40.4173.2-74.7172.1162.700111.5K479 K480 A486 T487K479-E483 WeakPolarHBondContact CE-OE1 3.4Å; K479-E483 HydrophobicContact CG-CG 4.41Å; K479-E483 IonicContact NZ-OE1 2.85Å; K479-E483 WeakPolarHBondContact O-CB 3.45Å; K479-E483 WeakPolarHBondContact O-CG 3.49Å; K479-E483 PolarHBondContact O-N 3.47Å; K480-E483 PolarHBondContact O-N 3.12Å; E483-A486 PolarHBondContact O-N 3.36Å; E483-T487 PolarHBondContact O-N 3.31Å; E483-T487 PolarHBondContact O-OG1 3.08Å
484Q84.1Confident85.4Confident128 Ų128102 Ų10260%0.59853%0.534SS*.Hα-helixtrans-65.1-42.2172.7-73.5176-6.700112.7K480 N481 A486 T487 Q488K480-Q484 WeakPolarHBondContact O-CG 3.38Å; K480-Q484 PolarHBondContact O-N 2.92Å; N481-Q484 PolarHBondContact O-N 2.86Å; Q484-A486 VanDerWaalsContact C-N 3.31Å; Q484-A486 PolarHBondContact O-N 2.91Å; Q484-T487 PolarHBondContact O-N 3.45Å; Q484-T487 PolarHBondContact O-OG1 3.19Å; Q484-Q488 PolarHBondContact O-N 3.37Å
485A87.5Confident85.3Confident48 Ų48100 Ų10040%0.39752%0.524SS..Hα-helixtrans-63.3-38.5173.800000111.8N481 A482 Q488 L489N481-A485 PolarHBondContact O-N 3.29Å; A482-A485 PolarHBondContact O-N 2.85Å; A485-Q488 PolarHBondContact O-N 3.13Å; A485-L489 WeakPolarHBondContact O-CG 3.14Å; A485-L489 PolarHBondContact O-N 3.41Å
486A82.8Confident85.4Confident57 Ų5796.8 Ų96.847%0.47152%0.519SS..Hα-helixtrans-67.5-38.7177.300000112.9A482 E483 Q484 K490A482-A486 WeakPolarHBondContact O-CB 3.41Å; A482-A486 PolarHBondContact O-N 3.5Å; E483-A486 PolarHBondContact O-N 3.36Å; Q484-A486 VanDerWaalsContact C-N 3.31Å; Q484-A486 PolarHBondContact O-N 2.91Å; A486-K490 WeakPolarHBondContact O-CB 3.43Å; A486-K490 PolarHBondContact O-N 3.35Å
487T86.5Confident85.4Confident90 Ų90100 Ų10055%0.55253%0.525SS*.Hα-helixtrans-68.1-37.4173.555.70000111.8E483 Q484 K490 V491E483-T487 PolarHBondContact O-N 3.31Å; E483-T487 PolarHBondContact O-OG1 3.08Å; Q484-T487 PolarHBondContact O-N 3.45Å; Q484-T487 PolarHBondContact O-OG1 3.19Å; T487-K490 WeakPolarHBondContact O-CB 3.31Å; T487-K490 PolarHBondContact O-N 2.93Å; T487-V491 PolarHBondContact O-N 3.14Å; T487-V491 VanDerWaalsContact O-N 3.08Å
488Q86.5Confident85.4Confident135 Ų135101 Ų10163%0.63152%0.519SS*.Hα-helixtrans-64.5-42.6175-167.2173.318.800112.4Q484 A485 K490 V491 Q492Q484-Q488 PolarHBondContact O-N 3.37Å; A485-Q488 PolarHBondContact O-N 3.13Å; Q488-K490 VanDerWaalsContact C-N 3.33Å; Q488-K490 PolarHBondContact O-N 3.04Å; Q488-V491 PolarHBondContact O-N 3.32Å; Q488-Q492 PolarHBondContact O-N 2.99Å; Q488-Q492 VanDerWaalsContact O-N 3.14Å
489L87.5Confident85.7Confident111 Ų111102 Ų10258%0.58152%0.518SS*.Hα-helixtrans-64-35.8173-74171.3000112.3A485 Q492 L493A485-L489 WeakPolarHBondContact O-CG 3.14Å; A485-L489 PolarHBondContact O-N 3.41Å; L489-Q492 PolarHBondContact O-N 2.89Å; L489-L493 PolarHBondContact O-N 3.37Å
490K87.4Confident85.5Confident146 Ų146103.2 Ų103.264%0.63552%0.519SS*.Hα-helixtrans-63.7-39.1175.1-172.6175.7179.5179.60112.2A486 T487 Q488 L493 Q494A486-K490 WeakPolarHBondContact O-CB 3.43Å; A486-K490 PolarHBondContact O-N 3.35Å; T487-K490 WeakPolarHBondContact O-CB 3.31Å; T487-K490 PolarHBondContact O-N 2.93Å; Q488-K490 VanDerWaalsContact C-N 3.33Å; Q488-K490 PolarHBondContact O-N 3.04Å; K490-L493 PolarHBondContact O-N 3.27Å; K490-Q494 PolarHBondContact O-N 2.88Å
491V90.2Very high85.5Confident87 Ų87103.1 Ų103.153%0.52752%0.521SS..Hα-helixtrans-63.7-43.8173.41740000110.9T487 Q488 L493 Q494 E495T487-V491 PolarHBondContact O-N 3.14Å; T487-V491 VanDerWaalsContact O-N 3.08Å; Q488-V491 PolarHBondContact O-N 3.32Å; V491-L493 VanDerWaalsContact C-N 3.34Å; V491-L493 PolarHBondContact O-N 3.44Å; V491-Q494 PolarHBondContact O-N 3.24Å; V491-E495 PolarHBondContact O-N 2.89Å
492Q84.4Confident85.7Confident113 Ų113103.5 Ų103.553%0.52852%0.52SS..Hα-helixtrans-62.9-37.7176.3-71.3-174.3-8.400113Q488 L489 E495 A496Q488-Q492 PolarHBondContact O-N 2.99Å; Q488-Q492 VanDerWaalsContact O-N 3.14Å; L489-Q492 PolarHBondContact O-N 2.89Å; Q492-E495 PolarHBondContact O-N 2.79Å; Q492-A496 WeakPolarHBondContact O-CB 3.36Å; Q492-A496 PolarHBondContact O-N 3.5Å
493L85.3Confident86Confident103 Ų103103.8 Ų103.854%0.53952%0.515SS..Hα-helixtrans-61-47.6173.5-16879.2000110.6L489 K490 V491 E495 A496 E497L489-L493 PolarHBondContact O-N 3.37Å; K490-L493 PolarHBondContact O-N 3.27Å; V491-L493 VanDerWaalsContact C-N 3.34Å; V491-L493 PolarHBondContact O-N 3.44Å; L493-E495 VanDerWaalsContact C-N 3.32Å; L493-E495 PolarHBondContact O-N 3.39Å; L493-A496 CarbonylContact O-C 3.57Å; L493-A496 WeakPolarHBondContact O-CA 3.48Å; L493-A496 WeakPolarHBondContact O-CB 3.47Å; L493-A496 PolarHBondContact O-N 3.49Å; L493-E497 WeakPolarHBondContact O-CG 3.46Å; L493-E497 PolarHBondContact O-N 2.88Å
494Q85.4Confident85.7Confident123 Ų123101.5 Ų101.558%0.57550%0.504SS*.Hα-helixtrans-66.9-31.9-178.4-157.1171.18.500112.5K490 V491 R498K490-Q494 PolarHBondContact O-N 2.88Å; V491-Q494 PolarHBondContact O-N 3.24Å; Q494-R498 PolarHBondContact O-N 3.31Å
495E84.4Confident85.9Confident78 Ų7898.9 Ų98.936%0.36450%0.5SS..Hα-helixtrans-68.6-37.5168.3-74-146.2100.800113.2V491 Q492 L493 R498 R499V491-E495 PolarHBondContact O-N 2.89Å; Q492-E495 PolarHBondContact O-N 2.79Å; L493-E495 VanDerWaalsContact C-N 3.32Å; L493-E495 PolarHBondContact O-N 3.39Å; E495-R498 IonicContact OE1-NH2 3.48Å; E495-R498 PolarHBondContact OE1-NH2 3.04Å; E495-R498 VanDerWaalsContact OE1-NH2 3.13Å; E495-R499 VanDerWaalsContact O-CG 3.28Å; E495-R499 WeakPolarHBondContact O-CG 3.4Å; E495-R499 PolarHBondContact O-N 3.21Å
496A83Confident86Confident56 Ų56103.2 Ų103.246%0.46351%0.507SS..Hα-helixtrans-69-38.6176.400000111.7Q492 L493 R499 W500Q492-A496 WeakPolarHBondContact O-CB 3.36Å; Q492-A496 PolarHBondContact O-N 3.5Å; L493-A496 CarbonylContact O-C 3.57Å; L493-A496 WeakPolarHBondContact O-CA 3.48Å; L493-A496 WeakPolarHBondContact O-CB 3.47Å; L493-A496 PolarHBondContact O-N 3.49Å; A496-R499 PolarHBondContact O-N 3.03Å; A496-W500 WeakPolarHBondContact O-CB 3.46Å; A496-W500 PolarHBondContact O-N 2.85Å
497E82.9Confident86.1Confident102 Ų102104.1 Ų104.148%0.47750%0.504SS..Hα-helixtrans-60.1-51172-72.3170.5158.300110.8L493 R499 W500 E501L493-E497 WeakPolarHBondContact O-CG 3.46Å; L493-E497 PolarHBondContact O-N 2.88Å; E497-R499 PolarHBondContact O-N 3.46Å; E497-W500 WeakPolarHBondContact O-CA 3.41Å; E497-W500 WeakPolarHBondContact O-CB 3.44Å; E497-W500 PolarHBondContact O-N 3.01Å; E497-E501 PolarHBondContact O-N 3.31Å
498R86.8Confident86.1Confident101 Ų101107.3 Ų107.338%0.38151%0.505SS..Hα-helixtrans-56.1-45.6174.6179.1-178.858.877.2-3.5112.5Q494 E495 W500 E501 E502Q494-R498 PolarHBondContact O-N 3.31Å; E495-R498 IonicContact OE1-NH2 3.48Å; E495-R498 PolarHBondContact OE1-NH2 3.04Å; E495-R498 VanDerWaalsContact OE1-NH2 3.13Å; R498-W500 VanDerWaalsContact C-N 3.29Å; R498-W500 PolarHBondContact O-N 3.2Å; R498-E501 PolarHBondContact O-N 3.47Å; R498-E502 WeakPolarHBondContact CG-OE1 3.4Å; R498-E502 IonicContact CZ-OE1 2.73Å; R498-E502 IonicContact NH1-OE1 3.68Å; R498-E502 PolarHBondContact NH1-OE1 3.29Å; R498-E502 IonicContact NH1-OE2 3.36Å; R498-E502 PolarHBondContact NH1-OE2 3.4Å; R498-E502 WeakPolarHBondContact O-CG 3.45Å; R498-E502 PolarHBondContact O-N 2.9Å
499R88.1Confident86.2Confident145 Ų145107.3 Ų107.355%0.54750%0.503SS..Hα-helixtrans-63.8-34.5176.7-72.2175-166-163.26.6112.2E495 A496 E497 V503E495-R499 VanDerWaalsContact O-CG 3.28Å; E495-R499 WeakPolarHBondContact O-CG 3.4Å; E495-R499 PolarHBondContact O-N 3.21Å; A496-R499 PolarHBondContact O-N 3.03Å; E497-R499 PolarHBondContact O-N 3.46Å; R499-V503 WeakPolarHBondContact O-CG2 3.35Å; R499-V503 PolarHBondContact O-N 2.67Å
500W82.6Confident86Confident157 Ų157108.3 Ų108.360%0.59550%0.499SS*.Hα-helixtrans-69.3-38.8174.2179.5-111.9000112A496 E497 R498 V503 Q504A496-W500 WeakPolarHBondContact O-CB 3.46Å; A496-W500 PolarHBondContact O-N 2.85Å; E497-W500 WeakPolarHBondContact O-CA 3.41Å; E497-W500 WeakPolarHBondContact O-CB 3.44Å; E497-W500 PolarHBondContact O-N 3.01Å; R498-W500 VanDerWaalsContact C-N 3.29Å; R498-W500 PolarHBondContact O-N 3.2Å; W500-V503 HydrophobicContact CE3-CG1 4.49Å; W500-V503 HydrophobicContact CZ3-CG1 4.47Å; W500-V503 PolarHBondContact O-N 2.78Å; W500-Q504 HydrophobicContact CD2-CG 4.26Å; W500-Q504 HydrophobicContact CG-CG 4.49Å; W500-Q504 HydrophobicContact CZ2-CG 4.19Å; W500-Q504 WeakPolarHBondContact O-CB 3.39Å; W500-Q504 VanDerWaalsContact O-CG 3.26Å; W500-Q504 WeakPolarHBondContact O-CG 3.44Å; W500-Q504 PolarHBondContact O-N 3.03Å
501E87.2Confident85.6Confident136 Ų136104.5 Ų104.564%0.63649%0.489SS*.Hα-helixtrans-64.4-40.6172.5-69.3-174.6149.600112.3E497 R498 Q504 S505E497-E501 PolarHBondContact O-N 3.31Å; R498-E501 PolarHBondContact O-N 3.47Å; E501-Q504 PolarHBondContact O-N 3.4Å; E501-S505 VanDerWaalsContact O-CB 3.29Å; E501-S505 WeakPolarHBondContact O-CB 3.26Å; E501-S505 PolarHBondContact O-N 3.26Å
502E89.3Confident85.3Confident99 Ų99102.9 Ų102.946%0.46348%0.484SS..Hα-helixtrans-60-45.2172.7-73.8163-17400111.4R498 S505 Y506R498-E502 WeakPolarHBondContact CG-OE1 3.4Å; R498-E502 IonicContact CZ-OE1 2.73Å; R498-E502 IonicContact NH1-OE1 3.68Å; R498-E502 PolarHBondContact NH1-OE1 3.29Å; R498-E502 IonicContact NH1-OE2 3.36Å; R498-E502 PolarHBondContact NH1-OE2 3.4Å; R498-E502 WeakPolarHBondContact O-CG 3.45Å; R498-E502 PolarHBondContact O-N 2.9Å; E502-S505 PolarHBondContact O-N 2.92Å; E502-Y506 PolarHBondContact O-N 2.84Å
503V87.6Confident85.1Confident67 Ų67101.2 Ų101.241%0.40648%0.476SS..Hα-helixtrans-65.8-42.4175168.40000111.9R499 W500 S505 Y506 I507R499-V503 WeakPolarHBondContact O-CG2 3.35Å; R499-V503 PolarHBondContact O-N 2.67Å; W500-V503 HydrophobicContact CE3-CG1 4.49Å; W500-V503 HydrophobicContact CZ3-CG1 4.47Å; W500-V503 PolarHBondContact O-N 2.78Å; V503-S505 VanDerWaalsContact C-N 3.33Å; V503-S505 PolarHBondContact O-N 3.46Å; V503-Y506 PolarHBondContact O-N 2.89Å; V503-I507 HydrophobicContact CG1-CD1 3.86Å; V503-I507 HydrophobicContact CG1-CG1 4.47Å; V503-I507 VanDerWaalsContact O-CG1 3.29Å; V503-I507 WeakPolarHBondContact O-CG1 3.45Å; V503-I507 PolarHBondContact O-N 3.48Å
504Q81.2Confident84.6Confident49 Ų49102.1 Ų102.123%0.22948%0.478CS..Hα-helixtrans-63-38.9175.3-79.2-73.4-43.600112W500 E501 I507 R508W500-Q504 HydrophobicContact CD2-CG 4.26Å; W500-Q504 HydrophobicContact CG-CG 4.49Å; W500-Q504 HydrophobicContact CZ2-CG 4.19Å; W500-Q504 WeakPolarHBondContact O-CB 3.39Å; W500-Q504 VanDerWaalsContact O-CG 3.26Å; W500-Q504 WeakPolarHBondContact O-CG 3.44Å; W500-Q504 PolarHBondContact O-N 3.03Å; E501-Q504 PolarHBondContact O-N 3.4Å; Q504-I507 PolarHBondContact O-N 3.06Å; Q504-R508 VanDerWaalsContact O-CG 3.31Å; Q504-R508 WeakPolarHBondContact O-CG 3.44Å; Q504-R508 PolarHBondContact O-N 2.85Å
505S87.8Confident84.3Confident73 Ų73101.6 Ų101.651%0.5148%0.475SS..Hα-helixtrans-64.6-45.2174.1-170.50000111.4E501 E502 V503 I507 R508 K509E501-S505 VanDerWaalsContact O-CB 3.29Å; E501-S505 WeakPolarHBondContact O-CB 3.26Å; E501-S505 PolarHBondContact O-N 3.26Å; E502-S505 PolarHBondContact O-N 2.92Å; V503-S505 VanDerWaalsContact C-N 3.33Å; V503-S505 PolarHBondContact O-N 3.46Å; S505-I507 PolarHBondContact O-N 3.36Å; S505-R508 PolarHBondContact O-N 2.85Å; S505-K509 WeakPolarHBondContact O-CB 3.25Å; S505-K509 PolarHBondContact O-N 3.29Å
506Y88.9Confident84.1Confident139 Ų139100.6 Ų100.655%0.54548%0.481SS..Hα-helixtrans-60.5-43.4174176.4-100.4000112.4E502 V503 K509 R510E502-Y506 PolarHBondContact O-N 2.84Å; V503-Y506 PolarHBondContact O-N 2.89Å; Y506-K509 PolarHBondContact O-N 3.11Å; Y506-R510 HydrophobicContact CD1-CG 4.43Å; Y506-R510 HydrophobicContact CE1-CG 3.91Å; Y506-R510 HydrophobicContact CE2-CG 4.02Å; Y506-R510 WeakPolarHBondContact O-CG 3.36Å; Y506-R510 PolarHBondContact O-N 2.84Å; Y506-R510 PolarHBondContact OH-NE 3.49Å; Y506-R510 VanDerWaalsContact OH-NE 3.1Å
507I84.8Confident83.9Confident77 Ų77100.4 Ų100.440%0.39548%0.479SS..Hα-helixtrans-60.7-51.9175.3-70.1165.4000110.3V503 Q504 S505 K509 R510 T511V503-I507 HydrophobicContact CG1-CD1 3.86Å; V503-I507 HydrophobicContact CG1-CG1 4.47Å; V503-I507 VanDerWaalsContact O-CG1 3.29Å; V503-I507 WeakPolarHBondContact O-CG1 3.45Å; V503-I507 PolarHBondContact O-N 3.48Å; Q504-I507 PolarHBondContact O-N 3.06Å; S505-I507 PolarHBondContact O-N 3.36Å; I507-K509 VanDerWaalsContact C-N 3.28Å; I507-K509 PolarHBondContact O-N 3.02Å; I507-R510 CarbonylContact O-C 3.57Å; I507-R510 PolarHBondContact O-N 3.28Å; I507-R510 VanDerWaalsContact O-N 3.07Å; I507-T511 PolarHBondContact O-N 2.97Å; I507-T511 PolarHBondContact O-OG1 3.48Å
508R86.4Confident83.3Confident156 Ų156100.1 Ų100.159%0.58948%0.477SS*.Hα-helixtrans-57.8-40.5178.2-71.4173.2-160.4131.37.6112.2Q504 S505 T511 A512Q504-R508 VanDerWaalsContact O-CG 3.31Å; Q504-R508 WeakPolarHBondContact O-CG 3.44Å; Q504-R508 PolarHBondContact O-N 2.85Å; S505-R508 PolarHBondContact O-N 2.85Å; R508-T511 PolarHBondContact O-N 3.43Å; R508-A512 WeakPolarHBondContact O-CB 3.38Å; R508-A512 PolarHBondContact O-N 3.23Å
509K89.3Confident82.7Confident135 Ų135102.3 Ų102.359%0.58749%0.492SS*.Hα-helixtrans-63.3-44.5175.2-169.6-176.7178.1-168.40111.5S505 Y506 I507 T511 A512 E513S505-K509 WeakPolarHBondContact O-CB 3.25Å; S505-K509 PolarHBondContact O-N 3.29Å; Y506-K509 PolarHBondContact O-N 3.11Å; I507-K509 VanDerWaalsContact C-N 3.28Å; I507-K509 PolarHBondContact O-N 3.02Å; K509-T511 VanDerWaalsContact C-N 3.35Å; K509-T511 PolarHBondContact O-N 3.37Å; K509-A512 PolarHBondContact O-N 2.95Å; K509-E513 WeakPolarHBondContact CE-OE1 3.29Å; K509-E513 IonicContact NZ-OE1 3.57Å; K509-E513 WeakPolarHBondContact O-CB 3.19Å; K509-E513 WeakPolarHBondContact O-CG 3.46Å; K509-E513 PolarHBondContact O-N 3.34Å
510R83.8Confident82.1Confident132 Ų13299.2 Ų99.250%0.49849%0.486SS..Hα-helixtrans-64.6-35.8175.1-75-51.3-147.6160.210.4113.1Y506 I507 E513 H514Y506-R510 HydrophobicContact CD1-CG 4.43Å; Y506-R510 HydrophobicContact CE1-CG 3.91Å; Y506-R510 HydrophobicContact CE2-CG 4.02Å; Y506-R510 WeakPolarHBondContact O-CG 3.36Å; Y506-R510 PolarHBondContact O-N 2.84Å; Y506-R510 PolarHBondContact OH-NE 3.49Å; Y506-R510 VanDerWaalsContact OH-NE 3.1Å; I507-R510 CarbonylContact O-C 3.57Å; I507-R510 PolarHBondContact O-N 3.28Å; I507-R510 VanDerWaalsContact O-N 3.07Å; R510-E513 WeakPolarHBondContact CD-OE2 3.4Å; R510-E513 IonicContact CZ-OE2 2.59Å; R510-E513 IonicContact NE-OE2 2.64Å; R510-E513 IonicContact NH1-OE2 3.88Å; R510-E513 PolarHBondContact NH1-OE2 2.92Å; R510-H514 WeakPolarHBondContact O-CB 3.32Å; R510-H514 PolarHBondContact O-N 3.45Å
511T79.1Confident81.8Confident66 Ų6696.6 Ų96.641%0.40548%0.483SS..Hα-helixtrans-64.8-46172.5-57.40000111I507 R508 K509 E513 H514 E515I507-T511 PolarHBondContact O-N 2.97Å; I507-T511 PolarHBondContact O-OG1 3.48Å; R508-T511 PolarHBondContact O-N 3.43Å; K509-T511 VanDerWaalsContact C-N 3.35Å; K509-T511 PolarHBondContact O-N 3.37Å; T511-E513 PolarHBondContact O-N 2.95Å; T511-H514 CarbonylContact O-C 3.54Å; T511-H514 WeakPolarHBondContact O-CB 3.49Å; T511-H514 PolarHBondContact O-N 3.22Å; T511-H514 VanDerWaalsContact O-N 3.13Å; T511-E515 HydrophobicContact CG2-CG 4.35Å; T511-E515 WeakPolarHBondContact O-CB 3.44Å; T511-E515 WeakPolarHBondContact O-CG 3.22Å; T511-E515 PolarHBondContact O-N 3.35Å
512A82.2Confident81Confident53 Ų5395.7 Ų95.744%0.43848%0.479SS..Hα-helixtrans-64.9-37.9176.600000113R508 K509 H514 E515 A516R508-A512 WeakPolarHBondContact O-CB 3.38Å; R508-A512 PolarHBondContact O-N 3.23Å; K509-A512 PolarHBondContact O-N 2.95Å; A512-H514 VanDerWaalsContact C-N 3.32Å; A512-E515 PolarHBondContact O-N 2.95Å; A512-A516 WeakPolarHBondContact O-CB 3.34Å; A512-A516 PolarHBondContact O-N 3.49Å
513E80.6Confident80.1Confident78 Ų7895 Ų9536%0.36449%0.485SS..Hα-helixtrans-60.8-40.6170.8-74.7170.1-165.400111.5K509 R510 T511 A517K509-E513 WeakPolarHBondContact CE-OE1 3.29Å; K509-E513 IonicContact NZ-OE1 3.57Å; K509-E513 WeakPolarHBondContact O-CB 3.19Å; K509-E513 WeakPolarHBondContact O-CG 3.46Å; K509-E513 PolarHBondContact O-N 3.34Å; R510-E513 WeakPolarHBondContact CD-OE2 3.4Å; R510-E513 IonicContact CZ-OE2 2.59Å; R510-E513 IonicContact NE-OE2 2.64Å; R510-E513 IonicContact NH1-OE2 3.88Å; R510-E513 PolarHBondContact NH1-OE2 2.92Å; T511-E513 PolarHBondContact O-N 2.95Å; E513-A517 WeakPolarHBondContact O-CB 3.49Å; E513-A517 PolarHBondContact O-N 3.04Å; E513-A517 VanDerWaalsContact O-N 3.11Å
514H74.9Confident79.5Confident122 Ų12297.2 Ų97.257%0.56549%0.489SS*.Hα-helixtrans-69.2-43.8175.6-177.2-73.8000112.4R510 T511 A512 A516 A517 Q518R510-H514 WeakPolarHBondContact O-CB 3.32Å; R510-H514 PolarHBondContact O-N 3.45Å; T511-H514 CarbonylContact O-C 3.54Å; T511-H514 WeakPolarHBondContact O-CB 3.49Å; T511-H514 PolarHBondContact O-N 3.22Å; T511-H514 VanDerWaalsContact O-N 3.13Å; A512-H514 VanDerWaalsContact C-N 3.32Å; H514-A516 PolarHBondContact O-N 2.85Å; H514-A517 PolarHBondContact O-N 3.16Å; H514-Q518 PolarHBondContact CE1-OE1 3.01Å; H514-Q518 VanDerWaalsContact O-CB 3.25Å; H514-Q518 WeakPolarHBondContact O-CB 3.32Å; H514-Q518 PolarHBondContact O-N 3.27Å
515E78.9Confident78.8Confident113 Ų113101.5 Ų101.553%0.52851%0.508SS..Hα-helixtrans-63.5-39.5177.7-74.4171.6173.500111.8T511 A512 Q518 Q519T511-E515 HydrophobicContact CG2-CG 4.35Å; T511-E515 WeakPolarHBondContact O-CB 3.44Å; T511-E515 WeakPolarHBondContact O-CG 3.22Å; T511-E515 PolarHBondContact O-N 3.35Å; A512-E515 PolarHBondContact O-N 2.95Å; E515-Q518 PolarHBondContact O-N 3.5Å; E515-Q519 PolarHBondContact O-N 2.93Å
516A81Confident77.8Confident57 Ų57101.8 Ų101.847%0.47151%0.506SS..Hα-helixtrans-64.8-44.6173.300000112.1A512 H514 Q518 Q519 D520A512-A516 WeakPolarHBondContact O-CB 3.34Å; A512-A516 PolarHBondContact O-N 3.49Å; H514-A516 PolarHBondContact O-N 2.85Å; A516-Q518 VanDerWaalsContact C-N 3.28Å; A516-Q518 PolarHBondContact O-N 2.9Å; A516-Q519 PolarHBondContact O-N 2.95Å; A516-D520 PolarHBondContact O-N 3.45Å
517A77.9Confident76.6Confident51 Ų5198.6 Ų98.642%0.42151%0.508SS..Hα-helixtrans-64-34173.700000112.2E513 H514 L521E513-A517 WeakPolarHBondContact O-CB 3.49Å; E513-A517 PolarHBondContact O-N 3.04Å; E513-A517 VanDerWaalsContact O-N 3.11Å; H514-A517 PolarHBondContact O-N 3.16Å; A517-L521 WeakPolarHBondContact O-CB 3.49Å; A517-L521 WeakPolarHBondContact O-CG 3.07Å; A517-L521 PolarHBondContact O-N 2.82Å
518Q70.5Confident75.6Confident96 Ų96100.5 Ų100.545%0.44951%0.514SS..Hα-helixtrans-70.9-37.2175.7-174.9174.3-23.700111.9H514 E515 A516 L521 Q522H514-Q518 PolarHBondContact CE1-OE1 3.01Å; H514-Q518 VanDerWaalsContact O-CB 3.25Å; H514-Q518 WeakPolarHBondContact O-CB 3.32Å; H514-Q518 PolarHBondContact O-N 3.27Å; E515-Q518 PolarHBondContact O-N 3.5Å; A516-Q518 VanDerWaalsContact C-N 3.28Å; A516-Q518 PolarHBondContact O-N 2.9Å; Q518-L521 PolarHBondContact O-N 3.45Å; Q518-Q522 WeakPolarHBondContact O-CB 3.17Å; Q518-Q522 PolarHBondContact O-N 3.13Å
519Q75.4Confident74.2Confident147 Ų14798.3 Ų98.369%0.68751%0.51SS*.Hα-helixtrans-67.9-39.2172.9-77.9-170.6-14.500112.6E515 A516 Q522 S523E515-Q519 PolarHBondContact O-N 2.93Å; A516-Q519 PolarHBondContact O-N 2.95Å; Q519-Q522 PolarHBondContact O-N 3.48Å; Q519-S523 WeakPolarHBondContact O-CB 3.49Å; Q519-S523 PolarHBondContact O-N 3.37Å
520D75.4Confident72.6Confident80 Ų8097.5 Ų97.543%0.42851%0.512SS..Hα-helixtrans-62-45.2171.817067.6000111.6A516 Q522 S523 K524A516-D520 PolarHBondContact O-N 3.45Å; D520-Q522 VanDerWaalsContact C-N 3.34Å; D520-Q522 PolarHBondContact O-N 3Å; D520-S523 PolarHBondContact O-N 3.49Å; D520-K524 WeakPolarHBondContact O-CD 3.36Å; D520-K524 WeakPolarHBondContact O-CG 3.31Å; D520-K524 PolarHBondContact O-N 2.84Å; D520-K524 VanDerWaalsContact O-N 3.1Å; D520-K524 WeakPolarHBondContact OD1-CE 3.38Å; D520-K524 IonicContact OD1-NZ 2.81Å; D520-K524 PolarHBondContact OD1-NZ 2.88Å; D520-K524 IonicContact OD2-NZ 2.65Å; D520-K524 PolarHBondContact OD2-NZ 3.38Å
521L74.9Confident71.5Confident102 Ų10296.4 Ų96.453%0.53451%0.513SS..Hα-helixtrans-61.9-37.9171.4-81.7168.4000112.7A517 Q518 K524 F525A517-L521 WeakPolarHBondContact O-CB 3.49Å; A517-L521 WeakPolarHBondContact O-CG 3.07Å; A517-L521 PolarHBondContact O-N 2.82Å; Q518-L521 PolarHBondContact O-N 3.45Å; L521-K524 CarbonylContact O-C 3.58Å; L521-K524 PolarHBondContact O-N 2.84Å; L521-F525 WeakPolarHBondContact O-CB 3.36Å; L521-F525 PolarHBondContact O-N 2.9Å
522Q70.5Confident70.5Confident117 Ų11797.5 Ų97.555%0.54752%0.519SS..Hα-helixtrans-74.5-33.7-178.1-166.8156.7-3.600112.1Q518 Q519 D520 F525 V526Q518-Q522 WeakPolarHBondContact O-CB 3.17Å; Q518-Q522 PolarHBondContact O-N 3.13Å; Q519-Q522 PolarHBondContact O-N 3.48Å; D520-Q522 VanDerWaalsContact C-N 3.34Å; D520-Q522 PolarHBondContact O-N 3Å; Q522-F525 PolarHBondContact O-N 3.25Å; Q522-V526 WeakPolarHBondContact O-CG2 3.24Å; Q522-V526 PolarHBondContact O-N 3.47Å
523S70.4Confident69.1Low85 Ų85102.8 Ų102.859%0.59454%0.535SS*.Hα-helixtrans-60.7-44.4167.3-1750000111.3Q519 D520 F525 V526 A527Q519-S523 WeakPolarHBondContact O-CB 3.49Å; Q519-S523 PolarHBondContact O-N 3.37Å; D520-S523 PolarHBondContact O-N 3.49Å; S523-F525 VanDerWaalsContact C-N 3.33Å; S523-F525 PolarHBondContact O-N 2.93Å; S523-V526 PolarHBondContact O-N 3.28Å; S523-A527 PolarHBondContact O-N 3Å; S523-A527 VanDerWaalsContact O-N 3.12Å
524K74.4Confident67.8Low113 Ų113104 Ų10449%0.49155%0.552SS.*Hα-helixtrans-66.6-32.5174.2-69.5163.5-173.9168.10112.7D520 L521 K528D520-K524 WeakPolarHBondContact O-CD 3.36Å; D520-K524 WeakPolarHBondContact O-CG 3.31Å; D520-K524 PolarHBondContact O-N 2.84Å; D520-K524 VanDerWaalsContact O-N 3.1Å; D520-K524 WeakPolarHBondContact OD1-CE 3.38Å; D520-K524 IonicContact OD1-NZ 2.81Å; D520-K524 PolarHBondContact OD1-NZ 2.88Å; D520-K524 IonicContact OD2-NZ 2.65Å; D520-K524 PolarHBondContact OD2-NZ 3.38Å; L521-K524 CarbonylContact O-C 3.58Å; L521-K524 PolarHBondContact O-N 2.84Å; K524-K528 WeakPolarHBondContact O-CG 3.29Å; K524-K528 PolarHBondContact O-N 3.26Å; K524-K528 VanDerWaalsContact O-N 3.14Å
525F66.7Low66.9Low140 Ų140103.6 Ų103.661%0.61455%0.553SS**Hα-helixtrans-68.4-46173.7-109.7-86.8000111.8L521 Q522 S523 A527 K528 E529L521-F525 WeakPolarHBondContact O-CB 3.36Å; L521-F525 PolarHBondContact O-N 2.9Å; Q522-F525 PolarHBondContact O-N 3.25Å; S523-F525 VanDerWaalsContact C-N 3.33Å; S523-F525 PolarHBondContact O-N 2.93Å; F525-A527 VanDerWaalsContact C-N 3.25Å; F525-A527 PolarHBondContact O-N 3.38Å; F525-K528 CarbonylContact O-C 3.56Å; F525-K528 WeakPolarHBondContact O-CA 3.36Å; F525-K528 PolarHBondContact O-N 2.81Å; F525-E529 WeakPolarHBondContact O-CB 3.48Å; F525-E529 PolarHBondContact O-N 3.41Å
526V68.5Low64.9Low79 Ų79103.7 Ų103.748%0.47955%0.554SS.*Hα-helixtrans-60.7-36175.5171.20000111.5Q522 S523 K528 N530Q522-V526 WeakPolarHBondContact O-CG2 3.24Å; Q522-V526 PolarHBondContact O-N 3.47Å; S523-V526 PolarHBondContact O-N 3.28Å; V526-K528 VanDerWaalsContact C-N 3.28Å; V526-K528 PolarHBondContact O-N 3.21Å; V526-N530 PolarHBondContact O-ND2 2.86Å
527A63.5Low63.5Low71 Ų71106.8 Ų106.859%0.58757%0.571SS**Hα-helixtrans-64.9-30171.600000113.3S523 F525S523-A527 PolarHBondContact O-N 3Å; S523-A527 VanDerWaalsContact O-N 3.12Å; F525-A527 VanDerWaalsContact C-N 3.25Å; F525-A527 PolarHBondContact O-N 3.38Å
528K64.1Low62.3Low117 Ų117111.6 Ų111.651%0.50958%0.583SS.*Hα-helixtrans-89.6-24.6177.2-75.1-68.4175.6-165.20114.5K524 F525 V526 N530 E531 V532K524-K528 WeakPolarHBondContact O-CG 3.29Å; K524-K528 PolarHBondContact O-N 3.26Å; K524-K528 VanDerWaalsContact O-N 3.14Å; F525-K528 CarbonylContact O-C 3.56Å; F525-K528 WeakPolarHBondContact O-CA 3.36Å; F525-K528 PolarHBondContact O-N 2.81Å; V526-K528 VanDerWaalsContact C-N 3.28Å; V526-K528 PolarHBondContact O-N 3.21Å; K528-N530 VanDerWaalsContact C-N 3.32Å; K528-N530 PolarHBondContact O-N 2.71Å; K528-E531 WeakPolarHBondContact CD-OE2 3.43Å; K528-E531 WeakPolarHBondContact CE-OE2 3.3Å; K528-E531 IonicContact NZ-OE1 3.74Å; K528-E531 IonicContact NZ-OE2 2.56Å; K528-E531 PolarHBondContact NZ-OE2 3.44Å; K528-E531 CarbonylContact O-C 3.58Å; K528-E531 WeakPolarHBondContact O-CA 3.32Å; K528-E531 VanDerWaalsContact O-CB 3.25Å; K528-E531 WeakPolarHBondContact O-CB 3.47Å; K528-E531 PolarHBondContact O-N 3.46Å; K528-V532 WeakPolarHBondContact O-CG2 3.21Å; K528-V532 PolarHBondContact O-N 3.24Å
529E55Low61Low110 Ų110114.7 Ų114.751%0.51460%0.602SS.*Hα-helixtrans-69.5-33.2-177.6-166.4161.6-166.200111.6F525 E531 V532 Q533F525-E529 WeakPolarHBondContact O-CB 3.48Å; F525-E529 PolarHBondContact O-N 3.41Å; E529-E531 PolarHBondContact O-N 2.87Å; E529-V532 PolarHBondContact O-N 2.92Å; E529-Q533 PolarHBondContact O-N 3.4Å
530N56.6Low59.1Low118 Ų118112.5 Ų112.563%0.63160%0.598SS**Hα-helixtrans-62.2-25167.4-68.7-59.9000113.5V526 K528V526-N530 PolarHBondContact O-ND2 2.86Å; K528-N530 VanDerWaalsContact C-N 3.32Å; K528-N530 PolarHBondContact O-N 2.71Å
531E60.9Low57.4Low109 Ų109115.2 Ų115.251%0.50961%0.613SS.*Hα-helixtrans-86.8-30.7175.5-152.5175.8-163.400111K528 E529 S534K528-E531 WeakPolarHBondContact CD-OE2 3.43Å; K528-E531 WeakPolarHBondContact CE-OE2 3.3Å; K528-E531 IonicContact NZ-OE1 3.74Å; K528-E531 IonicContact NZ-OE2 2.56Å; K528-E531 PolarHBondContact NZ-OE2 3.44Å; K528-E531 CarbonylContact O-C 3.58Å; K528-E531 WeakPolarHBondContact O-CA 3.32Å; K528-E531 VanDerWaalsContact O-CB 3.25Å; K528-E531 WeakPolarHBondContact O-CB 3.47Å; K528-E531 PolarHBondContact O-N 3.46Å; E529-E531 PolarHBondContact O-N 2.87Å; E531-S534 WeakPolarHBondContact O-CB 3.43Å; E531-S534 PolarHBondContact O-N 3.25Å
532V58.1Low55.9Low89 Ų89117 Ų11754%0.53963%0.628SS.*Hα-helixtrans-78-28.7179.1171.50000113.1K528 E529 S534 L535K528-V532 WeakPolarHBondContact O-CG2 3.21Å; K528-V532 PolarHBondContact O-N 3.24Å; E529-V532 PolarHBondContact O-N 2.92Å; V532-S534 PolarHBondContact O-N 3.06Å; V532-S534 VanDerWaalsContact O-N 3.09Å; V532-L535 CarbonylContact O-C 3.56Å; V532-L535 WeakPolarHBondContact O-CA 3.39Å; V532-L535 PolarHBondContact O-N 2.96Å
533Q52Low54.3Low165 Ų165119.9 Ų119.977%0.77165%0.646SS**THydrogen-bonded Turntrans-61.7-17.1172-72.7-1736.600113.5E529E529-Q533 PolarHBondContact O-N 3.4Å
534S53.7Low53.1Low104 Ų104122.3 Ų122.373%0.72766%0.658SS**THydrogen-bonded Turntrans-79.5-17.7170.4-165.10000113.4E531 V532E531-S534 WeakPolarHBondContact O-CB 3.43Å; E531-S534 PolarHBondContact O-N 3.25Å; V532-S534 PolarHBondContact O-N 3.06Å; V532-S534 VanDerWaalsContact O-N 3.09Å
535L56.9Low51.7Low112 Ų112122 Ų12259%0.58667%0.67SS**SBendtrans-117.899-169.9-67.2176.5000112V532V532-L535 CarbonylContact O-C 3.56Å; V532-L535 WeakPolarHBondContact O-CA 3.39Å; V532-L535 PolarHBondContact O-N 2.96Å
536H36.3Very low50.7Low116 Ų116124.7 Ų124.754%0.53768%0.681SS.*  trans76.7107.8166.9-62.8-137.9000115.5K538H536-K538 HydrophobicContact CB-CB 3.82Å; H536-K538 WeakPolarHBondContact ND1-CB 3.47Å; H536-K538 PolarHBondContact ND1-O 3.43Å
537S51.7Low49.6Very low121 Ų121129.5 Ų129.585%0.84670%0.698SS**SBendcis59.8-4.3-2-160.80000117.7
538K52.6Low48.7Very low152 Ų152134.4 Ų134.466%0.66171%0.709SS**  trans-157.933.2-170.1-80.9176.6175.9177.40110.8H536H536-K538 HydrophobicContact CB-CB 3.82Å; H536-K538 WeakPolarHBondContact ND1-CB 3.47Å; H536-K538 PolarHBondContact ND1-O 3.43Å
539L42.3Very low48.1Very low162 Ų162136.4 Ų136.485%0.84872%0.724SS**  trans-125.536.1160.3-160.760.5000110.2
540T37Very low47.9Very low100 Ų100139.1 Ų139.161%0.61374%0.737SS**  trans-50.8151.6153.8-360000109.8
541D39.5Very low47.8Very low137 Ų137141.8 Ų141.873%0.73375%0.746SS**  trans66.490.6168.3-54.2-37.1000118.6
542T42.9Very low47.5Very low140 Ų140146 Ų14686%0.85976%0.757SS**  trans171.166.9133.828.40000109.6
543L36.2Very low47.4Very low177 Ų177148.5 Ų148.593%0.92777%0.767SS**  68.4128.579.6-158.175.2000114.6
544V46.4Very low47.4Very low137 Ų137147.9 Ų147.983%0.8377%0.766SS**  trans-108.8140-171.91730000111.1
545S44.8Very low47.5Very low106 Ų106150.1 Ų150.174%0.74177%0.765SS**  trans-168.5115.1150.6-163.30000117Q547S545-Q547 PolarHBondContact O-N 2.92Å
546K44.9Very low47.5Very low197 Ų197150.3 Ų150.386%0.85777%0.766SS**  17.687.9127.1-171.7-162.6177-170.30119
547Q46.9Very low48.4Very low179 Ų179151.6 Ų151.684%0.83677%0.774SS**  trans-152.742.3161.6-152.1173.30.400115.7S545S545-Q547 PolarHBondContact O-N 2.92Å
548Q43.8Very low48.6Very low175 Ų175153.7 Ų153.782%0.81877%0.77SS**SBendtrans-133.56.6-179.2-84.6-171.8-15.400116.3
549L51.2Low48.7Very low158 Ų158149.3 Ų149.383%0.82776%0.758SS**SBendtrans-90.9-34.7-176.7-147.774.5000113.6
550E51.5Low49.3Very low167 Ų167146.8 Ų146.878%0.7874%0.742SS**G310 helixtrans-78.7-28.6-165.8-69166.4159.400113.7R552E550-R552 PolarHBondContact O-N 3.23Å
551Q53.6Low49.9Very low174 Ų174149.5 Ų149.581%0.81375%0.748SS**G310 helixtrans-68.5-16.2177.9-79.7-175.9-24.300114.4
552R55.8Low50.6Low197 Ų197151.5 Ų151.574%0.74375%0.75SS**G310 helixtrans-79.9-20.3-178.4-96.1-171.2172.8115.1-1114.9E550E550-R552 PolarHBondContact O-N 3.23Å
553L54.6Low51.1Low142 Ų142151.7 Ų151.774%0.74374%0.735SS**SBendtrans-74.4-28.8-174-148.474.6000112.7
554M53.3Low51.9Low153 Ų153146.1 Ų146.175%0.75472%0.715SS**Hα-helixtrans-76.2-27-174.3-166.2162.9-78.300113.7L556M554-L556 VanDerWaalsContact C-N 3.33Å; M554-L556 PolarHBondContact O-N 3.38Å
555Q55.3Low52.2Low150 Ų150143.7 Ų143.770%0.70170%0.704SS**Hα-helixtrans-77-11.7-178.9-74-173.8-35.500114.7
556L56.8Low52.8Low116 Ų116146.2 Ų146.261%0.60770%0.701SS**Hα-helixtrans-82.2-35.5-177.7-92.6163.7000113.6M554 E558 S559M554-L556 VanDerWaalsContact C-N 3.33Å; M554-L556 PolarHBondContact O-N 3.38Å; L556-E558 VanDerWaalsContact C-N 3.29Å; L556-E558 PolarHBondContact O-N 3.31Å; L556-S559 WeakPolarHBondContact O-CB 3.36Å; L556-S559 PolarHBondContact O-N 3.23Å; L556-S559 VanDerWaalsContact O-N 3.11Å; L556-S559 PolarHBondContact O-OG 3.07Å
557M54.5Low53.2Low144 Ų144143.2 Ų143.271%0.70969%0.69SS**Hα-helixtrans-59.6-38.5179.6-86.9-176.1-75.800112.8S559 E560M557-S559 PolarHBondContact O-N 2.89Å; M557-S559 VanDerWaalsContact O-N 3.14Å; M557-E560 PolarHBondContact O-N 3.27Å
558E56.6Low53.7Low165 Ų165141.1 Ų141.177%0.77168%0.681SS**Hα-helixtrans-70.2-9.3-178.7-151.3168.4-144.200113.2L556L556-E558 VanDerWaalsContact C-N 3.29Å; L556-E558 PolarHBondContact O-N 3.31Å
559S55.1Low54.4Low59 Ų59136.6 Ų136.641%0.41367%0.669SS.*Hα-helixtrans-91.8-19.7177.978.10000114.6L556 M557L556-S559 WeakPolarHBondContact O-CB 3.36Å; L556-S559 PolarHBondContact O-N 3.23Å; L556-S559 VanDerWaalsContact O-N 3.11Å; L556-S559 PolarHBondContact O-OG 3.07Å; M557-S559 PolarHBondContact O-N 2.89Å; M557-S559 VanDerWaalsContact O-N 3.14Å
560E53.7Low55Low109 Ų109134.1 Ų134.151%0.50966%0.655SS.*Hα-helixtrans-71.5-43.9178.7-73.9-80.997.700111.6M557 K562 R563M557-E560 PolarHBondContact O-N 3.27Å; E560-K562 PolarHBondContact O-N 3.23Å; E560-R563 WeakPolarHBondContact O-CB 3.37Å; E560-R563 PolarHBondContact O-N 3.35Å; E560-R563 IonicContact OE1-CZ 3.87Å; E560-R563 IonicContact OE1-NH1 3.31Å; E560-R563 PolarHBondContact OE1-NH1 2.89Å; E560-R563 IonicContact OE1-NH2 3.13Å; E560-R563 PolarHBondContact OE1-NH2 2.92Å; E560-R563 IonicContact OE2-NH1 3.78Å
561Q49.7Very low55.5Low158 Ų158132.9 Ų132.974%0.73865%0.65SS**THydrogen-bonded Turntrans-61.1-20.1-171.2-164.762.917.700114
562K54.2Low56.2Low179 Ų179130.1 Ų130.178%0.77864%0.639SS**THydrogen-bonded Turntrans-85-3.5175.5-75.3-178.7177.5171.30114.5E560E560-K562 PolarHBondContact O-N 3.23Å
563R54.5Low56.8Low143 Ų143126.6 Ų126.654%0.5463%0.631SS.*THydrogen-bonded Turntrans-87.3-35.5177.4-148.4176.1-56.8119.810.1112.7E560 S565 K566E560-R563 WeakPolarHBondContact O-CB 3.37Å; E560-R563 PolarHBondContact O-N 3.35Å; E560-R563 IonicContact OE1-CZ 3.87Å; E560-R563 IonicContact OE1-NH1 3.31Å; E560-R563 PolarHBondContact OE1-NH1 2.89Å; E560-R563 IonicContact OE1-NH2 3.13Å; E560-R563 PolarHBondContact OE1-NH2 2.92Å; E560-R563 IonicContact OE2-NH1 3.78Å; R563-S565 PolarHBondContact O-N 3.28Å; R563-K566 PolarHBondContact O-N 2.89Å
564A53.1Low57.5Low60 Ų60124 Ų12450%0.49662%0.621SS.*G310 helixtrans-56.1-42.4-176.500000114.2K566 E567A564-K566 PolarHBondContact O-N 3.35Å; A564-E567 WeakPolarHBondContact O-CB 3.44Å; A564-E567 PolarHBondContact O-N 2.78Å
565S53.2Low58.5Low86 Ų86121.2 Ų121.260%0.60161%0.606SS**G310 helixtrans-67.84.2-179.1690000115.8R563R563-S565 PolarHBondContact O-N 3.28Å
566K56.5Low59.2Low159 Ų159118.7 Ų118.769%0.69160%0.598SS**G310 helixtrans-103.5-15169.5-88.8-172.2168.9-173.50114R563 A564R563-K566 PolarHBondContact O-N 2.89Å; A564-K566 PolarHBondContact O-N 3.35Å
567E53.6Low60.1Low134 Ų134117.5 Ų117.563%0.62659%0.591SS**Hα-helixtrans-70.1-51.5177.8-142.176.7-163.600109.9A564 S569 L570 Q571A564-E567 WeakPolarHBondContact O-CB 3.44Å; A564-E567 PolarHBondContact O-N 2.78Å; E567-S569 VanDerWaalsContact C-N 3.29Å; E567-S569 PolarHBondContact O-N 3.38Å; E567-L570 PolarHBondContact O-N 2.81Å; E567-Q571 PolarHBondContact O-N 3.5Å; E567-Q571 VanDerWaalsContact O-N 3.08Å
568E56.8Low61Low135 Ų135115.4 Ų115.463%0.63158%0.582SS**Hα-helixtrans-56.8-39.2179.3-70.5178.4126.400112.8L570 Q571 I572E568-L570 VanDerWaalsContact C-N 3.25Å; E568-L570 PolarHBondContact O-N 2.88Å; E568-Q571 PolarHBondContact O-N 3.48Å; E568-I572 WeakPolarHBondContact O-CG1 3.47Å; E568-I572 PolarHBondContact O-N 3.35Å; E568-I572 VanDerWaalsContact O-N 3.1Å
569S58.6Low61.8Low81 Ų81113 Ų11357%0.56657%0.571SS**Hα-helixtrans-66.6-24.3179.8-176.30000113.6E567E567-S569 VanDerWaalsContact C-N 3.29Å; E567-S569 PolarHBondContact O-N 3.38Å
570L64.2Low62.7Low105 Ų105116.2 Ų116.255%0.5558%0.579SS.*Hα-helixtrans-87.1-32.4173.3-70.7169.4000111E567 E568 Q573 V574E567-L570 PolarHBondContact O-N 2.81Å; E568-L570 VanDerWaalsContact C-N 3.25Å; E568-L570 PolarHBondContact O-N 2.88Å; L570-Q573 PolarHBondContact O-N 2.83Å; L570-V574 WeakPolarHBondContact O-CG2 3.49Å; L570-V574 PolarHBondContact O-N 2.97Å; L570-V574 VanDerWaalsContact O-N 3.15Å
571Q61.7Low63.7Low141 Ų141115.7 Ų115.766%0.65958%0.58SS**Hα-helixtrans-66-37.7179.2-166.1164.2-2.400112.5E567 E568 V574 Q575E567-Q571 PolarHBondContact O-N 3.5Å; E567-Q571 VanDerWaalsContact O-N 3.08Å; E568-Q571 PolarHBondContact O-N 3.48Å; Q571-V574 PolarHBondContact O-N 2.79Å; Q571-Q575 PolarHBondContact O-N 3.38Å
572I67.7Low65Low117 Ų117115.1 Ų115.160%0.658%0.577SS**Hα-helixtrans-63.5-42.7171.7-62.8172.1000111E568 V574 Q575 D576E568-I572 WeakPolarHBondContact O-CG1 3.47Å; E568-I572 PolarHBondContact O-N 3.35Å; E568-I572 VanDerWaalsContact O-N 3.1Å; I572-V574 PolarHBondContact O-N 3.49Å; I572-Q575 WeakPolarHBondContact O-CB 3.23Å; I572-Q575 PolarHBondContact O-N 2.96Å; I572-D576 PolarHBondContact O-N 3.46Å
573Q68.7Low65.9Low122 Ų122109.5 Ų109.557%0.5757%0.565SS**Hα-helixtrans-67.3-23-178.7-170.3167.746.600113.5L570 I577L570-Q573 PolarHBondContact O-N 2.83Å; Q573-I577 WeakPolarHBondContact O-CD1 3.47Å; Q573-I577 WeakPolarHBondContact O-CG1 3.35Å
574V69.9Low66.9Low88 Ų88106 Ų10653%0.53356%0.556SS.*Hα-helixtrans-77.7-29.1172.2172.30000111.9L570 Q571 I572 L578L570-V574 WeakPolarHBondContact O-CG2 3.49Å; L570-V574 PolarHBondContact O-N 2.97Å; L570-V574 VanDerWaalsContact O-N 3.15Å; Q571-V574 PolarHBondContact O-N 2.79Å; I572-V574 PolarHBondContact O-N 3.49Å; V574-L578 HydrophobicContact CG1-CD1 4.41Å; V574-L578 WeakPolarHBondContact O-CG 3.36Å; V574-L578 PolarHBondContact O-N 2.88Å
575Q73.6Confident68Low94 Ų94109.8 Ų109.844%0.43956%0.561SS.*Hα-helixtrans-68.4-47.8178.9-175.761.629.600111.9Q571 I572 I577 L578 E579Q571-Q575 PolarHBondContact O-N 3.38Å; I572-Q575 WeakPolarHBondContact O-CB 3.23Å; I572-Q575 PolarHBondContact O-N 2.96Å; Q575-I577 PolarHBondContact O-N 2.95Å; Q575-L578 WeakPolarHBondContact O-CB 3.37Å; Q575-L578 PolarHBondContact O-N 3.27Å; Q575-E579 PolarHBondContact NE2-OE1 2.91Å; Q575-E579 PolarHBondContact O-N 3.19Å; Q575-E579 VanDerWaalsContact O-N 3.13Å
576D71.3Confident69.1Low97 Ų97108.6 Ų108.652%0.51956%0.557SS.*Hα-helixtrans-53.9-40.8175.7-77.41.3000112I572 L578 E579 Q580I572-D576 PolarHBondContact O-N 3.46Å; D576-L578 VanDerWaalsContact C-N 3.32Å; D576-L578 PolarHBondContact O-N 2.79Å; D576-E579 PolarHBondContact O-N 2.9Å; D576-Q580 WeakPolarHBondContact O-CG 3.32Å; D576-Q580 PolarHBondContact O-N 3.39Å
577I74.2Confident70Confident91 Ų91103.2 Ų103.247%0.46753%0.534SS..Hα-helixtrans-69.2-29.8-179.2-66.1171.9000111.5Q573 Q575 N581Q573-I577 WeakPolarHBondContact O-CD1 3.47Å; Q573-I577 WeakPolarHBondContact O-CG1 3.35Å; Q575-I577 PolarHBondContact O-N 2.95Å; I577-N581 PolarHBondContact O-N 3.34Å; I577-N581 PolarHBondContact O-ND2 2.86Å
578L73.6Confident70.9Confident100 Ų100101.2 Ų101.252%0.52453%0.527SS..Hα-helixtrans-72.8-41.7174.3-72.2168.2000111.6V574 Q575 D576 N581 E582V574-L578 HydrophobicContact CG1-CD1 4.41Å; V574-L578 WeakPolarHBondContact O-CG 3.36Å; V574-L578 PolarHBondContact O-N 2.88Å; Q575-L578 WeakPolarHBondContact O-CB 3.37Å; Q575-L578 PolarHBondContact O-N 3.27Å; D576-L578 VanDerWaalsContact C-N 3.32Å; D576-L578 PolarHBondContact O-N 2.79Å; L578-N581 WeakPolarHBondContact O-CB 3.49Å; L578-N581 PolarHBondContact O-N 2.81Å; L578-N581 VanDerWaalsContact O-N 3.13Å; L578-E582 PolarHBondContact O-N 3.29Å; L578-E582 VanDerWaalsContact O-N 3.08Å
579E74.8Confident71.7Confident115 Ų115101.1 Ų101.154%0.53753%0.526SS..Hα-helixtrans-67.7-37.9178.4-69.6177.6-155.100111.9Q575 D576 N581 E582 A583Q575-E579 PolarHBondContact NE2-OE1 2.91Å; Q575-E579 PolarHBondContact O-N 3.19Å; Q575-E579 VanDerWaalsContact O-N 3.13Å; D576-E579 PolarHBondContact O-N 2.9Å; E579-N581 VanDerWaalsContact C-N 3.29Å; E579-N581 PolarHBondContact O-N 3.18Å; E579-E582 PolarHBondContact O-N 2.92Å; E579-A583 PolarHBondContact O-N 2.79Å; E579-A583 VanDerWaalsContact O-N 3.08Å
580Q73.6Confident72.4Confident127 Ų127101.9 Ų101.959%0.59352%0.521SS*.Hα-helixtrans-61.3-35.1169.6-73.8-178.4-10.500112.9D576 A583 L584D576-Q580 WeakPolarHBondContact O-CG 3.32Å; D576-Q580 PolarHBondContact O-N 3.39Å; Q580-A583 PolarHBondContact O-N 2.92Å; Q580-L584 PolarHBondContact O-N 3.06Å; Q580-L584 VanDerWaalsContact O-N 3.1Å
581N73.8Confident72.6Confident98 Ų98100.7 Ų100.752%0.52451%0.511SS..Hα-helixtrans-71.2-35.6176.7-90.3-89.5000112.8I577 L578 E579 K585I577-N581 PolarHBondContact O-N 3.34Å; I577-N581 PolarHBondContact O-ND2 2.86Å; L578-N581 WeakPolarHBondContact O-CB 3.49Å; L578-N581 PolarHBondContact O-N 2.81Å; L578-N581 VanDerWaalsContact O-N 3.13Å; E579-N581 VanDerWaalsContact C-N 3.29Å; E579-N581 PolarHBondContact O-N 3.18Å; N581-K585 VanDerWaalsContact O-CB 3.26Å; N581-K585 WeakPolarHBondContact O-CB 3.45Å; N581-K585 PolarHBondContact O-N 2.99Å; N581-K585 VanDerWaalsContact O-N 3.07Å
582E78.6Confident72.9Confident145 Ų14599.9 Ų99.968%0.67851%0.507SS*.Hα-helixtrans-66.3-41.2171.6-75.3-136.5120.400111.9L578 E579 L584 K585 A586L578-E582 PolarHBondContact O-N 3.29Å; L578-E582 VanDerWaalsContact O-N 3.08Å; E579-E582 PolarHBondContact O-N 2.92Å; E582-L584 PolarHBondContact O-N 3Å; E582-K585 PolarHBondContact O-N 2.92Å; E582-A586 PolarHBondContact O-N 3.4Å
583A72.4Confident72.9Confident62 Ų6297.9 Ų97.951%0.51250%0.504SS..Hα-helixtrans-59.4-48.4177.100000112.3E579 Q580 K585 A586 Q587E579-A583 PolarHBondContact O-N 2.79Å; E579-A583 VanDerWaalsContact O-N 3.08Å; Q580-A583 PolarHBondContact O-N 2.92Å; A583-K585 VanDerWaalsContact C-N 3.32Å; A583-K585 PolarHBondContact O-N 2.74Å; A583-A586 PolarHBondContact O-N 3.4Å; A583-Q587 WeakPolarHBondContact O-CB 3.38Å; A583-Q587 PolarHBondContact O-N 3.22Å
584L75Confident72.6Confident69 Ų6993.8 Ų93.836%0.36149%0.485SS..Hα-helixtrans-61.7-37.3174.7-91.5160.9000112.6Q580 E582 Q587 I588Q580-L584 PolarHBondContact O-N 3.06Å; Q580-L584 VanDerWaalsContact O-N 3.1Å; E582-L584 PolarHBondContact O-N 3Å; L584-Q587 WeakPolarHBondContact O-CB 3.38Å; L584-Q587 PolarHBondContact O-N 3.41Å; L584-I588 VanDerWaalsContact O-CG1 3.3Å; L584-I588 WeakPolarHBondContact O-CG1 3.27Å; L584-I588 PolarHBondContact O-N 3.38Å
585K77.5Confident72.3Confident140 Ų14095.2 Ų95.261%0.60949%0.488SS*.Hα-helixtrans-68.6-41.3178.6-168.9178.2179.8-172.30112.1N581 E582 A583 I588 Q589N581-K585 VanDerWaalsContact O-CB 3.26Å; N581-K585 WeakPolarHBondContact O-CB 3.45Å; N581-K585 PolarHBondContact O-N 2.99Å; N581-K585 VanDerWaalsContact O-N 3.07Å; E582-K585 PolarHBondContact O-N 2.92Å; A583-K585 VanDerWaalsContact C-N 3.32Å; A583-K585 PolarHBondContact O-N 2.74Å; K585-I588 PolarHBondContact O-N 2.85Å; K585-Q589 WeakPolarHBondContact O-CB 3.35Å; K585-Q589 PolarHBondContact O-N 2.86Å
586A74.2Confident71.5Confident61 Ų6194.2 Ų94.250%0.50450%0.496SS..Hα-helixtrans-63.5-40.7173.200000111.8E582 A583 Q589 Q590E582-A586 PolarHBondContact O-N 3.4Å; A583-A586 PolarHBondContact O-N 3.4Å; A586-Q589 PolarHBondContact O-N 3.42Å; A586-Q590 PolarHBondContact O-N 2.91Å
587Q76.3Confident70.8Confident45 Ų4593.8 Ų93.821%0.2151%0.506CS..Hα-helixtrans-61.9-45.7175.8-170.5-169.499.100112H79 A583 L584 Q589 Q590 F591H79-Q587 VanDerWaalsContact CD2-CD 3.42Å; H79-Q587 PolarHBondContact CD2-OE1 3.48Å; H79-Q587 PolarHBondContact NE2-OE1 3.14Å; A583-Q587 WeakPolarHBondContact O-CB 3.38Å; A583-Q587 PolarHBondContact O-N 3.22Å; L584-Q587 WeakPolarHBondContact O-CB 3.38Å; L584-Q587 PolarHBondContact O-N 3.41Å; Q587-Q589 VanDerWaalsContact C-N 3.3Å; Q587-Q589 PolarHBondContact O-N 2.97Å; Q587-Q590 WeakPolarHBondContact O-CB 3.19Å; Q587-Q590 PolarHBondContact O-N 3.19Å; Q587-F591 HydrophobicContact CG-CD2 4.39Å; Q587-F591 HydrophobicContact CG-CE2 3.98Å; Q587-F591 VanDerWaalsContact O-CD2 3.27Å; Q587-F591 WeakPolarHBondContact O-CD2 3.36Å; Q587-F591 PolarHBondContact O-N 3.44Å
588I73.1Confident69.5Low92 Ų9296.4 Ų96.447%0.47252%0.516SS..Hα-helixtrans-60.6-40173.8-70.7165.2000111.3L584 K585 F591 H592L584-I588 VanDerWaalsContact O-CG1 3.3Å; L584-I588 WeakPolarHBondContact O-CG1 3.27Å; L584-I588 PolarHBondContact O-N 3.38Å; K585-I588 PolarHBondContact O-N 2.85Å; I588-F591 PolarHBondContact O-N 2.8Å; I588-H592 PolarHBondContact O-N 2.85Å; I588-H592 VanDerWaalsContact O-N 3.1Å; I588-H592 PolarHBondContact O-ND1 3.35Å
589Q73.6Confident68.4Low133 Ų13396 Ų9662%0.62152%0.518SS*.Hα-helixtrans-67.5-38.8177.5-167.3167.6-7.500111.8K585 A586 Q587 F591 H592 S593K585-Q589 WeakPolarHBondContact O-CB 3.35Å; K585-Q589 PolarHBondContact O-N 2.86Å; A586-Q589 PolarHBondContact O-N 3.42Å; Q587-Q589 VanDerWaalsContact C-N 3.3Å; Q587-Q589 PolarHBondContact O-N 2.97Å; Q589-F591 PolarHBondContact O-N 3.03Å; Q589-H592 PolarHBondContact O-N 3.41Å; Q589-S593 PolarHBondContact O-N 2.95Å; Q589-S593 PolarHBondContact O-OG 2.82Å
590Q72.9Confident67.4Low98 Ų9895.3 Ų95.346%0.45853%0.526SS..Hα-helixtrans-61.2-41.8174-166.2-175.721.800112A586 Q587 S593 Q594A586-Q590 PolarHBondContact O-N 2.91Å; Q587-Q590 WeakPolarHBondContact O-CB 3.19Å; Q587-Q590 PolarHBondContact O-N 3.19Å; Q590-S593 PolarHBondContact O-N 2.85Å; Q590-Q594 WeakPolarHBondContact O-CG 3.18Å; Q590-Q594 PolarHBondContact O-N 2.98Å
591F68.7Low66.4Low79 Ų7991.9 Ų91.935%0.34652%0.52SS..Hα-helixtrans-65.9-39.5174.7-75.9-59.6000112.9H79 Q587 I588 Q589 S593 Q594 I595H79-F591 AromaticContact NE2-CE2 3.36Å; H79-F591 WeakPolarHBondContact NE2-CE2 3.21Å; H79-F591 AromaticContact NE2-CZ 3.44Å; H79-F591 WeakPolarHBondContact NE2-CZ 3.46Å; Q587-F591 HydrophobicContact CG-CD2 4.39Å; Q587-F591 HydrophobicContact CG-CE2 3.98Å; Q587-F591 VanDerWaalsContact O-CD2 3.27Å; Q587-F591 WeakPolarHBondContact O-CD2 3.36Å; Q587-F591 PolarHBondContact O-N 3.44Å; I588-F591 PolarHBondContact O-N 2.8Å; Q589-F591 PolarHBondContact O-N 3.03Å; F591-S593 VanDerWaalsContact C-N 3.34Å; F591-S593 PolarHBondContact O-N 3.33Å; F591-Q594 PolarHBondContact O-N 2.98Å; F591-I595 WeakPolarHBondContact O-CG1 3.27Å; F591-I595 PolarHBondContact O-N 3.49Å
592H67.9Low65.6Low124 Ų12491.2 Ų91.257%0.57452%0.522SS*.Hα-helixtrans-61.3-42.3173.8-78.681.4000111.8I588 Q589 Q594 I595 A596I588-H592 PolarHBondContact O-N 2.85Å; I588-H592 VanDerWaalsContact O-N 3.1Å; I588-H592 PolarHBondContact O-ND1 3.35Å; Q589-H592 PolarHBondContact O-N 3.41Å; H592-Q594 VanDerWaalsContact C-N 3.34Å; H592-Q594 PolarHBondContact O-N 2.95Å; H592-I595 PolarHBondContact O-N 3.17Å; H592-A596 WeakPolarHBondContact O-CB 3.43Å; H592-A596 PolarHBondContact O-N 2.89Å
593S67.4Low64.7Low76 Ų7688.6 Ų88.653%0.53152%0.516SS..Hα-helixtrans-64.7-34.9174.1-63.90000113.1Q589 Q590 F591 A597Q589-S593 PolarHBondContact O-N 2.95Å; Q589-S593 PolarHBondContact O-OG 2.82Å; Q590-S593 PolarHBondContact O-N 2.85Å; F591-S593 VanDerWaalsContact C-N 3.34Å; F591-S593 PolarHBondContact O-N 3.33Å; S593-A597 VanDerWaalsContact O-CB 3.31Å; S593-A597 WeakPolarHBondContact O-CB 3.27Å; S593-A597 PolarHBondContact O-N 3.4Å
594Q63.1Low64.1Low36 Ų3691 Ų9117%0.16852%0.519CS..Hα-helixtrans-68.5-41.9174.3-72.8177.51700112.2R82 Q590 F591 H592 A597 Q598R82-Q594 VanDerWaalsContact CZ-CD 3.43Å; R82-Q594 VanDerWaalsContact CZ-OE1 3.27Å; Q590-Q594 WeakPolarHBondContact O-CG 3.18Å; Q590-Q594 PolarHBondContact O-N 2.98Å; F591-Q594 PolarHBondContact O-N 2.98Å; H592-Q594 VanDerWaalsContact C-N 3.34Å; H592-Q594 PolarHBondContact O-N 2.95Å; Q594-A597 PolarHBondContact O-N 2.84Å; Q594-Q598 WeakPolarHBondContact O-CB 3.36Å; Q594-Q598 PolarHBondContact O-N 2.88Å; Q594-Q598 VanDerWaalsContact O-N 3.09Å
595I62.6Low63.5Low118 Ų11889.5 Ų89.561%0.60552%0.518SS*.Hα-helixtrans-64-43.4176.3-68165.4000110.4F591 H592 A597 Q598F591-I595 WeakPolarHBondContact O-CG1 3.27Å; F591-I595 PolarHBondContact O-N 3.49Å; H592-I595 PolarHBondContact O-N 3.17Å; I595-A597 VanDerWaalsContact C-N 3.26Å; I595-A597 PolarHBondContact O-N 2.82Å; I595-Q598 PolarHBondContact O-N 3.43Å
596A56.4Low63Low72 Ų7289 Ų8960%0.59552%0.517SS*.Hα-helixtrans-66.7-23.3176.300000114.1H592 T599H592-A596 WeakPolarHBondContact O-CB 3.43Å; H592-A596 PolarHBondContact O-N 2.89Å; A596-T599 PolarHBondContact O-OG1 3.45Å
597A57.1Low62.8Low89 Ų8991.8 Ų91.874%0.73652%0.52SS*.Hα-helixtrans-92.7-7.1175.700000113.9S593 Q594 I595S593-A597 VanDerWaalsContact O-CB 3.31Å; S593-A597 WeakPolarHBondContact O-CB 3.27Å; S593-A597 PolarHBondContact O-N 3.4Å; Q594-A597 PolarHBondContact O-N 2.84Å; I595-A597 VanDerWaalsContact C-N 3.26Å; I595-A597 PolarHBondContact O-N 2.82Å
598Q47.8Very low62.7Low145 Ų14594.3 Ų94.368%0.67853%0.534SS*.SBendtrans-111.912.5-177.8-163165.4-16.900112.9Q594 I595 S600Q594-Q598 WeakPolarHBondContact O-CB 3.36Å; Q594-Q598 PolarHBondContact O-N 2.88Å; Q594-Q598 VanDerWaalsContact O-N 3.09Å; I595-Q598 PolarHBondContact O-N 3.43Å; Q598-S600 PolarHBondContact O-N 2.87Å
599T50.2Low62.8Low92 Ų9296.3 Ų96.356%0.56454%0.541SS*.  trans-79.879.6173.836.60000112.2A596 A601A596-T599 PolarHBondContact O-OG1 3.45Å; T599-A601 PolarHBondContact O-N 3.46Å
600S52.6Low63Low100 Ų10097.7 Ų97.770%0.69955%0.545SS*.THydrogen-bonded Turntrans-67.424.7162.363.40000113.4Q598Q598-S600 PolarHBondContact O-N 2.87Å
601A54.2Low63.1Low56 Ų5697.3 Ų97.346%0.46355%0.549SS..Hα-helixtrans-76.8-27.9-171.100000112.9T599 A605T599-A601 PolarHBondContact O-N 3.46Å; A601-A605 WeakPolarHBondContact O-CB 3.44Å; A601-A605 PolarHBondContact O-N 3.33Å
602S56Low63.6Low83 Ų8397.5 Ų97.558%0.5855%0.553SS**Hα-helixtrans-62.9-51.1-178.9-160.40000111.8A605 E606S602-A605 PolarHBondContact O-N 3.4Å; S602-E606 WeakPolarHBondContact O-CG 3.49Å; S602-E606 PolarHBondContact O-N 2.79Å
603V60.3Low64.2Low90 Ų9094.3 Ų94.355%0.54555%0.548SS..Hα-helixtrans-65.2-43.9-179.7-177.20000110.8A605 E606 E607V603-A605 VanDerWaalsContact C-N 3.29Å; V603-A605 PolarHBondContact O-N 2.78Å; V603-E606 PolarHBondContact O-N 3.26Å; V603-E607 PolarHBondContact O-N 2.79Å
604L59.8Low64.7Low112 Ų11294.6 Ų94.659%0.58654%0.541SS*.Hα-helixtrans-64.2-34.6177.9-158.678.8000112L608L604-L608 VanDerWaalsContact O-CB 3.27Å; L604-L608 WeakPolarHBondContact O-CB 3.44Å; L604-L608 WeakPolarHBondContact O-CG 3.24Å; L604-L608 PolarHBondContact O-N 3.27Å
605A61.5Low65.5Low39 Ų3998.4 Ų98.432%0.32256%0.557SS.*Hα-helixtrans-73.1-36.6174.700000112.4A601 S602 V603 H609A601-A605 WeakPolarHBondContact O-CB 3.44Å; A601-A605 PolarHBondContact O-N 3.33Å; S602-A605 PolarHBondContact O-N 3.4Å; V603-A605 VanDerWaalsContact C-N 3.29Å; V603-A605 PolarHBondContact O-N 2.78Å; A605-H609 WeakPolarHBondContact O-CB 3.43Å; A605-H609 PolarHBondContact O-N 3.06Å; A605-H609 PolarHBondContact O-ND1 3.04Å
606E68.3Low66.3Low128 Ų12897.2 Ų97.260%0.59855%0.552SS**Hα-helixtrans-66.7-42.1173.9-74.5177.7144.300111.5S602 V603 H609 K610S602-E606 WeakPolarHBondContact O-CG 3.49Å; S602-E606 PolarHBondContact O-N 2.79Å; V603-E606 PolarHBondContact O-N 3.26Å; E606-H609 PolarHBondContact O-N 2.92Å; E606-K610 VanDerWaalsContact O-CB 3.28Å; E606-K610 WeakPolarHBondContact O-CB 3.47Å; E606-K610 PolarHBondContact O-N 3.2Å
607E68.9Low67.7Low121 Ų12199.2 Ų99.257%0.56555%0.548SS*.Hα-helixtrans-70.2-35.8174.7-75.8-178.2131.600112.4V603 K610 V611V603-E607 PolarHBondContact O-N 2.79Å; E607-K610 PolarHBondContact O-N 3.23Å; E607-V611 WeakPolarHBondContact O-CB 3.33Å; E607-V611 VanDerWaalsContact O-CG2 3.32Å; E607-V611 WeakPolarHBondContact O-CG2 3.47Å; E607-V611 PolarHBondContact O-N 2.88Å
608L73.6Confident68.6Low98 Ų9898.5 Ų98.551%0.51353%0.529SS..Hα-helixtrans-62.7-48.5170.1-85165.9000112.2L604 K610 V611 I612L604-L608 VanDerWaalsContact O-CB 3.27Å; L604-L608 WeakPolarHBondContact O-CB 3.44Å; L604-L608 WeakPolarHBondContact O-CG 3.24Å; L604-L608 PolarHBondContact O-N 3.27Å; L608-K610 PolarHBondContact O-N 2.85Å; L608-V611 PolarHBondContact O-N 2.83Å; L608-I612 WeakPolarHBondContact O-CB 3.47Å; L608-I612 WeakPolarHBondContact O-CD1 3.44Å; L608-I612 WeakPolarHBondContact O-CG1 3.29Å; L608-I612 PolarHBondContact O-N 3.24Å
609H75.1Confident70.1Confident134 Ų13496.1 Ų96.162%0.6252%0.52SS*.Hα-helixtrans-60.9-34.6176-75.8109.5000112.2A605 E606 A613A605-H609 WeakPolarHBondContact O-CB 3.43Å; A605-H609 PolarHBondContact O-N 3.06Å; A605-H609 PolarHBondContact O-ND1 3.04Å; E606-H609 PolarHBondContact O-N 2.92Å; H609-A613 VanDerWaalsContact O-CB 3.31Å; H609-A613 WeakPolarHBondContact O-CB 3.33Å; H609-A613 PolarHBondContact O-N 2.81Å
610K79.1Confident71.8Confident161 Ų16197.6 Ų97.670%0.752%0.519SS*.Hα-helixtrans-72-37.3177.3-164.8174.2-173.91780112.7E606 E607 L608 E614E606-K610 VanDerWaalsContact O-CB 3.28Å; E606-K610 WeakPolarHBondContact O-CB 3.47Å; E606-K610 PolarHBondContact O-N 3.2Å; E607-K610 PolarHBondContact O-N 3.23Å; L608-K610 PolarHBondContact O-N 2.85Å; K610-E614 PolarHBondContact O-N 2.93Å; K610-E614 VanDerWaalsContact O-N 3.12Å
611V75.5Confident73.1Confident90 Ų9098.7 Ų98.755%0.54551%0.513SS..Hα-helixtrans-69-40.2172.11690000111.1E607 L608 K615E607-V611 WeakPolarHBondContact O-CB 3.33Å; E607-V611 VanDerWaalsContact O-CG2 3.32Å; E607-V611 WeakPolarHBondContact O-CG2 3.47Å; E607-V611 PolarHBondContact O-N 2.88Å; L608-V611 PolarHBondContact O-N 2.83Å; V611-K615 HydrophobicContact CG1-CG 4.45Å; V611-K615 VanDerWaalsContact O-CB 3.3Å; V611-K615 WeakPolarHBondContact O-CB 3.35Å; V611-K615 VanDerWaalsContact O-CG 3.27Å; V611-K615 WeakPolarHBondContact O-CG 3.4Å; V611-K615 PolarHBondContact O-N 3.2Å
612I77.2Confident74.2Confident84 Ų84100.2 Ų100.243%0.43152%0.516SS..Hα-helixtrans-61.7-51.8174.1-70.1162.9000109.8L608 E614 K615 D616L608-I612 WeakPolarHBondContact O-CB 3.47Å; L608-I612 WeakPolarHBondContact O-CD1 3.44Å; L608-I612 WeakPolarHBondContact O-CG1 3.29Å; L608-I612 PolarHBondContact O-N 3.24Å; I612-E614 VanDerWaalsContact C-N 3.34Å; I612-E614 PolarHBondContact O-N 3.34Å; I612-K615 CarbonylContact O-C 3.51Å; I612-K615 WeakPolarHBondContact O-CA 3.49Å; I612-K615 WeakPolarHBondContact O-CB 3.49Å; I612-K615 PolarHBondContact O-N 2.9Å; I612-D616 WeakPolarHBondContact CG2-OD2 3.43Å; I612-D616 VanDerWaalsContact O-CG 3.26Å; I612-D616 PolarHBondContact O-N 3.31Å
613A81.5Confident75.4Confident57 Ų57101.7 Ų101.747%0.47151%0.514SS..Hα-helixtrans-60.9-37179.900000113.8H609 K617H609-A613 VanDerWaalsContact O-CB 3.31Å; H609-A613 WeakPolarHBondContact O-CB 3.33Å; H609-A613 PolarHBondContact O-N 2.81Å; A613-K617 VanDerWaalsContact O-CB 3.27Å; A613-K617 WeakPolarHBondContact O-CB 3.24Å; A613-K617 PolarHBondContact O-N 2.87Å
614E77.6Confident76.5Confident81 Ų81101.6 Ų101.638%0.37951%0.511SS..Hα-helixtrans-73.7-28.2173.3-177.857.4-149.100111.9K610 I612 K617 Q618K610-E614 PolarHBondContact O-N 2.93Å; K610-E614 VanDerWaalsContact O-N 3.12Å; I612-E614 VanDerWaalsContact C-N 3.34Å; I612-E614 PolarHBondContact O-N 3.34Å; E614-K617 IonicContact OE1-NZ 3.48Å; E614-K617 PolarHBondContact OE1-NZ 2.77Å; E614-K617 IonicContact OE2-NZ 3.23Å; E614-K617 PolarHBondContact OE2-NZ 3.47Å; E614-Q618 WeakPolarHBondContact O-CB 3.33Å; E614-Q618 VanDerWaalsContact O-CG 3.26Å; E614-Q618 WeakPolarHBondContact O-CG 3.3Å; E614-Q618 PolarHBondContact O-N 3.11Å; E614-Q618 PolarHBondContact OE1-NE2 3.45Å
615K79.8Confident77.5Confident117 Ų11799.4 Ų99.451%0.50951%0.505SS..Hα-helixtrans-74.2-40.9172.6-79.1-73.5162-154.70113V611 I612 K617 Q618 L619V611-K615 HydrophobicContact CG1-CG 4.45Å; V611-K615 VanDerWaalsContact O-CB 3.3Å; V611-K615 WeakPolarHBondContact O-CB 3.35Å; V611-K615 VanDerWaalsContact O-CG 3.27Å; V611-K615 WeakPolarHBondContact O-CG 3.4Å; V611-K615 PolarHBondContact O-N 3.2Å; I612-K615 CarbonylContact O-C 3.51Å; I612-K615 WeakPolarHBondContact O-CA 3.49Å; I612-K615 WeakPolarHBondContact O-CB 3.49Å; I612-K615 PolarHBondContact O-N 2.9Å; K615-K617 VanDerWaalsContact C-N 3.3Å; K615-K617 PolarHBondContact O-N 3.45Å; K615-Q618 PolarHBondContact O-N 3.03Å; K615-L619 WeakPolarHBondContact O-CB 3.36Å; K615-L619 PolarHBondContact O-N 3.27Å
616D79.4Confident78.5Confident93 Ų93102.2 Ų102.250%0.49751%0.514SS..Hα-helixtrans-63.2-39.2173.5-64.2-21.2000110.6I612 L619 K620I612-D616 WeakPolarHBondContact CG2-OD2 3.43Å; I612-D616 VanDerWaalsContact O-CG 3.26Å; I612-D616 PolarHBondContact O-N 3.31Å; D616-L619 PolarHBondContact O-N 2.87Å; D616-K620 WeakPolarHBondContact O-CB 3.47Å; D616-K620 PolarHBondContact O-N 3.24Å
617K85.6Confident79.3Confident114 Ų11498.1 Ų98.150%0.49650%0.502SS..Hα-helixtrans-64.6-41.2172.4177.3179.2150.6-132.60112.4A613 E614 K615 Q621A613-K617 VanDerWaalsContact O-CB 3.27Å; A613-K617 WeakPolarHBondContact O-CB 3.24Å; A613-K617 PolarHBondContact O-N 2.87Å; E614-K617 IonicContact OE1-NZ 3.48Å; E614-K617 PolarHBondContact OE1-NZ 2.77Å; E614-K617 IonicContact OE2-NZ 3.23Å; E614-K617 PolarHBondContact OE2-NZ 3.47Å; K615-K617 VanDerWaalsContact C-N 3.3Å; K615-K617 PolarHBondContact O-N 3.45Å; K617-Q621 VanDerWaalsContact O-CB 3.32Å; K617-Q621 WeakPolarHBondContact O-CB 3.33Å; K617-Q621 PolarHBondContact O-N 3.36Å
618Q76.6Confident79.9Confident73 Ų7397.8 Ų97.834%0.34150%0.504SS..Hα-helixtrans-67.1-41.6174.1-75.6168.220.300111.8E614 K615 Q621 T622E614-Q618 WeakPolarHBondContact O-CB 3.33Å; E614-Q618 VanDerWaalsContact O-CG 3.26Å; E614-Q618 WeakPolarHBondContact O-CG 3.3Å; E614-Q618 PolarHBondContact O-N 3.11Å; E614-Q618 PolarHBondContact OE1-NE2 3.45Å; K615-Q618 PolarHBondContact O-N 3.03Å; Q618-Q621 PolarHBondContact O-N 3.3Å; Q618-T622 PolarHBondContact O-N 3.18Å; Q618-T622 PolarHBondContact O-OG1 3.06Å
619L79.5Confident80.1Confident95 Ų9598.8 Ų98.850%0.49751%0.506SS..Hα-helixtrans-56.7-54.4173.3-110.5168.6000110.1K615 D616 Q621 T622 E623K615-L619 WeakPolarHBondContact O-CB 3.36Å; K615-L619 PolarHBondContact O-N 3.27Å; D616-L619 PolarHBondContact O-N 2.87Å; L619-Q621 VanDerWaalsContact C-N 3.31Å; L619-Q621 PolarHBondContact O-N 2.83Å; L619-T622 WeakPolarHBondContact CA-OG1 3.19Å; L619-T622 CarbonylContact O-C 3.58Å; L619-T622 WeakPolarHBondContact O-CA 3.43Å; L619-T622 PolarHBondContact O-N 3.21Å; L619-T622 PolarHBondContact O-OG1 2.77Å; L619-E623 WeakPolarHBondContact O-CG 3.29Å; L619-E623 PolarHBondContact O-N 3.04Å
620K86.1Confident80.3Confident123 Ų12397.9 Ų97.954%0.53550%0.502SS..Hα-helixtrans-59.1-41178.3-176.1156.6-173.1159.40112.6D616 T622 E623 D624D616-K620 WeakPolarHBondContact O-CB 3.47Å; D616-K620 PolarHBondContact O-N 3.24Å; K620-T622 VanDerWaalsContact C-N 3.26Å; K620-T622 PolarHBondContact O-N 3.35Å; K620-E623 PolarHBondContact O-N 3.48Å; K620-E623 VanDerWaalsContact O-N 3.13Å; K620-D624 WeakPolarHBondContact O-CB 3.37Å; K620-D624 PolarHBondContact O-N 3.45Å
621Q80.3Confident80.5Confident124 Ų12495.5 Ų95.558%0.57950%0.497SS*.Hα-helixtrans-66.1-28.8176-163.716913.800112.5K617 Q618 L619 S625K617-Q621 VanDerWaalsContact O-CB 3.32Å; K617-Q621 WeakPolarHBondContact O-CB 3.33Å; K617-Q621 PolarHBondContact O-N 3.36Å; Q618-Q621 PolarHBondContact O-N 3.3Å; L619-Q621 VanDerWaalsContact C-N 3.31Å; L619-Q621 PolarHBondContact O-N 2.83Å; Q621-S625 WeakPolarHBondContact O-CB 3.36Å; Q621-S625 PolarHBondContact O-N 3.24Å; Q621-S625 PolarHBondContact O-OG 2.95Å
622T76.7Confident80.7Confident87 Ų8795.8 Ų95.853%0.53449%0.492SS..Hα-helixtrans-78.8-30.716954.60000113.8Q618 L619 K620 S625 L626Q618-T622 PolarHBondContact O-N 3.18Å; Q618-T622 PolarHBondContact O-OG1 3.06Å; L619-T622 WeakPolarHBondContact CA-OG1 3.19Å; L619-T622 CarbonylContact O-C 3.58Å; L619-T622 WeakPolarHBondContact O-CA 3.43Å; L619-T622 PolarHBondContact O-N 3.21Å; L619-T622 PolarHBondContact O-OG1 2.77Å; K620-T622 VanDerWaalsContact C-N 3.26Å; K620-T622 PolarHBondContact O-N 3.35Å; T622-S625 PolarHBondContact O-N 2.82Å; T622-L626 VanDerWaalsContact O-CB 3.24Å; T622-L626 WeakPolarHBondContact O-CB 3.31Å; T622-L626 PolarHBondContact O-N 3.45Å
623E80.6Confident80.7Confident115 Ų11595.4 Ų95.454%0.53749%0.49SS..Hα-helixtrans-68.4-47.2172.9-70172.9151.700110.9L619 K620 S625 L626 A627L619-E623 WeakPolarHBondContact O-CG 3.29Å; L619-E623 PolarHBondContact O-N 3.04Å; K620-E623 PolarHBondContact O-N 3.48Å; K620-E623 VanDerWaalsContact O-N 3.13Å; E623-S625 VanDerWaalsContact C-N 3.26Å; E623-S625 PolarHBondContact O-N 3.12Å; E623-L626 CarbonylContact O-C 3.55Å; E623-L626 PolarHBondContact O-N 2.91Å; E623-L626 VanDerWaalsContact O-N 3.13Å; E623-A627 WeakPolarHBondContact O-CB 3.37Å; E623-A627 PolarHBondContact O-N 2.75Å
624D83.5Confident80.7Confident88 Ų8895.1 Ų95.147%0.47149%0.488SS..Hα-helixtrans-61-35.3174.5-64.3-27.1000111.1K620 N628K620-D624 WeakPolarHBondContact O-CB 3.37Å; K620-D624 PolarHBondContact O-N 3.45Å; D624-N628 PolarHBondContact O-N 2.73Å; D624-N628 PolarHBondContact O-ND2 2.87Å
625S81.3Confident81.1Confident65 Ų6593.9 Ų93.946%0.45549%0.488SS..Hα-helixtrans-72-38.6173.8-59.30000112.5Q621 T622 E623 N628 E629Q621-S625 WeakPolarHBondContact O-CB 3.36Å; Q621-S625 PolarHBondContact O-N 3.24Å; Q621-S625 PolarHBondContact O-OG 2.95Å; T622-S625 PolarHBondContact O-N 2.82Å; E623-S625 VanDerWaalsContact C-N 3.26Å; E623-S625 PolarHBondContact O-N 3.12Å; S625-N628 PolarHBondContact O-N 3.31Å; S625-E629 PolarHBondContact O-N 2.95Å
626L83.1Confident81.1Confident99 Ų9993 Ų9352%0.51849%0.485SS..Hα-helixtrans-70.6-32.6176.9-17762.4000111.7T622 E623 E629 Q630T622-L626 VanDerWaalsContact O-CB 3.24Å; T622-L626 WeakPolarHBondContact O-CB 3.31Å; T622-L626 PolarHBondContact O-N 3.45Å; E623-L626 CarbonylContact O-C 3.55Å; E623-L626 PolarHBondContact O-N 2.91Å; E623-L626 VanDerWaalsContact O-N 3.13Å; L626-E629 PolarHBondContact O-N 3.29Å; L626-Q630 WeakPolarHBondContact O-CB 3.29Å; L626-Q630 VanDerWaalsContact O-CG 3.31Å; L626-Q630 WeakPolarHBondContact O-CG 3.47Å; L626-Q630 PolarHBondContact O-N 2.86Å
627A83.4Confident81.1Confident41 Ų4195.4 Ų95.434%0.33949%0.493SS..Hα-helixtrans-64.1-47.2171.800000111.1E623 E629 Q630 D631E623-A627 WeakPolarHBondContact O-CB 3.37Å; E623-A627 PolarHBondContact O-N 2.75Å; A627-E629 VanDerWaalsContact C-N 3.31Å; A627-E629 PolarHBondContact O-N 3.41Å; A627-Q630 CarbonylContact O-C 3.6Å; A627-Q630 WeakPolarHBondContact O-CA 3.35Å; A627-Q630 WeakPolarHBondContact O-CB 3.38Å; A627-Q630 PolarHBondContact O-N 2.78Å; A627-D631 PolarHBondContact O-N 3.2Å
628N82.4Confident81Confident115 Ų11596.4 Ų96.462%0.61550%0.499SS*.Hα-helixtrans-59.7-38.3173.1-80.6-34.9000112.9D624 S625 H632D624-N628 PolarHBondContact O-N 2.73Å; D624-N628 PolarHBondContact O-ND2 2.87Å; S625-N628 PolarHBondContact O-N 3.31Å; N628-H632 WeakPolarHBondContact O-CB 3.17Å; N628-H632 PolarHBondContact O-N 3.49Å
629E77.9Confident81.3Confident118 Ų11898.7 Ų98.755%0.55151%0.51SS*.Hα-helixtrans-66.7-36.8172.7-78.6-78.5135.500112S625 L626 A627 H632 L633S625-E629 PolarHBondContact O-N 2.95Å; L626-E629 PolarHBondContact O-N 3.29Å; A627-E629 VanDerWaalsContact C-N 3.31Å; A627-E629 PolarHBondContact O-N 3.41Å; E629-H632 PolarHBondContact O-N 2.85Å; E629-L633 WeakPolarHBondContact O-CB 3.39Å; E629-L633 VanDerWaalsContact O-CG 3.23Å; E629-L633 WeakPolarHBondContact O-CG 3.25Å; E629-L633 PolarHBondContact O-N 3.19Å
630Q80.1Confident81.4Confident116 Ų11698.9 Ų98.954%0.54251%0.511SS..Hα-helixtrans-67.6-42.9174.6-76.8175.51.900112.1L626 A627 H632 L633 A634L626-Q630 WeakPolarHBondContact O-CB 3.29Å; L626-Q630 VanDerWaalsContact O-CG 3.31Å; L626-Q630 WeakPolarHBondContact O-CG 3.47Å; L626-Q630 PolarHBondContact O-N 2.86Å; A627-Q630 CarbonylContact O-C 3.6Å; A627-Q630 WeakPolarHBondContact O-CA 3.35Å; A627-Q630 WeakPolarHBondContact O-CB 3.38Å; A627-Q630 PolarHBondContact O-N 2.78Å; Q630-H632 VanDerWaalsContact C-N 3.35Å; Q630-L633 PolarHBondContact O-N 2.88Å; Q630-A634 WeakPolarHBondContact O-CB 3.29Å; Q630-A634 PolarHBondContact O-N 3Å
631D83Confident81.4Confident111 Ų11199.4 Ų99.459%0.59451%0.513SS*.Hα-helixtrans-64-40.2174.4-72.6-22.8000111.2A627 A634 S635A627-D631 PolarHBondContact O-N 3.2Å; D631-A634 PolarHBondContact O-N 3.39Å; D631-S635 WeakPolarHBondContact O-CB 3.25Å; D631-S635 PolarHBondContact O-N 3.47Å
632H78.8Confident81.6Confident95 Ų9598 Ų9844%0.4451%0.51SS..Hα-helixtrans-69.9-32.9175.6-163.91.6000112.5N628 E629 Q630 K636N628-H632 WeakPolarHBondContact O-CB 3.17Å; N628-H632 PolarHBondContact O-N 3.49Å; E629-H632 PolarHBondContact O-N 2.85Å; Q630-H632 VanDerWaalsContact C-N 3.35Å; H632-K636 WeakPolarHBondContact CE1-CE 3.45Å; H632-K636 PolarHBondContact CE1-NZ 3.34Å; H632-K636 PolarHBondContact NE2-NZ 2.95Å; H632-K636 WeakPolarHBondContact O-CG 3.27Å; H632-K636 PolarHBondContact O-N 3.17Å
633L77.7Confident81.9Confident76 Ų7698.3 Ų98.340%0.39851%0.511SS..Hα-helixtrans-68.8-41.5171.6-78.2168.3000111.8E629 Q630 K636 E637E629-L633 WeakPolarHBondContact O-CB 3.39Å; E629-L633 VanDerWaalsContact O-CG 3.23Å; E629-L633 WeakPolarHBondContact O-CG 3.25Å; E629-L633 PolarHBondContact O-N 3.19Å; Q630-L633 PolarHBondContact O-N 2.88Å; L633-K636 CarbonylContact O-C 3.45Å; L633-K636 PolarHBondContact O-N 3.18Å; L633-K636 VanDerWaalsContact O-N 3.17Å; L633-E637 WeakPolarHBondContact O-CB 3.33Å; L633-E637 PolarHBondContact O-N 2.94Å
634A82.1Confident81.8Confident52 Ų5298.7 Ų98.743%0.4351%0.513SS..Hα-helixtrans-62-43.4175.100000111.5Q630 D631 K636 E637 E638Q630-A634 WeakPolarHBondContact O-CB 3.29Å; Q630-A634 PolarHBondContact O-N 3Å; D631-A634 PolarHBondContact O-N 3.39Å; A634-K636 VanDerWaalsContact C-N 3.33Å; A634-K636 PolarHBondContact O-N 3.18Å; A634-E637 PolarHBondContact O-N 2.81Å; A634-E638 PolarHBondContact O-N 3.03Å
635S86Confident82Confident54 Ų5498.5 Ų98.538%0.37851%0.512SS..Hα-helixtrans-59.4-40.5172.1165.50000112.4D631 E638 E639D631-S635 WeakPolarHBondContact O-CB 3.25Å; D631-S635 PolarHBondContact O-N 3.47Å; S635-E638 PolarHBondContact O-N 3.42Å; S635-E639 WeakPolarHBondContact O-CG 3.39Å; S635-E639 PolarHBondContact O-N 2.8Å
636K79.4Confident82.3Confident100 Ų100101.5 Ų101.544%0.43552%0.52SS..Hα-helixtrans-72.5-29.1175.2-80168.1172.6145.50113.5H632 L633 A634 L640H632-K636 WeakPolarHBondContact CE1-CE 3.45Å; H632-K636 PolarHBondContact CE1-NZ 3.34Å; H632-K636 PolarHBondContact NE2-NZ 2.95Å; H632-K636 WeakPolarHBondContact O-CG 3.27Å; H632-K636 PolarHBondContact O-N 3.17Å; L633-K636 CarbonylContact O-C 3.45Å; L633-K636 PolarHBondContact O-N 3.18Å; L633-K636 VanDerWaalsContact O-N 3.17Å; A634-K636 VanDerWaalsContact C-N 3.33Å; A634-K636 PolarHBondContact O-N 3.18Å; K636-L640 VanDerWaalsContact O-CB 3.23Å; K636-L640 WeakPolarHBondContact O-CB 3.28Å; K636-L640 PolarHBondContact O-N 3.31Å
637E79.1Confident81.9Confident142 Ų142101.7 Ų101.766%0.66452%0.522SS*.Hα-helixtrans-70.2-37172.7-169.4175.5174.300110.8L633 A634 L640 K641L633-E637 WeakPolarHBondContact O-CB 3.33Å; L633-E637 PolarHBondContact O-N 2.94Å; A634-E637 PolarHBondContact O-N 2.81Å; E637-L640 PolarHBondContact O-N 3.23Å; E637-K641 VanDerWaalsContact O-CB 3.24Å; E637-K641 WeakPolarHBondContact O-CB 3.3Å; E637-K641 PolarHBondContact O-N 2.93Å
638E83.9Confident82.2Confident136 Ų136106.9 Ų106.964%0.63654%0.537SS*.Hα-helixtrans-66.2-47.4171.4-169.2160.7-135.500111.9A634 S635 L640 K641 D642A634-E638 PolarHBondContact O-N 3.03Å; S635-E638 PolarHBondContact O-N 3.42Å; E638-L640 VanDerWaalsContact C-N 3.33Å; E638-L640 PolarHBondContact O-N 3.12Å; E638-K641 WeakPolarHBondContact O-CB 3.31Å; E638-K641 PolarHBondContact O-N 3.03Å; E638-K641 VanDerWaalsContact O-N 3.15Å; E638-D642 PolarHBondContact O-N 3.45Å
639E82.4Confident82.4Confident121 Ų121106.5 Ų106.557%0.56553%0.534SS*.Hα-helixtrans-56.3-44.5171.6-74.2178.8169.400112.2S635 K641 D642 V643S635-E639 WeakPolarHBondContact O-CG 3.39Å; S635-E639 PolarHBondContact O-N 2.8Å; E639-K641 VanDerWaalsContact C-N 3.31Å; E639-K641 PolarHBondContact O-N 3.49Å; E639-D642 PolarHBondContact O-N 3.22Å; E639-V643 WeakPolarHBondContact O-CG2 3.43Å; E639-V643 PolarHBondContact O-N 2.85Å
640L82.2Confident82.6Confident98 Ų98106.5 Ų106.551%0.51354%0.538SS..Hα-helixtrans-64.7-36.6178.2-178.962.1000111.9K636 E637 E638 V643 Q644K636-L640 VanDerWaalsContact O-CB 3.23Å; K636-L640 WeakPolarHBondContact O-CB 3.28Å; K636-L640 PolarHBondContact O-N 3.31Å; E637-L640 PolarHBondContact O-N 3.23Å; E638-L640 VanDerWaalsContact C-N 3.33Å; E638-L640 PolarHBondContact O-N 3.12Å; L640-V643 PolarHBondContact O-N 3.21Å; L640-Q644 WeakPolarHBondContact O-CG 3.39Å; L640-Q644 PolarHBondContact O-N 2.88Å
641K85.4Confident82.8Confident135 Ų135107.1 Ų107.159%0.58754%0.538SS*.Hα-helixtrans-68.4-38.8177.2-169178.6-171.8176.90111.7E637 E638 E639 Q644 N645E637-K641 VanDerWaalsContact O-CB 3.24Å; E637-K641 WeakPolarHBondContact O-CB 3.3Å; E637-K641 PolarHBondContact O-N 2.93Å; E638-K641 WeakPolarHBondContact O-CB 3.31Å; E638-K641 PolarHBondContact O-N 3.03Å; E638-K641 VanDerWaalsContact O-N 3.15Å; E639-K641 VanDerWaalsContact C-N 3.31Å; E639-K641 PolarHBondContact O-N 3.49Å; K641-Q644 WeakPolarHBondContact O-CB 3.4Å; K641-Q644 PolarHBondContact O-N 2.64Å; K641-N645 VanDerWaalsContact O-CG 3.23Å; K641-N645 PolarHBondContact O-N 2.77Å; K641-N645 PolarHBondContact O-ND2 2.88Å
642D84.9Confident82.9Confident95 Ų95103.9 Ų103.951%0.50853%0.527SS..Hα-helixtrans-69.4-36.8172-84.5-8.6000112.5E638 E639 Q644 N645 M646E638-D642 PolarHBondContact O-N 3.45Å; E639-D642 PolarHBondContact O-N 3.22Å; D642-Q644 VanDerWaalsContact C-N 3.31Å; D642-Q644 PolarHBondContact O-N 2.81Å; D642-N645 PolarHBondContact O-N 2.9Å; D642-N645 PolarHBondContact OD1-ND2 2.68Å; D642-M646 WeakPolarHBondContact O-CB 3.4Å; D642-M646 VanDerWaalsContact O-CG 3.32Å; D642-M646 WeakPolarHBondContact O-CG 3.49Å; D642-M646 PolarHBondContact O-N 3.47Å
643V82.5Confident83.2Confident93 Ų93103.1 Ų103.156%0.56452%0.524SS*.Hα-helixtrans-62.4-37.7169.4170.20000111.5E639 L640 N647E639-V643 WeakPolarHBondContact O-CG2 3.43Å; E639-V643 PolarHBondContact O-N 2.85Å; L640-V643 PolarHBondContact O-N 3.21Å; V643-N647 VanDerWaalsContact O-CB 3.31Å; V643-N647 WeakPolarHBondContact O-CB 3.43Å; V643-N647 PolarHBondContact O-N 2.88Å
644Q79.7Confident83.3Confident123 Ų123103.7 Ų103.758%0.57553%0.53SS*.Hα-helixtrans-67-43173-74.9-179.81300112.4L640 K641 D642 N647 F648L640-Q644 WeakPolarHBondContact O-CG 3.39Å; L640-Q644 PolarHBondContact O-N 2.88Å; K641-Q644 WeakPolarHBondContact O-CB 3.4Å; K641-Q644 PolarHBondContact O-N 2.64Å; D642-Q644 VanDerWaalsContact C-N 3.31Å; D642-Q644 PolarHBondContact O-N 2.81Å; Q644-N647 PolarHBondContact O-N 3.26Å; Q644-F648 WeakPolarHBondContact O-CB 3.42Å; Q644-F648 PolarHBondContact O-N 2.84Å
645N85.8Confident83.3Confident83 Ų83107.4 Ų107.444%0.44454%0.539SS..Hα-helixtrans-60-46174.7-71.2-32.4000111.2K641 D642 N647 F648 L649K641-N645 VanDerWaalsContact O-CG 3.23Å; K641-N645 PolarHBondContact O-N 2.77Å; K641-N645 PolarHBondContact O-ND2 2.88Å; D642-N645 PolarHBondContact O-N 2.9Å; D642-N645 PolarHBondContact OD1-ND2 2.68Å; N645-N647 PolarHBondContact O-N 2.85Å; N645-F648 WeakPolarHBondContact O-CB 3.37Å; N645-F648 PolarHBondContact O-N 3.25Å; N645-L649 WeakPolarHBondContact O-CG 3.43Å; N645-L649 PolarHBondContact O-N 2.91Å
646M87.6Confident83.3Confident128 Ų128110.5 Ų110.563%0.63155%0.545SS*.Hα-helixtrans-65.1-36.6175.5-72.8-63.3-69.800112.1D642 L649 L650D642-M646 WeakPolarHBondContact O-CB 3.4Å; D642-M646 VanDerWaalsContact O-CG 3.32Å; D642-M646 WeakPolarHBondContact O-CG 3.49Å; D642-M646 PolarHBondContact O-N 3.47Å; M646-L649 PolarHBondContact O-N 3.42Å; M646-L649 HydrophobicContact SD-CD1 4.22Å; M646-L650 VanDerWaalsContact O-CB 3.28Å; M646-L650 WeakPolarHBondContact O-CB 3.23Å; M646-L650 PolarHBondContact O-N 3.41Å
647N76.4Confident83.5Confident103 Ų103110.5 Ų110.555%0.55155%0.549SS*.Hα-helixtrans-66.3-39.5173.9-162.7-87.5000111.8V643 Q644 N645 L650 K651V643-N647 VanDerWaalsContact O-CB 3.31Å; V643-N647 WeakPolarHBondContact O-CB 3.43Å; V643-N647 PolarHBondContact O-N 2.88Å; Q644-N647 PolarHBondContact O-N 3.26Å; N645-N647 PolarHBondContact O-N 2.85Å; N647-L650 PolarHBondContact O-N 3.36Å; N647-K651 WeakPolarHBondContact O-CB 3.4Å; N647-K651 PolarHBondContact O-N 3.45Å
648F89.6Confident83.5Confident151 Ų151109 Ų10966%0.66254%0.542SS*.Hα-helixtrans-63.8-45174.6-176.5-93.1000111.9Q644 N645 K651 A652Q644-F648 WeakPolarHBondContact O-CB 3.42Å; Q644-F648 PolarHBondContact O-N 2.84Å; N645-F648 WeakPolarHBondContact O-CB 3.37Å; N645-F648 PolarHBondContact O-N 3.25Å; F648-K651 PolarHBondContact O-N 3.48Å; F648-A652 WeakPolarHBondContact O-CB 3.49Å; F648-A652 PolarHBondContact O-N 2.83Å
649L85.4Confident83.3Confident106 Ų106105.2 Ų105.256%0.55553%0.534SS*.Hα-helixtrans-62.1-45.5174.3-72.7169.1000112N645 M646 K651 A652 E653N645-L649 WeakPolarHBondContact O-CG 3.43Å; N645-L649 PolarHBondContact O-N 2.91Å; M646-L649 PolarHBondContact O-N 3.42Å; M646-L649 HydrophobicContact SD-CD1 4.22Å; L649-K651 VanDerWaalsContact C-N 3.3Å; L649-K651 PolarHBondContact O-N 3.42Å; L649-A652 PolarHBondContact O-N 3.2Å; L649-E653 PolarHBondContact O-N 2.67Å
650L83Confident83.3Confident119 Ų119104.1 Ų104.162%0.62353%0.532SS*.Hα-helixtrans-62.5-38.9176.8-163.276.7000111.4M646 N647 E653 V654M646-L650 VanDerWaalsContact O-CB 3.28Å; M646-L650 WeakPolarHBondContact O-CB 3.23Å; M646-L650 PolarHBondContact O-N 3.41Å; N647-L650 PolarHBondContact O-N 3.36Å; L650-E653 PolarHBondContact O-N 2.88Å; L650-V654 WeakPolarHBondContact O-CB 3.49Å; L650-V654 VanDerWaalsContact O-CG2 3.29Å; L650-V654 WeakPolarHBondContact O-CG2 3.26Å; L650-V654 PolarHBondContact O-N 3.37Å
651K84.7Confident83.2Confident128 Ų128101.6 Ų101.656%0.55753%0.526SS*.Hα-helixtrans-67.7-37.9176.2-171.8173.6-175.8175.30112.3N647 F648 L649 Q655N647-K651 WeakPolarHBondContact O-CB 3.4Å; N647-K651 PolarHBondContact O-N 3.45Å; F648-K651 PolarHBondContact O-N 3.48Å; L649-K651 VanDerWaalsContact C-N 3.3Å; L649-K651 PolarHBondContact O-N 3.42Å; K651-Q655 WeakPolarHBondContact O-CG 3.49Å; K651-Q655 PolarHBondContact O-N 3.02Å
652A84Confident82.9Confident43 Ų4399.8 Ų99.836%0.35552%0.522SS..Hα-helixtrans-65.7-42.2172.900000111.6F648 L649 Q655 K656F648-A652 WeakPolarHBondContact O-CB 3.49Å; F648-A652 PolarHBondContact O-N 2.83Å; L649-A652 PolarHBondContact O-N 3.2Å; A652-Q655 PolarHBondContact O-N 3.18Å; A652-K656 WeakPolarHBondContact O-CB 3.43Å; A652-K656 PolarHBondContact O-N 2.78Å
653E84.7Confident82.8Confident80 Ų80101.6 Ų101.637%0.37453%0.528SS..Hα-helixtrans-69.3-36.9176.8-165.958.7-148.700111.9L649 L650 Q655 K656 L657L649-E653 PolarHBondContact O-N 2.67Å; L650-E653 PolarHBondContact O-N 2.88Å; E653-Q655 PolarHBondContact O-N 3.48Å; E653-K656 PolarHBondContact O-N 3.01Å; E653-K656 IonicContact OE1-NZ 2.84Å; E653-K656 PolarHBondContact OE1-NZ 3.41Å; E653-K656 IonicContact OE2-NZ 2.64Å; E653-K656 PolarHBondContact OE2-NZ 2.81Å; E653-L657 HydrophobicContact CG-CD1 4.49Å; E653-L657 WeakPolarHBondContact O-CB 3.4Å; E653-L657 WeakPolarHBondContact O-CG 3.35Å; E653-L657 PolarHBondContact O-N 3.37Å
654V80.2Confident82.5Confident87 Ų87103.2 Ų103.253%0.52753%0.529SS..Hα-helixtrans-62-40.6170.4166.70000111.6L650 K656 L657 Q658L650-V654 WeakPolarHBondContact O-CB 3.49Å; L650-V654 VanDerWaalsContact O-CG2 3.29Å; L650-V654 WeakPolarHBondContact O-CG2 3.26Å; L650-V654 PolarHBondContact O-N 3.37Å; V654-K656 VanDerWaalsContact C-N 3.35Å; V654-L657 PolarHBondContact O-N 2.89Å; V654-Q658 WeakPolarHBondContact O-CB 3.47Å; V654-Q658 PolarHBondContact O-N 3.4Å
655Q81.9Confident82.4Confident130 Ų130100.3 Ų100.361%0.60753%0.526SS*.Hα-helixtrans-65.1-37.4173.8-76.9179.2-27.600112.4K651 A652 E653 Q658 A659K651-Q655 WeakPolarHBondContact O-CG 3.49Å; K651-Q655 PolarHBondContact O-N 3.02Å; A652-Q655 PolarHBondContact O-N 3.18Å; E653-Q655 PolarHBondContact O-N 3.48Å; Q655-Q658 PolarHBondContact O-N 3.49Å; Q655-A659 WeakPolarHBondContact O-CB 3.5Å; Q655-A659 PolarHBondContact O-N 2.92Å
656K86.8Confident82.2Confident120 Ų12099.2 Ų99.252%0.52253%0.529SS..Hα-helixtrans-68.3-41.5176173.5160.7154.3-87.20112.3A652 E653 V654 A659 L660A652-K656 WeakPolarHBondContact O-CB 3.43Å; A652-K656 PolarHBondContact O-N 2.78Å; E653-K656 PolarHBondContact O-N 3.01Å; E653-K656 IonicContact OE1-NZ 2.84Å; E653-K656 PolarHBondContact OE1-NZ 3.41Å; E653-K656 IonicContact OE2-NZ 2.64Å; E653-K656 PolarHBondContact OE2-NZ 2.81Å; V654-K656 VanDerWaalsContact C-N 3.35Å; K656-A659 PolarHBondContact O-N 2.92Å; K656-L660 WeakPolarHBondContact O-CB 3.41Å; K656-L660 PolarHBondContact O-N 2.62Å
657L82.6Confident81.9Confident99 Ų9996.9 Ų96.952%0.51852%0.522SS..Hα-helixtrans-64.6-40.1171.6-70.8169.7000111.9E653 V654 L660 A661E653-L657 HydrophobicContact CG-CD1 4.49Å; E653-L657 WeakPolarHBondContact O-CB 3.4Å; E653-L657 WeakPolarHBondContact O-CG 3.35Å; E653-L657 PolarHBondContact O-N 3.37Å; V654-L657 PolarHBondContact O-N 2.89Å; L657-L660 PolarHBondContact O-N 3.15Å; L657-A661 WeakPolarHBondContact O-CB 3.41Å; L657-A661 PolarHBondContact O-N 2.95Å
658Q79.4Confident81.9Confident110 Ų11094.8 Ų94.851%0.51452%0.519SS..Hα-helixtrans-64.5-39.7174.7-175.664.671.800112.1V654 Q655 N662V654-Q658 WeakPolarHBondContact O-CB 3.47Å; V654-Q658 PolarHBondContact O-N 3.4Å; Q655-Q658 PolarHBondContact O-N 3.49Å; Q658-N662 PolarHBondContact NE2-OD1 3.25Å; Q658-N662 PolarHBondContact O-N 2.98Å; Q658-N662 PolarHBondContact O-ND2 3.24Å; Q658-N662 PolarHBondContact O-OD1 3.46Å
659A80.5Confident81.5Confident57 Ų5793.1 Ų93.147%0.47151%0.513SS..Hα-helixtrans-63.6-44.9174.500000111.5Q655 K656 N662 E663Q655-A659 WeakPolarHBondContact O-CB 3.5Å; Q655-A659 PolarHBondContact O-N 2.92Å; K656-A659 PolarHBondContact O-N 2.92Å; A659-N662 WeakPolarHBondContact O-CB 3.46Å; A659-N662 PolarHBondContact O-N 3.31Å; A659-E663 PolarHBondContact O-N 2.94Å
660L82.6Confident81.2Confident98 Ų9892.1 Ų92.151%0.51351%0.505SS..Hα-helixtrans-66.9-36.4179.1-165.3146.9000112.1K656 L657 E663 Q664K656-L660 WeakPolarHBondContact O-CB 3.41Å; K656-L660 PolarHBondContact O-N 2.62Å; L657-L660 PolarHBondContact O-N 3.15Å; L660-E663 PolarHBondContact O-N 2.87Å; L660-Q664 WeakPolarHBondContact O-CB 3.35Å; L660-Q664 PolarHBondContact O-N 3.19Å
661A79.1Confident81Confident46 Ų4690.2 Ų90.238%0.3850%0.498SS..Hα-helixtrans-64.8-38.7171.400000112.4L657 Q664 A665L657-A661 WeakPolarHBondContact O-CB 3.41Å; L657-A661 PolarHBondContact O-N 2.95Å; A661-Q664 PolarHBondContact O-N 2.83Å; A661-A665 PolarHBondContact O-N 3.18Å
662N79.3Confident80.8Confident96 Ų9688.6 Ų88.651%0.51349%0.493SS..Hα-helixtrans-67.1-38.1175.1-65.5-7.5000111.6Q658 A659 A665 A666Q658-N662 PolarHBondContact NE2-OD1 3.25Å; Q658-N662 PolarHBondContact O-N 2.98Å; Q658-N662 PolarHBondContact O-ND2 3.24Å; Q658-N662 PolarHBondContact O-OD1 3.46Å; A659-N662 WeakPolarHBondContact O-CB 3.46Å; A659-N662 PolarHBondContact O-N 3.31Å; N662-A665 PolarHBondContact O-N 2.77Å; N662-A666 WeakPolarHBondContact O-CB 3.38Å; N662-A666 PolarHBondContact O-N 2.78Å
663E83.8Confident80.7Confident133 Ų13391.7 Ų91.762%0.62150%0.498SS*.Hα-helixtrans-67.8-38.1174.2-172.4171.9-166.300111.9A659 L660 A666 T667A659-E663 PolarHBondContact O-N 2.94Å; L660-E663 PolarHBondContact O-N 2.87Å; E663-A666 PolarHBondContact O-N 3.03Å; E663-T667 WeakPolarHBondContact O-CG2 3.46Å; E663-T667 PolarHBondContact O-N 3.4Å; E663-T667 PolarHBondContact O-OG1 3.32Å
664Q76.6Confident80.5Confident128 Ų12892.6 Ų92.660%0.59850%0.504SS*.Hα-helixtrans-65.2-37.6172.8-167.9171.60.100112.1L660 A661 T667 A668L660-Q664 WeakPolarHBondContact O-CB 3.35Å; L660-Q664 PolarHBondContact O-N 3.19Å; A661-Q664 PolarHBondContact O-N 2.83Å; Q664-T667 WeakPolarHBondContact CA-OG1 3.25Å; Q664-T667 PolarHBondContact O-OG1 3.17Å; Q664-T667 VanDerWaalsContact O-OG1 3.08Å; Q664-A668 VanDerWaalsContact O-CB 3.27Å; Q664-A668 WeakPolarHBondContact O-CB 3.41Å; Q664-A668 PolarHBondContact O-N 3.02Å
665A77.8Confident80.3Confident61 Ų6193.5 Ų93.550%0.50450%0.502SS..Hα-helixtrans-67.6-40.7172.800000112.5A661 N662 A668 H669A661-A665 PolarHBondContact O-N 3.18Å; N662-A665 PolarHBondContact O-N 2.77Å; A665-A668 PolarHBondContact O-N 3.32Å; A665-H669 PolarHBondContact O-N 2.86Å
666A79.8Confident80.3Confident61 Ų6192.9 Ų92.950%0.50450%0.497SS..Hα-helixtrans-65.5-42.7177.100000112.3N662 E663 H669 E670N662-A666 WeakPolarHBondContact O-CB 3.38Å; N662-A666 PolarHBondContact O-N 2.78Å; E663-A666 PolarHBondContact O-N 3.03Å; A666-H669 PolarHBondContact O-N 3.02Å; A666-E670 PolarHBondContact O-N 3.32Å; A666-E670 VanDerWaalsContact O-N 3.08Å
667T81.6Confident80.2Confident79 Ų7989.8 Ų89.849%0.48549%0.491SS..Hα-helixtrans-68.2-38.3175.447.80000112.1E663 Q664 H669 E670 V671E663-T667 WeakPolarHBondContact O-CG2 3.46Å; E663-T667 PolarHBondContact O-N 3.4Å; E663-T667 PolarHBondContact O-OG1 3.32Å; Q664-T667 WeakPolarHBondContact CA-OG1 3.25Å; Q664-T667 PolarHBondContact O-OG1 3.17Å; Q664-T667 VanDerWaalsContact O-OG1 3.08Å; T667-H669 PolarHBondContact O-N 3.06Å; T667-E670 PolarHBondContact O-N 3.24Å; T667-V671 WeakPolarHBondContact O-CG2 3.32Å; T667-V671 PolarHBondContact O-N 2.96Å
668A75.8Confident80.1Confident59 Ų5988.6 Ų88.649%0.48848%0.484SS..Hα-helixtrans-60.2-42.9172.500000112.6Q664 A665 V671 E672Q664-A668 VanDerWaalsContact O-CB 3.27Å; Q664-A668 WeakPolarHBondContact O-CB 3.41Å; Q664-A668 PolarHBondContact O-N 3.02Å; A665-A668 PolarHBondContact O-N 3.32Å; A668-V671 PolarHBondContact O-N 2.93Å; A668-E672 PolarHBondContact O-N 3.3Å
669H82.2Confident80.1Confident115 Ų11587.9 Ų87.953%0.53248%0.481SS..Hα-helixtrans-65.4-38.6176.1179.8-86.2000112.6A665 A666 T667 E672 K673A665-H669 PolarHBondContact O-N 2.86Å; A666-H669 PolarHBondContact O-N 3.02Å; T667-H669 PolarHBondContact O-N 3.06Å; H669-E672 PolarHBondContact O-N 2.84Å; H669-K673 WeakPolarHBondContact O-CB 3.38Å; H669-K673 PolarHBondContact O-N 3.42Å
670E79.7Confident80.3Confident85 Ų8590.1 Ų90.140%0.39749%0.488SS..Hα-helixtrans-70.4-33.1175.2-165.760.5-152.400111.9A666 T667 K673 M674A666-E670 PolarHBondContact O-N 3.32Å; A666-E670 VanDerWaalsContact O-N 3.08Å; T667-E670 PolarHBondContact O-N 3.24Å; E670-K673 PolarHBondContact O-N 3.47Å; E670-K673 IonicContact OE1-NZ 2.89Å; E670-K673 PolarHBondContact OE1-NZ 3.49Å; E670-K673 IonicContact OE2-NZ 2.68Å; E670-K673 PolarHBondContact OE2-NZ 2.94Å; E670-M674 WeakPolarHBondContact O-CG 3.28Å; E670-M674 PolarHBondContact O-N 2.99Å
671V77.4Confident80.3Confident79 Ų7991.4 Ų91.448%0.47949%0.489SS..Hα-helixtrans-64.3-44.5169168.80000111.3T667 A668 K673 M674 Q675T667-V671 WeakPolarHBondContact O-CG2 3.32Å; T667-V671 PolarHBondContact O-N 2.96Å; A668-V671 PolarHBondContact O-N 2.93Å; V671-K673 VanDerWaalsContact C-N 3.28Å; V671-K673 PolarHBondContact O-N 2.94Å; V671-M674 HydrophobicContact CG2-CE 3.96Å; V671-M674 CarbonylContact O-C 3.57Å; V671-M674 PolarHBondContact O-N 3.48Å; V671-M674 VanDerWaalsContact O-N 3.15Å; V671-Q675 WeakPolarHBondContact O-CB 3.34Å; V671-Q675 PolarHBondContact O-N 3.37Å
672E81.1Confident80.4Confident94 Ų9493.9 Ų93.944%0.43949%0.493SS..Hα-helixtrans-61.3-38.1175.9-162-158.5171.500111.8A668 H669 Q675 K676A668-E672 PolarHBondContact O-N 3.3Å; H669-E672 PolarHBondContact O-N 2.84Å; E672-Q675 WeakPolarHBondContact O-CB 3.29Å; E672-Q675 PolarHBondContact O-N 2.68Å; E672-K676 WeakPolarHBondContact O-CG 3.32Å; E672-K676 PolarHBondContact O-N 2.86Å; E672-K676 WeakPolarHBondContact OE1-CE 3.41Å; E672-K676 IonicContact OE1-NZ 2.69Å; E672-K676 PolarHBondContact OE1-NZ 2.84Å; E672-K676 IonicContact OE2-NZ 2.57Å
673K82.4Confident80.7Confident108 Ų10893.2 Ų93.247%0.4749%0.49SS..Hα-helixtrans-66.8-38.4174173.4165.3160.2-105.70112.4H669 E670 V671 S677H669-K673 WeakPolarHBondContact O-CB 3.38Å; H669-K673 PolarHBondContact O-N 3.42Å; E670-K673 PolarHBondContact O-N 3.47Å; E670-K673 IonicContact OE1-NZ 2.89Å; E670-K673 PolarHBondContact OE1-NZ 3.49Å; E670-K673 IonicContact OE2-NZ 2.68Å; E670-K673 PolarHBondContact OE2-NZ 2.94Å; V671-K673 VanDerWaalsContact C-N 3.28Å; V671-K673 PolarHBondContact O-N 2.94Å; K673-S677 PolarHBondContact O-N 3.13Å
674M80.5Confident80.9Confident100 Ų10093.5 Ų93.549%0.49349%0.489SS..Hα-helixtrans-66.6-43.4169.8-72.8-171.7-67.600111.9E670 V671 K676 S677 I678E670-M674 WeakPolarHBondContact O-CG 3.28Å; E670-M674 PolarHBondContact O-N 2.99Å; V671-M674 HydrophobicContact CG2-CE 3.96Å; V671-M674 CarbonylContact O-C 3.57Å; V671-M674 PolarHBondContact O-N 3.48Å; V671-M674 VanDerWaalsContact O-N 3.15Å; M674-K676 PolarHBondContact O-N 3.35Å; M674-S677 CarbonylContact O-C 3.58Å; M674-S677 WeakPolarHBondContact O-CA 3.18Å; M674-S677 WeakPolarHBondContact O-CB 3.33Å; M674-S677 PolarHBondContact O-N 2.66Å; M674-I678 WeakPolarHBondContact O-CG1 3.29Å; M674-I678 PolarHBondContact O-N 3.25Å
675Q76.2Confident81.2Confident106 Ų10691.7 Ų91.750%0.49548%0.482SS..Hα-helixtrans-55.1-48.9176.3-164.681.9-1.700110.9V671 E672 S677 I678 H679V671-Q675 WeakPolarHBondContact O-CB 3.34Å; V671-Q675 PolarHBondContact O-N 3.37Å; E672-Q675 WeakPolarHBondContact O-CB 3.29Å; E672-Q675 PolarHBondContact O-N 2.68Å; Q675-S677 PolarHBondContact O-N 2.93Å; Q675-I678 WeakPolarHBondContact O-CB 3.3Å; Q675-I678 PolarHBondContact O-N 3.48Å; Q675-I678 VanDerWaalsContact O-N 3.17Å; Q675-H679 PolarHBondContact O-N 3.01Å; Q675-H679 PolarHBondContact O-ND1 3.21Å
676K81.3Confident81.6Confident117 Ų11795.3 Ų95.351%0.50948%0.483SS..Hα-helixtrans-63.1-38.4175.1-71167.7-175.11690112.3E672 M674 I678 V680E672-K676 WeakPolarHBondContact O-CG 3.32Å; E672-K676 PolarHBondContact O-N 2.86Å; E672-K676 WeakPolarHBondContact OE1-CE 3.41Å; E672-K676 IonicContact OE1-NZ 2.69Å; E672-K676 PolarHBondContact OE1-NZ 2.84Å; E672-K676 IonicContact OE2-NZ 2.57Å; M674-K676 PolarHBondContact O-N 3.35Å; K676-I678 VanDerWaalsContact C-N 3.32Å; K676-I678 PolarHBondContact O-N 2.96Å; K676-V680 WeakPolarHBondContact O-CG2 3.42Å; K676-V680 PolarHBondContact O-N 2.78Å; K676-V680 VanDerWaalsContact O-N 3.11Å
677S83.8Confident81.9Confident54 Ų5496.7 Ų96.738%0.37848%0.482SS..Hα-helixtrans-67.2-31.2173.9-174.10000113K673 M674 Q675 K681K673-S677 PolarHBondContact O-N 3.13Å; M674-S677 CarbonylContact O-C 3.58Å; M674-S677 WeakPolarHBondContact O-CA 3.18Å; M674-S677 WeakPolarHBondContact O-CB 3.33Å; M674-S677 PolarHBondContact O-N 2.66Å; Q675-S677 PolarHBondContact O-N 2.93Å; S677-K681 WeakPolarHBondContact O-CD 3.27Å; S677-K681 VanDerWaalsContact O-CG 3.23Å; S677-K681 WeakPolarHBondContact O-CG 3.26Å; S677-K681 PolarHBondContact O-N 2.94Å; S677-K681 PolarHBondContact OG-NZ 3.26Å
678I81.6Confident82.1Confident74 Ų7497.4 Ų97.438%0.37948%0.482SS..Hα-helixtrans-70.6-49.4175-71.3163.1000109.8M674 Q675 K676 V680 K681 E682M674-I678 WeakPolarHBondContact O-CG1 3.29Å; M674-I678 PolarHBondContact O-N 3.25Å; Q675-I678 WeakPolarHBondContact O-CB 3.3Å; Q675-I678 PolarHBondContact O-N 3.48Å; Q675-I678 VanDerWaalsContact O-N 3.17Å; K676-I678 VanDerWaalsContact C-N 3.32Å; K676-I678 PolarHBondContact O-N 2.96Å; I678-V680 VanDerWaalsContact C-N 3.33Å; I678-V680 PolarHBondContact O-N 3.19Å; I678-K681 CarbonylContact O-C 3.58Å; I678-K681 WeakPolarHBondContact O-CA 3.41Å; I678-K681 WeakPolarHBondContact O-CB 3.43Å; I678-K681 PolarHBondContact O-N 3.04Å; I678-E682 VanDerWaalsContact CG2-CD 3.49Å; I678-E682 HydrophobicContact CG2-CG 4.21Å; I678-E682 WeakPolarHBondContact CG2-OE2 3.48Å; I678-E682 WeakPolarHBondContact O-CG 3.24Å; I678-E682 PolarHBondContact O-N 2.81Å
679H79Confident82.4Confident96 Ų9699.7 Ų99.744%0.44448%0.482SS..Hα-helixtrans-57.1-44.6177.3-73.354.7000111.9Q675 K681 E682 D683Q675-H679 PolarHBondContact O-N 3.01Å; Q675-H679 PolarHBondContact O-ND1 3.21Å; H679-K681 PolarHBondContact O-N 2.96Å; H679-E682 PolarHBondContact O-N 3.31Å; H679-E682 VanDerWaalsContact O-N 3.16Å; H679-D683 PolarHBondContact O-N 3.33Å
680V85.1Confident82.5Confident104 Ų10499.5 Ų99.563%0.6348%0.482SS*.Hα-helixtrans-64.7-26.5176.1171.50000112.9K676 I678 K684K676-V680 WeakPolarHBondContact O-CG2 3.42Å; K676-V680 PolarHBondContact O-N 2.78Å; K676-V680 VanDerWaalsContact O-N 3.11Å; I678-V680 VanDerWaalsContact C-N 3.33Å; I678-V680 PolarHBondContact O-N 3.19Å; V680-K684 WeakPolarHBondContact O-CB 3.33Å; V680-K684 PolarHBondContact O-N 2.92Å
681K83.4Confident82.7Confident124 Ų124100.9 Ų100.954%0.53949%0.488SS..Hα-helixtrans-78.4-40.3171.7-72.8164.1-173.8165.40111.5S677 I678 H679 K684 I685S677-K681 WeakPolarHBondContact O-CD 3.27Å; S677-K681 VanDerWaalsContact O-CG 3.23Å; S677-K681 WeakPolarHBondContact O-CG 3.26Å; S677-K681 PolarHBondContact O-N 2.94Å; S677-K681 PolarHBondContact OG-NZ 3.26Å; I678-K681 CarbonylContact O-C 3.58Å; I678-K681 WeakPolarHBondContact O-CA 3.41Å; I678-K681 WeakPolarHBondContact O-CB 3.43Å; I678-K681 PolarHBondContact O-N 3.04Å; H679-K681 PolarHBondContact O-N 2.96Å; K681-K684 CarbonylContact O-C 3.59Å; K681-K684 PolarHBondContact O-N 2.86Å; K681-I685 WeakPolarHBondContact O-CB 3.38Å; K681-I685 VanDerWaalsContact O-CG1 3.25Å; K681-I685 WeakPolarHBondContact O-CG1 3.43Å; K681-I685 PolarHBondContact O-N 3.3Å
682E80.9Confident83.1Confident98 Ų98102.2 Ų102.246%0.45849%0.492SS..Hα-helixtrans-65.7-42.7178.2-70.6167.2149.500111.4I678 H679 K684 I685 R686I678-E682 VanDerWaalsContact CG2-CD 3.49Å; I678-E682 HydrophobicContact CG2-CG 4.21Å; I678-E682 WeakPolarHBondContact CG2-OE2 3.48Å; I678-E682 WeakPolarHBondContact O-CG 3.24Å; I678-E682 PolarHBondContact O-N 2.81Å; H679-E682 PolarHBondContact O-N 3.31Å; H679-E682 VanDerWaalsContact O-N 3.16Å; E682-K684 VanDerWaalsContact C-N 3.3Å; E682-K684 PolarHBondContact O-N 2.87Å; E682-I685 PolarHBondContact O-N 3Å; E682-R686 WeakPolarHBondContact O-CB 3.49Å; E682-R686 PolarHBondContact O-N 3.01Å
683D84.5Confident83Confident83 Ų83104.9 Ų104.944%0.44451%0.505SS..Hα-helixtrans-64.1-34.9172.3-71.7-24.4000112.3H679 R686 L687H679-D683 PolarHBondContact O-N 3.33Å; D683-R686 IonicContact OD1-CZ 2.62Å; D683-R686 IonicContact OD1-NE 3.4Å; D683-R686 IonicContact OD1-NH2 2.78Å; D683-R686 PolarHBondContact OD1-NH2 3.35Å; D683-L687 WeakPolarHBondContact O-CB 3.32Å; D683-L687 PolarHBondContact O-N 3Å
684K88.9Confident82.9Confident139 Ų139106.5 Ų106.560%0.60451%0.514SS*.Hα-helixtrans-73.2-33.8174-171.8170.4-177.3176.50112.6V680 K681 E682 L688V680-K684 WeakPolarHBondContact O-CB 3.33Å; V680-K684 PolarHBondContact O-N 2.92Å; K681-K684 CarbonylContact O-C 3.59Å; K681-K684 PolarHBondContact O-N 2.86Å; E682-K684 VanDerWaalsContact C-N 3.3Å; E682-K684 PolarHBondContact O-N 2.87Å; K684-L688 HydrophobicContact CG-CD1 4.28Å; K684-L688 WeakPolarHBondContact O-CB 3.41Å; K684-L688 WeakPolarHBondContact O-CD1 3.37Å; K684-L688 VanDerWaalsContact O-CG 3.23Å; K684-L688 WeakPolarHBondContact O-CG 3.42Å; K684-L688 PolarHBondContact O-N 3.44Å
685I82.6Confident83.1Confident89 Ų89107.1 Ų107.146%0.45652%0.515SS..Hα-helixtrans-64.5-50171.6-73.5161.3000108.8K681 E682 L687 L688 E689K681-I685 WeakPolarHBondContact O-CB 3.38Å; K681-I685 VanDerWaalsContact O-CG1 3.25Å; K681-I685 WeakPolarHBondContact O-CG1 3.43Å; K681-I685 PolarHBondContact O-N 3.3Å; E682-I685 PolarHBondContact O-N 3Å; I685-L687 VanDerWaalsContact C-N 3.33Å; I685-L687 PolarHBondContact O-N 2.81Å; I685-L688 CarbonylContact O-C 3.59Å; I685-L688 WeakPolarHBondContact O-CA 3.24Å; I685-L688 WeakPolarHBondContact O-CB 3.4Å; I685-L688 PolarHBondContact O-N 2.77Å; I685-E689 HydrophobicContact CG2-CG 4.22Å; I685-E689 WeakPolarHBondContact O-CG 3.42Å; I685-E689 PolarHBondContact O-N 2.73Å
686R86.7Confident83.3Confident137 Ų137105.9 Ų105.952%0.51752%0.515SS..Hα-helixtrans-53.5-47175.7-163-161.3-43.5-133.16.6112.2E682 D683 L688 E689 E690E682-R686 WeakPolarHBondContact O-CB 3.49Å; E682-R686 PolarHBondContact O-N 3.01Å; D683-R686 IonicContact OD1-CZ 2.62Å; D683-R686 IonicContact OD1-NE 3.4Å; D683-R686 IonicContact OD1-NH2 2.78Å; D683-R686 PolarHBondContact OD1-NH2 3.35Å; R686-L688 VanDerWaalsContact C-N 3.34Å; R686-L688 PolarHBondContact O-N 3.45Å; R686-E689 PolarHBondContact O-N 3Å; R686-E690 WeakPolarHBondContact O-CG 3.39Å; R686-E690 PolarHBondContact O-N 2.91Å
687L84.4Confident83.2Confident91 Ų91103.1 Ų103.148%0.47651%0.514SS..Hα-helixtrans-65.2-35.6176.7-173.667.2000112.6D683 I685 Q691D683-L687 WeakPolarHBondContact O-CB 3.32Å; D683-L687 PolarHBondContact O-N 3Å; I685-L687 VanDerWaalsContact C-N 3.33Å; I685-L687 PolarHBondContact O-N 2.81Å; L687-Q691 WeakPolarHBondContact O-CB 3.22Å; L687-Q691 VanDerWaalsContact O-CG 3.27Å; L687-Q691 WeakPolarHBondContact O-CG 3.45Å; L687-Q691 PolarHBondContact O-N 3.48Å
688L86.9Confident83.2Confident93 Ų93103.2 Ų103.249%0.48751%0.514SS..Hα-helixtrans-72-32.3173.9-73.7167.6000112.1K684 I685 R686 L692K684-L688 HydrophobicContact CG-CD1 4.28Å; K684-L688 WeakPolarHBondContact O-CB 3.41Å; K684-L688 WeakPolarHBondContact O-CD1 3.37Å; K684-L688 VanDerWaalsContact O-CG 3.23Å; K684-L688 WeakPolarHBondContact O-CG 3.42Å; K684-L688 PolarHBondContact O-N 3.44Å; I685-L688 CarbonylContact O-C 3.59Å; I685-L688 WeakPolarHBondContact O-CA 3.24Å; I685-L688 WeakPolarHBondContact O-CB 3.4Å; I685-L688 PolarHBondContact O-N 2.77Å; R686-L688 VanDerWaalsContact C-N 3.34Å; R686-L688 PolarHBondContact O-N 3.45Å; L688-L692 WeakPolarHBondContact O-CB 3.46Å; L688-L692 PolarHBondContact O-N 3.38Å
689E81.4Confident83.3Confident107 Ų107103.9 Ų103.950%0.552%0.515SS..Hα-helixtrans-70.4-40.9173.3-72173.2157.300111.3I685 R686 L692 Q693I685-E689 HydrophobicContact CG2-CG 4.22Å; I685-E689 WeakPolarHBondContact O-CG 3.42Å; I685-E689 PolarHBondContact O-N 2.73Å; R686-E689 PolarHBondContact O-N 3Å; E689-L692 PolarHBondContact O-N 2.9Å; E689-Q693 WeakPolarHBondContact O-CB 3.32Å; E689-Q693 WeakPolarHBondContact O-CG 3.4Å; E689-Q693 PolarHBondContact O-N 2.87Å
690E84.8Confident83.2Confident111 Ų111105.4 Ų105.452%0.51952%0.524SS..Hα-helixtrans-63.1-44.8171.7-73.9170.6-165.400111.5R686 Q693 H694R686-E690 WeakPolarHBondContact O-CG 3.39Å; R686-E690 PolarHBondContact O-N 2.91Å; E690-Q693 PolarHBondContact O-N 3.32Å; E690-H694 WeakPolarHBondContact O-CB 3.43Å; E690-H694 PolarHBondContact O-N 2.85Å
691Q84.7Confident83Confident114 Ų114104.7 Ų104.753%0.53351%0.513SS..Hα-helixtrans-62.1-43173.1-77.5179.5-1200111.8L687 H694 E695L687-Q691 WeakPolarHBondContact O-CB 3.22Å; L687-Q691 VanDerWaalsContact O-CG 3.27Å; L687-Q691 WeakPolarHBondContact O-CG 3.45Å; L687-Q691 PolarHBondContact O-N 3.48Å; Q691-H694 PolarHBondContact O-N 3.4Å; Q691-E695 WeakPolarHBondContact O-CB 3.4Å; Q691-E695 PolarHBondContact O-N 3.29Å
692L84.8Confident82.8Confident108 Ų108102.4 Ų102.457%0.56550%0.504SS*.Hα-helixtrans-66.8-37.5177.3-176.863.4000111.7L688 E689 E695 V696L688-L692 WeakPolarHBondContact O-CB 3.46Å; L688-L692 PolarHBondContact O-N 3.38Å; E689-L692 PolarHBondContact O-N 2.9Å; L692-E695 PolarHBondContact O-N 2.81Å; L692-V696 HydrophobicContact CD1-CG2 4.27Å; L692-V696 HydrophobicContact CG-CG2 4.4Å; L692-V696 VanDerWaalsContact O-CB 3.25Å; L692-V696 WeakPolarHBondContact O-CB 3.46Å; L692-V696 WeakPolarHBondContact O-CG2 3.37Å; L692-V696 PolarHBondContact O-N 3.41Å
693Q78.8Confident82.8Confident150 Ų150103.3 Ų103.370%0.70151%0.512SS*.Hα-helixtrans-66.3-41.1173-76.7-169.22900111.8E689 E690 V696 A697E689-Q693 WeakPolarHBondContact O-CB 3.32Å; E689-Q693 WeakPolarHBondContact O-CG 3.4Å; E689-Q693 PolarHBondContact O-N 2.87Å; E690-Q693 PolarHBondContact O-N 3.32Å; Q693-V696 PolarHBondContact O-N 3.31Å; Q693-A697 WeakPolarHBondContact O-CB 3.15Å; Q693-A697 PolarHBondContact O-N 2.86Å
694H80.6Confident82.5Confident142 Ų142104 Ų10466%0.65751%0.511SS*.Hα-helixtrans-65.1-41174.6-172.1-67.1000111.8E690 Q691 A697 S698E690-H694 WeakPolarHBondContact O-CB 3.43Å; E690-H694 PolarHBondContact O-N 2.85Å; Q691-H694 PolarHBondContact O-N 3.4Å; H694-A697 PolarHBondContact O-N 2.88Å; H694-S698 WeakPolarHBondContact O-CB 3.3Å; H694-S698 PolarHBondContact O-N 2.96Å
695E84.1Confident82.1Confident112 Ų112101.2 Ų101.252%0.52350%0.502SS..Hα-helixtrans-69.8-39.4176-173.4161.3-161.400111.7Q691 L692 A697 S698 K699Q691-E695 WeakPolarHBondContact O-CB 3.4Å; Q691-E695 PolarHBondContact O-N 3.29Å; L692-E695 PolarHBondContact O-N 2.81Å; E695-A697 VanDerWaalsContact C-N 3.33Å; E695-A697 PolarHBondContact O-N 2.86Å; E695-S698 PolarHBondContact O-N 2.85Å; E695-K699 HydrophobicContact CG-CG 4.14Å; E695-K699 VanDerWaalsContact O-CB 3.29Å; E695-K699 WeakPolarHBondContact O-CB 3.26Å; E695-K699 WeakPolarHBondContact O-CG 3.35Å; E695-K699 PolarHBondContact O-N 3.46Å
696V81.6Confident82.1Confident80 Ų80100.6 Ų100.649%0.48550%0.499SS..Hα-helixtrans-62.2-38.9171.9165.90000111.3L692 Q693 K699 M700L692-V696 HydrophobicContact CD1-CG2 4.27Å; L692-V696 HydrophobicContact CG-CG2 4.4Å; L692-V696 VanDerWaalsContact O-CB 3.25Å; L692-V696 WeakPolarHBondContact O-CB 3.46Å; L692-V696 WeakPolarHBondContact O-CG2 3.37Å; L692-V696 PolarHBondContact O-N 3.41Å; Q693-V696 PolarHBondContact O-N 3.31Å; V696-K699 PolarHBondContact O-N 2.97Å; V696-M700 VanDerWaalsContact O-CB 3.24Å; V696-M700 WeakPolarHBondContact O-CB 3.37Å; V696-M700 PolarHBondContact O-N 2.88Å
697A79.6Confident81.7Confident60 Ų6097 Ų9750%0.49650%0.495SS..Hα-helixtrans-66-45.217400000111.8Q693 H694 E695 K699 M700 E701Q693-A697 WeakPolarHBondContact O-CB 3.15Å; Q693-A697 PolarHBondContact O-N 2.86Å; H694-A697 PolarHBondContact O-N 2.88Å; E695-A697 VanDerWaalsContact C-N 3.33Å; E695-A697 PolarHBondContact O-N 2.86Å; A697-K699 VanDerWaalsContact C-N 3.34Å; A697-K699 PolarHBondContact O-N 2.95Å; A697-M700 PolarHBondContact O-N 2.96Å; A697-E701 PolarHBondContact O-N 3.45Å
698S83.2Confident81.4Confident55 Ų5598.5 Ų98.539%0.38550%0.499SS..Hα-helixtrans-60.3-43.5174.1-1690000111.6H694 E695 E701 E702H694-S698 WeakPolarHBondContact O-CB 3.3Å; H694-S698 PolarHBondContact O-N 2.96Å; E695-S698 PolarHBondContact O-N 2.85Å; S698-E701 PolarHBondContact O-N 3.3Å; S698-E702 WeakPolarHBondContact O-CB 3.44Å; S698-E702 WeakPolarHBondContact O-CG 3.43Å; S698-E702 PolarHBondContact O-N 2.87Å
699K83.8Confident81.1Confident89 Ų8998.7 Ų98.739%0.38750%0.498SS..Hα-helixtrans-71.6-27.5177.3-67.1-66.5170-135.90112.6E695 V696 A697 E702 L703E695-K699 HydrophobicContact CG-CG 4.14Å; E695-K699 VanDerWaalsContact O-CB 3.29Å; E695-K699 WeakPolarHBondContact O-CB 3.26Å; E695-K699 WeakPolarHBondContact O-CG 3.35Å; E695-K699 PolarHBondContact O-N 3.46Å; V696-K699 PolarHBondContact O-N 2.97Å; A697-K699 VanDerWaalsContact C-N 3.34Å; A697-K699 PolarHBondContact O-N 2.95Å; K699-E702 WeakPolarHBondContact CD-OE2 3.37Å; K699-E702 IonicContact NZ-OE1 2.78Å; K699-E702 PolarHBondContact NZ-OE1 3.08Å; K699-E702 IonicContact NZ-OE2 2.63Å; K699-E702 PolarHBondContact NZ-OE2 3.39Å; K699-L703 WeakPolarHBondContact O-CB 3.48Å; K699-L703 WeakPolarHBondContact O-CD1 3.3Å; K699-L703 WeakPolarHBondContact O-CG 3.36Å; K699-L703 PolarHBondContact O-N 3.43Å
700M76.4Confident80.9Confident128 Ų12897.7 Ų97.763%0.63150%0.496SS*.Hα-helixtrans-69.9-40.6171.5-174.2175-67.700111.4V696 A697 L703 K704V696-M700 VanDerWaalsContact O-CB 3.24Å; V696-M700 WeakPolarHBondContact O-CB 3.37Å; V696-M700 PolarHBondContact O-N 2.88Å; A697-M700 PolarHBondContact O-N 2.96Å; M700-L703 PolarHBondContact O-N 2.66Å; M700-K704 WeakPolarHBondContact O-CB 3.37Å; M700-K704 PolarHBondContact O-N 3.33Å
701E79.9Confident80.5Confident89 Ų8999.3 Ų99.342%0.41650%0.501SS..Hα-helixtrans-73-37.9175.3-165.261.6-158.400111.7A697 S698 L703 K704 I705A697-E701 PolarHBondContact O-N 3.45Å; S698-E701 PolarHBondContact O-N 3.3Å; E701-L703 PolarHBondContact O-N 2.85Å; E701-K704 WeakPolarHBondContact O-CB 3.4Å; E701-K704 PolarHBondContact O-N 2.88Å; E701-K704 IonicContact OE1-NZ 2.83Å; E701-K704 PolarHBondContact OE1-NZ 3.27Å; E701-K704 IonicContact OE2-NZ 2.62Å; E701-K704 PolarHBondContact OE2-NZ 3.47Å; E701-I705 WeakPolarHBondContact O-CG1 3.3Å; E701-I705 PolarHBondContact O-N 3.33Å
702E79.8Confident79.9Confident75 Ų7596.5 Ų96.535%0.3550%0.497SS..Hα-helixtrans-58.4-44.7167-77.2173.6-131.800111.6S698 K699 K704 I705 L706S698-E702 WeakPolarHBondContact O-CB 3.44Å; S698-E702 WeakPolarHBondContact O-CG 3.43Å; S698-E702 PolarHBondContact O-N 2.87Å; K699-E702 WeakPolarHBondContact CD-OE2 3.37Å; K699-E702 IonicContact NZ-OE1 2.78Å; K699-E702 PolarHBondContact NZ-OE1 3.08Å; K699-E702 IonicContact NZ-OE2 2.63Å; K699-E702 PolarHBondContact NZ-OE2 3.39Å; E702-K704 VanDerWaalsContact C-N 3.28Å; E702-K704 PolarHBondContact O-N 3.11Å; E702-I705 PolarHBondContact O-N 2.96Å; E702-L706 VanDerWaalsContact O-CB 3.24Å; E702-L706 WeakPolarHBondContact O-CB 3.48Å; E702-L706 VanDerWaalsContact O-CG 3.23Å; E702-L706 WeakPolarHBondContact O-CG 3.41Å; E702-L706 PolarHBondContact O-N 3.26Å
703L80.4Confident79.4Confident117 Ų11795.4 Ų95.461%0.61349%0.492SS*.Hα-helixtrans-65.4-30.1176.1-81.6168.9000112.6K699 M700 E701 L706 S707K699-L703 WeakPolarHBondContact O-CB 3.48Å; K699-L703 WeakPolarHBondContact O-CD1 3.3Å; K699-L703 WeakPolarHBondContact O-CG 3.36Å; K699-L703 PolarHBondContact O-N 3.43Å; M700-L703 PolarHBondContact O-N 2.66Å; E701-L703 PolarHBondContact O-N 2.85Å; L703-L706 CarbonylContact O-C 3.57Å; L703-S707 WeakPolarHBondContact O-CB 3.14Å; L703-S707 PolarHBondContact O-N 2.73Å
704K79.2Confident79.1Confident98 Ų9894.5 Ų94.543%0.42649%0.487SS..Hα-helixtrans-72.2-46.2174.9175.7160.4150.9-95.60111.2M700 E701 E702 L706 S707 E708M700-K704 WeakPolarHBondContact O-CB 3.37Å; M700-K704 PolarHBondContact O-N 3.33Å; E701-K704 WeakPolarHBondContact O-CB 3.4Å; E701-K704 PolarHBondContact O-N 2.88Å; E701-K704 IonicContact OE1-NZ 2.83Å; E701-K704 PolarHBondContact OE1-NZ 3.27Å; E701-K704 IonicContact OE2-NZ 2.62Å; E701-K704 PolarHBondContact OE2-NZ 3.47Å; E702-K704 VanDerWaalsContact C-N 3.28Å; E702-K704 PolarHBondContact O-N 3.11Å; K704-L706 VanDerWaalsContact C-N 3.34Å; K704-L706 PolarHBondContact O-N 3.47Å; K704-S707 WeakPolarHBondContact O-CB 3.35Å; K704-S707 PolarHBondContact O-N 3.23Å; K704-S707 VanDerWaalsContact O-N 3.09Å; K704-E708 PolarHBondContact O-N 2.96Å
705I81.3Confident78.4Confident80 Ų8090.5 Ų90.541%0.4148%0.476SS..Hα-helixtrans-59.4-45170.3-66.3163.9000110.5E701 E702 S707 E708 Q709E701-I705 WeakPolarHBondContact O-CG1 3.3Å; E701-I705 PolarHBondContact O-N 3.33Å; E702-I705 PolarHBondContact O-N 2.96Å; I705-S707 VanDerWaalsContact C-N 3.28Å; I705-S707 PolarHBondContact O-N 3.34Å; I705-E708 PolarHBondContact O-N 3.47Å; I705-Q709 WeakPolarHBondContact O-CB 3.39Å; I705-Q709 VanDerWaalsContact O-CG 3.3Å; I705-Q709 WeakPolarHBondContact O-CG 3.43Å; I705-Q709 PolarHBondContact O-N 2.87Å
706L82.4Confident77.7Confident77 Ų7789.9 Ų89.940%0.40347%0.473SS..Hα-helixtrans-67.4-25.1175.4-74.5167.5000112.7E702 L703 K704 N710E702-L706 VanDerWaalsContact O-CB 3.24Å; E702-L706 WeakPolarHBondContact O-CB 3.48Å; E702-L706 VanDerWaalsContact O-CG 3.23Å; E702-L706 WeakPolarHBondContact O-CG 3.41Å; E702-L706 PolarHBondContact O-N 3.26Å; L703-L706 CarbonylContact O-C 3.57Å; K704-L706 VanDerWaalsContact C-N 3.34Å; K704-L706 PolarHBondContact O-N 3.47Å; L706-N710 WeakPolarHBondContact O-CB 3.35Å; L706-N710 PolarHBondContact O-N 3.04Å; L706-N710 PolarHBondContact O-ND2 3.26Å
707S77.5Confident77Confident62 Ų6289.4 Ų89.443%0.43447%0.47SS..Hα-helixtrans-76-39.8174.1-175.30000111.3L703 K704 I705 N710 K711L703-S707 WeakPolarHBondContact O-CB 3.14Å; L703-S707 PolarHBondContact O-N 2.73Å; K704-S707 WeakPolarHBondContact O-CB 3.35Å; K704-S707 PolarHBondContact O-N 3.23Å; K704-S707 VanDerWaalsContact O-N 3.09Å; I705-S707 VanDerWaalsContact C-N 3.28Å; I705-S707 PolarHBondContact O-N 3.34Å; S707-N710 PolarHBondContact O-N 2.82Å; S707-K711 PolarHBondContact O-N 2.69Å
708E78.7Confident76.2Confident121 Ų12194 Ų9457%0.56548%0.481SS*.Hα-helixtrans-67.4-42.3172.4-69.5172.9-171.500111.1K704 I705 K711 A712K704-E708 PolarHBondContact O-N 2.96Å; I705-E708 PolarHBondContact O-N 3.47Å; E708-K711 PolarHBondContact O-N 3.35Å; E708-A712 PolarHBondContact O-N 2.79Å
709Q80.4Confident75Confident98 Ų9897.6 Ų97.646%0.45849%0.49SS..Hα-helixtrans-64.3-37.4169.6-71.1177.53.600112.3I705 K711 A712 L713I705-Q709 WeakPolarHBondContact O-CB 3.39Å; I705-Q709 VanDerWaalsContact O-CG 3.3Å; I705-Q709 WeakPolarHBondContact O-CG 3.43Å; I705-Q709 PolarHBondContact O-N 2.87Å; Q709-K711 VanDerWaalsContact C-N 3.34Å; Q709-A712 PolarHBondContact O-N 3.39Å; Q709-L713 VanDerWaalsContact O-CB 3.32Å; Q709-L713 WeakPolarHBondContact O-CB 3.31Å; Q709-L713 WeakPolarHBondContact O-CG 3.38Å; Q709-L713 PolarHBondContact O-N 3.24Å
710N76.5Confident73.7Confident85 Ų8598.5 Ų98.546%0.45550%0.498SS..Hα-helixtrans-70-27.9174.1-91.6-76.5000112.7L706 S707 Q714L706-N710 WeakPolarHBondContact O-CB 3.35Å; L706-N710 PolarHBondContact O-N 3.04Å; L706-N710 PolarHBondContact O-ND2 3.26Å; S707-N710 PolarHBondContact O-N 2.82Å; N710-Q714 WeakPolarHBondContact O-CB 3.31Å; N710-Q714 WeakPolarHBondContact O-CG 3.46Å; N710-Q714 PolarHBondContact O-N 3.13Å
711K76.9Confident72.5Confident145 Ų14599.7 Ų99.763%0.6350%0.502SS*.Hα-helixtrans-67.4-43.3168.3-77.6173.4177.7171.30111.4S707 E708 Q709 S715S707-K711 PolarHBondContact O-N 2.69Å; E708-K711 PolarHBondContact O-N 3.35Å; Q709-K711 VanDerWaalsContact C-N 3.34Å; K711-S715 PolarHBondContact O-N 2.79Å; K711-S715 VanDerWaalsContact O-N 3.11Å
712A71.2Confident71.1Confident55 Ų55101.1 Ų101.146%0.45552%0.517SS..Hα-helixtrans-61.7-50174.200000111.4E708 Q709 S715 E716E708-A712 PolarHBondContact O-N 2.79Å; Q709-A712 PolarHBondContact O-N 3.39Å; A712-S715 WeakPolarHBondContact O-CA 3.42Å; A712-S715 WeakPolarHBondContact O-CB 3.37Å; A712-S715 PolarHBondContact O-N 3.06Å; A712-S715 VanDerWaalsContact O-N 3.12Å; A712-S715 PolarHBondContact O-OG 3.45Å; A712-E716 PolarHBondContact O-N 2.87Å
713L75.4Confident69.7Low85 Ų85101.2 Ų101.245%0.44553%0.531SS..Hα-helixtrans-67.6-33.2178-73.1169.4000112.7Q709 S715 E716 V717Q709-L713 VanDerWaalsContact O-CB 3.32Å; Q709-L713 WeakPolarHBondContact O-CB 3.31Å; Q709-L713 WeakPolarHBondContact O-CG 3.38Å; Q709-L713 PolarHBondContact O-N 3.24Å; L713-S715 VanDerWaalsContact C-N 3.29Å; L713-S715 PolarHBondContact O-N 3.45Å; L713-E716 CarbonylContact O-C 3.54Å; L713-E716 WeakPolarHBondContact O-CA 3.32Å; L713-E716 PolarHBondContact O-N 2.96Å; L713-V717 WeakPolarHBondContact O-CB 3.32Å; L713-V717 WeakPolarHBondContact O-CG2 3.41Å; L713-V717 PolarHBondContact O-N 3.49Å
714Q72.4Confident68.1Low131 Ų131101.6 Ų101.661%0.61254%0.538SS*.Hα-helixtrans-63.4-38170.2-83.3-179-9.500110.9N710 E716 Q718N710-Q714 WeakPolarHBondContact O-CB 3.31Å; N710-Q714 WeakPolarHBondContact O-CG 3.46Å; N710-Q714 PolarHBondContact O-N 3.13Å; Q714-E716 PolarHBondContact O-N 3.07Å; Q714-E716 VanDerWaalsContact O-N 3.12Å; Q714-Q718 WeakPolarHBondContact O-CB 3.47Å; Q714-Q718 PolarHBondContact O-N 3.28Å
715S66Low66.5Low59 Ų59101.9 Ų101.941%0.41355%0.552SS.*Hα-helixtrans-66.8-7.6172.590.50000114K711 A712 L713 K719K711-S715 PolarHBondContact O-N 2.79Å; K711-S715 VanDerWaalsContact O-N 3.11Å; A712-S715 WeakPolarHBondContact O-CA 3.42Å; A712-S715 WeakPolarHBondContact O-CB 3.37Å; A712-S715 PolarHBondContact O-N 3.06Å; A712-S715 VanDerWaalsContact O-N 3.12Å; A712-S715 PolarHBondContact O-OG 3.45Å; L713-S715 VanDerWaalsContact C-N 3.29Å; L713-S715 PolarHBondContact O-N 3.45Å; S715-K719 WeakPolarHBondContact O-CD 3.42Å; S715-K719 WeakPolarHBondContact O-CE 3.23Å; S715-K719 WeakPolarHBondContact O-CG 3.38Å; S715-K719 PolarHBondContact O-NZ 3.36Å
716E69.9Low64.5Low98 Ų98106.6 Ų106.646%0.45857%0.573SS.*Hα-helixtrans-113.8-40.2-177.6-168.2151.2-116.900112A712 L713 Q714 Q718 K719 L720A712-E716 PolarHBondContact O-N 2.87Å; L713-E716 CarbonylContact O-C 3.54Å; L713-E716 WeakPolarHBondContact O-CA 3.32Å; L713-E716 PolarHBondContact O-N 2.96Å; Q714-E716 PolarHBondContact O-N 3.07Å; Q714-E716 VanDerWaalsContact O-N 3.12Å; E716-Q718 VanDerWaalsContact C-N 3.27Å; E716-Q718 PolarHBondContact O-N 2.86Å; E716-K719 CarbonylContact O-C 3.47Å; E716-K719 WeakPolarHBondContact O-CA 3.22Å; E716-K719 VanDerWaalsContact O-CB 3.3Å; E716-K719 WeakPolarHBondContact O-CB 3.46Å; E716-K719 PolarHBondContact O-N 3.19Å; E716-L720 HydrophobicContact CG-CD1 4.24Å; E716-L720 WeakPolarHBondContact O-CG 3.42Å; E716-L720 PolarHBondContact O-N 2.87Å
717V65.5Low62.3Low70 Ų70111.5 Ų111.542%0.42459%0.593SS.*Hα-helixtrans-61-36164.3174.50000110.3L713 K719 L720 Q721L713-V717 WeakPolarHBondContact O-CB 3.32Å; L713-V717 WeakPolarHBondContact O-CG2 3.41Å; L713-V717 PolarHBondContact O-N 3.49Å; V717-K719 PolarHBondContact O-N 2.61Å; V717-L720 PolarHBondContact O-N 3.12Å; V717-Q721 HydrophobicContact CG1-CB 4.28Å; V717-Q721 WeakPolarHBondContact O-CB 3.32Å; V717-Q721 PolarHBondContact O-N 2.75Å
718Q64.3Low61.3Low158 Ų158114.3 Ų114.374%0.73861%0.61SS**Hα-helixtrans-66.7-16.1171.8-164.3172.535.100113.2Q714 E716 T722Q714-Q718 WeakPolarHBondContact O-CB 3.47Å; Q714-Q718 PolarHBondContact O-N 3.28Å; E716-Q718 VanDerWaalsContact C-N 3.27Å; E716-Q718 PolarHBondContact O-N 2.86Å; Q718-T722 PolarHBondContact O-OG1 3.45Å
719K56.4Low59.6Low129 Ų129116.5 Ų116.556%0.56163%0.626SS**Hα-helixtrans-89.6-37.8168.7-55.6170.1-174.4119.60112S715 E716 V717 T722S715-K719 WeakPolarHBondContact O-CD 3.42Å; S715-K719 WeakPolarHBondContact O-CE 3.23Å; S715-K719 WeakPolarHBondContact O-CG 3.38Å; S715-K719 PolarHBondContact O-NZ 3.36Å; E716-K719 CarbonylContact O-C 3.47Å; E716-K719 WeakPolarHBondContact O-CA 3.22Å; E716-K719 VanDerWaalsContact O-CB 3.3Å; E716-K719 WeakPolarHBondContact O-CB 3.46Å; E716-K719 PolarHBondContact O-N 3.19Å; V717-K719 PolarHBondContact O-N 2.61Å; K719-T722 WeakPolarHBondContact O-CB 3.27Å; K719-T722 PolarHBondContact O-OG1 3.2Å
720L57.7Low57.7Low108 Ų108119.9 Ų119.957%0.56564%0.639SS**Hα-helixtrans-86.1-29.1-174.1-68.4170.7000114E716 V717 T722 A723E716-L720 HydrophobicContact CG-CD1 4.24Å; E716-L720 WeakPolarHBondContact O-CG 3.42Å; E716-L720 PolarHBondContact O-N 2.87Å; V717-L720 PolarHBondContact O-N 3.12Å; L720-T722 PolarHBondContact O-N 3.37Å; L720-A723 WeakPolarHBondContact O-CB 3.29Å; L720-A723 PolarHBondContact O-N 2.83Å
721Q51.4Low56Low153 Ų153123.2 Ų123.272%0.71566%0.657SS**THydrogen-bonded Turntrans-72.2-11.2175.4-165165.5500112V717 A723V717-Q721 HydrophobicContact CG1-CB 4.28Å; V717-Q721 WeakPolarHBondContact O-CB 3.32Å; V717-Q721 PolarHBondContact O-N 2.75Å; Q721-A723 PolarHBondContact O-N 3.32Å
722T50.2Low54.6Low119 Ų119122.6 Ų122.673%0.7367%0.665SS**THydrogen-bonded Turntrans-68.7-15.9163-36.40000112.8Q718 K719 L720Q718-T722 PolarHBondContact O-OG1 3.45Å; K719-T722 WeakPolarHBondContact O-CB 3.27Å; K719-T722 PolarHBondContact O-OG1 3.2Å; L720-T722 PolarHBondContact O-N 3.37Å
723A50.5Low53.7Low78 Ų78125.8 Ų125.865%0.64568%0.678SS**THydrogen-bonded Turntrans-116.3-20.9-164.800000116.5L720 Q721L720-A723 WeakPolarHBondContact O-CB 3.29Å; L720-A723 PolarHBondContact O-N 2.83Å; Q721-A723 PolarHBondContact O-N 3.32Å
724V46.9Very low52.6Low125 Ų125130.9 Ų130.976%0.75870%0.7SS**  trans-131.190.2-168.6-167.30000113.1
725S44.3Very low51.4Low103 Ų103133.2 Ų133.272%0.7271%0.711SS**  trans-131.391.2174.5168.90000111.3
726Q39.7Very low50.7Low180 Ų180137.5 Ų137.584%0.84173%0.726SS**  trans-167.2130.4167.8-110.814096.900116.1
727Q36.6Very low49.9Very low180 Ų180140.5 Ų140.584%0.84174%0.74SS**  trans69.7135.9144.7-86.9176.1-33.500125.7
728P56.6Low49.5Very low121 Ų121146.7 Ų146.779%0.78676%0.761SS**  trans-126.4178.9160.442.8-30.9000113.8
729N43.1Very low49.3Very low166 Ų166143 Ų14389%0.88875%0.752SS**  trans-161.4-178.4155.7-134.2-10.1000117.5
730K39.2Very low49.6Very low170 Ų170141.6 Ų141.674%0.73975%0.75SS**  trans-158.1133.5-160.2159.1-153.8174.8-166.60111.5
731D41.9Very low49.8Very low154 Ų154144.3 Ų144.382%0.82476%0.76SS**  trans-176.4109160.1-95.4-27.6000114.8
732V47.8Very low50.2Low132 Ų132144.5 Ų144.580%0.876%0.76SS**  trans-151.9-18.5170.9-173.70000114.5E734V732-E734 VanDerWaalsContact C-N 3.31Å; V732-E734 PolarHBondContact O-N 2.96Å; V732-E734 VanDerWaalsContact O-N 3.08Å
733V50.8Low51.2Low123 Ų123145.4 Ų145.475%0.74575%0.754SS**G310 helixtrans-65-22.5-157.6178.60000115.8Q735V733-Q735 VanDerWaalsContact C-N 3.33Å; V733-Q735 PolarHBondContact O-N 2.96Å
734E53.1Low52.1Low191 Ų191145.7 Ų145.789%0.89375%0.745SS**G310 helixtrans-76.4-5.9-162.4-151.2167-145.700115.8V732V732-E734 VanDerWaalsContact C-N 3.31Å; V732-E734 PolarHBondContact O-N 2.96Å; V732-E734 VanDerWaalsContact O-N 3.08Å
735Q47.3Very low53Low180 Ų180146.5 Ų146.584%0.84174%0.74SS**G310 helixtrans-83.1-20180-74.8-166.1-10.600115.3V733 E737V733-Q735 VanDerWaalsContact C-N 3.33Å; V733-Q735 PolarHBondContact O-N 2.96Å; Q735-E737 PolarHBondContact O-N 3.21Å
736M50.8Low54.1Low149 Ų149148.1 Ų148.173%0.73473%0.734SS**G310 helixtrans-75.6-27.7-163-168.9164.364.200114.4K738M736-K738 VanDerWaalsContact C-N 3.33Å; M736-K738 PolarHBondContact O-N 3.05Å
737E54.5Low55.7Low162 Ų162144 Ų14476%0.75772%0.718SS**G310 helixtrans-70.9-25.8-165-160.4157.6-140.100113.8Q735 C739Q735-E737 PolarHBondContact O-N 3.21Å; E737-C739 VanDerWaalsContact C-N 3.29Å; E737-C739 PolarHBondContact O-N 3.42Å
738K55.6Low57.4Low200 Ų200142.2 Ų142.287%0.8770%0.703SS**G310 helixtrans-78.5-6.7-175.3-149.2171.1-173.21750114.8M736M736-K738 VanDerWaalsContact C-N 3.33Å; M736-K738 PolarHBondContact O-N 3.05Å
739C61.1Low58.1Low81 Ų81140.6 Ų140.655%0.54769%0.691SS.*G310 helixtrans-84.9-14-179-175.40000113.7E737E737-C739 VanDerWaalsContact C-N 3.29Å; E737-C739 PolarHBondContact O-N 3.42Å
740I63.5Low59.4Low99 Ų99136.2 Ų136.251%0.50867%0.671SS.*SBendtrans-78.2-50.9-164.1-60.4174.3000111.9E742 K743I740-E742 VanDerWaalsContact C-N 3.27Å; I740-E742 PolarHBondContact O-N 3.49Å; I740-E742 VanDerWaalsContact O-N 3.1Å; I740-K743 PolarHBondContact O-N 3.03Å; I740-K743 VanDerWaalsContact O-N 3.16Å
741Q60.5Low61.2Low165 Ų165132.9 Ų132.977%0.77166%0.657SS**THydrogen-bonded Turntrans-63.2-22.3-167.2-67.7177.5-32.900115.4K743Q741-K743 VanDerWaalsContact C-N 3.26Å; Q741-K743 PolarHBondContact O-N 3.05Å
742E61.2Low62.6Low156 Ų156131.8 Ų131.873%0.72965%0.647SS**THydrogen-bonded Turntrans-80.6-3-179.3-154.5-175.4-146.200113.5I740I740-E742 VanDerWaalsContact C-N 3.27Å; I740-E742 PolarHBondContact O-N 3.49Å; I740-E742 VanDerWaalsContact O-N 3.1Å
743K69.4Low63.8Low139 Ų139131.7 Ų131.760%0.60464%0.642SS**THydrogen-bonded Turntrans-91.7-31.8177.6-69-176.2176.2177.40113.3I740 Q741 E745 K746 L747I740-K743 PolarHBondContact O-N 3.03Å; I740-K743 VanDerWaalsContact O-N 3.16Å; Q741-K743 VanDerWaalsContact C-N 3.26Å; Q741-K743 PolarHBondContact O-N 3.05Å; K743-E745 VanDerWaalsContact C-N 3.32Å; K743-E745 PolarHBondContact O-N 2.84Å; K743-K746 PolarHBondContact O-N 3.08Å; K743-K746 VanDerWaalsContact O-N 3.11Å; K743-L747 PolarHBondContact O-N 3.39Å
744D71.1Confident64.9Low84 Ų84130.7 Ų130.745%0.44963%0.632SS.*Hα-helixtrans-69.6-26.5-165.7-57.4-29.7000113.4L747D744-L747 WeakPolarHBondContact O-CB 3.41Å; D744-L747 PolarHBondContact O-N 3.29Å
745E64.1Low66.1Low141 Ų141128 Ų12866%0.65962%0.619SS**Hα-helixtrans-76.3-26.2175.4-60.5-161.4124.900113.4K743K743-E745 VanDerWaalsContact C-N 3.32Å; K743-E745 PolarHBondContact O-N 2.84Å
746K69Low67.3Low137 Ų137123.7 Ų123.760%0.59661%0.605SS**Hα-helixtrans-79.3-23.5174-69.7166.7-175.5147.80111.8K743 T749 V750K743-K746 PolarHBondContact O-N 3.08Å; K743-K746 VanDerWaalsContact O-N 3.11Å; K746-T749 PolarHBondContact O-OG1 2.93Å; K746-V750 WeakPolarHBondContact O-CG2 3.38Å
747L72.7Confident68.5Low95 Ų95118.2 Ų118.250%0.49759%0.587SS.*Hα-helixtrans-61.7-46.5174-166.169.6000110.8K743 D744 T749 V750 E751K743-L747 PolarHBondContact O-N 3.39Å; D744-L747 WeakPolarHBondContact O-CB 3.41Å; D744-L747 PolarHBondContact O-N 3.29Å; L747-T749 VanDerWaalsContact C-N 3.3Å; L747-T749 PolarHBondContact O-N 2.97Å; L747-V750 WeakPolarHBondContact O-CA 3.23Å; L747-V750 WeakPolarHBondContact O-CB 3.41Å; L747-V750 PolarHBondContact O-N 3.17Å; L747-E751 HydrophobicContact CG-CG 4.49Å; L747-E751 WeakPolarHBondContact O-CG 3.31Å; L747-E751 PolarHBondContact O-N 3.15Å
748R73.1Confident69.7Low142 Ų142115.9 Ų115.954%0.53658%0.579SS.*Hα-helixtrans-59.4-33-174.7-158.4-179.3-56.7121.28.2115.1E751R748-E751 WeakPolarHBondContact CA-OE2 3.39Å
749T70.3Confident70.6Confident87 Ų87111.7 Ų111.753%0.53457%0.565SS.*Hα-helixtrans-86-13.8176.336.80000113.4K746 L747K746-T749 PolarHBondContact O-OG1 2.93Å; L747-T749 VanDerWaalsContact C-N 3.3Å; L747-T749 PolarHBondContact O-N 2.97Å
750V70.9Confident71.3Confident74 Ų74113 Ų11345%0.44856%0.563SS.*Hα-helixtrans-81.9-34167.6173.40000110.5K746 L747 L753 L754K746-V750 WeakPolarHBondContact O-CG2 3.38Å; L747-V750 WeakPolarHBondContact O-CA 3.23Å; L747-V750 WeakPolarHBondContact O-CB 3.41Å; L747-V750 PolarHBondContact O-N 3.17Å; V750-L753 PolarHBondContact O-N 2.82Å; V750-L754 HydrophobicContact CG1-CD1 3.81Å; V750-L754 HydrophobicContact CG1-CG 4.08Å; V750-L754 WeakPolarHBondContact O-CB 3.28Å; V750-L754 WeakPolarHBondContact O-CG 3.49Å; V750-L754 PolarHBondContact O-N 3.42Å
751E77.1Confident71.8Confident99 Ų99112.3 Ų112.346%0.46356%0.563SS.*Hα-helixtrans-59.5-48.1178.7-72.3168.2160.500112.8L747 R748 L753 L754 E755L747-E751 HydrophobicContact CG-CG 4.49Å; L747-E751 WeakPolarHBondContact O-CG 3.31Å; L747-E751 PolarHBondContact O-N 3.15Å; R748-E751 WeakPolarHBondContact CA-OE2 3.39Å; E751-L753 VanDerWaalsContact C-N 3.31Å; E751-L753 PolarHBondContact O-N 3.44Å; E751-L754 PolarHBondContact O-N 2.62Å; E751-L754 VanDerWaalsContact O-N 3.17Å; E751-E755 PolarHBondContact O-N 3.39Å
752E71.5Confident72.5Confident131 Ų131107 Ų10761%0.61255%0.547SS*.Hα-helixtrans-62-35.1177.8-64.1179153.400113.1T756E752-T756 PolarHBondContact O-N 2.91Å; E752-T756 PolarHBondContact O-OG1 2.89Å
753L73.1Confident73Confident131 Ų131103 Ų10369%0.68653%0.534SS*.Hα-helixtrans-74.8-35.2175.9-70.6174000112.1V750 E751 G757V750-L753 PolarHBondContact O-N 2.82Å; E751-L753 VanDerWaalsContact C-N 3.31Å; E751-L753 PolarHBondContact O-N 3.44Å; L753-G757 PolarHBondContact O-N 2.93Å
754L73.5Confident73.5Confident102 Ų102102.7 Ų102.753%0.53453%0.529SS..Hα-helixtrans-66.5-42.5173.3-76.8173.1000111.5V750 E751 T756 G757 L758V750-L754 HydrophobicContact CG1-CD1 3.81Å; V750-L754 HydrophobicContact CG1-CG 4.08Å; V750-L754 WeakPolarHBondContact O-CB 3.28Å; V750-L754 WeakPolarHBondContact O-CG 3.49Å; V750-L754 PolarHBondContact O-N 3.42Å; E751-L754 PolarHBondContact O-N 2.62Å; E751-L754 VanDerWaalsContact O-N 3.17Å; L754-T756 VanDerWaalsContact C-N 3.35Å; L754-T756 PolarHBondContact O-N 2.78Å; L754-G757 CarbonylContact O-C 3.53Å; L754-G757 PolarHBondContact O-N 2.89Å; L754-G757 VanDerWaalsContact O-N 3.12Å; L754-L758 WeakPolarHBondContact O-CB 3.38Å; L754-L758 VanDerWaalsContact O-CG 3.25Å; L754-L758 WeakPolarHBondContact O-CG 3.42Å; L754-L758 PolarHBondContact O-N 3.32Å
755E77.8Confident73.9Confident133 Ų133103.2 Ų103.262%0.62153%0.528SS*.Hα-helixtrans-59.5-46.1176.8-173.7168.8-154.400111.4E751 G757 L758 I759E751-E755 PolarHBondContact O-N 3.39Å; E755-G757 VanDerWaalsContact C-N 3.29Å; E755-G757 PolarHBondContact O-N 3.04Å; E755-L758 PolarHBondContact O-N 3.3Å; E755-I759 WeakPolarHBondContact O-CG1 3.19Å; E755-I759 PolarHBondContact O-N 3.08Å
756T72.2Confident74.5Confident90 Ų90103.1 Ų103.155%0.55253%0.528SS*.Hα-helixtrans-60.8-37.4174.6-53.80000112.3E752 L754E752-T756 PolarHBondContact O-N 2.91Å; E752-T756 PolarHBondContact O-OG1 2.89Å; L754-T756 VanDerWaalsContact C-N 3.35Å; L754-T756 PolarHBondContact O-N 2.78Å
757G76.1Confident75.1Confident34 Ų34102.3 Ų102.335%0.35153%0.527SS..Hα-helixtrans-70.8-41.417600000113.6L753 L754 E755 I759 Q760 V761L753-G757 PolarHBondContact O-N 2.93Å; L754-G757 CarbonylContact O-C 3.53Å; L754-G757 PolarHBondContact O-N 2.89Å; L754-G757 VanDerWaalsContact O-N 3.12Å; E755-G757 VanDerWaalsContact C-N 3.29Å; E755-G757 PolarHBondContact O-N 3.04Å; G757-I759 VanDerWaalsContact C-N 3.32Å; G757-I759 PolarHBondContact O-N 3.11Å; G757-Q760 WeakPolarHBondContact O-CB 3.27Å; G757-Q760 PolarHBondContact O-N 2.92Å; G757-Q760 VanDerWaalsContact O-N 3.13Å; G757-V761 WeakPolarHBondContact O-CG2 3.35Å; G757-V761 PolarHBondContact O-N 3Å
758L79.6Confident75.5Confident114 Ų114101.9 Ų101.960%0.59752%0.524SS*.Hα-helixtrans-62.8-37.8-179.1-76.4166.7000111.9L754 E755 Q760 V761 A762L754-L758 WeakPolarHBondContact O-CB 3.38Å; L754-L758 VanDerWaalsContact O-CG 3.25Å; L754-L758 WeakPolarHBondContact O-CG 3.42Å; L754-L758 PolarHBondContact O-N 3.32Å; E755-L758 PolarHBondContact O-N 3.3Å; L758-Q760 VanDerWaalsContact C-N 3.34Å; L758-Q760 PolarHBondContact O-N 3.35Å; L758-V761 PolarHBondContact O-N 3.08Å; L758-V761 VanDerWaalsContact O-N 3.16Å; L758-A762 PolarHBondContact O-N 2.98Å
759I75.8Confident75.8Confident111 Ų11197.7 Ų97.757%0.56952%0.516SS*.Hα-helixtrans-60-44.2174-65.4166.5000110.6E755 G757 V761 A762 T763E755-I759 WeakPolarHBondContact O-CG1 3.19Å; E755-I759 PolarHBondContact O-N 3.08Å; G757-I759 VanDerWaalsContact C-N 3.32Å; G757-I759 PolarHBondContact O-N 3.11Å; I759-V761 VanDerWaalsContact C-N 3.32Å; I759-V761 PolarHBondContact O-N 3.24Å; I759-A762 PolarHBondContact O-N 2.99Å; I759-T763 PolarHBondContact O-N 3.1Å; I759-T763 VanDerWaalsContact O-N 3.14Å; I759-T763 PolarHBondContact O-OG1 2.95Å; I759-T763 VanDerWaalsContact O-OG1 3.11Å
760Q74.7Confident76.3Confident109 Ų10996 Ų9651%0.50951%0.512SS..Hα-helixtrans-68.9-25.7175.6-81.9-158.237.700114.6G757 L758 R764G757-Q760 WeakPolarHBondContact O-CB 3.27Å; G757-Q760 PolarHBondContact O-N 2.92Å; G757-Q760 VanDerWaalsContact O-N 3.13Å; L758-Q760 VanDerWaalsContact C-N 3.34Å; L758-Q760 PolarHBondContact O-N 3.35Å; Q760-R764 PolarHBondContact O-NH1 3.44Å
761V73.3Confident76.7Confident85 Ų8596.7 Ų96.752%0.51551%0.512SS..Hα-helixtrans-73.9-44.1172.7172.70000109.7G757 L758 I759 T763 R764 E765G757-V761 WeakPolarHBondContact O-CG2 3.35Å; G757-V761 PolarHBondContact O-N 3Å; L758-V761 PolarHBondContact O-N 3.08Å; L758-V761 VanDerWaalsContact O-N 3.16Å; I759-V761 VanDerWaalsContact C-N 3.32Å; I759-V761 PolarHBondContact O-N 3.24Å; V761-T763 PolarHBondContact O-N 3.39Å; V761-R764 PolarHBondContact O-N 3.39Å; V761-R764 VanDerWaalsContact O-N 3.16Å; V761-E765 WeakPolarHBondContact O-CB 3.18Å; V761-E765 PolarHBondContact O-N 2.88Å
762A75.3Confident77Confident52 Ų5298.4 Ų98.443%0.4351%0.514SS..Hα-helixtrans-57.8-45.8177.300000112.3L758 I759 R764 E765 E766L758-A762 PolarHBondContact O-N 2.98Å; I759-A762 PolarHBondContact O-N 2.99Å; A762-R764 VanDerWaalsContact C-N 3.32Å; A762-R764 PolarHBondContact O-N 3.33Å; A762-E765 WeakPolarHBondContact O-CB 3.4Å; A762-E765 PolarHBondContact O-N 3.48Å; A762-E765 VanDerWaalsContact O-N 3.16Å; A762-E766 PolarHBondContact O-N 2.85Å
763T72.7Confident77.5Confident72 Ų7296.2 Ų96.244%0.44251%0.51SS..Hα-helixtrans-60.1-39.7176.6-46.20000112.5I759 V761 E766 E767I759-T763 PolarHBondContact O-N 3.1Å; I759-T763 VanDerWaalsContact O-N 3.14Å; I759-T763 PolarHBondContact O-OG1 2.95Å; I759-T763 VanDerWaalsContact O-OG1 3.11Å; V761-T763 PolarHBondContact O-N 3.39Å; T763-E766 PolarHBondContact O-N 3.44Å; T763-E767 PolarHBondContact O-N 3.21Å
764R80.2Confident78Confident133 Ų13395.9 Ų95.950%0.50251%0.505SS..Hα-helixtrans-74.8-28.5176.6-70.9-176.3-179.793-5.1113.2Q760 V761 A762 L768Q760-R764 PolarHBondContact O-NH1 3.44Å; V761-R764 PolarHBondContact O-N 3.39Å; V761-R764 VanDerWaalsContact O-N 3.16Å; A762-R764 VanDerWaalsContact C-N 3.32Å; A762-R764 PolarHBondContact O-N 3.33Å; R764-L768 WeakPolarHBondContact O-CB 3.46Å; R764-L768 VanDerWaalsContact O-CG 3.29Å; R764-L768 WeakPolarHBondContact O-CG 3.39Å; R764-L768 PolarHBondContact O-N 2.95Å
765E78.5Confident78.1Confident95 Ų9595.2 Ų95.244%0.44450%0.502SS..Hα-helixtrans-66.6-38.8172.1-17383.1-111.800110.5V761 A762 L768 S769 R772V761-E765 WeakPolarHBondContact O-CB 3.18Å; V761-E765 PolarHBondContact O-N 2.88Å; A762-E765 WeakPolarHBondContact O-CB 3.4Å; A762-E765 PolarHBondContact O-N 3.48Å; A762-E765 VanDerWaalsContact O-N 3.16Å; E765-L768 PolarHBondContact O-N 2.83Å; E765-S769 WeakPolarHBondContact O-CB 3.49Å; E765-S769 PolarHBondContact O-N 3.41Å; E765-R772 IonicContact OE1-CZ 2.86Å; E765-R772 VanDerWaalsContact OE1-CZ 3.25Å; E765-R772 IonicContact OE1-NH1 2.78Å; E765-R772 PolarHBondContact OE1-NH1 3.36Å; E765-R772 IonicContact OE1-NH2 3.21Å; E765-R772 PolarHBondContact OE1-NH2 2.85Å
766E77.7Confident78.4Confident139 Ų13991.1 Ų91.165%0.6549%0.488SS*.Hα-helixtrans-63.3-47.5172.8-71.1-174.8148.500111.9A762 T763 L768 S769 A770A762-E766 PolarHBondContact O-N 2.85Å; T763-E766 PolarHBondContact O-N 3.44Å; E766-L768 PolarHBondContact O-N 3.06Å; E766-S769 WeakPolarHBondContact O-CB 3.31Å; E766-S769 PolarHBondContact O-N 3.49Å; E766-S769 VanDerWaalsContact O-N 3.07Å; E766-S769 PolarHBondContact O-OG 3.14Å; E766-A770 PolarHBondContact O-N 3.27Å; E766-A770 VanDerWaalsContact O-N 3.08Å
767E80.7Confident78.9Confident121 Ų12189.4 Ų89.457%0.56548%0.478SS*.Hα-helixtrans-57.1-46.6173.6-70175.7161.300111.8T763 S769 A770 I771T763-E767 PolarHBondContact O-N 3.21Å; E767-S769 VanDerWaalsContact C-N 3.3Å; E767-S769 PolarHBondContact O-N 3.03Å; E767-A770 PolarHBondContact O-N 3.37Å; E767-I771 WeakPolarHBondContact O-CG1 3.47Å; E767-I771 PolarHBondContact O-N 3.06Å; E767-I771 VanDerWaalsContact O-N 3.16Å
768L80.4Confident79.2Confident86 Ų8691.9 Ų91.945%0.4548%0.482SS..Hα-helixtrans-65.1-31.8175-75.2169.6000112.4R764 E765 E766 I771 R772R764-L768 WeakPolarHBondContact O-CB 3.46Å; R764-L768 VanDerWaalsContact O-CG 3.29Å; R764-L768 WeakPolarHBondContact O-CG 3.39Å; R764-L768 PolarHBondContact O-N 2.95Å; E765-L768 PolarHBondContact O-N 2.83Å; E766-L768 PolarHBondContact O-N 3.06Å; L768-I771 PolarHBondContact O-N 2.94Å; L768-R772 WeakPolarHBondContact O-CB 3.34Å; L768-R772 WeakPolarHBondContact O-CG 3.48Å; L768-R772 PolarHBondContact O-N 3.39Å
769S80.1Confident79.2Confident53 Ų5390 Ų9037%0.37148%0.476SS..Hα-helixtrans-66.3-38.617684.60000111.9E765 E766 E767 R772 T773E765-S769 WeakPolarHBondContact O-CB 3.49Å; E765-S769 PolarHBondContact O-N 3.41Å; E766-S769 WeakPolarHBondContact O-CB 3.31Å; E766-S769 PolarHBondContact O-N 3.49Å; E766-S769 VanDerWaalsContact O-N 3.07Å; E766-S769 PolarHBondContact O-OG 3.14Å; E767-S769 VanDerWaalsContact C-N 3.3Å; E767-S769 PolarHBondContact O-N 3.03Å; S769-R772 PolarHBondContact O-N 2.83Å; S769-T773 WeakPolarHBondContact O-CG2 3.5Å; S769-T773 PolarHBondContact O-N 2.77Å; S769-T773 PolarHBondContact O-OG1 2.85Å
770A80.1Confident79.6Confident53 Ų5390.9 Ų90.944%0.43847%0.472SS..Hα-helixtrans-65-44.5174.500000111.3E766 E767 R772 T773 E774E766-A770 PolarHBondContact O-N 3.27Å; E766-A770 VanDerWaalsContact O-N 3.08Å; E767-A770 PolarHBondContact O-N 3.37Å; A770-R772 VanDerWaalsContact C-N 3.3Å; A770-R772 PolarHBondContact O-N 2.81Å; A770-T773 PolarHBondContact O-N 3.31Å; A770-T773 PolarHBondContact O-OG1 3.2Å; A770-E774 WeakPolarHBondContact O-CB 3.35Å; A770-E774 PolarHBondContact O-N 2.99Å
771I80Confident79.9Confident88 Ų8890.7 Ų90.745%0.45147%0.471SS..Hα-helixtrans-63.9-36.3175.8-64167.9000111E767 L768 N775E767-I771 WeakPolarHBondContact O-CG1 3.47Å; E767-I771 PolarHBondContact O-N 3.06Å; E767-I771 VanDerWaalsContact O-N 3.16Å; L768-I771 PolarHBondContact O-N 2.94Å; I771-N775 WeakPolarHBondContact O-CB 3.41Å; I771-N775 PolarHBondContact O-N 2.89Å; I771-N775 PolarHBondContact O-ND2 3.15Å
772R83.4Confident80Confident134 Ų13491.2 Ų91.251%0.50647%0.474SS..Hα-helixtrans-66.3-41.8173.8-71.7168.6-158.3152.64.7112.2E765 L768 S769 A770 S776E765-R772 IonicContact OE1-CZ 2.86Å; E765-R772 VanDerWaalsContact OE1-CZ 3.25Å; E765-R772 IonicContact OE1-NH1 2.78Å; E765-R772 PolarHBondContact OE1-NH1 3.36Å; E765-R772 IonicContact OE1-NH2 3.21Å; E765-R772 PolarHBondContact OE1-NH2 2.85Å; L768-R772 WeakPolarHBondContact O-CB 3.34Å; L768-R772 WeakPolarHBondContact O-CG 3.48Å; L768-R772 PolarHBondContact O-N 3.39Å; S769-R772 PolarHBondContact O-N 2.83Å; A770-R772 VanDerWaalsContact C-N 3.3Å; A770-R772 PolarHBondContact O-N 2.81Å; R772-S776 WeakPolarHBondContact O-CB 3.26Å; R772-S776 PolarHBondContact O-N 3.3Å
773T82.8Confident80.1Confident86 Ų8694.9 Ų94.953%0.52848%0.482SS..Hα-helixtrans-71.6-37.118054.50000112.3S769 A770 S776 T777S769-T773 WeakPolarHBondContact O-CG2 3.5Å; S769-T773 PolarHBondContact O-N 2.77Å; S769-T773 PolarHBondContact O-OG1 2.85Å; A770-T773 PolarHBondContact O-N 3.31Å; A770-T773 PolarHBondContact O-OG1 3.2Å; T773-S776 PolarHBondContact O-N 2.86Å; T773-S776 PolarHBondContact O-OG 3.31Å; T773-T777 PolarHBondContact O-N 2.91Å; T773-T777 VanDerWaalsContact O-N 3.12Å; T773-T777 PolarHBondContact O-OG1 3.44Å
774E83.3Confident80.3Confident123 Ų12396.3 Ų96.358%0.57548%0.484SS*.Hα-helixtrans-60.8-51.8170.4-174.4174.4-151.200111.1A770 S776 T777 L778A770-E774 WeakPolarHBondContact O-CB 3.35Å; A770-E774 PolarHBondContact O-N 2.99Å; E774-S776 VanDerWaalsContact C-N 3.28Å; E774-S776 PolarHBondContact O-N 3.24Å; E774-T777 WeakPolarHBondContact O-CA 3.36Å; E774-T777 WeakPolarHBondContact O-CB 3.47Å; E774-T777 PolarHBondContact O-N 3.2Å; E774-L778 HydrophobicContact CG-CD1 4.27Å; E774-L778 PolarHBondContact O-N 2.92Å
775N75.7Confident80Confident88 Ų8895.7 Ų95.747%0.47149%0.49SS..Hα-helixtrans-59-36.7175-85.8-87.6000112.7I771 T777 T779I771-N775 WeakPolarHBondContact O-CB 3.41Å; I771-N775 PolarHBondContact O-N 2.89Å; I771-N775 PolarHBondContact O-ND2 3.15Å; N775-T777 PolarHBondContact O-N 2.81Å; N775-T779 VanDerWaalsContact O-CB 3.25Å; N775-T779 WeakPolarHBondContact O-CB 3.49Å; N775-T779 PolarHBondContact O-N 3.48Å; N775-T779 PolarHBondContact O-OG1 2.89Å
776S83Confident79.5Confident48 Ų4898.3 Ų98.334%0.33650%0.5SS..Hα-helixtrans-64.3-28.5174.986.20000112.7R772 T773 E774 R780R772-S776 WeakPolarHBondContact O-CB 3.26Å; R772-S776 PolarHBondContact O-N 3.3Å; T773-S776 PolarHBondContact O-N 2.86Å; T773-S776 PolarHBondContact O-OG 3.31Å; E774-S776 VanDerWaalsContact C-N 3.28Å; E774-S776 PolarHBondContact O-N 3.24Å; S776-R780 WeakPolarHBondContact O-CB 3.32Å; S776-R780 PolarHBondContact O-N 3.43Å; S776-R780 VanDerWaalsContact O-N 3.16Å; S776-R780 PolarHBondContact O-NH2 2.88Å; S776-R780 PolarHBondContact OG-NH2 3.06Å
777T84.3Confident79Confident54 Ų5493.9 Ų93.933%0.33149%0.487SS..Hα-helixtrans-85.1-44.1-177.9-59.60000110.8T773 E774 N775 T779 R780 E781T773-T777 PolarHBondContact O-N 2.91Å; T773-T777 VanDerWaalsContact O-N 3.12Å; T773-T777 PolarHBondContact O-OG1 3.44Å; E774-T777 WeakPolarHBondContact O-CA 3.36Å; E774-T777 WeakPolarHBondContact O-CB 3.47Å; E774-T777 PolarHBondContact O-N 3.2Å; N775-T777 PolarHBondContact O-N 2.81Å; T777-T779 VanDerWaalsContact C-N 3.27Å; T777-T779 PolarHBondContact O-N 3.47Å; T777-R780 WeakPolarHBondContact O-CA 3.34Å; T777-R780 WeakPolarHBondContact O-CB 3.37Å; T777-R780 PolarHBondContact O-N 2.95Å; T777-R780 PolarHBondContact OG1-NH1 3.17Å; T777-R780 VanDerWaalsContact OG1-NH1 3.11Å; T777-E781 PolarHBondContact O-N 3.03Å
778L82.1Confident78.4Confident86 Ų8693.6 Ų93.645%0.4548%0.484SS..Hα-helixtrans-57.9-40.1167.9-66.7170.9000111.7E774 R780 E781 V782E774-L778 HydrophobicContact CG-CD1 4.27Å; E774-L778 PolarHBondContact O-N 2.92Å; L778-R780 VanDerWaalsContact C-N 3.31Å; L778-R780 PolarHBondContact O-N 2.94Å; L778-E781 PolarHBondContact O-N 3.38Å; L778-V782 WeakPolarHBondContact O-CB 3.47Å; L778-V782 VanDerWaalsContact O-CG2 3.27Å; L778-V782 WeakPolarHBondContact O-CG2 3.44Å; L778-V782 PolarHBondContact O-N 3.27Å
779T79.6Confident77.3Confident74 Ų7496.7 Ų96.745%0.45450%0.496SS..Hα-helixtrans-62.3-38.5174.2-59.70000111.9N775 T777 Q783N775-T779 VanDerWaalsContact O-CB 3.25Å; N775-T779 WeakPolarHBondContact O-CB 3.49Å; N775-T779 PolarHBondContact O-N 3.48Å; N775-T779 PolarHBondContact O-OG1 2.89Å; T777-T779 VanDerWaalsContact C-N 3.27Å; T777-T779 PolarHBondContact O-N 3.47Å; T779-Q783 WeakPolarHBondContact O-CB 3.43Å; T779-Q783 WeakPolarHBondContact O-CG 3.25Å; T779-Q783 PolarHBondContact O-N 3.32Å
780R83Confident76.1Confident129 Ų12998.2 Ų98.249%0.48751%0.507SS..Hα-helixtrans-69.1-43.2177.8-165.4-176.8-53.410312.5111.7S776 T777 L778 Q783 E784S776-R780 WeakPolarHBondContact O-CB 3.32Å; S776-R780 PolarHBondContact O-N 3.43Å; S776-R780 VanDerWaalsContact O-N 3.16Å; S776-R780 PolarHBondContact O-NH2 2.88Å; S776-R780 PolarHBondContact OG-NH2 3.06Å; T777-R780 WeakPolarHBondContact O-CA 3.34Å; T777-R780 WeakPolarHBondContact O-CB 3.37Å; T777-R780 PolarHBondContact O-N 2.95Å; T777-R780 PolarHBondContact OG1-NH1 3.17Å; T777-R780 VanDerWaalsContact OG1-NH1 3.11Å; L778-R780 VanDerWaalsContact C-N 3.31Å; L778-R780 PolarHBondContact O-N 2.94Å; R780-Q783 PolarHBondContact O-N 2.72Å; R780-E784 WeakPolarHBondContact O-CB 3.26Å; R780-E784 PolarHBondContact O-N 3.34Å
781E80.9Confident75Confident105 Ų105102.4 Ų102.449%0.49152%0.522SS..Hα-helixtrans-63.5-42174.5-71175.7-178.600111.7T777 L778 Q783 E784 L785T777-E781 PolarHBondContact O-N 3.03Å; L778-E781 PolarHBondContact O-N 3.38Å; E781-Q783 VanDerWaalsContact C-N 3.35Å; E781-Q783 PolarHBondContact O-N 2.7Å; E781-E784 PolarHBondContact O-N 2.93Å; E781-L785 WeakPolarHBondContact O-CB 3.47Å; E781-L785 VanDerWaalsContact O-CG 3.31Å; E781-L785 WeakPolarHBondContact O-CG 3.45Å; E781-L785 PolarHBondContact O-N 3.42Å
782V75.5Confident73.6Confident96 Ų96105.8 Ų105.858%0.58254%0.536SS*.Hα-helixtrans-63.5-38.9173.2168.50000111.6L778 K786L778-V782 WeakPolarHBondContact O-CB 3.47Å; L778-V782 VanDerWaalsContact O-CG2 3.27Å; L778-V782 WeakPolarHBondContact O-CG2 3.44Å; L778-V782 PolarHBondContact O-N 3.27Å; V782-K786 VanDerWaalsContact O-CB 3.23Å; V782-K786 WeakPolarHBondContact O-CB 3.44Å; V782-K786 PolarHBondContact O-N 3.47Å
783Q77.3Confident71.9Confident129 Ų129103.2 Ų103.260%0.60354%0.535SS*.Hα-helixtrans-66.8-39173-78.2179.2-7.800112.4T779 R780 E781 K786 A787T779-Q783 WeakPolarHBondContact O-CB 3.43Å; T779-Q783 WeakPolarHBondContact O-CG 3.25Å; T779-Q783 PolarHBondContact O-N 3.32Å; R780-Q783 PolarHBondContact O-N 2.72Å; E781-Q783 VanDerWaalsContact C-N 3.35Å; E781-Q783 PolarHBondContact O-N 2.7Å; Q783-K786 PolarHBondContact O-N 3Å; Q783-A787 WeakPolarHBondContact O-CB 3.23Å; Q783-A787 PolarHBondContact O-N 3.44Å
784E77.9Confident70.7Confident102 Ų102103.9 Ų103.948%0.47754%0.543SS..Hα-helixtrans-71.3-37.6178.9-161.4-174.4134.300112R780 E781 A787 K788R780-E784 WeakPolarHBondContact O-CB 3.26Å; R780-E784 PolarHBondContact O-N 3.34Å; E781-E784 PolarHBondContact O-N 2.93Å; E784-A787 PolarHBondContact O-N 3.31Å; E784-K788 WeakPolarHBondContact O-CB 3.47Å; E784-K788 WeakPolarHBondContact O-CG 3.24Å; E784-K788 PolarHBondContact O-N 3.22Å; E784-K788 WeakPolarHBondContact OE1-CE 3.45Å; E784-K788 IonicContact OE1-NZ 2.71Å; E784-K788 PolarHBondContact OE1-NZ 3.16Å
785L74Confident69.4Low121 Ų121104 Ų10463%0.63454%0.542SS*.Hα-helixtrans-64.1-40.3169.5-73170.4000111.4E781 K788 Q789E781-L785 WeakPolarHBondContact O-CB 3.47Å; E781-L785 VanDerWaalsContact O-CG 3.31Å; E781-L785 WeakPolarHBondContact O-CG 3.45Å; E781-L785 PolarHBondContact O-N 3.42Å; L785-K788 PolarHBondContact O-N 3.03Å; L785-Q789 WeakPolarHBondContact O-CB 3.3Å; L785-Q789 PolarHBondContact O-N 2.96Å
786K68.7Low68.9Low149 Ų149104.1 Ų104.165%0.64855%0.545SS*.Hα-helixtrans-67.4-34.4175.2-171.7175.5-178.3179.10112.6V782 Q783 Q789 S790V782-K786 VanDerWaalsContact O-CB 3.23Å; V782-K786 WeakPolarHBondContact O-CB 3.44Å; V782-K786 PolarHBondContact O-N 3.47Å; Q783-K786 PolarHBondContact O-N 3Å; K786-Q789 PolarHBondContact O-N 3.49Å; K786-S790 PolarHBondContact O-N 3.47Å
787A65.8Low68.1Low46 Ų46105 Ų10538%0.3855%0.552SS.*Hα-helixtrans-66-47.4171.300000110.9Q783 E784 Q789 S790 D791Q783-A787 WeakPolarHBondContact O-CB 3.23Å; Q783-A787 PolarHBondContact O-N 3.44Å; E784-A787 PolarHBondContact O-N 3.31Å; A787-Q789 VanDerWaalsContact C-N 3.26Å; A787-Q789 PolarHBondContact O-N 3.27Å; A787-S790 CarbonylContact O-C 3.59Å; A787-S790 WeakPolarHBondContact O-CA 3.45Å; A787-S790 VanDerWaalsContact O-CB 3.3Å; A787-S790 WeakPolarHBondContact O-CB 3.22Å; A787-S790 PolarHBondContact O-N 2.76Å; A787-D791 PolarHBondContact O-N 2.94Å
788K67.9Low67.5Low115 Ų115107.1 Ų107.150%0.556%0.56SS.*Hα-helixtrans-60.9-32.7174.9-72.7163.6179.6168.10112.9E784 L785 S790 Q792E784-K788 WeakPolarHBondContact O-CB 3.47Å; E784-K788 WeakPolarHBondContact O-CG 3.24Å; E784-K788 PolarHBondContact O-N 3.22Å; E784-K788 WeakPolarHBondContact OE1-CE 3.45Å; E784-K788 IonicContact OE1-NZ 2.71Å; E784-K788 PolarHBondContact OE1-NZ 3.16Å; L785-K788 PolarHBondContact O-N 3.03Å; K788-S790 VanDerWaalsContact C-N 3.33Å; K788-Q792 VanDerWaalsContact O-CB 3.23Å; K788-Q792 WeakPolarHBondContact O-CB 3.22Å; K788-Q792 PolarHBondContact O-N 3.24Å
789Q58.1Low67.1Low152 Ų152106.8 Ų106.871%0.7156%0.558SS**Hα-helixtrans-70.4-26.5170.5-170.6-179.317.200113.1L785 K786 A787L785-Q789 WeakPolarHBondContact O-CB 3.3Å; L785-Q789 PolarHBondContact O-N 2.96Å; K786-Q789 PolarHBondContact O-N 3.49Å; A787-Q789 VanDerWaalsContact C-N 3.26Å; A787-Q789 PolarHBondContact O-N 3.27Å
790S54.8Low67Low85 Ų85108.4 Ų108.459%0.59456%0.561SS**Hα-helixtrans-81.6-35175.5-167.40000112.7K786 A787 K788K786-S790 PolarHBondContact O-N 3.47Å; A787-S790 CarbonylContact O-C 3.59Å; A787-S790 WeakPolarHBondContact O-CA 3.45Å; A787-S790 VanDerWaalsContact O-CB 3.3Å; A787-S790 WeakPolarHBondContact O-CB 3.22Å; A787-S790 PolarHBondContact O-N 2.76Å; K788-S790 VanDerWaalsContact C-N 3.33Å
791D56.2Low66.6Low140 Ų140105.4 Ų105.475%0.74956%0.555SS**Hα-helixtrans-78.3-27.3176.8-64.7-29.8000111.6A787 V793A787-D791 PolarHBondContact O-N 2.94Å; D791-V793 PolarHBondContact O-N 2.71Å
792Q51.2Low66.6Low159 Ų159105 Ų10574%0.74356%0.555SS**SBendtrans-85.786.1174-167.4162.563.900112K788K788-Q792 VanDerWaalsContact O-CB 3.23Å; K788-Q792 WeakPolarHBondContact O-CB 3.22Å; K788-Q792 PolarHBondContact O-N 3.24Å
793V48Very low66.8Low80 Ų80106.5 Ų106.549%0.48555%0.554SS.*  trans123.9131.2155.8-178.50000113.8D791 F795D791-V793 PolarHBondContact O-N 2.71Å; V793-F795 HydrophobicContact CB-CD2 3.95Å; V793-F795 HydrophobicContact CB-CE2 4.36Å; V793-F795 HydrophobicContact CG1-CB 4.35Å; V793-F795 HydrophobicContact CG1-CD2 3.27Å; V793-F795 HydrophobicContact CG1-CE2 3.58Å; V793-F795 HydrophobicContact CG1-CG 3.81Å; V793-F795 HydrophobicContact CG1-CZ 4.33Å; V793-F795 PolarHBondContact O-N 3.37Å
794S57.1Low67.3Low101 Ų101107.9 Ų107.971%0.70655%0.553SS**THydrogen-bonded Turntrans-66.321.9178.651.70000116V796 S797S794-V796 PolarHBondContact O-N 3.4Å; S794-S797 PolarHBondContact O-N 2.95Å
795F56.9Low67.7Low125 Ų125106.4 Ų106.455%0.54855%0.551SS.*Hα-helixtrans-62.5-28.8-177.5-86.6-54.6000113.1V793 S797 L798 I799V793-F795 HydrophobicContact CB-CD2 3.95Å; V793-F795 HydrophobicContact CB-CE2 4.36Å; V793-F795 HydrophobicContact CG1-CB 4.35Å; V793-F795 HydrophobicContact CG1-CD2 3.27Å; V793-F795 HydrophobicContact CG1-CE2 3.58Å; V793-F795 HydrophobicContact CG1-CG 3.81Å; V793-F795 HydrophobicContact CG1-CZ 4.33Å; V793-F795 PolarHBondContact O-N 3.37Å; F795-S797 PolarHBondContact O-N 3.44Å; F795-L798 HydrophobicContact CD1-CD2 4.32Å; F795-L798 HydrophobicContact CE1-CD2 4.46Å; F795-L798 PolarHBondContact O-N 2.88Å; F795-I799 HydrophobicContact CB-CD1 4.17Å; F795-I799 VanDerWaalsContact O-CB 3.28Å; F795-I799 WeakPolarHBondContact O-CB 3.36Å; F795-I799 WeakPolarHBondContact O-CD1 3.05Å; F795-I799 WeakPolarHBondContact O-CG1 3.06Å; F795-I799 PolarHBondContact O-N 3.1Å
796V65.4Low68.2Low90 Ų90105 Ų10555%0.54554%0.543SS..Hα-helixtrans-59.3-50.2180-177.30000111.2S794 L798 I799 E800S794-V796 PolarHBondContact O-N 3.4Å; V796-L798 PolarHBondContact O-N 3.21Å; V796-I799 PolarHBondContact O-N 2.95Å; V796-E800 WeakPolarHBondContact O-CB 3.45Å; V796-E800 WeakPolarHBondContact O-CG 3.42Å; V796-E800 PolarHBondContact O-N 2.91Å
797S66.4Low68.9Low68 Ų68104.6 Ų104.648%0.47654%0.544SS..Hα-helixtrans-61.7-42.6177.3-169.30000111.8S794 F795 I799 E800 D801S794-S797 PolarHBondContact O-N 2.95Å; F795-S797 PolarHBondContact O-N 3.44Å; S797-I799 VanDerWaalsContact C-N 3.34Å; S797-I799 PolarHBondContact O-N 2.98Å; S797-E800 PolarHBondContact O-N 2.72Å; S797-D801 PolarHBondContact O-N 3.46Å
798L71.3Confident69.8Low97 Ų97107 Ų10751%0.50855%0.547SS..Hα-helixtrans-66.7-35.7179.2-175.861.3000112F795 V796 L802F795-L798 HydrophobicContact CD1-CD2 4.32Å; F795-L798 HydrophobicContact CE1-CD2 4.46Å; F795-L798 PolarHBondContact O-N 2.88Å; V796-L798 PolarHBondContact O-N 3.21Å; L798-L802 HydrophobicContact CG-CD1 4.23Å; L798-L802 VanDerWaalsContact O-CB 3.26Å; L798-L802 WeakPolarHBondContact O-CB 3.38Å; L798-L802 WeakPolarHBondContact O-CD1 3.11Å; L798-L802 VanDerWaalsContact O-CG 3.26Å; L798-L802 WeakPolarHBondContact O-CG 3.4Å; L798-L802 PolarHBondContact O-N 3.27Å
799I74Confident70.7Confident79 Ų79105.9 Ų105.941%0.40554%0.542SS..Hα-helixtrans-71.3-36.1174.8-71.8165.6000110.9F795 V796 S797 K803F795-I799 HydrophobicContact CB-CD1 4.17Å; F795-I799 VanDerWaalsContact O-CB 3.28Å; F795-I799 WeakPolarHBondContact O-CB 3.36Å; F795-I799 WeakPolarHBondContact O-CD1 3.05Å; F795-I799 WeakPolarHBondContact O-CG1 3.06Å; F795-I799 PolarHBondContact O-N 3.1Å; V796-I799 PolarHBondContact O-N 2.95Å; S797-I799 VanDerWaalsContact C-N 3.34Å; S797-I799 PolarHBondContact O-N 2.98Å; I799-K803 HydrophobicContact CG2-CD 4.16Å; I799-K803 WeakPolarHBondContact O-CB 3.14Å; I799-K803 WeakPolarHBondContact O-CG 3.24Å; I799-K803 PolarHBondContact O-N 2.94Å
800E77Confident71.9Confident108 Ų108101.7 Ų101.751%0.50553%0.525SS..Hα-helixtrans-69.4-41175.3-74.8177.1165.200112.1V796 S797 K803 R804V796-E800 WeakPolarHBondContact O-CB 3.45Å; V796-E800 WeakPolarHBondContact O-CG 3.42Å; V796-E800 PolarHBondContact O-N 2.91Å; S797-E800 PolarHBondContact O-N 2.72Å; E800-K803 PolarHBondContact O-N 2.97Å; E800-R804 WeakPolarHBondContact O-CB 3.27Å; E800-R804 PolarHBondContact O-N 2.95Å
801D74.3Confident73.4Confident67 Ų6799.5 Ų99.536%0.35852%0.516SS..Hα-helixtrans-70.9-35.9173.2-73.3-40.5000112.6S797 R804 V805S797-D801 PolarHBondContact O-N 3.46Å; D801-R804 WeakPolarHBondContact O-CB 3.23Å; D801-R804 PolarHBondContact O-N 3.08Å; D801-R804 IonicContact OD1-CZ 3.88Å; D801-R804 IonicContact OD1-NE 2.75Å; D801-R804 PolarHBondContact OD1-NE 2.97Å; D801-R804 IonicContact OD1-NH2 3.25Å; D801-R804 PolarHBondContact OD1-NH2 3.43Å; D801-V805 WeakPolarHBondContact O-CG2 3.48Å; D801-V805 PolarHBondContact O-N 3.41Å
802L80Confident74.8Confident95 Ų9597.1 Ų97.150%0.49750%0.5SS..Hα-helixtrans-62.5-42.6169.4-81.4166.3000111.7L798 R804 V805 I806L798-L802 HydrophobicContact CG-CD1 4.23Å; L798-L802 VanDerWaalsContact O-CB 3.26Å; L798-L802 WeakPolarHBondContact O-CB 3.38Å; L798-L802 WeakPolarHBondContact O-CD1 3.11Å; L798-L802 VanDerWaalsContact O-CG 3.26Å; L798-L802 WeakPolarHBondContact O-CG 3.4Å; L798-L802 PolarHBondContact O-N 3.27Å; L802-R804 VanDerWaalsContact C-N 3.34Å; L802-R804 PolarHBondContact O-N 3.04Å; L802-V805 PolarHBondContact O-N 3.25Å; L802-I806 WeakPolarHBondContact O-CB 3.42Å; L802-I806 WeakPolarHBondContact O-CD1 3.27Å; L802-I806 WeakPolarHBondContact O-CG1 3.45Å; L802-I806 PolarHBondContact O-N 2.86Å
803K81.1Confident76.3Confident129 Ų12993.8 Ų93.856%0.56149%0.486SS*.Hα-helixtrans-62.5-39.7173.2-77168.1-179.9176.70112I799 E800 I806 H807I799-K803 HydrophobicContact CG2-CD 4.16Å; I799-K803 WeakPolarHBondContact O-CB 3.14Å; I799-K803 WeakPolarHBondContact O-CG 3.24Å; I799-K803 PolarHBondContact O-N 2.94Å; E800-K803 PolarHBondContact O-N 2.97Å; K803-I806 PolarHBondContact O-N 2.78Å; K803-H807 PolarHBondContact O-N 2.81Å
804R86.9Confident78.1Confident157 Ų15796.1 Ų96.159%0.59249%0.49SS*.Hα-helixtrans-60.7-48.5175.9-162.8-165-45.6-74.1-0.8110.9E800 D801 L802 H807 E808E800-R804 WeakPolarHBondContact O-CB 3.27Å; E800-R804 PolarHBondContact O-N 2.95Å; D801-R804 WeakPolarHBondContact O-CB 3.23Å; D801-R804 PolarHBondContact O-N 3.08Å; D801-R804 IonicContact OD1-CZ 3.88Å; D801-R804 IonicContact OD1-NE 2.75Å; D801-R804 PolarHBondContact OD1-NE 2.97Å; D801-R804 IonicContact OD1-NH2 3.25Å; D801-R804 PolarHBondContact OD1-NH2 3.43Å; L802-R804 VanDerWaalsContact C-N 3.34Å; L802-R804 PolarHBondContact O-N 3.04Å; R804-H807 PolarHBondContact O-N 3.39Å; R804-E808 WeakPolarHBondContact O-CB 3.44Å; R804-E808 PolarHBondContact O-N 2.92Å
805V87.3Confident79.3Confident72 Ų7294.1 Ų94.144%0.43648%0.476SS..Hα-helixtrans-65.9-40.5176.4171.50000111.4D801 L802 E808 K809D801-V805 WeakPolarHBondContact O-CG2 3.48Å; D801-V805 PolarHBondContact O-N 3.41Å; L802-V805 PolarHBondContact O-N 3.25Å; V805-E808 PolarHBondContact O-N 3.3Å; V805-K809 HydrophobicContact CG1-CG 4.3Å; V805-K809 WeakPolarHBondContact O-CB 3.32Å; V805-K809 VanDerWaalsContact O-CG 3.24Å; V805-K809 WeakPolarHBondContact O-CG 3.49Å; V805-K809 PolarHBondContact O-N 3.35Å
806I83.1Confident80.5Confident90 Ų9092.8 Ų92.846%0.46248%0.478SS..Hα-helixtrans-60.6-50175.4-72.7163.1000110.1L802 K803 E808 K809 D810L802-I806 WeakPolarHBondContact O-CB 3.42Å; L802-I806 WeakPolarHBondContact O-CD1 3.27Å; L802-I806 WeakPolarHBondContact O-CG1 3.45Å; L802-I806 PolarHBondContact O-N 2.86Å; K803-I806 PolarHBondContact O-N 2.78Å; I806-E808 VanDerWaalsContact C-N 3.34Å; I806-E808 PolarHBondContact O-N 3.35Å; I806-K809 CarbonylContact O-C 3.55Å; I806-K809 PolarHBondContact O-N 2.96Å; I806-D810 WeakPolarHBondContact CG2-OD2 3.34Å; I806-D810 PolarHBondContact O-N 2.87Å
807H83.4Confident81.3Confident141 Ų14193.9 Ų93.965%0.65348%0.477SS*.Hα-helixtrans-64.5-32.8176.5-79.1-5.7000114.2K803 R804 K809 D810 G811K803-H807 PolarHBondContact O-N 2.81Å; R804-H807 PolarHBondContact O-N 3.39Å; H807-K809 VanDerWaalsContact C-N 3.34Å; H807-D810 IonicContact ND1-OD2 2.72Å; H807-D810 PolarHBondContact ND1-OD2 3.38Å; H807-G811 PolarHBondContact O-N 3.24Å
808E85.9Confident82.3Confident97 Ų9796.9 Ų96.945%0.45348%0.484SS..Hα-helixtrans-64.1-40.6171-167.3-152.3112.500111.2R804 V805 I806 G811 Q812R804-E808 WeakPolarHBondContact O-CB 3.44Å; R804-E808 PolarHBondContact O-N 2.92Å; V805-E808 PolarHBondContact O-N 3.3Å; I806-E808 VanDerWaalsContact C-N 3.34Å; I806-E808 PolarHBondContact O-N 3.35Å; E808-G811 PolarHBondContact O-N 3.13Å; E808-Q812 WeakPolarHBondContact O-CG 3.34Å; E808-Q812 PolarHBondContact O-N 2.94Å; E808-Q812 PolarHBondContact OE1-NE2 2.81Å
809K85.8Confident83Confident91 Ų9197.6 Ų97.640%0.39649%0.488SS..Hα-helixtrans-73.5-37.8177.3-64.6-66.8165.2-113.90112.4V805 I806 H807 G811 Q812 I813V805-K809 HydrophobicContact CG1-CG 4.3Å; V805-K809 WeakPolarHBondContact O-CB 3.32Å; V805-K809 VanDerWaalsContact O-CG 3.24Å; V805-K809 WeakPolarHBondContact O-CG 3.49Å; V805-K809 PolarHBondContact O-N 3.35Å; I806-K809 CarbonylContact O-C 3.55Å; I806-K809 PolarHBondContact O-N 2.96Å; H807-K809 VanDerWaalsContact C-N 3.34Å; K809-G811 VanDerWaalsContact C-N 3.28Å; K809-G811 PolarHBondContact O-N 3.45Å; K809-Q812 PolarHBondContact O-N 3.15Å; K809-I813 WeakPolarHBondContact O-CB 3.48Å; K809-I813 WeakPolarHBondContact O-CD1 3.29Å; K809-I813 WeakPolarHBondContact O-CG1 3.35Å; K809-I813 PolarHBondContact O-N 3.24Å
810D84.1Confident83.5Confident64 Ų6499 Ų9934%0.34250%0.495SS..Hα-helixtrans-60-40170.7-61.6-31.4000110.8I806 H807 K814I806-D810 WeakPolarHBondContact CG2-OD2 3.34Å; I806-D810 PolarHBondContact O-N 2.87Å; H807-D810 IonicContact ND1-OD2 2.72Å; H807-D810 PolarHBondContact ND1-OD2 3.38Å; D810-K814 WeakPolarHBondContact O-CG 3.37Å; D810-K814 PolarHBondContact O-N 2.77Å
811G87Confident84Confident40 Ų40100 Ų10041%0.41250%0.5SS..Hα-helixtrans-67.3-40.9174.500000113.2H807 E808 K809 K814 S815H807-G811 PolarHBondContact O-N 3.24Å; E808-G811 PolarHBondContact O-N 3.13Å; K809-G811 VanDerWaalsContact C-N 3.28Å; K809-G811 PolarHBondContact O-N 3.45Å; G811-K814 PolarHBondContact O-N 3.47Å; G811-S815 WeakPolarHBondContact O-CB 3.47Å; G811-S815 PolarHBondContact O-N 3.21Å
812Q84.4Confident84.6Confident90 Ų90100.4 Ų100.442%0.42150%0.504SS..Hα-helixtrans-67.5-38.2174.2-74.8164.815.400112E808 K809 S815 V816E808-Q812 WeakPolarHBondContact O-CG 3.34Å; E808-Q812 PolarHBondContact O-N 2.94Å; E808-Q812 PolarHBondContact OE1-NE2 2.81Å; K809-Q812 PolarHBondContact O-N 3.15Å; Q812-S815 PolarHBondContact O-N 3.06Å; Q812-V816 WeakPolarHBondContact O-CG2 3.37Å; Q812-V816 PolarHBondContact O-N 2.93Å
813I83.6Confident84.7Confident88 Ų8899 Ų9945%0.45150%0.495SS..Hα-helixtrans-60.9-51.6173.2-72.9162.6000109.7K809 S815 V816 E817K809-I813 WeakPolarHBondContact O-CB 3.48Å; K809-I813 WeakPolarHBondContact O-CD1 3.29Å; K809-I813 WeakPolarHBondContact O-CG1 3.35Å; K809-I813 PolarHBondContact O-N 3.24Å; I813-S815 VanDerWaalsContact C-N 3.33Å; I813-S815 PolarHBondContact O-N 3.47Å; I813-V816 CarbonylContact O-C 3.49Å; I813-V816 WeakPolarHBondContact O-CA 3.42Å; I813-V816 WeakPolarHBondContact O-CB 3.36Å; I813-V816 PolarHBondContact O-N 3.37Å; I813-E817 HydrophobicContact CG2-CG 4.23Å; I813-E817 WeakPolarHBondContact O-CG 3.35Å; I813-E817 PolarHBondContact O-N 3.24Å
814K84.4Confident84.8Confident129 Ų12998 Ų9856%0.56150%0.495SS*.Hα-helixtrans-59-41177.5-74.9174.5-179.3-179.90113.3D810 G811 V816 E817 E818D810-K814 WeakPolarHBondContact O-CG 3.37Å; D810-K814 PolarHBondContact O-N 2.77Å; G811-K814 PolarHBondContact O-N 3.47Å; K814-V816 VanDerWaalsContact C-N 3.3Å; K814-V816 PolarHBondContact O-N 2.87Å; K814-E817 PolarHBondContact O-N 2.85Å; K814-E818 WeakPolarHBondContact O-CB 3.44Å; K814-E818 WeakPolarHBondContact O-CG 3.44Å; K814-E818 PolarHBondContact O-N 3.43Å
815S82.3Confident84.9Confident60 Ų6095.5 Ų95.542%0.4249%0.494SS..Hα-helixtrans-64.2-35175.3-176.90000112.3G811 Q812 I813 L819G811-S815 WeakPolarHBondContact O-CB 3.47Å; G811-S815 PolarHBondContact O-N 3.21Å; Q812-S815 PolarHBondContact O-N 3.06Å; I813-S815 VanDerWaalsContact C-N 3.33Å; I813-S815 PolarHBondContact O-N 3.47Å; S815-L819 WeakPolarHBondContact O-CB 3.4Å; S815-L819 WeakPolarHBondContact O-CD1 3.31Å; S815-L819 WeakPolarHBondContact O-CG 3.47Å; S815-L819 PolarHBondContact O-N 3.29Å
816V82.6Confident84.8Confident96 Ų9696.9 Ų96.958%0.58249%0.494SS*.Hα-helixtrans-72.6-36.1173170.20000111.9Q812 I813 K814 L819 L820Q812-V816 WeakPolarHBondContact O-CG2 3.37Å; Q812-V816 PolarHBondContact O-N 2.93Å; I813-V816 CarbonylContact O-C 3.49Å; I813-V816 WeakPolarHBondContact O-CA 3.42Å; I813-V816 WeakPolarHBondContact O-CB 3.36Å; I813-V816 PolarHBondContact O-N 3.37Å; K814-V816 VanDerWaalsContact C-N 3.3Å; K814-V816 PolarHBondContact O-N 2.87Å; V816-L819 PolarHBondContact O-N 3.49Å; V816-L820 WeakPolarHBondContact O-CB 3.44Å; V816-L820 PolarHBondContact O-N 3.27Å
817E82.5Confident84.9Confident113 Ų11396.1 Ų96.153%0.52849%0.493SS..Hα-helixtrans-64.7-46.3174.2-70.6170.7152.300111.3I813 K814 L820 E821I813-E817 HydrophobicContact CG2-CG 4.23Å; I813-E817 WeakPolarHBondContact O-CG 3.35Å; I813-E817 PolarHBondContact O-N 3.24Å; K814-E817 PolarHBondContact O-N 2.85Å; E817-L820 PolarHBondContact O-N 3.45Å; E817-E821 PolarHBondContact O-N 3.39Å
818E86.8Confident85Confident131 Ų13191.1 Ų91.161%0.61248%0.476SS*.Hα-helixtrans-61.4-43.5174.2-73.5174-178.100111.8K814 L820 E821 V822K814-E818 WeakPolarHBondContact O-CB 3.44Å; K814-E818 WeakPolarHBondContact O-CG 3.44Å; K814-E818 PolarHBondContact O-N 3.43Å; E818-L820 VanDerWaalsContact C-N 3.34Å; E818-L820 PolarHBondContact O-N 3.24Å; E818-E821 PolarHBondContact O-N 2.8Å; E818-V822 WeakPolarHBondContact O-CB 3.01Å; E818-V822 VanDerWaalsContact O-CG2 3.31Å; E818-V822 WeakPolarHBondContact O-CG2 3.39Å; E818-V822 PolarHBondContact O-N 2.61Å
819L85.8Confident85Confident113 Ų11390.6 Ų90.659%0.59248%0.476SS*.Hα-helixtrans-64.6-37.4174.9-76.1168.9000112.4S815 V816 E823S815-L819 WeakPolarHBondContact O-CB 3.4Å; S815-L819 WeakPolarHBondContact O-CD1 3.31Å; S815-L819 WeakPolarHBondContact O-CG 3.47Å; S815-L819 PolarHBondContact O-N 3.29Å; V816-L819 PolarHBondContact O-N 3.49Å; L819-E823 PolarHBondContact O-N 3.28Å
820L84.7Confident85.1Confident107 Ų10791.6 Ų91.656%0.5648%0.481SS*.Hα-helixtrans-69.1-40.9176.8-177.263.9000111.5V816 E817 E818 E823 L824V816-L820 WeakPolarHBondContact O-CB 3.44Å; V816-L820 PolarHBondContact O-N 3.27Å; E817-L820 PolarHBondContact O-N 3.45Å; E818-L820 VanDerWaalsContact C-N 3.34Å; E818-L820 PolarHBondContact O-N 3.24Å; L820-E823 PolarHBondContact O-N 2.94Å; L820-L824 HydrophobicContact CG-CD1 4.41Å; L820-L824 WeakPolarHBondContact O-CB 3.31Å; L820-L824 VanDerWaalsContact O-CG 3.3Å; L820-L824 WeakPolarHBondContact O-CG 3.48Å; L820-L824 PolarHBondContact O-N 2.73Å
821E87.3Confident85.1Confident131 Ų13193.8 Ų93.861%0.61249%0.489SS*.Hα-helixtrans-66.5-38.5175-173.2159.8-144.200111.6E817 E818 L824 L825E817-E821 PolarHBondContact O-N 3.39Å; E818-E821 PolarHBondContact O-N 2.8Å; E821-L824 PolarHBondContact O-N 3.36Å; E821-L825 WeakPolarHBondContact O-CG 3.35Å; E821-L825 PolarHBondContact O-N 3.19Å
822V87.9Confident85.1Confident74 Ų7498 Ų9845%0.44850%0.496SS..Hα-helixtrans-62.5-40.6171165.70000112.2E818 L825 K826E818-V822 WeakPolarHBondContact O-CB 3.01Å; E818-V822 VanDerWaalsContact O-CG2 3.31Å; E818-V822 WeakPolarHBondContact O-CG2 3.39Å; E818-V822 PolarHBondContact O-N 2.61Å; V822-L825 PolarHBondContact O-N 2.76Å; V822-K826 PolarHBondContact O-N 3.29Å
823E81.1Confident85.1Confident65 Ų6597.6 Ų97.630%0.30450%0.5SS..Hα-helixtrans-74-33.2175.6-164.459.3-13800112.4L819 L820 L825 K826 V827 K830L819-E823 PolarHBondContact O-N 3.28Å; L820-E823 PolarHBondContact O-N 2.94Å; E823-L825 VanDerWaalsContact C-N 3.31Å; E823-L825 PolarHBondContact O-N 3.48Å; E823-K826 CarbonylContact O-C 3.53Å; E823-K826 WeakPolarHBondContact O-CB 3.43Å; E823-K826 PolarHBondContact O-N 2.8Å; E823-K826 VanDerWaalsContact O-N 3.14Å; E823-K826 WeakPolarHBondContact OE1-CB 3.49Å; E823-K826 VanDerWaalsContact OE2-CD 3.28Å; E823-K826 WeakPolarHBondContact OE2-CD 3.06Å; E823-K826 WeakPolarHBondContact OE2-CE 3.31Å; E823-K826 IonicContact OE2-NZ 2.74Å; E823-K826 PolarHBondContact OE2-NZ 2.94Å; E823-V827 WeakPolarHBondContact O-CG2 3.28Å; E823-V827 PolarHBondContact O-N 2.76Å; E823-K830 IonicContact OE1-NZ 3.46Å; E823-K830 PolarHBondContact OE1-NZ 2.82Å
824L83.6Confident85.1Confident108 Ų10897.8 Ų97.857%0.56551%0.505SS*.Hα-helixtrans-60.4-40.5170.2-75.7169.7000111.4L820 E821 V827 A828L820-L824 HydrophobicContact CG-CD1 4.41Å; L820-L824 WeakPolarHBondContact O-CB 3.31Å; L820-L824 VanDerWaalsContact O-CG 3.3Å; L820-L824 WeakPolarHBondContact O-CG 3.48Å; L820-L824 PolarHBondContact O-N 2.73Å; E821-L824 PolarHBondContact O-N 3.36Å; L824-V827 PolarHBondContact O-N 3.26Å; L824-A828 WeakPolarHBondContact O-CB 3.2Å; L824-A828 PolarHBondContact O-N 2.87Å
825L89.5Confident85Confident106 Ų10696.5 Ų96.556%0.55550%0.501SS*.Hα-helixtrans-65.6-37.9172.3-73.5169.8000112.5E821 V822 E823 N829E821-L825 WeakPolarHBondContact O-CG 3.35Å; E821-L825 PolarHBondContact O-N 3.19Å; V822-L825 PolarHBondContact O-N 2.76Å; E823-L825 VanDerWaalsContact C-N 3.31Å; E823-L825 PolarHBondContact O-N 3.48Å; L825-N829 WeakPolarHBondContact O-CB 3.5Å; L825-N829 PolarHBondContact O-N 2.87Å; L825-N829 PolarHBondContact O-ND2 3.23Å
826K85.6Confident85.2Confident100 Ų10096.1 Ų96.144%0.43550%0.501SS..Hα-helixtrans-63.9-42.7171.3-73.9-176.5-121.8158.40111.7V822 E823 N829 K830V822-K826 PolarHBondContact O-N 3.29Å; E823-K826 CarbonylContact O-C 3.53Å; E823-K826 WeakPolarHBondContact O-CB 3.43Å; E823-K826 PolarHBondContact O-N 2.8Å; E823-K826 VanDerWaalsContact O-N 3.14Å; E823-K826 WeakPolarHBondContact OE1-CB 3.49Å; E823-K826 VanDerWaalsContact OE2-CD 3.28Å; E823-K826 WeakPolarHBondContact OE2-CD 3.06Å; E823-K826 WeakPolarHBondContact OE2-CE 3.31Å; E823-K826 IonicContact OE2-NZ 2.74Å; E823-K826 PolarHBondContact OE2-NZ 2.94Å; K826-N829 PolarHBondContact O-N 3.39Å; K826-K830 WeakPolarHBondContact O-CB 3.27Å; K826-K830 VanDerWaalsContact O-CG 3.22Å; K826-K830 WeakPolarHBondContact O-CG 3.29Å; K826-K830 PolarHBondContact O-N 2.87Å
827V83.6Confident85.3Confident74 Ų7496 Ų9645%0.44850%0.497SS..Hα-helixtrans-63.4-45.9176.4170.40000111E823 L824 N829 K830 E831E823-V827 WeakPolarHBondContact O-CG2 3.28Å; E823-V827 PolarHBondContact O-N 2.76Å; L824-V827 PolarHBondContact O-N 3.26Å; V827-N829 VanDerWaalsContact C-N 3.28Å; V827-N829 PolarHBondContact O-N 3.45Å; V827-K830 WeakPolarHBondContact O-CB 3.46Å; V827-K830 PolarHBondContact O-N 2.85Å; V827-E831 WeakPolarHBondContact O-CB 3.21Å; V827-E831 PolarHBondContact O-N 2.86Å
828A86.5Confident85.6Confident36 Ų3697.8 Ų97.830%0.29850%0.503SS..Hα-helixtrans-62.8-32.2176.300000112.9L824 K832L824-A828 WeakPolarHBondContact O-CB 3.2Å; L824-A828 PolarHBondContact O-N 2.87Å; A828-K832 WeakPolarHBondContact O-CG 3.49Å; A828-K832 PolarHBondContact O-N 3.37Å; A828-K832 VanDerWaalsContact O-N 3.15Å
829N86.5Confident85.5Confident86 Ų8698.2 Ų98.246%0.4651%0.505SS..Hα-helixtrans-77.4-38.5174-71.6-22.7000112.4L825 K826 V827 E831 K832 T833L825-N829 WeakPolarHBondContact O-CB 3.5Å; L825-N829 PolarHBondContact O-N 2.87Å; L825-N829 PolarHBondContact O-ND2 3.23Å; K826-N829 PolarHBondContact O-N 3.39Å; V827-N829 VanDerWaalsContact C-N 3.28Å; V827-N829 PolarHBondContact O-N 3.45Å; N829-E831 VanDerWaalsContact C-N 3.31Å; N829-E831 PolarHBondContact O-N 2.78Å; N829-K832 PolarHBondContact O-N 2.69Å; N829-K832 PolarHBondContact OD1-NZ 2.8Å; N829-T833 PolarHBondContact O-N 3.15Å
830K86.4Confident85.6Confident113 Ų11398.3 Ų98.349%0.49150%0.503SS..Hα-helixtrans-57.1-45.2169.1-71.2161.6-176.8168.70110.2E823 K826 V827 K832 T833 V834E823-K830 IonicContact OE1-NZ 3.46Å; E823-K830 PolarHBondContact OE1-NZ 2.82Å; K826-K830 WeakPolarHBondContact O-CB 3.27Å; K826-K830 VanDerWaalsContact O-CG 3.22Å; K826-K830 WeakPolarHBondContact O-CG 3.29Å; K826-K830 PolarHBondContact O-N 2.87Å; V827-K830 WeakPolarHBondContact O-CB 3.46Å; V827-K830 PolarHBondContact O-N 2.85Å; K830-K832 PolarHBondContact O-N 3.49Å; K830-T833 WeakPolarHBondContact CA-OG1 3.3Å; K830-T833 PolarHBondContact O-N 3.29Å; K830-T833 VanDerWaalsContact O-N 3.15Å; K830-T833 PolarHBondContact O-OG1 3.09Å; K830-V834 WeakPolarHBondContact O-CG2 3.36Å; K830-V834 PolarHBondContact O-N 2.92Å
831E85.9Confident85.4Confident110 Ų11097.8 Ų97.851%0.51450%0.499SS..Hα-helixtrans-60.4-45176.8-169.8-178.4174.300112.3V827 N829 T833 V834 Q835V827-E831 WeakPolarHBondContact O-CB 3.21Å; V827-E831 PolarHBondContact O-N 2.86Å; N829-E831 VanDerWaalsContact C-N 3.31Å; N829-E831 PolarHBondContact O-N 2.78Å; E831-T833 VanDerWaalsContact C-N 3.32Å; E831-T833 PolarHBondContact O-N 3.47Å; E831-V834 PolarHBondContact O-N 3.1Å; E831-V834 VanDerWaalsContact O-N 3.15Å; E831-Q835 WeakPolarHBondContact O-CG 3.31Å; E831-Q835 PolarHBondContact O-N 3.17Å; E831-Q835 PolarHBondContact OE1-NE2 3.47Å
832K86.4Confident85.5Confident128 Ų12896.5 Ų96.556%0.55749%0.493SS*.Hα-helixtrans-58.4-41.8173.3-70.2166.2-163.3162.20112.3A828 N829 K830 Q835 A836A828-K832 WeakPolarHBondContact O-CG 3.49Å; A828-K832 PolarHBondContact O-N 3.37Å; A828-K832 VanDerWaalsContact O-N 3.15Å; N829-K832 PolarHBondContact O-N 2.69Å; N829-K832 PolarHBondContact OD1-NZ 2.8Å; K830-K832 PolarHBondContact O-N 3.49Å; K832-Q835 PolarHBondContact O-N 2.94Å; K832-A836 PolarHBondContact O-N 3.48Å
833T84.1Confident85.5Confident81 Ų8196.7 Ų96.750%0.49749%0.494SS..Hα-helixtrans-66-36.7175.856.30000112.5N829 K830 E831 A836 L837N829-T833 PolarHBondContact O-N 3.15Å; K830-T833 WeakPolarHBondContact CA-OG1 3.3Å; K830-T833 PolarHBondContact O-N 3.29Å; K830-T833 VanDerWaalsContact O-N 3.15Å; K830-T833 PolarHBondContact O-OG1 3.09Å; E831-T833 VanDerWaalsContact C-N 3.32Å; E831-T833 PolarHBondContact O-N 3.47Å; T833-A836 PolarHBondContact O-N 2.81Å; T833-L837 WeakPolarHBondContact O-CB 3.45Å; T833-L837 VanDerWaalsContact O-CG 3.31Å; T833-L837 WeakPolarHBondContact O-CG 3.32Å; T833-L837 PolarHBondContact O-N 2.83Å
834V83.4Confident85.8Confident92 Ų9297.6 Ų97.656%0.55850%0.501SS*.Hα-helixtrans-66.7-37.7173.4171.40000111.5K830 E831 K838K830-V834 WeakPolarHBondContact O-CG2 3.36Å; K830-V834 PolarHBondContact O-N 2.92Å; E831-V834 PolarHBondContact O-N 3.1Å; E831-V834 VanDerWaalsContact O-N 3.15Å; V834-K838 WeakPolarHBondContact O-CB 3.19Å; V834-K838 PolarHBondContact O-N 3.45Å
835Q83.3Confident85.9Confident102 Ų10297.8 Ų97.848%0.47750%0.497SS..Hα-helixtrans-66.3-40.2174.2-69.8-177.61700112.1E831 K832 K838 Q839E831-Q835 WeakPolarHBondContact O-CG 3.31Å; E831-Q835 PolarHBondContact O-N 3.17Å; E831-Q835 PolarHBondContact OE1-NE2 3.47Å; K832-Q835 PolarHBondContact O-N 2.94Å; Q835-K838 PolarHBondContact O-N 3.08Å; Q835-Q839 WeakPolarHBondContact O-CG 3.32Å; Q835-Q839 PolarHBondContact O-N 3.31Å
836A84.9Confident85.8Confident53 Ų5399.1 Ų99.144%0.43850%0.501SS..Hα-helixtrans-63.9-50.8174.900000111.9K832 T833 K838 Q839 E840K832-A836 PolarHBondContact O-N 3.48Å; T833-A836 PolarHBondContact O-N 2.81Å; A836-K838 PolarHBondContact O-N 3.41Å; A836-Q839 WeakPolarHBondContact O-CB 3.45Å; A836-Q839 PolarHBondContact O-N 2.83Å; A836-E840 PolarHBondContact O-N 2.93Å
837L86.4Confident85.8Confident94 Ų9499.9 Ų99.949%0.49251%0.505SS..Hα-helixtrans-59-35175.4-71.1168.8000112T833 E840 I841T833-L837 WeakPolarHBondContact O-CB 3.45Å; T833-L837 VanDerWaalsContact O-CG 3.31Å; T833-L837 WeakPolarHBondContact O-CG 3.32Å; T833-L837 PolarHBondContact O-N 2.83Å; L837-E840 PolarHBondContact O-N 3.37Å; L837-I841 WeakPolarHBondContact O-CB 3.31Å; L837-I841 WeakPolarHBondContact O-CD1 3.46Å; L837-I841 WeakPolarHBondContact O-CG1 3.4Å; L837-I841 PolarHBondContact O-N 2.94Å
838K87.9Confident85.8Confident150 Ų150101 Ų10165%0.65251%0.508SS*.Hα-helixtrans-67.8-34.9175.1-175.6177.2178.6-178.40112.8V834 Q835 A836 E842V834-K838 WeakPolarHBondContact O-CB 3.19Å; V834-K838 PolarHBondContact O-N 3.45Å; Q835-K838 PolarHBondContact O-N 3.08Å; A836-K838 PolarHBondContact O-N 3.41Å; K838-E842 PolarHBondContact O-N 2.85Å
839Q85.5Confident85.7Confident139 Ų139101 Ų10165%0.6551%0.512SS*.Hα-helixtrans-69.8-43.5173-71.8173.3-8.600111Q835 A836 I841 E842 V843Q835-Q839 WeakPolarHBondContact O-CG 3.32Å; Q835-Q839 PolarHBondContact O-N 3.31Å; A836-Q839 WeakPolarHBondContact O-CB 3.45Å; A836-Q839 PolarHBondContact O-N 2.83Å; Q839-I841 PolarHBondContact O-N 3.29Å; Q839-E842 PolarHBondContact O-N 3.15Å; Q839-E842 VanDerWaalsContact O-N 3.08Å; Q839-V843 PolarHBondContact O-N 3.04Å
840E86.5Confident85.5Confident116 Ų116101.2 Ų101.254%0.54251%0.513SS..Hα-helixtrans-60.5-42.7176.3-169.9169.9-152.100112A836 L837 E842 V843 L844A836-E840 PolarHBondContact O-N 2.93Å; L837-E840 PolarHBondContact O-N 3.37Å; E840-E842 VanDerWaalsContact C-N 3.3Å; E840-E842 PolarHBondContact O-N 3.4Å; E840-V843 PolarHBondContact O-N 3.3Å; E840-L844 HydrophobicContact CG-CD1 4.35Å; E840-L844 WeakPolarHBondContact O-CB 3.23Å; E840-L844 VanDerWaalsContact O-CG 3.3Å; E840-L844 WeakPolarHBondContact O-CG 3.19Å; E840-L844 PolarHBondContact O-N 3.15Å
841I81.1Confident85.2Confident95 Ų9598.6 Ų98.649%0.48751%0.512SS..Hα-helixtrans-60.5-36.4172.2-74.1165.2000112.2L837 Q839 K845L837-I841 WeakPolarHBondContact O-CB 3.31Å; L837-I841 WeakPolarHBondContact O-CD1 3.46Å; L837-I841 WeakPolarHBondContact O-CG1 3.4Å; L837-I841 PolarHBondContact O-N 2.94Å; Q839-I841 PolarHBondContact O-N 3.29Å; I841-K845 WeakPolarHBondContact O-CG 3.21Å; I841-K845 PolarHBondContact O-N 3.47Å; I841-K845 VanDerWaalsContact O-N 3.08Å
842E88.5Confident84.9Confident104 Ų10499.6 Ų99.649%0.48652%0.517SS..Hα-helixtrans-73.8-38.7179.3-15166-159.100111.8K838 Q839 E840 K845 E846K838-E842 PolarHBondContact O-N 2.85Å; Q839-E842 PolarHBondContact O-N 3.15Å; Q839-E842 VanDerWaalsContact O-N 3.08Å; E840-E842 VanDerWaalsContact C-N 3.3Å; E840-E842 PolarHBondContact O-N 3.4Å; E842-K845 WeakPolarHBondContact O-CB 3.23Å; E842-K845 PolarHBondContact O-N 2.81Å; E842-K845 IonicContact OE1-NZ 2.68Å; E842-K845 IonicContact OE2-NZ 2.82Å; E842-K845 PolarHBondContact OE2-NZ 3.42Å; E842-E846 PolarHBondContact O-N 3.36Å; E842-E846 VanDerWaalsContact O-N 3.11Å
843V88.6Confident84.7Confident78 Ų7899.5 Ų99.547%0.47352%0.522SS..Hα-helixtrans-61.4-46.2171.3174.20000110.7Q839 E840 K845 E846 E847Q839-V843 PolarHBondContact O-N 3.04Å; E840-V843 PolarHBondContact O-N 3.3Å; V843-K845 VanDerWaalsContact C-N 3.29Å; V843-K845 PolarHBondContact O-N 3.39Å; V843-E846 WeakPolarHBondContact O-CB 3.47Å; V843-E846 PolarHBondContact O-N 2.84Å; V843-E847 HydrophobicContact CG1-CG 4.46Å; V843-E847 PolarHBondContact O-N 3.4Å
844L87.3Confident84.5Confident85 Ų85101.7 Ų101.745%0.44553%0.526SS..Hα-helixtrans-62.1-33177.5-72.6169000112.8E840 I848E840-L844 HydrophobicContact CG-CD1 4.35Å; E840-L844 WeakPolarHBondContact O-CB 3.23Å; E840-L844 VanDerWaalsContact O-CG 3.3Å; E840-L844 WeakPolarHBondContact O-CG 3.19Å; E840-L844 PolarHBondContact O-N 3.15Å; L844-I848 WeakPolarHBondContact O-CB 3.36Å; L844-I848 WeakPolarHBondContact O-CD1 3.21Å; L844-I848 WeakPolarHBondContact O-CG1 3.47Å; L844-I848 PolarHBondContact O-N 3.4Å
845K86.5Confident84.3Confident111 Ų111103.9 Ų103.948%0.48353%0.529SS..Hα-helixtrans-65.9-41.6170.8-72.3170.1-166.7164.80112.2I841 E842 V843 I848 G849I841-K845 WeakPolarHBondContact O-CG 3.21Å; I841-K845 PolarHBondContact O-N 3.47Å; I841-K845 VanDerWaalsContact O-N 3.08Å; E842-K845 WeakPolarHBondContact O-CB 3.23Å; E842-K845 PolarHBondContact O-N 2.81Å; E842-K845 IonicContact OE1-NZ 2.68Å; E842-K845 IonicContact OE2-NZ 2.82Å; E842-K845 PolarHBondContact OE2-NZ 3.42Å; V843-K845 VanDerWaalsContact C-N 3.29Å; V843-K845 PolarHBondContact O-N 3.39Å; K845-I848 PolarHBondContact O-N 2.7Å; K845-G849 PolarHBondContact O-N 2.68Å
846E86.6Confident84.1Confident135 Ų135101.7 Ų101.763%0.63153%0.528SS*.Hα-helixtrans-65.2-42.6177.8-171.2169.3-170.800110.7E842 V843 G849 N850E842-E846 PolarHBondContact O-N 3.36Å; E842-E846 VanDerWaalsContact O-N 3.11Å; V843-E846 WeakPolarHBondContact O-CB 3.47Å; V843-E846 PolarHBondContact O-N 2.84Å; E846-G849 PolarHBondContact O-N 3.34Å; E846-N850 WeakPolarHBondContact O-CB 3.49Å; E846-N850 VanDerWaalsContact O-CG 3.29Å; E846-N850 PolarHBondContact O-N 2.69Å; E846-N850 PolarHBondContact O-ND2 2.76Å; E846-N850 VanDerWaalsContact O-ND2 3.08Å
847E86.6Confident83.9Confident115 Ų115105.2 Ų105.254%0.53754%0.535SS..Hα-helixtrans-60.7-44.6172.1-70.3-175.1170.900112.6V843 G849 N850 A851V843-E847 HydrophobicContact CG1-CG 4.46Å; V843-E847 PolarHBondContact O-N 3.4Å; E847-G849 VanDerWaalsContact C-N 3.34Å; E847-G849 PolarHBondContact O-N 3.37Å; E847-N850 PolarHBondContact O-N 3.28Å; E847-A851 WeakPolarHBondContact O-CB 3.37Å; E847-A851 PolarHBondContact O-N 2.8Å
848I81.9Confident83.4Confident97 Ų97106.5 Ų106.550%0.49754%0.538SS..Hα-helixtrans-62.9-40.4175.1-71.9164.8000111.2L844 K845 A851 Q852L844-I848 WeakPolarHBondContact O-CB 3.36Å; L844-I848 WeakPolarHBondContact O-CD1 3.21Å; L844-I848 WeakPolarHBondContact O-CG1 3.47Å; L844-I848 PolarHBondContact O-N 3.4Å; K845-I848 PolarHBondContact O-N 2.7Å; I848-A851 PolarHBondContact O-N 2.81Å; I848-Q852 WeakPolarHBondContact O-CG 3.39Å; I848-Q852 PolarHBondContact O-N 3.48Å
849G84.9Confident82.9Confident37 Ų37104.8 Ų104.838%0.38154%0.536SS..Hα-helixtrans-62.1-45.8175.100000112.3K845 E846 E847 Q852 L853K845-G849 PolarHBondContact O-N 2.68Å; E846-G849 PolarHBondContact O-N 3.34Å; E847-G849 VanDerWaalsContact C-N 3.34Å; E847-G849 PolarHBondContact O-N 3.37Å; G849-Q852 PolarHBondContact O-N 3.32Å; G849-L853 PolarHBondContact O-N 3.25Å
850N83Confident82.8Confident90 Ų90101 Ų10148%0.48153%0.525SS..Hα-helixtrans-64.1-42.5176.1-72.4-37.5000111.9E846 E847 Q852 L853 E854E846-N850 WeakPolarHBondContact O-CB 3.49Å; E846-N850 VanDerWaalsContact O-CG 3.29Å; E846-N850 PolarHBondContact O-N 2.69Å; E846-N850 PolarHBondContact O-ND2 2.76Å; E846-N850 VanDerWaalsContact O-ND2 3.08Å; E847-N850 PolarHBondContact O-N 3.28Å; N850-Q852 VanDerWaalsContact C-N 3.33Å; N850-Q852 PolarHBondContact O-N 2.87Å; N850-L853 WeakPolarHBondContact O-CB 3.07Å; N850-L853 PolarHBondContact O-N 2.87Å; N850-E854 PolarHBondContact O-N 3.4Å
851A80.3Confident82.5Confident58 Ų5898.5 Ų98.548%0.47952%0.517SS..Hα-helixtrans-64.6-34.1175.400000112.8E847 I848 K855E847-A851 WeakPolarHBondContact O-CB 3.37Å; E847-A851 PolarHBondContact O-N 2.8Å; I848-A851 PolarHBondContact O-N 2.81Å; A851-K855 VanDerWaalsContact O-CB 3.28Å; A851-K855 WeakPolarHBondContact O-CB 3.3Å; A851-K855 PolarHBondContact O-N 3.07Å
852Q78.7Confident82.3Confident132 Ų13298.1 Ų98.162%0.61752%0.52SS*.Hα-helixtrans-68.8-39.2171.8-73.4-177.929.700112.2I848 G849 N850 K855 A856I848-Q852 WeakPolarHBondContact O-CG 3.39Å; I848-Q852 PolarHBondContact O-N 3.48Å; G849-Q852 PolarHBondContact O-N 3.32Å; N850-Q852 VanDerWaalsContact C-N 3.33Å; N850-Q852 PolarHBondContact O-N 2.87Å; Q852-K855 PolarHBondContact O-N 3.47Å; Q852-A856 PolarHBondContact O-N 2.72Å
853L82.8Confident81.8Confident126 Ų12697 Ų9766%0.6652%0.523SS*.Hα-helixtrans-63.5-44.7174.9-167.375.1000111.5G849 N850 A856 H857G849-L853 PolarHBondContact O-N 3.25Å; N850-L853 WeakPolarHBondContact O-CB 3.07Å; N850-L853 PolarHBondContact O-N 2.87Å; L853-A856 WeakPolarHBondContact O-CB 3.3Å; L853-A856 PolarHBondContact O-N 3.32Å; L853-H857 PolarHBondContact O-N 3.17Å
854E79.2Confident81.5Confident126 Ų12698.7 Ų98.759%0.58953%0.526SS*.Hα-helixtrans-66.5-37.6176.5-173.1169.5-16000111.9N850 A856 H857 Q858N850-E854 PolarHBondContact O-N 3.4Å; E854-A856 PolarHBondContact O-N 2.59Å; E854-H857 CarbonylContact O-C 3.56Å; E854-H857 WeakPolarHBondContact O-CB 3.49Å; E854-H857 PolarHBondContact O-N 3.01Å; E854-H857 VanDerWaalsContact O-N 3.15Å; E854-Q858 PolarHBondContact O-N 3.49Å
855K80.8Confident81.1Confident139 Ų13998.5 Ų98.560%0.60453%0.528SS*.Hα-helixtrans-62.6-39.9171.8-174.1175.9-178.8178.40112.2A851 Q852 H857 Q858 L859A851-K855 VanDerWaalsContact O-CB 3.28Å; A851-K855 WeakPolarHBondContact O-CB 3.3Å; A851-K855 PolarHBondContact O-N 3.07Å; Q852-K855 PolarHBondContact O-N 3.47Å; K855-H857 VanDerWaalsContact C-N 3.31Å; K855-Q858 PolarHBondContact O-N 3.33Å; K855-L859 WeakPolarHBondContact O-CG 3.43Å; K855-L859 PolarHBondContact O-N 3.21Å
856A78.1Confident80.8Confident56 Ų5697.4 Ų97.446%0.46353%0.525SS..Hα-helixtrans-64.1-38172.700000111.6Q852 L853 E854 L859 S860Q852-A856 PolarHBondContact O-N 2.72Å; L853-A856 WeakPolarHBondContact O-CB 3.3Å; L853-A856 PolarHBondContact O-N 3.32Å; E854-A856 PolarHBondContact O-N 2.59Å; A856-L859 PolarHBondContact O-N 2.97Å; A856-S860 PolarHBondContact O-N 3.03Å
857H81Confident80.6Confident126 Ų12698 Ų9858%0.58353%0.527SS*.Hα-helixtrans-65.6-43.1173.7-164.8-92.4000112.3L853 E854 K855 L859 S860 V861L853-H857 PolarHBondContact O-N 3.17Å; E854-H857 CarbonylContact O-C 3.56Å; E854-H857 WeakPolarHBondContact O-CB 3.49Å; E854-H857 PolarHBondContact O-N 3.01Å; E854-H857 VanDerWaalsContact O-N 3.15Å; K855-H857 VanDerWaalsContact C-N 3.31Å; H857-L859 VanDerWaalsContact C-N 3.32Å; H857-L859 PolarHBondContact O-N 3.43Å; H857-S860 WeakPolarHBondContact O-CB 3.49Å; H857-S860 PolarHBondContact O-N 2.77Å; H857-V861 WeakPolarHBondContact O-CG2 3.44Å; H857-V861 PolarHBondContact O-N 3.25Å
858Q75.1Confident80.5Confident121 Ų12197.9 Ų97.957%0.56553%0.53SS*.Hα-helixtrans-60.2-39.1173.1-75.2-170.35.300112.4E854 K855 V861 T862E854-Q858 PolarHBondContact O-N 3.49Å; K855-Q858 PolarHBondContact O-N 3.33Å; Q858-V861 PolarHBondContact O-N 3.38Å; Q858-T862 VanDerWaalsContact O-CB 3.27Å; Q858-T862 WeakPolarHBondContact O-CB 3.3Å; Q858-T862 PolarHBondContact O-N 2.64Å; Q858-T862 PolarHBondContact O-OG1 2.76Å
859L78.1Confident80.3Confident115 Ų11598 Ų9860%0.60253%0.528SS*.Hα-helixtrans-66-39.7175.7-72168.7000111.6K855 A856 H857 T862 S863K855-L859 WeakPolarHBondContact O-CG 3.43Å; K855-L859 PolarHBondContact O-N 3.21Å; A856-L859 PolarHBondContact O-N 2.97Å; H857-L859 VanDerWaalsContact C-N 3.32Å; H857-L859 PolarHBondContact O-N 3.43Å; L859-T862 PolarHBondContact O-N 2.92Å; L859-S863 PolarHBondContact O-N 3.02Å
860S83Confident80.1Confident59 Ų59100.2 Ų100.241%0.41353%0.531SS..Hα-helixtrans-60.9-50.1173.2-1740000112.1A856 H857 T862 S863 Q864A856-S860 PolarHBondContact O-N 3.03Å; H857-S860 WeakPolarHBondContact O-CB 3.49Å; H857-S860 PolarHBondContact O-N 2.77Å; S860-T862 VanDerWaalsContact C-N 3.31Å; S860-T862 PolarHBondContact O-N 2.83Å; S860-S863 WeakPolarHBondContact O-CB 3.4Å; S860-S863 PolarHBondContact O-N 3.48Å; S860-Q864 PolarHBondContact O-N 3.35Å
861V80.9Confident80.2Confident63 Ų63101.7 Ų101.738%0.38254%0.539SS..Hα-helixtrans-61-40.6176.2172.20000111.2H857 Q858 S863 Q864 V865H857-V861 WeakPolarHBondContact O-CG2 3.44Å; H857-V861 PolarHBondContact O-N 3.25Å; Q858-V861 PolarHBondContact O-N 3.38Å; V861-S863 VanDerWaalsContact C-N 3.33Å; V861-S863 PolarHBondContact O-N 3.49Å; V861-Q864 PolarHBondContact O-N 2.84Å; V861-V865 HydrophobicContact CG1-CG2 4.4Å; V861-V865 WeakPolarHBondContact O-CG2 3.38Å; V861-V865 PolarHBondContact O-N 2.87Å
862T77.2Confident80.2Confident88 Ų88104.7 Ų104.754%0.5455%0.546SS..Hα-helixtrans-62.5-39.7177.1-58.40000111.5Q858 L859 S860 V865 Q866Q858-T862 VanDerWaalsContact O-CB 3.27Å; Q858-T862 WeakPolarHBondContact O-CB 3.3Å; Q858-T862 PolarHBondContact O-N 2.64Å; Q858-T862 PolarHBondContact O-OG1 2.76Å; L859-T862 PolarHBondContact O-N 2.92Å; S860-T862 VanDerWaalsContact C-N 3.31Å; S860-T862 PolarHBondContact O-N 2.83Å; T862-V865 PolarHBondContact O-N 3.36Å; T862-Q866 WeakPolarHBondContact O-CB 3.42Å; T862-Q866 PolarHBondContact O-N 2.94Å
863S77.4Confident80.5Confident81 Ų81104.4 Ų104.457%0.56654%0.54SS*.Hα-helixtrans-62.9-44.9174.1-164.50000111.9L859 S860 V861 V865 Q866 E867L859-S863 PolarHBondContact O-N 3.02Å; S860-S863 WeakPolarHBondContact O-CB 3.4Å; S860-S863 PolarHBondContact O-N 3.48Å; V861-S863 VanDerWaalsContact C-N 3.33Å; V861-S863 PolarHBondContact O-N 3.49Å; S863-V865 PolarHBondContact O-N 2.94Å; S863-Q866 PolarHBondContact O-N 3.37Å; S863-E867 PolarHBondContact O-N 2.79Å
864Q83.3Confident80.3Confident113 Ų113100.1 Ų100.153%0.52853%0.525SS..Hα-helixtrans-63.1-41.6176-66.8176.51700112.1S860 V861 E867 L868S860-Q864 PolarHBondContact O-N 3.35Å; V861-Q864 PolarHBondContact O-N 2.84Å; Q864-E867 PolarHBondContact O-N 2.89Å; Q864-L868 WeakPolarHBondContact O-CB 3.41Å; Q864-L868 WeakPolarHBondContact O-CG 3.46Å; Q864-L868 PolarHBondContact O-N 3.02Å
865V78.5Confident80.3Confident81 Ų8199.7 Ų99.749%0.49152%0.521SS..Hα-helixtrans-62.7-42174.3169.70000111V861 T862 S863 E867 L868 Q869V861-V865 HydrophobicContact CG1-CG2 4.4Å; V861-V865 WeakPolarHBondContact O-CG2 3.38Å; V861-V865 PolarHBondContact O-N 2.87Å; T862-V865 PolarHBondContact O-N 3.36Å; S863-V865 PolarHBondContact O-N 2.94Å; V865-E867 VanDerWaalsContact C-N 3.35Å; V865-E867 PolarHBondContact O-N 3.38Å; V865-L868 PolarHBondContact O-N 3.28Å; V865-Q869 VanDerWaalsContact O-CB 3.27Å; V865-Q869 WeakPolarHBondContact O-CB 3.27Å; V865-Q869 PolarHBondContact O-N 3.36Å
866Q79.3Confident80.1Confident88 Ų8899 Ų9941%0.41152%0.521SS..Hα-helixtrans-64.1-39.1177.2-173.66180.600112.3T862 S863 Q869 N870T862-Q866 WeakPolarHBondContact O-CB 3.42Å; T862-Q866 PolarHBondContact O-N 2.94Å; S863-Q866 PolarHBondContact O-N 3.37Å; Q866-Q869 PolarHBondContact O-N 2.75Å; Q866-N870 PolarHBondContact NE2-OD1 3.04Å; Q866-N870 PolarHBondContact O-N 3.5Å; Q866-N870 PolarHBondContact O-ND2 3.25Å
867E81.9Confident80.2Confident146 Ų146102.1 Ų102.168%0.68253%0.525SS*.Hα-helixtrans-67.2-44.5176.8-168.7166.2-130.800111.6S863 Q864 V865 Q869 N870 L871S863-E867 PolarHBondContact O-N 2.79Å; Q864-E867 PolarHBondContact O-N 2.89Å; V865-E867 VanDerWaalsContact C-N 3.35Å; V865-E867 PolarHBondContact O-N 3.38Å; E867-Q869 VanDerWaalsContact C-N 3.32Å; E867-Q869 PolarHBondContact O-N 3.15Å; E867-N870 PolarHBondContact O-N 2.87Å; E867-L871 PolarHBondContact O-N 3.46Å
868L84.4Confident80.1Confident114 Ų114100.9 Ų100.960%0.59752%0.52SS*.Hα-helixtrans-61.2-38.6171.5-72.3170.8000112.3Q864 V865 L871 L872Q864-L868 WeakPolarHBondContact O-CB 3.41Å; Q864-L868 WeakPolarHBondContact O-CG 3.46Å; Q864-L868 PolarHBondContact O-N 3.02Å; V865-L868 PolarHBondContact O-N 3.28Å; L868-L871 PolarHBondContact O-N 3.45Å; L868-L872 WeakPolarHBondContact O-CB 3.36Å; L868-L872 PolarHBondContact O-N 3Å
869Q77.5Confident80.1Confident98 Ų9899 Ų9946%0.45852%0.517SS..Hα-helixtrans-69.2-34.1178.6-161.4-179.858.700111.9V865 Q866 E867 R873V865-Q869 VanDerWaalsContact O-CB 3.27Å; V865-Q869 WeakPolarHBondContact O-CB 3.27Å; V865-Q869 PolarHBondContact O-N 3.36Å; Q866-Q869 PolarHBondContact O-N 2.75Å; E867-Q869 VanDerWaalsContact C-N 3.32Å; E867-Q869 PolarHBondContact O-N 3.15Å; Q869-R873 WeakPolarHBondContact O-CB 3.48Å; Q869-R873 PolarHBondContact O-N 2.95Å
870N81.7Confident80.1Confident84 Ų8497.9 Ų97.945%0.44951%0.511SS..Hα-helixtrans-68.7-40.2171.1-68.9-19.6000111.6Q866 E867 L872 R873 G874Q866-N870 PolarHBondContact NE2-OD1 3.04Å; Q866-N870 PolarHBondContact O-N 3.5Å; Q866-N870 PolarHBondContact O-ND2 3.25Å; E867-N870 PolarHBondContact O-N 2.87Å; N870-L872 VanDerWaalsContact C-N 3.34Å; N870-R873 PolarHBondContact O-N 2.8Å; N870-G874 PolarHBondContact O-N 2.98Å
871L85.3Confident79.7Confident121 Ų12199 Ų9963%0.63452%0.519SS*.Hα-helixtrans-64.5-39175.2-161.374.5000111.9E867 L868 G874 K875E867-L871 PolarHBondContact O-N 3.46Å; L868-L871 PolarHBondContact O-N 3.45Å; L871-G874 PolarHBondContact O-N 3.22Å; L871-K875 WeakPolarHBondContact O-CG 3.3Å; L871-K875 PolarHBondContact O-N 2.84Å; L871-K875 VanDerWaalsContact O-N 3.09Å
872L79.6Confident79.4Confident121 Ų121101.1 Ų101.163%0.63453%0.526SS*.Hα-helixtrans-65.1-43.4175.3-166.173.5000111.4L868 N870 G874 K875 E876L868-L872 WeakPolarHBondContact O-CB 3.36Å; L868-L872 PolarHBondContact O-N 3Å; N870-L872 VanDerWaalsContact C-N 3.34Å; L872-G874 PolarHBondContact O-N 3.47Å; L872-K875 CarbonylContact O-C 3.59Å; L872-K875 WeakPolarHBondContact O-CA 3.25Å; L872-K875 WeakPolarHBondContact O-CB 3.31Å; L872-K875 PolarHBondContact O-N 3.17Å; L872-K875 VanDerWaalsContact O-N 3.07Å; L872-E876 PolarHBondContact O-N 2.85Å
873R84.8Confident79.5Confident127 Ų127102.5 Ų102.548%0.47953%0.525SS..Hα-helixtrans-57.9-47.6174.6-169.3-166.2-53.5-86.2-2.5111.9Q869 N870 K875 E876 E877Q869-R873 WeakPolarHBondContact O-CB 3.48Å; Q869-R873 PolarHBondContact O-N 2.95Å; N870-R873 PolarHBondContact O-N 2.8Å; R873-K875 PolarHBondContact O-N 2.75Å; R873-E876 WeakPolarHBondContact O-CB 3.38Å; R873-E876 PolarHBondContact O-N 3.42Å; R873-E876 VanDerWaalsContact O-N 3.11Å; R873-E877 WeakPolarHBondContact O-CG 3.28Å; R873-E877 PolarHBondContact O-N 3.33Å
874G78.9Confident79.3Confident35 Ų35101.2 Ų101.236%0.36152%0.519SS..Hα-helixtrans-63.2-27.6175.300000113.6N870 L871 L872 Q878N870-G874 PolarHBondContact O-N 2.98Å; L871-G874 PolarHBondContact O-N 3.22Å; L872-G874 PolarHBondContact O-N 3.47Å; G874-Q878 WeakPolarHBondContact O-CB 3.47Å; G874-Q878 PolarHBondContact O-N 3.47Å; G874-Q878 VanDerWaalsContact O-N 3.16Å
875K80.1Confident78.7Confident117 Ų11798.6 Ų98.651%0.50952%0.517SS..Hα-helixtrans-75.9-37.1171.4-75.1-74.6164.5-169.50112.8L871 L872 R873 Q878 V879L871-K875 WeakPolarHBondContact O-CG 3.3Å; L871-K875 PolarHBondContact O-N 2.84Å; L871-K875 VanDerWaalsContact O-N 3.09Å; L872-K875 CarbonylContact O-C 3.59Å; L872-K875 WeakPolarHBondContact O-CA 3.25Å; L872-K875 WeakPolarHBondContact O-CB 3.31Å; L872-K875 PolarHBondContact O-N 3.17Å; L872-K875 VanDerWaalsContact O-N 3.07Å; R873-K875 PolarHBondContact O-N 2.75Å; K875-Q878 PolarHBondContact O-N 2.93Å; K875-V879 WeakPolarHBondContact O-CG2 3.43Å; K875-V879 PolarHBondContact O-N 2.74Å
876E77.2Confident78.4Confident125 Ų125100.1 Ų100.158%0.58452%0.521SS*.Hα-helixtrans-66.1-42.2174.7-172.3169.3-143.100111.5L872 R873 Q878 V879 N880L872-E876 PolarHBondContact O-N 2.85Å; R873-E876 WeakPolarHBondContact O-CB 3.38Å; R873-E876 PolarHBondContact O-N 3.42Å; R873-E876 VanDerWaalsContact O-N 3.11Å; E876-Q878 PolarHBondContact O-N 3.48Å; E876-V879 PolarHBondContact O-N 3.32Å; E876-N880 WeakPolarHBondContact O-CB 3.2Å; E876-N880 PolarHBondContact O-N 2.78Å; E876-N880 PolarHBondContact O-ND2 2.84Å
877E78.9Confident78.2Confident121 Ų12199.9 Ų99.957%0.56552%0.52SS*.Hα-helixtrans-59.7-42.7170.4-71.3167.3-164.600111.9R873 N880 S881R873-E877 WeakPolarHBondContact O-CG 3.28Å; R873-E877 PolarHBondContact O-N 3.33Å; E877-N880 PolarHBondContact O-N 2.87Å; E877-S881 WeakPolarHBondContact O-CB 3.39Å; E877-S881 PolarHBondContact O-N 3.44Å
878Q78.1Confident77.4Confident101 Ų10197.6 Ų97.647%0.47251%0.513SS..Hα-helixtrans-64.2-38.7174.5-179.4164.375.900112.5G874 K875 E876 M882G874-Q878 WeakPolarHBondContact O-CB 3.47Å; G874-Q878 PolarHBondContact O-N 3.47Å; G874-Q878 VanDerWaalsContact O-N 3.16Å; K875-Q878 PolarHBondContact O-N 2.93Å; E876-Q878 PolarHBondContact O-N 3.48Å; Q878-M882 WeakPolarHBondContact O-CG 3.27Å; Q878-M882 PolarHBondContact O-N 2.87Å
879V76.9Confident76.5Confident82 Ų8299.8 Ų99.850%0.49751%0.513SS..Hα-helixtrans-67.4-42174.1167.50000111.6K875 E876 S881 M882 K883K875-V879 WeakPolarHBondContact O-CG2 3.43Å; K875-V879 PolarHBondContact O-N 2.74Å; E876-V879 PolarHBondContact O-N 3.32Å; V879-S881 VanDerWaalsContact C-N 3.32Å; V879-S881 PolarHBondContact O-N 3.14Å; V879-M882 HydrophobicContact CB-CE 4.49Å; V879-M882 HydrophobicContact CG2-CE 3.96Å; V879-M882 PolarHBondContact O-N 2.82Å; V879-K883 WeakPolarHBondContact O-CB 3.37Å; V879-K883 PolarHBondContact O-N 3.22Å
880N77.9Confident75.7Confident91 Ų9198.6 Ų98.649%0.48751%0.51SS..Hα-helixtrans-64-37.4176.6-75.7-45.7000112E876 E877 K883 A884E876-N880 WeakPolarHBondContact O-CB 3.2Å; E876-N880 PolarHBondContact O-N 2.78Å; E876-N880 PolarHBondContact O-ND2 2.84Å; E877-N880 PolarHBondContact O-N 2.87Å; N880-K883 PolarHBondContact O-N 3.32Å; N880-A884 PolarHBondContact O-N 2.91Å
881S74.6Confident74.9Confident83 Ų83101.2 Ų101.258%0.5851%0.514SS*.Hα-helixtrans-63.3-45.4171.8-174.10000112.3E877 V879 K883 A884 A885E877-S881 WeakPolarHBondContact O-CB 3.39Å; E877-S881 PolarHBondContact O-N 3.44Å; V879-S881 VanDerWaalsContact C-N 3.32Å; V879-S881 PolarHBondContact O-N 3.14Å; S881-K883 VanDerWaalsContact C-N 3.32Å; S881-K883 PolarHBondContact O-N 3.49Å; S881-A884 PolarHBondContact O-N 3.28Å; S881-A885 PolarHBondContact O-N 3.25Å; S881-A885 VanDerWaalsContact O-N 3.12Å
882M73.7Confident73.4Confident107 Ų107101.8 Ų101.853%0.52752%0.517SS..Hα-helixtrans-62.3-37.9173-70.5-171-61.600112.5Q878 V879 A885 L886Q878-M882 WeakPolarHBondContact O-CG 3.27Å; Q878-M882 PolarHBondContact O-N 2.87Å; V879-M882 HydrophobicContact CB-CE 4.49Å; V879-M882 HydrophobicContact CG2-CE 3.96Å; V879-M882 PolarHBondContact O-N 2.82Å; M882-A885 PolarHBondContact O-N 2.9Å; M882-L886 WeakPolarHBondContact O-CG 3.28Å; M882-L886 PolarHBondContact O-N 2.97Å
883K79.3Confident72.1Confident116 Ų116100.9 Ų100.950%0.50451%0.512SS..Hα-helixtrans-63.7-44.4177.2-169-170.6178.9-152.50111.5V879 N880 S881 A885 L886 E887V879-K883 WeakPolarHBondContact O-CB 3.37Å; V879-K883 PolarHBondContact O-N 3.22Å; N880-K883 PolarHBondContact O-N 3.32Å; S881-K883 VanDerWaalsContact C-N 3.32Å; S881-K883 PolarHBondContact O-N 3.49Å; K883-A885 VanDerWaalsContact C-N 3.33Å; K883-A885 PolarHBondContact O-N 3.39Å; K883-L886 PolarHBondContact O-N 2.93Å; K883-E887 WeakPolarHBondContact CE-OE1 3.5Å; K883-E887 IonicContact NZ-OE1 3.6Å; K883-E887 PolarHBondContact NZ-OE1 2.84Å; K883-E887 WeakPolarHBondContact O-CG 3.32Å; K883-E887 PolarHBondContact O-N 2.9Å
884A74Confident70.6Confident55 Ų55103.1 Ų103.146%0.45552%0.521SS..Hα-helixtrans-60.3-41.717500000112.1N880 S881 E887 D888N880-A884 PolarHBondContact O-N 2.91Å; S881-A884 PolarHBondContact O-N 3.28Å; A884-E887 PolarHBondContact O-N 3.17Å; A884-D888 PolarHBondContact O-N 2.85Å
885A71.1Confident69.3Low57 Ų57104.6 Ų104.647%0.47154%0.536SS..Hα-helixtrans-67.3-32.8175.500000113.3S881 M882 K883 R889S881-A885 PolarHBondContact O-N 3.25Å; S881-A885 VanDerWaalsContact O-N 3.12Å; M882-A885 PolarHBondContact O-N 2.9Å; K883-A885 VanDerWaalsContact C-N 3.33Å; K883-A885 PolarHBondContact O-N 3.39Å; A885-R889 PolarHBondContact O-N 2.86Å; A885-R889 VanDerWaalsContact O-N 3.16Å
886L71.6Confident67.4Low113 Ų113109.3 Ų109.359%0.59255%0.551SS**Hα-helixtrans-68.5-45.5170.7-74.1171.1000111.1M882 K883 D888 R889 D890M882-L886 WeakPolarHBondContact O-CG 3.28Å; M882-L886 PolarHBondContact O-N 2.97Å; K883-L886 PolarHBondContact O-N 2.93Å; L886-D888 VanDerWaalsContact C-N 3.25Å; L886-D888 PolarHBondContact O-N 3.22Å; L886-R889 CarbonylContact O-C 3.58Å; L886-R889 WeakPolarHBondContact O-CB 3.41Å; L886-R889 PolarHBondContact O-N 2.96Å; L886-R889 VanDerWaalsContact O-N 3.11Å; L886-D890 WeakPolarHBondContact O-CB 3.49Å; L886-D890 PolarHBondContact O-N 3.43Å
887E75.8Confident65.3Low83 Ų83107.3 Ų107.339%0.38856%0.564SS.*Hα-helixtrans-61.6-30.5177.2-73177.5-162.800112.9K883 A884 D890 R891K883-E887 WeakPolarHBondContact CE-OE1 3.5Å; K883-E887 IonicContact NZ-OE1 3.6Å; K883-E887 PolarHBondContact NZ-OE1 2.84Å; K883-E887 WeakPolarHBondContact O-CG 3.32Å; K883-E887 PolarHBondContact O-N 2.9Å; A884-E887 PolarHBondContact O-N 3.17Å; E887-D890 PolarHBondContact O-N 3.44Å; E887-R891 WeakPolarHBondContact O-CG 3.31Å; E887-R891 PolarHBondContact O-N 3.48Å
888D64.5Low62.9Low99 Ų99108.1 Ų108.153%0.52958%0.577SS.*Hα-helixtrans-70.2-45.1170.1-113.15.3000112.5A884 L886 D890 R891 D892A884-D888 PolarHBondContact O-N 2.85Å; L886-D888 VanDerWaalsContact C-N 3.25Å; L886-D888 PolarHBondContact O-N 3.22Å; D888-D890 PolarHBondContact O-N 3.33Å; D888-R891 WeakPolarHBondContact O-CB 3.28Å; D888-R891 PolarHBondContact O-N 3.03Å; D888-R891 VanDerWaalsContact O-N 3.17Å; D888-R891 IonicContact OD1-CZ 3.14Å; D888-R891 IonicContact OD1-NE 2.76Å; D888-R891 PolarHBondContact OD1-NE 2.9Å; D888-R891 IonicContact OD1-NH2 2.79Å; D888-R891 PolarHBondContact OD1-NH2 3.2Å; D888-D892 PolarHBondContact O-N 2.88Å
889R64.9Low60.4Low160 Ų160109.1 Ų109.160%0.60459%0.594SS**Hα-helixtrans-59.7-33.2171.7-75-178.960.882.82.3112.2A885 L886 D892 L893A885-R889 PolarHBondContact O-N 2.86Å; A885-R889 VanDerWaalsContact O-N 3.16Å; L886-R889 CarbonylContact O-C 3.58Å; L886-R889 WeakPolarHBondContact O-CB 3.41Å; L886-R889 PolarHBondContact O-N 2.96Å; L886-R889 VanDerWaalsContact O-N 3.11Å; R889-D892 WeakPolarHBondContact O-CB 3.31Å; R889-D892 PolarHBondContact O-N 3.17Å; R889-L893 WeakPolarHBondContact O-CB 3.18Å; R889-L893 VanDerWaalsContact O-CG 3.25Å; R889-L893 WeakPolarHBondContact O-CG 3.48Å; R889-L893 PolarHBondContact O-N 3.04Å
890D62.1Low58.1Low73 Ų73109.2 Ų109.239%0.3960%0.603SS.*Hα-helixtrans-76.8-27-179.7-139.349.8000112.1L886 E887 D888 R894L886-D890 WeakPolarHBondContact O-CB 3.49Å; L886-D890 PolarHBondContact O-N 3.43Å; E887-D890 PolarHBondContact O-N 3.44Å; D888-D890 PolarHBondContact O-N 3.33Å; D890-R894 VanDerWaalsContact O-CZ 3.26Å; D890-R894 PolarHBondContact O-N 3.19Å; D890-R894 PolarHBondContact O-NE 2.9Å; D890-R894 PolarHBondContact O-NH2 2.93Å; D890-R894 IonicContact OD2-CZ 3.47Å; D890-R894 IonicContact OD2-NH1 2.82Å; D890-R894 PolarHBondContact OD2-NH1 3.07Å; D890-R894 IonicContact OD2-NH2 2.66Å; D890-R894 PolarHBondContact OD2-NH2 2.84Å
891R64.3Low56Low139 Ų139113 Ų11353%0.52562%0.618SS.*Hα-helixtrans-65.6-46.3163.7-76.6-179.4-81-86.56.4111E887 D888 L893E887-R891 WeakPolarHBondContact O-CG 3.31Å; E887-R891 PolarHBondContact O-N 3.48Å; D888-R891 WeakPolarHBondContact O-CB 3.28Å; D888-R891 PolarHBondContact O-N 3.03Å; D888-R891 VanDerWaalsContact O-N 3.17Å; D888-R891 IonicContact OD1-CZ 3.14Å; D888-R891 IonicContact OD1-NE 2.76Å; D888-R891 PolarHBondContact OD1-NE 2.9Å; D888-R891 IonicContact OD1-NH2 2.79Å; D888-R891 PolarHBondContact OD1-NH2 3.2Å; R891-L893 PolarHBondContact O-N 2.89Å
892D53.3Low53.9Low132 Ų132114.8 Ų114.871%0.70663%0.625SS**Hα-helixtrans-62.7-39.6177.7-114.715.4000113D888 R889 G895D888-D892 PolarHBondContact O-N 2.88Å; R889-D892 WeakPolarHBondContact O-CB 3.31Å; R889-D892 PolarHBondContact O-N 3.17Å; D892-G895 PolarHBondContact O-N 3.43Å
893L52.5Low51.6Low102 Ų102115.5 Ų115.553%0.53464%0.639SS.*Hα-helixtrans-74.2-35.3-179.3-74.3169000113R889 R891 G895 R896R889-L893 WeakPolarHBondContact O-CB 3.18Å; R889-L893 VanDerWaalsContact O-CG 3.25Å; R889-L893 WeakPolarHBondContact O-CG 3.48Å; R889-L893 PolarHBondContact O-N 3.04Å; R891-L893 PolarHBondContact O-N 2.89Å; L893-G895 PolarHBondContact O-N 2.66Å; L893-R896 PolarHBondContact O-N 2.9Å; L893-R896 VanDerWaalsContact O-N 3.1Å
894R52.9Low49.3Very low174 Ų174114.4 Ų114.466%0.65765%0.646SS**THydrogen-bonded Turntrans-62.9-9.9173.3-88.4-177-79.3-80.3-1.5114D890 R896D890-R894 VanDerWaalsContact O-CZ 3.26Å; D890-R894 PolarHBondContact O-N 3.19Å; D890-R894 PolarHBondContact O-NE 2.9Å; D890-R894 PolarHBondContact O-NH2 2.93Å; D890-R894 IonicContact OD2-CZ 3.47Å; D890-R894 IonicContact OD2-NH1 2.82Å; D890-R894 PolarHBondContact OD2-NH1 3.07Å; D890-R894 IonicContact OD2-NH2 2.66Å; D890-R894 PolarHBondContact OD2-NH2 2.84Å; R894-R896 VanDerWaalsContact C-N 3.27Å; R894-R896 PolarHBondContact O-N 2.89Å
895G51.9Low47.2Very low66 Ų66118 Ų11868%0.6866%0.662SS**THydrogen-bonded Turntrans-73.6-2.6169.500000115.9D892 L893D892-G895 PolarHBondContact O-N 3.43Å; L893-G895 PolarHBondContact O-N 2.66Å
896R40.5Very low46.3Very low217 Ų217120.8 Ų120.882%0.81968%0.676SS**SBendtrans-142.6120.3-173.7-56-179.5-156.7-104.7-2.5115.4L893 R894L893-R896 PolarHBondContact O-N 2.9Å; L893-R896 VanDerWaalsContact O-N 3.1Å; R894-R896 VanDerWaalsContact C-N 3.27Å; R894-R896 PolarHBondContact O-N 2.89Å
897G33.3Very low44.9Very low83 Ų83121.2 Ų121.286%0.85668%0.675SS**  trans100.1121.914300000117.9
898T28.8Very low43.6Very low138 Ų138124.4 Ų124.485%0.84769%0.688SS**  trans-117.4178.9172.248.80000111.5
899C25.7Very low42.9Very low121 Ų121128.1 Ų128.182%0.81870%0.702SS**  trans82.6134.4-177.4-690000115.4
900A28.1Very low42.5Very low85 Ų85126 Ų12670%0.70270%0.699SS**  cis83.914540.300000112.2
901Q32.8Very low42.3Very low170 Ų170126.2 Ų126.279%0.79470%0.7SS**  cis-177.4159.4-1.4150.8-175.1-4.100110.8
902V30.7Very low42.2Very low121 Ų121124.3 Ų124.373%0.73370%0.697SS**  trans65131.9159.81590000120.9
903C25.1Very low42.7Very low122 Ų122121.7 Ų121.782%0.82469%0.688SS**  -165.9170.7117.5-150.40000111.4
904S30.9Very low43.7Very low93 Ų93119.2 Ų119.265%0.6568%0.677SS**  trans-151.1152.9-169.2-55.20000114.8
905T30.3Very low44.6Very low129 Ų129115.9 Ų115.979%0.79167%0.672SS**  trans62.7164160.247.70000118.8
906P51.8Low45.8Very low116 Ų116118.6 Ų118.675%0.75367%0.665SS**  cis-123.6148.7-11.635.1-19.7000114.6
907Q43.5Very low47.5Very low123 Ų123114 Ų11458%0.57565%0.653SS**  trans-148.737167.9-158.8169.4-4.500111E909 E910 L911Q907-E909 PolarHBondContact O-N 2.88Å; Q907-E910 HydrophobicContact CG-CB 4.43Å; Q907-E910 PolarHBondContact NE2-OE2 2.78Å; Q907-L911 HydrophobicContact CB-CD1 4.24Å; Q907-L911 WeakPolarHBondContact O-CB 3.49Å; Q907-L911 VanDerWaalsContact O-CG 3.31Å; Q907-L911 WeakPolarHBondContact O-CG 3.35Å; Q907-L911 PolarHBondContact O-N 3.38Å
908F48.1Very low49.7Very low150 Ų150115.7 Ų115.766%0.65864%0.637SS**Hα-helixtrans-73.8-28.6-149.6-149.7-97.9000116L911 E912F908-L911 CarbonylContact O-C 3.55Å; F908-L911 WeakPolarHBondContact O-CB 3.45Å; F908-E912 PolarHBondContact O-N 2.9Å
909E50.3Low52.1Low177 Ų177112.7 Ų112.783%0.82762%0.616SS**Hα-helixtrans-84.3-35-177.5-65.4174.6133.800112.5Q907 L911 E912 S913Q907-E909 PolarHBondContact O-N 2.88Å; E909-L911 VanDerWaalsContact C-N 3.32Å; E909-E912 PolarHBondContact O-N 2.84Å; E909-S913 PolarHBondContact O-N 3.46Å
910E55.7Low54.6Low116 Ų116111.1 Ų111.154%0.54260%0.599SS.*Hα-helixtrans-66.5-38.8165.5-173.9174.3-155.300110.2Q907 E912 S913 V914Q907-E910 HydrophobicContact CG-CB 4.43Å; Q907-E910 PolarHBondContact NE2-OE2 2.78Å; E910-E912 VanDerWaalsContact C-N 3.25Å; E910-E912 PolarHBondContact O-N 3.46Å; E910-S913 PolarHBondContact O-N 3.35Å; E910-S913 PolarHBondContact O-OG 2.89Å; E910-V914 HydrophobicContact CG-CG2 4.42Å; E910-V914 VanDerWaalsContact O-CB 3.32Å; E910-V914 WeakPolarHBondContact O-CB 3.22Å; E910-V914 VanDerWaalsContact O-CG2 3.26Å; E910-V914 WeakPolarHBondContact O-CG2 3.48Å; E910-V914 PolarHBondContact O-N 3.44Å
911L57.3Low57.1Low77 Ų77110.1 Ų110.140%0.40358%0.58SS.*Hα-helixtrans-60.8-26.9170.2-81.5167.6000113.4Q907 F908 E909 L915Q907-L911 HydrophobicContact CB-CD1 4.24Å; Q907-L911 WeakPolarHBondContact O-CB 3.49Å; Q907-L911 VanDerWaalsContact O-CG 3.31Å; Q907-L911 WeakPolarHBondContact O-CG 3.35Å; Q907-L911 PolarHBondContact O-N 3.38Å; F908-L911 CarbonylContact O-C 3.55Å; F908-L911 WeakPolarHBondContact O-CB 3.45Å; E909-L911 VanDerWaalsContact C-N 3.32Å; L911-L915 WeakPolarHBondContact O-CA 3.46Å; L911-L915 WeakPolarHBondContact O-CB 3.29Å; L911-L915 WeakPolarHBondContact O-CD1 3.46Å; L911-L915 WeakPolarHBondContact O-CG 3.32Å; L911-L915 PolarHBondContact O-N 3.22Å
912E63.3Low59.3Low99 Ų99106 Ų10646%0.46356%0.563SS.*Hα-helixtrans-77.1-38.5178.7-153.9-160.8133.100112.6F908 E909 E910 L915 K916F908-E912 PolarHBondContact O-N 2.9Å; E909-E912 PolarHBondContact O-N 2.84Å; E910-E912 VanDerWaalsContact C-N 3.25Å; E910-E912 PolarHBondContact O-N 3.46Å; E912-L915 PolarHBondContact O-N 2.91Å; E912-K916 PolarHBondContact O-N 2.84Å; E912-K916 IonicContact OE1-NZ 3.04Å; E912-K916 PolarHBondContact OE1-NZ 3.4Å
913S64.1Low61.8Low76 Ų76104.9 Ų104.953%0.53155%0.548SS..Hα-helixtrans-70.3-42.7173.869.80000111E909 E910 L915 K916 E917E909-S913 PolarHBondContact O-N 3.46Å; E910-S913 PolarHBondContact O-N 3.35Å; E910-S913 PolarHBondContact O-OG 2.89Å; S913-L915 VanDerWaalsContact C-N 3.34Å; S913-L915 PolarHBondContact O-N 3.36Å; S913-K916 PolarHBondContact O-N 3.07Å; S913-E917 PolarHBondContact O-N 2.98Å
914V72.1Confident64.5Low50 Ų50105 Ų10530%0.30353%0.531SS..Hα-helixtrans-62.5-40171.6172.90000110.5E910 K916 E917 K918E910-V914 HydrophobicContact CG-CG2 4.42Å; E910-V914 VanDerWaalsContact O-CB 3.32Å; E910-V914 WeakPolarHBondContact O-CB 3.22Å; E910-V914 VanDerWaalsContact O-CG2 3.26Å; E910-V914 WeakPolarHBondContact O-CG2 3.48Å; E910-V914 PolarHBondContact O-N 3.44Å; V914-K916 PolarHBondContact O-N 3.35Å; V914-E917 PolarHBondContact O-N 3.4Å; V914-K918 HydrophobicContact CG1-CG 3.83Å; V914-K918 VanDerWaalsContact O-CB 3.27Å; V914-K918 WeakPolarHBondContact O-CB 3.4Å; V914-K918 WeakPolarHBondContact O-CG 3.36Å; V914-K918 PolarHBondContact O-N 2.98Å
915L73.2Confident67Low104 Ų104104.9 Ų104.955%0.54552%0.522SS..Hα-helixtrans-60.6-44.8174.3-86.4164.7000110.9L911 E912 S913 E917 K918 D919L911-L915 WeakPolarHBondContact O-CA 3.46Å; L911-L915 WeakPolarHBondContact O-CB 3.29Å; L911-L915 WeakPolarHBondContact O-CD1 3.46Å; L911-L915 WeakPolarHBondContact O-CG 3.32Å; L911-L915 PolarHBondContact O-N 3.22Å; E912-L915 PolarHBondContact O-N 2.91Å; S913-L915 VanDerWaalsContact C-N 3.34Å; S913-L915 PolarHBondContact O-N 3.36Å; L915-E917 PolarHBondContact O-N 3.39Å; L915-K918 CarbonylContact O-C 3.49Å; L915-K918 PolarHBondContact O-N 2.81Å; L915-D919 WeakPolarHBondContact O-CB 3.45Å; L915-D919 PolarHBondContact O-N 2.94Å
916K76.2Confident69.4Low124 Ų124104.1 Ų104.154%0.53951%0.51SS..Hα-helixtrans-64.8-36.9175.9-82.5164.8176.4148.90113.1E912 S913 V914 N920E912-K916 PolarHBondContact O-N 2.84Å; E912-K916 IonicContact OE1-NZ 3.04Å; E912-K916 PolarHBondContact OE1-NZ 3.4Å; S913-K916 PolarHBondContact O-N 3.07Å; V914-K916 PolarHBondContact O-N 3.35Å; K916-N920 PolarHBondContact O-N 3.29Å; K916-N920 VanDerWaalsContact O-N 3.17Å; K916-N920 PolarHBondContact O-ND2 3.45Å
917E77.1Confident70.9Confident120 Ų120102.8 Ų102.856%0.56150%0.499SS*.Hα-helixtrans-68.4-44.4173.4-174.1173.1-146.600111.5S913 V914 L915 D919 N920 E921S913-E917 PolarHBondContact O-N 2.98Å; V914-E917 PolarHBondContact O-N 3.4Å; L915-E917 PolarHBondContact O-N 3.39Å; E917-D919 VanDerWaalsContact C-N 3.35Å; E917-D919 PolarHBondContact O-N 2.65Å; E917-N920 PolarHBondContact O-N 2.96Å; E917-E921 WeakPolarHBondContact O-CB 3.32Å; E917-E921 PolarHBondContact O-N 2.92Å
918K78.4Confident72.8Confident119 Ų119103.4 Ų103.452%0.51750%0.5SS..Hα-helixtrans-67.6-31.7177-65.6-64.2173.1-166.80112.5V914 L915 E921 I922V914-K918 HydrophobicContact CG1-CG 3.83Å; V914-K918 VanDerWaalsContact O-CB 3.27Å; V914-K918 WeakPolarHBondContact O-CB 3.4Å; V914-K918 WeakPolarHBondContact O-CG 3.36Å; V914-K918 PolarHBondContact O-N 2.98Å; L915-K918 CarbonylContact O-C 3.49Å; L915-K918 PolarHBondContact O-N 2.81Å; K918-E921 CarbonylContact O-C 3.58Å; K918-E921 PolarHBondContact O-N 3.07Å; K918-I922 VanDerWaalsContact O-CB 3.24Å; K918-I922 WeakPolarHBondContact O-CB 3.48Å; K918-I922 WeakPolarHBondContact O-CD1 3.42Å; K918-I922 WeakPolarHBondContact O-CG1 3.25Å; K918-I922 PolarHBondContact O-N 3.12Å
919D78.9Confident74.3Confident74 Ų74101.4 Ų101.440%0.39650%0.495SS..Hα-helixtrans-71.9-35176.3-169.160.2000110.8L915 E917 K923L915-D919 WeakPolarHBondContact O-CB 3.45Å; L915-D919 PolarHBondContact O-N 2.94Å; E917-D919 VanDerWaalsContact C-N 3.35Å; E917-D919 PolarHBondContact O-N 2.65Å; D919-K923 VanDerWaalsContact O-CD 3.3Å; D919-K923 WeakPolarHBondContact O-CD 3.42Å; D919-K923 VanDerWaalsContact O-CG 3.3Å; D919-K923 WeakPolarHBondContact O-CG 3.26Å; D919-K923 PolarHBondContact O-N 3.35Å; D919-K923 IonicContact OD1-NZ 3.2Å; D919-K923 IonicContact OD2-NZ 2.65Å; D919-K923 PolarHBondContact OD2-NZ 2.83Å
920N79.3Confident75.8Confident88 Ų88100 Ų10047%0.47149%0.486SS..Hα-helixtrans-72.3-36168.7-71.8-43.3000112.6K916 E917 K923 R924K916-N920 PolarHBondContact O-N 3.29Å; K916-N920 VanDerWaalsContact O-N 3.17Å; K916-N920 PolarHBondContact O-ND2 3.45Å; E917-N920 PolarHBondContact O-N 2.96Å; N920-K923 PolarHBondContact O-N 2.87Å; N920-R924 WeakPolarHBondContact O-CG 3.45Å; N920-R924 PolarHBondContact O-N 3.48Å
921E80.4Confident77.1Confident65 Ų6598.6 Ų98.630%0.30448%0.483SS..Hα-helixtrans-69.3-37.5172.8-161.968.6-95.100111.7E917 K918 R924 I925E917-E921 WeakPolarHBondContact O-CB 3.32Å; E917-E921 PolarHBondContact O-N 2.92Å; K918-E921 CarbonylContact O-C 3.58Å; K918-E921 PolarHBondContact O-N 3.07Å; E921-R924 CarbonylContact O-C 3.57Å; E921-R924 WeakPolarHBondContact O-CB 3.41Å; E921-R924 PolarHBondContact O-N 2.63Å; E921-R924 IonicContact OE1-CZ 3.87Å; E921-R924 IonicContact OE1-NE 2.67Å; E921-R924 PolarHBondContact OE1-NE 3.05Å; E921-R924 IonicContact OE1-NH2 3.15Å; E921-R924 PolarHBondContact OE1-NH2 3.33Å; E921-R924 IonicContact OE2-CZ 3.56Å; E921-R924 IonicContact OE2-NE 2.66Å; E921-R924 IonicContact OE2-NH2 3.53Å; E921-R924 PolarHBondContact OE2-NH2 3.5Å; E921-I925 HydrophobicContact CG-CD1 4.09Å; E921-I925 WeakPolarHBondContact O-CB 3.37Å; E921-I925 VanDerWaalsContact O-CG1 3.23Å; E921-I925 WeakPolarHBondContact O-CG1 3.22Å; E921-I925 PolarHBondContact O-N 3.01Å
922I78.1Confident78.1Confident84 Ų8498.5 Ų98.543%0.43149%0.486SS..Hα-helixtrans-60-47.1171.7-77161.4000108.7K918 R924 I925 E926K918-I922 VanDerWaalsContact O-CB 3.24Å; K918-I922 WeakPolarHBondContact O-CB 3.48Å; K918-I922 WeakPolarHBondContact O-CD1 3.42Å; K918-I922 WeakPolarHBondContact O-CG1 3.25Å; K918-I922 PolarHBondContact O-N 3.12Å; I922-R924 VanDerWaalsContact C-N 3.34Å; I922-R924 PolarHBondContact O-N 2.71Å; I922-I925 CarbonylContact O-C 3.57Å; I922-I925 WeakPolarHBondContact O-CA 3.48Å; I922-I925 WeakPolarHBondContact O-CB 3.44Å; I922-I925 PolarHBondContact O-N 3.23Å; I922-E926 HydrophobicContact CG2-CG 4.17Å; I922-E926 WeakPolarHBondContact O-CB 3.37Å; I922-E926 WeakPolarHBondContact O-CG 3.49Å; I922-E926 PolarHBondContact O-N 2.95Å
923K84.2Confident78.8Confident96 Ų96100 Ų10042%0.41749%0.493SS..Hα-helixtrans-62.2-37.1174.8-71.9157-170.4162.50113.1D919 N920 I925 V927D919-K923 VanDerWaalsContact O-CD 3.3Å; D919-K923 WeakPolarHBondContact O-CD 3.42Å; D919-K923 VanDerWaalsContact O-CG 3.3Å; D919-K923 WeakPolarHBondContact O-CG 3.26Å; D919-K923 PolarHBondContact O-N 3.35Å; D919-K923 IonicContact OD1-NZ 3.2Å; D919-K923 IonicContact OD2-NZ 2.65Å; D919-K923 PolarHBondContact OD2-NZ 2.83Å; N920-K923 PolarHBondContact O-N 2.87Å; K923-I925 VanDerWaalsContact C-N 3.33Å; K923-V927 WeakPolarHBondContact O-CG2 3.48Å; K923-V927 PolarHBondContact O-N 2.86Å; K923-V927 VanDerWaalsContact O-N 3.07Å
924R82.2Confident79.6Confident124 Ų12498.6 Ų98.647%0.46848%0.482SS..Hα-helixtrans-65.7-35.6171.3-74.3-166.7-68.6-1127.9112.4N920 E921 I922 K928N920-R924 WeakPolarHBondContact O-CG 3.45Å; N920-R924 PolarHBondContact O-N 3.48Å; E921-R924 CarbonylContact O-C 3.57Å; E921-R924 WeakPolarHBondContact O-CB 3.41Å; E921-R924 PolarHBondContact O-N 2.63Å; E921-R924 IonicContact OE1-CZ 3.87Å; E921-R924 IonicContact OE1-NE 2.67Å; E921-R924 PolarHBondContact OE1-NE 3.05Å; E921-R924 IonicContact OE1-NH2 3.15Å; E921-R924 PolarHBondContact OE1-NH2 3.33Å; E921-R924 IonicContact OE2-CZ 3.56Å; E921-R924 IonicContact OE2-NE 2.66Å; E921-R924 IonicContact OE2-NH2 3.53Å; E921-R924 PolarHBondContact OE2-NH2 3.5Å; I922-R924 VanDerWaalsContact C-N 3.34Å; I922-R924 PolarHBondContact O-N 2.71Å; R924-K928 VanDerWaalsContact O-CG 3.3Å; R924-K928 WeakPolarHBondContact O-CG 3.46Å; R924-K928 PolarHBondContact O-N 3.43Å
925I81.7Confident80.2Confident91 Ų91100.3 Ų100.347%0.46749%0.49SS..Hα-helixtrans-73.8-42176.1-71.2164.8000110.3E921 I922 K923 K928 L929E921-I925 HydrophobicContact CG-CD1 4.09Å; E921-I925 WeakPolarHBondContact O-CB 3.37Å; E921-I925 VanDerWaalsContact O-CG1 3.23Å; E921-I925 WeakPolarHBondContact O-CG1 3.22Å; E921-I925 PolarHBondContact O-N 3.01Å; I922-I925 CarbonylContact O-C 3.57Å; I922-I925 WeakPolarHBondContact O-CA 3.48Å; I922-I925 WeakPolarHBondContact O-CB 3.44Å; I922-I925 PolarHBondContact O-N 3.23Å; K923-I925 VanDerWaalsContact C-N 3.33Å; I925-K928 CarbonylContact O-C 3.3Å; I925-K928 PolarHBondContact O-N 2.93Å; I925-L929 WeakPolarHBondContact O-CA 3.47Å; I925-L929 WeakPolarHBondContact O-CB 3.3Å; I925-L929 PolarHBondContact O-N 3.36Å
926E80.8Confident80.4Confident114 Ų114100.1 Ų100.153%0.53349%0.493SS..Hα-helixtrans-61.4-44.4177.1-76.1178.9136.800111.7I922 L929 K930I922-E926 HydrophobicContact CG2-CG 4.17Å; I922-E926 WeakPolarHBondContact O-CB 3.37Å; I922-E926 WeakPolarHBondContact O-CG 3.49Å; I922-E926 PolarHBondContact O-N 2.95Å; E926-L929 PolarHBondContact O-N 2.98Å; E926-K930 VanDerWaalsContact O-CB 3.22Å; E926-K930 WeakPolarHBondContact O-CB 3.38Å; E926-K930 PolarHBondContact O-N 3.39Å
927V84.3Confident80.7Confident87 Ų8797.6 Ų97.653%0.52749%0.491SS..Hα-helixtrans-61.1-50.2174.1171.80000110.1K923 L929 K930 D931K923-V927 WeakPolarHBondContact O-CG2 3.48Å; K923-V927 PolarHBondContact O-N 2.86Å; K923-V927 VanDerWaalsContact O-N 3.07Å; V927-L929 VanDerWaalsContact C-N 3.32Å; V927-L929 PolarHBondContact O-N 3.37Å; V927-K930 PolarHBondContact O-N 2.86Å; V927-D931 VanDerWaalsContact O-CG 3.23Å; V927-D931 PolarHBondContact O-N 2.93Å
928K82.4Confident81.2Confident136 Ų13696.9 Ų96.959%0.59149%0.486SS*.Hα-helixtrans-60.9-38.5175.9-74.3174.1179.3177.50113R924 I925 K930 D931 T932R924-K928 VanDerWaalsContact O-CG 3.3Å; R924-K928 WeakPolarHBondContact O-CG 3.46Å; R924-K928 PolarHBondContact O-N 3.43Å; I925-K928 CarbonylContact O-C 3.3Å; I925-K928 PolarHBondContact O-N 2.93Å; K928-K930 VanDerWaalsContact C-N 3.34Å; K928-D931 PolarHBondContact O-N 2.87Å; K928-T932 WeakPolarHBondContact O-CG2 3.2Å; K928-T932 PolarHBondContact O-N 3.36Å; K928-T932 PolarHBondContact O-OG1 3.03Å; K928-T932 VanDerWaalsContact O-OG1 3.07Å
929L79.6Confident81.2Confident108 Ų10897.6 Ų97.657%0.56549%0.493SS*.Hα-helixtrans-65-44.5179.6-160.595.8000109I925 E926 V927 T932 E933I925-L929 WeakPolarHBondContact O-CA 3.47Å; I925-L929 WeakPolarHBondContact O-CB 3.3Å; I925-L929 PolarHBondContact O-N 3.36Å; E926-L929 PolarHBondContact O-N 2.98Å; V927-L929 VanDerWaalsContact C-N 3.32Å; V927-L929 PolarHBondContact O-N 3.37Å; L929-T932 WeakPolarHBondContact CA-OG1 3.5Å; L929-T932 CarbonylContact O-C 3.55Å; L929-T932 PolarHBondContact O-N 2.94Å; L929-T932 PolarHBondContact O-OG1 3.4Å; L929-E933 VanDerWaalsContact O-CB 3.23Å; L929-E933 WeakPolarHBondContact O-CB 3.45Å; L929-E933 PolarHBondContact O-N 2.96Å
930K83.6Confident81.3Confident147 Ų14797 Ų9764%0.63950%0.495SS*.Hα-helixtrans-66.9-37.4176.3-171.5172.8-175.1173.40112.9E926 V927 K928 E933 S934E926-K930 VanDerWaalsContact O-CB 3.22Å; E926-K930 WeakPolarHBondContact O-CB 3.38Å; E926-K930 PolarHBondContact O-N 3.39Å; V927-K930 PolarHBondContact O-N 2.86Å; K928-K930 VanDerWaalsContact C-N 3.34Å; K930-E933 PolarHBondContact O-N 3.08Å; K930-S934 WeakPolarHBondContact O-CB 3.44Å; K930-S934 PolarHBondContact O-N 3.34Å
931D81.8Confident81.5Confident87 Ų8798.7 Ų98.747%0.46550%0.5SS..Hα-helixtrans-62.9-48.8171.5-67.3-27.4000109.9V927 K928 E933 S934 D935V927-D931 VanDerWaalsContact O-CG 3.23Å; V927-D931 PolarHBondContact O-N 2.93Å; K928-D931 PolarHBondContact O-N 2.87Å; D931-E933 VanDerWaalsContact C-N 3.33Å; D931-E933 PolarHBondContact O-N 2.91Å; D931-S934 WeakPolarHBondContact O-CB 3.32Å; D931-S934 PolarHBondContact O-N 2.97Å; D931-S934 PolarHBondContact O-OG 2.61Å; D931-D935 PolarHBondContact O-N 3.08Å
932T77.5Confident81.7Confident76 Ų76100.3 Ų100.347%0.46651%0.51SS..Hα-helixtrans-66.9-28.4175.357.30000113.7K928 L929 D935 V936K928-T932 WeakPolarHBondContact O-CG2 3.2Å; K928-T932 PolarHBondContact O-N 3.36Å; K928-T932 PolarHBondContact O-OG1 3.03Å; K928-T932 VanDerWaalsContact O-OG1 3.07Å; L929-T932 WeakPolarHBondContact CA-OG1 3.5Å; L929-T932 CarbonylContact O-C 3.55Å; L929-T932 PolarHBondContact O-N 2.94Å; L929-T932 PolarHBondContact O-OG1 3.4Å; T932-D935 PolarHBondContact O-N 3.44Å; T932-V936 VanDerWaalsContact O-CB 3.23Å; T932-V936 WeakPolarHBondContact O-CB 3.17Å; T932-V936 WeakPolarHBondContact O-CG2 3.28Å; T932-V936 PolarHBondContact O-N 2.97Å
933E79.6Confident81.8Confident131 Ų131101.2 Ų101.261%0.61252%0.515SS*.Hα-helixtrans-71.6-39.4173.6-176.8176.2-13900109.8L929 K930 D931 D935 S937L929-E933 VanDerWaalsContact O-CB 3.23Å; L929-E933 WeakPolarHBondContact O-CB 3.45Å; L929-E933 PolarHBondContact O-N 2.96Å; K930-E933 PolarHBondContact O-N 3.08Å; D931-E933 VanDerWaalsContact C-N 3.33Å; D931-E933 PolarHBondContact O-N 2.91Å; E933-D935 VanDerWaalsContact C-N 3.34Å; E933-S937 VanDerWaalsContact O-CB 3.26Å; E933-S937 WeakPolarHBondContact O-CB 3.3Å; E933-S937 PolarHBondContact O-N 3.48Å
934S81.3Confident81.7Confident45 Ų45102.8 Ų102.832%0.31552%0.522SS..Hα-helixtrans-61.9-42169.7100.20000111.4K930 D931 S937 K938K930-S934 WeakPolarHBondContact O-CB 3.44Å; K930-S934 PolarHBondContact O-N 3.34Å; D931-S934 WeakPolarHBondContact O-CB 3.32Å; D931-S934 PolarHBondContact O-N 2.97Å; D931-S934 PolarHBondContact O-OG 2.61Å; S934-S937 PolarHBondContact O-N 2.7Å; S934-K938 WeakPolarHBondContact O-CE 3.47Å; S934-K938 VanDerWaalsContact O-CG 3.25Å; S934-K938 WeakPolarHBondContact O-CG 3.27Å; S934-K938 PolarHBondContact O-N 2.84Å; S934-K938 WeakPolarHBondContact OG-CE 3.21Å; S934-K938 PolarHBondContact OG-NZ 2.98Å
935D83.6Confident81.6Confident87 Ų87103 Ų10347%0.46553%0.528SS..Hα-helixtrans-76.2-33.4-178.3-72-14.7000112.4D931 T932 E933 K938 M939D931-D935 PolarHBondContact O-N 3.08Å; T932-D935 PolarHBondContact O-N 3.44Å; E933-D935 VanDerWaalsContact C-N 3.34Å; D935-K938 PolarHBondContact O-N 3.3Å; D935-K938 IonicContact OD1-NZ 2.79Å; D935-K938 PolarHBondContact OD1-NZ 3.35Å; D935-M939 WeakPolarHBondContact O-CB 3.4Å; D935-M939 PolarHBondContact O-N 3.37Å
936V77.3Confident81.5Confident100 Ų100101.9 Ų101.961%0.60653%0.526SS*.Hα-helixtrans-68.1-35.8168.81660000110.8T932 M939 S940T932-V936 VanDerWaalsContact O-CB 3.23Å; T932-V936 WeakPolarHBondContact O-CB 3.17Å; T932-V936 WeakPolarHBondContact O-CG2 3.28Å; T932-V936 PolarHBondContact O-N 2.97Å; V936-M939 PolarHBondContact O-N 3.42Å; V936-S940 VanDerWaalsContact O-CB 3.32Å; V936-S940 WeakPolarHBondContact O-CB 3.42Å; V936-S940 PolarHBondContact O-N 3.1Å
937S82.9Confident81.3Confident71 Ų71101.9 Ų101.950%0.49753%0.525SS..Hα-helixtrans-64.9-47.7172.8-166.30000111E933 S934 M939 S940 E941E933-S937 VanDerWaalsContact O-CB 3.26Å; E933-S937 WeakPolarHBondContact O-CB 3.3Å; E933-S937 PolarHBondContact O-N 3.48Å; S934-S937 PolarHBondContact O-N 2.7Å; S937-M939 VanDerWaalsContact C-N 3.33Å; S937-M939 PolarHBondContact O-N 2.62Å; S937-S940 CarbonylContact O-C 3.58Å; S937-S940 PolarHBondContact O-N 3.49Å; S937-S940 VanDerWaalsContact O-N 3.17Å; S937-E941 WeakPolarHBondContact O-CB 3.47Å; S937-E941 PolarHBondContact O-N 3.41Å
938K86.6Confident81.2Confident105 Ų105102.5 Ų102.546%0.45752%0.522SS..Hα-helixtrans-59-42.7172.8-67.3163-147.7159.60111.7S934 D935 S940 E941 L942S934-K938 WeakPolarHBondContact O-CE 3.47Å; S934-K938 VanDerWaalsContact O-CG 3.25Å; S934-K938 WeakPolarHBondContact O-CG 3.27Å; S934-K938 PolarHBondContact O-N 2.84Å; S934-K938 WeakPolarHBondContact OG-CE 3.21Å; S934-K938 PolarHBondContact OG-NZ 2.98Å; D935-K938 PolarHBondContact O-N 3.3Å; D935-K938 IonicContact OD1-NZ 2.79Å; D935-K938 PolarHBondContact OD1-NZ 3.35Å; K938-S940 VanDerWaalsContact C-N 3.33Å; K938-S940 PolarHBondContact O-N 2.85Å; K938-E941 PolarHBondContact O-N 2.85Å; K938-E941 VanDerWaalsContact O-N 3.17Å; K938-L942 WeakPolarHBondContact O-CB 3.45Å; K938-L942 PolarHBondContact O-N 2.93Å
939M79.4Confident81Confident134 Ų134101.6 Ų101.666%0.6652%0.52SS*.Hα-helixtrans-64-37.8176.4-167.474.27000111.5D935 V936 S937 E941 L943D935-M939 WeakPolarHBondContact O-CB 3.4Å; D935-M939 PolarHBondContact O-N 3.37Å; V936-M939 PolarHBondContact O-N 3.42Å; S937-M939 VanDerWaalsContact C-N 3.33Å; S937-M939 PolarHBondContact O-N 2.62Å; M939-E941 VanDerWaalsContact C-N 3.32Å; M939-L943 WeakPolarHBondContact O-CB 3.36Å; M939-L943 PolarHBondContact O-N 3.46Å
940S79.8Confident80.6Confident62 Ų62101 Ų10143%0.43452%0.518SS..Hα-helixtrans-72.6-24174.3-1770000113.1V936 S937 K938 K944V936-S940 VanDerWaalsContact O-CB 3.32Å; V936-S940 WeakPolarHBondContact O-CB 3.42Å; V936-S940 PolarHBondContact O-N 3.1Å; S937-S940 CarbonylContact O-C 3.58Å; S937-S940 PolarHBondContact O-N 3.49Å; S937-S940 VanDerWaalsContact O-N 3.17Å; K938-S940 VanDerWaalsContact C-N 3.33Å; K938-S940 PolarHBondContact O-N 2.85Å; S940-K944 PolarHBondContact O-N 3.4Å; S940-K944 VanDerWaalsContact O-N 3.1Å
941E84Confident80.5Confident123 Ų12399.2 Ų99.258%0.57551%0.51SS*.Hα-helixtrans-80.3-45.8176.4-159147.7-12200110.1S937 K938 M939 L943 K944 E945S937-E941 WeakPolarHBondContact O-CB 3.47Å; S937-E941 PolarHBondContact O-N 3.41Å; K938-E941 PolarHBondContact O-N 2.85Å; K938-E941 VanDerWaalsContact O-N 3.17Å; M939-E941 VanDerWaalsContact C-N 3.32Å; E941-L943 VanDerWaalsContact C-N 3.32Å; E941-L943 PolarHBondContact O-N 3.44Å; E941-K944 CarbonylContact O-C 3.53Å; E941-K944 WeakPolarHBondContact O-CA 3.27Å; E941-K944 VanDerWaalsContact O-CB 3.31Å; E941-K944 WeakPolarHBondContact O-CB 3.48Å; E941-K944 PolarHBondContact O-N 2.97Å; E941-K944 VanDerWaalsContact O-N 3.08Å; E941-E945 PolarHBondContact O-N 2.6Å
942L84.7Confident80.3Confident98 Ų98101.5 Ų101.551%0.51352%0.516SS..Hα-helixtrans-57.2-40.5165.4-86.6160.6000112.5K938 K944 E945 V946K938-L942 WeakPolarHBondContact O-CB 3.45Å; K938-L942 PolarHBondContact O-N 2.93Å; L942-K944 VanDerWaalsContact C-N 3.29Å; L942-K944 PolarHBondContact O-N 3.17Å; L942-E945 PolarHBondContact O-N 3.41Å; L942-V946 WeakPolarHBondContact O-CB 3.36Å; L942-V946 VanDerWaalsContact O-CG2 3.31Å; L942-V946 WeakPolarHBondContact O-CG2 3.36Å; L942-V946 PolarHBondContact O-N 3.47Å
943L80.1Confident80.3Confident103 Ų103101.5 Ų101.554%0.53951%0.513SS..Hα-helixtrans-66.5-32.9175.8-169.371.6000111.6M939 E941 Q947M939-L943 WeakPolarHBondContact O-CB 3.36Å; M939-L943 PolarHBondContact O-N 3.46Å; E941-L943 VanDerWaalsContact C-N 3.32Å; E941-L943 PolarHBondContact O-N 3.44Å; L943-Q947 VanDerWaalsContact O-CB 3.29Å; L943-Q947 WeakPolarHBondContact O-CB 3.47Å; L943-Q947 VanDerWaalsContact O-CG 3.27Å; L943-Q947 WeakPolarHBondContact O-CG 3.37Å; L943-Q947 PolarHBondContact O-N 3.45Å
944K82.3Confident80.2Confident129 Ų129102.9 Ų102.956%0.56152%0.517SS*.Hα-helixtrans-68.6-46.4170.7-89.5178.6176.6174.10111.6S940 E941 L942 V946 Q947 E948S940-K944 PolarHBondContact O-N 3.4Å; S940-K944 VanDerWaalsContact O-N 3.1Å; E941-K944 CarbonylContact O-C 3.53Å; E941-K944 WeakPolarHBondContact O-CA 3.27Å; E941-K944 VanDerWaalsContact O-CB 3.31Å; E941-K944 WeakPolarHBondContact O-CB 3.48Å; E941-K944 PolarHBondContact O-N 2.97Å; E941-K944 VanDerWaalsContact O-N 3.08Å; L942-K944 VanDerWaalsContact C-N 3.29Å; L942-K944 PolarHBondContact O-N 3.17Å; K944-V946 PolarHBondContact O-N 3.41Å; K944-Q947 CarbonylContact O-C 3.52Å; K944-Q947 PolarHBondContact O-N 3.06Å; K944-Q947 VanDerWaalsContact O-N 3.09Å; K944-E948 WeakPolarHBondContact O-CG 3.47Å; K944-E948 PolarHBondContact O-N 3.16Å
945E81.3Confident79.8Confident128 Ų128104.7 Ų104.760%0.59853%0.528SS*.Hα-helixtrans-58-48.9175.3-72.1-173.1135.500110.5E941 L942 Q947 E948 E949E941-E945 PolarHBondContact O-N 2.6Å; L942-E945 PolarHBondContact O-N 3.41Å; E945-Q947 VanDerWaalsContact C-N 3.27Å; E945-Q947 PolarHBondContact O-N 2.91Å; E945-E948 PolarHBondContact O-N 3.09Å; E945-E949 WeakPolarHBondContact O-CB 3.13Å; E945-E949 PolarHBondContact O-N 3.28Å
946V79.5Confident79.3Confident69 Ų69105.5 Ų105.542%0.41853%0.529SS..Hα-helixtrans-63-29.7175172.70000112.3L942 K944 N950L942-V946 WeakPolarHBondContact O-CB 3.36Å; L942-V946 VanDerWaalsContact O-CG2 3.31Å; L942-V946 WeakPolarHBondContact O-CG2 3.36Å; L942-V946 PolarHBondContact O-N 3.47Å; K944-V946 PolarHBondContact O-N 3.41Å; V946-N950 WeakPolarHBondContact O-CB 3.34Å; V946-N950 PolarHBondContact O-N 2.96Å; V946-N950 PolarHBondContact O-ND2 3.25Å
947Q74.9Confident78.6Confident113 Ų113105.9 Ų105.953%0.52853%0.528SS..Hα-helixtrans-75-40.6173-84.5-173.9-18.300113.5L943 K944 E945 N950 K951L943-Q947 VanDerWaalsContact O-CB 3.29Å; L943-Q947 WeakPolarHBondContact O-CB 3.47Å; L943-Q947 VanDerWaalsContact O-CG 3.27Å; L943-Q947 WeakPolarHBondContact O-CG 3.37Å; L943-Q947 PolarHBondContact O-N 3.45Å; K944-Q947 CarbonylContact O-C 3.52Å; K944-Q947 PolarHBondContact O-N 3.06Å; K944-Q947 VanDerWaalsContact O-N 3.09Å; E945-Q947 VanDerWaalsContact C-N 3.27Å; E945-Q947 PolarHBondContact O-N 2.91Å; Q947-N950 PolarHBondContact O-N 3.47Å; Q947-K951 WeakPolarHBondContact O-CB 3.23Å; Q947-K951 WeakPolarHBondContact O-CG 3.27Å; Q947-K951 PolarHBondContact O-N 2.98Å
948E82.6Confident77.5Confident100 Ų100105.8 Ų105.847%0.46753%0.527SS..Hα-helixtrans-73.2-31.3174.7-61-50.613600111.4K944 E945 K951 F952K944-E948 WeakPolarHBondContact O-CG 3.47Å; K944-E948 PolarHBondContact O-N 3.16Å; E945-E948 PolarHBondContact O-N 3.09Å; E948-K951 CarbonylContact O-C 3.58Å; E948-K951 WeakPolarHBondContact O-CB 3.31Å; E948-K951 PolarHBondContact O-N 3.24Å; E948-K951 IonicContact OE1-NZ 3.35Å; E948-K951 PolarHBondContact OE1-NZ 3.2Å; E948-K951 WeakPolarHBondContact OE2-CD 3.41Å; E948-K951 IonicContact OE2-NZ 3.37Å; E948-K951 PolarHBondContact OE2-NZ 3.1Å; E948-F952 VanDerWaalsContact O-CB 3.31Å; E948-F952 WeakPolarHBondContact O-CB 3.27Å; E948-F952 PolarHBondContact O-N 3.45Å
949E79.4Confident76Confident117 Ų117106.3 Ų106.355%0.54753%0.531SS..Hα-helixtrans-70.4-40.7170.4-170.2176.2-124.700110.9E945 K951 F952 L953E945-E949 WeakPolarHBondContact O-CB 3.13Å; E945-E949 PolarHBondContact O-N 3.28Å; E949-K951 VanDerWaalsContact C-N 3.34Å; E949-K951 PolarHBondContact O-N 2.99Å; E949-F952 PolarHBondContact O-N 2.97Å; E949-F952 VanDerWaalsContact O-N 3.17Å; E949-L953 HydrophobicContact CG-CD1 4.24Å; E949-L953 WeakPolarHBondContact O-CB 3.43Å; E949-L953 VanDerWaalsContact O-CG 3.3Å; E949-L953 WeakPolarHBondContact O-CG 3.46Å; E949-L953 PolarHBondContact O-N 3.06Å
950N69.6Low74.8Confident95 Ų95105.2 Ų105.251%0.50852%0.524SS..Hα-helixtrans-63.6-37.3169.4-93.1-94.1000112.1V946 Q947 K954V946-N950 WeakPolarHBondContact O-CB 3.34Å; V946-N950 PolarHBondContact O-N 2.96Å; V946-N950 PolarHBondContact O-ND2 3.25Å; Q947-N950 PolarHBondContact O-N 3.47Å; N950-K954 WeakPolarHBondContact O-CB 3.18Å; N950-K954 PolarHBondContact O-N 2.98Å
951K82.9Confident73.5Confident111 Ų111109.7 Ų109.748%0.48354%0.536SS..Hα-helixtrans-64.3-42.4170.2-80.4162.8161.1-179.30111.2Q947 E948 E949 K954 C955Q947-K951 WeakPolarHBondContact O-CB 3.23Å; Q947-K951 WeakPolarHBondContact O-CG 3.27Å; Q947-K951 PolarHBondContact O-N 2.98Å; E948-K951 CarbonylContact O-C 3.58Å; E948-K951 WeakPolarHBondContact O-CB 3.31Å; E948-K951 PolarHBondContact O-N 3.24Å; E948-K951 IonicContact OE1-NZ 3.35Å; E948-K951 PolarHBondContact OE1-NZ 3.2Å; E948-K951 WeakPolarHBondContact OE2-CD 3.41Å; E948-K951 IonicContact OE2-NZ 3.37Å; E948-K951 PolarHBondContact OE2-NZ 3.1Å; E949-K951 VanDerWaalsContact C-N 3.34Å; E949-K951 PolarHBondContact O-N 2.99Å; K951-K954 CarbonylContact O-C 3.59Å; K951-K954 PolarHBondContact O-N 3.14Å; K951-C955 VanDerWaalsContact O-CB 3.31Å; K951-C955 WeakPolarHBondContact O-CB 3.5Å; K951-C955 PolarHBondContact O-N 3.44Å; K951-C955 PolarHBondContact O-SG 3.03Å
952F77.9Confident71.8Confident134 Ų134110.6 Ų110.659%0.58854%0.539SS*.Hα-helixtrans-63.1-50.2178.6-179-98.7000110.8E948 E949 K954 C955 Q956E948-F952 VanDerWaalsContact O-CB 3.31Å; E948-F952 WeakPolarHBondContact O-CB 3.27Å; E948-F952 PolarHBondContact O-N 3.45Å; E949-F952 PolarHBondContact O-N 2.97Å; E949-F952 VanDerWaalsContact O-N 3.17Å; F952-K954 VanDerWaalsContact C-N 3.31Å; F952-K954 PolarHBondContact O-N 3.35Å; F952-C955 CarbonylContact O-C 3.53Å; F952-C955 WeakPolarHBondContact O-CB 3.49Å; F952-C955 PolarHBondContact O-N 3.29Å; F952-Q956 VanDerWaalsContact O-CB 3.28Å; F952-Q956 WeakPolarHBondContact O-CB 3.39Å; F952-Q956 PolarHBondContact O-N 2.82Å
953L77.4Confident70Confident77 Ų77111.7 Ų111.740%0.40354%0.542SS..Hα-helixtrans-59.9-37.8173.2-70168.2000112.1E949 Q956 L957E949-L953 HydrophobicContact CG-CD1 4.24Å; E949-L953 WeakPolarHBondContact O-CB 3.43Å; E949-L953 VanDerWaalsContact O-CG 3.3Å; E949-L953 WeakPolarHBondContact O-CG 3.46Å; E949-L953 PolarHBondContact O-N 3.06Å; L953-Q956 PolarHBondContact O-N 3.05Å; L953-L957 WeakPolarHBondContact O-CB 3.44Å; L953-L957 WeakPolarHBondContact O-CG 3.42Å; L953-L957 PolarHBondContact O-N 3.23Å
954K77.4Confident68.4Low159 Ų159113.4 Ų113.469%0.69155%0.547SS*.Hα-helixtrans-71.5-34.9175.8-170.6171.3-173.6173.60112.7N950 K951 F952 S958N950-K954 WeakPolarHBondContact O-CB 3.18Å; N950-K954 PolarHBondContact O-N 2.98Å; K951-K954 CarbonylContact O-C 3.59Å; K951-K954 PolarHBondContact O-N 3.14Å; F952-K954 VanDerWaalsContact C-N 3.31Å; F952-K954 PolarHBondContact O-N 3.35Å; K954-S958 VanDerWaalsContact O-CB 3.31Å; K954-S958 WeakPolarHBondContact O-CB 3.49Å; K954-S958 PolarHBondContact O-N 2.8Å
955C73Confident66.6Low83 Ų83110.9 Ų110.956%0.56155%0.55SS**Hα-helixtrans-69.9-37.1170.1-73.40000111.3K951 F952 S958 H959K951-C955 VanDerWaalsContact O-CB 3.31Å; K951-C955 WeakPolarHBondContact O-CB 3.5Å; K951-C955 PolarHBondContact O-N 3.44Å; K951-C955 PolarHBondContact O-SG 3.03Å; F952-C955 CarbonylContact O-C 3.53Å; F952-C955 WeakPolarHBondContact O-CB 3.49Å; F952-C955 PolarHBondContact O-N 3.29Å; C955-S958 CarbonylContact O-C 3.55Å; C955-S958 WeakPolarHBondContact O-CB 3.45Å; C955-S958 PolarHBondContact O-N 3.43Å; C955-H959 VanDerWaalsContact O-CB 3.27Å; C955-H959 WeakPolarHBondContact O-CB 3.29Å; C955-H959 PolarHBondContact O-N 3.35Å
956Q72.3Confident65Low104 Ų104109.6 Ų109.649%0.48656%0.556SS.*Hα-helixtrans-67.6-43.7175.9-168.2177.857.600110.9F952 L953 S958 H959 Q960F952-Q956 VanDerWaalsContact O-CB 3.28Å; F952-Q956 WeakPolarHBondContact O-CB 3.39Å; F952-Q956 PolarHBondContact O-N 2.82Å; L953-Q956 PolarHBondContact O-N 3.05Å; Q956-S958 VanDerWaalsContact C-N 3.34Å; Q956-S958 PolarHBondContact O-N 3.02Å; Q956-H959 CarbonylContact O-C 3.57Å; Q956-H959 PolarHBondContact O-N 3.45Å; Q956-Q960 VanDerWaalsContact O-CB 3.28Å; Q956-Q960 WeakPolarHBondContact O-CB 3.28Å; Q956-Q960 PolarHBondContact O-N 3.48Å
957L62.4Low63.6Low109 Ų109114.2 Ų114.257%0.57157%0.571SS**Hα-helixtrans-61.7-38.4169.5-78.1165.4000112.4L953 K961L953-L957 WeakPolarHBondContact O-CB 3.44Å; L953-L957 WeakPolarHBondContact O-CG 3.42Å; L953-L957 PolarHBondContact O-N 3.23Å; L957-K961 WeakPolarHBondContact O-CB 3.39Å; L957-K961 PolarHBondContact O-N 2.78Å
958S59.3Low62.2Low68 Ų68112.8 Ų112.848%0.47657%0.571SS.*Hα-helixtrans-67.5-37.8174.4-166.30000112.1K954 C955 Q956 K961 H962K954-S958 VanDerWaalsContact O-CB 3.31Å; K954-S958 WeakPolarHBondContact O-CB 3.49Å; K954-S958 PolarHBondContact O-N 2.8Å; C955-S958 CarbonylContact O-C 3.55Å; C955-S958 WeakPolarHBondContact O-CB 3.45Å; C955-S958 PolarHBondContact O-N 3.43Å; Q956-S958 VanDerWaalsContact C-N 3.34Å; Q956-S958 PolarHBondContact O-N 3.02Å; S958-K961 PolarHBondContact O-N 3.01Å; S958-H962 PolarHBondContact O-N 3.24Å
959H55.8Low60.9Low117 Ų117110.5 Ų110.554%0.54257%0.566SS.*Hα-helixtrans-72.1-39176.8-164.779000111.5C955 Q956 H962 Q963C955-H959 VanDerWaalsContact O-CB 3.27Å; C955-H959 WeakPolarHBondContact O-CB 3.29Å; C955-H959 PolarHBondContact O-N 3.35Å; Q956-H959 CarbonylContact O-C 3.57Å; Q956-H959 PolarHBondContact O-N 3.45Å; H959-H962 CarbonylContact O-C 3.54Å; H959-H962 PolarHBondContact O-N 3.43Å; H959-H962 VanDerWaalsContact O-N 3.13Å; H959-Q963 PolarHBondContact CD2-NE2 2.85Å; H959-Q963 PolarHBondContact NE2-NE2 2.96Å; H959-Q963 WeakPolarHBondContact O-CG 3.48Å; H959-Q963 PolarHBondContact O-N 2.98Å
960Q53.8Low59.7Low110 Ų110112.8 Ų112.851%0.51458%0.577SS.*Hα-helixtrans-64-40172.6-166.3175.822.800111Q956 Q963 Q964Q956-Q960 VanDerWaalsContact O-CB 3.28Å; Q956-Q960 WeakPolarHBondContact O-CB 3.28Å; Q956-Q960 PolarHBondContact O-N 3.48Å; Q960-Q963 PolarHBondContact O-N 2.86Å; Q960-Q964 PolarHBondContact O-N 2.78Å
961K51.9Low59.1Low156 Ų156115.6 Ų115.668%0.67859%0.587SS**Hα-helixtrans-62.8-38168.6-84.2-167.9170.1-1700113.2L957 S958 Q964 A965L957-K961 WeakPolarHBondContact O-CB 3.39Å; L957-K961 PolarHBondContact O-N 2.78Å; S958-K961 PolarHBondContact O-N 3.01Å; K961-Q964 PolarHBondContact O-N 3.15Å; K961-A965 PolarHBondContact O-N 3.37Å
962H49.3Very low58Low142 Ų142115.5 Ų115.566%0.65759%0.588SS**Hα-helixtrans-70.5-34.4174.8-101.867.4000113.1S958 H959 A965S958-H962 PolarHBondContact O-N 3.24Å; H959-H962 CarbonylContact O-C 3.54Å; H959-H962 PolarHBondContact O-N 3.43Å; H959-H962 VanDerWaalsContact O-N 3.13Å; H962-A965 WeakPolarHBondContact O-CB 3.43Å; H962-A965 PolarHBondContact O-N 3.3Å
963Q47.9Very low57.5Low121 Ų121113.9 Ų113.957%0.56559%0.585SS**Hα-helixtrans-70.3-35173-70.6-174.85.100111.7H959 Q960 A965 S966H959-Q963 PolarHBondContact CD2-NE2 2.85Å; H959-Q963 PolarHBondContact NE2-NE2 2.96Å; H959-Q963 WeakPolarHBondContact O-CG 3.48Å; H959-Q963 PolarHBondContact O-N 2.98Å; Q960-Q963 PolarHBondContact O-N 2.86Å; Q963-A965 VanDerWaalsContact C-N 3.26Å; Q963-A965 PolarHBondContact O-N 2.89Å; Q963-S966 WeakPolarHBondContact O-CB 3.33Å; Q963-S966 PolarHBondContact O-N 3.06Å
964Q45.6Very low57.2Low139 Ų139116.2 Ų116.265%0.6559%0.594SS**Hα-helixtrans-67.6-23.3169.3-76.3-176.1-33.300113.3Q960 K961 S966Q960-Q964 PolarHBondContact O-N 2.78Å; K961-Q964 PolarHBondContact O-N 3.15Å; Q964-S966 PolarHBondContact O-N 3.07Å
965A45.5Very low57Low76 Ų76112.1 Ų112.163%0.62858%0.582SS**THydrogen-bonded Turntrans-78.410.1173.900000114.3K961 H962 Q963K961-A965 PolarHBondContact O-N 3.37Å; H962-A965 WeakPolarHBondContact O-CB 3.43Å; H962-A965 PolarHBondContact O-N 3.3Å; Q963-A965 VanDerWaalsContact C-N 3.26Å; Q963-A965 PolarHBondContact O-N 2.89Å
966S46.8Very low57.2Low102 Ų102111.7 Ų111.771%0.71358%0.577SS**THydrogen-bonded Turntrans-97.13173.3-171.10000114Q963 Q964Q963-S966 WeakPolarHBondContact O-CB 3.33Å; Q963-S966 PolarHBondContact O-N 3.06Å; Q964-S966 PolarHBondContact O-N 3.07Å
967F50.5Low57.4Low166 Ų166110.7 Ų110.773%0.72857%0.574SS**SBendtrans-87.8155.6167.2-76.9-87.8000110.1
968P45.2Very low58.2Low83 Ų83108.8 Ų108.854%0.53957%0.57SS.*PPolyproline II helixtrans-56.6160.2175.726-35.6000110.9E972P968-E972 HydrophobicContact CB-CB 4.44Å
969S54.3Low59.5Low52 Ų52111.8 Ų111.836%0.36458%0.576SS.*PPolyproline II helixtrans-56.4148-17166.80000111.6E971 E972 L973S969-E971 PolarHBondContact O-N 3.41Å; S969-E971 VanDerWaalsContact O-N 3.08Å; S969-E972 VanDerWaalsContact CB-OE2 3.25Å; S969-E972 WeakPolarHBondContact CB-OE2 3.37Å; S969-E972 PolarHBondContact N-OE2 3.42Å; S969-E972 PolarHBondContact O-N 2.9Å; S969-E972 WeakPolarHBondContact OG-CB 3.24Å; S969-E972 VanDerWaalsContact OG-CD 3.29Å; S969-E972 VanDerWaalsContact OG-CG 3.22Å; S969-E972 WeakPolarHBondContact OG-CG 3.43Å; S969-E972 PolarHBondContact OG-N 3.48Å; S969-E972 VanDerWaalsContact OG-N 3.12Å; S969-E972 PolarHBondContact OG-OE2 2.95Å; S969-L973 PolarHBondContact O-N 3.11Å
970Q54.8Low60.9Low164 Ų164111.4 Ų111.477%0.76657%0.573SS**Hα-helixtrans-55.9-28.8176.3-175.5175.7-13.900111.4Q974Q970-Q974 WeakPolarHBondContact O-CB 3.48Å; Q970-Q974 PolarHBondContact O-N 3.48Å
971E57.6Low62.4Low155 Ų155111.8 Ų111.872%0.72458%0.575SS**Hα-helixtrans-69.9-47.5175.4-160.1158.9-14300111.9S969 L973 Q974 T975S969-E971 PolarHBondContact O-N 3.41Å; S969-E971 VanDerWaalsContact O-N 3.08Å; E971-L973 PolarHBondContact O-N 3.5Å; E971-Q974 PolarHBondContact O-N 2.89Å; E971-T975 PolarHBondContact O-N 3.36Å; E971-T975 PolarHBondContact O-OG1 3.13Å
972E59.9Low64.3Low108 Ų108110.6 Ų110.651%0.50557%0.57SS.*Hα-helixtrans-60.2-45.2174.3-75161.5120.300112.3P968 S969 Q974 T975 V976P968-E972 HydrophobicContact CB-CB 4.44Å; S969-E972 VanDerWaalsContact CB-OE2 3.25Å; S969-E972 WeakPolarHBondContact CB-OE2 3.37Å; S969-E972 PolarHBondContact N-OE2 3.42Å; S969-E972 PolarHBondContact O-N 2.9Å; S969-E972 WeakPolarHBondContact OG-CB 3.24Å; S969-E972 VanDerWaalsContact OG-CD 3.29Å; S969-E972 VanDerWaalsContact OG-CG 3.22Å; S969-E972 WeakPolarHBondContact OG-CG 3.43Å; S969-E972 PolarHBondContact OG-N 3.48Å; S969-E972 VanDerWaalsContact OG-N 3.12Å; S969-E972 PolarHBondContact OG-OE2 2.95Å; E972-Q974 VanDerWaalsContact C-N 3.29Å; E972-Q974 PolarHBondContact O-N 3.28Å; E972-T975 WeakPolarHBondContact CA-OG1 3.38Å; E972-T975 PolarHBondContact O-N 3.05Å; E972-T975 PolarHBondContact O-OG1 2.93Å; E972-V976 WeakPolarHBondContact O-CG2 3.2Å; E972-V976 PolarHBondContact O-N 2.91Å
973L66.8Low66.4Low100 Ų100108.1 Ų108.152%0.52456%0.559SS.*Hα-helixtrans-63.5-38.2177-174.964.2000111.2S969 E971 V976 I977S969-L973 PolarHBondContact O-N 3.11Å; E971-L973 PolarHBondContact O-N 3.5Å; L973-V976 PolarHBondContact O-N 2.67Å; L973-I977 HydrophobicContact CG-CD1 4.1Å; L973-I977 WeakPolarHBondContact O-CB 3.47Å; L973-I977 VanDerWaalsContact O-CG1 3.28Å; L973-I977 WeakPolarHBondContact O-CG1 3.2Å; L973-I977 PolarHBondContact O-N 2.9Å
974Q71.3Confident68.3Low127 Ų127107.4 Ų107.459%0.59356%0.557SS**Hα-helixtrans-72.2-31.6178.1-167.7163.14.800112.3Q970 E971 E972 S978Q970-Q974 WeakPolarHBondContact O-CB 3.48Å; Q970-Q974 PolarHBondContact O-N 3.48Å; E971-Q974 PolarHBondContact O-N 2.89Å; E972-Q974 VanDerWaalsContact C-N 3.29Å; E972-Q974 PolarHBondContact O-N 3.28Å; Q974-S978 WeakPolarHBondContact O-CB 3.45Å; Q974-S978 PolarHBondContact O-N 3.47Å
975T74Confident70.4Confident73 Ų73104.3 Ų104.345%0.44855%0.548SS..Hα-helixtrans-67.5-43.816848.90000112.2E971 E972 I977 S978 E979E971-T975 PolarHBondContact O-N 3.36Å; E971-T975 PolarHBondContact O-OG1 3.13Å; E972-T975 WeakPolarHBondContact CA-OG1 3.38Å; E972-T975 PolarHBondContact O-N 3.05Å; E972-T975 PolarHBondContact O-OG1 2.93Å; T975-I977 VanDerWaalsContact C-N 3.34Å; T975-I977 PolarHBondContact O-N 2.95Å; T975-S978 PolarHBondContact O-N 3.2Å; T975-S978 VanDerWaalsContact O-N 3.15Å; T975-E979 WeakPolarHBondContact O-CG 3.31Å; T975-E979 PolarHBondContact O-N 2.95Å
976V75.8Confident72.5Confident73 Ų73104.5 Ų104.544%0.44254%0.539SS..Hα-helixtrans-65-38178170.20000111.4E972 L973 K980E972-V976 WeakPolarHBondContact O-CG2 3.2Å; E972-V976 PolarHBondContact O-N 2.91Å; L973-V976 PolarHBondContact O-N 2.67Å; V976-K980 HydrophobicContact CG1-CG 4.48Å; V976-K980 WeakPolarHBondContact O-CB 3.47Å; V976-K980 VanDerWaalsContact O-CG 3.23Å; V976-K980 WeakPolarHBondContact O-CG 3.36Å; V976-K980 PolarHBondContact O-N 2.82Å
977I76.1Confident74.6Confident83 Ų83103.8 Ų103.843%0.42653%0.526SS..Hα-helixtrans-62.3-47.6171.6-71.1166000110.2L973 T975 E979 K980 E981L973-I977 HydrophobicContact CG-CD1 4.1Å; L973-I977 WeakPolarHBondContact O-CB 3.47Å; L973-I977 VanDerWaalsContact O-CG1 3.28Å; L973-I977 WeakPolarHBondContact O-CG1 3.2Å; L973-I977 PolarHBondContact O-N 2.9Å; T975-I977 VanDerWaalsContact C-N 3.34Å; T975-I977 PolarHBondContact O-N 2.95Å; I977-E979 VanDerWaalsContact C-N 3.35Å; I977-E979 PolarHBondContact O-N 3.16Å; I977-K980 PolarHBondContact O-N 3.12Å; I977-K980 VanDerWaalsContact O-N 3.17Å; I977-E981 HydrophobicContact CG2-CG 4.23Å; I977-E981 WeakPolarHBondContact O-CB 3.34Å; I977-E981 WeakPolarHBondContact O-CG 3.34Å; I977-E981 PolarHBondContact O-N 3.49Å
978S80Confident76.3Confident69 Ų6999.2 Ų99.248%0.48351%0.514SS..Hα-helixtrans-64.3-36.5179.4-168.70000113.1Q974 T975 K982Q974-S978 WeakPolarHBondContact O-CB 3.45Å; Q974-S978 PolarHBondContact O-N 3.47Å; T975-S978 PolarHBondContact O-N 3.2Å; T975-S978 VanDerWaalsContact O-N 3.15Å; S978-K982 VanDerWaalsContact O-CB 3.3Å; S978-K982 WeakPolarHBondContact O-CB 3.39Å; S978-K982 PolarHBondContact O-N 2.85Å
979E85.8Confident78.5Confident131 Ų131100.2 Ų100.261%0.61252%0.515SS*.Hα-helixtrans-65.2-40.8172.5-74.6-178.8164.300112T975 I977 K982 E983T975-E979 WeakPolarHBondContact O-CG 3.31Å; T975-E979 PolarHBondContact O-N 2.95Å; I977-E979 VanDerWaalsContact C-N 3.35Å; I977-E979 PolarHBondContact O-N 3.16Å; E979-K982 PolarHBondContact O-N 3.06Å; E979-E983 WeakPolarHBondContact O-CB 3.37Å; E979-E983 PolarHBondContact O-N 3.35Å
980K86.3Confident80.3Confident109 Ų109103.1 Ų103.147%0.47452%0.523SS..Hα-helixtrans-73.1-37177.3-68.7-72.2156-162.50112.7V976 I977 K982 E983 I984V976-K980 HydrophobicContact CG1-CG 4.48Å; V976-K980 WeakPolarHBondContact O-CB 3.47Å; V976-K980 VanDerWaalsContact O-CG 3.23Å; V976-K980 WeakPolarHBondContact O-CG 3.36Å; V976-K980 PolarHBondContact O-N 2.82Å; I977-K980 PolarHBondContact O-N 3.12Å; I977-K980 VanDerWaalsContact O-N 3.17Å; K980-K982 VanDerWaalsContact C-N 3.32Å; K980-E983 VanDerWaalsContact CD-OE2 3.31Å; K980-E983 WeakPolarHBondContact CD-OE2 3.22Å; K980-E983 WeakPolarHBondContact CE-OE2 3.48Å; K980-E983 IonicContact NZ-OE1 3.16Å; K980-E983 IonicContact NZ-OE2 2.68Å; K980-E983 PolarHBondContact NZ-OE2 2.99Å; K980-E983 PolarHBondContact O-N 3.16Å; K980-I984 WeakPolarHBondContact O-CB 3.25Å; K980-I984 WeakPolarHBondContact O-CD1 3.39Å; K980-I984 WeakPolarHBondContact O-CG1 3.41Å; K980-I984 PolarHBondContact O-N 3.14Å
981E85.9Confident81.9Confident118 Ų118100.9 Ų100.955%0.55152%0.515SS*.Hα-helixtrans-59.8-44.1169.1-75.2177.6157.200110.6I977 I984 T985I977-E981 HydrophobicContact CG2-CG 4.23Å; I977-E981 WeakPolarHBondContact O-CB 3.34Å; I977-E981 WeakPolarHBondContact O-CG 3.34Å; I977-E981 PolarHBondContact O-N 3.49Å; E981-I984 PolarHBondContact O-N 2.87Å; E981-T985 WeakPolarHBondContact O-CG2 3.43Å; E981-T985 PolarHBondContact O-N 2.89Å; E981-T985 PolarHBondContact O-OG1 2.97Å
982K91.7Very high83.5Confident131 Ų13197.5 Ų97.557%0.5750%0.5SS*.Hα-helixtrans-62.8-49.8175.9-170.3-165.9170.7-159.20111.7S978 E979 K980 I984 T985 D986S978-K982 VanDerWaalsContact O-CB 3.3Å; S978-K982 WeakPolarHBondContact O-CB 3.39Å; S978-K982 PolarHBondContact O-N 2.85Å; E979-K982 PolarHBondContact O-N 3.06Å; K980-K982 VanDerWaalsContact C-N 3.32Å; K982-I984 VanDerWaalsContact C-N 3.28Å; K982-I984 PolarHBondContact O-N 2.96Å; K982-T985 WeakPolarHBondContact CA-OG1 3.43Å; K982-T985 CarbonylContact O-C 3.57Å; K982-T985 WeakPolarHBondContact O-CA 3.39Å; K982-T985 PolarHBondContact O-N 3.44Å; K982-T985 PolarHBondContact O-OG1 3.33Å; K982-D986 WeakPolarHBondContact CE-OD2 3.35Å; K982-D986 PolarHBondContact O-N 3.34Å
983E92.6Very high84.9Confident91 Ų9196.1 Ų96.143%0.42550%0.502SS..Hα-helixtrans-58.4-39.3177.1-172.1179.2-160.200111.7E979 K980 D986 L987E979-E983 WeakPolarHBondContact O-CB 3.37Å; E979-E983 PolarHBondContact O-N 3.35Å; K980-E983 VanDerWaalsContact CD-OE2 3.31Å; K980-E983 WeakPolarHBondContact CD-OE2 3.22Å; K980-E983 WeakPolarHBondContact CE-OE2 3.48Å; K980-E983 IonicContact NZ-OE1 3.16Å; K980-E983 IonicContact NZ-OE2 2.68Å; K980-E983 PolarHBondContact NZ-OE2 2.99Å; K980-E983 PolarHBondContact O-N 3.16Å; E983-D986 PolarHBondContact O-N 3.4Å; E983-L987 HydrophobicContact CG-CD1 4.24Å; E983-L987 WeakPolarHBondContact O-CB 3.5Å; E983-L987 VanDerWaalsContact O-CG 3.27Å; E983-L987 WeakPolarHBondContact O-CG 3.33Å; E983-L987 PolarHBondContact O-N 3.26Å
984I88Confident86.1Confident105 Ų10596 Ų9654%0.53850%0.502SS..Hα-helixtrans-62.9-44.1171.5-71.6164.3000111K980 E981 K982 L987 C988K980-I984 WeakPolarHBondContact O-CB 3.25Å; K980-I984 WeakPolarHBondContact O-CD1 3.39Å; K980-I984 WeakPolarHBondContact O-CG1 3.41Å; K980-I984 PolarHBondContact O-N 3.14Å; E981-I984 PolarHBondContact O-N 2.87Å; K982-I984 VanDerWaalsContact C-N 3.28Å; K982-I984 PolarHBondContact O-N 2.96Å; I984-L987 PolarHBondContact O-N 2.91Å; I984-C988 WeakPolarHBondContact O-CB 3.49Å; I984-C988 PolarHBondContact O-N 3.5Å; I984-C988 PolarHBondContact O-SG 3.27Å
985T89.8Confident87.1Confident75 Ų7595.6 Ų95.646%0.4650%0.498SS..Hα-helixtrans-65.9-38.6176.256.80000112.9E981 K982 C988 N989E981-T985 WeakPolarHBondContact O-CG2 3.43Å; E981-T985 PolarHBondContact O-N 2.89Å; E981-T985 PolarHBondContact O-OG1 2.97Å; K982-T985 WeakPolarHBondContact CA-OG1 3.43Å; K982-T985 CarbonylContact O-C 3.57Å; K982-T985 WeakPolarHBondContact O-CA 3.39Å; K982-T985 PolarHBondContact O-N 3.44Å; K982-T985 PolarHBondContact O-OG1 3.33Å; T985-C988 PolarHBondContact O-N 2.95Å; T985-N989 WeakPolarHBondContact O-CB 3.41Å; T985-N989 PolarHBondContact O-N 3.22Å; T985-N989 PolarHBondContact O-ND2 3.26Å
986D89.6Confident88Confident80 Ų8096.4 Ų96.443%0.42850%0.499SS..Hα-helixtrans-66.5-42.5177.7-72.7-26.7000110.5K982 E983 N989 E990K982-D986 WeakPolarHBondContact CE-OD2 3.35Å; K982-D986 PolarHBondContact O-N 3.34Å; E983-D986 PolarHBondContact O-N 3.4Å; D986-N989 WeakPolarHBondContact O-CB 3.37Å; D986-N989 PolarHBondContact O-N 3.47Å; D986-E990 PolarHBondContact O-N 2.93Å
987L90.6Very high88.7Confident86 Ų8695.4 Ų95.445%0.4550%0.499SS..Hα-helixtrans-65.7-37.2172.1-72.4169.4000113E983 I984 E990 L991E983-L987 HydrophobicContact CG-CD1 4.24Å; E983-L987 WeakPolarHBondContact O-CB 3.5Å; E983-L987 VanDerWaalsContact O-CG 3.27Å; E983-L987 WeakPolarHBondContact O-CG 3.33Å; E983-L987 PolarHBondContact O-N 3.26Å; I984-L987 PolarHBondContact O-N 2.91Å; L987-E990 PolarHBondContact O-N 2.96Å; L987-L991 WeakPolarHBondContact O-CB 3.4Å; L987-L991 VanDerWaalsContact O-CG 3.3Å; L987-L991 WeakPolarHBondContact O-CG 3.36Å; L987-L991 PolarHBondContact O-N 2.98Å
988C86.9Confident89.3Confident71 Ų7195 Ų9548%0.4850%0.5SS..Hα-helixtrans-65.5-39.1173-77.50000111.9I984 T985 E992I984-C988 WeakPolarHBondContact O-CB 3.49Å; I984-C988 PolarHBondContact O-N 3.5Å; I984-C988 PolarHBondContact O-SG 3.27Å; T985-C988 PolarHBondContact O-N 2.95Å; C988-E992 WeakPolarHBondContact O-CB 3.5Å; C988-E992 PolarHBondContact O-N 3.49Å
989N90.3Very high89.7Confident104 Ų10495.2 Ų95.256%0.55649%0.494SS*.Hα-helixtrans-66-40.4174.4-70.8-35.9000111.4T985 D986 E992 S993T985-N989 WeakPolarHBondContact O-CB 3.41Å; T985-N989 PolarHBondContact O-N 3.22Å; T985-N989 PolarHBondContact O-ND2 3.26Å; D986-N989 WeakPolarHBondContact O-CB 3.37Å; D986-N989 PolarHBondContact O-N 3.47Å; N989-E992 PolarHBondContact O-N 2.91Å; N989-S993 VanDerWaalsContact O-CB 3.26Å; N989-S993 WeakPolarHBondContact O-CB 3.36Å; N989-S993 PolarHBondContact O-N 3.35Å
990E93.4Very high89.9Confident112 Ų11295 Ų9552%0.52349%0.492SS..Hα-helixtrans-66.4-43.9174.9-174.1171.8-157.400112D986 L987 E992 S993 L994D986-E990 PolarHBondContact O-N 2.93Å; L987-E990 PolarHBondContact O-N 2.96Å; E990-E992 PolarHBondContact O-N 3.49Å; E990-S993 WeakPolarHBondContact O-CB 3.46Å; E990-S993 PolarHBondContact O-N 2.95Å; E990-L994 HydrophobicContact CG-CD1 3.99Å; E990-L994 HydrophobicContact CG-CG 4.39Å; E990-L994 WeakPolarHBondContact O-CB 3.32Å; E990-L994 WeakPolarHBondContact O-CG 3.35Å; E990-L994 PolarHBondContact O-N 2.65Å
991L87.5Confident89.9Confident117 Ų11795.3 Ų95.361%0.61350%0.496SS*.Hα-helixtrans-60.8-42.2174.8-77.3170.3000112.2L987 K995L987-L991 WeakPolarHBondContact O-CB 3.4Å; L987-L991 VanDerWaalsContact O-CG 3.3Å; L987-L991 WeakPolarHBondContact O-CG 3.36Å; L987-L991 PolarHBondContact O-N 2.98Å; L991-K995 WeakPolarHBondContact O-CB 3.47Å; L991-K995 PolarHBondContact O-N 2.78Å
992E90.9Very high90.2Very high85 Ų8596.5 Ų96.540%0.39750%0.495SS..Hα-helixtrans-69.9-35.3175.8-170.457-140.600111.5C988 N989 E990 K995 N996C988-E992 WeakPolarHBondContact O-CB 3.5Å; C988-E992 PolarHBondContact O-N 3.49Å; N989-E992 PolarHBondContact O-N 2.91Å; E990-E992 PolarHBondContact O-N 3.49Å; E992-K995 PolarHBondContact O-N 2.89Å; E992-K995 IonicContact OE1-NZ 3.57Å; E992-K995 PolarHBondContact OE1-NZ 3.16Å; E992-K995 IonicContact OE2-NZ 3.77Å; E992-K995 PolarHBondContact OE2-NZ 3.39Å; E992-N996 WeakPolarHBondContact O-CB 3.36Å; E992-N996 PolarHBondContact O-N 3.31Å; E992-N996 PolarHBondContact O-ND2 3.39Å; E992-N996 PolarHBondContact OE1-ND2 2.95Å
993S90.6Very high90.2Very high79 Ų7996.2 Ų96.255%0.55249%0.494SS*.Hα-helixtrans-62.5-50.3172.7-175.50000111.8N989 E990 K995 N996 A997N989-S993 VanDerWaalsContact O-CB 3.26Å; N989-S993 WeakPolarHBondContact O-CB 3.36Å; N989-S993 PolarHBondContact O-N 3.35Å; E990-S993 WeakPolarHBondContact O-CB 3.46Å; E990-S993 PolarHBondContact O-N 2.95Å; S993-K995 PolarHBondContact O-N 3.5Å; S993-N996 PolarHBondContact O-N 2.97Å; S993-A997 WeakPolarHBondContact O-CB 3.46Å; S993-A997 PolarHBondContact O-N 2.92Å
994L90.4Very high90.2Very high98 Ų9897.1 Ų97.151%0.51350%0.496SS..Hα-helixtrans-60.5-42.6175.4-74.9168.1000111.7E990 A997 V998E990-L994 HydrophobicContact CG-CD1 3.99Å; E990-L994 HydrophobicContact CG-CG 4.39Å; E990-L994 WeakPolarHBondContact O-CB 3.32Å; E990-L994 WeakPolarHBondContact O-CG 3.35Å; E990-L994 PolarHBondContact O-N 2.65Å; L994-A997 PolarHBondContact O-N 3.44Å; L994-V998 WeakPolarHBondContact O-CG2 3.4Å; L994-V998 PolarHBondContact O-N 2.96Å
995K93.8Very high90.2Very high118 Ų11895.6 Ų95.651%0.51349%0.489SS..Hα-helixtrans-59.3-46.4173.9169.3165.1158.7-87.10111.7L991 E992 S993 V998 E999L991-K995 WeakPolarHBondContact O-CB 3.47Å; L991-K995 PolarHBondContact O-N 2.78Å; E992-K995 PolarHBondContact O-N 2.89Å; E992-K995 IonicContact OE1-NZ 3.57Å; E992-K995 PolarHBondContact OE1-NZ 3.16Å; E992-K995 IonicContact OE2-NZ 3.77Å; E992-K995 PolarHBondContact OE2-NZ 3.39Å; S993-K995 PolarHBondContact O-N 3.5Å; K995-V998 PolarHBondContact O-N 2.89Å; K995-E999 WeakPolarHBondContact O-CB 3.28Å; K995-E999 PolarHBondContact O-N 2.74Å
996N92.9Very high90.3Very high89 Ų8996.4 Ų96.448%0.47649%0.491SS..Hα-helixtrans-67.4-34.5175.7-78.3-72.3000112.6E992 S993 E999 H1000E992-N996 WeakPolarHBondContact O-CB 3.36Å; E992-N996 PolarHBondContact O-N 3.31Å; E992-N996 PolarHBondContact O-ND2 3.39Å; E992-N996 PolarHBondContact OE1-ND2 2.95Å; S993-N996 PolarHBondContact O-N 2.97Å; N996-E999 PolarHBondContact O-N 3.06Å; N996-H1000 VanDerWaalsContact O-CB 3.25Å; N996-H1000 WeakPolarHBondContact O-CB 3.45Å; N996-H1000 PolarHBondContact O-N 2.89Å
997A90.1Very high90.5Very high53 Ų5396 Ų9644%0.43849%0.488SS..Hα-helixtrans-65-4317300000112S993 L994 H1000 Q1001S993-A997 WeakPolarHBondContact O-CB 3.46Å; S993-A997 PolarHBondContact O-N 2.92Å; L994-A997 PolarHBondContact O-N 3.44Å; A997-H1000 PolarHBondContact O-N 3.46Å; A997-Q1001 VanDerWaalsContact O-CG 3.3Å; A997-Q1001 WeakPolarHBondContact O-CG 3.35Å; A997-Q1001 PolarHBondContact O-N 3.37Å
998V87.3Confident90.5Very high75 Ų7595.9 Ų95.946%0.45549%0.488SS..Hα-helixtrans-64.1-42.9173.7169.10000111.2L994 K995 H1000 Q1001 R1002L994-V998 WeakPolarHBondContact O-CG2 3.4Å; L994-V998 PolarHBondContact O-N 2.96Å; K995-V998 PolarHBondContact O-N 2.89Å; V998-H1000 VanDerWaalsContact C-N 3.34Å; V998-H1000 PolarHBondContact O-N 2.9Å; V998-Q1001 PolarHBondContact O-N 2.87Å; V998-R1002 WeakPolarHBondContact O-CG 3.44Å; V998-R1002 PolarHBondContact O-N 3.49Å
999E89.1Confident90.7Very high73 Ų73100.4 Ų100.434%0.34150%0.495SS..Hα-helixtrans-66.1-36.5178.2-155.758.2-144.600111.9K995 N996 R1002 K1003K995-E999 WeakPolarHBondContact O-CB 3.28Å; K995-E999 PolarHBondContact O-N 2.74Å; N996-E999 PolarHBondContact O-N 3.06Å; E999-R1002 PolarHBondContact O-N 3.23Å; E999-R1002 IonicContact OE2-CZ 2.9Å; E999-R1002 IonicContact OE2-NH1 2.6Å; E999-R1002 PolarHBondContact OE2-NH1 2.95Å; E999-K1003 WeakPolarHBondContact O-CG 3.47Å; E999-K1003 PolarHBondContact O-N 3.37Å
1000H90.4Very high90.8Very high125 Ų125101.2 Ų101.258%0.57950%0.495SS*.Hα-helixtrans-67.3-40.9171.8-177.4-90.1000112.2N996 A997 V998 K1003 K1004N996-H1000 VanDerWaalsContact O-CB 3.25Å; N996-H1000 WeakPolarHBondContact O-CB 3.45Å; N996-H1000 PolarHBondContact O-N 2.89Å; A997-H1000 PolarHBondContact O-N 3.46Å; V998-H1000 VanDerWaalsContact C-N 3.34Å; V998-H1000 PolarHBondContact O-N 2.9Å; H1000-K1003 PolarHBondContact O-N 2.81Å; H1000-K1004 WeakPolarHBondContact O-CB 3.44Å; H1000-K1004 PolarHBondContact O-N 3.38Å
1001Q86.4Confident90.8Very high117 Ų117101.4 Ų101.455%0.54749%0.494SS..Hα-helixtrans-67.9-34.1174.2-68.7-71.514.600112.4A997 V998 N1005A997-Q1001 VanDerWaalsContact O-CG 3.3Å; A997-Q1001 WeakPolarHBondContact O-CG 3.35Å; A997-Q1001 PolarHBondContact O-N 3.37Å; V998-Q1001 PolarHBondContact O-N 2.87Å; Q1001-N1005 VanDerWaalsContact O-CB 3.32Å; Q1001-N1005 WeakPolarHBondContact O-CB 3.48Å; Q1001-N1005 PolarHBondContact O-N 3.17Å
1002R91.3Very high90.9Very high143 Ų143100.9 Ų100.954%0.5449%0.492SS..Hα-helixtrans-61.5-49.3171-77.6172.1173.1168.1-4111.5V998 E999 N1005 N1006V998-R1002 WeakPolarHBondContact O-CG 3.44Å; V998-R1002 PolarHBondContact O-N 3.49Å; E999-R1002 PolarHBondContact O-N 3.23Å; E999-R1002 IonicContact OE2-CZ 2.9Å; E999-R1002 IonicContact OE2-NH1 2.6Å; E999-R1002 PolarHBondContact OE2-NH1 2.95Å; R1002-N1005 PolarHBondContact O-N 2.83Å; R1002-N1006 PolarHBondContact O-N 2.83Å
1003K92.2Very high91.1Very high125 Ų125104.4 Ų104.454%0.54350%0.502SS..Hα-helixtrans-57-53.3174.1-72.8171.5-177.5174.30110.7E999 H1000 N1005 N1006 D1007E999-K1003 WeakPolarHBondContact O-CG 3.47Å; E999-K1003 PolarHBondContact O-N 3.37Å; H1000-K1003 PolarHBondContact O-N 2.81Å; K1003-N1005 VanDerWaalsContact C-N 3.25Å; K1003-N1005 PolarHBondContact O-N 2.68Å; K1003-N1006 CarbonylContact O-C 3.58Å; K1003-N1006 WeakPolarHBondContact O-CA 3.48Å; K1003-N1006 WeakPolarHBondContact O-CB 3.46Å; K1003-N1006 PolarHBondContact O-N 2.88Å; K1003-D1007 VanDerWaalsContact O-CG 3.32Å; K1003-D1007 PolarHBondContact O-N 2.97Å
1004K92.9Very high91.1Very high109 Ų109105.6 Ų105.647%0.47450%0.499SS..Hα-helixtrans-56.9-35176.5-169.8176.6179.9-178.20113.3H1000 L1008H1000-K1004 WeakPolarHBondContact O-CB 3.44Å; H1000-K1004 PolarHBondContact O-N 3.38Å; K1004-L1008 HydrophobicContact CG-CD1 4.3Å; K1004-L1008 WeakPolarHBondContact O-CB 3.37Å; K1004-L1008 WeakPolarHBondContact O-CD1 3.26Å; K1004-L1008 WeakPolarHBondContact O-CG 3.49Å; K1004-L1008 PolarHBondContact O-N 3.23Å
1005N88.5Confident91.1Very high73 Ų73103.1 Ų103.139%0.3949%0.493SS..Hα-helixtrans-71.1-37.5174.6-163.7-103.9000112.1Q1001 R1002 K1003 L1008 R1009Q1001-N1005 VanDerWaalsContact O-CB 3.32Å; Q1001-N1005 WeakPolarHBondContact O-CB 3.48Å; Q1001-N1005 PolarHBondContact O-N 3.17Å; R1002-N1005 PolarHBondContact O-N 2.83Å; K1003-N1005 VanDerWaalsContact C-N 3.25Å; K1003-N1005 PolarHBondContact O-N 2.68Å; N1005-L1008 PolarHBondContact O-N 3.3Å; N1005-R1009 VanDerWaalsContact O-CG 3.29Å; N1005-R1009 WeakPolarHBondContact O-CG 3.18Å; N1005-R1009 PolarHBondContact O-N 3.35Å; N1005-R1009 PolarHBondContact OD1-NE 2.85Å; N1005-R1009 PolarHBondContact OD1-NH2 3.16Å
1006N91.7Very high91Very high93 Ų93103.9 Ų103.950%0.49750%0.499SS..Hα-helixtrans-66.9-48173.8-68.6-11.6000111.3R1002 K1003 L1008 R1009 E1010R1002-N1006 PolarHBondContact O-N 2.83Å; K1003-N1006 CarbonylContact O-C 3.58Å; K1003-N1006 WeakPolarHBondContact O-CA 3.48Å; K1003-N1006 WeakPolarHBondContact O-CB 3.46Å; K1003-N1006 PolarHBondContact O-N 2.88Å; N1006-L1008 PolarHBondContact O-N 3.24Å; N1006-R1009 WeakPolarHBondContact O-CA 3.35Å; N1006-R1009 WeakPolarHBondContact O-CB 3.44Å; N1006-R1009 PolarHBondContact O-N 3.29Å; N1006-E1010 PolarHBondContact O-N 2.98Å
1007D93.3Very high90.9Very high70 Ų70105.2 Ų105.237%0.37450%0.503SS..Hα-helixtrans-54.7-37.5173.2-61.58.7000111.7K1003 K1011K1003-D1007 VanDerWaalsContact O-CG 3.32Å; K1003-D1007 PolarHBondContact O-N 2.97Å; D1007-K1011 WeakPolarHBondContact O-CB 3.49Å; D1007-K1011 WeakPolarHBondContact O-CD 3.47Å; D1007-K1011 VanDerWaalsContact O-CG 3.27Å; D1007-K1011 WeakPolarHBondContact O-CG 3.19Å; D1007-K1011 PolarHBondContact O-N 2.91Å
1008L91.6Very high90.9Very high85 Ų85105.3 Ų105.345%0.44550%0.504SS..Hα-helixtrans-74.4-32.8176.3-76.9169.2000112.5K1004 N1005 N1006 N1012K1004-L1008 HydrophobicContact CG-CD1 4.3Å; K1004-L1008 WeakPolarHBondContact O-CB 3.37Å; K1004-L1008 WeakPolarHBondContact O-CD1 3.26Å; K1004-L1008 WeakPolarHBondContact O-CG 3.49Å; K1004-L1008 PolarHBondContact O-N 3.23Å; N1005-L1008 PolarHBondContact O-N 3.3Å; N1006-L1008 PolarHBondContact O-N 3.24Å; L1008-N1012 VanDerWaalsContact O-CB 3.3Å; L1008-N1012 WeakPolarHBondContact O-CB 3.33Å; L1008-N1012 PolarHBondContact O-N 3.11Å; L1008-N1012 PolarHBondContact O-ND2 3.47Å
1009R90.6Very high90.9Very high165 Ų165107.3 Ų107.362%0.62351%0.511SS*.Hα-helixtrans-67.5-45.2171.8-72167.9-166.9-134.72111N1005 N1006 N1012 W1013N1005-R1009 VanDerWaalsContact O-CG 3.29Å; N1005-R1009 WeakPolarHBondContact O-CG 3.18Å; N1005-R1009 PolarHBondContact O-N 3.35Å; N1005-R1009 PolarHBondContact OD1-NE 2.85Å; N1005-R1009 PolarHBondContact OD1-NH2 3.16Å; N1006-R1009 WeakPolarHBondContact O-CA 3.35Å; N1006-R1009 WeakPolarHBondContact O-CB 3.44Å; N1006-R1009 PolarHBondContact O-N 3.29Å; R1009-N1012 PolarHBondContact O-N 3.3Å; R1009-W1013 WeakPolarHBondContact O-CB 3.36Å; R1009-W1013 PolarHBondContact O-N 3.4Å
1010E92.2Very high90.9Very high121 Ų121106.3 Ų106.357%0.56552%0.515SS*.Hα-helixtrans-59.2-52176.6-171.8168.3-133.400110.2N1006 N1012 W1013 E1014N1006-E1010 PolarHBondContact O-N 2.98Å; E1010-N1012 VanDerWaalsContact C-N 3.35Å; E1010-N1012 PolarHBondContact O-N 2.9Å; E1010-W1013 CarbonylContact O-C 3.57Å; E1010-W1013 WeakPolarHBondContact O-CA 3.42Å; E1010-W1013 WeakPolarHBondContact O-CB 3.47Å; E1010-W1013 PolarHBondContact O-N 3.02Å; E1010-E1014 WeakPolarHBondContact O-CG 3.46Å; E1010-E1014 PolarHBondContact O-N 3.46Å
1011K92.9Very high91Very high116 Ų116104 Ų10450%0.50451%0.513SS..Hα-helixtrans-64.8-32177.2-72.2163.2-172.8153.20114.2D1007 A1015D1007-K1011 WeakPolarHBondContact O-CB 3.49Å; D1007-K1011 WeakPolarHBondContact O-CD 3.47Å; D1007-K1011 VanDerWaalsContact O-CG 3.27Å; D1007-K1011 WeakPolarHBondContact O-CG 3.19Å; D1007-K1011 PolarHBondContact O-N 2.91Å; K1011-A1015 WeakPolarHBondContact O-CB 3.37Å; K1011-A1015 PolarHBondContact O-N 2.78Å
1012N89.8Confident91.1Very high106 Ų106101.5 Ų101.557%0.56751%0.506SS*.Hα-helixtrans-71.8-33.5171.5-86.9-82.4000112L1008 R1009 E1010 M1016L1008-N1012 VanDerWaalsContact O-CB 3.3Å; L1008-N1012 WeakPolarHBondContact O-CB 3.33Å; L1008-N1012 PolarHBondContact O-N 3.11Å; L1008-N1012 PolarHBondContact O-ND2 3.47Å; R1009-N1012 PolarHBondContact O-N 3.3Å; E1010-N1012 VanDerWaalsContact C-N 3.35Å; E1010-N1012 PolarHBondContact O-N 2.9Å; N1012-M1016 VanDerWaalsContact O-CB 3.24Å; N1012-M1016 WeakPolarHBondContact O-CB 3.39Å; N1012-M1016 PolarHBondContact O-N 2.66Å
1013W94.7Very high91.1Very high159 Ų159101.3 Ų101.360%0.60251%0.511SS*.Hα-helixtrans-70.6-45.3175.2178.978.6000111.3R1009 E1010 A1015 M1016 E1017R1009-W1013 WeakPolarHBondContact O-CB 3.36Å; R1009-W1013 PolarHBondContact O-N 3.4Å; E1010-W1013 CarbonylContact O-C 3.57Å; E1010-W1013 WeakPolarHBondContact O-CA 3.42Å; E1010-W1013 WeakPolarHBondContact O-CB 3.47Å; E1010-W1013 PolarHBondContact O-N 3.02Å; W1013-A1015 VanDerWaalsContact C-N 3.34Å; W1013-A1015 PolarHBondContact O-N 3.38Å; W1013-M1016 PolarHBondContact O-N 3.2Å; W1013-M1016 VanDerWaalsContact O-N 3.17Å; W1013-E1017 PolarHBondContact O-N 3.34Å
1014E91.1Very high91.1Very high105 Ų105102 Ų10249%0.49151%0.514SS..Hα-helixtrans-57.3-44.9170.3-69.9-178.8138.100111.6E1010 M1016 E1017 A1018E1010-E1014 WeakPolarHBondContact O-CG 3.46Å; E1010-E1014 PolarHBondContact O-N 3.46Å; E1014-M1016 VanDerWaalsContact C-N 3.34Å; E1014-M1016 PolarHBondContact O-N 2.97Å; E1014-E1017 PolarHBondContact O-N 2.92Å; E1014-A1018 VanDerWaalsContact O-CB 3.26Å; E1014-A1018 WeakPolarHBondContact O-CB 3.35Å; E1014-A1018 PolarHBondContact O-N 2.92Å
1015A91.1Very high91.1Very high46 Ų46101.5 Ų101.538%0.3852%0.515SS..Hα-helixtrans-65-36.9176.400000112.3K1011 W1013 L1019K1011-A1015 WeakPolarHBondContact O-CB 3.37Å; K1011-A1015 PolarHBondContact O-N 2.78Å; W1013-A1015 VanDerWaalsContact C-N 3.34Å; W1013-A1015 PolarHBondContact O-N 3.38Å; A1015-L1019 WeakPolarHBondContact O-CB 3.43Å; A1015-L1019 VanDerWaalsContact O-CG 3.24Å; A1015-L1019 WeakPolarHBondContact O-CG 3.35Å; A1015-L1019 PolarHBondContact O-N 3.45Å
1016M90.4Very high91.2Very high133 Ų133102.7 Ų102.766%0.65552%0.521SS*.Hα-helixtrans-70.3-38.8176-171.9176-67.500112N1012 W1013 E1014 L1019 A1020N1012-M1016 VanDerWaalsContact O-CB 3.24Å; N1012-M1016 WeakPolarHBondContact O-CB 3.39Å; N1012-M1016 PolarHBondContact O-N 2.66Å; W1013-M1016 PolarHBondContact O-N 3.2Å; W1013-M1016 VanDerWaalsContact O-N 3.17Å; E1014-M1016 VanDerWaalsContact C-N 3.34Å; E1014-M1016 PolarHBondContact O-N 2.97Å; M1016-L1019 PolarHBondContact O-N 2.95Å; M1016-A1020 WeakPolarHBondContact O-CB 3.42Å; M1016-A1020 PolarHBondContact O-N 3.22Å
1017E91.6Very high91.1Very high118 Ų118103.6 Ų103.655%0.55152%0.522SS*.Hα-helixtrans-68.1-40.9173.6-174.1171.3-129.700111.3W1013 E1014 A1020 S1021W1013-E1017 PolarHBondContact O-N 3.34Å; E1014-E1017 PolarHBondContact O-N 2.92Å; E1017-A1020 PolarHBondContact O-N 3.08Å; E1017-S1021 WeakPolarHBondContact O-CB 3.25Å; E1017-S1021 PolarHBondContact O-N 3.29Å
1018A90.8Very high91Very high55 Ų55104.7 Ų104.746%0.45553%0.528SS..Hα-helixtrans-61.4-45172.600000111.7E1014 S1021 T1022E1014-A1018 VanDerWaalsContact O-CB 3.26Å; E1014-A1018 WeakPolarHBondContact O-CB 3.35Å; E1014-A1018 PolarHBondContact O-N 2.92Å; A1018-S1021 WeakPolarHBondContact O-CB 3.23Å; A1018-S1021 PolarHBondContact O-N 2.96Å; A1018-T1022 WeakPolarHBondContact O-CG2 3.5Å; A1018-T1022 PolarHBondContact O-N 3.4Å; A1018-T1022 PolarHBondContact O-OG1 3.48Å
1019L87Confident90.9Very high117 Ų117108.3 Ų108.361%0.61354%0.535SS*.Hα-helixtrans-60.7-51.7174.7-78.5168.9000111.2A1015 M1016 S1021 T1022 E1023A1015-L1019 WeakPolarHBondContact O-CB 3.43Å; A1015-L1019 VanDerWaalsContact O-CG 3.24Å; A1015-L1019 WeakPolarHBondContact O-CG 3.35Å; A1015-L1019 PolarHBondContact O-N 3.45Å; M1016-L1019 PolarHBondContact O-N 2.95Å; L1019-S1021 PolarHBondContact O-N 2.79Å; L1019-T1022 CarbonylContact O-C 3.58Å; L1019-T1022 PolarHBondContact O-N 3.36Å; L1019-T1022 PolarHBondContact O-OG1 2.92Å; L1019-E1023 WeakPolarHBondContact O-CB 3.47Å; L1019-E1023 PolarHBondContact O-N 2.87Å
1020A88.2Confident90.9Very high51 Ų51104.7 Ų104.742%0.42153%0.531SS..Hα-helixtrans-59.5-34.6177.400000112.7M1016 E1017 K1024M1016-A1020 WeakPolarHBondContact O-CB 3.42Å; M1016-A1020 PolarHBondContact O-N 3.22Å; E1017-A1020 PolarHBondContact O-N 3.08Å; A1020-K1024 VanDerWaalsContact O-CB 3.24Å; A1020-K1024 WeakPolarHBondContact O-CB 3.49Å; A1020-K1024 PolarHBondContact O-N 2.88Å
1021S91.9Very high90.8Very high76 Ų76103.2 Ų103.253%0.53153%0.527SS..Hα-helixtrans-66.8-42.8173-172.40000112E1017 A1018 L1019 M1025E1017-S1021 WeakPolarHBondContact O-CB 3.25Å; E1017-S1021 PolarHBondContact O-N 3.29Å; A1018-S1021 WeakPolarHBondContact O-CB 3.23Å; A1018-S1021 PolarHBondContact O-N 2.96Å; L1019-S1021 PolarHBondContact O-N 2.79Å; S1021-M1025 WeakPolarHBondContact O-CB 3.43Å; S1021-M1025 PolarHBondContact O-N 3.49Å
1022T89.8Confident90.8Very high65 Ų65103.6 Ų103.640%0.39953%0.529SS..Hα-helixtrans-69-39.8174.159.80000113A1018 L1019 M1025 L1026A1018-T1022 WeakPolarHBondContact O-CG2 3.5Å; A1018-T1022 PolarHBondContact O-N 3.4Å; A1018-T1022 PolarHBondContact O-OG1 3.48Å; L1019-T1022 CarbonylContact O-C 3.58Å; L1019-T1022 PolarHBondContact O-N 3.36Å; L1019-T1022 PolarHBondContact O-OG1 2.92Å; T1022-M1025 PolarHBondContact O-N 2.97Å; T1022-L1026 WeakPolarHBondContact O-CB 3.48Å; T1022-L1026 VanDerWaalsContact O-CG 3.29Å; T1022-L1026 WeakPolarHBondContact O-CG 3.4Å; T1022-L1026 PolarHBondContact O-N 3.08Å
1023E90.3Very high90.7Very high139 Ų139101.5 Ų101.565%0.6552%0.52SS*.Hα-helixtrans-59.3-49.2174.1-177.6-178.1-169.900110.2L1019 M1025 L1026 Q1027L1019-E1023 WeakPolarHBondContact O-CB 3.47Å; L1019-E1023 PolarHBondContact O-N 2.87Å; E1023-M1025 PolarHBondContact O-N 3.25Å; E1023-L1026 PolarHBondContact O-N 2.85Å; E1023-Q1027 WeakPolarHBondContact O-CB 3.18Å; E1023-Q1027 PolarHBondContact O-N 3.31Å
1024K92.5Very high90.2Very high140 Ų14096.7 Ų96.761%0.60951%0.511SS*.Hα-helixtrans-59.6-44.1174.7-176.2177.2178.2-179.30112.2A1020 L1026 Q1027 D1028A1020-K1024 VanDerWaalsContact O-CB 3.24Å; A1020-K1024 WeakPolarHBondContact O-CB 3.49Å; A1020-K1024 PolarHBondContact O-N 2.88Å; K1024-L1026 VanDerWaalsContact C-N 3.33Å; K1024-L1026 PolarHBondContact O-N 3.13Å; K1024-Q1027 PolarHBondContact O-N 2.97Å; K1024-D1028 WeakPolarHBondContact O-CB 3.31Å; K1024-D1028 PolarHBondContact O-N 2.74Å
1025M93.4Very high90.1Very high98 Ų9898 Ų9848%0.48352%0.515SS..Hα-helixtrans-62.4-39.6176.9-167.7-144.8-56.600112.1S1021 T1022 E1023 R1029S1021-M1025 WeakPolarHBondContact O-CB 3.43Å; S1021-M1025 PolarHBondContact O-N 3.49Å; T1022-M1025 PolarHBondContact O-N 2.97Å; E1023-M1025 PolarHBondContact O-N 3.25Å; M1025-R1029 WeakPolarHBondContact O-CB 3.4Å; M1025-R1029 WeakPolarHBondContact O-CG 3.46Å; M1025-R1029 PolarHBondContact O-N 3.45Å
1026L90.8Very high89.9Confident99 Ų99100.2 Ų100.252%0.51852%0.517SS..Hα-helixtrans-68.6-42.6175.9-72.4171.4000111.1T1022 E1023 K1024 R1029 V1030T1022-L1026 WeakPolarHBondContact O-CB 3.48Å; T1022-L1026 VanDerWaalsContact O-CG 3.29Å; T1022-L1026 WeakPolarHBondContact O-CG 3.4Å; T1022-L1026 PolarHBondContact O-N 3.08Å; E1023-L1026 PolarHBondContact O-N 2.85Å; K1024-L1026 VanDerWaalsContact C-N 3.33Å; K1024-L1026 PolarHBondContact O-N 3.13Å; L1026-R1029 CarbonylContact O-C 3.6Å; L1026-R1029 WeakPolarHBondContact O-CB 3.41Å; L1026-R1029 PolarHBondContact O-N 3.3Å; L1026-V1030 WeakPolarHBondContact O-CB 3.34Å; L1026-V1030 WeakPolarHBondContact O-CG2 3.24Å; L1026-V1030 PolarHBondContact O-N 2.84Å
1027Q88.8Confident89.6Confident111 Ų111102.6 Ų102.652%0.51952%0.519SS..Hα-helixtrans-64.3-42.9176.8-171.767.8-20.400111.7E1023 K1024 R1029 V1030 N1031E1023-Q1027 WeakPolarHBondContact O-CB 3.18Å; E1023-Q1027 PolarHBondContact O-N 3.31Å; K1024-Q1027 PolarHBondContact O-N 2.97Å; Q1027-R1029 VanDerWaalsContact C-N 3.35Å; Q1027-R1029 PolarHBondContact O-N 2.64Å; Q1027-V1030 PolarHBondContact O-N 2.7Å; Q1027-N1031 VanDerWaalsContact O-CB 3.3Å; Q1027-N1031 WeakPolarHBondContact O-CB 3.49Å; Q1027-N1031 VanDerWaalsContact O-CG 3.24Å; Q1027-N1031 PolarHBondContact O-N 2.84Å; Q1027-N1031 PolarHBondContact O-ND2 3.01Å; Q1027-N1031 VanDerWaalsContact O-ND2 3.11Å
1028D91.1Very high89.4Confident93 Ų93104.4 Ų104.450%0.49752%0.521SS..Hα-helixtrans-64.4-37.4173.2-77.3-24.9000111.8K1024 K1032K1024-D1028 WeakPolarHBondContact O-CB 3.31Å; K1024-D1028 PolarHBondContact O-N 2.74Å; D1028-K1032 WeakPolarHBondContact O-CB 3.42Å; D1028-K1032 PolarHBondContact O-N 2.76Å
1029R91.3Very high89.3Confident162 Ų162106.8 Ų106.861%0.61152%0.522SS*.Hα-helixtrans-64.5-46.6171.5-83.7178.6164.9-159.7-3.2112.3M1025 L1026 Q1027 K1032 T1033M1025-R1029 WeakPolarHBondContact O-CB 3.4Å; M1025-R1029 WeakPolarHBondContact O-CG 3.46Å; M1025-R1029 PolarHBondContact O-N 3.45Å; L1026-R1029 CarbonylContact O-C 3.6Å; L1026-R1029 WeakPolarHBondContact O-CB 3.41Å; L1026-R1029 PolarHBondContact O-N 3.3Å; Q1027-R1029 VanDerWaalsContact C-N 3.35Å; Q1027-R1029 PolarHBondContact O-N 2.64Å; R1029-K1032 PolarHBondContact O-N 2.73Å; R1029-T1033 WeakPolarHBondContact O-CB 3.39Å; R1029-T1033 PolarHBondContact O-N 2.65Å; R1029-T1033 PolarHBondContact O-OG1 3.43Å
1030V89.6Confident89.2Confident89 Ų89107.4 Ų107.454%0.53952%0.522SS..Hα-helixtrans-61.8-45.7177.9167.60000110.5L1026 Q1027 K1032 T1033 S1034L1026-V1030 WeakPolarHBondContact O-CB 3.34Å; L1026-V1030 WeakPolarHBondContact O-CG2 3.24Å; L1026-V1030 PolarHBondContact O-N 2.84Å; Q1027-V1030 PolarHBondContact O-N 2.7Å; V1030-K1032 PolarHBondContact O-N 2.88Å; V1030-T1033 PolarHBondContact O-N 3.47Å; V1030-S1034 WeakPolarHBondContact O-CB 3.38Å; V1030-S1034 PolarHBondContact O-N 3.29Å
1031N89.9Confident89.1Confident89 Ų89108.8 Ų108.848%0.47653%0.525SS..Hα-helixtrans-60.7-43.6174.9-75.6-35000112Q1027 S1034 K1035Q1027-N1031 VanDerWaalsContact O-CB 3.3Å; Q1027-N1031 WeakPolarHBondContact O-CB 3.49Å; Q1027-N1031 VanDerWaalsContact O-CG 3.24Å; Q1027-N1031 PolarHBondContact O-N 2.84Å; Q1027-N1031 PolarHBondContact O-ND2 3.01Å; Q1027-N1031 VanDerWaalsContact O-ND2 3.11Å; N1031-S1034 PolarHBondContact O-N 3.43Å; N1031-K1035 WeakPolarHBondContact O-CB 3.37Å; N1031-K1035 PolarHBondContact O-N 3.27Å
1032K92.5Very high88.9Confident125 Ų125110.1 Ų110.154%0.54352%0.523SS..Hα-helixtrans-63.1-51.6176178.9173.6172.2177.50111.8D1028 R1029 V1030 S1034 K1035 E1036D1028-K1032 WeakPolarHBondContact O-CB 3.42Å; D1028-K1032 PolarHBondContact O-N 2.76Å; R1029-K1032 PolarHBondContact O-N 2.73Å; V1030-K1032 PolarHBondContact O-N 2.88Å; K1032-S1034 VanDerWaalsContact C-N 3.3Å; K1032-S1034 PolarHBondContact O-N 3.25Å; K1032-K1035 WeakPolarHBondContact O-CB 3.49Å; K1032-K1035 PolarHBondContact O-N 2.9Å; K1032-K1035 VanDerWaalsContact O-N 3.13Å; K1032-E1036 WeakPolarHBondContact CE-OE1 3.2Å; K1032-E1036 HydrophobicContact CG-CG 4.36Å; K1032-E1036 IonicContact NZ-OE1 3.63Å; K1032-E1036 WeakPolarHBondContact O-CG 3.36Å; K1032-E1036 PolarHBondContact O-N 3.27Å
1033T87.3Confident88.8Confident61 Ų61109.5 Ų109.537%0.37452%0.524SS..Hα-helixtrans-63.4-34.7178.4-61.50000112.2R1029 V1030 R1037R1029-T1033 WeakPolarHBondContact O-CB 3.39Å; R1029-T1033 PolarHBondContact O-N 2.65Å; R1029-T1033 PolarHBondContact O-OG1 3.43Å; V1030-T1033 PolarHBondContact O-N 3.47Å; T1033-R1037 HydrophobicContact CG2-CG 4.4Å; T1033-R1037 VanDerWaalsContact O-CB 3.29Å; T1033-R1037 WeakPolarHBondContact O-CB 3.44Å; T1033-R1037 VanDerWaalsContact O-CG 3.25Å; T1033-R1037 WeakPolarHBondContact O-CG 3.28Å; T1033-R1037 PolarHBondContact O-N 2.87Å
1034S84.1Confident88.5Confident58 Ų58106.7 Ų106.741%0.40651%0.513SS..Hα-helixtrans-63-44.1172.3-177.60000111.8V1030 N1031 K1032 R1038V1030-S1034 WeakPolarHBondContact O-CB 3.38Å; V1030-S1034 PolarHBondContact O-N 3.29Å; N1031-S1034 PolarHBondContact O-N 3.43Å; K1032-S1034 VanDerWaalsContact C-N 3.3Å; K1032-S1034 PolarHBondContact O-N 3.25Å; S1034-R1038 WeakPolarHBondContact O-CB 3.26Å; S1034-R1038 PolarHBondContact O-N 3.26Å
1035K89.4Confident88.3Confident134 Ų134103 Ų10358%0.58350%0.497SS*.Hα-helixtrans-66.2-44.8175.5-173177.3-179.5179.20112.4N1031 K1032 R1038 Q1039N1031-K1035 WeakPolarHBondContact O-CB 3.37Å; N1031-K1035 PolarHBondContact O-N 3.27Å; K1032-K1035 WeakPolarHBondContact O-CB 3.49Å; K1032-K1035 PolarHBondContact O-N 2.9Å; K1032-K1035 VanDerWaalsContact O-N 3.13Å; K1035-R1038 PolarHBondContact O-N 2.81Å; K1035-Q1039 WeakPolarHBondContact O-CG 3.23Å; K1035-Q1039 PolarHBondContact O-N 2.85Å
1036E88.2Confident88Confident91 Ų91103.4 Ų103.443%0.42550%0.501SS..Hα-helixtrans-63.8-43.7178-72.4170.7157.800111.4K1032 R1038 Q1039 H1040K1032-E1036 WeakPolarHBondContact CE-OE1 3.2Å; K1032-E1036 HydrophobicContact CG-CG 4.36Å; K1032-E1036 IonicContact NZ-OE1 3.63Å; K1032-E1036 WeakPolarHBondContact O-CG 3.36Å; K1032-E1036 PolarHBondContact O-N 3.27Å; E1036-R1038 PolarHBondContact O-N 2.83Å; E1036-Q1039 PolarHBondContact O-N 3.17Å; E1036-H1040 WeakPolarHBondContact O-CB 3.42Å; E1036-H1040 PolarHBondContact O-N 2.87Å
1037R84.2Confident87.9Confident183 Ų183105.5 Ų105.569%0.69151%0.509SS*.Hα-helixtrans-59.3-44.3172-77.4177.4179.6-173.40.5111.8T1033 H1040 V1041T1033-R1037 HydrophobicContact CG2-CG 4.4Å; T1033-R1037 VanDerWaalsContact O-CB 3.29Å; T1033-R1037 WeakPolarHBondContact O-CB 3.44Å; T1033-R1037 VanDerWaalsContact O-CG 3.25Å; T1033-R1037 WeakPolarHBondContact O-CG 3.28Å; T1033-R1037 PolarHBondContact O-N 2.87Å; R1037-H1040 PolarHBondContact O-N 2.85Å; R1037-V1041 WeakPolarHBondContact O-CG2 3.39Å; R1037-V1041 PolarHBondContact O-N 3.33Å
1038R86.3Confident87.7Confident156 Ų156101.7 Ų101.759%0.58949%0.494SS*.Hα-helixtrans-61.5-47.9177.7-168.4-173.9-57.1-177.12111.7S1034 K1035 E1036 H1040 V1041 E1042S1034-R1038 WeakPolarHBondContact O-CB 3.26Å; S1034-R1038 PolarHBondContact O-N 3.26Å; K1035-R1038 PolarHBondContact O-N 2.81Å; E1036-R1038 PolarHBondContact O-N 2.83Å; R1038-H1040 VanDerWaalsContact C-N 3.28Å; R1038-H1040 PolarHBondContact O-N 3.22Å; R1038-V1041 PolarHBondContact O-N 2.77Å; R1038-E1042 WeakPolarHBondContact CD-OE1 3.37Å; R1038-E1042 WeakPolarHBondContact CG-OE1 3.37Å; R1038-E1042 WeakPolarHBondContact O-CB 3.36Å; R1038-E1042 WeakPolarHBondContact O-CG 3.48Å; R1038-E1042 PolarHBondContact O-N 3.42Å
1039Q88.4Confident87.6Confident106 Ų10698.7 Ų98.750%0.49548%0.477SS..Hα-helixtrans-62.7-34.6176.9-71.6-179.5-47.200112.4K1035 E1036 A1043K1035-Q1039 WeakPolarHBondContact O-CG 3.23Å; K1035-Q1039 PolarHBondContact O-N 2.85Å; E1036-Q1039 PolarHBondContact O-N 3.17Å; Q1039-A1043 WeakPolarHBondContact O-CB 3.44Å; Q1039-A1043 PolarHBondContact O-N 3.22Å
1040H85.1Confident87.3Confident130 Ų13094.8 Ų94.860%0.60247%0.468SS*.Hα-helixtrans-71.6-38.6176.5-157.941.4000112.1E1036 R1037 R1038 A1043 I1044E1036-H1040 WeakPolarHBondContact O-CB 3.42Å; E1036-H1040 PolarHBondContact O-N 2.87Å; R1037-H1040 PolarHBondContact O-N 2.85Å; R1038-H1040 VanDerWaalsContact C-N 3.28Å; R1038-H1040 PolarHBondContact O-N 3.22Å; H1040-A1043 PolarHBondContact O-N 3.45Å; H1040-I1044 WeakPolarHBondContact O-CB 3.44Å; H1040-I1044 WeakPolarHBondContact O-CD1 3.47Å; H1040-I1044 VanDerWaalsContact O-CG1 3.25Å; H1040-I1044 WeakPolarHBondContact O-CG1 3.42Å; H1040-I1044 PolarHBondContact O-N 3.37Å
1041V85.4Confident87.1Confident79 Ų7994 Ų9448%0.47946%0.46SS..Hα-helixtrans-61.2-52.5169.6171.30000110.4R1037 R1038 A1043 I1044 E1045R1037-V1041 WeakPolarHBondContact O-CG2 3.39Å; R1037-V1041 PolarHBondContact O-N 3.33Å; R1038-V1041 PolarHBondContact O-N 2.77Å; V1041-A1043 PolarHBondContact O-N 3Å; V1041-I1044 PolarHBondContact O-N 2.82Å; V1041-E1045 HydrophobicContact CG1-CG 4.13Å; V1041-E1045 WeakPolarHBondContact O-CG 3.37Å; V1041-E1045 PolarHBondContact O-N 3.43Å
1042E88Confident86.9Confident104 Ų10491.7 Ų91.749%0.48645%0.447SS..Hα-helixtrans-54.8-38.4177.8-72.6166.5-174.400112.3R1038 L1046R1038-E1042 WeakPolarHBondContact CD-OE1 3.37Å; R1038-E1042 WeakPolarHBondContact CG-OE1 3.37Å; R1038-E1042 WeakPolarHBondContact O-CB 3.36Å; R1038-E1042 WeakPolarHBondContact O-CG 3.48Å; R1038-E1042 PolarHBondContact O-N 3.42Å; E1042-L1046 WeakPolarHBondContact O-CB 3.31Å; E1042-L1046 PolarHBondContact O-N 3.03Å
1043A88.1Confident86.5Confident52 Ų5289.9 Ų89.943%0.4344%0.44SS..Hα-helixtrans-68.4-45174.800000112.9Q1039 H1040 V1041 E1045 L1046 E1047Q1039-A1043 WeakPolarHBondContact O-CB 3.44Å; Q1039-A1043 PolarHBondContact O-N 3.22Å; H1040-A1043 PolarHBondContact O-N 3.45Å; V1041-A1043 PolarHBondContact O-N 3Å; A1043-E1045 VanDerWaalsContact C-N 3.34Å; A1043-L1046 PolarHBondContact O-N 2.95Å; A1043-E1047 PolarHBondContact O-N 2.93Å
1044I84.1Confident86.3Confident81 Ų8195.2 Ų95.242%0.41545%0.453SS..Hα-helixtrans-65.6-37.2176.9-68.9163.8000110.9H1040 V1041 S1048H1040-I1044 WeakPolarHBondContact O-CB 3.44Å; H1040-I1044 WeakPolarHBondContact O-CD1 3.47Å; H1040-I1044 VanDerWaalsContact O-CG1 3.25Å; H1040-I1044 WeakPolarHBondContact O-CG1 3.42Å; H1040-I1044 PolarHBondContact O-N 3.37Å; V1041-I1044 PolarHBondContact O-N 2.82Å; I1044-S1048 WeakPolarHBondContact O-CB 3.36Å; I1044-S1048 PolarHBondContact O-N 3.25Å; I1044-S1048 PolarHBondContact O-OG 3.45Å
1045E89.1Confident86.1Confident61 Ų6197 Ų9729%0.28546%0.458SS..Hα-helixtrans-63.5-39.7173.2-70.7-165.8163.500111.9V1041 A1043 K1049 Y1067V1041-E1045 HydrophobicContact CG1-CG 4.13Å; V1041-E1045 WeakPolarHBondContact O-CG 3.37Å; V1041-E1045 PolarHBondContact O-N 3.43Å; A1043-E1045 VanDerWaalsContact C-N 3.34Å; E1045-K1049 VanDerWaalsContact O-CB 3.29Å; E1045-K1049 WeakPolarHBondContact O-CB 3.23Å; E1045-K1049 WeakPolarHBondContact O-CG 3.49Å; E1045-K1049 PolarHBondContact O-N 3Å; E1045-Y1067 HydrophobicContact CB-CD1 4.25Å; E1045-Y1067 HydrophobicContact CB-CD2 3.62Å; E1045-Y1067 HydrophobicContact CB-CE1 4.47Å; E1045-Y1067 HydrophobicContact CB-CE2 3.91Å; E1045-Y1067 HydrophobicContact CB-CG 3.82Å; E1045-Y1067 HydrophobicContact CG-CD1 3.51Å; E1045-Y1067 HydrophobicContact CG-CD2 3.84Å; E1045-Y1067 HydrophobicContact CG-CE1 3.83Å; E1045-Y1067 HydrophobicContact CG-CE2 4.16Å; E1045-Y1067 HydrophobicContact CG-CG 3.51Å; E1045-Y1067 VanDerWaalsContact O-CE2 3.32Å; E1045-Y1067 WeakPolarHBondContact O-CE2 3.4Å; E1045-Y1067 VanDerWaalsContact OE1-CB 3.31Å; E1045-Y1067 WeakPolarHBondContact OE1-CB 3.17Å; E1045-Y1067 VanDerWaalsContact OE1-CD1 3.29Å; E1045-Y1067 WeakPolarHBondContact OE1-CD1 3.27Å; E1045-Y1067 WeakPolarHBondContact OE2-CB 3.47Å
1046L87.1Confident85.6Confident108 Ų10893.8 Ų93.857%0.56544%0.444SS*.Hα-helixtrans-68.9-48.4176.6-165.481.7000111.6E1042 A1043 S1048 K1049 D1050E1042-L1046 WeakPolarHBondContact O-CB 3.31Å; E1042-L1046 PolarHBondContact O-N 3.03Å; A1043-L1046 PolarHBondContact O-N 2.95Å; L1046-S1048 VanDerWaalsContact C-N 3.32Å; L1046-S1048 PolarHBondContact O-N 3.05Å; L1046-K1049 WeakPolarHBondContact O-CB 3.33Å; L1046-K1049 PolarHBondContact O-N 3.36Å; L1046-D1050 PolarHBondContact O-N 2.87Å
1047E87.3Confident85.2Confident143 Ų14394.8 Ų94.867%0.66846%0.458SS*.Hα-helixtrans-61.5-41.5177.5-176.7172.2-161.200111A1043 D1050 L1051A1043-E1047 PolarHBondContact O-N 2.93Å; E1047-D1050 PolarHBondContact O-N 3.18Å; E1047-L1051 WeakPolarHBondContact O-CB 3.49Å; E1047-L1051 PolarHBondContact O-N 3.13Å
1048S85.4Confident84.4Confident30 Ų3091.9 Ų91.921%0.2146%0.46CS..Hα-helixtrans-64.8-41.3175-60.50000112I1044 L1046 D1050 L1052 Y1067I1044-S1048 WeakPolarHBondContact O-CB 3.36Å; I1044-S1048 PolarHBondContact O-N 3.25Å; I1044-S1048 PolarHBondContact O-OG 3.45Å; L1046-S1048 VanDerWaalsContact C-N 3.32Å; L1046-S1048 PolarHBondContact O-N 3.05Å; S1048-D1050 VanDerWaalsContact C-N 3.34Å; S1048-D1050 PolarHBondContact O-N 3.4Å; S1048-L1052 VanDerWaalsContact O-CB 3.31Å; S1048-L1052 WeakPolarHBondContact O-CB 3.46Å; S1048-L1052 WeakPolarHBondContact O-CD1 3.37Å; S1048-L1052 VanDerWaalsContact O-CG 3.24Å; S1048-L1052 WeakPolarHBondContact O-CG 3.37Å; S1048-L1052 PolarHBondContact O-N 3.39Å; S1048-Y1067 WeakPolarHBondContact CB-OH 3.31Å; S1048-Y1067 PolarHBondContact OG-OH 3.32Å
1049K88Confident84Confident31 Ų3184.9 Ų84.914%0.13544%0.435CS..Hα-helixtrans-57.7-44.6172.9-91.2163.6165.5169.40111.5E1045 L1046 K1053 Y1067 W1070E1045-K1049 VanDerWaalsContact O-CB 3.29Å; E1045-K1049 WeakPolarHBondContact O-CB 3.23Å; E1045-K1049 WeakPolarHBondContact O-CG 3.49Å; E1045-K1049 PolarHBondContact O-N 3Å; L1046-K1049 WeakPolarHBondContact O-CB 3.33Å; L1046-K1049 PolarHBondContact O-N 3.36Å; K1049-K1053 VanDerWaalsContact O-CG 3.22Å; K1049-K1053 WeakPolarHBondContact O-CG 3.38Å; K1049-K1053 PolarHBondContact O-N 2.95Å; K1049-K1053 VanDerWaalsContact O-N 3.12Å; K1049-Y1067 HydrophobicContact CD-CD2 4.01Å; K1049-Y1067 HydrophobicContact CG-CD2 4.07Å; K1049-Y1067 HydrophobicContact CG-CE2 4.18Å; K1049-W1070 HydrophobicContact CB-CH2 4.21Å; K1049-W1070 HydrophobicContact CB-CZ2 4.5Å; K1049-W1070 HydrophobicContact CB-CZ3 4.23Å; K1049-W1070 HydrophobicContact CD-CD2 4.3Å; K1049-W1070 HydrophobicContact CD-CE3 4.44Å; K1049-W1070 VanDerWaalsContact CE-CG 3.5Å; K1049-W1070 HydrophobicContact CG-CD2 3.71Å; K1049-W1070 HydrophobicContact CG-CE3 3.5Å; K1049-W1070 VanDerWaalsContact CG-CE3 3.5Å; K1049-W1070 HydrophobicContact CG-CG 4.42Å; K1049-W1070 HydrophobicContact CG-CH2 3.97Å; K1049-W1070 HydrophobicContact CG-CZ2 4.16Å; K1049-W1070 HydrophobicContact CG-CZ3 3.64Å; K1049-W1070 WeakPolarHBondContact O-CH2 3.47Å
1050D85.4Confident83.5Confident80 Ų8084.3 Ų84.343%0.42844%0.443SS..Hα-helixtrans-79.3-34.7-177.9-75.7-7000113.4L1046 E1047 S1048 K1053 R1054L1046-D1050 PolarHBondContact O-N 2.87Å; E1047-D1050 PolarHBondContact O-N 3.18Å; S1048-D1050 VanDerWaalsContact C-N 3.34Å; S1048-D1050 PolarHBondContact O-N 3.4Å; D1050-K1053 PolarHBondContact O-N 3.48Å; D1050-K1053 WeakPolarHBondContact OD1-CE 3.49Å; D1050-K1053 IonicContact OD1-NZ 2.61Å; D1050-K1053 PolarHBondContact OD1-NZ 2.92Å; D1050-R1054 VanDerWaalsContact O-CB 3.31Å; D1050-R1054 WeakPolarHBondContact O-CB 3.47Å; D1050-R1054 PolarHBondContact O-N 3.48Å
1051L86.8Confident83.4Confident72 Ų7279 Ų7938%0.37742%0.42SS..Hα-helixtrans-57.8-47.5169.3175.360.1000111E1047 R1054 L1055E1047-L1051 WeakPolarHBondContact O-CB 3.49Å; E1047-L1051 PolarHBondContact O-N 3.13Å; L1051-R1054 PolarHBondContact O-N 3.44Å; L1051-L1055 HydrophobicContact CD1-CD1 4Å; L1051-L1055 HydrophobicContact CD1-CG 4.22Å; L1051-L1055 HydrophobicContact CG-CD1 4.06Å; L1051-L1055 WeakPolarHBondContact O-CG 3.36Å; L1051-L1055 PolarHBondContact O-N 3.3Å
1052L84.5Confident83.1Confident40 Ų4078.6 Ų78.621%0.20942%0.419CS..Hα-helixtrans-66-44.8179.6-74.3169.8000112S1048 R1054 L1055 F1056 W1070 L1071 F1074S1048-L1052 VanDerWaalsContact O-CB 3.31Å; S1048-L1052 WeakPolarHBondContact O-CB 3.46Å; S1048-L1052 WeakPolarHBondContact O-CD1 3.37Å; S1048-L1052 VanDerWaalsContact O-CG 3.24Å; S1048-L1052 WeakPolarHBondContact O-CG 3.37Å; S1048-L1052 PolarHBondContact O-N 3.39Å; L1052-R1054 VanDerWaalsContact C-N 3.26Å; L1052-R1054 PolarHBondContact O-N 2.92Å; L1052-L1055 PolarHBondContact O-N 3.42Å; L1052-F1056 PolarHBondContact O-N 2.92Å; L1052-W1070 HydrophobicContact CB-CH2 4.14Å; L1052-W1070 HydrophobicContact CB-CZ3 4.29Å; L1052-W1070 HydrophobicContact CD1-CZ3 3.98Å; L1052-L1071 HydrophobicContact CD1-CD2 3.45Å; L1052-L1071 VanDerWaalsContact CD1-CD2 3.45Å; L1052-F1074 HydrophobicContact CB-CD1 4.3Å; L1052-F1074 HydrophobicContact CB-CE1 3.79Å; L1052-F1074 HydrophobicContact CB-CE2 4.17Å; L1052-F1074 HydrophobicContact CB-CZ 3.72Å; L1052-F1074 HydrophobicContact CD1-CD1 4.43Å; L1052-F1074 HydrophobicContact CD2-CD1 4.46Å; L1052-F1074 HydrophobicContact CD2-CE1 3.92Å; L1052-F1074 HydrophobicContact CG-CE1 4.3Å; L1052-F1074 VanDerWaalsContact O-CZ 3.28Å; L1052-F1074 WeakPolarHBondContact O-CZ 3.31Å
1053K83.8Confident82.4Confident88 Ų8878.8 Ų78.838%0.38343%0.432SS..Hα-helixtrans-55.7-40.8171.4-69.4165.9-155.6165.10112.1K1049 D1050 F1056 P1057 W1070K1049-K1053 VanDerWaalsContact O-CG 3.22Å; K1049-K1053 WeakPolarHBondContact O-CG 3.38Å; K1049-K1053 PolarHBondContact O-N 2.95Å; K1049-K1053 VanDerWaalsContact O-N 3.12Å; D1050-K1053 PolarHBondContact O-N 3.48Å; D1050-K1053 WeakPolarHBondContact OD1-CE 3.49Å; D1050-K1053 IonicContact OD1-NZ 2.61Å; D1050-K1053 PolarHBondContact OD1-NZ 2.92Å; K1053-F1056 CarbonylContact O-C 3.41Å; K1053-F1056 VanDerWaalsContact O-C 3.3Å; K1053-P1057 WeakPolarHBondContact O-CA 3.47Å; K1053-W1070 HydrophobicContact CG-CH2 4.36Å; K1053-W1070 HydrophobicContact CG-CZ2 4.16Å
1054R84Confident82Confident173 Ų17382.9 Ų82.965%0.65345%0.446SS*.Hα-helixtrans-70.9-31.9179.3-172.9177.361.673.1-5.2112.9D1050 L1051 L1052D1050-R1054 VanDerWaalsContact O-CB 3.31Å; D1050-R1054 WeakPolarHBondContact O-CB 3.47Å; D1050-R1054 PolarHBondContact O-N 3.48Å; L1051-R1054 PolarHBondContact O-N 3.44Å; L1052-R1054 VanDerWaalsContact C-N 3.26Å; L1052-R1054 PolarHBondContact O-N 2.92Å
1055L80.3Confident81.8Confident96 Ų9681.6 Ų81.650%0.50344%0.44SS..Hα-helixtrans-77.3-31.2176.2-71.2171.9000112.7L1051 L1052L1051-L1055 HydrophobicContact CD1-CD1 4Å; L1051-L1055 HydrophobicContact CD1-CG 4.22Å; L1051-L1055 HydrophobicContact CG-CD1 4.06Å; L1051-L1055 WeakPolarHBondContact O-CG 3.36Å; L1051-L1055 PolarHBondContact O-N 3.3Å; L1052-L1055 PolarHBondContact O-N 3.42Å
1056F78.8Confident81.7Confident66 Ų6682.4 Ų82.429%0.28945%0.446SS..  trans-130.974.8176.1-52.7-87.2000112L1052 K1053 T1058 V1059 F1074 A1078 V1082L1052-F1056 PolarHBondContact O-N 2.92Å; K1053-F1056 CarbonylContact O-C 3.41Å; K1053-F1056 VanDerWaalsContact O-C 3.3Å; F1056-T1058 PolarHBondContact O-N 3.37Å; F1056-T1058 VanDerWaalsContact O-N 3.08Å; F1056-V1059 HydrophobicContact CB-CB 4.04Å; F1056-V1059 HydrophobicContact CB-CG2 3.67Å; F1056-V1059 WeakPolarHBondContact O-CB 3.33Å; F1056-V1059 PolarHBondContact O-N 3.01Å; F1056-F1074 HydrophobicContact CB-CZ 3.93Å; F1056-F1074 AromaticContact CD2-CE1 3.84Å; F1056-F1074 HydrophobicContact CD2-CE1 3.84Å; F1056-F1074 AromaticContact CD2-CZ 3.78Å; F1056-F1074 HydrophobicContact CD2-CZ 3.78Å; F1056-F1074 HydrophobicContact CE2-CE1 4.49Å; F1056-F1074 HydrophobicContact CG-CZ 4.25Å; F1056-A1078 HydrophobicContact CG-CB 4.48Å; F1056-V1082 HydrophobicContact CD1-CG2 4.37Å; F1056-V1082 HydrophobicContact CE1-CG2 3.54Å; F1056-V1082 HydrophobicContact CZ-CG2 4.14Å
1057P78.4Confident81.6Confident111 Ų11179.5 Ų79.572%0.72143%0.428SS*.THydrogen-bonded Turntrans-60.3-23.1-174.7-26.136.2000115.1K1053 V1059K1053-P1057 WeakPolarHBondContact O-CA 3.47Å; P1057-V1059 VanDerWaalsContact C-N 3.3Å
1058T69.1Low81.5Confident122 Ų12275.7 Ų75.775%0.74842%0.417SS*.THydrogen-bonded Turntrans-75.7-10.7174.520.80000114.1F1056 S1060F1056-T1058 PolarHBondContact O-N 3.37Å; F1056-T1058 VanDerWaalsContact O-N 3.08Å; T1058-S1060 PolarHBondContact O-N 3.43Å
1059V78.1Confident81.6Confident9 Ų978.7 Ų78.76%0.05543%0.428CS..  trans-95.992.1-175179.10000111.1F1056 P1057 V1061 F1074 K1077 A1078 C1081F1056-V1059 HydrophobicContact CB-CB 4.04Å; F1056-V1059 HydrophobicContact CB-CG2 3.67Å; F1056-V1059 WeakPolarHBondContact O-CB 3.33Å; F1056-V1059 PolarHBondContact O-N 3.01Å; P1057-V1059 VanDerWaalsContact C-N 3.3Å; V1059-V1061 HydrophobicContact CG1-CG2 4.23Å; V1059-F1074 HydrophobicContact CB-CD2 4.39Å; V1059-F1074 HydrophobicContact CB-CE2 3.83Å; V1059-F1074 HydrophobicContact CB-CZ 4.15Å; V1059-F1074 HydrophobicContact CG1-CD2 3.59Å; V1059-F1074 HydrophobicContact CG1-CE2 3.53Å; V1059-F1074 HydrophobicContact CG1-CG 4.15Å; V1059-F1074 HydrophobicContact CG1-CZ 4.04Å; V1059-K1077 HydrophobicContact CG1-CB 3.63Å; V1059-A1078 HydrophobicContact CG2-CB 4.27Å; V1059-C1081 HydrophobicContact CG2-CB 4.4Å
1060S77.9Confident81.8Confident94 Ų9477.4 Ų77.466%0.65742%0.422SS*.  trans-87.1129.7175.4-179.60000112.7T1058 K1077T1058-S1060 PolarHBondContact O-N 3.43Å; S1060-K1077 WeakPolarHBondContact O-CD 3.25Å; S1060-K1077 PolarHBondContact O-NZ 2.9Å
1061V82.3Confident81.8Confident19 Ų1976.2 Ų76.212%0.11542%0.415CS..  trans-137.3135.6179.3-178.50000109.5V1059 S1063 L1065 W1070 F1074 K1077V1059-V1061 HydrophobicContact CG1-CG2 4.23Å; V1061-S1063 PolarHBondContact O-N 3.02Å; V1061-L1065 HydrophobicContact CG1-CD1 4.3Å; V1061-W1070 HydrophobicContact CG1-CG 4.2Å; V1061-F1074 HydrophobicContact CG2-CB 3.97Å; V1061-F1074 HydrophobicContact CG2-CD2 3.97Å; V1061-F1074 HydrophobicContact CG2-CG 4.44Å; V1061-K1077 HydrophobicContact CG2-CD 4.29Å
1062P78.6Confident81.8Confident71 Ų7180.9 Ų80.946%0.46143%0.428SS..  trans-54.8131.8179.1-26.135.3000113N1064 L1065 W1070P1062-N1064 VanDerWaalsContact C-N 3.33Å; P1062-N1064 VanDerWaalsContact CB-OD1 3.25Å; P1062-N1064 WeakPolarHBondContact CB-OD1 3.48Å; P1062-N1064 PolarHBondContact O-N 3.18Å; P1062-L1065 HydrophobicContact CB-CD1 4.47Å; P1062-W1070 VanDerWaalsContact O-CD1 3.25Å
1063S74.5Confident81.7Confident108 Ų10880.2 Ų80.276%0.75543%0.431SS*.THydrogen-bonded Turntrans-78.9-11-173.445.60000114.8V1061 L1065V1061-S1063 PolarHBondContact O-N 3.02Å; S1063-L1065 VanDerWaalsContact C-N 3.32Å; S1063-L1065 PolarHBondContact O-N 3.1Å
1064N78.5Confident81.9Confident138 Ų13876.3 Ų76.374%0.73841%0.414SS*.THydrogen-bonded Turntrans-85.14.2-178.265.7-48.4000114.6P1062P1062-N1064 VanDerWaalsContact C-N 3.33Å; P1062-N1064 VanDerWaalsContact CB-OD1 3.25Å; P1062-N1064 WeakPolarHBondContact CB-OD1 3.48Å; P1062-N1064 PolarHBondContact O-N 3.18Å
1065L81.1Confident81.9Confident54 Ų5472.5 Ų72.528%0.28340%0.404SS..SBendtrans-87.9146.5179.8-61.4175.1000111.8V1061 P1062 S1063 E1069 W1070V1061-L1065 HydrophobicContact CG1-CD1 4.3Å; P1062-L1065 HydrophobicContact CB-CD1 4.47Å; S1063-L1065 VanDerWaalsContact C-N 3.32Å; S1063-L1065 PolarHBondContact O-N 3.1Å; L1065-E1069 HydrophobicContact CB-CB 4.21Å; L1065-W1070 HydrophobicContact CB-CB 4.12Å
1066N85.1Confident82Confident78 Ų7876.1 Ų76.142%0.41742%0.415SS..  trans-60.8157.8169.974.455.6000110.2S1068 E1069 W1070N1066-S1068 VanDerWaalsContact C-N 3.29Å; N1066-S1068 PolarHBondContact O-N 2.93Å; N1066-S1068 PolarHBondContact OD1-N 3.49Å; N1066-S1068 PolarHBondContact OD1-OG 3.02Å; N1066-E1069 PolarHBondContact ND2-OE1 2.98Å; N1066-E1069 PolarHBondContact ND2-OE2 3.44Å; N1066-E1069 PolarHBondContact O-N 2.86Å; N1066-E1069 PolarHBondContact OD1-N 3.23Å; N1066-W1070 VanDerWaalsContact O-CB 3.29Å; N1066-W1070 WeakPolarHBondContact O-CB 3.3Å; N1066-W1070 PolarHBondContact O-N 3.23Å
1067Y85.7Confident82Confident47 Ų4777.8 Ų77.818%0.18442%0.422CS..Hα-helixtrans-59.6-37.1-170.8-179.8-111.6000113.7E1045 S1048 K1049 W1070 L1071E1045-Y1067 HydrophobicContact CB-CD1 4.25Å; E1045-Y1067 HydrophobicContact CB-CD2 3.62Å; E1045-Y1067 HydrophobicContact CB-CE1 4.47Å; E1045-Y1067 HydrophobicContact CB-CE2 3.91Å; E1045-Y1067 HydrophobicContact CB-CG 3.82Å; E1045-Y1067 HydrophobicContact CG-CD1 3.51Å; E1045-Y1067 HydrophobicContact CG-CD2 3.84Å; E1045-Y1067 HydrophobicContact CG-CE1 3.83Å; E1045-Y1067 HydrophobicContact CG-CE2 4.16Å; E1045-Y1067 HydrophobicContact CG-CG 3.51Å; E1045-Y1067 VanDerWaalsContact O-CE2 3.32Å; E1045-Y1067 WeakPolarHBondContact O-CE2 3.4Å; E1045-Y1067 VanDerWaalsContact OE1-CB 3.31Å; E1045-Y1067 WeakPolarHBondContact OE1-CB 3.17Å; E1045-Y1067 VanDerWaalsContact OE1-CD1 3.29Å; E1045-Y1067 WeakPolarHBondContact OE1-CD1 3.27Å; E1045-Y1067 WeakPolarHBondContact OE2-CB 3.47Å; S1048-Y1067 WeakPolarHBondContact CB-OH 3.31Å; S1048-Y1067 PolarHBondContact OG-OH 3.32Å; K1049-Y1067 HydrophobicContact CD-CD2 4.01Å; K1049-Y1067 HydrophobicContact CG-CD2 4.07Å; K1049-Y1067 HydrophobicContact CG-CE2 4.18Å; Y1067-W1070 PolarHBondContact O-N 2.87Å; Y1067-L1071 HydrophobicContact CD1-CD1 3.93Å; Y1067-L1071 HydrophobicContact CD1-CG 4.45Å; Y1067-L1071 HydrophobicContact CD2-CG 4.31Å; Y1067-L1071 HydrophobicContact CE1-CD1 3.41Å; Y1067-L1071 VanDerWaalsContact CE1-CD1 3.41Å; Y1067-L1071 HydrophobicContact CE1-CG 4.14Å; Y1067-L1071 HydrophobicContact CE2-CD1 4.12Å; Y1067-L1071 HydrophobicContact CE2-CD2 4.18Å; Y1067-L1071 HydrophobicContact CE2-CG 3.97Å; Y1067-L1071 HydrophobicContact CG-CD1 4.49Å; Y1067-L1071 WeakPolarHBondContact O-CB 3.39Å; Y1067-L1071 WeakPolarHBondContact O-CG 3.39Å; Y1067-L1071 PolarHBondContact O-N 2.89Å
1068S85.9Confident81.9Confident62 Ų6273 Ų7343%0.43439%0.392SS..Hα-helixtrans-68.6-36.417982.70000113.5N1066 R1072N1066-S1068 VanDerWaalsContact C-N 3.29Å; N1066-S1068 PolarHBondContact O-N 2.93Å; N1066-S1068 PolarHBondContact OD1-N 3.49Å; N1066-S1068 PolarHBondContact OD1-OG 3.02Å; S1068-R1072 WeakPolarHBondContact O-CB 3.32Å; S1068-R1072 PolarHBondContact O-N 2.87Å
1069E86.1Confident82.1Confident94 Ų9473.6 Ų73.644%0.43938%0.384SS..Hα-helixtrans-75.4-40.7174.6-77.1163.4-156.100111.5L1065 N1066 R1072 G1073L1065-E1069 HydrophobicContact CB-CB 4.21Å; N1066-E1069 PolarHBondContact ND2-OE1 2.98Å; N1066-E1069 PolarHBondContact ND2-OE2 3.44Å; N1066-E1069 PolarHBondContact O-N 2.86Å; N1066-E1069 PolarHBondContact OD1-N 3.23Å; E1069-R1072 PolarHBondContact O-N 2.83Å; E1069-G1073 PolarHBondContact O-N 2.88Å
1070W92.6Very high81.6Confident4 Ų476.8 Ų76.82%0.01541%0.411CS..Hα-helixtrans-60.3-48.6176.2-171.991.7000110.9K1049 L1052 K1053 V1061 P1062 L1065 N1066 Y1067 R1072 G1073 F1074K1049-W1070 HydrophobicContact CB-CH2 4.21Å; K1049-W1070 HydrophobicContact CB-CZ2 4.5Å; K1049-W1070 HydrophobicContact CB-CZ3 4.23Å; K1049-W1070 HydrophobicContact CD-CD2 4.3Å; K1049-W1070 HydrophobicContact CD-CE3 4.44Å; K1049-W1070 VanDerWaalsContact CE-CG 3.5Å; K1049-W1070 HydrophobicContact CG-CD2 3.71Å; K1049-W1070 HydrophobicContact CG-CE3 3.5Å; K1049-W1070 VanDerWaalsContact CG-CE3 3.5Å; K1049-W1070 HydrophobicContact CG-CG 4.42Å; K1049-W1070 HydrophobicContact CG-CH2 3.97Å; K1049-W1070 HydrophobicContact CG-CZ2 4.16Å; K1049-W1070 HydrophobicContact CG-CZ3 3.64Å; K1049-W1070 WeakPolarHBondContact O-CH2 3.47Å; L1052-W1070 HydrophobicContact CB-CH2 4.14Å; L1052-W1070 HydrophobicContact CB-CZ3 4.29Å; L1052-W1070 HydrophobicContact CD1-CZ3 3.98Å; K1053-W1070 HydrophobicContact CG-CH2 4.36Å; K1053-W1070 HydrophobicContact CG-CZ2 4.16Å; V1061-W1070 HydrophobicContact CG1-CG 4.2Å; P1062-W1070 VanDerWaalsContact O-CD1 3.25Å; L1065-W1070 HydrophobicContact CB-CB 4.12Å; N1066-W1070 VanDerWaalsContact O-CB 3.29Å; N1066-W1070 WeakPolarHBondContact O-CB 3.3Å; N1066-W1070 PolarHBondContact O-N 3.23Å; Y1067-W1070 PolarHBondContact O-N 2.87Å; W1070-R1072 PolarHBondContact O-N 3.39Å; W1070-G1073 PolarHBondContact O-N 2.86Å; W1070-F1074 HydrophobicContact CE3-CB 4.24Å; W1070-F1074 HydrophobicContact CH2-CB 4.27Å; W1070-F1074 AromaticContact CH2-CD2 3.48Å; W1070-F1074 HydrophobicContact CH2-CD2 3.48Å; W1070-F1074 VanDerWaalsContact CH2-CD2 3.48Å; W1070-F1074 HydrophobicContact CH2-CE2 4.02Å; W1070-F1074 AromaticContact CH2-CG 3.95Å; W1070-F1074 HydrophobicContact CH2-CG 3.95Å; W1070-F1074 AromaticContact CZ2-CD2 3.86Å; W1070-F1074 HydrophobicContact CZ2-CD2 3.86Å; W1070-F1074 HydrophobicContact CZ3-CB 4.03Å; W1070-F1074 HydrophobicContact CZ3-CD2 4.05Å; W1070-F1074 HydrophobicContact CZ3-CG 4.02Å; W1070-F1074 VanDerWaalsContact O-CB 3.25Å; W1070-F1074 WeakPolarHBondContact O-CB 3.23Å; W1070-F1074 PolarHBondContact O-N 3.07Å
1071L86.8Confident81Confident55 Ų5575 Ų7529%0.28840%0.398SS..Hα-helixtrans-58-46.6175.1-81.3-179.3000111.7L1052 Y1067 G1073 F1074 E1075L1052-L1071 HydrophobicContact CD1-CD2 3.45Å; L1052-L1071 VanDerWaalsContact CD1-CD2 3.45Å; Y1067-L1071 HydrophobicContact CD1-CD1 3.93Å; Y1067-L1071 HydrophobicContact CD1-CG 4.45Å; Y1067-L1071 HydrophobicContact CD2-CG 4.31Å; Y1067-L1071 HydrophobicContact CE1-CD1 3.41Å; Y1067-L1071 VanDerWaalsContact CE1-CD1 3.41Å; Y1067-L1071 HydrophobicContact CE1-CG 4.14Å; Y1067-L1071 HydrophobicContact CE2-CD1 4.12Å; Y1067-L1071 HydrophobicContact CE2-CD2 4.18Å; Y1067-L1071 HydrophobicContact CE2-CG 3.97Å; Y1067-L1071 HydrophobicContact CG-CD1 4.49Å; Y1067-L1071 WeakPolarHBondContact O-CB 3.39Å; Y1067-L1071 WeakPolarHBondContact O-CG 3.39Å; Y1067-L1071 PolarHBondContact O-N 2.89Å; L1071-G1073 PolarHBondContact O-N 3.28Å; L1071-F1074 WeakPolarHBondContact O-CB 3.27Å; L1071-F1074 PolarHBondContact O-N 3.48Å; L1071-E1075 VanDerWaalsContact O-CB 3.29Å; L1071-E1075 WeakPolarHBondContact O-CB 3.43Å; L1071-E1075 PolarHBondContact O-N 2.93Å
1072R85Confident79.9Confident169 Ų16978 Ų7864%0.63842%0.416SS*.Hα-helixtrans-65.7-38.2-179-158.6-176-47.6-1565.6112.3S1068 E1069 W1070 K1076S1068-R1072 WeakPolarHBondContact O-CB 3.32Å; S1068-R1072 PolarHBondContact O-N 2.87Å; E1069-R1072 PolarHBondContact O-N 2.83Å; W1070-R1072 PolarHBondContact O-N 3.39Å; R1072-K1076 WeakPolarHBondContact O-CB 3.46Å; R1072-K1076 PolarHBondContact O-N 3.24Å
1073G83.3Confident78.7Confident26 Ų2679 Ų7927%0.26843%0.43SS..Hα-helixtrans-68.4-36.2172.800000112.9E1069 W1070 L1071 K1077E1069-G1073 PolarHBondContact O-N 2.88Å; W1070-G1073 PolarHBondContact O-N 2.86Å; L1071-G1073 PolarHBondContact O-N 3.28Å; G1073-K1077 PolarHBondContact O-N 3.35Å
1074F87.1Confident77.9Confident7 Ų776.9 Ų76.93%0.03143%0.426CS..Hα-helixtrans-68.3-52.6174.9-172.8-85.3000111.5L1052 F1056 V1059 V1061 W1070 L1071 K1076 K1077 A1078L1052-F1074 HydrophobicContact CB-CD1 4.3Å; L1052-F1074 HydrophobicContact CB-CE1 3.79Å; L1052-F1074 HydrophobicContact CB-CE2 4.17Å; L1052-F1074 HydrophobicContact CB-CZ 3.72Å; L1052-F1074 HydrophobicContact CD1-CD1 4.43Å; L1052-F1074 HydrophobicContact CD2-CD1 4.46Å; L1052-F1074 HydrophobicContact CD2-CE1 3.92Å; L1052-F1074 HydrophobicContact CG-CE1 4.3Å; L1052-F1074 VanDerWaalsContact O-CZ 3.28Å; L1052-F1074 WeakPolarHBondContact O-CZ 3.31Å; F1056-F1074 HydrophobicContact CB-CZ 3.93Å; F1056-F1074 AromaticContact CD2-CE1 3.84Å; F1056-F1074 HydrophobicContact CD2-CE1 3.84Å; F1056-F1074 AromaticContact CD2-CZ 3.78Å; F1056-F1074 HydrophobicContact CD2-CZ 3.78Å; F1056-F1074 HydrophobicContact CE2-CE1 4.49Å; F1056-F1074 HydrophobicContact CG-CZ 4.25Å; V1059-F1074 HydrophobicContact CB-CD2 4.39Å; V1059-F1074 HydrophobicContact CB-CE2 3.83Å; V1059-F1074 HydrophobicContact CB-CZ 4.15Å; V1059-F1074 HydrophobicContact CG1-CD2 3.59Å; V1059-F1074 HydrophobicContact CG1-CE2 3.53Å; V1059-F1074 HydrophobicContact CG1-CG 4.15Å; V1059-F1074 HydrophobicContact CG1-CZ 4.04Å; V1061-F1074 HydrophobicContact CG2-CB 3.97Å; V1061-F1074 HydrophobicContact CG2-CD2 3.97Å; V1061-F1074 HydrophobicContact CG2-CG 4.44Å; W1070-F1074 HydrophobicContact CE3-CB 4.24Å; W1070-F1074 HydrophobicContact CH2-CB 4.27Å; W1070-F1074 AromaticContact CH2-CD2 3.48Å; W1070-F1074 HydrophobicContact CH2-CD2 3.48Å; W1070-F1074 VanDerWaalsContact CH2-CD2 3.48Å; W1070-F1074 HydrophobicContact CH2-CE2 4.02Å; W1070-F1074 AromaticContact CH2-CG 3.95Å; W1070-F1074 HydrophobicContact CH2-CG 3.95Å; W1070-F1074 AromaticContact CZ2-CD2 3.86Å; W1070-F1074 HydrophobicContact CZ2-CD2 3.86Å; W1070-F1074 HydrophobicContact CZ3-CB 4.03Å; W1070-F1074 HydrophobicContact CZ3-CD2 4.05Å; W1070-F1074 HydrophobicContact CZ3-CG 4.02Å; W1070-F1074 VanDerWaalsContact O-CB 3.25Å; W1070-F1074 WeakPolarHBondContact O-CB 3.23Å; W1070-F1074 PolarHBondContact O-N 3.07Å; L1071-F1074 WeakPolarHBondContact O-CB 3.27Å; L1071-F1074 PolarHBondContact O-N 3.48Å; F1074-K1076 VanDerWaalsContact C-N 3.32Å; F1074-K1076 PolarHBondContact O-N 2.91Å; F1074-K1077 CarbonylContact O-C 3.53Å; F1074-K1077 PolarHBondContact O-N 3.49Å; F1074-A1078 HydrophobicContact CD1-CB 4.17Å; F1074-A1078 HydrophobicContact CE1-CB 3.89Å; F1074-A1078 WeakPolarHBondContact O-CB 3.36Å; F1074-A1078 PolarHBondContact O-N 3.25Å
1075E83.9Confident76.4Confident93 Ų9376.2 Ų76.244%0.43543%0.427SS..Hα-helixtrans-52.2-48.2177.6-172.6-156.4163.400111.5L1071 K1077 A1078 K1079L1071-E1075 VanDerWaalsContact O-CB 3.29Å; L1071-E1075 WeakPolarHBondContact O-CB 3.43Å; L1071-E1075 PolarHBondContact O-N 2.93Å; E1075-K1077 VanDerWaalsContact C-N 3.27Å; E1075-K1077 PolarHBondContact O-N 3.32Å; E1075-A1078 PolarHBondContact O-N 2.94Å; E1075-K1079 HydrophobicContact CG-CD 4.17Å; E1075-K1079 WeakPolarHBondContact O-CB 3.22Å; E1075-K1079 WeakPolarHBondContact O-CG 3.47Å; E1075-K1079 PolarHBondContact O-N 3.32Å; E1075-K1079 VanDerWaalsContact OE1-CE 3.29Å; E1075-K1079 WeakPolarHBondContact OE1-CE 3.45Å; E1075-K1079 IonicContact OE1-NZ 2.65Å; E1075-K1079 PolarHBondContact OE1-NZ 2.84Å
1076K83.3Confident74.6Confident172 Ų17279.5 Ų79.575%0.74845%0.454SS*.Hα-helixtrans-61.1-33.2179.4-172173.3-178177.30113R1072 F1074R1072-K1076 WeakPolarHBondContact O-CB 3.46Å; R1072-K1076 PolarHBondContact O-N 3.24Å; F1074-K1076 VanDerWaalsContact C-N 3.32Å; F1074-K1076 PolarHBondContact O-N 2.91Å
1077K79.8Confident72.9Confident101 Ų10181.7 Ų81.744%0.43947%0.466SS..Hα-helixtrans-84.7-40.2176.7-69.5-172.4-174.4-168.90112.6V1059 S1060 V1061 G1073 F1074 E1075 K1079 A1080 C1081V1059-K1077 HydrophobicContact CG1-CB 3.63Å; S1060-K1077 WeakPolarHBondContact O-CD 3.25Å; S1060-K1077 PolarHBondContact O-NZ 2.9Å; V1061-K1077 HydrophobicContact CG2-CD 4.29Å; G1073-K1077 PolarHBondContact O-N 3.35Å; F1074-K1077 CarbonylContact O-C 3.53Å; F1074-K1077 PolarHBondContact O-N 3.49Å; E1075-K1077 VanDerWaalsContact C-N 3.27Å; E1075-K1077 PolarHBondContact O-N 3.32Å; K1077-K1079 VanDerWaalsContact C-N 3.34Å; K1077-K1079 PolarHBondContact O-N 3.45Å; K1077-A1080 WeakPolarHBondContact O-CB 3.19Å; K1077-A1080 PolarHBondContact O-N 2.85Å; K1077-C1081 PolarHBondContact O-N 2.8Å
1078A76.3Confident71.3Confident9 Ų982.4 Ų82.47%0.07448%0.482CS..Hα-helixtrans-61.8-40.7176.200000111.5F1056 V1059 F1074 E1075 A1080 C1081 V1082F1056-A1078 HydrophobicContact CG-CB 4.48Å; V1059-A1078 HydrophobicContact CG2-CB 4.27Å; F1074-A1078 HydrophobicContact CD1-CB 4.17Å; F1074-A1078 HydrophobicContact CE1-CB 3.89Å; F1074-A1078 WeakPolarHBondContact O-CB 3.36Å; F1074-A1078 PolarHBondContact O-N 3.25Å; E1075-A1078 PolarHBondContact O-N 2.94Å; A1078-A1080 PolarHBondContact O-N 3.43Å; A1078-C1081 PolarHBondContact O-N 2.83Å; A1078-V1082 WeakPolarHBondContact O-CG2 3.44Å; A1078-V1082 PolarHBondContact O-N 3.29Å
1079K72.8Confident69.6Low136 Ų13685.1 Ų85.159%0.59149%0.488SS*.Hα-helixtrans-58.4-32.1172.2-78.4177.5169.2175.60113.2E1075 K1077E1075-K1079 HydrophobicContact CG-CD 4.17Å; E1075-K1079 WeakPolarHBondContact O-CB 3.22Å; E1075-K1079 WeakPolarHBondContact O-CG 3.47Å; E1075-K1079 PolarHBondContact O-N 3.32Å; E1075-K1079 VanDerWaalsContact OE1-CE 3.29Å; E1075-K1079 WeakPolarHBondContact OE1-CE 3.45Å; E1075-K1079 IonicContact OE1-NZ 2.65Å; E1075-K1079 PolarHBondContact OE1-NZ 2.84Å; K1077-K1079 VanDerWaalsContact C-N 3.34Å; K1077-K1079 PolarHBondContact O-N 3.45Å
1080A68.3Low68.3Low76 Ų7683.3 Ų83.363%0.62849%0.489SS*.Hα-helixtrans-74.7-29.7174.300000113K1077 A1078K1077-A1080 WeakPolarHBondContact O-CB 3.19Å; K1077-A1080 PolarHBondContact O-N 2.85Å; A1078-A1080 PolarHBondContact O-N 3.43Å
1081C63.6Low66.8Low56 Ų5686.4 Ų86.438%0.37851%0.508SS..Hα-helixtrans-79.5-39.7175.1-64.30000113.1V1059 K1077 A1078 A1083 G1084V1059-C1081 HydrophobicContact CG2-CB 4.4Å; K1077-C1081 PolarHBondContact O-N 2.8Å; A1078-C1081 PolarHBondContact O-N 2.83Å; C1081-A1083 PolarHBondContact O-N 3.36Å; C1081-G1084 PolarHBondContact O-N 2.89Å
1082V60.4Low65.7Low81 Ų8188.9 Ų88.949%0.49152%0.517SS..Hα-helixtrans-65.1-23.6-178170.20000112.5F1056 A1078 G1084F1056-V1082 HydrophobicContact CD1-CG2 4.37Å; F1056-V1082 HydrophobicContact CE1-CG2 3.54Å; F1056-V1082 HydrophobicContact CZ-CG2 4.14Å; A1078-V1082 WeakPolarHBondContact O-CG2 3.44Å; A1078-V1082 PolarHBondContact O-N 3.29Å; V1082-G1084 PolarHBondContact O-N 3.41Å
1083A53.8Low64.9Low92 Ų9285.4 Ų85.476%0.7651%0.514SS*.THydrogen-bonded Turntrans-61.7-7.5174.600000115C1081C1081-A1083 PolarHBondContact O-N 3.36Å
1084G55.8Low64.4Low65 Ų6589.8 Ų89.867%0.6753%0.531SS*.THydrogen-bonded Turntrans-103.6-14.7-174.500000117.5C1081 V1082C1081-G1084 PolarHBondContact O-N 2.89Å; V1082-G1084 PolarHBondContact O-N 3.41Å
1085T48.3Very low63.4Low123 Ų12395 Ų9576%0.75556%0.555SS**  trans-146126.9-17053.10000113.3
1086S42.9Very low62.8Low123 Ų12396.1 Ų96.186%0.8656%0.56SS**  trans-125.5123.9167-176.60000108.8
1087D49.1Very low62.5Low125 Ų12596.4 Ų96.467%0.66856%0.556SS**  trans-131.7118.5174.7-172.7-3.4000108.9
1088A51.7Low62.3Low62 Ų6297.5 Ų97.551%0.51257%0.566SS.*Hα-helixtrans-81.7-18.2-159.900000114.2
1089E51.6Low62.5Low118 Ų118103 Ų10355%0.55159%0.589SS**Hα-helixtrans-81.6-28.4-173.8-143.559.7-150.300112.5V1091 K1092E1089-V1091 VanDerWaalsContact C-N 3.32Å; E1089-K1092 IonicContact OE1-NZ 2.63Å; E1089-K1092 PolarHBondContact OE1-NZ 3.45Å; E1089-K1092 IonicContact OE2-NZ 2.61Å; E1089-K1092 PolarHBondContact OE2-NZ 2.78Å
1090A58.5Low62.8Low57 Ų57101.3 Ų101.347%0.47158%0.583SS.*Hα-helixtrans-67.5-32.5171.900000112.4K1092 V1093 L1094A1090-K1092 PolarHBondContact O-N 2.83Å; A1090-V1093 PolarHBondContact O-N 2.69Å; A1090-L1094 WeakPolarHBondContact O-CG 3.37Å; A1090-L1094 PolarHBondContact O-N 3.25Å
1091V60.5Low63.2Low68 Ų68100 Ų10041%0.41257%0.572SS.*Hα-helixtrans-60.4-47.9-178.7-178.40000110.9E1089 V1093 L1094 E1095E1089-V1091 VanDerWaalsContact C-N 3.32Å; V1091-V1093 VanDerWaalsContact C-N 3.3Å; V1091-V1093 PolarHBondContact O-N 3.44Å; V1091-L1094 CarbonylContact O-C 3.6Å; V1091-L1094 WeakPolarHBondContact O-CA 3.46Å; V1091-L1094 WeakPolarHBondContact O-CB 3.43Å; V1091-L1094 PolarHBondContact O-N 2.93Å; V1091-E1095 HydrophobicContact CG1-CG 4.2Å; V1091-E1095 WeakPolarHBondContact O-CG 3.43Å; V1091-E1095 PolarHBondContact O-N 3.48Å
1092K64.4Low63.8Low108 Ų108100 Ų10047%0.4757%0.573SS.*Hα-helixtrans-60-36.4-178.2-58171.8-165.7163.90113.5E1089 A1090 E1095 H1096E1089-K1092 IonicContact OE1-NZ 2.63Å; E1089-K1092 PolarHBondContact OE1-NZ 3.45Å; E1089-K1092 IonicContact OE2-NZ 2.61Å; E1089-K1092 PolarHBondContact OE2-NZ 2.78Å; A1090-K1092 PolarHBondContact O-N 2.83Å; K1092-E1095 WeakPolarHBondContact CA-OE2 3.32Å; K1092-H1096 PolarHBondContact O-N 3.14Å; K1092-H1096 VanDerWaalsContact O-N 3.11Å
1093V68.7Low65.1Low95 Ų95101 Ų10158%0.57657%0.572SS**Hα-helixtrans-72.5-35.1177.8-179.40000110.9A1090 V1091 R1097A1090-V1093 PolarHBondContact O-N 2.69Å; V1091-V1093 VanDerWaalsContact C-N 3.3Å; V1091-V1093 PolarHBondContact O-N 3.44Å; V1093-R1097 PolarHBondContact O-N 3.14Å
1094L71.1Confident66.6Low119 Ų119102.2 Ų102.262%0.62356%0.563SS**Hα-helixtrans-71-38.5172.9-67.9170.3000111.8A1090 V1091 R1097 L1098A1090-L1094 WeakPolarHBondContact O-CG 3.37Å; A1090-L1094 PolarHBondContact O-N 3.25Å; V1091-L1094 CarbonylContact O-C 3.6Å; V1091-L1094 WeakPolarHBondContact O-CA 3.46Å; V1091-L1094 WeakPolarHBondContact O-CB 3.43Å; V1091-L1094 PolarHBondContact O-N 2.93Å; L1094-R1097 PolarHBondContact O-N 3.34Å; L1094-L1098 WeakPolarHBondContact O-CB 3.37Å; L1094-L1098 PolarHBondContact O-N 2.87Å
1095E67.3Low68Low115 Ų115104.7 Ų104.754%0.53756%0.557SS.*Hα-helixtrans-60.4-44.1173.9-73174.3142.300112V1091 K1092 L1098 K1099V1091-E1095 HydrophobicContact CG1-CG 4.2Å; V1091-E1095 WeakPolarHBondContact O-CG 3.43Å; V1091-E1095 PolarHBondContact O-N 3.48Å; K1092-E1095 WeakPolarHBondContact CA-OE2 3.32Å; E1095-L1098 PolarHBondContact O-N 2.82Å; E1095-K1099 PolarHBondContact O-N 3.06Å
1096H72Confident70Confident117 Ų117103 Ų10354%0.54255%0.547SS..Hα-helixtrans-60.9-48.7175.6-168.4-74.1000111.6K1092 L1098 K1099 E1100K1092-H1096 PolarHBondContact O-N 3.14Å; K1092-H1096 VanDerWaalsContact O-N 3.11Å; H1096-L1098 VanDerWaalsContact C-N 3.34Å; H1096-L1098 PolarHBondContact O-N 3Å; H1096-K1099 WeakPolarHBondContact O-CB 3.43Å; H1096-K1099 PolarHBondContact O-N 3.36Å; H1096-K1099 VanDerWaalsContact O-N 3.15Å; H1096-E1100 IonicContact CE1-OE1 2.65Å; H1096-E1100 PolarHBondContact CE1-OE1 3.5Å; H1096-E1100 IonicContact CE1-OE2 2.67Å; H1096-E1100 PolarHBondContact CE1-OE2 3.48Å; H1096-E1100 IonicContact ND1-OE1 3.46Å; H1096-E1100 IonicContact ND1-OE2 3.9Å; H1096-E1100 PolarHBondContact ND1-OE2 3.45Å; H1096-E1100 PolarHBondContact O-N 3.1Å
1097R76.3Confident72.3Confident179 Ų179102.8 Ų102.868%0.67554%0.536SS*.Hα-helixtrans-66.3-34178.2-82.8-173.6157-143.2-7.2113.3V1093 L1094 K1099 A1101V1093-R1097 PolarHBondContact O-N 3.14Å; L1094-R1097 PolarHBondContact O-N 3.34Å; R1097-K1099 VanDerWaalsContact C-N 3.3Å; R1097-A1101 VanDerWaalsContact O-CB 3.22Å; R1097-A1101 WeakPolarHBondContact O-CB 3.25Å; R1097-A1101 PolarHBondContact O-N 3.03Å
1098L75.4Confident74.3Confident124 Ų124101.3 Ų101.365%0.64953%0.527SS*.Hα-helixtrans-64.7-37.6173.4-178.263.3000110.6L1094 E1095 H1096 S1102L1094-L1098 WeakPolarHBondContact O-CB 3.37Å; L1094-L1098 PolarHBondContact O-N 2.87Å; E1095-L1098 PolarHBondContact O-N 2.82Å; H1096-L1098 VanDerWaalsContact C-N 3.34Å; H1096-L1098 PolarHBondContact O-N 3Å; L1098-S1102 WeakPolarHBondContact O-CB 3.48Å; L1098-S1102 PolarHBondContact O-N 3.34Å; L1098-S1102 PolarHBondContact O-OG 2.96Å
1099K80.6Confident76.1Confident125 Ų125102.5 Ų102.554%0.54352%0.522SS..Hα-helixtrans-67.9-49.1175.1-162.4-179.4-174.3-104.70112E1095 H1096 R1097 A1101 S1102 E1103E1095-K1099 PolarHBondContact O-N 3.06Å; H1096-K1099 WeakPolarHBondContact O-CB 3.43Å; H1096-K1099 PolarHBondContact O-N 3.36Å; H1096-K1099 VanDerWaalsContact O-N 3.15Å; R1097-K1099 VanDerWaalsContact C-N 3.3Å; K1099-A1101 VanDerWaalsContact C-N 3.27Å; K1099-A1101 PolarHBondContact O-N 3.49Å; K1099-S1102 WeakPolarHBondContact CA-OG 3.47Å; K1099-S1102 PolarHBondContact O-N 3.13Å; K1099-S1102 VanDerWaalsContact O-N 3.08Å; K1099-S1102 PolarHBondContact O-OG 3.21Å; K1099-E1103 VanDerWaalsContact CE-OE1 3.29Å; K1099-E1103 WeakPolarHBondContact CE-OE1 3.35Å; K1099-E1103 IonicContact NZ-OE1 2.71Å; K1099-E1103 PolarHBondContact NZ-OE1 2.98Å; K1099-E1103 WeakPolarHBondContact O-CG 3.5Å; K1099-E1103 PolarHBondContact O-N 3.49Å
1100E79.3Confident78Confident100 Ų100102.8 Ų102.847%0.46753%0.526SS..Hα-helixtrans-56.6-41.9174.4-69.5170.3123.300111.4H1096 M1104H1096-E1100 IonicContact CE1-OE1 2.65Å; H1096-E1100 PolarHBondContact CE1-OE1 3.5Å; H1096-E1100 IonicContact CE1-OE2 2.67Å; H1096-E1100 PolarHBondContact CE1-OE2 3.48Å; H1096-E1100 IonicContact ND1-OE1 3.46Å; H1096-E1100 IonicContact ND1-OE2 3.9Å; H1096-E1100 PolarHBondContact ND1-OE2 3.45Å; H1096-E1100 PolarHBondContact O-N 3.1Å; E1100-M1104 WeakPolarHBondContact O-CB 3.41Å; E1100-M1104 PolarHBondContact O-N 3.34Å
1101A76.3Confident79.4Confident48 Ų48104.3 Ų104.340%0.39752%0.524SS..Hα-helixtrans-67.3-37.6175.200000112.9R1097 K1099 H1105R1097-A1101 VanDerWaalsContact O-CB 3.22Å; R1097-A1101 WeakPolarHBondContact O-CB 3.25Å; R1097-A1101 PolarHBondContact O-N 3.03Å; K1099-A1101 VanDerWaalsContact C-N 3.27Å; K1099-A1101 PolarHBondContact O-N 3.49Å; A1101-H1105 VanDerWaalsContact O-CB 3.31Å; A1101-H1105 WeakPolarHBondContact O-CB 3.43Å; A1101-H1105 PolarHBondContact O-N 3.17Å
1102S77.1Confident80.9Confident57 Ų57104.1 Ų104.140%0.39953%0.525SS..Hα-helixtrans-70.6-37.1176.369.20000112.9L1098 K1099 H1105 T1106L1098-S1102 WeakPolarHBondContact O-CB 3.48Å; L1098-S1102 PolarHBondContact O-N 3.34Å; L1098-S1102 PolarHBondContact O-OG 2.96Å; K1099-S1102 WeakPolarHBondContact CA-OG 3.47Å; K1099-S1102 PolarHBondContact O-N 3.13Å; K1099-S1102 VanDerWaalsContact O-N 3.08Å; K1099-S1102 PolarHBondContact O-OG 3.21Å; S1102-H1105 PolarHBondContact O-N 2.98Å; S1102-T1106 WeakPolarHBondContact O-CG2 3.47Å; S1102-T1106 PolarHBondContact O-N 2.83Å; S1102-T1106 PolarHBondContact O-OG1 3.4Å
1103E86.7Confident82.3Confident100 Ų100102.6 Ų102.647%0.46752%0.519SS..Hα-helixtrans-67.9-37.8175.4-71.5174.4-172.400110.8K1099 T1106 L1107K1099-E1103 VanDerWaalsContact CE-OE1 3.29Å; K1099-E1103 WeakPolarHBondContact CE-OE1 3.35Å; K1099-E1103 IonicContact NZ-OE1 2.71Å; K1099-E1103 PolarHBondContact NZ-OE1 2.98Å; K1099-E1103 WeakPolarHBondContact O-CG 3.5Å; K1099-E1103 PolarHBondContact O-N 3.49Å; E1103-T1106 PolarHBondContact O-OG1 3.04Å; E1103-L1107 PolarHBondContact O-N 3.16Å
1104M85Confident83.4Confident119 Ų119105.2 Ų105.259%0.58652%0.523SS*.Hα-helixtrans-68.4-37171.4-170.9172.965.700112.4E1100 L1107 L1108E1100-M1104 WeakPolarHBondContact O-CB 3.41Å; E1100-M1104 PolarHBondContact O-N 3.34Å; M1104-L1107 PolarHBondContact O-N 3.36Å; M1104-L1108 HydrophobicContact CG-CD1 4.28Å; M1104-L1108 PolarHBondContact O-N 3.34Å
1105H86Confident84.6Confident117 Ų117106 Ų10654%0.54252%0.518SS..Hα-helixtrans-65.6-39.8175.2-173.6-47.4000111.9A1101 S1102 L1107 L1108 Q1109A1101-H1105 VanDerWaalsContact O-CB 3.31Å; A1101-H1105 WeakPolarHBondContact O-CB 3.43Å; A1101-H1105 PolarHBondContact O-N 3.17Å; S1102-H1105 PolarHBondContact O-N 2.98Å; H1105-L1107 VanDerWaalsContact C-N 3.33Å; H1105-L1108 PolarHBondContact O-N 2.94Å; H1105-Q1109 PolarHBondContact CE1-OE1 2.57Å; H1105-Q1109 VanDerWaalsContact O-CB 3.31Å; H1105-Q1109 WeakPolarHBondContact O-CB 3.44Å; H1105-Q1109 PolarHBondContact O-N 3.12Å
1106T90.9Very high86Confident87 Ų87105.9 Ų105.953%0.53452%0.516SS..Hα-helixtrans-68.3-33.2177.153.40000112.2S1102 E1103 Q1109 L1110S1102-T1106 WeakPolarHBondContact O-CG2 3.47Å; S1102-T1106 PolarHBondContact O-N 2.83Å; S1102-T1106 PolarHBondContact O-OG1 3.4Å; E1103-T1106 PolarHBondContact O-OG1 3.04Å; T1106-Q1109 PolarHBondContact O-N 2.88Å; T1106-L1110 PolarHBondContact O-N 3Å
1107L89.4Confident87Confident119 Ų119104 Ų10462%0.62352%0.517SS*.Hα-helixtrans-67.6-45.6173.4-169.667.5000112.1E1103 M1104 H1105 Q1109 L1110 E1111E1103-L1107 PolarHBondContact O-N 3.16Å; M1104-L1107 PolarHBondContact O-N 3.36Å; H1105-L1107 VanDerWaalsContact C-N 3.33Å; L1107-Q1109 VanDerWaalsContact C-N 3.32Å; L1107-Q1109 PolarHBondContact O-N 2.88Å; L1107-L1110 WeakPolarHBondContact O-CB 3.18Å; L1107-L1110 PolarHBondContact O-N 2.92Å; L1107-E1111 PolarHBondContact O-N 3.11Å
1108L91.5Very high88Confident93 Ų9399 Ų9949%0.48751%0.506SS..Hα-helixtrans-63.5-36.8173.9-83.2161.7000112.2M1104 H1105 E1111 C1112M1104-L1108 HydrophobicContact CG-CD1 4.28Å; M1104-L1108 PolarHBondContact O-N 3.34Å; H1105-L1108 PolarHBondContact O-N 2.94Å; L1108-E1111 PolarHBondContact O-N 2.69Å; L1108-C1112 WeakPolarHBondContact O-CB 3.24Å; L1108-C1112 PolarHBondContact O-N 3.29Å; L1108-C1112 PolarHBondContact O-SG 3.33Å
1109Q89.6Confident88.8Confident87 Ų8798.5 Ų98.541%0.40750%0.503SS..Hα-helixtrans-60.1-48.1172.9-168.379.640.700110.6H1105 T1106 L1107 E1111 C1112 E1113H1105-Q1109 PolarHBondContact CE1-OE1 2.57Å; H1105-Q1109 VanDerWaalsContact O-CB 3.31Å; H1105-Q1109 WeakPolarHBondContact O-CB 3.44Å; H1105-Q1109 PolarHBondContact O-N 3.12Å; T1106-Q1109 PolarHBondContact O-N 2.88Å; L1107-Q1109 VanDerWaalsContact C-N 3.32Å; L1107-Q1109 PolarHBondContact O-N 2.88Å; Q1109-E1111 VanDerWaalsContact C-N 3.33Å; Q1109-E1111 PolarHBondContact O-N 2.88Å; Q1109-C1112 WeakPolarHBondContact O-CB 3.49Å; Q1109-C1112 PolarHBondContact O-N 3.41Å; Q1109-E1113 PolarHBondContact NE2-OE1 2.97Å; Q1109-E1113 WeakPolarHBondContact O-CG 3.29Å; Q1109-E1113 PolarHBondContact O-N 3Å
1110L92.4Very high89.4Confident124 Ų12495.3 Ų95.365%0.64950%0.5SS*.Hα-helixtrans-59.4-40.1176.5-89.8160.3000112.8T1106 L1107 K1114T1106-L1110 PolarHBondContact O-N 3Å; L1107-L1110 WeakPolarHBondContact O-CB 3.18Å; L1107-L1110 PolarHBondContact O-N 2.92Å; L1110-K1114 WeakPolarHBondContact O-CB 3.47Å; L1110-K1114 PolarHBondContact O-N 3.24Å
1111E87.8Confident89.9Confident90 Ų9096.6 Ų96.642%0.42151%0.506SS..Hα-helixtrans-67.1-42175.3-145.5-169.7150.400111.5L1107 L1108 Q1109 K1114 Y1115L1107-E1111 PolarHBondContact O-N 3.11Å; L1108-E1111 PolarHBondContact O-N 2.69Å; Q1109-E1111 VanDerWaalsContact C-N 3.33Å; Q1109-E1111 PolarHBondContact O-N 2.88Å; E1111-K1114 WeakPolarHBondContact O-CB 3.34Å; E1111-K1114 PolarHBondContact O-N 3.39Å; E1111-Y1115 HydrophobicContact CB-CE2 4.37Å; E1111-Y1115 HydrophobicContact CG-CD2 4.26Å; E1111-Y1115 HydrophobicContact CG-CE2 3.58Å; E1111-Y1115 WeakPolarHBondContact O-CD2 3.36Å; E1111-Y1115 PolarHBondContact O-N 3.42Å; E1111-Y1115 WeakPolarHBondContact OE1-CE2 3.47Å; E1111-Y1115 VanDerWaalsContact OE1-CZ 3.29Å; E1111-Y1115 PolarHBondContact OE1-OH 2.93Å
1112C92.1Very high90.8Very high63 Ų6397.4 Ų97.443%0.42651%0.506SS..Hα-helixtrans-61.5-44.2174.2-73.40000113L1108 Q1109 K1114 Y1115 K1116L1108-C1112 WeakPolarHBondContact O-CB 3.24Å; L1108-C1112 PolarHBondContact O-N 3.29Å; L1108-C1112 PolarHBondContact O-SG 3.33Å; Q1109-C1112 WeakPolarHBondContact O-CB 3.49Å; Q1109-C1112 PolarHBondContact O-N 3.41Å; C1112-K1114 VanDerWaalsContact C-N 3.3Å; C1112-K1114 PolarHBondContact O-N 2.89Å; C1112-Y1115 PolarHBondContact O-N 3.16Å; C1112-K1116 WeakPolarHBondContact O-CG 3.2Å; C1112-K1116 PolarHBondContact O-N 3.43Å
1113E92.3Very high91.6Very high77 Ų77100 Ų10036%0.3651%0.512SS..Hα-helixtrans-64.2-35.8174.6-59.9-42.3133.100111.5Q1109 K1116 S1117Q1109-E1113 PolarHBondContact NE2-OE1 2.97Å; Q1109-E1113 WeakPolarHBondContact O-CG 3.29Å; Q1109-E1113 PolarHBondContact O-N 3Å; E1113-K1116 PolarHBondContact O-N 3.45Å; E1113-K1116 IonicContact OE1-NZ 2.62Å; E1113-K1116 PolarHBondContact OE1-NZ 2.72Å; E1113-K1116 WeakPolarHBondContact OE2-CD 3.29Å; E1113-K1116 IonicContact OE2-NZ 2.7Å; E1113-K1116 PolarHBondContact OE2-NZ 2.93Å; E1113-S1117 WeakPolarHBondContact O-CB 3.17Å; E1113-S1117 PolarHBondContact O-N 3.26Å
1114K92.6Very high92.1Very high149 Ų14996.3 Ų96.365%0.64850%0.501SS*.Hα-helixtrans-64.4-44.2173.3-171.2-179.1178.9-175.30112.1L1110 E1111 C1112 S1117 V1118L1110-K1114 WeakPolarHBondContact O-CB 3.47Å; L1110-K1114 PolarHBondContact O-N 3.24Å; E1111-K1114 WeakPolarHBondContact O-CB 3.34Å; E1111-K1114 PolarHBondContact O-N 3.39Å; C1112-K1114 VanDerWaalsContact C-N 3.3Å; C1112-K1114 PolarHBondContact O-N 2.89Å; K1114-S1117 PolarHBondContact O-N 3.31Å; K1114-V1118 WeakPolarHBondContact O-CG2 3.19Å; K1114-V1118 PolarHBondContact O-N 3Å
1115Y95.6Very high92.5Very high135 Ų13595.3 Ų95.353%0.52950%0.497SS..Hα-helixtrans-64.3-40175-70.5-59.1000112.2E1111 C1112 S1117 V1118 L1119E1111-Y1115 HydrophobicContact CB-CE2 4.37Å; E1111-Y1115 HydrophobicContact CG-CD2 4.26Å; E1111-Y1115 HydrophobicContact CG-CE2 3.58Å; E1111-Y1115 WeakPolarHBondContact O-CD2 3.36Å; E1111-Y1115 PolarHBondContact O-N 3.42Å; E1111-Y1115 WeakPolarHBondContact OE1-CE2 3.47Å; E1111-Y1115 VanDerWaalsContact OE1-CZ 3.29Å; E1111-Y1115 PolarHBondContact OE1-OH 2.93Å; C1112-Y1115 PolarHBondContact O-N 3.16Å; Y1115-S1117 VanDerWaalsContact C-N 3.35Å; Y1115-S1117 PolarHBondContact O-N 3.3Å; Y1115-V1118 PolarHBondContact O-N 3.23Å; Y1115-L1119 WeakPolarHBondContact O-CB 3.42Å; Y1115-L1119 VanDerWaalsContact O-CG 3.28Å; Y1115-L1119 WeakPolarHBondContact O-CG 3.48Å; Y1115-L1119 PolarHBondContact O-N 3.42Å
1116K96.4Very high92.9Very high114 Ų11495 Ų9550%0.49650%0.499SS..Hα-helixtrans-59.1-44.4172-72.3169.9-177.3171.70111.9C1112 E1113 V1118 L1119 A1120C1112-K1116 WeakPolarHBondContact O-CG 3.2Å; C1112-K1116 PolarHBondContact O-N 3.43Å; E1113-K1116 PolarHBondContact O-N 3.45Å; E1113-K1116 IonicContact OE1-NZ 2.62Å; E1113-K1116 PolarHBondContact OE1-NZ 2.72Å; E1113-K1116 WeakPolarHBondContact OE2-CD 3.29Å; E1113-K1116 IonicContact OE2-NZ 2.7Å; E1113-K1116 PolarHBondContact OE2-NZ 2.93Å; K1116-V1118 PolarHBondContact O-N 3.47Å; K1116-L1119 PolarHBondContact O-N 3.45Å; K1116-A1120 WeakPolarHBondContact O-CB 3.49Å; K1116-A1120 PolarHBondContact O-N 3.47Å
1117S94.7Very high93.1Very high78 Ų7894.4 Ų94.455%0.54549%0.49SS..Hα-helixtrans-61.1-44.3178.5-170.20000111.9E1113 K1114 Y1115 E1121E1113-S1117 WeakPolarHBondContact O-CB 3.17Å; E1113-S1117 PolarHBondContact O-N 3.26Å; K1114-S1117 PolarHBondContact O-N 3.31Å; Y1115-S1117 VanDerWaalsContact C-N 3.35Å; Y1115-S1117 PolarHBondContact O-N 3.3Å; S1117-E1121 WeakPolarHBondContact O-CB 3.45Å; S1117-E1121 PolarHBondContact O-N 2.79Å
1118V95.7Very high93.4Very high73 Ų7395.8 Ų95.844%0.44249%0.49SS..Hα-helixtrans-67.2-40.4176.4173.90000111.2K1114 Y1115 K1116 E1121 T1122K1114-V1118 WeakPolarHBondContact O-CG2 3.19Å; K1114-V1118 PolarHBondContact O-N 3Å; Y1115-V1118 PolarHBondContact O-N 3.23Å; K1116-V1118 PolarHBondContact O-N 3.47Å; V1118-E1121 PolarHBondContact O-N 2.75Å; V1118-T1122 WeakPolarHBondContact O-CG2 3.5Å; V1118-T1122 PolarHBondContact O-N 3.49Å; V1118-T1122 PolarHBondContact O-OG1 2.82Å
1119L92.5Very high93.5Very high113 Ų11396.5 Ų96.559%0.59249%0.494SS*.Hα-helixtrans-61-48.9175.3-76.2167.8000111.3Y1115 K1116 E1121 T1122 E1123Y1115-L1119 WeakPolarHBondContact O-CB 3.42Å; Y1115-L1119 VanDerWaalsContact O-CG 3.28Å; Y1115-L1119 WeakPolarHBondContact O-CG 3.48Å; Y1115-L1119 PolarHBondContact O-N 3.42Å; K1116-L1119 PolarHBondContact O-N 3.45Å; L1119-E1121 VanDerWaalsContact C-N 3.32Å; L1119-E1121 PolarHBondContact O-N 2.73Å; L1119-T1122 WeakPolarHBondContact CA-OG1 3.22Å; L1119-T1122 PolarHBondContact O-N 2.89Å; L1119-T1122 PolarHBondContact O-OG1 2.71Å; L1119-E1123 WeakPolarHBondContact O-CB 3.34Å; L1119-E1123 PolarHBondContact O-N 3.36Å
1120A92.9Very high93.8Very high58 Ų5897.7 Ų97.748%0.47950%0.5SS..Hα-helixtrans-61.8-36.1176.900000112.8K1116 G1124K1116-A1120 WeakPolarHBondContact O-CB 3.49Å; K1116-A1120 PolarHBondContact O-N 3.47Å; A1120-G1124 PolarHBondContact O-N 2.92Å
1121E91.3Very high93.9Very high128 Ų12896.6 Ų96.660%0.59849%0.487SS*.Hα-helixtrans-66.2-46.2172.7-174.3174-162.500111.5S1117 V1118 L1119 E1123 G1124 I1125S1117-E1121 WeakPolarHBondContact O-CB 3.45Å; S1117-E1121 PolarHBondContact O-N 2.79Å; V1118-E1121 PolarHBondContact O-N 2.75Å; L1119-E1121 VanDerWaalsContact C-N 3.32Å; L1119-E1121 PolarHBondContact O-N 2.73Å; E1121-E1123 VanDerWaalsContact C-N 3.34Å; E1121-E1123 PolarHBondContact O-N 2.62Å; E1121-G1124 PolarHBondContact O-N 2.85Å; E1121-I1125 HydrophobicContact CG-CD1 4.34Å; E1121-I1125 WeakPolarHBondContact O-CG1 3.39Å; E1121-I1125 PolarHBondContact O-N 3.2Å
1122T94.7Very high94Very high64 Ų6495.6 Ų95.639%0.39349%0.49SS..Hα-helixtrans-65.3-35.7175.9560000112.9V1118 L1119 I1125 L1126V1118-T1122 WeakPolarHBondContact O-CG2 3.5Å; V1118-T1122 PolarHBondContact O-N 3.49Å; V1118-T1122 PolarHBondContact O-OG1 2.82Å; L1119-T1122 WeakPolarHBondContact CA-OG1 3.22Å; L1119-T1122 PolarHBondContact O-N 2.89Å; L1119-T1122 PolarHBondContact O-OG1 2.71Å; T1122-I1125 PolarHBondContact O-N 3.05Å; T1122-L1126 WeakPolarHBondContact O-CG 3.45Å; T1122-L1126 PolarHBondContact O-N 3.36Å
1123E94.1Very high94Very high112 Ų11296 Ų9652%0.52349%0.49SS..Hα-helixtrans-65.9-44.6173.2-170.7-178.2161.700110.7L1119 E1121 I1125 L1126 Q1127L1119-E1123 WeakPolarHBondContact O-CB 3.34Å; L1119-E1123 PolarHBondContact O-N 3.36Å; E1121-E1123 VanDerWaalsContact C-N 3.34Å; E1121-E1123 PolarHBondContact O-N 2.62Å; E1123-I1125 VanDerWaalsContact C-N 3.26Å; E1123-I1125 PolarHBondContact O-N 3.38Å; E1123-L1126 PolarHBondContact O-N 3.28Å; E1123-L1126 VanDerWaalsContact O-N 3.12Å; E1123-Q1127 HydrophobicContact CG-CG 4.45Å; E1123-Q1127 WeakPolarHBondContact O-CG 3.41Å; E1123-Q1127 PolarHBondContact O-N 3.22Å; E1123-Q1127 PolarHBondContact OE1-NE2 3.09Å
1124G95.6Very high94.2Very high23 Ų2396.7 Ų96.724%0.23749%0.493CS..Hα-helixtrans-60.5-33.1173.900000113.5A1120 E1121 K1128A1120-G1124 PolarHBondContact O-N 2.92Å; E1121-G1124 PolarHBondContact O-N 2.85Å; G1124-K1128 WeakPolarHBondContact O-CB 3.3Å; G1124-K1128 WeakPolarHBondContact O-CD 3.46Å; G1124-K1128 VanDerWaalsContact O-CG 3.23Å; G1124-K1128 WeakPolarHBondContact O-CG 3.28Å; G1124-K1128 PolarHBondContact O-N 3.44Å
1125I94.8Very high94.3Very high98 Ų9895.6 Ų95.650%0.50349%0.491SS..Hα-helixtrans-70.6-46171.6-68.5165.2000110.8E1121 T1122 E1123 K1128 L1129E1121-I1125 HydrophobicContact CG-CD1 4.34Å; E1121-I1125 WeakPolarHBondContact O-CG1 3.39Å; E1121-I1125 PolarHBondContact O-N 3.2Å; T1122-I1125 PolarHBondContact O-N 3.05Å; E1123-I1125 VanDerWaalsContact C-N 3.26Å; E1123-I1125 PolarHBondContact O-N 3.38Å; I1125-K1128 WeakPolarHBondContact O-CB 3.34Å; I1125-K1128 PolarHBondContact O-N 2.9Å; I1125-L1129 PolarHBondContact O-N 2.72Å
1126L94.5Very high94Very high111 Ų11192.7 Ų92.758%0.58148%0.482SS*.Hα-helixtrans-62-43.8177.9-74.1168.7000112T1122 E1123 K1128 L1129 Q1130T1122-L1126 WeakPolarHBondContact O-CG 3.45Å; T1122-L1126 PolarHBondContact O-N 3.36Å; E1123-L1126 PolarHBondContact O-N 3.28Å; E1123-L1126 VanDerWaalsContact O-N 3.12Å; L1126-K1128 VanDerWaalsContact C-N 3.32Å; L1126-K1128 PolarHBondContact O-N 3.31Å; L1126-L1129 PolarHBondContact O-N 2.8Å; L1126-Q1130 WeakPolarHBondContact O-CB 3.5Å; L1126-Q1130 PolarHBondContact O-N 3.42Å
1127Q94.8Very high93.7Very high73 Ų7393.3 Ų93.334%0.34149%0.487SS..Hα-helixtrans-63.4-35.2174.3-67.5-179.811.900112.2E1123 R1131E1123-Q1127 HydrophobicContact CG-CG 4.45Å; E1123-Q1127 WeakPolarHBondContact O-CG 3.41Å; E1123-Q1127 PolarHBondContact O-N 3.22Å; E1123-Q1127 PolarHBondContact OE1-NE2 3.09Å; Q1127-R1131 WeakPolarHBondContact O-CG 3.37Å; Q1127-R1131 PolarHBondContact O-N 2.89Å; Q1127-R1131 PolarHBondContact O-NH1 3.13Å
1128K94.6Very high93.6Very high148 Ų14892.5 Ų92.564%0.64348%0.481SS*.Hα-helixtrans-67.1-41.7174.2-78168.6-176.5174.10111.3G1124 I1125 L1126 S1132G1124-K1128 WeakPolarHBondContact O-CB 3.3Å; G1124-K1128 WeakPolarHBondContact O-CD 3.46Å; G1124-K1128 VanDerWaalsContact O-CG 3.23Å; G1124-K1128 WeakPolarHBondContact O-CG 3.28Å; G1124-K1128 PolarHBondContact O-N 3.44Å; I1125-K1128 WeakPolarHBondContact O-CB 3.34Å; I1125-K1128 PolarHBondContact O-N 2.9Å; L1126-K1128 VanDerWaalsContact C-N 3.32Å; L1126-K1128 PolarHBondContact O-N 3.31Å; K1128-S1132 WeakPolarHBondContact O-CB 3.46Å; K1128-S1132 PolarHBondContact O-N 2.85Å
1129L95.2Very high93.6Very high109 Ų10993.9 Ų93.957%0.57148%0.481SS*.Hα-helixtrans-64-45.5175-175.463.5000111.3I1125 L1126 S1132 V1133I1125-L1129 PolarHBondContact O-N 2.72Å; L1126-L1129 PolarHBondContact O-N 2.8Å; L1129-S1132 WeakPolarHBondContact O-CB 3.35Å; L1129-S1132 PolarHBondContact O-N 3.35Å; L1129-V1133 WeakPolarHBondContact O-CG2 3.41Å; L1129-V1133 PolarHBondContact O-N 2.97Å
1130Q94.4Very high93.5Very high112 Ų11295.7 Ų95.752%0.52348%0.48SS..Hα-helixtrans-57.5-54.9176.2177.7177.3-13.900111.5L1126 S1132 V1133 E1134L1126-Q1130 WeakPolarHBondContact O-CB 3.5Å; L1126-Q1130 PolarHBondContact O-N 3.42Å; Q1130-S1132 PolarHBondContact O-N 3.49Å; Q1130-V1133 PolarHBondContact O-N 2.91Å; Q1130-E1134 HydrophobicContact CG-CG 4.28Å; Q1130-E1134 VanDerWaalsContact CG-OE1 3.26Å; Q1130-E1134 WeakPolarHBondContact CG-OE1 3.47Å; Q1130-E1134 PolarHBondContact NE2-OE1 3.14Å; Q1130-E1134 WeakPolarHBondContact O-CG 3.48Å; Q1130-E1134 PolarHBondContact O-N 3.46Å
1131R94.8Very high93.6Very high101 Ų101100 Ų10038%0.38149%0.488SS..Hα-helixtrans-56.8-36.2176.4-69.3-178.2-155.391.8-3.2112.2Q1127 Q1135Q1127-R1131 WeakPolarHBondContact O-CG 3.37Å; Q1127-R1131 PolarHBondContact O-N 2.89Å; Q1127-R1131 PolarHBondContact O-NH1 3.13Å; R1131-Q1135 VanDerWaalsContact O-CB 3.22Å; R1131-Q1135 WeakPolarHBondContact O-CB 3.47Å; R1131-Q1135 PolarHBondContact O-N 3.24Å
1132S91.2Very high93.7Very high69 Ų6998 Ų9848%0.48348%0.481SS..Hα-helixtrans-68.4-34.6176.6-170.20000112.9K1128 L1129 Q1130 E1136K1128-S1132 WeakPolarHBondContact O-CB 3.46Å; K1128-S1132 PolarHBondContact O-N 2.85Å; L1129-S1132 WeakPolarHBondContact O-CB 3.35Å; L1129-S1132 PolarHBondContact O-N 3.35Å; Q1130-S1132 PolarHBondContact O-N 3.49Å; S1132-E1136 WeakPolarHBondContact O-CB 3.49Å; S1132-E1136 PolarHBondContact O-N 2.92Å
1133V92Very high93.6Very high70 Ų70100.9 Ų100.942%0.42449%0.488SS..Hα-helixtrans-72.8-49.6174.5172.10000110.1L1129 Q1130 Q1135 E1136 E1137L1129-V1133 WeakPolarHBondContact O-CG2 3.41Å; L1129-V1133 PolarHBondContact O-N 2.97Å; Q1130-V1133 PolarHBondContact O-N 2.91Å; V1133-Q1135 VanDerWaalsContact C-N 3.29Å; V1133-Q1135 PolarHBondContact O-N 3.27Å; V1133-E1136 PolarHBondContact O-N 3.49Å; V1133-E1137 HydrophobicContact CG1-CG 4.23Å; V1133-E1137 WeakPolarHBondContact O-CG 3.3Å; V1133-E1137 PolarHBondContact O-N 2.95Å
1134E95.6Very high93.2Very high92 Ų9297.9 Ų97.943%0.4348%0.482SS..Hα-helixtrans-56.7-41.4177.5-69166.9166.700112.1Q1130 S1138Q1130-E1134 HydrophobicContact CG-CG 4.28Å; Q1130-E1134 VanDerWaalsContact CG-OE1 3.26Å; Q1130-E1134 WeakPolarHBondContact CG-OE1 3.47Å; Q1130-E1134 PolarHBondContact NE2-OE1 3.14Å; Q1130-E1134 WeakPolarHBondContact O-CG 3.48Å; Q1130-E1134 PolarHBondContact O-N 3.46Å; E1134-S1138 VanDerWaalsContact O-CB 3.29Å; E1134-S1138 WeakPolarHBondContact O-CB 3.39Å; E1134-S1138 PolarHBondContact O-N 2.88Å
1135Q94.7Very high93Very high126 Ų126100.5 Ų100.559%0.58949%0.491SS*.Hα-helixtrans-68.1-34.8176.2-165.9-175.638.900112.2R1131 V1133 K1139R1131-Q1135 VanDerWaalsContact O-CB 3.22Å; R1131-Q1135 WeakPolarHBondContact O-CB 3.47Å; R1131-Q1135 PolarHBondContact O-N 3.24Å; V1133-Q1135 VanDerWaalsContact C-N 3.29Å; V1133-Q1135 PolarHBondContact O-N 3.27Å; Q1135-K1139 WeakPolarHBondContact O-CG 3.23Å; Q1135-K1139 PolarHBondContact O-N 3.07Å
1136E89.1Confident92.9Very high75 Ų75100.6 Ų100.635%0.3549%0.489SS..Hα-helixtrans-74.2-45.4177.5-16358.5-148.600111S1132 V1133 S1138 K1139 W1140S1132-E1136 WeakPolarHBondContact O-CB 3.49Å; S1132-E1136 PolarHBondContact O-N 2.92Å; V1133-E1136 PolarHBondContact O-N 3.49Å; E1136-S1138 PolarHBondContact O-N 3.39Å; E1136-K1139 WeakPolarHBondContact O-CB 3.39Å; E1136-K1139 PolarHBondContact O-N 2.92Å; E1136-K1139 WeakPolarHBondContact OE2-CD 3.48Å; E1136-K1139 WeakPolarHBondContact OE2-CE 3.33Å; E1136-K1139 IonicContact OE2-NZ 2.86Å; E1136-K1139 PolarHBondContact OE2-NZ 3.08Å; E1136-W1140 PolarHBondContact O-N 3.22Å; E1136-W1140 PolarHBondContact OE1-NE1 2.75Å
1137E90.4Very high92.4Very high126 Ų12698.4 Ų98.459%0.58948%0.483SS*.Hα-helixtrans-54.2-41.5170.7-72.8-175.4174.300111.7V1133 W1140 K1141V1133-E1137 HydrophobicContact CG1-CG 4.23Å; V1133-E1137 WeakPolarHBondContact O-CG 3.3Å; V1133-E1137 PolarHBondContact O-N 2.95Å; E1137-W1140 PolarHBondContact O-N 2.68Å; E1137-K1141 VanDerWaalsContact O-CB 3.27Å; E1137-K1141 WeakPolarHBondContact O-CB 3.24Å; E1137-K1141 PolarHBondContact O-N 2.78Å
1138S92.8Very high92.2Very high62 Ų62100 Ų10043%0.43449%0.491SS..Hα-helixtrans-61-43.9174.8-172.30000112.5E1134 E1136 K1141 I1142E1134-S1138 VanDerWaalsContact O-CB 3.29Å; E1134-S1138 WeakPolarHBondContact O-CB 3.39Å; E1134-S1138 PolarHBondContact O-N 2.88Å; E1136-S1138 PolarHBondContact O-N 3.39Å; S1138-K1141 PolarHBondContact O-N 2.8Å; S1138-I1142 VanDerWaalsContact O-CG1 3.32Å; S1138-I1142 WeakPolarHBondContact O-CG1 3.18Å; S1138-I1142 PolarHBondContact O-N 2.71Å
1139K95.1Very high92.3Very high101 Ų10199.7 Ų99.744%0.43949%0.485SS..Hα-helixtrans-61.2-46.7173.7-65.4167.6-151.7164.10111.7Q1135 E1136 K1141 I1142 K1143Q1135-K1139 WeakPolarHBondContact O-CG 3.23Å; Q1135-K1139 PolarHBondContact O-N 3.07Å; E1136-K1139 WeakPolarHBondContact O-CB 3.39Å; E1136-K1139 PolarHBondContact O-N 2.92Å; E1136-K1139 WeakPolarHBondContact OE2-CD 3.48Å; E1136-K1139 WeakPolarHBondContact OE2-CE 3.33Å; E1136-K1139 IonicContact OE2-NZ 2.86Å; E1136-K1139 PolarHBondContact OE2-NZ 3.08Å; K1139-K1141 VanDerWaalsContact C-N 3.31Å; K1139-K1141 PolarHBondContact O-N 3.43Å; K1139-I1142 PolarHBondContact O-N 3.3Å; K1139-K1143 WeakPolarHBondContact O-CB 3.33Å; K1139-K1143 PolarHBondContact O-N 3Å
1140W90.9Very high92.2Very high152 Ų152100.8 Ų100.858%0.57649%0.489SS*.Hα-helixtrans-65.6-34.9179.6-72.6106.4000112.2E1136 E1137 K1143 A1144E1136-W1140 PolarHBondContact O-N 3.22Å; E1136-W1140 PolarHBondContact OE1-NE1 2.75Å; E1137-W1140 PolarHBondContact O-N 2.68Å; W1140-K1143 HydrophobicContact CE3-CD 4.24Å; W1140-K1143 HydrophobicContact CZ3-CD 4.06Å; W1140-K1143 PolarHBondContact O-N 3.07Å; W1140-A1144 VanDerWaalsContact O-CB 3.32Å; W1140-A1144 WeakPolarHBondContact O-CB 3.5Å; W1140-A1144 PolarHBondContact O-N 3.45Å
1141K95.1Very high92Very high147 Ų14799.3 Ų99.364%0.63948%0.484SS*.Hα-helixtrans-65.3-48173.1-172.5176-178.51800112.1E1137 S1138 K1139 K1143 A1144 D1145E1137-K1141 VanDerWaalsContact O-CB 3.27Å; E1137-K1141 WeakPolarHBondContact O-CB 3.24Å; E1137-K1141 PolarHBondContact O-N 2.78Å; S1138-K1141 PolarHBondContact O-N 2.8Å; K1139-K1141 VanDerWaalsContact C-N 3.31Å; K1139-K1141 PolarHBondContact O-N 3.43Å; K1141-K1143 VanDerWaalsContact C-N 3.32Å; K1141-K1143 PolarHBondContact O-N 3.19Å; K1141-A1144 WeakPolarHBondContact O-CB 3.4Å; K1141-A1144 PolarHBondContact O-N 2.99Å; K1141-D1145 PolarHBondContact O-N 3.16Å
1142I94.3Very high92Very high88 Ų8899.9 Ų99.945%0.45149%0.489SS..Hα-helixtrans-57.4-46.7174.8-69.4162.5000110.5S1138 K1139 A1144 D1145 E1146S1138-I1142 VanDerWaalsContact O-CG1 3.32Å; S1138-I1142 WeakPolarHBondContact O-CG1 3.18Å; S1138-I1142 PolarHBondContact O-N 2.71Å; K1139-I1142 PolarHBondContact O-N 3.3Å; I1142-A1144 VanDerWaalsContact C-N 3.34Å; I1142-A1144 PolarHBondContact O-N 2.83Å; I1142-D1145 PolarHBondContact O-N 3.16Å; I1142-E1146 WeakPolarHBondContact O-CG 3.37Å; I1142-E1146 PolarHBondContact O-N 3.43Å
1143K92.6Very high92.2Very high123 Ų123100.4 Ų100.454%0.53548%0.484SS..Hα-helixtrans-65.2-35.2178.9-165.7173.3-175.9178.10112.6K1139 W1140 K1141 S1147K1139-K1143 WeakPolarHBondContact O-CB 3.33Å; K1139-K1143 PolarHBondContact O-N 3Å; W1140-K1143 HydrophobicContact CE3-CD 4.24Å; W1140-K1143 HydrophobicContact CZ3-CD 4.06Å; W1140-K1143 PolarHBondContact O-N 3.07Å; K1141-K1143 VanDerWaalsContact C-N 3.32Å; K1141-K1143 PolarHBondContact O-N 3.19Å; K1143-S1147 PolarHBondContact O-N 3.34Å; K1143-S1147 PolarHBondContact O-OG 3.16Å
1144A84.1Confident92.2Very high49 Ų49101.9 Ų101.941%0.40549%0.489SS..Hα-helixtrans-64.7-49.8171.200000110.8W1140 K1141 I1142 E1146 S1147 Q1148W1140-A1144 VanDerWaalsContact O-CB 3.32Å; W1140-A1144 WeakPolarHBondContact O-CB 3.5Å; W1140-A1144 PolarHBondContact O-N 3.45Å; K1141-A1144 WeakPolarHBondContact O-CB 3.4Å; K1141-A1144 PolarHBondContact O-N 2.99Å; I1142-A1144 VanDerWaalsContact C-N 3.34Å; I1142-A1144 PolarHBondContact O-N 2.83Å; A1144-E1146 VanDerWaalsContact C-N 3.27Å; A1144-E1146 PolarHBondContact O-N 3.36Å; A1144-S1147 PolarHBondContact O-N 3.11Å; A1144-S1147 PolarHBondContact O-OG 3.13Å; A1144-Q1148 WeakPolarHBondContact O-CB 3.31Å; A1144-Q1148 PolarHBondContact O-N 3.46Å
1145D92.2Very high92.1Very high78 Ų78104.6 Ų104.642%0.41750%0.495SS..Hα-helixtrans-60.9-33.5177-75.6-36.4000112.7K1141 I1142 R1149K1141-D1145 PolarHBondContact O-N 3.16Å; I1142-D1145 PolarHBondContact O-N 3.16Å; D1145-R1149 WeakPolarHBondContact O-CB 3.36Å; D1145-R1149 WeakPolarHBondContact O-CG 3.42Å; D1145-R1149 PolarHBondContact O-N 3.29Å; D1145-R1149 PolarHBondContact O-NE 2.79Å
1146E92.9Very high92.1Very high101 Ų101105 Ų10547%0.47249%0.492SS..Hα-helixtrans-67.2-50.7172.9-76.4177.6166.300111.8I1142 A1144 Q1148 R1149 M1150I1142-E1146 WeakPolarHBondContact O-CG 3.37Å; I1142-E1146 PolarHBondContact O-N 3.43Å; A1144-E1146 VanDerWaalsContact C-N 3.27Å; A1144-E1146 PolarHBondContact O-N 3.36Å; E1146-Q1148 VanDerWaalsContact C-N 3.28Å; E1146-Q1148 PolarHBondContact O-N 3.41Å; E1146-R1149 VanDerWaalsContact CG-NH2 3.26Å; E1146-R1149 WeakPolarHBondContact O-CB 3.47Å; E1146-R1149 PolarHBondContact O-N 3.14Å; E1146-R1149 VanDerWaalsContact O-N 3.15Å; E1146-M1150 PolarHBondContact O-N 2.89Å
1147S84.6Confident92.3Very high65 Ų65105.5 Ų105.546%0.45549%0.494SS..Hα-helixtrans-61.2-37.5176.366.40000112K1143 A1144 M1150 I1151K1143-S1147 PolarHBondContact O-N 3.34Å; K1143-S1147 PolarHBondContact O-OG 3.16Å; A1144-S1147 PolarHBondContact O-N 3.11Å; A1144-S1147 PolarHBondContact O-OG 3.13Å; S1147-M1150 PolarHBondContact O-N 3.44Å; S1147-I1151 WeakPolarHBondContact O-CB 3.38Å; S1147-I1151 VanDerWaalsContact O-CG1 3.26Å; S1147-I1151 WeakPolarHBondContact O-CG1 3.23Å; S1147-I1151 PolarHBondContact O-N 3.02Å
1148Q90.4Very high92.2Very high107 Ų107105.9 Ų105.950%0.549%0.49SS..Hα-helixtrans-73.4-29.2176.5-168.3163.8-5.200112.8A1144 E1146 K1152A1144-Q1148 WeakPolarHBondContact O-CB 3.31Å; A1144-Q1148 PolarHBondContact O-N 3.46Å; E1146-Q1148 VanDerWaalsContact C-N 3.28Å; E1146-Q1148 PolarHBondContact O-N 3.41Å; Q1148-K1152 WeakPolarHBondContact O-CB 3.48Å; Q1148-K1152 VanDerWaalsContact O-CG 3.29Å; Q1148-K1152 WeakPolarHBondContact O-CG 3.35Å; Q1148-K1152 PolarHBondContact O-N 3.36Å
1149R95.5Very high92.3Very high140 Ų140107.8 Ų107.853%0.52849%0.492SS..Hα-helixtrans-66.1-43.7167.1-86.2173.3-83.1140.7-9111.6D1145 E1146 K1152 Q1153D1145-R1149 WeakPolarHBondContact O-CB 3.36Å; D1145-R1149 WeakPolarHBondContact O-CG 3.42Å; D1145-R1149 PolarHBondContact O-N 3.29Å; D1145-R1149 PolarHBondContact O-NE 2.79Å; E1146-R1149 VanDerWaalsContact CG-NH2 3.26Å; E1146-R1149 WeakPolarHBondContact O-CB 3.47Å; E1146-R1149 PolarHBondContact O-N 3.14Å; E1146-R1149 VanDerWaalsContact O-N 3.15Å; R1149-K1152 PolarHBondContact O-N 3.12Å; R1149-Q1153 PolarHBondContact O-N 2.9Å
1150M93.4Very high92.1Very high132 Ų132107.4 Ų107.465%0.6549%0.492SS*.Hα-helixtrans-66.5-41.3177.3-173.8159-81.500112.2E1146 S1147 K1152 Q1153 L1154E1146-M1150 PolarHBondContact O-N 2.89Å; S1147-M1150 PolarHBondContact O-N 3.44Å; M1150-K1152 VanDerWaalsContact C-N 3.33Å; M1150-K1152 PolarHBondContact O-N 3.04Å; M1150-Q1153 WeakPolarHBondContact O-CB 3.3Å; M1150-Q1153 PolarHBondContact O-N 3.41Å; M1150-Q1153 VanDerWaalsContact O-N 3.08Å; M1150-L1154 HydrophobicContact CG-CD1 4.18Å; M1150-L1154 WeakPolarHBondContact O-CG 3.38Å; M1150-L1154 PolarHBondContact O-N 3.33Å
1151I90.9Very high92.1Very high82 Ų82105.4 Ų105.442%0.42149%0.492SS..Hα-helixtrans-61.1-40.4172.3-70.3163.3000111.3S1147 Q1153 R1155S1147-I1151 WeakPolarHBondContact O-CB 3.38Å; S1147-I1151 VanDerWaalsContact O-CG1 3.26Å; S1147-I1151 WeakPolarHBondContact O-CG1 3.23Å; S1147-I1151 PolarHBondContact O-N 3.02Å; I1151-Q1153 VanDerWaalsContact C-N 3.29Å; I1151-Q1153 PolarHBondContact O-N 3.39Å; I1151-R1155 WeakPolarHBondContact O-CG 3.5Å; I1151-R1155 PolarHBondContact O-N 3.4Å; I1151-R1155 VanDerWaalsContact O-N 3.1Å
1152K94.3Very high91.9Very high112 Ų112102.6 Ų102.649%0.48748%0.481SS..Hα-helixtrans-64.9-32.2173.7-78.3173.9179.2179.10112.5Q1148 R1149 M1150 R1156Q1148-K1152 WeakPolarHBondContact O-CB 3.48Å; Q1148-K1152 VanDerWaalsContact O-CG 3.29Å; Q1148-K1152 WeakPolarHBondContact O-CG 3.35Å; Q1148-K1152 PolarHBondContact O-N 3.36Å; R1149-K1152 PolarHBondContact O-N 3.12Å; M1150-K1152 VanDerWaalsContact C-N 3.33Å; M1150-K1152 PolarHBondContact O-N 3.04Å; K1152-R1156 PolarHBondContact O-N 2.95Å
1153Q94.8Very high91.9Very high81 Ų81104.2 Ų104.238%0.37949%0.488SS..Hα-helixtrans-72.4-50.6177.2-176.557.919.300111.6R1149 M1150 I1151 R1155 R1156 E1157R1149-Q1153 PolarHBondContact O-N 2.9Å; M1150-Q1153 WeakPolarHBondContact O-CB 3.3Å; M1150-Q1153 PolarHBondContact O-N 3.41Å; M1150-Q1153 VanDerWaalsContact O-N 3.08Å; I1151-Q1153 VanDerWaalsContact C-N 3.29Å; I1151-Q1153 PolarHBondContact O-N 3.39Å; Q1153-R1155 PolarHBondContact O-N 3.39Å; Q1153-R1156 PolarHBondContact O-N 3.09Å; Q1153-E1157 VanDerWaalsContact CG-OE1 3.3Å; Q1153-E1157 WeakPolarHBondContact CG-OE1 3.46Å; Q1153-E1157 PolarHBondContact NE2-OE1 3.11Å; Q1153-E1157 PolarHBondContact O-N 2.77Å
1154L93.3Very high91.8Very high101 Ų101103.5 Ų103.553%0.52949%0.487SS..Hα-helixtrans-58.6-31.5176.9-69.3168.2000112.7M1150 R1158M1150-L1154 HydrophobicContact CG-CD1 4.18Å; M1150-L1154 WeakPolarHBondContact O-CG 3.38Å; M1150-L1154 PolarHBondContact O-N 3.33Å; L1154-R1158 WeakPolarHBondContact O-CB 3.25Å; L1154-R1158 PolarHBondContact O-N 2.83Å
1155R92.3Very high92.1Very high148 Ų148106.4 Ų106.456%0.55849%0.494SS*.Hα-helixtrans-63.9-45.9171.5-76.5-179.3-162.8-161.73.5112.8I1151 Q1153 E1157 R1158 E1159I1151-R1155 WeakPolarHBondContact O-CG 3.5Å; I1151-R1155 PolarHBondContact O-N 3.4Å; I1151-R1155 VanDerWaalsContact O-N 3.1Å; Q1153-R1155 PolarHBondContact O-N 3.39Å; R1155-E1157 VanDerWaalsContact C-N 3.32Å; R1155-E1157 PolarHBondContact O-N 2.8Å; R1155-R1158 WeakPolarHBondContact O-CB 3.35Å; R1155-R1158 PolarHBondContact O-N 3.18Å; R1155-E1159 WeakPolarHBondContact O-CB 3.47Å; R1155-E1159 VanDerWaalsContact O-CD 3.31Å; R1155-E1159 WeakPolarHBondContact O-CG 3.41Å; R1155-E1159 PolarHBondContact O-N 3.12Å
1156R95.3Very high92Very high135 Ų135109 Ų10951%0.50950%0.504SS..Hα-helixtrans-65.4-37177.6-64.5-176.9-158.6104.7-0.9112.3K1152 Q1153 E1159 H1160K1152-R1156 PolarHBondContact O-N 2.95Å; Q1153-R1156 PolarHBondContact O-N 3.09Å; R1156-E1159 PolarHBondContact O-N 3.47Å; R1156-H1160 VanDerWaalsContact O-CB 3.28Å; R1156-H1160 WeakPolarHBondContact O-CB 3.42Å; R1156-H1160 PolarHBondContact O-N 2.7Å
1157E92.9Very high92Very high86 Ų86110.1 Ų110.140%0.40251%0.507SS..Hα-helixtrans-66.1-40.5175.6-72.2162.7-175.100110.7Q1153 R1155 H1160 L1161Q1153-E1157 VanDerWaalsContact CG-OE1 3.3Å; Q1153-E1157 WeakPolarHBondContact CG-OE1 3.46Å; Q1153-E1157 PolarHBondContact NE2-OE1 3.11Å; Q1153-E1157 PolarHBondContact O-N 2.77Å; R1155-E1157 VanDerWaalsContact C-N 3.32Å; R1155-E1157 PolarHBondContact O-N 2.8Å; E1157-H1160 PolarHBondContact O-N 3.18Å; E1157-L1161 WeakPolarHBondContact O-CB 3.44Å; E1157-L1161 VanDerWaalsContact O-CG 3.27Å; E1157-L1161 WeakPolarHBondContact O-CG 3.37Å; E1157-L1161 PolarHBondContact O-N 2.94Å
1158R89.4Confident92.3Very high133 Ų133109.4 Ų109.450%0.50251%0.505SS..Hα-helixtrans-64.1-48171.3-164-150.870.9-173.57.9112.2L1154 R1155 H1160 L1161 E1162L1154-R1158 WeakPolarHBondContact O-CB 3.25Å; L1154-R1158 PolarHBondContact O-N 2.83Å; R1155-R1158 WeakPolarHBondContact O-CB 3.35Å; R1155-R1158 PolarHBondContact O-N 3.18Å; R1158-H1160 VanDerWaalsContact C-N 3.28Å; R1158-H1160 PolarHBondContact O-N 3.04Å; R1158-L1161 PolarHBondContact O-N 3.09Å; R1158-L1161 VanDerWaalsContact O-N 3.15Å; R1158-E1162 WeakPolarHBondContact CD-OE1 3.32Å; R1158-E1162 HydrophobicContact CG-CG 4.39Å; R1158-E1162 IonicContact CZ-OE1 3.69Å; R1158-E1162 VanDerWaalsContact CZ-OE1 3.26Å; R1158-E1162 IonicContact CZ-OE2 2.69Å; R1158-E1162 IonicContact NE-OE1 2.73Å; R1158-E1162 PolarHBondContact NE-OE1 2.85Å; R1158-E1162 IonicContact NE-OE2 2.64Å; R1158-E1162 PolarHBondContact NE-OE2 3.1Å; R1158-E1162 IonicContact NH2-OE1 2.64Å; R1158-E1162 PolarHBondContact NH2-OE1 3.45Å; R1158-E1162 IonicContact NH2-OE2 3.72Å; R1158-E1162 PolarHBondContact NH2-OE2 3.32Å; R1158-E1162 WeakPolarHBondContact O-CB 3.47Å; R1158-E1162 VanDerWaalsContact O-CG 3.25Å; R1158-E1162 WeakPolarHBondContact O-CG 3.17Å; R1158-E1162 PolarHBondContact O-N 2.81Å
1159E93.1Very high92.2Very high102 Ų102109.3 Ų109.348%0.47751%0.505SS..Hα-helixtrans-59.4-37.6177.6-72.2155-168.100111.7R1155 R1156 E1162 M1163R1155-E1159 WeakPolarHBondContact O-CB 3.47Å; R1155-E1159 VanDerWaalsContact O-CD 3.31Å; R1155-E1159 WeakPolarHBondContact O-CG 3.41Å; R1155-E1159 PolarHBondContact O-N 3.12Å; R1156-E1159 PolarHBondContact O-N 3.47Å; E1159-E1162 WeakPolarHBondContact CA-OE2 3.36Å; E1159-M1163 PolarHBondContact O-N 2.99Å; E1159-M1163 VanDerWaalsContact O-N 3.12Å
1160H91.5Very high92Very high94 Ų94108.6 Ų108.644%0.43551%0.509SS..Hα-helixtrans-67.2-44.4173.6-178.6-0.5000112.2R1156 E1157 R1158 M1163 E1164R1156-H1160 VanDerWaalsContact O-CB 3.28Å; R1156-H1160 WeakPolarHBondContact O-CB 3.42Å; R1156-H1160 PolarHBondContact O-N 2.7Å; E1157-H1160 PolarHBondContact O-N 3.18Å; R1158-H1160 VanDerWaalsContact C-N 3.28Å; R1158-H1160 PolarHBondContact O-N 3.04Å; H1160-M1163 PolarHBondContact O-N 3.32Å; H1160-E1164 IonicContact CE1-OE1 2.7Å; H1160-E1164 PolarHBondContact CE1-OE1 3.27Å; H1160-E1164 PolarHBondContact O-N 3.42Å
1161L92.4Very high91.9Very high110 Ų110106.5 Ų106.558%0.57650%0.498SS*.Hα-helixtrans-69.3-34.5177.7-71.1168.6000112.3E1157 R1158 M1163 E1164 L1165E1157-L1161 WeakPolarHBondContact O-CB 3.44Å; E1157-L1161 VanDerWaalsContact O-CG 3.27Å; E1157-L1161 WeakPolarHBondContact O-CG 3.37Å; E1157-L1161 PolarHBondContact O-N 2.94Å; R1158-L1161 PolarHBondContact O-N 3.09Å; R1158-L1161 VanDerWaalsContact O-N 3.15Å; L1161-M1163 VanDerWaalsContact C-N 3.35Å; L1161-E1164 PolarHBondContact O-N 2.94Å; L1161-L1165 VanDerWaalsContact O-CB 3.31Å; L1161-L1165 WeakPolarHBondContact O-CB 3.37Å; L1161-L1165 PolarHBondContact O-N 2.85Å
1162E89.6Confident91.9Very high87 Ų87110.4 Ų110.441%0.40751%0.507SS..Hα-helixtrans-61.4-43.4172.2-75.4167153.300110.5R1158 E1159 L1165 E1166R1158-E1162 WeakPolarHBondContact CD-OE1 3.32Å; R1158-E1162 HydrophobicContact CG-CG 4.39Å; R1158-E1162 IonicContact CZ-OE1 3.69Å; R1158-E1162 VanDerWaalsContact CZ-OE1 3.26Å; R1158-E1162 IonicContact CZ-OE2 2.69Å; R1158-E1162 IonicContact NE-OE1 2.73Å; R1158-E1162 PolarHBondContact NE-OE1 2.85Å; R1158-E1162 IonicContact NE-OE2 2.64Å; R1158-E1162 PolarHBondContact NE-OE2 3.1Å; R1158-E1162 IonicContact NH2-OE1 2.64Å; R1158-E1162 PolarHBondContact NH2-OE1 3.45Å; R1158-E1162 IonicContact NH2-OE2 3.72Å; R1158-E1162 PolarHBondContact NH2-OE2 3.32Å; R1158-E1162 WeakPolarHBondContact O-CB 3.47Å; R1158-E1162 VanDerWaalsContact O-CG 3.25Å; R1158-E1162 WeakPolarHBondContact O-CG 3.17Å; R1158-E1162 PolarHBondContact O-N 2.81Å; E1159-E1162 WeakPolarHBondContact CA-OE2 3.36Å; E1162-L1165 PolarHBondContact O-N 2.87Å; E1162-E1166 PolarHBondContact O-N 3.08Å
1163M93.5Very high91.7Very high122 Ų122108.8 Ų108.860%0.60151%0.51SS*.Hα-helixtrans-67.9-38.3174.9-176.9-178.163.700113.2E1159 H1160 L1161 K1167E1159-M1163 PolarHBondContact O-N 2.99Å; E1159-M1163 VanDerWaalsContact O-N 3.12Å; H1160-M1163 PolarHBondContact O-N 3.32Å; L1161-M1163 VanDerWaalsContact C-N 3.35Å; M1163-K1167 WeakPolarHBondContact O-CB 3.47Å; M1163-K1167 PolarHBondContact O-N 3.47Å
1164E91.6Very high91.6Very high109 Ų109107.9 Ų107.951%0.50951%0.51SS..Hα-helixtrans-67.8-35.9174.2-72.5-160.9148.500112.2H1160 L1161 A1168H1160-E1164 IonicContact CE1-OE1 2.7Å; H1160-E1164 PolarHBondContact CE1-OE1 3.27Å; H1160-E1164 PolarHBondContact O-N 3.42Å; L1161-E1164 PolarHBondContact O-N 2.94Å; E1164-A1168 WeakPolarHBondContact O-CB 3.35Å; E1164-A1168 PolarHBondContact O-N 2.88Å
1165L89.6Confident91.5Very high109 Ų109110.2 Ų110.257%0.57151%0.513SS*.Hα-helixtrans-65.6-49174.4-177.364000111.3L1161 E1162 K1167 A1168 E1169L1161-L1165 VanDerWaalsContact O-CB 3.31Å; L1161-L1165 WeakPolarHBondContact O-CB 3.37Å; L1161-L1165 PolarHBondContact O-N 2.85Å; E1162-L1165 PolarHBondContact O-N 2.87Å; L1165-K1167 VanDerWaalsContact C-N 3.28Å; L1165-K1167 PolarHBondContact O-N 2.85Å; L1165-A1168 CarbonylContact O-C 3.55Å; L1165-A1168 WeakPolarHBondContact O-CB 3.37Å; L1165-A1168 PolarHBondContact O-N 3.39Å; L1165-A1168 VanDerWaalsContact O-N 3.07Å; L1165-E1169 WeakPolarHBondContact O-CG 3.39Å; L1165-E1169 PolarHBondContact O-N 3.37Å
1166E90.9Very high91.5Very high133 Ų133106.1 Ų106.162%0.62151%0.505SS*.Hα-helixtrans-60.5-38.2177.7-174.8171.3-143.200111.7E1162 E1169 M1170E1162-E1166 PolarHBondContact O-N 3.08Å; E1166-E1169 PolarHBondContact O-N 3.29Å; E1166-M1170 WeakPolarHBondContact O-CB 3.41Å; E1166-M1170 PolarHBondContact O-N 2.95Å
1167K93.1Very high91.3Very high124 Ų124105.6 Ų105.654%0.53951%0.509SS..Hα-helixtrans-61.9-46171.7-178.3176.2177.6-72.80112M1163 L1165 E1169 M1170 E1171M1163-K1167 WeakPolarHBondContact O-CB 3.47Å; M1163-K1167 PolarHBondContact O-N 3.47Å; L1165-K1167 VanDerWaalsContact C-N 3.28Å; L1165-K1167 PolarHBondContact O-N 2.85Å; K1167-E1169 VanDerWaalsContact C-N 3.31Å; K1167-E1169 PolarHBondContact O-N 3.45Å; K1167-M1170 PolarHBondContact O-N 3.4Å; K1167-E1171 WeakPolarHBondContact CE-OE1 3.43Å; K1167-E1171 IonicContact NZ-OE1 2.71Å; K1167-E1171 PolarHBondContact NZ-OE1 2.94Å; K1167-E1171 WeakPolarHBondContact O-CG 3.44Å; K1167-E1171 PolarHBondContact O-N 3.32Å
1168A90.1Very high91.2Very high50 Ų50106.4 Ų106.441%0.41351%0.513SS..Hα-helixtrans-65-34.1177.200000112.4E1164 L1165 R1172E1164-A1168 WeakPolarHBondContact O-CB 3.35Å; E1164-A1168 PolarHBondContact O-N 2.88Å; L1165-A1168 CarbonylContact O-C 3.55Å; L1165-A1168 WeakPolarHBondContact O-CB 3.37Å; L1165-A1168 PolarHBondContact O-N 3.39Å; L1165-A1168 VanDerWaalsContact O-N 3.07Å; A1168-R1172 WeakPolarHBondContact O-CB 3.37Å; A1168-R1172 PolarHBondContact O-N 2.86Å
1169E89.1Confident91.3Very high105 Ų105104.8 Ų104.849%0.49152%0.518SS..Hα-helixtrans-69.9-36.4173-67.7-151.413000112.6L1165 E1166 K1167 R1172 S1173L1165-E1169 WeakPolarHBondContact O-CG 3.39Å; L1165-E1169 PolarHBondContact O-N 3.37Å; E1166-E1169 PolarHBondContact O-N 3.29Å; K1167-E1169 VanDerWaalsContact C-N 3.31Å; K1167-E1169 PolarHBondContact O-N 3.45Å; E1169-R1172 PolarHBondContact O-N 2.96Å; E1169-R1172 IonicContact OE1-NH1 2.78Å; E1169-S1173 VanDerWaalsContact O-CB 3.27Å; E1169-S1173 WeakPolarHBondContact O-CB 3.47Å; E1169-S1173 PolarHBondContact O-N 3.24Å
1170M91.4Very high91.2Very high126 Ų126108.2 Ų108.262%0.62153%0.526SS*.Hα-helixtrans-65.9-43.4173.6-167.9-178.6-60.700112.1E1166 K1167 S1173 T1174E1166-M1170 WeakPolarHBondContact O-CB 3.41Å; E1166-M1170 PolarHBondContact O-N 2.95Å; K1167-M1170 PolarHBondContact O-N 3.4Å; M1170-S1173 PolarHBondContact O-N 3.46Å; M1170-T1174 PolarHBondContact O-N 3.28Å; M1170-T1174 PolarHBondContact O-OG1 2.91Å
1171E91.1Very high91.2Very high87 Ų87108.4 Ų108.441%0.40753%0.528SS..Hα-helixtrans-61.6-47.2172.5-73175-164.500111.1K1167 S1173 T1174 Y1175K1167-E1171 WeakPolarHBondContact CE-OE1 3.43Å; K1167-E1171 IonicContact NZ-OE1 2.71Å; K1167-E1171 PolarHBondContact NZ-OE1 2.94Å; K1167-E1171 WeakPolarHBondContact O-CG 3.44Å; K1167-E1171 PolarHBondContact O-N 3.32Å; E1171-S1173 PolarHBondContact O-N 3.01Å; E1171-T1174 WeakPolarHBondContact O-CB 3.5Å; E1171-T1174 PolarHBondContact O-N 3.41Å; E1171-Y1175 WeakPolarHBondContact O-CD2 3.46Å; E1171-Y1175 PolarHBondContact O-N 3.34Å
1172R91.1Very high91.2Very high164 Ų164108.3 Ų108.362%0.61953%0.527SS*.Hα-helixtrans-58.8-42.3175.1178.6-176.2174.5-147.10.6112.7A1168 E1169 T1174 Y1175 V1176A1168-R1172 WeakPolarHBondContact O-CB 3.37Å; A1168-R1172 PolarHBondContact O-N 2.86Å; E1169-R1172 PolarHBondContact O-N 2.96Å; E1169-R1172 IonicContact OE1-NH1 2.78Å; R1172-T1174 VanDerWaalsContact C-N 3.31Å; R1172-Y1175 PolarHBondContact O-N 3.35Å; R1172-V1176 WeakPolarHBondContact O-CG2 3.33Å; R1172-V1176 PolarHBondContact O-N 2.99Å
1173S89.7Confident91.3Very high79 Ų79110.6 Ų110.655%0.55254%0.536SS*.Hα-helixtrans-62.3-40.9176.8-170.80000111.2E1169 M1170 E1171 V1176 M1177E1169-S1173 VanDerWaalsContact O-CB 3.27Å; E1169-S1173 WeakPolarHBondContact O-CB 3.47Å; E1169-S1173 PolarHBondContact O-N 3.24Å; M1170-S1173 PolarHBondContact O-N 3.46Å; E1171-S1173 PolarHBondContact O-N 3.01Å; S1173-V1176 PolarHBondContact O-N 3.32Å; S1173-M1177 PolarHBondContact O-N 3.34Å
1174T92.3Very high91.2Very high62 Ų62108 Ų10838%0.3853%0.527SS..Hα-helixtrans-62.4-49.6175.5-52.70000111.1M1170 E1171 R1172 V1176 M1177 E1178M1170-T1174 PolarHBondContact O-N 3.28Å; M1170-T1174 PolarHBondContact O-OG1 2.91Å; E1171-T1174 WeakPolarHBondContact O-CB 3.5Å; E1171-T1174 PolarHBondContact O-N 3.41Å; R1172-T1174 VanDerWaalsContact C-N 3.31Å; T1174-V1176 VanDerWaalsContact C-N 3.32Å; T1174-V1176 PolarHBondContact O-N 3.17Å; T1174-M1177 WeakPolarHBondContact O-CB 3.4Å; T1174-M1177 PolarHBondContact O-N 2.87Å; T1174-E1178 PolarHBondContact O-N 3.31Å
1175Y91.1Very high91.2Very high149 Ų149107.4 Ų107.458%0.58452%0.524SS*.Hα-helixtrans-60.3-37.4174.6-71.6-57.8000113.1E1171 R1172 M1177 E1178 V1179E1171-Y1175 WeakPolarHBondContact O-CD2 3.46Å; E1171-Y1175 PolarHBondContact O-N 3.34Å; R1172-Y1175 PolarHBondContact O-N 3.35Å; Y1175-M1177 VanDerWaalsContact C-N 3.3Å; Y1175-M1177 PolarHBondContact O-N 2.96Å; Y1175-E1178 PolarHBondContact O-N 2.98Å; Y1175-V1179 WeakPolarHBondContact O-CB 3.29Å; Y1175-V1179 VanDerWaalsContact O-CG2 3.27Å; Y1175-V1179 WeakPolarHBondContact O-CG2 3.37Å; Y1175-V1179 PolarHBondContact O-N 2.89Å
1176V92.4Very high91.4Very high63 Ų63107.6 Ų107.638%0.38253%0.525SS..Hα-helixtrans-65.6-34.1174.9167.20000111.6R1172 S1173 T1174 R1180R1172-V1176 WeakPolarHBondContact O-CG2 3.33Å; R1172-V1176 PolarHBondContact O-N 2.99Å; S1173-V1176 PolarHBondContact O-N 3.32Å; T1174-V1176 VanDerWaalsContact C-N 3.32Å; T1174-V1176 PolarHBondContact O-N 3.17Å; V1176-R1180 VanDerWaalsContact O-CG 3.28Å; V1176-R1180 WeakPolarHBondContact O-CG 3.44Å; V1176-R1180 PolarHBondContact O-N 2.78Å; V1176-R1180 VanDerWaalsContact O-N 3.1Å
1177M90.6Very high91.3Very high123 Ų123105.9 Ų105.961%0.60652%0.52SS*.Hα-helixtrans-69-46174-173.6171.764.700111.7S1173 T1174 Y1175 V1179 R1180 E1181S1173-M1177 PolarHBondContact O-N 3.34Å; T1174-M1177 WeakPolarHBondContact O-CB 3.4Å; T1174-M1177 PolarHBondContact O-N 2.87Å; Y1175-M1177 VanDerWaalsContact C-N 3.3Å; Y1175-M1177 PolarHBondContact O-N 2.96Å; M1177-V1179 PolarHBondContact O-N 2.79Å; M1177-R1180 WeakPolarHBondContact O-CB 3.23Å; M1177-R1180 PolarHBondContact O-N 2.93Å; M1177-E1181 PolarHBondContact O-N 3.27Å
1178E92.6Very high91.2Very high104 Ų104104.7 Ų104.749%0.48652%0.516SS..Hα-helixtrans-59.4-43.5174.9-68.8179.4170.100112.1T1174 Y1175 R1180 E1181 L1182T1174-E1178 PolarHBondContact O-N 3.31Å; Y1175-E1178 PolarHBondContact O-N 2.98Å; E1178-R1180 VanDerWaalsContact C-N 3.33Å; E1178-R1180 PolarHBondContact O-N 3.2Å; E1178-E1181 PolarHBondContact O-N 3.26Å; E1178-L1182 WeakPolarHBondContact O-CB 3.43Å; E1178-L1182 WeakPolarHBondContact O-CG 3.21Å; E1178-L1182 PolarHBondContact O-N 2.77Å
1179V91.2Very high91.3Very high98 Ų98106 Ų10659%0.59452%0.52SS*.Hα-helixtrans-65.9-33.3177.2168.90000112.2Y1175 M1177 K1183Y1175-V1179 WeakPolarHBondContact O-CB 3.29Å; Y1175-V1179 VanDerWaalsContact O-CG2 3.27Å; Y1175-V1179 WeakPolarHBondContact O-CG2 3.37Å; Y1175-V1179 PolarHBondContact O-N 2.89Å; M1177-V1179 PolarHBondContact O-N 2.79Å; V1179-K1183 VanDerWaalsContact O-CB 3.29Å; V1179-K1183 WeakPolarHBondContact O-CB 3.17Å; V1179-K1183 PolarHBondContact O-N 3.48Å; V1179-K1183 VanDerWaalsContact O-N 3.09Å
1180R90.5Very high91.3Very high174 Ų174106.9 Ų106.966%0.65752%0.523SS*.Hα-helixtrans-66.7-45.5171.5-74.5172.1-167.5174.45.6111.4V1176 M1177 E1178 K1183 T1184V1176-R1180 VanDerWaalsContact O-CG 3.28Å; V1176-R1180 WeakPolarHBondContact O-CG 3.44Å; V1176-R1180 PolarHBondContact O-N 2.78Å; V1176-R1180 VanDerWaalsContact O-N 3.1Å; M1177-R1180 WeakPolarHBondContact O-CB 3.23Å; M1177-R1180 PolarHBondContact O-N 2.93Å; E1178-R1180 VanDerWaalsContact C-N 3.33Å; E1178-R1180 PolarHBondContact O-N 3.2Å; R1180-K1183 WeakPolarHBondContact O-CB 3.13Å; R1180-K1183 PolarHBondContact O-N 3.26Å; R1180-K1183 VanDerWaalsContact O-N 3.16Å; R1180-T1184 PolarHBondContact O-N 3.4Å; R1180-T1184 PolarHBondContact O-OG1 3.04Å; R1180-T1184 VanDerWaalsContact O-OG1 3.14Å
1181E91.5Very high91.3Very high99 Ų99103.8 Ų103.846%0.46351%0.514SS..Hα-helixtrans-62.3-48.2-179.7-179.751.9-146.900111.6M1177 E1178 K1183 T1184 Q1185M1177-E1181 PolarHBondContact O-N 3.27Å; E1178-E1181 PolarHBondContact O-N 3.26Å; E1181-K1183 VanDerWaalsContact C-N 3.25Å; E1181-K1183 PolarHBondContact O-N 3.43Å; E1181-T1184 WeakPolarHBondContact O-CB 3.39Å; E1181-T1184 PolarHBondContact O-N 3.39Å; E1181-Q1185 WeakPolarHBondContact O-CG 3.39Å; E1181-Q1185 PolarHBondContact O-N 2.99Å; E1181-Q1185 PolarHBondContact OE1-NE2 3.02Å
1182L92.9Very high91.3Very high108 Ų108104.9 Ų104.957%0.56552%0.517SS*.Hα-helixtrans-59.1-35.5173.5-69.2171.2000112.4E1178 Q1185 L1186E1178-L1182 WeakPolarHBondContact O-CB 3.43Å; E1178-L1182 WeakPolarHBondContact O-CG 3.21Å; E1178-L1182 PolarHBondContact O-N 2.77Å; L1182-Q1185 PolarHBondContact O-N 2.82Å; L1182-L1186 WeakPolarHBondContact O-CB 3.36Å; L1182-L1186 PolarHBondContact O-N 3.48Å
1183K91.5Very high91.3Very high135 Ų135101.9 Ų101.959%0.58751%0.513SS*.Hα-helixtrans-69.3-36.3174.4-175.6172-179.4176.20112.5V1179 R1180 E1181 L1186 N1187V1179-K1183 VanDerWaalsContact O-CB 3.29Å; V1179-K1183 WeakPolarHBondContact O-CB 3.17Å; V1179-K1183 PolarHBondContact O-N 3.48Å; V1179-K1183 VanDerWaalsContact O-N 3.09Å; R1180-K1183 WeakPolarHBondContact O-CB 3.13Å; R1180-K1183 PolarHBondContact O-N 3.26Å; R1180-K1183 VanDerWaalsContact O-N 3.16Å; E1181-K1183 VanDerWaalsContact C-N 3.25Å; E1181-K1183 PolarHBondContact O-N 3.43Å; K1183-L1186 PolarHBondContact O-N 3.11Å; K1183-N1187 WeakPolarHBondContact O-CB 3.48Å; K1183-N1187 PolarHBondContact O-N 3.11Å; K1183-N1187 PolarHBondContact O-ND2 2.84Å
1184T91.1Very high91.3Very high68 Ų68103.4 Ų103.442%0.41751%0.512SS..Hα-helixtrans-62.6-48.1172.3-56.10000110.7R1180 E1181 L1186 N1187 E1188R1180-T1184 PolarHBondContact O-N 3.4Å; R1180-T1184 PolarHBondContact O-OG1 3.04Å; R1180-T1184 VanDerWaalsContact O-OG1 3.14Å; E1181-T1184 WeakPolarHBondContact O-CB 3.39Å; E1181-T1184 PolarHBondContact O-N 3.39Å; T1184-L1186 VanDerWaalsContact C-N 3.32Å; T1184-L1186 PolarHBondContact O-N 3.07Å; T1184-N1187 PolarHBondContact O-N 3.33Å; T1184-N1187 VanDerWaalsContact O-N 3.16Å; T1184-E1188 PolarHBondContact O-N 3.49Å
1185Q92.3Very high91.2Very high95 Ų95104.8 Ų104.844%0.44452%0.517SS..Hα-helixtrans-63-36.6178.1-65.1176.317.500112.5E1181 L1182 E1188 T1189E1181-Q1185 WeakPolarHBondContact O-CG 3.39Å; E1181-Q1185 PolarHBondContact O-N 2.99Å; E1181-Q1185 PolarHBondContact OE1-NE2 3.02Å; L1182-Q1185 PolarHBondContact O-N 2.82Å; Q1185-E1188 PolarHBondContact O-N 3.32Å; Q1185-T1189 WeakPolarHBondContact O-CG2 3.45Å; Q1185-T1189 PolarHBondContact O-N 3.15Å; Q1185-T1189 PolarHBondContact O-OG1 2.86Å
1186L92.4Very high91.1Very high114 Ų114102.2 Ų102.260%0.59751%0.51SS*.Hα-helixtrans-65.9-41.7173.1-174.962.2000112.2L1182 K1183 T1184 T1189 H1190L1182-L1186 WeakPolarHBondContact O-CB 3.36Å; L1182-L1186 PolarHBondContact O-N 3.48Å; K1183-L1186 PolarHBondContact O-N 3.11Å; T1184-L1186 VanDerWaalsContact C-N 3.32Å; T1184-L1186 PolarHBondContact O-N 3.07Å; L1186-T1189 WeakPolarHBondContact CA-OG1 3.41Å; L1186-T1189 PolarHBondContact O-N 3.09Å; L1186-T1189 PolarHBondContact O-OG1 2.9Å; L1186-T1189 VanDerWaalsContact O-OG1 3.06Å; L1186-H1190 WeakPolarHBondContact O-CB 3.3Å; L1186-H1190 PolarHBondContact O-N 3.24Å
1187N88.8Confident90.8Very high97 Ų97105.2 Ų105.252%0.51952%0.52SS..Hα-helixtrans-65.6-41175.6-71.2-15.7000111.8K1183 T1184 S1191K1183-N1187 WeakPolarHBondContact O-CB 3.48Å; K1183-N1187 PolarHBondContact O-N 3.11Å; K1183-N1187 PolarHBondContact O-ND2 2.84Å; T1184-N1187 PolarHBondContact O-N 3.33Å; T1184-N1187 VanDerWaalsContact O-N 3.16Å; N1187-S1191 WeakPolarHBondContact O-CB 3.4Å; N1187-S1191 PolarHBondContact O-N 3.46Å
1188E92.4Very high90.7Very high98 Ų98103 Ų10346%0.45851%0.513SS..Hα-helixtrans-62.6-45.9175.1-85.6-161.8-150.900112.6T1184 Q1185 S1191 K1192T1184-E1188 PolarHBondContact O-N 3.49Å; Q1185-E1188 PolarHBondContact O-N 3.32Å; E1188-S1191 PolarHBondContact O-N 3.04Å; E1188-K1192 WeakPolarHBondContact O-CD 3.35Å; E1188-K1192 VanDerWaalsContact O-CG 3.28Å; E1188-K1192 WeakPolarHBondContact O-CG 3.5Å; E1188-K1192 PolarHBondContact O-N 3.35Å; E1188-K1192 IonicContact OE2-NZ 3.6Å; E1188-K1192 PolarHBondContact OE2-NZ 2.92Å
1189T91.8Very high90.5Very high79 Ų79102.5 Ų102.549%0.48551%0.511SS..Hα-helixtrans-67.5-37.8179.646.30000111.6Q1185 L1186 K1192 L1193Q1185-T1189 WeakPolarHBondContact O-CG2 3.45Å; Q1185-T1189 PolarHBondContact O-N 3.15Å; Q1185-T1189 PolarHBondContact O-OG1 2.86Å; L1186-T1189 WeakPolarHBondContact CA-OG1 3.41Å; L1186-T1189 PolarHBondContact O-N 3.09Å; L1186-T1189 PolarHBondContact O-OG1 2.9Å; L1186-T1189 VanDerWaalsContact O-OG1 3.06Å; T1189-K1192 PolarHBondContact O-N 2.94Å; T1189-L1193 WeakPolarHBondContact O-CB 3.38Å; T1189-L1193 PolarHBondContact O-N 3.28Å
1190H89.2Confident90.2Very high123 Ų123105.1 Ų105.157%0.56951%0.51SS*.Hα-helixtrans-62.9-40.4170.6-169.2-37.7000112.2L1186 Q1194L1186-H1190 WeakPolarHBondContact O-CB 3.3Å; L1186-H1190 PolarHBondContact O-N 3.24Å; H1190-Q1194 VanDerWaalsContact O-CB 3.32Å; H1190-Q1194 WeakPolarHBondContact O-CB 3.3Å; H1190-Q1194 PolarHBondContact O-N 3.48Å
1191S90.6Very high90Very high60 Ų60103.3 Ų103.342%0.4251%0.507SS..Hα-helixtrans-65.3-45.2177.1-176.50000111.9N1187 E1188 Q1194 N1195N1187-S1191 WeakPolarHBondContact O-CB 3.4Å; N1187-S1191 PolarHBondContact O-N 3.46Å; E1188-S1191 PolarHBondContact O-N 3.04Å; S1191-Q1194 PolarHBondContact O-N 3.14Å; S1191-N1195 VanDerWaalsContact O-CG 3.27Å; S1191-N1195 PolarHBondContact O-N 3.1Å; S1191-N1195 PolarHBondContact O-ND2 3.41Å
1192K91.7Very high89.9Confident111 Ų111103.5 Ų103.548%0.48351%0.506SS..Hα-helixtrans-58.8-48.8174.6-70.7161-171.1164.30111.2E1188 T1189 Q1194 N1195 E1196E1188-K1192 WeakPolarHBondContact O-CD 3.35Å; E1188-K1192 VanDerWaalsContact O-CG 3.28Å; E1188-K1192 WeakPolarHBondContact O-CG 3.5Å; E1188-K1192 PolarHBondContact O-N 3.35Å; E1188-K1192 IonicContact OE2-NZ 3.6Å; E1188-K1192 PolarHBondContact OE2-NZ 2.92Å; T1189-K1192 PolarHBondContact O-N 2.94Å; K1192-Q1194 VanDerWaalsContact C-N 3.33Å; K1192-Q1194 PolarHBondContact O-N 3.19Å; K1192-N1195 PolarHBondContact O-N 3.09Å; K1192-E1196 PolarHBondContact O-N 3.35Å
1193L90Very high89.7Confident100 Ų100102.5 Ų102.552%0.52451%0.505SS..Hα-helixtrans-61.8-38.2176.9-17763.8000112.6T1189 E1196 Q1197T1189-L1193 WeakPolarHBondContact O-CB 3.38Å; T1189-L1193 PolarHBondContact O-N 3.28Å; L1193-E1196 PolarHBondContact O-N 3.04Å; L1193-Q1197 WeakPolarHBondContact O-CB 3.24Å; L1193-Q1197 PolarHBondContact O-N 3.47Å
1194Q90.8Very high89.5Confident112 Ų11298.6 Ų98.652%0.52350%0.498SS..Hα-helixtrans-66.4-40.1176179.9173.5-32.600112H1190 S1191 K1192 Q1197 T1198H1190-Q1194 VanDerWaalsContact O-CB 3.32Å; H1190-Q1194 WeakPolarHBondContact O-CB 3.3Å; H1190-Q1194 PolarHBondContact O-N 3.48Å; S1191-Q1194 PolarHBondContact O-N 3.14Å; K1192-Q1194 VanDerWaalsContact C-N 3.33Å; K1192-Q1194 PolarHBondContact O-N 3.19Å; Q1194-Q1197 WeakPolarHBondContact O-CB 3.29Å; Q1194-Q1197 PolarHBondContact O-N 2.72Å; Q1194-T1198 PolarHBondContact O-N 3.5Å; Q1194-T1198 PolarHBondContact O-OG1 3.44Å
1195N89.2Confident89.2Confident91 Ų9199.1 Ų99.149%0.48750%0.498SS..Hα-helixtrans-64.8-45176.1-66.8-22.5000111.1S1191 K1192 Q1197 T1198 E1199S1191-N1195 VanDerWaalsContact O-CG 3.27Å; S1191-N1195 PolarHBondContact O-N 3.1Å; S1191-N1195 PolarHBondContact O-ND2 3.41Å; K1192-N1195 PolarHBondContact O-N 3.09Å; N1195-Q1197 VanDerWaalsContact C-N 3.33Å; N1195-Q1197 PolarHBondContact O-N 3.32Å; N1195-T1198 WeakPolarHBondContact CA-OG1 3.47Å; N1195-T1198 PolarHBondContact O-N 2.85Å; N1195-T1198 VanDerWaalsContact O-N 3.16Å; N1195-T1198 PolarHBondContact O-OG1 2.93Å; N1195-E1199 PolarHBondContact O-N 2.85Å
1196E88.8Confident89Confident94 Ų9498.1 Ų98.144%0.43950%0.495SS..Hα-helixtrans-57.6-44171-77.2-174.1-127.200112.2K1192 L1193 T1198 E1199 R1200K1192-E1196 PolarHBondContact O-N 3.35Å; L1193-E1196 PolarHBondContact O-N 3.04Å; E1196-T1198 VanDerWaalsContact C-N 3.27Å; E1196-T1198 PolarHBondContact O-N 3.2Å; E1196-E1199 PolarHBondContact O-N 3.11Å; E1196-R1200 VanDerWaalsContact O-CB 3.31Å; E1196-R1200 WeakPolarHBondContact O-CB 3.45Å; E1196-R1200 WeakPolarHBondContact O-CG 3.3Å; E1196-R1200 PolarHBondContact O-N 2.75Å; E1196-R1200 IonicContact OE2-CZ 2.66Å; E1196-R1200 IonicContact OE2-NE 2.66Å; E1196-R1200 IonicContact OE2-NH2 3.66Å; E1196-R1200 PolarHBondContact OE2-NH2 3.28Å
1197Q86.2Confident88.8Confident127 Ų12798 Ų9859%0.59350%0.495SS*.Hα-helixtrans-58.7-39.2176.9-167.482.5-100111.4L1193 Q1194 N1195 K1201L1193-Q1197 WeakPolarHBondContact O-CB 3.24Å; L1193-Q1197 PolarHBondContact O-N 3.47Å; Q1194-Q1197 WeakPolarHBondContact O-CB 3.29Å; Q1194-Q1197 PolarHBondContact O-N 2.72Å; N1195-Q1197 VanDerWaalsContact C-N 3.33Å; N1195-Q1197 PolarHBondContact O-N 3.32Å; Q1197-K1201 WeakPolarHBondContact O-CB 3.49Å; Q1197-K1201 PolarHBondContact O-N 3.18Å; Q1197-K1201 VanDerWaalsContact O-N 3.14Å
1198T89.1Confident88.6Confident77 Ų7798.6 Ų98.647%0.47249%0.494SS..Hα-helixtrans-71.8-40.6176.950.60000113.5Q1194 N1195 E1196 K1201 K1202Q1194-T1198 PolarHBondContact O-N 3.5Å; Q1194-T1198 PolarHBondContact O-OG1 3.44Å; N1195-T1198 WeakPolarHBondContact CA-OG1 3.47Å; N1195-T1198 PolarHBondContact O-N 2.85Å; N1195-T1198 VanDerWaalsContact O-N 3.16Å; N1195-T1198 PolarHBondContact O-OG1 2.93Å; E1196-T1198 VanDerWaalsContact C-N 3.27Å; E1196-T1198 PolarHBondContact O-N 3.2Å; T1198-K1201 PolarHBondContact O-N 3.4Å; T1198-K1202 WeakPolarHBondContact O-CB 3.47Å; T1198-K1202 PolarHBondContact O-N 2.96Å
1199E89.5Confident88.4Confident93 Ų9399.3 Ų99.344%0.43550%0.496SS..Hα-helixtrans-70.6-40.8177-76.2-62.6147.700111.8N1195 E1196 K1201 K1202 V1203N1195-E1199 PolarHBondContact O-N 2.85Å; E1196-E1199 PolarHBondContact O-N 3.11Å; E1199-K1201 VanDerWaalsContact C-N 3.26Å; E1199-K1201 PolarHBondContact O-N 2.65Å; E1199-K1202 PolarHBondContact O-N 3.33Å; E1199-K1202 VanDerWaalsContact O-N 3.13Å; E1199-K1202 IonicContact OE1-NZ 3.81Å; E1199-K1202 PolarHBondContact OE1-NZ 2.71Å; E1199-K1202 IonicContact OE2-NZ 2.62Å; E1199-K1202 PolarHBondContact OE2-NZ 3.01Å; E1199-V1203 WeakPolarHBondContact O-CG2 3.27Å; E1199-V1203 PolarHBondContact O-N 3.12Å
1200R84.2Confident87.9Confident152 Ų15298.2 Ų98.257%0.57449%0.494SS*.Hα-helixtrans-57-39.2171-70.2171.5-167.8-156.36.8111.8E1196 A1204E1196-R1200 VanDerWaalsContact O-CB 3.31Å; E1196-R1200 WeakPolarHBondContact O-CB 3.45Å; E1196-R1200 WeakPolarHBondContact O-CG 3.3Å; E1196-R1200 PolarHBondContact O-N 2.75Å; E1196-R1200 IonicContact OE2-CZ 2.66Å; E1196-R1200 IonicContact OE2-NE 2.66Å; E1196-R1200 IonicContact OE2-NH2 3.66Å; E1196-R1200 PolarHBondContact OE2-NH2 3.28Å; R1200-A1204 WeakPolarHBondContact O-CB 3.34Å; R1200-A1204 PolarHBondContact O-N 3.31Å; R1200-A1204 VanDerWaalsContact O-N 3.08Å
1201K85.9Confident87.4Confident137 Ų13797.1 Ų97.160%0.59649%0.49SS*.Hα-helixtrans-66.6-46174.5-176.2-179.7174.9-175.40111.9Q1197 T1198 E1199 V1203 A1204 D1205Q1197-K1201 WeakPolarHBondContact O-CB 3.49Å; Q1197-K1201 PolarHBondContact O-N 3.18Å; Q1197-K1201 VanDerWaalsContact O-N 3.14Å; T1198-K1201 PolarHBondContact O-N 3.4Å; E1199-K1201 VanDerWaalsContact C-N 3.26Å; E1199-K1201 PolarHBondContact O-N 2.65Å; K1201-V1203 PolarHBondContact O-N 2.8Å; K1201-A1204 WeakPolarHBondContact O-CB 3.12Å; K1201-A1204 PolarHBondContact O-N 3.12Å; K1201-A1204 VanDerWaalsContact O-N 3.12Å; K1201-D1205 PolarHBondContact O-N 3.45Å
1202K89.6Confident87.2Confident102 Ų10299.6 Ų99.644%0.44350%0.495SS..Hα-helixtrans-59.9-44177.6172.6172152-124.20112T1198 E1199 A1204 D1205 D1206T1198-K1202 WeakPolarHBondContact O-CB 3.47Å; T1198-K1202 PolarHBondContact O-N 2.96Å; E1199-K1202 PolarHBondContact O-N 3.33Å; E1199-K1202 VanDerWaalsContact O-N 3.13Å; E1199-K1202 IonicContact OE1-NZ 3.81Å; E1199-K1202 PolarHBondContact OE1-NZ 2.71Å; E1199-K1202 IonicContact OE2-NZ 2.62Å; E1199-K1202 PolarHBondContact OE2-NZ 3.01Å; K1202-A1204 VanDerWaalsContact C-N 3.33Å; K1202-A1204 PolarHBondContact O-N 3.39Å; K1202-D1205 PolarHBondContact O-N 3.16Å; K1202-D1206 WeakPolarHBondContact O-CB 3.44Å; K1202-D1206 PolarHBondContact O-N 3.1Å
1203V89.2Confident86.8Confident88 Ų8897.7 Ų97.753%0.53350%0.495SS..Hα-helixtrans-61.1-39.4172.61720000111.7E1199 K1201 L1207E1199-V1203 WeakPolarHBondContact O-CG2 3.27Å; E1199-V1203 PolarHBondContact O-N 3.12Å; K1201-V1203 PolarHBondContact O-N 2.8Å; V1203-L1207 VanDerWaalsContact O-CB 3.24Å; V1203-L1207 WeakPolarHBondContact O-CB 3.25Å; V1203-L1207 PolarHBondContact O-N 2.94Å
1204A86.6Confident86.3Confident53 Ų5397.8 Ų97.844%0.43850%0.496SS..Hα-helixtrans-67.4-40.4174.700000112.9R1200 K1201 K1202 H1208R1200-A1204 WeakPolarHBondContact O-CB 3.34Å; R1200-A1204 PolarHBondContact O-N 3.31Å; R1200-A1204 VanDerWaalsContact O-N 3.08Å; K1201-A1204 WeakPolarHBondContact O-CB 3.12Å; K1201-A1204 PolarHBondContact O-N 3.12Å; K1201-A1204 VanDerWaalsContact O-N 3.12Å; K1202-A1204 VanDerWaalsContact C-N 3.33Å; K1202-A1204 PolarHBondContact O-N 3.39Å; A1204-H1208 WeakPolarHBondContact O-CB 3.36Å; A1204-H1208 PolarHBondContact O-N 3.08Å
1205D84.9Confident85.8Confident79 Ų7997 Ų9742%0.42250%0.495SS..Hα-helixtrans-65-40.5175.4-72.4-30000111.4K1201 K1202 H1208 K1209K1201-D1205 PolarHBondContact O-N 3.45Å; K1202-D1205 PolarHBondContact O-N 3.16Å; D1205-H1208 PolarHBondContact O-N 3.2Å; D1205-K1209 WeakPolarHBondContact O-CE 3.45Å; D1205-K1209 WeakPolarHBondContact O-CG 3.11Å; D1205-K1209 PolarHBondContact O-N 3.18Å; D1205-K1209 VanDerWaalsContact O-N 3.08Å
1206D87.6Confident85.4Confident74 Ų7495.2 Ų95.240%0.39649%0.49SS..Hα-helixtrans-71.7-38.5176.5-73.9-29.6000112.6K1202 H1208 K1209 A1210K1202-D1206 WeakPolarHBondContact O-CB 3.44Å; K1202-D1206 PolarHBondContact O-N 3.1Å; D1206-H1208 VanDerWaalsContact C-N 3.27Å; D1206-H1208 PolarHBondContact O-N 3.46Å; D1206-K1209 PolarHBondContact O-N 3.05Å; D1206-K1209 WeakPolarHBondContact OD1-CD 3.48Å; D1206-K1209 WeakPolarHBondContact OD1-CE 3.3Å; D1206-K1209 IonicContact OD1-NZ 3.93Å; D1206-K1209 PolarHBondContact OD1-NZ 2.62Å; D1206-A1210 PolarHBondContact O-N 2.86Å
1207L88.1Confident84.8Confident112 Ų11295.2 Ų95.259%0.58649%0.492SS*.Hα-helixtrans-59.1-39.5169.4179.462.7000111.2V1203 A1210 Q1211V1203-L1207 VanDerWaalsContact O-CB 3.24Å; V1203-L1207 WeakPolarHBondContact O-CB 3.25Å; V1203-L1207 PolarHBondContact O-N 2.94Å; L1207-A1210 PolarHBondContact O-N 2.83Å; L1207-Q1211 WeakPolarHBondContact O-CB 3.38Å; L1207-Q1211 PolarHBondContact O-N 2.94Å
1208H84.6Confident84.2Confident109 Ų10995 Ų9551%0.50549%0.491SS..Hα-helixtrans-66-40.7176.1-166.978000112.3A1204 D1205 D1206 A1210 Q1211 Q1212A1204-H1208 WeakPolarHBondContact O-CB 3.36Å; A1204-H1208 PolarHBondContact O-N 3.08Å; D1205-H1208 PolarHBondContact O-N 3.2Å; D1206-H1208 VanDerWaalsContact C-N 3.27Å; D1206-H1208 PolarHBondContact O-N 3.46Å; H1208-A1210 VanDerWaalsContact C-N 3.34Å; H1208-A1210 PolarHBondContact O-N 2.6Å; H1208-Q1211 WeakPolarHBondContact O-CB 3.24Å; H1208-Q1211 PolarHBondContact O-N 2.94Å; H1208-Q1212 PolarHBondContact CD2-NE2 2.92Å; H1208-Q1212 PolarHBondContact NE2-NE2 3.47Å; H1208-Q1212 WeakPolarHBondContact O-CG 3.39Å; H1208-Q1212 PolarHBondContact O-N 3.3Å
1209K87.9Confident83.5Confident113 Ų11394.6 Ų94.649%0.49149%0.491SS..Hα-helixtrans-62.2-40.1172.7-64.7163.3-151.5164.10111.9D1205 D1206 Q1212 S1213D1205-K1209 WeakPolarHBondContact O-CE 3.45Å; D1205-K1209 WeakPolarHBondContact O-CG 3.11Å; D1205-K1209 PolarHBondContact O-N 3.18Å; D1205-K1209 VanDerWaalsContact O-N 3.08Å; D1206-K1209 PolarHBondContact O-N 3.05Å; D1206-K1209 WeakPolarHBondContact OD1-CD 3.48Å; D1206-K1209 WeakPolarHBondContact OD1-CE 3.3Å; D1206-K1209 IonicContact OD1-NZ 3.93Å; D1206-K1209 PolarHBondContact OD1-NZ 2.62Å; K1209-Q1212 PolarHBondContact O-N 3.24Å; K1209-S1213 WeakPolarHBondContact O-CB 3.42Å; K1209-S1213 PolarHBondContact O-N 2.87Å; K1209-S1213 PolarHBondContact O-OG 3.33Å
1210A83.3Confident82.8Confident55 Ų5596.6 Ų96.646%0.45550%0.498SS..Hα-helixtrans-63.5-44.2174.500000111.5D1206 L1207 H1208 Q1212 S1213 L1214D1206-A1210 PolarHBondContact O-N 2.86Å; L1207-A1210 PolarHBondContact O-N 2.83Å; H1208-A1210 VanDerWaalsContact C-N 3.34Å; H1208-A1210 PolarHBondContact O-N 2.6Å; A1210-Q1212 PolarHBondContact O-N 3.46Å; A1210-S1213 WeakPolarHBondContact O-CB 3.2Å; A1210-S1213 PolarHBondContact O-N 2.93Å; A1210-L1214 WeakPolarHBondContact O-CB 3.32Å; A1210-L1214 PolarHBondContact O-N 3.24Å
1211Q78.4Confident82.1Confident100 Ų10094.5 Ų94.547%0.46750%0.497SS..Hα-helixtrans-60.5-44.3176-160.177.311.700112L1207 H1208 S1213 L1214 N1215L1207-Q1211 WeakPolarHBondContact O-CB 3.38Å; L1207-Q1211 PolarHBondContact O-N 2.94Å; H1208-Q1211 WeakPolarHBondContact O-CB 3.24Å; H1208-Q1211 PolarHBondContact O-N 2.94Å; Q1211-S1213 VanDerWaalsContact C-N 3.35Å; Q1211-L1214 PolarHBondContact O-N 2.87Å; Q1211-N1215 VanDerWaalsContact O-CG 3.24Å; Q1211-N1215 PolarHBondContact O-N 3.41Å; Q1211-N1215 PolarHBondContact O-ND2 3.44Å
1212Q85.6Confident81.1Confident113 Ų11390.9 Ų90.953%0.52849%0.489SS..Hα-helixtrans-62.4-41174.5-70.9-17710.600112H1208 K1209 A1210 N1215 S1216H1208-Q1212 PolarHBondContact CD2-NE2 2.92Å; H1208-Q1212 PolarHBondContact NE2-NE2 3.47Å; H1208-Q1212 WeakPolarHBondContact O-CG 3.39Å; H1208-Q1212 PolarHBondContact O-N 3.3Å; K1209-Q1212 PolarHBondContact O-N 3.24Å; A1210-Q1212 PolarHBondContact O-N 3.46Å; Q1212-N1215 PolarHBondContact O-N 3.32Å; Q1212-S1216 PolarHBondContact O-N 2.71Å
1213S83.1Confident79.7Confident70 Ų7091.9 Ų91.949%0.4950%0.498SS..Hα-helixtrans-64.7-43.4177.8-58.70000111.8K1209 A1210 Q1211 S1216 I1217K1209-S1213 WeakPolarHBondContact O-CB 3.42Å; K1209-S1213 PolarHBondContact O-N 2.87Å; K1209-S1213 PolarHBondContact O-OG 3.33Å; A1210-S1213 WeakPolarHBondContact O-CB 3.2Å; A1210-S1213 PolarHBondContact O-N 2.93Å; Q1211-S1213 VanDerWaalsContact C-N 3.35Å; S1213-S1216 WeakPolarHBondContact O-CB 3.5Å; S1213-S1216 PolarHBondContact O-N 3.17Å; S1213-I1217 WeakPolarHBondContact O-CG1 3.4Å; S1213-I1217 PolarHBondContact O-N 2.75Å
1214L80.6Confident78.1Confident103 Ų10394.7 Ų94.754%0.53950%0.504SS..Hα-helixtrans-59.9-45.5174.3-170.574.5000111.4A1210 Q1211 S1216 I1217 H1218A1210-L1214 WeakPolarHBondContact O-CB 3.32Å; A1210-L1214 PolarHBondContact O-N 3.24Å; Q1211-L1214 PolarHBondContact O-N 2.87Å; L1214-S1216 VanDerWaalsContact C-N 3.33Å; L1214-S1216 PolarHBondContact O-N 3.21Å; L1214-I1217 PolarHBondContact O-N 3.32Å; L1214-H1218 PolarHBondContact O-N 2.9Å
1215N80.4Confident76.6Confident95 Ų9594.8 Ų94.851%0.50850%0.504SS..Hα-helixtrans-62.7-38.1176.2-70.4-18.7000112.2Q1211 Q1212 H1218 S1219Q1211-N1215 VanDerWaalsContact O-CG 3.24Å; Q1211-N1215 PolarHBondContact O-N 3.41Å; Q1211-N1215 PolarHBondContact O-ND2 3.44Å; Q1212-N1215 PolarHBondContact O-N 3.32Å; N1215-H1218 PolarHBondContact O-N 2.88Å; N1215-S1219 WeakPolarHBondContact O-CB 3.47Å; N1215-S1219 PolarHBondContact O-N 3.42Å
1216S78.8Confident75.1Confident53 Ų5393.9 Ų93.937%0.37151%0.507SS..Hα-helixtrans-64.1-41.2174.3-170.30000112.1Q1212 S1213 L1214 K1220Q1212-S1216 PolarHBondContact O-N 2.71Å; S1213-S1216 WeakPolarHBondContact O-CB 3.5Å; S1213-S1216 PolarHBondContact O-N 3.17Å; L1214-S1216 VanDerWaalsContact C-N 3.33Å; L1214-S1216 PolarHBondContact O-N 3.21Å; S1216-K1220 VanDerWaalsContact O-CG 3.31Å; S1216-K1220 WeakPolarHBondContact O-CG 3.42Å; S1216-K1220 PolarHBondContact O-N 3.35Å; S1216-K1220 VanDerWaalsContact O-N 3.1Å
1217I77.9Confident73.4Confident95 Ų9592.3 Ų92.349%0.48751%0.509SS..Hα-helixtrans-64.7-47.1174.4-68.2164000110.5S1213 L1214 S1219 K1220 I1221S1213-I1217 WeakPolarHBondContact O-CG1 3.4Å; S1213-I1217 PolarHBondContact O-N 2.75Å; L1214-I1217 PolarHBondContact O-N 3.32Å; I1217-S1219 VanDerWaalsContact C-N 3.33Å; I1217-S1219 PolarHBondContact O-N 3.4Å; I1217-K1220 PolarHBondContact O-N 2.95Å; I1217-I1221 HydrophobicContact CG2-CD1 3.79Å; I1217-I1221 HydrophobicContact CG2-CG1 4.46Å; I1217-I1221 WeakPolarHBondContact O-CG1 3.35Å; I1217-I1221 PolarHBondContact O-N 3.21Å
1218H73Confident71.5Confident123 Ų12392.2 Ų92.257%0.56951%0.509SS*.Hα-helixtrans-61.1-40.8178.5-164.5-48.8000111.9L1214 N1215 I1221 S1222L1214-H1218 PolarHBondContact O-N 2.9Å; N1215-H1218 PolarHBondContact O-N 2.88Å; H1218-I1221 PolarHBondContact O-N 3.28Å; H1218-S1222 PolarHBondContact ND1-OG 2.98Å; H1218-S1222 PolarHBondContact O-N 2.99Å; H1218-S1222 PolarHBondContact O-OG 2.94Å; H1218-S1222 VanDerWaalsContact O-OG 3.13Å
1219S74.4Confident69.6Low67 Ų6792.2 Ų92.247%0.46952%0.517SS..Hα-helixtrans-62.1-42.5175.1-1760000112.2N1215 I1217 S1222 L1223N1215-S1219 WeakPolarHBondContact O-CB 3.47Å; N1215-S1219 PolarHBondContact O-N 3.42Å; I1217-S1219 VanDerWaalsContact C-N 3.33Å; I1217-S1219 PolarHBondContact O-N 3.4Å; S1219-S1222 PolarHBondContact O-N 3.21Å; S1219-L1223 WeakPolarHBondContact O-CB 3.34Å; S1219-L1223 PolarHBondContact O-N 2.9Å
1220K74.4Confident67.5Low136 Ų13692.8 Ų92.859%0.59153%0.53SS*.Hα-helixtrans-64.3-38.3174.6-71.4166.5-177.3172.10112.7S1216 I1217 L1223 K1224S1216-K1220 VanDerWaalsContact O-CG 3.31Å; S1216-K1220 WeakPolarHBondContact O-CG 3.42Å; S1216-K1220 PolarHBondContact O-N 3.35Å; S1216-K1220 VanDerWaalsContact O-N 3.1Å; I1217-K1220 PolarHBondContact O-N 2.95Å; K1220-L1223 PolarHBondContact O-N 3.16Å; K1220-K1224 PolarHBondContact O-N 2.84Å
1221I69.9Low65.6Low108 Ų10896.3 Ų96.355%0.55455%0.545SS*.Hα-helixtrans-65.3-45.3175-68.7167.6000110.4I1217 H1218 L1223 K1224 A1225I1217-I1221 HydrophobicContact CG2-CD1 3.79Å; I1217-I1221 HydrophobicContact CG2-CG1 4.46Å; I1217-I1221 WeakPolarHBondContact O-CG1 3.35Å; I1217-I1221 PolarHBondContact O-N 3.21Å; H1218-I1221 PolarHBondContact O-N 3.28Å; I1221-L1223 PolarHBondContact O-N 3.04Å; I1221-K1224 PolarHBondContact O-N 3.45Å; I1221-A1225 PolarHBondContact O-N 2.84Å
1222S64.1Low64Low61 Ų6198.9 Ų98.943%0.42756%0.561SS.*Hα-helixtrans-62.2-40.4176-62.70000112.7H1218 S1219 A1225 A1226H1218-S1222 PolarHBondContact ND1-OG 2.98Å; H1218-S1222 PolarHBondContact O-N 2.99Å; H1218-S1222 PolarHBondContact O-OG 2.94Å; H1218-S1222 VanDerWaalsContact O-OG 3.13Å; S1219-S1222 PolarHBondContact O-N 3.21Å; S1222-A1225 PolarHBondContact O-N 3.32Å; S1222-A1226 WeakPolarHBondContact O-CB 3.21Å; S1222-A1226 PolarHBondContact O-N 3.03Å
1223L59.9Low61.6Low122 Ų122101.6 Ų101.664%0.63957%0.573SS**Hα-helixtrans-62.6-39.7173.3-91.1160.4000112.6S1219 K1220 I1221 A1226 G1227S1219-L1223 WeakPolarHBondContact O-CB 3.34Å; S1219-L1223 PolarHBondContact O-N 2.9Å; K1220-L1223 PolarHBondContact O-N 3.16Å; I1221-L1223 PolarHBondContact O-N 3.04Å; L1223-A1226 PolarHBondContact O-N 3.28Å; L1223-G1227 PolarHBondContact O-N 3.46Å; L1223-G1227 VanDerWaalsContact O-N 3.1Å
1224K57.5Low59.1Low148 Ų148105 Ų10564%0.64359%0.586SS**Hα-helixtrans-68-45.7177-167.9175.4-179.9-176.30111.9K1220 I1221 A1226 G1227 D1228K1220-K1224 PolarHBondContact O-N 2.84Å; I1221-K1224 PolarHBondContact O-N 3.45Å; K1224-A1226 VanDerWaalsContact C-N 3.28Å; K1224-A1226 PolarHBondContact O-N 2.81Å; K1224-G1227 PolarHBondContact O-N 2.98Å; K1224-D1228 PolarHBondContact O-N 3.49Å; K1224-D1228 VanDerWaalsContact O-N 3.13Å
1225A54.7Low56.9Low55 Ų55105.7 Ų105.746%0.45560%0.599SS.*Hα-helixtrans-59.8-36.9176.100000112.7I1221 S1222 T1229I1221-A1225 PolarHBondContact O-N 2.84Å; S1222-A1225 PolarHBondContact O-N 3.32Å; A1225-T1229 PolarHBondContact O-OG1 3.5Å
1226A53.1Low54.8Low59 Ų59108.5 Ų108.549%0.48862%0.615SS.*Hα-helixtrans-67.1-37.5173.500000112.8S1222 L1223 K1224 T1229S1222-A1226 WeakPolarHBondContact O-CB 3.21Å; S1222-A1226 PolarHBondContact O-N 3.03Å; L1223-A1226 PolarHBondContact O-N 3.28Å; K1224-A1226 VanDerWaalsContact C-N 3.28Å; K1224-A1226 PolarHBondContact O-N 2.81Å; A1226-T1229 PolarHBondContact O-N 2.85Å
1227G52.1Low52.6Low42 Ų42114.3 Ų114.343%0.43364%0.64SS.*Hα-helixtrans-62.8-43.7176.700000113.3L1223 K1224 T1229 V1230L1223-G1227 PolarHBondContact O-N 3.46Å; L1223-G1227 VanDerWaalsContact O-N 3.1Å; K1224-G1227 PolarHBondContact O-N 2.98Å; G1227-T1229 PolarHBondContact O-N 3.05Å; G1227-T1229 VanDerWaalsContact O-N 3.14Å; G1227-V1230 PolarHBondContact O-N 3.15Å
1228D47.6Very low50.5Low109 Ų109114.7 Ų114.758%0.58365%0.651SS**THydrogen-bonded Turntrans-69.8-7.4-179.6-63.8-27.7000113.3K1224K1224-D1228 PolarHBondContact O-N 3.49Å; K1224-D1228 VanDerWaalsContact O-N 3.13Å
1229T45.3Very low49.6Very low110 Ų110114 Ų11468%0.67566%0.657SS**THydrogen-bonded Turntrans-87.4-11.3-178-54.20000113.7A1225 A1226 G1227A1225-T1229 PolarHBondContact O-OG1 3.5Å; A1226-T1229 PolarHBondContact O-N 2.85Å; G1227-T1229 PolarHBondContact O-N 3.05Å; G1227-T1229 VanDerWaalsContact O-N 3.14Å
1230V43.5Very low47.7Very low125 Ų125119.4 Ų119.476%0.75868%0.675SS**SBendtrans-103.2-1.9-168.3-175.60000113.8G1227G1227-V1230 PolarHBondContact O-N 3.15Å
1231V43.7Very low45.8Very low129 Ų129121.9 Ų121.978%0.78269%0.691SS**SBendtrans-118.932.3-170.2-156.10000113.1
1232I44.5Very low44.7Very low153 Ų153126.3 Ų126.379%0.78571%0.709SS**  trans-130.886.7175.3-51.5-179000110.4
1233E35.3Very low43.5Very low170 Ų170127.7 Ų127.779%0.79472%0.719SS**  trans-150.8127.4159.6-145.6176.4-131.300109.8
1234N31.6Very low42.9Very low141 Ų141126.8 Ų126.875%0.75472%0.721SS**SBendtrans67.4115-179-39.7-78.1000114.4
1235S34.1Very low42.4Very low118 Ų118126.6 Ų126.683%0.82572%0.722SS**  cis-157.2162.231.9-51.20000112.6
1236D35.5Very low42.1Very low155 Ų155132.9 Ų132.983%0.82974%0.739SS**  trans-67.4146.8177.5-61.3-83.8000115.1
1237I32.8Very low41.9Very low175 Ų175137 Ų13790%0.89775%0.748SS**  -176.2158.6118-92157.1000109.6
1238S33Very low41.9Very low102 Ų102139.4 Ų139.471%0.71376%0.755SS**  trans-125169.5-165.7-165.40000110.8
1239P55.3Low42.1Very low110 Ų110141.2 Ų141.271%0.71476%0.761SS**  cis-122.4-150.7-31.627-3.8000111.1
1240E33.9Very low42.6Very low180 Ų180138.5 Ų138.584%0.84175%0.747SS**  trans70.590.3167-61-168.4136.300118.8
1241M33.7Very low43.3Very low187 Ų187136.6 Ų136.692%0.92174%0.736SS**  -170.9150.5105.4-97.9-161.4-63.400111.1
1242E47.2Very low43.9Very low201 Ų201133.7 Ų133.794%0.93972%0.721SS**  trans-76.6143.6173.4-63.1178.4123.800111
1243S38.8Very low44.7Very low90 Ų90132 Ų13263%0.62971%0.712SS**  trans-132.7142.5170.861.50000110.9E1245S1243-E1245 VanDerWaalsContact C-N 3.31Å; S1243-E1245 PolarHBondContact O-N 2.9Å
1244P47.5Very low46.1Very low104 Ų104128.6 Ų128.668%0.67570%0.7SS**THydrogen-bonded Turntrans-82.22.2-162.332.3-37.2000115.3K1246 E1247P1244-K1246 VanDerWaalsContact C-N 3.31Å; P1244-K1246 PolarHBondContact O-N 2.88Å; P1244-E1247 PolarHBondContact O-N 2.91Å
1245E47.7Very low48Very low144 Ų144127.6 Ų127.667%0.67369%0.691SS**Hα-helixtrans-77-12.9-168.3-59.5-171.3139.200114.5S1243 T1248 M1249S1243-E1245 VanDerWaalsContact C-N 3.31Å; S1243-E1245 PolarHBondContact O-N 2.9Å; E1245-T1248 PolarHBondContact O-OG1 3.4Å; E1245-M1249 PolarHBondContact O-N 3.38Å
1246K48.1Very low49.7Very low186 Ų186125 Ų12581%0.80967%0.67SS**Hα-helixtrans-78.2-28.8174-79-175.9176.6175.50113.4P1244 S1250P1244-K1246 VanDerWaalsContact C-N 3.31Å; P1244-K1246 PolarHBondContact O-N 2.88Å; K1246-S1250 WeakPolarHBondContact O-CB 3.45Å; K1246-S1250 PolarHBondContact O-N 2.63Å; K1246-S1250 PolarHBondContact O-OG 3.15Å
1247E49.8Very low51.4Low146 Ų146120.7 Ų120.768%0.68265%0.649SS**Hα-helixtrans-76.1-39.5174.8-74.6-163.7126.200111.9P1244 M1249 S1250 V1251P1244-E1247 PolarHBondContact O-N 2.91Å; E1247-M1249 VanDerWaalsContact C-N 3.34Å; E1247-M1249 PolarHBondContact O-N 3.43Å; E1247-S1250 PolarHBondContact O-N 3.21Å; E1247-S1250 PolarHBondContact O-OG 3.48Å; E1247-S1250 VanDerWaalsContact O-OG 3.1Å; E1247-V1251 WeakPolarHBondContact O-CB 3.37Å; E1247-V1251 VanDerWaalsContact O-CG2 3.29Å; E1247-V1251 WeakPolarHBondContact O-CG2 3.4Å; E1247-V1251 PolarHBondContact O-N 2.84Å
1248T51.2Low53.3Low93 Ų93115.9 Ų115.957%0.57163%0.628SS**Hα-helixtrans-63.7-38.5178.552.10000112.3E1245 S1252E1245-T1248 PolarHBondContact O-OG1 3.4Å; T1248-S1252 VanDerWaalsContact O-CB 3.23Å; T1248-S1252 WeakPolarHBondContact O-CB 3.35Å; T1248-S1252 PolarHBondContact O-N 3.46Å
1249M52Low55.1Low146 Ų146116.3 Ų116.372%0.71962%0.619SS**Hα-helixtrans-70.9-36.3172.4-74.8-139.8-69.100113.5E1245 E1247 L1253E1245-M1249 PolarHBondContact O-N 3.38Å; E1247-M1249 VanDerWaalsContact C-N 3.34Å; E1247-M1249 PolarHBondContact O-N 3.43Å; M1249-L1253 WeakPolarHBondContact O-CB 3.18Å; M1249-L1253 PolarHBondContact O-N 3Å
1250S55.5Low55.9Low53 Ų53116.4 Ų116.437%0.37161%0.613SS.*Hα-helixtrans-70.8-38.8177.675.80000112.1K1246 E1247 L1253 N1254K1246-S1250 WeakPolarHBondContact O-CB 3.45Å; K1246-S1250 PolarHBondContact O-N 2.63Å; K1246-S1250 PolarHBondContact O-OG 3.15Å; E1247-S1250 PolarHBondContact O-N 3.21Å; E1247-S1250 PolarHBondContact O-OG 3.48Å; E1247-S1250 VanDerWaalsContact O-OG 3.1Å; S1250-L1253 PolarHBondContact O-N 2.97Å; S1250-N1254 WeakPolarHBondContact O-CB 3.37Å; S1250-N1254 VanDerWaalsContact O-CG 3.26Å; S1250-N1254 PolarHBondContact O-N 3.33Å; S1250-N1254 PolarHBondContact O-ND2 2.91Å; S1250-N1254 VanDerWaalsContact O-ND2 3.09Å
1251V58.4Low57.7Low86 Ų86113.9 Ų113.952%0.52160%0.601SS.*Hα-helixtrans-63.6-47.3172.1171.50000110.6E1247 L1253 N1254 Q1255E1247-V1251 WeakPolarHBondContact O-CB 3.37Å; E1247-V1251 VanDerWaalsContact O-CG2 3.29Å; E1247-V1251 WeakPolarHBondContact O-CG2 3.4Å; E1247-V1251 PolarHBondContact O-N 2.84Å; V1251-L1253 VanDerWaalsContact C-N 3.35Å; V1251-L1253 PolarHBondContact O-N 3.2Å; V1251-N1254 PolarHBondContact O-N 3.31Å; V1251-Q1255 VanDerWaalsContact O-CB 3.23Å; V1251-Q1255 WeakPolarHBondContact O-CB 3.35Å; V1251-Q1255 PolarHBondContact O-N 3Å
1252S57.1Low59.6Low67 Ų67110.9 Ų110.947%0.46959%0.585SS.*Hα-helixtrans-56.8-46.5175.81750000112.2T1248 Q1255 T1256T1248-S1252 VanDerWaalsContact O-CB 3.23Å; T1248-S1252 WeakPolarHBondContact O-CB 3.35Å; T1248-S1252 PolarHBondContact O-N 3.46Å; S1252-Q1255 PolarHBondContact O-N 3.11Å; S1252-T1256 PolarHBondContact O-N 3.41Å; S1252-T1256 PolarHBondContact O-OG1 3.32Å
1253L60.3Low60.9Low117 Ų117106 Ų10661%0.61357%0.565SS**Hα-helixtrans-66.3-44.8179.9-160.674.7000111.7M1249 S1250 V1251 Q1255 T1256 V1257M1249-L1253 WeakPolarHBondContact O-CB 3.18Å; M1249-L1253 PolarHBondContact O-N 3Å; S1250-L1253 PolarHBondContact O-N 2.97Å; V1251-L1253 VanDerWaalsContact C-N 3.35Å; V1251-L1253 PolarHBondContact O-N 3.2Å; L1253-Q1255 VanDerWaalsContact C-N 3.31Å; L1253-Q1255 PolarHBondContact O-N 3Å; L1253-T1256 PolarHBondContact O-N 3.44Å; L1253-V1257 WeakPolarHBondContact O-CG2 3.43Å; L1253-V1257 PolarHBondContact O-N 3.18Å
1254N65.7Low62.5Low100 Ų100107.1 Ų107.154%0.53556%0.563SS.*Hα-helixtrans-62.3-38175.6-75.6-34000112S1250 V1251 V1257 T1258S1250-N1254 WeakPolarHBondContact O-CB 3.37Å; S1250-N1254 VanDerWaalsContact O-CG 3.26Å; S1250-N1254 PolarHBondContact O-N 3.33Å; S1250-N1254 PolarHBondContact O-ND2 2.91Å; S1250-N1254 VanDerWaalsContact O-ND2 3.09Å; V1251-N1254 PolarHBondContact O-N 3.31Å; N1254-V1257 PolarHBondContact O-N 3.45Å; N1254-T1258 WeakPolarHBondContact O-CB 3.38Å; N1254-T1258 PolarHBondContact O-N 2.75Å; N1254-T1258 PolarHBondContact O-OG1 2.68Å
1255Q69.8Low63.6Low119 Ų119108.1 Ų108.156%0.55656%0.558SS**Hα-helixtrans-68.3-38.3176.9-163.316825.200111.8V1251 S1252 L1253 T1258 Q1259V1251-Q1255 VanDerWaalsContact O-CB 3.23Å; V1251-Q1255 WeakPolarHBondContact O-CB 3.35Å; V1251-Q1255 PolarHBondContact O-N 3Å; S1252-Q1255 PolarHBondContact O-N 3.11Å; L1253-Q1255 VanDerWaalsContact C-N 3.31Å; L1253-Q1255 PolarHBondContact O-N 3Å; Q1255-T1258 PolarHBondContact O-N 3.01Å; Q1255-Q1259 WeakPolarHBondContact O-CG 3.36Å; Q1255-Q1259 PolarHBondContact O-N 3.34Å
1256T71.6Confident64.8Low63 Ų63106.8 Ų106.839%0.38755%0.552SS.*Hα-helixtrans-66.6-41.6171.5-55.70000112S1252 L1253 T1258 Q1259 L1260S1252-T1256 PolarHBondContact O-N 3.41Å; S1252-T1256 PolarHBondContact O-OG1 3.32Å; L1253-T1256 PolarHBondContact O-N 3.44Å; T1256-T1258 VanDerWaalsContact C-N 3.31Å; T1256-T1258 PolarHBondContact O-N 2.91Å; T1256-Q1259 PolarHBondContact O-N 3.02Å; T1256-L1260 HydrophobicContact CG2-CD1 4.3Å; T1256-L1260 WeakPolarHBondContact O-CG 3.48Å; T1256-L1260 PolarHBondContact O-N 2.83Å
1257V70.9Confident65.9Low66 Ų66101.4 Ų101.440%0.454%0.535SS..Hα-helixtrans-62.5-39.6174.2168.80000111.1L1253 N1254 L1260 Q1261L1253-V1257 WeakPolarHBondContact O-CG2 3.43Å; L1253-V1257 PolarHBondContact O-N 3.18Å; N1254-V1257 PolarHBondContact O-N 3.45Å; V1257-L1260 PolarHBondContact O-N 3.22Å; V1257-Q1261 WeakPolarHBondContact O-CG 3.47Å; V1257-Q1261 PolarHBondContact O-N 3.47Å
1258T71Confident66.6Low73 Ų7398.7 Ų98.745%0.44853%0.525SS..Hα-helixtrans-64.7-45.1177.1-550000110.6N1254 Q1255 T1256 L1260 Q1261 Q1262N1254-T1258 WeakPolarHBondContact O-CB 3.38Å; N1254-T1258 PolarHBondContact O-N 2.75Å; N1254-T1258 PolarHBondContact O-OG1 2.68Å; Q1255-T1258 PolarHBondContact O-N 3.01Å; T1256-T1258 VanDerWaalsContact C-N 3.31Å; T1256-T1258 PolarHBondContact O-N 2.91Å; T1258-L1260 VanDerWaalsContact C-N 3.35Å; T1258-L1260 PolarHBondContact O-N 3.47Å; T1258-Q1261 PolarHBondContact O-N 3.07Å; T1258-Q1262 VanDerWaalsContact O-CB 3.3Å; T1258-Q1262 WeakPolarHBondContact O-CB 3.47Å; T1258-Q1262 PolarHBondContact O-N 3.42Å
1259Q72.2Confident67.4Low112 Ų11299.1 Ų99.152%0.52352%0.52SS..Hα-helixtrans-60.8-40.6174.5-74.9174-15.900112.5Q1255 T1256 Q1262 L1263Q1255-Q1259 WeakPolarHBondContact O-CG 3.36Å; Q1255-Q1259 PolarHBondContact O-N 3.34Å; T1256-Q1259 PolarHBondContact O-N 3.02Å; Q1259-Q1262 PolarHBondContact O-N 2.93Å; Q1259-L1263 WeakPolarHBondContact O-CB 3.39Å; Q1259-L1263 WeakPolarHBondContact O-CG 3.47Å; Q1259-L1263 PolarHBondContact O-N 3.2Å
1260L72.7Confident67.9Low112 Ų11298.1 Ų98.159%0.58651%0.514SS*.Hα-helixtrans-67.2-39.9175.6-75.9167.3000112.6T1256 V1257 T1258 Q1262 L1264T1256-L1260 HydrophobicContact CG2-CD1 4.3Å; T1256-L1260 WeakPolarHBondContact O-CG 3.48Å; T1256-L1260 PolarHBondContact O-N 2.83Å; V1257-L1260 PolarHBondContact O-N 3.22Å; T1258-L1260 VanDerWaalsContact C-N 3.35Å; T1258-L1260 PolarHBondContact O-N 3.47Å; L1260-Q1262 VanDerWaalsContact C-N 3.34Å; L1260-L1264 VanDerWaalsContact O-CB 3.3Å; L1260-L1264 WeakPolarHBondContact O-CB 3.46Å; L1260-L1264 PolarHBondContact O-N 2.79Å
1261Q70.8Confident68.1Low126 Ų126100.8 Ų100.859%0.58952%0.524SS*.Hα-helixtrans-65.1-39172.9-75.1-176.7-46.200111.9V1257 T1258 L1264 Q1265V1257-Q1261 WeakPolarHBondContact O-CG 3.47Å; V1257-Q1261 PolarHBondContact O-N 3.47Å; T1258-Q1261 PolarHBondContact O-N 3.07Å; Q1261-L1264 PolarHBondContact O-N 3.48Å; Q1261-Q1265 WeakPolarHBondContact O-CB 3.41Å; Q1261-Q1265 PolarHBondContact O-N 3.48Å
1262Q73.8Confident67.9Low125 Ų125101.4 Ų101.458%0.58453%0.528SS*.Hα-helixtrans-68.5-44.1179.9-164.3163.25.900111.5T1258 Q1259 L1260 L1264 Q1265 E1266T1258-Q1262 VanDerWaalsContact O-CB 3.3Å; T1258-Q1262 WeakPolarHBondContact O-CB 3.47Å; T1258-Q1262 PolarHBondContact O-N 3.42Å; Q1259-Q1262 PolarHBondContact O-N 2.93Å; L1260-Q1262 VanDerWaalsContact C-N 3.34Å; Q1262-L1264 PolarHBondContact O-N 3.5Å; Q1262-Q1265 PolarHBondContact O-N 3.3Å; Q1262-E1266 WeakPolarHBondContact O-CB 3.38Å; Q1262-E1266 PolarHBondContact O-N 3.23Å
1263L74.1Confident67.6Low99 Ų99105.8 Ų105.852%0.51854%0.538SS..Hα-helixtrans-60.5-42.3170.4-77.8167.1000112.2Q1259 Q1265 E1266 V1267Q1259-L1263 WeakPolarHBondContact O-CB 3.39Å; Q1259-L1263 WeakPolarHBondContact O-CG 3.47Å; Q1259-L1263 PolarHBondContact O-N 3.2Å; L1263-Q1265 VanDerWaalsContact C-N 3.29Å; L1263-Q1265 PolarHBondContact O-N 3.36Å; L1263-E1266 PolarHBondContact O-N 3.4Å; L1263-V1267 WeakPolarHBondContact O-CG2 3.49Å; L1263-V1267 PolarHBondContact O-N 3.08Å
1264L71.9Confident66.8Low113 Ų113108.9 Ų108.959%0.59255%0.549SS*.Hα-helixtrans-65-34.5177.1-168.970.8000111.9L1260 Q1261 Q1262 N1268L1260-L1264 VanDerWaalsContact O-CB 3.3Å; L1260-L1264 WeakPolarHBondContact O-CB 3.46Å; L1260-L1264 PolarHBondContact O-N 2.79Å; Q1261-L1264 PolarHBondContact O-N 3.48Å; Q1262-L1264 PolarHBondContact O-N 3.5Å; L1264-N1268 WeakPolarHBondContact O-CB 3.31Å; L1264-N1268 PolarHBondContact O-N 3.44Å; L1264-N1268 VanDerWaalsContact O-N 3.13Å; L1264-N1268 PolarHBondContact O-ND2 2.96Å
1265Q71.1Confident65.5Low124 Ų124112.3 Ų112.358%0.57958%0.575SS**Hα-helixtrans-72.4-36.6174.7-171.6172.37.400112Q1261 Q1262 L1263 N1268 Q1269Q1261-Q1265 WeakPolarHBondContact O-CB 3.41Å; Q1261-Q1265 PolarHBondContact O-N 3.48Å; Q1262-Q1265 PolarHBondContact O-N 3.3Å; L1263-Q1265 VanDerWaalsContact C-N 3.29Å; L1263-Q1265 PolarHBondContact O-N 3.36Å; Q1265-N1268 PolarHBondContact O-N 2.94Å; Q1265-Q1269 WeakPolarHBondContact O-CG 3.44Å; Q1265-Q1269 PolarHBondContact O-N 3.37Å
1266E72Confident65.3Low117 Ų117112 Ų11255%0.54758%0.575SS.*Hα-helixtrans-68.4-42.7177.2-163.8160.5-129.400111.6Q1262 L1263 N1268 Q1269 Q1270Q1262-E1266 WeakPolarHBondContact O-CB 3.38Å; Q1262-E1266 PolarHBondContact O-N 3.23Å; L1263-E1266 PolarHBondContact O-N 3.4Å; E1266-N1268 PolarHBondContact O-N 3.45Å; E1266-Q1269 CarbonylContact O-C 3.49Å; E1266-Q1269 PolarHBondContact O-N 3.3Å; E1266-Q1269 VanDerWaalsContact O-N 3.14Å; E1266-Q1270 PolarHBondContact O-N 2.94Å
1267V71.9Confident64.9Low73 Ų73114.6 Ų114.644%0.44259%0.585SS.*Hα-helixtrans-62.2-41171.1170.40000111.7L1263 Q1269 Q1270 L1271L1263-V1267 WeakPolarHBondContact O-CG2 3.49Å; L1263-V1267 PolarHBondContact O-N 3.08Å; V1267-Q1269 VanDerWaalsContact C-N 3.32Å; V1267-Q1269 PolarHBondContact O-N 3.13Å; V1267-Q1270 PolarHBondContact O-N 2.96Å; V1267-L1271 HydrophobicContact CG1-CD1 4.38Å; V1267-L1271 PolarHBondContact O-N 3.1Å
1268N63.7Low64.6Low89 Ų89117.3 Ų117.348%0.47660%0.596SS.*Hα-helixtrans-65.5-33.2173.5-85.4-74000112.6L1264 Q1265 E1266 L1271 T1272L1264-N1268 WeakPolarHBondContact O-CB 3.31Å; L1264-N1268 PolarHBondContact O-N 3.44Å; L1264-N1268 VanDerWaalsContact O-N 3.13Å; L1264-N1268 PolarHBondContact O-ND2 2.96Å; Q1265-N1268 PolarHBondContact O-N 2.94Å; E1266-N1268 PolarHBondContact O-N 3.45Å; N1268-L1271 PolarHBondContact O-N 3.41Å; N1268-T1272 PolarHBondContact O-N 3.12Å; N1268-T1272 PolarHBondContact O-OG1 2.91Å
1269Q68Low64.2Low101 Ų101119.9 Ų119.947%0.47260%0.604SS.*Hα-helixtrans-73.6-22.3173.2-78.7-165.610.700113.9Q1265 E1266 V1267 K1273Q1265-Q1269 WeakPolarHBondContact O-CG 3.44Å; Q1265-Q1269 PolarHBondContact O-N 3.37Å; E1266-Q1269 CarbonylContact O-C 3.49Å; E1266-Q1269 PolarHBondContact O-N 3.3Å; E1266-Q1269 VanDerWaalsContact O-N 3.14Å; V1267-Q1269 VanDerWaalsContact C-N 3.32Å; V1267-Q1269 PolarHBondContact O-N 3.13Å; Q1269-K1273 WeakPolarHBondContact O-CD 3.45Å; Q1269-K1273 VanDerWaalsContact O-CG 3.28Å; Q1269-K1273 WeakPolarHBondContact O-CG 3.45Å
1270Q62.9Low63.7Low125 Ų125120.4 Ų120.458%0.58461%0.609SS**Hα-helixtrans-74.5-48.5167.5-73.1178.7-38.600110.4E1266 V1267 T1272 K1273E1266-Q1270 PolarHBondContact O-N 2.94Å; V1267-Q1270 PolarHBondContact O-N 2.96Å; Q1270-T1272 PolarHBondContact O-N 3.25Å; Q1270-K1273 PolarHBondContact O-N 3.43Å
1271L59.7Low63.1Low110 Ų110120.9 Ų120.958%0.57661%0.611SS**Hα-helixtrans-58.1-30.6176.9-104.674.3000114V1267 N1268V1267-L1271 HydrophobicContact CG1-CD1 4.38Å; V1267-L1271 PolarHBondContact O-N 3.1Å; N1268-L1271 PolarHBondContact O-N 3.41Å
1272T54.1Low62.6Low99 Ų99120.6 Ų120.661%0.60761%0.613SS**THydrogen-bonded Turntrans-91.811.7177.145.60000114.3N1268 Q1270N1268-T1272 PolarHBondContact O-N 3.12Å; N1268-T1272 PolarHBondContact O-OG1 2.91Å; Q1270-T1272 PolarHBondContact O-N 3.25Å
1273K50.3Low61.7Low159 Ų159120.2 Ų120.269%0.69162%0.615SS**THydrogen-bonded Turntrans-111.9-6.4170.9-78.3174.9-176.6168.10114Q1269 Q1270Q1269-K1273 WeakPolarHBondContact O-CD 3.45Å; Q1269-K1273 VanDerWaalsContact O-CG 3.28Å; Q1269-K1273 WeakPolarHBondContact O-CG 3.45Å; Q1270-K1273 PolarHBondContact O-N 3.43Å
1274E44.3Very low60.7Low181 Ų181122 Ų12285%0.84662%0.623SS**  trans-114.324.9178.5-61.9-172.3145.200112.2
1275T38.6Very low59.7Low173 Ų173122.8 Ų122.8100%1.06163%0.626SS**  trans-125.60169.559.40000110.5

Retrieved 1,275 of 1,275 residues in 703 ms (Link to these results)