A0A087YID4_POEFO Loading...

PRKC, apoptosis, WT1, regulator

AlphaFold DB , UniProt , Accession A0A087YID4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 344 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
1M37.8Very low50Low250 Ų250133.5 Ų133.5100%1.23281%0.811SS**  0134.60-73.8166.8161.200107.9
2A45.8Very low50.4Low102 Ų102127.8 Ų127.884%0.84379%0.787SS**  trans-145.895.6177.800000109.4
3T47.7Very low51.6Low143 Ų143124.7 Ų124.788%0.87776%0.763SS**  trans-98.483.2178.248.30000109.4G5T3-G5 PolarHBondContact O-N 3.44Å
4G46.2Very low53.2Low74 Ų74126.1 Ų126.176%0.76375%0.754SS**  trans-68.392.8174.100000111F6G4-F6 PolarHBondContact O-N 3.37Å
5G47.8Very low55.3Low69 Ų69124.7 Ų124.771%0.71174%0.74SS**  trans-72.693.2178.500000111.9T3 K7T3-G5 PolarHBondContact O-N 3.44Å; G5-K7 PolarHBondContact O-N 2.68Å
6F47Very low57.2Low209 Ų209125.5 Ų125.592%0.91773%0.734SS**  trans-60.1108.1164.4-95.3-97.2000109.3G4 S8G4-F6 PolarHBondContact O-N 3.37Å; F6-S8 PolarHBondContact O-N 3.15Å
7K58.5Low59.1Low202 Ų202124.8 Ų124.888%0.87872%0.722SS**  trans-70.8112.2168.3-69-173176.4-1730108.4G5 N9G5-K7 PolarHBondContact O-N 2.68Å; K7-N9 PolarHBondContact O-N 3.33Å; K7-N9 VanDerWaalsContact O-N 3.13Å
8S51.9Low60.9Low108 Ų108125.1 Ų125.176%0.75571%0.709SS**  trans-62.6110.2169.852.90000109.4F6 A10F6-S8 PolarHBondContact O-N 3.15Å; S8-A10 PolarHBondContact O-N 2.8Å; S8-A10 VanDerWaalsContact O-N 3.07Å
9N54.3Low62.7Low143 Ų143125 Ų12577%0.76570%0.7SS**  trans-67.9105.8176-168.5-26.3000108.4K7K7-N9 PolarHBondContact O-N 3.33Å; K7-N9 VanDerWaalsContact O-N 3.13Å
10A58.8Low64.2Low44 Ų44121.7 Ų121.736%0.36469%0.689SS.*  trans-104.5149.2-169.200000110.4S8 A12 D13S8-A10 PolarHBondContact O-N 2.8Å; S8-A10 VanDerWaalsContact O-N 3.07Å; A10-A12 PolarHBondContact O-N 2.88Å; A10-D13 VanDerWaalsContact O-CB 3.27Å; A10-D13 WeakPolarHBondContact O-CB 3.28Å; A10-D13 PolarHBondContact O-N 3.5Å
11P54.7Low65.6Low125 Ų125122.3 Ų122.381%0.81268%0.684SS**Hα-helixtrans-64.1-6.4-175.825.5-35.1000115.2
12A53.9Low68.3Low64 Ų64116.9 Ų116.953%0.52965%0.65SS.*Hα-helixtrans-67.4-35.716700000112.6A10 F14 L15 E16A10-A12 PolarHBondContact O-N 2.88Å; A12-F14 VanDerWaalsContact C-N 3.34Å; A12-F14 PolarHBondContact O-N 3.38Å; A12-L15 PolarHBondContact O-N 3.18Å; A12-E16 PolarHBondContact O-N 2.83Å
13D66.5Low70.6Confident88 Ų88116.4 Ų116.447%0.47163%0.631SS.*Hα-helixtrans-60.5-41.4-174.6-153-6.3000110.8A10 L15 E16 E17A10-D13 VanDerWaalsContact O-CB 3.27Å; A10-D13 WeakPolarHBondContact O-CB 3.28Å; A10-D13 PolarHBondContact O-N 3.5Å; D13-L15 PolarHBondContact O-N 2.75Å; D13-E16 PolarHBondContact O-N 2.86Å; D13-E17 VanDerWaalsContact O-CB 3.29Å; D13-E17 WeakPolarHBondContact O-CB 3.32Å; D13-E17 PolarHBondContact O-N 3.39Å
14F73.6Confident72.7Confident145 Ų145117.4 Ų117.464%0.63662%0.623SS**Hα-helixtrans-62.8-37.8174.8-179.9-101.6000113.6A12 W18A12-F14 VanDerWaalsContact C-N 3.34Å; A12-F14 PolarHBondContact O-N 3.38Å; F14-W18 VanDerWaalsContact O-CB 3.26Å; F14-W18 WeakPolarHBondContact O-CB 3.5Å; F14-W18 PolarHBondContact O-N 2.88Å
15L85.2Confident75Confident104 Ų104119.2 Ų119.255%0.54561%0.613SS.*Hα-helixtrans-73.6-32.2179.2-153.888000111.4A12 D13 K19A12-L15 PolarHBondContact O-N 3.18Å; D13-L15 PolarHBondContact O-N 2.75Å; L15-K19 VanDerWaalsContact O-CG 3.31Å; L15-K19 WeakPolarHBondContact O-CG 3.47Å; L15-K19 PolarHBondContact O-N 2.78Å; L15-K19 VanDerWaalsContact O-N 3.12Å
16E86.3Confident77.1Confident138 Ų138122 Ų12265%0.64560%0.602SS**Hα-helixtrans-75.7-42.6175.9-167.4153.4-147.200111.4A12 D13 W18 K19 A20A12-E16 PolarHBondContact O-N 2.83Å; D13-E16 PolarHBondContact O-N 2.86Å; E16-W18 PolarHBondContact O-N 2.86Å; E16-K19 PolarHBondContact O-N 2.92Å; E16-A20 WeakPolarHBondContact O-CB 3.48Å; E16-A20 PolarHBondContact O-N 3.14Å
17E88.5Confident78.9Confident114 Ų114114.8 Ų114.853%0.53358%0.581SS.*Hα-helixtrans-58.1-45.3169.5-168.2-161.4163.300110.9D13 K19 A20 K21D13-E17 VanDerWaalsContact O-CB 3.29Å; D13-E17 WeakPolarHBondContact O-CB 3.32Å; D13-E17 PolarHBondContact O-N 3.39Å; E17-K19 PolarHBondContact O-N 3.15Å; E17-A20 CarbonylContact O-C 3.54Å; E17-A20 PolarHBondContact O-N 2.97Å; E17-K21 VanDerWaalsContact O-CB 3.22Å; E17-K21 WeakPolarHBondContact O-CB 3.12Å; E17-K21 PolarHBondContact O-N 3.17Å
18W92.6Very high80.4Confident130 Ų130111.2 Ų111.249%0.49257%0.565SS.*Hα-helixtrans-65.7-39.6179.3-171.389000112.4F14 E16 K21 R22F14-W18 VanDerWaalsContact O-CB 3.26Å; F14-W18 WeakPolarHBondContact O-CB 3.5Å; F14-W18 PolarHBondContact O-N 2.88Å; E16-W18 PolarHBondContact O-N 2.86Å; W18-K21 PolarHBondContact O-N 3.15Å; W18-R22 WeakPolarHBondContact O-CB 3.35Å; W18-R22 PolarHBondContact O-N 3.01Å
19K94.6Very high82.1Confident123 Ų123111.7 Ų111.754%0.53556%0.557SS.*Hα-helixtrans-60.9-48.8169.7-76.7173-179.51800111.2L15 E16 E17 K21 R22 E23L15-K19 VanDerWaalsContact O-CG 3.31Å; L15-K19 WeakPolarHBondContact O-CG 3.47Å; L15-K19 PolarHBondContact O-N 2.78Å; L15-K19 VanDerWaalsContact O-N 3.12Å; E16-K19 PolarHBondContact O-N 2.92Å; E17-K19 PolarHBondContact O-N 3.15Å; K19-K21 VanDerWaalsContact C-N 3.3Å; K19-K21 PolarHBondContact O-N 3.37Å; K19-R22 WeakPolarHBondContact O-CB 3.48Å; K19-R22 PolarHBondContact O-N 3.05Å; K19-E23 WeakPolarHBondContact O-CB 3.34Å; K19-E23 PolarHBondContact O-N 2.92Å
20A92.6Very high83.4Confident59 Ų59110 Ų11049%0.48855%0.547SS..Hα-helixtrans-62.2-35.8178.300000112.5E16 E17 E23 K24E16-A20 WeakPolarHBondContact O-CB 3.48Å; E16-A20 PolarHBondContact O-N 3.14Å; E17-A20 CarbonylContact O-C 3.54Å; E17-A20 PolarHBondContact O-N 2.97Å; A20-E23 PolarHBondContact O-N 2.89Å; A20-K24 WeakPolarHBondContact O-CB 3.37Å; A20-K24 PolarHBondContact O-N 2.94Å
21K93.8Very high84.2Confident134 Ų134109.3 Ų109.358%0.58355%0.545SS*.Hα-helixtrans-69-41.3176.3-171172.1-176.4172.80111.8E17 W18 K19 M25E17-K21 VanDerWaalsContact O-CB 3.22Å; E17-K21 WeakPolarHBondContact O-CB 3.12Å; E17-K21 PolarHBondContact O-N 3.17Å; W18-K21 PolarHBondContact O-N 3.15Å; K19-K21 VanDerWaalsContact C-N 3.3Å; K19-K21 PolarHBondContact O-N 3.37Å; K21-M25 WeakPolarHBondContact O-CG 3.27Å; K21-M25 PolarHBondContact O-N 3.13Å; K21-M25 VanDerWaalsContact O-N 3.09Å
22R94.4Very high85.2Confident136 Ų136106.4 Ų106.451%0.51352%0.522SS..Hα-helixtrans-61.3-48.2170172.9-174.3-81.9-174.1-12.9111.1W18 K19 K24 M25 R26W18-R22 WeakPolarHBondContact O-CB 3.35Å; W18-R22 PolarHBondContact O-N 3.01Å; K19-R22 WeakPolarHBondContact O-CB 3.48Å; K19-R22 PolarHBondContact O-N 3.05Å; R22-K24 PolarHBondContact O-N 2.85Å; R22-M25 WeakPolarHBondContact O-CB 3.42Å; R22-M25 PolarHBondContact O-N 3.07Å; R22-R26 PolarHBondContact O-N 2.99Å
23E93.2Very high86.1Confident93 Ų93107.9 Ų107.944%0.43552%0.52SS..Hα-helixtrans-66.3-39.5-178.2-153.459.2-115.100111.7K19 A20 M25 R26 A27K19-E23 WeakPolarHBondContact O-CB 3.34Å; K19-E23 PolarHBondContact O-N 2.92Å; A20-E23 PolarHBondContact O-N 2.89Å; E23-M25 VanDerWaalsContact C-N 3.31Å; E23-M25 PolarHBondContact O-N 3.42Å; E23-R26 PolarHBondContact O-N 3.35Å; E23-R26 WeakPolarHBondContact OE1-CD 3.38Å; E23-R26 IonicContact OE1-CZ 3.89Å; E23-R26 IonicContact OE1-NE 2.67Å; E23-R26 IonicContact OE1-NH1 2.76Å; E23-R26 PolarHBondContact OE1-NH1 3.19Å; E23-R26 IonicContact OE2-CZ 2.75Å; E23-R26 IonicContact OE2-NH1 3.91Å; E23-R26 PolarHBondContact OE2-NH1 3.22Å; E23-A27 WeakPolarHBondContact O-CB 3.39Å; E23-A27 PolarHBondContact O-N 3.35Å
24K92.4Very high86.1Confident164 Ų164105 Ų10571%0.71351%0.509SS*.Hα-helixtrans-60.9-36.5172.7-178.6172.1-178.5176.20112.6A20 R22 K28A20-K24 WeakPolarHBondContact O-CB 3.37Å; A20-K24 PolarHBondContact O-N 2.94Å; R22-K24 PolarHBondContact O-N 2.85Å; K24-K28 VanDerWaalsContact O-CB 3.28Å; K24-K28 WeakPolarHBondContact O-CB 3.46Å; K24-K28 PolarHBondContact O-N 2.87Å
25M94Very high85.6Confident111 Ų111105.6 Ų105.655%0.54751%0.511SS..Hα-helixtrans-67.8-45172-76.3-66.7-68.300111.6K21 R22 E23 K28 M29K21-M25 WeakPolarHBondContact O-CG 3.27Å; K21-M25 PolarHBondContact O-N 3.13Å; K21-M25 VanDerWaalsContact O-N 3.09Å; R22-M25 WeakPolarHBondContact O-CB 3.42Å; R22-M25 PolarHBondContact O-N 3.07Å; E23-M25 VanDerWaalsContact C-N 3.31Å; E23-M25 PolarHBondContact O-N 3.42Å; M25-K28 PolarHBondContact O-N 2.99Å; M25-M29 WeakPolarHBondContact O-CG 3.42Å; M25-M29 PolarHBondContact O-N 2.98Å
26R91.9Very high84.9Confident127 Ų127104.8 Ų104.848%0.47952%0.52SS..Hα-helixtrans-61.5-47.6177.3-166.9-173-70.5137.7-12.7111.7R22 E23 K28 M29 L30R22-R26 PolarHBondContact O-N 2.99Å; E23-R26 PolarHBondContact O-N 3.35Å; E23-R26 WeakPolarHBondContact OE1-CD 3.38Å; E23-R26 IonicContact OE1-CZ 3.89Å; E23-R26 IonicContact OE1-NE 2.67Å; E23-R26 IonicContact OE1-NH1 2.76Å; E23-R26 PolarHBondContact OE1-NH1 3.19Å; E23-R26 IonicContact OE2-CZ 2.75Å; E23-R26 IonicContact OE2-NH1 3.91Å; E23-R26 PolarHBondContact OE2-NH1 3.22Å; R26-K28 PolarHBondContact O-N 3.4Å; R26-M29 PolarHBondContact O-N 3.4Å; R26-L30 HydrophobicContact CG-CD1 4.25Å; R26-L30 WeakPolarHBondContact O-CG 3.47Å; R26-L30 PolarHBondContact O-N 3.4Å
27A86.3Confident84Confident58 Ų58102.8 Ų102.848%0.47952%0.517SS..Hα-helixtrans-63.5-36.8175.900000112.7E23 G31E23-A27 WeakPolarHBondContact O-CB 3.39Å; E23-A27 PolarHBondContact O-N 3.35Å; A27-G31 PolarHBondContact O-N 3.47Å
28K89.4Confident82.5Confident127 Ų127100.3 Ų100.355%0.55252%0.522SS*.Hα-helixtrans-61.9-50.1171.6-175.9-168.8170.5-164.20110.8K24 M25 R26 L30 G31 D32K24-K28 VanDerWaalsContact O-CB 3.28Å; K24-K28 WeakPolarHBondContact O-CB 3.46Å; K24-K28 PolarHBondContact O-N 2.87Å; M25-K28 PolarHBondContact O-N 2.99Å; R26-K28 PolarHBondContact O-N 3.4Å; K28-L30 PolarHBondContact O-N 2.96Å; K28-G31 PolarHBondContact O-N 2.67Å; K28-D32 WeakPolarHBondContact CE-OD2 3.48Å; K28-D32 WeakPolarHBondContact CG-OD2 3.43Å; K28-D32 WeakPolarHBondContact O-CB 3.44Å; K28-D32 PolarHBondContact O-N 3.37Å
29M86.7Confident80.6Confident118 Ų11897.9 Ų97.958%0.58152%0.521SS*.Hα-helixtrans-60.4-45.3179.5-70.9178.371.200111.6M25 R26 G31 D32 I33M25-M29 WeakPolarHBondContact O-CG 3.42Å; M25-M29 PolarHBondContact O-N 2.98Å; R26-M29 PolarHBondContact O-N 3.4Å; M29-G31 VanDerWaalsContact C-N 3.34Å; M29-G31 PolarHBondContact O-N 2.82Å; M29-D32 PolarHBondContact O-N 3.15Å; M29-I33 WeakPolarHBondContact O-CB 3.48Å; M29-I33 WeakPolarHBondContact O-CD1 3.18Å; M29-I33 WeakPolarHBondContact O-CG1 3.29Å; M29-I33 PolarHBondContact O-N 2.83Å
30L81.3Confident78.3Confident107 Ų10797.8 Ų97.856%0.5653%0.533SS*.Hα-helixtrans-59.9-42174.5-71.7167.5000112.2R26 K28 A34R26-L30 HydrophobicContact CG-CD1 4.25Å; R26-L30 WeakPolarHBondContact O-CG 3.47Å; R26-L30 PolarHBondContact O-N 3.4Å; K28-L30 PolarHBondContact O-N 2.96Å; L30-A34 WeakPolarHBondContact O-CB 3.35Å; L30-A34 PolarHBondContact O-N 3.35Å
31G77.2Confident76.3Confident30 Ų30101.7 Ų101.731%0.30955%0.545SS..Hα-helixtrans-69.3-32.517700000114.2A27 K28 M29 K35A27-G31 PolarHBondContact O-N 3.47Å; K28-G31 PolarHBondContact O-N 2.67Å; M29-G31 VanDerWaalsContact C-N 3.34Å; M29-G31 PolarHBondContact O-N 2.82Å; G31-K35 WeakPolarHBondContact O-CD 3.47Å; G31-K35 WeakPolarHBondContact O-CE 3.42Å; G31-K35 VanDerWaalsContact O-CG 3.25Å; G31-K35 WeakPolarHBondContact O-CG 3.42Å; G31-K35 PolarHBondContact O-N 2.93Å
32D75.8Confident74.1Confident64 Ų64102.6 Ų102.634%0.34256%0.556SS.*Hα-helixtrans-79.8-32.6176.1-68.5-22.5000111.6K28 M29 K35 A36K28-D32 WeakPolarHBondContact CE-OD2 3.48Å; K28-D32 WeakPolarHBondContact CG-OD2 3.43Å; K28-D32 WeakPolarHBondContact O-CB 3.44Å; K28-D32 PolarHBondContact O-N 3.37Å; M29-D32 PolarHBondContact O-N 3.15Å; D32-K35 IonicContact OD1-NZ 2.68Å; D32-K35 PolarHBondContact OD1-NZ 3.03Å; D32-A36 PolarHBondContact O-N 3.05Å; D32-A36 VanDerWaalsContact O-N 3.14Å
33I71.1Confident71.8Confident96 Ų96101.5 Ų101.549%0.49257%0.567SS.*Hα-helixtrans-62.4-49167.7-70.6163000110.6M29 K35 A36 T37M29-I33 WeakPolarHBondContact O-CB 3.48Å; M29-I33 WeakPolarHBondContact O-CD1 3.18Å; M29-I33 WeakPolarHBondContact O-CG1 3.29Å; M29-I33 PolarHBondContact O-N 2.83Å; I33-K35 VanDerWaalsContact C-N 3.27Å; I33-K35 PolarHBondContact O-N 2.87Å; I33-A36 WeakPolarHBondContact O-CA 3.46Å; I33-A36 WeakPolarHBondContact O-CB 3.17Å; I33-A36 PolarHBondContact O-N 2.8Å; I33-T37 PolarHBondContact O-N 2.81Å; I33-T37 PolarHBondContact O-OG1 3.4Å
34A66.4Low69.2Low27 Ų27102 Ų10222%0.22359%0.587CS.*Hα-helixtrans-61.7-33.3-179.900000113L30 G38 V39L30-A34 WeakPolarHBondContact O-CB 3.35Å; L30-A34 PolarHBondContact O-N 3.35Å; A34-G38 PolarHBondContact O-N 3.27Å; A34-V39 PolarHBondContact O-N 3.44Å
35K64.9Low66.7Low157 Ų15799.9 Ų99.968%0.68359%0.593SS**Hα-helixtrans-67.9-36170.5-70165.9-157.1160.80112.6G31 D32 I33G31-K35 WeakPolarHBondContact O-CD 3.47Å; G31-K35 WeakPolarHBondContact O-CE 3.42Å; G31-K35 VanDerWaalsContact O-CG 3.25Å; G31-K35 WeakPolarHBondContact O-CG 3.42Å; G31-K35 PolarHBondContact O-N 2.93Å; D32-K35 IonicContact OD1-NZ 2.68Å; D32-K35 PolarHBondContact OD1-NZ 3.03Å; I33-K35 VanDerWaalsContact C-N 3.27Å; I33-K35 PolarHBondContact O-N 2.87Å
36A70.3Confident64Low88 Ų8899.2 Ų99.273%0.72760%0.599SS**Hα-helixtrans-76-34.9-17900000112.9D32 I33D32-A36 PolarHBondContact O-N 3.05Å; D32-A36 VanDerWaalsContact O-N 3.14Å; I33-A36 WeakPolarHBondContact O-CA 3.46Å; I33-A36 WeakPolarHBondContact O-CB 3.17Å; I33-A36 PolarHBondContact O-N 2.8Å
37T66.1Low61.2Low95 Ų95100.4 Ų100.458%0.58362%0.615SS**Hα-helixtrans-89.8-12.8176.856.50000114I33 V39I33-T37 PolarHBondContact O-N 2.81Å; I33-T37 PolarHBondContact O-OG1 3.4Å; T37-V39 PolarHBondContact O-N 3.06Å
38G56.8Low58.5Low62 Ų62103.7 Ų103.764%0.63963%0.634SS**THydrogen-bonded Turntrans72.411.3178.600000114.9A34 P40A34-G38 PolarHBondContact O-N 3.27Å; G38-P40 WeakPolarHBondContact O-CD 3.3Å
39V54.5Low55.9Low79 Ų79104.8 Ų104.848%0.47965%0.652SS.*  trans-92.9113.8-178.2-178.30000110.1A34 T37 L41A34-V39 PolarHBondContact O-N 3.44Å; T37-V39 PolarHBondContact O-N 3.06Å; V39-L41 HydrophobicContact CG1-CD2 4.37Å; V39-L41 HydrophobicContact CG1-CG 4.49Å; V39-L41 PolarHBondContact O-N 3.08Å
40P45.2Very low53.3Low121 Ų121104.6 Ų104.679%0.78666%0.662SS**  trans-79.987.3-178.132.3-34.8000111.6G38 N42G38-P40 WeakPolarHBondContact O-CD 3.3Å; P40-N42 PolarHBondContact O-N 2.91Å
41L51.2Low51.1Low142 Ų142107.2 Ų107.274%0.74368%0.677SS**  trans-74.1113167.9-65.3-179.6000110V39 P43V39-L41 HydrophobicContact CG1-CD2 4.37Å; V39-L41 HydrophobicContact CG1-CG 4.49Å; V39-L41 PolarHBondContact O-N 3.08Å; L41-P43 WeakPolarHBondContact O-CD 3.49Å
42N47.3Very low48.9Very low152 Ų152111.3 Ų111.381%0.81370%0.7SS**  trans-83.9114.6-175.5-171.230.1000111.1P40 A44P40-N42 PolarHBondContact O-N 2.91Å; N42-A44 PolarHBondContact O-N 3.22Å; N42-A44 VanDerWaalsContact O-N 3.13Å
43P46.9Very low46.9Very low113 Ų113119 Ų11973%0.73473%0.725SS**  trans-75.7104.7-176.830-33.7000111.2L41 S45L41-P43 WeakPolarHBondContact O-CD 3.49Å; P43-S45 PolarHBondContact O-N 3.25Å
44A38.6Very low45.1Very low104 Ų104122.5 Ų122.586%0.8674%0.744SS**  trans-67.996.9176.900000111.5N42N42-A44 PolarHBondContact O-N 3.22Å; N42-A44 VanDerWaalsContact O-N 3.13Å
45S38Very low43.4Very low119 Ų119125.2 Ų125.283%0.83277%0.774SS**  trans-76.2131.4175.4-173.70000111.6P43P43-S45 PolarHBondContact O-N 3.25Å
46S37.6Very low41.9Very low97 Ų97122.3 Ų122.368%0.67878%0.779SS**  trans-73.5144.4178.857.30000113.8
47N34.1Very low41.2Very low153 Ų153124 Ų12482%0.81878%0.783SS**  trans67.7105.8162.5-63.7-10.5000119.2
48S30.3Very low40.4Very low127 Ų127125.6 Ų125.689%0.88880%0.795SS**  trans-154.8132.8136.6-80.80000110.3
49T33Very low39.1Very low149 Ų149125.4 Ų125.491%0.91479%0.793SS**  trans-101.3119.1-172.3-57.40000112
50S33.3Very low38.2Very low115 Ų115127.8 Ų127.880%0.80481%0.808SS**  trans-158.2143.3159.355.90000112.4
51N34.7Very low37.5Very low162 Ų162129 Ų12987%0.86680%0.803SS**  trans-82.8141176.3-76.9-43.1000111.4
52S31.7Very low36.7Very low115 Ų115129.2 Ų129.280%0.80480%0.804SS**  -175.6111.6125.1-83.50000115.8
53R32.7Very low35.9Very low227 Ų227126.6 Ų126.686%0.85780%0.797SS**  27.8125.2127.9-66.8-176.7178.8-163.8-1.1121.2
54L34.6Very low35.1Very low169 Ų169127.2 Ų127.289%0.88580%0.799SS**  trans70132.6135.8-59.1167000120.5
55G29.8Very low34.9Very low83 Ų83129.8 Ų129.886%0.85680%0.798SS**  trans133.8130.6146.700000118.2
56A33.4Very low35.8Very low97 Ų97129.8 Ų129.880%0.80280%0.795SS**  trans-165.3167.4163.200000108.8
57P55.8Low35.5Very low124 Ų124131.6 Ų131.681%0.80580%0.797SS**  cis-106.1-118.2-20.323.51.4000107.6
58P49.9Very low35.7Very low127 Ų127134.5 Ų134.583%0.82580%0.796SS**  cis-134.3-178.7-29.141.4-23.4000116
59G29.4Very low36Very low58 Ų58133.8 Ų133.860%0.59879%0.792SS**  trans144.3106.5169.200000110.6
60T33.8Very low36.1Very low129 Ų129131.6 Ų131.679%0.79179%0.789SS**  59.3135.873.478.60000113.1
61E32.1Very low36.2Very low148 Ų148132.1 Ų132.169%0.69279%0.792SS**  cis-125.3150.128.1-60.8-66.6119.900111.5
62L33.7Very low36.3Very low145 Ų145129.1 Ų129.176%0.75979%0.79SS**  46.6136.187.6-65.6163.9000115.1
63C30.1Very low36.3Very low98 Ų98127 Ų12766%0.66279%0.786SS**  cis-161.6166.129.7-132.20000116
64T30.7Very low36.6Very low126 Ų126123.5 Ų123.577%0.77378%0.784SS**  trans54.4112.6151.452.10000124.3
65N35.2Very low36.4Very low157 Ų157120.5 Ų120.584%0.8478%0.777SS**  trans-76.5168.9137.4-83.2-45.7000109.9
66P55.1Low36.8Very low119 Ų119127.4 Ų127.477%0.77378%0.777SS**  cis-134.1-16436.240.1-17.4000113.6
67D31.6Very low36.7Very low135 Ų135127.9 Ų127.972%0.72277%0.77SS**  cis-162.5176.920-159.6-4.2000112.4
68R38.6Very low35.7Very low214 Ų214126.9 Ų126.981%0.80877%0.766SS**  trans76.388.9158.8-66.2-176.7169.8-156.1-7121.5
69S37.5Very low34.9Very low113 Ų113126.2 Ų126.279%0.7976%0.764SS**  40.3111.3112.8-53.80000122.3
70A34.2Very low35.2Very low103 Ų103128.6 Ų128.685%0.85177%0.772SS**  85.5155.1118.400000122.6
71S36.1Very low35.7Very low125 Ų125127.8 Ų127.887%0.87477%0.771SS**  trans96.5132.4160.7-155.40000119.2
72A35.9Very low36.4Very low100 Ų100126.6 Ų126.683%0.82678%0.776SS**  trans-61.8167.3-176.600000116.7
73G31.6Very low36.9Very low70 Ų70125.8 Ų125.872%0.72278%0.777SS**  trans150.195.6148.600000118.7
74N39.4Very low37.2Very low153 Ų153126 Ų12682%0.81879%0.786SS**  trans46.1112.8132.9-74.525.8000123.3
75C31.7Very low37.6Very low107 Ų107131 Ų13172%0.72379%0.791SS**  90.9153.4120.6-62.50000122.4
76R36.6Very low37.8Very low227 Ų227129.2 Ų129.286%0.85779%0.79SS**  trans83.3141.1161.7-54.8-161.5142.1-144.6-7.5116.5
77T31.2Very low37.3Very low108 Ų108129.2 Ų129.266%0.66379%0.79SS**  cis-162.8150.9-6.69.90000113.3
78S35.3Very low37.8Very low102 Ų102128.9 Ų128.971%0.71380%0.799SS**  trans68.2138.3141.1-57.90000123.7
79S34.2Very low37.6Very low113 Ų113122.9 Ų122.979%0.7980%0.803SS**  trans64.2148.3152.855.90000119.1
80S34.9Very low37.2Very low109 Ų109121.3 Ų121.376%0.76281%0.805SS**  cis-164.3149.4-16.945.80000109.5
81S43.6Very low37.2Very low111 Ų111122.4 Ų122.478%0.77680%0.801SS**  trans-72.9150.2176.352.60000113.9
82P48.4Very low37.3Very low123 Ų123124 Ų12480%0.79980%0.799SS**  trans-117.3132.615034.7-25.3000112.2
83V43.7Very low37.4Very low129 Ų129127.5 Ų127.578%0.78280%0.804SS**  trans-88.1133.4167.4173.70000108.9
84A36.3Very low37.3Very low102 Ų102134.9 Ų134.984%0.84381%0.81SS**  trans-85.6129.9173.500000111.1
85R38.4Very low37Very low232 Ų232131.7 Ų131.788%0.87581%0.805SS**  trans-115.3135.4172.7-71.317464.2-164.31.6110
86S39.8Very low37Very low119 Ų119134.9 Ų134.983%0.83281%0.809SS**  trans-70142.3172.8-53.70000111.8
87P45.6Very low36.6Very low119 Ų119126.6 Ų126.677%0.77379%0.794SS**  trans-95.5156.2166.936.1-31.9000112
88S40.1Very low36.7Very low128 Ų128126.8 Ų126.890%0.89580%0.8SS**  trans-151.5148.7168.3-72.10000109.9
89G34.8Very low36.6Very low88 Ų88128.5 Ų128.591%0.90780%0.801SS**  trans102.8129173.800000115.3
90G30.6Very low36.7Very low79 Ų79129.6 Ų129.681%0.81480%0.797SS**  trans-173.8122.8173.100000109.7
91T34.1Very low36.7Very low126 Ų126133.7 Ų133.777%0.77380%0.801SS**  trans-110.7151.6-163.652.30000114.4
92L38.1Very low36.2Very low159 Ų159138.5 Ų138.583%0.83281%0.808SS**  trans42.8121.3144.3-69.4167000119.6
93N37.3Very low35.5Very low174 Ų174136.6 Ų136.693%0.9380%0.803SS**  trans-145.5157.6142-97-55.6000110.9
94R29.8Very low35.6Very low224 Ų224136.2 Ų136.285%0.84580%0.803SS**  trans-139.3164.8-172.1168.7178170-173.8-3.1109.6
95A32.3Very low36.2Very low86 Ų86136.2 Ų136.271%0.71180%0.795SS**  trans91.3144.7172.500000114.9
96E32Very low35.9Very low175 Ų175132.3 Ų132.382%0.81879%0.786SS**  cis-161.6170.5-8.6-106.6-77.6131.700108.7
97G29Very low35.6Very low53 Ų53133.6 Ų133.655%0.54678%0.781SS.*  trans102.4106.417100000115.8
98S32.3Very low35Very low112 Ų112137.4 Ų137.478%0.78379%0.788SS**  77.8135.576.678.70000114.2
99N32.8Very low34.7Very low137 Ų137140.3 Ų140.373%0.73379%0.785SS**  cis-163.3150.65.5-129.6-26.5000113.2
100L36.1Very low34.7Very low136 Ų136142.3 Ų142.371%0.71278%0.78SS**  trans40113.6146.5-70.8163.8000122.1
101K35.8Very low34.7Very low195 Ų195149.5 Ų149.585%0.84878%0.782SS**  171.2135.7103.5-98.5152.2-174.8170.40118.2
102K33.1Very low34.4Very low212 Ų212149.5 Ų149.592%0.92279%0.786SS**  trans73.2158.7142.6-148.2159.2-175.8175.90118.8
103A33.3Very low34.1Very low84 Ų84147.1 Ų147.169%0.69479%0.79SS**  trans-139.1-153.6-165.300000112.1
104P46.5Very low33.9Very low120 Ų120144 Ų14478%0.77978%0.781SS**  -96.7-159-117.341.3-23.8000112.2
105P48.9Very low34.8Very low103 Ų103139.5 Ų139.567%0.66978%0.781SS**  cis-140.7-129.27.944.5-21.3000114.5
106Q32.2Very low34.7Very low149 Ų149141.2 Ų141.270%0.69678%0.778SS**  trans89.5105-173.9-49.5-81.4-21.900111.6
107M33.5Very low34.8Very low147 Ų147138.6 Ų138.672%0.72478%0.779SS**  cis86.212041.49817366.100114.8
108E32.2Very low35.2Very low198 Ų198140.3 Ų140.393%0.92578%0.783SS**  trans-164.3176.5134-117.7179.6174.400111.4
109K34.8Very low35.3Very low190 Ų190140.7 Ų140.783%0.82679%0.786SS**  trans-140.3171.4-167-89.6178.2175.2172.40112.5
110T33Very low35.5Very low130 Ų130141.5 Ų141.580%0.79879%0.787SS**  trans74.7148.8155.622.50000117.3
111R30.8Very low36Very low229 Ų229143.6 Ų143.686%0.86480%0.795SS**  cis-151.8161.7-4.8-158.7166.4-172.5178.81.4110.8
112C27.9Very low35.8Very low126 Ų126138.2 Ų138.285%0.85179%0.787SS**  trans-73.9154.7177.3-34.20000113.8
113A31.6Very low35.9Very low110 Ų110133.6 Ų133.691%0.90978%0.78SS**  trans-151.7141.1151.700000110.7
114S35Very low36Very low108 Ų108137.8 Ų137.876%0.75579%0.791SS**  trans-147.6155170.9167.50000107.5
115P46.8Very low35.6Very low129 Ų129139.2 Ų139.284%0.83879%0.792SS**  -131.8170.212737.2-28.8000113.8
116D31.4Very low34.8Very low123 Ų123141.3 Ų141.366%0.65880%0.798SS**  trans-102159.5-170173.932.8000112.8S118D116-S118 PolarHBondContact OD1-N 3.39Å
117S34.3Very low35Very low119 Ų119139 Ų13983%0.83280%0.798SS**  trans-160.870.9162.3-78.50000112.8
118S36.4Very low35.3Very low90 Ų90139.4 Ų139.463%0.62980%0.803SS**  trans-1.9128.1145.4-71.10000119.1D116D116-S118 PolarHBondContact OD1-N 3.39Å
119S34.3Very low35.7Very low120 Ų120138.4 Ų138.484%0.83980%0.796SS**  -159.5149.6126.9-1650000110.9
120M36.9Very low35.7Very low154 Ų154135.7 Ų135.776%0.75979%0.79SS**  trans-146.4-178.6-173.2-57.6-173.4-169.700111.3
121M46.5Very low35.9Very low179 Ų179135 Ų13588%0.88279%0.79SS**  trans77.1140.8-175.8-43.8-52.217700114.4
122A32.5Very low36.3Very low82 Ų82130.3 Ų130.368%0.67879%0.79SS**  cis138.4138.7-15.800000110
123C34.8Very low36.6Very low116 Ų116129.7 Ų129.778%0.78479%0.787SS**  trans26.2130.616460.30000121.4
124N35Very low37.3Very low172 Ų172130.2 Ų130.292%0.9278%0.781SS**  -152.2141.3128.3-103.7-28.5000110.5
125N39.1Very low37.3Very low150 Ų150130 Ų13080%0.80278%0.78SS**  trans-157.9105.6179.8178.4102.8000108.3
126D30.9Very low37.3Very low146 Ų146130.1 Ų130.178%0.78178%0.781SS**  trans-168.1160.5154-137-72.5000114.5
127S37.5Very low37.7Very low101 Ų101129.6 Ų129.671%0.70679%0.787SS**  trans69.7112.1150-70.60000121.4
128D40Very low38.3Very low155 Ų155134 Ų13483%0.82979%0.791SS**  trans-51138.9153.7-70.3-87.9000112.9
129K40.3Very low38.6Very low178 Ų178133.2 Ų133.277%0.77480%0.796SS**  trans-158.4131130.1-92.7-29.4-156.9153.90115.4
130D34Very low39.2Very low132 Ų132136.1 Ų136.171%0.70679%0.794SS**  trans24.1125.8150.8-66.6-67.2000120.9
131S37Very low39.6Very low115 Ų115135.6 Ų135.680%0.80479%0.789SS**  trans-73.5157.3164.4-600000112.1
132P39Very low39.8Very low132 Ų132137 Ų13786%0.85779%0.791SS**  -134.6167100.837.7-28.9000114.5
133S35.7Very low40.9Very low112 Ų112142.1 Ų142.178%0.78380%0.798SS**  trans-105.9-170.4-170.470.50000112.2
134P46.8Very low41.4Very low121 Ų121144.3 Ų144.379%0.78680%0.802SS**  -129.1-179.4-110.136-15.6000115.1
135S33.6Very low41.8Very low105 Ų105141.6 Ų141.673%0.73480%0.796SS**  trans-150.7148.1153.865.30000110.9
136P47.2Very low42.2Very low131 Ų131137.6 Ų137.685%0.85179%0.79SS**  -139.2165.6110.338.3-27.7000113.6
137S39.2Very low43.1Very low112 Ų112136.7 Ų136.778%0.78379%0.792SS**  trans-135.8119.4-176-53.70000114.1
138K47.5Very low43.3Very low212 Ų212136.1 Ų136.192%0.92279%0.788SS**  trans-155.5141.1146.2-59.6-164.4-179.3177.20105.5
139G42.2Very low43.7Very low72 Ų72133.5 Ų133.574%0.74279%0.788SS**  cis81.112841.200000109.2
140K46.6Very low44.5Very low182 Ų182135.5 Ų135.579%0.79179%0.791SS**  cis-158.1169.26.1-91-163.2165.5-1430107.6
141E46.9Very low45.5Very low142 Ų142139.6 Ų139.666%0.66480%0.802SS**  cis-166145.2-22.8-115.1-169.6-90.200107.5
142K50.8Low46.7Very low209 Ų209136.9 Ų136.991%0.90979%0.792SS**  trans-162.1135.3151.9-156.7163.6-174.4172.90113.4
143K55Low47.9Very low189 Ų189138.8 Ų138.882%0.82279%0.787SS**  trans-89.9138.6170.9-64.7-176.8-178.9179.70111.4
144N44.3Very low49.1Very low162 Ų162135.6 Ų135.687%0.86677%0.772SS**  trans-141161.7141.660.328.2000108.9
145S43.4Very low50.1Low116 Ų116137.6 Ų137.681%0.81177%0.771SS**PPolyproline II helixtrans-97.4124.2-168.4-164.70000111.3
146G48.9Very low51.6Low65 Ų65137.4 Ų137.467%0.6776%0.761SS**PPolyproline II helixtrans-68.2130.3173.500000111.2
147P48.3Very low52.9Low127 Ų127135.5 Ų135.583%0.82574%0.74SS**PPolyproline II helixtrans-74.5130.4-174.428.6-34.4000112.8
148S41.7Very low54.7Low89 Ų89137 Ų13762%0.62273%0.733SS**  trans36.3102.2151.8-160.40000116.9R150S148-R150 PolarHBondContact OG-N 2.87Å
149A49.6Very low55.8Low100 Ų100134.2 Ų134.283%0.82672%0.717SS**  cis58.730.335.600000115.6
150R55.8Low57.4Low221 Ų221137.1 Ų137.183%0.83471%0.709SS**  trans-148.3120.8155.1-95.5118.1-161-91.52114.1S148S148-R150 PolarHBondContact OG-N 2.87Å
151K56.3Low58.4Low217 Ų217133.3 Ų133.394%0.94370%0.696SS**SBendtrans48.499.1141.2-158.3171.7-174176.60117.9
152G61.4Low59.5Low58 Ų58134.4 Ų134.460%0.59869%0.694SS**  trans156.5-13.4162.300000119.5G154G152-G154 PolarHBondContact O-N 3Å
153K63.8Low60.1Low172 Ų172128.7 Ų128.775%0.74867%0.671SS**THydrogen-bonded Turntrans-64.4128.7175-81.2-161.9168-140.40110.9E157K153-E157 WeakPolarHBondContact CB-OE2 3.36Å; K153-E157 VanDerWaalsContact CD-OE2 3.28Å; K153-E157 WeakPolarHBondContact CD-OE2 3.46Å; K153-E157 WeakPolarHBondContact CE-OE1 3.37Å; K153-E157 WeakPolarHBondContact CG-OE2 3.45Å; K153-E157 IonicContact NZ-OE1 3.88Å; K153-E157 PolarHBondContact NZ-OE1 2.99Å; K153-E157 IonicContact NZ-OE2 2.65Å
154G62.5Low61.1Low45 Ų45128.8 Ų128.846%0.46467%0.671SS.*THydrogen-bonded Turntrans136.1-28.7177.700000116.1G152 K158G152-G154 PolarHBondContact O-N 3Å; G154-K158 WeakPolarHBondContact O-CB 3.48Å; G154-K158 WeakPolarHBondContact O-CD 3.05Å
155Q67.6Low62.7Low163 Ų163130.9 Ų130.976%0.76267%0.667SS**THydrogen-bonded Turntrans-114.4-48.6178.9-153.5178.723.800113.3K158 R159Q155-K158 PolarHBondContact O-N 3.32Å; Q155-R159 WeakPolarHBondContact O-CB 3.37Å; Q155-R159 PolarHBondContact O-N 2.86Å
156I65.4Low64Low101 Ų101133.4 Ų133.452%0.51866%0.659SS.*Hα-helixtrans-67.5-39.7175.3-16964.2000111.9K158 R159 K160I156-K158 VanDerWaalsContact C-N 3.33Å; I156-K158 PolarHBondContact O-N 3.5Å; I156-R159 WeakPolarHBondContact O-CB 3.34Å; I156-R159 PolarHBondContact O-N 3.44Å; I156-K160 PolarHBondContact O-N 3.11Å
157E74.3Confident64.5Low92 Ų92136.2 Ų136.243%0.4367%0.668SS.*Hα-helixtrans-68.5-33.9176.8-164.2166.4-141.100111.5K153 L161K153-E157 WeakPolarHBondContact CB-OE2 3.36Å; K153-E157 VanDerWaalsContact CD-OE2 3.28Å; K153-E157 WeakPolarHBondContact CD-OE2 3.46Å; K153-E157 WeakPolarHBondContact CE-OE1 3.37Å; K153-E157 WeakPolarHBondContact CG-OE2 3.45Å; K153-E157 IonicContact NZ-OE1 3.88Å; K153-E157 PolarHBondContact NZ-OE1 2.99Å; K153-E157 IonicContact NZ-OE2 2.65Å; E157-L161 WeakPolarHBondContact O-CB 3.49Å; E157-L161 PolarHBondContact O-N 2.97Å
158K75.9Confident64.9Low143 Ų143134.6 Ų134.662%0.62266%0.656SS**Hα-helixtrans-81.1-23.9176.2-158.7170.2-171.3172.90112.7G154 Q155 I156 R162G154-K158 WeakPolarHBondContact O-CB 3.48Å; G154-K158 WeakPolarHBondContact O-CD 3.05Å; Q155-K158 PolarHBondContact O-N 3.32Å; I156-K158 VanDerWaalsContact C-N 3.33Å; I156-K158 PolarHBondContact O-N 3.5Å; K158-R162 WeakPolarHBondContact O-CG 3.38Å; K158-R162 PolarHBondContact O-N 2.94Å; K158-R162 VanDerWaalsContact O-N 3.15Å
159R70.8Confident66Low154 Ų154133.3 Ų133.358%0.58166%0.657SS**Hα-helixtrans-66.5-57.8163.3-175-176.2-67.8176.3-2.4109.1Q155 I156 L161 R162 E163Q155-R159 WeakPolarHBondContact O-CB 3.37Å; Q155-R159 PolarHBondContact O-N 2.86Å; I156-R159 WeakPolarHBondContact O-CB 3.34Å; I156-R159 PolarHBondContact O-N 3.44Å; R159-L161 PolarHBondContact O-N 3.37Å; R159-L161 VanDerWaalsContact O-N 3.17Å; R159-R162 CarbonylContact O-C 3.33Å; R159-R162 WeakPolarHBondContact O-CA 3.48Å; R159-R162 WeakPolarHBondContact O-CB 3.48Å; R159-R162 PolarHBondContact O-N 2.92Å; R159-E163 WeakPolarHBondContact O-CB 3.15Å; R159-E163 PolarHBondContact O-N 3.02Å
160K76.1Confident66.4Low132 Ų132135 Ų13557%0.57466%0.657SS**Hα-helixtrans-55-34.7176.2-78-166.9171-170.70113.6I156 E163 K164I156-K160 PolarHBondContact O-N 3.11Å; K160-E163 WeakPolarHBondContact O-CB 3.45Å; K160-K164 WeakPolarHBondContact O-CB 3.32Å; K160-K164 WeakPolarHBondContact O-CG 3.45Å; K160-K164 PolarHBondContact O-N 3.08Å
161L67.1Low66.3Low102 Ų102130.2 Ų130.253%0.53465%0.652SS.*Hα-helixtrans-72.3-31.8173.7-170.768000113.1E157 R159 R165E157-L161 WeakPolarHBondContact O-CB 3.49Å; E157-L161 PolarHBondContact O-N 2.97Å; R159-L161 PolarHBondContact O-N 3.37Å; R159-L161 VanDerWaalsContact O-N 3.17Å; L161-R165 WeakPolarHBondContact O-CB 3.08Å; L161-R165 VanDerWaalsContact O-CG 3.27Å; L161-R165 WeakPolarHBondContact O-CG 3.34Å; L161-R165 PolarHBondContact O-N 2.9Å
162R70.4Confident66.4Low165 Ų165125.2 Ų125.262%0.62364%0.644SS**Hα-helixtrans-71.6-39.9170.5-82.9-176.6168.3-165.4-2.5111.5K158 R159 R165 R166K158-R162 WeakPolarHBondContact O-CG 3.38Å; K158-R162 PolarHBondContact O-N 2.94Å; K158-R162 VanDerWaalsContact O-N 3.15Å; R159-R162 CarbonylContact O-C 3.33Å; R159-R162 WeakPolarHBondContact O-CA 3.48Å; R159-R162 WeakPolarHBondContact O-CB 3.48Å; R159-R162 PolarHBondContact O-N 2.92Å; R162-R165 CarbonylContact O-C 3.56Å; R162-R165 VanDerWaalsContact O-C 3.26Å; R162-R165 PolarHBondContact O-N 3.2Å; R162-R165 VanDerWaalsContact O-N 3.13Å; R162-R166 WeakPolarHBondContact O-CB 3.44Å; R162-R166 VanDerWaalsContact O-CG 3.29Å; R162-R166 WeakPolarHBondContact O-CG 3.35Å; R162-R166 PolarHBondContact O-N 3.49Å
163E62.8Low66.4Low89 Ų89129 Ų12942%0.41665%0.65SS.*Hα-helixtrans-59.4-54.6174.7-133.1145.5-128.400110.3R159 K160 R165 R166R159-E163 WeakPolarHBondContact O-CB 3.15Å; R159-E163 PolarHBondContact O-N 3.02Å; K160-E163 WeakPolarHBondContact O-CB 3.45Å; E163-R165 PolarHBondContact O-N 3.43Å; E163-R166 CarbonylContact O-C 3.26Å; E163-R166 PolarHBondContact O-N 3.24Å; E163-R166 VanDerWaalsContact O-N 3.07Å
164K76.2Confident65.9Low191 Ų191126 Ų12683%0.8365%0.647SS**THydrogen-bonded Turntrans-60.9-8.3172.2-76.4-165.3170.6-1600115.1K160K160-K164 WeakPolarHBondContact O-CB 3.32Å; K160-K164 WeakPolarHBondContact O-CG 3.45Å; K160-K164 PolarHBondContact O-N 3.08Å
165R78.3Confident65.5Low207 Ų207129.9 Ų129.978%0.78167%0.668SS**THydrogen-bonded Turntrans-12412.7178.3-63.8-175.770.7165.64.7113L161 R162 E163L161-R165 WeakPolarHBondContact O-CB 3.08Å; L161-R165 VanDerWaalsContact O-CG 3.27Å; L161-R165 WeakPolarHBondContact O-CG 3.34Å; L161-R165 PolarHBondContact O-N 2.9Å; R162-R165 CarbonylContact O-C 3.56Å; R162-R165 VanDerWaalsContact O-C 3.26Å; R162-R165 PolarHBondContact O-N 3.2Å; R162-R165 VanDerWaalsContact O-N 3.13Å; E163-R165 PolarHBondContact O-N 3.43Å
166R71.5Confident64.2Low169 Ų169127.7 Ų127.764%0.63866%0.661SS**SBendtrans-149.194.3176.1-68.1174.2162-142.7-11.2105.9R162 E163 T168R162-R166 WeakPolarHBondContact O-CB 3.44Å; R162-R166 VanDerWaalsContact O-CG 3.29Å; R162-R166 WeakPolarHBondContact O-CG 3.35Å; R162-R166 PolarHBondContact O-N 3.49Å; E163-R166 CarbonylContact O-C 3.26Å; E163-R166 PolarHBondContact O-N 3.24Å; E163-R166 VanDerWaalsContact O-N 3.07Å; R166-T168 PolarHBondContact O-N 3.35Å
167S58.9Low63.5Low123 Ų123131.1 Ų131.186%0.8668%0.675SS**  trans-53.7106.5176.7-168.50000109.2G169S167-G169 PolarHBondContact O-N 3.42Å
168T56.4Low62.2Low93 Ų93132.5 Ų132.557%0.57169%0.694SS**  trans-79.2106.2164.647.60000105R166R166-T168 PolarHBondContact O-N 3.35Å
169G65.1Low61.3Low63 Ų63133.8 Ų133.865%0.64971%0.707SS**SBendtrans-54.7153.7179.500000111.6S167S167-G169 PolarHBondContact O-N 3.42Å
170V57.4Low60.5Low135 Ų135133.7 Ų133.782%0.81872%0.718SS**  trans67.392.2-168.9-167.90000112.8
171V53.4Low58.8Low121 Ų121136.6 Ų136.673%0.73373%0.734SS**  trans-83.9118.2157.7174.30000107.1I173V171-I173 HydrophobicContact CG1-CG1 4.44Å; V171-I173 PolarHBondContact O-N 2.79Å
172S60.1Low57.9Low111 Ų111139.3 Ų139.378%0.77675%0.748SS**  trans-69.4102171.4-53.20000109.9
173I59.9Low56.6Low139 Ų139139 Ų13971%0.71376%0.759SS**  trans-81.9125.8171.1-55.5178000107.6V171 S175V171-I173 HydrophobicContact CG1-CG1 4.44Å; V171-I173 PolarHBondContact O-N 2.79Å; I173-S175 PolarHBondContact O-N 2.73Å
174P53.1Low56.2Low108 Ų108142.1 Ų142.170%0.70178%0.779SS**  trans-66.6125.5171.1-17.831.9000110N176P174-N176 PolarHBondContact O-N 3.28Å
175S54.4Low54.8Low127 Ų127139.9 Ų139.989%0.88878%0.776SS**  trans-75.2109.7-177.3-47.90000112I173I173-S175 PolarHBondContact O-N 2.73Å
176N40.4Very low53.8Low117 Ų117136.5 Ų136.563%0.62677%0.773SS**  trans-139.6124.9156.771.8-68.7000111.5P174P174-N176 PolarHBondContact O-N 3.28Å
177E51.9Low53Low172 Ų172132.3 Ų132.380%0.80477%0.774SS**  trans39.878.6157.372.9-140.3142.700119.6
178S45.4Very low52.8Low121 Ų121128.8 Ų128.885%0.84676%0.757SS**  trans-94.298.8146.1540000109.4
179L58.3Low52.8Low170 Ų170128.1 Ų128.189%0.8975%0.748SS**  trans-65.1151.6164.7-179.570.1000109.6
180D53.4Low52.4Low152 Ų152131.3 Ų131.381%0.81374%0.744SS**  trans85.275175-151.939.5000115.8
181E40Very low52.4Low194 Ų194130.7 Ų130.791%0.90774%0.736SS**  trans-144.8101.9155.2-147.3161.2-127.400108.3
182L48Very low53.1Low159 Ų159130.3 Ų130.383%0.83272%0.721SS**  trans-132.186172.3-92.4177.4000108.4
183D42.7Very low53.6Low158 Ų158132.2 Ų132.285%0.84571%0.711SS**  trans-155.3106.4148.9-111.9-24.2000107.7D185D183-D185 VanDerWaalsContact C-N 3.31Å; D183-D185 PolarHBondContact O-N 3.01Å
184D55.1Low54.3Low155 Ų155130 Ų13083%0.82970%0.698SS**  trans-76.179.8177.8-81.8-52000110D186D184-D186 PolarHBondContact O-N 3.3Å
185D47.8Very low55.1Low144 Ų144131.2 Ų131.277%0.7769%0.694SS**  trans-77.474.1172.1-126.4-12.2000109.9D183 A187 G188D183-D185 VanDerWaalsContact C-N 3.31Å; D183-D185 PolarHBondContact O-N 3.01Å; D185-A187 PolarHBondContact O-N 3.28Å; D185-G188 PolarHBondContact O-N 3Å
186D56.2Low56.2Low136 Ų136130 Ų13073%0.72768%0.675SS**THydrogen-bonded Turntrans-51.6-12-172.9-157.916.4000114.7D184D184-D186 PolarHBondContact O-N 3.3Å
187A55.3Low58.2Low80 Ų80130.5 Ų130.566%0.66167%0.673SS**Hα-helixtrans-68-35.6171.900000113.5D185D185-A187 PolarHBondContact O-N 3.28Å
188G54.1Low59.8Low49 Ų49127.9 Ų127.951%0.50566%0.664SS.*Hα-helixtrans-76.7-32.8-17500000113.9D185 R192D185-G188 PolarHBondContact O-N 3Å; G188-R192 PolarHBondContact O-N 3.06Å
189E56.5Low61.7Low79 Ų79126.3 Ų126.337%0.36965%0.649SS.*Hα-helixtrans-74.7-28.5-177.7-139-146.6-153.500112.8R192 R193E189-R192 VanDerWaalsContact CD-NH2 3.31Å; E189-R192 IonicContact OE1-CZ 3.73Å; E189-R192 IonicContact OE1-NH2 2.68Å; E189-R192 PolarHBondContact OE1-NH2 3.01Å; E189-R193 VanDerWaalsContact O-CB 3.26Å; E189-R193 WeakPolarHBondContact O-CB 2.97Å; E189-R193 PolarHBondContact O-N 3.23Å; E189-R193 IonicContact OE2-CZ 2.7Å; E189-R193 IonicContact OE2-NE 3.81Å; E189-R193 IonicContact OE2-NH2 2.75Å; E189-R193 PolarHBondContact OE2-NH2 3.41Å
190K55.9Low63.2Low131 Ų131125.2 Ų125.257%0.5764%0.639SS**Hα-helixtrans-63.1-45.3174.1-177.5-179.8176.1-73.60111.7R193 E194K190-R193 PolarHBondContact O-N 3.22Å; K190-E194 IonicContact NZ-OE2 3.22Å; K190-E194 PolarHBondContact NZ-OE2 3.39Å; K190-E194 WeakPolarHBondContact O-CB 3.34Å; K190-E194 PolarHBondContact O-N 2.76Å
191D59.3Low64.6Low121 Ų121122.1 Ų122.165%0.64763%0.626SS**Hα-helixtrans-62.8-46.4-179.2-164.549.6000110.9R193 E194 E195D191-R193 VanDerWaalsContact C-N 3.33Å; D191-R193 PolarHBondContact O-N 3.06Å; D191-E194 PolarHBondContact O-N 2.91Å; D191-E195 PolarHBondContact O-N 3.05Å
192R67.6Low66.8Low114 Ų114116.8 Ų116.843%0.4360%0.604SS.*Hα-helixtrans-59.5-40.5173.1-178.5172.561.675.5-4.3112.6G188 E189 E195 E196G188-R192 PolarHBondContact O-N 3.06Å; E189-R192 VanDerWaalsContact CD-NH2 3.31Å; E189-R192 IonicContact OE1-CZ 3.73Å; E189-R192 IonicContact OE1-NH2 2.68Å; E189-R192 PolarHBondContact OE1-NH2 3.01Å; R192-E195 PolarHBondContact O-N 2.94Å; R192-E196 WeakPolarHBondContact CG-OE1 3.26Å; R192-E196 IonicContact CZ-OE1 2.71Å; R192-E196 IonicContact NH1-OE1 2.72Å; R192-E196 PolarHBondContact NH1-OE1 3.07Å; R192-E196 IonicContact NH1-OE2 2.61Å; R192-E196 WeakPolarHBondContact O-CB 3.27Å; R192-E196 WeakPolarHBondContact O-CG 3.31Å; R192-E196 PolarHBondContact O-N 3.36Å
193R69.4Low68.6Low150 Ų150112.3 Ų112.357%0.56658%0.583SS**Hα-helixtrans-69.2-35.4178.2-164.3-176.4-60.2-179.73112.3E189 K190 D191 E196 E197E189-R193 VanDerWaalsContact O-CB 3.26Å; E189-R193 WeakPolarHBondContact O-CB 2.97Å; E189-R193 PolarHBondContact O-N 3.23Å; E189-R193 IonicContact OE2-CZ 2.7Å; E189-R193 IonicContact OE2-NE 3.81Å; E189-R193 IonicContact OE2-NH2 2.75Å; E189-R193 PolarHBondContact OE2-NH2 3.41Å; K190-R193 PolarHBondContact O-N 3.22Å; D191-R193 VanDerWaalsContact C-N 3.33Å; D191-R193 PolarHBondContact O-N 3.06Å; R193-E196 PolarHBondContact O-N 2.88Å; R193-E197 WeakPolarHBondContact O-CB 3.27Å; R193-E197 PolarHBondContact O-N 3.13Å
194E74.6Confident70.5Confident92 Ų92112 Ų11243%0.4357%0.574SS.*Hα-helixtrans-71.2-36.9175.8-164.4163.4161.400111.2K190 D191 E197 L198K190-E194 IonicContact NZ-OE2 3.22Å; K190-E194 PolarHBondContact NZ-OE2 3.39Å; K190-E194 WeakPolarHBondContact O-CB 3.34Å; K190-E194 PolarHBondContact O-N 2.76Å; D191-E194 PolarHBondContact O-N 2.91Å; E194-E197 PolarHBondContact O-N 3.12Å; E194-L198 HydrophobicContact CG-CD1 4.46Å; E194-L198 WeakPolarHBondContact O-CB 3.27Å; E194-L198 WeakPolarHBondContact O-CD1 3.42Å; E194-L198 PolarHBondContact O-N 3.24Å
195E71.4Confident71.8Confident134 Ų134109.6 Ų109.663%0.62656%0.558SS**Hα-helixtrans-63.8-46.9168.8-173.6178.2-154.400111.9D191 R192 E197 L198 V199D191-E195 PolarHBondContact O-N 3.05Å; R192-E195 PolarHBondContact O-N 2.94Å; E195-E197 VanDerWaalsContact C-N 3.31Å; E195-E197 PolarHBondContact O-N 3.27Å; E195-L198 PolarHBondContact O-N 3Å; E195-V199 WeakPolarHBondContact O-CG2 3.3Å; E195-V199 PolarHBondContact O-N 3.06Å
196E76.8Confident73Confident103 Ų103106.4 Ų106.448%0.48154%0.541SS..Hα-helixtrans-59.9-38.8176.4-75.9173.3-151.500112R192 R193 Q200R192-E196 WeakPolarHBondContact CG-OE1 3.26Å; R192-E196 IonicContact CZ-OE1 2.71Å; R192-E196 IonicContact NH1-OE1 2.72Å; R192-E196 PolarHBondContact NH1-OE1 3.07Å; R192-E196 IonicContact NH1-OE2 2.61Å; R192-E196 WeakPolarHBondContact O-CB 3.27Å; R192-E196 WeakPolarHBondContact O-CG 3.31Å; R192-E196 PolarHBondContact O-N 3.36Å; R193-E196 PolarHBondContact O-N 2.88Å; E196-Q200 WeakPolarHBondContact O-CB 3.46Å; E196-Q200 PolarHBondContact O-N 3.05Å
197E82.1Confident73.9Confident126 Ų126105.4 Ų105.459%0.58953%0.532SS*.Hα-helixtrans-69.6-42.9174.4-171.5168.5-173.300112.2R193 E194 E195 V199 Q200 V201R193-E197 WeakPolarHBondContact O-CB 3.27Å; R193-E197 PolarHBondContact O-N 3.13Å; E194-E197 PolarHBondContact O-N 3.12Å; E195-E197 VanDerWaalsContact C-N 3.31Å; E195-E197 PolarHBondContact O-N 3.27Å; E197-V199 VanDerWaalsContact C-N 3.32Å; E197-V199 PolarHBondContact O-N 3.04Å; E197-Q200 PolarHBondContact O-N 3.26Å; E197-V201 HydrophobicContact CG-CG2 4.42Å; E197-V201 WeakPolarHBondContact O-CG2 3.46Å; E197-V201 PolarHBondContact O-N 2.8Å
198L85Confident74.7Confident118 Ų118104.9 Ų104.962%0.61852%0.523SS*.Hα-helixtrans-58.4-42.8174.1-105.573.3000112E194 E195 N202E194-L198 HydrophobicContact CG-CD1 4.46Å; E194-L198 WeakPolarHBondContact O-CB 3.27Å; E194-L198 WeakPolarHBondContact O-CD1 3.42Å; E194-L198 PolarHBondContact O-N 3.24Å; E195-L198 PolarHBondContact O-N 3Å; L198-N202 VanDerWaalsContact O-CB 3.3Å; L198-N202 WeakPolarHBondContact O-CB 3.19Å; L198-N202 PolarHBondContact O-N 3.42Å
199V86.5Confident75.1Confident87 Ų87109 Ų10953%0.52753%0.531SS..Hα-helixtrans-65.4-39.7176.7170.50000111.1E195 E197 T203E195-V199 WeakPolarHBondContact O-CG2 3.3Å; E195-V199 PolarHBondContact O-N 3.06Å; E197-V199 VanDerWaalsContact C-N 3.32Å; E197-V199 PolarHBondContact O-N 3.04Å; V199-T203 WeakPolarHBondContact O-CB 3.44Å; V199-T203 PolarHBondContact O-N 2.91Å; V199-T203 PolarHBondContact O-OG1 3.14Å
200Q89.2Confident75.3Confident147 Ų147110.1 Ų110.169%0.68754%0.544SS*.Hα-helixtrans-66.2-45.4176.6-169.9170.6114.200112.2E196 E197 T203 F204E196-Q200 WeakPolarHBondContact O-CB 3.46Å; E196-Q200 PolarHBondContact O-N 3.05Å; E197-Q200 PolarHBondContact O-N 3.26Å; Q200-T203 PolarHBondContact O-N 3.5Å; Q200-F204 PolarHBondContact O-N 2.93Å
201V83.8Confident75.3Confident87 Ų87107.5 Ų107.553%0.52755%0.546SS..Hα-helixtrans-63.8-42.5176.1171.90000111.1E197 T203 F204 Q205E197-V201 HydrophobicContact CG-CG2 4.42Å; E197-V201 WeakPolarHBondContact O-CG2 3.46Å; E197-V201 PolarHBondContact O-N 2.8Å; V201-T203 VanDerWaalsContact C-N 3.34Å; V201-T203 PolarHBondContact O-N 3.41Å; V201-F204 PolarHBondContact O-N 3.25Å; V201-Q205 WeakPolarHBondContact O-CB 3.36Å; V201-Q205 PolarHBondContact O-N 2.91Å
202N84.6Confident74.5Confident83 Ų83106 Ų10644%0.44454%0.538SS..Hα-helixtrans-65.4-38.3176.8-166.3-100.3000111.9L198 Q205 N206L198-N202 VanDerWaalsContact O-CB 3.3Å; L198-N202 WeakPolarHBondContact O-CB 3.19Å; L198-N202 PolarHBondContact O-N 3.42Å; N202-Q205 PolarHBondContact O-N 3.08Å; N202-N206 VanDerWaalsContact O-CG 3.3Å; N202-N206 PolarHBondContact O-N 3.03Å; N202-N206 PolarHBondContact O-ND2 3.34Å; N202-N206 PolarHBondContact OD1-ND2 3.45Å
203T86.9Confident74Confident64 Ų64106.3 Ų106.339%0.39356%0.555SS.*Hα-helixtrans-61-51.6174.3-57.70000110.6V199 Q200 V201 Q205 N206 E207V199-T203 WeakPolarHBondContact O-CB 3.44Å; V199-T203 PolarHBondContact O-N 2.91Å; V199-T203 PolarHBondContact O-OG1 3.14Å; Q200-T203 PolarHBondContact O-N 3.5Å; V201-T203 VanDerWaalsContact C-N 3.34Å; V201-T203 PolarHBondContact O-N 3.41Å; T203-Q205 VanDerWaalsContact C-N 3.28Å; T203-Q205 PolarHBondContact O-N 2.92Å; T203-N206 PolarHBondContact O-N 3.19Å; T203-E207 WeakPolarHBondContact O-CG 3.23Å; T203-E207 PolarHBondContact O-N 3.08Å
204F82.8Confident73.2Confident152 Ų152102.8 Ų102.867%0.66756%0.558SS**Hα-helixtrans-61.3-34.3177.4-174.2-99.9000112.9Q200 V201 S208Q200-F204 PolarHBondContact O-N 2.93Å; V201-F204 PolarHBondContact O-N 3.25Å; F204-S208 VanDerWaalsContact O-CB 3.3Å; F204-S208 WeakPolarHBondContact O-CB 3.23Å; F204-S208 PolarHBondContact O-N 2.89Å; F204-S208 PolarHBondContact O-OG 2.91Å
205Q82.1Confident72.1Confident105 Ų105102.8 Ų102.849%0.49156%0.564SS.*Hα-helixtrans-67.8-43.5174.7-169.9175.236.800112.3V201 N202 T203 S208 M209V201-Q205 WeakPolarHBondContact O-CB 3.36Å; V201-Q205 PolarHBondContact O-N 2.91Å; N202-Q205 PolarHBondContact O-N 3.08Å; T203-Q205 VanDerWaalsContact C-N 3.28Å; T203-Q205 PolarHBondContact O-N 2.92Å; Q205-S208 WeakPolarHBondContact CA-OG 3.43Å; Q205-S208 PolarHBondContact O-OG 2.82Å; Q205-M209 WeakPolarHBondContact O-CG 3.3Å; Q205-M209 PolarHBondContact O-N 2.93Å; Q205-M209 VanDerWaalsContact O-N 3.08Å
206N73.1Confident70.9Confident76 Ų7699.8 Ų99.841%0.40657%0.57SS.*Hα-helixtrans-67.2-38.9176.5-69.9-45.9000112N202 T203 T210N202-N206 VanDerWaalsContact O-CG 3.3Å; N202-N206 PolarHBondContact O-N 3.03Å; N202-N206 PolarHBondContact O-ND2 3.34Å; N202-N206 PolarHBondContact OD1-ND2 3.45Å; T203-N206 PolarHBondContact O-N 3.19Å; N206-T210 WeakPolarHBondContact O-CG2 3.36Å; N206-T210 PolarHBondContact O-N 2.94Å; N206-T210 PolarHBondContact O-OG1 2.93Å
207E75.2Confident69.6Low116 Ų116105.3 Ų105.354%0.54259%0.588SS.*Hα-helixtrans-67.3-46.2175.7-72.3-179.1177.400111.5T203 M209 T210 A211T203-E207 WeakPolarHBondContact O-CG 3.23Å; T203-E207 PolarHBondContact O-N 3.08Å; E207-M209 VanDerWaalsContact C-N 3.31Å; E207-M209 PolarHBondContact O-N 3.17Å; E207-T210 CarbonylContact O-C 3.57Å; E207-T210 PolarHBondContact O-N 3.2Å; E207-T210 PolarHBondContact O-OG1 3.48Å; E207-A211 VanDerWaalsContact O-CB 3.23Å; E207-A211 WeakPolarHBondContact O-CB 3.41Å; E207-A211 PolarHBondContact O-N 3.31Å
208S71.4Confident68.1Low68 Ų68107.1 Ų107.148%0.47660%0.601SS.*Hα-helixtrans-67-26.3178.354.10000114.1F204 Q205F204-S208 VanDerWaalsContact O-CB 3.3Å; F204-S208 WeakPolarHBondContact O-CB 3.23Å; F204-S208 PolarHBondContact O-N 2.89Å; F204-S208 PolarHBondContact O-OG 2.91Å; Q205-S208 WeakPolarHBondContact CA-OG 3.43Å; Q205-S208 PolarHBondContact O-OG 2.82Å
209M63.8Low66.2Low136 Ų136110 Ų11067%0.6762%0.616SS**Hα-helixtrans-77.4-22.3169.1-71.9-160.8-5300114.1Q205 E207Q205-M209 WeakPolarHBondContact O-CG 3.3Å; Q205-M209 PolarHBondContact O-N 2.93Å; Q205-M209 VanDerWaalsContact O-N 3.08Å; E207-M209 VanDerWaalsContact C-N 3.31Å; E207-M209 PolarHBondContact O-N 3.17Å
210T58.9Low64.3Low103 Ų103114.6 Ų114.663%0.63263%0.631SS**Hα-helixtrans-101.5-12.4-17950.70000113.5N206 E207 D212N206-T210 WeakPolarHBondContact O-CG2 3.36Å; N206-T210 PolarHBondContact O-N 2.94Å; N206-T210 PolarHBondContact O-OG1 2.93Å; E207-T210 CarbonylContact O-C 3.57Å; E207-T210 PolarHBondContact O-N 3.2Å; E207-T210 PolarHBondContact O-OG1 3.48Å; T210-D212 PolarHBondContact O-N 3.3Å
211A56.3Low61.6Low76 Ų76116 Ų11663%0.62864%0.638SS**  trans-78.414.7176.500000114.9E207 P213E207-A211 VanDerWaalsContact O-CB 3.23Å; E207-A211 WeakPolarHBondContact O-CB 3.41Å; E207-A211 PolarHBondContact O-N 3.31Å; A211-P213 VanDerWaalsContact O-CD 3.26Å; A211-P213 WeakPolarHBondContact O-CD 3.36Å
212D43.9Very low59Low89 Ų89118.1 Ų118.148%0.47665%0.652SS.*  trans-68.2114.4166.7-179.8-3.7000109.6T210 A214 T215T210-D212 PolarHBondContact O-N 3.3Å; D212-A214 PolarHBondContact O-N 3.35Å; D212-A214 VanDerWaalsContact OD1-CB 3.27Å; D212-A214 WeakPolarHBondContact OD1-CB 3.26Å; D212-A214 PolarHBondContact OD1-N 2.72Å; D212-T215 PolarHBondContact O-N 3.39Å; D212-T215 PolarHBondContact O-OG1 3.25Å
213P55.2Low57.5Low120 Ų120119.6 Ų119.678%0.77967%0.666SS**G310 helixtrans-62.4-14.5-179.127.5-36.2000114A211 T215A211-P213 VanDerWaalsContact O-CD 3.26Å; A211-P213 WeakPolarHBondContact O-CD 3.36Å; P213-T215 VanDerWaalsContact C-N 3.25Å; P213-T215 PolarHBondContact O-N 2.93Å
214A52.9Low55.3Low77 Ų77126.3 Ų126.364%0.63669%0.689SS**G310 helixtrans-64.9-27.2172.800000113.2D212 G216D212-A214 PolarHBondContact O-N 3.35Å; D212-A214 VanDerWaalsContact OD1-CB 3.27Å; D212-A214 WeakPolarHBondContact OD1-CB 3.26Å; D212-A214 PolarHBondContact OD1-N 2.72Å; A214-G216 VanDerWaalsContact C-N 3.32Å; A214-G216 PolarHBondContact O-N 3.4Å
215T52.2Low53Low91 Ų91124.2 Ų124.256%0.55870%0.7SS**G310 helixtrans-74.7-19.8-171.6-35.50000113.5D212 P213 Y217D212-T215 PolarHBondContact O-N 3.39Å; D212-T215 PolarHBondContact O-OG1 3.25Å; P213-T215 VanDerWaalsContact C-N 3.25Å; P213-T215 PolarHBondContact O-N 2.93Å; T215-Y217 PolarHBondContact O-N 2.96Å; T215-Y217 VanDerWaalsContact O-N 3.08Å
216G46.4Very low51Low72 Ų72124.2 Ų124.274%0.74272%0.718SS**G310 helixtrans-68.1-8.7-168.900000116.9A214A214-G216 VanDerWaalsContact C-N 3.32Å; A214-G216 PolarHBondContact O-N 3.4Å
217Y48.4Very low49.4Very low218 Ų218126.8 Ų126.886%0.85574%0.742SS**G310 helixtrans-104-9.3-170-94.8-82.8000116.5T215T215-Y217 PolarHBondContact O-N 2.96Å; T215-Y217 VanDerWaalsContact O-N 3.08Å
218L51.5Low47.5Very low164 Ų164124.4 Ų124.486%0.85975%0.748SS**SBendtrans-109.4-12.4-165.7-166.355.5000116
219L45.4Very low46.2Very low178 Ų178133.2 Ų133.293%0.93277%0.771SS**  trans-10940.5-170.8-150.274000115
220Q45.4Very low45Very low184 Ų184136.2 Ų136.286%0.8678%0.781SS**  trans-113.752.9177-158.4-172.618.400113.7
221E34.2Very low44.2Very low176 Ų176140.5 Ų140.582%0.82279%0.791SS**  trans-149107.9168.4-129.5167.5-13600117.1
222T28.7Very low43.5Very low133 Ų133146.8 Ų146.882%0.81680%0.798SS**  trans68140.8154.963.20000122.2
223P52.1Low43.4Very low114 Ų114150.2 Ų150.274%0.7482%0.816SS**  trans-114.8170.4176.141.7-34.4000115.6
224K40.9Very low42.9Very low205 Ų205151 Ų15189%0.89182%0.819SS**  trans93.4118.5167.1-58.9169.4177.7166.50117.9
225A34.3Very low42.5Very low107 Ų107155.2 Ų155.288%0.88483%0.83SS**  -149.4154.412100000109.4
226A41Very low42.3Very low106 Ų106158 Ų15888%0.87684%0.84SS**  trans-135.6116.8177.800000111.5
227S38.8Very low42.1Very low130 Ų130163.8 Ų163.891%0.90985%0.85SS**  trans-165.1153.6170.6-165.70000107
228G35.7Very low41.8Very low65 Ų65163.4 Ų163.467%0.6785%0.853SS**  cis176.3137.7-2.100000106.9F230G228-F230 PolarHBondContact O-N 3.04Å
229R44.8Very low41.5Very low254 Ų254164.8 Ų164.896%0.95886%0.855SS**  trans-71131.3-169.7-53.3-179.2-153.5120.67.4111.2
230F37.4Very low41.3Very low198 Ų198165.8 Ų165.887%0.86886%0.855SS**  trans-135.1140.3154.7-144.4-95.7000111.5G228G228-F230 PolarHBondContact O-N 3.04Å
231K41.8Very low41Very low193 Ų193164.9 Ų164.984%0.83986%0.856SS**  trans-80.9134.6178.2-58.3174.6-178.4178.40108.6
232R42.5Very low41.3Very low209 Ų209162.3 Ų162.379%0.78986%0.857SS**  trans-140.910.3171.1-127.2-163.6-60.7132.1-4.3115.8T234R232-T234 VanDerWaalsContact C-N 3.3Å; R232-T234 PolarHBondContact O-N 3.17Å
233N41.8Very low41.6Very low160 Ų160160.4 Ų160.486%0.85686%0.855SS**THydrogen-bonded Turntrans-8170.9-178.9-166.815.2000111.7
234T43.7Very low40.8Very low138 Ų138166.9 Ų166.985%0.84787%0.865SS**THydrogen-bonded Turntrans-162.46169.8-7.20000116.1R232R232-T234 VanDerWaalsContact C-N 3.3Å; R232-T234 PolarHBondContact O-N 3.17Å
235L46Very low40.6Very low164 Ų164166.4 Ų166.486%0.85987%0.866SS**SBendtrans-151.956.4-178.8-16071.2000115.2
236I47.3Very low40.6Very low150 Ų150164.9 Ų164.977%0.76986%0.861SS**  trans-139.160.4166.5-44.9179000110.4
237M42.7Very low40.3Very low194 Ų194168.9 Ų168.996%0.95686%0.864SS**SBendtrans-148.645.8169.7-80.3-161.417300112.1
238K42.8Very low40.3Very low209 Ų209170.9 Ų170.991%0.90986%0.859SS**SBendtrans-1568.4168.1-135.8-172.1173.9-179.60119
239E44.5Very low40.4Very low193 Ų193176.8 Ų176.890%0.90287%0.869SS**  trans-151.564.3-175.2-158.1161.6-14300114.7
240Q40.8Very low40.4Very low200 Ų200174.2 Ų174.294%0.93587%0.867SS**  trans-14377.2155.5-75.9-158.20.800110.5
241N38.5Very low40.7Very low164 Ų164169.6 Ų169.688%0.87787%0.866SS**SBendtrans-151.2134.8157-142.5-10.5000107.7
242S40.9Very low40.7Very low122 Ų122164 Ų16485%0.85386%0.863SS**  trans70.788.8-164.5-163.80000116.2
243A34.7Very low40.6Very low94 Ų94157.3 Ų157.378%0.77786%0.859SS**  trans-153.9115.415300000111.8
244R35.9Very low40.5Very low250 Ų250156.5 Ų156.594%0.94386%0.855SS**  trans59.7101.8160.3-64.6-173.9170.3-143.2-6.1119.5
245Q37.8Very low40.6Very low194 Ų194158.2 Ų158.291%0.90786%0.857SS**  trans-65161.6139.2-60.7161.4-60.400110.6
246G32.5Very low40.6Very low75 Ų75161 Ų16177%0.77386%0.856SS**  trans79100.7144.800000118.3
247M36.2Very low40.4Very low191 Ų191162.7 Ų162.794%0.94186%0.861SS**  trans-147.4129137.9-169.6161.8174.800108.1
248E37.8Very low40.8Very low172 Ų172164.4 Ų164.480%0.80486%0.856SS**  trans-113.6-177.9-177.6-64.8177.6-160.600109.9
249E38.7Very low41Very low189 Ų189163.3 Ų163.388%0.88386%0.855SS**  trans63.6105.2-179.3-61-164.2111.200117.9
250E43.5Very low41.2Very low199 Ų199160 Ų16093%0.9384%0.843SS**  -136.1113.7125.8-171.1169.4-169.400109.6
251A45.3Very low41.7Very low102 Ų102162.2 Ų162.284%0.84384%0.843SS**  trans-117.184.6-177.200000111
252G39.9Very low42.3Very low75 Ų75162 Ų16277%0.77384%0.836SS**  trans-134.398.3177.100000111.4
253G41.5Very low42.4Very low68 Ų68162.2 Ų162.270%0.70184%0.838SS**  trans-111.6176.9-167.300000116.6
254N40.4Very low43.6Very low143 Ų143169 Ų16977%0.76584%0.843SS**  trans70.7123.6173.9-57.1-47.1000117.3
255I45.6Very low44.4Very low174 Ų174166 Ų16689%0.89284%0.84SS**  -149.1140.598.1-97.4151.2000110.5
256R46.3Very low45Very low224 Ų224159.9 Ų159.985%0.84583%0.829SS**  trans-75.4138.8-166.3-53.6152.3-178.2169-0.6111.8
257Q41.8Very low46.3Very low185 Ų185158.4 Ų158.486%0.86481%0.814SS**  trans-134.8135.7135-165.3156.6-9.500109.7
258R50.9Low47.6Very low229 Ų229151 Ų15186%0.86479%0.787SS**  trans-100.7110-179.2-79.4177.2169.2176.8-3.5109.4
259E47.8Very low49.2Very low187 Ų187145.5 Ų145.587%0.87477%0.771SS**  trans-174.1140.6149-102.3145.8-162.100105.9
260N47.7Very low51.3Low124 Ų124141.9 Ų141.966%0.66376%0.757SS**  cis-132.7137.512.6179.810.5000110.6H262N260-H262 PolarHBondContact O-N 2.75Å; N260-H262 PolarHBondContact OD1-CD2 3.26Å
261R52.8Low53.5Low245 Ų245138.1 Ų138.193%0.92574%0.743SS**  trans-95.872.7176.6-84.6-173.8167.6-174.1-5.3111.5
262H49.5Very low55.5Low161 Ų161139.1 Ų139.175%0.74573%0.73SS**  trans-135.9139.4168.5-82-71.9000112.5N260N260-H262 PolarHBondContact O-N 2.75Å; N260-H262 PolarHBondContact OD1-CD2 3.26Å
263S44.5Very low58Low126 Ų126142.3 Ų142.388%0.88172%0.723SS**  trans62.471.7172-144.60000117.7
264R59.3Low60.4Low235 Ų235144.9 Ų144.989%0.88771%0.711SS**  trans-133.456.7163-162.8-168.7178.9-1042.5112.6
265E51.9Low63Low188 Ų188141.9 Ų141.988%0.87970%0.698SS**SBendtrans-150.8107.2164.1-146.487.8-107.600107.2
266G52.2Low65.3Low66 Ų66140 Ų14068%0.6869%0.685SS**SBendtrans117.5-27.9179.300000116.9
267G59.1Low67.5Low44 Ų44133.7 Ų133.745%0.45467%0.665SS.*SBendtrans-77.6-40.3178.200000114.7N270 L271G267-N270 WeakPolarHBondContact O-CB 3.44Å; G267-N270 PolarHBondContact O-N 2.83Å; G267-N270 VanDerWaalsContact O-N 3.15Å; G267-L271 PolarHBondContact O-N 2.97Å
268G63.7Low70Confident36 Ų36128.6 Ų128.637%0.37164%0.644SS.*Hα-helixtrans-57.9-55.7-174.100000113.3N270 L271 E272G268-N270 PolarHBondContact O-N 3.24Å; G268-L271 PolarHBondContact O-N 2.76Å; G268-E272 WeakPolarHBondContact O-CG 3.32Å; G268-E272 PolarHBondContact O-N 3.37Å
269A70.6Confident72.1Confident56 Ų56122.4 Ų122.446%0.46363%0.625SS.*Hα-helixtrans-67.2-317900000115.2E272 K273A269-E272 WeakPolarHBondContact CA-OE2 3.46Å; A269-K273 VanDerWaalsContact O-CD 3.31Å; A269-K273 WeakPolarHBondContact O-CD 3.33Å; A269-K273 WeakPolarHBondContact O-CG 3.49Å
270N82.6Confident74.4Confident112 Ų112119.6 Ų119.660%0.59961%0.61SS**Hα-helixtrans-95.1-45.2169.2-165.5-36.3000110G267 G268 E272 K273 R274G267-N270 WeakPolarHBondContact O-CB 3.44Å; G267-N270 PolarHBondContact O-N 2.83Å; G267-N270 VanDerWaalsContact O-N 3.15Å; G268-N270 PolarHBondContact O-N 3.24Å; N270-E272 PolarHBondContact O-N 3.32Å; N270-K273 PolarHBondContact O-N 3.47Å; N270-R274 PolarHBondContact O-N 2.75Å
271L89.8Confident76.6Confident121 Ų121116.3 Ų116.363%0.63459%0.592SS**Hα-helixtrans-60-42.6171.8-68.8168.7000112.4G267 G268 R274 V275G267-L271 PolarHBondContact O-N 2.97Å; G268-L271 PolarHBondContact O-N 2.76Å; L271-R274 PolarHBondContact O-N 2.87Å; L271-V275 WeakPolarHBondContact O-CG2 3.29Å; L271-V275 PolarHBondContact O-N 2.98Å
272E88.2Confident78.5Confident123 Ų123108.9 Ų108.958%0.57557%0.57SS**Hα-helixtrans-57.8-49.1175.6-73.1156.4-166.900110.9G268 A269 N270 R274 V275 E276G268-E272 WeakPolarHBondContact O-CG 3.32Å; G268-E272 PolarHBondContact O-N 3.37Å; A269-E272 WeakPolarHBondContact CA-OE2 3.46Å; N270-E272 PolarHBondContact O-N 3.32Å; E272-R274 VanDerWaalsContact C-N 3.33Å; E272-R274 PolarHBondContact O-N 3.5Å; E272-V275 PolarHBondContact O-N 2.85Å; E272-V275 VanDerWaalsContact O-N 3.17Å; E272-E276 WeakPolarHBondContact O-CG 3.38Å; E272-E276 PolarHBondContact O-N 3.43Å
273K91.4Very high80.7Confident141 Ų141107.1 Ų107.161%0.61356%0.56SS**Hα-helixtrans-62.2-37.4174.7-71.2176.5-175.1177.80113A269 N270 V275 E276 E277A269-K273 VanDerWaalsContact O-CD 3.31Å; A269-K273 WeakPolarHBondContact O-CD 3.33Å; A269-K273 WeakPolarHBondContact O-CG 3.49Å; N270-K273 PolarHBondContact O-N 3.47Å; K273-V275 VanDerWaalsContact C-N 3.33Å; K273-E276 PolarHBondContact O-N 3.49Å; K273-E277 VanDerWaalsContact O-CB 3.26Å; K273-E277 WeakPolarHBondContact O-CB 3.33Å; K273-E277 PolarHBondContact O-N 2.88Å
274R93.2Very high83.2Confident123 Ų123105.3 Ų105.346%0.46454%0.54SS..Hα-helixtrans-70.2-30.6176.9-174.756.1179.2168.37.4112N270 L271 E272 E277 L278N270-R274 PolarHBondContact O-N 2.75Å; L271-R274 PolarHBondContact O-N 2.87Å; E272-R274 VanDerWaalsContact C-N 3.33Å; E272-R274 PolarHBondContact O-N 3.5Å; R274-E277 WeakPolarHBondContact CD-OE2 3.5Å; R274-E277 IonicContact CZ-OE2 3.95Å; R274-E277 IonicContact NE-OE2 3.6Å; R274-E277 IonicContact NH1-OE2 3.77Å; R274-E277 PolarHBondContact NH1-OE2 2.75Å; R274-L278 HydrophobicContact CG-CD1 4.22Å; R274-L278 WeakPolarHBondContact O-CB 3.35Å; R274-L278 WeakPolarHBondContact O-CD1 3.22Å; R274-L278 WeakPolarHBondContact O-CG 3.48Å; R274-L278 PolarHBondContact O-N 3.05Å
275V94.4Very high84.8Confident80 Ų8098.8 Ų98.849%0.48552%0.523SS..Hα-helixtrans-70.6-44.9170.3171.20000110.7L271 E272 K273 E277 L278 E279L271-V275 WeakPolarHBondContact O-CG2 3.29Å; L271-V275 PolarHBondContact O-N 2.98Å; E272-V275 PolarHBondContact O-N 2.85Å; E272-V275 VanDerWaalsContact O-N 3.17Å; K273-V275 VanDerWaalsContact C-N 3.33Å; V275-E277 VanDerWaalsContact C-N 3.3Å; V275-E277 PolarHBondContact O-N 3.22Å; V275-L278 PolarHBondContact O-N 3.43Å; V275-E279 VanDerWaalsContact O-CB 3.28Å; V275-E279 WeakPolarHBondContact O-CB 3.36Å; V275-E279 PolarHBondContact O-N 2.9Å
276E93.7Very high86.9Confident135 Ų13597.2 Ų97.263%0.63151%0.509SS*.Hα-helixtrans-58.7-40.1174-71.5177.1168.100112.5E272 K273 K280E272-E276 WeakPolarHBondContact O-CG 3.38Å; E272-E276 PolarHBondContact O-N 3.43Å; K273-E276 PolarHBondContact O-N 3.49Å; E276-K280 VanDerWaalsContact O-CB 3.26Å; E276-K280 WeakPolarHBondContact O-CB 3.44Å; E276-K280 PolarHBondContact O-N 3.22Å
277E92.7Very high89Confident91 Ų91101.2 Ų101.243%0.42551%0.507SS..Hα-helixtrans-64.8-53.8175.2-174.7175-12800111.3K273 R274 V275 E279 K280 D281K273-E277 VanDerWaalsContact O-CB 3.26Å; K273-E277 WeakPolarHBondContact O-CB 3.33Å; K273-E277 PolarHBondContact O-N 2.88Å; R274-E277 WeakPolarHBondContact CD-OE2 3.5Å; R274-E277 IonicContact CZ-OE2 3.95Å; R274-E277 IonicContact NE-OE2 3.6Å; R274-E277 IonicContact NH1-OE2 3.77Å; R274-E277 PolarHBondContact NH1-OE2 2.75Å; V275-E277 VanDerWaalsContact C-N 3.3Å; V275-E277 PolarHBondContact O-N 3.22Å; E277-E279 VanDerWaalsContact C-N 3.3Å; E277-E279 PolarHBondContact O-N 3.22Å; E277-K280 WeakPolarHBondContact O-CB 3.26Å; E277-K280 PolarHBondContact O-N 3.48Å; E277-D281 VanDerWaalsContact O-CG 3.26Å; E277-D281 PolarHBondContact O-N 3.27Å
278L94.8Very high90.8Very high78 Ų78106 Ų10641%0.40852%0.518SS..Hα-helixtrans-61.1-36.3176.7-72.2168.6000112.7R274 V275 L282R274-L278 HydrophobicContact CG-CD1 4.22Å; R274-L278 WeakPolarHBondContact O-CB 3.35Å; R274-L278 WeakPolarHBondContact O-CD1 3.22Å; R274-L278 WeakPolarHBondContact O-CG 3.48Å; R274-L278 PolarHBondContact O-N 3.05Å; V275-L278 PolarHBondContact O-N 3.43Å; L278-L282 WeakPolarHBondContact O-CB 3.48Å; L278-L282 VanDerWaalsContact O-CG 3.27Å; L278-L282 WeakPolarHBondContact O-CG 3.3Å; L278-L282 PolarHBondContact O-N 3.03Å
279E93.8Very high92.4Very high99 Ų99110.6 Ų110.646%0.46353%0.53SS..Hα-helixtrans-65-38.8172.9-93.6-158.8-142.500112.5V275 E277 K283V275-E279 VanDerWaalsContact O-CB 3.28Å; V275-E279 WeakPolarHBondContact O-CB 3.36Å; V275-E279 PolarHBondContact O-N 2.9Å; E277-E279 VanDerWaalsContact C-N 3.3Å; E277-E279 PolarHBondContact O-N 3.22Å; E279-K283 WeakPolarHBondContact O-CD 3.38Å; E279-K283 VanDerWaalsContact O-CE 3.23Å; E279-K283 WeakPolarHBondContact O-CE 3.46Å; E279-K283 WeakPolarHBondContact O-CG 3.47Å; E279-K283 PolarHBondContact O-N 2.99Å; E279-K283 IonicContact OE2-NZ 3.81Å; E279-K283 PolarHBondContact OE2-NZ 3.05Å
280K95.9Very high93.6Very high128 Ų128113.2 Ų113.256%0.55754%0.535SS*.Hα-helixtrans-70.1-43.2178176.5-167.8166.2-143.70110.6E276 E277 K283 L284E276-K280 VanDerWaalsContact O-CB 3.26Å; E276-K280 WeakPolarHBondContact O-CB 3.44Å; E276-K280 PolarHBondContact O-N 3.22Å; E277-K280 WeakPolarHBondContact O-CB 3.26Å; E277-K280 PolarHBondContact O-N 3.48Å; K280-K283 CarbonylContact O-C 3.6Å; K280-K283 WeakPolarHBondContact O-CB 3.36Å; K280-K283 PolarHBondContact O-N 2.71Å; K280-K283 VanDerWaalsContact O-N 3.13Å; K280-L284 HydrophobicContact CG-CD1 4.38Å; K280-L284 WeakPolarHBondContact O-CG 3.47Å; K280-L284 PolarHBondContact O-N 3.39Å
281D94Very high94.3Very high55 Ų55111.7 Ų111.729%0.29453%0.534SS..Hα-helixtrans-65.4-46.6178.9-63.6-14.1000110E277 K283 L284 D285E277-D281 VanDerWaalsContact O-CG 3.26Å; E277-D281 PolarHBondContact O-N 3.27Å; D281-K283 PolarHBondContact O-N 2.9Å; D281-K283 VanDerWaalsContact O-N 3.09Å; D281-L284 CarbonylContact O-C 3.54Å; D281-L284 WeakPolarHBondContact O-CA 3.26Å; D281-L284 WeakPolarHBondContact O-CB 3.37Å; D281-L284 PolarHBondContact O-N 2.93Å; D281-D285 VanDerWaalsContact O-CG 3.27Å; D281-D285 PolarHBondContact O-N 3.47Å
282L93.7Very high94.7Very high89 Ų89115.1 Ų115.147%0.46654%0.538SS..Hα-helixtrans-58.8-25.4171.4-75170.5000114.3L278 R286L278-L282 WeakPolarHBondContact O-CB 3.48Å; L278-L282 VanDerWaalsContact O-CG 3.27Å; L278-L282 WeakPolarHBondContact O-CG 3.3Å; L278-L282 PolarHBondContact O-N 3.03Å; L282-R286 WeakPolarHBondContact O-CB 3.47Å; L282-R286 VanDerWaalsContact O-CD 3.31Å; L282-R286 WeakPolarHBondContact O-CD 3.32Å; L282-R286 WeakPolarHBondContact O-CG 3.44Å; L282-R286 PolarHBondContact O-N 2.91Å
283K96.1Very high95.2Very high123 Ų123114 Ų11454%0.53554%0.536SS..Hα-helixtrans-81.9-26.2173.2-70.5158.9-160.1164.10112.1E279 K280 D281 K287E279-K283 WeakPolarHBondContact O-CD 3.38Å; E279-K283 VanDerWaalsContact O-CE 3.23Å; E279-K283 WeakPolarHBondContact O-CE 3.46Å; E279-K283 WeakPolarHBondContact O-CG 3.47Å; E279-K283 PolarHBondContact O-N 2.99Å; E279-K283 IonicContact OE2-NZ 3.81Å; E279-K283 PolarHBondContact OE2-NZ 3.05Å; K280-K283 CarbonylContact O-C 3.6Å; K280-K283 WeakPolarHBondContact O-CB 3.36Å; K280-K283 PolarHBondContact O-N 2.71Å; K280-K283 VanDerWaalsContact O-N 3.13Å; D281-K283 PolarHBondContact O-N 2.9Å; D281-K283 VanDerWaalsContact O-N 3.09Å; K283-K287 VanDerWaalsContact O-CB 3.3Å; K283-K287 WeakPolarHBondContact O-CB 3.35Å; K283-K287 PolarHBondContact O-N 2.9Å
284L96.2Very high95.5Very high89 Ų89111.1 Ų111.147%0.46653%0.53SS..Hα-helixtrans-78-50.5172.9-70.2170.9000110.8K280 D281 R286 K287 E288K280-L284 HydrophobicContact CG-CD1 4.38Å; K280-L284 WeakPolarHBondContact O-CG 3.47Å; K280-L284 PolarHBondContact O-N 3.39Å; D281-L284 CarbonylContact O-C 3.54Å; D281-L284 WeakPolarHBondContact O-CA 3.26Å; D281-L284 WeakPolarHBondContact O-CB 3.37Å; D281-L284 PolarHBondContact O-N 2.93Å; L284-R286 PolarHBondContact O-N 3.48Å; L284-K287 CarbonylContact O-C 3.55Å; L284-K287 WeakPolarHBondContact O-CA 3.14Å; L284-K287 WeakPolarHBondContact O-CB 3.36Å; L284-K287 PolarHBondContact O-N 3.38Å; L284-E288 PolarHBondContact O-N 2.86Å
285D93.7Very high95.8Very high97 Ų97110.6 Ų110.652%0.51953%0.531SS..Hα-helixtrans-54.7-51.5179.7-62.4-19.9000111.2D281 K287 E288 E289D281-D285 VanDerWaalsContact O-CG 3.27Å; D281-D285 PolarHBondContact O-N 3.47Å; D285-K287 VanDerWaalsContact C-N 3.26Å; D285-K287 PolarHBondContact O-N 3.23Å; D285-E288 PolarHBondContact O-N 2.95Å; D285-E289 WeakPolarHBondContact O-CB 3.41Å; D285-E289 PolarHBondContact O-N 3.48Å
286R95.6Very high96Very high156 Ų156109.6 Ų109.659%0.58953%0.525SS*.Hα-helixtrans-60.8-33.8175.8-72.2174.6-178.5165.12.1112.9L282 L284 L290L282-R286 WeakPolarHBondContact O-CB 3.47Å; L282-R286 VanDerWaalsContact O-CD 3.31Å; L282-R286 WeakPolarHBondContact O-CD 3.32Å; L282-R286 WeakPolarHBondContact O-CG 3.44Å; L282-R286 PolarHBondContact O-N 2.91Å; L284-R286 PolarHBondContact O-N 3.48Å; R286-L290 VanDerWaalsContact O-CB 3.26Å; R286-L290 WeakPolarHBondContact O-CB 3.44Å; R286-L290 WeakPolarHBondContact O-CD1 3.23Å; R286-L290 WeakPolarHBondContact O-CG 3.44Å; R286-L290 PolarHBondContact O-N 2.94Å
287K95.9Very high96.2Very high149 Ų149106.5 Ų106.565%0.64852%0.515SS*.Hα-helixtrans-73.3-38.9178-178.1-172.6173.1-168.30110.9K283 L284 D285 S291K283-K287 VanDerWaalsContact O-CB 3.3Å; K283-K287 WeakPolarHBondContact O-CB 3.35Å; K283-K287 PolarHBondContact O-N 2.9Å; L284-K287 CarbonylContact O-C 3.55Å; L284-K287 WeakPolarHBondContact O-CA 3.14Å; L284-K287 WeakPolarHBondContact O-CB 3.36Å; L284-K287 PolarHBondContact O-N 3.38Å; D285-K287 VanDerWaalsContact C-N 3.26Å; D285-K287 PolarHBondContact O-N 3.23Å; K287-S291 VanDerWaalsContact O-CB 3.26Å; K287-S291 WeakPolarHBondContact O-CB 3.46Å; K287-S291 PolarHBondContact O-N 3.23Å
288E96.5Very high96.5Very high146 Ų146107.4 Ų107.468%0.68252%0.519SS*.Hα-helixtrans-68.9-45.7175.8-173.6168.815400111.2L284 D285 L290 S291 R292L284-E288 PolarHBondContact O-N 2.86Å; D285-E288 PolarHBondContact O-N 2.95Å; E288-L290 PolarHBondContact O-N 2.87Å; E288-S291 PolarHBondContact O-N 3.36Å; E288-S291 VanDerWaalsContact O-N 3.17Å; E288-R292 WeakPolarHBondContact O-CB 3.33Å; E288-R292 PolarHBondContact O-N 2.82Å
289E96.9Very high96.7Very high132 Ų132106.8 Ų106.862%0.61752%0.516SS*.Hα-helixtrans-55.3-51.5173.3-174.8-171.7-168.600111.2D285 S291 R292 L293D285-E289 WeakPolarHBondContact O-CB 3.41Å; D285-E289 PolarHBondContact O-N 3.48Å; E289-S291 VanDerWaalsContact C-N 3.35Å; E289-S291 PolarHBondContact O-N 2.97Å; E289-R292 PolarHBondContact O-N 2.98Å; E289-L293 WeakPolarHBondContact O-CB 3.49Å; E289-L293 PolarHBondContact O-N 3.17Å
290L96.8Very high96.9Very high110 Ų110108.3 Ų108.358%0.57652%0.521SS*.Hα-helixtrans-61.2-41175.9-74.7170.1000112.1R286 E288 L293 V294R286-L290 VanDerWaalsContact O-CB 3.26Å; R286-L290 WeakPolarHBondContact O-CB 3.44Å; R286-L290 WeakPolarHBondContact O-CD1 3.23Å; R286-L290 WeakPolarHBondContact O-CG 3.44Å; R286-L290 PolarHBondContact O-N 2.94Å; E288-L290 PolarHBondContact O-N 2.87Å; L290-L293 PolarHBondContact O-N 2.95Å; L290-V294 WeakPolarHBondContact O-CB 3.5Å; L290-V294 VanDerWaalsContact O-CG2 3.24Å; L290-V294 WeakPolarHBondContact O-CG2 3.2Å; L290-V294 PolarHBondContact O-N 3.09Å
291S97.8Very high97Very high81 Ų81106.5 Ų106.557%0.56652%0.518SS*.Hα-helixtrans-66.4-37.6177.9-166.70000112.2K287 E288 E289 K295K287-S291 VanDerWaalsContact O-CB 3.26Å; K287-S291 WeakPolarHBondContact O-CB 3.46Å; K287-S291 PolarHBondContact O-N 3.23Å; E288-S291 PolarHBondContact O-N 3.36Å; E288-S291 VanDerWaalsContact O-N 3.17Å; E289-S291 VanDerWaalsContact C-N 3.35Å; E289-S291 PolarHBondContact O-N 2.97Å; S291-K295 PolarHBondContact O-N 3.39Å; S291-K295 VanDerWaalsContact O-N 3.12Å
292R98Very high97.3Very high192 Ų192108.6 Ų108.673%0.72553%0.526SS*.Hα-helixtrans-68.6-43.8175.5-177.8178.5177-174.5-1.8110.8E288 E289 K295 V296E288-R292 WeakPolarHBondContact O-CB 3.33Å; E288-R292 PolarHBondContact O-N 2.82Å; E289-R292 PolarHBondContact O-N 2.98Å; R292-K295 PolarHBondContact O-N 2.65Å; R292-V296 WeakPolarHBondContact O-CG2 3.45Å; R292-V296 PolarHBondContact O-N 2.99Å
293L98.1Very high97.5Very high101 Ų101108 Ų10853%0.52953%0.526SS..Hα-helixtrans-65.1-46178.1-178.560.2000111.7E289 L290 K295 V296 V297E289-L293 WeakPolarHBondContact O-CB 3.49Å; E289-L293 PolarHBondContact O-N 3.17Å; L290-L293 PolarHBondContact O-N 2.95Å; L293-K295 VanDerWaalsContact C-N 3.3Å; L293-K295 PolarHBondContact O-N 3.49Å; L293-V296 PolarHBondContact O-N 3.19Å; L293-V297 WeakPolarHBondContact O-CG2 3.43Å; L293-V297 PolarHBondContact O-N 2.71Å
294V98.5Very high97.6Very high80 Ų80106 Ų10649%0.48552%0.52SS..Hα-helixtrans-57.5-44.4174.6166.30000110.7L290 V297 Q298L290-V294 WeakPolarHBondContact O-CB 3.5Å; L290-V294 VanDerWaalsContact O-CG2 3.24Å; L290-V294 WeakPolarHBondContact O-CG2 3.2Å; L290-V294 PolarHBondContact O-N 3.09Å; V294-V297 PolarHBondContact O-N 2.72Å; V294-Q298 WeakPolarHBondContact O-CG 3.32Å; V294-Q298 PolarHBondContact O-N 2.94Å
295K98.5Very high97.8Very high112 Ų112107.3 Ų107.349%0.48752%0.524SS..Hα-helixtrans-62.9-45.5175.8-161.4-158.5174.1-121.60112S291 R292 L293 V297 Q298 D299S291-K295 PolarHBondContact O-N 3.39Å; S291-K295 VanDerWaalsContact O-N 3.12Å; R292-K295 PolarHBondContact O-N 2.65Å; L293-K295 VanDerWaalsContact C-N 3.3Å; L293-K295 PolarHBondContact O-N 3.49Å; K295-V297 PolarHBondContact O-N 2.83Å; K295-Q298 PolarHBondContact O-N 3.28Å; K295-Q298 VanDerWaalsContact O-N 3.12Å; K295-D299 VanDerWaalsContact CE-OD1 3.28Å; K295-D299 WeakPolarHBondContact CE-OD1 3.39Å; K295-D299 WeakPolarHBondContact CE-OD2 3.28Å; K295-D299 IonicContact NZ-OD1 3.63Å; K295-D299 PolarHBondContact NZ-OD1 3.17Å; K295-D299 IonicContact NZ-OD2 2.64Å; K295-D299 PolarHBondContact NZ-OD2 2.84Å; K295-D299 WeakPolarHBondContact O-CB 3.42Å; K295-D299 VanDerWaalsContact O-CG 3.25Å; K295-D299 PolarHBondContact O-N 3.19Å
296V98.6Very high98Very high58 Ų58107.6 Ų107.635%0.35252%0.52SS..Hα-helixtrans-63.9-26.7178.41690000112.5R292 L293 K300R292-V296 WeakPolarHBondContact O-CG2 3.45Å; R292-V296 PolarHBondContact O-N 2.99Å; L293-V296 PolarHBondContact O-N 3.19Å; V296-K300 HydrophobicContact CG1-CD 4.37Å; V296-K300 WeakPolarHBondContact O-CB 3.31Å; V296-K300 WeakPolarHBondContact O-CD 3.41Å; V296-K300 WeakPolarHBondContact O-CG 3.43Å; V296-K300 PolarHBondContact O-N 2.79Å
297V98.5Very high98.2Very high70 Ų70105.1 Ų105.142%0.42452%0.518SS..Hα-helixtrans-72.5-48.6170172.30000110.6L293 V294 K295 K300 D301L293-V297 WeakPolarHBondContact O-CG2 3.43Å; L293-V297 PolarHBondContact O-N 2.71Å; V294-V297 PolarHBondContact O-N 2.72Å; K295-V297 PolarHBondContact O-N 2.83Å; V297-K300 CarbonylContact O-C 3.59Å; V297-K300 WeakPolarHBondContact O-CA 3.41Å; V297-K300 WeakPolarHBondContact O-CB 3.37Å; V297-K300 PolarHBondContact O-N 3.44Å; V297-K300 VanDerWaalsContact O-N 3.08Å; V297-D301 WeakPolarHBondContact CG1-OD2 3.26Å; V297-D301 PolarHBondContact O-N 3.12Å
298Q98.7Very high98.3Very high110 Ų110103.5 Ų103.551%0.51451%0.511SS..Hα-helixtrans-59.7-48.6177.2-70.6171.4-26.500112.8V294 K295 K300 D301 E302V294-Q298 WeakPolarHBondContact O-CG 3.32Å; V294-Q298 PolarHBondContact O-N 2.94Å; K295-Q298 PolarHBondContact O-N 3.28Å; K295-Q298 VanDerWaalsContact O-N 3.12Å; Q298-K300 PolarHBondContact O-N 3.27Å; Q298-K300 VanDerWaalsContact O-N 3.15Å; Q298-D301 PolarHBondContact O-N 2.98Å; Q298-E302 PolarHBondContact O-N 3.41Å
299D98.5Very high98.4Very high66 Ų66101.8 Ų101.835%0.35350%0.503SS..Hα-helixtrans-57.2-28.3175.8-68.8-12.3000111.4K295 V303K295-D299 VanDerWaalsContact CE-OD1 3.28Å; K295-D299 WeakPolarHBondContact CE-OD1 3.39Å; K295-D299 WeakPolarHBondContact CE-OD2 3.28Å; K295-D299 IonicContact NZ-OD1 3.63Å; K295-D299 PolarHBondContact NZ-OD1 3.17Å; K295-D299 IonicContact NZ-OD2 2.64Å; K295-D299 PolarHBondContact NZ-OD2 2.84Å; K295-D299 WeakPolarHBondContact O-CB 3.42Å; K295-D299 VanDerWaalsContact O-CG 3.25Å; K295-D299 PolarHBondContact O-N 3.19Å; D299-V303 WeakPolarHBondContact O-CG2 3.21Å
300K98.7Very high98.5Very high131 Ų131100.5 Ų100.557%0.5750%0.497SS*.Hα-helixtrans-84.9-40.9175.3-77.2174-177.7178.40113.3V296 V297 Q298 E302 V303 I304V296-K300 HydrophobicContact CG1-CD 4.37Å; V296-K300 WeakPolarHBondContact O-CB 3.31Å; V296-K300 WeakPolarHBondContact O-CD 3.41Å; V296-K300 WeakPolarHBondContact O-CG 3.43Å; V296-K300 PolarHBondContact O-N 2.79Å; V297-K300 CarbonylContact O-C 3.59Å; V297-K300 WeakPolarHBondContact O-CA 3.41Å; V297-K300 WeakPolarHBondContact O-CB 3.37Å; V297-K300 PolarHBondContact O-N 3.44Å; V297-K300 VanDerWaalsContact O-N 3.08Å; Q298-K300 PolarHBondContact O-N 3.27Å; Q298-K300 VanDerWaalsContact O-N 3.15Å; K300-E302 VanDerWaalsContact C-N 3.27Å; K300-E302 PolarHBondContact O-N 3.15Å; K300-V303 PolarHBondContact O-N 2.99Å; K300-I304 WeakPolarHBondContact O-CG1 3.36Å; K300-I304 PolarHBondContact O-N 3.41Å
301D98.8Very high98.6Very high89 Ų89100 Ų10048%0.47649%0.494SS..Hα-helixtrans-61.6-39177.1-73.5-32.1000110.6V297 Q298 V303 I304 E305V297-D301 WeakPolarHBondContact CG1-OD2 3.26Å; V297-D301 PolarHBondContact O-N 3.12Å; Q298-D301 PolarHBondContact O-N 2.98Å; D301-V303 VanDerWaalsContact C-N 3.31Å; D301-V303 PolarHBondContact O-N 3.38Å; D301-I304 PolarHBondContact O-N 2.61Å; D301-E305 WeakPolarHBondContact O-CB 3.15Å; D301-E305 PolarHBondContact O-N 3.47Å
302E98.8Very high98.6Very high100 Ų100102.9 Ų102.947%0.46750%0.498SS..Hα-helixtrans-58.5-36.4170.2-89.7-160.7-136.900113.9Q298 K300 K306Q298-E302 PolarHBondContact O-N 3.41Å; K300-E302 VanDerWaalsContact C-N 3.27Å; K300-E302 PolarHBondContact O-N 3.15Å; E302-K306 VanDerWaalsContact O-CD 3.23Å; E302-K306 WeakPolarHBondContact O-CD 3.35Å; E302-K306 WeakPolarHBondContact O-CE 3.39Å; E302-K306 WeakPolarHBondContact O-CG 3.24Å; E302-K306 PolarHBondContact O-N 3.47Å; E302-K306 IonicContact OE2-NZ 2.69Å; E302-K306 PolarHBondContact OE2-NZ 3.08Å
303V98.8Very high98.7Very high77 Ų7798.3 Ų98.347%0.46749%0.488SS..Hα-helixtrans-76.6-36.71771700000110.5D299 K300 D301 E305 L307D299-V303 WeakPolarHBondContact O-CG2 3.21Å; K300-V303 PolarHBondContact O-N 2.99Å; D301-V303 VanDerWaalsContact C-N 3.31Å; D301-V303 PolarHBondContact O-N 3.38Å; V303-E305 VanDerWaalsContact C-N 3.3Å; V303-E305 PolarHBondContact O-N 3.25Å; V303-L307 HydrophobicContact CG1-CD1 3.91Å; V303-L307 HydrophobicContact CG1-CG 4.41Å; V303-L307 WeakPolarHBondContact O-CB 3.33Å; V303-L307 VanDerWaalsContact O-CG 3.26Å; V303-L307 WeakPolarHBondContact O-CG 3.4Å; V303-L307 PolarHBondContact O-N 2.93Å
304I98.8Very high98.7Very high80 Ų8097.9 Ų97.941%0.4149%0.486SS..Hα-helixtrans-65.7-33.8174.3-70.3164.4000111.2K300 D301 K308K300-I304 WeakPolarHBondContact O-CG1 3.36Å; K300-I304 PolarHBondContact O-N 3.41Å; D301-I304 PolarHBondContact O-N 2.61Å; I304-K308 WeakPolarHBondContact O-CD 3.37Å; I304-K308 VanDerWaalsContact O-CG 3.27Å; I304-K308 WeakPolarHBondContact O-CG 3.19Å; I304-K308 PolarHBondContact O-N 2.91Å
305E98.8Very high98.7Very high116 Ų11698.1 Ų98.154%0.54248%0.484SS..Hα-helixtrans-65.4-55.7173.3-171.8164.6-133.600111.2D301 V303 L307 K308 E309D301-E305 WeakPolarHBondContact O-CB 3.15Å; D301-E305 PolarHBondContact O-N 3.47Å; V303-E305 VanDerWaalsContact C-N 3.3Å; V303-E305 PolarHBondContact O-N 3.25Å; E305-L307 VanDerWaalsContact C-N 3.26Å; E305-L307 PolarHBondContact O-N 2.79Å; E305-K308 WeakPolarHBondContact O-CA 3.28Å; E305-K308 WeakPolarHBondContact O-CB 3.37Å; E305-K308 PolarHBondContact O-N 3.01Å; E305-E309 PolarHBondContact O-N 2.93Å
306K98.8Very high98.7Very high104 Ų10497.9 Ų97.945%0.45249%0.488SS..Hα-helixtrans-58.2-35.3178.4-66.8157-164.2150.10113E302 E309 E310E302-K306 VanDerWaalsContact O-CD 3.23Å; E302-K306 WeakPolarHBondContact O-CD 3.35Å; E302-K306 WeakPolarHBondContact O-CE 3.39Å; E302-K306 WeakPolarHBondContact O-CG 3.24Å; E302-K306 PolarHBondContact O-N 3.47Å; E302-K306 IonicContact OE2-NZ 2.69Å; E302-K306 PolarHBondContact OE2-NZ 3.08Å; K306-E309 PolarHBondContact O-N 3.29Å; K306-E310 PolarHBondContact O-N 2.97Å
307L98.8Very high98.7Very high104 Ų10498.7 Ų98.755%0.54549%0.49SS..Hα-helixtrans-72.5-24.2174.8-72.8172.4000113.5V303 E305 I311V303-L307 HydrophobicContact CG1-CD1 3.91Å; V303-L307 HydrophobicContact CG1-CG 4.41Å; V303-L307 WeakPolarHBondContact O-CB 3.33Å; V303-L307 VanDerWaalsContact O-CG 3.26Å; V303-L307 WeakPolarHBondContact O-CG 3.4Å; V303-L307 PolarHBondContact O-N 2.93Å; E305-L307 VanDerWaalsContact C-N 3.26Å; E305-L307 PolarHBondContact O-N 2.79Å; L307-I311 VanDerWaalsContact O-CD1 3.3Å; L307-I311 WeakPolarHBondContact O-CD1 3.35Å; L307-I311 WeakPolarHBondContact O-CG1 3.34Å; L307-I311 PolarHBondContact O-N 2.91Å
308K98.8Very high98.7Very high115 Ų11599.4 Ų99.450%0.549%0.491SS..Hα-helixtrans-75.2-44.2169.6-69.4159.8-173.7166.10110.8I304 E305 E310 I311 E312I304-K308 WeakPolarHBondContact O-CD 3.37Å; I304-K308 VanDerWaalsContact O-CG 3.27Å; I304-K308 WeakPolarHBondContact O-CG 3.19Å; I304-K308 PolarHBondContact O-N 2.91Å; E305-K308 WeakPolarHBondContact O-CA 3.28Å; E305-K308 WeakPolarHBondContact O-CB 3.37Å; E305-K308 PolarHBondContact O-N 3.01Å; K308-E310 VanDerWaalsContact C-N 3.32Å; K308-E310 PolarHBondContact O-N 3.48Å; K308-I311 CarbonylContact O-C 3.58Å; K308-I311 PolarHBondContact O-N 3.44Å; K308-I311 VanDerWaalsContact O-N 3.08Å; K308-E312 WeakPolarHBondContact O-CG 3.28Å; K308-E312 PolarHBondContact O-N 3.12Å
309E98.8Very high98.7Very high110 Ų11098.9 Ų98.951%0.51449%0.492SS..Hα-helixtrans-56.1-46.7176.1-65.1179.4141.500111.1E305 K306 I311 E312 L313E305-E309 PolarHBondContact O-N 2.93Å; K306-E309 PolarHBondContact O-N 3.29Å; E309-I311 PolarHBondContact O-N 2.92Å; E309-E312 PolarHBondContact O-N 3.37Å; E309-L313 WeakPolarHBondContact O-CG 3.48Å; E309-L313 PolarHBondContact O-N 2.7Å
310E98.6Very high98.7Very high105 Ų105102.3 Ų102.349%0.49151%0.506SS..Hα-helixtrans-60.6-41.2174.4-175.772.4-174.900112.2K306 K308 L313 L314K306-E310 PolarHBondContact O-N 2.97Å; K308-E310 VanDerWaalsContact C-N 3.32Å; K308-E310 PolarHBondContact O-N 3.48Å; E310-L313 PolarHBondContact O-N 2.87Å; E310-L314 HydrophobicContact CG-CD1 4Å; E310-L314 WeakPolarHBondContact O-CB 3.12Å; E310-L314 VanDerWaalsContact O-CG 3.23Å; E310-L314 WeakPolarHBondContact O-CG 3.45Å; E310-L314 PolarHBondContact O-N 3.17Å
311I98.8Very high98.7Very high100 Ų100102.1 Ų102.151%0.51351%0.505SS..Hα-helixtrans-66.5-40.6175.8-73.1167.5000111.1L307 K308 E309 L314 N315L307-I311 VanDerWaalsContact O-CD1 3.3Å; L307-I311 WeakPolarHBondContact O-CD1 3.35Å; L307-I311 WeakPolarHBondContact O-CG1 3.34Å; L307-I311 PolarHBondContact O-N 2.91Å; K308-I311 CarbonylContact O-C 3.58Å; K308-I311 PolarHBondContact O-N 3.44Å; K308-I311 VanDerWaalsContact O-N 3.08Å; E309-I311 PolarHBondContact O-N 2.92Å; I311-L314 PolarHBondContact O-N 3.43Å; I311-N315 WeakPolarHBondContact CG2-ND2 3.11Å; I311-N315 PolarHBondContact O-N 3.27Å; I311-N315 PolarHBondContact O-ND2 3.22Å
312E98.8Very high98.7Very high140 Ų140104 Ų10465%0.65451%0.511SS*.Hα-helixtrans-65.5-40.3178.1-73.6174.5-157.600111.3K308 E309 L316K308-E312 WeakPolarHBondContact O-CG 3.28Å; K308-E312 PolarHBondContact O-N 3.12Å; E309-E312 PolarHBondContact O-N 3.37Å; E312-L316 PolarHBondContact O-N 2.84Å; E312-L316 VanDerWaalsContact O-N 3.14Å
313L98.8Very high98.7Very high96 Ų96105.3 Ų105.350%0.50352%0.521SS..Hα-helixtrans-64.1-47.6171.8-69.5171.2000112.3E309 E310 N315 L316 D317E309-L313 WeakPolarHBondContact O-CG 3.48Å; E309-L313 PolarHBondContact O-N 2.7Å; E310-L313 PolarHBondContact O-N 2.87Å; L313-N315 VanDerWaalsContact C-N 3.25Å; L313-N315 PolarHBondContact O-N 2.8Å; L313-L316 WeakPolarHBondContact O-CB 3.11Å; L313-L316 PolarHBondContact O-N 2.69Å; L313-D317 PolarHBondContact O-N 2.82Å
314L98.8Very high98.7Very high93 Ų93106.7 Ų106.749%0.48752%0.523SS..Hα-helixtrans-65.5-25.4179.7-73171.2000113.7E310 I311 L318E310-L314 HydrophobicContact CG-CD1 4Å; E310-L314 WeakPolarHBondContact O-CB 3.12Å; E310-L314 VanDerWaalsContact O-CG 3.23Å; E310-L314 WeakPolarHBondContact O-CG 3.45Å; E310-L314 PolarHBondContact O-N 3.17Å; I311-L314 PolarHBondContact O-N 3.43Å; L314-L318 WeakPolarHBondContact O-CB 3.26Å; L314-L318 PolarHBondContact O-N 2.83Å
315N98.6Very high98.7Very high85 Ų85107 Ų10746%0.45553%0.525SS..Hα-helixtrans-75.3-39169.8-73-65.6000111.5I311 L313 L318 D319I311-N315 WeakPolarHBondContact CG2-ND2 3.11Å; I311-N315 PolarHBondContact O-N 3.27Å; I311-N315 PolarHBondContact O-ND2 3.22Å; L313-N315 VanDerWaalsContact C-N 3.25Å; L313-N315 PolarHBondContact O-N 2.8Å; N315-L318 WeakPolarHBondContact O-CB 3.23Å; N315-L318 PolarHBondContact O-N 2.93Å; N315-D319 PolarHBondContact O-N 2.75Å
316L98.8Very high98.7Very high107 Ų107105.4 Ų105.456%0.5652%0.518SS*.Hα-helixtrans-63.6-44.4176.2-177.765.5000112E312 L313 L318 D319 E320E312-L316 PolarHBondContact O-N 2.84Å; E312-L316 VanDerWaalsContact O-N 3.14Å; L313-L316 WeakPolarHBondContact O-CB 3.11Å; L313-L316 PolarHBondContact O-N 2.69Å; L316-L318 VanDerWaalsContact C-N 3.27Å; L316-L318 PolarHBondContact O-N 3.14Å; L316-D319 PolarHBondContact O-N 3.28Å; L316-E320 PolarHBondContact O-N 3.13Å
317D98.8Very high98.7Very high74 Ų74105.8 Ų105.840%0.39652%0.521SS..Hα-helixtrans-58.6-40.3172.6-77.213.2000111L313 E320 F321L313-D317 PolarHBondContact O-N 2.82Å; D317-E320 PolarHBondContact O-N 2.98Å; D317-F321 HydrophobicContact CB-CE2 4.2Å; D317-F321 WeakPolarHBondContact O-CD2 3.44Å; D317-F321 WeakPolarHBondContact O-CG 3.3Å; D317-F321 PolarHBondContact O-N 3.43Å
318L98.8Very high98.7Very high85 Ų85104.2 Ų104.245%0.44551%0.513SS..Hα-helixtrans-66.8-43.6178.8-174.1150.1000111.9L314 N315 L316 F321 E322L314-L318 WeakPolarHBondContact O-CB 3.26Å; L314-L318 PolarHBondContact O-N 2.83Å; N315-L318 WeakPolarHBondContact O-CB 3.23Å; N315-L318 PolarHBondContact O-N 2.93Å; L316-L318 VanDerWaalsContact C-N 3.27Å; L316-L318 PolarHBondContact O-N 3.14Å; L318-F321 PolarHBondContact O-N 2.92Å; L318-E322 HydrophobicContact CD2-CG 4.22Å; L318-E322 PolarHBondContact O-N 2.64Å
319D98.6Very high98.7Very high100 Ų100103.3 Ų103.354%0.53551%0.509SS..Hα-helixtrans-60.5-43.2174.4-73.3-16.5000111N315 L316 F321 E322 D323N315-D319 PolarHBondContact O-N 2.75Å; L316-D319 PolarHBondContact O-N 3.28Å; D319-F321 PolarHBondContact O-N 2.84Å; D319-E322 PolarHBondContact O-N 3.19Å; D319-D323 PolarHBondContact O-N 3.49Å; D319-D323 VanDerWaalsContact O-N 3.08Å
320E98.8Very high98.7Very high137 Ų137103.3 Ų103.364%0.6451%0.509SS*.Hα-helixtrans-62.3-41.5175.8-175.4169.3-162.500112L316 D317 D323 E324L316-E320 PolarHBondContact O-N 3.13Å; D317-E320 PolarHBondContact O-N 2.98Å; E320-D323 PolarHBondContact O-N 3.13Å; E320-E324 PolarHBondContact O-N 2.96Å
321F98.7Very high98.7Very high128 Ų128102.6 Ų102.656%0.56151%0.506SS*.Hα-helixtrans-69.3-29.5175-66.7-47.5000113.6D317 L318 D319 N325D317-F321 HydrophobicContact CB-CE2 4.2Å; D317-F321 WeakPolarHBondContact O-CD2 3.44Å; D317-F321 WeakPolarHBondContact O-CG 3.3Å; D317-F321 PolarHBondContact O-N 3.43Å; L318-F321 PolarHBondContact O-N 2.92Å; D319-F321 PolarHBondContact O-N 2.84Å; F321-N325 WeakPolarHBondContact O-CB 3.38Å; F321-N325 PolarHBondContact O-N 2.81Å; F321-N325 VanDerWaalsContact O-N 3.11Å
322E98.8Very high98.7Very high128 Ų128102.5 Ų102.560%0.59851%0.506SS*.Hα-helixtrans-69.8-41173.6-73.3-156.2174.800111.8L318 D319 N325 E326L318-E322 HydrophobicContact CD2-CG 4.22Å; L318-E322 PolarHBondContact O-N 2.64Å; D319-E322 PolarHBondContact O-N 3.19Å; E322-N325 PolarHBondContact O-N 3.33Å; E322-E326 PolarHBondContact O-N 3.2Å
323D98.8Very high98.7Very high128 Ų128103.3 Ų103.368%0.68451%0.507SS*.Hα-helixtrans-66.2-46.7175-98.4-6.3000112.3D319 E320 N325 E326 Q327D319-D323 PolarHBondContact O-N 3.49Å; D319-D323 VanDerWaalsContact O-N 3.08Å; E320-D323 PolarHBondContact O-N 3.13Å; D323-N325 VanDerWaalsContact C-N 3.31Å; D323-N325 PolarHBondContact O-N 3.09Å; D323-E326 PolarHBondContact O-N 3.29Å; D323-Q327 PolarHBondContact O-N 2.97Å
324E98.7Very high98.7Very high106 Ų106102.8 Ų102.850%0.49551%0.508SS..Hα-helixtrans-58.6-44.9175.4-171.3-167.7-172.200110.7E320 E326 Q327 L328E320-E324 PolarHBondContact O-N 2.96Å; E324-E326 PolarHBondContact O-N 3.46Å; E324-Q327 WeakPolarHBondContact O-CB 3.27Å; E324-Q327 PolarHBondContact O-N 3.19Å; E324-L328 HydrophobicContact CG-CD1 4.07Å; E324-L328 HydrophobicContact CG-CG 4.44Å; E324-L328 WeakPolarHBondContact O-CB 3.33Å; E324-L328 WeakPolarHBondContact O-CG 3.4Å; E324-L328 PolarHBondContact O-N 2.92Å
325N98.6Very high98.7Very high86 Ų86103.3 Ų103.346%0.4651%0.511SS..Hα-helixtrans-62-41.8178.9-177.112.2000111.4F321 E322 D323 L328 K329F321-N325 WeakPolarHBondContact O-CB 3.38Å; F321-N325 PolarHBondContact O-N 2.81Å; F321-N325 VanDerWaalsContact O-N 3.11Å; E322-N325 PolarHBondContact O-N 3.33Å; D323-N325 VanDerWaalsContact C-N 3.31Å; D323-N325 PolarHBondContact O-N 3.09Å; N325-L328 PolarHBondContact O-N 2.96Å; N325-K329 VanDerWaalsContact C-CE 3.46Å; N325-K329 VanDerWaalsContact CG-CE 3.42Å; N325-K329 WeakPolarHBondContact O-CE 3.47Å; N325-K329 WeakPolarHBondContact O-CG 3.43Å; N325-K329 PolarHBondContact O-N 3.3Å; N325-K329 WeakPolarHBondContact OD1-CE 3.48Å
326E98.8Very high98.7Very high83 Ų83105.5 Ų105.539%0.38852%0.522SS..Hα-helixtrans-68.9-35.7175.6-169.356-143.300112.9E322 D323 E324 K329 Q330E322-E326 PolarHBondContact O-N 3.2Å; D323-E326 PolarHBondContact O-N 3.29Å; E324-E326 PolarHBondContact O-N 3.46Å; E326-K329 PolarHBondContact O-N 3.39Å; E326-K329 WeakPolarHBondContact OE2-CD 3.43Å; E326-K329 WeakPolarHBondContact OE2-CE 3.37Å; E326-K329 IonicContact OE2-NZ 3.71Å; E326-K329 PolarHBondContact OE2-NZ 2.87Å; E326-Q330 WeakPolarHBondContact O-CG 3.41Å; E326-Q330 PolarHBondContact O-N 2.8Å
327Q98.8Very high98.7Very high111 Ų111107.3 Ų107.352%0.51953%0.526SS..Hα-helixtrans-58.8-50.6168178.2179.8-30.100110.7D323 E324 K329 Q330 E331D323-Q327 PolarHBondContact O-N 2.97Å; E324-Q327 WeakPolarHBondContact O-CB 3.27Å; E324-Q327 PolarHBondContact O-N 3.19Å; Q327-K329 VanDerWaalsContact C-N 3.28Å; Q327-K329 PolarHBondContact O-N 2.83Å; Q327-Q330 WeakPolarHBondContact O-CA 3.43Å; Q327-Q330 WeakPolarHBondContact O-CB 3.49Å; Q327-Q330 PolarHBondContact O-N 3.16Å; Q327-E331 HydrophobicContact CG-CG 4.43Å; Q327-E331 PolarHBondContact NE2-OE1 3.01Å; Q327-E331 PolarHBondContact O-N 3.33Å
328L98.8Very high98.7Very high72 Ų72107.1 Ų107.138%0.37753%0.527SS..Hα-helixtrans-61.5-34.7179.2-71.3171.2000112.2E324 N325 N332E324-L328 HydrophobicContact CG-CD1 4.07Å; E324-L328 HydrophobicContact CG-CG 4.44Å; E324-L328 WeakPolarHBondContact O-CB 3.33Å; E324-L328 WeakPolarHBondContact O-CG 3.4Å; E324-L328 PolarHBondContact O-N 2.92Å; N325-L328 PolarHBondContact O-N 2.96Å; L328-N332 VanDerWaalsContact O-CB 3.32Å; L328-N332 WeakPolarHBondContact O-CB 3.36Å; L328-N332 PolarHBondContact O-N 3.26Å; L328-N332 PolarHBondContact O-ND2 2.96Å
329K98.8Very high98.6Very high95 Ų95106.8 Ų106.841%0.41353%0.528SS..Hα-helixtrans-61.9-43.3170.5-81.7170.3-100.6154.70111.5N325 E326 Q327 K333N325-K329 VanDerWaalsContact C-CE 3.46Å; N325-K329 VanDerWaalsContact CG-CE 3.42Å; N325-K329 WeakPolarHBondContact O-CE 3.47Å; N325-K329 WeakPolarHBondContact O-CG 3.43Å; N325-K329 PolarHBondContact O-N 3.3Å; N325-K329 WeakPolarHBondContact OD1-CE 3.48Å; E326-K329 PolarHBondContact O-N 3.39Å; E326-K329 WeakPolarHBondContact OE2-CD 3.43Å; E326-K329 WeakPolarHBondContact OE2-CE 3.37Å; E326-K329 IonicContact OE2-NZ 3.71Å; E326-K329 PolarHBondContact OE2-NZ 2.87Å; Q327-K329 VanDerWaalsContact C-N 3.28Å; Q327-K329 PolarHBondContact O-N 2.83Å; K329-K333 WeakPolarHBondContact O-CB 3.46Å; K329-K333 PolarHBondContact O-N 2.97Å
330Q98.8Very high98.6Very high110 Ų110102.8 Ų102.851%0.51451%0.511SS..Hα-helixtrans-69.2-38.7178.1-68.4177.452.500112.9E326 Q327 T334E326-Q330 WeakPolarHBondContact O-CG 3.41Å; E326-Q330 PolarHBondContact O-N 2.8Å; Q327-Q330 WeakPolarHBondContact O-CA 3.43Å; Q327-Q330 WeakPolarHBondContact O-CB 3.49Å; Q327-Q330 PolarHBondContact O-N 3.16Å; Q330-T334 WeakPolarHBondContact O-CB 3.25Å; Q330-T334 PolarHBondContact O-N 3.47Å; Q330-T334 PolarHBondContact O-OG1 3.02Å
331E98.4Very high98.5Very high90 Ų90102.2 Ų102.242%0.42151%0.508SS..Hα-helixtrans-64.5-50.7173.6-72.2-174.5-160.300111.4Q327 K333 T334 L335Q327-E331 HydrophobicContact CG-CG 4.43Å; Q327-E331 PolarHBondContact NE2-OE1 3.01Å; Q327-E331 PolarHBondContact O-N 3.33Å; E331-K333 VanDerWaalsContact C-N 3.32Å; E331-K333 PolarHBondContact O-N 3.17Å; E331-T334 CarbonylContact O-C 3.56Å; E331-T334 WeakPolarHBondContact O-CA 3.26Å; E331-T334 WeakPolarHBondContact O-CB 3.41Å; E331-T334 PolarHBondContact O-N 2.86Å; E331-L335 WeakPolarHBondContact O-CG 3.26Å; E331-L335 PolarHBondContact O-N 3.48Å
332N98.6Very high98.5Very high98 Ų98102.9 Ų102.952%0.52452%0.517SS..Hα-helixtrans-60.1-40177.4-81.6-69.8000112.4L328 T334 L335 L336L328-N332 VanDerWaalsContact O-CB 3.32Å; L328-N332 WeakPolarHBondContact O-CB 3.36Å; L328-N332 PolarHBondContact O-N 3.26Å; L328-N332 PolarHBondContact O-ND2 2.96Å; N332-T334 VanDerWaalsContact C-N 3.27Å; N332-T334 PolarHBondContact O-N 3.4Å; N332-L335 PolarHBondContact O-N 3.33Å; N332-L336 VanDerWaalsContact O-CB 3.3Å; N332-L336 WeakPolarHBondContact O-CB 3.2Å; N332-L336 PolarHBondContact O-N 2.83Å
333K98.8Very high98.3Very high157 Ų157101.8 Ų101.868%0.68352%0.519SS*.Hα-helixtrans-60.8-35.5172.6179.5180-179.1179.50112.4K329 E331 K337K329-K333 WeakPolarHBondContact O-CB 3.46Å; K329-K333 PolarHBondContact O-N 2.97Å; E331-K333 VanDerWaalsContact C-N 3.32Å; E331-K333 PolarHBondContact O-N 3.17Å; K333-K337 WeakPolarHBondContact O-CB 3.46Å; K333-K337 PolarHBondContact O-N 3.37Å
334T98.6Very high97.1Very high85 Ų85107.9 Ų107.952%0.52153%0.532SS..Hα-helixtrans-74.7-45.3176.7-59.20000111.5Q330 E331 N332 L336 K337 V338Q330-T334 WeakPolarHBondContact O-CB 3.25Å; Q330-T334 PolarHBondContact O-N 3.47Å; Q330-T334 PolarHBondContact O-OG1 3.02Å; E331-T334 CarbonylContact O-C 3.56Å; E331-T334 WeakPolarHBondContact O-CA 3.26Å; E331-T334 WeakPolarHBondContact O-CB 3.41Å; E331-T334 PolarHBondContact O-N 2.86Å; N332-T334 VanDerWaalsContact C-N 3.27Å; N332-T334 PolarHBondContact O-N 3.4Å; T334-L336 PolarHBondContact O-N 3.18Å; T334-K337 WeakPolarHBondContact O-CB 3.43Å; T334-K337 PolarHBondContact O-N 2.98Å; T334-V338 WeakPolarHBondContact O-CG2 3.41Å; T334-V338 PolarHBondContact O-N 2.89Å
335L98.6Very high97Very high105 Ų105108 Ų10855%0.5553%0.534SS..Hα-helixtrans-58.4-46.4174-69.5173.1000111.4E331 N332 K337 V338 V339E331-L335 WeakPolarHBondContact O-CG 3.26Å; E331-L335 PolarHBondContact O-N 3.48Å; N332-L335 PolarHBondContact O-N 3.33Å; L335-K337 VanDerWaalsContact C-N 3.29Å; L335-K337 PolarHBondContact O-N 3.39Å; L335-V338 PolarHBondContact O-N 2.87Å; L335-V338 VanDerWaalsContact O-N 3.15Å; L335-V339 WeakPolarHBondContact O-CG2 3.39Å; L335-V339 PolarHBondContact O-N 3.39Å
336L98.4Very high96.9Very high131 Ų131109.1 Ų109.169%0.68654%0.538SS*.Hα-helixtrans-61.4-36.7177.2-17463.9000112.2N332 T334 G340N332-L336 VanDerWaalsContact O-CB 3.3Å; N332-L336 WeakPolarHBondContact O-CB 3.2Å; N332-L336 PolarHBondContact O-N 2.83Å; T334-L336 PolarHBondContact O-N 3.18Å; L336-G340 PolarHBondContact O-N 3.04Å
337K98.4Very high96.8Very high144 Ų144110.6 Ų110.663%0.62655%0.547SS*.Hα-helixtrans-66-41.8174-175.9-176.8177.1-173.90112.1K333 T334 L335 Q341K333-K337 WeakPolarHBondContact O-CB 3.46Å; K333-K337 PolarHBondContact O-N 3.37Å; T334-K337 WeakPolarHBondContact O-CB 3.43Å; T334-K337 PolarHBondContact O-N 2.98Å; L335-K337 VanDerWaalsContact C-N 3.29Å; L335-K337 PolarHBondContact O-N 3.39Å; K337-Q341 WeakPolarHBondContact O-CG 3.47Å; K337-Q341 PolarHBondContact O-N 2.68Å; K337-Q341 VanDerWaalsContact O-N 3.15Å
338V98.4Very high96.7Very high70 Ų70110.5 Ų110.542%0.42455%0.548SS..Hα-helixtrans-68.9-47.5177.4172.50000111.1T334 L335 G340 Q341 L342T334-V338 WeakPolarHBondContact O-CG2 3.41Å; T334-V338 PolarHBondContact O-N 2.89Å; L335-V338 PolarHBondContact O-N 2.87Å; L335-V338 VanDerWaalsContact O-N 3.15Å; V338-G340 VanDerWaalsContact C-N 3.29Å; V338-G340 PolarHBondContact O-N 3.42Å; V338-Q341 WeakPolarHBondContact O-CA 3.33Å; V338-Q341 WeakPolarHBondContact O-CB 3.31Å; V338-Q341 PolarHBondContact O-N 3.35Å; V338-L342 HydrophobicContact CG1-CD1 4.12Å; V338-L342 WeakPolarHBondContact O-CG 3.16Å; V338-L342 PolarHBondContact O-N 3.15Å; V338-L342 VanDerWaalsContact O-N 3.14Å
339V98.2Very high96.6Very high78 Ų78112.9 Ų112.947%0.47356%0.559SS.*Hα-helixtrans-56.2-46.7174171.20000110L335 Q341 L342 T343L335-V339 WeakPolarHBondContact O-CG2 3.39Å; L335-V339 PolarHBondContact O-N 3.39Å; V339-Q341 PolarHBondContact O-N 3.01Å; V339-Q341 VanDerWaalsContact O-N 3.15Å; V339-L342 PolarHBondContact O-N 3.05Å; V339-T343 HydrophobicContact CG1-CG2 4.18Å; V339-T343 WeakPolarHBondContact O-CG2 3.41Å; V339-T343 PolarHBondContact O-N 2.85Å; V339-T343 PolarHBondContact O-OG1 2.92Å
340G98.1Very high96.4Very high17 Ų17114.1 Ų114.118%0.17557%0.569CS.*Hα-helixtrans-65.9-9.1174.700000115.5L336 V338 R344L336-G340 PolarHBondContact O-N 3.04Å; V338-G340 VanDerWaalsContact C-N 3.29Å; V338-G340 PolarHBondContact O-N 3.42Å; G340-R344 PolarHBondContact O-NE 3.32Å; G340-R344 PolarHBondContact O-NH2 3.06Å
341Q97.2Very high96.3Very high125 Ų125114.4 Ų114.458%0.58457%0.573SS**Hα-helixtrans-92.9-22.7168-76177-28.100112.4K337 V338 V339K337-Q341 WeakPolarHBondContact O-CG 3.47Å; K337-Q341 PolarHBondContact O-N 2.68Å; K337-Q341 VanDerWaalsContact O-N 3.15Å; V338-Q341 WeakPolarHBondContact O-CA 3.33Å; V338-Q341 WeakPolarHBondContact O-CB 3.31Å; V338-Q341 PolarHBondContact O-N 3.35Å; V339-Q341 PolarHBondContact O-N 3.01Å; V339-Q341 VanDerWaalsContact O-N 3.15Å
342L97.5Very high96.1Very high141 Ų141116.3 Ų116.374%0.73858%0.584SS**Hα-helixtrans-92.5-12179.4-63.3172.6000113.3V338 V339V338-L342 HydrophobicContact CG1-CD1 4.12Å; V338-L342 WeakPolarHBondContact O-CG 3.16Å; V338-L342 PolarHBondContact O-N 3.15Å; V338-L342 VanDerWaalsContact O-N 3.14Å; V339-L342 PolarHBondContact O-N 3.05Å
343T95.6Very high95.9Very high105 Ų105117.8 Ų117.864%0.64459%0.589SS**  trans-11119.2-178.958.70000114.1V339V339-T343 HydrophobicContact CG1-CG2 4.18Å; V339-T343 WeakPolarHBondContact O-CG2 3.41Å; V339-T343 PolarHBondContact O-N 2.85Å; V339-T343 PolarHBondContact O-OG1 2.92Å
344R72.8Confident95.6Very high256 Ų256114.3 Ų114.397%0.96658%0.581SS**  trans-127.10174.4-82.3-174.9-73-156.6-5.4111G340G340-R344 PolarHBondContact O-NE 3.32Å; G340-R344 PolarHBondContact O-NH2 3.06Å

Retrieved 344 of 344 residues in 184.8 ms (Link to these results)