A0A077YW75_TRITR Loading...

Zinc transporter 2

AlphaFold DB , UniProt , Accession A0A077YW75, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 369 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
1M33.8Very low31.3Very low240 Ų240146.8 Ų146.8100%1.18282%0.816SS**  088.40-159.2168.1178.300105
2V33.7Very low31.3Very low137 Ų137148.4 Ų148.483%0.8382%0.819SS**  trans-113.1110.9-179.9179.30000104.5V4V2-V4 PolarHBondContact O-N 2.91Å
3E30.3Very low31.2Very low187 Ų187147.2 Ų147.287%0.87481%0.809SS**  trans-62127.2176.3-73.4171.6148.800108.8
4V33.7Very low31.1Very low122 Ų122144.3 Ų144.374%0.73980%0.8SS**  trans-90.8115.1169.3179.30000105.1V2 D6V2-V4 PolarHBondContact O-N 2.91Å; V4-D6 PolarHBondContact O-N 2.95Å
5D31.1Very low31Very low158 Ų158144.1 Ų144.185%0.84580%0.797SS**  trans-81110.5175.4-166.713.4000108.6G7D5-G7 VanDerWaalsContact C-N 3.34Å; D5-G7 PolarHBondContact O-N 3.46Å
6D29.4Very low30.9Very low142 Ų142147.1 Ų147.176%0.75980%0.795SS**  trans-76.579.9179.1-82.7-32.1000110.2V4 L8V4-D6 PolarHBondContact O-N 2.95Å; D6-L8 PolarHBondContact O-N 3.13Å
7G31.2Very low30.9Very low74 Ų74147.7 Ų147.776%0.76379%0.788SS**  trans-96.456.617300000113.2D5 S9D5-G7 VanDerWaalsContact C-N 3.34Å; D5-G7 PolarHBondContact O-N 3.46Å; G7-S9 PolarHBondContact O-N 2.87Å
8L33.2Very low31Very low149 Ų149143.7 Ų143.778%0.7877%0.773SS**  trans-80.4106.3172.1-92.7160.9000110.9D6D6-L8 PolarHBondContact O-N 3.13Å
9S29.1Very low31.3Very low95 Ų95139.8 Ų139.866%0.66476%0.763SS**  trans35.592.3134.163.10000118.5G7G7-S9 PolarHBondContact O-N 2.87Å
10E28.7Very low31.2Very low179 Ų179140 Ų14084%0.83676%0.763SS**  trans-130.2120.2145.1-77.9-171.9156.400109
11D30Very low31.1Very low132 Ų132136.2 Ų136.271%0.70675%0.751SS**  trans62.674.4148.7-55.9-22.7000119.6I13D11-I13 VanDerWaalsContact C-N 3.32Å
12I31.7Very low30.9Very low166 Ų166130.1 Ų130.185%0.85173%0.727SS**  trans-98.267.8143.3-49.7177.5000107.6P14I12-P14 VanDerWaalsContact O-CD 3.28Å; I12-P14 WeakPolarHBondContact O-CD 3.48Å
13I30.3Very low30.8Very low133 Ų133129.2 Ų129.268%0.68273%0.727SS**  trans-76.8111157.7-58.7178.1000104.8D11 N15D11-I13 VanDerWaalsContact C-N 3.32Å; I13-N15 PolarHBondContact O-N 2.88Å; I13-N15 VanDerWaalsContact O-N 3.11Å
14P29.1Very low30.6Very low106 Ų106124.3 Ų124.369%0.68872%0.718SS**  trans-56.7124.6-179.220.9-31.3000109.3I12 Y16I12-P14 VanDerWaalsContact O-CD 3.28Å; I12-P14 WeakPolarHBondContact O-CD 3.48Å; P14-Y16 PolarHBondContact O-N 3.29Å
15N29.2Very low30.4Very low141 Ų141128 Ų12875%0.75472%0.72SS**  trans-52.296.5175.4-176.13.3000109.1I13 K17I13-N15 PolarHBondContact O-N 2.88Å; I13-N15 VanDerWaalsContact O-N 3.11Å; N15-K17 PolarHBondContact O-N 3.43Å
16Y29.5Very low30.2Very low193 Ų193124.1 Ų124.176%0.75771%0.706SS**  trans-66.788.1165.5-169.8-94.1000105.4P14 S18 A19P14-Y16 PolarHBondContact O-N 3.29Å; Y16-S18 PolarHBondContact O-N 2.92Å; Y16-A19 HydrophobicContact CE1-CB 4.42Å
17K31Very low30.6Very low157 Ų157122.7 Ų122.768%0.68371%0.707SS**  trans-45.9119.5163.8-81.1-175.7176.2179.30105.4N15 A19N15-K17 PolarHBondContact O-N 3.43Å; K17-A19 PolarHBondContact O-N 3.29Å
18S33.8Very low30.6Very low75 Ų75123.4 Ų123.452%0.52470%0.696SS.*  trans-36.8137.717644.20000109.9Y16 D20 A21Y16-S18 PolarHBondContact O-N 2.92Å; S18-D20 PolarHBondContact O-N 3.45Å; S18-A21 PolarHBondContact O-N 3.02Å; S18-A21 VanDerWaalsContact O-N 3.11Å
19A35Very low30.5Very low71 Ų71122.3 Ų122.359%0.58769%0.691SS**G310 helixtrans-57.33.1-178.100000114.5Y16 K17Y16-A19 HydrophobicContact CE1-CB 4.42Å; K17-A19 PolarHBondContact O-N 3.29Å
20D31.1Very low30.7Very low142 Ų142128.1 Ų128.176%0.75970%0.7SS**G310 helixtrans-84.1-7.9174-58.1-36.5000113.9S18S18-D20 PolarHBondContact O-N 3.45Å
21A28.5Very low30.7Very low61 Ų61127.3 Ų127.350%0.50470%0.697SS.*G310 helixtrans-93.4-0.4179.600000115.1S18S18-A21 PolarHBondContact O-N 3.02Å; S18-A21 VanDerWaalsContact O-N 3.11Å
22V29.9Very low30.5Very low112 Ų112128.8 Ų128.868%0.67970%0.704SS**  trans-105.735.8177.8-161.30000111.6Y25V22-Y25 HydrophobicContact CG1-CD2 4.27Å
23S30.4Very low30.3Very low118 Ų118128.7 Ų128.783%0.82570%0.702SS**SBendtrans-965.616282.50000113.4
24A27.8Very low30.3Very low84 Ų84128.6 Ų128.669%0.69471%0.707SS**  trans-111.39.3-174.100000115.8S26A24-S26 PolarHBondContact O-N 3.13Å
25Y27.9Very low30.3Very low199 Ų199132.1 Ų132.178%0.7872%0.721SS**  trans-77.887.1164.3-86.6-82.7000108.9V22V22-Y25 HydrophobicContact CG1-CD2 4.27Å
26S28.6Very low30.4Very low77 Ų77127.8 Ų127.854%0.53871%0.709SS.*  trans-44.6133.5165.1178.20000110.1A24 T28A24-S26 PolarHBondContact O-N 3.13Å; S26-T28 PolarHBondContact O-N 3.5Å; S26-T28 PolarHBondContact OG-OG1 3.18Å
27S37.7Very low30.3Very low112 Ų112123.9 Ų123.978%0.78371%0.71SS**THydrogen-bonded Turntrans-60.616.7-177.9-330000115.6
28T30.5Very low30.2Very low89 Ų89124.1 Ų124.155%0.54672%0.719SS.*THydrogen-bonded Turntrans-100.6-9.7-169.237.50000115.2S26S26-T28 PolarHBondContact O-N 3.5Å; S26-T28 PolarHBondContact OG-OG1 3.18Å
29D30.6Very low30.1Very low126 Ų126125.7 Ų125.767%0.67473%0.73SS**SBendtrans-102.68.2-173.7-69.9-20.9000115.8
30Y33.1Very low29.9Very low218 Ų218132 Ų13286%0.85575%0.747SS**SBendtrans-130.716.1175.6-86.5-85.1000115.1N32Y30-N32 VanDerWaalsContact C-N 3.35Å
31E28.6Very low29.9Very low162 Ų162132.8 Ų132.876%0.75775%0.751SS**  trans-85.41.9172.8-81.8-172.7153.300114.3
32N26.9Very low30.3Very low162 Ų162134.5 Ų134.587%0.86676%0.759SS**SBendtrans-97.320.3-178.1-78.5-28.7000115.5Y30Y30-N32 VanDerWaalsContact C-N 3.35Å
33M28.1Very low30.6Very low165 Ų165137.5 Ų137.581%0.81376%0.763SS**SBendtrans-130.2123.4169.1-66.4-170.9-179.900110
34V29.8Very low31.2Very low130 Ų130138.2 Ų138.279%0.78876%0.756SS**  trans90.271178.8-160.10000114.7
35D29.5Very low32.1Very low181 Ų181137.1 Ų137.197%0.96874%0.744SS**  trans-72.2108.1142.3-158.87.4000107.1
36G30.4Very low33.3Very low50 Ų50130.2 Ų130.252%0.51572%0.722SS.*  trans168.379.1-17200000112.9
37S28.3Very low34.3Very low111 Ų111134.7 Ų134.778%0.77673%0.734SS**  trans4.3127.3164.459.30000120.1
38D27.5Very low34.6Very low161 Ų161133.7 Ų133.786%0.86173%0.726SS**  trans64.890.7150.4-77.8-23.7000119.5
39S32.8Very low35.5Very low109 Ų109137.2 Ų137.276%0.76274%0.736SS**  170.2134.5105.647.60000109.1L41S39-L41 PolarHBondContact O-N 3.42Å
40Q29.4Very low35.7Very low203 Ų203139.8 Ų139.895%0.94974%0.741SS**  trans-68.265.5-178.4-64.5176.4-0.300112S42Q40-S42 VanDerWaalsContact C-N 3.3Å; Q40-S42 PolarHBondContact O-N 3Å; Q40-S42 VanDerWaalsContact O-N 3.08Å
41L31.4Very low35.7Very low159 Ų159135.9 Ų135.983%0.83274%0.74SS**  trans-75.593.4160.8-147.987.9000106S39 F43S39-L41 PolarHBondContact O-N 3.42Å; L41-F43 PolarHBondContact O-N 3.05Å
42S36.7Very low36.4Very low97 Ų97132.7 Ų132.768%0.67874%0.741SS**  trans-50.7109.5170.846.80000108.3Q40 I44Q40-S42 VanDerWaalsContact C-N 3.3Å; Q40-S42 PolarHBondContact O-N 3Å; Q40-S42 VanDerWaalsContact O-N 3.08Å; S42-I44 PolarHBondContact O-N 3.06Å
43F37.8Very low36.7Very low175 Ų175128.2 Ų128.277%0.76873%0.734SS**  trans-65.190.4173.3-168.8-95.9000106.3L41 S45L41-F43 PolarHBondContact O-N 3.05Å; F43-S45 VanDerWaalsContact C-N 3.33Å; F43-S45 PolarHBondContact O-N 3.42Å
44I41.7Very low37.3Very low132 Ų132126.1 Ų126.168%0.67773%0.726SS**  trans-58.2106.2168.8-70.2172.5000104.6S42 V46S42-I44 PolarHBondContact O-N 3.06Å; I44-V46 PolarHBondContact O-N 2.99Å
45S46.3Very low38.3Very low61 Ų61126.6 Ų126.643%0.42772%0.724SS.*  trans-49.3111.6168.41750000107.4F43 H47 C48F43-S45 VanDerWaalsContact C-N 3.33Å; F43-S45 PolarHBondContact O-N 3.42Å; S45-H47 PolarHBondContact O-N 3.14Å; S45-C48 PolarHBondContact O-N 2.87Å; S45-C48 VanDerWaalsContact O-N 3.07Å
46V54.2Low39.1Very low55 Ų55127.1 Ų127.133%0.33372%0.718SS.*THydrogen-bonded Turntrans-58.3-16.1-173.7179.30000111.5I44 L332 R339I44-V46 PolarHBondContact O-N 2.99Å; V46-L332 HydrophobicContact CG2-CD1 4.3Å; V46-R339 PolarHBondContact O-NH1 3.48Å
47H48.5Very low40Very low171 Ų171127.7 Ų127.779%0.79272%0.717SS**THydrogen-bonded Turntrans-92-10.3179.4-91.6-40000116.9S45S45-H47 PolarHBondContact O-N 3.14Å
48C45.5Very low41.6Very low91 Ų91124.6 Ų124.662%0.61569%0.692SS**PPolyproline II helixtrans-90.1124.1-175.2-85.20000113.5S45S45-C48 PolarHBondContact O-N 2.87Å; S45-C48 VanDerWaalsContact O-N 3.07Å
49H47.6Very low43.5Very low162 Ų162125 Ų12575%0.7568%0.683SS**PPolyproline II helixtrans-75.6127.8169.8-62-77.9000110.4
50K36.3Very low45.3Very low180 Ų180121.3 Ų121.378%0.78366%0.662SS**PPolyproline II helixtrans-74.3128.5-178.1-165.5169.7-175.9169.80110.6
51T32.8Very low47.1Very low137 Ų137112.7 Ų112.784%0.8463%0.625SS**PPolyproline II helixtrans-79.6132.2172.8450000110.5
52A42.6Very low49.1Very low94 Ų94112.2 Ų112.278%0.77761%0.612SS**PPolyproline II helixtrans-90.5127178.700000110.1
53G32.6Very low51Low69 Ų69113.7 Ų113.771%0.71161%0.607SS**  trans-120.4135.3161.300000109.2
54D42.7Very low52.9Low121 Ų121105.7 Ų105.765%0.64757%0.573SS**  trans178100.1134-158.94000109.4
55D49Very low54.5Low140 Ų140103.6 Ų103.675%0.74956%0.563SS**  trans-87.8-15.4-170.8-66.6-39.2000114.4D58D55-D58 WeakPolarHBondContact O-CB 3.26Å
56K46.1Very low56.3Low192 Ų192106 Ų10684%0.83557%0.57SS**THydrogen-bonded Turntrans-84.3-31.9-168.5-70.5-175.6-179.5174.70114.4D58K56-D58 PolarHBondContact O-N 3.36Å
57A50.8Low57.6Low61 Ų61107.9 Ų107.950%0.50458%0.578SS.*THydrogen-bonded Turntrans-70.5-11.5175.200000112.9
58D61.5Low59.2Low46 Ų46100.3 Ų100.325%0.24654%0.544CS..Hα-helixtrans-83.8-32.6-169.7-156-1000113.1D55 K56 G60 A61 R62D55-D58 WeakPolarHBondContact O-CB 3.26Å; K56-D58 PolarHBondContact O-N 3.36Å; D58-G60 PolarHBondContact O-N 3.26Å; D58-A61 PolarHBondContact O-N 3.05Å; D58-R62 VanDerWaalsContact O-CB 3.31Å; D58-R62 WeakPolarHBondContact O-CB 3.4Å; D58-R62 WeakPolarHBondContact O-CG 3.31Å; D58-R62 PolarHBondContact O-N 3.27Å; D58-R62 WeakPolarHBondContact OD1-CD 3.39Å; D58-R62 WeakPolarHBondContact OD1-CG 3.47Å; D58-R62 IonicContact OD1-CZ 2.91Å; D58-R62 IonicContact OD1-NE 2.61Å; D58-R62 PolarHBondContact OD1-NE 2.91Å; D58-R62 IonicContact OD1-NH2 3.01Å; D58-R62 IonicContact OD2-CZ 2.68Å; D58-R62 IonicContact OD2-NE 3.81Å; D58-R62 PolarHBondContact OD2-NE 3.29Å; D58-R62 IonicContact OD2-NH2 3.32Å; D58-R62 PolarHBondContact OD2-NH2 3.3Å
59Y68.4Low60.9Low170 Ų17099.6 Ų99.667%0.66753%0.533SS*.Hα-helixtrans-63.9-43.3-174.4-175.1-96.8000113.2K63Y59-K63 HydrophobicContact CE1-CD 4.3Å; Y59-K63 WeakPolarHBondContact O-CB 3.2Å; Y59-K63 PolarHBondContact O-N 3.2Å
60G69Low62.8Low31 Ų3196.8 Ų96.832%0.3252%0.522SS..Hα-helixtrans-64.9-46.6179.900000112.6D58 K63 A64D58-G60 PolarHBondContact O-N 3.26Å; G60-K63 PolarHBondContact O-N 3.36Å; G60-A64 WeakPolarHBondContact O-CB 3.28Å; G60-A64 PolarHBondContact O-N 3.46Å
61A66.9Low65.3Low22 Ų2290.6 Ų90.618%0.18250%0.498CS..Hα-helixtrans-63.3-46.917700000111.4D58 K63 A64 L65D58-A61 PolarHBondContact O-N 3.05Å; A61-K63 PolarHBondContact O-N 3.47Å; A61-A64 PolarHBondContact O-N 2.86Å; A61-L65 VanDerWaalsContact O-CG 3.29Å; A61-L65 WeakPolarHBondContact O-CG 3.3Å; A61-L65 PolarHBondContact O-N 3.28Å
62R73.8Confident67.8Low149 Ų14985.3 Ų85.356%0.56247%0.466SS*.Hα-helixtrans-58.2-44.8175.6-73.9176-176.8-159.94.2112.3D58 L65 L66D58-R62 VanDerWaalsContact O-CB 3.31Å; D58-R62 WeakPolarHBondContact O-CB 3.4Å; D58-R62 WeakPolarHBondContact O-CG 3.31Å; D58-R62 PolarHBondContact O-N 3.27Å; D58-R62 WeakPolarHBondContact OD1-CD 3.39Å; D58-R62 WeakPolarHBondContact OD1-CG 3.47Å; D58-R62 IonicContact OD1-CZ 2.91Å; D58-R62 IonicContact OD1-NE 2.61Å; D58-R62 PolarHBondContact OD1-NE 2.91Å; D58-R62 IonicContact OD1-NH2 3.01Å; D58-R62 IonicContact OD2-CZ 2.68Å; D58-R62 IonicContact OD2-NE 3.81Å; D58-R62 PolarHBondContact OD2-NE 3.29Å; D58-R62 IonicContact OD2-NH2 3.32Å; D58-R62 PolarHBondContact OD2-NH2 3.3Å; R62-L65 PolarHBondContact O-N 3.01Å; R62-L66 WeakPolarHBondContact O-CB 3.5Å; R62-L66 WeakPolarHBondContact O-CG 3.32Å; R62-L66 PolarHBondContact O-N 3.31Å
63K77.6Confident70.1Confident129 Ų12983.3 Ų83.356%0.56144%0.444SS*.Hα-helixtrans-64.1-41.8179.2-172.7177.5179.2-179.10111.8Y59 G60 A61 L66 L67Y59-K63 HydrophobicContact CE1-CD 4.3Å; Y59-K63 WeakPolarHBondContact O-CB 3.2Å; Y59-K63 PolarHBondContact O-N 3.2Å; G60-K63 PolarHBondContact O-N 3.36Å; A61-K63 PolarHBondContact O-N 3.47Å; K63-L66 PolarHBondContact O-N 2.9Å; K63-L67 WeakPolarHBondContact O-CB 3.5Å; K63-L67 PolarHBondContact O-N 3.32Å
64A76.6Confident73Confident7 Ų785.2 Ų85.26%0.05844%0.437CS..Hα-helixtrans-65.6-40.8176.900000112.4G60 A61 L67 S68 V186 F190G60-A64 WeakPolarHBondContact O-CB 3.28Å; G60-A64 PolarHBondContact O-N 3.46Å; A61-A64 PolarHBondContact O-N 2.86Å; A64-L67 PolarHBondContact O-N 2.97Å; A64-S68 WeakPolarHBondContact O-CB 3.21Å; A64-S68 PolarHBondContact O-N 3.26Å; A64-S68 PolarHBondContact O-OG 3.46Å; A64-V186 HydrophobicContact CB-CG1 4.03Å; A64-F190 HydrophobicContact CB-CB 3.28Å; A64-F190 HydrophobicContact CB-CD1 4.48Å; A64-F190 HydrophobicContact CB-CD2 3.91Å; A64-F190 HydrophobicContact CB-CG 3.66Å
65L76.7Confident75.3Confident88 Ų8879.8 Ų79.846%0.46141%0.408SS..Hα-helixtrans-62.4-46174.3-70.6173000111.5A61 R62 L67 S68 M69A61-L65 VanDerWaalsContact O-CG 3.29Å; A61-L65 WeakPolarHBondContact O-CG 3.3Å; A61-L65 PolarHBondContact O-N 3.28Å; R62-L65 PolarHBondContact O-N 3.01Å; L65-L67 PolarHBondContact O-N 3.15Å; L65-S68 PolarHBondContact O-N 2.95Å; L65-M69 WeakPolarHBondContact O-CB 3.44Å; L65-M69 PolarHBondContact O-N 3.5Å
66L82.5Confident77.4Confident111 Ų11173.7 Ų73.758%0.58138%0.375SS*.Hα-helixtrans-63.1-42.1177.1-73.2171.2000112.4R62 K63 M69 L70R62-L66 WeakPolarHBondContact O-CB 3.5Å; R62-L66 WeakPolarHBondContact O-CG 3.32Å; R62-L66 PolarHBondContact O-N 3.31Å; K63-L66 PolarHBondContact O-N 2.9Å; L66-M69 HydrophobicContact CD2-CE 4.24Å; L66-M69 PolarHBondContact O-N 3.45Å; L66-L70 WeakPolarHBondContact O-CB 3.39Å; L66-L70 PolarHBondContact O-N 3.01Å
67L82.4Confident79.7Confident94 Ų9468 Ų6849%0.49236%0.356SS..Hα-helixtrans-63.9-42176.8-177.564.8000111.6K63 A64 L65 L70 L71K63-L67 WeakPolarHBondContact O-CB 3.5Å; K63-L67 PolarHBondContact O-N 3.32Å; A64-L67 PolarHBondContact O-N 2.97Å; L65-L67 PolarHBondContact O-N 3.15Å; L67-L70 PolarHBondContact O-N 3.34Å; L67-L71 WeakPolarHBondContact O-CB 3.37Å; L67-L71 PolarHBondContact O-N 3.23Å
68S81.1Confident81.8Confident12 Ų1267.2 Ų67.28%0.08435%0.35CS..Hα-helixtrans-67.4-40.9178.6-53.10000111.3A64 L65 L70 L71 C72 L187A64-S68 WeakPolarHBondContact O-CB 3.21Å; A64-S68 PolarHBondContact O-N 3.26Å; A64-S68 PolarHBondContact O-OG 3.46Å; L65-S68 PolarHBondContact O-N 2.95Å; S68-L70 PolarHBondContact O-N 2.95Å; S68-L71 PolarHBondContact O-N 2.98Å; S68-C72 VanDerWaalsContact O-CB 3.28Å; S68-C72 WeakPolarHBondContact O-CB 3.44Å; S68-C72 PolarHBondContact O-N 3.36Å; S68-L187 WeakPolarHBondContact OG-CD1 3.47Å
69M82.4Confident83.3Confident77 Ų7765.1 Ų65.138%0.37934%0.338SS..Hα-helixtrans-62.8-42.2175.2-168.7174.876.700111.7L65 L66 C72 V73 F105L65-M69 WeakPolarHBondContact O-CB 3.44Å; L65-M69 PolarHBondContact O-N 3.5Å; L66-M69 HydrophobicContact CD2-CE 4.24Å; L66-M69 PolarHBondContact O-N 3.45Å; M69-C72 PolarHBondContact O-N 2.99Å; M69-V73 WeakPolarHBondContact O-CG2 3.22Å; M69-V73 PolarHBondContact O-N 3.3Å; M69-F105 HydrophobicContact SD-CD1 4.23Å; M69-F105 HydrophobicContact SD-CE1 3.73Å
70L87.7Confident84.6Confident102 Ų10260.9 Ų60.953%0.53433%0.327SS..Hα-helixtrans-62.1-46.2175.5178.364.8000111.6L66 L67 S68 V73 I74L66-L70 WeakPolarHBondContact O-CB 3.39Å; L66-L70 PolarHBondContact O-N 3.01Å; L67-L70 PolarHBondContact O-N 3.34Å; S68-L70 PolarHBondContact O-N 2.95Å; L70-V73 PolarHBondContact O-N 3.01Å; L70-I74 HydrophobicContact CD1-CD1 4.16Å; L70-I74 HydrophobicContact CG-CD1 4.02Å; L70-I74 WeakPolarHBondContact O-CG1 3.32Å; L70-I74 PolarHBondContact O-N 2.81Å; L70-I74 VanDerWaalsContact O-N 3.07Å
71L87.5Confident85.9Confident51 Ų5163.4 Ų63.427%0.26734%0.335SS..Hα-helixtrans-65.4-39.9-179.7-171151.5000111.5L67 S68 I74 F75 V179 V182 M183L67-L71 WeakPolarHBondContact O-CB 3.37Å; L67-L71 PolarHBondContact O-N 3.23Å; S68-L71 PolarHBondContact O-N 2.98Å; L71-I74 PolarHBondContact O-N 3.19Å; L71-F75 WeakPolarHBondContact O-CB 3.42Å; L71-F75 PolarHBondContact O-N 3.44Å; L71-V179 HydrophobicContact CD2-CB 4.16Å; L71-V179 HydrophobicContact CD2-CG1 3.24Å; L71-V179 HydrophobicContact CD2-CG2 4.29Å; L71-V182 HydrophobicContact CD1-CG1 4.49Å; L71-M183 HydrophobicContact CD2-CE 4.5Å; L71-M183 HydrophobicContact CD2-CG 3.63Å; L71-M183 HydrophobicContact CD2-SD 3.78Å
72C87.1Confident87.2Confident26 Ų2662.6 Ų62.618%0.17633%0.33CS..Hα-helixtrans-59.2-47.7173.11770000111.6S68 M69 I74 F75 M76 M183S68-C72 VanDerWaalsContact O-CB 3.28Å; S68-C72 WeakPolarHBondContact O-CB 3.44Å; S68-C72 PolarHBondContact O-N 3.36Å; M69-C72 PolarHBondContact O-N 2.99Å; C72-I74 PolarHBondContact O-N 3.19Å; C72-F75 PolarHBondContact O-N 3.46Å; C72-M76 WeakPolarHBondContact O-CB 3.47Å; C72-M76 PolarHBondContact O-N 3.19Å; C72-M183 HydrophobicContact CB-SD 4.02Å
73V90.7Very high88.1Confident52 Ų5255.5 Ų55.532%0.31530%0.303SS..Hα-helixtrans-63.6-41179.1171.60000112.4M69 L70 M76 T77 L102M69-V73 WeakPolarHBondContact O-CG2 3.22Å; M69-V73 PolarHBondContact O-N 3.3Å; L70-V73 PolarHBondContact O-N 3.01Å; V73-M76 HydrophobicContact CG1-CE 4.41Å; V73-T77 PolarHBondContact O-N 3.25Å; V73-T77 VanDerWaalsContact O-N 3.09Å; V73-T77 PolarHBondContact O-OG1 3.32Å; V73-L102 HydrophobicContact CG2-CD2 4.05Å
74I92.1Very high88.9Confident109 Ų10958.5 Ų58.556%0.55931%0.312SS*.Hα-helixtrans-62.9-47.4176.9-69167.3000110.2L70 L71 C72 T77 A78L70-I74 HydrophobicContact CD1-CD1 4.16Å; L70-I74 HydrophobicContact CG-CD1 4.02Å; L70-I74 WeakPolarHBondContact O-CG1 3.32Å; L70-I74 PolarHBondContact O-N 2.81Å; L70-I74 VanDerWaalsContact O-N 3.07Å; L71-I74 PolarHBondContact O-N 3.19Å; C72-I74 PolarHBondContact O-N 3.19Å; I74-T77 PolarHBondContact O-N 3.36Å; I74-A78 PolarHBondContact O-N 3.41Å; I74-A78 VanDerWaalsContact O-N 3.11Å
75F91.4Very high89.7Confident7 Ų763.5 Ų63.53%0.03134%0.337CS..Hα-helixtrans-67.9-46.1-178.3-177-111.7000112.1L71 C72 T77 A78 E79 L98 V175 V179L71-F75 WeakPolarHBondContact O-CB 3.42Å; L71-F75 PolarHBondContact O-N 3.44Å; C72-F75 PolarHBondContact O-N 3.46Å; F75-T77 PolarHBondContact O-N 3.22Å; F75-A78 CarbonylContact O-C 3.57Å; F75-A78 WeakPolarHBondContact O-CA 3.5Å; F75-A78 WeakPolarHBondContact O-CB 3.49Å; F75-A78 PolarHBondContact O-N 2.72Å; F75-E79 HydrophobicContact CD1-CG 4.19Å; F75-E79 HydrophobicContact CD2-CG 4.46Å; F75-E79 HydrophobicContact CE1-CG 3.63Å; F75-E79 WeakPolarHBondContact CE1-OE1 3.5Å; F75-E79 HydrophobicContact CE2-CG 3.92Å; F75-E79 HydrophobicContact CZ-CG 3.43Å; F75-E79 VanDerWaalsContact CZ-CG 3.43Å; F75-E79 WeakPolarHBondContact CZ-OE1 3.46Å; F75-E79 PolarHBondContact O-N 2.84Å; F75-L98 HydrophobicContact CD1-CD1 4.1Å; F75-L98 HydrophobicContact CE1-CD1 4.37Å; F75-V175 HydrophobicContact CD2-CG1 4.09Å; F75-V175 HydrophobicContact CE2-CB 4.33Å; F75-V175 HydrophobicContact CE2-CG1 3.81Å; F75-V179 HydrophobicContact CB-CG1 3.82Å; F75-V179 HydrophobicContact CD1-CB 4.45Å; F75-V179 HydrophobicContact CD1-CG1 3.77Å; F75-V179 HydrophobicContact CD2-CB 4.28Å; F75-V179 HydrophobicContact CD2-CG1 4.19Å; F75-V179 HydrophobicContact CD2-CG2 3.95Å; F75-V179 HydrophobicContact CE1-CG1 4.47Å; F75-V179 HydrophobicContact CE2-CG2 4.5Å; F75-V179 HydrophobicContact CG-CB 4.2Å; F75-V179 HydrophobicContact CG-CG1 3.62Å; F75-V179 HydrophobicContact CG-CG2 4.22Å
76M93.2Very high90.5Very high12 Ų1259.4 Ų59.46%0.05932%0.316CS..Hα-helixtrans-51.4-43.8172.2178.8-171.963.900111.6C72 V73 A78 E79 I80 L98 L99 L102C72-M76 WeakPolarHBondContact O-CB 3.47Å; C72-M76 PolarHBondContact O-N 3.19Å; V73-M76 HydrophobicContact CG1-CE 4.41Å; M76-A78 PolarHBondContact O-N 3.38Å; M76-E79 PolarHBondContact O-N 3.02Å; M76-I80 HydrophobicContact CG-CD1 4.22Å; M76-I80 VanDerWaalsContact O-CG1 3.32Å; M76-I80 WeakPolarHBondContact O-CG1 3.46Å; M76-I80 PolarHBondContact O-N 3.28Å; M76-L98 HydrophobicContact CB-CB 4.3Å; M76-L98 HydrophobicContact CB-CD1 4.29Å; M76-L98 HydrophobicContact CG-CB 4.13Å; M76-L98 HydrophobicContact SD-CB 4.44Å; M76-L99 HydrophobicContact CE-CD1 4.27Å; M76-L99 WeakPolarHBondContact SD-CA 3.5Å; M76-L99 HydrophobicContact SD-CB 3.69Å; M76-L99 HydrophobicContact SD-CD1 3.86Å; M76-L99 HydrophobicContact SD-CG 4.4Å; M76-L102 HydrophobicContact CE-CD2 3.97Å
77T93.9Very high90.9Very high73 Ų7355.5 Ų55.545%0.44830%0.303SS..Hα-helixtrans-64.8-41177.4-53.10000111.7V73 I74 F75 E79 I80 V81V73-T77 PolarHBondContact O-N 3.25Å; V73-T77 VanDerWaalsContact O-N 3.09Å; V73-T77 PolarHBondContact O-OG1 3.32Å; I74-T77 PolarHBondContact O-N 3.36Å; F75-T77 PolarHBondContact O-N 3.22Å; T77-E79 VanDerWaalsContact C-N 3.31Å; T77-E79 PolarHBondContact O-N 3.27Å; T77-I80 PolarHBondContact O-N 3.48Å; T77-V81 WeakPolarHBondContact O-CG2 3.39Å; T77-V81 PolarHBondContact O-N 3.1Å; T77-V81 VanDerWaalsContact O-N 3.17Å
78A94.9Very high91.4Very high44 Ų4451 Ų5136%0.36428%0.279SS..Hα-helixtrans-64.4-36.2176.300000112I74 F75 M76 G82I74-A78 PolarHBondContact O-N 3.41Å; I74-A78 VanDerWaalsContact O-N 3.11Å; F75-A78 CarbonylContact O-C 3.57Å; F75-A78 WeakPolarHBondContact O-CA 3.5Å; F75-A78 WeakPolarHBondContact O-CB 3.49Å; F75-A78 PolarHBondContact O-N 2.72Å; M76-A78 PolarHBondContact O-N 3.38Å; A78-G82 VanDerWaalsContact O-CA 3.31Å; A78-G82 WeakPolarHBondContact O-CA 3.3Å; A78-G82 PolarHBondContact O-N 3.23Å
79E94Very high91.9Very high2 Ų250.9 Ų50.91%0.00928%0.277CS..Hα-helixtrans-73.1-37.8176-66.3-166.313100113.4F75 M76 T77 G82 G83 I91 A95 L98F75-E79 HydrophobicContact CD1-CG 4.19Å; F75-E79 HydrophobicContact CD2-CG 4.46Å; F75-E79 HydrophobicContact CE1-CG 3.63Å; F75-E79 WeakPolarHBondContact CE1-OE1 3.5Å; F75-E79 HydrophobicContact CE2-CG 3.92Å; F75-E79 HydrophobicContact CZ-CG 3.43Å; F75-E79 VanDerWaalsContact CZ-CG 3.43Å; F75-E79 WeakPolarHBondContact CZ-OE1 3.46Å; F75-E79 PolarHBondContact O-N 2.84Å; M76-E79 PolarHBondContact O-N 3.02Å; T77-E79 VanDerWaalsContact C-N 3.31Å; T77-E79 PolarHBondContact O-N 3.27Å; E79-G82 PolarHBondContact O-N 3.39Å; E79-G83 WeakPolarHBondContact O-CA 3.35Å; E79-G83 PolarHBondContact O-N 2.96Å; E79-I91 HydrophobicContact CB-CG2 3.92Å; E79-I91 HydrophobicContact CG-CG2 4.32Å; E79-I91 WeakPolarHBondContact O-CG2 3.49Å; E79-A95 HydrophobicContact CB-CB 3.68Å; E79-A95 PolarHBondContact OE2-N 2.98Å; E79-L98 VanDerWaalsContact OE2-CD1 3.24Å; E79-L98 WeakPolarHBondContact OE2-CD1 3.22Å
80I95.2Very high92.3Very high81 Ų8147.2 Ų47.242%0.41526%0.259SS..Hα-helixtrans-59.4-51.3174.3-68.7169.7000109.9M76 T77 Y84 A95M76-I80 HydrophobicContact CG-CD1 4.22Å; M76-I80 VanDerWaalsContact O-CG1 3.32Å; M76-I80 WeakPolarHBondContact O-CG1 3.46Å; M76-I80 PolarHBondContact O-N 3.28Å; T77-I80 PolarHBondContact O-N 3.48Å; I80-Y84 PolarHBondContact O-N 2.83Å; I80-A95 HydrophobicContact CG1-CB 3.83Å
81V95.6Very high92.6Very high83 Ų8342.4 Ų42.450%0.50323%0.234SC..Hα-helixtrans-66.7-46.3-180176.30000110.3T77 Y84 L85T77-V81 WeakPolarHBondContact O-CG2 3.39Å; T77-V81 PolarHBondContact O-N 3.1Å; T77-V81 VanDerWaalsContact O-N 3.17Å; V81-Y84 PolarHBondContact O-N 2.68Å; V81-L85 HydrophobicContact CG1-CD1 3.94Å; V81-L85 HydrophobicContact CG1-CG 4.44Å; V81-L85 VanDerWaalsContact O-CG 3.29Å; V81-L85 WeakPolarHBondContact O-CG 3.27Å; V81-L85 PolarHBondContact O-N 3.29Å
82G94.5Very high92.8Very high6 Ų643 Ų436%0.06224%0.237CC..Hα-helixtrans-67.5-37.4-177.100000113.7A78 E79 L85 A86 L172A78-G82 VanDerWaalsContact O-CA 3.31Å; A78-G82 WeakPolarHBondContact O-CA 3.3Å; A78-G82 PolarHBondContact O-N 3.23Å; E79-G82 PolarHBondContact O-N 3.39Å; G82-L85 PolarHBondContact O-N 2.63Å; G82-A86 WeakPolarHBondContact O-CB 3.46Å; G82-A86 PolarHBondContact O-N 3.25Å; G82-L172 VanDerWaalsContact C-CD1 3.43Å
83G93.8Very high93.1Very high0 Ų041.8 Ų41.80%023%0.229CC..Hα-helixtrans-66.7-40.1174.900000112.1E79 A86 G87 S88E79-G83 WeakPolarHBondContact O-CA 3.35Å; E79-G83 PolarHBondContact O-N 2.96Å; G83-A86 PolarHBondContact O-N 2.82Å; G83-G87 PolarHBondContact O-N 3.26Å; G83-S88 PolarHBondContact O-N 3.34Å; G83-S88 VanDerWaalsContact O-N 3.16Å
84Y93.4Very high93.1Very high191 Ų19139.5 Ų39.575%0.74922%0.215SC*.Hα-helixtrans-63.5-46.4172-177.7-95000111.9I80 V81 A86 G87I80-Y84 PolarHBondContact O-N 2.83Å; V81-Y84 PolarHBondContact O-N 2.68Å; Y84-A86 VanDerWaalsContact C-N 3.34Å; Y84-A86 PolarHBondContact O-N 2.99Å; Y84-G87 PolarHBondContact O-N 3.16Å
85L94.8Very high93.2Very high112 Ų11234.4 Ų34.459%0.58619%0.189SC*.Hα-helixtrans-67-33.8178-68.7175.4000112.9V81 G82 I168V81-L85 HydrophobicContact CG1-CD1 3.94Å; V81-L85 HydrophobicContact CG1-CG 4.44Å; V81-L85 VanDerWaalsContact O-CG 3.29Å; V81-L85 WeakPolarHBondContact O-CG 3.27Å; V81-L85 PolarHBondContact O-N 3.29Å; G82-L85 PolarHBondContact O-N 2.63Å; L85-I168 HydrophobicContact CB-CD1 4.3Å
86A92.3Very high93.2Very high3 Ų335 Ų353%0.02520%0.196CC..Hα-helixtrans-80.1-16.5178.100000113.4G82 G83 Y84 S88 I91 I164 D165 I168G82-A86 WeakPolarHBondContact O-CB 3.46Å; G82-A86 PolarHBondContact O-N 3.25Å; G83-A86 PolarHBondContact O-N 2.82Å; Y84-A86 VanDerWaalsContact C-N 3.34Å; Y84-A86 PolarHBondContact O-N 2.99Å; A86-S88 PolarHBondContact O-N 3.41Å; A86-I91 HydrophobicContact CB-CD1 4.13Å; A86-I164 CarbonylContact O-C 3.56Å; A86-I164 VanDerWaalsContact O-CA 3.32Å; A86-I164 WeakPolarHBondContact O-CA 3.17Å; A86-D165 PolarHBondContact O-N 3.4Å; A86-I168 HydrophobicContact CB-CB 3.97Å; A86-I168 HydrophobicContact CB-CG2 3.8Å
87G91.1Very high93.1Very high29 Ų2934.8 Ų34.830%0.29919%0.194SC..THydrogen-bonded Turntrans61.226.6-168.600000113G83 Y84 R156G83-G87 PolarHBondContact O-N 3.26Å; Y84-G87 PolarHBondContact O-N 3.16Å; G87-R156 PolarHBondContact O-NH1 3.46Å; G87-R156 PolarHBondContact O-NH2 2.87Å
88S92.6Very high92.9Very high0 Ų031.4 Ų31.40%017%0.173CC..  trans-99.6118.1-177.1171.10000110.8G83 A86 A90 I91 I92 D248G83-S88 PolarHBondContact O-N 3.34Å; G83-S88 VanDerWaalsContact O-N 3.16Å; A86-S88 PolarHBondContact O-N 3.41Å; S88-A90 VanDerWaalsContact C-N 3.29Å; S88-A90 PolarHBondContact OG-N 3.47Å; S88-I91 PolarHBondContact OG-N 3.2Å; S88-I92 WeakPolarHBondContact O-CG1 3.28Å; S88-I92 PolarHBondContact O-N 3Å; S88-D248 PolarHBondContact OG-OD1 2.94Å
89L91.9Very high92.8Very high9 Ų933.5 Ų33.55%0.04718%0.178CC..Hα-helixtrans-71.1-30.1174.9-17563.4000110.8I92 T93 L149 I152 A153 D248 T252L89-I92 PolarHBondContact O-N 3.49Å; L89-T93 VanDerWaalsContact O-CB 3.29Å; L89-T93 WeakPolarHBondContact O-CB 3.39Å; L89-T93 PolarHBondContact O-N 3.36Å; L89-T93 PolarHBondContact O-OG1 3.32Å; L89-L149 HydrophobicContact CD1-CD2 4.29Å; L89-I152 HydrophobicContact CD1-CB 4.27Å; L89-I152 HydrophobicContact CD1-CG2 3.64Å; L89-I152 HydrophobicContact CD2-CB 4.36Å; L89-I152 HydrophobicContact CD2-CG2 3.93Å; L89-I152 HydrophobicContact CG-CG2 4.44Å; L89-A153 VanDerWaalsContact CD2-CA 3.41Å; L89-A153 HydrophobicContact CD2-CB 3.59Å; L89-D248 VanDerWaalsContact CB-OD2 3.22Å; L89-D248 WeakPolarHBondContact CB-OD2 3.36Å; L89-D248 PolarHBondContact N-OD1 3.28Å; L89-D248 PolarHBondContact N-OD2 3.34Å; L89-T252 HydrophobicContact CD2-CG2 4.19Å; L89-T252 HydrophobicContact CG-CG2 4.37Å
90A91.7Very high92.6Very high0 Ų033.7 Ų33.70%018%0.179CC..Hα-helixtrans-64.1-41.8177.100000112.1S88 T93 D94 M169 D248 C251S88-A90 VanDerWaalsContact C-N 3.29Å; S88-A90 PolarHBondContact OG-N 3.47Å; A90-T93 WeakPolarHBondContact O-CB 3.49Å; A90-T93 PolarHBondContact O-N 2.9Å; A90-D94 PolarHBondContact O-N 2.96Å; A90-M169 HydrophobicContact CB-CE 4.24Å; A90-D248 WeakPolarHBondContact CB-OD1 3.49Å; A90-D248 PolarHBondContact N-OD1 3.5Å; A90-C251 HydrophobicContact CB-CB 4.43Å
91I92.3Very high92.2Very high1 Ų131.5 Ų31.51%0.00517%0.169CC..Hα-helixtrans-67.6-42.1174.9-60.3171.1000110.8E79 A86 S88 T93 D94 A95 M169 L172 V233E79-I91 HydrophobicContact CB-CG2 3.92Å; E79-I91 HydrophobicContact CG-CG2 4.32Å; E79-I91 WeakPolarHBondContact O-CG2 3.49Å; A86-I91 HydrophobicContact CB-CD1 4.13Å; S88-I91 PolarHBondContact OG-N 3.2Å; I91-T93 PolarHBondContact O-N 2.96Å; I91-D94 PolarHBondContact O-N 3.03Å; I91-A95 WeakPolarHBondContact O-CB 3.31Å; I91-A95 PolarHBondContact O-N 2.71Å; I91-M169 HydrophobicContact CD1-CB 3.96Å; I91-M169 HydrophobicContact CD1-CG 3.8Å; I91-M169 HydrophobicContact CG1-CG 4.25Å; I91-L172 HydrophobicContact CD1-CB 4.18Å; I91-L172 HydrophobicContact CD1-CD1 3.8Å; I91-L172 HydrophobicContact CG2-CD1 4.39Å; I91-V233 HydrophobicContact CG1-CG1 4.21Å
92I93.2Very high91.9Very high63 Ų6329.6 Ų29.632%0.32316%0.155SC..Hα-helixtrans-62.3-34.8175.7-66.1169.3000110.7S88 L89 A96S88-I92 WeakPolarHBondContact O-CG1 3.28Å; S88-I92 PolarHBondContact O-N 3Å; L89-I92 PolarHBondContact O-N 3.49Å; I92-A96 WeakPolarHBondContact O-CB 3.4Å; I92-A96 PolarHBondContact O-N 3.06Å
93T92.4Very high91.7Very high0 Ų030.6 Ų30.60%016%0.163CC..Hα-helixtrans-63.8-48.5175.1-61.90000110.8L89 A90 I91 A95 A96 H97 L149 T252L89-T93 VanDerWaalsContact O-CB 3.29Å; L89-T93 WeakPolarHBondContact O-CB 3.39Å; L89-T93 PolarHBondContact O-N 3.36Å; L89-T93 PolarHBondContact O-OG1 3.32Å; A90-T93 WeakPolarHBondContact O-CB 3.49Å; A90-T93 PolarHBondContact O-N 2.9Å; I91-T93 PolarHBondContact O-N 2.96Å; T93-A95 PolarHBondContact O-N 3.4Å; T93-A96 PolarHBondContact O-N 3.43Å; T93-H97 PolarHBondContact O-CD2 3.4Å; T93-H97 PolarHBondContact O-N 3.23Å; T93-L149 HydrophobicContact CG2-CD1 4.01Å; T93-T252 HydrophobicContact CG2-CG2 4.29Å; T93-T252 WeakPolarHBondContact OG1-CG2 3.32Å; T93-T252 PolarHBondContact OG1-OG1 3.3Å
94D90.9Very high91.5Very high4 Ų431.3 Ų31.32%0.02117%0.168CC..Hα-helixtrans-58.5-49.4176.5-149.98.3000110.1A90 I91 A96 H97 L98 S230A90-D94 PolarHBondContact O-N 2.96Å; I91-D94 PolarHBondContact O-N 3.03Å; D94-A96 PolarHBondContact O-N 2.85Å; D94-H97 PolarHBondContact O-N 3.49Å; D94-L98 WeakPolarHBondContact O-CG 3.18Å; D94-L98 PolarHBondContact O-N 2.81Å; D94-S230 PolarHBondContact OD2-OG 3.4Å
95A93.5Very high91.1Very high2 Ų226.9 Ų26.92%0.01715%0.153CC..Hα-helixtrans-59.9-42.2177.800000113.6E79 I80 I91 T93 L99E79-A95 HydrophobicContact CB-CB 3.68Å; E79-A95 PolarHBondContact OE2-N 2.98Å; I80-A95 HydrophobicContact CG1-CB 3.83Å; I91-A95 WeakPolarHBondContact O-CB 3.31Å; I91-A95 PolarHBondContact O-N 2.71Å; T93-A95 PolarHBondContact O-N 3.4Å; A95-L99 WeakPolarHBondContact O-CB 3.36Å; A95-L99 PolarHBondContact O-N 3.1Å
96A93.1Very high90.8Very high21 Ų2126.2 Ų26.217%0.17415%0.149CC..Hα-helixtrans-66.3-41.2178.400000110.9I92 T93 D94 L99 T100 I145 L149I92-A96 WeakPolarHBondContact O-CB 3.4Å; I92-A96 PolarHBondContact O-N 3.06Å; T93-A96 PolarHBondContact O-N 3.43Å; D94-A96 PolarHBondContact O-N 2.85Å; A96-L99 PolarHBondContact O-N 3.15Å; A96-T100 PolarHBondContact O-N 2.77Å; A96-T100 PolarHBondContact O-OG1 2.83Å; A96-I145 HydrophobicContact CB-CG2 4Å; A96-L149 HydrophobicContact CB-CD1 4.04Å
97H89.5Confident90.7Very high6 Ų628.1 Ų28.13%0.02816%0.159CC..Hα-helixtrans-60.4-51.4174.4-76.2-57000111.2T93 D94 L99 T100 D101T93-H97 PolarHBondContact O-CD2 3.4Å; T93-H97 PolarHBondContact O-N 3.23Å; D94-H97 PolarHBondContact O-N 3.49Å; H97-L99 VanDerWaalsContact C-N 3.25Å; H97-L99 PolarHBondContact O-N 3.36Å; H97-T100 CarbonylContact O-C 3.58Å; H97-T100 WeakPolarHBondContact O-CA 3.31Å; H97-T100 WeakPolarHBondContact O-CB 3.29Å; H97-T100 PolarHBondContact O-N 2.77Å; H97-D101 VanDerWaalsContact O-CG 3.3Å; H97-D101 PolarHBondContact O-N 3.41Å
98L90.1Very high90.4Very high3 Ų329 Ų292%0.01616%0.16CC..Hα-helixtrans-54.5-40.2175.9-67.2176.8000113F75 M76 E79 D94 D101 L102F75-L98 HydrophobicContact CD1-CD1 4.1Å; F75-L98 HydrophobicContact CE1-CD1 4.37Å; M76-L98 HydrophobicContact CB-CB 4.3Å; M76-L98 HydrophobicContact CB-CD1 4.29Å; M76-L98 HydrophobicContact CG-CB 4.13Å; M76-L98 HydrophobicContact SD-CB 4.44Å; E79-L98 VanDerWaalsContact OE2-CD1 3.24Å; E79-L98 WeakPolarHBondContact OE2-CD1 3.22Å; D94-L98 WeakPolarHBondContact O-CG 3.18Å; D94-L98 PolarHBondContact O-N 2.81Å; L98-D101 PolarHBondContact O-N 2.99Å; L98-L102 PolarHBondContact O-N 2.9Å
99L92.4Very high90Very high88 Ų8832.7 Ų32.746%0.46118%0.18SC..Hα-helixtrans-64.6-41.9174.8179.465.3000111.9M76 A95 A96 H97 D101 L102 A103M76-L99 HydrophobicContact CE-CD1 4.27Å; M76-L99 WeakPolarHBondContact SD-CA 3.5Å; M76-L99 HydrophobicContact SD-CB 3.69Å; M76-L99 HydrophobicContact SD-CD1 3.86Å; M76-L99 HydrophobicContact SD-CG 4.4Å; A95-L99 WeakPolarHBondContact O-CB 3.36Å; A95-L99 PolarHBondContact O-N 3.1Å; A96-L99 PolarHBondContact O-N 3.15Å; H97-L99 VanDerWaalsContact C-N 3.25Å; H97-L99 PolarHBondContact O-N 3.36Å; L99-D101 VanDerWaalsContact C-N 3.27Å; L99-D101 PolarHBondContact O-N 2.81Å; L99-L102 PolarHBondContact O-N 2.94Å; L99-A103 WeakPolarHBondContact O-CB 3.31Å; L99-A103 PolarHBondContact O-N 3.34Å
100T91.3Very high89.8Confident6 Ų638.2 Ų38.24%0.03720%0.203CC..Hα-helixtrans-66.3-33.7178.8-29.80000111.3A96 H97 A103 S104 L141 I142 I145A96-T100 PolarHBondContact O-N 2.77Å; A96-T100 PolarHBondContact O-OG1 2.83Å; H97-T100 CarbonylContact O-C 3.58Å; H97-T100 WeakPolarHBondContact O-CA 3.31Å; H97-T100 WeakPolarHBondContact O-CB 3.29Å; H97-T100 PolarHBondContact O-N 2.77Å; T100-A103 PolarHBondContact O-N 3.44Å; T100-S104 WeakPolarHBondContact O-CB 3.25Å; T100-S104 PolarHBondContact O-N 2.85Å; T100-S104 PolarHBondContact O-OG 3.18Å; T100-L141 HydrophobicContact CG2-CB 4.25Å; T100-L141 HydrophobicContact CG2-CD2 3.68Å; T100-L141 HydrophobicContact CG2-CG 3.57Å; T100-I142 HydrophobicContact CG2-CB 4.47Å; T100-I142 HydrophobicContact CG2-CG1 3.77Å; T100-I145 HydrophobicContact CG2-CG1 4.2Å
101D86.5Confident89.6Confident35 Ų3538.7 Ų38.719%0.18721%0.207CC..Hα-helixtrans-71.7-42176.2-63.5-42.6000111.9H97 L98 L99 A103 S104 F105 H222H97-D101 VanDerWaalsContact O-CG 3.3Å; H97-D101 PolarHBondContact O-N 3.41Å; L98-D101 PolarHBondContact O-N 2.99Å; L99-D101 VanDerWaalsContact C-N 3.27Å; L99-D101 PolarHBondContact O-N 2.81Å; D101-A103 VanDerWaalsContact C-N 3.31Å; D101-A103 PolarHBondContact O-N 2.89Å; D101-S104 PolarHBondContact O-N 2.8Å; D101-F105 WeakPolarHBondContact O-CB 3.16Å; D101-F105 PolarHBondContact O-N 3.26Å; D101-H222 WeakPolarHBondContact CB-NE2 3.44Å; D101-H222 VanDerWaalsContact CG-NE2 3.3Å; D101-H222 IonicContact OD1-CE1 3.82Å; D101-H222 PolarHBondContact OD1-CE1 3.38Å; D101-H222 VanDerWaalsContact OD1-CE1 3.31Å; D101-H222 IonicContact OD1-NE2 3.1Å; D101-H222 IonicContact OD2-CE1 3.31Å; D101-H222 PolarHBondContact OD2-CE1 3.32Å; D101-H222 IonicContact OD2-NE2 3.71Å; D101-H222 PolarHBondContact OD2-NE2 3.36Å
102L88.8Confident89.1Confident42 Ų4243.1 Ų43.122%0.2223%0.229CC..Hα-helixtrans-57.8-46170.6177.762.3000111.1V73 M76 L98 L99 F105 L106V73-L102 HydrophobicContact CG2-CD2 4.05Å; M76-L102 HydrophobicContact CE-CD2 3.97Å; L98-L102 PolarHBondContact O-N 2.9Å; L99-L102 PolarHBondContact O-N 2.94Å; L102-F105 PolarHBondContact O-N 3.15Å; L102-L106 WeakPolarHBondContact O-CG 3.44Å; L102-L106 PolarHBondContact O-N 2.96Å
103A91Very high88.7Confident28 Ų2848 Ų4823%0.23124%0.244CC..Hα-helixtrans-61.7-44.7176.400000111.6L99 T100 D101 F105 L106 I107 L141L99-A103 WeakPolarHBondContact O-CB 3.31Å; L99-A103 PolarHBondContact O-N 3.34Å; T100-A103 PolarHBondContact O-N 3.44Å; D101-A103 VanDerWaalsContact C-N 3.31Å; D101-A103 PolarHBondContact O-N 2.89Å; A103-F105 VanDerWaalsContact C-N 3.3Å; A103-F105 PolarHBondContact O-N 3.04Å; A103-L106 PolarHBondContact O-N 2.85Å; A103-I107 WeakPolarHBondContact O-CD1 3.21Å; A103-I107 VanDerWaalsContact O-CG1 3.25Å; A103-I107 WeakPolarHBondContact O-CG1 3.38Å; A103-I107 PolarHBondContact O-N 3.49Å; A103-L141 HydrophobicContact CB-CD2 3.87Å
104S89Confident88.4Confident14 Ų1450.1 Ų50.110%0.09825%0.254CS..Hα-helixtrans-61.7-37.9177.6-61.30000112.2T100 D101 I107 S108 S138T100-S104 WeakPolarHBondContact O-CB 3.25Å; T100-S104 PolarHBondContact O-N 2.85Å; T100-S104 PolarHBondContact O-OG 3.18Å; D101-S104 PolarHBondContact O-N 2.8Å; S104-I107 PolarHBondContact O-N 3.43Å; S104-S108 WeakPolarHBondContact O-CB 3.35Å; S104-S108 PolarHBondContact O-N 2.98Å; S104-S108 PolarHBondContact O-OG 2.93Å; S104-S138 WeakPolarHBondContact OG-CB 3.43Å
105F85Confident88.1Confident98 Ų9850.4 Ų50.443%0.4326%0.257SS..Hα-helixtrans-64.8-46.2174.1176.8-106.2000111.9M69 D101 L102 A103 I107 S108 L109M69-F105 HydrophobicContact SD-CD1 4.23Å; M69-F105 HydrophobicContact SD-CE1 3.73Å; D101-F105 WeakPolarHBondContact O-CB 3.16Å; D101-F105 PolarHBondContact O-N 3.26Å; L102-F105 PolarHBondContact O-N 3.15Å; A103-F105 VanDerWaalsContact C-N 3.3Å; A103-F105 PolarHBondContact O-N 3.04Å; F105-I107 VanDerWaalsContact C-N 3.35Å; F105-I107 PolarHBondContact O-N 3.35Å; F105-S108 WeakPolarHBondContact O-CB 3.45Å; F105-S108 PolarHBondContact O-N 3.44Å; F105-L109 HydrophobicContact CD1-CD1 4.06Å; F105-L109 HydrophobicContact CD1-CG 4.49Å; F105-L109 HydrophobicContact CE1-CD1 3.45Å; F105-L109 VanDerWaalsContact CE1-CD1 3.45Å; F105-L109 HydrophobicContact CE1-CG 4.06Å; F105-L109 HydrophobicContact CE2-CD2 4.39Å; F105-L109 HydrophobicContact CE2-CG 4.29Å; F105-L109 HydrophobicContact CZ-CD1 3.71Å; F105-L109 HydrophobicContact CZ-CD2 4.1Å; F105-L109 HydrophobicContact CZ-CG 3.95Å; F105-L109 WeakPolarHBondContact O-CG 3.28Å; F105-L109 PolarHBondContact O-N 3.23Å
106L88.9Confident87.6Confident98 Ų9854.6 Ų54.651%0.51329%0.286SS..Hα-helixtrans-62-42.3176.4-67.7174.8000111.9L102 A103 S108 L109 F110L102-L106 WeakPolarHBondContact O-CG 3.44Å; L102-L106 PolarHBondContact O-N 2.96Å; A103-L106 PolarHBondContact O-N 2.85Å; L106-S108 VanDerWaalsContact C-N 3.33Å; L106-L109 PolarHBondContact O-N 3.34Å; L106-F110 PolarHBondContact O-N 3.39Å
107I90.6Very high87.3Confident44 Ų4459.9 Ų59.923%0.22630%0.302CS..Hα-helixtrans-60.5-45.2174.1-68.8163.2000110.1A103 S104 F105 L109 F110 S111 G134 V137A103-I107 WeakPolarHBondContact O-CD1 3.21Å; A103-I107 VanDerWaalsContact O-CG1 3.25Å; A103-I107 WeakPolarHBondContact O-CG1 3.38Å; A103-I107 PolarHBondContact O-N 3.49Å; S104-I107 PolarHBondContact O-N 3.43Å; F105-I107 VanDerWaalsContact C-N 3.35Å; F105-I107 PolarHBondContact O-N 3.35Å; I107-L109 PolarHBondContact O-N 2.95Å; I107-F110 PolarHBondContact O-N 2.85Å; I107-S111 WeakPolarHBondContact O-CB 3.46Å; I107-S111 PolarHBondContact O-N 3.22Å; I107-S111 PolarHBondContact O-OG 3.4Å; I107-G134 WeakPolarHBondContact CG2-O 3.23Å; I107-V137 HydrophobicContact CD1-CG1 4.14Å
108S83.4Confident86.8Confident48 Ų4867.8 Ų67.834%0.33634%0.339SS..Hα-helixtrans-62.1-42.5178.5-61.40000112.2S104 F105 L106 S111 M112S104-S108 WeakPolarHBondContact O-CB 3.35Å; S104-S108 PolarHBondContact O-N 2.98Å; S104-S108 PolarHBondContact O-OG 2.93Å; F105-S108 WeakPolarHBondContact O-CB 3.45Å; F105-S108 PolarHBondContact O-N 3.44Å; L106-S108 VanDerWaalsContact C-N 3.33Å; S108-S111 PolarHBondContact O-N 3.49Å; S108-M112 WeakPolarHBondContact O-CB 3.45Å; S108-M112 WeakPolarHBondContact O-CG 3.34Å; S108-M112 PolarHBondContact O-N 3.43Å
109L84.1Confident86.6Confident77 Ų7770.6 Ų70.640%0.40336%0.363SS..Hα-helixtrans-60.2-45.9174.2-74.1179.6000111.8F105 L106 I107 M112 Y113F105-L109 HydrophobicContact CD1-CD1 4.06Å; F105-L109 HydrophobicContact CD1-CG 4.49Å; F105-L109 HydrophobicContact CE1-CD1 3.45Å; F105-L109 VanDerWaalsContact CE1-CD1 3.45Å; F105-L109 HydrophobicContact CE1-CG 4.06Å; F105-L109 HydrophobicContact CE2-CD2 4.39Å; F105-L109 HydrophobicContact CE2-CG 4.29Å; F105-L109 HydrophobicContact CZ-CD1 3.71Å; F105-L109 HydrophobicContact CZ-CD2 4.1Å; F105-L109 HydrophobicContact CZ-CG 3.95Å; F105-L109 WeakPolarHBondContact O-CG 3.28Å; F105-L109 PolarHBondContact O-N 3.23Å; L106-L109 PolarHBondContact O-N 3.34Å; I107-L109 PolarHBondContact O-N 2.95Å; L109-M112 HydrophobicContact CD2-CE 3.68Å; L109-M112 PolarHBondContact O-N 2.9Å; L109-Y113 WeakPolarHBondContact O-CB 3.37Å; L109-Y113 PolarHBondContact O-N 3.42Å
110F87.7Confident86.3Confident125 Ų12569.3 Ų69.355%0.54836%0.359SS..Hα-helixtrans-64.1-43.9177.9177.6-106.7000111.9L106 I107 M112 Y113 M114L106-F110 PolarHBondContact O-N 3.39Å; I107-F110 PolarHBondContact O-N 2.85Å; F110-M112 PolarHBondContact O-N 3.48Å; F110-Y113 WeakPolarHBondContact O-CB 3.15Å; F110-Y113 PolarHBondContact O-N 3.02Å; F110-M114 HydrophobicContact CD1-CG 4.47Å; F110-M114 HydrophobicContact CD1-SD 4.02Å; F110-M114 HydrophobicContact CE1-CG 4.06Å; F110-M114 HydrophobicContact CE1-SD 3.24Å; F110-M114 WeakPolarHBondContact CE1-SD 3.31Å; F110-M114 HydrophobicContact CE2-CG 4.27Å; F110-M114 HydrophobicContact CE2-SD 4.3Å; F110-M114 HydrophobicContact CZ-CG 3.95Å; F110-M114 HydrophobicContact CZ-SD 3.41Å; F110-M114 WeakPolarHBondContact CZ-SD 3.29Å; F110-M114 WeakPolarHBondContact O-CG 3.08Å; F110-M114 PolarHBondContact O-N 2.95Å
111S88.2Confident86.1Confident10 Ų1081.5 Ų81.57%0.0740%0.404CS..Hα-helixtrans-63.1-40.5176-80.30000112.7I107 S108 M114 A115 A130 G134I107-S111 WeakPolarHBondContact O-CB 3.46Å; I107-S111 PolarHBondContact O-N 3.22Å; I107-S111 PolarHBondContact O-OG 3.4Å; S108-S111 PolarHBondContact O-N 3.49Å; S111-M114 PolarHBondContact O-N 3.27Å; S111-A115 VanDerWaalsContact O-CB 3.24Å; S111-A115 WeakPolarHBondContact O-CB 3.39Å; S111-A115 PolarHBondContact O-N 2.96Å; S111-A130 VanDerWaalsContact CB-O 3.26Å; S111-A130 WeakPolarHBondContact CB-O 3.41Å; S111-A130 PolarHBondContact OG-O 2.83Å; S111-G134 VanDerWaalsContact OG-CA 3.26Å; S111-G134 WeakPolarHBondContact OG-CA 3.45Å
112M82.4Confident86.2Confident94 Ų9489.3 Ų89.346%0.46344%0.436SS..Hα-helixtrans-63.5-42.8172.9-76-171.3-63.400111.5S108 L109 F110 M114 A115 S116S108-M112 WeakPolarHBondContact O-CB 3.45Å; S108-M112 WeakPolarHBondContact O-CG 3.34Å; S108-M112 PolarHBondContact O-N 3.43Å; L109-M112 HydrophobicContact CD2-CE 3.68Å; L109-M112 PolarHBondContact O-N 2.9Å; F110-M112 PolarHBondContact O-N 3.48Å; M112-M114 VanDerWaalsContact C-N 3.33Å; M112-M114 PolarHBondContact O-N 3.17Å; M112-A115 PolarHBondContact O-N 2.72Å; M112-S116 PolarHBondContact O-N 3.15Å
113Y84.6Confident86.2Confident165 Ų16590.8 Ų90.865%0.64744%0.444SS*.Hα-helixtrans-58-46.9174.6172.8-102000111L109 F110 S116L109-Y113 WeakPolarHBondContact O-CB 3.37Å; L109-Y113 PolarHBondContact O-N 3.42Å; F110-Y113 WeakPolarHBondContact O-CB 3.15Å; F110-Y113 PolarHBondContact O-N 3.02Å; Y113-S116 PolarHBondContact O-N 3.21Å; Y113-S116 PolarHBondContact O-OG 2.69Å
114M84.9Confident86Confident44 Ų4494 Ų9422%0.21746%0.464CS..Hα-helixtrans-63.2-44.3175.6-70.2-169.372.900112.5F110 S111 M112 S116 R117 W127 A130F110-M114 HydrophobicContact CD1-CG 4.47Å; F110-M114 HydrophobicContact CD1-SD 4.02Å; F110-M114 HydrophobicContact CE1-CG 4.06Å; F110-M114 HydrophobicContact CE1-SD 3.24Å; F110-M114 WeakPolarHBondContact CE1-SD 3.31Å; F110-M114 HydrophobicContact CE2-CG 4.27Å; F110-M114 HydrophobicContact CE2-SD 4.3Å; F110-M114 HydrophobicContact CZ-CG 3.95Å; F110-M114 HydrophobicContact CZ-SD 3.41Å; F110-M114 WeakPolarHBondContact CZ-SD 3.29Å; F110-M114 WeakPolarHBondContact O-CG 3.08Å; F110-M114 PolarHBondContact O-N 2.95Å; S111-M114 PolarHBondContact O-N 3.27Å; M112-M114 VanDerWaalsContact C-N 3.33Å; M112-M114 PolarHBondContact O-N 3.17Å; M114-S116 PolarHBondContact O-N 3Å; M114-R117 WeakPolarHBondContact O-CB 3.39Å; M114-R117 WeakPolarHBondContact O-CG 3.03Å; M114-R117 PolarHBondContact O-N 3.38Å; M114-R117 VanDerWaalsContact O-N 3.13Å; M114-W127 HydrophobicContact CE-CE3 3.56Å; M114-W127 HydrophobicContact CE-CH2 4.17Å; M114-W127 HydrophobicContact CE-CZ3 3.28Å; M114-W127 WeakPolarHBondContact O-CB 3.47Å; M114-A130 HydrophobicContact CB-CB 3.95Å
115A85.4Confident85.8Confident10 Ų1098.3 Ų98.38%0.08348%0.482CS..Hα-helixtrans-67-19.5-178.100000113.8S111 M112 R117 W127 H128 E131S111-A115 VanDerWaalsContact O-CB 3.24Å; S111-A115 WeakPolarHBondContact O-CB 3.39Å; S111-A115 PolarHBondContact O-N 2.96Å; M112-A115 PolarHBondContact O-N 2.72Å; A115-R117 VanDerWaalsContact C-N 3.28Å; A115-W127 WeakPolarHBondContact CA-O 3.18Å; A115-H128 PolarHBondContact O-ND1 3.18Å; A115-E131 HydrophobicContact CB-CB 4.48Å
116S83.1Confident85.9Confident90 Ų9094.2 Ų94.263%0.62947%0.467SS*.THydrogen-bonded Turntrans-78.2-11.2175.977.90000113.7M112 Y113 M114M112-S116 PolarHBondContact O-N 3.15Å; Y113-S116 PolarHBondContact O-N 3.21Å; Y113-S116 PolarHBondContact O-OG 2.69Å; M114-S116 PolarHBondContact O-N 3Å
117R85.6Confident85.9Confident133 Ų13392.7 Ų92.750%0.50246%0.455SS..SBendtrans-69.7143.6177.3-63.6-175.171.3-168.13.8111.7M114 A115 W127M114-R117 WeakPolarHBondContact O-CB 3.39Å; M114-R117 WeakPolarHBondContact O-CG 3.03Å; M114-R117 PolarHBondContact O-N 3.38Å; M114-R117 VanDerWaalsContact O-N 3.13Å; A115-R117 VanDerWaalsContact C-N 3.28Å; R117-W127 HydrophobicContact CB-CG 4.16Å
118E79.9Confident85.7Confident172 Ų17292.3 Ų92.380%0.80445%0.452SS*.PPolyproline II helixtrans-60.6157.2177-64.1-177.417900113.1
119A85.5Confident86Confident62 Ų6293.4 Ų93.451%0.51245%0.448SS..PPolyproline II helixtrans-63148.4175.300000111.7
120T86.3Confident86.2Confident61 Ų6190.2 Ų90.237%0.37443%0.434SS..BIsolated β-bridgetrans-124.4162177.365.40000109.4K122 L123 S124T120-K122 PolarHBondContact O-N 3.3Å; T120-L123 PolarHBondContact N-O 3.02Å; T120-L123 VanDerWaalsContact N-O 3.11Å; T120-L123 CarbonylContact O-C 3.02Å; T120-L123 PolarHBondContact O-N 2.77Å; T120-L123 PolarHBondContact OG1-N 3.35Å; T120-S124 PolarHBondContact O-N 3.35Å
121R86.8Confident86.2Confident262 Ų26287.7 Ų87.799%0.98942%0.423SS*.THydrogen-bonded Turntrans-56.5-26177.1-64.7-176.3-176.7-179.30.5113.7
122K88.8Confident86.3Confident199 Ų19987.5 Ų87.587%0.86542%0.422SS*.THydrogen-bonded Turntrans-84.1-26.8175.9-65.9-173.5178.6-176.40113.2T120T120-K122 PolarHBondContact O-N 3.3Å
123L88.3Confident86.8Confident72 Ų7287.2 Ų87.238%0.37742%0.422SS..BIsolated β-bridgetrans-127.885-178.7-62.4175.4000108T120 F125 G126 W127T120-L123 PolarHBondContact N-O 3.02Å; T120-L123 VanDerWaalsContact N-O 3.11Å; T120-L123 CarbonylContact O-C 3.02Å; T120-L123 PolarHBondContact O-N 2.77Å; T120-L123 PolarHBondContact OG1-N 3.35Å; L123-F125 VanDerWaalsContact C-N 3.29Å; L123-F125 PolarHBondContact O-N 3.35Å; L123-G126 WeakPolarHBondContact O-CA 3.26Å; L123-G126 PolarHBondContact O-N 3.06Å; L123-W127 HydrophobicContact CD1-CD2 3.91Å; L123-W127 HydrophobicContact CD1-CE3 4.28Å; L123-W127 HydrophobicContact CD1-CG 4.41Å; L123-W127 HydrophobicContact CD1-CH2 4.24Å; L123-W127 HydrophobicContact CD1-CZ2 3.86Å; L123-W127 HydrophobicContact CD1-CZ3 4.43Å
124S86.8Confident87.1Confident95 Ų9579.6 Ų79.666%0.66439%0.393SS*.THydrogen-bonded Turntrans-61.4-34.6-174.251.10000113.2T120 G126T120-S124 PolarHBondContact O-N 3.35Å; S124-G126 VanDerWaalsContact C-N 3.28Å
125F84.5Confident87.3Confident105 Ų10578.9 Ų78.946%0.46139%0.394SS..THydrogen-bonded Turntrans-87.26.1172.7-65.8-71.7000113.6L123 H128 L308L123-F125 VanDerWaalsContact C-N 3.29Å; L123-F125 PolarHBondContact O-N 3.35Å; F125-H128 PolarHBondContact O-CD2 2.97Å; F125-L308 HydrophobicContact CB-CD2 4.06Å; F125-L308 HydrophobicContact CD1-CD1 4.27Å; F125-L308 HydrophobicContact CD1-CD2 4.01Å; F125-L308 HydrophobicContact CD2-CD2 4.27Å; F125-L308 HydrophobicContact CG-CD2 3.86Å
126G88.2Confident87.7Confident12 Ų1280.2 Ų80.212%0.12440%0.4CS..THydrogen-bonded Turntrans66-152.9-174.500000114.2L123 S124 H128L123-G126 WeakPolarHBondContact O-CA 3.26Å; L123-G126 PolarHBondContact O-N 3.06Å; S124-G126 VanDerWaalsContact C-N 3.28Å; G126-H128 VanDerWaalsContact C-N 3.35Å; G126-H128 PolarHBondContact O-N 2.94Å
127W88.4Confident88.3Confident67 Ų6779.6 Ų79.625%0.25439%0.392SS..THydrogen-bonded Turntrans-95.416.1-168.1-69.683.4000113.6M114 A115 R117 L123 R129 A130M114-W127 HydrophobicContact CE-CE3 3.56Å; M114-W127 HydrophobicContact CE-CH2 4.17Å; M114-W127 HydrophobicContact CE-CZ3 3.28Å; M114-W127 WeakPolarHBondContact O-CB 3.47Å; A115-W127 WeakPolarHBondContact CA-O 3.18Å; R117-W127 HydrophobicContact CB-CG 4.16Å; L123-W127 HydrophobicContact CD1-CD2 3.91Å; L123-W127 HydrophobicContact CD1-CE3 4.28Å; L123-W127 HydrophobicContact CD1-CG 4.41Å; L123-W127 HydrophobicContact CD1-CH2 4.24Å; L123-W127 HydrophobicContact CD1-CZ2 3.86Å; L123-W127 HydrophobicContact CD1-CZ3 4.43Å; W127-R129 PolarHBondContact O-N 3.34Å; W127-R129 VanDerWaalsContact O-N 3.16Å; W127-A130 WeakPolarHBondContact O-CB 3.37Å; W127-A130 PolarHBondContact O-N 3.25Å
128H86.4Confident88.6Confident36 Ų3673.7 Ų73.717%0.16737%0.371CS..THydrogen-bonded Turntrans-58.6-33.4-173.1-63.2-23.7000113.7A115 F125 G126 A130 E131 T309 K312A115-H128 PolarHBondContact O-ND1 3.18Å; F125-H128 PolarHBondContact O-CD2 2.97Å; G126-H128 VanDerWaalsContact C-N 3.35Å; G126-H128 PolarHBondContact O-N 2.94Å; H128-A130 PolarHBondContact O-N 3.5Å; H128-E131 WeakPolarHBondContact O-CB 3.3Å; H128-E131 PolarHBondContact O-N 3.47Å; H128-T309 HydrophobicContact CB-CG2 3.7Å; H128-T309 VanDerWaalsContact O-CG2 3.23Å; H128-T309 WeakPolarHBondContact O-CG2 3.08Å; H128-K312 PolarHBondContact CD2-NZ 3.15Å; H128-K312 VanDerWaalsContact CD2-NZ 3.29Å; H128-K312 PolarHBondContact CE1-NZ 2.87Å; H128-K312 VanDerWaalsContact CG-NZ 3.32Å; H128-K312 PolarHBondContact ND1-NZ 2.94Å; H128-K312 PolarHBondContact NE2-NZ 2.88Å
129R89.9Confident89.2Confident70 Ų7065.8 Ų65.826%0.26433%0.334SS..Hα-helixtrans-66.2-15.9175.7-68.2-169.9177.3-80.610114.1W127 E131 V132 L133 V273 E276W127-R129 PolarHBondContact O-N 3.34Å; W127-R129 VanDerWaalsContact O-N 3.16Å; R129-E131 PolarHBondContact O-N 3.48Å; R129-V132 PolarHBondContact O-N 2.94Å; R129-V132 VanDerWaalsContact O-N 3.17Å; R129-L133 WeakPolarHBondContact O-CG 3.27Å; R129-L133 PolarHBondContact O-N 3.1Å; R129-V273 PolarHBondContact NH1-O 3.49Å; R129-V273 VanDerWaalsContact NH1-O 3.14Å; R129-E276 IonicContact NH2-OE1 2.89Å; R129-E276 PolarHBondContact NH2-OE1 3.01Å
130A89.3Confident89.7Confident11 Ų1167 Ų679%0.09133%0.331CS..Hα-helixtrans-61.4-30.9176.600000112.6S111 M114 W127 H128 G134S111-A130 VanDerWaalsContact CB-O 3.26Å; S111-A130 WeakPolarHBondContact CB-O 3.41Å; S111-A130 PolarHBondContact OG-O 2.83Å; M114-A130 HydrophobicContact CB-CB 3.95Å; W127-A130 WeakPolarHBondContact O-CB 3.37Å; W127-A130 PolarHBondContact O-N 3.25Å; H128-A130 PolarHBondContact O-N 3.5Å; A130-G134 PolarHBondContact O-N 3.16Å
131E86.5Confident90.1Very high71 Ų7166.6 Ų66.633%0.33233%0.327SS..Hα-helixtrans-60.9-49.1173.4-169.7-175.8150.700111.4A115 H128 R129 L133 G134 A135A115-E131 HydrophobicContact CB-CB 4.48Å; H128-E131 WeakPolarHBondContact O-CB 3.3Å; H128-E131 PolarHBondContact O-N 3.47Å; R129-E131 PolarHBondContact O-N 3.48Å; E131-L133 PolarHBondContact O-N 2.82Å; E131-G134 PolarHBondContact O-N 3.22Å; E131-A135 PolarHBondContact O-N 3.15Å
132V91Very high90.4Very high6 Ų654.9 Ų54.94%0.03628%0.284CS..Hα-helixtrans-66.4-39.9-179.4-173.90000111R129 A135 L136 V270 V273 L274R129-V132 PolarHBondContact O-N 2.94Å; R129-V132 VanDerWaalsContact O-N 3.17Å; V132-A135 PolarHBondContact O-N 3.5Å; V132-L136 PolarHBondContact O-N 3.19Å; V132-V270 HydrophobicContact CG1-CG1 3.91Å; V132-V273 HydrophobicContact CB-CG1 4.44Å; V132-V273 HydrophobicContact CG1-CB 4.1Å; V132-V273 HydrophobicContact CG1-CG1 4.02Å; V132-V273 HydrophobicContact CG2-CB 4.43Å; V132-V273 HydrophobicContact CG2-CG1 3.59Å; V132-L274 HydrophobicContact CB-CD2 4.46Å; V132-L274 HydrophobicContact CG1-CD1 4.49Å; V132-L274 HydrophobicContact CG1-CD2 3.8Å; V132-L274 HydrophobicContact CG1-CG 3.8Å
133L92.4Very high90.7Very high89 Ų8949.7 Ų49.747%0.46626%0.259SS..Hα-helixtrans-65.2-39.2175.3-68.6175.7000112.2R129 E131 L136 V137 L274R129-L133 WeakPolarHBondContact O-CG 3.27Å; R129-L133 PolarHBondContact O-N 3.1Å; E131-L133 PolarHBondContact O-N 2.82Å; L133-L136 WeakPolarHBondContact O-CB 3.33Å; L133-L136 PolarHBondContact O-N 2.94Å; L133-V137 WeakPolarHBondContact O-CG2 3.39Å; L133-V137 PolarHBondContact O-N 3.29Å; L133-L274 HydrophobicContact CD2-CD2 4.27Å
134G91.1Very high91.1Very high4 Ų451.3 Ų51.34%0.04127%0.267CS..Hα-helixtrans-61.2-44.6174.400000112.1I107 S111 A130 E131 L136 V137 S138I107-G134 WeakPolarHBondContact CG2-O 3.23Å; S111-G134 VanDerWaalsContact OG-CA 3.26Å; S111-G134 WeakPolarHBondContact OG-CA 3.45Å; A130-G134 PolarHBondContact O-N 3.16Å; E131-G134 PolarHBondContact O-N 3.22Å; G134-L136 PolarHBondContact O-N 3.45Å; G134-V137 PolarHBondContact O-N 2.89Å; G134-S138 WeakPolarHBondContact O-CB 3.09Å; G134-S138 PolarHBondContact O-N 3.49Å; G134-S138 PolarHBondContact O-OG 2.95Å
135A90.2Very high91.5Very high30 Ų3049 Ų4925%0.24825%0.247CC..Hα-helixtrans-61.4-42.7174.400000111.9E131 V132 S138 V139 V270E131-A135 PolarHBondContact O-N 3.15Å; V132-A135 PolarHBondContact O-N 3.5Å; A135-S138 PolarHBondContact O-N 2.93Å; A135-V139 WeakPolarHBondContact O-CG2 3.43Å; A135-V139 PolarHBondContact O-N 3.11Å; A135-V270 HydrophobicContact CB-CG2 3.82Å
136L93.8Very high92Very high37 Ų3744.5 Ų44.519%0.19423%0.228CC..Hα-helixtrans-58-51.8175.6-178.263.3000111.8V132 L133 G134 S138 V139 I140 M267 V270 L274V132-L136 PolarHBondContact O-N 3.19Å; L133-L136 WeakPolarHBondContact O-CB 3.33Å; L133-L136 PolarHBondContact O-N 2.94Å; G134-L136 PolarHBondContact O-N 3.45Å; L136-S138 VanDerWaalsContact C-N 3.28Å; L136-S138 PolarHBondContact O-N 3.49Å; L136-V139 PolarHBondContact O-N 3.22Å; L136-I140 HydrophobicContact CD1-CD1 3.97Å; L136-I140 HydrophobicContact CD1-CG1 4.38Å; L136-I140 HydrophobicContact CD2-CD1 4.47Å; L136-I140 HydrophobicContact CG-CD1 3.83Å; L136-I140 VanDerWaalsContact O-CG1 3.32Å; L136-I140 WeakPolarHBondContact O-CG1 3.28Å; L136-I140 PolarHBondContact O-N 3.09Å; L136-M267 HydrophobicContact CD1-CE 4.21Å; L136-M267 HydrophobicContact CD1-SD 3.64Å; L136-V270 HydrophobicContact CB-CG1 3.67Å; L136-V270 HydrophobicContact CD1-CG1 3.96Å; L136-V270 HydrophobicContact CG-CG1 4.35Å; L136-L274 HydrophobicContact CD2-CD1 3.89Å
137V94.4Very high92.3Very high78 Ų7845.9 Ų45.947%0.47324%0.242SC..Hα-helixtrans-60.4-41.1-179.7172.50000110.7I107 L133 G134 I140 L141I107-V137 HydrophobicContact CD1-CG1 4.14Å; L133-V137 WeakPolarHBondContact O-CG2 3.39Å; L133-V137 PolarHBondContact O-N 3.29Å; G134-V137 PolarHBondContact O-N 2.89Å; V137-I140 PolarHBondContact O-N 3.35Å; V137-L141 WeakPolarHBondContact O-CB 3.29Å; V137-L141 PolarHBondContact O-N 3.46Å
138S92.5Very high92.7Very high8 Ų846.6 Ų46.66%0.05625%0.25CC..Hα-helixtrans-60.3-48.6177.5-57.60000111.6S104 G134 A135 L136 I140 L141 I142S104-S138 WeakPolarHBondContact OG-CB 3.43Å; G134-S138 WeakPolarHBondContact O-CB 3.09Å; G134-S138 PolarHBondContact O-N 3.49Å; G134-S138 PolarHBondContact O-OG 2.95Å; A135-S138 PolarHBondContact O-N 2.93Å; L136-S138 VanDerWaalsContact C-N 3.28Å; L136-S138 PolarHBondContact O-N 3.49Å; S138-I140 PolarHBondContact O-N 3.17Å; S138-L141 WeakPolarHBondContact O-CB 3.34Å; S138-L141 PolarHBondContact O-N 2.85Å; S138-I142 WeakPolarHBondContact O-CG1 3.39Å; S138-I142 PolarHBondContact O-N 3.41Å
139V93.2Very high93.1Very high6 Ų645.2 Ų45.24%0.03624%0.244CC..Hα-helixtrans-64.6-41178.1176.90000111.7A135 L136 L141 I142 W143 I266 M267A135-V139 WeakPolarHBondContact O-CG2 3.43Å; A135-V139 PolarHBondContact O-N 3.11Å; L136-V139 PolarHBondContact O-N 3.22Å; V139-L141 VanDerWaalsContact C-N 3.31Å; V139-L141 PolarHBondContact O-N 2.96Å; V139-I142 PolarHBondContact O-N 2.81Å; V139-W143 HydrophobicContact CG1-CD2 4.49Å; V139-W143 HydrophobicContact CG1-CZ2 4.39Å; V139-W143 PolarHBondContact O-N 3.31Å; V139-I266 HydrophobicContact CG2-CB 4.42Å; V139-I266 HydrophobicContact CG2-CG2 3.94Å; V139-M267 HydrophobicContact CB-CE 4.29Å; V139-M267 HydrophobicContact CG1-CB 4.16Å; V139-M267 HydrophobicContact CG1-CE 3.66Å; V139-M267 HydrophobicContact CG1-SD 4.33Å
140I95.3Very high93.4Very high87 Ų8744.1 Ų44.145%0.44625%0.245SC..Hα-helixtrans-61.8-41.1176.6-70171.7000110.9L136 V137 S138 W143 L144 M267L136-I140 HydrophobicContact CD1-CD1 3.97Å; L136-I140 HydrophobicContact CD1-CG1 4.38Å; L136-I140 HydrophobicContact CD2-CD1 4.47Å; L136-I140 HydrophobicContact CG-CD1 3.83Å; L136-I140 VanDerWaalsContact O-CG1 3.32Å; L136-I140 WeakPolarHBondContact O-CG1 3.28Å; L136-I140 PolarHBondContact O-N 3.09Å; V137-I140 PolarHBondContact O-N 3.35Å; S138-I140 PolarHBondContact O-N 3.17Å; I140-W143 PolarHBondContact O-N 2.96Å; I140-L144 WeakPolarHBondContact O-CB 3.4Å; I140-L144 PolarHBondContact O-N 2.78Å; I140-M267 HydrophobicContact CG1-CE 4.08Å
141L94Very high93.8Very high53 Ų5351 Ų5128%0.27727%0.269SS..Hα-helixtrans-61.7-44.5176.9-176.268000111.2T100 A103 V137 S138 V139 W143 L144 I145T100-L141 HydrophobicContact CG2-CB 4.25Å; T100-L141 HydrophobicContact CG2-CD2 3.68Å; T100-L141 HydrophobicContact CG2-CG 3.57Å; A103-L141 HydrophobicContact CB-CD2 3.87Å; V137-L141 WeakPolarHBondContact O-CB 3.29Å; V137-L141 PolarHBondContact O-N 3.46Å; S138-L141 WeakPolarHBondContact O-CB 3.34Å; S138-L141 PolarHBondContact O-N 2.85Å; V139-L141 VanDerWaalsContact C-N 3.31Å; V139-L141 PolarHBondContact O-N 2.96Å; L141-W143 VanDerWaalsContact C-N 3.34Å; L141-W143 PolarHBondContact O-N 3.41Å; L141-L144 PolarHBondContact O-N 3.49Å; L141-I145 WeakPolarHBondContact O-CG1 3.43Å; L141-I145 PolarHBondContact O-N 2.89Å
142I93.2Very high94.1Very high17 Ų1750.9 Ų50.99%0.08727%0.27CS..Hα-helixtrans-59.1-45.6175.4-65.4165.8000110.8T100 S138 V139 L144 I145 T146 V259 T263T100-I142 HydrophobicContact CG2-CB 4.47Å; T100-I142 HydrophobicContact CG2-CG1 3.77Å; S138-I142 WeakPolarHBondContact O-CG1 3.39Å; S138-I142 PolarHBondContact O-N 3.41Å; V139-I142 PolarHBondContact O-N 2.81Å; I142-L144 VanDerWaalsContact C-N 3.35Å; I142-L144 PolarHBondContact O-N 3.3Å; I142-I145 PolarHBondContact O-N 3.42Å; I142-T146 VanDerWaalsContact O-CB 3.25Å; I142-T146 WeakPolarHBondContact O-CB 3.35Å; I142-T146 PolarHBondContact O-N 3.07Å; I142-T146 PolarHBondContact O-OG1 2.99Å; I142-V259 HydrophobicContact CG2-CG1 3.45Å; I142-V259 VanDerWaalsContact CG2-CG1 3.45Å; I142-T263 HydrophobicContact CD1-CG2 4.27Å; I142-T263 HydrophobicContact CG2-CG2 4.2Å
143W95.1Very high94.3Very high90 Ų9050.6 Ų50.634%0.34127%0.268SS..Hα-helixtrans-64.9-38.7178.6-73.612.7000112.7V139 I140 L141 G147 L260 T263 V264 M267V139-W143 HydrophobicContact CG1-CD2 4.49Å; V139-W143 HydrophobicContact CG1-CZ2 4.39Å; V139-W143 PolarHBondContact O-N 3.31Å; I140-W143 PolarHBondContact O-N 2.96Å; L141-W143 VanDerWaalsContact C-N 3.34Å; L141-W143 PolarHBondContact O-N 3.41Å; W143-G147 PolarHBondContact O-N 3.27Å; W143-L260 HydrophobicContact CD2-CD1 4.17Å; W143-L260 HydrophobicContact CG-CD1 4.34Å; W143-L260 HydrophobicContact CZ2-CD1 4.1Å; W143-T263 PolarHBondContact NE1-OG1 3.2Å; W143-V264 HydrophobicContact CH2-CG2 4.27Å; W143-V264 HydrophobicContact CZ2-CG2 3.62Å; W143-M267 HydrophobicContact CD2-CE 4.42Å; W143-M267 HydrophobicContact CE3-CE 4.13Å; W143-M267 HydrophobicContact CH2-CB 4.32Å; W143-M267 HydrophobicContact CH2-CE 3.86Å; W143-M267 HydrophobicContact CH2-CG 3.94Å; W143-M267 HydrophobicContact CZ2-CB 4.08Å; W143-M267 HydrophobicContact CZ2-CE 4.14Å; W143-M267 HydrophobicContact CZ2-CG 4.19Å; W143-M267 HydrophobicContact CZ3-CE 3.85Å
144L96.1Very high94.5Very high105 Ų10548 Ų4855%0.5526%0.26SS..Hα-helixtrans-62.3-51.4176.4179.465.5000111.1I140 L141 I142 G147 I148I140-L144 WeakPolarHBondContact O-CB 3.4Å; I140-L144 PolarHBondContact O-N 2.78Å; L141-L144 PolarHBondContact O-N 3.49Å; I142-L144 VanDerWaalsContact C-N 3.35Å; I142-L144 PolarHBondContact O-N 3.3Å; L144-G147 PolarHBondContact O-N 3.32Å; L144-I148 HydrophobicContact CD1-CD1 4.45Å; L144-I148 HydrophobicContact CG-CD1 4.25Å; L144-I148 WeakPolarHBondContact O-CG1 3.36Å; L144-I148 PolarHBondContact O-N 2.99Å
145I95.4Very high94.6Very high47 Ų4751.4 Ų51.424%0.24128%0.275CS..Hα-helixtrans-62-45178.3-66.6-60.6000110.8A96 T100 L141 I142 G147 I148 L149A96-I145 HydrophobicContact CB-CG2 4Å; T100-I145 HydrophobicContact CG2-CG1 4.2Å; L141-I145 WeakPolarHBondContact O-CG1 3.43Å; L141-I145 PolarHBondContact O-N 2.89Å; I142-I145 PolarHBondContact O-N 3.42Å; I145-G147 VanDerWaalsContact C-N 3.32Å; I145-G147 PolarHBondContact O-N 2.98Å; I145-I148 WeakPolarHBondContact O-CB 3.29Å; I145-I148 PolarHBondContact O-N 3.39Å; I145-I148 VanDerWaalsContact O-N 3.16Å; I145-L149 HydrophobicContact CG2-CD1 3.91Å; I145-L149 HydrophobicContact CG2-CG 4.4Å; I145-L149 WeakPolarHBondContact O-CG 3.48Å; I145-L149 PolarHBondContact O-N 2.92Å
146T94.9Very high94.7Very high11 Ų1151.2 Ų51.27%0.06727%0.268CS..Hα-helixtrans-58.8-44.3176.7-55.60000111.1I142 I148 L149 V150I142-T146 VanDerWaalsContact O-CB 3.25Å; I142-T146 WeakPolarHBondContact O-CB 3.35Å; I142-T146 PolarHBondContact O-N 3.07Å; I142-T146 PolarHBondContact O-OG1 2.99Å; T146-I148 VanDerWaalsContact C-N 3.33Å; T146-I148 PolarHBondContact O-N 3.25Å; T146-L149 PolarHBondContact O-N 3.08Å; T146-V150 HydrophobicContact CG2-CG2 4.39Å; T146-V150 WeakPolarHBondContact O-CB 3.44Å; T146-V150 VanDerWaalsContact O-CG2 3.26Å; T146-V150 WeakPolarHBondContact O-CG2 3.41Å; T146-V150 PolarHBondContact O-N 2.82Å
147G96.2Very high94.6Very high40 Ų4052.3 Ų52.341%0.41227%0.273SS..Hα-helixtrans-61.3-39.3176.700000113.2W143 L144 I145 Y151W143-G147 PolarHBondContact O-N 3.27Å; L144-G147 PolarHBondContact O-N 3.32Å; I145-G147 VanDerWaalsContact C-N 3.32Å; I145-G147 PolarHBondContact O-N 2.98Å; G147-Y151 WeakPolarHBondContact O-CB 3.16Å; G147-Y151 PolarHBondContact O-N 3.02Å
148I96.3Very high94.6Very high82 Ų8254.3 Ų54.342%0.42128%0.28SS..Hα-helixtrans-64.2-45.7174.9-67.3164.7000110.6L144 I145 T146 Y151 I152L144-I148 HydrophobicContact CD1-CD1 4.45Å; L144-I148 HydrophobicContact CG-CD1 4.25Å; L144-I148 WeakPolarHBondContact O-CG1 3.36Å; L144-I148 PolarHBondContact O-N 2.99Å; I145-I148 WeakPolarHBondContact O-CB 3.29Å; I145-I148 PolarHBondContact O-N 3.39Å; I145-I148 VanDerWaalsContact O-N 3.16Å; T146-I148 VanDerWaalsContact C-N 3.33Å; T146-I148 PolarHBondContact O-N 3.25Å; I148-Y151 WeakPolarHBondContact O-CB 3.3Å; I148-Y151 PolarHBondContact O-N 3.5Å; I148-I152 HydrophobicContact CG2-CD1 3.86Å; I148-I152 WeakPolarHBondContact O-CG1 3.3Å; I148-I152 PolarHBondContact O-N 2.98Å
149L94.5Very high94.5Very high8 Ų861.8 Ų61.84%0.04231%0.308CS..Hα-helixtrans-65-40.6179.7-66.9169.1000112.2L89 T93 A96 I145 T146 Y151 I152 A153 T252L89-L149 HydrophobicContact CD1-CD2 4.29Å; T93-L149 HydrophobicContact CG2-CD1 4.01Å; A96-L149 HydrophobicContact CB-CD1 4.04Å; I145-L149 HydrophobicContact CG2-CD1 3.91Å; I145-L149 HydrophobicContact CG2-CG 4.4Å; I145-L149 WeakPolarHBondContact O-CG 3.48Å; I145-L149 PolarHBondContact O-N 2.92Å; T146-L149 PolarHBondContact O-N 3.08Å; L149-Y151 VanDerWaalsContact C-N 3.34Å; L149-Y151 PolarHBondContact O-N 3.25Å; L149-I152 PolarHBondContact O-N 3.34Å; L149-A153 WeakPolarHBondContact O-CB 3.24Å; L149-A153 PolarHBondContact O-N 3.11Å; L149-T252 HydrophobicContact CB-CG2 4.24Å
150V96.1Very high94.2Very high46 Ų4666.9 Ų66.928%0.27934%0.335SS..Hα-helixtrans-61-42.5173.5167.80000111.3T146 A153 A154 F253 S256T146-V150 HydrophobicContact CG2-CG2 4.39Å; T146-V150 WeakPolarHBondContact O-CB 3.44Å; T146-V150 VanDerWaalsContact O-CG2 3.26Å; T146-V150 WeakPolarHBondContact O-CG2 3.41Å; T146-V150 PolarHBondContact O-N 2.82Å; V150-A153 PolarHBondContact O-N 3.48Å; V150-A154 WeakPolarHBondContact O-CB 3.43Å; V150-A154 PolarHBondContact O-N 2.96Å; V150-F253 HydrophobicContact CG1-CD1 4.19Å; V150-F253 HydrophobicContact CG1-CE1 3.75Å; V150-S256 VanDerWaalsContact CG2-CB 3.43Å; V150-S256 VanDerWaalsContact CG2-OG 3.3Å; V150-S256 WeakPolarHBondContact CG2-OG 3.34Å
151Y96.8Very high93.6Very high156 Ų15667.5 Ų67.561%0.61234%0.339SS*.Hα-helixtrans-61.7-48175.8175-90.5000111.4G147 I148 L149 A153 A154 E155G147-Y151 WeakPolarHBondContact O-CB 3.16Å; G147-Y151 PolarHBondContact O-N 3.02Å; I148-Y151 WeakPolarHBondContact O-CB 3.3Å; I148-Y151 PolarHBondContact O-N 3.5Å; L149-Y151 VanDerWaalsContact C-N 3.34Å; L149-Y151 PolarHBondContact O-N 3.25Å; Y151-A153 VanDerWaalsContact C-N 3.31Å; Y151-A153 PolarHBondContact O-N 2.92Å; Y151-A154 PolarHBondContact O-N 2.92Å; Y151-E155 PolarHBondContact O-N 3.45Å
152I94.6Very high93Very high68 Ų6866.6 Ų66.635%0.34933%0.333SS..Hα-helixtrans-62.5-39.6177.6-63.9166.6000110.8L89 I148 L149 A154 E155 R156L89-I152 HydrophobicContact CD1-CB 4.27Å; L89-I152 HydrophobicContact CD1-CG2 3.64Å; L89-I152 HydrophobicContact CD2-CB 4.36Å; L89-I152 HydrophobicContact CD2-CG2 3.93Å; L89-I152 HydrophobicContact CG-CG2 4.44Å; I148-I152 HydrophobicContact CG2-CD1 3.86Å; I148-I152 WeakPolarHBondContact O-CG1 3.3Å; I148-I152 PolarHBondContact O-N 2.98Å; L149-I152 PolarHBondContact O-N 3.34Å; I152-A154 PolarHBondContact O-N 3.25Å; I152-E155 PolarHBondContact O-N 3.06Å; I152-R156 WeakPolarHBondContact O-CB 3.36Å; I152-R156 PolarHBondContact O-N 3.26Å
153A94.5Very high92.5Very high0 Ų072 Ų720%036%0.362CS..Hα-helixtrans-63.4-41.4176.600000112L89 L149 V150 Y151 R156 I157 P249 T252 F253L89-A153 VanDerWaalsContact CD2-CA 3.41Å; L89-A153 HydrophobicContact CD2-CB 3.59Å; L149-A153 WeakPolarHBondContact O-CB 3.24Å; L149-A153 PolarHBondContact O-N 3.11Å; V150-A153 PolarHBondContact O-N 3.48Å; Y151-A153 VanDerWaalsContact C-N 3.31Å; Y151-A153 PolarHBondContact O-N 2.92Å; A153-R156 PolarHBondContact O-N 3.33Å; A153-I157 WeakPolarHBondContact O-CG1 2.85Å; A153-I157 PolarHBondContact O-N 3.07Å; A153-P249 HydrophobicContact CB-CB 4.23Å; A153-T252 HydrophobicContact CB-CG2 3.93Å; A153-F253 HydrophobicContact CB-CD2 4.25Å; A153-F253 HydrophobicContact CB-CE1 4.49Å; A153-F253 HydrophobicContact CB-CE2 3.75Å; A153-F253 HydrophobicContact CB-CZ 3.91Å
154A95.4Very high92.2Very high35 Ų3568.1 Ų68.129%0.28935%0.348SS..Hα-helixtrans-64.5-44.2175.700000111.5V150 Y151 I152 R156 I157 I158 F253V150-A154 WeakPolarHBondContact O-CB 3.43Å; V150-A154 PolarHBondContact O-N 2.96Å; Y151-A154 PolarHBondContact O-N 2.92Å; I152-A154 PolarHBondContact O-N 3.25Å; A154-R156 VanDerWaalsContact C-N 3.32Å; A154-R156 PolarHBondContact O-N 2.96Å; A154-I157 PolarHBondContact O-N 3.42Å; A154-I158 WeakPolarHBondContact O-CG1 3.37Å; A154-I158 PolarHBondContact O-N 2.88Å; A154-F253 HydrophobicContact CB-CZ 4.02Å
155E94.6Very high92Very high76 Ų7666.2 Ų66.236%0.35534%0.339SS..Hα-helixtrans-58.7-44.4176.4-174.1167.1-164.900111.6Y151 I152 I157 I158 Y159Y151-E155 PolarHBondContact O-N 3.45Å; I152-E155 PolarHBondContact O-N 3.06Å; E155-I157 VanDerWaalsContact C-N 3.31Å; E155-I157 PolarHBondContact O-N 3.25Å; E155-I158 PolarHBondContact O-N 3.19Å; E155-I158 VanDerWaalsContact O-N 3.15Å; E155-Y159 HydrophobicContact CG-CD2 3.44Å; E155-Y159 VanDerWaalsContact CG-CD2 3.44Å; E155-Y159 HydrophobicContact CG-CE2 3.5Å; E155-Y159 WeakPolarHBondContact O-CD2 3.32Å; E155-Y159 PolarHBondContact O-N 2.88Å; E155-Y159 WeakPolarHBondContact OE1-CE2 3.39Å
156R90.9Very high91.7Very high26 Ų2664.9 Ų64.910%0.09834%0.335CS..Hα-helixtrans-58.8-39.5177.2-165.3167.3-164.9-175.415.7112.9G87 I152 A153 A154 N160 D161 F162 D163 I164 D248 P249G87-R156 PolarHBondContact O-NH1 3.46Å; G87-R156 PolarHBondContact O-NH2 2.87Å; I152-R156 WeakPolarHBondContact O-CB 3.36Å; I152-R156 PolarHBondContact O-N 3.26Å; A153-R156 PolarHBondContact O-N 3.33Å; A154-R156 VanDerWaalsContact C-N 3.32Å; A154-R156 PolarHBondContact O-N 2.96Å; R156-N160 PolarHBondContact O-N 2.6Å; R156-D161 WeakPolarHBondContact CG-O 3.41Å; R156-D161 PolarHBondContact NE-O 3.33Å; R156-D161 PolarHBondContact NH2-O 3.32Å; R156-D161 PolarHBondContact O-N 3.03Å; R156-F162 HydrophobicContact CG-CD1 4.28Å; R156-F162 HydrophobicContact CG-CE1 4.13Å; R156-D163 PolarHBondContact NH2-O 3.02Å; R156-I164 VanDerWaalsContact NH2-CG1 3.35Å; R156-D248 IonicContact CZ-OD2 3.72Å; R156-D248 IonicContact NH1-OD2 3.73Å; R156-D248 PolarHBondContact NH1-OD2 3.37Å; R156-P249 HydrophobicContact CB-CG 4.11Å; R156-P249 HydrophobicContact CG-CG 3.98Å
157I92.6Very high91.5Very high59 Ų5973.6 Ų73.630%0.30337%0.366SS..Hα-helixtrans-68.4-43.7175.3-67.3178.7000111.4A153 A154 E155 N160 P249 F253A153-I157 WeakPolarHBondContact O-CG1 2.85Å; A153-I157 PolarHBondContact O-N 3.07Å; A154-I157 PolarHBondContact O-N 3.42Å; E155-I157 VanDerWaalsContact C-N 3.31Å; E155-I157 PolarHBondContact O-N 3.25Å; I157-N160 PolarHBondContact O-N 2.94Å; I157-P249 HydrophobicContact CD1-CB 3.93Å; I157-P249 HydrophobicContact CG1-CB 3.72Å; I157-P249 HydrophobicContact CG1-CG 4.05Å; I157-F253 HydrophobicContact CD1-CD2 4.4Å; I157-F253 HydrophobicContact CD1-CE2 3.66Å
158I93.8Very high91.4Very high120 Ų12074.2 Ų74.262%0.61536%0.359SS*.Hα-helixtrans-66-43.8-176.2-68.6165.6000111.1A154 E155A154-I158 WeakPolarHBondContact O-CG1 3.37Å; A154-I158 PolarHBondContact O-N 2.88Å; E155-I158 PolarHBondContact O-N 3.19Å; E155-I158 VanDerWaalsContact O-N 3.15Å
159Y92.1Very high91.3Very high166 Ų16670.3 Ų70.365%0.65134%0.339SS*.Hα-helixtrans-88-0.6-178-65-61.9000114.4E155 D161E155-Y159 HydrophobicContact CG-CD2 3.44Å; E155-Y159 VanDerWaalsContact CG-CD2 3.44Å; E155-Y159 HydrophobicContact CG-CE2 3.5Å; E155-Y159 WeakPolarHBondContact O-CD2 3.32Å; E155-Y159 PolarHBondContact O-N 2.88Å; E155-Y159 WeakPolarHBondContact OE1-CE2 3.39Å; Y159-D161 PolarHBondContact O-N 2.96Å
160N85.5Confident91.2Very high113 Ų11372.6 Ų72.660%0.60435%0.351SS*.THydrogen-bonded Turntrans51.336.7-176.9-65.6-80000113.6R156 I157 F162R156-N160 PolarHBondContact O-N 2.6Å; I157-N160 PolarHBondContact O-N 2.94Å; N160-F162 VanDerWaalsContact CA-CE2 3.48Å; N160-F162 HydrophobicContact CB-CD2 4.25Å; N160-F162 HydrophobicContact CB-CE2 3.88Å; N160-F162 WeakPolarHBondContact O-CD2 3.12Å; N160-F162 PolarHBondContact O-N 3Å
161D83Confident91.2Very high100 Ų10075.4 Ų75.454%0.53536%0.364SS..  trans-84.891.9179.8179.725.7000110.3R156 Y159R156-D161 WeakPolarHBondContact CG-O 3.41Å; R156-D161 PolarHBondContact NE-O 3.33Å; R156-D161 PolarHBondContact NH2-O 3.32Å; R156-D161 PolarHBondContact O-N 3.03Å; Y159-D161 PolarHBondContact O-N 2.96Å
162F82.1Confident91.1Very high34 Ų3469 Ų6915%0.14934%0.34CS..  trans-122.851.6-173.2-57.3-56.8000112.2R156 N160 I164 Q245 I246 P249R156-F162 HydrophobicContact CG-CD1 4.28Å; R156-F162 HydrophobicContact CG-CE1 4.13Å; N160-F162 VanDerWaalsContact CA-CE2 3.48Å; N160-F162 HydrophobicContact CB-CD2 4.25Å; N160-F162 HydrophobicContact CB-CE2 3.88Å; N160-F162 WeakPolarHBondContact O-CD2 3.12Å; N160-F162 PolarHBondContact O-N 3Å; F162-I164 PolarHBondContact O-N 3.35Å; F162-Q245 HydrophobicContact CB-CB 3.67Å; F162-Q245 HydrophobicContact CG-CB 4.24Å; F162-Q245 PolarHBondContact O-NE2 3.44Å; F162-Q245 PolarHBondContact O-OE1 3.33Å; F162-I246 HydrophobicContact CE1-CB 4.48Å; F162-I246 HydrophobicContact CE1-CG1 4.4Å; F162-I246 HydrophobicContact CZ-CB 4.28Å; F162-I246 HydrophobicContact CZ-CD1 4.48Å; F162-I246 HydrophobicContact CZ-CG1 4.03Å; F162-P249 HydrophobicContact CE1-CG 4.02Å
163D82.9Confident91.1Very high129 Ų12966 Ų6669%0.6933%0.325SS*.  trans-87.9105.1166.3-159.26.7000109.9R156R156-D163 PolarHBondContact NH2-O 3.02Å
164I88.2Confident91.1Very high9 Ų967.6 Ų67.65%0.04634%0.338CS..  trans-131120.7-178.6-53.5176000109.2A86 R156 F162 A166 M169 I240 Q245 D248A86-I164 CarbonylContact O-C 3.56Å; A86-I164 VanDerWaalsContact O-CA 3.32Å; A86-I164 WeakPolarHBondContact O-CA 3.17Å; R156-I164 VanDerWaalsContact NH2-CG1 3.35Å; F162-I164 PolarHBondContact O-N 3.35Å; I164-A166 PolarHBondContact O-N 3.42Å; I164-M169 HydrophobicContact CG2-SD 4.07Å; I164-I240 HydrophobicContact CD1-CD1 4.39Å; I164-I240 HydrophobicContact CG2-CG2 4.49Å; I164-Q245 HydrophobicContact CD1-CB 4.21Å; I164-D248 HydrophobicContact CD1-CB 3.45Å; I164-D248 VanDerWaalsContact CD1-CB 3.45Å
165D90.9Very high91Very high66 Ų6669 Ų6935%0.35334%0.343SS..  trans-75.994.2168.1-169.3-35000109.6A86 R167 I168 M169A86-D165 PolarHBondContact O-N 3.4Å; D165-R167 PolarHBondContact O-N 2.98Å; D165-R167 VanDerWaalsContact O-N 3.15Å; D165-R167 WeakPolarHBondContact OD1-CA 3.4Å; D165-R167 VanDerWaalsContact OD1-CB 3.3Å; D165-R167 WeakPolarHBondContact OD1-CB 3.27Å; D165-R167 PolarHBondContact OD1-N 3.38Å; D165-I168 HydrophobicContact CB-CB 4.29Å; D165-I168 HydrophobicContact CB-CD1 4.11Å; D165-I168 HydrophobicContact CB-CG1 4.22Å; D165-I168 PolarHBondContact O-N 3.43Å; D165-I168 PolarHBondContact OD1-N 3.1Å; D165-I168 VanDerWaalsContact OD1-N 3.14Å; D165-I168 WeakPolarHBondContact OD2-CD1 3.33Å; D165-M169 WeakPolarHBondContact O-CB 3.39Å; D165-M169 PolarHBondContact O-N 3.31Å
166A88.7Confident91Very high19 Ų1965.3 Ų65.316%0.15733%0.326CS..Hα-helixtrans-58.3-25.7179.300000113.2I164 L170 I240I164-A166 PolarHBondContact O-N 3.42Å; A166-L170 WeakPolarHBondContact O-CB 3.45Å; A166-L170 PolarHBondContact O-N 2.97Å; A166-I240 HydrophobicContact CB-CG2 4.1Å
167R92.5Very high91.1Very high193 Ų19365.4 Ų65.473%0.72833%0.329SS*.Hα-helixtrans-75.6-47.6-179.2-59.3-179.5178.6-162.80.3110.6D165 M169 L170 I171D165-R167 PolarHBondContact O-N 2.98Å; D165-R167 VanDerWaalsContact O-N 3.15Å; D165-R167 WeakPolarHBondContact OD1-CA 3.4Å; D165-R167 VanDerWaalsContact OD1-CB 3.3Å; D165-R167 WeakPolarHBondContact OD1-CB 3.27Å; D165-R167 PolarHBondContact OD1-N 3.38Å; R167-M169 VanDerWaalsContact C-N 3.3Å; R167-L170 PolarHBondContact O-N 3.35Å; R167-I171 VanDerWaalsContact O-CG1 3.28Å; R167-I171 WeakPolarHBondContact O-CG1 3.48Å; R167-I171 PolarHBondContact O-N 2.9Å
168I93.5Very high91.2Very high53 Ų5367.6 Ų67.627%0.27234%0.341SS..Hα-helixtrans-62.2-44.2176-61176.6000109.2L85 A86 D165 L170 I171 L172L85-I168 HydrophobicContact CB-CD1 4.3Å; A86-I168 HydrophobicContact CB-CB 3.97Å; A86-I168 HydrophobicContact CB-CG2 3.8Å; D165-I168 HydrophobicContact CB-CB 4.29Å; D165-I168 HydrophobicContact CB-CD1 4.11Å; D165-I168 HydrophobicContact CB-CG1 4.22Å; D165-I168 PolarHBondContact O-N 3.43Å; D165-I168 PolarHBondContact OD1-N 3.1Å; D165-I168 VanDerWaalsContact OD1-N 3.14Å; D165-I168 WeakPolarHBondContact OD2-CD1 3.33Å; I168-L170 PolarHBondContact O-N 3.03Å; I168-I171 PolarHBondContact O-N 3.4Å; I168-L172 HydrophobicContact CG2-CD1 3.66Å; I168-L172 HydrophobicContact CG2-CG 4.35Å; I168-L172 WeakPolarHBondContact O-CG 3.49Å; I168-L172 PolarHBondContact O-N 3.35Å
169M93.4Very high91.2Very high0 Ų063 Ų630%032%0.318CS..Hα-helixtrans-58.1-48177.5-176-175.7-177.500112.6A90 I91 I164 D165 R167 I171 L172 A173 V233 A236 A237 I240A90-M169 HydrophobicContact CB-CE 4.24Å; I91-M169 HydrophobicContact CD1-CB 3.96Å; I91-M169 HydrophobicContact CD1-CG 3.8Å; I91-M169 HydrophobicContact CG1-CG 4.25Å; I164-M169 HydrophobicContact CG2-SD 4.07Å; D165-M169 WeakPolarHBondContact O-CB 3.39Å; D165-M169 PolarHBondContact O-N 3.31Å; R167-M169 VanDerWaalsContact C-N 3.3Å; M169-I171 PolarHBondContact O-N 2.86Å; M169-L172 PolarHBondContact O-N 3.39Å; M169-A173 VanDerWaalsContact O-CB 3.27Å; M169-A173 WeakPolarHBondContact O-CB 3.45Å; M169-A173 PolarHBondContact O-N 3.34Å; M169-V233 HydrophobicContact CE-CG1 4.17Å; M169-A236 HydrophobicContact CE-CB 4.03Å; M169-A237 HydrophobicContact CB-CB 4.49Å; M169-A237 HydrophobicContact CE-CB 4.09Å; M169-A237 HydrophobicContact CG-CB 3.77Å; M169-A237 HydrophobicContact SD-CB 4.01Å; M169-I240 HydrophobicContact CE-CD1 3.7Å; M169-I240 HydrophobicContact SD-CD1 3.52Å; M169-I240 VanDerWaalsContact SD-CD1 3.52Å
170L94Very high91.1Very high56 Ų5655.1 Ų55.129%0.29329%0.287SS..Hα-helixtrans-64-41.9180-174.7153.5000112.2A166 R167 I168 A174 A237 L238A166-L170 WeakPolarHBondContact O-CB 3.45Å; A166-L170 PolarHBondContact O-N 2.97Å; R167-L170 PolarHBondContact O-N 3.35Å; I168-L170 PolarHBondContact O-N 3.03Å; L170-A174 VanDerWaalsContact O-CB 3.32Å; L170-A174 WeakPolarHBondContact O-CB 3.33Å; L170-A174 PolarHBondContact O-N 2.72Å; L170-A237 HydrophobicContact CB-CB 4.16Å; L170-L238 HydrophobicContact CD1-CD2 3.84Å
171I95.1Very high91.4Very high105 Ų10555.7 Ų55.754%0.53828%0.284SS..Hα-helixtrans-62.5-49.4178.3-69.1166.6000110.4R167 I168 M169 A174 V175R167-I171 VanDerWaalsContact O-CG1 3.28Å; R167-I171 WeakPolarHBondContact O-CG1 3.48Å; R167-I171 PolarHBondContact O-N 2.9Å; I168-I171 PolarHBondContact O-N 3.4Å; M169-I171 PolarHBondContact O-N 2.86Å; I171-A174 PolarHBondContact O-N 3.49Å; I171-V175 VanDerWaalsContact O-CG2 3.31Å; I171-V175 WeakPolarHBondContact O-CG2 3.46Å; I171-V175 PolarHBondContact O-N 3.49Å
172L94.8Very high91.8Very high23 Ų2353.9 Ų53.912%0.1228%0.277CS..Hα-helixtrans-64.4-43.5-178.9-70.7166.6000111.8G82 I91 I168 M169 A174 V175 G176G82-L172 VanDerWaalsContact C-CD1 3.43Å; I91-L172 HydrophobicContact CD1-CB 4.18Å; I91-L172 HydrophobicContact CD1-CD1 3.8Å; I91-L172 HydrophobicContact CG2-CD1 4.39Å; I168-L172 HydrophobicContact CG2-CD1 3.66Å; I168-L172 HydrophobicContact CG2-CG 4.35Å; I168-L172 WeakPolarHBondContact O-CG 3.49Å; I168-L172 PolarHBondContact O-N 3.35Å; M169-L172 PolarHBondContact O-N 3.39Å; L172-A174 VanDerWaalsContact C-N 3.34Å; L172-A174 PolarHBondContact O-N 3.33Å; L172-V175 PolarHBondContact O-N 3.41Å; L172-G176 PolarHBondContact O-N 2.78Å
173A93.6Very high92.1Very high3 Ų352.7 Ų52.73%0.02527%0.272CS..Hα-helixtrans-62.8-41177.700000112.1M169 G176 V177 V233 L234 A237M169-A173 VanDerWaalsContact O-CB 3.27Å; M169-A173 WeakPolarHBondContact O-CB 3.45Å; M169-A173 PolarHBondContact O-N 3.34Å; A173-G176 PolarHBondContact O-N 2.89Å; A173-V177 WeakPolarHBondContact O-CG2 3.33Å; A173-V177 PolarHBondContact O-N 3.46Å; A173-V233 HydrophobicContact CB-CB 4.41Å; A173-V233 HydrophobicContact CB-CG1 3.89Å; A173-L234 HydrophobicContact CB-CB 3.97Å; A173-L234 HydrophobicContact CB-CD1 4.08Å; A173-A237 HydrophobicContact CB-CB 4.48Å
174A94.9Very high92.3Very high34 Ų3447.2 Ų47.228%0.28125%0.246SC..Hα-helixtrans-64.1-42.7175.500000111.6L170 I171 L172 G176 I178 L234L170-A174 VanDerWaalsContact O-CB 3.32Å; L170-A174 WeakPolarHBondContact O-CB 3.33Å; L170-A174 PolarHBondContact O-N 2.72Å; I171-A174 PolarHBondContact O-N 3.49Å; L172-A174 VanDerWaalsContact C-N 3.34Å; L172-A174 PolarHBondContact O-N 3.33Å; A174-G176 VanDerWaalsContact C-N 3.34Å; A174-I178 WeakPolarHBondContact O-CD1 3.3Å; A174-I178 VanDerWaalsContact O-CG1 3.28Å; A174-I178 WeakPolarHBondContact O-CG1 3.26Å; A174-I178 PolarHBondContact O-N 2.93Å; A174-L234 HydrophobicContact CB-CD1 4.26Å
175V94.8Very high92.2Very high64 Ų6449.4 Ų49.439%0.38826%0.26SS..Hα-helixtrans-62.8-41.5174.5173.60000110.8F75 I171 L172 I178 V179F75-V175 HydrophobicContact CD2-CG1 4.09Å; F75-V175 HydrophobicContact CE2-CB 4.33Å; F75-V175 HydrophobicContact CE2-CG1 3.81Å; I171-V175 VanDerWaalsContact O-CG2 3.31Å; I171-V175 WeakPolarHBondContact O-CG2 3.46Å; I171-V175 PolarHBondContact O-N 3.49Å; L172-V175 PolarHBondContact O-N 3.41Å; V175-I178 WeakPolarHBondContact O-CB 3.42Å; V175-I178 PolarHBondContact O-N 3.44Å; V175-V179 HydrophobicContact CG1-CG2 4.04Å; V175-V179 WeakPolarHBondContact O-CB 3.38Å; V175-V179 VanDerWaalsContact O-CG2 3.3Å; V175-V179 WeakPolarHBondContact O-CG2 3.46Å; V175-V179 PolarHBondContact O-N 3.38Å
176G93.4Very high91.9Very high0 Ų047.5 Ų47.50%025%0.25CS..Hα-helixtrans-62.3-44.3178.700000113.7L172 A173 A174 I178 V179 N180L172-G176 PolarHBondContact O-N 2.78Å; A173-G176 PolarHBondContact O-N 2.89Å; A174-G176 VanDerWaalsContact C-N 3.34Å; G176-I178 VanDerWaalsContact C-N 3.29Å; G176-I178 PolarHBondContact O-N 2.98Å; G176-V179 PolarHBondContact O-N 3.44Å; G176-N180 WeakPolarHBondContact O-CB 3.26Å; G176-N180 PolarHBondContact O-N 2.92Å
177V94.1Very high91.6Very high27 Ų2747.1 Ų47.116%0.16425%0.246CC..Hα-helixtrans-58.5-43.5173.41730000111.1A173 F181 F227 S230 V231 L234A173-V177 WeakPolarHBondContact O-CG2 3.33Å; A173-V177 PolarHBondContact O-N 3.46Å; V177-F181 WeakPolarHBondContact O-CB 3.27Å; V177-F181 PolarHBondContact O-N 3.39Å; V177-F227 HydrophobicContact CG1-CE2 3.99Å; V177-S230 WeakPolarHBondContact CG2-O 3.45Å; V177-V231 HydrophobicContact CG1-CG2 4.24Å; V177-V231 HydrophobicContact CG2-CG2 4.02Å; V177-L234 HydrophobicContact CG2-CB 4.14Å; V177-L234 HydrophobicContact CG2-CD2 4.03Å
178I94.3Very high91Very high106 Ų10641.8 Ų41.854%0.54423%0.229SC..Hα-helixtrans-65-45.8177.8-66.5165.3000110.7A174 V175 G176 F181 V182A174-I178 WeakPolarHBondContact O-CD1 3.3Å; A174-I178 VanDerWaalsContact O-CG1 3.28Å; A174-I178 WeakPolarHBondContact O-CG1 3.26Å; A174-I178 PolarHBondContact O-N 2.93Å; V175-I178 WeakPolarHBondContact O-CB 3.42Å; V175-I178 PolarHBondContact O-N 3.44Å; G176-I178 VanDerWaalsContact C-N 3.29Å; G176-I178 PolarHBondContact O-N 2.98Å; I178-F181 PolarHBondContact O-N 3.07Å; I178-V182 HydrophobicContact CG2-CG2 4.43Å; I178-V182 WeakPolarHBondContact O-CB 3.46Å; I178-V182 VanDerWaalsContact O-CG2 3.26Å; I178-V182 WeakPolarHBondContact O-CG2 3.35Å; I178-V182 PolarHBondContact O-N 2.94Å
179V92.6Very high90.2Very high22 Ų2245 Ų4513%0.13325%0.246CC..Hα-helixtrans-61.6-51.2180158.50000110.8L71 F75 V175 G176 F181 V182 M183L71-V179 HydrophobicContact CD2-CB 4.16Å; L71-V179 HydrophobicContact CD2-CG1 3.24Å; L71-V179 HydrophobicContact CD2-CG2 4.29Å; F75-V179 HydrophobicContact CB-CG1 3.82Å; F75-V179 HydrophobicContact CD1-CB 4.45Å; F75-V179 HydrophobicContact CD1-CG1 3.77Å; F75-V179 HydrophobicContact CD2-CB 4.28Å; F75-V179 HydrophobicContact CD2-CG1 4.19Å; F75-V179 HydrophobicContact CD2-CG2 3.95Å; F75-V179 HydrophobicContact CE1-CG1 4.47Å; F75-V179 HydrophobicContact CE2-CG2 4.5Å; F75-V179 HydrophobicContact CG-CB 4.2Å; F75-V179 HydrophobicContact CG-CG1 3.62Å; F75-V179 HydrophobicContact CG-CG2 4.22Å; V175-V179 HydrophobicContact CG1-CG2 4.04Å; V175-V179 WeakPolarHBondContact O-CB 3.38Å; V175-V179 VanDerWaalsContact O-CG2 3.3Å; V175-V179 WeakPolarHBondContact O-CG2 3.46Å; V175-V179 PolarHBondContact O-N 3.38Å; G176-V179 PolarHBondContact O-N 3.44Å; V179-F181 VanDerWaalsContact C-N 3.32Å; V179-F181 PolarHBondContact O-N 2.88Å; V179-V182 PolarHBondContact O-N 2.94Å; V179-M183 HydrophobicContact CG1-CE 3.9Å; V179-M183 WeakPolarHBondContact O-CG 3.39Å; V179-M183 PolarHBondContact O-N 3.29Å
180N91.6Very high89.1Confident1 Ų150.6 Ų50.61%0.00527%0.271CS..Hα-helixtrans-63.7-37.5178.7-75-15.3000112G176 M183 G184 D226 F227 S230G176-N180 WeakPolarHBondContact O-CB 3.26Å; G176-N180 PolarHBondContact O-N 2.92Å; N180-M183 PolarHBondContact O-N 3.02Å; N180-M183 WeakPolarHBondContact OD1-CE 3.45Å; N180-G184 PolarHBondContact O-N 3.46Å; N180-D226 PolarHBondContact ND2-O 2.92Å; N180-F227 HydrophobicContact CB-CB 4.15Å; N180-F227 HydrophobicContact CB-CD2 4.2Å; N180-S230 PolarHBondContact ND2-OG 3.29Å
181F91.5Very high87.4Confident126 Ų12649 Ų4955%0.55327%0.268SS*.Hα-helixtrans-64-43.4173-177.8-98000112.7V177 I178 V179 G184 T185 F227V177-F181 WeakPolarHBondContact O-CB 3.27Å; V177-F181 PolarHBondContact O-N 3.39Å; I178-F181 PolarHBondContact O-N 3.07Å; V179-F181 VanDerWaalsContact C-N 3.32Å; V179-F181 PolarHBondContact O-N 2.88Å; F181-G184 PolarHBondContact O-N 3.05Å; F181-T185 WeakPolarHBondContact O-CB 3.19Å; F181-T185 PolarHBondContact O-N 3.3Å; F181-T185 PolarHBondContact O-OG1 3.02Å; F181-F227 HydrophobicContact CB-CD2 4.41Å; F181-F227 HydrophobicContact CB-CE2 4.12Å; F181-F227 HydrophobicContact CD2-CE2 4.37Å
182V90.8Very high85.5Confident61 Ų6146.1 Ų46.137%0.3726%0.264SS..Hα-helixtrans-63.8-45175.8169.20000110.5L71 I178 V179 G184 T185 V186L71-V182 HydrophobicContact CD1-CG1 4.49Å; I178-V182 HydrophobicContact CG2-CG2 4.43Å; I178-V182 WeakPolarHBondContact O-CB 3.46Å; I178-V182 VanDerWaalsContact O-CG2 3.26Å; I178-V182 WeakPolarHBondContact O-CG2 3.35Å; I178-V182 PolarHBondContact O-N 2.94Å; V179-V182 PolarHBondContact O-N 2.94Å; V182-G184 PolarHBondContact O-N 3.16Å; V182-T185 PolarHBondContact O-N 2.92Å; V182-V186 HydrophobicContact CG1-CG2 4.24Å; V182-V186 WeakPolarHBondContact O-CB 3.5Å; V182-V186 VanDerWaalsContact O-CG2 3.27Å; V182-V186 WeakPolarHBondContact O-CG2 3.43Å; V182-V186 PolarHBondContact O-N 3.28Å
183M87.7Confident83Confident10 Ų1050.5 Ų50.55%0.04928%0.283CS..Hα-helixtrans-58.6-48.7175.5-70.8-165.3-67.200111.3L71 C72 V179 N180 T185 V186 L187 V223L71-M183 HydrophobicContact CD2-CE 4.5Å; L71-M183 HydrophobicContact CD2-CG 3.63Å; L71-M183 HydrophobicContact CD2-SD 3.78Å; C72-M183 HydrophobicContact CB-SD 4.02Å; V179-M183 HydrophobicContact CG1-CE 3.9Å; V179-M183 WeakPolarHBondContact O-CG 3.39Å; V179-M183 PolarHBondContact O-N 3.29Å; N180-M183 PolarHBondContact O-N 3.02Å; N180-M183 WeakPolarHBondContact OD1-CE 3.45Å; M183-T185 VanDerWaalsContact C-N 3.29Å; M183-T185 PolarHBondContact O-N 3.41Å; M183-V186 PolarHBondContact O-N 3.31Å; M183-L187 WeakPolarHBondContact O-CD1 3.45Å; M183-L187 PolarHBondContact O-N 2.7Å; M183-V223 HydrophobicContact CB-CG1 4.14Å
184G87.5Confident80.3Confident14 Ų1454 Ų5414%0.14432%0.319CS..Hα-helixtrans-59.1-41177.700000112.4N180 F181 V182 L187 Q188N180-G184 PolarHBondContact O-N 3.46Å; F181-G184 PolarHBondContact O-N 3.05Å; V182-G184 PolarHBondContact O-N 3.16Å; G184-L187 PolarHBondContact O-N 3.39Å; G184-Q188 WeakPolarHBondContact O-CB 3.35Å; G184-Q188 PolarHBondContact O-N 2.67Å
185T86.7Confident77.2Confident55 Ų5560.6 Ų60.634%0.33734%0.344SS..Hα-helixtrans-68.5-43178-54.80000111.8F181 V182 M183 Q188 L189F181-T185 WeakPolarHBondContact O-CB 3.19Å; F181-T185 PolarHBondContact O-N 3.3Å; F181-T185 PolarHBondContact O-OG1 3.02Å; V182-T185 PolarHBondContact O-N 2.92Å; M183-T185 VanDerWaalsContact C-N 3.29Å; M183-T185 PolarHBondContact O-N 3.41Å; T185-Q188 PolarHBondContact O-N 3.29Å; T185-L189 HydrophobicContact CG2-CD1 3.84Å; T185-L189 HydrophobicContact CG2-CG 4.24Å; T185-L189 WeakPolarHBondContact O-CB 3.28Å; T185-L189 VanDerWaalsContact O-CG 3.23Å; T185-L189 WeakPolarHBondContact O-CG 3.19Å; T185-L189 PolarHBondContact O-N 3.45Å
186V84.9Confident74.2Confident25 Ų2562.6 Ų62.615%0.15236%0.361CS..Hα-helixtrans-61-46175.5168.80000110.3A64 V182 M183 Q188 L189 F190A64-V186 HydrophobicContact CB-CG1 4.03Å; V182-V186 HydrophobicContact CG1-CG2 4.24Å; V182-V186 WeakPolarHBondContact O-CB 3.5Å; V182-V186 VanDerWaalsContact O-CG2 3.27Å; V182-V186 WeakPolarHBondContact O-CG2 3.43Å; V182-V186 PolarHBondContact O-N 3.28Å; M183-V186 PolarHBondContact O-N 3.31Å; V186-Q188 VanDerWaalsContact C-N 3.32Å; V186-Q188 PolarHBondContact O-N 2.99Å; V186-L189 PolarHBondContact O-N 3.47Å; V186-F190 HydrophobicContact CG1-CD2 3.9Å; V186-F190 HydrophobicContact CG1-CE2 4.35Å; V186-F190 WeakPolarHBondContact O-CB 3.37Å; V186-F190 VanDerWaalsContact O-CD2 3.27Å; V186-F190 WeakPolarHBondContact O-CD2 3.38Å; V186-F190 PolarHBondContact O-N 2.87Å
187L81.1Confident71.2Confident12 Ų1271.8 Ų71.86%0.06340%0.403CS..Hα-helixtrans-62.3-39.6176.6-9275000111.9S68 M183 G184 G191 A219 V223S68-L187 WeakPolarHBondContact OG-CD1 3.47Å; M183-L187 WeakPolarHBondContact O-CD1 3.45Å; M183-L187 PolarHBondContact O-N 2.7Å; G184-L187 PolarHBondContact O-N 3.39Å; L187-G191 WeakPolarHBondContact O-CA 3.38Å; L187-G191 PolarHBondContact O-N 2.95Å; L187-A219 HydrophobicContact CD2-CB 3.75Å; L187-V223 HydrophobicContact CD2-CG2 4.11Å
188Q79.7Confident68.3Low80 Ų8073.4 Ų73.437%0.37443%0.425SS..Hα-helixtrans-67.9-43178.8-175.167.7-6.700112.2G184 T185 V186 H193G184-Q188 WeakPolarHBondContact O-CB 3.35Å; G184-Q188 PolarHBondContact O-N 2.67Å; T185-Q188 PolarHBondContact O-N 3.29Å; V186-Q188 VanDerWaalsContact C-N 3.32Å; V186-Q188 PolarHBondContact O-N 2.99Å; Q188-H193 PolarHBondContact NE2-ND1 2.98Å
189L77.7Confident65.2Low122 Ų12278 Ų7864%0.63945%0.445SS*.Hα-helixtrans-69.3-39.8-178.6-70.6174.3000112.5T185 V186T185-L189 HydrophobicContact CG2-CD1 3.84Å; T185-L189 HydrophobicContact CG2-CG 4.24Å; T185-L189 WeakPolarHBondContact O-CB 3.28Å; T185-L189 VanDerWaalsContact O-CG 3.23Å; T185-L189 WeakPolarHBondContact O-CG 3.19Å; T185-L189 PolarHBondContact O-N 3.45Å; V186-L189 PolarHBondContact O-N 3.47Å
190F69.3Low62.5Low117 Ų11781.1 Ų81.151%0.51347%0.468SS..Hα-helixtrans-101.3-18-175.2-68.3-79.9000114.3A64 V186A64-F190 HydrophobicContact CB-CB 3.28Å; A64-F190 HydrophobicContact CB-CD1 4.48Å; A64-F190 HydrophobicContact CB-CD2 3.91Å; A64-F190 HydrophobicContact CB-CG 3.66Å; V186-F190 HydrophobicContact CG1-CD2 3.9Å; V186-F190 HydrophobicContact CG1-CE2 4.35Å; V186-F190 WeakPolarHBondContact O-CB 3.37Å; V186-F190 VanDerWaalsContact O-CD2 3.27Å; V186-F190 WeakPolarHBondContact O-CD2 3.38Å; V186-F190 PolarHBondContact O-N 2.87Å
191G59.8Low59.8Low23 Ų2387.2 Ų87.224%0.23751%0.505CS..Hα-helixtrans-93.3-27-169.800000115.9L187L187-G191 WeakPolarHBondContact O-CA 3.38Å; L187-G191 PolarHBondContact O-N 2.95Å
192G54Low57.2Low43 Ų4387.4 Ų87.444%0.44351%0.511SS..THydrogen-bonded Turntrans-166-4.7-167.200000121.1
193H43.1Very low54.5Low116 Ų11695.4 Ų95.454%0.53754%0.536SS..  trans-124.864.4178-70.581.5000111.7Q188 H195Q188-H193 PolarHBondContact NE2-ND1 2.98Å; H193-H195 VanDerWaalsContact C-N 3.3Å; H193-H195 PolarHBondContact O-N 3.46Å
194G36.7Very low52.2Low75 Ų7599.4 Ų99.477%0.77357%0.565SS**  trans-65.696.4156.100000108.5S196G194-S196 PolarHBondContact O-N 2.79Å
195H29.6Very low49.8Very low173 Ų173107.6 Ų107.680%0.80159%0.592SS**  trans-62.480.6158.9-72.5-77.5000108.2H193H193-H195 VanDerWaalsContact C-N 3.3Å; H193-H195 PolarHBondContact O-N 3.46Å
196S31.4Very low47.9Very low107 Ų107109.3 Ų109.375%0.74861%0.606SS**  trans-108.8107.1160.778.10000108.7G194 G198G194-S196 PolarHBondContact O-N 2.79Å; S196-G198 PolarHBondContact O-N 2.89Å; S196-G198 VanDerWaalsContact O-N 3.08Å
197H31.4Very low46.1Very low192 Ų192111.7 Ų111.789%0.88962%0.624SS**  trans-61.5103.9161.7-71.6-86.3000107.8
198G31.8Very low44.2Very low61 Ų61113.9 Ų113.963%0.62964%0.64SS**  trans-16094175.800000110.6S196 S200S196-G198 PolarHBondContact O-N 2.89Å; S196-G198 VanDerWaalsContact O-N 3.08Å; G198-S200 PolarHBondContact O-N 2.83Å; G198-S200 VanDerWaalsContact O-N 3.07Å
199Q30.4Very low42.5Very low203 Ų203113 Ų11395%0.94964%0.636SS**  trans-57.2108.6161.8-78.1-173.5-0.800108.3
200S36.7Very low41Very low88 Ų88110.4 Ų110.462%0.61563%0.626SS**  trans-136.7116.7152.576.40000109G198 N202G198-S200 PolarHBondContact O-N 2.83Å; G198-S200 VanDerWaalsContact O-N 3.07Å; S200-N202 PolarHBondContact O-N 3.23Å; S200-N202 VanDerWaalsContact O-N 3.13Å
201V34.8Very low39.9Very low129 Ų129111.1 Ų111.178%0.78263%0.625SS**  trans-78.990179.1-143.90000105.9
202N35.4Very low39.4Very low129 Ų129114.8 Ų114.869%0.6963%0.631SS**  trans-128.7108.1171.5-85.5-37.2000109.1S200 S204S200-N202 PolarHBondContact O-N 3.23Å; S200-N202 VanDerWaalsContact O-N 3.13Å; N202-S204 PolarHBondContact O-N 3.43Å
203Y34.8Very low39.3Very low230 Ų230116.7 Ų116.790%0.90263%0.631SS**SBendtrans-69.468.1170.4-82-92.4000110.2
204S39.2Very low39.9Very low93 Ų93115.1 Ų115.165%0.6563%0.626SS**  trans-152.760.5166.9-83.70000108.8N202N202-S204 PolarHBondContact O-N 3.43Å
205R37.7Very low40.9Very low186 Ų186116.6 Ų116.670%0.70262%0.616SS**  trans-130.977.6-175.6-158.5177.8-147.2157.66.2107.9
206S45.6Very low42.5Very low92 Ų92109.9 Ų109.964%0.64359%0.587SS**SBendtrans-161.3141.1169.7-153.90000111.3
207S47.2Very low44Very low74 Ų74113.2 Ų113.252%0.51758%0.584SS.*SBendtrans87.6-72.2-171.680.30000117.5Q209 T210 R211S207-Q209 PolarHBondContact O-N 3.46Å; S207-T210 PolarHBondContact O-N 2.73Å; S207-R211 PolarHBondContact O-N 2.85Å
208S41.8Very low45.6Very low59 Ų59106.8 Ų106.841%0.41356%0.563SS.*Hα-helixtrans-67.3-41.8-17168.10000113.9R212S208-R212 PolarHBondContact O-N 3.44Å; S208-R212 VanDerWaalsContact O-N 3.15Å
209Q43.1Very low47.5Very low61 Ų61105.2 Ų105.229%0.28555%0.545SS..Hα-helixtrans-68-37.3174.9-167.7176.1-8.300111.4S207 N213S207-Q209 PolarHBondContact O-N 3.46Å; Q209-N213 WeakPolarHBondContact O-CB 3.38Å; Q209-N213 PolarHBondContact O-N 3.4Å; Q209-N213 PolarHBondContact O-ND2 2.77Å; Q209-N213 PolarHBondContact O-OD1 3.26Å
210T47.4Very low49.6Very low68 Ų6899.2 Ų99.242%0.41752%0.516SS..Hα-helixtrans-65.7-46.2177.8-45.60000111.7S207 R212 N213 I214S207-T210 PolarHBondContact O-N 2.73Å; T210-R212 PolarHBondContact O-N 2.94Å; T210-N213 WeakPolarHBondContact O-CB 3.47Å; T210-N213 PolarHBondContact O-N 2.95Å; T210-I214 HydrophobicContact CG2-CD1 4.13Å; T210-I214 VanDerWaalsContact O-CG1 3.31Å; T210-I214 WeakPolarHBondContact O-CG1 3.48Å; T210-I214 PolarHBondContact O-N 2.94Å
211R46.4Very low51.5Low131 Ų13199.7 Ų99.749%0.49451%0.51SS..Hα-helixtrans-62.6-41.8176.6-78.3-169.2175.2149.95.3112.8S207 N213 I214 N215 D311S207-R211 PolarHBondContact O-N 2.85Å; R211-N213 VanDerWaalsContact C-N 3.34Å; R211-N213 PolarHBondContact O-N 3.36Å; R211-I214 PolarHBondContact O-N 3.49Å; R211-N215 PolarHBondContact O-N 2.93Å; R211-D311 IonicContact NE-OD2 3.93Å; R211-D311 PolarHBondContact NE-OD2 2.78Å; R211-D311 IonicContact NH2-OD2 3.05Å
212R48.4Very low53.6Low101 Ų10197 Ų9738%0.38149%0.489SS..Hα-helixtrans-58.8-46.3172.2-88.9-171.6-75.699.4-5.8111.7S208 T210 I214 N215 V216S208-R212 PolarHBondContact O-N 3.44Å; S208-R212 VanDerWaalsContact O-N 3.15Å; T210-R212 PolarHBondContact O-N 2.94Å; R212-I214 VanDerWaalsContact C-N 3.26Å; R212-I214 PolarHBondContact O-N 3.34Å; R212-N215 PolarHBondContact O-N 3.37Å; R212-V216 WeakPolarHBondContact O-CB 3.36Å; R212-V216 WeakPolarHBondContact O-CG2 3.34Å; R212-V216 PolarHBondContact O-N 3.49Å
213N51.5Low55.9Low82 Ų8291.6 Ų91.644%0.43946%0.461SS..Hα-helixtrans-61.1-37.5177.7-67.4-12.2000111.4Q209 T210 R211 R217Q209-N213 WeakPolarHBondContact O-CB 3.38Å; Q209-N213 PolarHBondContact O-N 3.4Å; Q209-N213 PolarHBondContact O-ND2 2.77Å; Q209-N213 PolarHBondContact O-OD1 3.26Å; T210-N213 WeakPolarHBondContact O-CB 3.47Å; T210-N213 PolarHBondContact O-N 2.95Å; R211-N213 VanDerWaalsContact C-N 3.34Å; R211-N213 PolarHBondContact O-N 3.36Å; N213-R217 WeakPolarHBondContact O-CB 3.12Å; N213-R217 PolarHBondContact O-N 2.99Å
214I56.5Low58.2Low83 Ų8384.5 Ų84.543%0.42644%0.438SS..Hα-helixtrans-68.5-49.1178-67.9163.7000111.1T210 R211 R212 V216 R217 A218T210-I214 HydrophobicContact CG2-CD1 4.13Å; T210-I214 VanDerWaalsContact O-CG1 3.31Å; T210-I214 WeakPolarHBondContact O-CG1 3.48Å; T210-I214 PolarHBondContact O-N 2.94Å; R211-I214 PolarHBondContact O-N 3.49Å; R212-I214 VanDerWaalsContact C-N 3.26Å; R212-I214 PolarHBondContact O-N 3.34Å; I214-V216 PolarHBondContact O-N 3.22Å; I214-R217 PolarHBondContact O-N 3.01Å; I214-A218 WeakPolarHBondContact O-CB 3.37Å; I214-A218 PolarHBondContact O-N 3.4Å
215N58.3Low60.3Low107 Ų10781.3 Ų81.357%0.57242%0.42SS*.Hα-helixtrans-63.6-44.4-178.7-70.7-1.4000111.9R211 R212 A218 A219R211-N215 PolarHBondContact O-N 2.93Å; R212-N215 PolarHBondContact O-N 3.37Å; N215-A218 PolarHBondContact O-N 2.95Å; N215-A219 WeakPolarHBondContact O-CB 3.36Å; N215-A219 PolarHBondContact O-N 3.28Å
216V61.9Low62.6Low32 Ų3272.8 Ų72.819%0.19439%0.388CS..Hα-helixtrans-65.7-40.8176.2174.30000110.7R212 I214 A219 F220R212-V216 WeakPolarHBondContact O-CB 3.36Å; R212-V216 WeakPolarHBondContact O-CG2 3.34Å; R212-V216 PolarHBondContact O-N 3.49Å; I214-V216 PolarHBondContact O-N 3.22Å; V216-A219 PolarHBondContact O-N 3.21Å; V216-F220 WeakPolarHBondContact O-CB 3.49Å; V216-F220 PolarHBondContact O-N 2.92Å
217R63.9Low64.7Low177 Ų17771.3 Ų71.367%0.66837%0.37SS*.Hα-helixtrans-63.7-40.6175.6179.3179178.2-175-0.6111.9N213 I214 F220 I221N213-R217 WeakPolarHBondContact O-CB 3.12Å; N213-R217 PolarHBondContact O-N 2.99Å; I214-R217 PolarHBondContact O-N 3.01Å; R217-F220 PolarHBondContact O-N 3.41Å; R217-I221 HydrophobicContact CG-CD1 3.89Å; R217-I221 HydrophobicContact CG-CG1 4.44Å; R217-I221 VanDerWaalsContact O-CG1 3.27Å; R217-I221 WeakPolarHBondContact O-CG1 3.28Å; R217-I221 PolarHBondContact O-N 3.41Å
218A64.9Low66.7Low56 Ų5672.4 Ų72.446%0.46337%0.369SS..Hα-helixtrans-62.6-47.7176.100000110.6I214 N215 F220 I221 H222I214-A218 WeakPolarHBondContact O-CB 3.37Å; I214-A218 PolarHBondContact O-N 3.4Å; N215-A218 PolarHBondContact O-N 2.95Å; A218-F220 VanDerWaalsContact C-N 3.32Å; A218-F220 PolarHBondContact O-N 3.27Å; A218-I221 PolarHBondContact O-N 2.95Å; A218-H222 WeakPolarHBondContact O-CB 3.36Å; A218-H222 PolarHBondContact O-N 3.13Å
219A71.1Confident68.9Low29 Ų2970.4 Ų70.424%0.2435%0.353CS..Hα-helixtrans-60.7-39174.900000112.5L187 N215 V216 H222 V223L187-A219 HydrophobicContact CD2-CB 3.75Å; N215-A219 WeakPolarHBondContact O-CB 3.36Å; N215-A219 PolarHBondContact O-N 3.28Å; V216-A219 PolarHBondContact O-N 3.21Å; A219-H222 WeakPolarHBondContact O-CB 3.25Å; A219-H222 PolarHBondContact O-N 3.18Å; A219-V223 WeakPolarHBondContact O-CG2 3.4Å; A219-V223 PolarHBondContact O-N 3.05Å
220F75.2Confident71.2Confident76 Ų7667.5 Ų67.533%0.33334%0.34SS..Hα-helixtrans-67.6-44.6176.7178.2-97.3000112.9V216 R217 A218 H222 V223 L224V216-F220 WeakPolarHBondContact O-CB 3.49Å; V216-F220 PolarHBondContact O-N 2.92Å; R217-F220 PolarHBondContact O-N 3.41Å; A218-F220 VanDerWaalsContact C-N 3.32Å; A218-F220 PolarHBondContact O-N 3.27Å; F220-H222 PolarHBondContact O-N 2.65Å; F220-V223 PolarHBondContact O-N 3.34Å; F220-L224 HydrophobicContact CE1-CD2 4.48Å; F220-L224 VanDerWaalsContact O-CB 3.3Å; F220-L224 WeakPolarHBondContact O-CB 3.41Å; F220-L224 PolarHBondContact O-N 3.45Å
221I76.6Confident73.3Confident98 Ų9866.8 Ų66.850%0.50334%0.335SS..Hα-helixtrans-60.1-37175.8-70.8167000110.2R217 A218 G225R217-I221 HydrophobicContact CG-CD1 3.89Å; R217-I221 HydrophobicContact CG-CG1 4.44Å; R217-I221 VanDerWaalsContact O-CG1 3.27Å; R217-I221 WeakPolarHBondContact O-CG1 3.28Å; R217-I221 PolarHBondContact O-N 3.41Å; A218-I221 PolarHBondContact O-N 2.95Å; I221-G225 PolarHBondContact O-N 3.12Å; I221-G225 VanDerWaalsContact O-N 3.16Å
222H79.3Confident75.5Confident74 Ų7461.6 Ų61.634%0.34332%0.323SS..Hα-helixtrans-66.7-54.7177-175.954.1000112.4D101 A218 A219 F220 L224 G225 D226D101-H222 WeakPolarHBondContact CB-NE2 3.44Å; D101-H222 VanDerWaalsContact CG-NE2 3.3Å; D101-H222 IonicContact OD1-CE1 3.82Å; D101-H222 PolarHBondContact OD1-CE1 3.38Å; D101-H222 VanDerWaalsContact OD1-CE1 3.31Å; D101-H222 IonicContact OD1-NE2 3.1Å; D101-H222 IonicContact OD2-CE1 3.31Å; D101-H222 PolarHBondContact OD2-CE1 3.32Å; D101-H222 IonicContact OD2-NE2 3.71Å; D101-H222 PolarHBondContact OD2-NE2 3.36Å; A218-H222 WeakPolarHBondContact O-CB 3.36Å; A218-H222 PolarHBondContact O-N 3.13Å; A219-H222 WeakPolarHBondContact O-CB 3.25Å; A219-H222 PolarHBondContact O-N 3.18Å; F220-H222 PolarHBondContact O-N 2.65Å; H222-L224 PolarHBondContact O-N 2.85Å; H222-L224 VanDerWaalsContact O-N 3.15Å; H222-G225 VanDerWaalsContact O-CA 3.3Å; H222-G225 WeakPolarHBondContact O-CA 3.32Å; H222-G225 PolarHBondContact O-N 2.9Å; H222-D226 IonicContact CE1-OD1 2.68Å; H222-D226 IonicContact NE2-OD2 2.68Å; H222-D226 PolarHBondContact O-N 3.07Å; H222-D226 VanDerWaalsContact O-N 3.1Å
223V82.3Confident77.5Confident15 Ų1556.9 Ų56.99%0.09131%0.305CS..Hα-helixtrans-58.6-31.7176.9172.60000112.1M183 L187 A219 F220 G225 D226 F227M183-V223 HydrophobicContact CB-CG1 4.14Å; L187-V223 HydrophobicContact CD2-CG2 4.11Å; A219-V223 WeakPolarHBondContact O-CG2 3.4Å; A219-V223 PolarHBondContact O-N 3.05Å; F220-V223 PolarHBondContact O-N 3.34Å; V223-G225 VanDerWaalsContact C-N 3.34Å; V223-D226 PolarHBondContact O-N 3.45Å; V223-F227 WeakPolarHBondContact O-CB 3.47Å; V223-F227 PolarHBondContact O-N 3.26Å
224L83.9Confident79.6Confident80 Ų8055 Ų5542%0.41930%0.295SS..Hα-helixtrans-66.3-36.3172.9-177.363.4000112.2F220 H222 I228F220-L224 HydrophobicContact CE1-CD2 4.48Å; F220-L224 VanDerWaalsContact O-CB 3.3Å; F220-L224 WeakPolarHBondContact O-CB 3.41Å; F220-L224 PolarHBondContact O-N 3.45Å; H222-L224 PolarHBondContact O-N 2.85Å; H222-L224 VanDerWaalsContact O-N 3.15Å; L224-I228 HydrophobicContact CG-CD1 4.4Å; L224-I228 WeakPolarHBondContact O-CD1 3.47Å; L224-I228 VanDerWaalsContact O-CG1 3.28Å; L224-I228 WeakPolarHBondContact O-CG1 3.33Å; L224-I228 PolarHBondContact O-N 3.37Å; L224-I228 VanDerWaalsContact O-N 3.1Å
225G83.5Confident81.3Confident26 Ų2654.7 Ų54.727%0.26830%0.296SS..Hα-helixtrans-61-51.5171.900000111.9I221 H222 V223 F227 I228 Q229I221-G225 PolarHBondContact O-N 3.12Å; I221-G225 VanDerWaalsContact O-N 3.16Å; H222-G225 VanDerWaalsContact O-CA 3.3Å; H222-G225 WeakPolarHBondContact O-CA 3.32Å; H222-G225 PolarHBondContact O-N 2.9Å; V223-G225 VanDerWaalsContact C-N 3.34Å; G225-F227 VanDerWaalsContact C-N 3.28Å; G225-F227 PolarHBondContact O-N 3.27Å; G225-I228 WeakPolarHBondContact O-CB 2.98Å; G225-I228 PolarHBondContact O-N 3.28Å; G225-Q229 PolarHBondContact O-N 2.83Å
226D86.8Confident82.8Confident8 Ų849.8 Ų49.84%0.04327%0.27CS..Hα-helixtrans-61.3-39.4178.8-54.6-13.2000111.1N180 H222 V223 I228 Q229 S230N180-D226 PolarHBondContact ND2-O 2.92Å; H222-D226 IonicContact CE1-OD1 2.68Å; H222-D226 IonicContact NE2-OD2 2.68Å; H222-D226 PolarHBondContact O-N 3.07Å; H222-D226 VanDerWaalsContact O-N 3.1Å; V223-D226 PolarHBondContact O-N 3.45Å; D226-I228 VanDerWaalsContact C-N 3.34Å; D226-I228 PolarHBondContact O-N 2.97Å; D226-Q229 PolarHBondContact O-N 2.91Å; D226-S230 PolarHBondContact O-N 3.32Å; D226-S230 PolarHBondContact O-OG 3.02Å
227F89Confident84.2Confident61 Ų6148.2 Ų48.227%0.26826%0.261SS..Hα-helixtrans-59.5-44.2174.2177.8-103.2000112.1V177 N180 F181 V223 G225 Q229 S230 V231V177-F227 HydrophobicContact CG1-CE2 3.99Å; N180-F227 HydrophobicContact CB-CB 4.15Å; N180-F227 HydrophobicContact CB-CD2 4.2Å; F181-F227 HydrophobicContact CB-CD2 4.41Å; F181-F227 HydrophobicContact CB-CE2 4.12Å; F181-F227 HydrophobicContact CD2-CE2 4.37Å; V223-F227 WeakPolarHBondContact O-CB 3.47Å; V223-F227 PolarHBondContact O-N 3.26Å; G225-F227 VanDerWaalsContact C-N 3.28Å; G225-F227 PolarHBondContact O-N 3.27Å; F227-Q229 VanDerWaalsContact C-N 3.33Å; F227-S230 PolarHBondContact O-N 2.97Å; F227-V231 HydrophobicContact CD1-CG2 4.5Å; F227-V231 HydrophobicContact CE1-CG2 4.07Å; F227-V231 HydrophobicContact CE2-CG2 4.1Å; F227-V231 HydrophobicContact CZ-CG2 3.85Å; F227-V231 VanDerWaalsContact O-CG2 3.3Å; F227-V231 WeakPolarHBondContact O-CG2 3.33Å; F227-V231 PolarHBondContact O-N 2.77Å
228I88.7Confident85.4Confident96 Ų9644 Ų4449%0.49225%0.252SS..Hα-helixtrans-63.3-41.3176.4-68.9163.7000110.6L224 G225 D226 G232L224-I228 HydrophobicContact CG-CD1 4.4Å; L224-I228 WeakPolarHBondContact O-CD1 3.47Å; L224-I228 VanDerWaalsContact O-CG1 3.28Å; L224-I228 WeakPolarHBondContact O-CG1 3.33Å; L224-I228 PolarHBondContact O-N 3.37Å; L224-I228 VanDerWaalsContact O-N 3.1Å; G225-I228 WeakPolarHBondContact O-CB 2.98Å; G225-I228 PolarHBondContact O-N 3.28Å; D226-I228 VanDerWaalsContact C-N 3.34Å; D226-I228 PolarHBondContact O-N 2.97Å; I228-G232 PolarHBondContact O-N 3.47Å
229Q88.5Confident86.6Confident18 Ų1844.4 Ų44.48%0.08425%0.245CC..Hα-helixtrans-62.4-51176.7-72.8177.2-100.200111.4G225 D226 F227 V231 G232 V233 F255G225-Q229 PolarHBondContact O-N 2.83Å; D226-Q229 PolarHBondContact O-N 2.91Å; F227-Q229 VanDerWaalsContact C-N 3.33Å; Q229-V231 VanDerWaalsContact C-N 3.32Å; Q229-V231 PolarHBondContact O-N 2.74Å; Q229-G232 CarbonylContact O-C 3.56Å; Q229-G232 WeakPolarHBondContact O-CA 3.45Å; Q229-G232 PolarHBondContact O-N 3.34Å; Q229-V233 WeakPolarHBondContact O-CG2 3.29Å; Q229-V233 PolarHBondContact O-N 3.5Å; Q229-F255 HydrophobicContact CB-CE1 4.44Å; Q229-F255 HydrophobicContact CG-CD1 4.03Å; Q229-F255 HydrophobicContact CG-CE1 4.38Å; Q229-F255 HydrophobicContact CG-CG 4.41Å; Q229-F255 VanDerWaalsContact O-CZ 3.25Å; Q229-F255 WeakPolarHBondContact O-CZ 2.96Å
230S91.1Very high87.2Confident0 Ų043.3 Ų43.30%024%0.235CC..Hα-helixtrans-64.7-33.2-179.7-53.60000113.2D94 V177 N180 D226 F227 G232 V233 L234D94-S230 PolarHBondContact OD2-OG 3.4Å; V177-S230 WeakPolarHBondContact CG2-O 3.45Å; N180-S230 PolarHBondContact ND2-OG 3.29Å; D226-S230 PolarHBondContact O-N 3.32Å; D226-S230 PolarHBondContact O-OG 3.02Å; F227-S230 PolarHBondContact O-N 2.97Å; S230-G232 VanDerWaalsContact C-N 3.33Å; S230-V233 PolarHBondContact O-N 2.9Å; S230-L234 WeakPolarHBondContact O-CB 3.33Å; S230-L234 PolarHBondContact O-N 3.22Å
231V92.5Very high87.5Confident53 Ų5345.4 Ų45.432%0.32124%0.244SC..Hα-helixtrans-63.1-42170.3170.10000110.7V177 F227 Q229 L234 V235V177-V231 HydrophobicContact CG1-CG2 4.24Å; V177-V231 HydrophobicContact CG2-CG2 4.02Å; F227-V231 HydrophobicContact CD1-CG2 4.5Å; F227-V231 HydrophobicContact CE1-CG2 4.07Å; F227-V231 HydrophobicContact CE2-CG2 4.1Å; F227-V231 HydrophobicContact CZ-CG2 3.85Å; F227-V231 VanDerWaalsContact O-CG2 3.3Å; F227-V231 WeakPolarHBondContact O-CG2 3.33Å; F227-V231 PolarHBondContact O-N 2.77Å; Q229-V231 VanDerWaalsContact C-N 3.32Å; Q229-V231 PolarHBondContact O-N 2.74Å; V231-L234 WeakPolarHBondContact O-CB 3.48Å; V231-L234 PolarHBondContact O-N 3.03Å; V231-V235 WeakPolarHBondContact O-CG2 3.39Å; V231-V235 PolarHBondContact O-N 2.9Å
232G90.9Very high87.9Confident22 Ų2248.3 Ų48.323%0.22725%0.253CS..Hα-helixtrans-62.3-41.4175.100000112.6I228 Q229 S230 L234 V235 A236I228-G232 PolarHBondContact O-N 3.47Å; Q229-G232 CarbonylContact O-C 3.56Å; Q229-G232 WeakPolarHBondContact O-CA 3.45Å; Q229-G232 PolarHBondContact O-N 3.34Å; S230-G232 VanDerWaalsContact C-N 3.33Å; G232-L234 VanDerWaalsContact C-N 3.32Å; G232-L234 PolarHBondContact O-N 3.41Å; G232-V235 PolarHBondContact O-N 2.88Å; G232-A236 WeakPolarHBondContact O-CB 3.31Å; G232-A236 PolarHBondContact O-N 3.15Å
233V92Very high87.8Confident2 Ų253 Ų531%0.01228%0.275CS..Hα-helixtrans-62.6-40.2174.9-179.30000110.5I91 M169 A173 Q229 S230 A236 A237 F255I91-V233 HydrophobicContact CG1-CG1 4.21Å; M169-V233 HydrophobicContact CE-CG1 4.17Å; A173-V233 HydrophobicContact CB-CB 4.41Å; A173-V233 HydrophobicContact CB-CG1 3.89Å; Q229-V233 WeakPolarHBondContact O-CG2 3.29Å; Q229-V233 PolarHBondContact O-N 3.5Å; S230-V233 PolarHBondContact O-N 2.9Å; V233-A236 WeakPolarHBondContact O-CB 3.4Å; V233-A236 PolarHBondContact O-N 2.89Å; V233-A237 WeakPolarHBondContact O-CB 3.49Å; V233-A237 PolarHBondContact O-N 3.27Å; V233-F255 HydrophobicContact CG2-CE2 3.57Å; V233-F255 HydrophobicContact CG2-CZ 3.99Å
234L94Very high87.7Confident43 Ų4356.7 Ų56.723%0.22529%0.294CS..Hα-helixtrans-63.7-43.6176.3179.162.9000112A173 A174 V177 S230 V231 G232 A236 A237 L238A173-L234 HydrophobicContact CB-CB 3.97Å; A173-L234 HydrophobicContact CB-CD1 4.08Å; A174-L234 HydrophobicContact CB-CD1 4.26Å; V177-L234 HydrophobicContact CG2-CB 4.14Å; V177-L234 HydrophobicContact CG2-CD2 4.03Å; S230-L234 WeakPolarHBondContact O-CB 3.33Å; S230-L234 PolarHBondContact O-N 3.22Å; V231-L234 WeakPolarHBondContact O-CB 3.48Å; V231-L234 PolarHBondContact O-N 3.03Å; G232-L234 VanDerWaalsContact C-N 3.32Å; G232-L234 PolarHBondContact O-N 3.41Å; L234-A236 VanDerWaalsContact C-N 3.34Å; L234-A237 WeakPolarHBondContact O-CB 3.21Å; L234-A237 PolarHBondContact O-N 3.49Å; L234-L238 WeakPolarHBondContact O-CG 3.43Å; L234-L238 PolarHBondContact O-N 2.85Å
235V92.2Very high87.6Confident76 Ų7656.2 Ų56.246%0.46129%0.29SS..Hα-helixtrans-62.3-43.4174.9172.70000110.5V231 G232 A237 L238 I239V231-V235 WeakPolarHBondContact O-CG2 3.39Å; V231-V235 PolarHBondContact O-N 2.9Å; G232-V235 PolarHBondContact O-N 2.88Å; V235-A237 VanDerWaalsContact C-N 3.34Å; V235-A237 PolarHBondContact O-N 3.2Å; V235-L238 PolarHBondContact O-N 3.47Å; V235-I239 HydrophobicContact CG1-CD1 3.84Å; V235-I239 HydrophobicContact CG1-CG1 4.49Å; V235-I239 VanDerWaalsContact O-CG1 3.31Å; V235-I239 WeakPolarHBondContact O-CG1 3.42Å; V235-I239 PolarHBondContact O-N 3.5Å
236A90.2Very high87.9Confident3 Ų358.4 Ų58.43%0.02530%0.295CS..Hα-helixtrans-58.9-44.9174.700000111.7M169 G232 V233 L234 L238 I239 I240 I247 C251M169-A236 HydrophobicContact CE-CB 4.03Å; G232-A236 WeakPolarHBondContact O-CB 3.31Å; G232-A236 PolarHBondContact O-N 3.15Å; V233-A236 WeakPolarHBondContact O-CB 3.4Å; V233-A236 PolarHBondContact O-N 2.89Å; L234-A236 VanDerWaalsContact C-N 3.34Å; A236-L238 VanDerWaalsContact C-N 3.34Å; A236-L238 PolarHBondContact O-N 2.61Å; A236-I239 PolarHBondContact O-N 2.91Å; A236-I240 WeakPolarHBondContact O-CB 3.41Å; A236-I240 WeakPolarHBondContact O-CD1 3.4Å; A236-I240 WeakPolarHBondContact O-CG1 3.48Å; A236-I240 PolarHBondContact O-N 3.4Å; A236-I247 HydrophobicContact CB-CG2 3.88Å; A236-C251 HydrophobicContact CB-CB 4.18Å
237A90.8Very high88.1Confident0 Ų059.9 Ų59.90%030%0.302CS..Hα-helixtrans-60.3-42.2177.500000112.4M169 L170 A173 V233 L234 V235 I239 I240 F241M169-A237 HydrophobicContact CB-CB 4.49Å; M169-A237 HydrophobicContact CE-CB 4.09Å; M169-A237 HydrophobicContact CG-CB 3.77Å; M169-A237 HydrophobicContact SD-CB 4.01Å; L170-A237 HydrophobicContact CB-CB 4.16Å; A173-A237 HydrophobicContact CB-CB 4.48Å; V233-A237 WeakPolarHBondContact O-CB 3.49Å; V233-A237 PolarHBondContact O-N 3.27Å; L234-A237 WeakPolarHBondContact O-CB 3.21Å; L234-A237 PolarHBondContact O-N 3.49Å; V235-A237 VanDerWaalsContact C-N 3.34Å; V235-A237 PolarHBondContact O-N 3.2Å; A237-I239 VanDerWaalsContact C-N 3.35Å; A237-I239 PolarHBondContact O-N 2.89Å; A237-I240 PolarHBondContact O-N 2.9Å; A237-F241 PolarHBondContact O-N 3.19Å; A237-F241 VanDerWaalsContact O-N 3.13Å
238L90.9Very high88.1Confident89 Ų8957 Ų5747%0.46629%0.289SS..Hα-helixtrans-64.3-38.3176-71.3172.4000112.2L170 L234 V235 A236 F241 F242L170-L238 HydrophobicContact CD1-CD2 3.84Å; L234-L238 WeakPolarHBondContact O-CG 3.43Å; L234-L238 PolarHBondContact O-N 2.85Å; V235-L238 PolarHBondContact O-N 3.47Å; A236-L238 VanDerWaalsContact C-N 3.34Å; A236-L238 PolarHBondContact O-N 2.61Å; L238-F241 WeakPolarHBondContact O-CB 3.45Å; L238-F242 VanDerWaalsContact O-CD2 3.26Å; L238-F242 WeakPolarHBondContact O-CD2 3.34Å
239I88.2Confident88.3Confident64 Ų6452.4 Ų52.433%0.32827%0.266SS..Hα-helixtrans-71.7-40.8177.8-63.7166.3000110.9V235 A236 A237 F241 F242 L244 I247V235-I239 HydrophobicContact CG1-CD1 3.84Å; V235-I239 HydrophobicContact CG1-CG1 4.49Å; V235-I239 VanDerWaalsContact O-CG1 3.31Å; V235-I239 WeakPolarHBondContact O-CG1 3.42Å; V235-I239 PolarHBondContact O-N 3.5Å; A236-I239 PolarHBondContact O-N 2.91Å; A237-I239 VanDerWaalsContact C-N 3.35Å; A237-I239 PolarHBondContact O-N 2.89Å; I239-F241 PolarHBondContact O-N 2.83Å; I239-F242 WeakPolarHBondContact O-CB 3.42Å; I239-F242 PolarHBondContact O-N 3.48Å; I239-L244 HydrophobicContact CG2-CB 4.15Å; I239-L244 HydrophobicContact CG2-CD1 4.02Å; I239-I247 HydrophobicContact CG2-CD1 4.32Å; I239-I247 HydrophobicContact CG2-CG1 3.8Å
240I85.3Confident88.4Confident6 Ų654.8 Ų54.83%0.03128%0.278CS..Hα-helixtrans-62.4-31178.3-69.9163.3000111.1I164 A166 M169 A236 A237 F242 H243 L244 Q245 I247 D248I164-I240 HydrophobicContact CD1-CD1 4.39Å; I164-I240 HydrophobicContact CG2-CG2 4.49Å; A166-I240 HydrophobicContact CB-CG2 4.1Å; M169-I240 HydrophobicContact CE-CD1 3.7Å; M169-I240 HydrophobicContact SD-CD1 3.52Å; M169-I240 VanDerWaalsContact SD-CD1 3.52Å; A236-I240 WeakPolarHBondContact O-CB 3.41Å; A236-I240 WeakPolarHBondContact O-CD1 3.4Å; A236-I240 WeakPolarHBondContact O-CG1 3.48Å; A236-I240 PolarHBondContact O-N 3.4Å; A237-I240 PolarHBondContact O-N 2.9Å; I240-F242 PolarHBondContact O-N 3.08Å; I240-F242 VanDerWaalsContact O-N 3.13Å; I240-H243 PolarHBondContact O-N 3.36Å; I240-L244 WeakPolarHBondContact CG1-O 3.5Å; I240-Q245 HydrophobicContact CG2-CG 4.13Å; I240-I247 HydrophobicContact CG1-CB 4.11Å; I240-D248 HydrophobicContact CD1-CB 3.94Å
241F81.9Confident88.4Confident120 Ų12055.3 Ų55.353%0.52628%0.282SS..THydrogen-bonded Turntrans-56.9-25.6172.1-167.2-93.8000113.1A237 L238 I239 H243A237-F241 PolarHBondContact O-N 3.19Å; A237-F241 VanDerWaalsContact O-N 3.13Å; L238-F241 WeakPolarHBondContact O-CB 3.45Å; I239-F241 PolarHBondContact O-N 2.83Å; F241-H243 VanDerWaalsContact C-N 3.3Å; F241-H243 PolarHBondContact O-N 2.87Å
242F84Confident88.4Confident158 Ų15852.8 Ų52.869%0.69327%0.267SS*.THydrogen-bonded Turntrans-90.524.9173.1-64.8-82.1000113.8L238 I239 I240L238-F242 VanDerWaalsContact O-CD2 3.26Å; L238-F242 WeakPolarHBondContact O-CD2 3.34Å; I239-F242 WeakPolarHBondContact O-CB 3.42Å; I239-F242 PolarHBondContact O-N 3.48Å; I240-F242 PolarHBondContact O-N 3.08Å; I240-F242 VanDerWaalsContact O-N 3.13Å
243H76.2Confident88.6Confident173 Ų17355.2 Ų55.280%0.80127%0.271SS*.THydrogen-bonded Turntrans70.224.9175.7-56.1-73.6000116.6I240 F241I240-H243 PolarHBondContact O-N 3.36Å; F241-H243 VanDerWaalsContact C-N 3.3Å; F241-H243 PolarHBondContact O-N 2.87Å
244L80.8Confident88.6Confident93 Ų9359.6 Ų59.649%0.48729%0.293SS..  trans-105.474.4173.9-63.9179.8000111.8I239 I240 I246 I247I239-L244 HydrophobicContact CG2-CB 4.15Å; I239-L244 HydrophobicContact CG2-CD1 4.02Å; I240-L244 WeakPolarHBondContact CG1-O 3.5Å; L244-I246 VanDerWaalsContact C-N 3.3Å; L244-I246 PolarHBondContact O-N 2.79Å; L244-I247 HydrophobicContact CB-CG1 3.91Å; L244-I247 WeakPolarHBondContact O-CB 3.31Å; L244-I247 WeakPolarHBondContact O-CG1 3.47Å; L244-I247 PolarHBondContact O-N 3.5Å
245Q82.8Confident88.4Confident69 Ų6958 Ų5832%0.32229%0.285SS..THydrogen-bonded Turntrans-71.8-20.3-175.1-64.6168.7-46.800114.2F162 I164 I240 I247 D248F162-Q245 HydrophobicContact CB-CB 3.67Å; F162-Q245 HydrophobicContact CG-CB 4.24Å; F162-Q245 PolarHBondContact O-NE2 3.44Å; F162-Q245 PolarHBondContact O-OE1 3.33Å; I164-Q245 HydrophobicContact CD1-CB 4.21Å; I240-Q245 HydrophobicContact CG2-CG 4.13Å; Q245-I247 PolarHBondContact O-N 3.44Å; Q245-D248 PolarHBondContact O-N 3.41Å
246I88.8Confident88.5Confident73 Ų7354.6 Ų54.637%0.37426%0.264SS..THydrogen-bonded Turntrans-60.4-16.7174.7-163.5165.7000113.3F162 L244 D248 P249 I250F162-I246 HydrophobicContact CE1-CB 4.48Å; F162-I246 HydrophobicContact CE1-CG1 4.4Å; F162-I246 HydrophobicContact CZ-CB 4.28Å; F162-I246 HydrophobicContact CZ-CD1 4.48Å; F162-I246 HydrophobicContact CZ-CG1 4.03Å; L244-I246 VanDerWaalsContact C-N 3.3Å; L244-I246 PolarHBondContact O-N 2.79Å; I246-D248 VanDerWaalsContact C-N 3.25Å; I246-D248 PolarHBondContact O-N 3.35Å; I246-P249 WeakPolarHBondContact O-CD 3.25Å; I246-I250 HydrophobicContact CG1-CD1 4.3Å; I246-I250 HydrophobicContact CG2-CD1 4.39Å; I246-I250 WeakPolarHBondContact O-CG1 3.43Å
247I90.6Very high88.6Confident38 Ų3860.2 Ų60.220%0.19529%0.293CS..Hα-helixtrans-65.2-29.3-179.8-63.9-66.8000111.9A236 I239 I240 L244 Q245 I250 C251A236-I247 HydrophobicContact CB-CG2 3.88Å; I239-I247 HydrophobicContact CG2-CD1 4.32Å; I239-I247 HydrophobicContact CG2-CG1 3.8Å; I240-I247 HydrophobicContact CG1-CB 4.11Å; L244-I247 HydrophobicContact CB-CG1 3.91Å; L244-I247 WeakPolarHBondContact O-CB 3.31Å; L244-I247 WeakPolarHBondContact O-CG1 3.47Å; L244-I247 PolarHBondContact O-N 3.5Å; Q245-I247 PolarHBondContact O-N 3.44Å; I247-I250 HydrophobicContact CD1-CD1 4.46Å; I247-I250 PolarHBondContact O-N 3.39Å; I247-C251 VanDerWaalsContact O-CB 3.29Å; I247-C251 WeakPolarHBondContact O-CB 3.47Å; I247-C251 PolarHBondContact O-N 3.39Å
248D89.7Confident88.5Confident0 Ų064.2 Ų64.20%031%0.314CS..Hα-helixtrans-61.4-54-178.3176.389.8000112.5S88 L89 A90 R156 I164 I240 Q245 I246 I250 C251 T252S88-D248 PolarHBondContact OG-OD1 2.94Å; L89-D248 VanDerWaalsContact CB-OD2 3.22Å; L89-D248 WeakPolarHBondContact CB-OD2 3.36Å; L89-D248 PolarHBondContact N-OD1 3.28Å; L89-D248 PolarHBondContact N-OD2 3.34Å; A90-D248 WeakPolarHBondContact CB-OD1 3.49Å; A90-D248 PolarHBondContact N-OD1 3.5Å; R156-D248 IonicContact CZ-OD2 3.72Å; R156-D248 IonicContact NH1-OD2 3.73Å; R156-D248 PolarHBondContact NH1-OD2 3.37Å; I164-D248 HydrophobicContact CD1-CB 3.45Å; I164-D248 VanDerWaalsContact CD1-CB 3.45Å; I240-D248 HydrophobicContact CD1-CB 3.94Å; Q245-D248 PolarHBondContact O-N 3.41Å; I246-D248 VanDerWaalsContact C-N 3.25Å; I246-D248 PolarHBondContact O-N 3.35Å; D248-I250 VanDerWaalsContact C-N 3.35Å; D248-I250 PolarHBondContact O-N 2.97Å; D248-C251 VanDerWaalsContact O-CB 3.31Å; D248-C251 WeakPolarHBondContact O-CB 3.39Å; D248-C251 PolarHBondContact O-N 2.71Å; D248-T252 PolarHBondContact O-N 2.96Å; D248-T252 VanDerWaalsContact O-N 3.1Å; D248-T252 PolarHBondContact O-OG1 3.01Å
249P92.5Very high88.4Confident0 Ų060.7 Ų60.70%030%0.296CS..Hα-helixtrans-58-41170.8-2528.9000114.5A153 R156 I157 F162 I246 C251 T252 F253A153-P249 HydrophobicContact CB-CB 4.23Å; R156-P249 HydrophobicContact CB-CG 4.11Å; R156-P249 HydrophobicContact CG-CG 3.98Å; I157-P249 HydrophobicContact CD1-CB 3.93Å; I157-P249 HydrophobicContact CG1-CB 3.72Å; I157-P249 HydrophobicContact CG1-CG 4.05Å; F162-P249 HydrophobicContact CE1-CG 4.02Å; I246-P249 WeakPolarHBondContact O-CD 3.25Å; P249-C251 VanDerWaalsContact C-N 3.25Å; P249-C251 PolarHBondContact O-N 3.07Å; P249-T252 WeakPolarHBondContact O-CB 3.29Å; P249-T252 PolarHBondContact O-N 3.26Å; P249-T252 VanDerWaalsContact O-N 3.15Å; P249-F253 WeakPolarHBondContact O-CD2 3.46Å; P249-F253 PolarHBondContact O-N 3.25Å
250I92.2Very high88.6Confident68 Ų6861 Ų6135%0.34930%0.298SS..Hα-helixtrans-60.7-41.4179.7-65.9170.3000109.9I246 I247 D248 F253 I254I246-I250 HydrophobicContact CG1-CD1 4.3Å; I246-I250 HydrophobicContact CG2-CD1 4.39Å; I246-I250 WeakPolarHBondContact O-CG1 3.43Å; I247-I250 HydrophobicContact CD1-CD1 4.46Å; I247-I250 PolarHBondContact O-N 3.39Å; D248-I250 VanDerWaalsContact C-N 3.35Å; D248-I250 PolarHBondContact O-N 2.97Å; I250-F253 PolarHBondContact O-N 2.96Å; I250-I254 HydrophobicContact CG2-CD1 4Å; I250-I254 WeakPolarHBondContact O-CG1 3.45Å; I250-I254 PolarHBondContact O-N 3.4Å
251C91Very high88.9Confident12 Ų1263.9 Ų63.98%0.08132%0.323CS..Hα-helixtrans-60-46.8175.2-1550000111A90 A236 I247 D248 P249 F253 I254 F255A90-C251 HydrophobicContact CB-CB 4.43Å; A236-C251 HydrophobicContact CB-CB 4.18Å; I247-C251 VanDerWaalsContact O-CB 3.29Å; I247-C251 WeakPolarHBondContact O-CB 3.47Å; I247-C251 PolarHBondContact O-N 3.39Å; D248-C251 VanDerWaalsContact O-CB 3.31Å; D248-C251 WeakPolarHBondContact O-CB 3.39Å; D248-C251 PolarHBondContact O-N 2.71Å; P249-C251 VanDerWaalsContact C-N 3.25Å; P249-C251 PolarHBondContact O-N 3.07Å; C251-F253 VanDerWaalsContact C-N 3.35Å; C251-F253 PolarHBondContact O-N 3.01Å; C251-I254 PolarHBondContact O-N 3.37Å; C251-I254 VanDerWaalsContact O-N 3.17Å; C251-F255 HydrophobicContact CB-CE2 4.33Å; C251-F255 VanDerWaalsContact O-CD2 3.29Å; C251-F255 WeakPolarHBondContact O-CD2 3.48Å; C251-F255 WeakPolarHBondContact O-CG 3.32Å; C251-F255 PolarHBondContact O-N 2.82Å; C251-F255 WeakPolarHBondContact SG-CE2 3.34Å; C251-F255 WeakPolarHBondContact SG-CZ 3.48Å
252T92.1Very high89Confident0 Ų062.5 Ų62.50%033%0.325CS..Hα-helixtrans-57.8-42.1174.5-63.80000112.6L89 T93 L149 A153 D248 P249 F255 S256L89-T252 HydrophobicContact CD2-CG2 4.19Å; L89-T252 HydrophobicContact CG-CG2 4.37Å; T93-T252 HydrophobicContact CG2-CG2 4.29Å; T93-T252 WeakPolarHBondContact OG1-CG2 3.32Å; T93-T252 PolarHBondContact OG1-OG1 3.3Å; L149-T252 HydrophobicContact CB-CG2 4.24Å; A153-T252 HydrophobicContact CB-CG2 3.93Å; D248-T252 PolarHBondContact O-N 2.96Å; D248-T252 VanDerWaalsContact O-N 3.1Å; D248-T252 PolarHBondContact O-OG1 3.01Å; P249-T252 WeakPolarHBondContact O-CB 3.29Å; P249-T252 PolarHBondContact O-N 3.26Å; P249-T252 VanDerWaalsContact O-N 3.15Å; T252-F255 PolarHBondContact O-N 2.94Å; T252-S256 VanDerWaalsContact O-CB 3.28Å; T252-S256 WeakPolarHBondContact O-CB 3.43Å; T252-S256 PolarHBondContact O-N 3.36Å; T252-S256 PolarHBondContact O-OG 3.36Å
253F94.5Very high89.3Confident73 Ų7355.5 Ų55.532%0.3230%0.295SS..Hα-helixtrans-63.1-43.5175.4-76.6-69.9000112.5V150 A153 A154 I157 P249 I250 C251 S256 L257V150-F253 HydrophobicContact CG1-CD1 4.19Å; V150-F253 HydrophobicContact CG1-CE1 3.75Å; A153-F253 HydrophobicContact CB-CD2 4.25Å; A153-F253 HydrophobicContact CB-CE1 4.49Å; A153-F253 HydrophobicContact CB-CE2 3.75Å; A153-F253 HydrophobicContact CB-CZ 3.91Å; A154-F253 HydrophobicContact CB-CZ 4.02Å; I157-F253 HydrophobicContact CD1-CD2 4.4Å; I157-F253 HydrophobicContact CD1-CE2 3.66Å; P249-F253 WeakPolarHBondContact O-CD2 3.46Å; P249-F253 PolarHBondContact O-N 3.25Å; I250-F253 PolarHBondContact O-N 2.96Å; C251-F253 VanDerWaalsContact C-N 3.35Å; C251-F253 PolarHBondContact O-N 3.01Å; F253-S256 PolarHBondContact O-N 2.82Å; F253-L257 PolarHBondContact O-N 3.47Å
254I92.8Very high90.1Very high93 Ų9349.5 Ų49.548%0.47727%0.27SS..Hα-helixtrans-61.8-47.7178.7-69168.2000110I250 C251 L257 L258I250-I254 HydrophobicContact CG2-CD1 4Å; I250-I254 WeakPolarHBondContact O-CG1 3.45Å; I250-I254 PolarHBondContact O-N 3.4Å; C251-I254 PolarHBondContact O-N 3.37Å; C251-I254 VanDerWaalsContact O-N 3.17Å; I254-L257 PolarHBondContact O-N 3.39Å; I254-L258 HydrophobicContact CG2-CD1 4.25Å; I254-L258 WeakPolarHBondContact O-CG 3.37Å; I254-L258 PolarHBondContact O-N 2.87Å
255F89.7Confident90.5Very high10 Ų1049.9 Ų49.94%0.04427%0.269CS..Hα-helixtrans-64.9-40.9178-61.6-36.5000112.8Q229 V233 C251 T252 L257 L258 V259Q229-F255 HydrophobicContact CB-CE1 4.44Å; Q229-F255 HydrophobicContact CG-CD1 4.03Å; Q229-F255 HydrophobicContact CG-CE1 4.38Å; Q229-F255 HydrophobicContact CG-CG 4.41Å; Q229-F255 VanDerWaalsContact O-CZ 3.25Å; Q229-F255 WeakPolarHBondContact O-CZ 2.96Å; V233-F255 HydrophobicContact CG2-CE2 3.57Å; V233-F255 HydrophobicContact CG2-CZ 3.99Å; C251-F255 HydrophobicContact CB-CE2 4.33Å; C251-F255 VanDerWaalsContact O-CD2 3.29Å; C251-F255 WeakPolarHBondContact O-CD2 3.48Å; C251-F255 WeakPolarHBondContact O-CG 3.32Å; C251-F255 PolarHBondContact O-N 2.82Å; C251-F255 WeakPolarHBondContact SG-CE2 3.34Å; C251-F255 WeakPolarHBondContact SG-CZ 3.48Å; T252-F255 PolarHBondContact O-N 2.94Å; F255-L257 VanDerWaalsContact C-N 3.26Å; F255-L257 PolarHBondContact O-N 3.43Å; F255-L258 HydrophobicContact CD1-CD1 4.31Å; F255-L258 PolarHBondContact O-N 3.2Å; F255-L258 VanDerWaalsContact O-N 3.11Å; F255-V259 WeakPolarHBondContact O-CG2 3.38Å; F255-V259 PolarHBondContact O-N 3.38Å
256S92.5Very high90.7Very high5 Ų550.2 Ų50.24%0.03527%0.272CS..Hα-helixtrans-57.9-41.5175.3-62.30000111.6V150 T252 F253 L260V150-S256 VanDerWaalsContact CG2-CB 3.43Å; V150-S256 VanDerWaalsContact CG2-OG 3.3Å; V150-S256 WeakPolarHBondContact CG2-OG 3.34Å; T252-S256 VanDerWaalsContact O-CB 3.28Å; T252-S256 WeakPolarHBondContact O-CB 3.43Å; T252-S256 PolarHBondContact O-N 3.36Å; T252-S256 PolarHBondContact O-OG 3.36Å; F253-S256 PolarHBondContact O-N 2.82Å; S256-L260 VanDerWaalsContact O-CB 3.26Å; S256-L260 WeakPolarHBondContact O-CB 3.26Å; S256-L260 PolarHBondContact O-N 3.26Å
257L92.7Very high90.9Very high120 Ų12047.9 Ų47.963%0.62826%0.261SS*.Hα-helixtrans-67.2-40.2176.3-176.262.7000112.1F253 I254 F255 L260 A261F253-L257 PolarHBondContact O-N 3.47Å; I254-L257 PolarHBondContact O-N 3.39Å; F255-L257 VanDerWaalsContact C-N 3.26Å; F255-L257 PolarHBondContact O-N 3.43Å; L257-L260 PolarHBondContact O-N 2.84Å; L257-A261 WeakPolarHBondContact O-CB 3.48Å; L257-A261 PolarHBondContact O-N 3.35Å
258L89.5Confident91Very high85 Ų8552.6 Ų52.645%0.44528%0.279SS..Hα-helixtrans-63.5-48.4176.8-71.1174.7000111.6I254 F255 L260 A261 T262I254-L258 HydrophobicContact CG2-CD1 4.25Å; I254-L258 WeakPolarHBondContact O-CG 3.37Å; I254-L258 PolarHBondContact O-N 2.87Å; F255-L258 HydrophobicContact CD1-CD1 4.31Å; F255-L258 PolarHBondContact O-N 3.2Å; F255-L258 VanDerWaalsContact O-N 3.11Å; L258-L260 VanDerWaalsContact C-N 3.33Å; L258-L260 PolarHBondContact O-N 3.38Å; L258-A261 PolarHBondContact O-N 3.2Å; L258-T262 WeakPolarHBondContact O-CG2 3.45Å; L258-T262 PolarHBondContact O-N 2.94Å; L258-T262 PolarHBondContact O-OG1 3.37Å
259V89Confident91Very high14 Ų1453.9 Ų53.99%0.08529%0.287CS..Hα-helixtrans-62.7-40.6177.6172.40000111I142 F255 T262 T263I142-V259 HydrophobicContact CG2-CG1 3.45Å; I142-V259 VanDerWaalsContact CG2-CG1 3.45Å; F255-V259 WeakPolarHBondContact O-CG2 3.38Å; F255-V259 PolarHBondContact O-N 3.38Å; V259-T262 PolarHBondContact O-OG1 3.07Å; V259-T263 HydrophobicContact CG1-CG2 4.31Å; V259-T263 WeakPolarHBondContact O-CB 3.44Å; V259-T263 VanDerWaalsContact O-CG2 3.28Å; V259-T263 WeakPolarHBondContact O-CG2 3.32Å; V259-T263 PolarHBondContact O-N 3.11Å; V259-T263 PolarHBondContact O-OG1 3.14Å
260L92Very high90.9Very high71 Ų7153.9 Ų53.937%0.37229%0.287SS..Hα-helixtrans-64-44.4175.7-173.862.4000111.4W143 S256 L257 L258 T262 T263 V264W143-L260 HydrophobicContact CD2-CD1 4.17Å; W143-L260 HydrophobicContact CG-CD1 4.34Å; W143-L260 HydrophobicContact CZ2-CD1 4.1Å; S256-L260 VanDerWaalsContact O-CB 3.26Å; S256-L260 WeakPolarHBondContact O-CB 3.26Å; S256-L260 PolarHBondContact O-N 3.26Å; L257-L260 PolarHBondContact O-N 2.84Å; L258-L260 VanDerWaalsContact C-N 3.33Å; L258-L260 PolarHBondContact O-N 3.38Å; L260-T262 PolarHBondContact O-N 3.37Å; L260-T263 PolarHBondContact O-N 3.27Å; L260-T263 PolarHBondContact O-OG1 2.97Å; L260-V264 HydrophobicContact CD1-CG2 3.98Å; L260-V264 HydrophobicContact CG-CG2 4.16Å; L260-V264 WeakPolarHBondContact O-CB 3.39Å; L260-V264 WeakPolarHBondContact O-CG2 3.45Å; L260-V264 PolarHBondContact O-N 3.29Å
261A91.3Very high91Very high67 Ų6753.8 Ų53.855%0.55429%0.289SS*.Hα-helixtrans-62.2-42-179.600000112.6L257 L258L257-A261 WeakPolarHBondContact O-CB 3.48Å; L257-A261 PolarHBondContact O-N 3.35Å; L258-A261 PolarHBondContact O-N 3.2Å
262T85.2Confident91.1Very high91 Ų9155.8 Ų55.856%0.55830%0.299SS*.Hα-helixtrans-70.8-41.1178.556.50000111.8L258 V259 L260L258-T262 WeakPolarHBondContact O-CG2 3.45Å; L258-T262 PolarHBondContact O-N 2.94Å; L258-T262 PolarHBondContact O-OG1 3.37Å; V259-T262 PolarHBondContact O-OG1 3.07Å; L260-T262 PolarHBondContact O-N 3.37Å
263T89.3Confident91.1Very high10 Ų1056 Ų566%0.06130%0.3CS..Hα-helixtrans-78.5-26.3-177.157.20000114.2I142 W143 V259 L260 H265 I266 M267I142-T263 HydrophobicContact CD1-CG2 4.27Å; I142-T263 HydrophobicContact CG2-CG2 4.2Å; W143-T263 PolarHBondContact NE1-OG1 3.2Å; V259-T263 HydrophobicContact CG1-CG2 4.31Å; V259-T263 WeakPolarHBondContact O-CB 3.44Å; V259-T263 VanDerWaalsContact O-CG2 3.28Å; V259-T263 WeakPolarHBondContact O-CG2 3.32Å; V259-T263 PolarHBondContact O-N 3.11Å; V259-T263 PolarHBondContact O-OG1 3.14Å; L260-T263 PolarHBondContact O-N 3.27Å; L260-T263 PolarHBondContact O-OG1 2.97Å; T263-H265 PolarHBondContact O-N 3Å; T263-I266 WeakPolarHBondContact O-CB 3.21Å; T263-I266 PolarHBondContact O-N 2.8Å; T263-I266 VanDerWaalsContact O-N 3.12Å; T263-M267 PolarHBondContact O-N 3.2Å
264V93Very high91Very high48 Ų4855.2 Ų55.229%0.29130%0.299SS..Hα-helixtrans-59.5-35.2173.6163.30000111.7W143 L260 M267 K268W143-V264 HydrophobicContact CH2-CG2 4.27Å; W143-V264 HydrophobicContact CZ2-CG2 3.62Å; L260-V264 HydrophobicContact CD1-CG2 3.98Å; L260-V264 HydrophobicContact CG-CG2 4.16Å; L260-V264 WeakPolarHBondContact O-CB 3.39Å; L260-V264 WeakPolarHBondContact O-CG2 3.45Å; L260-V264 PolarHBondContact O-N 3.29Å; V264-M267 PolarHBondContact O-N 3.35Å; V264-K268 WeakPolarHBondContact O-CG 3.46Å; V264-K268 PolarHBondContact O-N 3.17Å
265H88.9Confident91Very high100 Ų10057.8 Ų57.846%0.46331%0.31SS..Hα-helixtrans-64.2-43.6175.7-176.182.6000111.9T263 K268 D269 R280T263-H265 PolarHBondContact O-N 3Å; H265-K268 PolarHBondContact O-N 3.03Å; H265-D269 IonicContact CD2-OD2 3.42Å; H265-D269 IonicContact NE2-OD2 3.79Å; H265-D269 PolarHBondContact O-N 3.49Å; H265-R280 VanDerWaalsContact CE1-CZ 3.49Å; H265-R280 PolarHBondContact CE1-NH1 2.68Å; H265-R280 PolarHBondContact CE1-NH2 3.32Å; H265-R280 PolarHBondContact NE2-NH1 3.42Å
266I88.2Confident91.2Very high76 Ų7662.8 Ų62.839%0.3933%0.334SS..Hα-helixtrans-65-43.8176.5-57.6174000110.1V139 T263 K268 D269 V270V139-I266 HydrophobicContact CG2-CB 4.42Å; V139-I266 HydrophobicContact CG2-CG2 3.94Å; T263-I266 WeakPolarHBondContact O-CB 3.21Å; T263-I266 PolarHBondContact O-N 2.8Å; T263-I266 VanDerWaalsContact O-N 3.12Å; I266-K268 VanDerWaalsContact C-N 3.3Å; I266-K268 PolarHBondContact O-N 3.29Å; I266-D269 PolarHBondContact O-N 2.86Å; I266-D269 VanDerWaalsContact O-N 3.08Å; I266-V270 HydrophobicContact CG2-CG2 4.38Å; I266-V270 WeakPolarHBondContact O-CG2 3.46Å; I266-V270 PolarHBondContact O-N 3.21Å
267M92.5Very high91.1Very high25 Ų2563.4 Ų63.412%0.12334%0.341CS..Hα-helixtrans-55.8-44.6176.1-176.262.895.200111.6L136 V139 I140 W143 T263 V264 D269 V270 V271L136-M267 HydrophobicContact CD1-CE 4.21Å; L136-M267 HydrophobicContact CD1-SD 3.64Å; V139-M267 HydrophobicContact CB-CE 4.29Å; V139-M267 HydrophobicContact CG1-CB 4.16Å; V139-M267 HydrophobicContact CG1-CE 3.66Å; V139-M267 HydrophobicContact CG1-SD 4.33Å; I140-M267 HydrophobicContact CG1-CE 4.08Å; W143-M267 HydrophobicContact CD2-CE 4.42Å; W143-M267 HydrophobicContact CE3-CE 4.13Å; W143-M267 HydrophobicContact CH2-CB 4.32Å; W143-M267 HydrophobicContact CH2-CE 3.86Å; W143-M267 HydrophobicContact CH2-CG 3.94Å; W143-M267 HydrophobicContact CZ2-CB 4.08Å; W143-M267 HydrophobicContact CZ2-CE 4.14Å; W143-M267 HydrophobicContact CZ2-CG 4.19Å; W143-M267 HydrophobicContact CZ3-CE 3.85Å; T263-M267 PolarHBondContact O-N 3.2Å; V264-M267 PolarHBondContact O-N 3.35Å; M267-D269 VanDerWaalsContact C-N 3.27Å; M267-D269 PolarHBondContact O-N 3.36Å; M267-V270 PolarHBondContact O-N 2.97Å; M267-V271 HydrophobicContact CG-CG2 4.32Å; M267-V271 WeakPolarHBondContact O-CB 3.44Å; M267-V271 VanDerWaalsContact O-CG2 3.29Å; M267-V271 WeakPolarHBondContact O-CG2 3.43Å; M267-V271 PolarHBondContact O-N 3.07Å; M267-V271 HydrophobicContact SD-CG2 4.2Å
268K92.5Very high91.1Very high136 Ų13659.7 Ų59.759%0.59133%0.325SS*.Hα-helixtrans-60.3-37.8177.7-75.3176.4178.1-179.60112.3V264 H265 I266 N272V264-K268 WeakPolarHBondContact O-CG 3.46Å; V264-K268 PolarHBondContact O-N 3.17Å; H265-K268 PolarHBondContact O-N 3.03Å; I266-K268 VanDerWaalsContact C-N 3.3Å; I266-K268 PolarHBondContact O-N 3.29Å; K268-N272 VanDerWaalsContact O-CB 3.32Å; K268-N272 WeakPolarHBondContact O-CB 3.32Å; K268-N272 PolarHBondContact O-N 3.18Å
269D89.5Confident91Very high28 Ų2856.5 Ų56.515%0.1531%0.309CS..Hα-helixtrans-70.2-44.9177.5-71.5-29.5000112.4H265 I266 M267 V271 N272 V273 R280 M310H265-D269 IonicContact CD2-OD2 3.42Å; H265-D269 IonicContact NE2-OD2 3.79Å; H265-D269 PolarHBondContact O-N 3.49Å; I266-D269 PolarHBondContact O-N 2.86Å; I266-D269 VanDerWaalsContact O-N 3.08Å; M267-D269 VanDerWaalsContact C-N 3.27Å; M267-D269 PolarHBondContact O-N 3.36Å; D269-V271 VanDerWaalsContact C-N 3.32Å; D269-V271 PolarHBondContact O-N 3.16Å; D269-N272 WeakPolarHBondContact O-CB 3.23Å; D269-N272 PolarHBondContact O-N 3.29Å; D269-V273 WeakPolarHBondContact O-CG2 3.34Å; D269-V273 PolarHBondContact O-N 3.24Å; D269-R280 IonicContact OD1-CZ 3.91Å; D269-R280 IonicContact OD1-NE 3.18Å; D269-R280 PolarHBondContact OD1-NE 3.38Å; D269-R280 IonicContact OD1-NH1 3.14Å; D269-R280 PolarHBondContact OD1-NH1 3.08Å; D269-R280 IonicContact OD1-NH2 3.86Å; D269-R280 PolarHBondContact OD1-NH2 3.33Å; D269-R280 IonicContact OD2-CZ 2.65Å; D269-R280 IonicContact OD2-NE 3.94Å; D269-R280 IonicContact OD2-NH1 2.83Å; D269-R280 PolarHBondContact OD2-NH1 3.47Å; D269-R280 IonicContact OD2-NH2 3.81Å; D269-R280 PolarHBondContact OD2-NH2 3.43Å; D269-M310 HydrophobicContact CB-CE 3.62Å; D269-M310 HydrophobicContact CB-SD 4.35Å
270V90.9Very high90.7Very high0 Ų062.4 Ų62.40%033%0.33CS..Hα-helixtrans-58.1-47.5174.8171.80000110.6V132 A135 L136 I266 M267 N272 V273 L274 M310V132-V270 HydrophobicContact CG1-CG1 3.91Å; A135-V270 HydrophobicContact CB-CG2 3.82Å; L136-V270 HydrophobicContact CB-CG1 3.67Å; L136-V270 HydrophobicContact CD1-CG1 3.96Å; L136-V270 HydrophobicContact CG-CG1 4.35Å; I266-V270 HydrophobicContact CG2-CG2 4.38Å; I266-V270 WeakPolarHBondContact O-CG2 3.46Å; I266-V270 PolarHBondContact O-N 3.21Å; M267-V270 PolarHBondContact O-N 2.97Å; V270-N272 PolarHBondContact O-N 3.27Å; V270-V273 PolarHBondContact O-N 3.41Å; V270-L274 HydrophobicContact CG1-CD1 4.1Å; V270-L274 WeakPolarHBondContact O-CG 3.5Å; V270-L274 PolarHBondContact O-N 3.34Å; V270-M310 HydrophobicContact CG2-CE 4.38Å
271V93.9Very high90.3Very high65 Ų6563.1 Ų63.139%0.39435%0.354SS..Hα-helixtrans-62.9-41.6176.8171.90000111.2M267 D269 V273 L274 M275M267-V271 HydrophobicContact CG-CG2 4.32Å; M267-V271 WeakPolarHBondContact O-CB 3.44Å; M267-V271 VanDerWaalsContact O-CG2 3.29Å; M267-V271 WeakPolarHBondContact O-CG2 3.43Å; M267-V271 PolarHBondContact O-N 3.07Å; M267-V271 HydrophobicContact SD-CG2 4.2Å; D269-V271 VanDerWaalsContact C-N 3.32Å; D269-V271 PolarHBondContact O-N 3.16Å; V271-V273 VanDerWaalsContact C-N 3.32Å; V271-V273 PolarHBondContact O-N 3.32Å; V271-L274 PolarHBondContact O-N 3.38Å; V271-M275 HydrophobicContact CG1-CG 3.93Å; V271-M275 VanDerWaalsContact O-CB 3.32Å; V271-M275 WeakPolarHBondContact O-CB 3.26Å; V271-M275 WeakPolarHBondContact O-CG 3.16Å; V271-M275 PolarHBondContact O-N 2.89Å
272N92.4Very high90.3Very high54 Ų5461.2 Ų61.229%0.28934%0.335SS..Hα-helixtrans-58.5-42.7176.7-174.671.2000111.9K268 D269 V270 M275 E276 G277 S278K268-N272 VanDerWaalsContact O-CB 3.32Å; K268-N272 WeakPolarHBondContact O-CB 3.32Å; K268-N272 PolarHBondContact O-N 3.18Å; D269-N272 WeakPolarHBondContact O-CB 3.23Å; D269-N272 PolarHBondContact O-N 3.29Å; V270-N272 PolarHBondContact O-N 3.27Å; N272-M275 PolarHBondContact O-N 3.45Å; N272-E276 PolarHBondContact O-N 2.81Å; N272-G277 WeakPolarHBondContact O-CA 3.25Å; N272-G277 PolarHBondContact O-N 2.71Å; N272-S278 PolarHBondContact ND2-O 3.27Å
273V91.9Very high90.5Very high4 Ų461.4 Ų61.42%0.02433%0.332CS..Hα-helixtrans-68.3-38177.1179.10000112R129 V132 D269 V270 V271 E276 M310R129-V273 PolarHBondContact NH1-O 3.49Å; R129-V273 VanDerWaalsContact NH1-O 3.14Å; V132-V273 HydrophobicContact CB-CG1 4.44Å; V132-V273 HydrophobicContact CG1-CB 4.1Å; V132-V273 HydrophobicContact CG1-CG1 4.02Å; V132-V273 HydrophobicContact CG2-CB 4.43Å; V132-V273 HydrophobicContact CG2-CG1 3.59Å; D269-V273 WeakPolarHBondContact O-CG2 3.34Å; D269-V273 PolarHBondContact O-N 3.24Å; V270-V273 PolarHBondContact O-N 3.41Å; V271-V273 VanDerWaalsContact C-N 3.32Å; V271-V273 PolarHBondContact O-N 3.32Å; V273-E276 PolarHBondContact O-N 3.22Å; V273-M310 HydrophobicContact CG2-SD 3.91Å
274L92.5Very high90.7Very high58 Ų5863.1 Ų63.130%0.30434%0.339SS..Hα-helixtrans-69.3-34.1176.4-68.9175.9000112.7V132 L133 L136 V270 V271 E276V132-L274 HydrophobicContact CB-CD2 4.46Å; V132-L274 HydrophobicContact CG1-CD1 4.49Å; V132-L274 HydrophobicContact CG1-CD2 3.8Å; V132-L274 HydrophobicContact CG1-CG 3.8Å; L133-L274 HydrophobicContact CD2-CD2 4.27Å; L136-L274 HydrophobicContact CD2-CD1 3.89Å; V270-L274 HydrophobicContact CG1-CD1 4.1Å; V270-L274 WeakPolarHBondContact O-CG 3.5Å; V270-L274 PolarHBondContact O-N 3.34Å; V271-L274 PolarHBondContact O-N 3.38Å; L274-E276 PolarHBondContact O-N 2.85Å
275M93.7Very high90.7Very high146 Ų14665.5 Ų65.572%0.71935%0.354SS*.THydrogen-bonded Turntrans-80.57176.2-67.3-61.7-62.300113.3V271 N272 G277V271-M275 HydrophobicContact CG1-CG 3.93Å; V271-M275 VanDerWaalsContact O-CB 3.32Å; V271-M275 WeakPolarHBondContact O-CB 3.26Å; V271-M275 WeakPolarHBondContact O-CG 3.16Å; V271-M275 PolarHBondContact O-N 2.89Å; N272-M275 PolarHBondContact O-N 3.45Å; M275-G277 PolarHBondContact O-N 3.03Å
276E92.9Very high90.9Very high116 Ų11663.7 Ų63.754%0.54235%0.345SS..THydrogen-bonded Turntrans58.532.6-177.9-51.1-168.6151.700112.8R129 N272 V273 L274 W306R129-E276 IonicContact NH2-OE1 2.89Å; R129-E276 PolarHBondContact NH2-OE1 3.01Å; N272-E276 PolarHBondContact O-N 2.81Å; V273-E276 PolarHBondContact O-N 3.22Å; L274-E276 PolarHBondContact O-N 2.85Å; E276-W306 HydrophobicContact CB-CB 4.08Å; E276-W306 WeakPolarHBondContact O-CB 3.35Å
277G91.7Very high91.2Very high17 Ų1760.1 Ų60.118%0.17533%0.327CS..PPolyproline II helixtrans-72.1156177.800000113.2N272 M275 S307N272-G277 WeakPolarHBondContact O-CA 3.25Å; N272-G277 PolarHBondContact O-N 2.71Å; M275-G277 PolarHBondContact O-N 3.03Å; G277-S307 PolarHBondContact O-N 2.94Å; G277-S307 PolarHBondContact O-OG 3.01Å
278S91.5Very high91.4Very high43 Ų4361 Ų6130%0.30133%0.332SS..PPolyproline II helixtrans-61138.6173.2-172.80000110.3N272N272-S278 PolarHBondContact ND2-O 3.27Å
279P87.7Confident91.5Very high17 Ų1759.8 Ų59.811%0.1132%0.324CS..PPolyproline II helixtrans-62.6151.8176.628.5-37.6000111.5G281 I282 I305 S307 I313P279-G281 PolarHBondContact O-N 2.88Å; P279-I282 HydrophobicContact CG-CB 4.06Å; P279-I282 HydrophobicContact CG-CD1 3.64Å; P279-I282 HydrophobicContact CG-CG1 3.84Å; P279-I282 PolarHBondContact O-N 3.36Å; P279-I305 HydrophobicContact CG-CG2 4.36Å; P279-S307 WeakPolarHBondContact CA-OG 3.39Å; P279-S307 WeakPolarHBondContact CB-OG 3.33Å; P279-I313 HydrophobicContact CB-CD1 4.35Å; P279-I313 HydrophobicContact CB-CG1 4.17Å; P279-I313 HydrophobicContact CG-CD1 4Å; P279-I313 HydrophobicContact CG-CG1 3.88Å; P279-I313 HydrophobicContact CG-CG2 4.09Å
280R82.5Confident91.8Very high139 Ų13960.7 Ų60.753%0.52533%0.326SS..THydrogen-bonded Turntrans-64.8131.7174.7-71.1-175174.4167.46.2110.5H265 D269H265-R280 VanDerWaalsContact CE1-CZ 3.49Å; H265-R280 PolarHBondContact CE1-NH1 2.68Å; H265-R280 PolarHBondContact CE1-NH2 3.32Å; H265-R280 PolarHBondContact NE2-NH1 3.42Å; D269-R280 IonicContact OD1-CZ 3.91Å; D269-R280 IonicContact OD1-NE 3.18Å; D269-R280 PolarHBondContact OD1-NE 3.38Å; D269-R280 IonicContact OD1-NH1 3.14Å; D269-R280 PolarHBondContact OD1-NH1 3.08Å; D269-R280 IonicContact OD1-NH2 3.86Å; D269-R280 PolarHBondContact OD1-NH2 3.33Å; D269-R280 IonicContact OD2-CZ 2.65Å; D269-R280 IonicContact OD2-NE 3.94Å; D269-R280 IonicContact OD2-NH1 2.83Å; D269-R280 PolarHBondContact OD2-NH1 3.47Å; D269-R280 IonicContact OD2-NH2 3.81Å; D269-R280 PolarHBondContact OD2-NH2 3.43Å
281G85.3Confident92.1Very high85 Ų8560.7 Ų60.788%0.87633%0.326SS*.THydrogen-bonded Turntrans95-9.4177.200000115P279P279-G281 PolarHBondContact O-N 2.88Å
282I89.2Confident92.2Very high27 Ų2759.2 Ų59.214%0.13832%0.324CS..  trans-92.6113.4168.4-61-166.5000109P279 F284 V287 I305 I313 Y342P279-I282 HydrophobicContact CG-CB 4.06Å; P279-I282 HydrophobicContact CG-CD1 3.64Å; P279-I282 HydrophobicContact CG-CG1 3.84Å; P279-I282 PolarHBondContact O-N 3.36Å; I282-F284 PolarHBondContact O-N 3.49Å; I282-V287 HydrophobicContact CG2-CG2 3.67Å; I282-I305 HydrophobicContact CG2-CD1 3.97Å; I282-I305 HydrophobicContact CG2-CG2 4.42Å; I282-I313 HydrophobicContact CD1-CD1 3.64Å; I282-I313 HydrophobicContact CD1-CG2 4.19Å; I282-Y342 HydrophobicContact CD1-CD1 4.12Å; I282-Y342 HydrophobicContact CG1-CD1 4.23Å; I282-Y342 HydrophobicContact CG2-CD1 4.13Å; I282-Y342 HydrophobicContact CG2-CE1 4.38Å
283D91.2Very high92.4Very high95 Ų9561.5 Ų61.551%0.50834%0.336SS..  trans-81.5115170.3-173-25.8000109.4T285 E286 V287D283-T285 VanDerWaalsContact C-N 3.27Å; D283-T285 PolarHBondContact O-N 3.3Å; D283-T285 WeakPolarHBondContact OD1-CB 3.48Å; D283-T285 PolarHBondContact OD1-N 2.89Å; D283-E286 HydrophobicContact CB-CB 3.79Å; D283-E286 PolarHBondContact O-N 2.94Å; D283-E286 PolarHBondContact OD1-N 2.95Å; D283-V287 WeakPolarHBondContact O-CG2 3.35Å; D283-V287 PolarHBondContact O-N 3.16Å; D283-V287 VanDerWaalsContact O-N 3.07Å
284F92.4Very high92.6Very high46 Ų4662 Ų6220%0.20234%0.339CS..Hα-helixtrans-55.2-41.8177.6-177.8-90.6000112.4I282 V287 I288 L303 I305 P366 P367I282-F284 PolarHBondContact O-N 3.49Å; F284-V287 PolarHBondContact O-N 2.93Å; F284-I288 HydrophobicContact CD1-CD1 3.93Å; F284-I288 HydrophobicContact CD1-CG1 4.47Å; F284-I288 HydrophobicContact CE1-CD1 3.29Å; F284-I288 HydrophobicContact CE1-CG1 4.14Å; F284-I288 HydrophobicContact CZ-CD1 3.89Å; F284-I288 PolarHBondContact O-N 2.88Å; F284-I288 VanDerWaalsContact O-N 3.11Å; F284-L303 HydrophobicContact CD2-CD2 4.01Å; F284-L303 HydrophobicContact CD2-CG 4.32Å; F284-L303 HydrophobicContact CE1-CD2 4.45Å; F284-L303 HydrophobicContact CE2-CB 4.01Å; F284-L303 HydrophobicContact CE2-CD2 3.71Å; F284-L303 HydrophobicContact CE2-CG 3.68Å; F284-L303 VanDerWaalsContact CE2-O 3.27Å; F284-L303 WeakPolarHBondContact CE2-O 3.24Å; F284-L303 HydrophobicContact CG-CD2 4.49Å; F284-L303 HydrophobicContact CZ-CB 3.95Å; F284-L303 HydrophobicContact CZ-CD2 3.95Å; F284-L303 HydrophobicContact CZ-CG 4.08Å; F284-I305 HydrophobicContact CD2-CD1 4.12Å; F284-I305 HydrophobicContact CD2-CG1 4.45Å; F284-P366 HydrophobicContact CE1-CB 3.99Å; F284-P367 HydrophobicContact CE1-CG 3.93Å; F284-P367 HydrophobicContact CE2-CG 4.48Å; F284-P367 HydrophobicContact CZ-CG 3.84Å
285T92.3Very high92.7Very high98 Ų9865.1 Ų65.160%0.60136%0.356SS*.Hα-helixtrans-69.2-37.5-179.7-58.70000111.1D283 V287 I288 R289D283-T285 VanDerWaalsContact C-N 3.27Å; D283-T285 PolarHBondContact O-N 3.3Å; D283-T285 WeakPolarHBondContact OD1-CB 3.48Å; D283-T285 PolarHBondContact OD1-N 2.89Å; T285-V287 VanDerWaalsContact C-N 3.34Å; T285-I288 PolarHBondContact O-N 3.34Å; T285-R289 WeakPolarHBondContact O-CB 3.4Å; T285-R289 PolarHBondContact O-N 3.31Å
286E94.2Very high92.6Very high62 Ų6258.7 Ų58.729%0.2933%0.327SS..Hα-helixtrans-65.6-38.2176.1-177.561-174.300111.8D283 R289 K290D283-E286 HydrophobicContact CB-CB 3.79Å; D283-E286 PolarHBondContact O-N 2.94Å; D283-E286 PolarHBondContact OD1-N 2.95Å; E286-R289 PolarHBondContact O-N 3.16Å; E286-R289 IonicContact OE1-CZ 2.62Å; E286-R289 IonicContact OE1-NE 2.91Å; E286-R289 IonicContact OE1-NH2 3.61Å; E286-R289 PolarHBondContact OE1-NH2 2.98Å; E286-R289 IonicContact OE2-CZ 3.87Å; E286-R289 IonicContact OE2-NE 2.88Å; E286-R289 PolarHBondContact OE2-NE 2.91Å; E286-R289 IonicContact OE2-NH2 2.94Å; E286-R289 PolarHBondContact OE2-NH2 2.84Å; E286-K290 WeakPolarHBondContact O-CG 3.4Å; E286-K290 PolarHBondContact O-N 3.44Å; E286-K290 WeakPolarHBondContact OE1-CE 3.44Å; E286-K290 IonicContact OE1-NZ 3.95Å
287V95.4Very high92.8Very high1 Ų153.8 Ų53.81%0.00631%0.305CS..Hα-helixtrans-64.2-45.6174.9176.60000111.1I282 D283 F284 T285 R289 K290 L291 L303 I305 L338 Y342I282-V287 HydrophobicContact CG2-CG2 3.67Å; D283-V287 WeakPolarHBondContact O-CG2 3.35Å; D283-V287 PolarHBondContact O-N 3.16Å; D283-V287 VanDerWaalsContact O-N 3.07Å; F284-V287 PolarHBondContact O-N 2.93Å; T285-V287 VanDerWaalsContact C-N 3.34Å; V287-R289 VanDerWaalsContact C-N 3.32Å; V287-R289 PolarHBondContact O-N 2.99Å; V287-K290 PolarHBondContact O-N 3.36Å; V287-L291 HydrophobicContact CG1-CD1 3.85Å; V287-L291 HydrophobicContact CG1-CG 4.38Å; V287-L291 WeakPolarHBondContact O-CB 3.24Å; V287-L291 WeakPolarHBondContact O-CG 3.19Å; V287-L291 PolarHBondContact O-N 2.78Å; V287-L303 HydrophobicContact CB-CD2 4.12Å; V287-L303 HydrophobicContact CG1-CD1 4.18Å; V287-L303 HydrophobicContact CG1-CD2 3.82Å; V287-I305 HydrophobicContact CB-CD1 4.06Å; V287-I305 HydrophobicContact CG1-CD1 4.1Å; V287-I305 HydrophobicContact CG2-CD1 3.87Å; V287-L338 HydrophobicContact CG1-CD2 4.03Å; V287-Y342 HydrophobicContact CG2-CD1 4.01Å; V287-Y342 HydrophobicContact CG2-CD2 4.49Å; V287-Y342 HydrophobicContact CG2-CE1 3.54Å; V287-Y342 HydrophobicContact CG2-CE2 4.09Å; V287-Y342 HydrophobicContact CG2-CG 4.45Å
288I94.8Very high92.8Very high43 Ų4354.4 Ų54.422%0.22131%0.308CS..Hα-helixtrans-56.8-48.3174.5-72.7-174.7000110.7F284 T285 K290 L291 G292 V300 L303 P366F284-I288 HydrophobicContact CD1-CD1 3.93Å; F284-I288 HydrophobicContact CD1-CG1 4.47Å; F284-I288 HydrophobicContact CE1-CD1 3.29Å; F284-I288 HydrophobicContact CE1-CG1 4.14Å; F284-I288 HydrophobicContact CZ-CD1 3.89Å; F284-I288 PolarHBondContact O-N 2.88Å; F284-I288 VanDerWaalsContact O-N 3.11Å; T285-I288 PolarHBondContact O-N 3.34Å; I288-K290 PolarHBondContact O-N 2.95Å; I288-L291 PolarHBondContact O-N 3.34Å; I288-G292 PolarHBondContact O-N 2.96Å; I288-V300 HydrophobicContact CG1-CG1 4.48Å; I288-V300 HydrophobicContact CG2-CB 4.41Å; I288-L303 HydrophobicContact CD1-CD2 4.17Å; I288-L303 HydrophobicContact CG1-CB 4.47Å; I288-L303 HydrophobicContact CG1-CD2 3.38Å; I288-P366 HydrophobicContact CD1-CB 3.84Å
289R95.2Very high92.9Very high112 Ų11254.8 Ų54.842%0.42330%0.304SS..Hα-helixtrans-58.9-50.7-178.1-168.4-168.266.666.35.5110.8T285 E286 V287 L291 G292 D293T285-R289 WeakPolarHBondContact O-CB 3.4Å; T285-R289 PolarHBondContact O-N 3.31Å; E286-R289 PolarHBondContact O-N 3.16Å; E286-R289 IonicContact OE1-CZ 2.62Å; E286-R289 IonicContact OE1-NE 2.91Å; E286-R289 IonicContact OE1-NH2 3.61Å; E286-R289 PolarHBondContact OE1-NH2 2.98Å; E286-R289 IonicContact OE2-CZ 3.87Å; E286-R289 IonicContact OE2-NE 2.88Å; E286-R289 PolarHBondContact OE2-NE 2.91Å; E286-R289 IonicContact OE2-NH2 2.94Å; E286-R289 PolarHBondContact OE2-NH2 2.84Å; V287-R289 VanDerWaalsContact C-N 3.32Å; V287-R289 PolarHBondContact O-N 2.99Å; R289-L291 PolarHBondContact O-N 3.47Å; R289-G292 PolarHBondContact O-N 3.39Å; R289-G292 VanDerWaalsContact O-N 3.16Å; R289-D293 IonicContact CZ-OD2 3.46Å; R289-D293 IonicContact NH1-OD2 3.16Å; R289-D293 PolarHBondContact NH1-OD2 3.05Å; R289-D293 VanDerWaalsContact O-CG 3.23Å; R289-D293 PolarHBondContact O-N 2.95Å
290K96.8Very high93.2Very high47 Ų4754.7 Ų54.720%0.20430%0.304CS..Hα-helixtrans-65.7-35.4-179.7-73.8-162.2-165.4166.70114E286 V287 I288 L337 Q341 Y342E286-K290 WeakPolarHBondContact O-CG 3.4Å; E286-K290 PolarHBondContact O-N 3.44Å; E286-K290 WeakPolarHBondContact OE1-CE 3.44Å; E286-K290 IonicContact OE1-NZ 3.95Å; V287-K290 PolarHBondContact O-N 3.36Å; I288-K290 PolarHBondContact O-N 2.95Å; K290-L337 HydrophobicContact CB-CD1 4.1Å; K290-L337 HydrophobicContact CB-CD2 4.24Å; K290-Q341 VanDerWaalsContact CD-OE1 3.25Å; K290-Y342 HydrophobicContact CD-CE2 4.25Å; K290-Y342 VanDerWaalsContact CD-OH 3.32Å; K290-Y342 WeakPolarHBondContact CD-OH 3.41Å; K290-Y342 WeakPolarHBondContact CE-OH 3.24Å; K290-Y342 PolarHBondContact NZ-OH 3.3Å
291L97Very high93.7Very high0 Ų048.7 Ų48.70%028%0.282CS..Hα-helixtrans-69.1-36.1173.2-72.5173.3000111.6V287 I288 R289 D293 I294 V300 L303 V317 L319 A334 L337 L338V287-L291 HydrophobicContact CG1-CD1 3.85Å; V287-L291 HydrophobicContact CG1-CG 4.38Å; V287-L291 WeakPolarHBondContact O-CB 3.24Å; V287-L291 WeakPolarHBondContact O-CG 3.19Å; V287-L291 PolarHBondContact O-N 2.78Å; I288-L291 PolarHBondContact O-N 3.34Å; R289-L291 PolarHBondContact O-N 3.47Å; L291-D293 VanDerWaalsContact C-N 3.34Å; L291-I294 HydrophobicContact CD2-CD1 3.96Å; L291-I294 WeakPolarHBondContact O-CB 3.29Å; L291-I294 WeakPolarHBondContact O-CG1 3.27Å; L291-I294 PolarHBondContact O-N 3.29Å; L291-V300 HydrophobicContact CB-CG1 4.34Å; L291-V300 HydrophobicContact CB-CG2 3.8Å; L291-V300 HydrophobicContact CD1-CG1 4.24Å; L291-L303 HydrophobicContact CD1-CD1 4.43Å; L291-V317 HydrophobicContact CD1-CG1 4.25Å; L291-V317 HydrophobicContact CD1-CG2 4.01Å; L291-L319 HydrophobicContact CB-CD2 4.26Å; L291-A334 HydrophobicContact CD2-CB 3.99Å; L291-L337 HydrophobicContact CD2-CD2 4.37Å; L291-L338 HydrophobicContact CD2-CG 4.36Å
292G95.3Very high94Very high34 Ų3447.5 Ų47.535%0.35126%0.255SS..Hα-helixtrans-69.7-28.417500000113.8I288 R289 I294I288-G292 PolarHBondContact O-N 2.96Å; R289-G292 PolarHBondContact O-N 3.39Å; R289-G292 VanDerWaalsContact O-N 3.16Å; G292-I294 PolarHBondContact O-N 3.28Å
293D96.6Very high94.2Very high101 Ų10146.8 Ų46.854%0.5425%0.252SS..THydrogen-bonded Turntrans-72.6-7.9175.3-67.3-20.6000113R289 L291 N295R289-D293 IonicContact CZ-OD2 3.46Å; R289-D293 IonicContact NH1-OD2 3.16Å; R289-D293 PolarHBondContact NH1-OD2 3.05Å; R289-D293 VanDerWaalsContact O-CG 3.23Å; R289-D293 PolarHBondContact O-N 2.95Å; L291-D293 VanDerWaalsContact C-N 3.34Å; D293-N295 PolarHBondContact O-N 2.9Å
294I96Very high94.4Very high15 Ų1549 Ų498%0.07725%0.253CS..SBendtrans-69.4122.3176.6-62173.8000109L291 G292 G296 V297 V330 K333 A334 L337L291-I294 HydrophobicContact CD2-CD1 3.96Å; L291-I294 WeakPolarHBondContact O-CB 3.29Å; L291-I294 WeakPolarHBondContact O-CG1 3.27Å; L291-I294 PolarHBondContact O-N 3.29Å; G292-I294 PolarHBondContact O-N 3.28Å; I294-G296 PolarHBondContact O-N 3.11Å; I294-G296 VanDerWaalsContact O-N 3.15Å; I294-V297 HydrophobicContact CB-CG2 3.82Å; I294-V297 HydrophobicContact CG2-CG2 4.05Å; I294-V297 WeakPolarHBondContact O-CB 3.28Å; I294-V297 PolarHBondContact O-N 3.49Å; I294-V330 HydrophobicContact CG2-CG1 4.29Å; I294-K333 HydrophobicContact CG2-CB 4.04Å; I294-K333 HydrophobicContact CG2-CD 4.16Å; I294-A334 HydrophobicContact CD1-CB 3.79Å; I294-L337 HydrophobicContact CD1-CD1 4.4Å; I294-L337 HydrophobicContact CG1-CD1 4.46Å
295N94.2Very high94.5Very high124 Ų12447.4 Ų47.466%0.66325%0.246SC*.THydrogen-bonded Turntrans-49.3123.3176.1-71-35.5000111.4D293D293-N295 PolarHBondContact O-N 2.9Å
296G93.4Very high94.6Very high11 Ų1144.9 Ų44.911%0.11323%0.226CC..THydrogen-bonded Turntrans98.1-13.5178.700000115.1I294 I321 Y322I294-G296 PolarHBondContact O-N 3.11Å; I294-G296 VanDerWaalsContact O-N 3.15Å; G296-I321 VanDerWaalsContact O-CA 3.24Å; G296-I321 WeakPolarHBondContact O-CA 3.4Å; G296-I321 WeakPolarHBondContact O-CB 3.44Å; G296-Y322 WeakPolarHBondContact O-CD2 3.26Å; G296-Y322 PolarHBondContact O-N 3.02Å
297V95.7Very high94.5Very high12 Ų1242.2 Ų42.27%0.07321%0.214CC..EExtended strand (participates in β ladder)trans-77.9121.1172.81790000109.4I294 V300 L319 I321 V330I294-V297 HydrophobicContact CB-CG2 3.82Å; I294-V297 HydrophobicContact CG2-CG2 4.05Å; I294-V297 WeakPolarHBondContact O-CB 3.28Å; I294-V297 PolarHBondContact O-N 3.49Å; V297-V300 HydrophobicContact CG1-CG2 3.96Å; V297-L319 HydrophobicContact CG1-CD2 4.4Å; V297-L319 HydrophobicContact CG2-CD1 4.4Å; V297-I321 HydrophobicContact CG2-CG2 4.39Å; V297-V330 HydrophobicContact CG2-CG1 3.69Å
298A93.3Very high94.1Very high31 Ų3142.3 Ų42.326%0.25621%0.214SC..EExtended strand (participates in β ladder)trans-90.3-36.3175.300000111.7A320 Y322 F354A298-A320 WeakPolarHBondContact CA-O 3.43Å; A298-A320 WeakPolarHBondContact CB-O 3.47Å; A298-A320 PolarHBondContact N-O 2.62Å; A298-Y322 HydrophobicContact CB-CD1 4.04Å; A298-Y322 HydrophobicContact CB-CD2 4.32Å; A298-Y322 HydrophobicContact CB-CE1 3.64Å; A298-Y322 HydrophobicContact CB-CE2 3.95Å; A298-Y322 HydrophobicContact CB-CG 4.37Å; A298-F354 HydrophobicContact CB-CB 3.85Å; A298-F354 HydrophobicContact CB-CD2 3.77Å; A298-F354 HydrophobicContact CB-CG 3.81Å
299K92.4Very high93.7Very high50 Ų5040.3 Ų40.322%0.21720%0.204CC..EExtended strand (participates in β ladder)trans-154.5145.3-179.9-168.3169.4-180171.20111.7A320 F354 M358K299-A320 HydrophobicContact CB-CB 4.11Å; K299-A320 PolarHBondContact N-O 3.02Å; K299-A320 PolarHBondContact O-N 3.11Å; K299-F354 HydrophobicContact CB-CD2 4.38Å; K299-F354 HydrophobicContact CB-CE2 4.39Å; K299-M358 HydrophobicContact CD-CB 4.46Å; K299-M358 PolarHBondContact NZ-O 2.94Å
300V94.2Very high93Very high16 Ų1639.5 Ų39.510%0.09721%0.206CC..EExtended strand (participates in β ladder)trans-110130.8171.4-175.90000108.1I288 L291 V297 V317 L319I288-V300 HydrophobicContact CG1-CG1 4.48Å; I288-V300 HydrophobicContact CG2-CB 4.41Å; L291-V300 HydrophobicContact CB-CG1 4.34Å; L291-V300 HydrophobicContact CB-CG2 3.8Å; L291-V300 HydrophobicContact CD1-CG1 4.24Å; V297-V300 HydrophobicContact CG1-CG2 3.96Å; V300-V317 HydrophobicContact CG1-CG2 3.57Å; V300-L319 HydrophobicContact CB-CD2 4.3Å; V300-L319 HydrophobicContact CG1-CD2 4.01Å; V300-L319 HydrophobicContact CG2-CD2 3.81Å
301H92Very high92.3Very high13 Ų1341.1 Ų41.16%0.0622%0.217CC..EExtended strand (participates in β ladder)trans-149.8169.7177.25788.6000112.2L303 H318 E352 C364H301-L303 PolarHBondContact O-N 3.21Å; H301-H318 WeakPolarHBondContact CE1-CB 3.36Å; H301-H318 AromaticContact CE1-CG 3.98Å; H301-H318 AromaticContact CE1-ND1 3.94Å; H301-H318 PolarHBondContact N-O 3.13Å; H301-H318 WeakPolarHBondContact ND1-CB 3.43Å; H301-H318 WeakPolarHBondContact O-CB 3.34Å; H301-H318 PolarHBondContact O-N 3.24Å; H301-E352 IonicContact CE1-OE1 3.36Å; H301-E352 PolarHBondContact CE1-OE1 3.01Å; H301-E352 IonicContact NE2-OE1 2.71Å; H301-E352 PolarHBondContact NE2-OE1 2.89Å; H301-E352 VanDerWaalsContact NE2-OE1 3.16Å; H301-C364 HydrophobicContact CB-CB 3.85Å
302D92Very high91.9Very high59 Ų5942.7 Ų42.732%0.31622%0.224SC..EExtended strand (participates in β ladder)trans45.337.1-173.3-161.329000113.1R304 H318D302-R304 PolarHBondContact O-N 2.77Å; D302-R304 IonicContact OD1-CZ 3.03Å; D302-R304 IonicContact OD1-NE 3.49Å; D302-R304 PolarHBondContact OD1-NE 2.9Å; D302-R304 IonicContact OD1-NH2 3.62Å; D302-R304 PolarHBondContact OD1-NH2 3.41Å; D302-R304 IonicContact OD2-NE 2.79Å; D302-R304 IonicContact OD2-NH2 3.83Å; D302-H318 IonicContact OD2-NE2 3.83Å
303L94.4Very high91.7Very high13 Ų1342.2 Ų42.27%0.06821%0.213CC..EExtended strand (participates in β ladder)trans-67.8122.3172.8175.764.6000108.4F284 V287 I288 L291 H301 I305 V315 S316 V317F284-L303 HydrophobicContact CD2-CD2 4.01Å; F284-L303 HydrophobicContact CD2-CG 4.32Å; F284-L303 HydrophobicContact CE1-CD2 4.45Å; F284-L303 HydrophobicContact CE2-CB 4.01Å; F284-L303 HydrophobicContact CE2-CD2 3.71Å; F284-L303 HydrophobicContact CE2-CG 3.68Å; F284-L303 VanDerWaalsContact CE2-O 3.27Å; F284-L303 WeakPolarHBondContact CE2-O 3.24Å; F284-L303 HydrophobicContact CG-CD2 4.49Å; F284-L303 HydrophobicContact CZ-CB 3.95Å; F284-L303 HydrophobicContact CZ-CD2 3.95Å; F284-L303 HydrophobicContact CZ-CG 4.08Å; V287-L303 HydrophobicContact CB-CD2 4.12Å; V287-L303 HydrophobicContact CG1-CD1 4.18Å; V287-L303 HydrophobicContact CG1-CD2 3.82Å; I288-L303 HydrophobicContact CD1-CD2 4.17Å; I288-L303 HydrophobicContact CG1-CB 4.47Å; I288-L303 HydrophobicContact CG1-CD2 3.38Å; L291-L303 HydrophobicContact CD1-CD1 4.43Å; H301-L303 PolarHBondContact O-N 3.21Å; L303-I305 HydrophobicContact CD1-CD1 4.31Å; L303-I305 HydrophobicContact CD1-CG1 3.92Å; L303-I305 HydrophobicContact CD2-CD1 4.1Å; L303-I305 HydrophobicContact CD2-CG1 4.42Å; L303-I305 HydrophobicContact CG-CD1 4.29Å; L303-I305 HydrophobicContact CG-CG1 4.05Å; L303-V315 HydrophobicContact CD1-CG1 3.77Å; L303-S316 CarbonylContact C-O 3.57Å; L303-S316 WeakPolarHBondContact CA-O 3.22Å; L303-V317 HydrophobicContact CB-CG2 4.03Å; L303-V317 HydrophobicContact CD1-CB 3.78Å; L303-V317 HydrophobicContact CD1-CG2 3.88Å
304R94.6Very high91.6Very high141 Ų14137.5 Ų37.553%0.53219%0.188SC..EExtended strand (participates in β ladder)trans-125128.2173.1-58.6-175.4-170.9-161.54.4108.1D302 W306 V315 S316D302-R304 PolarHBondContact O-N 2.77Å; D302-R304 IonicContact OD1-CZ 3.03Å; D302-R304 IonicContact OD1-NE 3.49Å; D302-R304 PolarHBondContact OD1-NE 2.9Å; D302-R304 IonicContact OD1-NH2 3.62Å; D302-R304 PolarHBondContact OD1-NH2 3.41Å; D302-R304 IonicContact OD2-NE 2.79Å; D302-R304 IonicContact OD2-NH2 3.83Å; R304-W306 HydrophobicContact CB-CE3 3.93Å; R304-W306 HydrophobicContact CB-CZ3 3.78Å; R304-V315 CarbonylContact O-C 3.57Å; R304-V315 VanDerWaalsContact O-CA 3.28Å; R304-V315 WeakPolarHBondContact O-CA 3.22Å; R304-S316 PolarHBondContact N-O 3.46Å; R304-S316 PolarHBondContact O-N 2.74Å
305I95.1Very high91.6Very high13 Ų1336.9 Ų36.97%0.06719%0.185CC..EExtended strand (participates in β ladder)trans-127.6121.3177.2-52.1177.2000105.9P279 I282 F284 V287 L303 I313 V315P279-I305 HydrophobicContact CG-CG2 4.36Å; I282-I305 HydrophobicContact CG2-CD1 3.97Å; I282-I305 HydrophobicContact CG2-CG2 4.42Å; F284-I305 HydrophobicContact CD2-CD1 4.12Å; F284-I305 HydrophobicContact CD2-CG1 4.45Å; V287-I305 HydrophobicContact CB-CD1 4.06Å; V287-I305 HydrophobicContact CG1-CD1 4.1Å; V287-I305 HydrophobicContact CG2-CD1 3.87Å; L303-I305 HydrophobicContact CD1-CD1 4.31Å; L303-I305 HydrophobicContact CD1-CG1 3.92Å; L303-I305 HydrophobicContact CD2-CD1 4.1Å; L303-I305 HydrophobicContact CD2-CG1 4.42Å; L303-I305 HydrophobicContact CG-CD1 4.29Å; L303-I305 HydrophobicContact CG-CG1 4.05Å; I305-I313 HydrophobicContact CG2-CG2 4.05Å; I305-V315 HydrophobicContact CB-CG2 4.47Å; I305-V315 HydrophobicContact CG1-CG1 4.48Å; I305-V315 HydrophobicContact CG1-CG2 4.17Å; I305-V315 HydrophobicContact CG2-CG2 4.11Å
306W94.5Very high91.6Very high45 Ų4532.3 Ų32.317%0.1716%0.163CC..EExtended strand (participates in β ladder)trans-141.4160.5179.768.199.3000111.5E276 R304 A314E276-W306 HydrophobicContact CB-CB 4.08Å; E276-W306 WeakPolarHBondContact O-CB 3.35Å; R304-W306 HydrophobicContact CB-CE3 3.93Å; R304-W306 HydrophobicContact CB-CZ3 3.78Å; W306-A314 HydrophobicContact CD2-CB 3.92Å; W306-A314 HydrophobicContact CG-CB 4.39Å; W306-A314 HydrophobicContact CH2-CB 4.13Å; W306-A314 HydrophobicContact CZ2-CB 3.49Å; W306-A314 VanDerWaalsContact CZ2-CB 3.49Å; W306-A314 PolarHBondContact N-O 3.48Å; W306-A314 PolarHBondContact O-N 3.43Å
307S91Very high91.8Very high5 Ų531.8 Ų31.84%0.03516%0.157CC..EExtended strand (participates in β ladder)trans-100.3125.1178.3-500000110G277 P279G277-S307 PolarHBondContact O-N 2.94Å; G277-S307 PolarHBondContact O-OG 3.01Å; P279-S307 WeakPolarHBondContact CA-OG 3.39Å; P279-S307 WeakPolarHBondContact CB-OG 3.33Å
308L87.4Confident91.8Very high3 Ų332.8 Ų32.82%0.01616%0.161CC..SBendtrans-81.1-39.6169.6-76155.4000111F125 K312 A314 F345F125-L308 HydrophobicContact CB-CD2 4.06Å; F125-L308 HydrophobicContact CD1-CD1 4.27Å; F125-L308 HydrophobicContact CD1-CD2 4.01Å; F125-L308 HydrophobicContact CD2-CD2 4.27Å; F125-L308 HydrophobicContact CG-CD2 3.86Å; L308-K312 HydrophobicContact CB-CB 3.98Å; L308-K312 PolarHBondContact N-O 2.99Å; L308-A314 HydrophobicContact CD1-CB 3.8Å; L308-A314 HydrophobicContact CG-CB 4.26Å; L308-F345 HydrophobicContact CD1-CD1 4.34Å
309T85.9Confident91.9Very high1 Ų131.3 Ų31.31%0.00615%0.149CC..SBendtrans-142.4-176.2171.371.60000108.8H128 D311 K312H128-T309 HydrophobicContact CB-CG2 3.7Å; H128-T309 VanDerWaalsContact O-CG2 3.23Å; H128-T309 WeakPolarHBondContact O-CG2 3.08Å; T309-D311 PolarHBondContact O-N 3.06Å; T309-D311 PolarHBondContact OG1-N 2.97Å; T309-K312 HydrophobicContact CG2-CD 4.36Å; T309-K312 WeakPolarHBondContact OG1-CB 3.37Å; T309-K312 PolarHBondContact OG1-N 3.3Å
310M82Confident92Very high96 Ų9628.9 Ų28.947%0.47314%0.138SC..SBendtrans-59.7-26.7174.6-61.9-56.3-147.500113.4D269 V270 V273D269-M310 HydrophobicContact CB-CE 3.62Å; D269-M310 HydrophobicContact CB-SD 4.35Å; V270-M310 HydrophobicContact CG2-CE 4.38Å; V273-M310 HydrophobicContact CG2-SD 3.91Å
311D82.3Confident92.1Very high80 Ų8028.2 Ų28.243%0.42813%0.134SC..SBendtrans-113-7.4-173.4-80.3-0.9000113.6R211 T309R211-D311 IonicContact NE-OD2 3.93Å; R211-D311 PolarHBondContact NE-OD2 2.78Å; R211-D311 IonicContact NH2-OD2 3.05Å; T309-D311 PolarHBondContact O-N 3.06Å; T309-D311 PolarHBondContact OG1-N 2.97Å
312K87.3Confident92.2Very high34 Ų3433.4 Ų33.415%0.14815%0.154CC..  trans-116.8107.6-173.5-70.7179.3177.6171.30110.5H128 L308 T309 F345H128-K312 PolarHBondContact CD2-NZ 3.15Å; H128-K312 VanDerWaalsContact CD2-NZ 3.29Å; H128-K312 PolarHBondContact CE1-NZ 2.87Å; H128-K312 VanDerWaalsContact CG-NZ 3.32Å; H128-K312 PolarHBondContact ND1-NZ 2.94Å; H128-K312 PolarHBondContact NE2-NZ 2.88Å; L308-K312 HydrophobicContact CB-CB 3.98Å; L308-K312 PolarHBondContact N-O 2.99Å; T309-K312 HydrophobicContact CG2-CD 4.36Å; T309-K312 WeakPolarHBondContact OG1-CB 3.37Å; T309-K312 PolarHBondContact OG1-N 3.3Å; K312-F345 HydrophobicContact CB-CB 4.16Å; K312-F345 HydrophobicContact CB-CD1 4.1Å; K312-F345 HydrophobicContact CB-CG 4.13Å; K312-F345 HydrophobicContact CD-CD1 3.95Å; K312-F345 HydrophobicContact CD-CD2 4.49Å; K312-F345 HydrophobicContact CD-CE1 3.94Å; K312-F345 HydrophobicContact CD-CE2 4.46Å; K312-F345 HydrophobicContact CD-CG 4.26Å; K312-F345 HydrophobicContact CD-CZ 4.21Å; K312-F345 HydrophobicContact CG-CB 4.31Å; K312-F345 HydrophobicContact CG-CD1 4.01Å; K312-F345 HydrophobicContact CG-CD2 4.2Å; K312-F345 HydrophobicContact CG-CE1 4.47Å; K312-F345 HydrophobicContact CG-CG 3.9Å
313I92Very high92.1Very high24 Ų2440 Ų4012%0.12317%0.174CC..EExtended strand (participates in β ladder)trans-99.1134.4179.9-57.4162000108.3P279 I282 I305 V315 V344 F345 E346P279-I313 HydrophobicContact CB-CD1 4.35Å; P279-I313 HydrophobicContact CB-CG1 4.17Å; P279-I313 HydrophobicContact CG-CD1 4Å; P279-I313 HydrophobicContact CG-CG1 3.88Å; P279-I313 HydrophobicContact CG-CG2 4.09Å; I282-I313 HydrophobicContact CD1-CD1 3.64Å; I282-I313 HydrophobicContact CD1-CG2 4.19Å; I305-I313 HydrophobicContact CG2-CG2 4.05Å; I313-V315 HydrophobicContact CG2-CG2 4.32Å; I313-V344 HydrophobicContact CG2-CG2 4.26Å; I313-F345 WeakPolarHBondContact O-CA 3.44Å; I313-F345 WeakPolarHBondContact O-CB 3.03Å; I313-F345 PolarHBondContact O-N 3.11Å; I313-E346 PolarHBondContact O-N 3.14Å
314A93.3Very high92Very high1 Ų147.6 Ų47.61%0.00821%0.21CC..EExtended strand (participates in β ladder)trans-117.4141.4172.200000110.4W306 L308 E346W306-A314 HydrophobicContact CD2-CB 3.92Å; W306-A314 HydrophobicContact CG-CB 4.39Å; W306-A314 HydrophobicContact CH2-CB 4.13Å; W306-A314 HydrophobicContact CZ2-CB 3.49Å; W306-A314 VanDerWaalsContact CZ2-CB 3.49Å; W306-A314 PolarHBondContact N-O 3.48Å; W306-A314 PolarHBondContact O-N 3.43Å; L308-A314 HydrophobicContact CD1-CB 3.8Å; L308-A314 HydrophobicContact CG-CB 4.26Å; A314-E346 CarbonylContact C-O 3.54Å; A314-E346 VanDerWaalsContact CA-O 3.22Å; A314-E346 WeakPolarHBondContact CA-O 3.48Å; A314-E346 HydrophobicContact CB-CB 4.32Å
315V96Very high91.8Very high3 Ų344.5 Ų44.52%0.01820%0.201CC..EExtended strand (participates in β ladder)trans-130.4136.2-180178.30000110.1L303 R304 I305 I313 L338 V344 E346 C347 T348L303-V315 HydrophobicContact CD1-CG1 3.77Å; R304-V315 CarbonylContact O-C 3.57Å; R304-V315 VanDerWaalsContact O-CA 3.28Å; R304-V315 WeakPolarHBondContact O-CA 3.22Å; I305-V315 HydrophobicContact CB-CG2 4.47Å; I305-V315 HydrophobicContact CG1-CG1 4.48Å; I305-V315 HydrophobicContact CG1-CG2 4.17Å; I305-V315 HydrophobicContact CG2-CG2 4.11Å; I313-V315 HydrophobicContact CG2-CG2 4.32Å; V315-L338 HydrophobicContact CB-CD1 4.49Å; V315-L338 HydrophobicContact CG1-CD1 4.02Å; V315-L338 HydrophobicContact CG1-CD2 4.3Å; V315-V344 HydrophobicContact CB-CG1 4.07Å; V315-V344 HydrophobicContact CB-CG2 4.43Å; V315-V344 HydrophobicContact CG2-CB 4.4Å; V315-V344 HydrophobicContact CG2-CG1 3.87Å; V315-V344 HydrophobicContact CG2-CG2 3.55Å; V315-E346 PolarHBondContact N-O 3.49Å; V315-C347 CarbonylContact O-C 3.54Å; V315-C347 VanDerWaalsContact O-CA 3.26Å; V315-C347 WeakPolarHBondContact O-CA 3.06Å; V315-T348 PolarHBondContact O-N 3.34Å
316S95.9Very high91.7Very high27 Ų2748.3 Ų48.319%0.18922%0.222CC..EExtended strand (participates in β ladder)trans-126.1133.3166.9-173.10000108.1L303 R304 T348L303-S316 CarbonylContact C-O 3.57Å; L303-S316 WeakPolarHBondContact CA-O 3.22Å; R304-S316 PolarHBondContact N-O 3.46Å; R304-S316 PolarHBondContact O-N 2.74Å; S316-T348 CarbonylContact C-O 3.56Å; S316-T348 VanDerWaalsContact CA-O 3.32Å; S316-T348 WeakPolarHBondContact CA-O 3.36Å
317V96.2Very high91.7Very high0 Ų048.1 Ų48.10%023%0.23CC..EExtended strand (participates in β ladder)trans-151.4147.9-178.665.20000111.5L291 V300 L303 L319 T348 V349 Q350L291-V317 HydrophobicContact CD1-CG1 4.25Å; L291-V317 HydrophobicContact CD1-CG2 4.01Å; V300-V317 HydrophobicContact CG1-CG2 3.57Å; L303-V317 HydrophobicContact CB-CG2 4.03Å; L303-V317 HydrophobicContact CD1-CB 3.78Å; L303-V317 HydrophobicContact CD1-CG2 3.88Å; V317-L319 HydrophobicContact CG2-CD2 4.09Å; V317-T348 PolarHBondContact N-O 3.42Å; V317-V349 HydrophobicContact CG1-CB 4.36Å; V317-V349 HydrophobicContact CG1-CG1 4.28Å; V317-V349 HydrophobicContact CG1-CG2 3.92Å; V317-V349 WeakPolarHBondContact O-CA 3.48Å; V317-Q350 PolarHBondContact O-N 3.22Å
318H95.3Very high91.8Very high33 Ų3354.1 Ų54.115%0.15326%0.257CS..EExtended strand (participates in β ladder)trans-107.3130.8170.9-67.8-146.8000109.6H301 D302 Q350 E352H301-H318 WeakPolarHBondContact CE1-CB 3.36Å; H301-H318 AromaticContact CE1-CG 3.98Å; H301-H318 AromaticContact CE1-ND1 3.94Å; H301-H318 PolarHBondContact N-O 3.13Å; H301-H318 WeakPolarHBondContact ND1-CB 3.43Å; H301-H318 WeakPolarHBondContact O-CB 3.34Å; H301-H318 PolarHBondContact O-N 3.24Å; D302-H318 IonicContact OD2-NE2 3.83Å; H318-Q350 CarbonylContact C-O 3.56Å; H318-Q350 WeakPolarHBondContact CA-O 3.32Å; H318-Q350 PolarHBondContact CE1-NE2 2.94Å; H318-Q350 PolarHBondContact CE1-OE1 3.37Å; H318-Q350 PolarHBondContact ND1-NE2 2.78Å; H318-E352 IonicContact ND1-OE2 3.91Å
319L96.2Very high92.1Very high0 Ų058.4 Ų58.40%028%0.277CS..EExtended strand (participates in β ladder)trans-115.8114.4177.5-57.5-178.1000109.3L291 V297 V300 V317 V330 A334 V349 Q350 I351 E352L291-L319 HydrophobicContact CB-CD2 4.26Å; V297-L319 HydrophobicContact CG1-CD2 4.4Å; V297-L319 HydrophobicContact CG2-CD1 4.4Å; V300-L319 HydrophobicContact CB-CD2 4.3Å; V300-L319 HydrophobicContact CG1-CD2 4.01Å; V300-L319 HydrophobicContact CG2-CD2 3.81Å; V317-L319 HydrophobicContact CG2-CD2 4.09Å; L319-V330 HydrophobicContact CD1-CG1 4.05Å; L319-A334 HydrophobicContact CD1-CB 3.68Å; L319-V349 HydrophobicContact CD1-CG1 3.56Å; L319-V349 HydrophobicContact CG-CG1 3.94Å; L319-Q350 PolarHBondContact N-O 2.88Å; L319-I351 WeakPolarHBondContact O-CA 3.33Å; L319-E352 PolarHBondContact O-N 3.35Å
320A94.8Very high92.6Very high0 Ų058.5 Ų58.50%028%0.278CS..EExtended strand (participates in β ladder)trans-84.5119.9170.300000109A298 K299 E352 F354 M358A298-A320 WeakPolarHBondContact CA-O 3.43Å; A298-A320 WeakPolarHBondContact CB-O 3.47Å; A298-A320 PolarHBondContact N-O 2.62Å; K299-A320 HydrophobicContact CB-CB 4.11Å; K299-A320 PolarHBondContact N-O 3.02Å; K299-A320 PolarHBondContact O-N 3.11Å; A320-E352 CarbonylContact C-O 3.51Å; A320-E352 VanDerWaalsContact CA-O 3.28Å; A320-E352 WeakPolarHBondContact CA-O 3.34Å; A320-E352 HydrophobicContact CB-CG 4.48Å; A320-F354 HydrophobicContact CB-CB 4.3Å; A320-F354 HydrophobicContact CB-CD2 4.18Å; A320-M358 HydrophobicContact CB-CE 4.34Å; A320-M358 HydrophobicContact CB-SD 3.69Å
321I96.3Very high93.2Very high1 Ų156.4 Ų56.41%0.00527%0.268CS..EExtended strand (participates in β ladder)trans-110.5155.4-178.264.3165.5000111.9G296 V297 Q325 A327 V330 I351 E352 F354G296-I321 VanDerWaalsContact O-CA 3.24Å; G296-I321 WeakPolarHBondContact O-CA 3.4Å; G296-I321 WeakPolarHBondContact O-CB 3.44Å; V297-I321 HydrophobicContact CG2-CG2 4.39Å; I321-Q325 HydrophobicContact CD1-CB 4.32Å; I321-A327 HydrophobicContact CD1-CB 3.94Å; I321-V330 HydrophobicContact CG2-CB 4.34Å; I321-V330 HydrophobicContact CG2-CG1 3.89Å; I321-V330 HydrophobicContact CG2-CG2 4.14Å; I321-I351 HydrophobicContact CD1-CG2 3.56Å; I321-I351 HydrophobicContact CG1-CG2 3.73Å; I321-I351 HydrophobicContact CG2-CG2 4Å; I321-E352 WeakPolarHBondContact CG1-O 3.39Å; I321-E352 PolarHBondContact N-O 3.47Å; I321-F354 PolarHBondContact O-N 3.43Å
322Y94.5Very high93.8Very high122 Ų12256.5 Ų56.548%0.47827%0.269SS..  trans-65.7148.2171-58.9-72.5000111G296 A298 E324 Q325G296-Y322 WeakPolarHBondContact O-CD2 3.26Å; G296-Y322 PolarHBondContact O-N 3.02Å; A298-Y322 HydrophobicContact CB-CD1 4.04Å; A298-Y322 HydrophobicContact CB-CD2 4.32Å; A298-Y322 HydrophobicContact CB-CE1 3.64Å; A298-Y322 HydrophobicContact CB-CE2 3.95Å; A298-Y322 HydrophobicContact CB-CG 4.37Å; Y322-E324 PolarHBondContact O-N 2.93Å; Y322-E324 VanDerWaalsContact O-N 3.14Å; Y322-Q325 WeakPolarHBondContact O-CB 3.32Å; Y322-Q325 PolarHBondContact O-N 2.92Å; Y322-Q325 VanDerWaalsContact O-N 3.11Å
323R90.3Very high94.2Very high198 Ų19858.8 Ų58.875%0.74728%0.278SS*.THydrogen-bonded Turntrans-58.1-30-174.1-71.2-173.9175.9-171.1-1.2114.3Q325R323-Q325 VanDerWaalsContact C-N 3.28Å; R323-Q325 PolarHBondContact O-N 2.89Å
324E90.6Very high94.4Very high172 Ų17257.6 Ų57.680%0.80427%0.272SS*.THydrogen-bonded Turntrans-80.8-5.2-176.7-32.7-56.3150.400113.6Y322Y322-E324 PolarHBondContact O-N 2.93Å; Y322-E324 VanDerWaalsContact O-N 3.14Å
325Q91.1Very high94.5Very high77 Ų7759 Ų5936%0.3628%0.28SS..SBendtrans-94146-167.8-61.6-67.7-33.900112.3I321 Y322 R323 A327I321-Q325 HydrophobicContact CD1-CB 4.32Å; Y322-Q325 WeakPolarHBondContact O-CB 3.32Å; Y322-Q325 PolarHBondContact O-N 2.92Å; Y322-Q325 VanDerWaalsContact O-N 3.11Å; R323-Q325 VanDerWaalsContact C-N 3.28Å; R323-Q325 PolarHBondContact O-N 2.89Å; Q325-A327 PolarHBondContact O-N 3.29Å
326N93.2Very high94.4Very high92 Ų9261.3 Ų61.349%0.49230%0.295SS..  trans-76.6108.1176.1-173.9-18.9000110.6Q328 E329 V330N326-Q328 VanDerWaalsContact C-N 3.25Å; N326-Q328 PolarHBondContact O-N 3.07Å; N326-Q328 WeakPolarHBondContact OD1-CB 3.33Å; N326-Q328 PolarHBondContact OD1-N 3Å; N326-E329 HydrophobicContact CB-CB 3.97Å; N326-E329 PolarHBondContact O-N 3.28Å; N326-E329 VanDerWaalsContact O-N 3.16Å; N326-E329 PolarHBondContact OD1-N 3.22Å; N326-V330 PolarHBondContact O-N 3.47Å; N326-V330 VanDerWaalsContact O-N 3.17Å
327A94.2Very high94.3Very high42 Ų4261.3 Ų61.335%0.34729%0.293SS..Hα-helixtrans-55.2-38.7178.100000112.9I321 Q325 E329 V330 L331 I351I321-A327 HydrophobicContact CD1-CB 3.94Å; Q325-A327 PolarHBondContact O-N 3.29Å; A327-E329 VanDerWaalsContact C-N 3.34Å; A327-E329 PolarHBondContact O-N 2.98Å; A327-V330 PolarHBondContact O-N 2.72Å; A327-L331 WeakPolarHBondContact O-CB 3.24Å; A327-L331 PolarHBondContact O-N 2.75Å; A327-I351 HydrophobicContact CB-CD1 4.37Å; A327-I351 HydrophobicContact CB-CG2 3.97Å; A327-I351 WeakPolarHBondContact O-CD1 3.35Å
328Q94Very high94.2Very high131 Ų13161.3 Ų61.361%0.61229%0.293SS*.Hα-helixtrans-69.2-34.6-178.3-168.766.5-3.300112.3N326 L331 L332N326-Q328 VanDerWaalsContact C-N 3.25Å; N326-Q328 PolarHBondContact O-N 3.07Å; N326-Q328 WeakPolarHBondContact OD1-CB 3.33Å; N326-Q328 PolarHBondContact OD1-N 3Å; Q328-L331 PolarHBondContact O-N 2.86Å; Q328-L332 WeakPolarHBondContact O-CB 3.42Å; Q328-L332 PolarHBondContact O-N 3.16Å
329E93.8Very high94.1Very high93 Ų9365 Ų6544%0.43531%0.305SS..Hα-helixtrans-68.9-42.9176.6-169.3-174.1158.200111.3N326 A327 L332 K333N326-E329 HydrophobicContact CB-CB 3.97Å; N326-E329 PolarHBondContact O-N 3.28Å; N326-E329 VanDerWaalsContact O-N 3.16Å; N326-E329 PolarHBondContact OD1-N 3.22Å; A327-E329 VanDerWaalsContact C-N 3.34Å; A327-E329 PolarHBondContact O-N 2.98Å; E329-L332 PolarHBondContact O-N 3.21Å; E329-K333 HydrophobicContact CG-CD 4.34Å; E329-K333 WeakPolarHBondContact O-CB 3.36Å; E329-K333 WeakPolarHBondContact O-CG 3.47Å; E329-K333 PolarHBondContact O-N 3.37Å; E329-K333 WeakPolarHBondContact OE1-CE 3.45Å; E329-K333 IonicContact OE1-NZ 3.35Å; E329-K333 PolarHBondContact OE1-NZ 3.03Å
330V95Very high93.8Very high3 Ų369.8 Ų69.82%0.01833%0.331CS..Hα-helixtrans-63.1-43.4174.5176.40000110.6I294 V297 L319 I321 N326 A327 L332 K333 A334 I351I294-V330 HydrophobicContact CG2-CG1 4.29Å; V297-V330 HydrophobicContact CG2-CG1 3.69Å; L319-V330 HydrophobicContact CD1-CG1 4.05Å; I321-V330 HydrophobicContact CG2-CB 4.34Å; I321-V330 HydrophobicContact CG2-CG1 3.89Å; I321-V330 HydrophobicContact CG2-CG2 4.14Å; N326-V330 PolarHBondContact O-N 3.47Å; N326-V330 VanDerWaalsContact O-N 3.17Å; A327-V330 PolarHBondContact O-N 2.72Å; V330-L332 PolarHBondContact O-N 3.05Å; V330-K333 PolarHBondContact O-N 3.17Å; V330-A334 WeakPolarHBondContact O-CB 3.4Å; V330-A334 PolarHBondContact O-N 3.05Å; V330-I351 HydrophobicContact CB-CD1 4.23Å; V330-I351 HydrophobicContact CG1-CD1 4.25Å
331L95.5Very high93.7Very high52 Ų5274.6 Ų74.627%0.27235%0.354SS..Hα-helixtrans-58-48.3177.7-177.957.9000111.8A327 Q328 A334 T335 V349 I351A327-L331 WeakPolarHBondContact O-CB 3.24Å; A327-L331 PolarHBondContact O-N 2.75Å; Q328-L331 PolarHBondContact O-N 2.86Å; L331-A334 PolarHBondContact O-N 2.82Å; L331-T335 VanDerWaalsContact O-CB 3.24Å; L331-T335 WeakPolarHBondContact O-CB 3.4Å; L331-T335 PolarHBondContact O-N 2.88Å; L331-T335 PolarHBondContact O-OG1 2.92Å; L331-V349 HydrophobicContact CD1-CB 3.61Å; L331-V349 HydrophobicContact CD1-CG1 3.9Å; L331-V349 HydrophobicContact CD1-CG2 4.45Å; L331-I351 HydrophobicContact CB-CD1 3.63Å; L331-I351 HydrophobicContact CD1-CD1 4.38Å
332L94.6Very high93.4Very high82 Ų8275.8 Ų75.843%0.42936%0.358SS..Hα-helixtrans-61.9-49178.7-176.664.4000110.7V46 Q328 E329 V330 A334 T335 T336V46-L332 HydrophobicContact CG2-CD1 4.3Å; Q328-L332 WeakPolarHBondContact O-CB 3.42Å; Q328-L332 PolarHBondContact O-N 3.16Å; E329-L332 PolarHBondContact O-N 3.21Å; V330-L332 PolarHBondContact O-N 3.05Å; L332-A334 PolarHBondContact O-N 3.02Å; L332-T335 PolarHBondContact O-N 3.28Å; L332-T336 WeakPolarHBondContact O-CB 3.43Å; L332-T336 PolarHBondContact O-N 3.26Å; L332-T336 PolarHBondContact O-OG1 3.16Å
333K95.4Very high93.2Very high81 Ų8176.4 Ų76.435%0.35237%0.365SS..Hα-helixtrans-59.2-45.6178.6-76.1171.8173.1169.30112.4I294 E329 V330 L337I294-K333 HydrophobicContact CG2-CB 4.04Å; I294-K333 HydrophobicContact CG2-CD 4.16Å; E329-K333 HydrophobicContact CG-CD 4.34Å; E329-K333 WeakPolarHBondContact O-CB 3.36Å; E329-K333 WeakPolarHBondContact O-CG 3.47Å; E329-K333 PolarHBondContact O-N 3.37Å; E329-K333 WeakPolarHBondContact OE1-CE 3.45Å; E329-K333 IonicContact OE1-NZ 3.35Å; E329-K333 PolarHBondContact OE1-NZ 3.03Å; V330-K333 PolarHBondContact O-N 3.17Å; K333-L337 WeakPolarHBondContact O-CB 3.48Å; K333-L337 PolarHBondContact O-N 3.28Å
334A96.2Very high93.2Very high0 Ų067.5 Ų67.50%033%0.333CS..Hα-helixtrans-65.3-45.8179.400000111.8L291 I294 L319 V330 L331 L332 L337 L338 V349L291-A334 HydrophobicContact CD2-CB 3.99Å; I294-A334 HydrophobicContact CD1-CB 3.79Å; L319-A334 HydrophobicContact CD1-CB 3.68Å; V330-A334 WeakPolarHBondContact O-CB 3.4Å; V330-A334 PolarHBondContact O-N 3.05Å; L331-A334 PolarHBondContact O-N 2.82Å; L332-A334 PolarHBondContact O-N 3.02Å; A334-L337 PolarHBondContact O-N 2.82Å; A334-L338 WeakPolarHBondContact O-CG 3.28Å; A334-L338 PolarHBondContact O-N 3.17Å; A334-V349 HydrophobicContact CB-CG1 4.25Å; A334-V349 HydrophobicContact CB-CG2 4.39Å
335T94.8Very high93.1Very high29 Ų2963.6 Ų63.618%0.17831%0.313CS..Hα-helixtrans-63.1-46.9179.2-60.40000111.4L331 L332 L338 R339L331-T335 VanDerWaalsContact O-CB 3.24Å; L331-T335 WeakPolarHBondContact O-CB 3.4Å; L331-T335 PolarHBondContact O-N 2.88Å; L331-T335 PolarHBondContact O-OG1 2.92Å; L332-T335 PolarHBondContact O-N 3.28Å; T335-L338 PolarHBondContact O-N 2.9Å; T335-R339 WeakPolarHBondContact O-CB 3.44Å; T335-R339 PolarHBondContact O-N 3.4Å
336T94.3Very high93Very high53 Ų5364.2 Ų64.233%0.32532%0.316SS..Hα-helixtrans-62.2-43.3176.6-62.40000111.3L332 L338 R339 D340L332-T336 WeakPolarHBondContact O-CB 3.43Å; L332-T336 PolarHBondContact O-N 3.26Å; L332-T336 PolarHBondContact O-OG1 3.16Å; T336-L338 PolarHBondContact O-N 3.49Å; T336-R339 PolarHBondContact O-N 3.46Å; T336-D340 VanDerWaalsContact CG2-OD2 3.24Å; T336-D340 WeakPolarHBondContact CG2-OD2 3.35Å; T336-D340 VanDerWaalsContact O-CB 3.29Å; T336-D340 WeakPolarHBondContact O-CB 3.25Å; T336-D340 PolarHBondContact O-N 3.04Å
337L94.7Very high93Very high26 Ų2661.8 Ų61.814%0.13631%0.306CS..Hα-helixtrans-59.2-48177.1-177.8153.3000112K290 L291 I294 K333 A334 Q341 Y342K290-L337 HydrophobicContact CB-CD1 4.1Å; K290-L337 HydrophobicContact CB-CD2 4.24Å; L291-L337 HydrophobicContact CD2-CD2 4.37Å; I294-L337 HydrophobicContact CD1-CD1 4.4Å; I294-L337 HydrophobicContact CG1-CD1 4.46Å; K333-L337 WeakPolarHBondContact O-CB 3.48Å; K333-L337 PolarHBondContact O-N 3.28Å; A334-L337 PolarHBondContact O-N 2.82Å; L337-Q341 WeakPolarHBondContact O-CB 3.33Å; L337-Q341 PolarHBondContact O-N 3.49Å; L337-Q341 VanDerWaalsContact O-N 3.07Å; L337-Y342 HydrophobicContact CD2-CD2 4.19Å; L337-Y342 HydrophobicContact CD2-CE2 3.81Å
338L94.3Very high93.1Very high1 Ų164.1 Ų64.11%0.00532%0.316CS..Hα-helixtrans-63.9-42179-71.7173.4000111.8V287 L291 V315 A334 T335 T336 Y342 H343 V344 C347 V349V287-L338 HydrophobicContact CG1-CD2 4.03Å; L291-L338 HydrophobicContact CD2-CG 4.36Å; V315-L338 HydrophobicContact CB-CD1 4.49Å; V315-L338 HydrophobicContact CG1-CD1 4.02Å; V315-L338 HydrophobicContact CG1-CD2 4.3Å; A334-L338 WeakPolarHBondContact O-CG 3.28Å; A334-L338 PolarHBondContact O-N 3.17Å; T335-L338 PolarHBondContact O-N 2.9Å; T336-L338 PolarHBondContact O-N 3.49Å; L338-Y342 HydrophobicContact CD2-CD2 4.4Å; L338-Y342 CarbonylContact O-C 3.57Å; L338-Y342 WeakPolarHBondContact O-CB 3.4Å; L338-Y342 PolarHBondContact O-N 3.08Å; L338-H343 PolarHBondContact O-N 3.12Å; L338-V344 HydrophobicContact CB-CB 4.3Å; L338-V344 HydrophobicContact CB-CG2 4.05Å; L338-V344 WeakPolarHBondContact O-CG2 3.49Å; L338-V344 PolarHBondContact O-N 2.9Å; L338-C347 HydrophobicContact CD1-CB 4.24Å; L338-V349 HydrophobicContact CD1-CG2 4.2Å
339R92.2Very high93.2Very high109 Ų10958.8 Ų58.841%0.41129%0.292SS..Hα-helixtrans-70.1-46.4-179.7-172.6174.1179.4142.1-7.4112.7V46 T335 T336 H343V46-R339 PolarHBondContact O-NH1 3.48Å; T335-R339 WeakPolarHBondContact O-CB 3.44Å; T335-R339 PolarHBondContact O-N 3.4Å; T336-R339 PolarHBondContact O-N 3.46Å; R339-H343 VanDerWaalsContact O-CA 3.25Å; R339-H343 WeakPolarHBondContact O-CA 3.24Å; R339-H343 PolarHBondContact O-N 3.25Å
340D90.9Very high93.3Very high101 Ų10158.6 Ų58.654%0.5429%0.291SS..Hα-helixtrans-80.6-39.9-170.8-69.8-10.1000112.2T336T336-D340 VanDerWaalsContact CG2-OD2 3.24Å; T336-D340 WeakPolarHBondContact CG2-OD2 3.35Å; T336-D340 VanDerWaalsContact O-CB 3.29Å; T336-D340 WeakPolarHBondContact O-CB 3.25Å; T336-D340 PolarHBondContact O-N 3.04Å
341Q91.4Very high93.3Very high102 Ų10260.5 Ų60.548%0.47730%0.301SS..Hα-helixtrans-91.7-30.3-175.4-58.4-169.520.400113.6K290 L337K290-Q341 VanDerWaalsContact CD-OE1 3.25Å; L337-Q341 WeakPolarHBondContact O-CB 3.33Å; L337-Q341 PolarHBondContact O-N 3.49Å; L337-Q341 VanDerWaalsContact O-N 3.07Å
342Y91Very high93.3Very high26 Ų2660.7 Ų60.710%0.10230%0.3CS..Hα-helixtrans-116.11.3-174.6-61-81.6000113.4I282 V287 K290 L337 L338 V344I282-Y342 HydrophobicContact CD1-CD1 4.12Å; I282-Y342 HydrophobicContact CG1-CD1 4.23Å; I282-Y342 HydrophobicContact CG2-CD1 4.13Å; I282-Y342 HydrophobicContact CG2-CE1 4.38Å; V287-Y342 HydrophobicContact CG2-CD1 4.01Å; V287-Y342 HydrophobicContact CG2-CD2 4.49Å; V287-Y342 HydrophobicContact CG2-CE1 3.54Å; V287-Y342 HydrophobicContact CG2-CE2 4.09Å; V287-Y342 HydrophobicContact CG2-CG 4.45Å; K290-Y342 HydrophobicContact CD-CE2 4.25Å; K290-Y342 VanDerWaalsContact CD-OH 3.32Å; K290-Y342 WeakPolarHBondContact CD-OH 3.41Å; K290-Y342 WeakPolarHBondContact CE-OH 3.24Å; K290-Y342 PolarHBondContact NZ-OH 3.3Å; L337-Y342 HydrophobicContact CD2-CD2 4.19Å; L337-Y342 HydrophobicContact CD2-CE2 3.81Å; L338-Y342 HydrophobicContact CD2-CD2 4.4Å; L338-Y342 CarbonylContact O-C 3.57Å; L338-Y342 WeakPolarHBondContact O-CB 3.4Å; L338-Y342 PolarHBondContact O-N 3.08Å; Y342-V344 PolarHBondContact O-N 3.24Å; Y342-V344 VanDerWaalsContact O-N 3.16Å
343H89Confident93.2Very high134 Ų13461.9 Ų61.962%0.6230%0.304SS*.  trans52.836.2179.4-55.6-45.7000113.2L338 R339 F345L338-H343 PolarHBondContact O-N 3.12Å; R339-H343 VanDerWaalsContact O-CA 3.25Å; R339-H343 WeakPolarHBondContact O-CA 3.24Å; R339-H343 PolarHBondContact O-N 3.25Å; H343-F345 PolarHBondContact O-N 3.33Å
344V90.5Very high93Very high12 Ų1260.6 Ų60.67%0.07330%0.298CS..EExtended strand (participates in β ladder)trans-62.1126.4178.2177.10000109.3I313 V315 L338 Y342 E346 C347I313-V344 HydrophobicContact CG2-CG2 4.26Å; V315-V344 HydrophobicContact CB-CG1 4.07Å; V315-V344 HydrophobicContact CB-CG2 4.43Å; V315-V344 HydrophobicContact CG2-CB 4.4Å; V315-V344 HydrophobicContact CG2-CG1 3.87Å; V315-V344 HydrophobicContact CG2-CG2 3.55Å; L338-V344 HydrophobicContact CB-CB 4.3Å; L338-V344 HydrophobicContact CB-CG2 4.05Å; L338-V344 WeakPolarHBondContact O-CG2 3.49Å; L338-V344 PolarHBondContact O-N 2.9Å; Y342-V344 PolarHBondContact O-N 3.24Å; Y342-V344 VanDerWaalsContact O-N 3.16Å; V344-E346 WeakPolarHBondContact CG1-O 3.43Å; V344-C347 HydrophobicContact CG1-CB 3.82Å
345F88.2Confident92.6Very high89 Ų8962.8 Ų62.839%0.3931%0.314SS..EExtended strand (participates in β ladder)trans-79.5-44.3-179.8179.2-107.3000110.9L308 K312 I313 H343L308-F345 HydrophobicContact CD1-CD1 4.34Å; K312-F345 HydrophobicContact CB-CB 4.16Å; K312-F345 HydrophobicContact CB-CD1 4.1Å; K312-F345 HydrophobicContact CB-CG 4.13Å; K312-F345 HydrophobicContact CD-CD1 3.95Å; K312-F345 HydrophobicContact CD-CD2 4.49Å; K312-F345 HydrophobicContact CD-CE1 3.94Å; K312-F345 HydrophobicContact CD-CE2 4.46Å; K312-F345 HydrophobicContact CD-CG 4.26Å; K312-F345 HydrophobicContact CD-CZ 4.21Å; K312-F345 HydrophobicContact CG-CB 4.31Å; K312-F345 HydrophobicContact CG-CD1 4.01Å; K312-F345 HydrophobicContact CG-CD2 4.2Å; K312-F345 HydrophobicContact CG-CE1 4.47Å; K312-F345 HydrophobicContact CG-CG 3.9Å; I313-F345 WeakPolarHBondContact O-CA 3.44Å; I313-F345 WeakPolarHBondContact O-CB 3.03Å; I313-F345 PolarHBondContact O-N 3.11Å; H343-F345 PolarHBondContact O-N 3.33Å
346E90.2Very high92.1Very high91 Ų9169.1 Ų69.143%0.42534%0.341SS..EExtended strand (participates in β ladder)trans-131.8128.4176.7-69.5-66.3172.600109.8I313 A314 V315 V344I313-E346 PolarHBondContact O-N 3.14Å; A314-E346 CarbonylContact C-O 3.54Å; A314-E346 VanDerWaalsContact CA-O 3.22Å; A314-E346 WeakPolarHBondContact CA-O 3.48Å; A314-E346 HydrophobicContact CB-CB 4.32Å; V315-E346 PolarHBondContact N-O 3.49Å; V344-E346 WeakPolarHBondContact CG1-O 3.43Å
347C93.8Very high91.5Very high40 Ų4073.3 Ų73.327%0.2736%0.361SS..EExtended strand (participates in β ladder)trans-131.7135176.364.30000112.2V315 L338 V344V315-C347 CarbonylContact O-C 3.54Å; V315-C347 VanDerWaalsContact O-CA 3.26Å; V315-C347 WeakPolarHBondContact O-CA 3.06Å; L338-C347 HydrophobicContact CD1-CB 4.24Å; V344-C347 HydrophobicContact CG1-CB 3.82Å
348T95Very high90.9Very high91 Ų9172.9 Ų72.956%0.55836%0.359SS*.EExtended strand (participates in β ladder)trans-116117169.5-57.50000108.4V315 S316 V317V315-T348 PolarHBondContact O-N 3.34Å; S316-T348 CarbonylContact C-O 3.56Å; S316-T348 VanDerWaalsContact CA-O 3.32Å; S316-T348 WeakPolarHBondContact CA-O 3.36Å; V317-T348 PolarHBondContact N-O 3.42Å
349V96.5Very high90Very high20 Ų2079.6 Ų79.612%0.12139%0.39CS..EExtended strand (participates in β ladder)trans-114.6109.1176.9179.50000107.5V317 L319 L331 A334 L338 I351V317-V349 HydrophobicContact CG1-CB 4.36Å; V317-V349 HydrophobicContact CG1-CG1 4.28Å; V317-V349 HydrophobicContact CG1-CG2 3.92Å; V317-V349 WeakPolarHBondContact O-CA 3.48Å; L319-V349 HydrophobicContact CD1-CG1 3.56Å; L319-V349 HydrophobicContact CG-CG1 3.94Å; L331-V349 HydrophobicContact CD1-CB 3.61Å; L331-V349 HydrophobicContact CD1-CG1 3.9Å; L331-V349 HydrophobicContact CD1-CG2 4.45Å; A334-V349 HydrophobicContact CB-CG1 4.25Å; A334-V349 HydrophobicContact CB-CG2 4.39Å; L338-V349 HydrophobicContact CD1-CG2 4.2Å; V349-I351 HydrophobicContact CG1-CG1 4.24Å
350Q95.9Very high89.3Confident89 Ų8977.6 Ų77.642%0.41640%0.403SS..EExtended strand (participates in β ladder)trans-88.1132.5171.5-179.9172.8-51.900109V317 H318 L319 E352V317-Q350 PolarHBondContact O-N 3.22Å; H318-Q350 CarbonylContact C-O 3.56Å; H318-Q350 WeakPolarHBondContact CA-O 3.32Å; H318-Q350 PolarHBondContact CE1-NE2 2.94Å; H318-Q350 PolarHBondContact CE1-OE1 3.37Å; H318-Q350 PolarHBondContact ND1-NE2 2.78Å; L319-Q350 PolarHBondContact N-O 2.88Å; Q350-E352 PolarHBondContact NE2-OE2 2.95Å
351I95.9Very high88.7Confident43 Ų4375 Ų7522%0.22139%0.393CS..EExtended strand (participates in β ladder)trans-112.9133.3177.3-61.3-177.9000109.3L319 I321 A327 V330 L331 V349L319-I351 WeakPolarHBondContact O-CA 3.33Å; I321-I351 HydrophobicContact CD1-CG2 3.56Å; I321-I351 HydrophobicContact CG1-CG2 3.73Å; I321-I351 HydrophobicContact CG2-CG2 4Å; A327-I351 HydrophobicContact CB-CD1 4.37Å; A327-I351 HydrophobicContact CB-CG2 3.97Å; A327-I351 WeakPolarHBondContact O-CD1 3.35Å; V330-I351 HydrophobicContact CB-CD1 4.23Å; V330-I351 HydrophobicContact CG1-CD1 4.25Å; L331-I351 HydrophobicContact CB-CD1 3.63Å; L331-I351 HydrophobicContact CD1-CD1 4.38Å; V349-I351 HydrophobicContact CG1-CG1 4.24Å
352E93.7Very high88Confident55 Ų5577.9 Ų77.926%0.25741%0.406SS..EExtended strand (participates in β ladder)trans-139.2161.517657.9-170.2-138.300110.8H301 H318 L319 A320 I321 Q350 M358H301-E352 IonicContact CE1-OE1 3.36Å; H301-E352 PolarHBondContact CE1-OE1 3.01Å; H301-E352 IonicContact NE2-OE1 2.71Å; H301-E352 PolarHBondContact NE2-OE1 2.89Å; H301-E352 VanDerWaalsContact NE2-OE1 3.16Å; H318-E352 IonicContact ND1-OE2 3.91Å; L319-E352 PolarHBondContact O-N 3.35Å; A320-E352 CarbonylContact C-O 3.51Å; A320-E352 VanDerWaalsContact CA-O 3.28Å; A320-E352 WeakPolarHBondContact CA-O 3.34Å; A320-E352 HydrophobicContact CB-CG 4.48Å; I321-E352 WeakPolarHBondContact CG1-O 3.39Å; I321-E352 PolarHBondContact N-O 3.47Å; Q350-E352 PolarHBondContact NE2-OE2 2.95Å; E352-M358 HydrophobicContact CG-CE 4.07Å; E352-M358 WeakPolarHBondContact OE1-CE 3.48Å
353H94.4Very high87.2Confident108 Ų10887.8 Ų87.850%0.544%0.444SS..EExtended strand (participates in β ladder)trans-79.2138.5175.1-67.5-58.8000110.5S355 M358H353-S355 PolarHBondContact O-N 2.72Å; H353-M358 WeakPolarHBondContact O-CE 3.35Å
354F90.3Very high86.6Confident54 Ų5482.3 Ų82.324%0.23742%0.42CS..  trans-59.3128.4173.6-177.2-101.9000111.2A298 K299 A320 I321 M358 Q359A298-F354 HydrophobicContact CB-CB 3.85Å; A298-F354 HydrophobicContact CB-CD2 3.77Å; A298-F354 HydrophobicContact CB-CG 3.81Å; K299-F354 HydrophobicContact CB-CD2 4.38Å; K299-F354 HydrophobicContact CB-CE2 4.39Å; A320-F354 HydrophobicContact CB-CB 4.3Å; A320-F354 HydrophobicContact CB-CD2 4.18Å; I321-F354 PolarHBondContact O-N 3.43Å; F354-M358 HydrophobicContact CD2-SD 4.15Å; F354-M358 HydrophobicContact CE2-CB 4.44Å; F354-Q359 HydrophobicContact CZ-CG 4.04Å
355S87.9Confident86.1Confident46 Ų4687.2 Ų87.232%0.32244%0.442SS..  trans-120.7148.9169.469.60000110.4H353 D357 M358H353-S355 PolarHBondContact O-N 2.72Å; S355-D357 PolarHBondContact O-N 2.76Å; S355-M358 WeakPolarHBondContact O-CB 3.08Å; S355-M358 WeakPolarHBondContact O-CG 3.41Å; S355-M358 PolarHBondContact O-N 2.94Å; S355-M358 VanDerWaalsContact O-N 3.12Å
356E83.2Confident85.7Confident161 Ų16186.9 Ų86.975%0.75245%0.449SS*.G310 helixtrans-61.8-30-178.3-66.7-176.3173.500112.4M358 Q359E356-M358 PolarHBondContact O-N 3.11Å; E356-M358 VanDerWaalsContact O-N 3.08Å; E356-Q359 WeakPolarHBondContact O-CB 3.42Å; E356-Q359 PolarHBondContact O-N 2.83Å
357D81.7Confident85.2Confident141 Ų14187.1 Ų87.175%0.75446%0.458SS*.G310 helixtrans-57.1-26.4176.7-57.8-31.2000112.9S355 Q359S355-D357 PolarHBondContact O-N 2.76Å; D357-Q359 PolarHBondContact O-N 2.99Å
358M82.5Confident84.5Confident17 Ų1794.5 Ų94.58%0.08449%0.486CS..G310 helixtrans-67.1-20.8178.1-62.5178.4-175.600112.9K299 A320 E352 H353 F354 S355 E356 G360K299-M358 HydrophobicContact CD-CB 4.46Å; K299-M358 PolarHBondContact NZ-O 2.94Å; A320-M358 HydrophobicContact CB-CE 4.34Å; A320-M358 HydrophobicContact CB-SD 3.69Å; E352-M358 HydrophobicContact CG-CE 4.07Å; E352-M358 WeakPolarHBondContact OE1-CE 3.48Å; H353-M358 WeakPolarHBondContact O-CE 3.35Å; F354-M358 HydrophobicContact CD2-SD 4.15Å; F354-M358 HydrophobicContact CE2-CB 4.44Å; S355-M358 WeakPolarHBondContact O-CB 3.08Å; S355-M358 WeakPolarHBondContact O-CG 3.41Å; S355-M358 PolarHBondContact O-N 2.94Å; S355-M358 VanDerWaalsContact O-N 3.12Å; E356-M358 PolarHBondContact O-N 3.11Å; E356-M358 VanDerWaalsContact O-N 3.08Å; M358-G360 VanDerWaalsContact C-N 3.33Å; M358-G360 PolarHBondContact O-N 3.11Å
359Q76.3Confident83.2Confident142 Ų142105.5 Ų105.566%0.66452%0.517SS*.G310 helixtrans-66.3-34.5-178.2-67.5-174.81.800112.4F354 E356 D357F354-Q359 HydrophobicContact CZ-CG 4.04Å; E356-Q359 WeakPolarHBondContact O-CB 3.42Å; E356-Q359 PolarHBondContact O-N 2.83Å; D357-Q359 PolarHBondContact O-N 2.99Å
360G76.1Confident82.5Confident67 Ų67109.8 Ų109.869%0.69154%0.537SS*.G310 helixtrans-100.22.8-177.900000115.4M358 Q362M358-G360 VanDerWaalsContact C-N 3.33Å; M358-G360 PolarHBondContact O-N 3.11Å; G360-Q362 PolarHBondContact O-N 2.83Å
361C78.4Confident81.8Confident46 Ų46110.8 Ų110.831%0.31154%0.543SS..  trans-77.9110.5-175.9-176.10000111.7R363 C364C361-R363 PolarHBondContact O-N 3.38Å; C361-C364 HydrophobicContact CB-CB 4.02Å; C361-C364 WeakPolarHBondContact O-CB 3.28Å; C361-C364 PolarHBondContact O-N 3.5Å
362Q76.7Confident81.1Confident164 Ų164114.6 Ų114.677%0.76656%0.561SS**G310 helixtrans-60.5-27.3176.2-66.9-179.4100113.4G360 C364 E365G360-Q362 PolarHBondContact O-N 2.83Å; Q362-C364 VanDerWaalsContact C-N 3.27Å; Q362-C364 PolarHBondContact O-N 3.05Å; Q362-E365 PolarHBondContact O-N 3.47Å
363R75.8Confident80.3Confident234 Ų234118.1 Ų118.188%0.88358%0.579SS**G310 helixtrans-74.7-17.4175.6-67.5-174.7179.2170.90.2113.2C361C361-R363 PolarHBondContact O-N 3.38Å
364C76.5Confident79.4Confident18 Ų18118.8 Ų118.812%0.12258%0.584CS.*G310 helixtrans-91.1-5.8176.2-64.40000112.5H301 C361 Q362H301-C364 HydrophobicContact CB-CB 3.85Å; C361-C364 HydrophobicContact CB-CB 4.02Å; C361-C364 WeakPolarHBondContact O-CB 3.28Å; C361-C364 PolarHBondContact O-N 3.5Å; Q362-C364 VanDerWaalsContact C-N 3.27Å; Q362-C364 PolarHBondContact O-N 3.05Å
365E78.8Confident78.7Confident115 Ų115123.1 Ų123.154%0.53761%0.607SS.*SBendtrans-72.5139.6172.7-68.1-177-177.100109.9Q362Q362-E365 PolarHBondContact O-N 3.47Å
366P79.9Confident78.1Confident82 Ų82128.6 Ų128.653%0.53263%0.627SS.*PPolyproline II helixtrans-60.7144.7173.125.2-32.2000110.3F284 I288 K368F284-P366 HydrophobicContact CE1-CB 3.99Å; I288-P366 HydrophobicContact CD1-CB 3.84Å; P366-K368 PolarHBondContact O-N 3.47Å
367P80.6Confident77.7Confident97 Ų97126.1 Ų126.163%0.6362%0.618SS**PPolyproline II helixtrans-54.4140.1175.721-31.8000111.2F284F284-P367 HydrophobicContact CE1-CG 3.93Å; F284-P367 HydrophobicContact CE2-CG 4.48Å; F284-P367 HydrophobicContact CZ-CG 3.84Å
368K78.1Confident77.3Confident194 Ų194124.8 Ų124.884%0.84361%0.607SS**PPolyproline II helixtrans-69.3147.5175.7-64.1-179.7-177.6177.10109.7P366P366-K368 PolarHBondContact O-N 3.47Å
369R68.2Low76.9Confident322 Ų322134.6 Ų134.6100%1.21565%0.654SS**  trans-64.20-178.4-160.2-178.8-169.6-172.75.7112.9

Retrieved 369 of 369 residues in 198.6 ms (Link to these results)