A0A5K4F877_SCHMA Loading...

TNFR

AlphaFold DB , UniProt , Accession A0A5K4F877, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 384 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
1M34.3Very low30.9Very low241 Ų241141.3 Ų141.3100%1.18782%0.818SS**  0120.40-80.5138.676.500107.6
2A33.1Very low30.4Very low105 Ų105138.5 Ų138.587%0.86880%0.804SS**  trans-75.5151.9-170.500000113
3P36.4Very low30.5Very low116 Ų116136.1 Ų136.175%0.75380%0.8SS**  trans-128.6120.7147.629.9-13000113.3
4L28.7Very low30.1Very low161 Ų161136.4 Ų136.484%0.84380%0.796SS**  trans46135.2142.6-63.8164.6000122.3
5P29.8Very low30Very low116 Ų116135.1 Ų135.175%0.75379%0.791SS**  trans-84.6128179.234.5-30.1000111.5
6V33Very low29.8Very low121 Ų121135.6 Ų135.673%0.73380%0.796SS**  trans-94.3112.2163.6-1800000107.4N8V6-N8 VanDerWaalsContact C-N 3.34Å; V6-N8 PolarHBondContact O-N 2.99Å
7T28.1Very low29.7Very low128 Ų128136.3 Ų136.379%0.78579%0.794SS**  trans-74.288.5168.6510000109
8N29.3Very low29.5Very low131 Ų131140.6 Ų140.670%0.70180%0.795SS**  trans-94.2106158.8-87.5-11000107.5V6 V10V6-N8 VanDerWaalsContact C-N 3.34Å; V6-N8 PolarHBondContact O-N 2.99Å; N8-V10 VanDerWaalsContact C-N 3.29Å; N8-V10 PolarHBondContact O-N 3.49Å
9N31.4Very low29.4Very low164 Ų164140.3 Ų140.388%0.87780%0.799SS**  trans-68.994.3165.8-82.9-7.5000108.4
10V25.7Very low29.2Very low112 Ų112137.7 Ų137.768%0.67979%0.79SS**  trans-72.6111.9157.5170.20000107.3N8 V12N8-V10 VanDerWaalsContact C-N 3.29Å; N8-V10 PolarHBondContact O-N 3.49Å; V10-V12 HydrophobicContact CG1-CB 4.44Å; V10-V12 HydrophobicContact CG1-CG2 4Å
11I30Very low29Very low159 Ų159140 Ų14082%0.81579%0.794SS**  trans-124.492.2141.9-59.6-179.1000105.6
12V25.5Very low28.7Very low108 Ų108136.1 Ų136.166%0.65578%0.777SS**  trans-72.1127.7159.6166.60000106.7V10V10-V12 HydrophobicContact CG1-CB 4.44Å; V10-V12 HydrophobicContact CG1-CG2 4Å
13S30.8Very low28.3Very low107 Ų107141.5 Ų141.575%0.74878%0.777SS**  trans-149.897.1148.7-67.60000107.4T15S13-T15 PolarHBondContact O-N 2.97Å
14D24.8Very low28Very low140 Ų140141.2 Ų141.275%0.74977%0.772SS**  trans-38.7130156.5-80.9-48.6000110.7
15T28.8Very low27.8Very low117 Ų117142.6 Ų142.672%0.71877%0.771SS**  trans-162.799.9139.9-62.10000108.8S13 I17S13-T15 PolarHBondContact O-N 2.97Å; T15-I17 HydrophobicContact CG2-CB 4.35Å; T15-I17 HydrophobicContact CG2-CD1 3.64Å; T15-I17 HydrophobicContact CG2-CG1 3.62Å
16T27.1Very low27.8Very low143 Ų143144.1 Ų144.188%0.87777%0.773SS**  trans-79.9107.4160.7-58.80000108.5
17I28Very low27.4Very low148 Ų148143.7 Ų143.776%0.75978%0.776SS**  trans-138.9131.1165.6-62179000110.7T15T15-I17 HydrophobicContact CG2-CB 4.35Å; T15-I17 HydrophobicContact CG2-CD1 3.64Å; T15-I17 HydrophobicContact CG2-CG1 3.62Å
18R25.6Very low27.4Very low214 Ų214146.1 Ų146.181%0.80878%0.775SS**  trans-57.2158.1-179.5-83.7174.1163.4-161.5-3.9114.7S20R18-S20 PolarHBondContact O-N 3.01Å; R18-S20 VanDerWaalsContact O-N 3.13Å
19P27.6Very low27.2Very low134 Ų134149 Ų14987%0.8779%0.785SS**SBendtrans-83.389.1173.534.8-29.5000109.9
20S25.2Very low27Very low89 Ų89151.3 Ų151.362%0.62278%0.783SS**  trans-163.9125.6164.839.10000108.3R18R18-S20 PolarHBondContact O-N 3.01Å; R18-S20 VanDerWaalsContact O-N 3.13Å
21E26Very low27.1Very low185 Ų185152.3 Ų152.386%0.86478%0.784SS**  trans89.981.2175.6-53-175.5173.100117.1
22L28.7Very low27Very low161 Ų161154.7 Ų154.784%0.84379%0.788SS**  trans-122.180.3144.1-112.9160.6000108.2V24L22-V24 VanDerWaalsContact C-N 3.33Å; L22-V24 HydrophobicContact CD2-CG2 3.75Å; L22-V24 PolarHBondContact O-N 3.38Å; L22-V24 VanDerWaalsContact O-N 3.1Å
23Y24.1Very low27.1Very low218 Ų218158.2 Ų158.286%0.85580%0.795SS**  trans-70.589.6163.8-119-90.8000107.8K25Y23-K25 PolarHBondContact O-N 3.18Å
24V29.2Very low27.1Very low109 Ų109158.8 Ų158.866%0.66179%0.79SS**  trans-89.595.8163.2179.70000107.5L22 N26L22-V24 VanDerWaalsContact C-N 3.33Å; L22-V24 HydrophobicContact CD2-CG2 3.75Å; L22-V24 PolarHBondContact O-N 3.38Å; L22-V24 VanDerWaalsContact O-N 3.1Å; V24-N26 PolarHBondContact O-N 3.05Å; V24-N26 VanDerWaalsContact O-N 3.09Å
25K25.2Very low27.3Very low190 Ų190160.9 Ų160.983%0.82680%0.795SS**  trans-70.693.4168.7-154.6176.6-168177.70107.5Y23Y23-K25 PolarHBondContact O-N 3.18Å
26N28.6Very low27.6Very low149 Ų149162 Ų16280%0.79780%0.797SS**  trans-134.5110.3159.2-104.9-14.9000109.8V24 K28V24-N26 PolarHBondContact O-N 3.05Å; V24-N26 VanDerWaalsContact O-N 3.09Å; N26-K28 PolarHBondContact O-N 3.04Å
27S25.1Very low27.7Very low112 Ų112163.6 Ų163.678%0.78380%0.795SS**  trans-52.7124.7176.1-54.50000112.3
28K27.8Very low27.8Very low179 Ų179164.1 Ų164.178%0.77880%0.795SS**  -168.2104.4128.1-99.1165.8-167.4-173.80107.8N26 Y30N26-K28 PolarHBondContact O-N 3.04Å; K28-Y30 WeakPolarHBondContact O-CD2 3.41Å; K28-Y30 PolarHBondContact O-N 3.3Å; K28-Y30 VanDerWaalsContact O-N 3.12Å
29E25.5Very low28.2Very low191 Ų191163 Ų16389%0.89380%0.796SS**  trans-34.8106157.3-170.1167.5-16100110.1
30Y27Very low28.6Very low213 Ų213161.9 Ų161.984%0.83579%0.787SS**  trans-102.4117161.5-86-82.7000106.3K28 K32K28-Y30 WeakPolarHBondContact O-CD2 3.41Å; K28-Y30 PolarHBondContact O-N 3.3Å; K28-Y30 VanDerWaalsContact O-N 3.12Å; Y30-K32 PolarHBondContact O-N 2.84Å
31D27.8Very low29.3Very low133 Ų133161.4 Ų161.471%0.71178%0.777SS**  trans-47.9132.3172.4-87-48.9000110.6F33D31-F33 PolarHBondContact O-N 2.68Å
32K28.9Very low30.2Very low208 Ų208155.9 Ų155.990%0.90475%0.754SS**  trans-63.584.5169.7-165.9-179.4-174.2-172.80107.4Y30 D34Y30-K32 PolarHBondContact O-N 2.84Å; K32-D34 PolarHBondContact O-N 3.17Å
33F27.3Very low31.2Very low183 Ų183151.3 Ų151.380%0.80373%0.725SS**  trans-63.5121.1170.7-107.6-92.9000108.2D31 E35D31-F33 PolarHBondContact O-N 2.68Å; F33-E35 PolarHBondContact O-N 3.47Å; F33-E35 VanDerWaalsContact O-N 3.16Å
34D30Very low32.1Very low118 Ų118144 Ų14463%0.63170%0.699SS**  trans-54.8114171.8-126.4-38.6000108.8K32 N36 E37K32-D34 PolarHBondContact O-N 3.17Å; D34-N36 PolarHBondContact O-N 3.16Å; D34-E37 PolarHBondContact O-N 3.13Å
35E30.8Very low32.9Very low184 Ų184143.9 Ų143.986%0.8670%0.699SS**THydrogen-bonded Turntrans-59.8-1.8174.9-90.6179.9154.200113.1F33F33-E35 PolarHBondContact O-N 3.47Å; F33-E35 VanDerWaalsContact O-N 3.16Å
36N33.2Very low33.8Very low142 Ų142137.1 Ų137.176%0.75967%0.671SS**THydrogen-bonded Turntrans-91.5-8.8-178.3-72.7-37.7000115.4D34D34-N36 PolarHBondContact O-N 3.16Å
37E29.7Very low34.5Very low176 Ų176130.9 Ų130.982%0.82264%0.638SS**SBendtrans-105.3-2.6175-86.7-165.815500114.8D34 K39D34-E37 PolarHBondContact O-N 3.13Å; E37-K39 PolarHBondContact O-N 3.24Å
38M29.7Very low35.1Very low158 Ų158128.7 Ų128.778%0.77862%0.621SS**  trans-83.560.8166.7-106.1-167.1-171.900111.2V40M38-V40 HydrophobicContact CB-CG2 4.38Å; M38-V40 HydrophobicContact CG-CG2 4.04Å; M38-V40 PolarHBondContact O-N 3.47Å; M38-V40 HydrophobicContact SD-CG2 4.19Å
39K35.3Very low35.5Very low190 Ų190131.1 Ų131.183%0.82663%0.625SS**  trans-73.172.2148.2-80.4-172.7-179.5179.10107.5E37 L41E37-K39 PolarHBondContact O-N 3.24Å; K39-L41 VanDerWaalsContact C-N 3.32Å; K39-L41 PolarHBondContact O-N 3.2Å
40V34.8Very low35.7Very low111 Ų111124.5 Ų124.567%0.67360%0.6SS**  trans-52.9109154.8178.20000104.2M38 N42M38-V40 HydrophobicContact CB-CG2 4.38Å; M38-V40 HydrophobicContact CG-CG2 4.04Å; M38-V40 PolarHBondContact O-N 3.47Å; M38-V40 HydrophobicContact SD-CG2 4.19Å; V40-N42 PolarHBondContact O-N 3.35Å
41L39.9Very low35.8Very low79 Ų79119.7 Ų119.741%0.41460%0.598SS.*  trans-53.8115.4-173.9-125.493000108.3K39 W43 L46 Q349K39-L41 VanDerWaalsContact C-N 3.32Å; K39-L41 PolarHBondContact O-N 3.2Å; L41-W43 PolarHBondContact O-N 3.41Å; L41-L46 HydrophobicContact CD2-CD1 4.43Å; L41-Q349 VanDerWaalsContact CD2-CD 3.44Å
42N44.7Very low35.9Very low70 Ų70117.5 Ų117.537%0.37459%0.593SS.*  trans-74.897.6178.3-167.72.4000106.6V40 Q44 T45V40-N42 PolarHBondContact O-N 3.35Å; N42-Q44 VanDerWaalsContact CG-CD 3.48Å; N42-Q44 VanDerWaalsContact CG-OE1 3.23Å; N42-Q44 PolarHBondContact ND2-OE1 2.95Å; N42-Q44 PolarHBondContact O-N 3.37Å; N42-Q44 WeakPolarHBondContact OD1-CB 3.42Å; N42-Q44 WeakPolarHBondContact OD1-CG 3.47Å; N42-Q44 PolarHBondContact OD1-N 2.98Å; N42-Q44 PolarHBondContact OD1-NE2 3.01Å; N42-Q44 PolarHBondContact OD1-OE1 3.47Å; N42-T45 PolarHBondContact O-N 3.42Å; N42-T45 PolarHBondContact O-OG1 3.17Å
43W49.9Very low35.8Very low65 Ų65114.8 Ų114.825%0.24659%0.588CS.*G310 helixtrans-50.9-19.1177.554.5-94.6000112.5L41 T45 L46 L47 V235 T280L41-W43 PolarHBondContact O-N 3.41Å; W43-T45 PolarHBondContact O-N 3.49Å; W43-L46 PolarHBondContact O-N 3.17Å; W43-L46 VanDerWaalsContact O-N 3.08Å; W43-L47 HydrophobicContact CE3-CD1 4.32Å; W43-L47 HydrophobicContact CZ3-CD1 4.05Å; W43-V235 HydrophobicContact CE3-CG2 4.34Å; W43-T280 HydrophobicContact CH2-CG2 3.14Å; W43-T280 WeakPolarHBondContact CH2-OG1 3.36Å; W43-T280 HydrophobicContact CZ2-CG2 4.02Å; W43-T280 HydrophobicContact CZ3-CG2 3.49Å; W43-T280 VanDerWaalsContact CZ3-CG2 3.49Å
44Q43.5Very low35.8Very low63 Ų63115 Ų11529%0.29459%0.592SS.*G310 helixtrans-56.5-25.8170.4-61.4161.612.800113.4N42 L46 T280 H284N42-Q44 VanDerWaalsContact CG-CD 3.48Å; N42-Q44 VanDerWaalsContact CG-OE1 3.23Å; N42-Q44 PolarHBondContact ND2-OE1 2.95Å; N42-Q44 PolarHBondContact O-N 3.37Å; N42-Q44 WeakPolarHBondContact OD1-CB 3.42Å; N42-Q44 WeakPolarHBondContact OD1-CG 3.47Å; N42-Q44 PolarHBondContact OD1-N 2.98Å; N42-Q44 PolarHBondContact OD1-NE2 3.01Å; N42-Q44 PolarHBondContact OD1-OE1 3.47Å; Q44-L46 VanDerWaalsContact C-N 3.31Å; Q44-L46 PolarHBondContact O-N 3.39Å; Q44-T280 HydrophobicContact CG-CG2 4.05Å; Q44-H284 WeakPolarHBondContact CB-NE2 3.3Å; Q44-H284 VanDerWaalsContact CD-NE2 3.35Å; Q44-H284 WeakPolarHBondContact CG-NE2 3.49Å; Q44-H284 PolarHBondContact OE1-NE2 3.09Å
45T47.1Very low35.9Very low108 Ų108117.6 Ų117.666%0.66360%0.604SS**G310 helixtrans-78-10.3176.953.40000114.5N42 W43N42-T45 PolarHBondContact O-N 3.42Å; N42-T45 PolarHBondContact O-OG1 3.17Å; W43-T45 PolarHBondContact O-N 3.49Å
46L42.6Very low35.8Very low47 Ų47117.9 Ų117.925%0.24661%0.606CS.*G310 helixtrans-101.52.7-179-68.2155.1000112.7L41 W43 Q44 L346L41-L46 HydrophobicContact CD2-CD1 4.43Å; W43-L46 PolarHBondContact O-N 3.17Å; W43-L46 VanDerWaalsContact O-N 3.08Å; Q44-L46 VanDerWaalsContact C-N 3.31Å; Q44-L46 PolarHBondContact O-N 3.39Å; L46-L346 HydrophobicContact CB-CD1 4.25Å; L46-L346 HydrophobicContact CD1-CD1 4.16Å; L46-L346 HydrophobicContact CD1-CD2 3.62Å; L46-L346 HydrophobicContact CD1-CG 3.71Å
47L43.9Very low35.5Very low19 Ų19118.5 Ų118.510%0.09961%0.609CS.*SBendtrans-77.8145172.8-68.6167.6000109.7W43 R49 Y238 A281W43-L47 HydrophobicContact CE3-CD1 4.32Å; W43-L47 HydrophobicContact CZ3-CD1 4.05Å; L47-R49 PolarHBondContact O-N 2.98Å; L47-R49 VanDerWaalsContact O-N 3.08Å; L47-Y238 HydrophobicContact CD2-CE1 4.48Å; L47-A281 VanDerWaalsContact CD1-CA 3.42Å; L47-A281 HydrophobicContact CD1-CB 3.79Å; L47-A281 HydrophobicContact CD2-CB 3.53Å; L47-A281 HydrophobicContact CG-CB 4.15Å
48P38.2Very low35.4Very low65 Ų65120.4 Ų120.442%0.42261%0.609SS.*PPolyproline II helixtrans-61.4118.5-173.323.7-29.5000110S50P48-S50 PolarHBondContact O-N 2.95Å
49R35.7Very low35.3Very low230 Ų230119.5 Ų119.587%0.86861%0.612SS**PPolyproline II helixtrans-70.6120167.4-147.3172.4-176.3170.5-0.3105.8L47 S51L47-R49 PolarHBondContact O-N 2.98Å; L47-R49 VanDerWaalsContact O-N 3.08Å; R49-S51 PolarHBondContact O-N 3.24Å
50S30.4Very low34.9Very low53 Ų53119.5 Ų119.537%0.37161%0.608SS.*  trans-57.3115.9-179.959.40000109.3P48 S52P48-S50 PolarHBondContact O-N 2.95Å; S50-S52 PolarHBondContact O-N 3.08Å; S50-S52 VanDerWaalsContact O-N 3.13Å
51S27.8Very low34.7Very low112 Ų112120.2 Ų120.278%0.78362%0.615SS**  trans-71.5100.3167.438.20000107.9R49 D53R49-S51 PolarHBondContact O-N 3.24Å; S51-D53 PolarHBondContact O-N 2.87Å; S51-D53 VanDerWaalsContact O-N 3.15Å
52S30.5Very low34.2Very low87 Ų87124.4 Ų124.461%0.60864%0.635SS**THydrogen-bonded Turntrans-71.97.1-180-750000114.9S50S50-S52 PolarHBondContact O-N 3.08Å; S50-S52 VanDerWaalsContact O-N 3.13Å
53D26.7Very low33.3Very low151 Ų151129.9 Ų129.981%0.80766%0.658SS**THydrogen-bonded Turntrans-104.113.6-163-65.9-19.4000116.3S51S51-D53 PolarHBondContact O-N 2.87Å; S51-D53 VanDerWaalsContact O-N 3.15Å
54Q28.5Very low32.5Very low188 Ų188132.6 Ų132.688%0.87968%0.676SS**SBendtrans-132.721.1-179.6-75.9-137.150.200117.4
55L31.3Very low31.8Very low172 Ų172137.8 Ų137.890%0.90170%0.7SS**  trans-116.737.1176.7-142.482000114.8
56E28.3Very low31.4Very low189 Ų189138.6 Ų138.688%0.88371%0.705SS**  trans-99.666.4164.9-75.3-169157.900111.2
57N27.7Very low30.7Very low156 Ų156142.2 Ų142.283%0.83473%0.729SS**SBendtrans178.295.9151.2-107.4-36.5000110.8
58R26.5Very low30.2Very low216 Ų216150.7 Ų150.782%0.81577%0.765SS**  trans171.381.7139.1-94.6178.7-150.4-146.410.1108.9Y60R58-Y60 HydrophobicContact CG-CE2 4.35Å; R58-Y60 PolarHBondContact O-N 3.31Å
59T28.7Very low29.9Very low138 Ų138157.6 Ų157.685%0.84778%0.783SS**  trans-75.4113163.4-56.60000108.6
60Y26.8Very low29.9Very low190 Ų190154.2 Ų154.275%0.74578%0.78SS**  trans-120.8129.7155.9-74-79.2000108.1R58 M62R58-Y60 HydrophobicContact CG-CE2 4.35Å; R58-Y60 PolarHBondContact O-N 3.31Å; Y60-M62 PolarHBondContact O-N 3.28Å
61P30.1Very low30.2Very low127 Ų127156.9 Ų156.983%0.82579%0.791SS**  trans-81.2109.1174.531.8-28.4000108.3
62M29.6Very low30.3Very low166 Ų166158.6 Ų158.682%0.81879%0.791SS**  trans-108.6115.6168.4-165.5-179.8-89.900109Y60 I64Y60-M62 PolarHBondContact O-N 3.28Å; M62-I64 PolarHBondContact O-N 2.71Å
63H26.2Very low30.4Very low186 Ų186165.1 Ų165.186%0.86180%0.804SS**  trans-66.2114175.6-137.3-81.5000108.8
64I33.1Very low30.7Very low122 Ų122162.7 Ų162.763%0.62680%0.798SS**  trans-108.1110.9175.4-60.4175000108.5M62M62-I64 PolarHBondContact O-N 2.71Å
65Q28.6Very low30.8Very low172 Ų172158 Ų15880%0.80479%0.792SS**  trans-72.8116.6163.8-81.5176.4-10.700108.8V67Q65-V67 PolarHBondContact O-N 3.19Å
66T37.9Very low31.1Very low125 Ų125160.6 Ų160.677%0.76779%0.791SS**  trans-84.8102170.351.20000109.5F68T66-F68 VanDerWaalsContact C-N 3.31Å; T66-F68 PolarHBondContact O-N 3.2Å
67V29.3Very low31.2Very low122 Ų122159.2 Ų159.274%0.73979%0.79SS**  trans-84.380.2163177.80000107.9Q65Q65-V67 PolarHBondContact O-N 3.19Å
68F33.4Very low31.7Very low197 Ų197160.2 Ų160.286%0.86479%0.79SS**  trans-132.290.4153.2-87.7-79.6000105.8T66 I70T66-F68 VanDerWaalsContact C-N 3.31Å; T66-F68 PolarHBondContact O-N 3.2Å; F68-I70 PolarHBondContact O-N 3.34Å
69R30Very low32Very low210 Ų210159.1 Ų159.179%0.79279%0.794SS**  trans-73.9112163.2-70.8-173.4178.9172.2-0.9106.5D71R69-D71 PolarHBondContact O-N 3.07Å
70I36.8Very low32.5Very low159 Ų159157.1 Ų157.182%0.81579%0.786SS**  trans-7492.5150.1-65.8166.5000102.7F68 D72F68-I70 PolarHBondContact O-N 3.34Å; I70-D72 PolarHBondContact O-N 3.31Å
71D35.5Very low32.8Very low110 Ų110155.5 Ų155.559%0.58879%0.79SS**  trans-65.4116.9173-76.6-40.9000107.6R69 Y73R69-D71 PolarHBondContact O-N 3.07Å; D71-Y73 PolarHBondContact O-N 3.09Å
72D29.9Very low33.3Very low147 Ų147157.6 Ų157.679%0.78679%0.792SS**  trans-50.6105.3165.6-72.6-50.3000109.7I70 S74I70-D72 PolarHBondContact O-N 3.31Å; D72-S74 PolarHBondContact O-N 3.19Å
73Y33.5Very low33.8Very low225 Ų225154.6 Ų154.688%0.88279%0.788SS**  trans-75.976.9160.1-96.3-88.8000108.7D71D71-Y73 PolarHBondContact O-N 3.09Å
74S32Very low34.3Very low99 Ų99152 Ų15269%0.69278%0.78SS**  trans-91.6138.3156.967.50000109.4D72D72-S74 PolarHBondContact O-N 3.19Å
75A31.8Very low34.6Very low90 Ų90152.4 Ų152.474%0.74478%0.783SS**  trans82.983.2169.900000117.4
76Y36.7Very low35Very low226 Ų226151.9 Ų151.989%0.88679%0.786SS**  -125.1115.4127.5-95.9-83.2000108.4Q78Y76-Q78 PolarHBondContact O-N 2.83Å
77D31.2Very low35.4Very low161 Ų161151.9 Ų151.986%0.86178%0.782SS**  trans-56.4118.7161.7-75.9-46.3000109.1
78Q38.5Very low36.3Very low176 Ų176155.2 Ų155.282%0.82279%0.786SS**  trans-142.884.5152-159.9155.313.800108.9Y76 S80Y76-Q78 PolarHBondContact O-N 2.83Å; Q78-S80 PolarHBondContact O-N 2.89Å; Q78-S80 VanDerWaalsContact O-N 3.14Å
79E32.5Very low37.2Very low194 Ų194150.3 Ų150.391%0.90778%0.776SS**  trans-47.6111157.4-162.4157.5-161.300108.7
80S38.5Very low38.4Very low96 Ų96146.1 Ų146.167%0.67177%0.769SS**  trans-152.498.3161.4490000109.4Q78Q78-S80 PolarHBondContact O-N 2.89Å; Q78-S80 VanDerWaalsContact O-N 3.14Å
81D34.1Very low39.2Very low155 Ų155145.5 Ų145.583%0.82976%0.763SS**  trans18.2123.9145-64.8-41.3000119.5S83D81-S83 PolarHBondContact O-N 3.27Å
82I39.7Very low40.1Very low172 Ų172145.5 Ų145.588%0.88276%0.761SS**  trans-44.9116.7154.2-64.2156.4000109.9
83S40.8Very low41.6Very low103 Ų103145.3 Ų145.372%0.7276%0.759SS**  trans-143.5123.1152.1171.90000109.2D81D81-S83 PolarHBondContact O-N 3.27Å
84D36.7Very low43.3Very low130 Ų130138.6 Ų138.670%0.69574%0.743SS**  trans-41.5148.5163.8-60.5-60.6000113.1
85N38.5Very low45.4Very low131 Ų131138.5 Ų138.570%0.70173%0.734SS**  trans164.893.3131.7-77-27000112.9N87N85-N87 VanDerWaalsContact C-N 3.31Å; N85-N87 PolarHBondContact O-N 3.35Å
86N38.5Very low47.8Very low161 Ų161140.6 Ų140.686%0.86172%0.724SS**  32.925.1123.9-72.4-12.4000123.5
87N45.2Very low50Low126 Ų126134.2 Ų134.267%0.67471%0.711SS**  trans-119.527.2-179-74.2-18.7000115.8N85 S89N85-N87 VanDerWaalsContact C-N 3.31Å; N85-N87 PolarHBondContact O-N 3.35Å; N87-S89 VanDerWaalsContact C-N 3.32Å; N87-S89 PolarHBondContact O-N 3.37Å
88K48.1Very low52.5Low191 Ų191130 Ų13083%0.8369%0.694SS**THydrogen-bonded Turntrans-82.52.3-178.7-123.8162.5-175.71660115.4
89S53.5Low54.9Low95 Ų95125.6 Ų125.666%0.66468%0.675SS**THydrogen-bonded Turntrans-90.7-11-178.556.90000115.2N87N87-S89 VanDerWaalsContact C-N 3.32Å; N87-S89 PolarHBondContact O-N 3.37Å
90N54.5Low57.5Low121 Ų121122.1 Ų122.165%0.64766%0.66SS**SBendtrans-102.7-1.3-171.8-64.8-17000114.6
91Q53Low60.1Low147 Ų147118.8 Ų118.869%0.68764%0.641SS**SBendtrans-87-11.5-175.4-142.71731200113.8
92M55Low62.8Low110 Ų110116.3 Ų116.354%0.54263%0.627SS.*SBendtrans-87.6-22.9-179.1-67.317780.800113.8I95 Y96M92-I95 PolarHBondContact O-N 3.41Å; M92-Y96 HydrophobicContact CB-CD2 4.38Å; M92-Y96 HydrophobicContact CB-CE2 3.99Å; M92-Y96 HydrophobicContact CE-CE2 4.14Å; M92-Y96 WeakPolarHBondContact O-CD2 3.33Å; M92-Y96 PolarHBondContact O-N 2.83Å
93L60.8Low65.3Low143 Ų143112 Ų11275%0.74961%0.606SS**Hα-helixtrans-62.1-44.5-176.3-155.375.6000114.9I95 Y96 C97L93-I95 VanDerWaalsContact C-N 3.27Å; L93-I95 PolarHBondContact O-N 3.49Å; L93-Y96 PolarHBondContact O-N 3.37Å; L93-C97 PolarHBondContact O-N 3.2Å
94P70.4Confident67.8Low83 Ų83112 Ų11254%0.53960%0.596SS.*Hα-helixtrans-69-26.5178.924.4-31.6000113C97 S98P94-C97 PolarHBondContact O-N 3.32Å; P94-S98 PolarHBondContact O-N 3.1Å
95I76Confident70.5Confident97 Ų97110.7 Ų110.750%0.49759%0.588SS.*Hα-helixtrans-69.4-44.3179.1-60.5169.2000110.1M92 L93 C97 S98 I99M92-I95 PolarHBondContact O-N 3.41Å; L93-I95 VanDerWaalsContact C-N 3.27Å; L93-I95 PolarHBondContact O-N 3.49Å; I95-C97 PolarHBondContact O-N 3.31Å; I95-S98 PolarHBondContact O-N 2.84Å; I95-I99 HydrophobicContact CG2-CD1 3.82Å; I95-I99 WeakPolarHBondContact O-CG1 3.49Å; I95-I99 PolarHBondContact O-N 3.48Å
96Y80.8Confident73.1Confident135 Ų135108 Ų10853%0.52958%0.58SS.*Hα-helixtrans-65.1-38.1174.8-71.1-68.8000112.6M92 L93 S98 I99 M100M92-Y96 HydrophobicContact CB-CD2 4.38Å; M92-Y96 HydrophobicContact CB-CE2 3.99Å; M92-Y96 HydrophobicContact CE-CE2 4.14Å; M92-Y96 WeakPolarHBondContact O-CD2 3.33Å; M92-Y96 PolarHBondContact O-N 2.83Å; L93-Y96 PolarHBondContact O-N 3.37Å; Y96-S98 VanDerWaalsContact C-N 3.32Å; Y96-S98 PolarHBondContact O-N 3.28Å; Y96-I99 PolarHBondContact O-N 3.49Å; Y96-M100 WeakPolarHBondContact O-CB 3.46Å; Y96-M100 VanDerWaalsContact O-CG 3.25Å; Y96-M100 WeakPolarHBondContact O-CG 3.29Å; Y96-M100 PolarHBondContact O-N 2.81Å
97C82.7Confident75.6Confident92 Ų92105.2 Ų105.262%0.62256%0.564SS**Hα-helixtrans-61.7-41.4175.5-170.60000111.5L93 P94 I95 G101L93-C97 PolarHBondContact O-N 3.2Å; P94-C97 PolarHBondContact O-N 3.32Å; I95-C97 PolarHBondContact O-N 3.31Å; C97-G101 PolarHBondContact O-N 3.34Å
98S85.3Confident77.9Confident72 Ų72104.3 Ų104.350%0.50356%0.559SS.*Hα-helixtrans-64.7-45.6176-176.90000112.3P94 I95 Y96 G101 L102P94-S98 PolarHBondContact O-N 3.1Å; I95-S98 PolarHBondContact O-N 2.84Å; Y96-S98 VanDerWaalsContact C-N 3.32Å; Y96-S98 PolarHBondContact O-N 3.28Å; S98-G101 PolarHBondContact O-N 3.5Å; S98-L102 WeakPolarHBondContact O-CG 3.19Å; S98-L102 PolarHBondContact O-N 2.99Å
99I88.1Confident80.1Confident83 Ų8399.4 Ų99.443%0.42655%0.547SS..Hα-helixtrans-65.4-45.7179.3-67.1161.8000111I95 Y96 G101 L102 I103I95-I99 HydrophobicContact CG2-CD1 3.82Å; I95-I99 WeakPolarHBondContact O-CG1 3.49Å; I95-I99 PolarHBondContact O-N 3.48Å; Y96-I99 PolarHBondContact O-N 3.49Å; I99-G101 VanDerWaalsContact C-N 3.31Å; I99-G101 PolarHBondContact O-N 2.92Å; I99-L102 PolarHBondContact O-N 2.86Å; I99-I103 HydrophobicContact CG2-CD1 4Å; I99-I103 WeakPolarHBondContact O-CG1 3.35Å; I99-I103 PolarHBondContact O-N 2.89Å
100M87.8Confident82Confident121 Ų121101.4 Ų101.460%0.59654%0.541SS*.Hα-helixtrans-63.8-38.1176.9-68.9-63.7-115.800111.6Y96 I103 I104Y96-M100 WeakPolarHBondContact O-CB 3.46Å; Y96-M100 VanDerWaalsContact O-CG 3.25Å; Y96-M100 WeakPolarHBondContact O-CG 3.29Å; Y96-M100 PolarHBondContact O-N 2.81Å; M100-I103 PolarHBondContact O-N 3.12Å; M100-I103 HydrophobicContact SD-CD1 4.31Å; M100-I104 WeakPolarHBondContact O-CD1 3.37Å; M100-I104 VanDerWaalsContact O-CG1 3.27Å; M100-I104 WeakPolarHBondContact O-CG1 3.48Å; M100-I104 PolarHBondContact O-N 3.24Å
101G92.1Very high83.8Confident26 Ų2699.3 Ų99.327%0.26853%0.533SS..Hα-helixtrans-60.5-45.2173.300000112.7C97 S98 I99 I103 I104 I105C97-G101 PolarHBondContact O-N 3.34Å; S98-G101 PolarHBondContact O-N 3.5Å; I99-G101 VanDerWaalsContact C-N 3.31Å; I99-G101 PolarHBondContact O-N 2.92Å; G101-I103 VanDerWaalsContact C-N 3.34Å; G101-I103 PolarHBondContact O-N 2.93Å; G101-I104 PolarHBondContact O-N 3.37Å; G101-I105 WeakPolarHBondContact O-CD1 3.16Å; G101-I105 VanDerWaalsContact O-CG1 3.27Å; G101-I105 WeakPolarHBondContact O-CG1 3.39Å; G101-I105 PolarHBondContact O-N 3.37Å
102L90.4Very high85.7Confident103 Ų10396.9 Ų96.954%0.53953%0.528SS..Hα-helixtrans-64-37.9177.2-74174.9000112.6S98 I99 S106S98-L102 WeakPolarHBondContact O-CG 3.19Å; S98-L102 PolarHBondContact O-N 2.99Å; I99-L102 PolarHBondContact O-N 2.86Å; L102-S106 VanDerWaalsContact O-CB 3.28Å; L102-S106 WeakPolarHBondContact O-CB 3.5Å; L102-S106 PolarHBondContact O-N 2.86Å; L102-S106 PolarHBondContact O-OG 3.49Å
103I93.6Very high87.5Confident83 Ų8396.1 Ų96.143%0.42652%0.519SS..Hα-helixtrans-64.2-45.4175.6-66.7164.1000110.4I99 M100 G101 S106 L107I99-I103 HydrophobicContact CG2-CD1 4Å; I99-I103 WeakPolarHBondContact O-CG1 3.35Å; I99-I103 PolarHBondContact O-N 2.89Å; M100-I103 PolarHBondContact O-N 3.12Å; M100-I103 HydrophobicContact SD-CD1 4.31Å; G101-I103 VanDerWaalsContact C-N 3.34Å; G101-I103 PolarHBondContact O-N 2.93Å; I103-S106 PolarHBondContact O-N 2.9Å; I103-L107 HydrophobicContact CG2-CD1 4.06Å; I103-L107 WeakPolarHBondContact O-CG 3.02Å; I103-L107 PolarHBondContact O-N 3.21Å
104I93.3Very high88.9Confident101 Ų10194.5 Ų94.552%0.51851%0.506SS..Hα-helixtrans-63.1-45.9178.9-67.6164.5000110.9M100 G101 S106 L107 L108M100-I104 WeakPolarHBondContact O-CD1 3.37Å; M100-I104 VanDerWaalsContact O-CG1 3.27Å; M100-I104 WeakPolarHBondContact O-CG1 3.48Å; M100-I104 PolarHBondContact O-N 3.24Å; G101-I104 PolarHBondContact O-N 3.37Å; I104-S106 VanDerWaalsContact C-N 3.34Å; I104-S106 PolarHBondContact O-N 3.33Å; I104-L107 PolarHBondContact O-N 2.91Å; I104-L108 HydrophobicContact CG2-CD1 4.08Å; I104-L108 PolarHBondContact O-N 2.88Å
105I93.6Very high89.8Confident103 Ų10395.5 Ų95.553%0.52851%0.507SS..Hα-helixtrans-62.4-43.2177.8-68.5161.8000110.5G101 L107 L108 C109G101-I105 WeakPolarHBondContact O-CD1 3.16Å; G101-I105 VanDerWaalsContact O-CG1 3.27Å; G101-I105 WeakPolarHBondContact O-CG1 3.39Å; G101-I105 PolarHBondContact O-N 3.37Å; I105-L107 PolarHBondContact O-N 3.27Å; I105-L108 PolarHBondContact O-N 3.26Å; I105-C109 WeakPolarHBondContact O-CB 3.44Å; I105-C109 PolarHBondContact O-N 2.74Å
106S91.4Very high90.5Very high76 Ų7697.2 Ų97.253%0.53151%0.507SS..Hα-helixtrans-62.7-41.2177.7-59.80000112L102 I103 I104 C109 Y110L102-S106 VanDerWaalsContact O-CB 3.28Å; L102-S106 WeakPolarHBondContact O-CB 3.5Å; L102-S106 PolarHBondContact O-N 2.86Å; L102-S106 PolarHBondContact O-OG 3.49Å; I103-S106 PolarHBondContact O-N 2.9Å; I104-S106 VanDerWaalsContact C-N 3.34Å; I104-S106 PolarHBondContact O-N 3.33Å; S106-C109 PolarHBondContact O-N 3.42Å; S106-Y110 WeakPolarHBondContact O-CB 3.33Å; S106-Y110 PolarHBondContact O-N 3.43Å
107L91.9Very high90.6Very high101 Ų10198.2 Ų98.253%0.52951%0.51SS..Hα-helixtrans-65.4-42.1175.4-76.8168.6000112.1I103 I104 I105 Y110 V111I103-L107 HydrophobicContact CG2-CD1 4.06Å; I103-L107 WeakPolarHBondContact O-CG 3.02Å; I103-L107 PolarHBondContact O-N 3.21Å; I104-L107 PolarHBondContact O-N 2.91Å; I105-L107 PolarHBondContact O-N 3.27Å; L107-Y110 PolarHBondContact O-N 3.19Å; L107-V111 WeakPolarHBondContact O-CG2 3.34Å; L107-V111 PolarHBondContact O-N 2.76Å
108L93Very high90.4Very high108 Ų10899.3 Ų99.357%0.56551%0.506SS*.Hα-helixtrans-61.6-46.4175.3-79.5165.6000111.3I104 I105 Y110 V111 V112I104-L108 HydrophobicContact CG2-CD1 4.08Å; I104-L108 PolarHBondContact O-N 2.88Å; I105-L108 PolarHBondContact O-N 3.26Å; L108-Y110 VanDerWaalsContact C-N 3.3Å; L108-Y110 PolarHBondContact O-N 3.33Å; L108-V111 PolarHBondContact O-N 2.94Å; L108-V112 WeakPolarHBondContact O-CG2 3.41Å; L108-V112 PolarHBondContact O-N 3.33Å
109C94Very high90.2Very high87 Ų87103.5 Ų103.559%0.58851%0.511SS*.Hα-helixtrans-58.3-42.7174.2-107.70000111.6I105 S106 V112 Y113I105-C109 WeakPolarHBondContact O-CB 3.44Å; I105-C109 PolarHBondContact O-N 2.74Å; S106-C109 PolarHBondContact O-N 3.42Å; C109-V112 PolarHBondContact O-N 3.49Å; C109-Y113 VanDerWaalsContact O-CB 3.25Å; C109-Y113 WeakPolarHBondContact O-CB 3.35Å; C109-Y113 PolarHBondContact O-N 2.84Å
110Y93.5Very high89.6Confident137 Ų137103.3 Ų103.354%0.53751%0.508SS..Hα-helixtrans-64-41.8177.7-179.8-104.8000112.7S106 L107 L108 Y113 K114S106-Y110 WeakPolarHBondContact O-CB 3.33Å; S106-Y110 PolarHBondContact O-N 3.43Å; L107-Y110 PolarHBondContact O-N 3.19Å; L108-Y110 VanDerWaalsContact C-N 3.3Å; L108-Y110 PolarHBondContact O-N 3.33Å; Y110-Y113 PolarHBondContact O-N 3.18Å; Y110-K114 HydrophobicContact CE1-CD 4.45Å; Y110-K114 VanDerWaalsContact O-CB 3.25Å; Y110-K114 WeakPolarHBondContact O-CB 3.18Å; Y110-K114 PolarHBondContact O-N 2.99Å
111V93.4Very high88.5Confident77 Ų77100.6 Ų100.647%0.46750%0.504SS..Hα-helixtrans-65.3-43.9176.4175.90000111L107 L108 K114 L115L107-V111 WeakPolarHBondContact O-CG2 3.34Å; L107-V111 PolarHBondContact O-N 2.76Å; L108-V111 PolarHBondContact O-N 2.94Å; V111-K114 PolarHBondContact O-N 3.2Å; V111-L115 HydrophobicContact CG1-CD1 4.02Å; V111-L115 HydrophobicContact CG1-CG 4.45Å; V111-L115 WeakPolarHBondContact O-CB 3.27Å; V111-L115 WeakPolarHBondContact O-CG 3.41Å; V111-L115 PolarHBondContact O-N 3.24Å
112V93.2Very high87.1Confident96 Ų96102.4 Ų102.458%0.58251%0.513SS*.Hα-helixtrans-63.1-45.3176.9174.20000110.8L108 C109 K114 L115 W116L108-V112 WeakPolarHBondContact O-CG2 3.41Å; L108-V112 PolarHBondContact O-N 3.33Å; C109-V112 PolarHBondContact O-N 3.49Å; V112-K114 VanDerWaalsContact C-N 3.33Å; V112-K114 PolarHBondContact O-N 3.01Å; V112-L115 PolarHBondContact O-N 3.3Å; V112-W116 VanDerWaalsContact O-CB 3.28Å; V112-W116 WeakPolarHBondContact O-CB 3.18Å; V112-W116 PolarHBondContact O-N 3.38Å
113Y92.9Very high85.5Confident94 Ų94102.8 Ų102.837%0.36951%0.511SS..Hα-helixtrans-59.7-43.3175.3175.4-98.4000111.6C109 Y110 W116 R117C109-Y113 VanDerWaalsContact O-CB 3.25Å; C109-Y113 WeakPolarHBondContact O-CB 3.35Å; C109-Y113 PolarHBondContact O-N 2.84Å; Y110-Y113 PolarHBondContact O-N 3.18Å; Y113-W116 HydrophobicContact CD2-CE3 4.44Å; Y113-W116 PolarHBondContact O-N 3.36Å; Y113-R117 WeakPolarHBondContact O-CB 3.43Å; Y113-R117 PolarHBondContact O-N 3.42Å
114K89.6Confident83.6Confident109 Ų109104 Ų10447%0.47452%0.518SS..Hα-helixtrans-63.8-42.9177.5-172174.8-178.6178.20112.1Y110 V111 V112 Q118Y110-K114 HydrophobicContact CE1-CD 4.45Å; Y110-K114 VanDerWaalsContact O-CB 3.25Å; Y110-K114 WeakPolarHBondContact O-CB 3.18Å; Y110-K114 PolarHBondContact O-N 2.99Å; V111-K114 PolarHBondContact O-N 3.2Å; V112-K114 VanDerWaalsContact C-N 3.33Å; V112-K114 PolarHBondContact O-N 3.01Å; K114-Q118 WeakPolarHBondContact O-CG 3.35Å; K114-Q118 PolarHBondContact O-N 2.73Å
115L88.1Confident81.6Confident104 Ų104101.7 Ų101.755%0.54551%0.513SS..Hα-helixtrans-66.6-39.3175.5-73.5170.9000111.9V111 V112 Q118 R119V111-L115 HydrophobicContact CG1-CD1 4.02Å; V111-L115 HydrophobicContact CG1-CG 4.45Å; V111-L115 WeakPolarHBondContact O-CB 3.27Å; V111-L115 WeakPolarHBondContact O-CG 3.41Å; V111-L115 PolarHBondContact O-N 3.24Å; V112-L115 PolarHBondContact O-N 3.3Å; L115-Q118 PolarHBondContact O-N 3.03Å; L115-R119 WeakPolarHBondContact O-CB 3.48Å; L115-R119 PolarHBondContact O-N 3.34Å
116W91.9Very high79.5Confident133 Ų133105 Ų10550%0.50452%0.524SS..Hα-helixtrans-63.4-48.4176.4-177.877.2000111V112 Y113 Q118 R119 E120V112-W116 VanDerWaalsContact O-CB 3.28Å; V112-W116 WeakPolarHBondContact O-CB 3.18Å; V112-W116 PolarHBondContact O-N 3.38Å; Y113-W116 HydrophobicContact CD2-CE3 4.44Å; Y113-W116 PolarHBondContact O-N 3.36Å; W116-Q118 VanDerWaalsContact C-N 3.33Å; W116-Q118 PolarHBondContact O-N 3.15Å; W116-R119 WeakPolarHBondContact O-CA 3.44Å; W116-R119 WeakPolarHBondContact O-CB 3.37Å; W116-R119 PolarHBondContact O-N 3.48Å; W116-E120 HydrophobicContact CD2-CG 4.45Å; W116-E120 WeakPolarHBondContact CH2-OE1 3.4Å; W116-E120 VanDerWaalsContact CZ2-CD 3.49Å; W116-E120 HydrophobicContact CZ2-CG 4.38Å; W116-E120 WeakPolarHBondContact CZ2-OE1 3.33Å; W116-E120 PolarHBondContact O-N 3.13Å
117R82Confident77.4Confident156 Ų156107 Ų10759%0.58953%0.528SS*.Hα-helixtrans-61.4-37.9176.9-166.5171.2-178.3176.60.3112.8Y113 E120 A121Y113-R117 WeakPolarHBondContact O-CB 3.43Å; Y113-R117 PolarHBondContact O-N 3.42Å; R117-E120 PolarHBondContact O-N 3Å; R117-A121 PolarHBondContact O-N 3.48Å; R117-A121 VanDerWaalsContact O-N 3.16Å
118Q79.7Confident75.2Confident116 Ų116105 Ų10554%0.54253%0.526SS..Hα-helixtrans-65-38.6171.6-78.1-177.4-15.200112.3K114 L115 W116 A121 S122K114-Q118 WeakPolarHBondContact O-CG 3.35Å; K114-Q118 PolarHBondContact O-N 2.73Å; L115-Q118 PolarHBondContact O-N 3.03Å; W116-Q118 VanDerWaalsContact C-N 3.33Å; W116-Q118 PolarHBondContact O-N 3.15Å; Q118-A121 PolarHBondContact O-N 2.96Å; Q118-S122 PolarHBondContact O-N 3.46Å
119R80.4Confident72.9Confident160 Ų160105.7 Ų105.760%0.60453%0.531SS*.Hα-helixtrans-65.2-39.5177.3-167.6175.6-177.1160.6-0.8111.5L115 W116 S122 K123L115-R119 WeakPolarHBondContact O-CB 3.48Å; L115-R119 PolarHBondContact O-N 3.34Å; W116-R119 WeakPolarHBondContact O-CA 3.44Å; W116-R119 WeakPolarHBondContact O-CB 3.37Å; W116-R119 PolarHBondContact O-N 3.48Å; R119-S122 WeakPolarHBondContact CA-OG 3.22Å; R119-S122 PolarHBondContact O-N 3.13Å; R119-S122 PolarHBondContact O-OG 3.34Å; R119-K123 WeakPolarHBondContact O-CG 3.26Å; R119-K123 PolarHBondContact O-N 3.15Å; R119-K123 VanDerWaalsContact O-N 3.09Å
120E75.9Confident70.7Confident79 Ų79105.5 Ų105.537%0.36953%0.53SS..Hα-helixtrans-64.2-43.2175-62.5-156.914200112.3W116 R117 S122 K123 N124W116-E120 HydrophobicContact CD2-CG 4.45Å; W116-E120 WeakPolarHBondContact CH2-OE1 3.4Å; W116-E120 VanDerWaalsContact CZ2-CD 3.49Å; W116-E120 HydrophobicContact CZ2-CG 4.38Å; W116-E120 WeakPolarHBondContact CZ2-OE1 3.33Å; W116-E120 PolarHBondContact O-N 3.13Å; R117-E120 PolarHBondContact O-N 3Å; E120-S122 VanDerWaalsContact C-N 3.28Å; E120-S122 PolarHBondContact O-N 3.08Å; E120-K123 PolarHBondContact O-N 3.4Å; E120-N124 PolarHBondContact O-N 3.44Å
121A65.4Low68.3Low63 Ų63108.9 Ų108.952%0.52154%0.543SS..Hα-helixtrans-59.8-38.2174.100000112.5R117 Q118 N124 A125R117-A121 PolarHBondContact O-N 3.48Å; R117-A121 VanDerWaalsContact O-N 3.16Å; Q118-A121 PolarHBondContact O-N 2.96Å; A121-N124 PolarHBondContact O-N 3.46Å; A121-A125 PolarHBondContact O-N 3.25Å
122S61.5Low65.7Low64 Ų64110.7 Ų110.745%0.44855%0.55SS.*Hα-helixtrans-71.7-30.7178.872.80000114.2Q118 R119 E120 K126Q118-S122 PolarHBondContact O-N 3.46Å; R119-S122 WeakPolarHBondContact CA-OG 3.22Å; R119-S122 PolarHBondContact O-N 3.13Å; R119-S122 PolarHBondContact O-OG 3.34Å; E120-S122 VanDerWaalsContact C-N 3.28Å; E120-S122 PolarHBondContact O-N 3.08Å; S122-K126 PolarHBondContact O-N 2.94Å
123K57.2Low63.2Low112 Ų112109.9 Ų109.949%0.48755%0.549SS..Hα-helixtrans-70.4-38.4175.9-72.9173.3179.6177.20111R119 E120 K126 L127R119-K123 WeakPolarHBondContact O-CG 3.26Å; R119-K123 PolarHBondContact O-N 3.15Å; R119-K123 VanDerWaalsContact O-N 3.09Å; E120-K123 PolarHBondContact O-N 3.4Å; K123-K126 PolarHBondContact O-N 2.83Å; K123-L127 PolarHBondContact O-N 3.22Å
124N54Low60.7Low109 Ų109112.4 Ų112.458%0.58357%0.569SS**Hα-helixtrans-72.3-32.2179.3-64.6-15.3000112.3E120 A121 L127 A128E120-N124 PolarHBondContact O-N 3.44Å; A121-N124 PolarHBondContact O-N 3.46Å; N124-L127 PolarHBondContact O-N 3.12Å; N124-A128 PolarHBondContact O-N 2.88Å; N124-A128 VanDerWaalsContact O-N 3.11Å
125A51.4Low58.2Low51 Ų51116.1 Ų116.142%0.42159%0.585SS.*Hα-helixtrans-64.2-42.9172.900000112.4A121 L127 A128 D129A121-A125 PolarHBondContact O-N 3.25Å; A125-L127 VanDerWaalsContact C-N 3.28Å; A125-L127 PolarHBondContact O-N 3.02Å; A125-A128 PolarHBondContact O-N 3.35Å; A125-D129 PolarHBondContact O-N 3.21Å
126K48.1Very low55.8Low174 Ų174115.9 Ų115.976%0.75759%0.588SS**Hα-helixtrans-67.8-23.6178.4-86.8-173.7172.4-1750114.4S122 K123S122-K126 PolarHBondContact O-N 2.94Å; K123-K126 PolarHBondContact O-N 2.83Å
127L48Very low53.2Low118 Ų118117.1 Ų117.162%0.61860%0.604SS**Hα-helixtrans-84-32.7174.7-81.6152.5000112.1K123 N124 A125 S130 Y131K123-L127 PolarHBondContact O-N 3.22Å; N124-L127 PolarHBondContact O-N 3.12Å; A125-L127 VanDerWaalsContact C-N 3.28Å; A125-L127 PolarHBondContact O-N 3.02Å; L127-S130 PolarHBondContact O-N 3.43Å; L127-Y131 PolarHBondContact O-N 3.27Å
128A45.8Very low51.2Low59 Ų59117.7 Ų117.749%0.48862%0.618SS.*Hα-helixtrans-66.4-38.2175.900000112.4N124 A125 S130 Y131 N132N124-A128 PolarHBondContact O-N 2.88Å; N124-A128 VanDerWaalsContact O-N 3.11Å; A125-A128 PolarHBondContact O-N 3.35Å; A128-S130 VanDerWaalsContact C-N 3.3Å; A128-S130 PolarHBondContact O-N 3.14Å; A128-Y131 PolarHBondContact O-N 3.44Å; A128-N132 PolarHBondContact O-N 3.44Å
129D45Very low49.1Very low122 Ų122119.8 Ų119.865%0.65263%0.632SS**Hα-helixtrans-68.2-30176.5-66.9-26.4000112.2A125A125-D129 PolarHBondContact O-N 3.21Å
130S48.4Very low46.8Very low82 Ų82119.5 Ų119.557%0.57364%0.643SS**Hα-helixtrans-80.1-23.8-180-163.90000113.7L127 A128L127-S130 PolarHBondContact O-N 3.43Å; A128-S130 VanDerWaalsContact C-N 3.3Å; A128-S130 PolarHBondContact O-N 3.14Å
131Y41.6Very low44.8Very low208 Ų208125.5 Ų125.582%0.81666%0.662SS**Hα-helixtrans-89.2-18.8178.7-120.4-92.9000113.3L127 A128L127-Y131 PolarHBondContact O-N 3.27Å; A128-Y131 PolarHBondContact O-N 3.44Å
132N40Very low43Very low116 Ų116129 Ų12962%0.6268%0.677SS**Hα-helixtrans-93.9-8.8179-140.310.1000113.8A128 N134A128-N132 PolarHBondContact O-N 3.44Å; N132-N134 VanDerWaalsContact C-N 3.27Å; N132-N134 PolarHBondContact O-N 3.14Å
133S39.8Very low41.5Very low79 Ų79130.9 Ų130.955%0.55269%0.69SS**THydrogen-bonded Turntrans-75.5-9.2178-166.20000114.4
134N40.8Very low40.2Very low146 Ų146131.6 Ų131.678%0.78171%0.708SS**THydrogen-bonded Turntrans-103.99.4-176.1-72.7-15.5000114.2N132N132-N134 VanDerWaalsContact C-N 3.27Å; N132-N134 PolarHBondContact O-N 3.14Å
135K37.8Very low38.9Very low188 Ų188133.9 Ų133.982%0.81772%0.719SS**SBendtrans-129.75.6-175.7-137.3174.3-176.4174.20116
136T37.9Very low37.9Very low98 Ų98138.8 Ų138.860%0.60174%0.738SS**SBendtrans-1111.8179.549.90000115L138T136-L138 PolarHBondContact O-N 3.14Å
137D37.2Very low37.1Very low159 Ų159135.8 Ų135.885%0.8573%0.731SS**THydrogen-bonded Turntrans-92.719.2-169.8-127.36.9000115.5
138L38.4Very low36.4Very low169 Ų169137.3 Ų137.389%0.88574%0.739SS**THydrogen-bonded Turntrans-127.53.7-177-132146.4000114.8T136T136-L138 PolarHBondContact O-N 3.14Å
139L35.5Very low35.8Very low159 Ų159142.7 Ų142.783%0.83275%0.754SS**SBendtrans-131.61.4-179.2-85.3157000115.1R141L139-R141 PolarHBondContact O-N 3.48Å; L139-R141 VanDerWaalsContact O-N 3.17Å
140D32.8Very low35.3Very low155 Ų155142.2 Ų142.283%0.82975%0.751SS**  trans-90.183.4170.4-123-6.9000111.2T142D140-T142 PolarHBondContact O-N 2.69Å
141R34.6Very low34.5Very low205 Ų205146.2 Ų146.277%0.77476%0.761SS**  trans-8.4108.6145.2-66.5160.684.3127.8-0.9112L139 S143L139-R141 PolarHBondContact O-N 3.48Å; L139-R141 VanDerWaalsContact O-N 3.17Å; R141-S143 PolarHBondContact O-N 3.08Å; R141-S143 VanDerWaalsContact O-N 3.09Å
142T27.6Very low34.1Very low135 Ų135146 Ų14683%0.82877%0.767SS**  35.366.899.366.90000114.3D140D140-T142 PolarHBondContact O-N 2.69Å
143S28.7Very low33.6Very low105 Ų105150.6 Ų150.673%0.73478%0.775SS**  trans-176.585.7152.954.10000112.9R141R141-S143 PolarHBondContact O-N 3.08Å; R141-S143 VanDerWaalsContact O-N 3.09Å
144C29.8Very low33.2Very low126 Ų126156.9 Ų156.985%0.85179%0.787SS**  trans-175.386.1136.9460000108.4D146C144-D146 PolarHBondContact O-N 2.84Å
145L28.3Very low33Very low158 Ų158157.5 Ų157.583%0.82779%0.789SS**  trans-66.1105.9156.8-160.488000106.2
146D30.6Very low32.5Very low153 Ų153153.8 Ų153.882%0.81879%0.786SS**  trans-116.793.7161.8-150.3-6.2000108.2C144C144-D146 PolarHBondContact O-N 2.84Å
147N30.2Very low32.1Very low111 Ų111154.7 Ų154.759%0.59480%0.796SS**  trans-79.8116.9163.7-80.2-46.1000106.9
148N32.8Very low31.8Very low150 Ų150150.3 Ų150.380%0.80279%0.789SS**  161.4110.4121.9-80.5-41.2000111.1
149H32.8Very low31.4Very low173 Ų173152 Ų15280%0.80179%0.789SS**  -149.298129.3-155.9-80.1000111.6
150L35.5Very low31.2Very low111 Ų111149.3 Ų149.358%0.58178%0.779SS**  trans26.5116.4140.6-76.1119.8000120.3
151Q31.7Very low31.2Very low167 Ų167148.4 Ų148.478%0.7877%0.774SS**  54.6103.3120.4-58.3-166.723.500118.8
152H34.2Very low31Very low204 Ų204145.7 Ų145.794%0.94478%0.776SS**  -145124.4125.6-113.4-85.4000110.7
153R28.6Very low31Very low211 Ų211145.3 Ų145.380%0.79678%0.778SS**  trans-102.3153.2-174.6-171.2-171.5-170.1-176.24.7109.8
154R32Very low31.2Very low212 Ų212144.9 Ų144.980%0.878%0.781SS**  trans87.7137.4167.2-50.1-175.9177.4159.6-0113.2
155I35.3Very low31.3Very low159 Ų159147.7 Ų147.782%0.81578%0.782SS**  cis-156.3138.733.4-43156.7000110.1
156S27.6Very low31.4Very low110 Ų110147.3 Ų147.377%0.76978%0.779SS**  trans30.1147.6138.4-144.60000121.3
157S29.7Very low31.6Very low116 Ų116145 Ų14581%0.81177%0.773SS**  cis-177.1157.612.120.40000110.3
158G30.2Very low31.5Very low67 Ų67146 Ų14669%0.69178%0.778SS**  trans135.3101149.800000114.7
159F30.2Very low31.4Very low204 Ų204146.4 Ų146.490%0.89578%0.775SS**  67.4124.599.8-120.6-115000112
160V32Very low31.2Very low103 Ų103143.3 Ų143.362%0.62477%0.773SS**  cis-164.6142.318.3-1400000104.3
161N32Very low31.1Very low136 Ų136144.5 Ų144.573%0.72779%0.787SS**  -178.7138.886.4-104.5-17.6000111.7
162N31.2Very low31Very low149 Ų149145.1 Ų145.180%0.79779%0.79SS**  trans66.4102148.4-67.3-4.1000122.2
163S28.1Very low30.5Very low126 Ų126140.1 Ų140.188%0.88178%0.778SS**  trans-37.6133.1144.4-47.90000115.5
164A32.8Very low30.4Very low97 Ų97134.1 Ų134.180%0.80277%0.774SS**  trans-157.8108.813500000109.9
165H32.4Very low30.3Very low185 Ų185132.1 Ų132.186%0.85678%0.779SS**  trans57.1131.1146.2-163-83.4000121.9
166L30Very low30Very low149 Ų149132.8 Ų132.878%0.7878%0.778SS**  trans-59.6170.1176.1-112.965.9000115.6
167P35.1Very low30.3Very low104 Ų104135.9 Ų135.968%0.67579%0.785SS**  trans-96.5158.2-158.638.8-35.6000113.2
168N27.8Very low30.2Very low134 Ų134136.2 Ų136.272%0.71778%0.778SS**  trans-170134.3151.1-110.7-14.3000115.1
169H30Very low30.2Very low157 Ų157139.5 Ų139.573%0.72778%0.78SS**  trans79.7109.7149.2-52.9-50.5000122.2
170S29.2Very low30Very low108 Ų108136.8 Ų136.876%0.75577%0.773SS**  trans17.7149137.6-52.40000122.2
171P32.2Very low30Very low137 Ų137136.4 Ų136.489%0.8978%0.781SS**  trans-120.6119136.333.1-19.8000110.6
172Q29.3Very low29.7Very low179 Ų179137.2 Ų137.284%0.83679%0.785SS**  trans-117120.4167.7-170.9165-15.700109.5
173S25.5Very low29.7Very low100 Ų100135.5 Ų135.570%0.69979%0.785SS**  trans61132.5148.183.10000123.2
174A25.5Very low29.6Very low85 Ų85135.1 Ų135.170%0.70278%0.778SS**  76.5112.2129.300000118.9
175N31Very low29.6Very low169 Ų169135.7 Ų135.790%0.90477%0.773SS**  trans-133.5112.6133-89.7-24.1000108.2
176E27.6Very low29.2Very low173 Ų173133.9 Ų133.981%0.80877%0.77SS**  trans-67.1140.9156.6-74.7175.6137.200109.3
177L34Very low29.1Very low175 Ų175133.3 Ų133.392%0.91677%0.767SS**  trans-143.6108.2153.3-112.4159.3000108
178N28Very low28.6Very low124 Ų124135.3 Ų135.366%0.66377%0.772SS**  trans-62.4138.3169.1-67.9-47.5000110.9
179N30.9Very low28.8Very low135 Ų135136.6 Ų136.672%0.72278%0.777SS**  161.4122115.6-84.7-24.3000113.1
180I25.5Very low28.7Very low147 Ų147135.8 Ų135.875%0.75478%0.778SS**  56.2106.7128.8-50.2165.1000117.5
181A31.7Very low28.6Very low95 Ų95138 Ų13879%0.78578%0.782SS**  -159.6117.7129.800000110.3
182D25Very low28.3Very low154 Ų154139.1 Ų139.182%0.82478%0.775SS**  trans-41.6130.4159.8-69.4-62.2000112.9
183S32.5Very low28.2Very low112 Ų112137.3 Ų137.378%0.78377%0.771SS**  trans-168.5105139.19.90000110.2
184T26.7Very low28.3Very low119 Ų119139.3 Ų139.373%0.7377%0.769SS**  trans-40.6130.2161.5-39.10000112.4
185P31.3Very low28.3Very low108 Ų108144.1 Ų144.170%0.70177%0.774SS**  trans-98.5102.7151.730-18.4000108.2N187P185-N187 VanDerWaalsContact C-N 3.35Å; P185-N187 PolarHBondContact O-N 3.21Å
186D24.9Very low28.1Very low148 Ų148142.1 Ų142.179%0.79176%0.764SS**  trans-60.3100.9158.4-81.2-37.6000107.6
187N27.4Very low27.9Very low137 Ų137140.6 Ų140.673%0.73376%0.761SS**  trans-128.265.3169.8-101.6-19.3000108.2P185P185-N187 VanDerWaalsContact C-N 3.35Å; P185-N187 PolarHBondContact O-N 3.21Å
188D25.5Very low27.8Very low146 Ų146140.2 Ų140.278%0.78176%0.758SS**  trans-99.278.2161.6-89.2-29.9000109.3
189I31.3Very low27.7Very low160 Ų160140.8 Ų140.882%0.82176%0.76SS**  trans-129.464.4152.7-52.8179000106.2
190N28.4Very low27.4Very low140 Ų140145.6 Ų145.675%0.74977%0.769SS**  trans-91.3117165.1-91.3-38.2000108.9Q192N190-Q192 PolarHBondContact O-N 2.95Å
191N26.5Very low27.4Very low155 Ų155141.8 Ų141.883%0.82977%0.766SS**  trans-36.4103.1164.1-73.9-42.7000112.6
192Q25.6Very low27Very low160 Ų160146.6 Ų146.675%0.74877%0.772SS**  trans-128.384.5153.4-83.7-170.57.800108.1N190 Q194N190-Q192 PolarHBondContact O-N 2.95Å; Q192-Q194 PolarHBondContact O-N 3.49Å
193L28.5Very low27Very low141 Ų141148.1 Ų148.174%0.73878%0.775SS**  trans-71.484.4157.2-95.1153.6000107.5F195L193-F195 HydrophobicContact CB-CE2 4.31Å; L193-F195 HydrophobicContact CD2-CE2 4.4Å; L193-F195 HydrophobicContact CD2-CZ 4.38Å; L193-F195 PolarHBondContact O-N 3.06Å
194Q25.7Very low26.8Very low143 Ų143152.9 Ų152.967%0.66878%0.781SS**  trans-64.1113.7158.4-79.9-178.8-8.800108.1Q192 N196Q192-Q194 PolarHBondContact O-N 3.49Å; Q194-N196 PolarHBondContact O-N 3.03Å
195F26.5Very low26.9Very low186 Ų186151.5 Ų151.582%0.81678%0.782SS**  trans-89.497.8162.8-78.8-82.7000108.2L193L193-F195 HydrophobicContact CB-CE2 4.31Å; L193-F195 HydrophobicContact CD2-CE2 4.4Å; L193-F195 HydrophobicContact CD2-CZ 4.38Å; L193-F195 PolarHBondContact O-N 3.06Å
196N26.5Very low26.8Very low127 Ų127151.7 Ų151.768%0.67978%0.783SS**  trans-94.9122.2163.1-85.9-10000109.3Q194Q194-N196 PolarHBondContact O-N 3.03Å
197D24.4Very low27Very low140 Ų140153.4 Ų153.475%0.74979%0.791SS**  trans17.2110.7143.4-65.1-32.8000118.7
198I30.1Very low27.4Very low168 Ų168154.7 Ų154.786%0.86280%0.797SS**  trans-128.3101.5140.7-57179.8000108
199I26.6Very low27.5Very low136 Ų136151 Ų15170%0.69779%0.794SS**  trans-74.6129.1164.5-66.5175.6000108
200Y25.1Very low27.2Very low235 Ų235153.1 Ų153.192%0.92280%0.797SS**  trans-170.3121.2135.5-122.1-90.1000110.5
201G24.3Very low27.4Very low67 Ų67153.6 Ų153.669%0.69180%0.798SS**  trans126.773.9162.200000117.1E203G201-E203 PolarHBondContact O-N 3.21Å
202H24.6Very low27.4Very low197 Ų197152.9 Ų152.991%0.91280%0.795SS**  trans15.699143.7-109.4-72.8000119.1
203E24.9Very low27.6Very low186 Ų186154.1 Ų154.187%0.86980%0.8SS**  trans-173.2153.5134.848.2-162.9-179.900112G201 A205G201-E203 PolarHBondContact O-N 3.21Å; E203-A205 PolarHBondContact O-N 3.35Å; E203-A205 VanDerWaalsContact O-N 3.13Å
204K28Very low27.5Very low212 Ų212151.1 Ų151.192%0.92279%0.791SS**  trans-61.9106.7-159.3-63.9169.7177.7175.50112.8
205A28.5Very low27.7Very low90 Ų90152.2 Ų152.274%0.74480%0.801SS**  trans-64.4131168.600000111E203E203-A205 PolarHBondContact O-N 3.35Å; E203-A205 VanDerWaalsContact O-N 3.13Å
206P30.1Very low28.1Very low112 Ų112146 Ų14673%0.72778%0.781SS**  trans-70135.4164.53.910.4000109L208P206-L208 VanDerWaalsContact C-N 3.34Å; P206-L208 PolarHBondContact O-N 3.45Å
207L28.8Very low28.6Very low183 Ų183142.4 Ų142.496%0.95877%0.766SS**  trans-60.686.7177.9-64.5166000111.2
208L35.5Very low29.2Very low165 Ų165143.2 Ų143.286%0.86476%0.763SS**  trans-95.2113.9164.2-89.1157.6000108.3P206P206-L208 VanDerWaalsContact C-N 3.34Å; P206-L208 PolarHBondContact O-N 3.45Å
209G27.2Very low29.9Very low68 Ų68141.2 Ų141.270%0.70175%0.754SS**  trans-56.3148.2-178.800000112.7L211G209-L211 PolarHBondContact O-N 3.27Å
210K25.9Very low31Very low205 Ų205136.6 Ų136.689%0.89173%0.731SS**  trans-44.3111.9174-70174.7175.2178.90110D212K210-D212 PolarHBondContact O-N 3.43Å
211L32.8Very low32.7Very low149 Ų149129.1 Ų129.178%0.7870%0.703SS**  trans-80.7103.8173-160.485.3000107.7G209 H213G209-L211 PolarHBondContact O-N 3.27Å; L211-H213 PolarHBondContact O-N 3.33Å; L211-H213 PolarHBondContact O-ND1 3.41Å
212D25.6Very low34.4Very low141 Ų141132.8 Ų132.875%0.75470%0.702SS**  trans-58119.7172.6-73.3-38.5000109.7K210 S214K210-D212 PolarHBondContact O-N 3.43Å; D212-S214 PolarHBondContact O-N 3.08Å
213H29.5Very low36.5Very low186 Ų186125.7 Ų125.786%0.86167%0.67SS**  trans-71.478.8176.1-72.553000109.1L211L211-H213 PolarHBondContact O-N 3.33Å; L211-H213 PolarHBondContact O-ND1 3.41Å
214S26.3Very low38.7Very low77 Ų77119 Ų11954%0.53864%0.642SS.*  trans-87.613616357.10000108.7D212 S216D212-S214 PolarHBondContact O-N 3.08Å; S214-S216 PolarHBondContact O-N 3.5Å
215N31.2Very low41.1Very low166 Ų166108.9 Ų108.989%0.88860%0.598SS**THydrogen-bonded Turntrans-59.125.6-174.5-69.8-27.2000116.3
216S34.3Very low43.2Very low55 Ų55108.7 Ų108.739%0.38559%0.588SS.*THydrogen-bonded Turntrans-104.45.5174.972.50000113.9S214 K355S214-S216 PolarHBondContact O-N 3.5Å; S216-K355 PolarHBondContact O-NZ 3.47Å; S216-K355 PolarHBondContact OG-NZ 3.38Å
217S37.2Very low45.2Very low53 Ų53105.7 Ų105.737%0.37157%0.567SS.*SBendtrans-82.2-27.2-178.679.10000113.3N219 N220 F221S217-N219 PolarHBondContact O-N 3.43Å; S217-N220 PolarHBondContact O-N 2.92Å; S217-F221 WeakPolarHBondContact O-CD2 3.22Å; S217-F221 WeakPolarHBondContact O-CE2 3.41Å
218F37.8Very low47.5Very low157 Ų15797.5 Ų97.569%0.68952%0.524SS*.G310 helixtrans-67.3-33.4-175.9-84-83.4000113.8N220 F221F218-N220 PolarHBondContact O-N 3.33Å; F218-N220 VanDerWaalsContact O-N 3.16Å; F218-F221 PolarHBondContact O-N 2.94Å
219N43.5Very low49.4Very low125 Ų12592.3 Ų92.367%0.66850%0.5SS*.G310 helixtrans-70.6-12.1-178.7-68.93.6000114.4S217S217-N219 PolarHBondContact O-N 3.43Å
220N50.3Low51.8Low40 Ų4092.8 Ų92.821%0.21449%0.485CS..G310 helixtrans-85.4-19.6177.4-78.3-15.8000112.8S217 F218 Q223 I351S217-N220 PolarHBondContact O-N 2.92Å; F218-N220 PolarHBondContact O-N 3.33Å; F218-N220 VanDerWaalsContact O-N 3.16Å; N220-Q223 WeakPolarHBondContact O-CB 3.41Å; N220-Q223 PolarHBondContact OD1-NE2 3.31Å; N220-I351 HydrophobicContact CB-CG2 4.43Å
221F59.8Low54.2Low77 Ų7787.2 Ų87.234%0.33847%0.466SS..THydrogen-bonded Turntrans-89.2-17.6-174.4-68.4-68000113.7S217 F218 L328 G329S217-F221 WeakPolarHBondContact O-CD2 3.22Å; S217-F221 WeakPolarHBondContact O-CE2 3.41Å; F218-F221 PolarHBondContact O-N 2.94Å; F221-L328 PolarHBondContact O-N 3.37Å; F221-G329 PolarHBondContact O-N 3.14Å
222E60.8Low56.4Low144 Ų14480.4 Ų80.467%0.67343%0.43SS*.THydrogen-bonded Turntrans-83.40.2170.3-69.7-173.6161.800113
223Q68.1Low59.1Low49 Ų4973.9 Ų73.923%0.22940%0.395CS..SBendtrans-66.8144.5179.7-73.9-179.814.700111.5N220 V227 L328N220-Q223 WeakPolarHBondContact O-CB 3.41Å; N220-Q223 PolarHBondContact OD1-NE2 3.31Å; Q223-V227 HydrophobicContact CB-CG2 3.99Å; Q223-V227 HydrophobicContact CG-CG2 4.47Å; Q223-L328 HydrophobicContact CB-CD2 4.17Å; Q223-L328 WeakPolarHBondContact O-CB 3.49Å; Q223-L328 PolarHBondContact O-N 3.44Å
224P72.4Confident61.7Low44 Ų4465 Ų6529%0.28635%0.354SS..BIsolated β-bridgetrans-65.2150.1173.929.1-35.2000110T226 V227 N324P224-T226 WeakPolarHBondContact CB-OG1 3.14Å; P224-T226 WeakPolarHBondContact CG-OG1 3.22Å; P224-T226 PolarHBondContact O-N 2.99Å; P224-V227 HydrophobicContact CG-CG2 4.19Å; P224-V227 WeakPolarHBondContact O-CG2 3.2Å; P224-V227 PolarHBondContact O-N 3.42Å; P224-N324 WeakPolarHBondContact CA-OD1 3.48Å; P224-N324 WeakPolarHBondContact CB-OD1 3.48Å
225I77.2Confident64.3Low1 Ų161.7 Ų61.71%0.00533%0.33CS..G310 helixtrans-59.1-22.1178.9-64.7163.9000111.6V227 I228 L233 F317 M320 V326 L331I225-V227 PolarHBondContact O-N 3.36Å; I225-I228 HydrophobicContact CG2-CD1 4.2Å; I225-I228 WeakPolarHBondContact O-CB 3.43Å; I225-I228 WeakPolarHBondContact O-CG1 3.39Å; I225-I228 PolarHBondContact O-N 2.89Å; I225-L233 HydrophobicContact CG2-CD1 4.16Å; I225-F317 HydrophobicContact CG2-CD1 4.38Å; I225-F317 HydrophobicContact CG2-CE1 4.48Å; I225-M320 HydrophobicContact CD1-CB 3.79Å; I225-M320 HydrophobicContact CD1-SD 4.15Å; I225-V326 HydrophobicContact CD1-CB 3.9Å; I225-V326 HydrophobicContact CD1-CG1 4.14Å; I225-V326 WeakPolarHBondContact CD1-O 3.46Å; I225-V326 WeakPolarHBondContact CG1-O 3.36Å; I225-L331 HydrophobicContact CD1-CB 4.47Å; I225-L331 HydrophobicContact CD1-CD2 4.18Å; I225-L331 HydrophobicContact CG1-CD2 4.08Å; I225-L331 HydrophobicContact CG2-CD2 4.23Å
226T73.7Confident66.8Low85 Ų8553.8 Ų53.852%0.52129%0.288SS..G310 helixtrans-60-12.6175.359.20000114.5P224 I228 C321P224-T226 WeakPolarHBondContact CB-OG1 3.14Å; P224-T226 WeakPolarHBondContact CG-OG1 3.22Å; P224-T226 PolarHBondContact O-N 2.99Å; T226-I228 PolarHBondContact O-N 3.38Å; T226-C321 HydrophobicContact CG2-CB 4.03Å
227V72.6Confident69.3Low49 Ų4951.2 Ų51.230%0.29727%0.27SS..G310 helixtrans-69.8-23.2171.5179.90000112Q223 P224 I225 P229 I354Q223-V227 HydrophobicContact CB-CG2 3.99Å; Q223-V227 HydrophobicContact CG-CG2 4.47Å; P224-V227 HydrophobicContact CG-CG2 4.19Å; P224-V227 WeakPolarHBondContact O-CG2 3.2Å; P224-V227 PolarHBondContact O-N 3.42Å; I225-V227 PolarHBondContact O-N 3.36Å; V227-P229 WeakPolarHBondContact O-CD 3.44Å; V227-I354 HydrophobicContact CG1-CD1 3.96Å
228I75.4Confident71.5Confident11 Ų1149.6 Ų49.66%0.05626%0.256CS..SBendtrans-72.5125.5177-56.6178000109.3I225 T226 I232 L233 I236 L328 L331 I347I225-I228 HydrophobicContact CG2-CD1 4.2Å; I225-I228 WeakPolarHBondContact O-CB 3.43Å; I225-I228 WeakPolarHBondContact O-CG1 3.39Å; I225-I228 PolarHBondContact O-N 2.89Å; T226-I228 PolarHBondContact O-N 3.38Å; I228-I232 HydrophobicContact CG2-CB 3.99Å; I228-I232 HydrophobicContact CG2-CG2 3.94Å; I228-L233 HydrophobicContact CB-CD1 4.34Å; I228-L233 HydrophobicContact CD1-CD1 4.29Å; I228-L233 HydrophobicContact CG2-CB 4.18Å; I228-L233 HydrophobicContact CG2-CD1 4.19Å; I228-I236 HydrophobicContact CD1-CD1 4.45Å; I228-I236 HydrophobicContact CG2-CD1 4.31Å; I228-L328 HydrophobicContact CD1-CD1 3.75Å; I228-L328 HydrophobicContact CG1-CD1 4.04Å; I228-L331 HydrophobicContact CD1-CD2 4.28Å; I228-I347 HydrophobicContact CD1-CD1 4.42Å; I228-I347 HydrophobicContact CD1-CG1 4.27Å; I228-I347 HydrophobicContact CD1-CG2 4.26Å
229P75.4Confident73.5Confident56 Ų5644.2 Ų44.236%0.36423%0.231SC..  trans-57.2139.5174.3-26.236000112.4V227 N231 I232 L233V227-P229 WeakPolarHBondContact O-CD 3.44Å; P229-N231 WeakPolarHBondContact CB-OD1 3.49Å; P229-N231 PolarHBondContact O-N 2.85Å; P229-N231 VanDerWaalsContact O-N 3.12Å; P229-I232 HydrophobicContact CB-CG1 4.3Å; P229-I232 PolarHBondContact O-N 3.14Å; P229-L233 PolarHBondContact O-N 3.37Å
230M78.7Confident75.4Confident78 Ų7838.3 Ų38.338%0.38420%0.199SC..Hα-helixtrans-54.9-36.1-172.7-153.972.8160.400113.9L233 G234 D269 L270 A273M230-L233 PolarHBondContact O-N 2.91Å; M230-G234 PolarHBondContact O-N 3.43Å; M230-D269 HydrophobicContact CE-CB 3.65Å; M230-L270 HydrophobicContact CE-CB 3.64Å; M230-L270 HydrophobicContact CE-CD1 4.41Å; M230-L270 HydrophobicContact SD-CD1 4.28Å; M230-A273 HydrophobicContact CG-CB 4.42Å
231N75.9Confident77Confident89 Ų8936.7 Ų36.748%0.47619%0.191SC..Hα-helixtrans-66.3-41.317759.9-30.5000112.3P229 G234 V235P229-N231 WeakPolarHBondContact CB-OD1 3.49Å; P229-N231 PolarHBondContact O-N 2.85Å; P229-N231 VanDerWaalsContact O-N 3.12Å; N231-G234 PolarHBondContact O-N 3.15Å; N231-V235 WeakPolarHBondContact O-CG2 3.34Å; N231-V235 PolarHBondContact O-N 3.31Å; N231-V235 VanDerWaalsContact O-N 3.1Å
232I79.1Confident77.8Confident5 Ų536.3 Ų36.33%0.02619%0.19CC..Hα-helixtrans-70.4-40.2176.2-57.3-62.2000109.9I228 P229 G234 V235 I236 Q350I228-I232 HydrophobicContact CG2-CB 3.99Å; I228-I232 HydrophobicContact CG2-CG2 3.94Å; P229-I232 HydrophobicContact CB-CG1 4.3Å; P229-I232 PolarHBondContact O-N 3.14Å; I232-G234 PolarHBondContact O-N 3.32Å; I232-V235 PolarHBondContact O-N 2.89Å; I232-V235 VanDerWaalsContact O-N 3.14Å; I232-I236 HydrophobicContact CG2-CD1 3.9Å; I232-I236 WeakPolarHBondContact O-CD1 3.45Å; I232-I236 VanDerWaalsContact O-CG1 3.31Å; I232-I236 WeakPolarHBondContact O-CG1 3.45Å; I232-I236 PolarHBondContact O-N 3.36Å; I232-Q350 HydrophobicContact CD1-CG 4.19Å; I232-Q350 HydrophobicContact CG1-CG 3.99Å; I232-Q350 HydrophobicContact CG2-CG 4.29Å
233L83.2Confident78.2Confident4 Ų436.6 Ų36.62%0.02119%0.192CC..Hα-helixtrans-59.7-38.9173.9-159.564000111.2I225 I228 P229 M230 I236 C237 L270 F317I225-L233 HydrophobicContact CG2-CD1 4.16Å; I228-L233 HydrophobicContact CB-CD1 4.34Å; I228-L233 HydrophobicContact CD1-CD1 4.29Å; I228-L233 HydrophobicContact CG2-CB 4.18Å; I228-L233 HydrophobicContact CG2-CD1 4.19Å; P229-L233 PolarHBondContact O-N 3.37Å; M230-L233 PolarHBondContact O-N 2.91Å; L233-I236 PolarHBondContact O-N 2.65Å; L233-C237 WeakPolarHBondContact O-CB 3.34Å; L233-C237 PolarHBondContact O-N 2.69Å; L233-C237 PolarHBondContact O-SG 2.91Å; L233-L270 HydrophobicContact CB-CD1 3.93Å; L233-L270 HydrophobicContact CD2-CD1 3.88Å; L233-L270 HydrophobicContact CD2-CD2 4.1Å; L233-L270 HydrophobicContact CG-CD1 3.87Å; L233-L270 HydrophobicContact CG-CD2 4.49Å; L233-F317 HydrophobicContact CD1-CD1 3.51Å; L233-F317 HydrophobicContact CD1-CE1 3.71Å; L233-F317 HydrophobicContact CD1-CG 4.44Å; L233-F317 HydrophobicContact CG-CD1 4.2Å
234G82.9Confident78.5Confident0 Ų035 Ų350%019%0.188CC..Hα-helixtrans-61.8-42.8172.900000113.2M230 N231 I232 I236 C237 Y238 T274M230-G234 PolarHBondContact O-N 3.43Å; N231-G234 PolarHBondContact O-N 3.15Å; I232-G234 PolarHBondContact O-N 3.32Å; G234-I236 PolarHBondContact O-N 3.23Å; G234-C237 PolarHBondContact O-N 2.86Å; G234-Y238 WeakPolarHBondContact O-CB 3.44Å; G234-Y238 PolarHBondContact O-N 3.37Å; G234-T274 WeakPolarHBondContact CA-OG1 3.46Å
235V80.8Confident79.1Confident8 Ų833.8 Ų33.85%0.04818%0.178CC..Hα-helixtrans-63.5-42.2174.9175.70000111.4W43 N231 I232 Y238 R239 A277 L346W43-V235 HydrophobicContact CE3-CG2 4.34Å; N231-V235 WeakPolarHBondContact O-CG2 3.34Å; N231-V235 PolarHBondContact O-N 3.31Å; N231-V235 VanDerWaalsContact O-N 3.1Å; I232-V235 PolarHBondContact O-N 2.89Å; I232-V235 VanDerWaalsContact O-N 3.14Å; V235-Y238 PolarHBondContact O-N 2.98Å; V235-R239 WeakPolarHBondContact O-CG 3.29Å; V235-R239 PolarHBondContact O-N 2.84Å; V235-A277 HydrophobicContact CB-CB 4.36Å; V235-A277 HydrophobicContact CG2-CB 3.75Å; V235-L346 HydrophobicContact CG1-CD1 4.31Å
236I83.6Confident79.4Confident0 Ų039.7 Ų39.70%021%0.205CC..Hα-helixtrans-63.3-47.1177.1-66.5159.5000110.2I228 I232 L233 G234 Y238 R239 L240 F317 L343 I347I228-I236 HydrophobicContact CD1-CD1 4.45Å; I228-I236 HydrophobicContact CG2-CD1 4.31Å; I232-I236 HydrophobicContact CG2-CD1 3.9Å; I232-I236 WeakPolarHBondContact O-CD1 3.45Å; I232-I236 VanDerWaalsContact O-CG1 3.31Å; I232-I236 WeakPolarHBondContact O-CG1 3.45Å; I232-I236 PolarHBondContact O-N 3.36Å; L233-I236 PolarHBondContact O-N 2.65Å; G234-I236 PolarHBondContact O-N 3.23Å; I236-Y238 VanDerWaalsContact C-N 3.32Å; I236-Y238 PolarHBondContact O-N 3.37Å; I236-R239 PolarHBondContact O-N 3.28Å; I236-L240 HydrophobicContact CG2-CD1 3.52Å; I236-L240 WeakPolarHBondContact O-CB 3.48Å; I236-L240 PolarHBondContact O-N 2.88Å; I236-F317 HydrophobicContact CG2-CE1 4.31Å; I236-F317 HydrophobicContact CG2-CE2 4.26Å; I236-F317 HydrophobicContact CG2-CZ 3.71Å; I236-L343 HydrophobicContact CG1-CD2 4.16Å; I236-I347 HydrophobicContact CD1-CD1 3.77Å; I236-I347 HydrophobicContact CD1-CG1 3.47Å; I236-I347 VanDerWaalsContact CD1-CG1 3.47Å; I236-I347 HydrophobicContact CG1-CG1 4.4Å
237C86.9Confident79.7Confident1 Ų141.3 Ų41.31%0.00721%0.207CC..Hα-helixtrans-58.9-44176.3-70.80000111.3L233 G234 L240 S241 T274 T313 V314L233-C237 WeakPolarHBondContact O-CB 3.34Å; L233-C237 PolarHBondContact O-N 2.69Å; L233-C237 PolarHBondContact O-SG 2.91Å; G234-C237 PolarHBondContact O-N 2.86Å; C237-L240 PolarHBondContact O-N 3.39Å; C237-S241 VanDerWaalsContact O-CB 3.27Å; C237-S241 WeakPolarHBondContact O-CB 3.24Å; C237-S241 PolarHBondContact O-N 2.94Å; C237-T274 HydrophobicContact CB-CG2 3.79Å; C237-T313 HydrophobicContact CB-CG2 4.23Å; C237-T313 WeakPolarHBondContact O-CG2 3.31Å; C237-V314 HydrophobicContact CB-CG2 4.27Å
238Y83.8Confident80.3Confident19 Ų1939 Ų398%0.07519%0.193CC..Hα-helixtrans-62-48178.6172.2-113.4000111.5L47 G234 V235 I236 L240 S241 Q242 Q278 A281 L310L47-Y238 HydrophobicContact CD2-CE1 4.48Å; G234-Y238 WeakPolarHBondContact O-CB 3.44Å; G234-Y238 PolarHBondContact O-N 3.37Å; V235-Y238 PolarHBondContact O-N 2.98Å; I236-Y238 VanDerWaalsContact C-N 3.32Å; I236-Y238 PolarHBondContact O-N 3.37Å; Y238-L240 PolarHBondContact O-N 2.93Å; Y238-S241 PolarHBondContact O-N 3.25Å; Y238-S241 PolarHBondContact O-OG 3.43Å; Y238-Q242 PolarHBondContact O-N 3.42Å; Y238-Q242 PolarHBondContact OH-NE2 3.43Å; Y238-Q278 HydrophobicContact CD2-CB 3.6Å; Y238-Q278 HydrophobicContact CD2-CG 4.11Å; Y238-Q278 HydrophobicContact CE2-CB 3.45Å; Y238-Q278 VanDerWaalsContact CE2-CB 3.45Å; Y238-Q278 HydrophobicContact CE2-CG 3.48Å; Y238-Q278 VanDerWaalsContact CE2-CG 3.48Å; Y238-Q278 HydrophobicContact CG-CB 4.35Å; Y238-A281 HydrophobicContact CD1-CB 4.39Å; Y238-A281 HydrophobicContact CE1-CB 3.46Å; Y238-A281 VanDerWaalsContact CE1-CB 3.46Å; Y238-L310 HydrophobicContact CD2-CD1 4.12Å
239R78.6Confident80.6Confident44 Ų4438.5 Ų38.517%0.16619%0.191CC..Hα-helixtrans-62.4-43.6179.5-75.4-92.9-88.7-166.1-6.9112.1V235 I236 S241 Q242 H243 D342 L343V235-R239 WeakPolarHBondContact O-CG 3.29Å; V235-R239 PolarHBondContact O-N 2.84Å; I236-R239 PolarHBondContact O-N 3.28Å; R239-S241 VanDerWaalsContact C-N 3.32Å; R239-S241 PolarHBondContact O-N 3.41Å; R239-Q242 PolarHBondContact O-N 2.87Å; R239-H243 PolarHBondContact O-N 2.86Å; R239-D342 IonicContact CZ-OD2 2.73Å; R239-D342 IonicContact NH2-OD2 3.63Å; R239-D342 PolarHBondContact NH2-OD2 2.91Å; R239-L343 HydrophobicContact CB-CD1 4.24Å; R239-L343 HydrophobicContact CB-CD2 3.83Å; R239-L343 HydrophobicContact CG-CD2 4.13Å
240L84Confident81Confident0 Ų039.4 Ų39.40%020%0.199CC..Hα-helixtrans-69.8-28.7177.3-78.6155000113.2I236 C237 Y238 Q242 H243 W245 L248 T313 F317 L335 L343I236-L240 HydrophobicContact CG2-CD1 3.52Å; I236-L240 WeakPolarHBondContact O-CB 3.48Å; I236-L240 PolarHBondContact O-N 2.88Å; C237-L240 PolarHBondContact O-N 3.39Å; Y238-L240 PolarHBondContact O-N 2.93Å; L240-Q242 PolarHBondContact O-N 3.41Å; L240-H243 WeakPolarHBondContact CA-O 3.31Å; L240-H243 CarbonylContact O-C 3.21Å; L240-H243 PolarHBondContact O-N 2.82Å; L240-H243 VanDerWaalsContact O-O 3.1Å; L240-W245 HydrophobicContact CB-CB 4.45Å; L240-W245 PolarHBondContact O-N 2.85Å; L240-W245 VanDerWaalsContact O-N 3.15Å; L240-L248 HydrophobicContact CD1-CD2 3.83Å; L240-L248 HydrophobicContact CD2-CB 4.48Å; L240-L248 HydrophobicContact CD2-CD2 3.95Å; L240-T313 HydrophobicContact CB-CG2 3.86Å; L240-F317 HydrophobicContact CD1-CE2 3.59Å; L240-F317 HydrophobicContact CD1-CZ 3.87Å; L240-L335 HydrophobicContact CD1-CD2 3.92Å; L240-L335 HydrophobicContact CD2-CD2 4.04Å; L240-L335 HydrophobicContact CG-CD2 4.44Å; L240-L343 HydrophobicContact CD1-CD1 4.23Å; L240-L343 HydrophobicContact CD2-CD1 4.41Å; L240-L343 HydrophobicContact CG-CD1 3.93Å
241S83.5Confident81Confident6 Ų639.8 Ų39.84%0.04220%0.2CC..Hα-helixtrans-67.4-27.7176.776.80000112.7C237 Y238 R239 N309 L310 T313C237-S241 VanDerWaalsContact O-CB 3.27Å; C237-S241 WeakPolarHBondContact O-CB 3.24Å; C237-S241 PolarHBondContact O-N 2.94Å; Y238-S241 PolarHBondContact O-N 3.25Å; Y238-S241 PolarHBondContact O-OG 3.43Å; R239-S241 VanDerWaalsContact C-N 3.32Å; R239-S241 PolarHBondContact O-N 3.41Å; S241-N309 WeakPolarHBondContact O-CB 3.42Å; S241-L310 VanDerWaalsContact OG-CD1 3.26Å; S241-L310 WeakPolarHBondContact OG-CD1 3.4Å; S241-T313 WeakPolarHBondContact CA-OG1 3.4Å
242Q77.3Confident81.2Confident69 Ų6936.8 Ų36.832%0.32218%0.184SC..Hα-helixtrans-72-49173.7-61.9-163.715.600110.1Y238 R239 L240Y238-Q242 PolarHBondContact O-N 3.42Å; Y238-Q242 PolarHBondContact OH-NE2 3.43Å; R239-Q242 PolarHBondContact O-N 2.87Å; L240-Q242 PolarHBondContact O-N 3.41Å
243H69.8Low81.4Confident151 Ų15144 Ų4470%0.69922%0.222SC*.THydrogen-bonded Turntrans-148129.4-177.9-53.4-65000110.5R239 L240R239-H243 PolarHBondContact O-N 2.86Å; L240-H243 WeakPolarHBondContact CA-O 3.31Å; L240-H243 CarbonylContact O-C 3.21Å; L240-H243 PolarHBondContact O-N 2.82Å; L240-H243 VanDerWaalsContact O-O 3.1Å
244G74.8Confident81.2Confident15 Ų1544.6 Ų44.616%0.15523%0.226CC..THydrogen-bonded Turntrans102.1-3.6164.200000117.7Q246 E247 L248G244-Q246 VanDerWaalsContact C-N 3.34Å; G244-Q246 PolarHBondContact O-N 2.88Å; G244-E247 PolarHBondContact O-N 3.46Å; G244-L248 WeakPolarHBondContact O-CB 3.48Å; G244-L248 PolarHBondContact O-N 3.36Å
245W83.9Confident80.8Confident18 Ų1849.9 Ų49.97%0.06825%0.251CS..Hα-helixtrans-62.1-37.9179.678.2-94.7000113.8L240 L248 A249 T256 F259 N309 M312 T313L240-W245 HydrophobicContact CB-CB 4.45Å; L240-W245 PolarHBondContact O-N 2.85Å; L240-W245 VanDerWaalsContact O-N 3.15Å; W245-L248 PolarHBondContact O-N 3.49Å; W245-A249 WeakPolarHBondContact O-CB 3.43Å; W245-A249 PolarHBondContact O-N 3.43Å; W245-T256 HydrophobicContact CZ3-CG2 4.35Å; W245-F259 HydrophobicContact CZ3-CE2 4.3Å; W245-N309 PolarHBondContact NE1-OD1 3.26Å; W245-M312 HydrophobicContact CD2-CB 4.39Å; W245-M312 HydrophobicContact CE3-CB 4.28Å; W245-M312 HydrophobicContact CH2-CB 3.58Å; W245-M312 HydrophobicContact CH2-CE 3.81Å; W245-M312 HydrophobicContact CH2-CG 3.95Å; W245-M312 HydrophobicContact CZ2-CB 3.68Å; W245-M312 HydrophobicContact CZ2-CG 4.1Å; W245-M312 HydrophobicContact CZ3-CB 3.9Å; W245-M312 HydrophobicContact CZ3-CE 4.21Å; W245-T313 HydrophobicContact CB-CG2 3.96Å; W245-T313 WeakPolarHBondContact CB-OG1 3.49Å; W245-T313 VanDerWaalsContact CG-OG1 3.27Å
246Q83.1Confident80.4Confident125 Ų12552.9 Ų52.958%0.58427%0.269SS*.Hα-helixtrans-69.3-42.8178.4-66-178.5-29.200111.7G244 L248 A249 S250G244-Q246 VanDerWaalsContact C-N 3.34Å; G244-Q246 PolarHBondContact O-N 2.88Å; Q246-L248 VanDerWaalsContact C-N 3.31Å; Q246-L248 PolarHBondContact O-N 3.35Å; Q246-A249 PolarHBondContact O-N 3.33Å; Q246-S250 PolarHBondContact O-N 3.16Å
247E80.7Confident79.8Confident119 Ų11955.6 Ų55.656%0.55629%0.288SS*.Hα-helixtrans-62.9-40.8175.3-73168.6-168.100110.5G244 S250 M251 L338G244-E247 PolarHBondContact O-N 3.46Å; E247-S250 WeakPolarHBondContact CA-OG 3.41Å; E247-S250 PolarHBondContact O-N 2.86Å; E247-S250 PolarHBondContact O-OG 3.5Å; E247-M251 WeakPolarHBondContact O-CG 3.44Å; E247-M251 PolarHBondContact O-N 3.28Å; E247-L338 HydrophobicContact CB-CD2 3.85Å; E247-L338 WeakPolarHBondContact OE2-CD2 3.44Å
248L84Confident79.1Confident0 Ų059.3 Ų59.30%030%0.304CS..Hα-helixtrans-65.2-44175.6-171.866.5000111.7L240 G244 W245 Q246 S250 M251 L252 M316 F317 L331 L335 L338L240-L248 HydrophobicContact CD1-CD2 3.83Å; L240-L248 HydrophobicContact CD2-CB 4.48Å; L240-L248 HydrophobicContact CD2-CD2 3.95Å; G244-L248 WeakPolarHBondContact O-CB 3.48Å; G244-L248 PolarHBondContact O-N 3.36Å; W245-L248 PolarHBondContact O-N 3.49Å; Q246-L248 VanDerWaalsContact C-N 3.31Å; Q246-L248 PolarHBondContact O-N 3.35Å; L248-S250 VanDerWaalsContact C-N 3.28Å; L248-S250 PolarHBondContact O-N 3.14Å; L248-M251 PolarHBondContact O-N 3.05Å; L248-L252 HydrophobicContact CD1-CD1 4Å; L248-L252 HydrophobicContact CD1-CG 4.45Å; L248-L252 HydrophobicContact CG-CD1 3.92Å; L248-L252 WeakPolarHBondContact O-CB 3.42Å; L248-L252 WeakPolarHBondContact O-CG 3.45Å; L248-L252 PolarHBondContact O-N 2.88Å; L248-L252 VanDerWaalsContact O-N 3.07Å; L248-M316 HydrophobicContact CB-CE 4.12Å; L248-M316 HydrophobicContact CD2-CE 3.47Å; L248-M316 VanDerWaalsContact CD2-CE 3.47Å; L248-M316 HydrophobicContact CG-CE 3.65Å; L248-F317 HydrophobicContact CD2-CE2 4.2Å; L248-F317 HydrophobicContact CD2-CZ 4.36Å; L248-L331 HydrophobicContact CD2-CD1 4.2Å; L248-L335 HydrophobicContact CD1-CD2 4.26Å; L248-L335 HydrophobicContact CD1-CG 4.47Å; L248-L335 HydrophobicContact CD2-CD2 4.15Å; L248-L338 HydrophobicContact CB-CD1 3.54Å; L248-L338 HydrophobicContact CD1-CD1 3.45Å; L248-L338 VanDerWaalsContact CD1-CD1 3.45Å; L248-L338 HydrophobicContact CG-CD1 4.05Å
249A83.6Confident78.7Confident1 Ų158.4 Ų58.41%0.00830%0.301CS..Hα-helixtrans-58.6-43174.600000111.1W245 Q246 L252 D253 L254 F259 M316W245-A249 WeakPolarHBondContact O-CB 3.43Å; W245-A249 PolarHBondContact O-N 3.43Å; Q246-A249 PolarHBondContact O-N 3.33Å; A249-L252 CarbonylContact O-C 3.59Å; A249-L252 PolarHBondContact O-N 2.94Å; A249-D253 PolarHBondContact O-N 2.98Å; A249-L254 HydrophobicContact CB-CB 4.35Å; A249-L254 PolarHBondContact O-N 2.9Å; A249-F259 HydrophobicContact CB-CE2 4.37Å; A249-F259 HydrophobicContact CB-CZ 4.38Å; A249-M316 HydrophobicContact CB-SD 3.88Å
250S82.2Confident78Confident76 Ų7662.2 Ų62.253%0.53132%0.324SS..Hα-helixtrans-66.7-40.7177.575.90000113Q246 E247 L248 L252 D253Q246-S250 PolarHBondContact O-N 3.16Å; E247-S250 WeakPolarHBondContact CA-OG 3.41Å; E247-S250 PolarHBondContact O-N 2.86Å; E247-S250 PolarHBondContact O-OG 3.5Å; L248-S250 VanDerWaalsContact C-N 3.28Å; L248-S250 PolarHBondContact O-N 3.14Å; S250-L252 PolarHBondContact O-N 2.72Å; S250-D253 PolarHBondContact O-N 3.46Å
251M80.3Confident77.2Confident85 Ų8569.9 Ų69.942%0.41936%0.36SS..Hα-helixtrans-66.8-25.7177.3-79.2-168.1-16900113E247 L248 K337 L338E247-M251 WeakPolarHBondContact O-CG 3.44Å; E247-M251 PolarHBondContact O-N 3.28Å; L248-M251 PolarHBondContact O-N 3.05Å; M251-K337 HydrophobicContact CE-CB 3.97Å; M251-K337 HydrophobicContact SD-CB 3.76Å; M251-K337 HydrophobicContact SD-CD 4.29Å; M251-L338 HydrophobicContact CE-CG 4.36Å; M251-L338 HydrophobicContact SD-CD1 4.28Å; M251-L338 HydrophobicContact SD-CG 4.48Å
252L80Confident76.3Confident27 Ų2771 Ų7114%0.14137%0.365CS..THydrogen-bonded Turntrans-96.97.1179.4-65.8173.2000112.6L248 A249 S250 L254 M316 M320 V326 S334L248-L252 HydrophobicContact CD1-CD1 4Å; L248-L252 HydrophobicContact CD1-CG 4.45Å; L248-L252 HydrophobicContact CG-CD1 3.92Å; L248-L252 WeakPolarHBondContact O-CB 3.42Å; L248-L252 WeakPolarHBondContact O-CG 3.45Å; L248-L252 PolarHBondContact O-N 2.88Å; L248-L252 VanDerWaalsContact O-N 3.07Å; A249-L252 CarbonylContact O-C 3.59Å; A249-L252 PolarHBondContact O-N 2.94Å; S250-L252 PolarHBondContact O-N 2.72Å; L252-L254 HydrophobicContact CB-CD1 3.78Å; L252-L254 HydrophobicContact CB-CG 3.8Å; L252-L254 HydrophobicContact CD1-CD1 4.08Å; L252-L254 PolarHBondContact O-N 2.93Å; L252-M316 HydrophobicContact CD1-CE 4.21Å; L252-M320 HydrophobicContact CD1-SD 3.68Å; L252-V326 HydrophobicContact CB-CG2 4.37Å; L252-V326 HydrophobicContact CD1-CG1 4.22Å; L252-V326 HydrophobicContact CD1-CG2 4.3Å; L252-V326 HydrophobicContact CD2-CG1 3.73Å; L252-V326 HydrophobicContact CD2-CG2 4.19Å; L252-S334 VanDerWaalsContact CD2-OG 3.29Å; L252-S334 WeakPolarHBondContact CD2-OG 3.46Å
253D82.2Confident75.5Confident155 Ų15571 Ų7183%0.82937%0.371SS*.THydrogen-bonded Turntrans49.239.2-175-74.4-33000113A249 S250A249-D253 PolarHBondContact O-N 2.98Å; S250-D253 PolarHBondContact O-N 3.46Å
254L79.7Confident75.1Confident17 Ų1768.4 Ų68.49%0.08937%0.37CS..  trans-89121.5179.2-63.9169.2000110.6A249 L252 T256 F259 M316 Y319 M320 V326A249-L254 HydrophobicContact CB-CB 4.35Å; A249-L254 PolarHBondContact O-N 2.9Å; L252-L254 HydrophobicContact CB-CD1 3.78Å; L252-L254 HydrophobicContact CB-CG 3.8Å; L252-L254 HydrophobicContact CD1-CD1 4.08Å; L252-L254 PolarHBondContact O-N 2.93Å; L254-T256 PolarHBondContact O-N 3.24Å; L254-F259 HydrophobicContact CB-CE1 4.18Å; L254-F259 HydrophobicContact CB-CZ 3.78Å; L254-M316 HydrophobicContact CD1-CE 3.93Å; L254-M316 HydrophobicContact CD1-CG 3.99Å; L254-M316 HydrophobicContact CD1-SD 4.5Å; L254-Y319 HydrophobicContact CD2-CD1 3.98Å; L254-Y319 HydrophobicContact CD2-CE1 3.84Å; L254-M320 HydrophobicContact CD1-CG 3.65Å; L254-M320 HydrophobicContact CD1-SD 3.67Å; L254-M320 HydrophobicContact CD2-CG 4.39Å; L254-V326 HydrophobicContact CD2-CG2 4.5Å
255E74.7Confident74.3Confident112 Ų11275.4 Ų75.452%0.52340%0.399SS..  trans-76.7110.8179.9-149.8-179.1-179.800110.5S257 K258E255-S257 WeakPolarHBondContact CG-OG 3.26Å; E255-S257 PolarHBondContact O-N 2.96Å; E255-S257 VanDerWaalsContact O-N 3.12Å; E255-K258 HydrophobicContact CB-CD 4.34Å; E255-K258 HydrophobicContact CB-CG 4.32Å; E255-K258 WeakPolarHBondContact O-CB 3.39Å; E255-K258 PolarHBondContact O-N 3.17Å; E255-K258 WeakPolarHBondContact OE2-CE 3.27Å; E255-K258 IonicContact OE2-NZ 3.85Å
256T70.7Confident73Confident70 Ų7077.7 Ų77.743%0.42941%0.412SS..G310 helixtrans-62.2-24-173.359.20000113.6W245 L254 K258 F259W245-T256 HydrophobicContact CZ3-CG2 4.35Å; L254-T256 PolarHBondContact O-N 3.24Å; T256-K258 PolarHBondContact O-N 3.27Å; T256-F259 HydrophobicContact CG2-CD2 4.34Å; T256-F259 HydrophobicContact CG2-CE2 3.82Å; T256-F259 WeakPolarHBondContact O-CB 3.42Å; T256-F259 WeakPolarHBondContact O-CG 3.28Å; T256-F259 PolarHBondContact O-N 3.32Å; T256-F259 VanDerWaalsContact O-N 3.14Å
257S73Confident72.2Confident58 Ų5872.6 Ų72.641%0.40639%0.389SS..G310 helixtrans-62.5-24175.5600000113.2E255 F259E255-S257 WeakPolarHBondContact CG-OG 3.26Å; E255-S257 PolarHBondContact O-N 2.96Å; E255-S257 VanDerWaalsContact O-N 3.12Å; S257-F259 VanDerWaalsContact C-N 3.3Å
258K70.9Confident71.9Confident78 Ų7869.4 Ų69.434%0.33938%0.38SS..G310 helixtrans-77.5-18.2178-64.3-174.8-177.4169.60112.5E255 T256 Q261 L262 Y319E255-K258 HydrophobicContact CB-CD 4.34Å; E255-K258 HydrophobicContact CB-CG 4.32Å; E255-K258 WeakPolarHBondContact O-CB 3.39Å; E255-K258 PolarHBondContact O-N 3.17Å; E255-K258 WeakPolarHBondContact OE2-CE 3.27Å; E255-K258 IonicContact OE2-NZ 3.85Å; T256-K258 PolarHBondContact O-N 3.27Å; K258-Q261 PolarHBondContact O-N 3.11Å; K258-L262 WeakPolarHBondContact O-CD1 3.46Å; K258-Y319 HydrophobicContact CB-CD2 4.32Å; K258-Y319 HydrophobicContact CB-CE2 3.89Å; K258-Y319 HydrophobicContact CD-CE2 4Å; K258-Y319 WeakPolarHBondContact CD-OH 3.35Å
259F75.1Confident71.6Confident1 Ų173.8 Ų73.80%0.00440%0.404CS..G310 helixtrans-72.6-34-175.9-55.7-17.5000112.1W245 A249 L254 T256 S257 Q261 L262 M312 M316 Y319W245-F259 HydrophobicContact CZ3-CE2 4.3Å; A249-F259 HydrophobicContact CB-CE2 4.37Å; A249-F259 HydrophobicContact CB-CZ 4.38Å; L254-F259 HydrophobicContact CB-CE1 4.18Å; L254-F259 HydrophobicContact CB-CZ 3.78Å; T256-F259 HydrophobicContact CG2-CD2 4.34Å; T256-F259 HydrophobicContact CG2-CE2 3.82Å; T256-F259 WeakPolarHBondContact O-CB 3.42Å; T256-F259 WeakPolarHBondContact O-CG 3.28Å; T256-F259 PolarHBondContact O-N 3.32Å; T256-F259 VanDerWaalsContact O-N 3.14Å; S257-F259 VanDerWaalsContact C-N 3.3Å; F259-Q261 PolarHBondContact O-N 3.42Å; F259-L262 VanDerWaalsContact O-CD1 3.31Å; F259-L262 WeakPolarHBondContact O-CD1 3.37Å; F259-L262 PolarHBondContact O-N 3.37Å; F259-M312 HydrophobicContact CB-CE 4.28Å; F259-M312 HydrophobicContact CD2-CE 3.96Å; F259-M316 HydrophobicContact CD2-CB 4.07Å; F259-M316 HydrophobicContact CE1-CB 4.23Å; F259-M316 HydrophobicContact CE1-CG 4.22Å; F259-M316 HydrophobicContact CE2-CB 3.7Å; F259-M316 HydrophobicContact CE2-CG 3.91Å; F259-M316 HydrophobicContact CG-CB 4.49Å; F259-M316 HydrophobicContact CZ-CB 3.81Å; F259-M316 HydrophobicContact CZ-CG 3.64Å; F259-Y319 HydrophobicContact CD1-CG 4.27Å; F259-Y319 HydrophobicContact CE1-CD1 4.09Å; F259-Y319 HydrophobicContact CE1-CG 4.27Å
260D65.6Low71.5Confident123 Ų12373.8 Ų73.866%0.65840%0.403SS*.G310 helixtrans-72.6-16.8179-67.2-36.1000113.1
261Q65.9Low71.6Confident162 Ų16272.2 Ų72.276%0.75739%0.389SS*.G310 helixtrans-88.7-3.1-177.9-63.3-178.2400113.3K258 F259K258-Q261 PolarHBondContact O-N 3.11Å; F259-Q261 PolarHBondContact O-N 3.42Å
262L64.5Low71.8Confident28 Ų2871.5 Ų71.515%0.14739%0.392CS..SBendtrans-74.7142-178.7-79.698.4000112.2K258 F259 S264 T267 Q318 Y319 L322K258-L262 WeakPolarHBondContact O-CD1 3.46Å; F259-L262 VanDerWaalsContact O-CD1 3.31Å; F259-L262 WeakPolarHBondContact O-CD1 3.37Å; F259-L262 PolarHBondContact O-N 3.37Å; L262-S264 PolarHBondContact O-N 3.37Å; L262-T267 HydrophobicContact CB-CG2 4.48Å; L262-Q318 HydrophobicContact CD2-CB 4.07Å; L262-Q318 HydrophobicContact CD2-CG 3.95Å; L262-Y319 HydrophobicContact CD1-CD2 4.09Å; L262-L322 HydrophobicContact CD2-CD1 3.63Å
263P60.3Low71.9Confident69 Ų6971 Ų7145%0.44839%0.392SS..  trans-58.8128.8175.1-20.331000111.5E265 I266P263-E265 PolarHBondContact O-N 3.45Å; P263-I266 HydrophobicContact CB-CD1 3.9Å; P263-I266 HydrophobicContact CB-CG1 4.15Å; P263-I266 HydrophobicContact CG-CD1 3.69Å; P263-I266 HydrophobicContact CG-CG1 4.48Å; P263-I266 PolarHBondContact O-N 3.48Å
264S62.5Low71.9Confident98 Ų9863.6 Ų63.669%0.68535%0.352SS*.Hα-helixtrans-61.1-26.2-17853.50000114.1L262 I266 T267 S268L262-S264 PolarHBondContact O-N 3.37Å; S264-I266 VanDerWaalsContact C-N 3.34Å; S264-T267 WeakPolarHBondContact CA-OG1 3.33Å; S264-T267 PolarHBondContact O-OG1 3.28Å; S264-S268 PolarHBondContact O-N 3.48Å
265E56.7Low72.1Confident162 Ų16266.8 Ų66.876%0.75737%0.368SS*.Hα-helixtrans-65.6-37.4174.9-97.4172.2160.600112.1P263 S268P263-E265 PolarHBondContact O-N 3.45Å; E265-S268 WeakPolarHBondContact O-CB 3.26Å; E265-S268 PolarHBondContact O-N 3.32Å; E265-S268 PolarHBondContact O-OG 3.17Å
266I58Low72.4Confident65 Ų6567.3 Ų67.333%0.33337%0.37SS..Hα-helixtrans-78.3-28.2-174.7-56.5170.9000111P263 S264 S268 Q318 L322P263-I266 HydrophobicContact CB-CD1 3.9Å; P263-I266 HydrophobicContact CB-CG1 4.15Å; P263-I266 HydrophobicContact CG-CD1 3.69Å; P263-I266 HydrophobicContact CG-CG1 4.48Å; P263-I266 PolarHBondContact O-N 3.48Å; S264-I266 VanDerWaalsContact C-N 3.34Å; I266-S268 VanDerWaalsContact C-N 3.28Å; I266-Q318 HydrophobicContact CG2-CG 3.7Å; I266-Q318 PolarHBondContact O-OE1 2.99Å; I266-L322 HydrophobicContact CD1-CD1 4.43Å; I266-L322 HydrophobicContact CG2-CD1 3.9Å
267T66.8Low72.7Confident18 Ų1864.1 Ų64.111%0.1135%0.351CS..Hα-helixtrans-75.3-18.1173.451.70000112.6L262 S264 L271 Q318L262-T267 HydrophobicContact CB-CG2 4.48Å; S264-T267 WeakPolarHBondContact CA-OG1 3.33Å; S264-T267 PolarHBondContact O-OG1 3.28Å; T267-L271 WeakPolarHBondContact O-CB 3.36Å; T267-L271 PolarHBondContact O-N 3.41Å; T267-Q318 HydrophobicContact CG2-CB 4.37Å; T267-Q318 HydrophobicContact CG2-CG 4.3Å
268S72.7Confident73.1Confident52 Ų5263.6 Ų63.636%0.36434%0.342SS..Hα-helixtrans-66.7-42-171.273.20000114.6S264 E265 I266 L271 S272S264-S268 PolarHBondContact O-N 3.48Å; E265-S268 WeakPolarHBondContact O-CB 3.26Å; E265-S268 PolarHBondContact O-N 3.32Å; E265-S268 PolarHBondContact O-OG 3.17Å; I266-S268 VanDerWaalsContact C-N 3.28Å; S268-L271 PolarHBondContact O-N 3.05Å; S268-S272 WeakPolarHBondContact O-CB 3.46Å; S268-S272 PolarHBondContact O-N 3.37Å
269D78.4Confident73.5Confident93 Ų9363.8 Ų63.850%0.49735%0.35SS..Hα-helixtrans-66.4-43.6-179.8-79-14.7000111.3M230 S272 A273M230-D269 HydrophobicContact CE-CB 3.65Å; D269-S272 PolarHBondContact O-N 2.96Å; D269-A273 PolarHBondContact O-N 3.11Å
270L82.3Confident73.6Confident0 Ų064.9 Ų64.90%036%0.356CS..Hα-helixtrans-71.9-38.1179.1-175.556.2000110.3M230 L233 S272 A273 T274 V314 F317M230-L270 HydrophobicContact CE-CB 3.64Å; M230-L270 HydrophobicContact CE-CD1 4.41Å; M230-L270 HydrophobicContact SD-CD1 4.28Å; L233-L270 HydrophobicContact CB-CD1 3.93Å; L233-L270 HydrophobicContact CD2-CD1 3.88Å; L233-L270 HydrophobicContact CD2-CD2 4.1Å; L233-L270 HydrophobicContact CG-CD1 3.87Å; L233-L270 HydrophobicContact CG-CD2 4.49Å; L270-S272 VanDerWaalsContact C-N 3.34Å; L270-S272 PolarHBondContact O-N 3.37Å; L270-A273 PolarHBondContact O-N 3.46Å; L270-T274 VanDerWaalsContact O-CB 3.28Å; L270-T274 WeakPolarHBondContact O-CB 3.41Å; L270-T274 PolarHBondContact O-N 3.34Å; L270-T274 PolarHBondContact O-OG1 2.84Å; L270-V314 HydrophobicContact CB-CG1 3.95Å; L270-V314 HydrophobicContact CD2-CG1 4.08Å; L270-V314 HydrophobicContact CG-CG1 3.94Å; L270-V314 HydrophobicContact CG-CG2 4.45Å; L270-F317 HydrophobicContact CD2-CB 3.93Å
271L84.6Confident73.8Confident43 Ų4359.5 Ų59.523%0.22533%0.329CS..Hα-helixtrans-61.9-42.6174.2-173.265.5000111.3T267 S268 T274 M275 L310 V314T267-L271 WeakPolarHBondContact O-CB 3.36Å; T267-L271 PolarHBondContact O-N 3.41Å; S268-L271 PolarHBondContact O-N 3.05Å; L271-T274 PolarHBondContact O-N 2.85Å; L271-M275 HydrophobicContact CG-CE 4.43Å; L271-M275 WeakPolarHBondContact O-CB 3.27Å; L271-M275 WeakPolarHBondContact O-CG 3.44Å; L271-M275 PolarHBondContact O-N 3.13Å; L271-L310 HydrophobicContact CD1-CD2 3.95Å; L271-L310 HydrophobicContact CD1-CG 4.48Å; L271-V314 HydrophobicContact CB-CG1 4.18Å; L271-V314 HydrophobicContact CD1-CG2 4.1Å
272S84.4Confident74.2Confident71 Ų7155.4 Ų55.450%0.49731%0.31SS..Hα-helixtrans-60.4-49.8174-99.50000111.8S268 D269 L270 T274 M275 E276S268-S272 WeakPolarHBondContact O-CB 3.46Å; S268-S272 PolarHBondContact O-N 3.37Å; D269-S272 PolarHBondContact O-N 2.96Å; L270-S272 VanDerWaalsContact C-N 3.34Å; L270-S272 PolarHBondContact O-N 3.37Å; S272-T274 PolarHBondContact O-N 2.96Å; S272-M275 PolarHBondContact O-N 2.99Å; S272-E276 WeakPolarHBondContact O-CB 3.44Å; S272-E276 PolarHBondContact O-N 2.9Å
273A80.9Confident74.5Confident15 Ų1556.6 Ų56.612%0.12432%0.32CS..Hα-helixtrans-60.5-36.4176.900000112.1M230 D269 L270 A277M230-A273 HydrophobicContact CG-CB 4.42Å; D269-A273 PolarHBondContact O-N 3.11Å; L270-A273 PolarHBondContact O-N 3.46Å; A273-A277 PolarHBondContact O-N 3.1Å
274T82.9Confident74.5Confident0 Ų056 Ų560%031%0.312CS..Hα-helixtrans-70.5-41.4177.4-53.20000111.4G234 C237 L270 L271 S272 E276 A277 Q278 L310 V314G234-T274 WeakPolarHBondContact CA-OG1 3.46Å; C237-T274 HydrophobicContact CB-CG2 3.79Å; L270-T274 VanDerWaalsContact O-CB 3.28Å; L270-T274 WeakPolarHBondContact O-CB 3.41Å; L270-T274 PolarHBondContact O-N 3.34Å; L270-T274 PolarHBondContact O-OG1 2.84Å; L271-T274 PolarHBondContact O-N 2.85Å; S272-T274 PolarHBondContact O-N 2.96Å; T274-E276 VanDerWaalsContact C-N 3.34Å; T274-A277 WeakPolarHBondContact O-CB 3.31Å; T274-A277 PolarHBondContact O-N 3.12Å; T274-Q278 PolarHBondContact O-N 3.16Å; T274-L310 HydrophobicContact CG2-CD1 3.4Å; T274-L310 VanDerWaalsContact CG2-CD1 3.4Å; T274-L310 HydrophobicContact CG2-CD2 4.3Å; T274-L310 HydrophobicContact CG2-CG 3.87Å; T274-V314 HydrophobicContact CG2-CG2 4.11Å; T274-V314 WeakPolarHBondContact OG1-CG2 3.4Å
275M82.8Confident74.3Confident85 Ų8554.1 Ų54.142%0.41929%0.293SS..Hα-helixtrans-66.4-36.1174.5-74.6-163.5-62.500111.8L271 S272 Q278 T279 L310L271-M275 HydrophobicContact CG-CE 4.43Å; L271-M275 WeakPolarHBondContact O-CB 3.27Å; L271-M275 WeakPolarHBondContact O-CG 3.44Å; L271-M275 PolarHBondContact O-N 3.13Å; S272-M275 PolarHBondContact O-N 2.99Å; M275-Q278 WeakPolarHBondContact O-CB 3.37Å; M275-Q278 PolarHBondContact O-N 2.94Å; M275-T279 WeakPolarHBondContact O-CG2 3.36Å; M275-T279 PolarHBondContact O-N 3.49Å; M275-T279 PolarHBondContact O-OG1 2.92Å; M275-L310 HydrophobicContact CG-CD2 4.13Å
276E80.7Confident74.4Confident123 Ų12353.1 Ų53.158%0.57529%0.287SS*.Hα-helixtrans-65-40.6173.5-170.4-178.6174.400111.8S272 T274 Q278 T279 T280S272-E276 WeakPolarHBondContact O-CB 3.44Å; S272-E276 PolarHBondContact O-N 2.9Å; T274-E276 VanDerWaalsContact C-N 3.34Å; E276-Q278 VanDerWaalsContact C-N 3.32Å; E276-Q278 PolarHBondContact O-N 2.92Å; E276-T279 WeakPolarHBondContact CA-OG1 3.2Å; E276-T279 PolarHBondContact O-N 3.27Å; E276-T279 PolarHBondContact O-OG1 3.32Å; E276-T280 WeakPolarHBondContact O-CB 3.02Å; E276-T280 PolarHBondContact O-N 3.32Å; E276-T280 PolarHBondContact O-OG1 3.01Å
277A78Confident74.2Confident2 Ų256.5 Ų56.52%0.01730%0.301CS..Hα-helixtrans-62.1-41.3172.200000111.6V235 A273 T274 A281V235-A277 HydrophobicContact CB-CB 4.36Å; V235-A277 HydrophobicContact CG2-CB 3.75Å; A273-A277 PolarHBondContact O-N 3.1Å; T274-A277 WeakPolarHBondContact O-CB 3.31Å; T274-A277 PolarHBondContact O-N 3.12Å; A277-A281 WeakPolarHBondContact O-CB 3.21Å; A277-A281 PolarHBondContact O-N 2.63Å
278Q82.4Confident73.2Confident48 Ų4859.2 Ų59.222%0.22432%0.32CS..Hα-helixtrans-61.8-52.7175.3175.3173.96.500112Y238 T274 M275 E276 T280 A281 E282Y238-Q278 HydrophobicContact CD2-CB 3.6Å; Y238-Q278 HydrophobicContact CD2-CG 4.11Å; Y238-Q278 HydrophobicContact CE2-CB 3.45Å; Y238-Q278 VanDerWaalsContact CE2-CB 3.45Å; Y238-Q278 HydrophobicContact CE2-CG 3.48Å; Y238-Q278 VanDerWaalsContact CE2-CG 3.48Å; Y238-Q278 HydrophobicContact CG-CB 4.35Å; T274-Q278 PolarHBondContact O-N 3.16Å; M275-Q278 WeakPolarHBondContact O-CB 3.37Å; M275-Q278 PolarHBondContact O-N 2.94Å; E276-Q278 VanDerWaalsContact C-N 3.32Å; E276-Q278 PolarHBondContact O-N 2.92Å; Q278-T280 PolarHBondContact O-N 3.3Å; Q278-A281 WeakPolarHBondContact O-CB 3.16Å; Q278-A281 PolarHBondContact O-N 3.35Å; Q278-A281 VanDerWaalsContact O-N 3.16Å; Q278-E282 HydrophobicContact CG-CG 4.38Å; Q278-E282 VanDerWaalsContact CG-OE1 3.29Å; Q278-E282 WeakPolarHBondContact CG-OE1 3.47Å; Q278-E282 PolarHBondContact NE2-OE1 3.46Å; Q278-E282 WeakPolarHBondContact O-CB 3.18Å; Q278-E282 WeakPolarHBondContact O-CG 3.44Å; Q278-E282 PolarHBondContact O-N 3.5Å
279T78.8Confident71.9Confident82 Ų8258.8 Ų58.850%0.50331%0.314SS..Hα-helixtrans-62.5-35.2-176.753.70000111.5M275 E276 S283M275-T279 WeakPolarHBondContact O-CG2 3.36Å; M275-T279 PolarHBondContact O-N 3.49Å; M275-T279 PolarHBondContact O-OG1 2.92Å; E276-T279 WeakPolarHBondContact CA-OG1 3.2Å; E276-T279 PolarHBondContact O-N 3.27Å; E276-T279 PolarHBondContact O-OG1 3.32Å; T279-S283 WeakPolarHBondContact O-CB 3.43Å; T279-S283 PolarHBondContact O-N 2.8Å; T279-S283 PolarHBondContact O-OG 2.67Å
280T77Confident70.6Confident23 Ų2361.5 Ų61.514%0.14132%0.323CS..Hα-helixtrans-72.7-40176.2-51.30000111.9W43 Q44 E276 Q278 E282 S283 H284W43-T280 HydrophobicContact CH2-CG2 3.14Å; W43-T280 WeakPolarHBondContact CH2-OG1 3.36Å; W43-T280 HydrophobicContact CZ2-CG2 4.02Å; W43-T280 HydrophobicContact CZ3-CG2 3.49Å; W43-T280 VanDerWaalsContact CZ3-CG2 3.49Å; Q44-T280 HydrophobicContact CG-CG2 4.05Å; E276-T280 WeakPolarHBondContact O-CB 3.02Å; E276-T280 PolarHBondContact O-N 3.32Å; E276-T280 PolarHBondContact O-OG1 3.01Å; Q278-T280 PolarHBondContact O-N 3.3Å; T280-E282 VanDerWaalsContact C-N 3.31Å; T280-E282 PolarHBondContact O-N 3.28Å; T280-S283 WeakPolarHBondContact CA-OG 3.46Å; T280-S283 PolarHBondContact O-N 2.83Å; T280-S283 PolarHBondContact O-OG 2.71Å; T280-H284 PolarHBondContact O-CD2 2.71Å; T280-H284 PolarHBondContact O-N 3.03Å
281A70.4Confident68.8Low10 Ų1068.5 Ų68.58%0.08336%0.361CS..Hα-helixtrans-58.8-45.3172.600000112.1L47 Y238 A277 Q278 H284 L285L47-A281 VanDerWaalsContact CD1-CA 3.42Å; L47-A281 HydrophobicContact CD1-CB 3.79Å; L47-A281 HydrophobicContact CD2-CB 3.53Å; L47-A281 HydrophobicContact CG-CB 4.15Å; Y238-A281 HydrophobicContact CD1-CB 4.39Å; Y238-A281 HydrophobicContact CE1-CB 3.46Å; Y238-A281 VanDerWaalsContact CE1-CB 3.46Å; A277-A281 WeakPolarHBondContact O-CB 3.21Å; A277-A281 PolarHBondContact O-N 2.63Å; Q278-A281 WeakPolarHBondContact O-CB 3.16Å; Q278-A281 PolarHBondContact O-N 3.35Å; Q278-A281 VanDerWaalsContact O-N 3.16Å; A281-H284 PolarHBondContact O-N 3.46Å; A281-L285 PolarHBondContact O-N 3.33Å
282E73.8Confident66.7Low76 Ų7671.7 Ų71.736%0.35538%0.378SS..Hα-helixtrans-68.8-34.9179.2-71.2178.2-169.900112.5Q278 T280 L285 K286Q278-E282 HydrophobicContact CG-CG 4.38Å; Q278-E282 VanDerWaalsContact CG-OE1 3.29Å; Q278-E282 WeakPolarHBondContact CG-OE1 3.47Å; Q278-E282 PolarHBondContact NE2-OE1 3.46Å; Q278-E282 WeakPolarHBondContact O-CB 3.18Å; Q278-E282 WeakPolarHBondContact O-CG 3.44Å; Q278-E282 PolarHBondContact O-N 3.5Å; T280-E282 VanDerWaalsContact C-N 3.31Å; T280-E282 PolarHBondContact O-N 3.28Å; E282-L285 PolarHBondContact O-N 3.31Å; E282-K286 WeakPolarHBondContact O-CG 3.43Å; E282-K286 PolarHBondContact O-N 3.04Å
283S69.4Low64.3Low53 Ų5373.4 Ų73.437%0.37139%0.39SS..Hα-helixtrans-68-41.8176.572.30000111.6T279 T280 L285 K286 Q287T279-S283 WeakPolarHBondContact O-CB 3.43Å; T279-S283 PolarHBondContact O-N 2.8Å; T279-S283 PolarHBondContact O-OG 2.67Å; T280-S283 WeakPolarHBondContact CA-OG 3.46Å; T280-S283 PolarHBondContact O-N 2.83Å; T280-S283 PolarHBondContact O-OG 2.71Å; S283-L285 VanDerWaalsContact C-N 3.32Å; S283-L285 PolarHBondContact O-N 3.22Å; S283-K286 PolarHBondContact O-N 3.19Å; S283-Q287 WeakPolarHBondContact O-CB 3.47Å; S283-Q287 PolarHBondContact O-N 3.36Å
284H60.8Low62.2Low57 Ų5779.6 Ų79.626%0.26442%0.421SS..Hα-helixtrans-63.5-38.3173.8-80-70.5000112.2Q44 T280 A281 Q287 C288Q44-H284 WeakPolarHBondContact CB-NE2 3.3Å; Q44-H284 VanDerWaalsContact CD-NE2 3.35Å; Q44-H284 WeakPolarHBondContact CG-NE2 3.49Å; Q44-H284 PolarHBondContact OE1-NE2 3.09Å; T280-H284 PolarHBondContact O-CD2 2.71Å; T280-H284 PolarHBondContact O-N 3.03Å; A281-H284 PolarHBondContact O-N 3.46Å; H284-Q287 PolarHBondContact O-N 3.02Å; H284-C288 WeakPolarHBondContact O-CB 3.34Å; H284-C288 PolarHBondContact O-N 3.28Å; H284-C288 PolarHBondContact O-SG 2.89Å; H284-C288 VanDerWaalsContact O-SG 3.37Å
285L58.5Low59.7Low58 Ų5886 Ų8630%0.30446%0.46SS..Hα-helixtrans-64.3-42.3175.5-157.682.6000111.6A281 E282 S283 N289A281-L285 PolarHBondContact O-N 3.33Å; E282-L285 PolarHBondContact O-N 3.31Å; S283-L285 VanDerWaalsContact C-N 3.32Å; S283-L285 PolarHBondContact O-N 3.22Å; L285-N289 WeakPolarHBondContact O-CB 3.49Å; L285-N289 PolarHBondContact O-N 3.16Å; L285-N289 PolarHBondContact O-ND2 3.37Å; L285-N289 VanDerWaalsContact O-ND2 3.13Å
286K58.1Low57.7Low142 Ų14288.1 Ų88.162%0.61747%0.472SS*.Hα-helixtrans-64.8-40.1175.8-75.6176.6-177175.50111.9E282 S283 N289 Q290E282-K286 WeakPolarHBondContact O-CG 3.43Å; E282-K286 PolarHBondContact O-N 3.04Å; S283-K286 PolarHBondContact O-N 3.19Å; K286-N289 PolarHBondContact O-N 3.37Å; K286-Q290 PolarHBondContact O-N 3.09Å; K286-Q290 VanDerWaalsContact O-N 3.16Å
287Q54Low55.4Low135 Ų13589.2 Ų89.263%0.63148%0.477SS*.Hα-helixtrans-71-36.8-179.1-167.7146.8-0.900112.6S283 H284 N289 Q290S283-Q287 WeakPolarHBondContact O-CB 3.47Å; S283-Q287 PolarHBondContact O-N 3.36Å; H284-Q287 PolarHBondContact O-N 3.02Å; Q287-N289 VanDerWaalsContact C-N 3.31Å; Q287-N289 PolarHBondContact O-N 2.83Å; Q287-Q290 PolarHBondContact O-N 3.24Å
288C45.6Very low53.4Low75 Ų7593.8 Ų93.851%0.50751%0.506SS..Hα-helixtrans-68.6-28.3172.7-72.70000113.2H284H284-C288 WeakPolarHBondContact O-CB 3.34Å; H284-C288 PolarHBondContact O-N 3.28Å; H284-C288 PolarHBondContact O-SG 2.89Å; H284-C288 VanDerWaalsContact O-SG 3.37Å
289N47.1Very low51.6Low44 Ų4497.8 Ų97.824%0.23553%0.528CS..Hα-helixtrans-88.6-7179.8-72.9-28.9000113.6L285 K286 Q287 D291 N292L285-N289 WeakPolarHBondContact O-CB 3.49Å; L285-N289 PolarHBondContact O-N 3.16Å; L285-N289 PolarHBondContact O-ND2 3.37Å; L285-N289 VanDerWaalsContact O-ND2 3.13Å; K286-N289 PolarHBondContact O-N 3.37Å; Q287-N289 VanDerWaalsContact C-N 3.31Å; Q287-N289 PolarHBondContact O-N 2.83Å; N289-D291 VanDerWaalsContact C-N 3.3Å; N289-N292 CarbonylContact O-C 3.6Å; N289-N292 PolarHBondContact O-N 3.01Å
290Q50.1Low49.5Very low149 Ų14997.7 Ų97.770%0.69653%0.528SS*.THydrogen-bonded Turntrans-76.5-20.2-178.8-141.7155.5-7.200112.8K286 Q287 N292K286-Q290 PolarHBondContact O-N 3.09Å; K286-Q290 VanDerWaalsContact O-N 3.16Å; Q287-Q290 PolarHBondContact O-N 3.24Å; Q290-N292 VanDerWaalsContact C-N 3.25Å; Q290-N292 PolarHBondContact O-N 3.3Å
291D44.8Very low47.5Very low147 Ų147104.5 Ų104.579%0.78656%0.563SS**THydrogen-bonded Turntrans-76.8-13172.4-70.4-28.1000112.9N289N289-D291 VanDerWaalsContact C-N 3.3Å
292N39.5Very low46.1Very low111 Ų111107.6 Ų107.659%0.59458%0.578SS**SBendtrans-119.280.3-179.7-56.82.7000108.4N289 Q290 N294N289-N292 CarbonylContact O-C 3.6Å; N289-N292 PolarHBondContact O-N 3.01Å; Q290-N292 VanDerWaalsContact C-N 3.25Å; Q290-N292 PolarHBondContact O-N 3.3Å; N292-N294 VanDerWaalsContact C-N 3.33Å; N292-N294 PolarHBondContact O-N 3.33Å
293S34.1Very low45Very low106 Ų106108.1 Ų108.174%0.74158%0.584SS**  trans-57.399.2166.1-710000108.6
294N36.7Very low44.1Very low145 Ų145112.3 Ų112.378%0.77560%0.602SS**SBendtrans-178.1105.7141.9-80.4-22.9000109.5N292N292-N294 VanDerWaalsContact C-N 3.33Å; N292-N294 PolarHBondContact O-N 3.33Å
295T32.1Very low44Very low135 Ų135114.2 Ų114.283%0.82861%0.614SS**  trans49.286.2150.3-42.40000117.1
296I39.2Very low44.2Very low130 Ų130114.2 Ų114.267%0.66761%0.614SS**  trans-124.3114.6155.5-58.4-175.4000108.3
297Q33.6Very low44.5Very low145 Ų145114.4 Ų114.468%0.67862%0.615SS**  trans-55.6139.2171.4-69.3-164.70.400109.3I299Q297-I299 PolarHBondContact O-N 3.49Å
298P35.5Very low45.6Very low98 Ų98112.8 Ų112.864%0.63661%0.611SS**  trans-53.2130167.923.4-30.7000107.5T300P298-T300 VanDerWaalsContact C-OG1 3.27Å; P298-T300 WeakPolarHBondContact CB-OG1 3.48Å; P298-T300 WeakPolarHBondContact CG-OG1 3.43Å; P298-T300 WeakPolarHBondContact O-CB 3.38Å; P298-T300 PolarHBondContact O-N 3.16Å; P298-T300 PolarHBondContact O-OG1 3.37Å
299I43.9Very low47.3Very low133 Ų133111.3 Ų111.368%0.68260%0.598SS**SBendtrans-59.587.4173.8-56.4168.5000106.7Q297Q297-I299 PolarHBondContact O-N 3.49Å
300T34.9Very low49Very low80 Ų80109.6 Ų109.649%0.49159%0.589SS.*  trans-115.8-0.5-170.2-40.50000111.5P298P298-T300 VanDerWaalsContact C-OG1 3.27Å; P298-T300 WeakPolarHBondContact CB-OG1 3.48Å; P298-T300 WeakPolarHBondContact CG-OG1 3.43Å; P298-T300 WeakPolarHBondContact O-CB 3.38Å; P298-T300 PolarHBondContact O-N 3.16Å; P298-T300 PolarHBondContact O-OG1 3.37Å
301N34.7Very low50.5Low165 Ų165105 Ų10588%0.88257%0.571SS**SBendtrans-97.510.6-175.4-90.31.9000115.9
302N41.1Very low52.3Low76 Ų7699.1 Ų99.141%0.40654%0.539SS..SBendtrans-137.818.7175.9-133.87.2000114.7N304 N305 N306N302-N304 VanDerWaalsContact C-N 3.29Å; N302-N304 PolarHBondContact O-N 3.46Å; N302-N305 PolarHBondContact O-N 3.16Å; N302-N305 PolarHBondContact OD1-ND2 2.91Å; N302-N305 VanDerWaalsContact OD1-ND2 3.16Å; N302-N306 WeakPolarHBondContact O-CB 3.28Å; N302-N306 PolarHBondContact O-N 3.27Å
303N50.5Low54.5Low87 Ų8793.9 Ų93.947%0.46551%0.511SS..Hα-helixtrans-60.9-33.1-171.9-86.3-9.3000113.9K307N303-K307 WeakPolarHBondContact O-CB 3.46Å; N303-K307 PolarHBondContact O-N 3.45Å
304N51.3Low56.9Low140 Ų14088.9 Ų88.975%0.74948%0.476SS*.Hα-helixtrans-74.8-43-179.9-70.8-8.8000112.3N302 N308N302-N304 VanDerWaalsContact C-N 3.29Å; N302-N304 PolarHBondContact O-N 3.46Å; N304-N308 WeakPolarHBondContact O-CB 3.48Å; N304-N308 PolarHBondContact O-N 3.48Å
305N59.3Low59.2Low98 Ų9882.5 Ų82.552%0.52444%0.442SS..Hα-helixtrans-69.5-41.7177.8-70.7-21.4000111.5N302 N308 N309N302-N305 PolarHBondContact O-N 3.16Å; N302-N305 PolarHBondContact OD1-ND2 2.91Å; N302-N305 VanDerWaalsContact OD1-ND2 3.16Å; N305-N308 PolarHBondContact O-N 3.05Å; N305-N309 WeakPolarHBondContact O-CB 3.43Å; N305-N309 VanDerWaalsContact O-CG 3.24Å; N305-N309 PolarHBondContact O-N 3.2Å; N305-N309 PolarHBondContact O-ND2 3.22Å
306N62.6Low61.7Low58 Ų5876 Ų7631%0.3140%0.403SS..Hα-helixtrans-65-40.7176.9-79.85.5000111.7N302 N308 N309 L310N302-N306 WeakPolarHBondContact O-CB 3.28Å; N302-N306 PolarHBondContact O-N 3.27Å; N306-N308 VanDerWaalsContact C-N 3.31Å; N306-N308 PolarHBondContact O-N 2.91Å; N306-N309 PolarHBondContact O-N 2.91Å; N306-L310 VanDerWaalsContact O-CB 3.29Å; N306-L310 WeakPolarHBondContact O-CB 3.49Å; N306-L310 PolarHBondContact O-N 3.48Å
307K64.8Low63.9Low146 Ų14669.9 Ų69.964%0.63537%0.371SS*.Hα-helixtrans-64.7-38.1176.1-170.5169-175.5172.20111.7N303 T311N303-K307 WeakPolarHBondContact O-CB 3.46Å; N303-K307 PolarHBondContact O-N 3.45Å; K307-T311 WeakPolarHBondContact O-CB 3.29Å; K307-T311 PolarHBondContact O-N 2.8Å; K307-T311 PolarHBondContact O-OG1 3.33Å
308N76.2Confident66.2Low101 Ų10164 Ų6454%0.5434%0.344SS..Hα-helixtrans-67.7-45175.8-152.228000111.3N304 N305 N306 L310 T311 M312N304-N308 WeakPolarHBondContact O-CB 3.48Å; N304-N308 PolarHBondContact O-N 3.48Å; N305-N308 PolarHBondContact O-N 3.05Å; N306-N308 VanDerWaalsContact C-N 3.31Å; N306-N308 PolarHBondContact O-N 2.91Å; N308-L310 VanDerWaalsContact C-N 3.34Å; N308-L310 PolarHBondContact O-N 2.86Å; N308-T311 PolarHBondContact O-N 3.43Å; N308-M312 WeakPolarHBondContact O-CB 3.12Å; N308-M312 VanDerWaalsContact O-CG 3.27Å; N308-M312 WeakPolarHBondContact O-CG 3.29Å; N308-M312 PolarHBondContact O-N 2.82Å
309N81Confident68.4Low44 Ų4460.1 Ų60.124%0.23532%0.316CS..Hα-helixtrans-61.6-40.1175.5-72.6-21.5000112.5S241 W245 N305 N306 M312 T313S241-N309 WeakPolarHBondContact O-CB 3.42Å; W245-N309 PolarHBondContact NE1-OD1 3.26Å; N305-N309 WeakPolarHBondContact O-CB 3.43Å; N305-N309 VanDerWaalsContact O-CG 3.24Å; N305-N309 PolarHBondContact O-N 3.2Å; N305-N309 PolarHBondContact O-ND2 3.22Å; N306-N309 PolarHBondContact O-N 2.91Å; N309-M312 PolarHBondContact O-N 3.05Å; N309-T313 WeakPolarHBondContact O-CB 3.37Å; N309-T313 PolarHBondContact O-N 3.02Å; N309-T313 PolarHBondContact O-OG1 2.85Å
310L83.6Confident70.1Confident8 Ų853.8 Ų53.84%0.04228%0.284CS..Hα-helixtrans-60.4-50.7175.1-163.383.6000110.5Y238 S241 L271 T274 M275 N306 N308 M312 T313 V314Y238-L310 HydrophobicContact CD2-CD1 4.12Å; S241-L310 VanDerWaalsContact OG-CD1 3.26Å; S241-L310 WeakPolarHBondContact OG-CD1 3.4Å; L271-L310 HydrophobicContact CD1-CD2 3.95Å; L271-L310 HydrophobicContact CD1-CG 4.48Å; T274-L310 HydrophobicContact CG2-CD1 3.4Å; T274-L310 VanDerWaalsContact CG2-CD1 3.4Å; T274-L310 HydrophobicContact CG2-CD2 4.3Å; T274-L310 HydrophobicContact CG2-CG 3.87Å; M275-L310 HydrophobicContact CG-CD2 4.13Å; N306-L310 VanDerWaalsContact O-CB 3.29Å; N306-L310 WeakPolarHBondContact O-CB 3.49Å; N306-L310 PolarHBondContact O-N 3.48Å; N308-L310 VanDerWaalsContact C-N 3.34Å; N308-L310 PolarHBondContact O-N 2.86Å; L310-M312 VanDerWaalsContact C-N 3.33Å; L310-M312 PolarHBondContact O-N 2.86Å; L310-T313 PolarHBondContact O-N 3.21Å; L310-V314 WeakPolarHBondContact O-CB 3.4Å; L310-V314 VanDerWaalsContact O-CG2 3.28Å; L310-V314 WeakPolarHBondContact O-CG2 3.49Å; L310-V314 PolarHBondContact O-N 2.66Å
311T81.8Confident72.3Confident52 Ų5250.9 Ų50.932%0.31927%0.267SS..Hα-helixtrans-61.1-44.4-179.5-51.80000110.4K307 N308 T313 V314 S315K307-T311 WeakPolarHBondContact O-CB 3.29Å; K307-T311 PolarHBondContact O-N 2.8Å; K307-T311 PolarHBondContact O-OG1 3.33Å; N308-T311 PolarHBondContact O-N 3.43Å; T311-T313 PolarHBondContact O-N 3.44Å; T311-V314 PolarHBondContact O-N 3.3Å; T311-S315 WeakPolarHBondContact O-CB 3.41Å; T311-S315 PolarHBondContact O-N 3.41Å; T311-S315 PolarHBondContact O-OG 3.03Å; T311-S315 VanDerWaalsContact O-OG 3.09Å
312M81.7Confident74.3Confident24 Ų2447.4 Ų47.412%0.11825%0.248CC..Hα-helixtrans-64.3-41177.3-71.2-59.5-77.700112.7W245 F259 N308 N309 L310 S315 M316W245-M312 HydrophobicContact CD2-CB 4.39Å; W245-M312 HydrophobicContact CE3-CB 4.28Å; W245-M312 HydrophobicContact CH2-CB 3.58Å; W245-M312 HydrophobicContact CH2-CE 3.81Å; W245-M312 HydrophobicContact CH2-CG 3.95Å; W245-M312 HydrophobicContact CZ2-CB 3.68Å; W245-M312 HydrophobicContact CZ2-CG 4.1Å; W245-M312 HydrophobicContact CZ3-CB 3.9Å; W245-M312 HydrophobicContact CZ3-CE 4.21Å; F259-M312 HydrophobicContact CB-CE 4.28Å; F259-M312 HydrophobicContact CD2-CE 3.96Å; N308-M312 WeakPolarHBondContact O-CB 3.12Å; N308-M312 VanDerWaalsContact O-CG 3.27Å; N308-M312 WeakPolarHBondContact O-CG 3.29Å; N308-M312 PolarHBondContact O-N 2.82Å; N309-M312 PolarHBondContact O-N 3.05Å; L310-M312 VanDerWaalsContact C-N 3.33Å; L310-M312 PolarHBondContact O-N 2.86Å; M312-S315 PolarHBondContact O-N 3.06Å; M312-M316 WeakPolarHBondContact O-CB 3.35Å; M312-M316 PolarHBondContact O-N 3.2Å
313T85.6Confident75.8Confident1 Ų149.2 Ų49.21%0.00625%0.254CS..Hα-helixtrans-65.9-42.1177.9-52.60000111.1C237 L240 S241 W245 N309 L310 T311 M316 F317C237-T313 HydrophobicContact CB-CG2 4.23Å; C237-T313 WeakPolarHBondContact O-CG2 3.31Å; L240-T313 HydrophobicContact CB-CG2 3.86Å; S241-T313 WeakPolarHBondContact CA-OG1 3.4Å; W245-T313 HydrophobicContact CB-CG2 3.96Å; W245-T313 WeakPolarHBondContact CB-OG1 3.49Å; W245-T313 VanDerWaalsContact CG-OG1 3.27Å; N309-T313 WeakPolarHBondContact O-CB 3.37Å; N309-T313 PolarHBondContact O-N 3.02Å; N309-T313 PolarHBondContact O-OG1 2.85Å; L310-T313 PolarHBondContact O-N 3.21Å; T311-T313 PolarHBondContact O-N 3.44Å; T313-M316 WeakPolarHBondContact O-CB 3.48Å; T313-M316 PolarHBondContact O-N 2.84Å; T313-F317 HydrophobicContact CG2-CD2 4.25Å; T313-F317 PolarHBondContact O-N 3.43Å
314V85.2Confident76.8Confident1 Ų148.8 Ų48.81%0.00625%0.252CS..Hα-helixtrans-62.3-47.6175.2168.20000110.5C237 L270 L271 T274 L310 T311 M316 F317 Q318C237-V314 HydrophobicContact CB-CG2 4.27Å; L270-V314 HydrophobicContact CB-CG1 3.95Å; L270-V314 HydrophobicContact CD2-CG1 4.08Å; L270-V314 HydrophobicContact CG-CG1 3.94Å; L270-V314 HydrophobicContact CG-CG2 4.45Å; L271-V314 HydrophobicContact CB-CG1 4.18Å; L271-V314 HydrophobicContact CD1-CG2 4.1Å; T274-V314 HydrophobicContact CG2-CG2 4.11Å; T274-V314 WeakPolarHBondContact OG1-CG2 3.4Å; L310-V314 WeakPolarHBondContact O-CB 3.4Å; L310-V314 VanDerWaalsContact O-CG2 3.28Å; L310-V314 WeakPolarHBondContact O-CG2 3.49Å; L310-V314 PolarHBondContact O-N 2.66Å; T311-V314 PolarHBondContact O-N 3.3Å; V314-M316 VanDerWaalsContact C-N 3.31Å; V314-M316 PolarHBondContact O-N 3.41Å; V314-F317 PolarHBondContact O-N 3.45Å; V314-Q318 VanDerWaalsContact O-CB 3.26Å; V314-Q318 WeakPolarHBondContact O-CB 3.41Å; V314-Q318 PolarHBondContact O-N 2.73Å
315S84Confident77.6Confident10 Ų1045 Ų457%0.0723%0.234CC..Hα-helixtrans-62-38.7177.6-65.80000112.3T311 M312 Q318 Y319T311-S315 WeakPolarHBondContact O-CB 3.41Å; T311-S315 PolarHBondContact O-N 3.41Å; T311-S315 PolarHBondContact O-OG 3.03Å; T311-S315 VanDerWaalsContact O-OG 3.09Å; M312-S315 PolarHBondContact O-N 3.06Å; S315-Q318 PolarHBondContact O-N 2.95Å; S315-Y319 WeakPolarHBondContact O-CB 3.48Å; S315-Y319 PolarHBondContact O-N 2.97Å
316M85.4Confident78.3Confident0 Ų040.6 Ų40.60%021%0.21CC..Hα-helixtrans-61.4-50.5174.2176.9-166.6142.200111.5L248 A249 L252 L254 F259 M312 T313 V314 Q318 Y319 M320L248-M316 HydrophobicContact CB-CE 4.12Å; L248-M316 HydrophobicContact CD2-CE 3.47Å; L248-M316 VanDerWaalsContact CD2-CE 3.47Å; L248-M316 HydrophobicContact CG-CE 3.65Å; A249-M316 HydrophobicContact CB-SD 3.88Å; L252-M316 HydrophobicContact CD1-CE 4.21Å; L254-M316 HydrophobicContact CD1-CE 3.93Å; L254-M316 HydrophobicContact CD1-CG 3.99Å; L254-M316 HydrophobicContact CD1-SD 4.5Å; F259-M316 HydrophobicContact CD2-CB 4.07Å; F259-M316 HydrophobicContact CE1-CB 4.23Å; F259-M316 HydrophobicContact CE1-CG 4.22Å; F259-M316 HydrophobicContact CE2-CB 3.7Å; F259-M316 HydrophobicContact CE2-CG 3.91Å; F259-M316 HydrophobicContact CG-CB 4.49Å; F259-M316 HydrophobicContact CZ-CB 3.81Å; F259-M316 HydrophobicContact CZ-CG 3.64Å; M312-M316 WeakPolarHBondContact O-CB 3.35Å; M312-M316 PolarHBondContact O-N 3.2Å; T313-M316 WeakPolarHBondContact O-CB 3.48Å; T313-M316 PolarHBondContact O-N 2.84Å; V314-M316 VanDerWaalsContact C-N 3.31Å; V314-M316 PolarHBondContact O-N 3.41Å; M316-Q318 VanDerWaalsContact C-N 3.3Å; M316-Q318 PolarHBondContact O-N 3.4Å; M316-Y319 WeakPolarHBondContact O-CB 3.41Å; M316-Y319 PolarHBondContact O-N 3.12Å; M316-M320 HydrophobicContact CE-CE 3.42Å; M316-M320 VanDerWaalsContact CE-CE 3.42Å; M316-M320 HydrophobicContact CE-SD 3.83Å; M316-M320 HydrophobicContact CG-CE 4.28Å; M316-M320 WeakPolarHBondContact O-CG 3.09Å; M316-M320 PolarHBondContact O-N 3.03Å
317F85Confident79.1Confident0 Ų040.3 Ų40.30%021%0.209CC..Hα-helixtrans-64.9-36.7178.4-96.6-87.3000112.5I225 L233 I236 L240 L248 L270 T313 V314 Y319 M320 C321 L331I225-F317 HydrophobicContact CG2-CD1 4.38Å; I225-F317 HydrophobicContact CG2-CE1 4.48Å; L233-F317 HydrophobicContact CD1-CD1 3.51Å; L233-F317 HydrophobicContact CD1-CE1 3.71Å; L233-F317 HydrophobicContact CD1-CG 4.44Å; L233-F317 HydrophobicContact CG-CD1 4.2Å; I236-F317 HydrophobicContact CG2-CE1 4.31Å; I236-F317 HydrophobicContact CG2-CE2 4.26Å; I236-F317 HydrophobicContact CG2-CZ 3.71Å; L240-F317 HydrophobicContact CD1-CE2 3.59Å; L240-F317 HydrophobicContact CD1-CZ 3.87Å; L248-F317 HydrophobicContact CD2-CE2 4.2Å; L248-F317 HydrophobicContact CD2-CZ 4.36Å; L270-F317 HydrophobicContact CD2-CB 3.93Å; T313-F317 HydrophobicContact CG2-CD2 4.25Å; T313-F317 PolarHBondContact O-N 3.43Å; V314-F317 PolarHBondContact O-N 3.45Å; F317-Y319 VanDerWaalsContact C-N 3.34Å; F317-M320 HydrophobicContact CB-CE 4.18Å; F317-M320 HydrophobicContact CD1-CE 3.41Å; F317-M320 VanDerWaalsContact CD1-CE 3.41Å; F317-M320 HydrophobicContact CD2-CE 3.67Å; F317-M320 HydrophobicContact CE1-CE 3.57Å; F317-M320 HydrophobicContact CE2-CE 3.8Å; F317-M320 HydrophobicContact CG-CE 3.49Å; F317-M320 VanDerWaalsContact CG-CE 3.49Å; F317-M320 HydrophobicContact CZ-CE 3.76Å; F317-M320 PolarHBondContact O-N 3.36Å; F317-C321 WeakPolarHBondContact O-CB 2.94Å; F317-C321 PolarHBondContact O-N 3.46Å; F317-C321 PolarHBondContact O-SG 3.46Å; F317-L331 HydrophobicContact CE1-CD1 4.19Å; F317-L331 HydrophobicContact CE1-CD2 3.89Å; F317-L331 HydrophobicContact CZ-CD1 3.98Å; F317-L331 HydrophobicContact CZ-CD2 4.37Å
318Q83Confident79.6Confident21 Ų2133.4 Ų33.410%0.09818%0.179CC..Hα-helixtrans-64.6-41.6175.4-163.561.540.500111.3L262 I266 T267 V314 S315 M316 C321 L322L262-Q318 HydrophobicContact CD2-CB 4.07Å; L262-Q318 HydrophobicContact CD2-CG 3.95Å; I266-Q318 HydrophobicContact CG2-CG 3.7Å; I266-Q318 PolarHBondContact O-OE1 2.99Å; T267-Q318 HydrophobicContact CG2-CB 4.37Å; T267-Q318 HydrophobicContact CG2-CG 4.3Å; V314-Q318 VanDerWaalsContact O-CB 3.26Å; V314-Q318 WeakPolarHBondContact O-CB 3.41Å; V314-Q318 PolarHBondContact O-N 2.73Å; S315-Q318 PolarHBondContact O-N 2.95Å; M316-Q318 VanDerWaalsContact C-N 3.3Å; M316-Q318 PolarHBondContact O-N 3.4Å; Q318-C321 PolarHBondContact O-N 2.97Å; Q318-L322 HydrophobicContact CG-CD1 3.95Å; Q318-L322 WeakPolarHBondContact O-CB 3.4Å; Q318-L322 WeakPolarHBondContact O-CG 3.37Å; Q318-L322 PolarHBondContact O-N 3.31Å
319Y80.6Confident79.5Confident17 Ų1729.4 Ų29.47%0.06716%0.161CC..Hα-helixtrans-60.3-46.7173.3-179-97.8000111.6L254 K258 F259 L262 S315 M316 F317 C321 L322 Q323 T325L254-Y319 HydrophobicContact CD2-CD1 3.98Å; L254-Y319 HydrophobicContact CD2-CE1 3.84Å; K258-Y319 HydrophobicContact CB-CD2 4.32Å; K258-Y319 HydrophobicContact CB-CE2 3.89Å; K258-Y319 HydrophobicContact CD-CE2 4Å; K258-Y319 WeakPolarHBondContact CD-OH 3.35Å; F259-Y319 HydrophobicContact CD1-CG 4.27Å; F259-Y319 HydrophobicContact CE1-CD1 4.09Å; F259-Y319 HydrophobicContact CE1-CG 4.27Å; L262-Y319 HydrophobicContact CD1-CD2 4.09Å; S315-Y319 WeakPolarHBondContact O-CB 3.48Å; S315-Y319 PolarHBondContact O-N 2.97Å; M316-Y319 WeakPolarHBondContact O-CB 3.41Å; M316-Y319 PolarHBondContact O-N 3.12Å; F317-Y319 VanDerWaalsContact C-N 3.34Å; Y319-C321 VanDerWaalsContact C-N 3.33Å; Y319-C321 PolarHBondContact O-N 3.23Å; Y319-L322 PolarHBondContact O-N 2.91Å; Y319-Q323 HydrophobicContact CD2-CG 4.02Å; Y319-Q323 HydrophobicContact CE2-CG 3.7Å; Y319-Q323 VanDerWaalsContact CZ-CD 3.4Å; Y319-Q323 WeakPolarHBondContact O-CB 3.37Å; Y319-Q323 PolarHBondContact O-N 3.31Å; Y319-Q323 VanDerWaalsContact OH-CD 3.29Å; Y319-Q323 PolarHBondContact OH-OE1 3.3Å; Y319-T325 HydrophobicContact CE1-CG2 4.5Å
320M81.1Confident79.4Confident0 Ų031.9 Ų31.90%017%0.172CC..Hα-helixtrans-60.7-40.8176.1-69.5-170.2-66.700112.3I225 L252 L254 M316 F317 N324 V326I225-M320 HydrophobicContact CD1-CB 3.79Å; I225-M320 HydrophobicContact CD1-SD 4.15Å; L252-M320 HydrophobicContact CD1-SD 3.68Å; L254-M320 HydrophobicContact CD1-CG 3.65Å; L254-M320 HydrophobicContact CD1-SD 3.67Å; L254-M320 HydrophobicContact CD2-CG 4.39Å; M316-M320 HydrophobicContact CE-CE 3.42Å; M316-M320 VanDerWaalsContact CE-CE 3.42Å; M316-M320 HydrophobicContact CE-SD 3.83Å; M316-M320 HydrophobicContact CG-CE 4.28Å; M316-M320 WeakPolarHBondContact O-CG 3.09Å; M316-M320 PolarHBondContact O-N 3.03Å; F317-M320 HydrophobicContact CB-CE 4.18Å; F317-M320 HydrophobicContact CD1-CE 3.41Å; F317-M320 VanDerWaalsContact CD1-CE 3.41Å; F317-M320 HydrophobicContact CD2-CE 3.67Å; F317-M320 HydrophobicContact CE1-CE 3.57Å; F317-M320 HydrophobicContact CE2-CE 3.8Å; F317-M320 HydrophobicContact CG-CE 3.49Å; F317-M320 VanDerWaalsContact CG-CE 3.49Å; F317-M320 HydrophobicContact CZ-CE 3.76Å; F317-M320 PolarHBondContact O-N 3.36Å; M320-N324 WeakPolarHBondContact O-CA 3.45Å; M320-N324 PolarHBondContact O-N 2.86Å; M320-N324 VanDerWaalsContact O-N 3.08Å; M320-V326 HydrophobicContact CG-CG2 4.2Å; M320-V326 HydrophobicContact SD-CB 4.25Å; M320-V326 HydrophobicContact SD-CG2 4.06Å
321C79.9Confident79.3Confident19 Ų1931.5 Ų31.513%0.12817%0.17CC..Hα-helixtrans-70.1-38.4179.1-68.50000112.9T226 F317 Q318 Y319T226-C321 HydrophobicContact CG2-CB 4.03Å; F317-C321 WeakPolarHBondContact O-CB 2.94Å; F317-C321 PolarHBondContact O-N 3.46Å; F317-C321 PolarHBondContact O-SG 3.46Å; Q318-C321 PolarHBondContact O-N 2.97Å; Y319-C321 VanDerWaalsContact C-N 3.33Å; Y319-C321 PolarHBondContact O-N 3.23Å
322L77Confident79Confident92 Ų9229.4 Ų29.448%0.48216%0.156SC..Hα-helixtrans-76.7-45.3-178.1-82.9161.5000112.6L262 I266 Q318 Y319 N324L262-L322 HydrophobicContact CD2-CD1 3.63Å; I266-L322 HydrophobicContact CD1-CD1 4.43Å; I266-L322 HydrophobicContact CG2-CD1 3.9Å; Q318-L322 HydrophobicContact CG-CD1 3.95Å; Q318-L322 WeakPolarHBondContact O-CB 3.4Å; Q318-L322 WeakPolarHBondContact O-CG 3.37Å; Q318-L322 PolarHBondContact O-N 3.31Å; Y319-L322 PolarHBondContact O-N 2.91Å; L322-N324 VanDerWaalsContact C-N 3.32Å
323Q72.8Confident78.8Confident114 Ų11432.6 Ų32.653%0.53317%0.174SC..Hα-helixtrans-85.8-10-176.9-60.5-140.5-4.200112.8Y319 T325Y319-Q323 HydrophobicContact CD2-CG 4.02Å; Y319-Q323 HydrophobicContact CE2-CG 3.7Å; Y319-Q323 VanDerWaalsContact CZ-CD 3.4Å; Y319-Q323 WeakPolarHBondContact O-CB 3.37Å; Y319-Q323 PolarHBondContact O-N 3.31Å; Y319-Q323 VanDerWaalsContact OH-CD 3.29Å; Y319-Q323 PolarHBondContact OH-OE1 3.3Å; Q323-T325 HydrophobicContact CB-CG2 3.58Å; Q323-T325 PolarHBondContact O-N 2.85Å; Q323-T325 VanDerWaalsContact O-N 3.13Å
324N71.7Confident78.6Confident79 Ų7933 Ų3342%0.42218%0.177SC..  trans48.837.6-176.2-161.743.7000112.3P224 M320 L322 V326P224-N324 WeakPolarHBondContact CA-OD1 3.48Å; P224-N324 WeakPolarHBondContact CB-OD1 3.48Å; M320-N324 WeakPolarHBondContact O-CA 3.45Å; M320-N324 PolarHBondContact O-N 2.86Å; M320-N324 VanDerWaalsContact O-N 3.08Å; L322-N324 VanDerWaalsContact C-N 3.32Å; N324-V326 VanDerWaalsContact C-N 3.3Å
325T68.3Low78.2Confident61 Ų6133 Ų3337%0.37418%0.177SC..  trans-76.1-21.8-175.4450000112.5Y319 Q323Y319-T325 HydrophobicContact CE1-CG2 4.5Å; Q323-T325 HydrophobicContact CB-CG2 3.58Å; Q323-T325 PolarHBondContact O-N 2.85Å; Q323-T325 VanDerWaalsContact O-N 3.13Å
326V73.1Confident77.9Confident5 Ų538.4 Ų38.43%0.0320%0.201CC..SBendtrans-128.4122.2-173.9-177.60000108.7I225 L252 L254 M320 N324 Q330 L331I225-V326 HydrophobicContact CD1-CB 3.9Å; I225-V326 HydrophobicContact CD1-CG1 4.14Å; I225-V326 WeakPolarHBondContact CD1-O 3.46Å; I225-V326 WeakPolarHBondContact CG1-O 3.36Å; L252-V326 HydrophobicContact CB-CG2 4.37Å; L252-V326 HydrophobicContact CD1-CG1 4.22Å; L252-V326 HydrophobicContact CD1-CG2 4.3Å; L252-V326 HydrophobicContact CD2-CG1 3.73Å; L252-V326 HydrophobicContact CD2-CG2 4.19Å; L254-V326 HydrophobicContact CD2-CG2 4.5Å; M320-V326 HydrophobicContact CG-CG2 4.2Å; M320-V326 HydrophobicContact SD-CB 4.25Å; M320-V326 HydrophobicContact SD-CG2 4.06Å; N324-V326 VanDerWaalsContact C-N 3.3Å; V326-Q330 HydrophobicContact CG1-CB 3.73Å; V326-L331 HydrophobicContact CG1-CB 4.19Å
327N79.1Confident77.4Confident52 Ų5245.2 Ų45.228%0.27823%0.23SC..BIsolated β-bridgetrans-78.3155.3174.3-66.1-13.8000110.2G329 Q330 L331N327-G329 PolarHBondContact O-N 3.47Å; N327-G329 VanDerWaalsContact O-N 3.12Å; N327-Q330 WeakPolarHBondContact O-CA 3.41Å; N327-Q330 WeakPolarHBondContact O-CB 3.35Å; N327-Q330 PolarHBondContact O-N 2.83Å; N327-L331 PolarHBondContact O-N 3.4Å
328L76.6Confident77Confident0 Ų046.2 Ų46.20%024%0.236CC..Hα-helixtrans-54.5-35.1-179.6-171.357000113.2F221 Q223 I228 L331 M332 I347 I351F221-L328 PolarHBondContact O-N 3.37Å; Q223-L328 HydrophobicContact CB-CD2 4.17Å; Q223-L328 WeakPolarHBondContact O-CB 3.49Å; Q223-L328 PolarHBondContact O-N 3.44Å; I228-L328 HydrophobicContact CD1-CD1 3.75Å; I228-L328 HydrophobicContact CG1-CD1 4.04Å; L328-L331 PolarHBondContact O-N 2.82Å; L328-M332 WeakPolarHBondContact O-CB 3.44Å; L328-M332 WeakPolarHBondContact O-CG 3.37Å; L328-M332 PolarHBondContact O-N 3.32Å; L328-I347 HydrophobicContact CD1-CG2 3.96Å; L328-I351 HydrophobicContact CD1-CD1 4.01Å; L328-I351 HydrophobicContact CD2-CD1 3.28Å; L328-I351 HydrophobicContact CD2-CG1 3.87Å; L328-I351 HydrophobicContact CG-CD1 3.78Å
329G72.2Confident76.4Confident17 Ų1752 Ų5218%0.17527%0.267CS..Hα-helixtrans-66.5-38.3173.400000114F221 N327 N333F221-G329 PolarHBondContact O-N 3.14Å; N327-G329 PolarHBondContact O-N 3.47Å; N327-G329 VanDerWaalsContact O-N 3.12Å; G329-N333 VanDerWaalsContact O-CB 3.3Å; G329-N333 WeakPolarHBondContact O-CB 3.47Å; G329-N333 PolarHBondContact O-N 2.9Å
330Q78.8Confident75.7Confident97 Ų9752.7 Ų52.745%0.45328%0.275SS..Hα-helixtrans-67.9-43.2175.1-70.2172.3-45.400110.6V326 N327 M332 N333 S334V326-Q330 HydrophobicContact CG1-CB 3.73Å; N327-Q330 WeakPolarHBondContact O-CA 3.41Å; N327-Q330 WeakPolarHBondContact O-CB 3.35Å; N327-Q330 PolarHBondContact O-N 2.83Å; Q330-M332 PolarHBondContact O-N 2.94Å; Q330-N333 PolarHBondContact O-N 3.45Å; Q330-S334 WeakPolarHBondContact O-CB 3.35Å; Q330-S334 PolarHBondContact O-N 2.92Å; Q330-S334 PolarHBondContact O-OG 3.4Å; Q330-S334 VanDerWaalsContact O-OG 3.08Å
331L82.2Confident75.1Confident0 Ų056.4 Ų56.40%030%0.299CS..Hα-helixtrans-59.4-47.4174.8178.464000111.4I225 I228 L248 F317 V326 N327 L328 N333 S334 L335 I347I225-L331 HydrophobicContact CD1-CB 4.47Å; I225-L331 HydrophobicContact CD1-CD2 4.18Å; I225-L331 HydrophobicContact CG1-CD2 4.08Å; I225-L331 HydrophobicContact CG2-CD2 4.23Å; I228-L331 HydrophobicContact CD1-CD2 4.28Å; L248-L331 HydrophobicContact CD2-CD1 4.2Å; F317-L331 HydrophobicContact CE1-CD1 4.19Å; F317-L331 HydrophobicContact CE1-CD2 3.89Å; F317-L331 HydrophobicContact CZ-CD1 3.98Å; F317-L331 HydrophobicContact CZ-CD2 4.37Å; V326-L331 HydrophobicContact CG1-CB 4.19Å; N327-L331 PolarHBondContact O-N 3.4Å; L328-L331 PolarHBondContact O-N 2.82Å; L331-N333 PolarHBondContact O-N 2.98Å; L331-S334 PolarHBondContact O-N 3.38Å; L331-L335 HydrophobicContact CD1-CD1 4.06Å; L331-L335 HydrophobicContact CD1-CG 4.17Å; L331-L335 HydrophobicContact CG-CD1 3.9Å; L331-L335 HydrophobicContact CG-CG 4.41Å; L331-L335 WeakPolarHBondContact O-CB 3.38Å; L331-L335 VanDerWaalsContact O-CG 3.27Å; L331-L335 WeakPolarHBondContact O-CG 3.49Å; L331-L335 PolarHBondContact O-N 3.09Å; L331-I347 HydrophobicContact CD2-CD1 4.49Å
332M76.7Confident74.6Confident7 Ų759.3 Ų59.33%0.03431%0.313CS..Hα-helixtrans-61.6-43.2179.2-77.4-74-78.500112.4L328 Q330 L335 Q336 V344 I347 Q348L328-M332 WeakPolarHBondContact O-CB 3.44Å; L328-M332 WeakPolarHBondContact O-CG 3.37Å; L328-M332 PolarHBondContact O-N 3.32Å; Q330-M332 PolarHBondContact O-N 2.94Å; M332-L335 PolarHBondContact O-N 3.46Å; M332-Q336 WeakPolarHBondContact O-CB 3.25Å; M332-Q336 PolarHBondContact O-N 3.25Å; M332-V344 HydrophobicContact CE-CB 4.24Å; M332-V344 HydrophobicContact CE-CG1 3.32Å; M332-V344 WeakPolarHBondContact CE-O 3.39Å; M332-V344 HydrophobicContact SD-CB 4.29Å; M332-V344 HydrophobicContact SD-CG1 3.93Å; M332-V344 HydrophobicContact SD-CG2 4.5Å; M332-I347 HydrophobicContact CE-CG2 4.38Å; M332-I347 HydrophobicContact CG-CG2 4.07Å; M332-I347 HydrophobicContact SD-CB 3.58Å; M332-I347 VanDerWaalsContact SD-CB 3.58Å; M332-I347 HydrophobicContact SD-CD1 4Å; M332-I347 HydrophobicContact SD-CG1 4.41Å; M332-I347 HydrophobicContact SD-CG2 3.39Å; M332-I347 WeakPolarHBondContact SD-CG2 3.34Å; M332-Q348 HydrophobicContact CE-CB 4.17Å; M332-Q348 HydrophobicContact CE-CG 3.57Å
333N77.2Confident74.5Confident91 Ų9155.1 Ų55.149%0.48729%0.291SS..Hα-helixtrans-66.9-40.5179.1-157.82.6000111.3G329 Q330 L331 Q336 K337G329-N333 VanDerWaalsContact O-CB 3.3Å; G329-N333 WeakPolarHBondContact O-CB 3.47Å; G329-N333 PolarHBondContact O-N 2.9Å; Q330-N333 PolarHBondContact O-N 3.45Å; L331-N333 PolarHBondContact O-N 2.98Å; N333-Q336 PolarHBondContact O-N 2.9Å; N333-K337 WeakPolarHBondContact O-CG 3.25Å; N333-K337 PolarHBondContact O-N 3.27Å
334S79.7Confident74.4Confident11 Ų1150.1 Ų50.18%0.07727%0.268CS..Hα-helixtrans-67.4-40.7175.5-61.10000112.3L252 Q330 L331 Q336 K337 L338L252-S334 VanDerWaalsContact CD2-OG 3.29Å; L252-S334 WeakPolarHBondContact CD2-OG 3.46Å; Q330-S334 WeakPolarHBondContact O-CB 3.35Å; Q330-S334 PolarHBondContact O-N 2.92Å; Q330-S334 PolarHBondContact O-OG 3.4Å; Q330-S334 VanDerWaalsContact O-OG 3.08Å; L331-S334 PolarHBondContact O-N 3.38Å; S334-Q336 VanDerWaalsContact C-N 3.29Å; S334-Q336 PolarHBondContact O-N 2.95Å; S334-K337 PolarHBondContact O-N 3.22Å; S334-L338 WeakPolarHBondContact O-CB 3.48Å; S334-L338 PolarHBondContact O-N 3.18Å
335L78.6Confident74.3Confident0 Ų048.5 Ų48.50%027%0.266CS..Hα-helixtrans-63.9-34.6174.2-73.2172.3000112.6L240 L248 L331 M332 L338 S340 L343 V344 I347L240-L335 HydrophobicContact CD1-CD2 3.92Å; L240-L335 HydrophobicContact CD2-CD2 4.04Å; L240-L335 HydrophobicContact CG-CD2 4.44Å; L248-L335 HydrophobicContact CD1-CD2 4.26Å; L248-L335 HydrophobicContact CD1-CG 4.47Å; L248-L335 HydrophobicContact CD2-CD2 4.15Å; L331-L335 HydrophobicContact CD1-CD1 4.06Å; L331-L335 HydrophobicContact CD1-CG 4.17Å; L331-L335 HydrophobicContact CG-CD1 3.9Å; L331-L335 HydrophobicContact CG-CG 4.41Å; L331-L335 WeakPolarHBondContact O-CB 3.38Å; L331-L335 VanDerWaalsContact O-CG 3.27Å; L331-L335 WeakPolarHBondContact O-CG 3.49Å; L331-L335 PolarHBondContact O-N 3.09Å; M332-L335 PolarHBondContact O-N 3.46Å; L335-L338 PolarHBondContact O-N 3.1Å; L335-S340 PolarHBondContact O-N 3.46Å; L335-L343 HydrophobicContact CD1-CB 4.44Å; L335-L343 HydrophobicContact CD2-CD1 4.13Å; L335-V344 HydrophobicContact CB-CG2 3.69Å; L335-I347 HydrophobicContact CD1-CD1 3.36Å
336Q76.1Confident74.4Confident124 Ų12445.9 Ų45.958%0.57925%0.25SC*.Hα-helixtrans-69.3-39.2175.5-165163.65.800111.6M332 N333 S334 L338 N339 V344M332-Q336 WeakPolarHBondContact O-CB 3.25Å; M332-Q336 PolarHBondContact O-N 3.25Å; N333-Q336 PolarHBondContact O-N 2.9Å; S334-Q336 VanDerWaalsContact C-N 3.29Å; S334-Q336 PolarHBondContact O-N 2.95Å; Q336-L338 VanDerWaalsContact C-N 3.3Å; Q336-L338 PolarHBondContact O-N 3.29Å; Q336-N339 PolarHBondContact O-N 2.73Å; Q336-V344 HydrophobicContact CB-CG2 4.11Å
337K76.7Confident74.4Confident143 Ų14345.7 Ų45.762%0.62225%0.248SC*.Hα-helixtrans-65.6-31.4172.7-73.7178.7-179.3-178.50113.3M251 N333 S334 N339M251-K337 HydrophobicContact CE-CB 3.97Å; M251-K337 HydrophobicContact SD-CB 3.76Å; M251-K337 HydrophobicContact SD-CD 4.29Å; N333-K337 WeakPolarHBondContact O-CG 3.25Å; N333-K337 PolarHBondContact O-N 3.27Å; S334-K337 PolarHBondContact O-N 3.22Å; K337-N339 PolarHBondContact O-N 3.36Å
338L75.4Confident74Confident21 Ų2148.3 Ų48.311%0.1126%0.259CS..THydrogen-bonded Turntrans-73.57.5174.1-101.1141.4000114.3E247 L248 M251 S334 L335 Q336 S340E247-L338 HydrophobicContact CB-CD2 3.85Å; E247-L338 WeakPolarHBondContact OE2-CD2 3.44Å; L248-L338 HydrophobicContact CB-CD1 3.54Å; L248-L338 HydrophobicContact CD1-CD1 3.45Å; L248-L338 VanDerWaalsContact CD1-CD1 3.45Å; L248-L338 HydrophobicContact CG-CD1 4.05Å; M251-L338 HydrophobicContact CE-CG 4.36Å; M251-L338 HydrophobicContact SD-CD1 4.28Å; M251-L338 HydrophobicContact SD-CG 4.48Å; S334-L338 WeakPolarHBondContact O-CB 3.48Å; S334-L338 PolarHBondContact O-N 3.18Å; L335-L338 PolarHBondContact O-N 3.1Å; Q336-L338 VanDerWaalsContact C-N 3.3Å; Q336-L338 PolarHBondContact O-N 3.29Å; L338-S340 PolarHBondContact O-N 3.41Å; L338-S340 VanDerWaalsContact O-N 3.17Å; L338-S340 PolarHBondContact O-OG 3.05Å
339N69.5Low73.6Confident143 Ų14351.8 Ų51.877%0.76528%0.275SS*.THydrogen-bonded Turntrans54.735-179.3-147.128.2000112.7Q336 K337 P341Q336-N339 PolarHBondContact O-N 2.73Å; K337-N339 PolarHBondContact O-N 3.36Å; N339-P341 WeakPolarHBondContact O-CD 3.28Å
340S67.3Low73.4Confident31 Ų3154.1 Ų54.122%0.21728%0.281CS..  trans-109.362.7177-67.50000111L335 L338 D342 L343 V344L335-S340 PolarHBondContact O-N 3.46Å; L338-S340 PolarHBondContact O-N 3.41Å; L338-S340 VanDerWaalsContact O-N 3.17Å; L338-S340 PolarHBondContact O-OG 3.05Å; S340-D342 PolarHBondContact O-N 3.34Å; S340-L343 PolarHBondContact O-N 3.44Å; S340-L343 VanDerWaalsContact O-N 3.1Å; S340-V344 PolarHBondContact O-N 2.94Å
341P68.2Low72.7Confident78 Ų7850.5 Ų50.551%0.50627%0.265SS..Hα-helixtrans-61.5-29.5-176.828.3-35.6000111.8N339 L343 V344 A345N339-P341 WeakPolarHBondContact O-CD 3.28Å; P341-L343 VanDerWaalsContact C-N 3.3Å; P341-L343 PolarHBondContact O-N 3.26Å; P341-V344 PolarHBondContact O-N 3.48Å; P341-A345 WeakPolarHBondContact O-CB 3.28Å; P341-A345 PolarHBondContact O-N 2.98Å
342D69.7Low71.2Confident80 Ų8052.8 Ų52.843%0.42829%0.288SS..Hα-helixtrans-59.9-38.8176.6-64.2-6.8000112.5R239 S340 L346R239-D342 IonicContact CZ-OD2 2.73Å; R239-D342 IonicContact NH2-OD2 3.63Å; R239-D342 PolarHBondContact NH2-OD2 2.91Å; S340-D342 PolarHBondContact O-N 3.34Å; D342-L346 WeakPolarHBondContact O-CB 3.37Å; D342-L346 PolarHBondContact O-N 3.46Å
343L73.7Confident69.7Low4 Ų456.2 Ų56.22%0.02131%0.306CS..Hα-helixtrans-74.7-39.9179.1-66.8178.5000111I236 R239 L240 L335 S340 P341 A345 L346 I347I236-L343 HydrophobicContact CG1-CD2 4.16Å; R239-L343 HydrophobicContact CB-CD1 4.24Å; R239-L343 HydrophobicContact CB-CD2 3.83Å; R239-L343 HydrophobicContact CG-CD2 4.13Å; L240-L343 HydrophobicContact CD1-CD1 4.23Å; L240-L343 HydrophobicContact CD2-CD1 4.41Å; L240-L343 HydrophobicContact CG-CD1 3.93Å; L335-L343 HydrophobicContact CD1-CB 4.44Å; L335-L343 HydrophobicContact CD2-CD1 4.13Å; S340-L343 PolarHBondContact O-N 3.44Å; S340-L343 VanDerWaalsContact O-N 3.1Å; P341-L343 VanDerWaalsContact C-N 3.3Å; P341-L343 PolarHBondContact O-N 3.26Å; L343-A345 VanDerWaalsContact C-N 3.32Å; L343-A345 PolarHBondContact O-N 3.06Å; L343-L346 HydrophobicContact CD2-CD1 4.34Å; L343-L346 WeakPolarHBondContact O-CB 3.5Å; L343-L346 PolarHBondContact O-N 2.88Å; L343-I347 VanDerWaalsContact O-CG1 3.26Å; L343-I347 WeakPolarHBondContact O-CG1 3.41Å; L343-I347 PolarHBondContact O-N 3.33Å
344V70.7Confident67.9Low8 Ų856.7 Ų56.75%0.04831%0.308CS..Hα-helixtrans-59.9-45.8174177.40000109.8M332 L335 Q336 S340 P341 I347 Q348M332-V344 HydrophobicContact CE-CB 4.24Å; M332-V344 HydrophobicContact CE-CG1 3.32Å; M332-V344 WeakPolarHBondContact CE-O 3.39Å; M332-V344 HydrophobicContact SD-CB 4.29Å; M332-V344 HydrophobicContact SD-CG1 3.93Å; M332-V344 HydrophobicContact SD-CG2 4.5Å; L335-V344 HydrophobicContact CB-CG2 3.69Å; Q336-V344 HydrophobicContact CB-CG2 4.11Å; S340-V344 PolarHBondContact O-N 2.94Å; P341-V344 PolarHBondContact O-N 3.48Å; V344-I347 PolarHBondContact O-N 3.3Å; V344-Q348 WeakPolarHBondContact O-CB 3.27Å; V344-Q348 PolarHBondContact O-N 3.03Å
345A70.7Confident65.8Low46 Ų4660.9 Ų60.938%0.3832%0.324SS..Hα-helixtrans-62.7-43.3176.500000112.2P341 L343 I347 Q348 Q349P341-A345 WeakPolarHBondContact O-CB 3.28Å; P341-A345 PolarHBondContact O-N 2.98Å; L343-A345 VanDerWaalsContact C-N 3.32Å; L343-A345 PolarHBondContact O-N 3.06Å; A345-I347 VanDerWaalsContact C-N 3.32Å; A345-I347 PolarHBondContact O-N 2.92Å; A345-Q348 PolarHBondContact O-N 3.37Å; A345-Q349 WeakPolarHBondContact O-CB 3.25Å; A345-Q349 PolarHBondContact O-N 3Å
346L70.7Confident63.7Low6 Ų663.7 Ų63.73%0.03134%0.344CS..Hα-helixtrans-55.7-46.9174.3-103.5161.2000112.3L46 V235 D342 L343 Q350L46-L346 HydrophobicContact CB-CD1 4.25Å; L46-L346 HydrophobicContact CD1-CD1 4.16Å; L46-L346 HydrophobicContact CD1-CD2 3.62Å; L46-L346 HydrophobicContact CD1-CG 3.71Å; V235-L346 HydrophobicContact CG1-CD1 4.31Å; D342-L346 WeakPolarHBondContact O-CB 3.37Å; D342-L346 PolarHBondContact O-N 3.46Å; L343-L346 HydrophobicContact CD2-CD1 4.34Å; L343-L346 WeakPolarHBondContact O-CB 3.5Å; L343-L346 PolarHBondContact O-N 2.88Å; L346-Q350 WeakPolarHBondContact O-CG 3.33Å; L346-Q350 PolarHBondContact O-N 3.29Å
347I72.8Confident61.9Low1 Ų166.2 Ų66.21%0.00535%0.353CS..Hα-helixtrans-69-48.2-179.7-67.5168.2000110I228 I236 L328 L331 M332 L335 L343 V344 A345 Q349 Q350 I351I228-I347 HydrophobicContact CD1-CD1 4.42Å; I228-I347 HydrophobicContact CD1-CG1 4.27Å; I228-I347 HydrophobicContact CD1-CG2 4.26Å; I236-I347 HydrophobicContact CD1-CD1 3.77Å; I236-I347 HydrophobicContact CD1-CG1 3.47Å; I236-I347 VanDerWaalsContact CD1-CG1 3.47Å; I236-I347 HydrophobicContact CG1-CG1 4.4Å; L328-I347 HydrophobicContact CD1-CG2 3.96Å; L331-I347 HydrophobicContact CD2-CD1 4.49Å; M332-I347 HydrophobicContact CE-CG2 4.38Å; M332-I347 HydrophobicContact CG-CG2 4.07Å; M332-I347 HydrophobicContact SD-CB 3.58Å; M332-I347 VanDerWaalsContact SD-CB 3.58Å; M332-I347 HydrophobicContact SD-CD1 4Å; M332-I347 HydrophobicContact SD-CG1 4.41Å; M332-I347 HydrophobicContact SD-CG2 3.39Å; M332-I347 WeakPolarHBondContact SD-CG2 3.34Å; L335-I347 HydrophobicContact CD1-CD1 3.36Å; L343-I347 VanDerWaalsContact O-CG1 3.26Å; L343-I347 WeakPolarHBondContact O-CG1 3.41Å; L343-I347 PolarHBondContact O-N 3.33Å; V344-I347 PolarHBondContact O-N 3.3Å; A345-I347 VanDerWaalsContact C-N 3.32Å; A345-I347 PolarHBondContact O-N 2.92Å; I347-Q349 VanDerWaalsContact C-N 3.29Å; I347-Q349 PolarHBondContact O-N 3.48Å; I347-Q350 PolarHBondContact O-N 3.02Å; I347-I351 HydrophobicContact CG2-CD1 3.31Å; I347-I351 HydrophobicContact CG2-CG1 4.25Å; I347-I351 WeakPolarHBondContact O-CD1 3.44Å; I347-I351 WeakPolarHBondContact O-CG1 3.45Å; I347-I351 PolarHBondContact O-N 2.97Å
348Q70.4Confident59.8Low106 Ų10667.2 Ų67.250%0.49536%0.358SS..Hα-helixtrans-58.9-39.2177.7-111.4164.816.100112.6M332 V344 A345 Q350 G352M332-Q348 HydrophobicContact CE-CB 4.17Å; M332-Q348 HydrophobicContact CE-CG 3.57Å; V344-Q348 WeakPolarHBondContact O-CB 3.27Å; V344-Q348 PolarHBondContact O-N 3.03Å; A345-Q348 PolarHBondContact O-N 3.37Å; Q348-Q350 VanDerWaalsContact C-N 3.35Å; Q348-G352 WeakPolarHBondContact O-CA 3.35Å; Q348-G352 PolarHBondContact O-N 3.13Å
349Q68.8Low57.7Low73 Ų7370.3 Ų70.334%0.34138%0.377SS..Hα-helixtrans-68.8-36-179.7-171.3164.617.700111.9L41 A345 I347 I353L41-Q349 VanDerWaalsContact CD2-CD 3.44Å; A345-Q349 WeakPolarHBondContact O-CB 3.25Å; A345-Q349 PolarHBondContact O-N 3Å; I347-Q349 VanDerWaalsContact C-N 3.29Å; I347-Q349 PolarHBondContact O-N 3.48Å; Q349-I353 VanDerWaalsContact O-CD1 3.29Å; Q349-I353 WeakPolarHBondContact O-CD1 3.27Å; Q349-I353 VanDerWaalsContact O-CG1 3.24Å; Q349-I353 WeakPolarHBondContact O-CG1 3.49Å; Q349-I353 PolarHBondContact O-N 3.32Å
350Q67Low56.1Low66 Ų6668.4 Ų68.431%0.30837%0.366SS..Hα-helixtrans-76.5-37.6177.6-68.7-67.9-3.900112.5I232 L346 I347 Q348I232-Q350 HydrophobicContact CD1-CG 4.19Å; I232-Q350 HydrophobicContact CG1-CG 3.99Å; I232-Q350 HydrophobicContact CG2-CG 4.29Å; L346-Q350 WeakPolarHBondContact O-CG 3.33Å; L346-Q350 PolarHBondContact O-N 3.29Å; I347-Q350 PolarHBondContact O-N 3.02Å; Q348-Q350 VanDerWaalsContact C-N 3.35Å
351I64.3Low54.4Low22 Ų2273 Ų7311%0.11339%0.388CS..Hα-helixtrans-71.7-36.7174.7-58.3157.3000110.8N220 L328 I347 I353 I354N220-I351 HydrophobicContact CB-CG2 4.43Å; L328-I351 HydrophobicContact CD1-CD1 4.01Å; L328-I351 HydrophobicContact CD2-CD1 3.28Å; L328-I351 HydrophobicContact CD2-CG1 3.87Å; L328-I351 HydrophobicContact CG-CD1 3.78Å; I347-I351 HydrophobicContact CG2-CD1 3.31Å; I347-I351 HydrophobicContact CG2-CG1 4.25Å; I347-I351 WeakPolarHBondContact O-CD1 3.44Å; I347-I351 WeakPolarHBondContact O-CG1 3.45Å; I347-I351 PolarHBondContact O-N 2.97Å; I351-I353 PolarHBondContact O-N 3.32Å; I351-I354 PolarHBondContact O-N 3.44Å; I351-I354 VanDerWaalsContact O-N 3.14Å
352G50.8Low52.7Low47 Ų4776 Ų7649%0.48540%0.396SS..Hα-helixtrans-62.8-20.3178.800000113.9Q348Q348-G352 WeakPolarHBondContact O-CA 3.35Å; Q348-G352 PolarHBondContact O-N 3.13Å
353I45.5Very low50.8Low80 Ų8074.4 Ų74.441%0.4139%0.391SS..THydrogen-bonded Turntrans-85.9-11.1178.2-67.8167.4000112.8Q349 I351 K355 S356Q349-I353 VanDerWaalsContact O-CD1 3.29Å; Q349-I353 WeakPolarHBondContact O-CD1 3.27Å; Q349-I353 VanDerWaalsContact O-CG1 3.24Å; Q349-I353 WeakPolarHBondContact O-CG1 3.49Å; Q349-I353 PolarHBondContact O-N 3.32Å; I351-I353 PolarHBondContact O-N 3.32Å; I353-K355 PolarHBondContact O-N 3.23Å; I353-S356 PolarHBondContact O-N 3.32Å; I353-S356 PolarHBondContact O-OG 3.14Å; I353-S356 VanDerWaalsContact O-OG 3.14Å
354I38.8Very low48.9Very low101 Ų10179.6 Ų79.652%0.51842%0.418SS..Hα-helixtrans-72-19173-59.3179000111.5V227 I351V227-I354 HydrophobicContact CG1-CD1 3.96Å; I351-I354 PolarHBondContact O-N 3.44Å; I351-I354 VanDerWaalsContact O-N 3.14Å
355K36.4Very low47.3Very low98 Ų9886.6 Ų86.643%0.42645%0.451SS..Hα-helixtrans-81.7-15.4171.2-73-171.9179.4-179.50114.3S216 I353 T359S216-K355 PolarHBondContact O-NZ 3.47Å; S216-K355 PolarHBondContact OG-NZ 3.38Å; I353-K355 PolarHBondContact O-N 3.23Å; K355-T359 PolarHBondContact O-OG1 3.47Å
356S35.1Very low45.5Very low59 Ų5990.7 Ų90.741%0.41346%0.462SS..Hα-helixtrans-93.9-15177.863.60000114.2I353 I360I353-S356 PolarHBondContact O-N 3.32Å; I353-S356 PolarHBondContact O-OG 3.14Å; I353-S356 VanDerWaalsContact O-OG 3.14Å; S356-I360 WeakPolarHBondContact O-CD1 3.33Å
357K36.8Very low43.6Very low178 Ų17898.7 Ų98.777%0.77449%0.493SS*.Hα-helixtrans-90.7-18.1175.8-104.2176.7178.5173.30115.5
358K33.5Very low41.8Very low164 Ų164106.4 Ų106.471%0.71353%0.526SS*.Hα-helixtrans-92.6-18.3176.1-158.8167.5-178.8177.90113.5
359T30.5Very low40.3Very low86 Ų86105.9 Ų105.953%0.52853%0.531SS..SBendtrans-98.8-3.1-173.5-28.60000114.1K355 S363K355-T359 PolarHBondContact O-OG1 3.47Å; T359-S363 PolarHBondContact O-OG 3.39Å
360I35.5Very low38.7Very low102 Ų102109.1 Ų109.152%0.52354%0.544SS..Hα-helixtrans-88.3-21.4172.7-64.6173.7000111.8S356S356-I360 WeakPolarHBondContact O-CD1 3.33Å
361N32.3Very low37.2Very low129 Ų129110.7 Ų110.769%0.6956%0.557SS**Hα-helixtrans-94.7-3.8176.7-72.9-13.8000114.2
362Q32.2Very low35.9Very low141 Ų141118.2 Ų118.266%0.65959%0.589SS**Hα-helixtrans-105.4-24.6171.4-93.9175.6-20.500113.1
363S31.2Very low35.2Very low46 Ų46120 Ų12032%0.32260%0.595SS.*Hα-helixtrans-74.8-27.1172.359.40000112.8T359 E365 E366 Y367T359-S363 PolarHBondContact O-OG 3.39Å; S363-E365 VanDerWaalsContact C-N 3.35Å; S363-E365 PolarHBondContact O-N 2.78Å; S363-E366 PolarHBondContact O-N 3.25Å; S363-Y367 VanDerWaalsContact O-CD2 3.31Å; S363-Y367 WeakPolarHBondContact O-CD2 3.09Å
364N32.7Very low34.8Very low112 Ų112122.4 Ų122.460%0.59961%0.607SS**Hα-helixtrans-79.5-9.4-179.7-84.2-9.2000115.4
365E36.7Very low34.7Very low156 Ų156126.8 Ų126.873%0.72962%0.622SS**Hα-helixtrans-88.9-27.2170.4-82.5-97.1135.100112.1S363S363-E365 VanDerWaalsContact C-N 3.35Å; S363-E365 PolarHBondContact O-N 2.78Å
366E32.8Very low34.8Very low131 Ų131127 Ų12761%0.61264%0.636SS**Hα-helixtrans-86.6-16-176.9-144.3176.4176.900114.1S363 T369S363-E366 PolarHBondContact O-N 3.25Å; E366-T369 PolarHBondContact O-OG1 2.94Å
367Y31.4Very low34.9Very low174 Ų174133.6 Ų133.668%0.68266%0.658SS**Hα-helixtrans-87.5-8.6172.4-80.2-82.5000114.4S363 T371S363-Y367 VanDerWaalsContact O-CD2 3.31Å; S363-Y367 WeakPolarHBondContact O-CD2 3.09Å; Y367-T371 PolarHBondContact O-OG1 3.04Å
368K36.1Very low34.7Very low163 Ų163133.3 Ų133.371%0.70966%0.659SS**Hα-helixtrans-88.3-18.5174-114.9176.6-177.2172.70113.9
369T37.8Very low34.7Very low96 Ų96132.8 Ų132.859%0.58966%0.664SS**Hα-helixtrans-91.5-23.2177.8440000113.3E366E366-T369 PolarHBondContact O-OG1 2.94Å
370K35.5Very low34.7Very low141 Ų141138.7 Ų138.761%0.61368%0.682SS**Hα-helixtrans-85.1-25.7174.8-83.1178.1178.3170.10115
371T34.3Very low34.6Very low98 Ų98143 Ų14360%0.60170%0.7SS**THydrogen-bonded Turntrans-86-10.6178.3430000114.5Y367Y367-T371 PolarHBondContact O-OG1 3.04Å
372K37.3Very low34.8Very low180 Ų180144.6 Ų144.678%0.78371%0.707SS**THydrogen-bonded Turntrans-88.8-16.3167.2-92.9-178.1176-1790114.4
373S37.7Very low34.8Very low86 Ų86146.2 Ų146.260%0.60172%0.715SS**THydrogen-bonded Turntrans-86.4-25.9178.7-170.10000113.1
374I37.1Very low35.1Very low129 Ų129155 Ų15566%0.66276%0.758SS**SBendtrans-90.8-19.7-175.6-61.3170.5000112.5
375K35.9Very low35.2Very low193 Ų193157.2 Ų157.284%0.83977%0.766SS**THydrogen-bonded Turntrans-90.34177.3-116.7177.5-176.9178.30115.6
376S37.5Very low35.1Very low103 Ų103157.2 Ų157.272%0.7277%0.768SS**THydrogen-bonded Turntrans-107.67.2177.7-167.70000113.9
377K38.2Very low35.2Very low198 Ų198158.7 Ų158.786%0.86178%0.777SS**SBendtrans-119.17.1-178.6-97.8-177.8175.2179.60115.2
378E33.5Very low35.5Very low171 Ų171157.8 Ų157.880%0.79978%0.782SS**SBendtrans-118.425.6-174.7-115.5179.9-17600114.2
379N31.7Very low35.4Very low153 Ų153157.4 Ų157.482%0.81879%0.787SS**SBendtrans-148.659.6177.8-121-4.1000112
380F31.9Very low35.3Very low210 Ų210161.5 Ų161.592%0.92180%0.8SS**SBendtrans-164.853.4161.6-111.4-72.2000111.6
381Q32.4Very low35.3Very low192 Ų192163 Ų16390%0.89781%0.814SS**  trans-152.279.4160.8-80.7-160.9-7.800110.6
382I36.7Very low35.3Very low163 Ų163168 Ų16884%0.83683%0.83SS**  trans-154.191.1147.2-52.9-176.3000102.9
383E32.4Very low35.2Very low175 Ų175167 Ų16782%0.81883%0.834SS**  53.579.884.6-156.3171.5-156.100113.8
384N37Very low34.9Very low231 Ų231174.4 Ų174.4100%1.23586%0.855SS**  177.70118.5-95.6-21.6000111.9

Retrieved 384 of 384 residues in 440.9 ms (Link to these results)