A0A077Z0Z6_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z0Z6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 379 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M42.4Very low43.2Very low248 Ų248188.9 Ų188.9100%1.22290%0.895SS**  0138.10-84.8162.4153.200108.6
2S42.7Very low43.2Very low120 Ų120182.8 Ų182.884%0.83988%0.884SS**PPolyproline II helixtrans-79.3145.7-134.4-51.20000117.7
3P42.6Very low43Very low125 Ų125184.7 Ų184.781%0.81289%0.885SS**PPolyproline II helixtrans-87145.9172.634.3-29.7000112.2K5P3-K5 PolarHBondContact O-N 3.02Å
4L44.9Very low42.6Very low182 Ų182185.7 Ų185.795%0.95389%0.889SS**PPolyproline II helixtrans-55.3117.9179.5-80.3148.1000112.6R6L4-R6 PolarHBondContact O-N 3.47Å
5K45.6Very low42.4Very low204 Ų204176.2 Ų176.289%0.88786%0.859SS**PPolyproline II helixtrans-58.9119174.1-118.9172.6177.31770110.5P3 R7P3-K5 PolarHBondContact O-N 3.02Å; K5-R7 PolarHBondContact O-N 3.43Å
6R42Very low42.1Very low248 Ų248174.6 Ų174.694%0.93686%0.856SS**PPolyproline II helixtrans-55.1119.8163.6-80.3-178.8174.8-176.4-1.1109.2L4 N8L4-R6 PolarHBondContact O-N 3.47Å; R6-N8 PolarHBondContact O-N 3.15Å
7R44.1Very low41.9Very low246 Ų246177.2 Ų177.293%0.92886%0.856SS**  trans-74.5115.3173.5-155.2174.8-172.6179.61.7108.3K5K5-R7 PolarHBondContact O-N 3.43Å
8N38.7Very low41.5Very low145 Ų145173.9 Ų173.978%0.77585%0.854SS**  trans-52.5132.6177.5-127.6-13.9000110.7R6R6-N8 PolarHBondContact O-N 3.15Å
9R44.4Very low41.4Very low239 Ų239169.2 Ų169.290%0.90285%0.845SS**  trans-107.321.8-174.3-133.9-174.9-163.8-175.64.8112.9
10D41.2Very low41.2Very low142 Ų142165.3 Ų165.376%0.75984%0.841SS**  trans-126.255.9-171.5-59.5-38.4000111.9
11Q46.3Very low41Very low179 Ų179163.9 Ų163.984%0.83683%0.834SS**  trans-130.4116.3169.3-134.6169.8600109.1F13Q11-F13 PolarHBondContact O-N 3.16Å
12P43.5Very low40.8Very low116 Ų116161.4 Ų161.475%0.75382%0.816SS**  trans-68.3131.617418-12.3000108.6E14P12-E14 PolarHBondContact O-N 3.19Å
13F41.1Very low40.5Very low207 Ų207166.8 Ų166.891%0.90882%0.818SS**  trans-62.998.7170.5-105.4-99.9000108.7Q11 G15Q11-F13 PolarHBondContact O-N 3.16Å; F13-G15 PolarHBondContact O-N 3.31Å
14E37.4Very low40Very low199 Ų199172.1 Ų172.193%0.9382%0.822SS**  trans-66.9102.1152.8-87.4176.5147.400107.1P12P12-E14 PolarHBondContact O-N 3.19Å
15G39.8Very low39.6Very low43 Ų43172.5 Ų172.544%0.44382%0.816SS.*  trans-147.7113.6174.400000108.5F13 Y17F13-G15 PolarHBondContact O-N 3.31Å; G15-Y17 WeakPolarHBondContact O-CD2 3.49Å; G15-Y17 PolarHBondContact O-N 3.08Å; G15-Y17 VanDerWaalsContact O-N 3.08Å
16D36.3Very low39.5Very low151 Ų151167.8 Ų167.881%0.80781%0.807SS**  trans-40.4105.1177.4-80.3-52.2000113.8
17Y38.8Very low39.3Very low219 Ų219165.3 Ų165.386%0.85981%0.806SS**  trans-131.655.6159.8-69.7-79.5000109.9G15 A19G15-Y17 WeakPolarHBondContact O-CD2 3.49Å; G15-Y17 PolarHBondContact O-N 3.08Å; G15-Y17 VanDerWaalsContact O-N 3.08Å; Y17-A19 PolarHBondContact O-N 3.13Å
18S34.8Very low38.8Very low118 Ų118163.2 Ų163.283%0.82580%0.799SS**  trans-7362.9165-57.10000110.3
19A40.2Very low38.6Very low83 Ų83165.7 Ų165.769%0.68680%0.803SS**  trans-135.356.2167.600000108.9Y17 I21Y17-A19 PolarHBondContact O-N 3.13Å; A19-I21 PolarHBondContact O-N 3.25Å
20A38.1Very low37.9Very low92 Ų92163.4 Ų163.476%0.7680%0.796SS**  trans-61.7103.816700000108.6K22A20-K22 VanDerWaalsContact C-N 3.3Å; A20-K22 PolarHBondContact O-N 3.45Å
21I36.4Very low37.7Very low135 Ų135162 Ų16269%0.69279%0.792SS**  trans-59.898.7163.4-63.4171000105.9A19 W23A19-I21 PolarHBondContact O-N 3.25Å; I21-W23 VanDerWaalsContact C-N 3.29Å; I21-W23 PolarHBondContact O-N 3.23Å
22K36.8Very low37.3Very low196 Ų196157.9 Ų157.985%0.85278%0.782SS**  trans-59.497.4164.5-87.8-178.9175.8176.10106.7A20 R24A20-K22 VanDerWaalsContact C-N 3.3Å; A20-K22 PolarHBondContact O-N 3.45Å; K22-R24 VanDerWaalsContact C-N 3.29Å; K22-R24 PolarHBondContact O-N 3.46Å
23W36.8Very low36.8Very low233 Ų233161.6 Ų161.688%0.88379%0.786SS**  trans-60.298.7163.2-70.789.9000107.1I21 K25I21-W23 VanDerWaalsContact C-N 3.29Å; I21-W23 PolarHBondContact O-N 3.23Å; W23-K25 PolarHBondContact O-N 3.24Å
24R33.2Very low36.6Very low237 Ų237161.4 Ų161.489%0.89479%0.785SS**  trans-61.1117.1174.5-158.6-172.1-86.8-151.9-0.8106.1K22K22-R24 VanDerWaalsContact C-N 3.29Å; K22-R24 PolarHBondContact O-N 3.46Å
25K35.9Very low36.5Very low190 Ų190163.3 Ų163.383%0.82678%0.784SS**  trans-47.7124.9173.6-78.1179.4177177.80108.3W23 E27W23-K25 PolarHBondContact O-N 3.24Å; K25-E27 PolarHBondContact O-N 3.23Å; K25-E27 VanDerWaalsContact O-N 3.12Å
26P44.2Very low36Very low106 Ų106164.2 Ų164.269%0.68879%0.793SS**  trans-71.2107.7166.3-0.516.6000106.2Y28P26-Y28 HydrophobicContact CB-CD2 3.55Å; P26-Y28 HydrophobicContact CB-CE2 4.26Å; P26-Y28 PolarHBondContact O-N 3.1Å
27E37Very low36Very low195 Ų195163.2 Ų163.291%0.91180%0.795SS**  trans-67.268.4157.8-75178.6166.500108.2K25K25-E27 PolarHBondContact O-N 3.23Å; K25-E27 VanDerWaalsContact O-N 3.12Å
28Y34.6Very low35.6Very low202 Ų202165.1 Ų165.179%0.79280%0.8SS**  trans-103102.2166.6-83.6-89.7000107.5P26 Y30P26-Y28 HydrophobicContact CB-CD2 3.55Å; P26-Y28 HydrophobicContact CB-CE2 4.26Å; P26-Y28 PolarHBondContact O-N 3.1Å; Y28-Y30 VanDerWaalsContact C-N 3.32Å; Y28-Y30 PolarHBondContact O-N 2.87Å
29K33.2Very low35.6Very low197 Ų197163 Ų16386%0.85780%0.797SS**  trans-55.697.6163.8-156.6174.8-170.8177.70107.1T31K29-T31 PolarHBondContact O-N 2.83Å
30Y29.8Very low35.2Very low192 Ų192165.7 Ų165.775%0.75381%0.805SS**  trans-61.8104.9175.9-170.9-94.8000108Y28 P32Y28-Y30 VanDerWaalsContact C-N 3.32Å; Y28-Y30 PolarHBondContact O-N 2.87Å; Y30-P32 HydrophobicContact CE1-CB 4.12Å
31T36.4Very low34.9Very low111 Ų111166.9 Ų166.968%0.68180%0.804SS**  trans-96.2112.5166.339.50000106.4K29 F33K29-T31 PolarHBondContact O-N 2.83Å; T31-F33 PolarHBondContact O-N 3.39Å
32P38.8Very low34.8Very low94 Ų94167.5 Ų167.561%0.6182%0.815SS**  trans-63.1128176.625-29.9000107.9Y30 K34Y30-P32 HydrophobicContact CE1-CB 4.12Å; P32-K34 PolarHBondContact O-N 2.93Å
33F33.3Very low34.7Very low193 Ų193162.6 Ų162.685%0.84681%0.811SS**  trans-37.7103.7179.4-70.9-92.1000112.1T31 R35T31-F33 PolarHBondContact O-N 3.39Å; F33-R35 PolarHBondContact O-N 3.15Å; F33-R35 VanDerWaalsContact O-N 3.15Å
34K36.4Very low34.3Very low203 Ų203155.9 Ų155.988%0.88381%0.805SS**  trans-65112.1159-80.2-172.5176.5-177.40106P32 G36P32-K34 PolarHBondContact O-N 2.93Å; K34-G36 PolarHBondContact O-N 2.91Å
35R34.8Very low34.3Very low240 Ų240153.2 Ų153.291%0.90680%0.803SS**  trans-48.4107.8165.4-81.7179.1178.8171.30.1107.8F33F33-R35 PolarHBondContact O-N 3.15Å; F33-R35 VanDerWaalsContact O-N 3.15Å
36G31.1Very low34.1Very low62 Ų62151.4 Ų151.464%0.63980%0.797SS**  trans-60.9137.5169.300000109.2K34K34-G36 PolarHBondContact O-N 2.91Å
37P35.4Very low33.6Very low130 Ų130151.5 Ų151.584%0.84479%0.792SS**  trans-64.5139.5179.43.75.3000110.4G39P37-G39 PolarHBondContact O-N 3.25Å; P37-G39 VanDerWaalsContact O-N 3.1Å
38R29.9Very low33.6Very low259 Ų259149.9 Ų149.998%0.97778%0.784SS**  trans-58.8109.5164-84.2177.2172.4167.5-3.4108.4
39G34.7Very low33.7Very low74 Ų74148.8 Ų148.876%0.76378%0.784SS**  trans-120116.5169.900000109.8P37P37-G39 PolarHBondContact O-N 3.25Å; P37-G39 VanDerWaalsContact O-N 3.1Å
40V32.3Very low33.9Very low138 Ų138146.8 Ų146.884%0.83678%0.783SS**  trans-71.4154.8169.7165.30000108.5
41P32.5Very low34.2Very low117 Ų117142.7 Ų142.776%0.7678%0.782SS**  trans-89.7156.5-147.436.4-33000113.7
42T34.8Very low34.3Very low148 Ų148145.7 Ų145.791%0.90879%0.788SS**  trans-143.4135.5161.3-2.80000109.7
43A34Very low34.1Very low93 Ų93149.8 Ų149.877%0.76980%0.799SS**  trans-80.6161-17300000113.2
44A28Very low34.1Very low92 Ų92144 Ų14476%0.7679%0.794SS**  trans73151.9145.900000120.3
45E33.7Very low34Very low182 Ų182143.6 Ų143.685%0.8580%0.795SS**  trans77.9136.5169.9-67178.7158.300117
46E31.5Very low34Very low151 Ų151138 Ų13871%0.70679%0.792SS**  cis-177.3164.7-15.2-157.2-172.7-172.900104.8
47N33Very low33.9Very low108 Ų108146 Ų14658%0.57881%0.805SS**  trans95103.6151.7-65.1-36000121.7
48E36.9Very low33.9Very low161 Ų161143.5 Ų143.575%0.75280%0.803SS**  76.7105.6119-68.9-171.8158.500119.9
49K38.3Very low34.3Very low179 Ų179140 Ų14078%0.77880%0.8SS**  175.7126.2101.5-96.5167.8-177.2172.10111.7
50N35.4Very low34.3Very low156 Ų156142.1 Ų142.183%0.83480%0.8SS**  trans42.3128.4142.6-58.41.7000118.2
51S37Very low34.6Very low105 Ų105142.6 Ų142.673%0.73480%0.803SS**  -165.8128.154.153.20000113.2
52E38.5Very low34.5Very low174 Ų174140.1 Ų140.181%0.81380%0.8SS**  trans47.7140.3131.2-70.3-179.8146.800124.7
53H35.2Very low34.5Very low181 Ų181140.5 Ų140.584%0.83880%0.796SS**  trans78.6101.1164.9-79.452.7000115.9
54G33.1Very low34.6Very low72 Ų72143.1 Ų143.174%0.74280%0.797SS**  102.8124.668.500000105.9
55E35.1Very low35.1Very low194 Ų194144.1 Ų144.191%0.90779%0.794SS**  cis-159.6136.846.6-72.8168.7152.400110.8
56S33.7Very low35.2Very low121 Ų121142.6 Ų142.685%0.84679%0.787SS**  trans32127137.8-154.10000123
57Y29.2Very low35.3Very low230 Ų230146.1 Ų146.190%0.90279%0.794SS**  trans-59.9148.1159.2-83.3-107.6000113.3
58G36.2Very low35.1Very low78 Ų78144.4 Ų144.480%0.80480%0.801SS**  trans-131.8114.6164.600000111.3
59M36.9Very low35.1Very low186 Ų186143.9 Ų143.992%0.91681%0.809SS**  trans-70.5153.7175.5-150.9110.4155.100111.4
60P35.7Very low35.1Very low119 Ų119142.3 Ų142.377%0.77381%0.809SS**  trans-96.4135.9-177.634.9-26.2000113.1
61T38.1Very low35.2Very low147 Ų147142.9 Ų142.990%0.90280%0.804SS**  trans-156.6131.7165.940.30000104.4
62G31.4Very low35.1Very low66 Ų66144.6 Ų144.668%0.6880%0.804SS**  cis152.1138.21600000105.2
63N33.2Very low34.9Very low156 Ų156140.8 Ų140.883%0.83480%0.796SS**  trans77.4147.9158.8-61.6-7.5000121.8
64D37.2Very low34.7Very low148 Ų148140 Ų14079%0.79179%0.793SS**  trans91.8126.9161-58-19.5000117
65T37.2Very low34.8Very low112 Ų112144.9 Ų144.969%0.68780%0.8SS**  cis-174.2145.6-20.5-11.60000104.5
66E35.8Very low34.7Very low151 Ų151145 Ų14571%0.70679%0.792SS**  trans58.9128.6157.2-61.6-168.8-171.700118.3
67R33.4Very low34.6Very low225 Ų225143.8 Ų143.885%0.84978%0.784SS**  178.9135.750.9-133.4168-145.4-135.81109
68G30.8Very low34.8Very low71 Ų71140.4 Ų140.473%0.73278%0.776SS**  trans75.585.914400000119
69T36.7Very low34.9Very low151 Ų151141.7 Ų141.793%0.92677%0.768SS**  trans-146.3120.813133.30000110.7
70D37.7Very low34.7Very low145 Ų145140.3 Ų140.378%0.77576%0.759SS**  trans-67.8141.8177.7-95.6-38.1000112.7
71K36.7Very low34.6Very low168 Ų168142 Ų14273%0.7376%0.762SS**  trans93.2100.9141.8-69166.7-173.7177.80121.2
72I35.3Very low34.2Very low141 Ų141144.7 Ų144.772%0.72376%0.756SS**  76.890.7122.1-60.3162.9000115.5
73S34.1Very low34.3Very low94 Ų94149.2 Ų149.266%0.65776%0.759SS**  77133.689.992.70000113.5
74H30.5Very low34.1Very low164 Ų164147.2 Ų147.276%0.75975%0.752SS**  cis-155.6128.910.7-105.2-78.9000106.3
75I35.2Very low33.9Very low175 Ų175146.5 Ų146.590%0.89775%0.753SS**  trans-115.3102.5157.1-63.9175.4000105.3S77I75-S77 PolarHBondContact O-N 2.96Å
76R33.1Very low33.7Very low197 Ų197146.3 Ų146.374%0.74376%0.757SS**  trans-80.3110.8178.5-162.1-179-176117.41.9108E78R76-E78 HydrophobicContact CG-CG 4.48Å; R76-E78 IonicContact CZ-OE1 3.35Å; R76-E78 IonicContact NE-OE1 3.27Å; R76-E78 PolarHBondContact NE-OE1 2.91Å; R76-E78 IonicContact NH2-OE1 2.63Å
77S32.6Very low33.4Very low96 Ų96143.3 Ų143.367%0.67177%0.766SS**  trans-78.8119.9162.1152.90000107.8I75I75-S77 PolarHBondContact O-N 2.96Å
78E33.6Very low33.2Very low158 Ų158144 Ų14474%0.73877%0.769SS**  trans-109.4101.8161.4-78.5179.3-177.400107.8R76R76-E78 HydrophobicContact CG-CG 4.48Å; R76-E78 IonicContact CZ-OE1 3.35Å; R76-E78 IonicContact NE-OE1 3.27Å; R76-E78 PolarHBondContact NE-OE1 2.91Å; R76-E78 IonicContact NH2-OE1 2.63Å
79V37.3Very low33.2Very low105 Ų105144 Ų14464%0.63677%0.769SS**  trans-89.6144.5162.6160.80000106.9
80E33.3Very low33.2Very low157 Ų157142.4 Ų142.473%0.73476%0.76SS**  trans66.3110.2165.7-79.4166.7145.200117
81D32.5Very low33.2Very low156 Ų156140.5 Ų140.583%0.83476%0.755SS**  -157.3145.296.5-110.2-30.9000113.8
82R30.4Very low33.4Very low203 Ų203139.6 Ų139.677%0.76676%0.758SS**  trans-62.7134.6179.7-63.3169.5176.9-167.6-1.2109.7
83H33.7Very low33.5Very low160 Ų160136.1 Ų136.174%0.74175%0.746SS**  trans152.6107.1132.6-86.8-76.7000110.9
84T29.4Very low33.8Very low114 Ų114138.6 Ų138.670%0.69975%0.751SS**  trans66.2130.6138.6610000120
85T32.2Very low34.3Very low133 Ų133133.2 Ų133.282%0.81674%0.735SS**  trans94.1113.2154.772.60000118.5
86S32.6Very low34.7Very low109 Ų109126.3 Ų126.376%0.76270%0.704SS**  trans75.786.6138.3-175.10000118.6R88S86-R88 PolarHBondContact O-N 2.81Å
87G29.3Very low35.2Very low87 Ų87119.9 Ų119.990%0.89769%0.694SS**  64.823.1110.300000119.9
88R31.2Very low35.8Very low239 Ų239124 Ų12490%0.90270%0.695SS**  trans-104.694.5175.7-131.3176.2-173.5-1802.6110.9S86 T90S86-R88 PolarHBondContact O-N 2.81Å; R88-T90 PolarHBondContact O-N 3.12Å
89G30.6Very low36.4Very low72 Ų72126 Ų12674%0.74270%0.695SS**  trans-59125.8173.200000111.2
90T35.5Very low36.8Very low118 Ų118126 Ų12672%0.72469%0.692SS**  trans-60.8123.817431.70000110.5R88 N92R88-T90 PolarHBondContact O-N 3.12Å; T90-N92 PolarHBondContact O-N 3.32Å
91P37.4Very low37.4Very low104 Ų104121 Ų12168%0.67567%0.674SS**SBendtrans-8754.1-178.737.4-34.4000110.5
92N41.8Very low37.9Very low149 Ų149120.2 Ų120.280%0.79767%0.665SS**  trans-114.99.1180-71.3-4.2000113.3T90T90-N92 PolarHBondContact O-N 3.32Å
93S37.7Very low38.7Very low69 Ų69116 Ų11648%0.48366%0.662SS.*  trans-89.9130.7174-172.70000110.4A95 A96 A97S93-A95 PolarHBondContact O-N 2.94Å; S93-A95 WeakPolarHBondContact OG-CB 3.49Å; S93-A95 PolarHBondContact OG-N 2.88Å; S93-A96 WeakPolarHBondContact O-CA 3.48Å; S93-A96 VanDerWaalsContact O-CB 3.31Å; S93-A96 WeakPolarHBondContact O-CB 3.45Å; S93-A96 PolarHBondContact O-N 3.17Å; S93-A97 PolarHBondContact O-N 3.29Å
94L40.3Very low39Very low145 Ų145115 Ų11576%0.75966%0.661SS**Hα-helixtrans-49.8-29.3167.3-158.6108.7000111.5A96 A97 W98L94-A96 VanDerWaalsContact C-N 3.35Å; L94-A96 PolarHBondContact O-N 3.3Å; L94-A97 PolarHBondContact O-N 3.35Å; L94-W98 WeakPolarHBondContact O-CB 3.49Å; L94-W98 PolarHBondContact O-N 3.36Å
95A41.7Very low39.4Very low51 Ų51118 Ų11842%0.42167%0.667SS.*Hα-helixtrans-67.7-29.5173.700000113.7S93 R99S93-A95 PolarHBondContact O-N 2.94Å; S93-A95 WeakPolarHBondContact OG-CB 3.49Å; S93-A95 PolarHBondContact OG-N 2.88Å; A95-R99 WeakPolarHBondContact O-CB 3.16Å; A95-R99 WeakPolarHBondContact O-CG 3.18Å; A95-R99 PolarHBondContact O-N 3.14Å; A95-R99 VanDerWaalsContact O-N 3.07Å
96A42.3Very low39.5Very low30 Ų30123.3 Ų123.325%0.24867%0.672CS.*Hα-helixtrans-75.9-37.5172.500000111.4S93 L94 W98 R99 N100S93-A96 WeakPolarHBondContact O-CA 3.48Å; S93-A96 VanDerWaalsContact O-CB 3.31Å; S93-A96 WeakPolarHBondContact O-CB 3.45Å; S93-A96 PolarHBondContact O-N 3.17Å; L94-A96 VanDerWaalsContact C-N 3.35Å; L94-A96 PolarHBondContact O-N 3.3Å; A96-W98 VanDerWaalsContact C-N 3.34Å; A96-R99 PolarHBondContact O-N 3.25Å; A96-N100 WeakPolarHBondContact O-CB 3.42Å; A96-N100 PolarHBondContact O-N 2.88Å; A96-N100 PolarHBondContact O-ND2 2.87Å
97A44.9Very low39.5Very low63 Ų63123.3 Ų123.352%0.52167%0.672SS.*Hα-helixtrans-63.9-40.1172.800000111.7S93 L94 N100 S101S93-A97 PolarHBondContact O-N 3.29Å; L94-A97 PolarHBondContact O-N 3.35Å; A97-N100 PolarHBondContact O-N 2.88Å; A97-S101 PolarHBondContact O-N 3.34Å
98W44.7Very low39.7Very low183 Ų183126.8 Ų126.869%0.69368%0.675SS**Hα-helixtrans-71.4-32177-150.965.2000113L94 A96 N100 S101L94-W98 WeakPolarHBondContact O-CB 3.49Å; L94-W98 PolarHBondContact O-N 3.36Å; A96-W98 VanDerWaalsContact C-N 3.34Å; W98-N100 VanDerWaalsContact C-N 3.32Å; W98-S101 PolarHBondContact O-OG 2.82Å
99R46.2Very low39.9Very low200 Ų200118.4 Ų118.476%0.75566%0.663SS**Hα-helixtrans-68.8-29.6170.4-79.8178.2171.9150-0.5112.9A95 A96A95-R99 WeakPolarHBondContact O-CB 3.16Å; A95-R99 WeakPolarHBondContact O-CG 3.18Å; A95-R99 PolarHBondContact O-N 3.14Å; A95-R99 VanDerWaalsContact O-N 3.07Å; A96-R99 PolarHBondContact O-N 3.25Å
100N44.5Very low39.8Very low104 Ų104122.2 Ų122.256%0.55667%0.667SS**Hα-helixtrans-89-18.1179.2-75.6-22.8000114.5A96 A97 W98 H102 T103A96-N100 WeakPolarHBondContact O-CB 3.42Å; A96-N100 PolarHBondContact O-N 2.88Å; A96-N100 PolarHBondContact O-ND2 2.87Å; A97-N100 PolarHBondContact O-N 2.88Å; W98-N100 VanDerWaalsContact C-N 3.32Å; N100-H102 VanDerWaalsContact C-N 3.29Å; N100-H102 PolarHBondContact O-N 3.45Å; N100-T103 PolarHBondContact O-N 3.04Å; N100-T103 PolarHBondContact O-OG1 2.83Å
101S45.6Very low39.7Very low51 Ų51124.9 Ų124.936%0.35768%0.675SS.*Hα-helixtrans-68.7-29.917860.90000112.3A97 W98 T103 L104A97-S101 PolarHBondContact O-N 3.34Å; W98-S101 PolarHBondContact O-OG 2.82Å; S101-T103 PolarHBondContact O-N 3.41Å; S101-L104 PolarHBondContact O-N 3.47Å
102H43Very low39.4Very low141 Ų141125.7 Ų125.765%0.65368%0.678SS**THydrogen-bonded Turntrans-69.4-11.9178.1-83-75.2000114.5N100N100-H102 VanDerWaalsContact C-N 3.29Å; N100-H102 PolarHBondContact O-N 3.45Å
103T47.7Very low38.9Very low113 Ų113124.8 Ų124.869%0.69368%0.678SS**THydrogen-bonded Turntrans-93-5.4176.437.50000114.6N100 S101N100-T103 PolarHBondContact O-N 3.04Å; N100-T103 PolarHBondContact O-OG1 2.83Å; S101-T103 PolarHBondContact O-N 3.41Å
104L40.1Very low39Very low139 Ų139130.1 Ų130.173%0.72870%0.695SS**SBendtrans-94.81.3-174.3-92.3152.6000115.4S101 R106S101-L104 PolarHBondContact O-N 3.47Å; L104-R106 PolarHBondContact O-N 2.91Å
105H38.1Very low38.9Very low177 Ų177129.3 Ų129.382%0.81970%0.701SS**  trans-94.824-172.4-102.7-82.2000116.3
106R33.7Very low38.3Very low246 Ų246130.2 Ų130.293%0.92872%0.716SS**  trans-130.770.9174.1-71.1-168.9177.8165.2-0.1112.2L104L104-R106 PolarHBondContact O-N 2.91Å
107S33.4Very low37.7Very low108 Ų108139.3 Ų139.376%0.75575%0.75SS**  trans-151.966.5155.970.30000109.6
108V34.4Very low37Very low160 Ų160145.7 Ų145.797%0.9777%0.77SS**  trans-127.891.4160.2-176.40000105
109G34.3Very low36.4Very low63 Ų63141.4 Ų141.465%0.64977%0.768SS**  trans-175.3119.2-179.400000106.2
110D28.4Very low35.4Very low153 Ų153140.3 Ų140.382%0.81877%0.77SS**  trans81.967.3174.7-53.8-21.8000117.9
111I32.7Very low34.7Very low174 Ų174144.6 Ų144.689%0.89279%0.787SS**  trans-138.473136.9-43.2174.5000108.3
112T31.8Very low33.9Very low120 Ų120151.4 Ų151.474%0.73681%0.813SS**  trans-115.6113155.943.90000106.7
113T32.6Very low33.4Very low130 Ų130148.6 Ų148.680%0.79881%0.814SS**  trans155.6143.1140.740.60000109.9
114E37.9Very low32.4Very low182 Ų182149.9 Ų149.985%0.8582%0.822SS**  trans87.8109.6165.6-54-155146.300119.2
115S38.2Very low32.1Very low127 Ų127149 Ų14989%0.88882%0.823SS**  trans73.4130.3151.976.30000115.7
116G30.8Very low31.8Very low71 Ų71149.7 Ų149.773%0.73282%0.823SS**  cis165.8123.28.700000104.2Q118G116-Q118 PolarHBondContact O-N 2.98Å
117F29Very low31.9Very low220 Ų220144 Ų14497%0.96582%0.818SS**  trans-53.3127173-93.1-105.1000110.7
118Q29.1Very low31.8Very low198 Ų198147.6 Ų147.693%0.92582%0.823SS**  trans-154.2130.6144.9-114.5179.524.900111.2G116G116-Q118 PolarHBondContact O-N 2.98Å
119S32.2Very low31.8Very low93 Ų93145.9 Ų145.965%0.6582%0.815SS**  trans-90.5154.6-178.755.70000112
120H25.9Very low31.6Very low176 Ų176147 Ų14782%0.81582%0.818SS**  trans61109.5162.6-59.2-45.7000118.5
121Q30.5Very low31.8Very low195 Ų195148.9 Ų148.991%0.91182%0.822SS**  -166.1134.5122.5-104.7167.622.900111A123Q121-A123 PolarHBondContact O-N 3.07Å
122H28.3Very low31.9Very low193 Ų193148 Ų14889%0.89482%0.817SS**  trans-55.2119.7168.2-97.1-101000110.1
123A32.3Very low31.8Very low82 Ų82146.7 Ų146.768%0.67881%0.813SS**  trans-127104.1163.400000108.6Q121 V125Q121-A123 PolarHBondContact O-N 3.07Å; A123-V125 HydrophobicContact CB-CG2 4.41Å; A123-V125 PolarHBondContact O-N 3.23Å; A123-V125 VanDerWaalsContact O-N 3.17Å
124T27.4Very low31.9Very low140 Ų140147 Ų14786%0.85982%0.817SS**  trans-64105.1167.9-49.20000108.4
125V32.9Very low31.9Very low122 Ų122144 Ų14474%0.73982%0.816SS**  trans-118.7111.9174-177.10000109A123A123-V125 HydrophobicContact CB-CG2 4.41Å; A123-V125 PolarHBondContact O-N 3.23Å; A123-V125 VanDerWaalsContact O-N 3.17Å
126K32.2Very low31.8Very low191 Ų191143.1 Ų143.183%0.8381%0.81SS**  trans-56.5130.3168-108.2172.8171.6175.50109.6Q128K126-Q128 PolarHBondContact O-N 3.16Å
127P36Very low32Very low127 Ų127146.3 Ų146.383%0.82582%0.815SS**  trans-74.4115.5170.627.8-28.3000109.6
128Q31.4Very low32.2Very low182 Ų182145.3 Ų145.385%0.8581%0.81SS**  trans-84.4133.5168.4-159.8177.223.100108K126 A130K126-Q128 PolarHBondContact O-N 3.16Å; Q128-A130 PolarHBondContact O-N 3.45Å
129P33Very low32.6Very low125 Ų125147 Ų14781%0.81281%0.808SS**  trans-76.3110.1-176.928.8-31.3000110.4Q131P129-Q131 PolarHBondContact O-N 2.87Å
130A31.6Very low32.7Very low85 Ų85150 Ų15070%0.70282%0.816SS**  trans-84.3106.6169.600000109.7Q128 I132Q128-A130 PolarHBondContact O-N 3.45Å; A130-I132 PolarHBondContact O-N 3.37Å
131Q31.6Very low33.3Very low193 Ų193147.3 Ų147.390%0.90281%0.814SS**  trans-61.9111.6160.1-79.5177.6-35.300108.6P129P129-Q131 PolarHBondContact O-N 2.87Å
132I34.5Very low33.6Very low157 Ų157145.4 Ų145.481%0.80581%0.809SS**  trans-104.7106.7169.6-60.2175.4000107.8A130A130-I132 PolarHBondContact O-N 3.37Å
133S30.7Very low34Very low91 Ų91141.5 Ų141.564%0.63680%0.804SS**  trans-64.1141.5170.7-540000111.3S135S133-S135 PolarHBondContact O-N 2.87Å
134P33.7Very low34.1Very low137 Ų137144.9 Ų144.989%0.8981%0.81SS**THydrogen-bonded Turntrans-86.789.6-177.934.2-30.9000110.5
135S39.6Very low34.7Very low118 Ų118143.4 Ų143.483%0.82580%0.803SS**THydrogen-bonded Turntrans-155.91.5165.362.30000115.9S133S133-S135 PolarHBondContact O-N 2.87Å
136S35.2Very low35Very low110 Ų110147.1 Ų147.177%0.76981%0.811SS**  trans-120.470.9-178.5170.80000111.8
137V35.2Very low35.3Very low137 Ų137143.1 Ų143.183%0.8380%0.803SS**  trans-111.196.5157.7-176.10000107.5R139V137-R139 PolarHBondContact O-N 3.02Å
138K33.9Very low35.3Very low200 Ų200142.2 Ų142.287%0.8780%0.797SS**  trans-59.1103.2174.4-158.2170.3-175176.50108.1L140K138-L140 PolarHBondContact O-N 2.99Å
139R37.3Very low35.4Very low234 Ų234139.8 Ų139.888%0.88380%0.8SS**  trans-65.7118.3176.1-73.1-175173.2171.2-0.5109.2V137V137-R139 PolarHBondContact O-N 3.02Å
140L34.5Very low35.4Very low156 Ų156136.5 Ų136.582%0.81779%0.789SS**  trans-68.9126.6164.8-92.1114.5000109.3K138 L142K138-L140 PolarHBondContact O-N 2.99Å; L140-L142 PolarHBondContact O-N 2.94Å
141P37.7Very low35.3Very low118 Ų118142.8 Ų142.877%0.76680%0.796SS**  trans-77.1105.2171.229.4-29.5000109.6S143P141-S143 PolarHBondContact O-N 2.77Å; P141-S143 VanDerWaalsContact O-N 3.15Å
142L36.7Very low35.2Very low155 Ų155135.9 Ų135.981%0.81277%0.772SS**  trans-76.990.3163.6-91121000108.8L140 L144L140-L142 PolarHBondContact O-N 2.94Å; L142-L144 PolarHBondContact O-N 3.07Å
143S36.6Very low35.2Very low111 Ų111135.1 Ų135.178%0.77678%0.777SS**  trans-69.5105.5159.2400000108.6P141P141-S143 PolarHBondContact O-N 2.77Å; P141-S143 VanDerWaalsContact O-N 3.15Å
144L35.5Very low35.2Very low154 Ų154138 Ų13881%0.80678%0.778SS**  trans-65.9135.2169.4-80.899.7000109.7L142L142-L144 PolarHBondContact O-N 3.07Å
145P38.7Very low35.3Very low109 Ų109136.7 Ų136.771%0.70877%0.768SS**  trans-69.6133.416427.6-28.2000109.4V147P145-V147 PolarHBondContact O-N 3.11Å; P145-V147 VanDerWaalsContact O-N 3.13Å
146H39.7Very low34.7Very low200 Ų200140.5 Ų140.593%0.92678%0.775SS**  trans-52.9114.1170.5-104.6-49.8000110.2
147V37.6Very low34.4Very low107 Ų107146.1 Ų146.165%0.64878%0.781SS**  trans-106.1133.3164.5-175.30000107.7P145P145-V147 PolarHBondContact O-N 3.11Å; P145-V147 VanDerWaalsContact O-N 3.13Å
148P36.3Very low34.2Very low107 Ų107145.1 Ų145.170%0.69577%0.771SS**  trans-61.3152.9-176.4-16.127.6000112.3G150P148-G150 PolarHBondContact O-N 3.27Å
149S33.2Very low34.2Very low132 Ų132141.4 Ų141.492%0.92377%0.771SS**THydrogen-bonded Turntrans-66.232.1-176.558.40000116.2
150G33.3Very low34.2Very low56 Ų56135 Ų13558%0.57776%0.758SS**THydrogen-bonded Turntrans-96.1-7.6-177.600000115.6P148P148-G150 PolarHBondContact O-N 3.27Å
151Y29.6Very low34.2Very low217 Ų217134.9 Ų134.985%0.85176%0.758SS**  trans-108.577.2-176.1-79.5-88000112
152A30.2Very low34Very low48 Ų48135.7 Ų135.740%0.39776%0.76SS.*  trans-114.1126.1153.400000107.1F154A152-F154 VanDerWaalsContact C-N 3.3Å; A152-F154 HydrophobicContact CB-CD1 4.08Å; A152-F154 HydrophobicContact CB-CD2 4.46Å; A152-F154 HydrophobicContact CB-CE1 3.7Å; A152-F154 HydrophobicContact CB-CE2 4.1Å; A152-F154 HydrophobicContact CB-CG 4.44Å; A152-F154 HydrophobicContact CB-CZ 3.7Å; A152-F154 WeakPolarHBondContact O-CD2 2.96Å; A152-F154 WeakPolarHBondContact O-CE2 2.89Å; A152-F154 PolarHBondContact O-N 2.98Å
153P35Very low33.7Very low140 Ų140133.2 Ų133.291%0.90975%0.753SS**  trans-78.296.1162.411.83.7000106.4
154F30.3Very low33.4Very low151 Ų151134.7 Ų134.766%0.66276%0.762SS**  trans-64.3143.2177.3-51.7-86.5000111.7A152A152-F154 VanDerWaalsContact C-N 3.3Å; A152-F154 HydrophobicContact CB-CD1 4.08Å; A152-F154 HydrophobicContact CB-CD2 4.46Å; A152-F154 HydrophobicContact CB-CE1 3.7Å; A152-F154 HydrophobicContact CB-CE2 4.1Å; A152-F154 HydrophobicContact CB-CG 4.44Å; A152-F154 HydrophobicContact CB-CZ 3.7Å; A152-F154 WeakPolarHBondContact O-CD2 2.96Å; A152-F154 WeakPolarHBondContact O-CE2 2.89Å; A152-F154 PolarHBondContact O-N 2.98Å
155T34.7Very low33.2Very low110 Ų110134.9 Ų134.968%0.67575%0.752SS**SBend48.4118.8126.566.50000119.7Y157T155-Y157 PolarHBondContact O-N 3.37Å
156M27.1Very low33.1Very low199 Ų199135.1 Ų135.198%0.9875%0.754SS**  trans0.2104.6148.7-76176.9164.900115.9
157Y28.5Very low32.9Very low227 Ų227132.3 Ų132.389%0.8974%0.735SS**  trans-94.9134.2173.7-120.2-96.7000112.3T155T155-Y157 PolarHBondContact O-N 3.37Å
158N32.8Very low32.7Very low117 Ų117132.8 Ų132.863%0.62674%0.743SS**  trans-71.7137.4-178.4-168.85.7000111.3T160N158-T160 VanDerWaalsContact C-N 3.34Å; N158-T160 PolarHBondContact O-N 2.95Å; N158-T160 PolarHBondContact OD1-OG1 3.32Å
159S32.6Very low32.8Very low122 Ų122134.1 Ų134.185%0.85375%0.749SS**THydrogen-bonded Turntrans-85.912.4-167.492.80000115.9
160T38.3Very low32.8Very low100 Ų100132.8 Ų132.861%0.61374%0.739SS**THydrogen-bonded Turntrans-100.6-6.5-170.417.30000115.5N158N158-T160 VanDerWaalsContact C-N 3.34Å; N158-T160 PolarHBondContact O-N 2.95Å; N158-T160 PolarHBondContact OD1-OG1 3.32Å
161N33.6Very low32.7Very low153 Ų153134.2 Ų134.282%0.81875%0.754SS**SBendtrans-120108.2179.3-68.6-17000111.6
162V33.7Very low32.9Very low135 Ų135133 Ų13382%0.81875%0.753SS**  trans-62157.9173177.20000110.6
163P31.1Very low33.4Very low103 Ų103136 Ų13667%0.66977%0.769SS**  cis-137.1122.1-46.436.5-16.7000111.9
164C30Very low33.7Very low141 Ų141133 Ų13395%0.95375%0.749SS**  trans-147135.1166-94.20000113.3
165R30.8Very low34.3Very low158 Ų158131.3 Ų131.360%0.59675%0.753SS**  trans-70.6154.2-175-67.5169.7175.1-173.2-2.5112.9W167R165-W167 HydrophobicContact CB-CD2 4.2Å; R165-W167 HydrophobicContact CB-CG 4.2Å; R165-W167 VanDerWaalsContact CD-CD2 3.46Å; R165-W167 VanDerWaalsContact CD-CE2 3.41Å; R165-W167 HydrophobicContact CG-CD2 3.92Å; R165-W167 VanDerWaalsContact CG-CE2 3.44Å; R165-W167 HydrophobicContact CG-CG 4.42Å; R165-W167 HydrophobicContact CG-CH2 4.37Å; R165-W167 HydrophobicContact CG-CZ2 3.64Å; R165-W167 VanDerWaalsContact CZ-CE3 3.45Å
166P36.1Very low34.8Very low115 Ų115134 Ų13475%0.74775%0.751SS**  trans-121.191.2148.133.7-19000109.9
167W35.5Very low35.7Very low140 Ų140129.9 Ų129.953%0.5374%0.74SS.*  trans-118.415170.1-39.9-27.7000112.3R165 T169R165-W167 HydrophobicContact CB-CD2 4.2Å; R165-W167 HydrophobicContact CB-CG 4.2Å; R165-W167 VanDerWaalsContact CD-CD2 3.46Å; R165-W167 VanDerWaalsContact CD-CE2 3.41Å; R165-W167 HydrophobicContact CG-CD2 3.92Å; R165-W167 VanDerWaalsContact CG-CE2 3.44Å; R165-W167 HydrophobicContact CG-CG 4.42Å; R165-W167 HydrophobicContact CG-CH2 4.37Å; R165-W167 HydrophobicContact CG-CZ2 3.64Å; R165-W167 VanDerWaalsContact CZ-CE3 3.45Å; W167-T169 PolarHBondContact O-N 3.02Å
168S33.6Very low36.3Very low117 Ų117125.7 Ų125.782%0.81873%0.731SS**THydrogen-bonded Turntrans-96.220.6-164.766.90000115.9
169T38.9Very low36.6Very low135 Ų135126.9 Ų126.983%0.82874%0.737SS**THydrogen-bonded Turntrans-113.6-5.3-17817.50000116.1W167W167-T169 PolarHBondContact O-N 3.02Å
170C33.7Very low36.9Very low105 Ų105126.1 Ų126.171%0.70973%0.73SS**SBendtrans-128.9109.1170.2-63.90000108.1F172C170-F172 PolarHBondContact O-N 3.3Å
171G29.6Very low36.9Very low86 Ų86129.2 Ų129.289%0.88774%0.741SS**  trans-6746.8-17100000116.7
172F33.9Very low36.7Very low191 Ų191128.2 Ų128.284%0.83875%0.745SS**  trans-106.5110168.2-89.2-86.8000109.6C170C170-F172 PolarHBondContact O-N 3.3Å
173P41.5Very low36.7Very low112 Ų112128.2 Ų128.273%0.72774%0.74SS**  trans-67.4131.9170.127-30.8000109.6
174P41.7Very low36.7Very low76 Ų76129.8 Ų129.849%0.49474%0.743SS.*  trans-73.1144.5176.129.9-33.4000110.9W176P174-W176 VanDerWaalsContact C-N 3.25Å; P174-W176 PolarHBondContact O-N 3.44Å
175P41.6Very low36.8Very low115 Ų115132.3 Ų132.375%0.74774%0.741SS**SBendtrans-81.239.2-166.534.2-38.3000115
176W45.7Very low36.8Very low166 Ų166130 Ų13063%0.62974%0.744SS**SBendtrans-122.2139.4-177.2-3393.4000111.6P174 I178 F338P174-W176 VanDerWaalsContact C-N 3.25Å; P174-W176 PolarHBondContact O-N 3.44Å; W176-I178 PolarHBondContact O-N 2.91Å; W176-F338 HydrophobicContact CH2-CZ 4.45Å; W176-F338 HydrophobicContact CZ2-CZ 4.12Å
177P45.9Very low36.6Very low114 Ų114133.1 Ų133.174%0.7475%0.748SS**  trans-64.1123.4170.426.5-30.5000109D179P177-D179 PolarHBondContact O-N 2.88Å; P177-D179 VanDerWaalsContact O-N 3.17Å
178I41.7Very low36.5Very low139 Ų139131.5 Ų131.571%0.71376%0.759SS**  trans-77.194.1167.8-60.4168.9000105.2W176 P180W176-I178 PolarHBondContact O-N 2.91Å; I178-P180 WeakPolarHBondContact O-CD 3.38Å
179D38.1Very low36.4Very low141 Ų141132.5 Ų132.575%0.75476%0.755SS**  trans-66.4122.5165-78.6-27.1000108.2P177P177-D179 PolarHBondContact O-N 2.88Å; P177-D179 VanDerWaalsContact O-N 3.17Å
180P40.8Very low36.2Very low107 Ų107134 Ų13470%0.69576%0.758SS**  trans-71.7153.2179.228.5-31.8000111.5I178 C182I178-P180 WeakPolarHBondContact O-CD 3.38Å; P180-C182 PolarHBondContact O-N 3.08Å
181L36.5Very low36Very low164 Ų164135.8 Ų135.886%0.85977%0.765SS**  trans-45.3120.4177-85.371.6000112.4N183L181-N183 PolarHBondContact O-N 3.13Å; L181-N183 VanDerWaalsContact O-N 3.11Å
182C29.6Very low36.5Very low133 Ų133136.1 Ų136.190%0.89976%0.76SS**  trans-68.5102162.5-70.70000110P180P180-C182 PolarHBondContact O-N 3.08Å
183N34.4Very low36.5Very low134 Ų134136.8 Ų136.872%0.71776%0.762SS**  trans-77.9126.7154.2-94-15.4000108.9L181L181-N183 PolarHBondContact O-N 3.13Å; L181-N183 VanDerWaalsContact O-N 3.11Å
184N31.1Very low36Very low136 Ų136137.8 Ų137.873%0.72777%0.766SS**  trans47.3103.2143.1-51.9-26.6000119
185H31Very low35.8Very low194 Ų194143.9 Ų143.990%0.89879%0.785SS**  -159.9118.2125.2-121.5-77.5000112.5
186V31.9Very low35.3Very low110 Ų110143.8 Ų143.867%0.66778%0.784SS**  trans-57.5140.7157.9171.50000107.4
187E32.1Very low34.7Very low180 Ų180140 Ų14084%0.84179%0.789SS**  176.9171.467.4-145.3151.1-141.900110.8
188S32.9Very low34.1Very low107 Ų107139.9 Ų139.975%0.74879%0.786SS**  trans103.484.6159.1-171.30000119.2
189N30.8Very low33.6Very low137 Ų137142.6 Ų142.673%0.73380%0.796SS**  32.1118.2124.1-76.5-20.4000119.5
190N35.1Very low33.5Very low168 Ų168145 Ų14590%0.89880%0.799SS**  trans-151105.5130.2-90.9-38.1000110.4A192N190-A192 PolarHBondContact O-N 3.02Å
191V30.9Very low33.2Very low141 Ų141143.8 Ų143.886%0.85580%0.798SS**  trans-68.9114.6166.3170.50000108.1
192A39.2Very low33.3Very low94 Ų94142.3 Ų142.378%0.77780%0.798SS**  trans-14694.4166.300000111.5N190N190-A192 PolarHBondContact O-N 3.02Å
193K34.4Very low33.7Very low204 Ų204144.9 Ų144.989%0.88780%0.797SS**  trans61.5103.6135.7-131.9167.9-174.2174.40118.8
194V31.3Very low33.9Very low134 Ų134146.3 Ų146.381%0.81280%0.799SS**  trans-49.9132.4157.8174.20000111.8
195K36Very low34.4Very low203 Ų203144.1 Ų144.188%0.88379%0.792SS**  trans-138.1114.6151.3-153.5178.6-171.5-1770107.6
196P32.7Very low34.7Very low113 Ų113138.6 Ų138.673%0.73478%0.776SS**  trans-90.5117.4178.432.9-23.9000108.3
197A32.2Very low35.1Very low88 Ų88139.6 Ų139.673%0.72778%0.782SS**  trans-173.5138.5161.700000111.9
198T34.2Very low35.7Very low111 Ų111139.9 Ų139.968%0.68178%0.78SS**  trans89.788154.2-35.60000116.3K200T198-K200 PolarHBondContact O-N 3.4Å
199E30.7Very low36.3Very low196 Ų196136.5 Ų136.592%0.91676%0.755SS**  trans-16.697.8136.5-170.9176.4-173.500112.1
200K35.2Very low37.1Very low192 Ų192137.1 Ų137.184%0.83575%0.751SS**  trans-102.2121.8171.6-79.5-168.5177.5-174.10108.9T198T198-K200 PolarHBondContact O-N 3.4Å
201A35.6Very low38.1Very low80 Ų80133.3 Ų133.366%0.66174%0.738SS**  trans-34.6149.2165.500000112.9E203A201-E203 PolarHBondContact O-N 3.04Å
202P37.1Very low39.6Very low133 Ų133127.8 Ų127.886%0.86470%0.702SS**  trans-52.5119.2-172.522.9-33.5000109.8E204P202-E204 PolarHBondContact O-N 3.29Å
203E39.7Very low41Very low187 Ų187124.6 Ų124.687%0.87467%0.67SS**  trans-47.3128.5178.2-77.9-170.213800110.1A201A201-E203 PolarHBondContact O-N 3.04Å
204E37.8Very low43Very low165 Ų165121.9 Ų121.977%0.77166%0.658SS**  trans-42.9134.8162.1-81.3-169.3121.400109P202 S206P202-E204 PolarHBondContact O-N 3.29Å; E204-S206 PolarHBondContact O-N 2.9Å
205P42.5Very low45.2Very low89 Ų89117.9 Ų117.958%0.57864%0.635SS**  trans-60.1118.3179.928.8-35.6000107.7T209P205-T209 HydrophobicContact CB-CG2 4.07Å; P205-T209 WeakPolarHBondContact CB-OG1 3.28Å; P205-T209 PolarHBondContact O-OG1 3.31Å
206S37.4Very low47.1Very low79 Ų79108.3 Ų108.355%0.55259%0.594SS**  trans-38.4141.3-178.461.80000111.6E204 K208 T209E204-S206 PolarHBondContact O-N 2.9Å; S206-K208 PolarHBondContact O-N 2.98Å; S206-T209 PolarHBondContact O-N 2.88Å; S206-T209 PolarHBondContact O-OG1 2.96Å
207V39.8Very low49.5Very low130 Ų130105.8 Ų105.879%0.78857%0.573SS**THydrogen-bonded Turntrans-44.4-19.7-175.2179.60000114.4T209V207-T209 PolarHBondContact O-N 2.95Å
208K44.5Very low52Low187 Ų187107.9 Ų107.981%0.81357%0.569SS**THydrogen-bonded Turntrans-68.5-21.8173.1-64.5-176.1178.3-1790115.1S206S206-K208 PolarHBondContact O-N 2.98Å
209T45.7Very low54.4Low36 Ų36104 Ų10422%0.22154%0.544CS..SBendtrans-80.5-26.8-179.254.20000113.9P205 S206 V207 S211 F212 W213P205-T209 HydrophobicContact CB-CG2 4.07Å; P205-T209 WeakPolarHBondContact CB-OG1 3.28Å; P205-T209 PolarHBondContact O-OG1 3.31Å; S206-T209 PolarHBondContact O-N 2.88Å; S206-T209 PolarHBondContact O-OG1 2.96Å; V207-T209 PolarHBondContact O-N 2.95Å; T209-S211 PolarHBondContact O-N 3.46Å; T209-F212 WeakPolarHBondContact O-CB 3.36Å; T209-F212 PolarHBondContact O-N 3.43Å; T209-W213 VanDerWaalsContact O-CD1 3.27Å
210K46.7Very low56.9Low150 Ų15094.8 Ų94.865%0.65250%0.501SS*.Hα-helixtrans-66-27.3179.1-70.1-177.9-178.1174.10112.7F212K210-F212 VanDerWaalsContact C-N 3.35Å
211S56.8Low59.4Low88 Ų8888.9 Ų88.962%0.61548%0.481SS*.Hα-helixtrans-70.7-29.9176.7-165.80000112.7T209 W213 K214 P215T209-S211 PolarHBondContact O-N 3.46Å; S211-W213 PolarHBondContact O-N 2.78Å; S211-K214 PolarHBondContact O-N 3.27Å; S211-P215 WeakPolarHBondContact O-CD 3.5Å
212F62.7Low62Low25 Ų2589 Ų8911%0.1147%0.47CS..Hα-helixtrans-67.1-38-174.1175.6-103.3000113.4T209 K210 K214 P215 L216 M275 Y335 V339T209-F212 WeakPolarHBondContact O-CB 3.36Å; T209-F212 PolarHBondContact O-N 3.43Å; K210-F212 VanDerWaalsContact C-N 3.35Å; F212-K214 VanDerWaalsContact C-N 3.35Å; F212-K214 PolarHBondContact O-N 2.83Å; F212-P215 WeakPolarHBondContact O-CD 3.44Å; F212-P215 WeakPolarHBondContact O-CG 3.44Å; F212-L216 HydrophobicContact CE1-CD2 4.46Å; F212-M275 HydrophobicContact CE1-CE 3.84Å; F212-Y335 HydrophobicContact CD2-CD1 4.19Å; F212-Y335 AromaticContact CD2-CE1 3.27Å; F212-Y335 HydrophobicContact CD2-CE1 3.27Å; F212-Y335 HydrophobicContact CD2-CE2 4.49Å; F212-Y335 AromaticContact CD2-CZ 3.45Å; F212-Y335 VanDerWaalsContact CD2-CZ 3.45Å; F212-Y335 VanDerWaalsContact CD2-OH 3.26Å; F212-Y335 WeakPolarHBondContact CD2-OH 3.36Å; F212-Y335 AromaticContact CE2-CD1 3.41Å; F212-Y335 HydrophobicContact CE2-CD1 3.41Å; F212-Y335 VanDerWaalsContact CE2-CD1 3.41Å; F212-Y335 AromaticContact CE2-CE1 2.95Å; F212-Y335 HydrophobicContact CE2-CE1 2.95Å; F212-Y335 HydrophobicContact CE2-CE2 4.36Å; F212-Y335 HydrophobicContact CE2-CG 4.29Å; F212-Y335 AromaticContact CE2-CZ 3.5Å; F212-Y335 VanDerWaalsContact CE2-CZ 3.5Å; F212-Y335 HydrophobicContact CG-CE1 4.24Å; F212-Y335 AromaticContact CZ-CD1 3.93Å; F212-Y335 HydrophobicContact CZ-CD1 3.93Å; F212-Y335 AromaticContact CZ-CE1 3.75Å; F212-Y335 HydrophobicContact CZ-CE1 3.75Å; F212-V339 HydrophobicContact CD2-CB 4.33Å; F212-V339 HydrophobicContact CD2-CG1 4.3Å; F212-V339 HydrophobicContact CD2-CG2 3.55Å; F212-V339 HydrophobicContact CE1-CG1 4.42Å; F212-V339 HydrophobicContact CE2-CB 3.63Å; F212-V339 HydrophobicContact CE2-CG1 3.91Å; F212-V339 HydrophobicContact CE2-CG2 3.11Å; F212-V339 HydrophobicContact CZ-CB 3.91Å; F212-V339 HydrophobicContact CZ-CG1 3.96Å; F212-V339 HydrophobicContact CZ-CG2 3.92Å
213W69Low64.5Low27 Ų2782.8 Ų82.810%0.10243%0.43CS..Hα-helixtrans-74.4-25.3-175.6-66.2101.8000113.3T209 S211 L216 M217 T267 W272 M275T209-W213 VanDerWaalsContact O-CD1 3.27Å; S211-W213 PolarHBondContact O-N 2.78Å; W213-L216 HydrophobicContact CE3-CD2 4.15Å; W213-L216 HydrophobicContact CZ3-CD2 4.41Å; W213-M217 WeakPolarHBondContact O-CB 3.3Å; W213-M217 PolarHBondContact O-N 3.43Å; W213-T267 HydrophobicContact CB-CG2 3.92Å; W213-T267 HydrophobicContact CD2-CG2 4.04Å; W213-T267 HydrophobicContact CE3-CG2 3.36Å; W213-T267 HydrophobicContact CG-CG2 4.33Å; W213-T267 VanDerWaalsContact CZ3-CA 3.48Å; W213-T267 HydrophobicContact CZ3-CG2 4.1Å; W213-W272 HydrophobicContact CZ2-CH2 4.3Å; W213-W272 HydrophobicContact CZ2-CZ2 4.35Å; W213-M275 HydrophobicContact CE3-CE 4.05Å; W213-M275 HydrophobicContact CH2-CE 3.69Å; W213-M275 HydrophobicContact CH2-CG 4.32Å; W213-M275 HydrophobicContact CH2-SD 3.24Å; W213-M275 WeakPolarHBondContact CH2-SD 3.48Å; W213-M275 HydrophobicContact CZ2-SD 4.16Å; W213-M275 HydrophobicContact CZ3-CE 3.38Å; W213-M275 HydrophobicContact CZ3-CG 4.32Å; W213-M275 HydrophobicContact CZ3-SD 3.52Å; W213-M275 VanDerWaalsContact CZ3-SD 3.52Å
214K75.4Confident66.9Low146 Ų14675.8 Ų75.864%0.63540%0.4SS*.Hα-helixtrans-65.6-51.7-176.2-160174.5-176-179.10113.6S211 F212 L216 M217 M218S211-K214 PolarHBondContact O-N 3.27Å; F212-K214 VanDerWaalsContact C-N 3.35Å; F212-K214 PolarHBondContact O-N 2.83Å; K214-L216 VanDerWaalsContact C-N 3.33Å; K214-M217 PolarHBondContact O-N 3.05Å; K214-M218 PolarHBondContact O-N 3.36Å; K214-M218 VanDerWaalsContact O-N 3.09Å
215P76.5Confident69.4Low50 Ų5072.1 Ų72.133%0.32539%0.388SS..Hα-helixtrans-66.1-37.9176.126.4-33.9000111.5S211 F212 M217 M218 I219 Y335S211-P215 WeakPolarHBondContact O-CD 3.5Å; F212-P215 WeakPolarHBondContact O-CD 3.44Å; F212-P215 WeakPolarHBondContact O-CG 3.44Å; P215-M217 VanDerWaalsContact C-N 3.34Å; P215-M217 PolarHBondContact O-N 2.97Å; P215-M218 PolarHBondContact O-N 3.3Å; P215-I219 WeakPolarHBondContact O-CG1 3.48Å; P215-I219 PolarHBondContact O-N 2.99Å; P215-Y335 HydrophobicContact CG-CE1 4.1Å; P215-Y335 WeakPolarHBondContact CG-OH 3.47Å
216L77.6Confident71.7Confident3 Ų369 Ų692%0.01637%0.366CS..Hα-helixtrans-63.3-41.4177.9-174.873.1000111.9F212 W213 K214 I219 A220 M275 Y279F212-L216 HydrophobicContact CE1-CD2 4.46Å; W213-L216 HydrophobicContact CE3-CD2 4.15Å; W213-L216 HydrophobicContact CZ3-CD2 4.41Å; K214-L216 VanDerWaalsContact C-N 3.33Å; L216-I219 PolarHBondContact O-N 3.43Å; L216-A220 WeakPolarHBondContact O-CB 3.39Å; L216-A220 PolarHBondContact O-N 3.27Å; L216-M275 HydrophobicContact CD2-CE 3.43Å; L216-M275 VanDerWaalsContact CD2-CE 3.43Å; L216-Y279 HydrophobicContact CD1-CE1 4.4Å; L216-Y279 WeakPolarHBondContact CD1-OH 3.26Å; L216-Y279 WeakPolarHBondContact CD2-OH 3.37Å
217M82Confident74.2Confident59 Ų5965.2 Ų65.229%0.29134%0.34SS..Hα-helixtrans-64.6-40.1175.4-173.5176.1179.500111.4W213 K214 P215 A220 V221 T267W213-M217 WeakPolarHBondContact O-CB 3.3Å; W213-M217 PolarHBondContact O-N 3.43Å; K214-M217 PolarHBondContact O-N 3.05Å; P215-M217 VanDerWaalsContact C-N 3.34Å; P215-M217 PolarHBondContact O-N 2.97Å; M217-A220 PolarHBondContact O-N 3.49Å; M217-V221 WeakPolarHBondContact O-CB 3.4Å; M217-V221 WeakPolarHBondContact O-CG2 3.45Å; M217-V221 PolarHBondContact O-N 3.17Å; M217-T267 HydrophobicContact CB-CG2 4.13Å
218M84.7Confident76.6Confident132 Ų13263 Ų6365%0.6532%0.322SS*.Hα-helixtrans-64-43.2175.5-74.1-158.2173.400112.1K214 P215 V221 L222K214-M218 PolarHBondContact O-N 3.36Å; K214-M218 VanDerWaalsContact O-N 3.09Å; P215-M218 PolarHBondContact O-N 3.3Å; M218-V221 PolarHBondContact O-N 3.26Å; M218-L222 WeakPolarHBondContact O-CB 3.48Å; M218-L222 PolarHBondContact O-N 3.25Å
219I84.9Confident78.7Confident30 Ų3055.4 Ų55.415%0.15429%0.294CS..Hα-helixtrans-63.4-47.2176.4-64.9163.7000110.1P215 L216 V221 L222 Q223 L328 I331P215-I219 WeakPolarHBondContact O-CG1 3.48Å; P215-I219 PolarHBondContact O-N 2.99Å; L216-I219 PolarHBondContact O-N 3.43Å; I219-V221 VanDerWaalsContact C-N 3.33Å; I219-V221 PolarHBondContact O-N 3.21Å; I219-L222 WeakPolarHBondContact O-CB 3.4Å; I219-L222 PolarHBondContact O-N 2.98Å; I219-L222 VanDerWaalsContact O-N 3.11Å; I219-Q223 HydrophobicContact CG2-CG 4.32Å; I219-Q223 WeakPolarHBondContact O-CG 3.36Å; I219-Q223 PolarHBondContact O-N 3.33Å; I219-L328 HydrophobicContact CG2-CB 4.48Å; I219-I331 HydrophobicContact CD1-CG2 4.31Å
220A84.2Confident80.7Confident2 Ų253.7 Ų53.72%0.01728%0.284CS..Hα-helixtrans-61-41.6179.100000111.9L216 M217 Q223 V224 I263 V264L216-A220 WeakPolarHBondContact O-CB 3.39Å; L216-A220 PolarHBondContact O-N 3.27Å; M217-A220 PolarHBondContact O-N 3.49Å; A220-Q223 PolarHBondContact O-N 3.37Å; A220-V224 WeakPolarHBondContact O-CG2 3.3Å; A220-V224 PolarHBondContact O-N 2.98Å; A220-I263 HydrophobicContact CB-CG2 4.08Å; A220-V264 HydrophobicContact CB-CG2 3.76Å
221V87.9Confident82.7Confident69 Ų6948 Ų4842%0.41826%0.26SS..Hα-helixtrans-62.9-42.3174.3170.70000111.1M217 M218 I219 Q223 V224 V225 V264M217-V221 WeakPolarHBondContact O-CB 3.4Å; M217-V221 WeakPolarHBondContact O-CG2 3.45Å; M217-V221 PolarHBondContact O-N 3.17Å; M218-V221 PolarHBondContact O-N 3.26Å; I219-V221 VanDerWaalsContact C-N 3.33Å; I219-V221 PolarHBondContact O-N 3.21Å; V221-Q223 VanDerWaalsContact C-N 3.33Å; V221-Q223 PolarHBondContact O-N 2.77Å; V221-V224 WeakPolarHBondContact O-CB 3.18Å; V221-V224 PolarHBondContact O-N 3.04Å; V221-V225 WeakPolarHBondContact O-CG2 3.34Å; V221-V225 PolarHBondContact O-N 3.44Å; V221-V264 HydrophobicContact CG2-CG2 4.39Å
222L89.4Confident84.3Confident83 Ų8348 Ų4844%0.43525%0.252SS..Hα-helixtrans-62-42.3175.8-170.364.5000111.1M218 I219 V224 V225 L226 L328M218-L222 WeakPolarHBondContact O-CB 3.48Å; M218-L222 PolarHBondContact O-N 3.25Å; I219-L222 WeakPolarHBondContact O-CB 3.4Å; I219-L222 PolarHBondContact O-N 2.98Å; I219-L222 VanDerWaalsContact O-N 3.11Å; L222-V224 VanDerWaalsContact C-N 3.33Å; L222-V224 PolarHBondContact O-N 3.31Å; L222-V225 WeakPolarHBondContact O-CB 3.46Å; L222-V225 PolarHBondContact O-N 3.04Å; L222-V225 VanDerWaalsContact O-N 3.12Å; L222-L226 HydrophobicContact CD1-CD1 4.13Å; L222-L226 HydrophobicContact CG-CD1 3.93Å; L222-L226 WeakPolarHBondContact O-CD1 3.46Å; L222-L226 PolarHBondContact O-N 3.23Å; L222-L328 HydrophobicContact CD2-CD1 3.66Å; L222-L328 HydrophobicContact CD2-CD2 4.02Å; L222-L328 HydrophobicContact CG-CD1 3.92Å
223Q89Confident85.3Confident2 Ų247.3 Ų47.31%0.00925%0.25CS..Hα-helixtrans-64.7-33.8175.2-67.4-170.7-72.400112.7I219 A220 V221 L226 G227 Q260 D325 L328I219-Q223 HydrophobicContact CG2-CG 4.32Å; I219-Q223 WeakPolarHBondContact O-CG 3.36Å; I219-Q223 PolarHBondContact O-N 3.33Å; A220-Q223 PolarHBondContact O-N 3.37Å; V221-Q223 VanDerWaalsContact C-N 3.33Å; V221-Q223 PolarHBondContact O-N 2.77Å; Q223-L226 PolarHBondContact O-N 3.49Å; Q223-G227 PolarHBondContact O-N 3.07Å; Q223-Q260 HydrophobicContact CB-CG 3.72Å; Q223-Q260 VanDerWaalsContact OE1-CD 3.29Å; Q223-D325 PolarHBondContact NE2-OD1 2.9Å; Q223-D325 VanDerWaalsContact NE2-OD1 3.16Å; Q223-L328 HydrophobicContact CG-CB 3.93Å; Q223-L328 HydrophobicContact CG-CD1 4.19Å
224V89.5Confident86.1Confident40 Ų4046 Ų4624%0.24225%0.246CC..Hα-helixtrans-62.1-44.9170.3173.10000110.6A220 V221 L222 L226 G227 M228 Q260A220-V224 WeakPolarHBondContact O-CG2 3.3Å; A220-V224 PolarHBondContact O-N 2.98Å; V221-V224 WeakPolarHBondContact O-CB 3.18Å; V221-V224 PolarHBondContact O-N 3.04Å; L222-V224 VanDerWaalsContact C-N 3.33Å; L222-V224 PolarHBondContact O-N 3.31Å; V224-L226 VanDerWaalsContact C-N 3.34Å; V224-L226 PolarHBondContact O-N 3.29Å; V224-G227 PolarHBondContact O-N 3.13Å; V224-M228 WeakPolarHBondContact O-CG 3.34Å; V224-M228 PolarHBondContact O-N 2.9Å; V224-Q260 HydrophobicContact CG2-CB 3.5Å
225V92.1Very high86.5Confident88 Ų8842.6 Ų42.653%0.53323%0.233SC..Hα-helixtrans-63-41.3178176.70000111V221 L222 M228 A229V221-V225 WeakPolarHBondContact O-CG2 3.34Å; V221-V225 PolarHBondContact O-N 3.44Å; L222-V225 WeakPolarHBondContact O-CB 3.46Å; L222-V225 PolarHBondContact O-N 3.04Å; L222-V225 VanDerWaalsContact O-N 3.12Å; V225-M228 PolarHBondContact O-N 3.46Å; V225-A229 PolarHBondContact O-N 2.92Å
226L90.1Very high86.8Confident22 Ų2243.6 Ų43.612%0.11524%0.235CC..Hα-helixtrans-64.4-43.2173.8-89.377.7000111.8L222 Q223 V224 M228 A229 I230 C324 D325 L328L222-L226 HydrophobicContact CD1-CD1 4.13Å; L222-L226 HydrophobicContact CG-CD1 3.93Å; L222-L226 WeakPolarHBondContact O-CD1 3.46Å; L222-L226 PolarHBondContact O-N 3.23Å; Q223-L226 PolarHBondContact O-N 3.49Å; V224-L226 VanDerWaalsContact C-N 3.34Å; V224-L226 PolarHBondContact O-N 3.29Å; L226-M228 VanDerWaalsContact C-N 3.28Å; L226-M228 PolarHBondContact O-N 3.41Å; L226-A229 WeakPolarHBondContact O-CB 3.32Å; L226-A229 PolarHBondContact O-N 2.85Å; L226-I230 WeakPolarHBondContact O-CG1 3.34Å; L226-I230 PolarHBondContact O-N 3.45Å; L226-C324 HydrophobicContact CD2-CB 3.71Å; L226-D325 HydrophobicContact CD2-CB 3.98Å; L226-L328 HydrophobicContact CD1-CD1 4.22Å; L226-L328 HydrophobicContact CD2-CD1 3.98Å
227G88.6Confident86.9Confident0 Ų043.7 Ų43.70%024%0.235CC..Hα-helixtrans-58.6-40175.200000112.4Q223 V224 I230 L231Q223-G227 PolarHBondContact O-N 3.07Å; V224-G227 PolarHBondContact O-N 3.13Å; G227-I230 PolarHBondContact O-N 3.34Å; G227-L231 WeakPolarHBondContact O-CB 3.37Å; G227-L231 PolarHBondContact O-N 3.43Å
228M91Very high86.7Confident84 Ų8445.5 Ų45.541%0.41425%0.245SC..Hα-helixtrans-63.9-41.6172.4-69.6-59.9-59.200112.1V224 V225 L226 L231 I232 I257V224-M228 WeakPolarHBondContact O-CG 3.34Å; V224-M228 PolarHBondContact O-N 2.9Å; V225-M228 PolarHBondContact O-N 3.46Å; L226-M228 VanDerWaalsContact C-N 3.28Å; L226-M228 PolarHBondContact O-N 3.41Å; M228-L231 PolarHBondContact O-N 2.85Å; M228-I232 WeakPolarHBondContact O-CB 3.44Å; M228-I232 WeakPolarHBondContact O-CD1 3.41Å; M228-I232 VanDerWaalsContact O-CG1 3.24Å; M228-I232 WeakPolarHBondContact O-CG1 3.31Å; M228-I232 PolarHBondContact O-N 3.29Å; M228-I257 HydrophobicContact CG-CD1 4.25Å; M228-I257 HydrophobicContact CG-CG1 4.44Å; M228-I257 HydrophobicContact SD-CD1 3.38Å; M228-I257 WeakPolarHBondContact SD-CD1 2.99Å; M228-I257 HydrophobicContact SD-CG1 4.04Å
229A89.6Confident86.5Confident27 Ų2745.2 Ų45.222%0.22325%0.245CC..Hα-helixtrans-64.2-40.9176.100000112V225 L226 I232 T233 L321V225-A229 PolarHBondContact O-N 2.92Å; L226-A229 WeakPolarHBondContact O-CB 3.32Å; L226-A229 PolarHBondContact O-N 2.85Å; A229-I232 PolarHBondContact O-N 2.82Å; A229-T233 WeakPolarHBondContact O-CB 3.38Å; A229-T233 WeakPolarHBondContact O-CG2 3.43Å; A229-T233 PolarHBondContact O-N 3.41Å; A229-T233 PolarHBondContact O-OG1 3.28Å; A229-L321 HydrophobicContact CB-CD1 3.82Å; A229-L321 HydrophobicContact CB-CD2 4.18Å
230I87Confident86Confident0 Ų047.8 Ų47.80%026%0.259CS..Hα-helixtrans-63-42.9174.4-65.4165.9000110.4L226 G227 T233 G234 L289 L321 D325L226-I230 WeakPolarHBondContact O-CG1 3.34Å; L226-I230 PolarHBondContact O-N 3.45Å; G227-I230 PolarHBondContact O-N 3.34Å; I230-T233 VanDerWaalsContact CA-OG1 3.32Å; I230-T233 WeakPolarHBondContact CA-OG1 3.49Å; I230-T233 PolarHBondContact O-N 3.49Å; I230-T233 PolarHBondContact O-OG1 3.46Å; I230-G234 PolarHBondContact O-N 3.02Å; I230-L289 HydrophobicContact CD1-CD2 4.44Å; I230-L321 HydrophobicContact CG1-CB 3.94Å; I230-L321 HydrophobicContact CG1-CD1 4.27Å; I230-D325 HydrophobicContact CD1-CB 4.45Å
231L89.4Confident85.1Confident30 Ų3054.7 Ų54.716%0.15729%0.288CS..Hα-helixtrans-63.8-46.5177.7-175147.1000111.8G227 M228 T233 G234 I235 L254 I257G227-L231 WeakPolarHBondContact O-CB 3.37Å; G227-L231 PolarHBondContact O-N 3.43Å; M228-L231 PolarHBondContact O-N 2.85Å; L231-T233 PolarHBondContact O-N 3.16Å; L231-G234 PolarHBondContact O-N 3.49Å; L231-I235 HydrophobicContact CD2-CD1 3.51Å; L231-I235 HydrophobicContact CD2-CG1 4.44Å; L231-I235 HydrophobicContact CG-CD1 4.37Å; L231-I235 VanDerWaalsContact O-CG1 3.31Å; L231-I235 WeakPolarHBondContact O-CG1 3.38Å; L231-I235 PolarHBondContact O-N 2.96Å; L231-L254 HydrophobicContact CD1-CB 4.35Å; L231-L254 HydrophobicContact CD1-CD1 4.39Å; L231-I257 HydrophobicContact CB-CD1 4.26Å; L231-I257 HydrophobicContact CD1-CD1 3.69Å
232I89.2Confident83.9Confident89 Ų8952.4 Ų52.446%0.45628%0.276SS..Hα-helixtrans-62.1-44.6178.1-68.6164000110.6M228 A229 I235 I236M228-I232 WeakPolarHBondContact O-CB 3.44Å; M228-I232 WeakPolarHBondContact O-CD1 3.41Å; M228-I232 VanDerWaalsContact O-CG1 3.24Å; M228-I232 WeakPolarHBondContact O-CG1 3.31Å; M228-I232 PolarHBondContact O-N 3.29Å; A229-I232 PolarHBondContact O-N 2.82Å; I232-I235 PolarHBondContact O-N 2.71Å; I232-I236 HydrophobicContact CG2-CD1 3.79Å; I232-I236 HydrophobicContact CG2-CG1 4.43Å; I232-I236 VanDerWaalsContact O-CG1 3.27Å; I232-I236 WeakPolarHBondContact O-CG1 3.45Å; I232-I236 PolarHBondContact O-N 2.94Å
233T85.3Confident82.3Confident11 Ų1157.5 Ų57.57%0.06729%0.291CS..Hα-helixtrans-66.9-38.5179.551.70000112.3A229 I230 L231 I236 R237 F317 L321A229-T233 WeakPolarHBondContact O-CB 3.38Å; A229-T233 WeakPolarHBondContact O-CG2 3.43Å; A229-T233 PolarHBondContact O-N 3.41Å; A229-T233 PolarHBondContact O-OG1 3.28Å; I230-T233 VanDerWaalsContact CA-OG1 3.32Å; I230-T233 WeakPolarHBondContact CA-OG1 3.49Å; I230-T233 PolarHBondContact O-N 3.49Å; I230-T233 PolarHBondContact O-OG1 3.46Å; L231-T233 PolarHBondContact O-N 3.16Å; T233-I236 PolarHBondContact O-N 3.31Å; T233-R237 WeakPolarHBondContact O-CB 3.42Å; T233-R237 PolarHBondContact O-N 3.4Å; T233-F317 HydrophobicContact CG2-CD1 3.42Å; T233-F317 VanDerWaalsContact CG2-CD1 3.42Å; T233-F317 HydrophobicContact CG2-CE1 3.45Å; T233-F317 VanDerWaalsContact CG2-CE1 3.45Å; T233-L321 HydrophobicContact CG2-CD1 4.12Å
234G84Confident80.6Confident0 Ų065.1 Ų65.10%033%0.329CS..Hα-helixtrans-60.5-42.8171.100000112.6I230 L231 R237 I238I230-G234 PolarHBondContact O-N 3.02Å; L231-G234 PolarHBondContact O-N 3.49Å; G234-R237 WeakPolarHBondContact O-CB 3.09Å; G234-R237 PolarHBondContact O-N 3.13Å; G234-I238 WeakPolarHBondContact O-CG1 3.49Å; G234-I238 PolarHBondContact O-N 3.29Å
235I85.3Confident79Confident73 Ų7364 Ų6437%0.37432%0.324SS..Hα-helixtrans-63.7-44.6174.8-67.6169.3000110.9L231 I232 R237 I238 I239 V250L231-I235 HydrophobicContact CD2-CD1 3.51Å; L231-I235 HydrophobicContact CD2-CG1 4.44Å; L231-I235 HydrophobicContact CG-CD1 4.37Å; L231-I235 VanDerWaalsContact O-CG1 3.31Å; L231-I235 WeakPolarHBondContact O-CG1 3.38Å; L231-I235 PolarHBondContact O-N 2.96Å; I232-I235 PolarHBondContact O-N 2.71Å; I235-R237 VanDerWaalsContact C-N 3.28Å; I235-R237 PolarHBondContact O-N 3.46Å; I235-I238 PolarHBondContact O-N 3.44Å; I235-I239 HydrophobicContact CG2-CD1 3.74Å; I235-I239 HydrophobicContact CG2-CG1 4.35Å; I235-I239 WeakPolarHBondContact O-CG1 3.24Å; I235-I239 PolarHBondContact O-N 2.91Å; I235-V250 HydrophobicContact CG1-CG2 4.2Å
236I82.8Confident77.4Confident71 Ų7164.6 Ų64.636%0.36433%0.327SS..Hα-helixtrans-58.6-43176.6-69.1165000110.4I232 T233 I238 I239 L240I232-I236 HydrophobicContact CG2-CD1 3.79Å; I232-I236 HydrophobicContact CG2-CG1 4.43Å; I232-I236 VanDerWaalsContact O-CG1 3.27Å; I232-I236 WeakPolarHBondContact O-CG1 3.45Å; I232-I236 PolarHBondContact O-N 2.94Å; T233-I236 PolarHBondContact O-N 3.31Å; I236-I238 VanDerWaalsContact C-N 3.34Å; I236-I238 PolarHBondContact O-N 3.26Å; I236-I239 PolarHBondContact O-N 3.27Å; I236-L240 HydrophobicContact CG2-CD1 3.68Å; I236-L240 HydrophobicContact CG2-CG 4.18Å; I236-L240 WeakPolarHBondContact O-CB 3.36Å; I236-L240 VanDerWaalsContact O-CG 3.28Å; I236-L240 WeakPolarHBondContact O-CG 3.41Å; I236-L240 PolarHBondContact O-N 3.06Å
237R78.4Confident76.5Confident6 Ų665.1 Ų65.12%0.02334%0.338CS..Hα-helixtrans-61.7-39.9177.8-167.2-178.3-120.7178.21.7112.3T233 G234 I235 L240 A242 D249 S296 V314 D315T233-R237 WeakPolarHBondContact O-CB 3.42Å; T233-R237 PolarHBondContact O-N 3.4Å; G234-R237 WeakPolarHBondContact O-CB 3.09Å; G234-R237 PolarHBondContact O-N 3.13Å; I235-R237 VanDerWaalsContact C-N 3.28Å; I235-R237 PolarHBondContact O-N 3.46Å; R237-L240 PolarHBondContact O-N 2.93Å; R237-A242 HydrophobicContact CG-CB 3.81Å; R237-A242 PolarHBondContact O-N 3.11Å; R237-D249 WeakPolarHBondContact CD-OD2 3.29Å; R237-D249 IonicContact CZ-OD2 3.88Å; R237-D249 IonicContact NE-OD2 3.78Å; R237-D249 IonicContact NH1-OD1 3.04Å; R237-D249 PolarHBondContact NH1-OD1 3.25Å; R237-D249 IonicContact NH1-OD2 3.92Å; R237-D249 PolarHBondContact NH1-OD2 2.96Å; R237-S296 PolarHBondContact NH1-OG 3.44Å; R237-S296 PolarHBondContact NH2-OG 3.23Å; R237-V314 HydrophobicContact CB-CG1 4.33Å; R237-D315 IonicContact CZ-OD1 2.71Å; R237-D315 IonicContact NE-OD1 3.87Å; R237-D315 PolarHBondContact NE-OD1 3.34Å; R237-D315 IonicContact NH2-OD1 3.49Å; R237-D315 PolarHBondContact NH2-OD1 2.96Å; R237-D315 IonicContact NH2-OD2 3.65Å
238I78.4Confident75.9Confident97 Ų9770.1 Ų70.150%0.49736%0.36SS..Hα-helixtrans-63.9-46.5173.6-66.3168000110.7G234 I235 I236 L240 K241 V250G234-I238 WeakPolarHBondContact O-CG1 3.49Å; G234-I238 PolarHBondContact O-N 3.29Å; I235-I238 PolarHBondContact O-N 3.44Å; I236-I238 VanDerWaalsContact C-N 3.34Å; I236-I238 PolarHBondContact O-N 3.26Å; I238-L240 VanDerWaalsContact C-N 3.31Å; I238-L240 PolarHBondContact O-N 2.87Å; I238-K241 PolarHBondContact O-N 2.99Å; I238-K241 VanDerWaalsContact O-N 3.13Å; I238-V250 HydrophobicContact CD1-CG2 3.53Å
239I81.1Confident75.5Confident125 Ų12566.2 Ų66.264%0.64134%0.341SS*.Hα-helixtrans-62.2-39.6179.6-67167.3000111.2I235 I236 K241I235-I239 HydrophobicContact CG2-CD1 3.74Å; I235-I239 HydrophobicContact CG2-CG1 4.35Å; I235-I239 WeakPolarHBondContact O-CG1 3.24Å; I235-I239 PolarHBondContact O-N 2.91Å; I236-I239 PolarHBondContact O-N 3.27Å; I239-K241 PolarHBondContact O-N 3.32Å; I239-K241 VanDerWaalsContact O-N 3.1Å
240L73.6Confident75.2Confident85 Ų8566.8 Ų66.845%0.44534%0.341SS..THydrogen-bonded Turntrans-73.77.7178.6-68.1175.6000113.9I236 R237 I238 A242 V314I236-L240 HydrophobicContact CG2-CD1 3.68Å; I236-L240 HydrophobicContact CG2-CG 4.18Å; I236-L240 WeakPolarHBondContact O-CB 3.36Å; I236-L240 VanDerWaalsContact O-CG 3.28Å; I236-L240 WeakPolarHBondContact O-CG 3.41Å; I236-L240 PolarHBondContact O-N 3.06Å; R237-L240 PolarHBondContact O-N 2.93Å; I238-L240 VanDerWaalsContact C-N 3.31Å; I238-L240 PolarHBondContact O-N 2.87Å; L240-A242 PolarHBondContact O-N 3.1Å; L240-V314 HydrophobicContact CD1-CG2 4.28Å
241K66.6Low75.2Confident147 Ų14772.5 Ų72.564%0.63937%0.366SS*.THydrogen-bonded Turntrans55.132.2178.8-68.2-177.6178.4175.90113.3I238 I239 Y243I238-K241 PolarHBondContact O-N 2.99Å; I238-K241 VanDerWaalsContact O-N 3.13Å; I239-K241 PolarHBondContact O-N 3.32Å; I239-K241 VanDerWaalsContact O-N 3.1Å; K241-Y243 HydrophobicContact CB-CD2 4.05Å; K241-Y243 HydrophobicContact CB-CE2 3.63Å; K241-Y243 HydrophobicContact CD-CE2 4.28Å; K241-Y243 HydrophobicContact CG-CE2 3.87Å; K241-Y243 WeakPolarHBondContact O-CD2 3.45Å; K241-Y243 PolarHBondContact O-N 3.46Å
242A60.8Low75.1Confident20 Ų2071.1 Ų71.117%0.16536%0.359CS..  trans-78.273.7171.700000109.4R237 L240 M244R237-A242 HydrophobicContact CG-CB 3.81Å; R237-A242 PolarHBondContact O-N 3.11Å; L240-A242 PolarHBondContact O-N 3.1Å; A242-M244 PolarHBondContact O-N 3.15Å
243Y57.3Low75Confident190 Ų19066.9 Ų66.975%0.74534%0.338SS*.THydrogen-bonded Turntrans-64.8-4.9-173.3-75.5-79.4000115.3K241 A245K241-Y243 HydrophobicContact CB-CD2 4.05Å; K241-Y243 HydrophobicContact CB-CE2 3.63Å; K241-Y243 HydrophobicContact CD-CE2 4.28Å; K241-Y243 HydrophobicContact CG-CE2 3.87Å; K241-Y243 WeakPolarHBondContact O-CD2 3.45Å; K241-Y243 PolarHBondContact O-N 3.46Å; Y243-A245 VanDerWaalsContact C-N 3.33Å
244M53.5Low75.2Confident163 Ų16370.5 Ų70.580%0.80336%0.356SS*.THydrogen-bonded Turntrans-78.8-15.3-178-70-71.4-168.900113.6A242A242-M244 PolarHBondContact O-N 3.15Å
245A54.9Low75.5Confident16 Ų1672.9 Ų72.913%0.13237%0.365CS..SBendtrans-119.389.3175.500000109.2Y243 G247 A295Y243-A245 VanDerWaalsContact C-N 3.33Å; A245-G247 PolarHBondContact O-N 3.26Å; A245-A295 HydrophobicContact CB-CB 4.44Å
246V59.5Low75.6Confident100 Ų10069.4 Ų69.461%0.60635%0.347SS*.  trans-43.7139.2167.5177.30000108.4F248V246-F248 HydrophobicContact CB-CD2 3.85Å; V246-F248 HydrophobicContact CB-CE2 3.72Å; V246-F248 HydrophobicContact CG1-CD2 4.13Å; V246-F248 HydrophobicContact CG1-CE2 3.81Å; V246-F248 HydrophobicContact CG1-CZ 4.39Å; V246-F248 WeakPolarHBondContact O-CB 3.48Å; V246-F248 WeakPolarHBondContact O-CD2 3.38Å; V246-F248 PolarHBondContact O-N 3.29Å
247G69.8Low76Confident33 Ų3367.8 Ų67.834%0.3434%0.339SS..THydrogen-bonded Turntrans-54.824.6-166.500000119.6A245 D249 V250 F251A245-G247 PolarHBondContact O-N 3.26Å; G247-D249 PolarHBondContact O-N 3.36Å; G247-V250 PolarHBondContact O-N 2.94Å; G247-V250 VanDerWaalsContact O-N 3.13Å; G247-F251 PolarHBondContact O-N 3.44Å; G247-F251 VanDerWaalsContact O-N 3.15Å
248F77.7Confident76.7Confident105 Ų10571.8 Ų71.846%0.46136%0.36SS..Hα-helixtrans-46.5-38.1163.1-65.2-66.1000112.5V246 V250 F251 V252V246-F248 HydrophobicContact CB-CD2 3.85Å; V246-F248 HydrophobicContact CB-CE2 3.72Å; V246-F248 HydrophobicContact CG1-CD2 4.13Å; V246-F248 HydrophobicContact CG1-CE2 3.81Å; V246-F248 HydrophobicContact CG1-CZ 4.39Å; V246-F248 WeakPolarHBondContact O-CB 3.48Å; V246-F248 WeakPolarHBondContact O-CD2 3.38Å; V246-F248 PolarHBondContact O-N 3.29Å; F248-V250 VanDerWaalsContact C-N 3.29Å; F248-V250 PolarHBondContact O-N 2.76Å; F248-F251 PolarHBondContact O-N 3.21Å; F248-V252 WeakPolarHBondContact O-CB 3.44Å; F248-V252 VanDerWaalsContact O-CG2 3.23Å; F248-V252 WeakPolarHBondContact O-CG2 3.26Å; F248-V252 PolarHBondContact O-N 2.92Å
249D81.1Confident77.2Confident3 Ų367.3 Ų67.32%0.01634%0.337CS..Hα-helixtrans-57.9-43.8177.8-59.5-32000111.7R237 G247 G253 P292 I318R237-D249 WeakPolarHBondContact CD-OD2 3.29Å; R237-D249 IonicContact CZ-OD2 3.88Å; R237-D249 IonicContact NE-OD2 3.78Å; R237-D249 IonicContact NH1-OD1 3.04Å; R237-D249 PolarHBondContact NH1-OD1 3.25Å; R237-D249 IonicContact NH1-OD2 3.92Å; R237-D249 PolarHBondContact NH1-OD2 2.96Å; G247-D249 PolarHBondContact O-N 3.36Å; D249-G253 PolarHBondContact O-N 2.75Å; D249-P292 WeakPolarHBondContact OD1-CB 3.16Å; D249-I318 HydrophobicContact CB-CD1 3.81Å; D249-I318 WeakPolarHBondContact OD1-CD1 3.38Å
250V84.1Confident77.6Confident39 Ų3961.4 Ų61.424%0.23631%0.307CS..Hα-helixtrans-69.7-42178.3179.80000110.6I235 I238 G247 F248 G253 L254I235-V250 HydrophobicContact CG1-CG2 4.2Å; I238-V250 HydrophobicContact CD1-CG2 3.53Å; G247-V250 PolarHBondContact O-N 2.94Å; G247-V250 VanDerWaalsContact O-N 3.13Å; F248-V250 VanDerWaalsContact C-N 3.29Å; F248-V250 PolarHBondContact O-N 2.76Å; V250-G253 PolarHBondContact O-N 2.89Å; V250-L254 WeakPolarHBondContact O-CB 3.24Å; V250-L254 PolarHBondContact O-N 3.5Å
251F86.6Confident78.3Confident120 Ų12058.7 Ų58.753%0.52630%0.3SS..Hα-helixtrans-61.7-45.6176.5178.9-97.2000111.9G247 F248 L254 Y255G247-F251 PolarHBondContact O-N 3.44Å; G247-F251 VanDerWaalsContact O-N 3.15Å; F248-F251 PolarHBondContact O-N 3.21Å; F251-L254 PolarHBondContact O-N 2.97Å; F251-Y255 WeakPolarHBondContact O-CB 3.29Å; F251-Y255 PolarHBondContact O-N 2.97Å
252V86.5Confident79.3Confident1 Ų154.7 Ų54.71%0.00629%0.285CS..Hα-helixtrans-64.9-46.5177.7172.90000110.1F248 L254 Y255 V256 L288 L289 P292F248-V252 WeakPolarHBondContact O-CB 3.44Å; F248-V252 VanDerWaalsContact O-CG2 3.23Å; F248-V252 WeakPolarHBondContact O-CG2 3.26Å; F248-V252 PolarHBondContact O-N 2.92Å; V252-L254 VanDerWaalsContact C-N 3.33Å; V252-L254 PolarHBondContact O-N 2.72Å; V252-Y255 PolarHBondContact O-N 3.36Å; V252-V256 HydrophobicContact CG1-CG2 4.28Å; V252-V256 WeakPolarHBondContact O-CG2 3.49Å; V252-V256 PolarHBondContact O-N 3.29Å; V252-L288 HydrophobicContact CG2-CB 4.39Å; V252-L289 HydrophobicContact CG1-CD2 3.89Å; V252-L289 HydrophobicContact CG1-CG 4.48Å; V252-P292 HydrophobicContact CG1-CG 4.36Å
253G86.8Confident80.4Confident0 Ų054 Ų540%028%0.278CS..Hα-helixtrans-56.5-45.6175.400000112.4D249 V250 V256 I257D249-G253 PolarHBondContact O-N 2.75Å; V250-G253 PolarHBondContact O-N 2.89Å; G253-V256 PolarHBondContact O-N 3.36Å; G253-I257 VanDerWaalsContact O-CD1 3.31Å; G253-I257 WeakPolarHBondContact O-CD1 3.48Å; G253-I257 VanDerWaalsContact O-CG1 3.26Å; G253-I257 WeakPolarHBondContact O-CG1 3.04Å; G253-I257 PolarHBondContact O-N 3.01Å; G253-I257 VanDerWaalsContact O-N 3.12Å
254L90.3Very high81.9Confident87 Ų8745.9 Ų45.946%0.45525%0.248SC..Hα-helixtrans-63.8-43.1176.5-172.968.1000111.9L231 V250 F251 V252 I257 I258L231-L254 HydrophobicContact CD1-CB 4.35Å; L231-L254 HydrophobicContact CD1-CD1 4.39Å; V250-L254 WeakPolarHBondContact O-CB 3.24Å; V250-L254 PolarHBondContact O-N 3.5Å; F251-L254 PolarHBondContact O-N 2.97Å; V252-L254 VanDerWaalsContact C-N 3.33Å; V252-L254 PolarHBondContact O-N 2.72Å; L254-I257 PolarHBondContact O-N 3.45Å; L254-I258 HydrophobicContact CG-CD1 4.05Å; L254-I258 WeakPolarHBondContact O-CG1 3.35Å; L254-I258 PolarHBondContact O-N 2.88Å
255Y90.6Very high83.4Confident49 Ų4941 Ų4119%0.19223%0.228CC..Hα-helixtrans-61.5-45.8178.2-172.3-99000111.6F251 V252 I257 I258 V259 A281 I284 Q285 L288F251-Y255 WeakPolarHBondContact O-CB 3.29Å; F251-Y255 PolarHBondContact O-N 2.97Å; V252-Y255 PolarHBondContact O-N 3.36Å; Y255-I257 VanDerWaalsContact C-N 3.32Å; Y255-I257 PolarHBondContact O-N 3.39Å; Y255-I258 PolarHBondContact O-N 3.02Å; Y255-V259 HydrophobicContact CD1-CG2 3.96Å; Y255-V259 HydrophobicContact CE1-CG2 3.59Å; Y255-V259 HydrophobicContact CE2-CG2 4.24Å; Y255-V259 HydrophobicContact CG-CG2 4.43Å; Y255-V259 WeakPolarHBondContact O-CG2 3.44Å; Y255-V259 PolarHBondContact O-N 2.81Å; Y255-A281 PolarHBondContact OH-O 3.43Å; Y255-I284 HydrophobicContact CE1-CG2 4.43Å; Y255-Q285 HydrophobicContact CD1-CB 4.16Å; Y255-Q285 HydrophobicContact CD1-CG 4.49Å; Y255-Q285 HydrophobicContact CE1-CB 3.91Å; Y255-L288 HydrophobicContact CD1-CD1 3.83Å; Y255-L288 HydrophobicContact CE1-CD1 3.85Å; Y255-L288 HydrophobicContact CG-CD1 4.19Å
256V88.4Confident84.8Confident0 Ų040.2 Ų40.20%022%0.221CC..Hα-helixtrans-55.6-47.7175.2173.70000110.3V252 G253 I258 V259 Q260 Q285V252-V256 HydrophobicContact CG1-CG2 4.28Å; V252-V256 WeakPolarHBondContact O-CG2 3.49Å; V252-V256 PolarHBondContact O-N 3.29Å; G253-V256 PolarHBondContact O-N 3.36Å; V256-I258 PolarHBondContact O-N 3.35Å; V256-V259 PolarHBondContact O-N 3.5Å; V256-Q260 HydrophobicContact CG1-CG 4.28Å; V256-Q260 WeakPolarHBondContact O-CB 3.45Å; V256-Q260 WeakPolarHBondContact O-CG 2.98Å; V256-Q260 PolarHBondContact O-N 2.89Å; V256-Q285 HydrophobicContact CG2-CG 3.77Å
257I90.9Very high85.9Confident37 Ų3735.8 Ų35.819%0.1920%0.195CC..Hα-helixtrans-61.4-43.6179.9-65.8157.6000111.4M228 L231 G253 L254 Y255 G261M228-I257 HydrophobicContact CG-CD1 4.25Å; M228-I257 HydrophobicContact CG-CG1 4.44Å; M228-I257 HydrophobicContact SD-CD1 3.38Å; M228-I257 WeakPolarHBondContact SD-CD1 2.99Å; M228-I257 HydrophobicContact SD-CG1 4.04Å; L231-I257 HydrophobicContact CB-CD1 4.26Å; L231-I257 HydrophobicContact CD1-CD1 3.69Å; G253-I257 VanDerWaalsContact O-CD1 3.31Å; G253-I257 WeakPolarHBondContact O-CD1 3.48Å; G253-I257 VanDerWaalsContact O-CG1 3.26Å; G253-I257 WeakPolarHBondContact O-CG1 3.04Å; G253-I257 PolarHBondContact O-N 3.01Å; G253-I257 VanDerWaalsContact O-N 3.12Å; L254-I257 PolarHBondContact O-N 3.45Å; Y255-I257 VanDerWaalsContact C-N 3.32Å; Y255-I257 PolarHBondContact O-N 3.39Å; I257-G261 PolarHBondContact O-N 3Å
258I91.5Very high86.5Confident90 Ų9043 Ų4346%0.46221%0.212SC..Hα-helixtrans-64.7-49.9179.8-67.4166.8000110.6L254 Y255 V256 Q260 G261 I262L254-I258 HydrophobicContact CG-CD1 4.05Å; L254-I258 WeakPolarHBondContact O-CG1 3.35Å; L254-I258 PolarHBondContact O-N 2.88Å; Y255-I258 PolarHBondContact O-N 3.02Å; V256-I258 PolarHBondContact O-N 3.35Å; I258-Q260 PolarHBondContact O-N 3.32Å; I258-G261 PolarHBondContact O-N 3.5Å; I258-I262 HydrophobicContact CG2-CD1 3.99Å; I258-I262 VanDerWaalsContact O-CG1 3.3Å; I258-I262 WeakPolarHBondContact O-CG1 3.48Å; I258-I262 PolarHBondContact O-N 3.26Å
259V89.5Confident86.6Confident3 Ų345.1 Ų45.12%0.01822%0.22CC..Hα-helixtrans-60.5-47-178.6172.20000110.9Y255 V256 I262 I263 A281Y255-V259 HydrophobicContact CD1-CG2 3.96Å; Y255-V259 HydrophobicContact CE1-CG2 3.59Å; Y255-V259 HydrophobicContact CE2-CG2 4.24Å; Y255-V259 HydrophobicContact CG-CG2 4.43Å; Y255-V259 WeakPolarHBondContact O-CG2 3.44Å; Y255-V259 PolarHBondContact O-N 2.81Å; V256-V259 PolarHBondContact O-N 3.5Å; V259-I262 WeakPolarHBondContact O-CB 3.34Å; V259-I262 PolarHBondContact O-N 3.45Å; V259-I263 HydrophobicContact CG1-CD1 4.17Å; V259-I263 WeakPolarHBondContact O-CG1 3.32Å; V259-I263 PolarHBondContact O-N 3.21Å; V259-A281 HydrophobicContact CB-CB 4.46Å; V259-A281 HydrophobicContact CG1-CB 3.96Å; V259-A281 HydrophobicContact CG2-CB 3.69Å
260Q88.9Confident86.4Confident1 Ų149.5 Ų49.51%0.00524%0.244CC..Hα-helixtrans-70.9-33.5-179.9-61.2-60.8-2300112.1Q223 V224 V256 I258 I262 I263 V264Q223-Q260 HydrophobicContact CB-CG 3.72Å; Q223-Q260 VanDerWaalsContact OE1-CD 3.29Å; V224-Q260 HydrophobicContact CG2-CB 3.5Å; V256-Q260 HydrophobicContact CG1-CG 4.28Å; V256-Q260 WeakPolarHBondContact O-CB 3.45Å; V256-Q260 WeakPolarHBondContact O-CG 2.98Å; V256-Q260 PolarHBondContact O-N 2.89Å; I258-Q260 PolarHBondContact O-N 3.32Å; Q260-I262 VanDerWaalsContact C-N 3.31Å; Q260-I262 PolarHBondContact O-N 3.47Å; Q260-I263 PolarHBondContact O-N 3.34Å; Q260-V264 VanDerWaalsContact O-CG2 3.32Å; Q260-V264 WeakPolarHBondContact O-CG2 3.48Å; Q260-V264 PolarHBondContact O-N 3.1Å
261G88.8Confident86Confident29 Ų2950.8 Ų50.830%0.29925%0.25SC..Hα-helixtrans-60-39.7170.200000112.8I257 I258 T265I257-G261 PolarHBondContact O-N 3Å; I258-G261 PolarHBondContact O-N 3.5Å; G261-T265 WeakPolarHBondContact O-CB 3.47Å; G261-T265 PolarHBondContact O-N 3.28Å; G261-T265 PolarHBondContact O-OG1 2.86Å
262I87.6Confident85.4Confident63 Ų6351.3 Ų51.332%0.32325%0.248SC..Hα-helixtrans-64.1-45.4173.4-66.3163.1000110.3I258 V259 Q260 T265 A266 L274I258-I262 HydrophobicContact CG2-CD1 3.99Å; I258-I262 VanDerWaalsContact O-CG1 3.3Å; I258-I262 WeakPolarHBondContact O-CG1 3.48Å; I258-I262 PolarHBondContact O-N 3.26Å; V259-I262 WeakPolarHBondContact O-CB 3.34Å; V259-I262 PolarHBondContact O-N 3.45Å; Q260-I262 VanDerWaalsContact C-N 3.31Å; Q260-I262 PolarHBondContact O-N 3.47Å; I262-T265 PolarHBondContact O-N 3.05Å; I262-A266 VanDerWaalsContact O-CB 3.29Å; I262-A266 WeakPolarHBondContact O-CB 3.34Å; I262-A266 PolarHBondContact O-N 2.88Å; I262-L274 HydrophobicContact CG2-CD2 4.15Å
263I85.2Confident85.1Confident4 Ų456 Ų562%0.02128%0.28CS..Hα-helixtrans-63.8-43179.5-66.5168.6000111.6A220 V259 Q260 T265 A266 T267A220-I263 HydrophobicContact CB-CG2 4.08Å; V259-I263 HydrophobicContact CG1-CD1 4.17Å; V259-I263 WeakPolarHBondContact O-CG1 3.32Å; V259-I263 PolarHBondContact O-N 3.21Å; Q260-I263 PolarHBondContact O-N 3.34Å; I263-T265 VanDerWaalsContact C-N 3.32Å; I263-T265 PolarHBondContact O-N 3.06Å; I263-A266 PolarHBondContact O-N 3.48Å; I263-T267 WeakPolarHBondContact O-CB 3.38Å; I263-T267 PolarHBondContact O-N 2.91Å; I263-T267 PolarHBondContact O-OG1 3.04Å
264V87Confident84.8Confident20 Ų2059.1 Ų59.112%0.12130%0.296CS..Hα-helixtrans-62.1-42.9175.4172.30000110.5A220 V221 Q260 T267 R268A220-V264 HydrophobicContact CB-CG2 3.76Å; V221-V264 HydrophobicContact CG2-CG2 4.39Å; Q260-V264 VanDerWaalsContact O-CG2 3.32Å; Q260-V264 WeakPolarHBondContact O-CG2 3.48Å; Q260-V264 PolarHBondContact O-N 3.1Å; V264-T267 PolarHBondContact O-N 2.81Å; V264-R268 WeakPolarHBondContact O-CG 3.44Å; V264-R268 PolarHBondContact O-N 3.34Å
265T86.2Confident84.3Confident61 Ų6155.3 Ų55.337%0.37428%0.276SS..Hα-helixtrans-67.1-40.5177.8-57.10000111.8G261 I262 I263 T267 R268 K269G261-T265 WeakPolarHBondContact O-CB 3.47Å; G261-T265 PolarHBondContact O-N 3.28Å; G261-T265 PolarHBondContact O-OG1 2.86Å; I262-T265 PolarHBondContact O-N 3.05Å; I263-T265 VanDerWaalsContact C-N 3.32Å; I263-T265 PolarHBondContact O-N 3.06Å; T265-T267 VanDerWaalsContact C-N 3.32Å; T265-T267 PolarHBondContact O-N 3.43Å; T265-R268 PolarHBondContact O-N 2.77Å; T265-K269 HydrophobicContact CG2-CD 4.15Å; T265-K269 WeakPolarHBondContact O-CB 3.44Å; T265-K269 WeakPolarHBondContact O-CG 3.29Å; T265-K269 PolarHBondContact O-N 3.47Å
266A84.1Confident83.8Confident0 Ų057.1 Ų57.10%029%0.293CS..Hα-helixtrans-60.8-43.5175.500000111.3I262 I263 K269 N270 N271 L274 M275I262-A266 VanDerWaalsContact O-CB 3.29Å; I262-A266 WeakPolarHBondContact O-CB 3.34Å; I262-A266 PolarHBondContact O-N 2.88Å; I263-A266 PolarHBondContact O-N 3.48Å; A266-K269 CarbonylContact O-C 3.58Å; A266-K269 PolarHBondContact O-N 2.9Å; A266-N270 WeakPolarHBondContact O-CA 3.36Å; A266-N270 PolarHBondContact O-N 3.42Å; A266-N271 PolarHBondContact O-N 3.2Å; A266-N271 VanDerWaalsContact O-N 3.11Å; A266-L274 HydrophobicContact CB-CB 3.61Å; A266-M275 HydrophobicContact CB-CB 4.11Å
267T81.4Confident83.6Confident7 Ų758.9 Ų58.94%0.04331%0.311CS..Hα-helixtrans-63.4-43.3177.2-60.10000111.7W213 M217 I263 V264 T265 N270W213-T267 HydrophobicContact CB-CG2 3.92Å; W213-T267 HydrophobicContact CD2-CG2 4.04Å; W213-T267 HydrophobicContact CE3-CG2 3.36Å; W213-T267 HydrophobicContact CG-CG2 4.33Å; W213-T267 VanDerWaalsContact CZ3-CA 3.48Å; W213-T267 HydrophobicContact CZ3-CG2 4.1Å; M217-T267 HydrophobicContact CB-CG2 4.13Å; I263-T267 WeakPolarHBondContact O-CB 3.38Å; I263-T267 PolarHBondContact O-N 2.91Å; I263-T267 PolarHBondContact O-OG1 3.04Å; V264-T267 PolarHBondContact O-N 2.81Å; T265-T267 VanDerWaalsContact C-N 3.32Å; T265-T267 PolarHBondContact O-N 3.43Å; T267-N270 PolarHBondContact O-N 2.95Å; T267-N270 PolarHBondContact O-OD1 3.22Å
268R82.5Confident83.3Confident185 Ų18557.1 Ų57.170%0.69830%0.302SS*.Hα-helixtrans-67.1-36.4176.7-74.7-176.2175.7-174.40.5113.1V264 T265V264-R268 WeakPolarHBondContact O-CG 3.44Å; V264-R268 PolarHBondContact O-N 3.34Å; T265-R268 PolarHBondContact O-N 2.77Å
269K81.3Confident82.9Confident148 Ų14854.1 Ų54.164%0.64329%0.285SS*.Hα-helixtrans-88.4-2.1-179.4-67.4-175177.7-177.40113.6T265 A266 N271T265-K269 HydrophobicContact CG2-CD 4.15Å; T265-K269 WeakPolarHBondContact O-CB 3.44Å; T265-K269 WeakPolarHBondContact O-CG 3.29Å; T265-K269 PolarHBondContact O-N 3.47Å; A266-K269 CarbonylContact O-C 3.58Å; A266-K269 PolarHBondContact O-N 2.9Å; K269-N271 HydrophobicContact CB-CB 4.27Å; K269-N271 PolarHBondContact O-N 3.24Å; K269-N271 VanDerWaalsContact O-N 3.1Å
270N75.5Confident82.7Confident96 Ų9658 Ų5851%0.51331%0.309SS..THydrogen-bonded Turntrans47.533.8-170.9-66.2-44.2000113.2A266 T267A266-N270 WeakPolarHBondContact O-CA 3.36Å; A266-N270 PolarHBondContact O-N 3.42Å; T267-N270 PolarHBondContact O-N 2.95Å; T267-N270 PolarHBondContact O-OD1 3.22Å
271N76.4Confident82.7Confident66 Ų6658.7 Ų58.735%0.35332%0.315SS..  trans-94.8105.2-175.4-174-23.6000110.3A266 K269 C273 L274 M275A266-N271 PolarHBondContact O-N 3.2Å; A266-N271 VanDerWaalsContact O-N 3.11Å; K269-N271 HydrophobicContact CB-CB 4.27Å; K269-N271 PolarHBondContact O-N 3.24Å; K269-N271 VanDerWaalsContact O-N 3.1Å; N271-C273 VanDerWaalsContact C-N 3.26Å; N271-C273 PolarHBondContact O-N 2.99Å; N271-C273 WeakPolarHBondContact OD1-CB 3.3Å; N271-C273 PolarHBondContact OD1-N 3.34Å; N271-L274 HydrophobicContact CB-CB 4.23Å; N271-L274 HydrophobicContact CB-CD1 3.96Å; N271-L274 HydrophobicContact CB-CG 4.5Å; N271-L274 PolarHBondContact O-N 3.39Å; N271-L274 PolarHBondContact OD1-N 3.35Å; N271-M275 WeakPolarHBondContact O-CB 3.35Å; N271-M275 PolarHBondContact O-N 3.49Å
272W74.7Confident82.4Confident130 Ų13057.3 Ų57.349%0.49230%0.3SS..Hα-helixtrans-60.7-30.7-179.3-64.898.7000113.9W213 M275 T276 K343W213-W272 HydrophobicContact CZ2-CH2 4.3Å; W213-W272 HydrophobicContact CZ2-CZ2 4.35Å; W272-M275 HydrophobicContact CE3-SD 3.96Å; W272-M275 HydrophobicContact CZ3-SD 3.96Å; W272-M275 PolarHBondContact O-N 2.97Å; W272-T276 WeakPolarHBondContact O-CB 3.46Å; W272-T276 PolarHBondContact O-N 2.95Å; W272-T276 PolarHBondContact O-OG1 3.33Å; W272-K343 VanDerWaalsContact CH2-NZ 3.33Å
273C78.9Confident82.3Confident101 Ų10157.8 Ų57.868%0.68231%0.306SS*.Hα-helixtrans-68.6-48.9178.4-176.40000110.7N271 M275 T276 G277N271-C273 VanDerWaalsContact C-N 3.26Å; N271-C273 PolarHBondContact O-N 2.99Å; N271-C273 WeakPolarHBondContact OD1-CB 3.3Å; N271-C273 PolarHBondContact OD1-N 3.34Å; C273-M275 VanDerWaalsContact C-N 3.26Å; C273-M275 PolarHBondContact O-N 3.39Å; C273-T276 PolarHBondContact O-N 3.33Å; C273-G277 PolarHBondContact O-N 3.45Å
274L81Confident82.4Confident64 Ų6461.8 Ų61.834%0.33533%0.327SS..Hα-helixtrans-61.6-36.5174.1-81.4162.1000111.7I262 A266 N271 G278I262-L274 HydrophobicContact CG2-CD2 4.15Å; A266-L274 HydrophobicContact CB-CB 3.61Å; N271-L274 HydrophobicContact CB-CB 4.23Å; N271-L274 HydrophobicContact CB-CD1 3.96Å; N271-L274 HydrophobicContact CB-CG 4.5Å; N271-L274 PolarHBondContact O-N 3.39Å; N271-L274 PolarHBondContact OD1-N 3.35Å; L274-G278 PolarHBondContact O-N 2.96Å
275M80.4Confident82.4Confident8 Ų860.9 Ų60.94%0.03932%0.321CS..Hα-helixtrans-65.3-45.8177.3-170.6-175.7-161.100111.3F212 W213 L216 A266 N271 W272 C273 G278 Y279F212-M275 HydrophobicContact CE1-CE 3.84Å; W213-M275 HydrophobicContact CE3-CE 4.05Å; W213-M275 HydrophobicContact CH2-CE 3.69Å; W213-M275 HydrophobicContact CH2-CG 4.32Å; W213-M275 HydrophobicContact CH2-SD 3.24Å; W213-M275 WeakPolarHBondContact CH2-SD 3.48Å; W213-M275 HydrophobicContact CZ2-SD 4.16Å; W213-M275 HydrophobicContact CZ3-CE 3.38Å; W213-M275 HydrophobicContact CZ3-CG 4.32Å; W213-M275 HydrophobicContact CZ3-SD 3.52Å; W213-M275 VanDerWaalsContact CZ3-SD 3.52Å; L216-M275 HydrophobicContact CD2-CE 3.43Å; L216-M275 VanDerWaalsContact CD2-CE 3.43Å; A266-M275 HydrophobicContact CB-CB 4.11Å; N271-M275 WeakPolarHBondContact O-CB 3.35Å; N271-M275 PolarHBondContact O-N 3.49Å; W272-M275 HydrophobicContact CE3-SD 3.96Å; W272-M275 HydrophobicContact CZ3-SD 3.96Å; W272-M275 PolarHBondContact O-N 2.97Å; C273-M275 VanDerWaalsContact C-N 3.26Å; C273-M275 PolarHBondContact O-N 3.39Å; M275-G278 PolarHBondContact O-N 2.93Å; M275-Y279 HydrophobicContact CE-CE2 3.5Å; M275-Y279 WeakPolarHBondContact CE-OH 3.31Å; M275-Y279 HydrophobicContact CG-CD2 3.86Å; M275-Y279 HydrophobicContact CG-CE2 3.42Å; M275-Y279 VanDerWaalsContact CG-CE2 3.42Å; M275-Y279 WeakPolarHBondContact O-CD2 3.25Å; M275-Y279 PolarHBondContact O-N 3.46Å; M275-Y279 HydrophobicContact SD-CE2 4.05Å
276T80.5Confident82.3Confident87 Ų8759.4 Ų59.453%0.53431%0.313SS..Hα-helixtrans-63.1-46.1178.1-53.90000110.9W272 C273 G278 Y279 T280W272-T276 WeakPolarHBondContact O-CB 3.46Å; W272-T276 PolarHBondContact O-N 2.95Å; W272-T276 PolarHBondContact O-OG1 3.33Å; C273-T276 PolarHBondContact O-N 3.33Å; T276-G278 VanDerWaalsContact C-N 3.32Å; T276-G278 PolarHBondContact O-N 3.05Å; T276-Y279 PolarHBondContact O-N 2.93Å; T276-T280 WeakPolarHBondContact O-CG2 3.29Å; T276-T280 PolarHBondContact O-N 3.26Å; T276-T280 PolarHBondContact O-OG1 3.44Å
277G83.2Confident82.4Confident37 Ų3765 Ų6538%0.38134%0.343SS..Hα-helixtrans-62.3-37175.100000113.3C273 T280 A281C273-G277 PolarHBondContact O-N 3.45Å; G277-T280 WeakPolarHBondContact CA-OG1 3.32Å; G277-T280 PolarHBondContact O-OG1 3.2Å; G277-A281 WeakPolarHBondContact O-CB 3.01Å; G277-A281 PolarHBondContact O-N 2.89Å
278G85.1Confident82.6Confident0 Ų066.5 Ų66.50%035%0.35CS..Hα-helixtrans-63.7-43.6173.600000112.4L274 M275 T276 A281 S282L274-G278 PolarHBondContact O-N 2.96Å; M275-G278 PolarHBondContact O-N 2.93Å; T276-G278 VanDerWaalsContact C-N 3.32Å; T276-G278 PolarHBondContact O-N 3.05Å; G278-A281 PolarHBondContact O-N 3.33Å; G278-S282 WeakPolarHBondContact O-CB 3.39Å; G278-S282 PolarHBondContact O-N 2.81Å
279Y83.4Confident82.6Confident27 Ų2757.7 Ų57.711%0.10632%0.317CS..Hα-helixtrans-69.3-39.3177.4-75.8-60.8000113.5L216 M275 T276 A281 S282 V283 L333 S336L216-Y279 HydrophobicContact CD1-CE1 4.4Å; L216-Y279 WeakPolarHBondContact CD1-OH 3.26Å; L216-Y279 WeakPolarHBondContact CD2-OH 3.37Å; M275-Y279 HydrophobicContact CE-CE2 3.5Å; M275-Y279 WeakPolarHBondContact CE-OH 3.31Å; M275-Y279 HydrophobicContact CG-CD2 3.86Å; M275-Y279 HydrophobicContact CG-CE2 3.42Å; M275-Y279 VanDerWaalsContact CG-CE2 3.42Å; M275-Y279 WeakPolarHBondContact O-CD2 3.25Å; M275-Y279 PolarHBondContact O-N 3.46Å; M275-Y279 HydrophobicContact SD-CE2 4.05Å; T276-Y279 PolarHBondContact O-N 2.93Å; Y279-A281 VanDerWaalsContact C-N 3.29Å; Y279-A281 PolarHBondContact O-N 3.35Å; Y279-S282 WeakPolarHBondContact O-CB 3.5Å; Y279-S282 PolarHBondContact O-N 2.91Å; Y279-S282 VanDerWaalsContact O-N 3.13Å; Y279-V283 WeakPolarHBondContact O-CG2 3.42Å; Y279-V283 PolarHBondContact O-N 3.3Å; Y279-L333 HydrophobicContact CD1-CD2 4.37Å; Y279-S336 WeakPolarHBondContact CE1-OG 3.43Å; Y279-S336 PolarHBondContact OH-OG 2.86Å
280T85.3Confident82.6Confident84 Ų8452.4 Ų52.452%0.51530%0.304SS..Hα-helixtrans-62.9-40.3174.953.60000110.9T276 G277 S282 V283 I284T276-T280 WeakPolarHBondContact O-CG2 3.29Å; T276-T280 PolarHBondContact O-N 3.26Å; T276-T280 PolarHBondContact O-OG1 3.44Å; G277-T280 WeakPolarHBondContact CA-OG1 3.32Å; G277-T280 PolarHBondContact O-OG1 3.2Å; T280-S282 VanDerWaalsContact C-N 3.33Å; T280-S282 PolarHBondContact O-N 3.16Å; T280-V283 PolarHBondContact O-N 2.99Å; T280-I284 PolarHBondContact O-N 2.93Å
281A87.5Confident82.9Confident16 Ų1651.7 Ų51.713%0.13230%0.3CS..Hα-helixtrans-65.9-33.9172.800000112.7Y255 V259 G277 G278 Y279 V283 I284 Q285Y255-A281 PolarHBondContact OH-O 3.43Å; V259-A281 HydrophobicContact CB-CB 4.46Å; V259-A281 HydrophobicContact CG1-CB 3.96Å; V259-A281 HydrophobicContact CG2-CB 3.69Å; G277-A281 WeakPolarHBondContact O-CB 3.01Å; G277-A281 PolarHBondContact O-N 2.89Å; G278-A281 PolarHBondContact O-N 3.33Å; Y279-A281 VanDerWaalsContact C-N 3.29Å; Y279-A281 PolarHBondContact O-N 3.35Å; A281-V283 VanDerWaalsContact C-N 3.33Å; A281-V283 PolarHBondContact O-N 2.9Å; A281-I284 WeakPolarHBondContact O-CB 3.26Å; A281-I284 PolarHBondContact O-N 3.22Å; A281-I284 VanDerWaalsContact O-N 3.16Å; A281-Q285 PolarHBondContact O-N 3.09Å
282S84.2Confident83Confident0 Ų048.6 Ų48.60%028%0.283CS..Hα-helixtrans-65.8-33.1174.2-174.80000112.7G278 Y279 T280 I284 Q285 C286G278-S282 WeakPolarHBondContact O-CB 3.39Å; G278-S282 PolarHBondContact O-N 2.81Å; Y279-S282 WeakPolarHBondContact O-CB 3.5Å; Y279-S282 PolarHBondContact O-N 2.91Å; Y279-S282 VanDerWaalsContact O-N 3.13Å; T280-S282 VanDerWaalsContact C-N 3.33Å; T280-S282 PolarHBondContact O-N 3.16Å; S282-I284 VanDerWaalsContact C-N 3.32Å; S282-I284 PolarHBondContact O-N 3.45Å; S282-Q285 VanDerWaalsContact O-CB 3.32Å; S282-Q285 WeakPolarHBondContact O-CB 3.23Å; S282-Q285 PolarHBondContact O-N 3.42Å; S282-C286 PolarHBondContact O-N 2.88Å; S282-C286 PolarHBondContact O-SG 3.43Å; S282-C286 VanDerWaalsContact O-SG 3.35Å
283V84.6Confident83.3Confident72 Ų7243.7 Ų43.744%0.43627%0.267SS..Hα-helixtrans-65.1-38.7171.6176.90000111.1Y279 T280 A281 C286 N287 L333Y279-V283 WeakPolarHBondContact O-CG2 3.42Å; Y279-V283 PolarHBondContact O-N 3.3Å; T280-V283 PolarHBondContact O-N 2.99Å; A281-V283 VanDerWaalsContact C-N 3.33Å; A281-V283 PolarHBondContact O-N 2.9Å; V283-C286 PolarHBondContact O-N 2.86Å; V283-N287 PolarHBondContact O-ND2 2.87Å; V283-L333 HydrophobicContact CG2-CD1 4.36Å; V283-L333 HydrophobicContact CG2-CD2 3.84Å
284I87.6Confident83.4Confident89 Ų8944.7 Ų44.746%0.45626%0.26SS..Hα-helixtrans-66.1-41.5174.4-61169.9000110.2Y255 T280 A281 S282 C286 N287 L288Y255-I284 HydrophobicContact CE1-CG2 4.43Å; T280-I284 PolarHBondContact O-N 2.93Å; A281-I284 WeakPolarHBondContact O-CB 3.26Å; A281-I284 PolarHBondContact O-N 3.22Å; A281-I284 VanDerWaalsContact O-N 3.16Å; S282-I284 VanDerWaalsContact C-N 3.32Å; S282-I284 PolarHBondContact O-N 3.45Å; I284-C286 VanDerWaalsContact C-N 3.3Å; I284-C286 PolarHBondContact O-N 3.39Å; I284-N287 WeakPolarHBondContact O-CB 3.4Å; I284-N287 PolarHBondContact O-N 3.08Å; I284-L288 HydrophobicContact CG2-CD1 3.98Å; I284-L288 HydrophobicContact CG2-CG 4.27Å; I284-L288 PolarHBondContact O-N 3.45Å
285Q87.1Confident83.2Confident0 Ų043 Ų430%026%0.255CS..Hα-helixtrans-53.6-45.4174.3-180-168.6-2600111.5Y255 V256 A281 S282 N287 L288 L289 D325Y255-Q285 HydrophobicContact CD1-CB 4.16Å; Y255-Q285 HydrophobicContact CD1-CG 4.49Å; Y255-Q285 HydrophobicContact CE1-CB 3.91Å; V256-Q285 HydrophobicContact CG2-CG 3.77Å; A281-Q285 PolarHBondContact O-N 3.09Å; S282-Q285 VanDerWaalsContact O-CB 3.32Å; S282-Q285 WeakPolarHBondContact O-CB 3.23Å; S282-Q285 PolarHBondContact O-N 3.42Å; Q285-N287 PolarHBondContact O-N 2.76Å; Q285-L288 PolarHBondContact O-N 2.83Å; Q285-L288 VanDerWaalsContact O-N 3.1Å; Q285-L289 HydrophobicContact CG-CD1 4.25Å; Q285-L289 HydrophobicContact CG-CG 4.45Å; Q285-L289 WeakPolarHBondContact O-CG 3.28Å; Q285-L289 PolarHBondContact O-N 3.49Å; Q285-D325 PolarHBondContact NE2-OD2 3.39Å
286C83.6Confident82.9Confident30 Ų3042.6 Ų42.620%0.20325%0.253CS..Hα-helixtrans-57.7-36.3177.5-67.70000113.1S282 V283 I284 L326S282-C286 PolarHBondContact O-N 2.88Å; S282-C286 PolarHBondContact O-SG 3.43Å; S282-C286 VanDerWaalsContact O-SG 3.35Å; V283-C286 PolarHBondContact O-N 2.86Å; I284-C286 VanDerWaalsContact C-N 3.3Å; I284-C286 PolarHBondContact O-N 3.39Å; C286-L326 HydrophobicContact CB-CD1 4.07Å
287N85.2Confident82.8Confident119 Ų11942.3 Ų42.364%0.63625%0.248SC*.Hα-helixtrans-74-40176.4-68.9-73.2000111.5V283 I284 Q285 L289 G290V283-N287 PolarHBondContact O-ND2 2.87Å; I284-N287 WeakPolarHBondContact O-CB 3.4Å; I284-N287 PolarHBondContact O-N 3.08Å; Q285-N287 PolarHBondContact O-N 2.76Å; N287-L289 PolarHBondContact O-N 3.16Å; N287-G290 PolarHBondContact O-N 2.61Å
288L85.6Confident82.5Confident38 Ų3844.2 Ų44.220%0.19925%0.247CC..Hα-helixtrans-68.3-32.2179.8-69.9175.7000113.1V252 Y255 I284 Q285 G290 L291 P292V252-L288 HydrophobicContact CG2-CB 4.39Å; Y255-L288 HydrophobicContact CD1-CD1 3.83Å; Y255-L288 HydrophobicContact CE1-CD1 3.85Å; Y255-L288 HydrophobicContact CG-CD1 4.19Å; I284-L288 HydrophobicContact CG2-CD1 3.98Å; I284-L288 HydrophobicContact CG2-CG 4.27Å; I284-L288 PolarHBondContact O-N 3.45Å; Q285-L288 PolarHBondContact O-N 2.83Å; Q285-L288 VanDerWaalsContact O-N 3.1Å; L288-G290 PolarHBondContact O-N 2.78Å; L288-G290 VanDerWaalsContact O-N 3.16Å; L288-L291 HydrophobicContact CD2-CD1 4.12Å; L288-L291 WeakPolarHBondContact O-CB 3.36Å; L288-L291 PolarHBondContact O-N 3.35Å; L288-L291 VanDerWaalsContact O-N 3.08Å; L288-P292 VanDerWaalsContact O-CD 3.23Å; L288-P292 WeakPolarHBondContact O-CD 3.23Å
289L82.9Confident81.9Confident0 Ų046 Ų460%026%0.259CS..THydrogen-bonded Turntrans-60.3-20.4173.3-74.9166.1000113I230 V252 Q285 N287 L291 P292 I293 C322 D325 L326I230-L289 HydrophobicContact CD1-CD2 4.44Å; V252-L289 HydrophobicContact CG1-CD2 3.89Å; V252-L289 HydrophobicContact CG1-CG 4.48Å; Q285-L289 HydrophobicContact CG-CD1 4.25Å; Q285-L289 HydrophobicContact CG-CG 4.45Å; Q285-L289 WeakPolarHBondContact O-CG 3.28Å; Q285-L289 PolarHBondContact O-N 3.49Å; N287-L289 PolarHBondContact O-N 3.16Å; L289-L291 VanDerWaalsContact C-N 3.28Å; L289-L291 PolarHBondContact O-N 3.2Å; L289-P292 VanDerWaalsContact O-CD 3.26Å; L289-P292 WeakPolarHBondContact O-CD 3.37Å; L289-P292 VanDerWaalsContact O-CG 3.28Å; L289-P292 WeakPolarHBondContact O-CG 3.48Å; L289-I293 WeakPolarHBondContact O-CD1 3.16Å; L289-I293 VanDerWaalsContact O-CG1 3.3Å; L289-I293 WeakPolarHBondContact O-CG1 3.34Å; L289-C322 HydrophobicContact CD2-CB 4.34Å; L289-D325 HydrophobicContact CD1-CB 4.38Å; L289-D325 WeakPolarHBondContact CD1-OD2 3.36Å; L289-L326 HydrophobicContact CD1-CB 4.47Å; L289-L326 HydrophobicContact CD1-CD1 4.43Å
290G82.3Confident81.3Confident36 Ų3647.5 Ų47.537%0.37127%0.268SS..Hα-helixtrans-65.9-28.817400000113.5N287 L288 F294N287-G290 PolarHBondContact O-N 2.61Å; L288-G290 PolarHBondContact O-N 2.78Å; L288-G290 VanDerWaalsContact O-N 3.16Å; G290-F294 VanDerWaalsContact O-CB 3.26Å; G290-F294 WeakPolarHBondContact O-CB 3.21Å; G290-F294 PolarHBondContact O-N 3.4Å
291L82Confident80.7Confident81 Ų8151.3 Ų51.342%0.42428%0.281SS..Hα-helixtrans-64.7-54.7-179.6-61.4175.5000113.1L288 L289 I293 F294 A295L288-L291 HydrophobicContact CD2-CD1 4.12Å; L288-L291 WeakPolarHBondContact O-CB 3.36Å; L288-L291 PolarHBondContact O-N 3.35Å; L288-L291 VanDerWaalsContact O-N 3.08Å; L289-L291 VanDerWaalsContact C-N 3.28Å; L289-L291 PolarHBondContact O-N 3.2Å; L291-I293 VanDerWaalsContact C-N 3.28Å; L291-I293 PolarHBondContact O-N 3.39Å; L291-F294 PolarHBondContact O-N 3.12Å; L291-A295 WeakPolarHBondContact O-CB 3.18Å; L291-A295 PolarHBondContact O-N 3.18Å
292P78.6Confident79.8Confident1 Ų158 Ų581%0.00631%0.306CS..Hα-helixtrans-64.8-33.2178.826.2-36.4000112.2D249 V252 L288 L289 S296 I318D249-P292 WeakPolarHBondContact OD1-CB 3.16Å; V252-P292 HydrophobicContact CG1-CG 4.36Å; L288-P292 VanDerWaalsContact O-CD 3.23Å; L288-P292 WeakPolarHBondContact O-CD 3.23Å; L289-P292 VanDerWaalsContact O-CD 3.26Å; L289-P292 WeakPolarHBondContact O-CD 3.37Å; L289-P292 VanDerWaalsContact O-CG 3.28Å; L289-P292 WeakPolarHBondContact O-CG 3.48Å; P292-S296 VanDerWaalsContact O-CB 3.25Å; P292-S296 WeakPolarHBondContact O-CB 3.32Å; P292-S296 PolarHBondContact O-N 2.97Å; P292-S296 PolarHBondContact O-OG 2.86Å; P292-I318 HydrophobicContact CB-CD1 4.39Å
293I80.5Confident78.7Confident28 Ų2859.1 Ų59.114%0.14432%0.316CS..Hα-helixtrans-63.6-50.2174.3-64.7170000109.9L289 L291 S296 L297 C322 L323L289-I293 WeakPolarHBondContact O-CD1 3.16Å; L289-I293 VanDerWaalsContact O-CG1 3.3Å; L289-I293 WeakPolarHBondContact O-CG1 3.34Å; L291-I293 VanDerWaalsContact C-N 3.28Å; L291-I293 PolarHBondContact O-N 3.39Å; I293-S296 PolarHBondContact O-N 2.89Å; I293-L297 HydrophobicContact CG2-CD1 3.84Å; I293-L297 HydrophobicContact CG2-CG 4.36Å; I293-L297 WeakPolarHBondContact O-CB 3.34Å; I293-L297 VanDerWaalsContact O-CG 3.28Å; I293-L297 WeakPolarHBondContact O-CG 3.48Å; I293-L297 PolarHBondContact O-N 3.28Å; I293-C322 HydrophobicContact CD1-CB 3.86Å; I293-C322 HydrophobicContact CG1-CB 3.6Å; I293-L323 HydrophobicContact CD1-CD2 4.37Å
294F80.3Confident77.5Confident121 Ų12160.7 Ų60.753%0.53132%0.322SS..Hα-helixtrans-63.9-43.8-179.7-173.6-103.5000112G290 L291 S296 L297 Q298G290-F294 VanDerWaalsContact O-CB 3.26Å; G290-F294 WeakPolarHBondContact O-CB 3.21Å; G290-F294 PolarHBondContact O-N 3.4Å; L291-F294 PolarHBondContact O-N 3.12Å; F294-S296 VanDerWaalsContact C-N 3.34Å; F294-S296 PolarHBondContact O-N 3.28Å; F294-L297 PolarHBondContact O-N 3.43Å; F294-Q298 HydrophobicContact CD1-CG 4.28Å; F294-Q298 HydrophobicContact CE1-CG 4.03Å; F294-Q298 HydrophobicContact CZ-CG 4.17Å; F294-Q298 WeakPolarHBondContact O-CB 3.34Å; F294-Q298 WeakPolarHBondContact O-CG 3.44Å; F294-Q298 PolarHBondContact O-N 3.45Å
295A76.9Confident76.1Confident28 Ų2863 Ų6323%0.23134%0.34CS..Hα-helixtrans-60.3-43.8176.500000111.9A245 L291 Q298 S299A245-A295 HydrophobicContact CB-CB 4.44Å; L291-A295 WeakPolarHBondContact O-CB 3.18Å; L291-A295 PolarHBondContact O-N 3.18Å; A295-Q298 PolarHBondContact O-N 2.98Å; A295-S299 WeakPolarHBondContact O-CB 3.37Å; A295-S299 PolarHBondContact O-N 3.39Å
296S75.6Confident74.6Confident0 Ų070 Ų700%038%0.378CS..Hα-helixtrans-69.5-39.9179.1-54.10000111.8R237 P292 I293 F294 S299 L300 I318 V319R237-S296 PolarHBondContact NH1-OG 3.44Å; R237-S296 PolarHBondContact NH2-OG 3.23Å; P292-S296 VanDerWaalsContact O-CB 3.25Å; P292-S296 WeakPolarHBondContact O-CB 3.32Å; P292-S296 PolarHBondContact O-N 2.97Å; P292-S296 PolarHBondContact O-OG 2.86Å; I293-S296 PolarHBondContact O-N 2.89Å; F294-S296 VanDerWaalsContact C-N 3.34Å; F294-S296 PolarHBondContact O-N 3.28Å; S296-S299 WeakPolarHBondContact O-CB 3.46Å; S296-S299 PolarHBondContact O-N 3.02Å; S296-L300 WeakPolarHBondContact O-CD1 3.47Å; S296-L300 PolarHBondContact O-N 3.36Å; S296-I318 WeakPolarHBondContact OG-CG2 3.34Å; S296-V319 VanDerWaalsContact CB-CG2 3.47Å
297L77.7Confident73.5Confident82 Ų8270.7 Ų70.743%0.42938%0.38SS..Hα-helixtrans-64.8-39.3174.5-71.9174.3000112.1I293 F294 S299 L300 Q301I293-L297 HydrophobicContact CG2-CD1 3.84Å; I293-L297 HydrophobicContact CG2-CG 4.36Å; I293-L297 WeakPolarHBondContact O-CB 3.34Å; I293-L297 VanDerWaalsContact O-CG 3.28Å; I293-L297 WeakPolarHBondContact O-CG 3.48Å; I293-L297 PolarHBondContact O-N 3.28Å; F294-L297 PolarHBondContact O-N 3.43Å; L297-S299 VanDerWaalsContact C-N 3.33Å; L297-L300 PolarHBondContact O-N 3.44Å; L297-Q301 WeakPolarHBondContact O-CB 3.46Å; L297-Q301 WeakPolarHBondContact O-CG 3.28Å; L297-Q301 PolarHBondContact O-N 2.87Å
298Q77.5Confident72.5Confident77 Ų7767.4 Ų67.436%0.3637%0.37SS..Hα-helixtrans-65.4-38.1173.4-75.7-163.5-17.800112.2F294 A295 Q301 K302F294-Q298 HydrophobicContact CD1-CG 4.28Å; F294-Q298 HydrophobicContact CE1-CG 4.03Å; F294-Q298 HydrophobicContact CZ-CG 4.17Å; F294-Q298 WeakPolarHBondContact O-CB 3.34Å; F294-Q298 WeakPolarHBondContact O-CG 3.44Å; F294-Q298 PolarHBondContact O-N 3.45Å; A295-Q298 PolarHBondContact O-N 2.98Å; Q298-Q301 PolarHBondContact O-N 3.15Å; Q298-K302 WeakPolarHBondContact O-CB 3.27Å; Q298-K302 WeakPolarHBondContact O-CG 3.42Å; Q298-K302 PolarHBondContact O-N 2.87Å
299S70.9Confident71.8Confident36 Ų3669 Ų6925%0.25239%0.388SS..Hα-helixtrans-59.6-51.1172.6-176.60000110.2A295 S296 L297 Q301 K302 A303 D315A295-S299 WeakPolarHBondContact O-CB 3.37Å; A295-S299 PolarHBondContact O-N 3.39Å; S296-S299 WeakPolarHBondContact O-CB 3.46Å; S296-S299 PolarHBondContact O-N 3.02Å; L297-S299 VanDerWaalsContact C-N 3.33Å; S299-Q301 VanDerWaalsContact C-N 3.32Å; S299-Q301 PolarHBondContact O-N 3.18Å; S299-K302 CarbonylContact O-C 3.59Å; S299-K302 PolarHBondContact O-N 3.41Å; S299-K302 VanDerWaalsContact O-N 3.17Å; S299-A303 WeakPolarHBondContact O-CB 3.41Å; S299-A303 PolarHBondContact O-N 3.25Å; S299-D315 WeakPolarHBondContact CB-OD2 3.44Å; S299-D315 PolarHBondContact OG-OD2 2.78Å
300L71.9Confident71.2Confident59 Ų5975.7 Ų75.731%0.30942%0.42SS..Hα-helixtrans-58.4-39176.2-9478.1000113.2S296 L297 A303 Y312 D315 I316S296-L300 WeakPolarHBondContact O-CD1 3.47Å; S296-L300 PolarHBondContact O-N 3.36Å; L297-L300 PolarHBondContact O-N 3.44Å; L300-A303 WeakPolarHBondContact O-CB 3.37Å; L300-A303 PolarHBondContact O-N 3.4Å; L300-Y312 HydrophobicContact CG-CD1 4.44Å; L300-D315 HydrophobicContact CD1-CB 3.28Å; L300-I316 HydrophobicContact CD2-CG1 4.35Å
301Q73.3Confident70.7Confident165 Ų16576.7 Ų76.777%0.77141%0.414SS*.Hα-helixtrans-71-31.6179-77.7-177.8-22.400113.3L297 Q298 S299 A303L297-Q301 WeakPolarHBondContact O-CB 3.46Å; L297-Q301 WeakPolarHBondContact O-CG 3.28Å; L297-Q301 PolarHBondContact O-N 2.87Å; Q298-Q301 PolarHBondContact O-N 3.15Å; S299-Q301 VanDerWaalsContact C-N 3.32Å; S299-Q301 PolarHBondContact O-N 3.18Å; Q301-A303 VanDerWaalsContact C-N 3.33Å
302K67.8Low70.3Confident155 Ų15576.1 Ų76.167%0.67441%0.407SS*.Hα-helixtrans-89.7-2.4177.7-70.1179.4179.6176.60112.9Q298 S299 D304Q298-K302 WeakPolarHBondContact O-CB 3.27Å; Q298-K302 WeakPolarHBondContact O-CG 3.42Å; Q298-K302 PolarHBondContact O-N 2.87Å; S299-K302 CarbonylContact O-C 3.59Å; S299-K302 PolarHBondContact O-N 3.41Å; S299-K302 VanDerWaalsContact O-N 3.17Å; K302-D304 PolarHBondContact O-N 2.91Å; K302-D304 VanDerWaalsContact O-N 3.11Å
303A60.4Low70.4Confident25 Ų2580.7 Ų80.721%0.20744%0.435CS..  trans-72.5108.5-173.300000109.5S299 L300 Q301 T307 Y312S299-A303 WeakPolarHBondContact O-CB 3.41Å; S299-A303 PolarHBondContact O-N 3.25Å; L300-A303 WeakPolarHBondContact O-CB 3.37Å; L300-A303 PolarHBondContact O-N 3.4Å; Q301-A303 VanDerWaalsContact C-N 3.33Å; A303-T307 HydrophobicContact CB-CG2 4.34Å; A303-T307 WeakPolarHBondContact CB-OG1 3.25Å; A303-Y312 HydrophobicContact CB-CD1 4.35Å; A303-Y312 HydrophobicContact CB-CE1 3.3Å; A303-Y312 HydrophobicContact CB-CE2 4.28Å; A303-Y312 WeakPolarHBondContact CB-OH 3.45Å; A303-Y312 PolarHBondContact O-OH 3.06Å
304D60.9Low70.5Confident105 Ų10580.6 Ų80.656%0.56144%0.435SS*.  trans-81166.9176.6-161.7-3.7000110K302 N306 T307 Y312K302-D304 PolarHBondContact O-N 2.91Å; K302-D304 VanDerWaalsContact O-N 3.11Å; D304-N306 PolarHBondContact O-N 2.9Å; D304-T307 PolarHBondContact N-OG1 3.45Å; D304-T307 PolarHBondContact O-N 3.41Å; D304-T307 PolarHBondContact O-OG1 3.37Å; D304-Y312 PolarHBondContact O-OH 2.91Å
305V57.6Low70.4Confident136 Ų13675 Ų7582%0.82441%0.411SS*.THydrogen-bonded Turntrans-54.9-21.5179.6-173.90000112.5
306N56.3Low70.7Confident149 Ų14978.1 Ų78.180%0.79742%0.423SS*.THydrogen-bonded Turntrans-89.7-1178.5-66-30.1000115D304 A308D304-N306 PolarHBondContact O-N 2.9Å; N306-A308 PolarHBondContact O-N 3.38Å
307T60.2Low71.2Confident43 Ų4383.2 Ų83.226%0.26445%0.445SS..SBendtrans-71130.917429.70000110.1A303 D304 A309 Y312A303-T307 HydrophobicContact CB-CG2 4.34Å; A303-T307 WeakPolarHBondContact CB-OG1 3.25Å; D304-T307 PolarHBondContact N-OG1 3.45Å; D304-T307 PolarHBondContact O-N 3.41Å; D304-T307 PolarHBondContact O-OG1 3.37Å; T307-A309 PolarHBondContact O-N 2.91Å; T307-Y312 WeakPolarHBondContact OG1-CE2 3.3Å; T307-Y312 VanDerWaalsContact OG1-CZ 3.25Å; T307-Y312 PolarHBondContact OG1-OH 2.88Å
308A63.6Low71.6Confident51 Ų5179.3 Ų79.342%0.42143%0.425SS..  trans-59.6130.1-176.500000109.9N306 H310 Q311N306-A308 PolarHBondContact O-N 3.38Å; A308-H310 PolarHBondContact O-N 3.35Å; A308-Q311 WeakPolarHBondContact O-CB 3.39Å; A308-Q311 PolarHBondContact O-N 3.5Å
309A71.4Confident71.9Confident70 Ų7076.7 Ų76.758%0.57941%0.414SS*.Hα-helixtrans-48.7-32.5178.700000113T307 Q311 Y312 V313T307-A309 PolarHBondContact O-N 2.91Å; A309-Q311 VanDerWaalsContact C-N 3.31Å; A309-Q311 PolarHBondContact O-N 3.33Å; A309-Y312 PolarHBondContact O-N 2.94Å; A309-V313 WeakPolarHBondContact O-CG2 3.21Å; A309-V313 PolarHBondContact O-N 2.92Å
310H70.2Confident72.8Confident142 Ų14278.3 Ų78.366%0.65742%0.422SS*.Hα-helixtrans-61.1-33.5175.9-60-60.1000113.9A308 V314A308-H310 PolarHBondContact O-N 3.35Å; H310-V314 VanDerWaalsContact O-CG2 3.27Å; H310-V314 WeakPolarHBondContact O-CG2 3.16Å; H310-V314 PolarHBondContact O-N 2.67Å; H310-V314 VanDerWaalsContact O-N 3.14Å
311Q71.3Confident73.6Confident56 Ų5676.5 Ų76.526%0.26241%0.413SS..Hα-helixtrans-68.4-43.6177-69.5177.5-28.900110.9A308 A309 V313 V314 D315A308-Q311 WeakPolarHBondContact O-CB 3.39Å; A308-Q311 PolarHBondContact O-N 3.5Å; A309-Q311 VanDerWaalsContact C-N 3.31Å; A309-Q311 PolarHBondContact O-N 3.33Å; Q311-V313 VanDerWaalsContact C-N 3.35Å; Q311-V313 PolarHBondContact O-N 3.38Å; Q311-V314 PolarHBondContact O-N 3.33Å; Q311-D315 WeakPolarHBondContact O-CB 3.35Å; Q311-D315 PolarHBondContact O-N 2.87Å; Q311-D315 VanDerWaalsContact O-OD1 3.08Å
312Y73.6Confident74.2Confident70 Ų7068.7 Ų68.728%0.27538%0.376SS..Hα-helixtrans-59.5-43.8174.9-70.5-82.2000112.8L300 A303 D304 T307 A309 V314 D315 I316L300-Y312 HydrophobicContact CG-CD1 4.44Å; A303-Y312 HydrophobicContact CB-CD1 4.35Å; A303-Y312 HydrophobicContact CB-CE1 3.3Å; A303-Y312 HydrophobicContact CB-CE2 4.28Å; A303-Y312 WeakPolarHBondContact CB-OH 3.45Å; A303-Y312 PolarHBondContact O-OH 3.06Å; D304-Y312 PolarHBondContact O-OH 2.91Å; T307-Y312 WeakPolarHBondContact OG1-CE2 3.3Å; T307-Y312 VanDerWaalsContact OG1-CZ 3.25Å; T307-Y312 PolarHBondContact OG1-OH 2.88Å; A309-Y312 PolarHBondContact O-N 2.94Å; Y312-V314 VanDerWaalsContact C-N 3.33Å; Y312-V314 PolarHBondContact O-N 3.37Å; Y312-D315 PolarHBondContact O-N 3.42Å; Y312-I316 WeakPolarHBondContact O-CB 3.43Å; Y312-I316 WeakPolarHBondContact O-CD1 3.41Å; Y312-I316 WeakPolarHBondContact O-CG1 3.42Å; Y312-I316 PolarHBondContact O-N 2.89Å
313V81Confident75.2Confident97 Ų9765.7 Ų65.759%0.58837%0.367SS*.Hα-helixtrans-62.9-43.3-180175.30000110.5A309 Q311 F317A309-V313 WeakPolarHBondContact O-CG2 3.21Å; A309-V313 PolarHBondContact O-N 2.92Å; Q311-V313 VanDerWaalsContact C-N 3.35Å; Q311-V313 PolarHBondContact O-N 3.38Å; V313-F317 WeakPolarHBondContact O-CB 3.44Å; V313-F317 PolarHBondContact O-N 2.81Å
314V81.8Confident76.7Confident25 Ų2567.4 Ų67.415%0.15238%0.377CS..Hα-helixtrans-64.9-42.4176.81740000111R237 L240 H310 Q311 Y312 F317 I318R237-V314 HydrophobicContact CB-CG1 4.33Å; L240-V314 HydrophobicContact CD1-CG2 4.28Å; H310-V314 VanDerWaalsContact O-CG2 3.27Å; H310-V314 WeakPolarHBondContact O-CG2 3.16Å; H310-V314 PolarHBondContact O-N 2.67Å; H310-V314 VanDerWaalsContact O-N 3.14Å; Q311-V314 PolarHBondContact O-N 3.33Å; Y312-V314 VanDerWaalsContact C-N 3.33Å; Y312-V314 PolarHBondContact O-N 3.37Å; V314-F317 PolarHBondContact O-N 3.44Å; V314-I318 WeakPolarHBondContact O-CG2 3.46Å; V314-I318 PolarHBondContact O-N 3.21Å
315D79.3Confident77.9Confident5 Ų562.4 Ų62.43%0.02735%0.35CS..Hα-helixtrans-67.4-40.9-179.2-67.44.7000112.2R237 S299 L300 Q311 Y312 F317 I318 V319R237-D315 IonicContact CZ-OD1 2.71Å; R237-D315 IonicContact NE-OD1 3.87Å; R237-D315 PolarHBondContact NE-OD1 3.34Å; R237-D315 IonicContact NH2-OD1 3.49Å; R237-D315 PolarHBondContact NH2-OD1 2.96Å; R237-D315 IonicContact NH2-OD2 3.65Å; S299-D315 WeakPolarHBondContact CB-OD2 3.44Å; S299-D315 PolarHBondContact OG-OD2 2.78Å; L300-D315 HydrophobicContact CD1-CB 3.28Å; Q311-D315 WeakPolarHBondContact O-CB 3.35Å; Q311-D315 PolarHBondContact O-N 2.87Å; Q311-D315 VanDerWaalsContact O-OD1 3.08Å; Y312-D315 PolarHBondContact O-N 3.42Å; D315-F317 VanDerWaalsContact C-N 3.34Å; D315-I318 WeakPolarHBondContact O-CG2 3.1Å; D315-V319 WeakPolarHBondContact O-CG2 3.43Å; D315-V319 PolarHBondContact O-N 3.28Å; D315-V319 VanDerWaalsContact O-N 3.11Å
316I82.6Confident79.3Confident93 Ų9358.9 Ų58.948%0.47733%0.327SS..Hα-helixtrans-66.3-40.7174-68.2165.3000110.2L300 Y312 V319 T320L300-I316 HydrophobicContact CD2-CG1 4.35Å; Y312-I316 WeakPolarHBondContact O-CB 3.43Å; Y312-I316 WeakPolarHBondContact O-CD1 3.41Å; Y312-I316 WeakPolarHBondContact O-CG1 3.42Å; Y312-I316 PolarHBondContact O-N 2.89Å; I316-V319 PolarHBondContact O-N 2.84Å; I316-T320 WeakPolarHBondContact O-CB 3.47Å; I316-T320 PolarHBondContact O-N 3.11Å; I316-T320 PolarHBondContact O-OG1 3.41Å
317F86.3Confident80.8Confident106 Ų10654.2 Ų54.247%0.46531%0.309SS..Hα-helixtrans-65.4-44.6-179.8-169.7-107000111.7T233 V313 V314 D315 T320 L321T233-F317 HydrophobicContact CG2-CD1 3.42Å; T233-F317 VanDerWaalsContact CG2-CD1 3.42Å; T233-F317 HydrophobicContact CG2-CE1 3.45Å; T233-F317 VanDerWaalsContact CG2-CE1 3.45Å; V313-F317 WeakPolarHBondContact O-CB 3.44Å; V313-F317 PolarHBondContact O-N 2.81Å; V314-F317 PolarHBondContact O-N 3.44Å; D315-F317 VanDerWaalsContact C-N 3.34Å; F317-T320 PolarHBondContact O-N 3.39Å; F317-L321 HydrophobicContact CD1-CD1 3.72Å; F317-L321 HydrophobicContact CD1-CG 4.25Å; F317-L321 HydrophobicContact CE1-CD1 3.42Å; F317-L321 VanDerWaalsContact CE1-CD1 3.42Å; F317-L321 HydrophobicContact CE1-CD2 4.5Å; F317-L321 HydrophobicContact CE1-CG 4.05Å; F317-L321 HydrophobicContact CZ-CD1 4.07Å; F317-L321 HydrophobicContact CZ-CD2 4.34Å; F317-L321 HydrophobicContact CZ-CG 4.3Å; F317-L321 WeakPolarHBondContact O-CG 3.44Å; F317-L321 PolarHBondContact O-N 2.93Å
318I85Confident82.1Confident1 Ų153.6 Ų53.61%0.00530%0.304CS..Hα-helixtrans-66.3-39177.3-166.2168.6000112D249 P292 S296 V314 D315 T320 L321 C322D249-I318 HydrophobicContact CB-CD1 3.81Å; D249-I318 WeakPolarHBondContact OD1-CD1 3.38Å; P292-I318 HydrophobicContact CB-CD1 4.39Å; S296-I318 WeakPolarHBondContact OG-CG2 3.34Å; V314-I318 WeakPolarHBondContact O-CG2 3.46Å; V314-I318 PolarHBondContact O-N 3.21Å; D315-I318 WeakPolarHBondContact O-CG2 3.1Å; I318-T320 VanDerWaalsContact C-N 3.33Å; I318-T320 PolarHBondContact O-N 2.94Å; I318-L321 PolarHBondContact O-N 2.92Å; I318-C322 WeakPolarHBondContact O-CB 3.2Å; I318-C322 PolarHBondContact O-N 3.13Å; I318-C322 PolarHBondContact O-SG 3.48Å
319V85.5Confident83Confident22 Ų2251.2 Ų51.213%0.13328%0.284CS..Hα-helixtrans-61.3-45.2174.3170.70000110.2S296 D315 I316 L321 C322 L323S296-V319 VanDerWaalsContact CB-CG2 3.47Å; D315-V319 WeakPolarHBondContact O-CG2 3.43Å; D315-V319 PolarHBondContact O-N 3.28Å; D315-V319 VanDerWaalsContact O-N 3.11Å; I316-V319 PolarHBondContact O-N 2.84Å; V319-L321 PolarHBondContact O-N 3.12Å; V319-C322 PolarHBondContact O-N 2.9Å; V319-L323 HydrophobicContact CG1-CD1 3.9Å; V319-L323 HydrophobicContact CG1-CG 4.35Å; V319-L323 WeakPolarHBondContact O-CB 3.22Å; V319-L323 VanDerWaalsContact O-CG 3.27Å; V319-L323 WeakPolarHBondContact O-CG 3.31Å; V319-L323 PolarHBondContact O-N 3.05Å
320T88.6Confident83.6Confident69 Ų6950.5 Ų50.542%0.42328%0.278SS..Hα-helixtrans-62.2-45.4178.6-54.70000111.2I316 F317 I318 L323 C324I316-T320 WeakPolarHBondContact O-CB 3.47Å; I316-T320 PolarHBondContact O-N 3.11Å; I316-T320 PolarHBondContact O-OG1 3.41Å; F317-T320 PolarHBondContact O-N 3.39Å; I318-T320 VanDerWaalsContact C-N 3.33Å; I318-T320 PolarHBondContact O-N 2.94Å; T320-L323 PolarHBondContact O-N 3.28Å; T320-C324 WeakPolarHBondContact O-CB 3.36Å; T320-C324 PolarHBondContact O-N 3.36Å; T320-C324 PolarHBondContact O-SG 3.43Å
321L89Confident84.4Confident22 Ų2248 Ų4812%0.11527%0.269CS..Hα-helixtrans-61.9-44176.6-73178.6000112.3A229 I230 T233 F317 I318 V319 C324 D325A229-L321 HydrophobicContact CB-CD1 3.82Å; A229-L321 HydrophobicContact CB-CD2 4.18Å; I230-L321 HydrophobicContact CG1-CB 3.94Å; I230-L321 HydrophobicContact CG1-CD1 4.27Å; T233-L321 HydrophobicContact CG2-CD1 4.12Å; F317-L321 HydrophobicContact CD1-CD1 3.72Å; F317-L321 HydrophobicContact CD1-CG 4.25Å; F317-L321 HydrophobicContact CE1-CD1 3.42Å; F317-L321 VanDerWaalsContact CE1-CD1 3.42Å; F317-L321 HydrophobicContact CE1-CD2 4.5Å; F317-L321 HydrophobicContact CE1-CG 4.05Å; F317-L321 HydrophobicContact CZ-CD1 4.07Å; F317-L321 HydrophobicContact CZ-CD2 4.34Å; F317-L321 HydrophobicContact CZ-CG 4.3Å; F317-L321 WeakPolarHBondContact O-CG 3.44Å; F317-L321 PolarHBondContact O-N 2.93Å; I318-L321 PolarHBondContact O-N 2.92Å; V319-L321 PolarHBondContact O-N 3.12Å; L321-C324 PolarHBondContact O-N 2.91Å; L321-D325 PolarHBondContact O-N 3.49Å
322C86.2Confident84.9Confident0 Ų045.4 Ų45.40%026%0.257CS..Hα-helixtrans-65.7-39178.7-670000111.8L289 I293 I318 V319 D325 L326L289-C322 HydrophobicContact CD2-CB 4.34Å; I293-C322 HydrophobicContact CD1-CB 3.86Å; I293-C322 HydrophobicContact CG1-CB 3.6Å; I318-C322 WeakPolarHBondContact O-CB 3.2Å; I318-C322 PolarHBondContact O-N 3.13Å; I318-C322 PolarHBondContact O-SG 3.48Å; V319-C322 PolarHBondContact O-N 2.9Å; C322-D325 PolarHBondContact O-N 2.89Å; C322-L326 VanDerWaalsContact O-CB 3.31Å; C322-L326 WeakPolarHBondContact O-CB 3.38Å; C322-L326 PolarHBondContact O-N 3.24Å
323L89Confident85.2Confident92 Ų9243.9 Ų43.948%0.48225%0.253SS..Hα-helixtrans-65.8-40.9174.9-72.6173.8000111.8I293 V319 T320 L326 A327I293-L323 HydrophobicContact CD1-CD2 4.37Å; V319-L323 HydrophobicContact CG1-CD1 3.9Å; V319-L323 HydrophobicContact CG1-CG 4.35Å; V319-L323 WeakPolarHBondContact O-CB 3.22Å; V319-L323 VanDerWaalsContact O-CG 3.27Å; V319-L323 WeakPolarHBondContact O-CG 3.31Å; V319-L323 PolarHBondContact O-N 3.05Å; T320-L323 PolarHBondContact O-N 3.28Å; L323-L326 PolarHBondContact O-N 3.43Å; L323-A327 WeakPolarHBondContact O-CB 3.26Å; L323-A327 PolarHBondContact O-N 2.9Å
324C90.3Very high85.2Confident61 Ų6142.7 Ų42.741%0.41225%0.249SC..Hα-helixtrans-62.6-44.2174.3-72.60000111.9L226 T320 L321 A327 L328L226-C324 HydrophobicContact CD2-CB 3.71Å; T320-C324 WeakPolarHBondContact O-CB 3.36Å; T320-C324 PolarHBondContact O-N 3.36Å; T320-C324 PolarHBondContact O-SG 3.43Å; L321-C324 PolarHBondContact O-N 2.91Å; C324-A327 PolarHBondContact O-N 3.27Å; C324-L328 WeakPolarHBondContact O-CG 3.36Å; C324-L328 PolarHBondContact O-N 3.11Å
325D87.8Confident85Confident0 Ų045 Ų450%026%0.256CS..Hα-helixtrans-66.2-39.2177.2-170.543.2000111.6Q223 L226 I230 Q285 L289 L321 C322 A327 L328 A329Q223-D325 PolarHBondContact NE2-OD1 2.9Å; Q223-D325 VanDerWaalsContact NE2-OD1 3.16Å; L226-D325 HydrophobicContact CD2-CB 3.98Å; I230-D325 HydrophobicContact CD1-CB 4.45Å; Q285-D325 PolarHBondContact NE2-OD2 3.39Å; L289-D325 HydrophobicContact CD1-CB 4.38Å; L289-D325 WeakPolarHBondContact CD1-OD2 3.36Å; L321-D325 PolarHBondContact O-N 3.49Å; C322-D325 PolarHBondContact O-N 2.89Å; D325-A327 VanDerWaalsContact C-N 3.35Å; D325-A327 PolarHBondContact O-N 3.37Å; D325-L328 PolarHBondContact O-N 3.17Å; D325-A329 VanDerWaalsContact O-CB 3.29Å; D325-A329 WeakPolarHBondContact O-CB 3.1Å; D325-A329 PolarHBondContact O-N 3.33Å
326L86.4Confident84.6Confident63 Ų6345.4 Ų45.433%0.3326%0.259SS..Hα-helixtrans-62.3-41.4174.8-171.967.9000111.9C286 L289 C322 L323 A329 A330C286-L326 HydrophobicContact CB-CD1 4.07Å; L289-L326 HydrophobicContact CD1-CB 4.47Å; L289-L326 HydrophobicContact CD1-CD1 4.43Å; C322-L326 VanDerWaalsContact O-CB 3.31Å; C322-L326 WeakPolarHBondContact O-CB 3.38Å; C322-L326 PolarHBondContact O-N 3.24Å; L323-L326 PolarHBondContact O-N 3.43Å; L326-A329 PolarHBondContact O-N 2.88Å; L326-A330 WeakPolarHBondContact O-CB 3.36Å; L326-A330 PolarHBondContact O-N 2.93Å
327A87.7Confident84.2Confident51 Ų5144.7 Ų44.742%0.42126%0.261SS..Hα-helixtrans-64-44.6175.600000111.6L323 C324 D325 A330 I331L323-A327 WeakPolarHBondContact O-CB 3.26Å; L323-A327 PolarHBondContact O-N 2.9Å; C324-A327 PolarHBondContact O-N 3.27Å; D325-A327 VanDerWaalsContact C-N 3.35Å; D325-A327 PolarHBondContact O-N 3.37Å; A327-A330 PolarHBondContact O-N 3.44Å; A327-I331 WeakPolarHBondContact O-CD1 3.36Å; A327-I331 VanDerWaalsContact O-CG1 3.25Å; A327-I331 WeakPolarHBondContact O-CG1 3.37Å; A327-I331 PolarHBondContact O-N 3.01Å
328L86.6Confident83.6Confident30 Ų3045.5 Ų45.516%0.15727%0.265CS..Hα-helixtrans-65.2-38.9176.3-71.9174.2000112.4I219 L222 Q223 L226 C324 D325 I331 S332I219-L328 HydrophobicContact CG2-CB 4.48Å; L222-L328 HydrophobicContact CD2-CD1 3.66Å; L222-L328 HydrophobicContact CD2-CD2 4.02Å; L222-L328 HydrophobicContact CG-CD1 3.92Å; Q223-L328 HydrophobicContact CG-CB 3.93Å; Q223-L328 HydrophobicContact CG-CD1 4.19Å; L226-L328 HydrophobicContact CD1-CD1 4.22Å; L226-L328 HydrophobicContact CD2-CD1 3.98Å; C324-L328 WeakPolarHBondContact O-CG 3.36Å; C324-L328 PolarHBondContact O-N 3.11Å; D325-L328 PolarHBondContact O-N 3.17Å; L328-I331 PolarHBondContact O-N 3.28Å; L328-S332 WeakPolarHBondContact O-CB 3.4Å; L328-S332 PolarHBondContact O-N 3.13Å; L328-S332 PolarHBondContact O-OG 3.37Å
329A83.8Confident82.7Confident0 Ų047.1 Ų47.10%027%0.274CS..Hα-helixtrans-65.3-40.617500000111.5D325 L326 S332 L333D325-A329 VanDerWaalsContact O-CB 3.29Å; D325-A329 WeakPolarHBondContact O-CB 3.1Å; D325-A329 PolarHBondContact O-N 3.33Å; L326-A329 PolarHBondContact O-N 2.88Å; A329-S332 PolarHBondContact O-N 3.48Å; A329-S332 PolarHBondContact O-OG 2.74Å; A329-L333 VanDerWaalsContact O-CB 3.29Å; A329-L333 WeakPolarHBondContact O-CB 3.2Å; A329-L333 WeakPolarHBondContact O-CD1 3.18Å; A329-L333 VanDerWaalsContact O-CG 3.24Å; A329-L333 WeakPolarHBondContact O-CG 3.35Å; A329-L333 PolarHBondContact O-N 2.89Å
330A84.3Confident81.8Confident56 Ų5650 Ų5046%0.46329%0.292SS..Hα-helixtrans-63.4-42.8174.400000111.6L326 A327 S334L326-A330 WeakPolarHBondContact O-CB 3.36Å; L326-A330 PolarHBondContact O-N 2.93Å; A327-A330 PolarHBondContact O-N 3.44Å; A330-S334 VanDerWaalsContact O-CB 3.29Å; A330-S334 WeakPolarHBondContact O-CB 3.37Å; A330-S334 PolarHBondContact O-N 3.27Å; A330-S334 PolarHBondContact O-OG 3.49Å
331I85.4Confident80.7Confident89 Ų8948.8 Ų48.846%0.45629%0.289SS..Hα-helixtrans-62.4-48175.6-67.4163.1000110.2I219 A327 L328 L333 S334 Y335I219-I331 HydrophobicContact CD1-CG2 4.31Å; A327-I331 WeakPolarHBondContact O-CD1 3.36Å; A327-I331 VanDerWaalsContact O-CG1 3.25Å; A327-I331 WeakPolarHBondContact O-CG1 3.37Å; A327-I331 PolarHBondContact O-N 3.01Å; L328-I331 PolarHBondContact O-N 3.28Å; I331-L333 PolarHBondContact O-N 3.45Å; I331-S334 PolarHBondContact O-N 2.71Å; I331-S334 PolarHBondContact O-OG 2.9Å; I331-Y335 WeakPolarHBondContact O-CB 3.22Å; I331-Y335 PolarHBondContact O-N 3.11Å
332S82.2Confident79.3Confident2 Ų249.1 Ų49.11%0.01430%0.298CS..Hα-helixtrans-64.5-42.6-178.974.60000111.9L328 A329 Y335 S336L328-S332 WeakPolarHBondContact O-CB 3.4Å; L328-S332 PolarHBondContact O-N 3.13Å; L328-S332 PolarHBondContact O-OG 3.37Å; A329-S332 PolarHBondContact O-N 3.48Å; A329-S332 PolarHBondContact O-OG 2.74Å; S332-Y335 PolarHBondContact O-N 3.06Å; S332-S336 PolarHBondContact O-N 3.37Å; S332-S336 PolarHBondContact O-OG 3.48Å
333L81.5Confident78Confident38 Ų3854.1 Ų54.120%0.19932%0.32CS..Hα-helixtrans-62.7-43.8174.4-74.7166.7000111.6Y279 V283 A329 I331 Y335 S336 C337Y279-L333 HydrophobicContact CD1-CD2 4.37Å; V283-L333 HydrophobicContact CG2-CD1 4.36Å; V283-L333 HydrophobicContact CG2-CD2 3.84Å; A329-L333 VanDerWaalsContact O-CB 3.29Å; A329-L333 WeakPolarHBondContact O-CB 3.2Å; A329-L333 WeakPolarHBondContact O-CD1 3.18Å; A329-L333 VanDerWaalsContact O-CG 3.24Å; A329-L333 WeakPolarHBondContact O-CG 3.35Å; A329-L333 PolarHBondContact O-N 2.89Å; I331-L333 PolarHBondContact O-N 3.45Å; L333-Y335 VanDerWaalsContact C-N 3.31Å; L333-Y335 PolarHBondContact O-N 3.25Å; L333-S336 PolarHBondContact O-N 2.67Å; L333-C337 WeakPolarHBondContact O-CB 3.49Å; L333-C337 PolarHBondContact O-N 2.63Å; L333-C337 PolarHBondContact O-SG 2.92Å
334S81Confident76.3Confident72 Ų7255.6 Ų55.650%0.50333%0.327SS..Hα-helixtrans-61.5-40.7177.975.40000111.9A330 I331 C337 F338A330-S334 VanDerWaalsContact O-CB 3.29Å; A330-S334 WeakPolarHBondContact O-CB 3.37Å; A330-S334 PolarHBondContact O-N 3.27Å; A330-S334 PolarHBondContact O-OG 3.49Å; I331-S334 PolarHBondContact O-N 2.71Å; I331-S334 PolarHBondContact O-OG 2.9Å; S334-C337 PolarHBondContact O-N 3.01Å; S334-F338 WeakPolarHBondContact O-CB 3.45Å; S334-F338 PolarHBondContact O-N 3.38Å
335Y75.7Confident74.3Confident74 Ų7461.1 Ų61.129%0.2934%0.34SS..Hα-helixtrans-66.4-40.6178-170.9-111.8000111.8F212 P215 I331 S332 L333 F338 V339F212-Y335 HydrophobicContact CD2-CD1 4.19Å; F212-Y335 AromaticContact CD2-CE1 3.27Å; F212-Y335 HydrophobicContact CD2-CE1 3.27Å; F212-Y335 HydrophobicContact CD2-CE2 4.49Å; F212-Y335 AromaticContact CD2-CZ 3.45Å; F212-Y335 VanDerWaalsContact CD2-CZ 3.45Å; F212-Y335 VanDerWaalsContact CD2-OH 3.26Å; F212-Y335 WeakPolarHBondContact CD2-OH 3.36Å; F212-Y335 AromaticContact CE2-CD1 3.41Å; F212-Y335 HydrophobicContact CE2-CD1 3.41Å; F212-Y335 VanDerWaalsContact CE2-CD1 3.41Å; F212-Y335 AromaticContact CE2-CE1 2.95Å; F212-Y335 HydrophobicContact CE2-CE1 2.95Å; F212-Y335 HydrophobicContact CE2-CE2 4.36Å; F212-Y335 HydrophobicContact CE2-CG 4.29Å; F212-Y335 AromaticContact CE2-CZ 3.5Å; F212-Y335 VanDerWaalsContact CE2-CZ 3.5Å; F212-Y335 HydrophobicContact CG-CE1 4.24Å; F212-Y335 AromaticContact CZ-CD1 3.93Å; F212-Y335 HydrophobicContact CZ-CD1 3.93Å; F212-Y335 AromaticContact CZ-CE1 3.75Å; F212-Y335 HydrophobicContact CZ-CE1 3.75Å; P215-Y335 HydrophobicContact CG-CE1 4.1Å; P215-Y335 WeakPolarHBondContact CG-OH 3.47Å; I331-Y335 WeakPolarHBondContact O-CB 3.22Å; I331-Y335 PolarHBondContact O-N 3.11Å; S332-Y335 PolarHBondContact O-N 3.06Å; L333-Y335 VanDerWaalsContact C-N 3.31Å; L333-Y335 PolarHBondContact O-N 3.25Å; Y335-F338 PolarHBondContact O-N 2.88Å; Y335-V339 PolarHBondContact O-N 2.9Å; Y335-V339 VanDerWaalsContact O-N 3.13Å
336S71.8Confident72.6Confident12 Ų1266.2 Ų66.28%0.08437%0.366CS..Hα-helixtrans-67.8-42.6175.4-55.70000112.9Y279 S332 L333 F338 V339 T340Y279-S336 WeakPolarHBondContact CE1-OG 3.43Å; Y279-S336 PolarHBondContact OH-OG 2.86Å; S332-S336 PolarHBondContact O-N 3.37Å; S332-S336 PolarHBondContact O-OG 3.48Å; L333-S336 PolarHBondContact O-N 2.67Å; S336-F338 VanDerWaalsContact C-N 3.32Å; S336-V339 PolarHBondContact O-N 3.29Å; S336-T340 WeakPolarHBondContact O-CG2 3.32Å; S336-T340 PolarHBondContact O-N 2.82Å; S336-T340 PolarHBondContact O-OG1 3.44Å
337C75.3Confident70.8Confident78 Ų7866.6 Ų66.653%0.52737%0.374SS..Hα-helixtrans-61.9-41.4174.2-760000111.1L333 S334 V339 T340 A341L333-C337 WeakPolarHBondContact O-CB 3.49Å; L333-C337 PolarHBondContact O-N 2.63Å; L333-C337 PolarHBondContact O-SG 2.92Å; S334-C337 PolarHBondContact O-N 3.01Å; C337-V339 VanDerWaalsContact C-N 3.35Å; C337-V339 PolarHBondContact O-N 2.9Å; C337-T340 WeakPolarHBondContact CA-OG1 3.17Å; C337-T340 PolarHBondContact O-OG1 2.94Å; C337-A341 WeakPolarHBondContact O-CB 3.5Å; C337-A341 PolarHBondContact O-N 3.49Å
338F72.7Confident68.9Low124 Ų12469.9 Ų69.954%0.54438%0.381SS..Hα-helixtrans-61.6-43177-177.1-97.6000112W176 S334 Y335 S336 G342W176-F338 HydrophobicContact CH2-CZ 4.45Å; W176-F338 HydrophobicContact CZ2-CZ 4.12Å; S334-F338 WeakPolarHBondContact O-CB 3.45Å; S334-F338 PolarHBondContact O-N 3.38Å; Y335-F338 PolarHBondContact O-N 2.88Å; S336-F338 VanDerWaalsContact C-N 3.32Å; F338-G342 PolarHBondContact O-N 2.9Å
339V66.9Low67.3Low34 Ų3476.7 Ų76.721%0.20641%0.409CS..Hα-helixtrans-75-36.4-178.7167.80000113.3F212 Y335 S336 C337 G342 K343F212-V339 HydrophobicContact CD2-CB 4.33Å; F212-V339 HydrophobicContact CD2-CG1 4.3Å; F212-V339 HydrophobicContact CD2-CG2 3.55Å; F212-V339 HydrophobicContact CE1-CG1 4.42Å; F212-V339 HydrophobicContact CE2-CB 3.63Å; F212-V339 HydrophobicContact CE2-CG1 3.91Å; F212-V339 HydrophobicContact CE2-CG2 3.11Å; F212-V339 HydrophobicContact CZ-CB 3.91Å; F212-V339 HydrophobicContact CZ-CG1 3.96Å; F212-V339 HydrophobicContact CZ-CG2 3.92Å; Y335-V339 PolarHBondContact O-N 2.9Å; Y335-V339 VanDerWaalsContact O-N 3.13Å; S336-V339 PolarHBondContact O-N 3.29Å; C337-V339 VanDerWaalsContact C-N 3.35Å; C337-V339 PolarHBondContact O-N 2.9Å; V339-G342 PolarHBondContact O-N 3.31Å; V339-K343 WeakPolarHBondContact O-CG 3.4Å; V339-K343 PolarHBondContact O-N 3.43Å
340T66.2Low65.9Low83 Ų8382.4 Ų82.451%0.50944%0.436SS..Hα-helixtrans-65.3-44.8172.149.20000111.1S336 C337 G342 K343 L344S336-T340 WeakPolarHBondContact O-CG2 3.32Å; S336-T340 PolarHBondContact O-N 2.82Å; S336-T340 PolarHBondContact O-OG1 3.44Å; C337-T340 WeakPolarHBondContact CA-OG1 3.17Å; C337-T340 PolarHBondContact O-OG1 2.94Å; T340-G342 VanDerWaalsContact C-N 3.35Å; T340-G342 PolarHBondContact O-N 3.01Å; T340-K343 PolarHBondContact O-N 3.19Å; T340-L344 WeakPolarHBondContact O-CB 3.24Å; T340-L344 WeakPolarHBondContact O-CD1 3.15Å; T340-L344 PolarHBondContact O-N 2.98Å
341A66Low64.3Low44 Ų4483.2 Ų83.236%0.36444%0.438SS..Hα-helixtrans-63.6-38.1174.700000112.7C337 L344 R345C337-A341 WeakPolarHBondContact O-CB 3.5Å; C337-A341 PolarHBondContact O-N 3.49Å; A341-L344 PolarHBondContact O-N 3.46Å; A341-R345 WeakPolarHBondContact O-CG 3.36Å; A341-R345 PolarHBondContact O-N 3.25Å
342G58.5Low62.6Low29 Ų2983.5 Ų83.530%0.29944%0.439SS..Hα-helixtrans-61.5-46.5174.100000112.1F338 V339 T340 R345 I346F338-G342 PolarHBondContact O-N 2.9Å; V339-G342 PolarHBondContact O-N 3.31Å; T340-G342 VanDerWaalsContact C-N 3.35Å; T340-G342 PolarHBondContact O-N 3.01Å; G342-R345 PolarHBondContact O-N 3.45Å; G342-I346 VanDerWaalsContact O-CG1 3.3Å; G342-I346 WeakPolarHBondContact O-CG1 3.31Å; G342-I346 PolarHBondContact O-N 2.59Å
343K58.3Low60.8Low104 Ų10485 Ų8545%0.45246%0.456SS..Hα-helixtrans-65.5-38.2175.4-75-168.1175.8-172.50112.8W272 V339 T340 I346 S347W272-K343 VanDerWaalsContact CH2-NZ 3.33Å; V339-K343 WeakPolarHBondContact O-CG 3.4Å; V339-K343 PolarHBondContact O-N 3.43Å; T340-K343 PolarHBondContact O-N 3.19Å; K343-I346 PolarHBondContact O-N 3.45Å; K343-S347 WeakPolarHBondContact O-CB 3.49Å; K343-S347 PolarHBondContact O-N 3.07Å
344L53.1Low59.1Low123 Ų12388 Ų8864%0.64447%0.472SS*.Hα-helixtrans-61.4-42.8173.8-85152.2000111.7T340 A341 S347 Q348T340-L344 WeakPolarHBondContact O-CB 3.24Å; T340-L344 WeakPolarHBondContact O-CD1 3.15Å; T340-L344 PolarHBondContact O-N 2.98Å; A341-L344 PolarHBondContact O-N 3.46Å; L344-S347 PolarHBondContact O-N 3.29Å; L344-Q348 VanDerWaalsContact O-CB 3.28Å; L344-Q348 WeakPolarHBondContact O-CB 3.16Å; L344-Q348 PolarHBondContact O-N 2.93Å
345R49.4Very low57.2Low178 Ų17888.8 Ų88.867%0.67248%0.477SS*.Hα-helixtrans-65.7-37.9175.5-77.7-175.7179.1158.42.7112.8A341 G342 K349A341-R345 WeakPolarHBondContact O-CG 3.36Å; A341-R345 PolarHBondContact O-N 3.25Å; G342-R345 PolarHBondContact O-N 3.45Å; R345-K349 VanDerWaalsContact O-CB 3.3Å; R345-K349 WeakPolarHBondContact O-CB 3.42Å; R345-K349 PolarHBondContact O-N 3.44Å
346I52.2Low55.5Low106 Ų10694.5 Ų94.554%0.54450%0.499SS..Hα-helixtrans-66.3-48.7176-64.5161.7000109.6G342 K343 Q348 K349 E350G342-I346 VanDerWaalsContact O-CG1 3.3Å; G342-I346 WeakPolarHBondContact O-CG1 3.31Å; G342-I346 PolarHBondContact O-N 2.59Å; K343-I346 PolarHBondContact O-N 3.45Å; I346-Q348 VanDerWaalsContact C-N 3.32Å; I346-Q348 PolarHBondContact O-N 2.9Å; I346-K349 CarbonylContact O-C 3.58Å; I346-K349 PolarHBondContact O-N 3.34Å; I346-K349 VanDerWaalsContact O-N 3.07Å; I346-E350 WeakPolarHBondContact O-CB 2.99Å; I346-E350 PolarHBondContact O-N 3.4Å
347S47.4Very low54.1Low72 Ų72104.4 Ų104.450%0.50354%0.535SS..Hα-helixtrans-64.1-34.4179.4-173.40000112.8K343 L344 E350 S351K343-S347 WeakPolarHBondContact O-CB 3.49Å; K343-S347 PolarHBondContact O-N 3.07Å; L344-S347 PolarHBondContact O-N 3.29Å; S347-E350 PolarHBondContact O-N 3.29Å; S347-S351 WeakPolarHBondContact O-CB 3.49Å; S347-S351 PolarHBondContact O-N 3.47Å; S347-S351 PolarHBondContact O-OG 2.96Å
348Q48.9Very low52.5Low120 Ų120105.4 Ų105.456%0.56154%0.543SS*.Hα-helixtrans-70.1-36.6172.8-168.8-178.114.700111.9L344 I346 E350 S351 I352L344-Q348 VanDerWaalsContact O-CB 3.28Å; L344-Q348 WeakPolarHBondContact O-CB 3.16Å; L344-Q348 PolarHBondContact O-N 2.93Å; I346-Q348 VanDerWaalsContact C-N 3.32Å; I346-Q348 PolarHBondContact O-N 2.9Å; Q348-E350 VanDerWaalsContact C-N 3.33Å; Q348-S351 PolarHBondContact O-OG 2.88Å; Q348-I352 HydrophobicContact CG-CD1 3.93Å; Q348-I352 WeakPolarHBondContact O-CB 3.21Å; Q348-I352 WeakPolarHBondContact O-CD1 3.19Å; Q348-I352 WeakPolarHBondContact O-CG1 3.39Å; Q348-I352 PolarHBondContact O-N 3.3Å
349K52.3Low51Low172 Ų172102.4 Ų102.475%0.74854%0.541SS*.Hα-helixtrans-70.6-32.5175.5-162.1176.4-177.6-176.60111.6R345 I346 G353R345-K349 VanDerWaalsContact O-CB 3.3Å; R345-K349 WeakPolarHBondContact O-CB 3.42Å; R345-K349 PolarHBondContact O-N 3.44Å; I346-K349 CarbonylContact O-C 3.58Å; I346-K349 PolarHBondContact O-N 3.34Å; I346-K349 VanDerWaalsContact O-N 3.07Å; K349-G353 PolarHBondContact O-N 3.17Å
350E54.5Low49.6Very low121 Ų121103.2 Ų103.257%0.56555%0.548SS*.Hα-helixtrans-72.7-43.7174.9-135.5161.6-158.800111.1I346 S347 Q348 I352 G353 D354I346-E350 WeakPolarHBondContact O-CB 2.99Å; I346-E350 PolarHBondContact O-N 3.4Å; S347-E350 PolarHBondContact O-N 3.29Å; Q348-E350 VanDerWaalsContact C-N 3.33Å; E350-I352 VanDerWaalsContact C-N 3.34Å; E350-I352 PolarHBondContact O-N 2.88Å; E350-G353 PolarHBondContact O-N 3.31Å; E350-G353 VanDerWaalsContact O-N 3.16Å; E350-D354 WeakPolarHBondContact O-CB 3.43Å; E350-D354 PolarHBondContact O-N 3.14Å
351S51.4Low48.6Very low73 Ų73104.1 Ų104.151%0.5156%0.555SS.*Hα-helixtrans-67.6-32.5176.576.10000113.2S347 Q348 S355S347-S351 WeakPolarHBondContact O-CB 3.49Å; S347-S351 PolarHBondContact O-N 3.47Å; S347-S351 PolarHBondContact O-OG 2.96Å; Q348-S351 PolarHBondContact O-OG 2.88Å; S351-S355 WeakPolarHBondContact O-CB 3.28Å; S351-S355 PolarHBondContact O-N 2.85Å
352I50.4Low47.7Very low94 Ų94109.8 Ų109.848%0.48257%0.572SS.*Hα-helixtrans-75.5-34.6172.5-65.4167.8000110.7Q348 E350 Y356Q348-I352 HydrophobicContact CG-CD1 3.93Å; Q348-I352 WeakPolarHBondContact O-CB 3.21Å; Q348-I352 WeakPolarHBondContact O-CD1 3.19Å; Q348-I352 WeakPolarHBondContact O-CG1 3.39Å; Q348-I352 PolarHBondContact O-N 3.3Å; E350-I352 VanDerWaalsContact C-N 3.34Å; E350-I352 PolarHBondContact O-N 2.88Å; I352-Y356 WeakPolarHBondContact O-CD2 3.42Å
353G44.3Very low47.3Very low35 Ų35115.5 Ų115.536%0.36159%0.591SS.*Hα-helixtrans-68.4-39.9175.700000113.5K349 E350 Y356 R357K349-G353 PolarHBondContact O-N 3.17Å; E350-G353 PolarHBondContact O-N 3.31Å; E350-G353 VanDerWaalsContact O-N 3.16Å; G353-Y356 PolarHBondContact O-N 3.29Å; G353-R357 PolarHBondContact O-N 3.28Å; G353-R357 VanDerWaalsContact O-N 3.14Å
354D44.4Very low46.7Very low100 Ų100116.8 Ų116.854%0.53560%0.602SS.*Hα-helixtrans-75.8-28.8179.8-74.8-23.6000112.4E350 Y356 R357 S358E350-D354 WeakPolarHBondContact O-CB 3.43Å; E350-D354 PolarHBondContact O-N 3.14Å; D354-Y356 PolarHBondContact O-N 3.38Å; D354-R357 PolarHBondContact O-N 3.18Å; D354-S358 WeakPolarHBondContact O-CB 3.27Å; D354-S358 PolarHBondContact O-N 3.31Å
355S41.9Very low46.6Very low88 Ų88118 Ų11862%0.61560%0.604SS**Hα-helixtrans-66.4-21.6172.1-1720000113.4S351S351-S355 WeakPolarHBondContact O-CB 3.28Å; S351-S355 PolarHBondContact O-N 2.85Å
356Y40.2Very low46.6Very low194 Ų194115 Ų11576%0.76160%0.601SS**Hα-helixtrans-99.8-18.2175.8-83.2-88.4000113.6I352 G353 D354I352-Y356 WeakPolarHBondContact O-CD2 3.42Å; G353-Y356 PolarHBondContact O-N 3.29Å; D354-Y356 PolarHBondContact O-N 3.38Å
357R43Very low46.6Very low221 Ų221113.8 Ų113.883%0.83460%0.602SS**Hα-helixtrans-95.2-17.4175.7-101.1-177.4171.3-173.4-1.9114.7G353 D354G353-R357 PolarHBondContact O-N 3.28Å; G353-R357 VanDerWaalsContact O-N 3.14Å; D354-R357 PolarHBondContact O-N 3.18Å
358S41.6Very low46.9Very low99 Ų99117.3 Ų117.369%0.69261%0.608SS**SBendtrans-80.8-10.8177.1-179.30000114.1D354 S360D354-S358 WeakPolarHBondContact O-CB 3.27Å; D354-S358 PolarHBondContact O-N 3.31Å; S358-S360 PolarHBondContact O-N 2.9Å
359A39.9Very low47.1Very low60 Ų60119.1 Ų119.150%0.49661%0.614SS.*SBendtrans-73.682.1165.400000108
360S38.6Very low47.2Very low52 Ų52115.8 Ų115.836%0.36461%0.605SS.*  trans-48.5132176.91750000109.5S358 K362 E363S358-S360 PolarHBondContact O-N 2.9Å; S360-K362 PolarHBondContact O-N 3.26Å; S360-K362 PolarHBondContact OG-N 3.1Å; S360-E363 PolarHBondContact O-N 3.13Å
361P44.7Very low47.2Very low102 Ų102117.2 Ų117.266%0.66261%0.611SS**Hα-helixtrans-59.6-5175.921.4-30.6000113.4Q365P361-Q365 WeakPolarHBondContact O-CG 3.27Å
362K47.1Very low47.3Very low162 Ų162119.8 Ų119.870%0.70462%0.615SS**Hα-helixtrans-80.2-28.9169.6-67.9-175174.1-1760114S360 L366S360-K362 PolarHBondContact O-N 3.26Å; S360-K362 PolarHBondContact OG-N 3.1Å; K362-L366 WeakPolarHBondContact O-CD1 3.33Å; K362-L366 PolarHBondContact O-N 2.89Å
363E49Very low47.5Very low149 Ų149118.6 Ų118.670%0.69662%0.615SS**Hα-helixtrans-77.8-31.2176.1-68.2-155.6147.800112.1S360 Q365 S367S360-E363 PolarHBondContact O-N 3.13Å; E363-Q365 VanDerWaalsContact C-N 3.31Å; E363-Q365 PolarHBondContact O-N 3.49Å; E363-S367 PolarHBondContact O-N 3.41Å
364L46.4Very low48Very low132 Ų132125.2 Ų125.269%0.69163%0.634SS**Hα-helixtrans-70.7-25.7172.6-125.392.2000113.1K368L364-K368 PolarHBondContact O-N 3.2Å
365Q50.3Low48.5Very low147 Ų147124 Ų12469%0.68763%0.634SS**Hα-helixtrans-85-28.5176.8-74.5-157.118.600113.6P361 E363 K369P361-Q365 WeakPolarHBondContact O-CG 3.27Å; E363-Q365 VanDerWaalsContact C-N 3.31Å; E363-Q365 PolarHBondContact O-N 3.49Å; Q365-K369 PolarHBondContact O-N 3.22Å; Q365-K369 VanDerWaalsContact O-N 3.13Å
366L50.5Low49.2Very low117 Ų117127.9 Ų127.961%0.61364%0.642SS**Hα-helixtrans-68.9-41.6169.9-100.2100.8000111.6K362 K368 K369 D370K362-L366 WeakPolarHBondContact O-CD1 3.33Å; K362-L366 PolarHBondContact O-N 2.89Å; L366-K368 PolarHBondContact O-N 2.94Å; L366-K369 PolarHBondContact O-N 3.47Å; L366-D370 PolarHBondContact O-N 3.31Å; L366-D370 VanDerWaalsContact O-N 3.08Å
367S51.3Low49.9Very low80 Ų80126 Ų12656%0.55965%0.645SS**Hα-helixtrans-65.7-24.2177.2-172.30000113.6E363E363-S367 PolarHBondContact O-N 3.41Å
368K54Low50.3Low145 Ų145121.4 Ų121.463%0.6364%0.642SS**Hα-helixtrans-83.5-35.5176.3-158.6173.7-178.4-177.50111.9L364 L366 Q371 E372L364-K368 PolarHBondContact O-N 3.2Å; L366-K368 PolarHBondContact O-N 2.94Å; K368-Q371 PolarHBondContact O-N 2.82Å; K368-E372 PolarHBondContact O-N 2.95Å; K368-E372 VanDerWaalsContact O-N 3.15Å
369K53.5Low50.3Low158 Ų158129.5 Ų129.569%0.68766%0.664SS**Hα-helixtrans-70.2-31.5176.4-118.4177.1177.8179.40113.6Q365 L366 Q371 S373Q365-K369 PolarHBondContact O-N 3.22Å; Q365-K369 VanDerWaalsContact O-N 3.13Å; L366-K369 PolarHBondContact O-N 3.47Å; K369-Q371 VanDerWaalsContact C-N 3.3Å; K369-S373 WeakPolarHBondContact O-CB 3.44Å; K369-S373 PolarHBondContact O-N 3.29Å; K369-S373 PolarHBondContact O-OG 3.36Å
370D54.5Low50.8Low103 Ų103133 Ų13355%0.55167%0.673SS**Hα-helixtrans-78.7-14.2175.2-69.5-25.6000113.4L366L366-D370 PolarHBondContact O-N 3.31Å; L366-D370 VanDerWaalsContact O-N 3.08Å
371Q54.1Low51.5Low150 Ų150137.3 Ų137.370%0.70169%0.689SS**Hα-helixtrans-90.1-31.8173.6-124177.11.400112.2K368 K369K368-Q371 PolarHBondContact O-N 2.82Å; K369-Q371 VanDerWaalsContact C-N 3.3Å
372E54.2Low51.9Low128 Ų128139.2 Ų139.260%0.59869%0.691SS**Hα-helixtrans-80-30.3178-133.5165.4166.500112.4K368 K374 S375K368-E372 PolarHBondContact O-N 2.95Å; K368-E372 VanDerWaalsContact O-N 3.15Å; E372-K374 VanDerWaalsContact C-N 3.29Å; E372-K374 PolarHBondContact O-N 3.38Å; E372-S375 PolarHBondContact O-N 3.17Å; E372-S375 PolarHBondContact O-OG 3.32Å
373S54.5Low52.1Low69 Ų69137.9 Ų137.948%0.48369%0.69SS.*THydrogen-bonded Turntrans-74.5-16.1174.564.60000114K369K369-S373 WeakPolarHBondContact O-CB 3.44Å; K369-S373 PolarHBondContact O-N 3.29Å; K369-S373 PolarHBondContact O-OG 3.36Å
374K54.4Low52.3Low173 Ų173137.2 Ų137.275%0.75269%0.69SS**THydrogen-bonded Turntrans-89.1-11.9175.6-103179.9177.3177.30114.2E372E372-K374 VanDerWaalsContact C-N 3.29Å; E372-K374 PolarHBondContact O-N 3.38Å
375S54.5Low52.7Low76 Ų76137.5 Ų137.553%0.53169%0.689SS.*SBendtrans-93.5-10.6177.849.60000114.5E372E372-S375 PolarHBondContact O-N 3.17Å; E372-S375 PolarHBondContact O-OG 3.32Å
376E56.7Low52.9Low168 Ų168136.9 Ų136.979%0.78569%0.69SS**SBendtrans-92.2-8.7178.1-79.7-171.1137.400114.6
377D55.1Low53.1Low155 Ų155138.4 Ų138.483%0.82970%0.695SS**SBendtrans-95.413.1175-87.3-27.5000113.8
378T51.2Low53.2Low124 Ų124143.3 Ų143.376%0.76171%0.707SS**  trans-118.386.7168.8-35.70000108.7
379K42.3Very low53.2Low270 Ų270143.1 Ų143.1100%1.17471%0.714SS**  trans-113.60173.1-147-177.9-168.8-179.70110.2

Retrieved 379 of 379 residues in 402.2 ms (Link to these results)