A0A077ZGS1_TRITR Loading...

Putative non-LTR retroelement reverse transcripta se

AlphaFold DB , UniProt , Accession A0A077ZGS1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 356 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M53.1Low58.4Low228 Ų228175.9 Ų175.9100%1.12386%0.859SS**  0100.90-71.3-61.5-166.400106.8T3M1-T3 PolarHBondContact O-N 2.81Å
2D54.6Low58.4Low153 Ų153181.9 Ų181.982%0.81887%0.865SS**  trans-85102.2-175.5-68.7-29000110Q4D2-Q4 PolarHBondContact O-N 2.99Å
3T58.4Low58.6Low136 Ų136186.4 Ų186.483%0.83487%0.868SS**  trans-6698.2177.2-46.50000109.1M1M1-T3 PolarHBondContact O-N 2.81Å
4Q68.2Low58.5Low161 Ų161179.9 Ų179.975%0.75286%0.862SS**PPolyproline II helixtrans-58134.8174-74.7-74.7-42.200110D2 S6D2-Q4 PolarHBondContact O-N 2.99Å; Q4-S6 PolarHBondContact O-N 3.15Å; Q4-S6 VanDerWaalsContact O-N 3.13Å
5P61.4Low58.7Low116 Ų116183.6 Ų183.675%0.75386%0.864SS**PPolyproline II helixtrans-64.6116.9-179.723.6-31.1000110.3R7P5-R7 PolarHBondContact O-N 2.69Å
6S65.3Low58.3Low113 Ų113187 Ų18779%0.7987%0.866SS**PPolyproline II helixtrans-56.4123.2176.553.60000110.8Q4Q4-S6 PolarHBondContact O-N 3.15Å; Q4-S6 VanDerWaalsContact O-N 3.13Å
7R57.5Low57.7Low235 Ų235182.2 Ų182.289%0.88786%0.858SS**PPolyproline II helixtrans-55.4138.7177.2-87.8-179.9173.5173.4-1.3110.8P5 H9P5-R7 PolarHBondContact O-N 2.69Å; R7-H9 PolarHBondContact O-N 3.04Å
8P58.9Low57.4Low123 Ų123185.3 Ų185.380%0.79986%0.86SS**PPolyproline II helixtrans-60.7124.8-177.6-8.816.3000110.8R10P8-R10 PolarHBondContact O-N 3.18Å; P8-R10 VanDerWaalsContact O-N 3.09Å
9H54.8Low57.1Low188 Ų188183.1 Ų183.187%0.8786%0.855SS**  trans-60.1114.9176.7-147.236000109.3R7 R11R7-H9 PolarHBondContact O-N 3.04Å; H9-R11 PolarHBondContact O-N 2.8Å
10R53.5Low56.6Low243 Ų243180 Ų18092%0.91785%0.854SS**  trans-65.696.7-174.2-160.1178.7-172.1179.53.2108.9P8 R12P8-R10 PolarHBondContact O-N 3.18Å; P8-R10 VanDerWaalsContact O-N 3.09Å; R10-R12 PolarHBondContact O-N 3.43Å
11R56.6Low56.2Low239 Ų239176.2 Ų176.290%0.90285%0.847SS**  trans-58108.7179-62.4179.586.9175.36.2109.3H9 R13H9-R11 PolarHBondContact O-N 2.8Å; R11-R13 PolarHBondContact O-N 3Å
12R58.3Low55.6Low248 Ų248169.8 Ų169.894%0.93683%0.83SS**PPolyproline II helixtrans-61.7116.1168.2-86.4-179.1157.7178.8-5107.9R10 A14R10-R12 PolarHBondContact O-N 3.43Å; R12-A14 PolarHBondContact O-N 2.88Å
13R61.6Low55Low240 Ų240171.8 Ų171.891%0.90683%0.832SS**PPolyproline II helixtrans-61.9126.2170.3-87.9-177.6174179.4-1.3108.4R11 R15R11-R13 PolarHBondContact O-N 3Å; R13-R15 PolarHBondContact O-N 2.73Å; R13-R15 VanDerWaalsContact O-N 3.11Å
14A56.8Low54.1Low95 Ų95175 Ų17579%0.78583%0.834SS**PPolyproline II helixtrans-55.6116.4169.900000109R12 R16R12-A14 PolarHBondContact O-N 2.88Å; A14-R16 PolarHBondContact O-N 2.71Å; A14-R16 VanDerWaalsContact O-N 3.16Å
15R61Low52.8Low236 Ų236176.8 Ų176.889%0.89184%0.839SS**  trans-67.8109.3169.6-74.2-176.9168.1-175.3-3.9106.8R13 C17R13-R15 PolarHBondContact O-N 2.73Å; R13-R15 VanDerWaalsContact O-N 3.11Å; R15-C17 PolarHBondContact O-N 2.8Å; R15-C17 VanDerWaalsContact O-N 3.09Å
16R53.6Low51.8Low238 Ų238176.9 Ų176.990%0.89884%0.84SS**  trans-71.599.2165.1-74.9-174.8179.8-172.4-0.8107A14 R18A14-R16 PolarHBondContact O-N 2.71Å; A14-R16 VanDerWaalsContact O-N 3.16Å; R16-R18 PolarHBondContact O-N 2.91Å
17C46.9Very low50.4Low106 Ų106181.6 Ų181.672%0.71684%0.841SS**  trans-61.3101.9162.9-62.80000107R15 N19R15-C17 PolarHBondContact O-N 2.8Å; R15-C17 VanDerWaalsContact O-N 3.09Å; C17-N19 PolarHBondContact O-N 2.73Å; C17-N19 VanDerWaalsContact O-N 3.16Å
18R51.9Low49.6Very low238 Ų238177.9 Ų177.990%0.89884%0.838SS**  trans-73.4101.3162.8-86.5-177.7172.5176.3-2.6105.5R16 S20R16-R18 PolarHBondContact O-N 2.91Å; R18-S20 PolarHBondContact O-N 2.76Å
19N51.8Low48.7Very low143 Ų143178.3 Ų178.377%0.76583%0.83SS**  trans-56.4108.4167.3-70-18000107.4C17 S21C17-N19 PolarHBondContact O-N 2.73Å; C17-N19 VanDerWaalsContact O-N 3.16Å; N19-S21 PolarHBondContact O-N 2.81Å
20S46.9Very low48.1Very low120 Ų120176.8 Ų176.884%0.83983%0.828SS**  trans-69.872.9168.152.80000108.4R18 A22R18-S20 PolarHBondContact O-N 2.76Å; S20-A22 VanDerWaalsContact C-N 3.3Å; S20-A22 PolarHBondContact O-N 2.86Å; S20-A22 VanDerWaalsContact O-N 3.16Å
21S48.4Very low47.5Very low102 Ų102169.8 Ų169.871%0.71382%0.822SS**  trans-81.390.616160.90000107.2N19 K23N19-S21 PolarHBondContact O-N 2.81Å; S21-K23 VanDerWaalsContact C-N 3.33Å; S21-K23 PolarHBondContact O-N 2.8Å
22A40.4Very low46.7Very low93 Ų93167.5 Ų167.577%0.76982%0.822SS**  trans-5895163.800000109S20S20-A22 VanDerWaalsContact C-N 3.3Å; S20-A22 PolarHBondContact O-N 2.86Å; S20-A22 VanDerWaalsContact O-N 3.16Å
23K43.9Very low45.9Very low195 Ų195160.7 Ų160.785%0.84882%0.818SS**  trans-105.788.1155.2-79.5-167.1176.9-177.20107.6S21 K25S21-K23 VanDerWaalsContact C-N 3.33Å; S21-K23 PolarHBondContact O-N 2.8Å; K23-K25 PolarHBondContact O-N 2.78Å
24K38.2Very low45Very low203 Ų203158.7 Ų158.788%0.88382%0.816SS**  trans-45.9115.6158.1-73.3174172.7177.30107.9
25K40.3Very low44.4Very low198 Ų198158.6 Ų158.686%0.86182%0.816SS**  trans-108.7128.3151.9-87.1-166.7174.7-1730107.6K23K23-K25 PolarHBondContact O-N 2.78Å
26P40.8Very low43.6Very low119 Ų119153.7 Ų153.777%0.77381%0.812SS**  trans-73.8144.1-173.329.4-32.9000112
27R36.9Very low43Very low212 Ų212148.6 Ų148.680%0.881%0.807SS**  trans3.5114.1151.4-70.3172165.5159-0.2115.9E29R27-E29 HydrophobicContact CB-CG 4.35Å; R27-E29 VanDerWaalsContact CD-OE1 3.23Å; R27-E29 WeakPolarHBondContact CD-OE1 3.05Å; R27-E29 IonicContact CZ-OE1 3.84Å; R27-E29 IonicContact NE-OE1 2.83Å; R27-E29 PolarHBondContact NE-OE1 3.06Å; R27-E29 VanDerWaalsContact NE-OE1 3.16Å
28N39.9Very low42.8Very low156 Ų156147.8 Ų147.883%0.83481%0.808SS**  trans-106.692.8145.8-167.82.5000106.5
29E40.9Very low42.4Very low133 Ų133140.3 Ų140.362%0.62180%0.796SS**  trans-86.2105.4167.8-70.9170.9-171.900106R27R27-E29 HydrophobicContact CB-CG 4.35Å; R27-E29 VanDerWaalsContact CD-OE1 3.23Å; R27-E29 WeakPolarHBondContact CD-OE1 3.05Å; R27-E29 IonicContact CZ-OE1 3.84Å; R27-E29 IonicContact NE-OE1 2.83Å; R27-E29 PolarHBondContact NE-OE1 3.06Å; R27-E29 VanDerWaalsContact NE-OE1 3.16Å
30N41.8Very low42Very low156 Ų156138.4 Ų138.483%0.83479%0.792SS**  trans-170.1128.6149.3-97.7-28.9000112.6
31A41.5Very low41.9Very low96 Ų96140.5 Ų140.579%0.79379%0.794SS**  trans68.175.6151.400000118.7
32E39.5Very low41.7Very low191 Ų191145 Ų14589%0.89380%0.796SS**  trans-119.2105.2143.4-99-175.8169.700109.6K34E32-K34 PolarHBondContact O-N 2.79Å; E32-K34 VanDerWaalsContact O-N 3.08Å
33A41.6Very low42.3Very low105 Ų105145.9 Ų145.987%0.86879%0.794SS**  trans-61.7104174.200000109.7A35A33-A35 PolarHBondContact O-N 3.2Å; A33-A35 VanDerWaalsContact O-N 3.12Å
34K42.6Very low42.3Very low197 Ų197145.4 Ų145.486%0.85780%0.795SS**  trans-72.2102.3166.6-73.9-177.1177.8-179.90108.2E32 V36E32-K34 PolarHBondContact O-N 2.79Å; E32-K34 VanDerWaalsContact O-N 3.08Å; K34-V36 PolarHBondContact O-N 2.88Å
35A44.9Very low42.3Very low94 Ų94141.6 Ų141.678%0.77779%0.793SS**  trans-61.8100.516700000108.8A33 V37A33-A35 PolarHBondContact O-N 3.2Å; A33-A35 VanDerWaalsContact O-N 3.12Å; A35-V37 PolarHBondContact O-N 3.14Å; A35-V37 VanDerWaalsContact O-N 3.14Å
36V42.4Very low42.5Very low133 Ų133137.2 Ų137.281%0.80679%0.787SS**  trans-72103.1170178.10000106.6K34 A38K34-V36 PolarHBondContact O-N 2.88Å; V36-A38 PolarHBondContact O-N 3.08Å; V36-A38 VanDerWaalsContact O-N 3.12Å
37V41.1Very low42.7Very low131 Ų131137.4 Ų137.479%0.79479%0.788SS**  trans-63.5110.8169.3176.90000106.7A35 A39A35-V37 PolarHBondContact O-N 3.14Å; A35-V37 VanDerWaalsContact O-N 3.14Å; V37-A39 PolarHBondContact O-N 2.97Å
38A43.6Very low42.8Very low89 Ų89130.9 Ų130.974%0.73679%0.787SS**  trans-59.8110.1173.500000108.6V36V36-A38 PolarHBondContact O-N 3.08Å; V36-A38 VanDerWaalsContact O-N 3.12Å
39A42.8Very low42.9Very low80 Ų80131.3 Ų131.366%0.66178%0.784SS**  trans-66.5134.3168.600000108V37 D41V37-A39 PolarHBondContact O-N 2.97Å; A39-D41 PolarHBondContact O-N 3.35Å
40P44Very low42.8Very low103 Ų103128.2 Ų128.267%0.66979%0.788SS**  trans-62.6125.1178.722.2-30000110.5Y42P40-Y42 HydrophobicContact CG-CE2 4.32Å; P40-Y42 PolarHBondContact O-N 2.88Å
41D45.7Very low42.5Very low164 Ų164129.7 Ų129.788%0.87779%0.787SS**  trans-60.195.3172.8-72.3-40.9000109.5A39A39-D41 PolarHBondContact O-N 3.35Å
42Y44Very low42.6Very low196 Ų196130.4 Ų130.477%0.76979%0.786SS**  trans-72.3129.6164.9-84.3-87.4000108.4P40 Q44P40-Y42 HydrophobicContact CG-CE2 4.32Å; P40-Y42 PolarHBondContact O-N 2.88Å; Y42-Q44 PolarHBondContact O-N 3.19Å
43P52.8Low42.5Very low112 Ų112130 Ų13073%0.72778%0.784SS**  trans-62.6112.2174.924.8-31.4000108.5C45P43-C45 PolarHBondContact O-N 2.78Å
44Q42.2Very low42.2Very low186 Ų186131.1 Ų131.187%0.86978%0.782SS**  trans-61.4110.1167-75.8-175.1-33.800107.4Y42 S46Y42-Q44 PolarHBondContact O-N 3.19Å; Q44-S46 VanDerWaalsContact C-N 3.34Å; Q44-S46 PolarHBondContact O-N 2.85Å
45C39.6Very low42.2Very low122 Ų122130 Ų13082%0.82479%0.785SS**  trans-61.999.4169.1-65.60000108.1P43 P47P43-C45 PolarHBondContact O-N 2.78Å; C45-P47 WeakPolarHBondContact O-CD 3.15Å
46S45Very low41.7Very low107 Ų107130.5 Ų130.575%0.74878%0.783SS**PPolyproline II helixtrans-57.7121.2169.2-630000108.7Q44 G48Q44-S46 VanDerWaalsContact C-N 3.34Å; Q44-S46 PolarHBondContact O-N 2.85Å; S46-G48 PolarHBondContact O-N 3.44Å; S46-G48 VanDerWaalsContact O-N 3.1Å
47P43.4Very low41.5Very low123 Ų123129.8 Ų129.880%0.79978%0.784SS**PPolyproline II helixtrans-59.3118.5175.5-20.231.5000108.9C45 Q49C45-P47 WeakPolarHBondContact O-CD 3.15Å; P47-Q49 PolarHBondContact O-N 3.23Å
48G39Very low41.4Very low75 Ų75134.2 Ų134.277%0.77379%0.786SS**PPolyproline II helixtrans-51.9127.1177.400000110.6S46 G50S46-G48 PolarHBondContact O-N 3.44Å; S46-G48 VanDerWaalsContact O-N 3.1Å; G48-G50 PolarHBondContact O-N 3.39Å
49Q41.9Very low40.9Very low165 Ų165136.1 Ų136.177%0.77179%0.789SS**  trans-67.782.2174-66.7-161.9-1600110.1P47 K51P47-Q49 PolarHBondContact O-N 3.23Å; Q49-K51 VanDerWaalsContact C-N 3.3Å; Q49-K51 PolarHBondContact O-N 3.24Å
50G39.7Very low40.6Very low68 Ų68141 Ų14170%0.70180%0.795SS**  trans-71.787.6162.200000109.1G48 S52G48-G50 PolarHBondContact O-N 3.39Å; G50-S52 VanDerWaalsContact C-N 3.29Å; G50-S52 PolarHBondContact O-N 2.98Å
51K36Very low40.3Very low186 Ų186143 Ų14381%0.80981%0.806SS**  trans-70.486.9166.9-68.5-179.2-179.4178.10108.3Q49Q49-K51 VanDerWaalsContact C-N 3.3Å; Q49-K51 PolarHBondContact O-N 3.24Å
52S43.7Very low40Very low112 Ų112140.2 Ų140.278%0.78380%0.799SS**  trans-84.7125.5168.546.80000109.8G50G50-S52 VanDerWaalsContact C-N 3.29Å; G50-S52 PolarHBondContact O-N 2.98Å
53Q36.3Very low39.7Very low182 Ų182136.7 Ų136.785%0.8580%0.803SS**  trans-67.2148.5175.9-78.3-164.2-34.100111.8L55Q53-L55 PolarHBondContact O-N 2.72Å
54P35.5Very low39.2Very low128 Ų128136.3 Ų136.383%0.83180%0.803SS**  trans-77.5107.2-177.330.4-32.6000111.1S56P54-S56 PolarHBondContact O-N 3.46Å
55L42.8Very low39.2Very low173 Ų173136.5 Ų136.591%0.90680%0.801SS**  trans-87.2103.9165.4-83.9161.2000109.6Q53Q53-L55 PolarHBondContact O-N 2.72Å
56S34Very low39.2Very low106 Ų106137.3 Ų137.374%0.74180%0.802SS**  trans42.3111.8142-165.50000118.3P54 R58P54-S56 PolarHBondContact O-N 3.46Å; S56-R58 PolarHBondContact O-N 2.75Å
57S38.7Very low39.3Very low117 Ų117139.9 Ų139.982%0.81881%0.807SS**  trans-57.5115.8164.8410000112.5
58R38.3Very low39Very low224 Ų224137 Ų13785%0.84580%0.799SS**  trans-127.6100.7153.2-160.6170.6-175.5-173.32.6109.5S56 K60S56-R58 PolarHBondContact O-N 2.75Å; R58-K60 PolarHBondContact O-N 3.47Å
59T32.7Very low39.5Very low129 Ų129143.1 Ų143.179%0.79180%0.804SS**  trans-55.3112.6172.232.40000110.8
60K38.3Very low39.6Very low182 Ų182146 Ų14679%0.79181%0.808SS**  trans-123.997.2153.9-80.8-172.5176.9-178.50107.7R58 S62R58-K60 PolarHBondContact O-N 3.47Å; K60-S62 PolarHBondContact O-N 3.49Å; K60-S62 VanDerWaalsContact O-N 3.15Å
61T37.1Very low39.9Very low146 Ų146149.6 Ų149.690%0.89681%0.811SS**  trans-61.2105167.237.60000108.5
62S38Very low40.6Very low106 Ų106148.3 Ų148.374%0.74181%0.811SS**  trans-112.7129.7161.263.80000108K60 S64K60-S62 PolarHBondContact O-N 3.49Å; K60-S62 VanDerWaalsContact O-N 3.15Å; S62-S64 PolarHBondContact O-N 3.37Å
63S38.7Very low40.8Very low122 Ų122153.9 Ų153.985%0.85382%0.815SS**  trans-66.294.5-179.3-178.90000109.3K65S63-K65 PolarHBondContact O-N 3.3Å
64S43Very low41.7Very low103 Ų103153.4 Ų153.472%0.7281%0.813SS**  trans-80.7109.4168.654.80000108.3S62 V66S62-S64 PolarHBondContact O-N 3.37Å; S64-V66 PolarHBondContact O-N 3.36Å; S64-V66 VanDerWaalsContact O-N 3.1Å
65K40.8Very low42.6Very low190 Ų190155.8 Ų155.883%0.82681%0.813SS**  trans-48.4116.1171.3-75.5173.9174.1175.50109.3S63 L67S63-K65 PolarHBondContact O-N 3.3Å; K65-L67 PolarHBondContact O-N 3.12Å
66V41.1Very low42.8Very low139 Ų139156.1 Ų156.184%0.84281%0.807SS**  trans-61103.6170178.20000107.4S64 G68S64-V66 PolarHBondContact O-N 3.36Å; S64-V66 VanDerWaalsContact O-N 3.1Å; V66-G68 PolarHBondContact O-N 3.3Å; V66-G68 VanDerWaalsContact O-N 3.08Å
67L47.3Very low43.7Very low162 Ų162158.2 Ų158.285%0.84881%0.809SS**  trans-65.4108.4168.2-71.3169.6000107K65 K69K65-L67 PolarHBondContact O-N 3.12Å; L67-K69 PolarHBondContact O-N 3.13Å
68G37Very low44.3Very low62 Ų62159.6 Ų159.664%0.63981%0.807SS**  trans-54.1128.6-178.900000111.2V66 R70V66-G68 PolarHBondContact O-N 3.3Å; V66-G68 VanDerWaalsContact O-N 3.08Å; G68-R70 PolarHBondContact O-N 3.01Å; G68-R70 VanDerWaalsContact O-N 3.11Å
69K48.2Very low44.9Very low203 Ų203154.9 Ų154.988%0.88381%0.808SS**  trans-60.9111.9168-64-175.6179.1-178.10107.2L67 D71L67-K69 PolarHBondContact O-N 3.13Å; K69-D71 PolarHBondContact O-N 3.08Å
70R45.4Very low45.6Very low226 Ų226157.1 Ų157.185%0.85381%0.81SS**  trans-73.6117.5169.9-74.2-178.6-175.6149.81.1107.7G68 I72G68-R70 PolarHBondContact O-N 3.01Å; G68-R70 VanDerWaalsContact O-N 3.11Å; R70-I72 PolarHBondContact O-N 3.17Å; R70-I72 VanDerWaalsContact O-N 3.17Å
71D46.1Very low46Very low143 Ų143153.5 Ų153.577%0.76581%0.807SS**  trans-61.8112.3171.1-76.6-30.6000109.7K69 R73K69-D71 PolarHBondContact O-N 3.08Å; D71-R73 PolarHBondContact O-N 3.36Å; D71-R73 VanDerWaalsContact O-N 3.07Å
72I50.1Low46.5Very low159 Ų159152.8 Ų152.882%0.81580%0.797SS**  trans-73.198172.5-59.2170.2000106.4R70 E74R70-I72 PolarHBondContact O-N 3.17Å; R70-I72 VanDerWaalsContact O-N 3.17Å; I72-E74 PolarHBondContact O-N 2.91Å
73R47.2Very low46.9Very low229 Ų229157.1 Ų157.186%0.86480%0.803SS**  trans-74.9114.3170.8-68.9-176.9-178.3179.40.6108.3D71 E75D71-R73 PolarHBondContact O-N 3.36Å; D71-R73 VanDerWaalsContact O-N 3.07Å; R73-E75 PolarHBondContact O-N 3.42Å
74E54.7Low47.5Very low172 Ų172160.8 Ų160.880%0.80480%0.798SS**  trans-64.598.9170.7-67.5-177.916700109.4I72 K76I72-E74 PolarHBondContact O-N 2.91Å; E74-K76 PolarHBondContact O-N 3.21Å; E74-K76 VanDerWaalsContact O-N 3.11Å
75E55.2Low47.7Very low179 Ų179163.8 Ų163.884%0.83681%0.806SS**  trans-69.2104.2171.6-168.9178.3179.200108.7R73 I77R73-E75 PolarHBondContact O-N 3.42Å; E75-I77 PolarHBondContact O-N 3.36Å
76K47.6Very low48Very low180 Ų180159.9 Ų159.978%0.78380%0.802SS**  trans-71106.7174.5-69.4-179.1-180178.50108.4E74 D78E74-K76 PolarHBondContact O-N 3.21Å; E74-K76 VanDerWaalsContact O-N 3.11Å; K76-D78 PolarHBondContact O-N 3.11Å
77I53.3Low48.3Very low150 Ų150161 Ų16177%0.76980%0.804SS**  trans-72111173.1-59.3170.3000108E75 S79E75-I77 PolarHBondContact O-N 3.36Å; I77-S79 PolarHBondContact O-N 2.97Å; I77-S79 VanDerWaalsContact O-N 3.14Å
78D51Low48.5Very low145 Ų145157.9 Ų157.978%0.77580%0.795SS**  trans-63.9110.2174.3-74.1-33.5000110.1K76 E80K76-D78 PolarHBondContact O-N 3.11Å; D78-E80 VanDerWaalsContact C-N 3.26Å; D78-E80 PolarHBondContact O-N 3.03Å; D78-E80 VanDerWaalsContact O-N 3.1Å
79S50.2Low49Very low125 Ų125164.9 Ų164.987%0.87481%0.808SS**  trans-87.357.7-177.842.80000111I77I77-S79 PolarHBondContact O-N 2.97Å; I77-S79 VanDerWaalsContact O-N 3.14Å
80E47.5Very low49.2Very low176 Ų176164.9 Ų164.982%0.82280%0.803SS**  trans-128.649.2-176-139.8-174.5-169.700114.4D78D78-E80 VanDerWaalsContact C-N 3.26Å; D78-E80 PolarHBondContact O-N 3.03Å; D78-E80 VanDerWaalsContact O-N 3.1Å
81S46.7Very low49.3Very low106 Ų106164.5 Ų164.574%0.74181%0.807SS**  trans-151.869.9172.159.10000113.2
82L48.2Very low49.7Very low131 Ų131167.2 Ų167.269%0.68681%0.812SS**  trans-15860.9159.3-137.483000113.2R84L82-R84 HydrophobicContact CD2-CG 4.2Å; L82-R84 HydrophobicContact CG-CG 4.23Å; L82-R84 PolarHBondContact O-N 3.09Å; L82-R84 VanDerWaalsContact O-N 3.11Å
83K46.9Very low49.3Very low198 Ų198163.2 Ų163.286%0.86181%0.81SS**  trans-76.993.1163.3-73.8176.8-176.5161.70108.1D85K83-D85 PolarHBondContact O-N 3.18Å
84R50.9Low49.4Very low198 Ų198163.8 Ų163.875%0.74781%0.812SS**  trans-75.3117175.2-75.9-178.6178.2156.40.5110.8L82 S86L82-R84 HydrophobicContact CD2-CG 4.2Å; L82-R84 HydrophobicContact CG-CG 4.23Å; L82-R84 PolarHBondContact O-N 3.09Å; L82-R84 VanDerWaalsContact O-N 3.11Å; R84-S86 PolarHBondContact O-N 2.98Å; R84-S86 PolarHBondContact O-OG 3.17Å
85D46.1Very low49.7Very low167 Ų167166.5 Ų166.589%0.89382%0.815SS**  trans-60.7102.5168.5-68.9-42.8000110.9K83K83-D85 PolarHBondContact O-N 3.18Å
86S46.8Very low49.3Very low107 Ų107167.8 Ų167.875%0.74882%0.818SS**  trans-112.663.6-179.828.60000110R84R84-S86 PolarHBondContact O-N 2.98Å; R84-S86 PolarHBondContact O-OG 3.17Å
87N49.1Very low49.6Very low163 Ų163165 Ų16587%0.87282%0.816SS**  trans-120.472.6172.1-88.6-26.1000110.8
88S50.1Low49.2Very low96 Ų96162.3 Ų162.367%0.67182%0.816SS**  trans-120.490.6165.8158.30000109.4R90S88-R90 PolarHBondContact O-N 3.17Å
89K48.6Very low49Very low209 Ų209161.7 Ų161.791%0.90982%0.818SS**  trans-72.585.5169.7-68-163.9-178.4-178.80110.1
90R51.8Low48.8Very low204 Ų204162.1 Ų162.177%0.7782%0.815SS**  trans-95.7109.6167.2-87.8-178.1166.5-173.6-4.9110.2S88 K92S88-R90 PolarHBondContact O-N 3.17Å; R90-K92 PolarHBondContact O-N 3.38Å; R90-K92 VanDerWaalsContact O-N 3.09Å
91K47.6Very low48.5Very low217 Ų217156.5 Ų156.594%0.94380%0.804SS**  trans-61103.5164.7-77.2-176.1175.2179.60108.3
92K53.6Low48.6Very low201 Ų201155.7 Ų155.787%0.87480%0.804SS**  trans-83.5113.3168.4-77.9-174176.6-179.20108.5R90 R94R90-K92 PolarHBondContact O-N 3.38Å; R90-K92 VanDerWaalsContact O-N 3.09Å; K92-R94 PolarHBondContact O-N 3.28Å
93G43.2Very low48.5Very low74 Ų74161.2 Ų161.276%0.76382%0.816SS**  trans-61124170.100000110.4R95G93-R95 PolarHBondContact O-N 3.4Å
94R48.6Very low48.7Very low241 Ų241158 Ų15891%0.90981%0.807SS**  trans-77.395.3179.3-175.7-179.5176.9-168.2-0.3108.9K92K92-R94 PolarHBondContact O-N 3.28Å
95R61.2Low48.7Very low229 Ų229152.2 Ų152.286%0.86480%0.797SS**  trans-73.6124.3166.4-78-177.3171.7161-2.4108.5G93 T97G93-R95 PolarHBondContact O-N 3.4Å; R95-T97 PolarHBondContact O-N 2.79Å
96K46.2Very low49.1Very low207 Ų207149.9 Ų149.990%0.978%0.784SS**  trans-71.3107.1169.8-65.9-176.1179.5-178.40107.4
97T54.3Low49.3Very low120 Ų120152.1 Ų152.174%0.73678%0.783SS**  trans-91.3114.5165.847.80000107.4R95 T99R95-T97 PolarHBondContact O-N 2.79Å; T97-T99 PolarHBondContact O-N 2.87Å
98A45.5Very low49.1Very low94 Ų94150.2 Ų150.278%0.77777%0.769SS**  trans-67.7112.9168.200000107.7V100A98-V100 PolarHBondContact O-N 2.79Å
99T46.8Very low49.2Very low133 Ų133153.9 Ų153.982%0.81677%0.768SS**  trans-68.597.1172-53.10000107.5T97 G101T97-T99 PolarHBondContact O-N 2.87Å; T99-G101 PolarHBondContact O-N 3.46Å; T99-G101 VanDerWaalsContact O-N 3.13Å
100V44.3Very low49.4Very low133 Ų133151.2 Ų151.281%0.80676%0.759SS**  trans-70.9105167.2179.40000106A98 A102A98-V100 PolarHBondContact O-N 2.79Å; V100-A102 PolarHBondContact O-N 2.86Å
101G42.6Very low49.4Very low58 Ų58146.9 Ų146.960%0.59875%0.75SS**  trans-60.5109.2174.200000109.2T99 R103T99-G101 PolarHBondContact O-N 3.46Å; T99-G101 VanDerWaalsContact O-N 3.13Å; G101-R103 PolarHBondContact O-N 3.44Å
102A49.4Very low49.4Very low89 Ų89143.4 Ų143.474%0.73674%0.741SS**  trans-61.9109.1169.100000107.4V100 L104V100-A102 PolarHBondContact O-N 2.86Å; A102-L104 PolarHBondContact O-N 3.47Å
103R45.2Very low49Very low248 Ų248138 Ų13894%0.93673%0.729SS**  trans-62.5100.8170.2-71.8178.4175.2178.4-3106.9G101 S105G101-R103 PolarHBondContact O-N 3.44Å; R103-S105 PolarHBondContact O-N 2.94Å
104L50.6Low49.2Very low131 Ų131140.8 Ų140.869%0.68673%0.725SS**  trans-65.8128.5169.6-70.1168.4000107.8A102A102-L104 PolarHBondContact O-N 3.47Å
105S51.2Low49.2Very low76 Ų76134.9 Ų134.953%0.53172%0.718SS.*  trans-53137175.2170.80000110.4R103 Q107 Q108R103-S105 PolarHBondContact O-N 2.94Å; S105-Q107 PolarHBondContact O-N 3.34Å; S105-Q107 VanDerWaalsContact O-N 3.09Å; S105-Q107 PolarHBondContact OG-N 2.7Å; S105-Q108 PolarHBondContact O-N 2.96Å
106D55.5Low48.6Very low117 Ų117130.9 Ų130.963%0.62672%0.719SS**G310 helixtrans-59.7-21.8-178.3-66.8-39.7000112.9Q108 R109D106-Q108 VanDerWaalsContact C-N 3.27Å; D106-Q108 PolarHBondContact O-N 2.83Å; D106-R109 PolarHBondContact O-N 3.47Å; D106-R109 IonicContact OD1-CZ 2.76Å; D106-R109 IonicContact OD1-NE 2.68Å; D106-R109 IonicContact OD1-NH2 3.16Å; D106-R109 PolarHBondContact OD1-NH2 3.24Å
107Q49.7Very low48.2Very low155 Ų155124 Ų12472%0.72471%0.706SS**G310 helixtrans-64.9-24.9174.9-76.3-176.2-20.200114.1S105S105-Q107 PolarHBondContact O-N 3.34Å; S105-Q107 VanDerWaalsContact O-N 3.09Å; S105-Q107 PolarHBondContact OG-N 2.7Å
108Q44.7Very low47.6Very low122 Ų122122.9 Ų122.957%0.5771%0.71SS**G310 helixtrans-78.7-22.2177.9-157.770.948.600112.1S105 D106S105-Q108 PolarHBondContact O-N 2.96Å; D106-Q108 VanDerWaalsContact C-N 3.27Å; D106-Q108 PolarHBondContact O-N 2.83Å
109R52.4Low47.3Very low173 Ų173128.1 Ų128.165%0.65372%0.715SS**THydrogen-bonded Turntrans-77.2-22.3-179.4-87.1-171.5-85.8-150.6-0.1113.7D106D106-R109 PolarHBondContact O-N 3.47Å; D106-R109 IonicContact OD1-CZ 2.76Å; D106-R109 IonicContact OD1-NE 2.68Å; D106-R109 IonicContact OD1-NH2 3.16Å; D106-R109 PolarHBondContact OD1-NH2 3.24Å
110E52.6Low47.1Very low154 Ų154131.8 Ų131.872%0.7272%0.72SS**THydrogen-bonded Turntrans-76.1-25.5-177.5-162.1168.9-166.400112.8
111I52.9Low47Very low112 Ų112130.7 Ų130.757%0.57472%0.718SS**G310 helixtrans-76.6-26.2-176.8-57.8177000112S113I111-S113 VanDerWaalsContact C-N 3.34Å; I111-S113 PolarHBondContact O-N 2.78Å
112D47.9Very low46.7Very low144 Ų144136.3 Ų136.377%0.7773%0.729SS**G310 helixtrans-85.6-0.1-175.7-73.9-18.3000114.3
113S43.5Very low46.1Very low87 Ų87141.5 Ų141.561%0.60873%0.734SS**G310 helixtrans-103.130.6-177.678.50000114.6I111 P115I111-S113 VanDerWaalsContact C-N 3.34Å; I111-S113 PolarHBondContact O-N 2.78Å; S113-P115 WeakPolarHBondContact O-CD 3.34Å
114I48.6Very low46Very low133 Ų133135.2 Ų135.268%0.68273%0.729SS**  trans-79.2111170.7-58.2177.9000108.6T116I114-T116 PolarHBondContact O-N 3.01Å
115P49.1Very low45.3Very low117 Ų117137.6 Ų137.676%0.7673%0.734SS**  trans-72.199.2178.429.5-32.6000110.1S113 G117S113-P115 WeakPolarHBondContact O-CD 3.34Å; P115-G117 PolarHBondContact O-N 3.16Å
116T46.9Very low44.7Very low146 Ų146141.6 Ų141.690%0.89675%0.749SS**  trans-71.378.5166.148.70000109.5I114I114-T116 PolarHBondContact O-N 3.01Å
117G37.9Very low44.1Very low61 Ų61144.5 Ų144.563%0.62976%0.763SS**  trans-157.933.1-174.400000114.2P115 K119P115-G117 PolarHBondContact O-N 3.16Å; G117-K119 PolarHBondContact O-N 3.27Å; G117-K119 VanDerWaalsContact O-N 3.13Å
118A42.7Very low43.3Very low98 Ų98148.5 Ų148.581%0.8177%0.771SS**  trans-72.8105.2172.100000109.6K120A118-K120 PolarHBondContact O-N 3Å; A118-K120 VanDerWaalsContact O-N 3.08Å
119K39.7Very low42.9Very low204 Ų204154 Ų15489%0.88779%0.787SS**  trans-53110.8171.6-68.1179.6176.8178.40109.2G117 S121G117-K119 PolarHBondContact O-N 3.27Å; G117-K119 VanDerWaalsContact O-N 3.13Å; K119-S121 PolarHBondContact O-N 2.8Å
120K42.5Very low42.1Very low210 Ų210155.2 Ų155.291%0.91380%0.797SS**  trans-64.3115.2171.1-68.4-176.4178-178.90108.2A118A118-K120 PolarHBondContact O-N 3Å; A118-K120 VanDerWaalsContact O-N 3.08Å
121S42.1Very low41.2Very low110 Ų110157.1 Ų157.177%0.76981%0.806SS**  trans-71142.717754.80000111K119 K123K119-S121 PolarHBondContact O-N 2.8Å; S121-K123 PolarHBondContact O-N 2.7Å
122E35.8Very low40.3Very low176 Ų176156.5 Ų156.582%0.82282%0.817SS**SBendtrans-84.540.4-164.9-160.6162-169.400113.7
123K37.1Very low39.8Very low197 Ų197154.2 Ų154.286%0.85782%0.818SS**  trans-126.564.8-173.4-73.5-172.8177.9-179.90113.3S121S121-K123 PolarHBondContact O-N 2.7Å
124S41.9Very low39.4Very low117 Ų117156.8 Ų156.882%0.81883%0.83SS**  trans-163.748.2156.4670000112.6
125K36.7Very low38.6Very low181 Ų181155.4 Ų155.479%0.78783%0.831SS**  trans-10081.5160.9-74.5177.3-178.51670107.2
126N39.5Very low37.7Very low159 Ų159154.9 Ų154.985%0.8583%0.83SS**  trans-179.346.6161.5-94.9-8.2000114.4
127I42.2Very low37Very low179 Ų179155.7 Ų155.792%0.91883%0.827SS**  trans-133.271.2158.7-52.5176.8000107.2
128R31.9Very low36.8Very low239 Ų239157.8 Ų157.890%0.90283%0.828SS**  trans-129.394.6175.3-135.5-173.9-173.1-173.61.3105.8
129R36.2Very low36.3Very low237 Ų237161.3 Ų161.389%0.89483%0.827SS**  trans156.2139153.6-86.9157.9-176.3-168.80.9109.4
130K36.4Very low36.1Very low198 Ų198157 Ų15786%0.86182%0.823SS**  trans87.784.2172.6-51.2-175.4179.5-175.50114.8
131Q34.3Very low35.6Very low195 Ų195153.9 Ų153.991%0.91181%0.812SS**  -178.872.7126-94.3173.525.600107.4
132A33.3Very low35.3Very low99 Ų99158.2 Ų158.282%0.81882%0.82SS**  trans-98.3139.3156.400000105.7
133A37.1Very low35.7Very low96 Ų96156.5 Ų156.579%0.79381%0.81SS**  trans79.973.4-17700000115.7
134V35Very low35.8Very low141 Ų141157 Ų15786%0.85581%0.812SS**  trans-112.4119.2136.7178.40000106.1
135C31.6Very low35.5Very low103 Ų103154.4 Ų154.470%0.69680%0.803SS**  trans-57.2142-169.5-61.50000112.5I137C135-I137 PolarHBondContact O-N 3.2Å; C135-I137 VanDerWaalsContact O-N 3.1Å
136S30.8Very low35.6Very low106 Ų106151.4 Ų151.474%0.74180%0.802SS**  trans-46.5106.8156.744.30000110.5T138S136-T138 PolarHBondContact O-N 3.26Å
137I32.2Very low35.5Very low164 Ų164150.1 Ų150.184%0.84180%0.8SS**  trans-80.899.3160.5-63.6173.1000105.8C135C135-I137 PolarHBondContact O-N 3.2Å; C135-I137 VanDerWaalsContact O-N 3.1Å
138T34.2Very low35.4Very low104 Ų104148.6 Ų148.664%0.63879%0.793SS**  trans-66.4126.8160.838.80000109.3S136S136-T138 PolarHBondContact O-N 3.26Å
139E32.3Very low36Very low172 Ų172145.6 Ų145.680%0.80479%0.789SS**SBendtrans72.3137.9144.2-62.4174.5173.800119.1
140S34.3Very low36.5Very low113 Ų113138.9 Ų138.979%0.7978%0.778SS**  trans69.278.4163.667.10000118.4
141E32.9Very low37Very low145 Ų145138.6 Ų138.668%0.67878%0.78SS**  trans-139.799.1136.4-79.3-153.4146.500109.4K143E141-K143 HydrophobicContact CB-CG 4.39Å; E141-K143 PolarHBondContact O-N 3.24Å; E141-K143 WeakPolarHBondContact OE1-CE 3.31Å; E141-K143 IonicContact OE1-NZ 3.73Å; E141-K143 PolarHBondContact OE1-NZ 3.06Å; E141-K143 VanDerWaalsContact OE2-CD 3.31Å; E141-K143 WeakPolarHBondContact OE2-CD 3.38Å; E141-K143 VanDerWaalsContact OE2-CE 3.27Å; E141-K143 WeakPolarHBondContact OE2-CE 3.1Å; E141-K143 IonicContact OE2-NZ 3.68Å; E141-K143 PolarHBondContact OE2-NZ 3.05Å
142E36.3Very low37.2Very low201 Ų201135.9 Ų135.994%0.93977%0.772SS**  trans-57.687.8152.9-71-177.8146.300108.5
143K43.1Very low37.5Very low140 Ų140137.1 Ų137.161%0.60977%0.765SS**  trans-129.495.7168.9-78.2-172.5-172.3153.50110.3E141 G145E141-K143 HydrophobicContact CB-CG 4.39Å; E141-K143 PolarHBondContact O-N 3.24Å; E141-K143 WeakPolarHBondContact OE1-CE 3.31Å; E141-K143 IonicContact OE1-NZ 3.73Å; E141-K143 PolarHBondContact OE1-NZ 3.06Å; E141-K143 VanDerWaalsContact OE2-CD 3.31Å; E141-K143 WeakPolarHBondContact OE2-CD 3.38Å; E141-K143 VanDerWaalsContact OE2-CE 3.27Å; E141-K143 WeakPolarHBondContact OE2-CE 3.1Å; E141-K143 IonicContact OE2-NZ 3.68Å; E141-K143 PolarHBondContact OE2-NZ 3.05Å; K143-G145 PolarHBondContact O-N 2.97Å
144K38.9Very low37.7Very low208 Ų208138.2 Ų138.290%0.90476%0.762SS**  trans38.174.3135.2-60.9-174.3177.7-175.40114.1
145G36Very low38Very low62 Ų62142 Ų14264%0.63976%0.761SS**  trans-61.6142.6154.300000109.3K143 T147K143-G145 PolarHBondContact O-N 2.97Å; G145-T147 PolarHBondContact O-N 3.45Å
146P40Very low38.4Very low118 Ų118144.8 Ų144.877%0.76677%0.767SS**  trans-60.4127.3-175.223.6-32.7000111I148P146-I148 PolarHBondContact O-N 3.49Å
147T37.4Very low38.8Very low132 Ų132150.5 Ų150.581%0.8177%0.772SS**  trans-61.699.9168.5-47.90000108G145 E149G145-T147 PolarHBondContact O-N 3.45Å; T147-E149 PolarHBondContact O-N 3.09Å
148I40Very low39.4Very low148 Ų148147.6 Ų147.676%0.75976%0.764SS**  trans-77.7107.4168-60.4172.2000105.5P146 S150P146-I148 PolarHBondContact O-N 3.49Å; I148-S150 VanDerWaalsContact C-N 3.32Å; I148-S150 PolarHBondContact O-N 3.04Å
149E42.6Very low39.6Very low176 Ų176149.5 Ų149.582%0.82278%0.775SS**  trans-61.598.4165.1-65.1-174.3168.100107.3T147 E151T147-E149 PolarHBondContact O-N 3.09Å; E149-E151 VanDerWaalsContact C-N 3.32Å; E149-E151 PolarHBondContact O-N 3.13Å
150S48.7Very low40Very low96 Ų96151.9 Ų151.967%0.67178%0.777SS**  trans-7296.9168.958.70000107.1I148 N152I148-S150 VanDerWaalsContact C-N 3.32Å; I148-S150 PolarHBondContact O-N 3.04Å; S150-N152 PolarHBondContact O-N 2.83Å; S150-N152 VanDerWaalsContact O-N 3.08Å
151E45.2Very low40.1Very low191 Ų191155.8 Ų155.889%0.89378%0.782SS**  trans-50.6115.2166.1-136.3175.1-177.700107.9E149 D153E149-E151 VanDerWaalsContact C-N 3.32Å; E149-E151 PolarHBondContact O-N 3.13Å; E151-D153 PolarHBondContact O-N 3.4Å
152N38.4Very low40.4Very low138 Ų138153.5 Ų153.574%0.73879%0.788SS**  trans-59.5100.7179.6-79.5-60.3000109.4S150 T154S150-N152 PolarHBondContact O-N 2.83Å; S150-N152 VanDerWaalsContact O-N 3.08Å; N152-T154 HydrophobicContact CB-CG2 4.47Å; N152-T154 PolarHBondContact O-N 3.12Å; N152-T154 PolarHBondContact O-OG1 3.15Å
153D40.8Very low40.3Very low126 Ų126150 Ų15067%0.67478%0.781SS**  trans-68.686.6167.7-160.4-3.5000108.6E151 R155E151-D153 PolarHBondContact O-N 3.4Å; D153-R155 PolarHBondContact O-N 2.9Å; D153-R155 WeakPolarHBondContact OD1-CD 3.48Å; D153-R155 WeakPolarHBondContact OD1-CG 3.33Å
154T40.6Very low40.1Very low119 Ų119151.5 Ų151.573%0.7380%0.795SS**THydrogen-bonded Turntrans-71.616.3-177.224.30000112.9N152N152-T154 HydrophobicContact CB-CG2 4.47Å; N152-T154 PolarHBondContact O-N 3.12Å; N152-T154 PolarHBondContact O-OG1 3.15Å
155R42.6Very low40Very low220 Ų220147 Ų14783%0.8379%0.79SS**THydrogen-bonded Turntrans-85.1-6-175.3-69.4-176.5-179.8-154.11.9115.1D153 R157D153-R155 PolarHBondContact O-N 2.9Å; D153-R155 WeakPolarHBondContact OD1-CD 3.48Å; D153-R155 WeakPolarHBondContact OD1-CG 3.33Å; R155-R157 PolarHBondContact O-N 3.08Å
156I39.1Very low39.9Very low162 Ų162150.8 Ų150.883%0.83180%0.801SS**  trans-97.464.9172.7-43.6179.4000109.6
157R40.1Very low39.5Very low225 Ų225153 Ų15385%0.84981%0.806SS**  trans-78.6123.5160.2-92.2-174.8178.1176.11.5108.2R155 V159R155-R157 PolarHBondContact O-N 3.08Å; R157-V159 PolarHBondContact O-N 3.09Å
158P43.6Very low39.4Very low103 Ų103155.9 Ų155.967%0.66981%0.81SS**  trans-60.9124.8175.422.7-30.5000109.3R160P158-R160 PolarHBondContact O-N 2.77Å
159V39.5Very low38.9Very low144 Ų144160.1 Ų160.187%0.87382%0.817SS**  trans-60.689.6163.9176.90000106.1R157 E161R157-V159 PolarHBondContact O-N 3.09Å; V159-E161 PolarHBondContact O-N 2.87Å
160R38.8Very low38.7Very low223 Ų223160.7 Ų160.784%0.84282%0.816SS**  trans-64.3120.2168.4-94.7-178.1166.8133.2-3.5107.3P158 A162P158-R160 PolarHBondContact O-N 2.77Å; R160-A162 PolarHBondContact O-N 3.09Å
161E38Very low38.2Very low194 Ų194165.1 Ų165.191%0.90782%0.823SS**  trans-44.2114.8166.3-61.5171.4160.500110.1V159V159-E161 PolarHBondContact O-N 2.87Å
162A39.6Very low37.5Very low97 Ų97163.6 Ų163.680%0.80282%0.818SS**  trans-14069.7171.200000108.6R160R160-A162 PolarHBondContact O-N 3.09Å
163T33.7Very low37.6Very low129 Ų129168 Ų16879%0.79183%0.825SS**  trans-133141.1157.948.50000107.2
164L39.2Very low37.4Very low171 Ų171169.6 Ų169.690%0.89583%0.833SS**SBendtrans98.672-176.2-50.5174.9000115.6
165S36.6Very low37.4Very low114 Ų114170.2 Ų170.280%0.79784%0.836SS**  trans-175.478.7135.9170.80000110.4
166T34.3Very low37Very low141 Ų141164.4 Ų164.487%0.86583%0.829SS**  trans-128.370169.68.70000109.8
167N31Very low36.9Very low164 Ų164163.1 Ų163.188%0.87783%0.829SS**  trans-124.264159-91.5-32.3000108.6
168Q35.6Very low36.7Very low192 Ų192158.2 Ų158.290%0.89782%0.824SS**  trans-131.394.8161.7-73.4-164.6400110.5
169R30Very low36.4Very low238 Ų238162.9 Ų162.990%0.89883%0.834SS**  trans-53.7131.8154.2-72169.7163.7175.9-5.9109.1
170K37.6Very low36.3Very low187 Ų187161.4 Ų161.481%0.81383%0.825SS**  161.5118.1121.1-87.2168.8-176.2179.90111.8
171K37.2Very low36.3Very low189 Ų189159 Ų15982%0.82282%0.821SS**  trans54113.3131.6-61.4-175.4176.7-172.80119.7
172M31.6Very low36.5Very low159 Ų159156.6 Ų156.678%0.78381%0.814SS**  59.6112127.9-59.2-160.969.800119.6
173R39.6Very low36.4Very low232 Ų232159.8 Ų159.888%0.87581%0.813SS**  -154.9118.1128.8-106.1172.2-165.3164.83.4108.8V175R173-V175 PolarHBondContact O-N 3.37Å
174N38.1Very low36.6Very low159 Ų159162 Ų16285%0.8581%0.814SS**  trans-64108.3166.4-65.6-16.3000107.1
175V38.7Very low36.5Very low131 Ų131159.9 Ų159.979%0.79481%0.808SS**  trans-101.9120.1169.6-176.40000107.4R173R173-V175 PolarHBondContact O-N 3.37Å
176S35.4Very low36.9Very low98 Ų98161.4 Ų161.469%0.68581%0.806SS**  trans-54.3138.6-175.350.60000113.8T178S176-T178 PolarHBondContact O-N 3.19Å
177T37.1Very low37.1Very low135 Ų135162.7 Ų162.783%0.82880%0.802SS**  trans-62106.8167.445.20000111.5
178T35.2Very low37.5Very low122 Ų122164 Ų16475%0.74880%0.803SS**  trans-81.3112.1160.936.50000109.2S176 V180S176-T178 PolarHBondContact O-N 3.19Å; T178-V180 PolarHBondContact O-N 3.29Å
179K37.7Very low37.7Very low201 Ų201161.2 Ų161.287%0.87480%0.799SS**  trans-64.7108.4167.5-69177.4176.8179.90108.3
180V37.3Very low38Very low114 Ų114153.3 Ų153.369%0.69179%0.791SS**  trans-91.9108.6167.5-177.50000106.9T178 N182T178-V180 PolarHBondContact O-N 3.29Å; V180-N182 WeakPolarHBondContact CG1-OD1 3.17Å; V180-N182 PolarHBondContact O-N 2.78Å
181K38.5Very low38Very low173 Ų173153.9 Ų153.975%0.75280%0.797SS**  trans-75.2106.2166.6-72.7179.3172.5-172.20106.9E183K181-E183 PolarHBondContact O-N 3.06Å
182N41.9Very low38Very low143 Ų143148.3 Ų148.377%0.76579%0.786SS**  trans-88.399.2162.7-74.4-6.4000106.8V180 E184V180-N182 WeakPolarHBondContact CG1-OD1 3.17Å; V180-N182 PolarHBondContact O-N 2.78Å; N182-E184 PolarHBondContact O-N 3Å
183E37.2Very low38Very low163 Ų163148.3 Ų148.376%0.76279%0.788SS**  trans-83.597.6164-71.8173.2-172.700106.3K181K181-E183 PolarHBondContact O-N 3.06Å
184E37.8Very low37.9Very low176 Ų176143 Ų14382%0.82278%0.784SS**  trans-104.4100.3172.8-159.1171.4-160.400108.3N182 I186N182-E184 PolarHBondContact O-N 3Å; E184-I186 PolarHBondContact O-N 2.94Å
185T37.7Very low37.8Very low126 Ų126141.6 Ų141.677%0.77378%0.781SS**  trans-75.5107.1178.2-42.70000108.7
186I44.8Very low37.7Very low147 Ų147139 Ų13975%0.75478%0.78SS**  trans-88.8108170.9-58.3174.7000107.6E184 Q188E184-I186 PolarHBondContact O-N 2.94Å; I186-Q188 PolarHBondContact O-N 3.47Å
187E39.9Very low37.7Very low168 Ų168142.9 Ų142.979%0.78579%0.787SS**  trans-62.9109.2171.5-68.3-178.1161.800109.8V189E187-V189 PolarHBondContact O-N 3.14Å; E187-V189 VanDerWaalsContact O-N 3.13Å
188Q38.7Very low37.6Very low192 Ų192142.5 Ų142.590%0.89779%0.79SS**  trans-73.997.5167-74.1-176.6-6.100108.6I186 G190I186-Q188 PolarHBondContact O-N 3.47Å; Q188-G190 PolarHBondContact O-N 3.44Å; Q188-G190 VanDerWaalsContact O-N 3.08Å
189V40Very low37.6Very low132 Ų132140.2 Ų140.280%0.879%0.791SS**  trans-70.9100.4167.2-177.30000107.5E187 E191E187-V189 PolarHBondContact O-N 3.14Å; E187-V189 VanDerWaalsContact O-N 3.13Å; V189-E191 PolarHBondContact O-N 3.19Å
190G35.4Very low37.5Very low72 Ų72138.6 Ų138.674%0.74279%0.792SS**  trans-71.7111.717000000110.2Q188Q188-G190 PolarHBondContact O-N 3.44Å; Q188-G190 VanDerWaalsContact O-N 3.08Å
191E37.3Very low37.2Very low199 Ų199141.1 Ų141.193%0.9380%0.802SS**  trans-91.9115.6161.4-161.5169.4-166.700108.1V189V189-E191 PolarHBondContact O-N 3.19Å
192A37.6Very low37.1Very low73 Ų73142 Ų14260%0.60381%0.808SS**  trans-102.3132-169.800000110.8
193I31.2Very low36.8Very low158 Ų158144 Ų14481%0.8181%0.813SS**  trans72.3140.4139.6-59.2167.4000115.4
194P37.5Very low36.9Very low122 Ų122144.8 Ų144.879%0.79282%0.817SS**  cis-136.9159.133.3198000118.8
195V36.3Very low36.9Very low129 Ų129146 Ų14678%0.78282%0.82SS**PPolyproline II helixtrans-63.4126.9168.8172.80000111.9
196G36.7Very low37.2Very low77 Ų77148.9 Ų148.979%0.79482%0.822SS**PPolyproline II helixtrans-78.4125.5160.200000110.6
197Q34.7Very low36.9Very low178 Ų178149 Ų14983%0.83282%0.822SS**PPolyproline II helixtrans-78.9161.8-177.8-67.7174.3-33.200113.3
198S36Very low36.8Very low127 Ų127151 Ų15189%0.88882%0.823SS**  trans102.8119.2151.383.20000117.3
199G34.4Very low36.9Very low74 Ų74149.3 Ų149.376%0.76382%0.82SS**  trans152.283167.500000114.8
200N35.7Very low37Very low168 Ų168151.8 Ų151.890%0.89882%0.82SS**  trans65.7108.2154.6-69.1-15.9000121.4E202N200-E202 PolarHBondContact O-N 3.49Å
201N31.8Very low37.2Very low166 Ų166152.9 Ų152.989%0.88882%0.816SS**  trans-59.3114154.8-72.3-46.8000111.6
202E35.8Very low37.5Very low192 Ų192148.1 Ų148.190%0.89781%0.811SS**  trans-139100.6146.8-119.6173.7-171.600109.4N200N200-E202 PolarHBondContact O-N 3.49Å
203Q36.2Very low37.7Very low186 Ų186153.6 Ų153.687%0.86982%0.821SS**  trans-3.3113.9158-56173.17.900116.6
204Q38.5Very low38Very low179 Ų179154.9 Ų154.984%0.83682%0.823SS**  trans-146.3100.5133.1-101.8178.527.100109.3F206Q204-F206 PolarHBondContact O-N 3.31Å
205K38.7Very low37.8Very low202 Ų202151.8 Ų151.888%0.87881%0.814SS**  trans-68.4107.1159.3-78.2175.4172.6178.40107.5
206F43.8Very low38.1Very low186 Ų186152.8 Ų152.882%0.81681%0.813SS**  trans-136.3140.6151.2-85.8-77.4000110.3Q204Q204-F206 PolarHBondContact O-N 3.31Å
207I38.6Very low38.1Very low149 Ų149154.6 Ų154.676%0.76481%0.809SS**  trans-75.4146.7-157.9-73.6154.2000110.8D209I207-D209 PolarHBondContact O-N 3.02Å; I207-D209 VanDerWaalsContact O-N 3.14Å
208R38Very low38.4Very low210 Ų210150.3 Ų150.379%0.79280%0.798SS**  trans-54.2106.9165.1-75.4171.5171.5163.4-1.9110.5
209D39.8Very low38.7Very low157 Ų157150.7 Ų150.784%0.8479%0.79SS**  trans-97.289.4152.4-77.7-23000108.8I207 S211I207-D209 PolarHBondContact O-N 3.02Å; I207-D209 VanDerWaalsContact O-N 3.14Å; D209-S211 PolarHBondContact O-N 3.43Å
210K42.4Very low38.8Very low184 Ų184155.1 Ų155.180%0.879%0.791SS**  trans-69.899.2161.1-73-177.9174.1-174.90107.5
211S40.4Very low39.1Very low95 Ų95152.3 Ų152.366%0.66478%0.78SS**  trans-132.295.2149.784.60000108.9D209 K213D209-S211 PolarHBondContact O-N 3.43Å; S211-K213 PolarHBondContact O-N 2.75Å
212A43.2Very low39.5Very low99 Ų99152 Ų15282%0.81877%0.773SS**  trans-65.282.5161.700000107.4
213K41.6Very low39.9Very low188 Ų188148.2 Ų148.282%0.81776%0.763SS**  trans-10180.2153.7-73.2-173.9-179.7-179.80105.4S211 G215S211-K213 PolarHBondContact O-N 2.75Å; K213-G215 PolarHBondContact O-N 3.02Å
214E37.5Very low39.9Very low184 Ų184146.2 Ų146.286%0.8676%0.757SS**  trans-60.783.7154.2-72.7179.9170.400106I216E214-I216 PolarHBondContact O-N 3.28Å
215G34.5Very low39.8Very low58 Ų58141.6 Ų141.660%0.59874%0.743SS**  trans-61.1108.6160.700000105.1K213 V217K213-G215 PolarHBondContact O-N 3.02Å; G215-V217 PolarHBondContact O-N 2.98Å
216I42Very low39.9Very low149 Ų149137.4 Ų137.476%0.76474%0.737SS**  trans-57.795.6162.1-61.7167.4000104.2E214 S218E214-I216 PolarHBondContact O-N 3.28Å; I216-S218 PolarHBondContact O-N 3.35Å
217V37.4Very low39.6Very low116 Ų116136 Ų13670%0.70374%0.738SS**  trans-69.687.7165.9-179.90000103.6G215 N219G215-V217 PolarHBondContact O-N 2.98Å; V217-N219 PolarHBondContact O-N 3.35Å
218S40.1Very low39.7Very low87 Ų87132.5 Ų132.561%0.60873%0.731SS**  trans-59.190.4160.5-560000105.3I216 E220I216-S218 PolarHBondContact O-N 3.35Å; S218-E220 PolarHBondContact O-N 3.33Å
219N41.8Very low39.8Very low135 Ų135126.9 Ų126.972%0.72273%0.73SS**  trans-63.688.8156.5-82.2-17.1000104.5V217 V221V217-N219 PolarHBondContact O-N 3.35Å; N219-V221 HydrophobicContact CB-CG2 4.37Å; N219-V221 PolarHBondContact O-N 3.19Å
220E37.3Very low39.9Very low168 Ų168127.2 Ų127.279%0.78573%0.731SS**  trans-59.482.8155.2-69.4-174.817300105.5S218 E222S218-E220 PolarHBondContact O-N 3.33Å; E220-E222 PolarHBondContact O-N 3.33Å
221V40.8Very low39.7Very low109 Ų109126.9 Ų126.966%0.66173%0.732SS**  trans-67.891.8157.7179.70000102.9N219 V223N219-V221 HydrophobicContact CB-CG2 4.37Å; N219-V221 PolarHBondContact O-N 3.19Å; V221-V223 HydrophobicContact CG1-CG2 4.03Å; V221-V223 PolarHBondContact O-N 3.38Å
222E41Very low39.7Very low160 Ų160128.7 Ų128.775%0.74873%0.734SS**  trans-53.192.4154.2-77-172.2157.700105.4E220 I224E220-E222 PolarHBondContact O-N 3.33Å; E222-I224 PolarHBondContact O-N 3.1Å
223V44.5Very low39.8Very low112 Ų112129.1 Ų129.168%0.67973%0.729SS**  trans-64.792.1159.5179.20000102.7V221 C225V221-V223 HydrophobicContact CG1-CG2 4.03Å; V221-V223 PolarHBondContact O-N 3.38Å; V223-C225 PolarHBondContact O-N 3.38Å
224I36.7Very low39.9Very low143 Ų143128.8 Ų128.873%0.73373%0.727SS**  trans-57.789.3164.3-61.3170.4000104E222 P226E222-I224 PolarHBondContact O-N 3.1Å; I224-P226 WeakPolarHBondContact O-CD 3.47Å; I224-P226 VanDerWaalsContact O-N 3.15Å
225C36Very low40Very low83 Ų83128.5 Ų128.556%0.56173%0.726SS**  trans-58.6116.3165.1-81.20000104.5V223 N227V223-C225 PolarHBondContact O-N 3.38Å; C225-N227 PolarHBondContact O-N 3.42Å
226P41.2Very low40.3Very low113 Ų113135 Ų13573%0.73474%0.738SS**  trans-65.886.9170.627.5-31.2000107.4I224 A228I224-P226 WeakPolarHBondContact O-CD 3.47Å; I224-P226 VanDerWaalsContact O-N 3.15Å; P226-A228 PolarHBondContact O-N 3.25Å; P226-A228 VanDerWaalsContact O-N 3.15Å
227N37.7Very low40.4Very low157 Ų157137 Ų13784%0.8474%0.741SS**  trans-7421.7161.3-87.4-15.8000110.7C225 A229C225-N227 PolarHBondContact O-N 3.42Å; N227-A229 PolarHBondContact O-N 3.16Å
228A40.6Very low40.4Very low76 Ų76139.4 Ų139.463%0.62875%0.745SS**  trans-74.990.8159.300000105.9P226 L230P226-A228 PolarHBondContact O-N 3.25Å; P226-A228 VanDerWaalsContact O-N 3.15Å; A228-L230 PolarHBondContact O-N 2.96Å
229A39.6Very low40.6Very low92 Ų92142.3 Ų142.376%0.7675%0.752SS**  trans-41.995.8159.400000108N227 E231N227-A229 PolarHBondContact O-N 3.16Å; A229-E231 PolarHBondContact O-N 3.29Å
230L42.1Very low40.6Very low164 Ų164141.7 Ų141.786%0.85975%0.747SS**  trans-60.392.3160.9-88.8150.9000104.3A228 N232A228-L230 PolarHBondContact O-N 2.96Å; L230-N232 PolarHBondContact O-N 3.05Å
231E38.4Very low40.8Very low176 Ų176142.2 Ų142.282%0.82275%0.747SS**  trans-45107.1163.7-73.5-171.5149.800106.5A229 P233A229-E231 PolarHBondContact O-N 3.29Å; E231-P233 WeakPolarHBondContact O-CD 3.24Å
232N40.3Very low41Very low133 Ų133142.5 Ų142.571%0.71175%0.749SS**  trans-56.6110174-92.4-48.6000107.7L230 F234L230-N232 PolarHBondContact O-N 3.05Å; N232-F234 PolarHBondContact O-N 3.13Å
233P45Very low41.2Very low109 Ų109142.4 Ų142.471%0.70875%0.753SS**G310 helixtrans-74.66.2-179.527.4-25.6000112.5E231 Q235E231-P233 WeakPolarHBondContact O-CD 3.24Å; P233-Q235 PolarHBondContact O-N 2.98Å
234F43.4Very low41.1Very low180 Ų180140 Ų14079%0.78975%0.752SS**G310 helixtrans-87.87.2-171.6-75.7-76.2000116.1N232N232-F234 PolarHBondContact O-N 3.13Å
235Q39.6Very low41.2Very low178 Ų178141.4 Ų141.483%0.83276%0.755SS**G310 helixtrans-100.77.4177.7-69.4-1621100116.1P233 K237P233-Q235 PolarHBondContact O-N 2.98Å; Q235-K237 VanDerWaalsContact C-N 3.34Å; Q235-K237 PolarHBondContact O-N 2.87Å
236K41.3Very low41.6Very low196 Ų196146.1 Ų146.185%0.85277%0.769SS**  trans-86.184.4159-77.5-177.6-179.2174.40108.9Q238K236-Q238 PolarHBondContact O-N 2.75Å
237K44.1Very low41.7Very low191 Ų191149 Ų14983%0.8377%0.773SS**  trans-57.888.7159.4-70.6179.8179.2177.70107.6Q235 I239Q235-K237 VanDerWaalsContact C-N 3.34Å; Q235-K237 PolarHBondContact O-N 2.87Å; K237-I239 PolarHBondContact O-N 3.44Å
238Q37.8Very low42.3Very low166 Ų166152.3 Ų152.378%0.77677%0.773SS**  trans-66.4104.3162.5-106.8-177.41.900106.2K236 I240K236-Q238 PolarHBondContact O-N 2.75Å; Q238-I240 HydrophobicContact CB-CG1 4.3Å; Q238-I240 PolarHBondContact O-N 3.45Å
239I43.6Very low42.9Very low148 Ų148153.2 Ų153.276%0.75978%0.781SS**  trans-67.686.4165.7-60.5165.9000105.2K237 K241K237-I239 PolarHBondContact O-N 3.44Å; I239-K241 HydrophobicContact CG2-CG 4.45Å; I239-K241 PolarHBondContact O-N 3.44Å; I239-K241 VanDerWaalsContact O-N 3.08Å
240I42.7Very low43.7Very low122 Ų122159.4 Ų159.463%0.62679%0.785SS**  trans-72.2102.3168.9-57.3175.4000105.2Q238 T242Q238-I240 HydrophobicContact CB-CG1 4.3Å; Q238-I240 PolarHBondContact O-N 3.45Å; I240-T242 HydrophobicContact CG2-CG2 3.87Å; I240-T242 PolarHBondContact O-N 2.99Å
241K40.8Very low44.5Very low179 Ų179157.8 Ų157.878%0.77878%0.784SS**  trans-66.889163.1-67.2178.5179.4-179.50106.8I239 D243I239-K241 HydrophobicContact CG2-CG 4.45Å; I239-K241 PolarHBondContact O-N 3.44Å; I239-K241 VanDerWaalsContact O-N 3.08Å; K241-D243 PolarHBondContact O-N 3.35Å
242T44.4Very low45.5Very low114 Ų114155.9 Ų155.970%0.69978%0.779SS**  trans-78.6111.6161.345.70000106.9I240 G244I240-T242 HydrophobicContact CG2-CG2 3.87Å; I240-T242 PolarHBondContact O-N 2.99Å; T242-G244 PolarHBondContact O-N 3.5Å
243D45.6Very low46.1Very low158 Ų158152.7 Ų152.785%0.84577%0.765SS**  trans-63.380.5160.6-63-38.1000107K241 E245K241-D243 PolarHBondContact O-N 3.35Å; D243-E245 PolarHBondContact O-N 3.2Å
244G41.9Very low47Very low63 Ų63153 Ų15365%0.64977%0.77SS**  trans-70.280.9173.100000107.7T242 E246T242-G244 PolarHBondContact O-N 3.5Å; G244-E246 PolarHBondContact O-N 3.47Å
245E40.2Very low47.6Very low171 Ų171151.9 Ų151.980%0.79976%0.761SS**  trans-49.1112.9154.8-92.3-166.3144.700106.4D243 Q247D243-E245 PolarHBondContact O-N 3.2Å; E245-Q247 PolarHBondContact O-N 3Å
246E44.3Very low48.2Very low183 Ų183148 Ų14886%0.85574%0.742SS**  trans-52.392.3168.9-74.7-179142.600107.9G244 R248G244-E246 PolarHBondContact O-N 3.47Å; E246-R248 PolarHBondContact O-N 3.32Å
247Q43.4Very low48.6Very low174 Ų174140.8 Ų140.881%0.81372%0.724SS**  trans-67.789.1166.7-71.6-160.5-0.200106.1E245 A249E245-Q247 PolarHBondContact O-N 3Å; Q247-A249 PolarHBondContact O-N 3.48Å; Q247-A249 VanDerWaalsContact O-N 3.12Å
248R49.5Very low48.8Very low225 Ų225141.3 Ų141.385%0.84972%0.721SS**  trans-41.3122.6170.7-84-176.1171.6-178.5-1.9108E246 R250E246-R248 PolarHBondContact O-N 3.32Å; R248-R250 PolarHBondContact O-N 3.11Å
249A52.8Low48.8Very low96 Ų96143.3 Ų143.379%0.79372%0.721SS**  trans-43.3115.7178.700000109.2Q247Q247-A249 PolarHBondContact O-N 3.48Å; Q247-A249 VanDerWaalsContact O-N 3.12Å
250R57.5Low49Very low222 Ų222144.3 Ų144.384%0.83872%0.723SS**PPolyproline II helixtrans-54.8127.9177.3-76.4-177.9178.7-166.90.1107.7R248 L252R248-R250 PolarHBondContact O-N 3.11Å; R250-L252 PolarHBondContact O-N 3.18Å; R250-L252 VanDerWaalsContact O-N 3.11Å
251P57.9Low49.2Very low129 Ų129145.9 Ų145.984%0.83873%0.728SS**PPolyproline II helixtrans-57.1123175.820.7-29.6000108.5
252L58.8Low49.3Very low136 Ų136142.9 Ų142.971%0.71273%0.725SS**PPolyproline II helixtrans-58.9147.1176.2-72.6168.2000109.3R250 S254R250-L252 PolarHBondContact O-N 3.18Å; R250-L252 VanDerWaalsContact O-N 3.11Å; L252-S254 PolarHBondContact O-N 3.26Å
253P54.5Low49.2Very low66 Ų66145.8 Ų145.843%0.42973%0.732SS.*PPolyproline II helixtrans-53.3135.8177.9-23.532.3000111.6W255 Q256P253-W255 VanDerWaalsContact CB-CD1 3.43Å; P253-W255 HydrophobicContact CB-CG 4.33Å; P253-W255 VanDerWaalsContact CB-NE1 3.26Å; P253-W255 PolarHBondContact O-N 2.85Å; P253-Q256 PolarHBondContact O-N 2.88Å
254S62.7Low48.9Very low115 Ų115146.4 Ų146.480%0.80473%0.73SS**THydrogen-bonded Turntrans-57.5-18.2-175.454.90000115.1L252L252-S254 PolarHBondContact O-N 3.26Å
255W55.9Low48.7Very low157 Ų157149.8 Ų149.860%0.59574%0.738SS**THydrogen-bonded Turntrans-73.7-23.3175.865.6-95.7000113.6P253 R258P253-W255 VanDerWaalsContact CB-CD1 3.43Å; P253-W255 HydrophobicContact CB-CG 4.33Å; P253-W255 VanDerWaalsContact CB-NE1 3.26Å; P253-W255 PolarHBondContact O-N 2.85Å; W255-R258 PolarHBondContact O-N 3.03Å
256Q52.2Low48.5Very low96 Ų96145 Ų14545%0.44974%0.736SS.*THydrogen-bonded Turntrans-73.5-29.1177.3-105.6164.9-5.800112.7P253 R258P253-Q256 PolarHBondContact O-N 2.88Å; Q256-R258 VanDerWaalsContact C-N 3.31Å; Q256-R258 PolarHBondContact O-N 3.23Å
257G49.9Very low48.3Very low46 Ų46144.1 Ų144.147%0.47474%0.737SS.*G310 helixtrans-74.7-18.1175.300000114.3W259G257-W259 PolarHBondContact O-N 2.77Å
258R48.4Very low48.1Very low201 Ų201140.5 Ų140.576%0.75873%0.73SS**G310 helixtrans-75.9-22.9-171.8-144178-135.6-139.42.1113.9W255 Q256W255-R258 PolarHBondContact O-N 3.03Å; Q256-R258 VanDerWaalsContact C-N 3.31Å; Q256-R258 PolarHBondContact O-N 3.23Å
259W38.5Very low47.4Very low208 Ų208138.1 Ų138.179%0.78873%0.729SS**G310 helixtrans-82.5-15.6-179.7-65.582.9000113.5G257G257-W259 PolarHBondContact O-N 2.77Å
260Q47Very low46.6Very low169 Ų169138.3 Ų138.379%0.7973%0.725SS**THydrogen-bonded Turntrans-86.2-19.4175-84.5-177.9-6.800113.7
261Q46.3Very low45.5Very low156 Ų156136.6 Ų136.673%0.72973%0.726SS**G310 helixtrans-84-12.3-178.2-85.8-175.3-14.900114.8M263Q261-M263 PolarHBondContact O-N 3.41Å; Q261-M263 VanDerWaalsContact O-N 3.16Å
262T43.7Very low44.6Very low116 Ų116138.3 Ų138.371%0.71273%0.726SS**G310 helixtrans-76.40.9-176.5-21.20000114.5
263M42.1Very low43.3Very low174 Ų174134.9 Ų134.986%0.85772%0.723SS**G310 helixtrans-105.55.7-178.7-68.3-65-174.200114.8Q261Q261-M263 PolarHBondContact O-N 3.41Å; Q261-M263 VanDerWaalsContact O-N 3.16Å
264Q39.2Very low42.2Very low171 Ų171141.4 Ų141.480%0.79975%0.748SS**SBendtrans-136.369-176-72.7-172.7-1.900113.1
265T38.5Very low41Very low134 Ų134141.8 Ų141.882%0.82275%0.751SS**  trans-160.457.3152.8-12.50000111.2
266G35.5Very low40Very low72 Ų72137.3 Ų137.374%0.74275%0.754SS**  trans-103.991.1164.400000108.9S268G266-S268 PolarHBondContact O-N 2.93Å; G266-S268 VanDerWaalsContact O-N 3.15Å
267N39.3Very low39.3Very low164 Ų164138.5 Ų138.588%0.87777%0.773SS**  trans-65.9102.1166.2-79.8-10.6000108.6
268S40.8Very low38.8Very low98 Ų98143.5 Ų143.569%0.68579%0.788SS**  trans-163107.5158.253.50000109.8G266G266-S268 PolarHBondContact O-N 2.93Å; G266-S268 VanDerWaalsContact O-N 3.15Å
269E35.1Very low38.3Very low174 Ų174137.6 Ų137.681%0.81378%0.782SS**  trans36.4105.2140.3-75.6160.6141.700119.1H271E269-H271 PolarHBondContact O-N 3.47Å; E269-H271 VanDerWaalsContact O-N 3.12Å
270S35Very low38.4Very low101 Ų101136.5 Ų136.571%0.70678%0.783SS**  31.174.2114.4175.30000116.7
271H35.4Very low38.3Very low186 Ų186134.1 Ų134.186%0.86178%0.775SS**  trans-126.496.9146.8-77.1-62.5000109.4E269 G273E269-H271 PolarHBondContact O-N 3.47Å; E269-H271 VanDerWaalsContact O-N 3.12Å; H271-G273 PolarHBondContact O-N 2.9Å
272I38.6Very low38Very low164 Ų164134.4 Ų134.484%0.84178%0.782SS**  trans-57.5122.2166.4-73.4159.4000108.9
273G30.2Very low37.9Very low64 Ų64134.1 Ų134.166%0.6678%0.776SS**  trans64.693.5140.900000118.5H271H271-G273 PolarHBondContact O-N 2.9Å
274Q31.9Very low37.5Very low204 Ų204129.4 Ų129.495%0.95377%0.772SS**  trans-136.1108.7139.2-89.3-173-14.200110.1
275S38.2Very low37.5Very low123 Ų123128.8 Ų128.886%0.8677%0.769SS**  trans-73.3132.2167.9172.70000109.3
276G34.5Very low37.6Very low63 Ų63132.7 Ų132.765%0.64977%0.768SS**  trans54.7103.9150.800000117.8
277S37.4Very low38.2Very low121 Ų121137.2 Ų137.285%0.84678%0.775SS**  trans176134.4130.9-78.50000109.2A279S277-A279 VanDerWaalsContact C-N 3.32Å; S277-A279 PolarHBondContact O-N 3.05Å
278N38.5Very low38.3Very low151 Ų151137.1 Ų137.181%0.80777%0.769SS**  trans-55.984.6177.5-65.8-44.1000112.2F280N278-F280 HydrophobicContact CB-CD2 4.06Å; N278-F280 HydrophobicContact CB-CE2 4.13Å; N278-F280 PolarHBondContact O-N 3.46Å
279A39.8Very low38.5Very low76 Ų76141 Ų14163%0.62878%0.776SS**  trans-80.383.3162.200000106.9S277 I281S277-A279 VanDerWaalsContact C-N 3.32Å; S277-A279 PolarHBondContact O-N 3.05Å; A279-I281 HydrophobicContact CB-CD1 4.34Å; A279-I281 HydrophobicContact CB-CG1 3.79Å; A279-I281 PolarHBondContact O-N 3.45Å
280F38.9Very low39.1Very low185 Ų185141 Ų14181%0.81178%0.776SS**  trans-5878.5150.5-77.1-95.2000106.5N278 N282N278-F280 HydrophobicContact CB-CD2 4.06Å; N278-F280 HydrophobicContact CB-CE2 4.13Å; N278-F280 PolarHBondContact O-N 3.46Å; F280-N282 PolarHBondContact O-N 3.19Å
281I45.2Very low39.4Very low120 Ų120145.2 Ų145.262%0.61578%0.782SS**  trans-72.694.5169.5-56.5-176.7000104.2A279 N283A279-I281 HydrophobicContact CB-CD1 4.34Å; A279-I281 HydrophobicContact CB-CG1 3.79Å; A279-I281 PolarHBondContact O-N 3.45Å; I281-N283 WeakPolarHBondContact CG2-OD1 3.13Å; I281-N283 PolarHBondContact O-N 3.24Å
282N39.7Very low39.9Very low162 Ų162145.5 Ų145.587%0.86678%0.781SS**  trans-61.370.9166-148.62.2000107F280 G284F280-N282 PolarHBondContact O-N 3.19Å; N282-G284 PolarHBondContact O-N 3.13Å
283N41.3Very low40.2Very low110 Ų110141.7 Ų141.759%0.58877%0.767SS**  trans-72.485.3170.8-86.8-18.7000106.1I281 Q285I281-N283 WeakPolarHBondContact CG2-OD1 3.13Å; I281-N283 PolarHBondContact O-N 3.24Å; N283-Q285 HydrophobicContact CB-CG 4.38Å; N283-Q285 PolarHBondContact O-N 3.21Å
284G34.8Very low41.2Very low75 Ų75142.2 Ų142.277%0.77376%0.761SS**  trans-61.341.9153.600000111.6N282 R286N282-G284 PolarHBondContact O-N 3.13Å; G284-R286 PolarHBondContact O-N 3.09Å
285Q39.4Very low42.1Very low158 Ų158137.3 Ų137.374%0.73875%0.748SS**  trans-65.892.1159.8-81-170.9-15.500105.5N283 L287N283-Q285 HydrophobicContact CB-CG 4.38Å; N283-Q285 PolarHBondContact O-N 3.21Å; Q285-L287 PolarHBondContact O-N 3.08Å
286R40.9Very low43Very low216 Ų216138.4 Ų138.482%0.81574%0.74SS**  trans-22.9109.9150.8-172.8177.9-175.9-178.9-0.1107.1G284 E288G284-R286 PolarHBondContact O-N 3.09Å; R286-E288 PolarHBondContact O-N 2.89Å
287L46.4Very low44Very low167 Ų167138.2 Ų138.287%0.87473%0.727SS**  trans-62.581.8174.6-159.691.1000105.5Q285 E289Q285-L287 PolarHBondContact O-N 3.08Å; L287-E289 PolarHBondContact O-N 3.13Å
288E42.5Very low44.8Very low161 Ų161135 Ų13575%0.75271%0.707SS**  trans-56.7114.1168.7-83.7-167.8162.900104.9R286 Q290R286-E288 PolarHBondContact O-N 2.89Å; E288-Q290 PolarHBondContact O-N 2.99Å
289E45.8Very low45.7Very low179 Ų179130.7 Ų130.784%0.83669%0.692SS**  trans-11.478.3160.6-63.6172.7177.900112.1L287 K291L287-E289 PolarHBondContact O-N 3.13Å; E289-K291 PolarHBondContact O-N 2.67Å
290Q45.8Very low46.6Very low176 Ų176130.8 Ų130.882%0.82269%0.685SS**  trans-70.992169.8-138.6-175.520.800102.6E288 F292E288-Q290 PolarHBondContact O-N 2.99Å; Q290-F292 PolarHBondContact O-N 2.83Å
291K42.9Very low47.7Very low188 Ų188127 Ų12782%0.81767%0.673SS**  trans-44.2107.5175.4-78.2175.6177.9173.40105.9E289E289-K291 PolarHBondContact O-N 2.67Å
292F44.4Very low48.7Very low193 Ų193125.8 Ų125.885%0.84667%0.667SS**PPolyproline II helixtrans-49.1123.8169.8-78.2-84.7000105.4Q290 S294Q290-F292 PolarHBondContact O-N 2.83Å; F292-S294 PolarHBondContact O-N 3.07Å
293P46.5Very low49.6Very low83 Ų83122.7 Ų122.754%0.53965%0.647SS.*PPolyproline II helixtrans-54.5126.7178.324.3-33000106T297P293-T297 HydrophobicContact CB-CG2 4.34Å
294S50.6Low50.6Low76 Ų76121.6 Ų121.653%0.53164%0.641SS.*PPolyproline II helixtrans-47.4147-175.551.70000109.6F292 E296 T297F292-S294 PolarHBondContact O-N 3.07Å; S294-E296 PolarHBondContact O-N 3Å; S294-T297 PolarHBondContact O-N 3.46Å; S294-T297 PolarHBondContact O-OG1 2.99Å
295S51.5Low52.1Low100 Ų100123.3 Ų123.370%0.69963%0.632SS**Hα-helixtrans-49-24.2-170.856.80000115A298 A299S295-A298 PolarHBondContact O-N 3.39Å; S295-A299 WeakPolarHBondContact O-CB 3.49Å; S295-A299 PolarHBondContact O-N 3.01Å
296E55.2Low53.3Low147 Ų147123.8 Ų123.869%0.68763%0.627SS**Hα-helixtrans-60.5-40172.3-69.8-173.6155.900113S294 T300S294-E296 PolarHBondContact O-N 3Å; E296-T300 PolarHBondContact O-N 2.99Å; E296-T300 PolarHBondContact O-OG1 3.33Å
297T56.2Low54.2Low59 Ų59121.6 Ų121.636%0.36262%0.619SS.*Hα-helixtrans-72-39.9179.4-22.20000111.6P293 S294 A299 T300 L301P293-T297 HydrophobicContact CB-CG2 4.34Å; S294-T297 PolarHBondContact O-N 3.46Å; S294-T297 PolarHBondContact O-OG1 2.99Å; T297-A299 VanDerWaalsContact C-N 3.35Å; T297-T300 VanDerWaalsContact CA-OG1 3.3Å; T297-T300 WeakPolarHBondContact CA-OG1 3.47Å; T297-T300 PolarHBondContact O-N 3.05Å; T297-T300 PolarHBondContact O-OG1 3.34Å; T297-T300 VanDerWaalsContact O-OG1 3.07Å; T297-L301 WeakPolarHBondContact O-CB 3.29Å; T297-L301 VanDerWaalsContact O-CG 3.31Å; T297-L301 WeakPolarHBondContact O-CG 3.31Å; T297-L301 PolarHBondContact O-N 3.04Å
298A55.2Low54.8Low52 Ų52119.1 Ų119.143%0.4361%0.607SS.*Hα-helixtrans-66.5-39.4176.200000111.3S295 L302S295-A298 PolarHBondContact O-N 3.39Å; A298-L302 WeakPolarHBondContact O-CB 3.21Å; A298-L302 PolarHBondContact O-N 3.16Å
299A57.4Low55.3Low61 Ų61115.4 Ų115.450%0.50460%0.595SS.*Hα-helixtrans-66.5-40.8176.800000112.3S295 T297 L302 H303S295-A299 WeakPolarHBondContact O-CB 3.49Å; S295-A299 PolarHBondContact O-N 3.01Å; T297-A299 VanDerWaalsContact C-N 3.35Å; A299-L302 PolarHBondContact O-N 2.88Å; A299-H303 WeakPolarHBondContact O-CB 3.33Å; A299-H303 PolarHBondContact O-N 3.1Å
300T57.9Low55.8Low78 Ų78115.7 Ų115.748%0.47959%0.588SS.*Hα-helixtrans-65.4-45175.4260000111.7E296 T297 L302 H303 D304E296-T300 PolarHBondContact O-N 2.99Å; E296-T300 PolarHBondContact O-OG1 3.33Å; T297-T300 VanDerWaalsContact CA-OG1 3.3Å; T297-T300 WeakPolarHBondContact CA-OG1 3.47Å; T297-T300 PolarHBondContact O-N 3.05Å; T297-T300 PolarHBondContact O-OG1 3.34Å; T297-T300 VanDerWaalsContact O-OG1 3.07Å; T300-L302 VanDerWaalsContact C-N 3.3Å; T300-L302 PolarHBondContact O-N 3.2Å; T300-H303 PolarHBondContact O-N 3.11Å; T300-D304 PolarHBondContact O-N 2.75Å
301L61.9Low56.2Low107 Ų107110.1 Ų110.156%0.5657%0.572SS**Hα-helixtrans-57.9-41.8174.2-74.9168.8000112.3T297 H303 D304 L305T297-L301 WeakPolarHBondContact O-CB 3.29Å; T297-L301 VanDerWaalsContact O-CG 3.31Å; T297-L301 WeakPolarHBondContact O-CG 3.31Å; T297-L301 PolarHBondContact O-N 3.04Å; L301-H303 VanDerWaalsContact C-N 3.3Å; L301-H303 PolarHBondContact O-N 3.2Å; L301-D304 PolarHBondContact O-N 2.66Å; L301-L305 WeakPolarHBondContact O-CB 3.46Å; L301-L305 PolarHBondContact O-N 2.7Å
302L66.2Low56.7Low93 Ų93103.2 Ų103.249%0.48755%0.55SS.*Hα-helixtrans-66.5-34.4176.8-143.183.6000112A298 A299 T300 R306A298-L302 WeakPolarHBondContact O-CB 3.21Å; A298-L302 PolarHBondContact O-N 3.16Å; A299-L302 PolarHBondContact O-N 2.88Å; T300-L302 VanDerWaalsContact C-N 3.3Å; T300-L302 PolarHBondContact O-N 3.2Å; L302-R306 VanDerWaalsContact O-CG 3.29Å; L302-R306 WeakPolarHBondContact O-CG 3.42Å; L302-R306 PolarHBondContact O-N 3.02Å; L302-R306 VanDerWaalsContact O-N 3.13Å
303H58.9Low57.1Low98 Ų9898 Ų9845%0.45453%0.531SS..Hα-helixtrans-73.4-37179.5-145.6-64.7000112.2A299 T300 L301 R306 R307A299-H303 WeakPolarHBondContact O-CB 3.33Å; A299-H303 PolarHBondContact O-N 3.1Å; T300-H303 PolarHBondContact O-N 3.11Å; L301-H303 VanDerWaalsContact C-N 3.3Å; L301-H303 PolarHBondContact O-N 3.2Å; H303-R306 PolarHBondContact O-N 2.79Å; H303-R307 PolarHBondContact O-N 2.99Å
304D62.1Low57.4Low86 Ų86100.5 Ų100.546%0.4654%0.536SS..Hα-helixtrans-69.7-42175.3-74.1-17.8000111.6T300 L301 R306 R307 N308T300-D304 PolarHBondContact O-N 2.75Å; L301-D304 PolarHBondContact O-N 2.66Å; D304-R306 VanDerWaalsContact C-N 3.33Å; D304-R306 PolarHBondContact O-N 3Å; D304-R307 PolarHBondContact O-N 3.05Å; D304-N308 WeakPolarHBondContact O-CB 3.46Å; D304-N308 PolarHBondContact O-N 2.8Å; D304-N308 PolarHBondContact O-ND2 3.03Å
305L65.4Low57.5Low112 Ų112103.8 Ų103.859%0.58654%0.543SS*.Hα-helixtrans-57.6-45.1171.8-103.1156.9000111.9L301 R307 N308 V309L301-L305 WeakPolarHBondContact O-CB 3.46Å; L301-L305 PolarHBondContact O-N 2.7Å; L305-R307 PolarHBondContact O-N 3.48Å; L305-N308 PolarHBondContact O-N 3.17Å; L305-V309 WeakPolarHBondContact O-CG2 3.31Å; L305-V309 PolarHBondContact O-N 3.09Å
306R66Low57.4Low168 Ų168107.5 Ų107.563%0.63454%0.543SS*.Hα-helixtrans-63.8-38.7177.8-76.8174.7178.2165.71.3112.6L302 H303 D304 R310L302-R306 VanDerWaalsContact O-CG 3.29Å; L302-R306 WeakPolarHBondContact O-CG 3.42Å; L302-R306 PolarHBondContact O-N 3.02Å; L302-R306 VanDerWaalsContact O-N 3.13Å; H303-R306 PolarHBondContact O-N 2.79Å; D304-R306 VanDerWaalsContact C-N 3.33Å; D304-R306 PolarHBondContact O-N 3Å; R306-R310 PolarHBondContact O-N 2.83Å
307R59.8Low57.2Low169 Ų169108.8 Ų108.864%0.63855%0.546SS*.Hα-helixtrans-66.7-43.3175.5-79.2-175.6176.7178.60.6111.7H303 D304 L305 V309 R310 A311H303-R307 PolarHBondContact O-N 2.99Å; D304-R307 PolarHBondContact O-N 3.05Å; L305-R307 PolarHBondContact O-N 3.48Å; R307-V309 PolarHBondContact O-N 2.68Å; R307-R310 PolarHBondContact O-N 2.76Å; R307-A311 PolarHBondContact O-N 2.99Å
308N57.8Low56.9Low115 Ų115110.6 Ų110.662%0.61556%0.562SS**Hα-helixtrans-65.6-39.9179.7-71-19.2000112.6D304 L305 R310 A311 A312D304-N308 WeakPolarHBondContact O-CB 3.46Å; D304-N308 PolarHBondContact O-N 2.8Å; D304-N308 PolarHBondContact O-ND2 3.03Å; L305-N308 PolarHBondContact O-N 3.17Å; N308-R310 VanDerWaalsContact C-N 3.31Å; N308-R310 PolarHBondContact O-N 3.14Å; N308-A311 PolarHBondContact O-N 3.16Å; N308-A312 WeakPolarHBondContact O-CB 3.3Å; N308-A312 PolarHBondContact O-N 3.26Å
309V54.8Low56.5Low83 Ų83112 Ų11250%0.50357%0.568SS.*Hα-helixtrans-65-35.7174.5172.60000111.6L305 R307 N313L305-V309 WeakPolarHBondContact O-CG2 3.31Å; L305-V309 PolarHBondContact O-N 3.09Å; R307-V309 PolarHBondContact O-N 2.68Å; V309-N313 PolarHBondContact O-N 3.1Å; V309-N313 VanDerWaalsContact O-N 3.16Å; V309-N313 PolarHBondContact O-ND2 3.12Å
310R56Low56Low185 Ų185112.7 Ų112.770%0.69857%0.574SS**Hα-helixtrans-69.7-44.1178.1-150.4-179.5-154-177.15.7111.8R306 R307 N308 N313 E314R306-R310 PolarHBondContact O-N 2.83Å; R307-R310 PolarHBondContact O-N 2.76Å; N308-R310 VanDerWaalsContact C-N 3.31Å; N308-R310 PolarHBondContact O-N 3.14Å; R310-N313 PolarHBondContact O-N 3.22Å; R310-E314 PolarHBondContact O-N 2.96Å; R310-E314 VanDerWaalsContact O-N 3.1Å
311A53.9Low55.5Low59 Ų59114.8 Ų114.849%0.48859%0.587SS.*Hα-helixtrans-62-42.2176.500000112R307 N308 N313 E314 Q315R307-A311 PolarHBondContact O-N 2.99Å; N308-A311 PolarHBondContact O-N 3.16Å; A311-N313 VanDerWaalsContact C-N 3.33Å; A311-N313 PolarHBondContact O-N 3.11Å; A311-E314 PolarHBondContact O-N 2.9Å; A311-Q315 PolarHBondContact O-N 3.35Å
312A52.9Low54.8Low43 Ų43120.6 Ų120.636%0.35560%0.601SS.*Hα-helixtrans-60.3-42.7175.500000111.8N308 Q315 Y316N308-A312 WeakPolarHBondContact O-CB 3.3Å; N308-A312 PolarHBondContact O-N 3.26Å; A312-Q315 PolarHBondContact O-N 3.02Å; A312-Y316 WeakPolarHBondContact O-CD2 3.35Å; A312-Y316 PolarHBondContact O-N 3.29Å
313N52.4Low53.8Low84 Ų84120.2 Ų120.245%0.44961%0.607SS.*Hα-helixtrans-67.9-37.5179.6-82.8-36.5000113.5V309 R310 A311 Q315 Y316 F317V309-N313 PolarHBondContact O-N 3.1Å; V309-N313 VanDerWaalsContact O-N 3.16Å; V309-N313 PolarHBondContact O-ND2 3.12Å; R310-N313 PolarHBondContact O-N 3.22Å; A311-N313 VanDerWaalsContact C-N 3.33Å; A311-N313 PolarHBondContact O-N 3.11Å; N313-Q315 PolarHBondContact O-N 2.93Å; N313-Y316 PolarHBondContact O-N 3.07Å; N313-F317 VanDerWaalsContact O-CD2 3.24Å; N313-F317 WeakPolarHBondContact O-CD2 3.34Å; N313-F317 PolarHBondContact O-N 3.14Å
314E53.8Low53.2Low135 Ų135123.3 Ų123.363%0.63163%0.626SS**Hα-helixtrans-64.7-30.5176.7-74.9-175.5-17900112.5R310 A311 Y316 F317 S318R310-E314 PolarHBondContact O-N 2.96Å; R310-E314 VanDerWaalsContact O-N 3.1Å; A311-E314 PolarHBondContact O-N 2.9Å; E314-Y316 VanDerWaalsContact C-N 3.34Å; E314-Y316 PolarHBondContact O-N 3.12Å; E314-F317 PolarHBondContact O-N 2.93Å; E314-S318 PolarHBondContact O-N 3.07Å; E314-S318 PolarHBondContact O-OG 2.99Å; E314-S318 VanDerWaalsContact O-OG 3.14Å
315Q51.8Low52.4Low145 Ų145124.9 Ų124.968%0.67863%0.633SS**Hα-helixtrans-69.2-31.3175.8-141.1176.6-3.100112.7A311 A312 N313 S318A311-Q315 PolarHBondContact O-N 3.35Å; A312-Q315 PolarHBondContact O-N 3.02Å; N313-Q315 PolarHBondContact O-N 2.93Å; Q315-S318 PolarHBondContact O-OG 3.08Å
316Y50.4Low51.4Low179 Ų179126.9 Ų126.970%0.70264%0.64SS**Hα-helixtrans-71.5-29.2174.1-78.9-76.3000113.4A312 N313 E314A312-Y316 WeakPolarHBondContact O-CD2 3.35Å; A312-Y316 PolarHBondContact O-N 3.29Å; N313-Y316 PolarHBondContact O-N 3.07Å; E314-Y316 VanDerWaalsContact C-N 3.34Å; E314-Y316 PolarHBondContact O-N 3.12Å
317F50.2Low50.8Low173 Ų173129 Ų12976%0.75965%0.648SS**Hα-helixtrans-89.2-21.4-178.9-72.8-70000114.4N313 E314N313-F317 VanDerWaalsContact O-CD2 3.24Å; N313-F317 WeakPolarHBondContact O-CD2 3.34Å; N313-F317 PolarHBondContact O-N 3.14Å; E314-F317 PolarHBondContact O-N 2.93Å
318S50.5Low50.3Low98 Ų98129.7 Ų129.769%0.68566%0.656SS**Hα-helixtrans-82.4-24.4-178.453.40000114.4E314 Q315E314-S318 PolarHBondContact O-N 3.07Å; E314-S318 PolarHBondContact O-OG 2.99Å; E314-S318 VanDerWaalsContact O-OG 3.14Å; Q315-S318 PolarHBondContact O-OG 3.08Å
319S46.9Very low50.1Low82 Ų82129.5 Ų129.557%0.57366%0.659SS**THydrogen-bonded Turntrans-94.416.3-17967.30000114.7T321S319-T321 PolarHBondContact O-N 3.16Å; S319-T321 PolarHBondContact O-OG1 3.11Å; S319-T321 VanDerWaalsContact O-OG1 3.09Å
320A46.5Very low49.9Very low75 Ų75130.6 Ų130.662%0.6267%0.668SS**  trans-72.152166.100000111.2R322A320-R322 PolarHBondContact O-N 3.4Å
321T47.9Very low49.6Very low122 Ų122133.5 Ų133.575%0.74868%0.678SS**  trans-49.8103.3146.322.70000106.1S319 S323S319-T321 PolarHBondContact O-N 3.16Å; S319-T321 PolarHBondContact O-OG1 3.11Å; S319-T321 VanDerWaalsContact O-OG1 3.09Å; T321-S323 PolarHBondContact O-N 3.2Å
322R46.1Very low49.5Very low228 Ų228139.2 Ų139.286%0.8670%0.695SS**  trans-60.971.9169.3-73.8171.6151-155.5-4.6108.2A320 N324A320-R322 PolarHBondContact O-N 3.4Å; R322-N324 PolarHBondContact O-N 3.17Å
323S46.7Very low49.4Very low86 Ų86141.3 Ų141.360%0.60171%0.713SS**  trans-61.8136.2163.6620000106.5T321 I325T321-S323 PolarHBondContact O-N 3.2Å; S323-I325 PolarHBondContact O-N 3.02Å
324N44.7Very low49.5Very low162 Ų162146.1 Ų146.187%0.86673%0.729SS**  trans-63.368.3177.5-93.2-32.6000110.2R322 Q326R322-N324 PolarHBondContact O-N 3.17Å; N324-Q326 PolarHBondContact O-N 3.04Å
325I45.1Very low49.6Very low119 Ų119144 Ų14461%0.6173%0.727SS**  trans-73.581.3162.6-51177.7000104.8S323 R327S323-I325 PolarHBondContact O-N 3.02Å; I325-R327 HydrophobicContact CG2-CG 3.66Å; I325-R327 PolarHBondContact O-N 3.16Å
326Q46.2Very low49.5Very low155 Ų155144.2 Ų144.272%0.72473%0.728SS**  trans-56.987.9150.9-85-179.4-17.700105.3N324 F328N324-Q326 PolarHBondContact O-N 3.04Å; Q326-F328 VanDerWaalsContact C-N 3.25Å; Q326-F328 PolarHBondContact O-N 3.37Å
327R53Low49.4Very low213 Ų213143.9 Ų143.980%0.80473%0.73SS**  trans-61.4102.4164.6-70.4-174.8178.9-177.4-1.7104.1I325 V329I325-R327 HydrophobicContact CG2-CG 3.66Å; I325-R327 PolarHBondContact O-N 3.16Å; R327-V329 PolarHBondContact O-N 2.97Å
328F49Very low49.3Very low182 Ų182139.4 Ų139.480%0.79872%0.717SS**  trans-53.298.2161-82.4-92.5000105.2Q326 P330Q326-F328 VanDerWaalsContact C-N 3.25Å; Q326-F328 PolarHBondContact O-N 3.37Å; F328-P330 WeakPolarHBondContact O-CD 3.27Å; F328-P330 VanDerWaalsContact O-N 3.13Å
329V52.7Low49.4Very low112 Ų112141 Ų14168%0.67972%0.718SS**  trans-65.4110.2166.2177.60000103R327 R331R327-V329 PolarHBondContact O-N 2.97Å; V329-R331 PolarHBondContact O-N 3.1Å
330P51.5Low49.3Very low106 Ų106142.6 Ų142.669%0.68872%0.719SS**  trans-54.4122.9174.721.8-30000106F328 Q332F328-P330 WeakPolarHBondContact O-CD 3.27Å; F328-P330 VanDerWaalsContact O-N 3.13Å; P330-Q332 PolarHBondContact O-N 3.08Å
331R48.9Very low49.4Very low245 Ų245142.8 Ų142.893%0.92572%0.716SS**  trans-50.5111.8172.1-78.8-177.6170.2-174.1-2.2105.2V329 A333V329-R331 PolarHBondContact O-N 3.1Å; R331-A333 PolarHBondContact O-N 3.35Å
332Q52.4Low48.9Very low179 Ų179141 Ų14184%0.83671%0.714SS**PPolyproline II helixtrans-51.4116.1-171.4-68.1-172.3-22.200107.7P330 K334P330-Q332 PolarHBondContact O-N 3.08Å; Q332-K334 PolarHBondContact O-N 3.1Å
333A50.5Low48.7Very low88 Ų88133.4 Ų133.473%0.72770%0.695SS**PPolyproline II helixtrans-49.8126166.200000106R331R331-A333 PolarHBondContact O-N 3.35Å
334K54.6Low49Very low184 Ų184134.2 Ų134.280%0.871%0.707SS**PPolyproline II helixtrans-50.9129178.1-76.2174.5178.5174.40107.2Q332 H336Q332-K334 PolarHBondContact O-N 3.1Å; K334-H336 PolarHBondContact O-N 2.97Å; K334-H336 VanDerWaalsContact O-N 3.09Å
335P55.3Low49.5Very low90 Ų90133.7 Ų133.758%0.58470%0.704SS**PPolyproline II helixtrans-55.3122.8175.519.9-29.2000108.1F337P335-F337 HydrophobicContact CB-CE2 4.34Å; P335-F337 HydrophobicContact CB-CZ 4.41Å; P335-F337 HydrophobicContact CG-CD2 4.48Å; P335-F337 HydrophobicContact CG-CE2 3.72Å; P335-F337 HydrophobicContact CG-CZ 3.85Å; P335-F337 VanDerWaalsContact O-CD2 3.31Å; P335-F337 WeakPolarHBondContact O-CD2 3.23Å; P335-F337 PolarHBondContact O-N 2.89Å
336H49.5Very low49.8Very low151 Ų151132.1 Ų132.170%0.69970%0.7SS**  trans-66.5101.6170.5-72.7-79.1000106.9K334 V338K334-H336 PolarHBondContact O-N 2.97Å; K334-H336 VanDerWaalsContact O-N 3.09Å; H336-V338 PolarHBondContact O-N 3.03Å; H336-V338 VanDerWaalsContact O-N 3.17Å
337F50.1Low49.7Very low171 Ų171127.9 Ų127.975%0.7570%0.698SS**  trans-74.2104.6171.4-69.5-79.3000107.8P335 N339P335-F337 HydrophobicContact CB-CE2 4.34Å; P335-F337 HydrophobicContact CB-CZ 4.41Å; P335-F337 HydrophobicContact CG-CD2 4.48Å; P335-F337 HydrophobicContact CG-CE2 3.72Å; P335-F337 HydrophobicContact CG-CZ 3.85Å; P335-F337 VanDerWaalsContact O-CD2 3.31Å; P335-F337 WeakPolarHBondContact O-CD2 3.23Å; P335-F337 PolarHBondContact O-N 2.89Å; F337-N339 PolarHBondContact O-N 2.84Å
338V47.3Very low49.3Very low79 Ų79123.3 Ų123.348%0.47969%0.688SS.*  trans-76.9109.1166.3-174.10000106.2H336 I340 I350H336-V338 PolarHBondContact O-N 3.03Å; H336-V338 VanDerWaalsContact O-N 3.17Å; V338-I340 HydrophobicContact CG1-CG1 4.2Å; V338-I340 PolarHBondContact O-N 3.28Å; V338-I350 HydrophobicContact CG1-CG2 4.18Å
339N52.7Low49.1Very low131 Ų131120.1 Ų120.170%0.70168%0.68SS**  trans-74.1106.3172.7-75.4-13.6000108F337F337-N339 PolarHBondContact O-N 2.84Å
340I44.6Very low48.9Very low117 Ų117120 Ų12060%0.667%0.674SS**EExtended strand (participates in β ladder)trans-93.2107.5172.3-55.4171.4000106.7V338 I348V338-I340 HydrophobicContact CG1-CG1 4.2Å; V338-I340 PolarHBondContact O-N 3.28Å; I340-I348 HydrophobicContact CG2-CG2 4.1Å
341S47.8Very low48.9Very low79 Ų79118.5 Ų118.555%0.55267%0.67SS**EExtended strand (participates in β ladder)trans-97.2116.6167.951.90000108.8
342A39.1Very low48.8Very low85 Ų85112.2 Ų112.270%0.70266%0.659SS**  trans-89.3112.5167.100000108
343S41Very low48.5Very low68 Ų68114.6 Ų114.648%0.47666%0.661SS.*  trans-91135.2165.2-176.30000107.8D345 T346S343-D345 PolarHBondContact O-N 3.15Å; S343-T346 VanDerWaalsContact O-O 3.08Å
344A54Low48.4Very low102 Ų102115.5 Ų115.584%0.84366%0.659SS**SBendtrans-67.7-26.2-176.600000112.7
345D54.7Low48.4Very low151 Ų151111.7 Ų111.781%0.80765%0.651SS**SBendtrans-103.6-12.7-167.9-63.2-29.2000113.9S343S343-D345 PolarHBondContact O-N 3.15Å
346T50.4Low47.8Very low87 Ų87119.4 Ų119.453%0.53468%0.679SS.*SBendtrans-144.4125.3179.1470000107S343S343-T346 VanDerWaalsContact O-O 3.08Å
347G44.5Very low47.7Very low65 Ų65117.8 Ų117.867%0.6768%0.678SS**  trans-46.5165.1-169.200000116.1N349G347-N349 PolarHBondContact O-N 3.24Å
348I44.6Very low47.6Very low118 Ų118115 Ų11561%0.60567%0.674SS**  trans-50.3105.1-173.3-56.5168.5000111.1I340 I350I340-I348 HydrophobicContact CG2-CG2 4.1Å; I348-I350 HydrophobicContact CG2-CG1 3.92Å
349N44.7Very low47.6Very low115 Ų115117 Ų11762%0.61569%0.685SS**EExtended strand (participates in β ladder)trans-88108.2173.2-97.1-39000109.3G347 A351G347-N349 PolarHBondContact O-N 3.24Å; N349-A351 PolarHBondContact O-N 3.27Å
350I47.8Very low47.3Very low108 Ų108116.2 Ų116.255%0.55468%0.684SS**EExtended strand (participates in β ladder)trans-9293.7176.4-53.7177.4000108.3V338 I348 V352V338-I350 HydrophobicContact CG1-CG2 4.18Å; I348-I350 HydrophobicContact CG2-CG1 3.92Å; I350-V352 HydrophobicContact CG2-CG2 4.01Å; I350-V352 PolarHBondContact O-N 3Å
351A52.4Low47.5Very low75 Ų75116.1 Ų116.162%0.6269%0.689SS**  trans-84.497173.500000110.2N349 R353N349-A351 PolarHBondContact O-N 3.27Å; A351-R353 PolarHBondContact O-N 3.36Å
352V46.4Very low47.5Very low113 Ų113118.6 Ų118.669%0.68570%0.698SS**  trans-80.6104171.4-175.10000108.3I350 P354I350-V352 HydrophobicContact CG2-CG2 4.01Å; I350-V352 PolarHBondContact O-N 3Å; V352-P354 WeakPolarHBondContact O-CD 3.37Å
353R45.6Very low48.1Very low230 Ų230121 Ų12187%0.86870%0.698SS**  trans-78.5118.9170.5-105.5-177.7174.3178.4-1.2109.6A351 T355A351-R353 PolarHBondContact O-N 3.36Å; R353-T355 PolarHBondContact O-N 3.43Å
354P48.4Very low48.6Very low107 Ų107125.1 Ų125.170%0.69572%0.715SS**  trans-70.8120.9167.911.9-2.5000109V352V352-P354 WeakPolarHBondContact O-CD 3.37Å
355T54.8Low48.2Very low103 Ų103127 Ų12763%0.63270%0.704SS**  trans-89.7115166.851.90000108.1R353R353-T355 PolarHBondContact O-N 3.43Å
356H43.9Very low47.6Very low252 Ų252124.8 Ų124.8100%1.16770%0.695SS**  trans-73.80169.4-75.5-71.5000112

Retrieved 356 of 356 residues in 100.6 ms (Link to these results)