A0A077Z167_TRITR Loading...

ARID domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z167, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 302 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
1M50.7Low55.9Low242 Ų242136.2 Ų136.2100%1.19284%0.838SS**  092.70-63.6-176.1178.300105.8
2A49.6Very low55.6Low95 Ų95134.6 Ų134.679%0.78583%0.832SS**  86.5117.992.600000111.2
3A55Low55.4Low83 Ų83135 Ų13569%0.68683%0.833SS**  trans72.4108.614800000116.8
4T60.1Low55.1Low135 Ų135136.4 Ų136.483%0.82883%0.833SS**  68.4119.2106.158.10000114.3
5S63Low54.9Low110 Ų110139.2 Ų139.277%0.76982%0.822SS**  -176.8110.5107.6-154.40000111.1
6T67.6Low54.7Low132 Ų132138.4 Ų138.481%0.8182%0.822SS**  trans41.2108.3131-49.30000119.7
7Q51.2Low54.3Low186 Ų186138.4 Ų138.487%0.86981%0.812SS**  trans-92.4154.5156.5-166.8174.74900109.5
8A55.2Low54Low92 Ų92143.3 Ų143.376%0.7681%0.814SS**  trans98.2146.1150.300000120.7
9A55.6Low53.5Low106 Ų106142.8 Ų142.888%0.87681%0.814SS**  trans76.8112.717400000114.9
10G50.7Low53.1Low69 Ų69144.8 Ų144.871%0.71182%0.821SS**  cis101.212926.500000109.9
11R56.6Low52.4Low248 Ų248141.4 Ų141.494%0.93681%0.811SS**  trans99.1152.5173.5-58.3-170.2168.4-143.8-1.2115.9
12P51.2Low51.9Low117 Ų117134.4 Ų134.476%0.7679%0.792SS**  -131.7178.4-86.224.21.3000111.8D14P12-D14 PolarHBondContact O-N 2.99Å
13V53.3Low51.4Low140 Ų140135 Ų13585%0.84880%0.797SS**  trans-49.2121.5169.4-177.70000111.8
14D51.2Low50.8Low155 Ų155135.4 Ų135.483%0.82980%0.8SS**  trans-137.4142.6156-150.3-65.9000109.7P12P12-D14 PolarHBondContact O-N 2.99Å
15R51.9Low50Low178 Ų178136.9 Ų136.967%0.67280%0.797SS**  trans-114.5120.8-154.1176.7-171.6179.9163.4-3.3107.5E17R15-E17 HydrophobicContact CG-CB 4.07Å; R15-E17 IonicContact CZ-OE2 3.29Å; R15-E17 IonicContact NE-OE2 2.6Å; R15-E17 PolarHBondContact NE-OE2 3.16Å; R15-E17 IonicContact NH2-OE2 3.64Å; R15-E17 PolarHBondContact NH2-OE2 2.95Å; R15-E17 PolarHBondContact O-N 2.88Å
16P52Low48.9Very low127 Ų127143.7 Ų143.783%0.82581%0.806SS**  trans-83.869.6172.834.2-32.2000109.7
17E47.4Very low47.4Very low137 Ų137141.1 Ų141.164%0.6481%0.806SS**  trans-104.458.5166.7-142-148.9139.900110.3R15R15-E17 HydrophobicContact CG-CB 4.07Å; R15-E17 IonicContact CZ-OE2 3.29Å; R15-E17 IonicContact NE-OE2 2.6Å; R15-E17 PolarHBondContact NE-OE2 3.16Å; R15-E17 IonicContact NH2-OE2 3.64Å; R15-E17 PolarHBondContact NH2-OE2 2.95Å; R15-E17 PolarHBondContact O-N 2.88Å
18R48.9Very low46.8Very low228 Ų228136.2 Ų136.286%0.8680%0.798SS**  trans-146.920.8178.1-76.6-159.1173.8-142.4-1.8116.1
19V45.8Very low45.8Very low133 Ų133140 Ų14081%0.80680%0.8SS**SBendtrans-105.9-2.1178.9-172.10000114.1
20L44.3Very low44.9Very low182 Ų182139.6 Ų139.695%0.95380%0.796SS**SBendtrans-113.58.9178.4-111.391.5000116.9
21A39.8Very low44.5Very low75 Ų75142.2 Ų142.262%0.6280%0.798SS**SBendtrans-124.311.6-17300000116.1
22A39.1Very low43.3Very low95 Ų95135 Ų13579%0.78578%0.784SS**SBendtrans-99.52.6-174.200000116
23A39.7Very low42.7Very low108 Ų108134 Ų13489%0.89379%0.786SS**SBendtrans-99.6-0.8176.200000114.5
24A42.7Very low41.8Very low90 Ų90131.4 Ų131.474%0.74477%0.773SS**SBendtrans-101.55.3-170.900000115.6
25Q42.9Very low41.1Very low167 Ų167128.3 Ų128.378%0.7877%0.769SS**SBendtrans-13216.6-169.8-98.4147.72.800116.4
26R39.3Very low40.5Very low252 Ų252124 Ų12495%0.95177%0.766SS**  trans-11051.1168.6-70.1-172.7170.7168.6-1.9112.2
27G36.2Very low40.2Very low79 Ų79123 Ų12381%0.81476%0.757SS**  trans-113.131.1160.400000110.7Q29G27-Q29 PolarHBondContact O-N 3.28Å; G27-Q29 VanDerWaalsContact O-N 3.16Å
28A38.6Very low39.6Very low83 Ų83120.7 Ų120.769%0.68675%0.754SS**  trans-71.6105.3176.300000108.4A30A28-A30 PolarHBondContact O-N 3.3Å
29Q35.1Very low39.4Very low172 Ų172113.8 Ų113.880%0.80473%0.733SS**  trans33.663138.2-64.7-176.1-19.900114.9G27 V31G27-Q29 PolarHBondContact O-N 3.28Å; G27-Q29 VanDerWaalsContact O-N 3.16Å; Q29-V31 PolarHBondContact O-N 3.15Å
30A36.1Very low39.3Very low97 Ų97114.7 Ų114.780%0.80272%0.722SS**  trans-69.383.7143.800000105A28 C32A28-A30 PolarHBondContact O-N 3.3Å; A30-C32 PolarHBondContact O-N 3.48Å
31V41.7Very low39.2Very low124 Ų124108.6 Ų108.675%0.75269%0.694SS**  trans-49.296.9163.1-95.20000106.1Q29 A33Q29-V31 PolarHBondContact O-N 3.15Å; V31-A33 PolarHBondContact O-N 3.25Å
32C32.8Very low39.3Very low96 Ų96110 Ų11065%0.64969%0.691SS**  trans-64.690.2169.5-173.60000105.5A30 C34A30-C32 PolarHBondContact O-N 3.48Å; C32-C34 PolarHBondContact O-N 3.32Å
33A36.9Very low39.8Very low97 Ų97113.2 Ų113.280%0.80269%0.69SS**  trans-68.27.8174.300000112V31 A35V31-A33 PolarHBondContact O-N 3.25Å; A33-A35 VanDerWaalsContact C-N 3.3Å; A33-A35 PolarHBondContact O-N 3.33Å
34C34.8Very low40.3Very low84 Ų84111.6 Ų111.657%0.56867%0.666SS**  trans-78.784.7168.3-129.90000109C32 C36C32-C34 PolarHBondContact O-N 3.32Å; C34-C36 PolarHBondContact O-N 3.33Å
35A36.3Very low40.4Very low91 Ų91109.7 Ų109.775%0.75265%0.65SS**  trans-63.712.8163.300000113.3A33 V37A33-A35 VanDerWaalsContact C-N 3.3Å; A33-A35 PolarHBondContact O-N 3.33Å; A35-V37 PolarHBondContact O-N 2.61Å
36C40Very low40.8Very low88 Ų88109.5 Ų109.560%0.59565%0.65SS**  trans-79.1106.7166.3-79.40000109.1C34 C38C34-C36 PolarHBondContact O-N 3.33Å; C36-C38 PolarHBondContact O-N 3.17Å
37V44.9Very low41.5Very low106 Ų106104 Ų10464%0.64263%0.633SS**  trans-43.780.1157.2177.10000110.2A35 M39A35-V37 PolarHBondContact O-N 2.61Å; V37-M39 HydrophobicContact CG1-CB 4.28Å; V37-M39 HydrophobicContact CG1-CG 3.51Å; V37-M39 HydrophobicContact CG1-SD 3.49Å; V37-M39 WeakPolarHBondContact CG1-SD 3.5Å; V37-M39 PolarHBondContact O-N 3.36Å
38C35.6Very low41.6Very low87 Ų87102.7 Ų102.759%0.58861%0.61SS**  trans-76.967.5172.6-85.40000109.4C36 R40C36-C38 PolarHBondContact O-N 3.17Å; C38-R40 PolarHBondContact O-N 2.68Å
39M45Very low42.4Very low84 Ų84105.6 Ų105.641%0.41461%0.61SS.*THydrogen-bonded Turntrans-69.527.2167.3-77.4174.7120.300112.6V37 S169V37-M39 HydrophobicContact CG1-CB 4.28Å; V37-M39 HydrophobicContact CG1-CG 3.51Å; V37-M39 HydrophobicContact CG1-SD 3.49Å; V37-M39 WeakPolarHBondContact CG1-SD 3.5Å; V37-M39 PolarHBondContact O-N 3.36Å; M39-S169 WeakPolarHBondContact CE-O 3.23Å
40R43.8Very low43.3Very low152 Ų152106.1 Ų106.157%0.57460%0.604SS**THydrogen-bonded Turntrans-139.116.8-172.6-134.2165.1178.5159.1-2.8114.1C38 D42 F111C38-R40 PolarHBondContact O-N 2.68Å; R40-D42 PolarHBondContact O-N 3.14Å; R40-F111 VanDerWaalsContact NH1-CE1 3.35Å
41C41Very low44Very low54 Ų54106.5 Ų106.537%0.36559%0.592SS.*THydrogen-bonded Turntrans-66.71.6176-74.50000114.9A45C41-A45 PolarHBondContact O-N 3.41Å
42D43.9Very low44.5Very low103 Ų103106.8 Ų106.855%0.55159%0.589SS**Hα-helixtrans-71.1-39.5177.4-146.5-113.4000111.9R40 N44R40-D42 PolarHBondContact O-N 3.14Å; D42-N44 PolarHBondContact O-N 3.23Å
43E49.3Very low45.7Very low163 Ų163105.3 Ų105.376%0.76258%0.583SS**Hα-helixtrans-76.7-4.9-178.5-106.3169.3116.600114.5
44N48.5Very low46.8Very low75 Ų75106.4 Ų106.440%0.40157%0.572SS.*Hα-helixtrans-126.71.1179.7-152.160.4000113.3D42 E46 K47 C48D42-N44 PolarHBondContact O-N 3.23Å; N44-E46 VanDerWaalsContact C-N 3.32Å; N44-E46 PolarHBondContact O-N 2.9Å; N44-K47 PolarHBondContact O-N 3.24Å; N44-K47 VanDerWaalsContact O-N 3.16Å; N44-K47 WeakPolarHBondContact OD1-CB 3.49Å; N44-K47 WeakPolarHBondContact OD1-CD 3.47Å; N44-C48 PolarHBondContact O-N 2.6Å
45A45.3Very low47.5Very low49 Ų49108.7 Ų108.741%0.40558%0.578SS.*Hα-helixtrans-61.6-41.617500000111.2C41 K47 C48 E49C41-A45 PolarHBondContact O-N 3.41Å; A45-K47 VanDerWaalsContact C-N 3.28Å; A45-K47 PolarHBondContact O-N 3.18Å; A45-C48 PolarHBondContact O-N 3.4Å; A45-E49 PolarHBondContact O-N 2.74Å
46E51.5Low48.2Very low164 Ų164115.1 Ų115.177%0.76658%0.583SS**Hα-helixtrans-65.2-31.3174.7-62.7-169.4120.500112.6N44 R50N44-E46 VanDerWaalsContact C-N 3.32Å; N44-E46 PolarHBondContact O-N 2.9Å; E46-R50 WeakPolarHBondContact O-CG 3.43Å; E46-R50 PolarHBondContact O-N 3.27Å; E46-R50 VanDerWaalsContact O-N 3.09Å
47K54.9Low48.5Very low137 Ų137115.1 Ų115.160%0.59659%0.585SS**Hα-helixtrans-76.5-35.5178.3-141.6173.2-171.11770111.8N44 A45 R50 L51N44-K47 PolarHBondContact O-N 3.24Å; N44-K47 VanDerWaalsContact O-N 3.16Å; N44-K47 WeakPolarHBondContact OD1-CB 3.49Å; N44-K47 WeakPolarHBondContact OD1-CD 3.47Å; A45-K47 VanDerWaalsContact C-N 3.28Å; A45-K47 PolarHBondContact O-N 3.18Å; K47-R50 PolarHBondContact O-N 3.13Å; K47-L51 VanDerWaalsContact O-CG 3.29Å; K47-L51 WeakPolarHBondContact O-CG 3.33Å; K47-L51 PolarHBondContact O-N 3.5Å
48C38.8Very low48.6Very low51 Ų51116 Ų11635%0.34559%0.59SS.*Hα-helixtrans-70.8-36.3172.5-80.60000112.4N44 A45 L51 L52N44-C48 PolarHBondContact O-N 2.6Å; A45-C48 PolarHBondContact O-N 3.4Å; C48-L51 PolarHBondContact O-N 3.32Å; C48-L52 WeakPolarHBondContact O-CB 3.4Å; C48-L52 WeakPolarHBondContact O-CG 3.48Å; C48-L52 PolarHBondContact O-N 2.9Å
49E54.3Low49.1Very low144 Ų144117.2 Ų117.267%0.67359%0.594SS**Hα-helixtrans-65.7-37.9171.7-76.4-148.4142.300112.1A45 L52 A53A45-E49 PolarHBondContact O-N 2.74Å; E49-L52 PolarHBondContact O-N 2.9Å; E49-A53 VanDerWaalsContact O-CB 3.31Å; E49-A53 WeakPolarHBondContact O-CB 3.49Å; E49-A53 PolarHBondContact O-N 3.17Å
50R54.9Low49.1Very low183 Ų183119.1 Ų119.169%0.69161%0.613SS**Hα-helixtrans-62.5-45.2171.8-79-177.9172.2174.1-0.1112.5E46 K47 L52 A53 E54E46-R50 WeakPolarHBondContact O-CG 3.43Å; E46-R50 PolarHBondContact O-N 3.27Å; E46-R50 VanDerWaalsContact O-N 3.09Å; K47-R50 PolarHBondContact O-N 3.13Å; R50-L52 VanDerWaalsContact C-N 3.34Å; R50-L52 PolarHBondContact O-N 3.07Å; R50-A53 CarbonylContact O-C 3.57Å; R50-A53 WeakPolarHBondContact O-CB 3.49Å; R50-A53 PolarHBondContact O-N 3.21Å; R50-A53 VanDerWaalsContact O-N 3.11Å; R50-E54 WeakPolarHBondContact O-CB 3.46Å; R50-E54 WeakPolarHBondContact O-CG 3.31Å; R50-E54 PolarHBondContact O-N 3.49Å
51L50.7Low49.4Very low104 Ų104118.2 Ų118.255%0.54562%0.624SS.*Hα-helixtrans-65.9-34.1177.7-70.1170.4000113.1K47 C48 D55K47-L51 VanDerWaalsContact O-CG 3.29Å; K47-L51 WeakPolarHBondContact O-CG 3.33Å; K47-L51 PolarHBondContact O-N 3.5Å; C48-L51 PolarHBondContact O-N 3.32Å; L51-D55 PolarHBondContact O-N 2.92Å; L51-D55 VanDerWaalsContact O-N 3.13Å
52L51.4Low49.7Very low130 Ų130120.5 Ų120.568%0.68164%0.641SS**Hα-helixtrans-75.8-23.8173.1-70.5172.6000113C48 E49 R50C48-L52 WeakPolarHBondContact O-CB 3.4Å; C48-L52 WeakPolarHBondContact O-CG 3.48Å; C48-L52 PolarHBondContact O-N 2.9Å; E49-L52 PolarHBondContact O-N 2.9Å; R50-L52 VanDerWaalsContact C-N 3.34Å; R50-L52 PolarHBondContact O-N 3.07Å
53A57.5Low49.8Very low65 Ų65124.9 Ų124.954%0.53766%0.658SS.*Hα-helixtrans-77.9-34.7170.500000111.9E49 R50 R56E49-A53 VanDerWaalsContact O-CB 3.31Å; E49-A53 WeakPolarHBondContact O-CB 3.49Å; E49-A53 PolarHBondContact O-N 3.17Å; R50-A53 CarbonylContact O-C 3.57Å; R50-A53 WeakPolarHBondContact O-CB 3.49Å; R50-A53 PolarHBondContact O-N 3.21Å; R50-A53 VanDerWaalsContact O-N 3.11Å; A53-R56 PolarHBondContact O-N 2.92Å
54E60.6Low49.7Very low121 Ų121120.3 Ų120.357%0.56566%0.655SS**Hα-helixtrans-70.6-38.8177.6-76.1169.299.700111.9R50 R56 S57R50-E54 WeakPolarHBondContact O-CB 3.46Å; R50-E54 WeakPolarHBondContact O-CG 3.31Å; R50-E54 PolarHBondContact O-N 3.49Å; E54-R56 PolarHBondContact O-N 3.41Å; E54-S57 PolarHBondContact O-N 3.05Å; E54-S57 PolarHBondContact O-OG 3.46Å
55D49.6Very low49.3Very low131 Ų131124.4 Ų124.470%0.70168%0.677SS**G310 helixtrans-67.3-15.7175.2-157.566.1000113.1L51L51-D55 PolarHBondContact O-N 2.92Å; L51-D55 VanDerWaalsContact O-N 3.13Å
56R51.3Low49.7Very low226 Ų226127 Ų12785%0.85369%0.687SS**G310 helixtrans-90.34.8178.1-139.6173.1-174.5175.20.8114.2A53 E54A53-R56 PolarHBondContact O-N 2.92Å; E54-R56 PolarHBondContact O-N 3.41Å
57S46Very low49.6Very low89 Ų89126.6 Ų126.662%0.62269%0.69SS**G310 helixtrans-107.97.8-177.169.30000115.5E54 V59E54-S57 PolarHBondContact O-N 3.05Å; E54-S57 PolarHBondContact O-OG 3.46Å; S57-V59 VanDerWaalsContact C-N 3.32Å; S57-V59 PolarHBondContact O-N 3.27Å
58V47.6Very low49.1Very low124 Ų124129.6 Ų129.675%0.75271%0.707SS**  trans-77.284.5171.8-174.60000110.2
59V45Very low49.2Very low113 Ų113130.9 Ų130.969%0.68573%0.728SS**  trans-131112.4154-164.70000106.7S57 T61S57-V59 VanDerWaalsContact C-N 3.32Å; S57-V59 PolarHBondContact O-N 3.27Å; V59-T61 PolarHBondContact O-N 2.92Å
60P45.4Very low48.8Very low124 Ų124129.3 Ų129.381%0.80573%0.733SS**  trans-84.9107.7176.231.8-27000108.6
61T49Very low48.4Very low133 Ų133126.4 Ų126.482%0.81674%0.741SS**  trans-98.8121.6160.438.40000109V59V59-T61 PolarHBondContact O-N 2.92Å
62S47.9Very low48Very low102 Ų102124.8 Ų124.871%0.71375%0.75SS**  trans-69.4165.8178.147.20000113.4
63E46.3Very low47.6Very low194 Ų194124.8 Ų124.891%0.90776%0.761SS**  trans79.9129.1165.4-41.2-167.1118.700113.7
64G46.3Very low46.8Very low68 Ų68127 Ų12770%0.70177%0.772SS**  cis154.915714.800000106.3
65N40.2Very low45.9Very low160 Ų160126.2 Ų126.286%0.85678%0.78SS**  trans71.2148.5176.2-93.84.3000118.3
66V54.9Low45.5Very low103 Ų103127.9 Ų127.962%0.62478%0.783SS**  cis172.2151.6-24133.70000104.2
67D48.7Very low44.7Very low156 Ų156125 Ų12583%0.83478%0.784SS**  trans89.5128.2161.2-73.6-40.9000122.5
68Q44.4Very low44.5Very low200 Ų200128 Ų12894%0.93579%0.793SS**  trans-86.3149179.8-59.6172.55.500110.1
69G41.3Very low44Very low78 Ų78126 Ų12680%0.80479%0.789SS**  trans-156112.5173.600000111.6
70S46.1Very low44Very low111 Ų111129.5 Ų129.578%0.77680%0.8SS**  trans-70.4157.6-169.1-60.80000117.3
71S45.6Very low43.4Very low122 Ų122127 Ų12785%0.85380%0.797SS**  trans69.4135.7130.361.80000122.7
72G42.9Very low43.8Very low71 Ų71127.4 Ų127.473%0.73280%0.799SS**  trans126.7131.615600000111.5
73S43.9Very low43.7Very low129 Ų129130.7 Ų130.790%0.90280%0.803SS**  cis-167.3155.2-3-1080000106.8
74S40.4Very low43.9Very low111 Ų111129 Ų12978%0.77680%0.8SS**  trans-78.3167.1-176.3-154.90000113.9
75S41.5Very low43.8Very low105 Ų105129.4 Ų129.473%0.73481%0.805SS**  trans85.5113.8151.7-46.30000119
76H41.3Very low44.1Very low166 Ų166131 Ų13177%0.76980%0.804SS**  -168.1116.6113.6-144-96.9000111.9
77L34.4Very low43.3Very low165 Ų165134.7 Ų134.786%0.86482%0.82SS**  trans-67.4141.5158-85.2160.4000109
78L42.4Very low43Very low154 Ų154133.6 Ų133.681%0.80682%0.818SS**  trans-163125.4147.5-101.1168.1000109.4
79A37.5Very low42.4Very low82 Ų82129 Ų12968%0.67882%0.815SS**  trans-78.6153.7175.900000111.8
80M44.2Very low42.4Very low186 Ų186130.4 Ų130.492%0.91682%0.818SS**  trans-156.3128.7144.4-78-54.4151.100108.3
81G32.5Very low42Very low71 Ų71130.7 Ų130.773%0.73281%0.811SS**  trans-95.5168.8173.400000112.5
82T56.9Low41.9Very low142 Ų142133.4 Ų133.487%0.87182%0.815SS**  trans-151.1137.2153.6520000109.3
83E46.4Very low41.4Very low171 Ų171139.7 Ų139.780%0.79982%0.817SS**  trans-85.8178.8-179.756.2-142.688.600113.8
84D50.9Low41.3Very low157 Ų157139 Ų13984%0.8481%0.812SS**  trans89.1111.2172.5-49.2-43.3000117.2
85G43.5Very low41.1Very low78 Ų78138.7 Ų138.780%0.80481%0.805SS**  cis115.865.511.600000113.1
86K47.7Very low40.7Very low193 Ų193141.1 Ų141.184%0.83981%0.807SS**  trans-165102.5158.3-147.9158-175.8173.90114.6
87L36.8Very low40.8Very low181 Ų181139.6 Ų139.695%0.94881%0.81SS**  trans-140.4112.4153.3-91.5166.5000107.6
88V42.6Very low41Very low132 Ų132138.4 Ų138.480%0.881%0.809SS**  trans-87.9118.4176.1-770000109.1
89A32.4Very low41.1Very low105 Ų105139.4 Ų139.487%0.86881%0.81SS**  trans-85.4132.1163.600000108.7
90A41.3Very low41.2Very low106 Ų106141.4 Ų141.488%0.87681%0.814SS**  trans-107.3115.2165.200000108.8
91D36.2Very low40.9Very low118 Ų118135.9 Ų135.963%0.63180%0.804SS**  trans-58.1142.5169.2-168.9-32.2000111.4R93D91-R93 PolarHBondContact OD1-N 2.67Å
92L45.4Very low40.9Very low178 Ų178139 Ų13993%0.93281%0.809SS**  trans-151.886.8145.2-102.7137.2000108.8
93R32.1Very low40.2Very low203 Ų203137.5 Ų137.577%0.76680%0.801SS**  trans-52.5132.9160-78.1163.783.8-170.66.2111.1D91D91-R93 PolarHBondContact OD1-N 2.67Å
94S40.1Very low39.8Very low116 Ų116135.4 Ų135.481%0.81180%0.8SS**  trans-140.397.9143.2-115.50000110.2
95T36.6Very low39.1Very low103 Ų103136.9 Ų136.963%0.63280%0.801SS**  trans-6.2136.21344.50000114.3
96M34.5Very low38.5Very low156 Ų156137.9 Ų137.977%0.76880%0.795SS**  cis-166.4160.947.8-66.7-163.217300113.3
97T43.4Very low38.3Very low135 Ų135134 Ų13483%0.82879%0.79SS**  trans78.1113141.738.60000121.2
98T38.7Very low38.4Very low139 Ų139134.8 Ų134.885%0.85379%0.786SS**  trans-69.6132.4162.4450000112.4
99H43.5Very low38.1Very low176 Ų176134.1 Ų134.182%0.81578%0.782SS**  trans-148.1142.4141.1-159.5-97.4000109.4
100T39.6Very low38.8Very low124 Ų124136.5 Ų136.576%0.76178%0.779SS**  trans-52.2129-174.445.70000112.7
101G37.8Very low38.6Very low69 Ų69137.8 Ų137.871%0.71177%0.765SS**  trans-165.7102.1177.100000110.6P103G101-P103 WeakPolarHBondContact O-CD 3.25Å
102V32.5Very low38.7Very low137 Ų137138 Ų13883%0.8377%0.773SS**  trans-59.9117.9178.2-178.70000109.6V104V102-V104 PolarHBondContact O-N 3.25Å
103P42.8Very low38.2Very low110 Ų110134.4 Ų134.471%0.71476%0.761SS**  trans-81.8111.9169.630.4-27.2000108.8G101 H105G101-P103 WeakPolarHBondContact O-CD 3.25Å; P103-H105 PolarHBondContact O-N 3.01Å
104V37.8Very low38.6Very low128 Ų128136.3 Ų136.378%0.77677%0.768SS**PPolyproline II helixtrans-54.9119.7169.8-81.30000110.3V102 C106V102-V104 PolarHBondContact O-N 3.25Å; V104-C106 PolarHBondContact O-N 3.47Å
105H35.5Very low38.3Very low187 Ų187135.8 Ų135.887%0.86677%0.771SS**PPolyproline II helixtrans-63.1118.1172.3-95.8-122.3000110.3P103P103-H105 PolarHBondContact O-N 3.01Å
106C31.8Very low38.6Very low100 Ų100135.1 Ų135.168%0.67678%0.776SS**PPolyproline II helixtrans-82.6120.6165.8-69.10000109.4V104 F108V104-C106 PolarHBondContact O-N 3.47Å; C106-F108 VanDerWaalsContact C-N 3.3Å; C106-F108 PolarHBondContact O-N 3.22Å
107P42.1Very low39.2Very low112 Ų112132.3 Ų132.373%0.72778%0.778SS**THydrogen-bonded Turntrans-88.152.5-173.537.1-35.5000111.7
108F39.1Very low39.3Very low197 Ų197130.5 Ų130.586%0.86476%0.762SS**THydrogen-bonded Turntrans-150.524.7175.4-83.2-68000115.9C106C106-F108 VanDerWaalsContact C-N 3.3Å; C106-F108 PolarHBondContact O-N 3.22Å
109T36.8Very low39.9Very low118 Ų118127.7 Ų127.772%0.72475%0.747SS**  trans-13180.5176.148.70000111.7F111T109-F111 PolarHBondContact O-N 2.99Å
110I47Very low39.9Very low154 Ų154126.5 Ų126.579%0.7974%0.739SS**  trans-81.9104.4158.8-62.6176.6000106.7
111F37.2Very low40.4Very low133 Ų133124.4 Ų124.458%0.58374%0.735SS**  trans110.9104.6170.9-72.6-73000117.5R40 T109R40-F111 VanDerWaalsContact NH1-CE1 3.35Å; T109-F111 PolarHBondContact O-N 2.99Å
112P39.2Very low40.8Very low124 Ų124127 Ų12781%0.80573%0.733SS**  trans-85.5105.4152.933.1-22.5000108
113C33.9Very low40.8Very low102 Ų102124.1 Ų124.169%0.68972%0.718SS**  trans-114.288.8166.5-670000108.5
114R41.1Very low40.7Very low242 Ų242125 Ų12591%0.91372%0.721SS**  trans22104.7150-166.7165.3140.3-163.1-5115.1A116R114-A116 PolarHBondContact O-N 3.44Å; R114-A116 VanDerWaalsContact O-N 3.15Å
115A32.6Very low40.7Very low105 Ų105123.6 Ų123.687%0.86872%0.717SS**  trans-40.3114.9171.300000112.1
116A43.2Very low40.9Very low90 Ų90121.5 Ų121.574%0.74471%0.712SS**  trans-116.2107.9159.500000106.4R114R114-A116 PolarHBondContact O-N 3.44Å; R114-A116 VanDerWaalsContact O-N 3.15Å
117A47.1Very low41.7Very low96 Ų96126.2 Ų126.279%0.79372%0.721SS**  trans-49.9138165.500000109.2P119A117-P119 VanDerWaalsContact O-CD 3.25Å; A117-P119 WeakPolarHBondContact O-CD 3.33Å
118L46.1Very low41.5Very low97 Ų97129.3 Ų129.351%0.50873%0.728SS.*  trans-54130.2-175-61.1166.1000111.3
119P50.3Low41.7Very low80 Ų80125.1 Ų125.152%0.51972%0.718SS.*  trans-109.9107139.432.9-19.4000106.2A117 A121A117-P119 VanDerWaalsContact O-CD 3.25Å; A117-P119 WeakPolarHBondContact O-CD 3.33Å; P119-A121 HydrophobicContact CB-CB 4.04Å; P119-A121 PolarHBondContact O-N 3.42Å
120F45Very low42Very low151 Ų151125.5 Ų125.566%0.66273%0.726SS**  trans-68.769.2149.7-174.3-96.7000106.2N122 N150F120-N122 PolarHBondContact O-N 2.87Å; F120-N122 VanDerWaalsContact O-N 3.07Å; F120-N150 WeakPolarHBondContact CE2-ND2 3.43Å
121A49.5Very low42.2Very low81 Ų81122.7 Ų122.767%0.66972%0.716SS**  trans-7799.3179.800000108.4P119P119-A121 HydrophobicContact CB-CB 4.04Å; P119-A121 PolarHBondContact O-N 3.42Å
122N45.8Very low42.8Very low124 Ų124119.6 Ų119.666%0.66371%0.711SS**  trans55.4114.1133-150.217.4000118.4F120 T124F120-N122 PolarHBondContact O-N 2.87Å; F120-N122 VanDerWaalsContact O-N 3.07Å; N122-T124 VanDerWaalsContact C-N 3.34Å; N122-T124 PolarHBondContact O-N 2.87Å
123C33.9Very low43.7Very low76 Ų76119 Ų11951%0.51471%0.71SS.*  trans-59.393.8162-161.20000108.8S125 R146C123-S125 VanDerWaalsContact C-N 3.3Å; C123-S125 PolarHBondContact O-N 3.3Å; C123-S125 VanDerWaalsContact O-N 3.14Å; C123-R146 PolarHBondContact SG-NH2 3.35Å
124T38.8Very low44.6Very low129 Ų129124 Ų12479%0.79171%0.714SS**  trans-82.385.2166.6230000107.5N122 N126N122-T124 VanDerWaalsContact C-N 3.34Å; N122-T124 PolarHBondContact O-N 2.87Å; T124-N126 PolarHBondContact O-N 3.47Å
125S39.4Very low45.1Very low98 Ų98117.1 Ų117.169%0.68569%0.692SS**  trans-67.9121.3164.6-160.50000108C123C123-S125 VanDerWaalsContact C-N 3.3Å; C123-S125 PolarHBondContact O-N 3.3Å; C123-S125 VanDerWaalsContact O-N 3.14Å
126N38.8Very low45.9Very low142 Ų142118.2 Ų118.276%0.75968%0.678SS**  trans-169.489.5154.9-97.3-7000110.5T124T124-N126 PolarHBondContact O-N 3.47Å
127K49.3Very low46.6Very low199 Ų199116.9 Ų116.987%0.86567%0.667SS**  trans-137.291.1147.1-123.9179.5-173.7-176.60107.4T129K127-T129 PolarHBondContact O-N 3.14Å; K127-T129 VanDerWaalsContact O-N 3.17Å
128M37.4Very low47.1Very low177 Ų177118.9 Ų118.987%0.87266%0.66SS**  trans-64.5106.2172.6-74.3166.8162.500108.9
129T43.7Very low48.4Very low109 Ų109119.1 Ų119.167%0.66966%0.661SS**  trans-130.9106.5160.255.50000107.2K127 T131K127-T129 PolarHBondContact O-N 3.14Å; K127-T129 VanDerWaalsContact O-N 3.17Å; T129-T131 PolarHBondContact O-N 3.24Å
130S43.3Very low49.6Very low126 Ų126121.8 Ų121.888%0.88167%0.667SS**  trans-57.291.7-176.745.50000112.6
131T49.9Very low51.4Low95 Ų95120.8 Ų120.858%0.58366%0.664SS**  trans-149.7120.8166.6-11.10000110T129 Q135T129-T131 PolarHBondContact O-N 3.24Å; T131-Q135 PolarHBondContact O-OE1 3.39Å
132S50.1Low53.1Low68 Ų68119.7 Ų119.748%0.47665%0.645SS.*  trans71.3101.1154.9-152.50000120.1R134 Q135 F136S132-R134 PolarHBondContact O-N 2.95Å; S132-Q135 PolarHBondContact O-N 3.49Å; S132-F136 WeakPolarHBondContact O-CD2 3.47Å
133S58.1Low55.1Low111 Ų111115.8 Ų115.878%0.77663%0.627SS**THydrogen-bonded Turntrans-50.9-12.2172.3-155.60000116.5
134R53.8Low57.8Low208 Ų208116.2 Ų116.279%0.78563%0.625SS**THydrogen-bonded Turntrans-87-28175.9-75.1-178.8173.7155.4-1.6113.4S132 F136S132-R134 PolarHBondContact O-N 2.95Å; R134-F136 VanDerWaalsContact C-N 3.33Å
135Q51.3Low60.3Low98 Ų98114.1 Ų114.146%0.45861%0.608SS.*Hα-helixtrans-72.3-30.7-177.5-69.6177.4-42.300111.7T131 S132 A137 E138 D139T131-Q135 PolarHBondContact O-OE1 3.39Å; S132-Q135 PolarHBondContact O-N 3.49Å; Q135-A137 VanDerWaalsContact C-N 3.27Å; Q135-A137 PolarHBondContact O-N 3.14Å; Q135-E138 PolarHBondContact O-N 3.07Å; Q135-D139 PolarHBondContact O-N 3.44Å; Q135-D139 VanDerWaalsContact O-N 3.15Å
136F48.8Very low62.8Low127 Ų127112.1 Ų112.156%0.55759%0.585SS**Hα-helixtrans-60.9-32.1178.2-62.8-80.9000113.8S132 R134 E140S132-F136 WeakPolarHBondContact O-CD2 3.47Å; R134-F136 VanDerWaalsContact C-N 3.33Å; F136-E140 WeakPolarHBondContact O-CG 3.33Å; F136-E140 PolarHBondContact O-N 3.5Å
137A58.5Low65.3Low62 Ų62112.5 Ų112.551%0.51258%0.576SS.*Hα-helixtrans-75.6-38.5179.900000112.4Q135 D139 E140 E141Q135-A137 VanDerWaalsContact C-N 3.27Å; Q135-A137 PolarHBondContact O-N 3.14Å; A137-D139 VanDerWaalsContact C-N 3.29Å; A137-D139 PolarHBondContact O-N 3.43Å; A137-E140 PolarHBondContact O-N 3.3Å; A137-E141 PolarHBondContact O-N 3.05Å
138E58.4Low67.4Low139 Ų139106 Ų10665%0.6556%0.555SS**Hα-helixtrans-66.9-34.9177.5-62.7178153.500111Q135 E142Q135-E138 PolarHBondContact O-N 3.07Å; E138-E142 WeakPolarHBondContact O-CB 3.38Å; E138-E142 PolarHBondContact O-N 3.14Å
139D71.7Confident70.1Confident101 Ų10198.1 Ų98.154%0.5452%0.517SS..Hα-helixtrans-69.3-31.9176.6-69.8-32.6000113Q135 A137 C143Q135-D139 PolarHBondContact O-N 3.44Å; Q135-D139 VanDerWaalsContact O-N 3.15Å; A137-D139 VanDerWaalsContact C-N 3.29Å; A137-D139 PolarHBondContact O-N 3.43Å; D139-C143 PolarHBondContact O-N 3.21Å; D139-C143 PolarHBondContact O-SG 2.96Å
140E76.8Confident72.3Confident136 Ų13694.5 Ų94.564%0.63649%0.493SS*.Hα-helixtrans-70-47177.6-78-175.117600112F136 A137 E142 C143 D144F136-E140 WeakPolarHBondContact O-CG 3.33Å; F136-E140 PolarHBondContact O-N 3.5Å; A137-E140 PolarHBondContact O-N 3.3Å; E140-E142 VanDerWaalsContact C-N 3.32Å; E140-E142 PolarHBondContact O-N 2.92Å; E140-C143 WeakPolarHBondContact O-CB 3.47Å; E140-C143 PolarHBondContact O-N 2.88Å; E140-C143 VanDerWaalsContact O-N 3.14Å; E140-D144 PolarHBondContact O-N 3.29Å; E140-D144 VanDerWaalsContact O-N 3.13Å
141E83.1Confident74.6Confident131 Ų13191.4 Ų91.461%0.61248%0.475SS*.Hα-helixtrans-61.6-41178-171.5-178.3172.300111.5A137 C143 D144 L145A137-E141 PolarHBondContact O-N 3.05Å; E141-C143 VanDerWaalsContact C-N 3.28Å; E141-C143 PolarHBondContact O-N 3.34Å; E141-D144 PolarHBondContact O-N 3.31Å; E141-L145 HydrophobicContact CG-CD1 4.14Å; E141-L145 HydrophobicContact CG-CG 4.48Å; E141-L145 WeakPolarHBondContact O-CB 2.95Å; E141-L145 WeakPolarHBondContact O-CG 3.36Å; E141-L145 PolarHBondContact O-N 3.34Å
142E85Confident76.6Confident58 Ų5890.9 Ų90.927%0.27147%0.466SS..Hα-helixtrans-62.1-36176.7-174.365.8-151.500112.2E138 E140 R146 Y178 R182E138-E142 WeakPolarHBondContact O-CB 3.38Å; E138-E142 PolarHBondContact O-N 3.14Å; E140-E142 VanDerWaalsContact C-N 3.32Å; E140-E142 PolarHBondContact O-N 2.92Å; E142-R146 VanDerWaalsContact O-CB 3.27Å; E142-R146 WeakPolarHBondContact O-CB 3.48Å; E142-R146 PolarHBondContact O-N 2.81Å; E142-Y178 VanDerWaalsContact CD-OH 3.28Å; E142-Y178 WeakPolarHBondContact OE1-CE1 3.27Å; E142-Y178 PolarHBondContact OE1-OH 3.17Å; E142-R182 IonicContact OE1-CZ 3.57Å; E142-R182 IonicContact OE1-NH1 2.61Å; E142-R182 PolarHBondContact OE1-NH1 3.2Å; E142-R182 IonicContact OE2-CZ 3.39Å; E142-R182 IonicContact OE2-NH1 2.68Å; E142-R182 PolarHBondContact OE2-NH1 3.13Å; E142-R182 IonicContact OE2-NH2 3.59Å
143C87.1Confident78.6Confident41 Ų4187.9 Ų87.928%0.27745%0.445SS..Hα-helixtrans-67.2-40.4175.2-75.20000112D139 E140 E141 R147D139-C143 PolarHBondContact O-N 3.21Å; D139-C143 PolarHBondContact O-SG 2.96Å; E140-C143 WeakPolarHBondContact O-CB 3.47Å; E140-C143 PolarHBondContact O-N 2.88Å; E140-C143 VanDerWaalsContact O-N 3.14Å; E141-C143 VanDerWaalsContact C-N 3.28Å; E141-C143 PolarHBondContact O-N 3.34Å; C143-R147 WeakPolarHBondContact O-CB 3.42Å; C143-R147 VanDerWaalsContact O-CG 3.3Å; C143-R147 WeakPolarHBondContact O-CG 3.3Å; C143-R147 PolarHBondContact O-N 3.1Å
144D90.7Very high80Confident86 Ų8685.8 Ų85.846%0.4642%0.422SS..Hα-helixtrans-67.7-44.6176.6-75-21000112.4E140 E141 R146 R147 S148E140-D144 PolarHBondContact O-N 3.29Å; E140-D144 VanDerWaalsContact O-N 3.13Å; E141-D144 PolarHBondContact O-N 3.31Å; D144-R146 VanDerWaalsContact C-N 3.33Å; D144-R146 PolarHBondContact O-N 3.2Å; D144-R147 PolarHBondContact O-N 3.23Å; D144-R147 IonicContact OD1-CZ 3.34Å; D144-R147 VanDerWaalsContact OD1-CZ 3.29Å; D144-R147 IonicContact OD1-NE 2.74Å; D144-R147 PolarHBondContact OD1-NE 3.07Å; D144-R147 IonicContact OD1-NH2 3.32Å; D144-R147 PolarHBondContact OD1-NH2 3.35Å; D144-S148 WeakPolarHBondContact O-CB 3.39Å; D144-S148 PolarHBondContact O-N 3.28Å
145L91.4Very high81.6Confident85 Ų8577.7 Ų77.745%0.44540%0.4SS..Hα-helixtrans-58.8-45.3174.4-72.4169.7000111.4E141 R147 S148 F149E141-L145 HydrophobicContact CG-CD1 4.14Å; E141-L145 HydrophobicContact CG-CG 4.48Å; E141-L145 WeakPolarHBondContact O-CB 2.95Å; E141-L145 WeakPolarHBondContact O-CG 3.36Å; E141-L145 PolarHBondContact O-N 3.34Å; L145-R147 PolarHBondContact O-N 2.63Å; L145-S148 PolarHBondContact O-N 3.38Å; L145-F149 VanDerWaalsContact O-CB 3.27Å; L145-F149 WeakPolarHBondContact O-CB 3.33Å; L145-F149 PolarHBondContact O-N 3.21Å
146R91.9Very high83.3Confident56 Ų5674.3 Ų74.321%0.21138%0.384CS..Hα-helixtrans-61.8-42.8176.6-175.817162.6161-2.3112.1C123 E142 D144 N150 Y178C123-R146 PolarHBondContact SG-NH2 3.35Å; E142-R146 VanDerWaalsContact O-CB 3.27Å; E142-R146 WeakPolarHBondContact O-CB 3.48Å; E142-R146 PolarHBondContact O-N 2.81Å; D144-R146 VanDerWaalsContact C-N 3.33Å; D144-R146 PolarHBondContact O-N 3.2Å; R146-N150 WeakPolarHBondContact O-CB 3.18Å; R146-N150 VanDerWaalsContact O-CG 3.22Å; R146-N150 PolarHBondContact O-N 2.95Å; R146-N150 PolarHBondContact O-ND2 3.37Å; R146-Y178 HydrophobicContact CB-CD1 3.73Å; R146-Y178 HydrophobicContact CB-CE1 3.61Å; R146-Y178 HydrophobicContact CB-CE2 4.47Å; R146-Y178 HydrophobicContact CB-CG 4.17Å; R146-Y178 HydrophobicContact CG-CD1 3.54Å; R146-Y178 HydrophobicContact CG-CE1 3.97Å; R146-Y178 HydrophobicContact CG-CG 3.88Å
147R91.2Very high85.1Confident150 Ų15068.3 Ų68.357%0.56636%0.358SS*.Hα-helixtrans-63.9-48.1177.6-77.7-173.4-77.3-165.1-5.9111.5C143 D144 L145 N150 A151C143-R147 WeakPolarHBondContact O-CB 3.42Å; C143-R147 VanDerWaalsContact O-CG 3.3Å; C143-R147 WeakPolarHBondContact O-CG 3.3Å; C143-R147 PolarHBondContact O-N 3.1Å; D144-R147 PolarHBondContact O-N 3.23Å; D144-R147 IonicContact OD1-CZ 3.34Å; D144-R147 VanDerWaalsContact OD1-CZ 3.29Å; D144-R147 IonicContact OD1-NE 2.74Å; D144-R147 PolarHBondContact OD1-NE 3.07Å; D144-R147 IonicContact OD1-NH2 3.32Å; D144-R147 PolarHBondContact OD1-NH2 3.35Å; L145-R147 PolarHBondContact O-N 2.63Å; R147-N150 PolarHBondContact O-N 2.92Å; R147-A151 PolarHBondContact O-N 2.96Å
148S93.2Very high86.4Confident61 Ų6172 Ų7243%0.42736%0.358SS..Hα-helixtrans-60.8-46.5177.7-177.40000111.7D144 L145 N150 A151 Q152D144-S148 WeakPolarHBondContact O-CB 3.39Å; D144-S148 PolarHBondContact O-N 3.28Å; L145-S148 PolarHBondContact O-N 3.38Å; S148-N150 PolarHBondContact O-N 3.23Å; S148-A151 PolarHBondContact O-N 3.24Å; S148-Q152 WeakPolarHBondContact O-CG 3.46Å; S148-Q152 PolarHBondContact O-N 3.4Å; S148-Q152 PolarHBondContact OG-NE2 3.15Å
149F93.7Very high87.5Confident13 Ų1373.1 Ų73.16%0.05736%0.357CS..Hα-helixtrans-58.3-48.5176.1173.4-91.1000112L145 A151 Q152 L153 L177 Y178 Y181 L227 Y230L145-F149 VanDerWaalsContact O-CB 3.27Å; L145-F149 WeakPolarHBondContact O-CB 3.33Å; L145-F149 PolarHBondContact O-N 3.21Å; F149-A151 VanDerWaalsContact C-N 3.33Å; F149-A151 PolarHBondContact O-N 2.93Å; F149-Q152 PolarHBondContact O-N 3.26Å; F149-L153 HydrophobicContact CE1-CB 4.45Å; F149-L153 HydrophobicContact CE1-CD2 3.74Å; F149-L153 HydrophobicContact CZ-CD2 4.01Å; F149-L153 VanDerWaalsContact O-CB 3.31Å; F149-L153 WeakPolarHBondContact O-CB 3.42Å; F149-L153 PolarHBondContact O-N 2.81Å; F149-L177 HydrophobicContact CE1-CB 4.46Å; F149-Y178 HydrophobicContact CB-CD2 3.71Å; F149-Y178 HydrophobicContact CB-CE2 4.13Å; F149-Y178 AromaticContact CD1-CD2 3.64Å; F149-Y178 HydrophobicContact CD1-CD2 3.64Å; F149-Y178 HydrophobicContact CD1-CG 4.07Å; F149-Y178 HydrophobicContact CD2-CD2 4.15Å; F149-Y178 VanDerWaalsContact CE1-CA 3.48Å; F149-Y178 HydrophobicContact CE1-CD2 4.27Å; F149-Y178 AromaticContact CG-CD2 3.56Å; F149-Y178 HydrophobicContact CG-CD2 3.56Å; F149-Y178 HydrophobicContact CG-CE2 4.36Å; F149-Y178 HydrophobicContact CG-CG 4.43Å; F149-Y181 HydrophobicContact CD2-CD1 4.13Å; F149-Y181 HydrophobicContact CD2-CE1 4.42Å; F149-Y181 AromaticContact CE2-CD1 3.39Å; F149-Y181 HydrophobicContact CE2-CD1 3.39Å; F149-Y181 HydrophobicContact CE2-CD2 4.32Å; F149-Y181 AromaticContact CE2-CE1 3.87Å; F149-Y181 HydrophobicContact CE2-CE1 3.87Å; F149-Y181 AromaticContact CE2-CG 3.64Å; F149-Y181 HydrophobicContact CE2-CG 3.64Å; F149-Y181 HydrophobicContact CZ-CD1 4.01Å; F149-Y181 AromaticContact CZ-CG 3.85Å; F149-Y181 HydrophobicContact CZ-CG 3.85Å; F149-L227 HydrophobicContact CZ-CD2 3.86Å; F149-Y230 AromaticContact CD2-CE1 3.98Å; F149-Y230 HydrophobicContact CD2-CE1 3.98Å; F149-Y230 HydrophobicContact CE2-CD1 4.17Å; F149-Y230 AromaticContact CE2-CE1 3.45Å; F149-Y230 HydrophobicContact CE2-CE1 3.45Å; F149-Y230 VanDerWaalsContact CE2-CE1 3.45Å; F149-Y230 HydrophobicContact CZ-CE1 4.3Å
150N90.9Very high87.8Confident33 Ų3371 Ų7118%0.17634%0.341CS..Hα-helixtrans-62.4-40.9-179.2-74.9-21.8000111.7F120 R146 R147 S148 L153 E154F120-N150 WeakPolarHBondContact CE2-ND2 3.43Å; R146-N150 WeakPolarHBondContact O-CB 3.18Å; R146-N150 VanDerWaalsContact O-CG 3.22Å; R146-N150 PolarHBondContact O-N 2.95Å; R146-N150 PolarHBondContact O-ND2 3.37Å; R147-N150 PolarHBondContact O-N 2.92Å; S148-N150 PolarHBondContact O-N 3.23Å; N150-L153 PolarHBondContact O-N 3.24Å; N150-E154 VanDerWaalsContact O-CB 3.3Å; N150-E154 WeakPolarHBondContact O-CB 3.48Å; N150-E154 PolarHBondContact O-N 3.27Å
151A91.5Very high87.4Confident60 Ų6066.4 Ų66.450%0.49632%0.323SS..Hα-helixtrans-63.5-44.2176.700000112.1R147 S148 F149 E154 A155R147-A151 PolarHBondContact O-N 2.96Å; S148-A151 PolarHBondContact O-N 3.24Å; F149-A151 VanDerWaalsContact C-N 3.33Å; F149-A151 PolarHBondContact O-N 2.93Å; A151-E154 PolarHBondContact O-N 3.07Å; A151-A155 PolarHBondContact O-N 3.31Å; A151-A155 VanDerWaalsContact O-N 3.09Å
152Q91.8Very high86.5Confident85 Ų8567.1 Ų67.140%0.39733%0.331SS..Hα-helixtrans-64.9-43.8176.6-69.5177.433.400112.1S148 F149 E154 A155 F156 Y230S148-Q152 WeakPolarHBondContact O-CG 3.46Å; S148-Q152 PolarHBondContact O-N 3.4Å; S148-Q152 PolarHBondContact OG-NE2 3.15Å; F149-Q152 PolarHBondContact O-N 3.26Å; Q152-E154 VanDerWaalsContact C-N 3.34Å; Q152-A155 PolarHBondContact O-N 3Å; Q152-F156 WeakPolarHBondContact O-CB 3.36Å; Q152-F156 PolarHBondContact O-N 2.89Å; Q152-Y230 HydrophobicContact CB-CE2 4.23Å; Q152-Y230 PolarHBondContact OE1-OH 3.49Å; Q152-Y230 VanDerWaalsContact OE1-OH 3.09Å
153L90.9Very high85.5Confident5 Ų566.8 Ų66.83%0.02634%0.344CS..Hα-helixtrans-65-40.3178.7-177.461.4000111F149 N150 F156 L157 L177 L227 Y230F149-L153 HydrophobicContact CE1-CB 4.45Å; F149-L153 HydrophobicContact CE1-CD2 3.74Å; F149-L153 HydrophobicContact CZ-CD2 4.01Å; F149-L153 VanDerWaalsContact O-CB 3.31Å; F149-L153 WeakPolarHBondContact O-CB 3.42Å; F149-L153 PolarHBondContact O-N 2.81Å; N150-L153 PolarHBondContact O-N 3.24Å; L153-F156 HydrophobicContact CD1-CD1 4.33Å; L153-F156 WeakPolarHBondContact O-CB 3.25Å; L153-F156 PolarHBondContact O-N 3.08Å; L153-L157 HydrophobicContact CD1-CD1 4.13Å; L153-L157 HydrophobicContact CD1-CG 4.08Å; L153-L157 HydrophobicContact CD2-CD1 4.46Å; L153-L157 HydrophobicContact CG-CD1 3.85Å; L153-L157 HydrophobicContact CG-CG 4.23Å; L153-L157 WeakPolarHBondContact O-CB 3.07Å; L153-L157 WeakPolarHBondContact O-CG 3.22Å; L153-L157 PolarHBondContact O-N 2.98Å; L153-L177 HydrophobicContact CD2-CB 3.98Å; L153-L177 HydrophobicContact CD2-CD1 3.68Å; L153-L177 HydrophobicContact CD2-CG 4.47Å; L153-L227 HydrophobicContact CD1-CD2 4.06Å; L153-L227 HydrophobicContact CD2-CD2 3.8Å; L153-Y230 HydrophobicContact CD1-CD1 4.46Å; L153-Y230 HydrophobicContact CD1-CD2 3.95Å; L153-Y230 HydrophobicContact CD1-CG 3.88Å
154E87.5Confident84.5Confident66 Ų6671.1 Ų71.131%0.30836%0.363SS..Hα-helixtrans-62.4-46.3176.3-173.3-180172.700111.8N150 A151 Q152 F156 L157 R158N150-E154 VanDerWaalsContact O-CB 3.3Å; N150-E154 WeakPolarHBondContact O-CB 3.48Å; N150-E154 PolarHBondContact O-N 3.27Å; A151-E154 PolarHBondContact O-N 3.07Å; Q152-E154 VanDerWaalsContact C-N 3.34Å; E154-F156 VanDerWaalsContact C-N 3.29Å; E154-F156 PolarHBondContact O-N 3.04Å; E154-L157 PolarHBondContact O-N 3.45Å; E154-R158 HydrophobicContact CG-CG 4.35Å; E154-R158 WeakPolarHBondContact O-CB 3.43Å; E154-R158 VanDerWaalsContact O-CG 3.28Å; E154-R158 WeakPolarHBondContact O-CG 3.41Å; E154-R158 PolarHBondContact O-N 3.07Å; E154-R158 IonicContact OE1-CZ 3.19Å; E154-R158 IonicContact OE1-NE 2.92Å; E154-R158 PolarHBondContact OE1-NE 3.38Å; E154-R158 IonicContact OE1-NH2 2.66Å; E154-R158 PolarHBondContact OE1-NH2 3.46Å
155A87.8Confident83.8Confident38 Ų3868.2 Ų68.231%0.31435%0.348SS..Hα-helixtrans-59.4-41.7175.600000111.8A151 Q152 R159A151-A155 PolarHBondContact O-N 3.31Å; A151-A155 VanDerWaalsContact O-N 3.09Å; Q152-A155 PolarHBondContact O-N 3Å; A155-R159 WeakPolarHBondContact O-CG 3.29Å; A155-R159 PolarHBondContact O-N 3.46Å
156F88.3Confident83.1Confident28 Ų2868.7 Ų68.712%0.12335%0.354CS..Hα-helixtrans-63.5-45.6175.5176.1-100.7000112.5Q152 L153 E154 R159 R160 R229 Y230 K233Q152-F156 WeakPolarHBondContact O-CB 3.36Å; Q152-F156 PolarHBondContact O-N 2.89Å; L153-F156 HydrophobicContact CD1-CD1 4.33Å; L153-F156 WeakPolarHBondContact O-CB 3.25Å; L153-F156 PolarHBondContact O-N 3.08Å; E154-F156 VanDerWaalsContact C-N 3.29Å; E154-F156 PolarHBondContact O-N 3.04Å; F156-R159 PolarHBondContact O-N 3.13Å; F156-R160 PolarHBondContact O-N 2.98Å; F156-R229 HydrophobicContact CE1-CB 4.12Å; F156-R229 HydrophobicContact CZ-CB 3.59Å; F156-Y230 HydrophobicContact CB-CD2 4.17Å; F156-Y230 HydrophobicContact CD1-CD2 4.18Å; F156-Y230 HydrophobicContact CG-CD2 4.08Å; F156-K233 HydrophobicContact CD2-CD 4.09Å; F156-K233 HydrophobicContact CE2-CD 4.21Å
157L86.6Confident82.7Confident1 Ų170 Ų701%0.00536%0.363CS..Hα-helixtrans-70.6-35.4-179.3-68.4174.5000112.4L153 E154 R159 R160 C161 V165 Y226L153-L157 HydrophobicContact CD1-CD1 4.13Å; L153-L157 HydrophobicContact CD1-CG 4.08Å; L153-L157 HydrophobicContact CD2-CD1 4.46Å; L153-L157 HydrophobicContact CG-CD1 3.85Å; L153-L157 HydrophobicContact CG-CG 4.23Å; L153-L157 WeakPolarHBondContact O-CB 3.07Å; L153-L157 WeakPolarHBondContact O-CG 3.22Å; L153-L157 PolarHBondContact O-N 2.98Å; E154-L157 PolarHBondContact O-N 3.45Å; L157-R159 VanDerWaalsContact C-N 3.32Å; L157-R159 PolarHBondContact O-N 3.44Å; L157-R160 PolarHBondContact O-N 3.37Å; L157-C161 WeakPolarHBondContact O-CA 3.39Å; L157-C161 WeakPolarHBondContact O-CB 3.3Å; L157-C161 PolarHBondContact O-N 3.18Å; L157-V165 HydrophobicContact CB-CG1 3.95Å; L157-V165 HydrophobicContact CB-CG2 3.69Å; L157-V165 HydrophobicContact CD1-CG1 3.75Å; L157-V165 HydrophobicContact CG-CG1 4.5Å; L157-Y226 HydrophobicContact CD1-CD1 3.77Å; L157-Y226 HydrophobicContact CD1-CE1 4.47Å; L157-Y226 HydrophobicContact CD2-CD1 4.01Å
158R85.2Confident82.4Confident138 Ų13863 Ų6352%0.52134%0.337SS..Hα-helixtrans-60.8-41.5176.5-78.1173.4176.5-1266.3111.9E154 G163 V165E154-R158 HydrophobicContact CG-CG 4.35Å; E154-R158 WeakPolarHBondContact O-CB 3.43Å; E154-R158 VanDerWaalsContact O-CG 3.28Å; E154-R158 WeakPolarHBondContact O-CG 3.41Å; E154-R158 PolarHBondContact O-N 3.07Å; E154-R158 IonicContact OE1-CZ 3.19Å; E154-R158 IonicContact OE1-NE 2.92Å; E154-R158 PolarHBondContact OE1-NE 3.38Å; E154-R158 IonicContact OE1-NH2 2.66Å; E154-R158 PolarHBondContact OE1-NH2 3.46Å; R158-G163 PolarHBondContact O-N 3.42Å; R158-V165 HydrophobicContact CG-CG2 4.09Å
159R82.2Confident82Confident164 Ų16461.7 Ų61.762%0.61933%0.328SS*.Hα-helixtrans-65.3-47.4176.4-66.8177.8-164.2137.85.7111.7A155 F156 L157A155-R159 WeakPolarHBondContact O-CG 3.29Å; A155-R159 PolarHBondContact O-N 3.46Å; F156-R159 PolarHBondContact O-N 3.13Å; L157-R159 VanDerWaalsContact C-N 3.32Å; L157-R159 PolarHBondContact O-N 3.44Å
160R76.7Confident81.6Confident57 Ų5761.7 Ų61.722%0.21533%0.329CS..Hα-helixtrans-81.8-31-173.6-170.3-178.261.1149.33.5115F156 L157 R225F156-R160 PolarHBondContact O-N 2.98Å; L157-R160 PolarHBondContact O-N 3.37Å; R160-R225 VanDerWaalsContact CZ-O 3.31Å; R160-R225 PolarHBondContact NH1-O 2.96Å; R160-R225 PolarHBondContact NH2-O 3.4Å
161C68.3Low80.9Confident39 Ų3962.2 Ų62.226%0.26433%0.332SS..THydrogen-bonded Turntrans-99.926.9-173.2-59.50000112.7L157 G163 I164L157-C161 WeakPolarHBondContact O-CA 3.39Å; L157-C161 WeakPolarHBondContact O-CB 3.3Å; L157-C161 PolarHBondContact O-N 3.18Å; C161-G163 PolarHBondContact O-N 3.29Å; C161-G163 VanDerWaalsContact O-N 3.08Å; C161-I164 PolarHBondContact O-N 3.09Å
162N64.6Low80.4Confident146 Ų14662 Ų6278%0.78134%0.335SS*.THydrogen-bonded Turntrans49.337.5-179.8-57.569.6000112.3I164N162-I164 VanDerWaalsContact C-N 3.3Å; N162-I164 PolarHBondContact O-N 2.86Å
163G64.5Low79.9Confident51 Ų5165.3 Ų65.353%0.52634%0.344SS..THydrogen-bonded Turntrans78.3-9.8-179.800000117R158 C161 V165R158-G163 PolarHBondContact O-N 3.42Å; C161-G163 PolarHBondContact O-N 3.29Å; C161-G163 VanDerWaalsContact O-N 3.08Å; G163-V165 PolarHBondContact O-N 3.29Å
164I66.5Low79.8Confident132 Ų13274.3 Ų74.368%0.67738%0.378SS*.  trans-98.694.8179.7-54.8177.1000109.7C161 N162 V166C161-I164 PolarHBondContact O-N 3.09Å; N162-I164 VanDerWaalsContact C-N 3.3Å; N162-I164 PolarHBondContact O-N 2.86Å; I164-V166 HydrophobicContact CG2-CG2 4.21Å
165V74.3Confident79.9Confident24 Ų2471.9 Ų71.915%0.14537%0.366CS..  trans-103.1102.7177.5-172.40000109.8L157 R158 G163 M167L157-V165 HydrophobicContact CB-CG1 3.95Å; L157-V165 HydrophobicContact CB-CG2 3.69Å; L157-V165 HydrophobicContact CD1-CG1 3.75Å; L157-V165 HydrophobicContact CG-CG1 4.5Å; R158-V165 HydrophobicContact CG-CG2 4.09Å; G163-V165 PolarHBondContact O-N 3.29Å; V165-M167 HydrophobicContact CG1-CE 3.52Å
166V77.8Confident80.1Confident95 Ų9572.1 Ų72.158%0.57636%0.362SS*.PPolyproline II helixtrans-94.2127.7172.2-177.90000109.1I164 Y226I164-V166 HydrophobicContact CG2-CG2 4.21Å; V166-Y226 VanDerWaalsContact O-CE1 3.3Å; V166-Y226 WeakPolarHBondContact O-CE1 3.45Å; V166-Y226 VanDerWaalsContact O-CZ 3.31Å; V166-Y226 PolarHBondContact O-OH 3.37Å
167M83Confident80.3Confident84 Ų8471.2 Ų71.241%0.41436%0.359SS..PPolyproline II helixtrans-68.4130.5175.5-71.9-62.9103.900110.6V165V165-M167 HydrophobicContact CG1-CE 3.52Å
168P84.7Confident80.7Confident2 Ų271.7 Ų71.71%0.01336%0.361CS..PPolyproline II helixtrans-73.4146.9-176.527.9-31.5000112.2I175 L177 I222 Y226P168-I175 HydrophobicContact CG-CB 4.47Å; P168-I175 PolarHBondContact O-N 3.36Å; P168-L177 HydrophobicContact CG-CD1 4.32Å; P168-L177 HydrophobicContact CG-CD2 3.77Å; P168-L177 HydrophobicContact CG-CG 4.24Å; P168-I222 HydrophobicContact CB-CB 4.45Å; P168-I222 HydrophobicContact CB-CD1 3.85Å; P168-I222 HydrophobicContact CB-CG1 3.82Å; P168-I222 HydrophobicContact CB-CG2 3.8Å; P168-I222 HydrophobicContact CG-CG2 3.65Å; P168-Y226 HydrophobicContact CB-CD2 4.35Å; P168-Y226 HydrophobicContact CB-CE2 3.81Å; P168-Y226 HydrophobicContact CG-CD2 4.1Å; P168-Y226 HydrophobicContact CG-CE2 3.94Å
169S85.4Confident81Confident35 Ų3571.6 Ų71.625%0.24536%0.36CS..EExtended strand (participates in β ladder)trans-131.2145.1174.655.40000111.8M39 R173M39-S169 WeakPolarHBondContact CE-O 3.23Å; S169-R173 CarbonylContact C-O 3.58Å; S169-R173 WeakPolarHBondContact CA-O 3.45Å; S169-R173 WeakPolarHBondContact CB-O 3.45Å
170I84.4Confident81.6Confident12 Ų1263.8 Ų63.86%0.06233%0.331CS..EExtended strand (participates in β ladder)trans-121125.3168.4-60.1171.8000106.4G172 R173 I175 I208 A219 I222I170-G172 VanDerWaalsContact C-N 3.34Å; I170-G172 PolarHBondContact O-N 3Å; I170-R173 PolarHBondContact N-O 3.46Å; I170-R173 WeakPolarHBondContact O-CB 3.33Å; I170-R173 PolarHBondContact O-N 3.32Å; I170-I175 HydrophobicContact CB-CD1 3.96Å; I170-I175 HydrophobicContact CB-CG1 4.36Å; I170-I175 HydrophobicContact CD1-CD1 3.9Å; I170-I175 HydrophobicContact CD1-CG1 4.04Å; I170-I175 HydrophobicContact CG1-CD1 3.89Å; I170-I175 HydrophobicContact CG1-CG1 3.86Å; I170-I208 HydrophobicContact CB-CD1 4.11Å; I170-I208 HydrophobicContact CD1-CD1 3.52Å; I170-I208 HydrophobicContact CG1-CD1 4.37Å; I170-I208 HydrophobicContact CG2-CD1 4.24Å; I170-A219 HydrophobicContact CD1-CB 4.41Å; I170-I222 HydrophobicContact CD1-CD1 3.6Å; I170-I222 HydrophobicContact CG1-CD1 3.41Å; I170-I222 VanDerWaalsContact CG1-CD1 3.41Å
171N77.6Confident82.5Confident45 Ų4562.9 Ų62.924%0.24133%0.328CS..THydrogen-bonded Turntrans4953.3-179.2-62.223.6000112R173 C212N171-R173 PolarHBondContact O-N 3.04Å; N171-C212 VanDerWaalsContact CG-SG 3.59Å; N171-C212 PolarHBondContact ND2-SG 2.66Å; N171-C212 PolarHBondContact OD1-SG 3.19Å
172G80.1Confident83.7Confident55 Ų5566.9 Ų66.957%0.56734%0.337SS*.THydrogen-bonded Turntrans70.5-16.2-178.300000115.7I170I170-G172 VanDerWaalsContact C-N 3.34Å; I170-G172 PolarHBondContact O-N 3Å
173R82.4Confident85.1Confident155 Ų15562.5 Ų62.559%0.58531%0.311SS*.EExtended strand (participates in β ladder)trans-82.9125.7179.6-63-174.1-178.6-166-3.3110.7S169 I170 N171 I175 G207S169-R173 CarbonylContact C-O 3.58Å; S169-R173 WeakPolarHBondContact CA-O 3.45Å; S169-R173 WeakPolarHBondContact CB-O 3.45Å; I170-R173 PolarHBondContact N-O 3.46Å; I170-R173 WeakPolarHBondContact O-CB 3.33Å; I170-R173 PolarHBondContact O-N 3.32Å; N171-R173 PolarHBondContact O-N 3.04Å; R173-I175 PolarHBondContact O-N 3Å; R173-G207 PolarHBondContact NH1-O 2.95Å
174R87.8Confident86.6Confident194 Ų19460.1 Ų60.173%0.73229%0.286SS*.EExtended strand (participates in β ladder)trans-64.5130.2171.4-66.3-177.3175.9-160.5-1.3109.4
175I90.5Very high87.9Confident14 Ų1456.8 Ų56.87%0.07227%0.272CS..PPolyproline II helixtrans-87.1125.5-179.8-59.5-51000110P168 I170 R173 L177 L180 L206 I208 I222P168-I175 HydrophobicContact CG-CB 4.47Å; P168-I175 PolarHBondContact O-N 3.36Å; I170-I175 HydrophobicContact CB-CD1 3.96Å; I170-I175 HydrophobicContact CB-CG1 4.36Å; I170-I175 HydrophobicContact CD1-CD1 3.9Å; I170-I175 HydrophobicContact CD1-CG1 4.04Å; I170-I175 HydrophobicContact CG1-CD1 3.89Å; I170-I175 HydrophobicContact CG1-CG1 3.86Å; R173-I175 PolarHBondContact O-N 3Å; I175-L177 PolarHBondContact O-N 3.49Å; I175-L180 HydrophobicContact CG2-CD2 4.17Å; I175-L206 HydrophobicContact CG2-CD1 4.29Å; I175-L206 HydrophobicContact CG2-CD2 4.31Å; I175-I208 HydrophobicContact CD1-CD1 3.86Å; I175-I208 HydrophobicContact CD1-CG1 4.44Å; I175-I222 HydrophobicContact CG1-CD1 3.87Å
176D91.5Very high88.8Confident43 Ų4362.6 Ų62.623%0.2330%0.298CS..  trans-74.7101.7170.3-173-24.8000109.3Y178 R179 L180D176-Y178 PolarHBondContact O-N 2.9Å; D176-Y178 WeakPolarHBondContact OD1-CB 3.36Å; D176-Y178 PolarHBondContact OD1-N 3.19Å; D176-R179 HydrophobicContact CB-CB 4.13Å; D176-R179 HydrophobicContact CB-CG 4.28Å; D176-R179 PolarHBondContact O-N 2.95Å; D176-R179 PolarHBondContact OD1-N 3.44Å; D176-R179 VanDerWaalsContact OD1-N 3.13Å; D176-R179 WeakPolarHBondContact OD2-CD 3.27Å; D176-R179 WeakPolarHBondContact OD2-CG 3.31Å; D176-R179 IonicContact OD2-NE 3.4Å; D176-L180 WeakPolarHBondContact O-CB 3.34Å; D176-L180 PolarHBondContact O-N 3.38Å
177L92.9Very high89.5Confident9 Ų959.7 Ų59.75%0.04728%0.278CS..Hα-helixtrans-64.2-29.6-179.2-67.8-179.5000112.8F149 L153 P168 I175 L180 Y181 I222 Y226 L227F149-L177 HydrophobicContact CE1-CB 4.46Å; L153-L177 HydrophobicContact CD2-CB 3.98Å; L153-L177 HydrophobicContact CD2-CD1 3.68Å; L153-L177 HydrophobicContact CD2-CG 4.47Å; P168-L177 HydrophobicContact CG-CD1 4.32Å; P168-L177 HydrophobicContact CG-CD2 3.77Å; P168-L177 HydrophobicContact CG-CG 4.24Å; I175-L177 PolarHBondContact O-N 3.49Å; L177-L180 HydrophobicContact CD2-CD2 4.35Å; L177-Y181 VanDerWaalsContact O-CB 3.23Å; L177-Y181 WeakPolarHBondContact O-CB 3.43Å; L177-Y181 PolarHBondContact O-N 2.8Å; L177-I222 HydrophobicContact CD2-CG2 3.83Å; L177-Y226 HydrophobicContact CD1-CD1 4.42Å; L177-Y226 HydrophobicContact CD1-CG 4.46Å; L177-L227 HydrophobicContact CB-CD2 4.48Å; L177-L227 HydrophobicContact CD2-CD1 4.26Å; L177-L227 HydrophobicContact CD2-CG 4.49Å
178Y93.8Very high90Very high12 Ų1257.9 Ų57.95%0.04728%0.281CS..Hα-helixtrans-71.7-46.4179.2170.1-108.2000111E142 R146 F149 D176 L180 Y181 R182E142-Y178 VanDerWaalsContact CD-OH 3.28Å; E142-Y178 WeakPolarHBondContact OE1-CE1 3.27Å; E142-Y178 PolarHBondContact OE1-OH 3.17Å; R146-Y178 HydrophobicContact CB-CD1 3.73Å; R146-Y178 HydrophobicContact CB-CE1 3.61Å; R146-Y178 HydrophobicContact CB-CE2 4.47Å; R146-Y178 HydrophobicContact CB-CG 4.17Å; R146-Y178 HydrophobicContact CG-CD1 3.54Å; R146-Y178 HydrophobicContact CG-CE1 3.97Å; R146-Y178 HydrophobicContact CG-CG 3.88Å; F149-Y178 HydrophobicContact CB-CD2 3.71Å; F149-Y178 HydrophobicContact CB-CE2 4.13Å; F149-Y178 AromaticContact CD1-CD2 3.64Å; F149-Y178 HydrophobicContact CD1-CD2 3.64Å; F149-Y178 HydrophobicContact CD1-CG 4.07Å; F149-Y178 HydrophobicContact CD2-CD2 4.15Å; F149-Y178 VanDerWaalsContact CE1-CA 3.48Å; F149-Y178 HydrophobicContact CE1-CD2 4.27Å; F149-Y178 AromaticContact CG-CD2 3.56Å; F149-Y178 HydrophobicContact CG-CD2 3.56Å; F149-Y178 HydrophobicContact CG-CE2 4.36Å; F149-Y178 HydrophobicContact CG-CG 4.43Å; D176-Y178 PolarHBondContact O-N 2.9Å; D176-Y178 WeakPolarHBondContact OD1-CB 3.36Å; D176-Y178 PolarHBondContact OD1-N 3.19Å; Y178-L180 VanDerWaalsContact C-N 3.33Å; Y178-L180 PolarHBondContact O-N 3.47Å; Y178-Y181 PolarHBondContact O-N 2.94Å; Y178-R182 HydrophobicContact CD2-CG 4.33Å; Y178-R182 HydrophobicContact CE2-CG 4.01Å; Y178-R182 WeakPolarHBondContact O-CG 3.4Å; Y178-R182 PolarHBondContact O-N 2.98Å; Y178-R182 WeakPolarHBondContact OH-CD 3.32Å
179R92.9Very high90.4Very high136 Ų13658 Ų5851%0.51328%0.282SS..Hα-helixtrans-61.5-42.2173.7-74.2-178.6177.7-177.71.2112.1D176 K183D176-R179 HydrophobicContact CB-CB 4.13Å; D176-R179 HydrophobicContact CB-CG 4.28Å; D176-R179 PolarHBondContact O-N 2.95Å; D176-R179 PolarHBondContact OD1-N 3.44Å; D176-R179 VanDerWaalsContact OD1-N 3.13Å; D176-R179 WeakPolarHBondContact OD2-CD 3.27Å; D176-R179 WeakPolarHBondContact OD2-CG 3.31Å; D176-R179 IonicContact OD2-NE 3.4Å; R179-K183 WeakPolarHBondContact O-CB 3.38Å; R179-K183 PolarHBondContact O-N 2.72Å
180L94.4Very high90.6Very high0 Ų057.7 Ų57.70%028%0.276CS..Hα-helixtrans-58.2-51175.117752.5000111.3I175 D176 L177 Y178 K183 V184 W199 V202 L206 I222 Y223 L227I175-L180 HydrophobicContact CG2-CD2 4.17Å; D176-L180 WeakPolarHBondContact O-CB 3.34Å; D176-L180 PolarHBondContact O-N 3.38Å; L177-L180 HydrophobicContact CD2-CD2 4.35Å; Y178-L180 VanDerWaalsContact C-N 3.33Å; Y178-L180 PolarHBondContact O-N 3.47Å; L180-K183 PolarHBondContact O-N 3.47Å; L180-V184 HydrophobicContact CD1-CG2 4.03Å; L180-V184 WeakPolarHBondContact O-CG2 3.49Å; L180-V184 PolarHBondContact O-N 3.04Å; L180-V184 VanDerWaalsContact O-N 3.1Å; L180-W199 HydrophobicContact CD1-CZ3 4.39Å; L180-V202 HydrophobicContact CD1-CG1 3.59Å; L180-L206 HydrophobicContact CB-CD2 3.8Å; L180-L206 HydrophobicContact CD1-CD1 4.19Å; L180-L206 HydrophobicContact CD1-CD2 4.39Å; L180-I222 HydrophobicContact CD2-CG2 4.06Å; L180-Y223 HydrophobicContact CD1-CD2 4.13Å; L180-Y223 HydrophobicContact CD2-CD2 4.27Å; L180-Y223 HydrophobicContact CG-CD2 3.89Å; L180-L227 HydrophobicContact CB-CD1 4.32Å; L180-L227 HydrophobicContact CD2-CD1 3.93Å; L180-L227 HydrophobicContact CG-CD1 3.91Å
181Y94.7Very high90.9Very high37 Ų3761.7 Ų61.715%0.14530%0.301CS..Hα-helixtrans-58.8-54.1179.2178-106.1000111.8F149 L177 Y178 K183 V184 V185 L227 Y230 E231F149-Y181 HydrophobicContact CD2-CD1 4.13Å; F149-Y181 HydrophobicContact CD2-CE1 4.42Å; F149-Y181 AromaticContact CE2-CD1 3.39Å; F149-Y181 HydrophobicContact CE2-CD1 3.39Å; F149-Y181 HydrophobicContact CE2-CD2 4.32Å; F149-Y181 AromaticContact CE2-CE1 3.87Å; F149-Y181 HydrophobicContact CE2-CE1 3.87Å; F149-Y181 AromaticContact CE2-CG 3.64Å; F149-Y181 HydrophobicContact CE2-CG 3.64Å; F149-Y181 HydrophobicContact CZ-CD1 4.01Å; F149-Y181 AromaticContact CZ-CG 3.85Å; F149-Y181 HydrophobicContact CZ-CG 3.85Å; L177-Y181 VanDerWaalsContact O-CB 3.23Å; L177-Y181 WeakPolarHBondContact O-CB 3.43Å; L177-Y181 PolarHBondContact O-N 2.8Å; Y178-Y181 PolarHBondContact O-N 2.94Å; Y181-K183 VanDerWaalsContact C-N 3.28Å; Y181-K183 PolarHBondContact O-N 3.12Å; Y181-V184 PolarHBondContact O-N 2.75Å; Y181-V185 HydrophobicContact CD1-CG2 4.36Å; Y181-V185 HydrophobicContact CD2-CG2 3.94Å; Y181-V185 HydrophobicContact CE1-CG2 4.05Å; Y181-V185 HydrophobicContact CE2-CG2 3.6Å; Y181-V185 HydrophobicContact CG-CG2 4.32Å; Y181-V185 WeakPolarHBondContact O-CB 3.45Å; Y181-V185 WeakPolarHBondContact O-CG2 3.15Å; Y181-V185 PolarHBondContact O-N 2.67Å; Y181-L227 HydrophobicContact CD2-CD2 4.45Å; Y181-Y230 HydrophobicContact CE2-CD1 4.24Å; Y181-Y230 HydrophobicContact CE2-CE1 4.43Å; Y181-E231 HydrophobicContact CE2-CB 4.13Å; Y181-E231 HydrophobicContact CE2-CG 4.39Å
182R94.3Very high91.7Very high123 Ų12364.7 Ų64.746%0.46431%0.312SS..Hα-helixtrans-55.6-43.9179.7-74.1-167.773.2-16414.7112.2E142 Y178 Q186E142-R182 IonicContact OE1-CZ 3.57Å; E142-R182 IonicContact OE1-NH1 2.61Å; E142-R182 PolarHBondContact OE1-NH1 3.2Å; E142-R182 IonicContact OE2-CZ 3.39Å; E142-R182 IonicContact OE2-NH1 2.68Å; E142-R182 PolarHBondContact OE2-NH1 3.13Å; E142-R182 IonicContact OE2-NH2 3.59Å; Y178-R182 HydrophobicContact CD2-CG 4.33Å; Y178-R182 HydrophobicContact CE2-CG 4.01Å; Y178-R182 WeakPolarHBondContact O-CG 3.4Å; Y178-R182 PolarHBondContact O-N 2.98Å; Y178-R182 WeakPolarHBondContact OH-CD 3.32Å; R182-Q186 VanDerWaalsContact O-CB 3.25Å; R182-Q186 WeakPolarHBondContact O-CB 3.45Å; R182-Q186 PolarHBondContact O-N 3.45Å
183K94.6Very high92.3Very high55 Ų5562.1 Ų62.124%0.23929%0.285CS..Hα-helixtrans-65.7-44.1-178.5-173.358175.8-179.50112.3R179 L180 Y181 Q186 M187 V202 V205R179-K183 WeakPolarHBondContact O-CB 3.38Å; R179-K183 PolarHBondContact O-N 2.72Å; L180-K183 PolarHBondContact O-N 3.47Å; Y181-K183 VanDerWaalsContact C-N 3.28Å; Y181-K183 PolarHBondContact O-N 3.12Å; K183-Q186 PolarHBondContact O-N 3.04Å; K183-M187 HydrophobicContact CG-SD 4.39Å; K183-M187 VanDerWaalsContact O-CG 3.31Å; K183-M187 WeakPolarHBondContact O-CG 3.46Å; K183-M187 PolarHBondContact O-N 2.98Å; K183-V202 HydrophobicContact CG-CG1 4.32Å; K183-V202 HydrophobicContact CG-CG2 4.41Å; K183-V205 HydrophobicContact CB-CG1 4.34Å; K183-V205 HydrophobicContact CD-CG2 3.9Å; K183-V205 HydrophobicContact CG-CB 4.38Å; K183-V205 HydrophobicContact CG-CG1 4.46Å; K183-V205 HydrophobicContact CG-CG2 3.97Å
184V94.9Very high92.7Very high0 Ų056 Ų560%027%0.266CS..Hα-helixtrans-69-42-179.7170.90000111.1L180 Y181 Q186 M187 G188 G189 V193 W199 V202 Y223L180-V184 HydrophobicContact CD1-CG2 4.03Å; L180-V184 WeakPolarHBondContact O-CG2 3.49Å; L180-V184 PolarHBondContact O-N 3.04Å; L180-V184 VanDerWaalsContact O-N 3.1Å; Y181-V184 PolarHBondContact O-N 2.75Å; V184-Q186 PolarHBondContact O-N 3.42Å; V184-M187 CarbonylContact O-C 3.56Å; V184-M187 WeakPolarHBondContact O-CA 3.38Å; V184-M187 WeakPolarHBondContact O-CB 3.42Å; V184-M187 PolarHBondContact O-N 3.17Å; V184-M187 VanDerWaalsContact O-N 3.07Å; V184-G188 PolarHBondContact O-N 3.46Å; V184-G189 PolarHBondContact O-N 3.45Å; V184-V193 HydrophobicContact CG1-CB 4.45Å; V184-V193 HydrophobicContact CG1-CG2 4Å; V184-W199 HydrophobicContact CG2-CH2 4.07Å; V184-W199 HydrophobicContact CG2-CZ3 3.98Å; V184-V202 HydrophobicContact CG2-CG1 4.42Å; V184-V202 HydrophobicContact CG2-CG2 4.35Å; V184-Y223 HydrophobicContact CB-CD2 4.14Å; V184-Y223 HydrophobicContact CB-CE2 3.49Å; V184-Y223 VanDerWaalsContact CB-CE2 3.49Å; V184-Y223 HydrophobicContact CG1-CD2 4.19Å; V184-Y223 HydrophobicContact CG1-CE1 4.46Å; V184-Y223 HydrophobicContact CG1-CE2 3.49Å; V184-Y223 VanDerWaalsContact CG1-CE2 3.49Å; V184-Y223 HydrophobicContact CG2-CD2 3.82Å; V184-Y223 HydrophobicContact CG2-CE2 3.72Å
185V93.4Very high92.9Very high63 Ų6351.3 Ų51.338%0.38226%0.263SS..Hα-helixtrans-62.7-42.2175.2173.20000111.1Y181 M187 G188Y181-V185 HydrophobicContact CD1-CG2 4.36Å; Y181-V185 HydrophobicContact CD2-CG2 3.94Å; Y181-V185 HydrophobicContact CE1-CG2 4.05Å; Y181-V185 HydrophobicContact CE2-CG2 3.6Å; Y181-V185 HydrophobicContact CG-CG2 4.32Å; Y181-V185 WeakPolarHBondContact O-CB 3.45Å; Y181-V185 WeakPolarHBondContact O-CG2 3.15Å; Y181-V185 PolarHBondContact O-N 2.67Å; V185-M187 PolarHBondContact O-N 2.88Å; V185-G188 WeakPolarHBondContact O-CA 3.49Å; V185-G188 PolarHBondContact O-N 2.84Å
186Q93.9Very high93Very high146 Ų14655.1 Ų55.168%0.68228%0.282SS*.Hα-helixtrans-58.3-31.4173.4-174.5-176.648.800112.4R182 K183 V184 G188R182-Q186 VanDerWaalsContact O-CB 3.25Å; R182-Q186 WeakPolarHBondContact O-CB 3.45Å; R182-Q186 PolarHBondContact O-N 3.45Å; K183-Q186 PolarHBondContact O-N 3.04Å; V184-Q186 PolarHBondContact O-N 3.42Å; Q186-G188 VanDerWaalsContact C-N 3.27Å; Q186-G188 PolarHBondContact O-N 3.3Å
187M93.3Very high93Very high33 Ų3355.2 Ų55.216%0.16329%0.292CS..THydrogen-bonded Turntrans-83.60.4176.1-66.4174.772.200113.7K183 V184 V185 K192 V193 K198 Q201 V202K183-M187 HydrophobicContact CG-SD 4.39Å; K183-M187 VanDerWaalsContact O-CG 3.31Å; K183-M187 WeakPolarHBondContact O-CG 3.46Å; K183-M187 PolarHBondContact O-N 2.98Å; V184-M187 CarbonylContact O-C 3.56Å; V184-M187 WeakPolarHBondContact O-CA 3.38Å; V184-M187 WeakPolarHBondContact O-CB 3.42Å; V184-M187 PolarHBondContact O-N 3.17Å; V184-M187 VanDerWaalsContact O-N 3.07Å; V185-M187 PolarHBondContact O-N 2.88Å; M187-K192 WeakPolarHBondContact O-CD 3.3Å; M187-V193 HydrophobicContact CB-CG2 3.45Å; M187-V193 VanDerWaalsContact CB-CG2 3.45Å; M187-V193 HydrophobicContact CE-CG1 4.43Å; M187-V193 HydrophobicContact CE-CG2 4.14Å; M187-V193 HydrophobicContact CG-CG2 4.38Å; M187-V193 HydrophobicContact SD-CG2 4.14Å; M187-K198 HydrophobicContact CE-CB 3.52Å; M187-K198 HydrophobicContact CE-CD 3.95Å; M187-K198 HydrophobicContact CE-CG 4.4Å; M187-Q201 HydrophobicContact CE-CB 4.33Å; M187-V202 HydrophobicContact SD-CG2 3.95Å
188G92.4Very high92.9Very high46 Ų4658 Ų5847%0.47431%0.305SS..THydrogen-bonded Turntrans95.625.3178.900000114.8V184 V185 Q186 K192V184-G188 PolarHBondContact O-N 3.46Å; V185-G188 WeakPolarHBondContact O-CA 3.49Å; V185-G188 PolarHBondContact O-N 2.84Å; Q186-G188 VanDerWaalsContact C-N 3.27Å; Q186-G188 PolarHBondContact O-N 3.3Å; G188-K192 WeakPolarHBondContact O-CB 3.43Å
189G92.4Very high92.9Very high4 Ų457.9 Ų57.94%0.04130%0.304CS..  trans89.9172.4169.800000115V184 T191 K192 V193 E231V184-G189 PolarHBondContact O-N 3.45Å; G189-T191 PolarHBondContact O-N 3.4Å; G189-K192 PolarHBondContact O-N 3.09Å; G189-V193 WeakPolarHBondContact O-CG2 3.1Å; G189-V193 PolarHBondContact O-N 3.12Å; G189-E231 WeakPolarHBondContact CA-OE1 3.35Å
190W90.8Very high92.8Very high30 Ų3056 Ų5611%0.11430%0.304CS..Hα-helixtrans-51.8-51.9-175.3166.2-102.8000113.6K192 V193 S194 W199 R220 Y223 M224 E231W190-K192 VanDerWaalsContact C-N 3.27Å; W190-K192 PolarHBondContact O-N 3.07Å; W190-V193 PolarHBondContact O-N 3.12Å; W190-S194 VanDerWaalsContact O-CB 3.25Å; W190-S194 WeakPolarHBondContact O-CB 3.19Å; W190-S194 PolarHBondContact O-N 2.91Å; W190-W199 HydrophobicContact CD2-CZ2 4.25Å; W190-W199 AromaticContact CE3-CH2 3.39Å; W190-W199 HydrophobicContact CE3-CH2 3.39Å; W190-W199 AromaticContact CE3-CZ2 3.24Å; W190-W199 HydrophobicContact CE3-CZ2 3.24Å; W190-W199 HydrophobicContact CH2-CZ2 4.1Å; W190-W199 AromaticContact CZ3-CH2 3.34Å; W190-W199 HydrophobicContact CZ3-CH2 3.34Å; W190-W199 AromaticContact CZ3-CZ2 3.13Å; W190-W199 HydrophobicContact CZ3-CZ2 3.13Å; W190-W199 HydrophobicContact CZ3-CZ3 4.46Å; W190-R220 HydrophobicContact CH2-CB 4.24Å; W190-R220 HydrophobicContact CH2-CG 3.21Å; W190-R220 WeakPolarHBondContact CH2-O 3.39Å; W190-R220 HydrophobicContact CZ2-CG 4.15Å; W190-R220 HydrophobicContact CZ3-CB 4.34Å; W190-R220 HydrophobicContact CZ3-CG 3.67Å; W190-R220 WeakPolarHBondContact CZ3-O 3.49Å; W190-Y223 HydrophobicContact CB-CD1 4.13Å; W190-Y223 HydrophobicContact CB-CE1 3.57Å; W190-Y223 AromaticContact CD2-CD1 3.83Å; W190-Y223 HydrophobicContact CD2-CD1 3.83Å; W190-Y223 HydrophobicContact CD2-CE1 4.2Å; W190-Y223 AromaticContact CE3-CD1 3.14Å; W190-Y223 HydrophobicContact CE3-CD1 3.14Å; W190-Y223 AromaticContact CE3-CE1 3.84Å; W190-Y223 HydrophobicContact CE3-CE1 3.84Å; W190-Y223 AromaticContact CE3-CG 3.65Å; W190-Y223 HydrophobicContact CE3-CG 3.65Å; W190-Y223 HydrophobicContact CG-CD1 4.26Å; W190-Y223 HydrophobicContact CG-CE1 4.14Å; W190-Y223 AromaticContact CZ3-CD1 3.78Å; W190-Y223 HydrophobicContact CZ3-CD1 3.78Å; W190-Y223 AromaticContact CZ3-CG 3.98Å; W190-Y223 HydrophobicContact CZ3-CG 3.98Å; W190-M224 HydrophobicContact CH2-CB 3.6Å; W190-M224 HydrophobicContact CH2-CG 4.32Å; W190-M224 HydrophobicContact CZ2-CB 3.88Å; W190-M224 HydrophobicContact CZ2-CG 4.1Å; W190-M224 HydrophobicContact CZ2-SD 4.33Å; W190-M224 HydrophobicContact CZ3-CB 4.31Å; W190-E231 WeakPolarHBondContact CB-OE2 3.33Å; W190-E231 PolarHBondContact N-OE1 3Å
191T91.4Very high92.7Very high95 Ų9561.3 Ų61.358%0.58333%0.329SS*.Hα-helixtrans-60.7-40.3-173.4-55.20000111G189 S195G189-T191 PolarHBondContact O-N 3.4Å; T191-S195 WeakPolarHBondContact O-CB 3.41Å; T191-S195 PolarHBondContact O-N 3.41Å; T191-S195 PolarHBondContact O-OG 3.25Å
192K92.9Very high92.6Very high109 Ų10959.5 Ų59.547%0.47432%0.322SS..Hα-helixtrans-73.6-44.3-179.7-167.9172.2179.2-177.60112M187 G188 G189 W190 S194 S195 M196M187-K192 WeakPolarHBondContact O-CD 3.3Å; G188-K192 WeakPolarHBondContact O-CB 3.43Å; G189-K192 PolarHBondContact O-N 3.09Å; W190-K192 VanDerWaalsContact C-N 3.27Å; W190-K192 PolarHBondContact O-N 3.07Å; K192-S194 VanDerWaalsContact C-N 3.3Å; K192-S194 PolarHBondContact O-N 3.34Å; K192-S195 PolarHBondContact O-N 3.16Å; K192-S195 PolarHBondContact O-OG 3.17Å; K192-S195 VanDerWaalsContact O-OG 3.07Å; K192-M196 HydrophobicContact CG-CG 4.5Å; K192-M196 HydrophobicContact CG-SD 4.05Å; K192-M196 WeakPolarHBondContact O-CB 3.34Å; K192-M196 WeakPolarHBondContact O-CG 3.3Å; K192-M196 PolarHBondContact O-N 3.09Å
193V93.4Very high92.4Very high1 Ų154 Ų541%0.00630%0.302CS..Hα-helixtrans-63.4-40.2176.9177.50000111.1V184 M187 G189 W190 G197 K198 W199 V202V184-V193 HydrophobicContact CG1-CB 4.45Å; V184-V193 HydrophobicContact CG1-CG2 4Å; M187-V193 HydrophobicContact CB-CG2 3.45Å; M187-V193 VanDerWaalsContact CB-CG2 3.45Å; M187-V193 HydrophobicContact CE-CG1 4.43Å; M187-V193 HydrophobicContact CE-CG2 4.14Å; M187-V193 HydrophobicContact CG-CG2 4.38Å; M187-V193 HydrophobicContact SD-CG2 4.14Å; G189-V193 WeakPolarHBondContact O-CG2 3.1Å; G189-V193 PolarHBondContact O-N 3.12Å; W190-V193 PolarHBondContact O-N 3.12Å; V193-G197 PolarHBondContact O-N 3.21Å; V193-G197 VanDerWaalsContact O-N 3.14Å; V193-K198 PolarHBondContact O-N 2.96Å; V193-W199 HydrophobicContact CB-CZ2 4.36Å; V193-W199 HydrophobicContact CG1-CD2 3.94Å; V193-W199 HydrophobicContact CG1-CE3 4.33Å; V193-W199 HydrophobicContact CG1-CG 4.3Å; V193-W199 HydrophobicContact CG1-CH2 4.35Å; V193-W199 HydrophobicContact CG1-CZ2 3.97Å; V193-V202 HydrophobicContact CG1-CG2 4.34Å
194S91.7Very high92.2Very high25 Ų2555.8 Ų55.818%0.17532%0.319CS..Hα-helixtrans-70.9-38179.2-169.10000113.2W190 K192 G197 R220W190-S194 VanDerWaalsContact O-CB 3.25Å; W190-S194 WeakPolarHBondContact O-CB 3.19Å; W190-S194 PolarHBondContact O-N 2.91Å; K192-S194 VanDerWaalsContact C-N 3.3Å; K192-S194 PolarHBondContact O-N 3.34Å; S194-G197 PolarHBondContact O-N 3.3Å; S194-R220 VanDerWaalsContact OG-CZ 3.26Å; S194-R220 PolarHBondContact OG-NE 2.85Å; S194-R220 PolarHBondContact OG-NH2 3.37Å; S194-R220 VanDerWaalsContact OG-NH2 3.12Å
195S92Very high92Very high96 Ų9658.4 Ų58.467%0.67133%0.334SS*.Hα-helixtrans-70.9-35.4176.865.60000112.1T191 K192 G197T191-S195 WeakPolarHBondContact O-CB 3.41Å; T191-S195 PolarHBondContact O-N 3.41Å; T191-S195 PolarHBondContact O-OG 3.25Å; K192-S195 PolarHBondContact O-N 3.16Å; K192-S195 PolarHBondContact O-OG 3.17Å; K192-S195 VanDerWaalsContact O-OG 3.07Å; S195-G197 VanDerWaalsContact C-N 3.31Å; S195-G197 PolarHBondContact O-N 3.18Å
196M92.1Very high91.8Very high95 Ų9556.6 Ų56.647%0.46832%0.323SS..THydrogen-bonded Turntrans-80-9.5177.9-62.2-175.595.700113.9K192 K198K192-M196 HydrophobicContact CG-CG 4.5Å; K192-M196 HydrophobicContact CG-SD 4.05Å; K192-M196 WeakPolarHBondContact O-CB 3.34Å; K192-M196 WeakPolarHBondContact O-CG 3.3Å; K192-M196 PolarHBondContact O-N 3.09Å; M196-K198 HydrophobicContact CB-CB 4.49Å; M196-K198 HydrophobicContact CB-CD 3.91Å; M196-K198 HydrophobicContact CB-CG 3.78Å; M196-K198 HydrophobicContact CE-CD 4.29Å; M196-K198 VanDerWaalsContact CE-CE 3.45Å; M196-K198 PolarHBondContact O-N 3.09Å; M196-K198 HydrophobicContact SD-CD 3.96Å
197G90.7Very high91.4Very high44 Ų4451.5 Ų51.545%0.45431%0.309SS..THydrogen-bonded Turntrans63.626.3-176.600000114.1V193 S194 S195 W199V193-G197 PolarHBondContact O-N 3.21Å; V193-G197 VanDerWaalsContact O-N 3.14Å; S194-G197 PolarHBondContact O-N 3.3Å; S195-G197 VanDerWaalsContact C-N 3.31Å; S195-G197 PolarHBondContact O-N 3.18Å; G197-W199 VanDerWaalsContact C-N 3.3Å; G197-W199 PolarHBondContact O-N 3.47Å
198K91.7Very high91.1Very high69 Ų6950.4 Ų50.430%0.330%0.304SS..G310 helixtrans-89.718.7-172.8-68.1-179.4175.5-179.80114.5M187 V193 M196 N200 Q201M187-K198 HydrophobicContact CE-CB 3.52Å; M187-K198 HydrophobicContact CE-CD 3.95Å; M187-K198 HydrophobicContact CE-CG 4.4Å; V193-K198 PolarHBondContact O-N 2.96Å; M196-K198 HydrophobicContact CB-CB 4.49Å; M196-K198 HydrophobicContact CB-CD 3.91Å; M196-K198 HydrophobicContact CB-CG 3.78Å; M196-K198 HydrophobicContact CE-CD 4.29Å; M196-K198 VanDerWaalsContact CE-CE 3.45Å; M196-K198 PolarHBondContact O-N 3.09Å; M196-K198 HydrophobicContact SD-CD 3.96Å; K198-N200 PolarHBondContact O-N 3.18Å; K198-Q201 WeakPolarHBondContact O-CB 3.31Å; K198-Q201 PolarHBondContact O-N 3.45Å
199W92.6Very high90.5Very high8 Ų849.8 Ų49.83%0.0330%0.297CS..G310 helixtrans-57.2-30.7177.7-72.7103.8000112.9L180 V184 W190 V193 G197 Q201 V202 L203 D216 A219 R220 Y223L180-W199 HydrophobicContact CD1-CZ3 4.39Å; V184-W199 HydrophobicContact CG2-CH2 4.07Å; V184-W199 HydrophobicContact CG2-CZ3 3.98Å; W190-W199 HydrophobicContact CD2-CZ2 4.25Å; W190-W199 AromaticContact CE3-CH2 3.39Å; W190-W199 HydrophobicContact CE3-CH2 3.39Å; W190-W199 AromaticContact CE3-CZ2 3.24Å; W190-W199 HydrophobicContact CE3-CZ2 3.24Å; W190-W199 HydrophobicContact CH2-CZ2 4.1Å; W190-W199 AromaticContact CZ3-CH2 3.34Å; W190-W199 HydrophobicContact CZ3-CH2 3.34Å; W190-W199 AromaticContact CZ3-CZ2 3.13Å; W190-W199 HydrophobicContact CZ3-CZ2 3.13Å; W190-W199 HydrophobicContact CZ3-CZ3 4.46Å; V193-W199 HydrophobicContact CB-CZ2 4.36Å; V193-W199 HydrophobicContact CG1-CD2 3.94Å; V193-W199 HydrophobicContact CG1-CE3 4.33Å; V193-W199 HydrophobicContact CG1-CG 4.3Å; V193-W199 HydrophobicContact CG1-CH2 4.35Å; V193-W199 HydrophobicContact CG1-CZ2 3.97Å; G197-W199 VanDerWaalsContact C-N 3.3Å; G197-W199 PolarHBondContact O-N 3.47Å; W199-Q201 PolarHBondContact O-N 3.33Å; W199-V202 HydrophobicContact CE3-CG2 4.35Å; W199-V202 WeakPolarHBondContact O-CB 3.3Å; W199-V202 PolarHBondContact O-N 3.13Å; W199-L203 PolarHBondContact O-N 2.92Å; W199-D216 HydrophobicContact CB-CB 3.72Å; W199-A219 HydrophobicContact CE3-CB 4.05Å; W199-A219 HydrophobicContact CZ3-CB 4.47Å; W199-R220 HydrophobicContact CD2-CB 3.97Å; W199-R220 HydrophobicContact CE3-CB 4.41Å; W199-R220 HydrophobicContact CG-CB 4.35Å; W199-R220 HydrophobicContact CZ2-CB 4.28Å; W199-R220 HydrophobicContact CZ2-CG 4.13Å; W199-Y223 HydrophobicContact CH2-CD2 4.24Å; W199-Y223 AromaticContact CH2-CG 3.99Å; W199-Y223 HydrophobicContact CH2-CG 3.99Å
200N91.1Very high89.8Confident98 Ų9855.6 Ų55.652%0.52434%0.337SS..G310 helixtrans-58.1-27.8172.5-67.4-53.5000113.9K198 V202 P204K198-N200 PolarHBondContact O-N 3.18Å; N200-V202 VanDerWaalsContact C-N 3.31Å; N200-P204 VanDerWaalsContact O-CD 3.29Å; N200-P204 WeakPolarHBondContact O-CD 3.48Å
201Q91.7Very high89.1Confident110 Ų11060.4 Ų60.451%0.51437%0.365SS..G310 helixtrans-81.2-13.5176.4-58.5-176.114.400112.9M187 K198 W199M187-Q201 HydrophobicContact CE-CB 4.33Å; K198-Q201 WeakPolarHBondContact O-CB 3.31Å; K198-Q201 PolarHBondContact O-N 3.45Å; W199-Q201 PolarHBondContact O-N 3.33Å
202V93Very high88.5Confident0 Ų056.5 Ų56.50%034%0.341CS..THydrogen-bonded Turntrans-87.3-33.4178.6-175.40000110.6L180 K183 V184 M187 V193 W199 N200 P204 V205 L206L180-V202 HydrophobicContact CD1-CG1 3.59Å; K183-V202 HydrophobicContact CG-CG1 4.32Å; K183-V202 HydrophobicContact CG-CG2 4.41Å; V184-V202 HydrophobicContact CG2-CG1 4.42Å; V184-V202 HydrophobicContact CG2-CG2 4.35Å; M187-V202 HydrophobicContact SD-CG2 3.95Å; V193-V202 HydrophobicContact CG1-CG2 4.34Å; W199-V202 HydrophobicContact CE3-CG2 4.35Å; W199-V202 WeakPolarHBondContact O-CB 3.3Å; W199-V202 PolarHBondContact O-N 3.13Å; N200-V202 VanDerWaalsContact C-N 3.31Å; V202-P204 VanDerWaalsContact C-CD 3.49Å; V202-V205 WeakPolarHBondContact O-CB 3.32Å; V202-V205 PolarHBondContact O-N 3.31Å; V202-V205 VanDerWaalsContact O-N 3.08Å; V202-L206 HydrophobicContact CG1-CD1 4.39Å; V202-L206 HydrophobicContact CG1-CG 4.45Å; V202-L206 PolarHBondContact O-N 2.97Å
203L91.6Very high88Confident8 Ų858 Ų584%0.04235%0.354CS..G310 helixtrans-53.2-45-178.5-57.3179.3000114.5W199 V205 L206 G207 I208 G215 D216 A219W199-L203 PolarHBondContact O-N 2.92Å; L203-V205 PolarHBondContact O-N 3.4Å; L203-L206 PolarHBondContact O-N 2.86Å; L203-G207 PolarHBondContact O-N 3.21Å; L203-I208 CarbonylContact C-O 3.57Å; L203-I208 HydrophobicContact CB-CB 4.17Å; L203-I208 HydrophobicContact CD2-CB 4.37Å; L203-I208 HydrophobicContact CD2-CD1 4.07Å; L203-I208 HydrophobicContact CD2-CG2 4.34Å; L203-I208 PolarHBondContact O-N 2.98Å; L203-G215 VanDerWaalsContact CD2-C 3.45Å; L203-G215 VanDerWaalsContact CD2-O 3.3Å; L203-G215 WeakPolarHBondContact CD2-O 3.1Å; L203-D216 HydrophobicContact CD1-CB 4.35Å; L203-A219 HydrophobicContact CD2-CB 3.98Å
204P90.4Very high87.6Confident92 Ų9261.7 Ų61.760%0.59738%0.379SS*.G310 helixtrans-61-33.4179.7-2435.3000112.8N200 V202 L206 G207N200-P204 VanDerWaalsContact O-CD 3.29Å; N200-P204 WeakPolarHBondContact O-CD 3.48Å; V202-P204 VanDerWaalsContact C-CD 3.49Å; P204-L206 VanDerWaalsContact C-N 3.29Å; P204-L206 PolarHBondContact O-N 2.95Å; P204-G207 PolarHBondContact O-N 3.46Å; P204-G207 VanDerWaalsContact O-N 3.07Å
205V89.2Confident87.4Confident54 Ų5460.5 Ų60.533%0.32737%0.371SS..G310 helixtrans-69.9-30.4179.1-177.40000111.6K183 V202 L203 G207K183-V205 HydrophobicContact CB-CG1 4.34Å; K183-V205 HydrophobicContact CD-CG2 3.9Å; K183-V205 HydrophobicContact CG-CB 4.38Å; K183-V205 HydrophobicContact CG-CG1 4.46Å; K183-V205 HydrophobicContact CG-CG2 3.97Å; V202-V205 WeakPolarHBondContact O-CB 3.32Å; V202-V205 PolarHBondContact O-N 3.31Å; V202-V205 VanDerWaalsContact O-N 3.08Å; L203-V205 PolarHBondContact O-N 3.4Å; V205-G207 PolarHBondContact O-N 3.35Å
206L89.2Confident87.2Confident26 Ų2658.8 Ų58.814%0.13635%0.354CS..G310 helixtrans-81.6-2.1174.1-54.9-179.3000112.5I175 L180 V202 L203 P204 I208 A219I175-L206 HydrophobicContact CG2-CD1 4.29Å; I175-L206 HydrophobicContact CG2-CD2 4.31Å; L180-L206 HydrophobicContact CB-CD2 3.8Å; L180-L206 HydrophobicContact CD1-CD1 4.19Å; L180-L206 HydrophobicContact CD1-CD2 4.39Å; V202-L206 HydrophobicContact CG1-CD1 4.39Å; V202-L206 HydrophobicContact CG1-CG 4.45Å; V202-L206 PolarHBondContact O-N 2.97Å; L203-L206 PolarHBondContact O-N 2.86Å; P204-L206 VanDerWaalsContact C-N 3.29Å; P204-L206 PolarHBondContact O-N 2.95Å; L206-I208 HydrophobicContact CB-CD1 3.84Å; L206-I208 HydrophobicContact CB-CG1 3.9Å; L206-I208 HydrophobicContact CD1-CD1 3.87Å; L206-I208 PolarHBondContact O-N 3.45Å; L206-A219 HydrophobicContact CD1-CB 4.32Å
207G86.8Confident87.1Confident38 Ų3860.4 Ų60.439%0.39236%0.356SS..THydrogen-bonded Turntrans66.324.9-172.300000112.7R173 L203 P204 V205R173-G207 PolarHBondContact NH1-O 2.95Å; L203-G207 PolarHBondContact O-N 3.21Å; P204-G207 PolarHBondContact O-N 3.46Å; P204-G207 VanDerWaalsContact O-N 3.07Å; V205-G207 PolarHBondContact O-N 3.35Å
208I85.3Confident87.1Confident11 Ų1159.2 Ų59.26%0.05634%0.344CS..  trans-91121.1175.2-59170000107.3I170 I175 L203 L206 C212I170-I208 HydrophobicContact CB-CD1 4.11Å; I170-I208 HydrophobicContact CD1-CD1 3.52Å; I170-I208 HydrophobicContact CG1-CD1 4.37Å; I170-I208 HydrophobicContact CG2-CD1 4.24Å; I175-I208 HydrophobicContact CD1-CD1 3.86Å; I175-I208 HydrophobicContact CD1-CG1 4.44Å; L203-I208 CarbonylContact C-O 3.57Å; L203-I208 HydrophobicContact CB-CB 4.17Å; L203-I208 HydrophobicContact CD2-CB 4.37Å; L203-I208 HydrophobicContact CD2-CD1 4.07Å; L203-I208 HydrophobicContact CD2-CG2 4.34Å; L203-I208 PolarHBondContact O-N 2.98Å; L206-I208 HydrophobicContact CB-CD1 3.84Å; L206-I208 HydrophobicContact CB-CG1 3.9Å; L206-I208 HydrophobicContact CD1-CD1 3.87Å; L206-I208 PolarHBondContact O-N 3.45Å; I208-C212 HydrophobicContact CG2-CB 3.5Å; I208-C212 VanDerWaalsContact CG2-CB 3.5Å
209G81Confident87.1Confident32 Ų3256 Ų5633%0.3333%0.33SS..  trans-65.3151.6176.600000111.5N211 C212G209-N211 WeakPolarHBondContact CA-OD1 3.33Å; G209-N211 PolarHBondContact O-N 3.14Å; G209-N211 VanDerWaalsContact O-N 3.12Å; G209-N211 PolarHBondContact O-OD1 3.3Å; G209-C212 WeakPolarHBondContact O-CB 3.4Å; G209-C212 PolarHBondContact O-N 3.25Å
210S76.9Confident87.1Confident127 Ų12760.8 Ų60.889%0.88835%0.348SS*.THydrogen-bonded Turntrans-63.7-12.3174.254.50000113.4C212S210-C212 PolarHBondContact O-N 3.4Å
211N77.1Confident87.1Confident130 Ų13058.1 Ų58.170%0.69534%0.335SS*.THydrogen-bonded Turntrans-75-9.3172.665.2-29.5000113.4G209 L213G209-N211 WeakPolarHBondContact CA-OD1 3.33Å; G209-N211 PolarHBondContact O-N 3.14Å; G209-N211 VanDerWaalsContact O-N 3.12Å; G209-N211 PolarHBondContact O-OD1 3.3Å; N211-L213 PolarHBondContact O-N 2.86Å; N211-L213 VanDerWaalsContact O-N 3.09Å
212C78.5Confident87Confident13 Ų1353.3 Ų53.39%0.08831%0.313CS..SBendtrans-69.3106.4174.9-175.50000110.3N171 I208 G209 S210 C214 G215N171-C212 VanDerWaalsContact CG-SG 3.59Å; N171-C212 PolarHBondContact ND2-SG 2.66Å; N171-C212 PolarHBondContact OD1-SG 3.19Å; I208-C212 HydrophobicContact CG2-CB 3.5Å; I208-C212 VanDerWaalsContact CG2-CB 3.5Å; G209-C212 WeakPolarHBondContact O-CB 3.4Å; G209-C212 PolarHBondContact O-N 3.25Å; S210-C212 PolarHBondContact O-N 3.4Å; C212-C214 PolarHBondContact O-N 3.47Å; C212-G215 PolarHBondContact O-N 2.92Å; C212-G215 VanDerWaalsContact O-N 3.09Å; C212-G215 VanDerWaalsContact SG-CA 3.52Å
213L82.5Confident87.1Confident140 Ų14053.3 Ų53.373%0.73331%0.313SS*.THydrogen-bonded Turntrans-54.2123.9170.2-63174.9000109.3N211 G215N211-L213 PolarHBondContact O-N 2.86Å; N211-L213 VanDerWaalsContact O-N 3.09Å; L213-G215 PolarHBondContact O-N 2.9Å
214C84Confident87Confident79 Ų7956.1 Ų56.153%0.53433%0.326SS..THydrogen-bonded Turntrans57.326.8-179.7-52.50000114.7C212 D216 Y217 G218C212-C214 PolarHBondContact O-N 3.47Å; C214-D216 PolarHBondContact O-N 3.44Å; C214-Y217 PolarHBondContact O-N 3.34Å; C214-G218 PolarHBondContact O-N 2.96Å
215G87.5Confident86.8Confident1 Ų159.4 Ų59.41%0.0133%0.327CS..Hα-helixtrans-59-36.3179.100000112.8L203 C212 L213 G218 A219L203-G215 VanDerWaalsContact CD2-C 3.45Å; L203-G215 VanDerWaalsContact CD2-O 3.3Å; L203-G215 WeakPolarHBondContact CD2-O 3.1Å; C212-G215 PolarHBondContact O-N 2.92Å; C212-G215 VanDerWaalsContact O-N 3.09Å; C212-G215 VanDerWaalsContact SG-CA 3.52Å; L213-G215 PolarHBondContact O-N 2.9Å; G215-G218 PolarHBondContact O-N 3.27Å; G215-A219 WeakPolarHBondContact O-CB 3.48Å; G215-A219 PolarHBondContact O-N 2.66Å
216D89.4Confident86.8Confident59 Ų5957.6 Ų57.632%0.31631%0.314SS..Hα-helixtrans-63.1-44.217666.8-45.3000112.1W199 L203 C214 A219 R220W199-D216 HydrophobicContact CB-CB 3.72Å; L203-D216 HydrophobicContact CD1-CB 4.35Å; C214-D216 PolarHBondContact O-N 3.44Å; D216-A219 PolarHBondContact O-N 2.92Å; D216-R220 WeakPolarHBondContact O-CB 3.3Å; D216-R220 PolarHBondContact O-N 3.49Å
217Y89.7Confident87Confident130 Ų13056.3 Ų56.351%0.5131%0.308SS..Hα-helixtrans-63.9-44.4173.4-179.4-100000111.4C214 A219 R220 T221C214-Y217 PolarHBondContact O-N 3.34Å; Y217-A219 PolarHBondContact O-N 2.83Å; Y217-R220 WeakPolarHBondContact O-CB 3.46Å; Y217-R220 PolarHBondContact O-N 3.4Å; Y217-T221 PolarHBondContact O-N 2.85Å; Y217-T221 PolarHBondContact O-OG1 2.79Å; Y217-T221 VanDerWaalsContact O-OG1 3.13Å
218G90.2Very high87Confident19 Ų1955 Ų5520%0.19629%0.293CS..Hα-helixtrans-57.5-47.6175.900000112.5C214 G215 R220 T221 I222C214-G218 PolarHBondContact O-N 2.96Å; G215-G218 PolarHBondContact O-N 3.27Å; G218-R220 VanDerWaalsContact C-N 3.32Å; G218-R220 PolarHBondContact O-N 2.9Å; G218-T221 PolarHBondContact O-N 2.92Å; G218-I222 VanDerWaalsContact O-CG1 3.3Å; G218-I222 WeakPolarHBondContact O-CG1 3.16Å; G218-I222 PolarHBondContact O-N 3.19Å
219A92Very high87.1Confident1 Ų157.1 Ų57.11%0.00830%0.3CS..Hα-helixtrans-61.3-42.2176.800000111.6I170 W199 L203 L206 G215 D216 Y217 I222 Y223I170-A219 HydrophobicContact CD1-CB 4.41Å; W199-A219 HydrophobicContact CE3-CB 4.05Å; W199-A219 HydrophobicContact CZ3-CB 4.47Å; L203-A219 HydrophobicContact CD2-CB 3.98Å; L206-A219 HydrophobicContact CD1-CB 4.32Å; G215-A219 WeakPolarHBondContact O-CB 3.48Å; G215-A219 PolarHBondContact O-N 2.66Å; D216-A219 PolarHBondContact O-N 2.92Å; Y217-A219 PolarHBondContact O-N 2.83Å; A219-I222 PolarHBondContact O-N 2.91Å; A219-Y223 WeakPolarHBondContact O-CB 3.25Å; A219-Y223 PolarHBondContact O-N 2.91Å
220R92Very high87.6Confident109 Ų10956 Ų5641%0.41129%0.287SS..Hα-helixtrans-59.9-51.6175.6-176.1178.1-178.1-163.9-2111.3W190 S194 W199 D216 Y217 G218 I222 Y223 M224W190-R220 HydrophobicContact CH2-CB 4.24Å; W190-R220 HydrophobicContact CH2-CG 3.21Å; W190-R220 WeakPolarHBondContact CH2-O 3.39Å; W190-R220 HydrophobicContact CZ2-CG 4.15Å; W190-R220 HydrophobicContact CZ3-CB 4.34Å; W190-R220 HydrophobicContact CZ3-CG 3.67Å; W190-R220 WeakPolarHBondContact CZ3-O 3.49Å; S194-R220 VanDerWaalsContact OG-CZ 3.26Å; S194-R220 PolarHBondContact OG-NE 2.85Å; S194-R220 PolarHBondContact OG-NH2 3.37Å; S194-R220 VanDerWaalsContact OG-NH2 3.12Å; W199-R220 HydrophobicContact CD2-CB 3.97Å; W199-R220 HydrophobicContact CE3-CB 4.41Å; W199-R220 HydrophobicContact CG-CB 4.35Å; W199-R220 HydrophobicContact CZ2-CB 4.28Å; W199-R220 HydrophobicContact CZ2-CG 4.13Å; D216-R220 WeakPolarHBondContact O-CB 3.3Å; D216-R220 PolarHBondContact O-N 3.49Å; Y217-R220 WeakPolarHBondContact O-CB 3.46Å; Y217-R220 PolarHBondContact O-N 3.4Å; G218-R220 VanDerWaalsContact C-N 3.32Å; G218-R220 PolarHBondContact O-N 2.9Å; R220-I222 VanDerWaalsContact C-N 3.33Å; R220-I222 PolarHBondContact O-N 3.13Å; R220-Y223 PolarHBondContact O-N 3.49Å; R220-M224 WeakPolarHBondContact O-CB 3.28Å; R220-M224 PolarHBondContact O-N 2.77Å
221T90.2Very high88.3Confident41 Ų4150.9 Ų50.925%0.25225%0.248SC..Hα-helixtrans-60.9-41.6179.5-59.40000112.1Y217 G218 M224 R225Y217-T221 PolarHBondContact O-N 2.85Å; Y217-T221 PolarHBondContact O-OG1 2.79Å; Y217-T221 VanDerWaalsContact O-OG1 3.13Å; G218-T221 PolarHBondContact O-N 2.92Å; T221-M224 PolarHBondContact O-N 3.22Å; T221-R225 VanDerWaalsContact O-CB 3.31Å; T221-R225 WeakPolarHBondContact O-CB 3.4Å; T221-R225 PolarHBondContact O-N 3.35Å
222I91.4Very high88.7Confident10 Ų1047.6 Ų47.65%0.05123%0.229CC..Hα-helixtrans-63.8-48.4177.4-71.5167.6000110.6P168 I170 I175 L177 L180 G218 A219 R220 M224 R225 Y226P168-I222 HydrophobicContact CB-CB 4.45Å; P168-I222 HydrophobicContact CB-CD1 3.85Å; P168-I222 HydrophobicContact CB-CG1 3.82Å; P168-I222 HydrophobicContact CB-CG2 3.8Å; P168-I222 HydrophobicContact CG-CG2 3.65Å; I170-I222 HydrophobicContact CD1-CD1 3.6Å; I170-I222 HydrophobicContact CG1-CD1 3.41Å; I170-I222 VanDerWaalsContact CG1-CD1 3.41Å; I175-I222 HydrophobicContact CG1-CD1 3.87Å; L177-I222 HydrophobicContact CD2-CG2 3.83Å; L180-I222 HydrophobicContact CD2-CG2 4.06Å; G218-I222 VanDerWaalsContact O-CG1 3.3Å; G218-I222 WeakPolarHBondContact O-CG1 3.16Å; G218-I222 PolarHBondContact O-N 3.19Å; A219-I222 PolarHBondContact O-N 2.91Å; R220-I222 VanDerWaalsContact C-N 3.33Å; R220-I222 PolarHBondContact O-N 3.13Å; I222-M224 VanDerWaalsContact C-N 3.33Å; I222-M224 PolarHBondContact O-N 2.94Å; I222-R225 PolarHBondContact O-N 3.41Å; I222-Y226 HydrophobicContact CG2-CD2 4.12Å; I222-Y226 WeakPolarHBondContact O-CD2 3.31Å; I222-Y226 PolarHBondContact O-N 2.92Å
223Y93.5Very high89.1Confident0 Ų049.8 Ų49.80%024%0.237CC..Iπ-helixtrans-59.5-46.6178.5-169.9-69.7000111L180 V184 W190 W199 A219 R220 R225 Y226 L227 A228 E231L180-Y223 HydrophobicContact CD1-CD2 4.13Å; L180-Y223 HydrophobicContact CD2-CD2 4.27Å; L180-Y223 HydrophobicContact CG-CD2 3.89Å; V184-Y223 HydrophobicContact CB-CD2 4.14Å; V184-Y223 HydrophobicContact CB-CE2 3.49Å; V184-Y223 VanDerWaalsContact CB-CE2 3.49Å; V184-Y223 HydrophobicContact CG1-CD2 4.19Å; V184-Y223 HydrophobicContact CG1-CE1 4.46Å; V184-Y223 HydrophobicContact CG1-CE2 3.49Å; V184-Y223 VanDerWaalsContact CG1-CE2 3.49Å; V184-Y223 HydrophobicContact CG2-CD2 3.82Å; V184-Y223 HydrophobicContact CG2-CE2 3.72Å; W190-Y223 HydrophobicContact CB-CD1 4.13Å; W190-Y223 HydrophobicContact CB-CE1 3.57Å; W190-Y223 AromaticContact CD2-CD1 3.83Å; W190-Y223 HydrophobicContact CD2-CD1 3.83Å; W190-Y223 HydrophobicContact CD2-CE1 4.2Å; W190-Y223 AromaticContact CE3-CD1 3.14Å; W190-Y223 HydrophobicContact CE3-CD1 3.14Å; W190-Y223 AromaticContact CE3-CE1 3.84Å; W190-Y223 HydrophobicContact CE3-CE1 3.84Å; W190-Y223 AromaticContact CE3-CG 3.65Å; W190-Y223 HydrophobicContact CE3-CG 3.65Å; W190-Y223 HydrophobicContact CG-CD1 4.26Å; W190-Y223 HydrophobicContact CG-CE1 4.14Å; W190-Y223 AromaticContact CZ3-CD1 3.78Å; W190-Y223 HydrophobicContact CZ3-CD1 3.78Å; W190-Y223 AromaticContact CZ3-CG 3.98Å; W190-Y223 HydrophobicContact CZ3-CG 3.98Å; W199-Y223 HydrophobicContact CH2-CD2 4.24Å; W199-Y223 AromaticContact CH2-CG 3.99Å; W199-Y223 HydrophobicContact CH2-CG 3.99Å; A219-Y223 WeakPolarHBondContact O-CB 3.25Å; A219-Y223 PolarHBondContact O-N 2.91Å; R220-Y223 PolarHBondContact O-N 3.49Å; Y223-R225 VanDerWaalsContact C-N 3.32Å; Y223-R225 PolarHBondContact O-N 2.81Å; Y223-Y226 PolarHBondContact O-N 3.11Å; Y223-L227 HydrophobicContact CD1-CB 4.01Å; Y223-L227 HydrophobicContact CD2-CB 4.09Å; Y223-L227 HydrophobicContact CD2-CD1 3.67Å; Y223-L227 HydrophobicContact CE1-CB 3.95Å; Y223-L227 HydrophobicContact CE2-CB 4.04Å; Y223-L227 HydrophobicContact CE2-CD1 3.86Å; Y223-L227 HydrophobicContact CG-CB 4.08Å; Y223-L227 HydrophobicContact CG-CD1 4.27Å; Y223-L227 CarbonylContact O-C 3.55Å; Y223-L227 WeakPolarHBondContact O-CA 3.34Å; Y223-L227 WeakPolarHBondContact O-CB 3.48Å; Y223-L227 PolarHBondContact O-N 2.89Å; Y223-A228 HydrophobicContact CD1-CB 4.36Å; Y223-A228 HydrophobicContact CE1-CB 4.38Å; Y223-A228 PolarHBondContact O-N 3.42Å; Y223-E231 VanDerWaalsContact CE1-OE2 3.3Å; Y223-E231 WeakPolarHBondContact CE1-OE2 3.36Å; Y223-E231 PolarHBondContact OH-OE2 3.03Å
224M89.5Confident89.3Confident66 Ų6647.4 Ų47.433%0.32522%0.222SC..Iπ-helixtrans-57.3-46.6177.7-169.8176.969.200111.9W190 R220 T221 I222W190-M224 HydrophobicContact CH2-CB 3.6Å; W190-M224 HydrophobicContact CH2-CG 4.32Å; W190-M224 HydrophobicContact CZ2-CB 3.88Å; W190-M224 HydrophobicContact CZ2-CG 4.1Å; W190-M224 HydrophobicContact CZ2-SD 4.33Å; W190-M224 HydrophobicContact CZ3-CB 4.31Å; R220-M224 WeakPolarHBondContact O-CB 3.28Å; R220-M224 PolarHBondContact O-N 2.77Å; T221-M224 PolarHBondContact O-N 3.22Å; I222-M224 VanDerWaalsContact C-N 3.33Å; I222-M224 PolarHBondContact O-N 2.94Å
225R87.4Confident89.2Confident161 Ų16149.5 Ų49.561%0.60823%0.227SC*.Iπ-helixtrans-68.5-44.8-176.2-173.8172.5-176.3-179.51.8111.6R160 T221 I222 Y223R160-R225 VanDerWaalsContact CZ-O 3.31Å; R160-R225 PolarHBondContact NH1-O 2.96Å; R160-R225 PolarHBondContact NH2-O 3.4Å; T221-R225 VanDerWaalsContact O-CB 3.31Å; T221-R225 WeakPolarHBondContact O-CB 3.4Å; T221-R225 PolarHBondContact O-N 3.35Å; I222-R225 PolarHBondContact O-N 3.41Å; Y223-R225 VanDerWaalsContact C-N 3.32Å; Y223-R225 PolarHBondContact O-N 2.81Å
226Y89.5Confident88.7Confident16 Ų1657 Ų576%0.06326%0.26CS..Iπ-helixtrans-101.3-37.3-169.6-67.6-92.1000114.1L157 V166 P168 L177 I222 Y223L157-Y226 HydrophobicContact CD1-CD1 3.77Å; L157-Y226 HydrophobicContact CD1-CE1 4.47Å; L157-Y226 HydrophobicContact CD2-CD1 4.01Å; V166-Y226 VanDerWaalsContact O-CE1 3.3Å; V166-Y226 WeakPolarHBondContact O-CE1 3.45Å; V166-Y226 VanDerWaalsContact O-CZ 3.31Å; V166-Y226 PolarHBondContact O-OH 3.37Å; P168-Y226 HydrophobicContact CB-CD2 4.35Å; P168-Y226 HydrophobicContact CB-CE2 3.81Å; P168-Y226 HydrophobicContact CG-CD2 4.1Å; P168-Y226 HydrophobicContact CG-CE2 3.94Å; L177-Y226 HydrophobicContact CD1-CD1 4.42Å; L177-Y226 HydrophobicContact CD1-CG 4.46Å; I222-Y226 HydrophobicContact CG2-CD2 4.12Å; I222-Y226 WeakPolarHBondContact O-CD2 3.31Å; I222-Y226 PolarHBondContact O-N 2.92Å; Y223-Y226 PolarHBondContact O-N 3.11Å
227L92.2Very high87.7Confident0 Ų057.1 Ų57.10%028%0.275CS..Iπ-helixtrans-110.8-30.1-164.6-65.1172.3000114.2F149 L153 L177 L180 Y181 Y223 R229 Y230 E231F149-L227 HydrophobicContact CZ-CD2 3.86Å; L153-L227 HydrophobicContact CD1-CD2 4.06Å; L153-L227 HydrophobicContact CD2-CD2 3.8Å; L177-L227 HydrophobicContact CB-CD2 4.48Å; L177-L227 HydrophobicContact CD2-CD1 4.26Å; L177-L227 HydrophobicContact CD2-CG 4.49Å; L180-L227 HydrophobicContact CB-CD1 4.32Å; L180-L227 HydrophobicContact CD2-CD1 3.93Å; L180-L227 HydrophobicContact CG-CD1 3.91Å; Y181-L227 HydrophobicContact CD2-CD2 4.45Å; Y223-L227 HydrophobicContact CD1-CB 4.01Å; Y223-L227 HydrophobicContact CD2-CB 4.09Å; Y223-L227 HydrophobicContact CD2-CD1 3.67Å; Y223-L227 HydrophobicContact CE1-CB 3.95Å; Y223-L227 HydrophobicContact CE2-CB 4.04Å; Y223-L227 HydrophobicContact CE2-CD1 3.86Å; Y223-L227 HydrophobicContact CG-CB 4.08Å; Y223-L227 HydrophobicContact CG-CD1 4.27Å; Y223-L227 CarbonylContact O-C 3.55Å; Y223-L227 WeakPolarHBondContact O-CA 3.34Å; Y223-L227 WeakPolarHBondContact O-CB 3.48Å; Y223-L227 PolarHBondContact O-N 2.89Å; L227-R229 VanDerWaalsContact C-N 3.31Å; L227-R229 PolarHBondContact O-N 3.23Å; L227-Y230 CarbonylContact O-C 3.46Å; L227-Y230 WeakPolarHBondContact O-CA 3.46Å; L227-Y230 WeakPolarHBondContact O-CB 2.92Å; L227-Y230 PolarHBondContact O-N 3.09Å; L227-E231 PolarHBondContact O-N 3.38Å
228A88Confident85.8Confident10 Ų1054.6 Ų54.68%0.08328%0.277CS..Hα-helixtrans-57.9-39.6-172.500000113.9Y223 Q232Y223-A228 HydrophobicContact CD1-CB 4.36Å; Y223-A228 HydrophobicContact CE1-CB 4.38Å; Y223-A228 PolarHBondContact O-N 3.42Å; A228-Q232 WeakPolarHBondContact O-CG 3.46Å; A228-Q232 PolarHBondContact O-N 2.68Å
229R87.1Confident84Confident55 Ų5561.6 Ų61.621%0.20830%0.304CS..Hα-helixtrans-75.5-33.8174.7-68.4-62.1-171.1-1782113F156 L227 Q232 K233 N262 F265F156-R229 HydrophobicContact CE1-CB 4.12Å; F156-R229 HydrophobicContact CZ-CB 3.59Å; L227-R229 VanDerWaalsContact C-N 3.31Å; L227-R229 PolarHBondContact O-N 3.23Å; R229-Q232 VanDerWaalsContact CD-OE1 3.29Å; R229-Q232 PolarHBondContact O-N 3.08Å; R229-K233 PolarHBondContact O-N 3Å; R229-N262 PolarHBondContact NH1-OD1 3.32Å; R229-N262 PolarHBondContact NH2-ND2 3.15Å; R229-N262 VanDerWaalsContact NH2-ND2 3.17Å; R229-N262 PolarHBondContact NH2-OD1 3.32Å; R229-F265 HydrophobicContact CG-CE2 4.14Å; R229-F265 HydrophobicContact CG-CZ 3.93Å; R229-F265 VanDerWaalsContact CZ-CE2 3.47Å; R229-F265 VanDerWaalsContact NH2-CE2 3.3Å
230Y91Very high81.9Confident10 Ų1065.1 Ų65.14%0.03933%0.329CS..Hα-helixtrans-63.7-44.6174.6178.2-93.7000110.7F149 Q152 L153 F156 Y181 L227 Q232 K233 Q234F149-Y230 AromaticContact CD2-CE1 3.98Å; F149-Y230 HydrophobicContact CD2-CE1 3.98Å; F149-Y230 HydrophobicContact CE2-CD1 4.17Å; F149-Y230 AromaticContact CE2-CE1 3.45Å; F149-Y230 HydrophobicContact CE2-CE1 3.45Å; F149-Y230 VanDerWaalsContact CE2-CE1 3.45Å; F149-Y230 HydrophobicContact CZ-CE1 4.3Å; Q152-Y230 HydrophobicContact CB-CE2 4.23Å; Q152-Y230 PolarHBondContact OE1-OH 3.49Å; Q152-Y230 VanDerWaalsContact OE1-OH 3.09Å; L153-Y230 HydrophobicContact CD1-CD1 4.46Å; L153-Y230 HydrophobicContact CD1-CD2 3.95Å; L153-Y230 HydrophobicContact CD1-CG 3.88Å; F156-Y230 HydrophobicContact CB-CD2 4.17Å; F156-Y230 HydrophobicContact CD1-CD2 4.18Å; F156-Y230 HydrophobicContact CG-CD2 4.08Å; Y181-Y230 HydrophobicContact CE2-CD1 4.24Å; Y181-Y230 HydrophobicContact CE2-CE1 4.43Å; L227-Y230 CarbonylContact O-C 3.46Å; L227-Y230 WeakPolarHBondContact O-CA 3.46Å; L227-Y230 WeakPolarHBondContact O-CB 2.92Å; L227-Y230 PolarHBondContact O-N 3.09Å; Y230-Q232 VanDerWaalsContact C-N 3.34Å; Y230-Q232 PolarHBondContact O-N 3.07Å; Y230-K233 WeakPolarHBondContact O-CB 3.29Å; Y230-K233 PolarHBondContact O-N 3.49Å; Y230-K233 VanDerWaalsContact O-N 3.15Å; Y230-Q234 HydrophobicContact CD1-CG 4.08Å; Y230-Q234 HydrophobicContact CE1-CG 3.67Å; Y230-Q234 HydrophobicContact CE2-CG 4.43Å; Y230-Q234 VanDerWaalsContact CZ-NE2 3.29Å; Y230-Q234 WeakPolarHBondContact O-CG 3.49Å; Y230-Q234 PolarHBondContact O-N 2.78Å; Y230-Q234 PolarHBondContact OH-NE2 3.09Å
231E91.2Very high80Confident19 Ų1964.6 Ų64.69%0.08933%0.334CS..Hα-helixtrans-56.8-45174.2-178.1-177.5-167.200111.7Y181 G189 W190 Y223 L227 Q234 L235Y181-E231 HydrophobicContact CE2-CB 4.13Å; Y181-E231 HydrophobicContact CE2-CG 4.39Å; G189-E231 WeakPolarHBondContact CA-OE1 3.35Å; W190-E231 WeakPolarHBondContact CB-OE2 3.33Å; W190-E231 PolarHBondContact N-OE1 3Å; Y223-E231 VanDerWaalsContact CE1-OE2 3.3Å; Y223-E231 WeakPolarHBondContact CE1-OE2 3.36Å; Y223-E231 PolarHBondContact OH-OE2 3.03Å; L227-E231 PolarHBondContact O-N 3.38Å; E231-Q234 PolarHBondContact O-N 3.23Å; E231-L235 HydrophobicContact CG-CD1 3.89Å; E231-L235 WeakPolarHBondContact O-CB 3.22Å; E231-L235 WeakPolarHBondContact O-CG 3.17Å; E231-L235 PolarHBondContact O-N 3.23Å
232Q86.8Confident78.2Confident61 Ų6169.3 Ų69.329%0.28536%0.358SS..Hα-helixtrans-61.3-44.8175.3-71.8176.1-10.700112A228 R229 Y230 Q234 L235 F236A228-Q232 WeakPolarHBondContact O-CG 3.46Å; A228-Q232 PolarHBondContact O-N 2.68Å; R229-Q232 VanDerWaalsContact CD-OE1 3.29Å; R229-Q232 PolarHBondContact O-N 3.08Å; Y230-Q232 VanDerWaalsContact C-N 3.34Å; Y230-Q232 PolarHBondContact O-N 3.07Å; Q232-Q234 VanDerWaalsContact C-N 3.27Å; Q232-Q234 PolarHBondContact O-N 3.41Å; Q232-L235 PolarHBondContact O-N 3.05Å; Q232-F236 HydrophobicContact CB-CD2 4.11Å; Q232-F236 HydrophobicContact CB-CE2 4.34Å; Q232-F236 HydrophobicContact CG-CE2 4.26Å; Q232-F236 WeakPolarHBondContact O-CD2 3.33Å; Q232-F236 PolarHBondContact O-N 3.02Å
233K86.6Confident76.3Confident59 Ų5975.8 Ų75.826%0.25739%0.393SS..Hα-helixtrans-59.1-40.3176.4-175.2166.1-173.8156.40111.6F156 R229 Y230 G237 D241F156-K233 HydrophobicContact CD2-CD 4.09Å; F156-K233 HydrophobicContact CE2-CD 4.21Å; R229-K233 PolarHBondContact O-N 3Å; Y230-K233 WeakPolarHBondContact O-CB 3.29Å; Y230-K233 PolarHBondContact O-N 3.49Å; Y230-K233 VanDerWaalsContact O-N 3.15Å; K233-G237 PolarHBondContact O-N 3.18Å; K233-D241 VanDerWaalsContact NZ-CG 3.33Å; K233-D241 IonicContact NZ-OD1 2.75Å; K233-D241 PolarHBondContact NZ-OD1 2.88Å; K233-D241 IonicContact NZ-OD2 3.04Å; K233-D241 PolarHBondContact NZ-OD2 3Å
234Q85.1Confident74.3Confident90 Ų9082 Ų8242%0.42143%0.426SS..Hα-helixtrans-69.6-36.9177.5-65.2-62.6-31.600113Y230 E231 Q232Y230-Q234 HydrophobicContact CD1-CG 4.08Å; Y230-Q234 HydrophobicContact CE1-CG 3.67Å; Y230-Q234 HydrophobicContact CE2-CG 4.43Å; Y230-Q234 VanDerWaalsContact CZ-NE2 3.29Å; Y230-Q234 WeakPolarHBondContact O-CG 3.49Å; Y230-Q234 PolarHBondContact O-N 2.78Å; Y230-Q234 PolarHBondContact OH-NE2 3.09Å; E231-Q234 PolarHBondContact O-N 3.23Å; Q232-Q234 VanDerWaalsContact C-N 3.27Å; Q232-Q234 PolarHBondContact O-N 3.41Å
235L82.1Confident72.3Confident122 Ų12288.4 Ų88.464%0.63946%0.455SS*.Hα-helixtrans-77.7-43.4-178.7-73.7168.6000113.4E231 Q232E231-L235 HydrophobicContact CG-CD1 3.89Å; E231-L235 WeakPolarHBondContact O-CB 3.22Å; E231-L235 WeakPolarHBondContact O-CG 3.17Å; E231-L235 PolarHBondContact O-N 3.23Å; Q232-L235 PolarHBondContact O-N 3.05Å
236F77.4Confident70.1Confident158 Ų15889.8 Ų89.869%0.69347%0.466SS*.Hα-helixtrans-91.9-7.4-172.5-64-67.9000113.3Q232 S238Q232-F236 HydrophobicContact CB-CD2 4.11Å; Q232-F236 HydrophobicContact CB-CE2 4.34Å; Q232-F236 HydrophobicContact CG-CE2 4.26Å; Q232-F236 WeakPolarHBondContact O-CD2 3.33Å; Q232-F236 PolarHBondContact O-N 3.02Å; F236-S238 PolarHBondContact O-N 2.81Å
237G68Low67.8Low63 Ų6394 Ų9465%0.64950%0.498SS*.  trans58.27171.600000115.6K233K233-G237 PolarHBondContact O-N 3.18Å
238S50.9Low65.6Low77 Ų7799.8 Ų99.854%0.53854%0.538SS..  trans-103.2114.6-169.6-175.40000110.2F236 S240F236-S238 PolarHBondContact O-N 2.81Å; S238-S240 PolarHBondContact O-N 3.32Å; S238-S240 VanDerWaalsContact O-N 3.13Å
239E51.9Low63.2Low165 Ų165102.4 Ų102.477%0.77157%0.566SS**  trans-7129.6176.562.7-166.9102.300114.9D241E239-D241 PolarHBondContact O-N 2.96Å
240S47.1Very low61.1Low76 Ų76107 Ų10753%0.53160%0.6SS.*  trans-72.772170.156.80000109.5S238 D242S238-S240 PolarHBondContact O-N 3.32Å; S238-S240 VanDerWaalsContact O-N 3.13Å; S240-D242 PolarHBondContact O-N 2.72Å; S240-D242 VanDerWaalsContact O-N 3.14Å
241D53.3Low58.3Low97 Ų97110.5 Ų110.552%0.51964%0.64SS.*  trans-75.633.5170.3-79.3-34000110.3K233 E239K233-D241 VanDerWaalsContact NZ-CG 3.33Å; K233-D241 IonicContact NZ-OD1 2.75Å; K233-D241 PolarHBondContact NZ-OD1 2.88Å; K233-D241 IonicContact NZ-OD2 3.04Å; K233-D241 PolarHBondContact NZ-OD2 3Å; E239-D241 PolarHBondContact O-N 2.96Å
242D52.7Low55.9Low140 Ų140113.4 Ų113.475%0.74968%0.675SS**  trans-120.25.1-166.2-72.3-48.2000117.2S240S240-D242 PolarHBondContact O-N 2.72Å; S240-D242 VanDerWaalsContact O-N 3.14Å
243D51.4Low53.5Low146 Ų146116.8 Ų116.878%0.78170%0.699SS**  trans-114.435.2-175.5-65.5-50.3000115.7E245D243-E245 PolarHBondContact O-N 3.48Å
244D51.3Low51.5Low132 Ų132125.3 Ų125.371%0.70673%0.73SS**  trans-9560.9164.1-73.5-56.1000110.8F246D244-F246 PolarHBondContact O-N 2.91Å
245E46.4Very low49.7Very low199 Ų199126.2 Ų126.293%0.9375%0.746SS**  trans-73.369164.6-168.5174.79100109.7D243D243-E245 PolarHBondContact O-N 3.48Å
246F42.6Very low47.9Very low190 Ų190126.4 Ų126.483%0.83376%0.757SS**  trans-141.659.5165.2-164.9-102.9000109.3D244D244-F246 PolarHBondContact O-N 2.91Å
247S41.7Very low46.4Very low105 Ų105130.3 Ų130.373%0.73477%0.768SS**  trans-157.5129.4161.5-89.30000109.9
248S45.5Very low45.4Very low121 Ų121130.6 Ų130.685%0.84677%0.771SS**  trans80.799.1-173.6-45.80000112.2
249G36.8Very low45.2Very low65 Ų65139.3 Ų139.367%0.6779%0.792SS**  62.4109.163.100000108.6
250T43.1Very low45Very low151 Ų151136.6 Ų136.693%0.92679%0.791SS**  trans97.297.7171.4-19.10000117.1
251G33.4Very low45.2Very low84 Ų84138.2 Ų138.287%0.86680%0.802SS**  trans43.2105.9143.900000120.5
252G39.6Very low44.9Very low80 Ų80136.9 Ų136.983%0.82580%0.795SS**  trans-164.487.4169.600000113.3
253V37.5Very low45Very low132 Ų132138.3 Ų138.380%0.880%0.797SS**  trans-62.4141.6169.3-101.70000111.4
254R44.6Very low45Very low239 Ų239138.4 Ų138.490%0.90279%0.788SS**  trans106.2106.4156.1-58.1146.6176.1-126.3-3.9117.1
255S45.7Very low44.8Very low109 Ų109137.2 Ų137.276%0.76278%0.776SS**  172.8118.7108.1-171.70000112.1R257S255-R257 PolarHBondContact O-N 3.34Å
256S45.1Very low44.6Very low125 Ų125131.5 Ų131.587%0.87476%0.758SS**  trans-8850.1-170.7-43.50000113.7
257R46.6Very low44.9Very low240 Ų240126.6 Ų126.691%0.90675%0.753SS**  trans-155.284.8-178.7-95.6159.2-164.7170.43.2111.3S255S255-R257 PolarHBondContact O-N 3.34Å
258G45.3Very low45Very low70 Ų70128 Ų12872%0.72275%0.752SS**  trans-162.995.2173.100000110.7S260G258-S260 VanDerWaalsContact C-N 3.32Å; G258-S260 PolarHBondContact O-N 3.16Å
259R46.9Very low44.8Very low260 Ų260132.8 Ų132.898%0.98175%0.752SS**  trans-63.892.3171.8-81.1175.3166.4173.4-4.9108.3S261R259-S261 PolarHBondContact O-N 2.88Å
260S47.8Very low44.9Very low108 Ų108137.5 Ų137.576%0.75576%0.761SS**  trans-78.8113.3-175.4-164.30000111.2G258 N262G258-S260 VanDerWaalsContact C-N 3.32Å; G258-S260 PolarHBondContact O-N 3.16Å; S260-N262 PolarHBondContact O-N 3.28Å
261S52.1Low44.9Very low109 Ų109135.8 Ų135.876%0.76275%0.752SS**  trans-7137.6-173.7179.90000114.7R259R259-S261 PolarHBondContact O-N 2.88Å
262N46.3Very low45.2Very low70 Ų70138.5 Ų138.537%0.37475%0.747SS.*  trans-128.454.5-174.9-92.6-21.7000113R229 S260 Y264R229-N262 PolarHBondContact NH1-OD1 3.32Å; R229-N262 PolarHBondContact NH2-ND2 3.15Å; R229-N262 VanDerWaalsContact NH2-ND2 3.17Å; R229-N262 PolarHBondContact NH2-OD1 3.32Å; S260-N262 PolarHBondContact O-N 3.28Å; N262-Y264 PolarHBondContact O-N 3.34Å; N262-Y264 VanDerWaalsContact O-N 3.12Å
263H55.1Low45.3Very low169 Ų169141.3 Ų141.378%0.78275%0.748SS**THydrogen-bonded Turntrans-67.4-6.9173-148-64.3000113.5
264Y51.2Low45.2Very low148 Ų148139 Ų13958%0.5874%0.738SS**THydrogen-bonded Turntrans-83.2-16.4-178.2-56.4-81000114.3N262N262-Y264 PolarHBondContact O-N 3.34Å; N262-Y264 VanDerWaalsContact O-N 3.12Å
265F46.8Very low45.2Very low108 Ų108137.8 Ų137.847%0.47474%0.739SS.*THydrogen-bonded Turntrans-111.6-12.6-176.4-85.7-96.4000114.5R229R229-F265 HydrophobicContact CG-CE2 4.14Å; R229-F265 HydrophobicContact CG-CZ 3.93Å; R229-F265 VanDerWaalsContact CZ-CE2 3.47Å; R229-F265 VanDerWaalsContact NH2-CE2 3.3Å
266S42.9Very low44.6Very low78 Ų78136 Ų13655%0.54574%0.738SS.*G310 helixtrans-87.9-5-176.5-69.50000115.1N268 R269S266-N268 PolarHBondContact O-N 3.36Å; S266-N268 VanDerWaalsContact O-N 3.09Å; S266-R269 PolarHBondContact O-N 3.14Å
267A48Very low44.1Very low87 Ų87135.6 Ų135.672%0.71974%0.735SS**G310 helixtrans-72.5-0.1-17500000115.2
268N44Very low43.7Very low136 Ų136128.9 Ų128.973%0.72773%0.725SS**G310 helixtrans-11410.8178.5-75.739.8000114.2S266 L270S266-N268 PolarHBondContact O-N 3.36Å; S266-N268 VanDerWaalsContact O-N 3.09Å; N268-L270 PolarHBondContact O-N 3.07Å
269R42.2Very low43.6Very low221 Ų221132.9 Ų132.983%0.83473%0.729SS**  trans-8598.5167.9-78.7-172.7-160-118.71.8109.6S266S266-R269 PolarHBondContact O-N 3.14Å
270L39.1Very low43.7Very low163 Ų163127.8 Ų127.885%0.85372%0.72SS**  trans-51.2133.2161.8-82.6156.3000109.4N268 D272N268-L270 PolarHBondContact O-N 3.07Å; L270-D272 PolarHBondContact O-N 3.39Å
271P43.6Very low43.1Very low115 Ų115130.2 Ų130.275%0.74773%0.725SS**  trans-66.8122.5172.326.1-30.4000109.3V273P271-V273 PolarHBondContact O-N 3.27Å; P271-V273 VanDerWaalsContact O-N 3.14Å
272D39.9Very low42.4Very low141 Ų141128.9 Ų128.975%0.75472%0.72SS**  trans-67.1107.1173-17292.8000109.1L270 S274L270-D272 PolarHBondContact O-N 3.39Å; D272-S274 VanDerWaalsContact C-N 3.34Å; D272-S274 PolarHBondContact O-N 3.31Å; D272-S274 PolarHBondContact OD2-N 2.86Å
273V40.7Very low41.8Very low140 Ų140136.3 Ų136.385%0.84874%0.743SS**  trans-92.863.4176.467.90000109.3P271P271-V273 PolarHBondContact O-N 3.27Å; P271-V273 VanDerWaalsContact O-N 3.14Å
274S35.7Very low40.7Very low84 Ų84137 Ų13759%0.58775%0.747SS**  trans-156.976.5178.3-77.50000113D272D272-S274 VanDerWaalsContact C-N 3.34Å; D272-S274 PolarHBondContact O-N 3.31Å; D272-S274 PolarHBondContact OD2-N 2.86Å
275K44.4Very low40.1Very low213 Ų213136 Ų13693%0.92676%0.761SS**  trans-176.6124.6146-103.4151.1-174.51750113.9
276G33.5Very low39.6Very low72 Ų72133.3 Ų133.374%0.74276%0.764SS**  trans63.696.3151.700000115.9
277S34.1Very low39.4Very low115 Ų115141.9 Ų141.980%0.80478%0.784SS**  45.5122.364.3-161.90000114.2
278S38.3Very low39.1Very low100 Ų100140.9 Ų140.970%0.69978%0.782SS**  trans61.991.1168.358.70000116.6
279D43.3Very low39.2Very low153 Ų153140.7 Ų140.782%0.81879%0.787SS**  trans-158.5107.4132.8-94.7-32.2000111.9
280I48.9Very low39.4Very low153 Ų153137.2 Ų137.279%0.78578%0.784SS**  trans59.192.9139.861.5159.4000121.4
281N34.4Very low39.7Very low160 Ų160136.8 Ų136.886%0.85678%0.781SS**  -7.7119.2127.1-167.910.4000116.2
282A38Very low39.7Very low81 Ų81139.6 Ų139.667%0.66979%0.789SS**  trans175.8109.4136.100000113.2
283R34.4Very low39.7Very low225 Ų225136 Ų13685%0.84979%0.785SS**  58.1114.4127.4-70.1161.172.5150.9-0119.5
284E32.2Very low39.9Very low185 Ų185138.8 Ų138.886%0.86479%0.789SS**  3.3119.1129.4-61.6-174.4120.900115.8
285S38Very low40.3Very low126 Ų126143 Ų14388%0.88180%0.799SS**  167.8132.3126.836.20000110.7
286G36.9Very low40.5Very low51 Ų51138.4 Ų138.453%0.52679%0.791SS.*  trans128.7106.8138.200000118.4
287W38.7Very low40.8Very low258 Ų258142.1 Ų142.198%0.97779%0.793SS**  trans74.1108.9138.2-39.4102.3000116
288G41.1Very low41.7Very low66 Ų66143.6 Ų143.668%0.6880%0.797SS**  cis90.891.832.700000111.2
289T45.4Very low41.7Very low133 Ų133147.2 Ų147.282%0.81680%0.803SS**  trans61.9129.5140.9-47.90000121.5
290L46.3Very low41.9Very low148 Ų148146.3 Ų146.378%0.77581%0.807SS**  trans154.4129.4138.3-82.9160.2000106.7
291L45.6Very low41.6Very low153 Ų153146.8 Ų146.880%0.80181%0.806SS**  cis-162.3150.529.7-102.7146.4000111
292L44.8Very low42.2Very low174 Ų174151.6 Ų151.691%0.91183%0.826SS**  trans-54.7155.8170.9-84.577.2000114.3
293G38.4Very low42.4Very low65 Ų65155.1 Ų155.167%0.6783%0.834SS**  trans152.296.3137.100000118.4
294Q46.1Very low42.8Very low200 Ų200151.4 Ų151.494%0.93583%0.833SS**  trans79.9121.6143.6-77.1144.820.400122.1
295H42.8Very low43.4Very low172 Ų172149.6 Ų149.680%0.79683%0.831SS**  trans-86.4157.7166.2-129.8-96.9000110.3L297H295-L297 PolarHBondContact ND1-N 3.35Å
296P48.5Very low43.7Very low116 Ų116150.9 Ų150.975%0.75383%0.828SS**  -144.7131.5101.832.6-14.9000113.3
297L41.7Very low44.1Very low151 Ų151157.2 Ų157.279%0.79185%0.847SS**  40.2106.3109.3-86.2173000115.6H295H295-L297 PolarHBondContact ND1-N 3.35Å
298V51.9Low44.5Very low146 Ų146150.5 Ų150.589%0.88584%0.838SS**  trans-127.2117.3154.9-73.80000109.1
299H37.6Very low44.7Very low176 Ų176156.5 Ų156.582%0.81585%0.85SS**  trans-91.5140.3169.4-157.178000107
300C47.9Very low44.7Very low134 Ų134158.3 Ų158.391%0.90585%0.852SS**  trans-133.5121.2167.2-144.10000108.1
301E43.3Very low44.5Very low163 Ų163159.2 Ų159.276%0.76286%0.859SS**  trans-84.2142.1-170.4-173.8-172.8108.100111.8
302M45.8Very low44.4Very low260 Ų260159.7 Ų159.7100%1.28186%0.864SS**  trans-160.50132-99.3157.1-164.200108.8

Retrieved 302 of 302 residues in 290.1 ms (Link to these results)