A0A096NLL0_PAPAN Loading...

Transmembrane protein 186

AlphaFold DB , UniProt , Accession A0A096NLL0, Species PAPAN (Papio anubis, Olive baboon), Gene TMEM186, Length 213 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
1M37.3Very low38.9Very low242 Ų242159.9 Ų159.9100%1.19284%0.842SS**  093.50-57.8-166.7-169.700106.2
2A40Very low38.4Very low103 Ų103165.1 Ų165.185%0.85184%0.842SS**  56.6132.99200000112.7
3A44Very low37.8Very low82 Ų82158.4 Ų158.468%0.67884%0.839SS**  cis-179.5158.7-13.500000105.6
4L43.8Very low37.3Very low152 Ų152162.6 Ų162.680%0.79685%0.846SS**  trans72.6132.2149.7-74.5158000117.1
5L43.5Very low36.9Very low155 Ų155157.9 Ų157.981%0.81284%0.841SS**  cis-154.4151.726.8-103.3150.3000112.8
6R40.8Very low36.5Very low220 Ų220153.9 Ų153.983%0.8384%0.837SS**  trans-69.6151.4174.1-57169.1-177.5175.82111.9
7V35.5Very low36.1Very low143 Ų143160.1 Ų160.187%0.86785%0.845SS**  -143.2119.6129.9179.20000109.3
8V42.4Very low35.7Very low113 Ų113160.4 Ų160.469%0.68584%0.841SS**  trans-112.7134.5171.1165.60000106.3R10V8-R10 HydrophobicContact CG1-CB 4.04Å
9P36.3Very low36Very low129 Ų129164.2 Ų164.284%0.83884%0.843SS**  trans-100.6105.1155.618.4-0.7000108.7
10R35.3Very low36.4Very low207 Ų207161.3 Ų161.378%0.78184%0.835SS**  trans-101.2110.9164.8-165.1-177.4-162.8177.45.9105.4V8V8-R10 HydrophobicContact CG1-CB 4.04Å
11F28.9Very low36.5Very low213 Ų213161.1 Ų161.193%0.93484%0.835SS**  trans-121.7106.8161.6-128.5-95000109.4
12R33Very low36.3Very low222 Ų222158.8 Ų158.884%0.83882%0.821SS**  trans-92.8129.5173.5180-176.3-177.3-179.20.9106.3
13G30Very low35.7Very low78 Ų78157 Ų15780%0.80481%0.813SS**  trans-169.189.7172.500000112
14K31.3Very low35.2Very low217 Ų217160.6 Ų160.694%0.94382%0.82SS**  trans-88.4123.9164.9-130.8-170.1-176.9-172.50106.8
15A30.9Very low34.5Very low92 Ų92164.8 Ų164.876%0.7683%0.825SS**  trans-169.1105.7157.900000107.3
16A31.6Very low33.9Very low94 Ų94161.8 Ų161.878%0.77782%0.816SS**  6086.296.600000111.9E18A16-E18 PolarHBondContact O-N 2.9Å
17W29.1Very low33.7Very low259 Ų259157.5 Ų157.598%0.98182%0.819SS**  trans-91.882.2170-155.255.1000108.4
18E28.4Very low33.4Very low166 Ų166156.1 Ų156.178%0.77682%0.815SS**  trans-73133164.9-75.3-87.2102.800108.6A16A16-E18 PolarHBondContact O-N 2.9Å
19R42.1Very low32.8Very low232 Ų232154.4 Ų154.488%0.87582%0.82SS**  trans-59.3149.3153.6-69.6-177.1-84.9-160.7-5.8107.8
20P44.4Very low32.5Very low106 Ų106156.1 Ų156.169%0.68882%0.817SS**  -155.6156102.430.8-8.6000117.8
21L37.9Very low32.5Very low158 Ų158153.6 Ų153.683%0.82781%0.814SS**  trans74.6118.6144.4-61.8158.8000119.5
22H32.3Very low32.7Very low193 Ų193150.1 Ų150.189%0.89481%0.805SS**  56.3116.468.2-107.8-97.4000114
23G28.9Very low33.7Very low67 Ų67144 Ų14469%0.69179%0.794SS**  trans148.388.4170.300000111.1
24L32.7Very low34Very low156 Ų156149.1 Ų149.182%0.81779%0.794SS**  74.999.3100.7-157.195.1000112.2
25W29.5Very low34.2Very low240 Ų240148.4 Ų148.491%0.90979%0.786SS**  trans-147.3106.5141.6-154.7-92.1000110.8
26C31.4Very low34Very low93 Ų93153.5 Ų153.563%0.62879%0.786SS**  trans-72.7160.6171.1-74.90000111.8
27C35.7Very low34Very low130 Ų130154.7 Ų154.788%0.87878%0.783SS**  trans-3.5129.5154.2-52.50000118.3
28S30.1Very low34Very low113 Ų113145.7 Ų145.779%0.7977%0.77SS**  trans-146.6128138.550.60000108.9
29G29.6Very low34Very low77 Ų77142.9 Ų142.979%0.79477%0.769SS**  trans-97.2175.1167.800000111.4
30Q30.5Very low33.6Very low166 Ų166143.3 Ų143.378%0.77677%0.771SS**  trans105.898.9156.6-155.5152.846.200118.6
31E33.7Very low33.3Very low154 Ų154143.9 Ų143.972%0.7278%0.777SS**  52.7138.6124.2-57.5168.8169.400118.6
32D33.8Very low33.3Very low140 Ų140141.4 Ų141.475%0.74977%0.77SS**  cis179.9-163.618.8-123.6-37.9000106.8
33P53Low33Very low92 Ų92139.4 Ų139.460%0.59777%0.772SS**  -127.7-170.3-70.930.2-7.4000114.8
34K36.5Very low33.2Very low187 Ų187140.8 Ų140.881%0.81377%0.771SS**  trans105.1106.4151.8-47-145.1-176.3-173.40117.3
35R35.6Very low33Very low202 Ų202142.6 Ų142.676%0.76277%0.772SS**  106.9115.693-157.3-171.1-161.5178.58.2110.3
36W28.2Very low33Very low199 Ų199139.6 Ų139.675%0.75477%0.768SS**  -166.7127.271.6-9384.3000107.7
37V31.6Very low33.1Very low119 Ų119143 Ų14372%0.72177%0.773SS**  68.2121.379177.70000115.3
38G27.4Very low33Very low69 Ų69142.1 Ų142.171%0.71177%0.765SS**  trans161.762.5166.900000111.4
39S28.3Very low33.2Very low107 Ų107142.2 Ų142.275%0.74876%0.763SS**  71.388.4102.5-58.60000114.2
40R34.5Very low33.2Very low242 Ų242143.5 Ų143.591%0.91375%0.751SS**  65.4124.4104.6-116.4-172.3-90.5-157.5-4.5114.1
41S37.1Very low33.3Very low117 Ų117144.6 Ų144.682%0.81876%0.757SS**  -152.5163.17046.50000116.1
42P39.4Very low33.4Very low106 Ų106143.5 Ų143.569%0.68875%0.752SS**  trans-114.2148.2-161.137.2-22.4000114.1
43T26.3Very low33.5Very low152 Ų152143 Ų14393%0.93375%0.754SS**  trans-135.5116.6152.1-38.80000110.1
44S32.6Very low33.1Very low96 Ų96143.2 Ų143.267%0.67175%0.747SS**  trans-75.4133.6-176.3169.10000112.9
45K29.1Very low33.4Very low194 Ų194140.7 Ų140.784%0.84374%0.736SS**  trans-172.1128.5135.7-64.9-49.3173.1164.70105.1
46E28.5Very low34.2Very low176 Ų176135.1 Ų135.182%0.82272%0.717SS**  cis-164130-3.9178.6160.589.700103.2
47K33.7Very low35.4Very low166 Ų166132.7 Ų132.772%0.72271%0.708SS**PPolyproline II helixtrans-94.2130.7-175.2175.8178.2-172.4-176.10108.5
48P33.8Very low36.3Very low111 Ų111130.5 Ų130.572%0.72169%0.691SS**PPolyproline II helixtrans-88153.9149.533.4-26.1000110.1
49P33Very low37.7Very low115 Ų115127.9 Ų127.975%0.74766%0.66SS**PPolyproline II helixtrans-93.2163.4-149.736.4-33000113.1
50N29.9Very low39.1Very low103 Ų103123.1 Ų123.155%0.55163%0.625SS**  trans7283.5161.3-135.826.4000118.3E52N50-E52 PolarHBondContact ND2-OE2 2.84Å; N50-E52 PolarHBondContact O-N 3.11Å; N50-E52 VanDerWaalsContact O-N 3.11Å; N50-E52 WeakPolarHBondContact OD1-CG 3.4Å
51Q33.4Very low40.2Very low189 Ų189117.5 Ų117.588%0.88360%0.604SS**  trans-79.862.5160.1-68.7-176-48.500110.1
52E35.7Very low41.2Very low132 Ų132112.4 Ų112.462%0.61757%0.568SS**SBendtrans-99.991.3165.8-75.8-178.5160.700107.2N50 E54N50-E52 PolarHBondContact ND2-OE2 2.84Å; N50-E52 PolarHBondContact O-N 3.11Å; N50-E52 VanDerWaalsContact O-N 3.11Å; N50-E52 WeakPolarHBondContact OD1-CG 3.4Å; E52-E54 VanDerWaalsContact C-N 3.32Å; E52-E54 PolarHBondContact O-N 2.82Å
53T36.8Very low41.9Very low129 Ų129111.5 Ų111.579%0.79156%0.557SS**  trans36.456.815948.70000114.7K55T53-K55 VanDerWaalsContact C-N 3.32Å; T53-K55 PolarHBondContact O-N 2.91Å
54E43.2Very low43.3Very low97 Ų97105.1 Ų105.145%0.45352%0.52SS..  trans-63.8101.7171.2-73.4-168.2133.200106.8E52 F56 N134E52-E54 VanDerWaalsContact C-N 3.32Å; E52-E54 PolarHBondContact O-N 2.82Å; E54-F56 VanDerWaalsContact C-N 3.25Å; E54-F56 HydrophobicContact CB-CE1 4.49Å; E54-F56 HydrophobicContact CB-CE2 3.95Å; E54-F56 HydrophobicContact CB-CZ 3.91Å; E54-F56 WeakPolarHBondContact O-CD2 3.37Å; E54-F56 WeakPolarHBondContact O-CE2 3.08Å; E54-F56 PolarHBondContact O-N 2.77Å; E54-N134 PolarHBondContact OE1-ND2 3.19Å; E54-N134 PolarHBondContact OE2-ND2 3.05Å
55K44Very low44.7Very low134 Ų134102.1 Ų102.158%0.58350%0.496SS*.  trans-66.691.1175.1-84.7175.7179172.40106.9T53 W57 E135T53-K55 VanDerWaalsContact C-N 3.32Å; T53-K55 PolarHBondContact O-N 2.91Å; K55-W57 VanDerWaalsContact O-CD1 3.3Å; K55-W57 PolarHBondContact O-N 3.34Å; K55-E135 HydrophobicContact CB-CG 4.44Å; K55-E135 VanDerWaalsContact CB-OE1 3.26Å; K55-E135 WeakPolarHBondContact CB-OE1 3.42Å; K55-E135 WeakPolarHBondContact O-CG 3.26Å
56F51.5Low46.2Very low84 Ų8495.1 Ų95.137%0.36848%0.479SS..  trans-66109.3172.1-65.3-76.8000108.5E54 M58 N134E54-F56 VanDerWaalsContact C-N 3.25Å; E54-F56 HydrophobicContact CB-CE1 4.49Å; E54-F56 HydrophobicContact CB-CE2 3.95Å; E54-F56 HydrophobicContact CB-CZ 3.91Å; E54-F56 WeakPolarHBondContact O-CD2 3.37Å; E54-F56 WeakPolarHBondContact O-CE2 3.08Å; E54-F56 PolarHBondContact O-N 2.77Å; F56-M58 PolarHBondContact O-N 3.37Å; F56-N134 HydrophobicContact CD1-CB 4.44Å; F56-N134 HydrophobicContact CE1-CB 4.26Å
57W53.2Low47.8Very low149 Ų14992.3 Ų92.356%0.56447%0.468SS*.EExtended strand (participates in β ladder)trans-82.9120.6175.1-78.989.5000109.5K55 F59 L133 E135K55-W57 VanDerWaalsContact O-CD1 3.3Å; K55-W57 PolarHBondContact O-N 3.34Å; W57-F59 PolarHBondContact O-N 2.85Å; W57-L133 PolarHBondContact N-O 3.27Å; W57-L133 PolarHBondContact O-N 3.07Å; W57-E135 VanDerWaalsContact CD1-OE1 3.26Å; W57-E135 PolarHBondContact NE1-OE1 2.69Å
58M51.8Low49.4Very low73 Ų7388 Ų8836%0.3645%0.449SS..EExtended strand (participates in β ladder)trans-69.297.4168.5-94.4-173.416800108.3F56 I130 Y132F56-M58 PolarHBondContact O-N 3.37Å; M58-I130 HydrophobicContact CE-CG2 4.06Å; M58-Y132 HydrophobicContact CE-CD1 4.4Å; M58-Y132 HydrophobicContact CE-CE1 3.31Å; M58-Y132 VanDerWaalsContact CE-CZ 3.45Å; M58-Y132 WeakPolarHBondContact CE-OH 3.35Å; M58-Y132 HydrophobicContact CG-CD1 3.56Å; M58-Y132 HydrophobicContact CG-CE1 3.36Å; M58-Y132 HydrophobicContact SD-CE1 4.13Å
59F55.7Low51Low14 Ų1483.1 Ų83.16%0.06142%0.42CS..EExtended strand (participates in β ladder)trans-87.1-24.6-178.8-169.7-113.4000112.6W57 L133 D198 R201 F202W57-F59 PolarHBondContact O-N 2.85Å; F59-L133 HydrophobicContact CB-CD1 4.02Å; F59-L133 HydrophobicContact CD1-CD1 3.82Å; F59-L133 HydrophobicContact CG-CD1 4.08Å; F59-D198 HydrophobicContact CD2-CB 4.08Å; F59-D198 HydrophobicContact CE2-CB 3.61Å; F59-D198 WeakPolarHBondContact CE2-O 3.4Å; F59-D198 WeakPolarHBondContact CZ-O 2.78Å; F59-R201 HydrophobicContact CD2-CB 4.4Å; F59-R201 HydrophobicContact CE2-CB 3.63Å; F59-R201 HydrophobicContact CZ-CB 3.94Å; F59-F202 HydrophobicContact CD1-CD2 4.3Å; F59-F202 HydrophobicContact CE1-CB 3.38Å; F59-F202 AromaticContact CE1-CD2 3.47Å; F59-F202 HydrophobicContact CE1-CD2 3.47Å; F59-F202 VanDerWaalsContact CE1-CD2 3.47Å; F59-F202 AromaticContact CE1-CG 3.86Å; F59-F202 HydrophobicContact CE1-CG 3.86Å; F59-F202 HydrophobicContact CZ-CB 3.37Å; F59-F202 HydrophobicContact CZ-CD2 4.29Å; F59-F202 HydrophobicContact CZ-CG 4.32Å
60Y58.3Low52.6Low6 Ų684.1 Ų84.12%0.02441%0.413CS..EExtended strand (participates in β ladder)trans-148.4123.5-174.2177.8-92.8000111.3F62 L131 V189 T190 G194Y60-F62 HydrophobicContact CE1-CB 3.83Å; Y60-F62 VanDerWaalsContact OH-CD2 3.28Å; Y60-F62 WeakPolarHBondContact OH-CD2 2.84Å; Y60-L131 HydrophobicContact CD1-CB 4.25Å; Y60-L131 PolarHBondContact O-N 2.92Å; Y60-V189 HydrophobicContact CE1-CG1 4.06Å; Y60-T190 PolarHBondContact OH-O 2.7Å; Y60-G194 VanDerWaalsContact CE2-CA 3.5Å
61R56.6Low54.7Low125 Ų12583.1 Ų83.147%0.47241%0.407SS..EExtended strand (participates in β ladder)trans-120.3115.6175.1-176.2174.3157.3-171.5-11.2109.3D63 H195R61-D63 IonicContact CZ-OD1 3.65Å; R61-D63 IonicContact CZ-OD2 3.16Å; R61-D63 IonicContact NE-OD1 3.39Å; R61-D63 PolarHBondContact NE-OD1 3Å; R61-D63 IonicContact NE-OD2 2.76Å; R61-D63 PolarHBondContact NE-OD2 3.23Å; R61-D63 IonicContact NH2-OD1 2.73Å; R61-D63 PolarHBondContact NH2-OD1 3.36Å; R61-D63 IonicContact NH2-OD2 3.49Å; R61-D63 PolarHBondContact NH2-OD2 2.92Å; R61-D63 PolarHBondContact O-N 3.49Å; R61-H195 PolarHBondContact O-N 3.02Å
62F59.3Low56.4Low10 Ų1074.5 Ų74.54%0.04437%0.367CS..EExtended strand (participates in β ladder)trans-92.693.2171.5-168.6-106.9000109.3Y60 A64 I65 G129 T190 Y193Y60-F62 HydrophobicContact CE1-CB 3.83Å; Y60-F62 VanDerWaalsContact OH-CD2 3.28Å; Y60-F62 WeakPolarHBondContact OH-CD2 2.84Å; F62-A64 HydrophobicContact CD1-CB 3.88Å; F62-A64 HydrophobicContact CE1-CB 3.32Å; F62-A64 HydrophobicContact CE2-CB 4.25Å; F62-A64 HydrophobicContact CZ-CB 3.53Å; F62-A64 PolarHBondContact O-N 3.15Å; F62-I65 HydrophobicContact CD1-CB 4.22Å; F62-I65 WeakPolarHBondContact O-CB 3.19Å; F62-I65 WeakPolarHBondContact O-CG2 3.38Å; F62-I65 PolarHBondContact O-N 3.12Å; F62-G129 WeakPolarHBondContact CB-O 3.38Å; F62-G129 PolarHBondContact N-O 3.48Å; F62-T190 WeakPolarHBondContact CE2-O 3.44Å; F62-T190 WeakPolarHBondContact CE2-OG1 3.26Å; F62-T190 WeakPolarHBondContact CZ-OG1 3.38Å; F62-Y193 VanDerWaalsContact CE2-CB 3.49Å; F62-Y193 HydrophobicContact CE2-CD2 4.35Å; F62-Y193 HydrophobicContact CE2-CG 4.4Å; F62-Y193 HydrophobicContact CZ-CD2 4.47Å
63D53.6Low58.3Low86 Ų8674.6 Ų74.646%0.4636%0.362SS..THydrogen-bonded Turntrans-67.4-20.1-178.3-89.7-41.9000113.6R61 I65 G66R61-D63 IonicContact CZ-OD1 3.65Å; R61-D63 IonicContact CZ-OD2 3.16Å; R61-D63 IonicContact NE-OD1 3.39Å; R61-D63 PolarHBondContact NE-OD1 3Å; R61-D63 IonicContact NE-OD2 2.76Å; R61-D63 PolarHBondContact NE-OD2 3.23Å; R61-D63 IonicContact NH2-OD1 2.73Å; R61-D63 PolarHBondContact NH2-OD1 3.36Å; R61-D63 IonicContact NH2-OD2 3.49Å; R61-D63 PolarHBondContact NH2-OD2 2.92Å; R61-D63 PolarHBondContact O-N 3.49Å; D63-I65 PolarHBondContact O-N 3.36Å; D63-I65 VanDerWaalsContact O-N 3.1Å; D63-G66 PolarHBondContact O-N 3.3Å; D63-G66 VanDerWaalsContact O-N 3.12Å
64A55.8Low60.2Low19 Ų1972.7 Ų72.716%0.15735%0.347CS..Hα-helixtrans-63.3-15.7174.500000113.1F62 G66 I67 F68F62-A64 HydrophobicContact CD1-CB 3.88Å; F62-A64 HydrophobicContact CE1-CB 3.32Å; F62-A64 HydrophobicContact CE2-CB 4.25Å; F62-A64 HydrophobicContact CZ-CB 3.53Å; F62-A64 PolarHBondContact O-N 3.15Å; A64-G66 PolarHBondContact O-N 3.33Å; A64-I67 PolarHBondContact O-N 3.01Å; A64-F68 HydrophobicContact CB-CD2 4.43Å; A64-F68 HydrophobicContact CB-CE2 4.32Å; A64-F68 WeakPolarHBondContact O-CD2 3.09Å; A64-F68 PolarHBondContact O-N 3.01Å; A64-F68 VanDerWaalsContact O-N 3.13Å
65I62.2Low61.8Low32 Ų3272.2 Ų72.216%0.16434%0.343CS..Hα-helixtrans-62-30.8173.5-159.4167.1000112.6F62 D63 G69 L145F62-I65 HydrophobicContact CD1-CB 4.22Å; F62-I65 WeakPolarHBondContact O-CB 3.19Å; F62-I65 WeakPolarHBondContact O-CG2 3.38Å; F62-I65 PolarHBondContact O-N 3.12Å; D63-I65 PolarHBondContact O-N 3.36Å; D63-I65 VanDerWaalsContact O-N 3.1Å; I65-G69 PolarHBondContact O-N 3.36Å; I65-L145 HydrophobicContact CD1-CB 3.86Å; I65-L145 HydrophobicContact CD1-CD1 3.99Å; I65-L145 HydrophobicContact CD1-CG 4.32Å; I65-L145 HydrophobicContact CG1-CB 4.25Å; I65-L145 HydrophobicContact CG1-CD1 3.98Å; I65-L145 HydrophobicContact CG1-CD2 3.99Å; I65-L145 HydrophobicContact CG1-CG 4.29Å
66G59.6Low63.5Low48 Ų4867.4 Ų67.450%0.49532%0.323SS..Hα-helixtrans-67.1-43.9178.600000112.1D63 A64 G69 F70D63-G66 PolarHBondContact O-N 3.3Å; D63-G66 VanDerWaalsContact O-N 3.12Å; A64-G66 PolarHBondContact O-N 3.33Å; G66-G69 PolarHBondContact O-N 2.7Å; G66-F70 PolarHBondContact O-N 3.3Å
67I63.4Low64.9Low116 Ų11666.2 Ų66.260%0.59533%0.329SS*.Hα-helixtrans-66.2-43.2178.5-59172.4000110.3A64 F70 L71A64-I67 PolarHBondContact O-N 3.01Å; I67-F70 PolarHBondContact O-N 3.14Å; I67-L71 HydrophobicContact CG2-CD1 4.08Å; I67-L71 WeakPolarHBondContact O-CG 2.9Å; I67-L71 PolarHBondContact O-N 3.3Å
68F66.4Low66.2Low75 Ų7565.3 Ų65.333%0.32933%0.332SS..Hα-helixtrans-65.3-38.6175.5-76.4-62.8000112.7A64 F70 L71 S72 F124A64-F68 HydrophobicContact CB-CD2 4.43Å; A64-F68 HydrophobicContact CB-CE2 4.32Å; A64-F68 WeakPolarHBondContact O-CD2 3.09Å; A64-F68 PolarHBondContact O-N 3.01Å; A64-F68 VanDerWaalsContact O-N 3.13Å; F68-F70 VanDerWaalsContact C-N 3.32Å; F68-F70 PolarHBondContact O-N 3.44Å; F68-L71 HydrophobicContact CD1-CD1 4.39Å; F68-L71 PolarHBondContact O-N 2.85Å; F68-S72 WeakPolarHBondContact O-CB 3.4Å; F68-S72 PolarHBondContact O-N 3.5Å; F68-F124 HydrophobicContact CB-CD1 4.48Å; F68-F124 HydrophobicContact CB-CE1 3.99Å; F68-F124 AromaticContact CD1-CE1 3.52Å; F68-F124 HydrophobicContact CD1-CE1 3.52Å; F68-F124 HydrophobicContact CD1-CZ 4.14Å; F68-F124 HydrophobicContact CE1-CE1 4.31Å; F68-F124 HydrophobicContact CG-CE1 4.04Å
69G67.7Low67.6Low9 Ų963.2 Ų63.29%0.09332%0.323CS..Hα-helixtrans-60.7-40.8171.900000112.4I65 G66 S72 R73I65-G69 PolarHBondContact O-N 3.36Å; G66-G69 PolarHBondContact O-N 2.7Å; G69-S72 PolarHBondContact O-N 3.27Å; G69-R73 WeakPolarHBondContact O-CG 3.09Å; G69-R73 PolarHBondContact O-N 2.73Å
70F67.6Low68.9Low137 Ų13765.2 Ų65.260%0.60134%0.342SS*.Hα-helixtrans-67-44.9176.1-167.9-106.3000112.3G66 I67 F68 S72 R73 L74G66-F70 PolarHBondContact O-N 3.3Å; I67-F70 PolarHBondContact O-N 3.14Å; F68-F70 VanDerWaalsContact C-N 3.32Å; F68-F70 PolarHBondContact O-N 3.44Å; F70-S72 VanDerWaalsContact C-N 3.32Å; F70-S72 PolarHBondContact O-N 2.67Å; F70-R73 PolarHBondContact O-N 2.76Å; F70-L74 HydrophobicContact CD1-CD1 3.54Å; F70-L74 HydrophobicContact CE1-CD1 3.13Å; F70-L74 HydrophobicContact CG-CD1 4.39Å; F70-L74 HydrophobicContact CZ-CD1 3.69Å; F70-L74 PolarHBondContact O-N 3.49Å
71L72.6Confident70Confident81 Ų8170.3 Ų70.342%0.42437%0.369SS..Hα-helixtrans-61.4-38.5175.3-79.2164000112.6I67 F68 L74 K75I67-L71 HydrophobicContact CG2-CD1 4.08Å; I67-L71 WeakPolarHBondContact O-CG 2.9Å; I67-L71 PolarHBondContact O-N 3.3Å; F68-L71 HydrophobicContact CD1-CD1 4.39Å; F68-L71 PolarHBondContact O-N 2.85Å; L71-L74 PolarHBondContact O-N 3.08Å; L71-K75 WeakPolarHBondContact O-CB 3.41Å; L71-K75 PolarHBondContact O-N 2.7Å
72S70.5Confident71.1Confident9 Ų967.6 Ų67.66%0.06337%0.367CS..Hα-helixtrans-64-45.4174.7172.30000111.2F68 G69 F70 L74 K75 L76F68-S72 WeakPolarHBondContact O-CB 3.4Å; F68-S72 PolarHBondContact O-N 3.5Å; G69-S72 PolarHBondContact O-N 3.27Å; F70-S72 VanDerWaalsContact C-N 3.32Å; F70-S72 PolarHBondContact O-N 2.67Å; S72-L74 PolarHBondContact O-N 2.81Å; S72-K75 PolarHBondContact O-N 3.49Å; S72-L76 WeakPolarHBondContact O-CB 3.42Å; S72-L76 WeakPolarHBondContact O-CG 3.45Å; S72-L76 PolarHBondContact O-N 3.37Å
73R73.8Confident72.1Confident133 Ų13371.7 Ų71.750%0.50239%0.392SS..Hα-helixtrans-63.1-40175.3-71.8179.7-176.3-175.27.4112.5G69 F70 L76 A77 G149G69-R73 WeakPolarHBondContact O-CG 3.09Å; G69-R73 PolarHBondContact O-N 2.73Å; F70-R73 PolarHBondContact O-N 2.76Å; R73-L76 PolarHBondContact O-N 3.39Å; R73-A77 WeakPolarHBondContact O-CB 3.4Å; R73-A77 PolarHBondContact O-N 3.27Å; R73-G149 PolarHBondContact NH2-O 3.29Å
74L77.8Confident73.6Confident89 Ų8972.4 Ų72.447%0.46640%0.399SS..Hα-helixtrans-64-46.4175.8-112.1134.8000111.8F70 L71 S72 L76 A77 Q78F70-L74 HydrophobicContact CD1-CD1 3.54Å; F70-L74 HydrophobicContact CE1-CD1 3.13Å; F70-L74 HydrophobicContact CG-CD1 4.39Å; F70-L74 HydrophobicContact CZ-CD1 3.69Å; F70-L74 PolarHBondContact O-N 3.49Å; L71-L74 PolarHBondContact O-N 3.08Å; S72-L74 PolarHBondContact O-N 2.81Å; L74-L76 VanDerWaalsContact C-N 3.33Å; L74-L76 PolarHBondContact O-N 3.45Å; L74-A77 PolarHBondContact O-N 2.93Å; L74-Q78 VanDerWaalsContact O-CB 3.31Å; L74-Q78 WeakPolarHBondContact O-CB 3.18Å; L74-Q78 PolarHBondContact O-N 2.76Å
75K76.9Confident74.7Confident88 Ų8875.4 Ų75.438%0.38342%0.415SS..Hα-helixtrans-62.4-39.3176.2-84.6-179.1172.6175.30112.4L71 S72 T79 L117L71-K75 WeakPolarHBondContact O-CB 3.41Å; L71-K75 PolarHBondContact O-N 2.7Å; S72-K75 PolarHBondContact O-N 3.49Å; K75-T79 PolarHBondContact O-N 2.86Å; K75-T79 VanDerWaalsContact O-N 3.08Å; K75-T79 PolarHBondContact O-OG1 3.34Å; K75-T79 VanDerWaalsContact O-OG1 3.04Å; K75-L117 HydrophobicContact CB-CD1 4.14Å
76L79.3Confident75.5Confident32 Ų3277.5 Ų77.517%0.16843%0.426CS..Hα-helixtrans-71.2-40.4176.4-75172.3000112.7S72 R73 L74 Q78 T79 A80 L117 F147S72-L76 WeakPolarHBondContact O-CB 3.42Å; S72-L76 WeakPolarHBondContact O-CG 3.45Å; S72-L76 PolarHBondContact O-N 3.37Å; R73-L76 PolarHBondContact O-N 3.39Å; L74-L76 VanDerWaalsContact C-N 3.33Å; L74-L76 PolarHBondContact O-N 3.45Å; L76-Q78 VanDerWaalsContact C-N 3.29Å; L76-Q78 PolarHBondContact O-N 3.24Å; L76-T79 WeakPolarHBondContact CA-OG1 3.36Å; L76-T79 PolarHBondContact O-N 2.79Å; L76-T79 PolarHBondContact O-OG1 3.4Å; L76-A80 VanDerWaalsContact O-CB 3.28Å; L76-A80 WeakPolarHBondContact O-CB 3.48Å; L76-A80 PolarHBondContact O-N 2.92Å; L76-L117 HydrophobicContact CD2-CD2 4.46Å; L76-F147 HydrophobicContact CD1-CE2 4.48Å; L76-F147 HydrophobicContact CD1-CZ 4.39Å; L76-F147 HydrophobicContact CD2-CE2 4.23Å; L76-F147 HydrophobicContact CD2-CZ 3.84Å
77A80.6Confident76.4Confident60 Ų6079 Ų7950%0.49643%0.428SS..Hα-helixtrans-63.7-39.8174.900000110.7R73 L74 A80 L81R73-A77 WeakPolarHBondContact O-CB 3.4Å; R73-A77 PolarHBondContact O-N 3.27Å; L74-A77 PolarHBondContact O-N 2.93Å; A77-A80 PolarHBondContact O-N 2.84Å; A77-L81 VanDerWaalsContact O-CB 3.31Å; A77-L81 WeakPolarHBondContact O-CB 3.43Å; A77-L81 PolarHBondContact O-N 3.46Å
78Q80.5Confident77.1Confident130 Ų13077 Ų7761%0.60742%0.422SS*.Hα-helixtrans-61.1-47.2175-175.8-179.9-16.500111.3L74 L76 L81 T82L74-Q78 VanDerWaalsContact O-CB 3.31Å; L74-Q78 WeakPolarHBondContact O-CB 3.18Å; L74-Q78 PolarHBondContact O-N 2.76Å; L76-Q78 VanDerWaalsContact C-N 3.29Å; L76-Q78 PolarHBondContact O-N 3.24Å; Q78-L81 PolarHBondContact O-N 2.77Å; Q78-T82 WeakPolarHBondContact O-CG2 3.42Å; Q78-T82 PolarHBondContact O-N 3.25Å; Q78-T82 PolarHBondContact O-OG1 2.84Å
79T81.3Confident77.3Confident28 Ų2875 Ų7517%0.17242%0.419CS..Hα-helixtrans-68.5-39.9176.936.60000113.1K75 L76 L81 T82 V83 L117K75-T79 PolarHBondContact O-N 2.86Å; K75-T79 VanDerWaalsContact O-N 3.08Å; K75-T79 PolarHBondContact O-OG1 3.34Å; K75-T79 VanDerWaalsContact O-OG1 3.04Å; L76-T79 WeakPolarHBondContact CA-OG1 3.36Å; L76-T79 PolarHBondContact O-N 2.79Å; L76-T79 PolarHBondContact O-OG1 3.4Å; T79-L81 VanDerWaalsContact C-N 3.31Å; T79-L81 PolarHBondContact O-N 3.22Å; T79-T82 VanDerWaalsContact CA-OG1 3.27Å; T79-T82 WeakPolarHBondContact CA-OG1 3.43Å; T79-T82 PolarHBondContact O-N 2.88Å; T79-T82 VanDerWaalsContact O-N 3.16Å; T79-T82 PolarHBondContact O-OG1 3.13Å; T79-V83 WeakPolarHBondContact O-CG2 3.18Å; T79-V83 PolarHBondContact O-N 3.33Å; T79-L117 HydrophobicContact CG2-CD1 3.64Å
80A82.4Confident77.3Confident57 Ų5778.1 Ų78.147%0.47144%0.439SS..Hα-helixtrans-58.9-44175.200000111.4L76 A77 T82 V83 V84L76-A80 VanDerWaalsContact O-CB 3.28Å; L76-A80 WeakPolarHBondContact O-CB 3.48Å; L76-A80 PolarHBondContact O-N 2.92Å; A77-A80 PolarHBondContact O-N 2.84Å; A80-T82 PolarHBondContact O-N 3.44Å; A80-V83 PolarHBondContact O-N 3.21Å; A80-V84 WeakPolarHBondContact O-CG2 3.11Å; A80-V84 PolarHBondContact O-N 3.49Å
81L82.4Confident77.8Confident113 Ų11378.8 Ų78.859%0.59244%0.439SS*.Hα-helixtrans-61.7-44.1175.2-172.467.3000111.1A77 Q78 T79 V83 V84 V85A77-L81 VanDerWaalsContact O-CB 3.31Å; A77-L81 WeakPolarHBondContact O-CB 3.43Å; A77-L81 PolarHBondContact O-N 3.46Å; Q78-L81 PolarHBondContact O-N 2.77Å; T79-L81 VanDerWaalsContact C-N 3.31Å; T79-L81 PolarHBondContact O-N 3.22Å; L81-V83 VanDerWaalsContact C-N 3.33Å; L81-V83 PolarHBondContact O-N 3.03Å; L81-V84 PolarHBondContact O-N 3.41Å; L81-V85 HydrophobicContact CD1-CG2 4.43Å; L81-V85 HydrophobicContact CG-CG2 4.39Å; L81-V85 WeakPolarHBondContact O-CB 3.33Å; L81-V85 VanDerWaalsContact O-CG2 3.23Å; L81-V85 WeakPolarHBondContact O-CG2 3.28Å; L81-V85 PolarHBondContact O-N 3.26Å
82T78.8Confident77.8Confident68 Ų6883 Ų8342%0.41745%0.449SS..Hα-helixtrans-63.3-37.4176.8550000112.9Q78 T79 A80 V84 V85 L86Q78-T82 WeakPolarHBondContact O-CG2 3.42Å; Q78-T82 PolarHBondContact O-N 3.25Å; Q78-T82 PolarHBondContact O-OG1 2.84Å; T79-T82 VanDerWaalsContact CA-OG1 3.27Å; T79-T82 WeakPolarHBondContact CA-OG1 3.43Å; T79-T82 PolarHBondContact O-N 2.88Å; T79-T82 VanDerWaalsContact O-N 3.16Å; T79-T82 PolarHBondContact O-OG1 3.13Å; A80-T82 PolarHBondContact O-N 3.44Å; T82-V84 VanDerWaalsContact C-N 3.32Å; T82-V84 PolarHBondContact O-N 3.2Å; T82-V85 PolarHBondContact O-N 3.18Å; T82-L86 WeakPolarHBondContact O-CB 3.31Å; T82-L86 PolarHBondContact O-N 3.08Å
83V82Confident77.6Confident96 Ų9686.8 Ų86.858%0.58246%0.462SS*.Hα-helixtrans-66.3-36.2177.1170.70000111.2T79 A80 L81 P87T79-V83 WeakPolarHBondContact O-CG2 3.18Å; T79-V83 PolarHBondContact O-N 3.33Å; A80-V83 PolarHBondContact O-N 3.21Å; L81-V83 VanDerWaalsContact C-N 3.33Å; L81-V83 PolarHBondContact O-N 3.03Å; V83-P87 WeakPolarHBondContact O-CD 3.32Å
84V84.2Confident77.2Confident101 Ų10184.8 Ų84.861%0.61247%0.469SS*.Hα-helixtrans-72.8-35.3175.9172.90000112A80 L81 T82 P87 P88A80-V84 WeakPolarHBondContact O-CG2 3.11Å; A80-V84 PolarHBondContact O-N 3.49Å; L81-V84 PolarHBondContact O-N 3.41Å; T82-V84 VanDerWaalsContact C-N 3.32Å; T82-V84 PolarHBondContact O-N 3.2Å; V84-P87 WeakPolarHBondContact O-CD 3.48Å; V84-P88 VanDerWaalsContact O-CD 3.31Å; V84-P88 WeakPolarHBondContact O-CD 3.4Å
85V79.6Confident77.1Confident81 Ų8186.5 Ų86.549%0.49148%0.475SS..Hα-helixtrans-79-23.3179.5173.90000112.4L81 T82 P88 A89L81-V85 HydrophobicContact CD1-CG2 4.43Å; L81-V85 HydrophobicContact CG-CG2 4.39Å; L81-V85 WeakPolarHBondContact O-CB 3.33Å; L81-V85 VanDerWaalsContact O-CG2 3.23Å; L81-V85 WeakPolarHBondContact O-CG2 3.28Å; L81-V85 PolarHBondContact O-N 3.26Å; T82-V85 PolarHBondContact O-N 3.18Å; V85-P88 VanDerWaalsContact O-CD 3.29Å; V85-P88 WeakPolarHBondContact O-CD 3.11Å; V85-A89 PolarHBondContact O-N 2.65Å
86L77.6Confident76.7Confident76 Ų7685.4 Ų85.440%0.39849%0.488SS..Hα-helixtrans-58.2-50179.5-144.286.5000114.1T82 A89 C90 M106T82-L86 WeakPolarHBondContact O-CB 3.31Å; T82-L86 PolarHBondContact O-N 3.08Å; L86-A89 WeakPolarHBondContact O-CB 3.02Å; L86-A89 PolarHBondContact O-N 3.32Å; L86-A89 VanDerWaalsContact O-N 3.11Å; L86-C90 PolarHBondContact O-N 3.36Å; L86-C90 PolarHBondContact O-SG 3.41Å; L86-C90 VanDerWaalsContact O-SG 3.37Å; L86-M106 HydrophobicContact CD1-CE 4.48Å
87P79.5Confident76Confident80 Ų8089.9 Ų89.952%0.51951%0.512SS..Hα-helixtrans-59.2-44.6-179.57.2-14.3000114.3V83 V84 A89 C90 Y91V83-P87 WeakPolarHBondContact O-CD 3.32Å; V84-P87 WeakPolarHBondContact O-CD 3.48Å; P87-A89 VanDerWaalsContact C-N 3.31Å; P87-A89 PolarHBondContact O-N 3.45Å; P87-C90 PolarHBondContact O-N 3.4Å; P87-Y91 PolarHBondContact O-N 2.97Å
88P78.5Confident75.4Confident74 Ų7490.7 Ų90.748%0.48151%0.507SS..Hα-helixtrans-57.6-40.5170.7-25.330000113.6V84 V85 Y91 W92V84-P88 VanDerWaalsContact O-CD 3.31Å; V84-P88 WeakPolarHBondContact O-CD 3.4Å; V85-P88 VanDerWaalsContact O-CD 3.29Å; V85-P88 WeakPolarHBondContact O-CD 3.11Å; P88-Y91 WeakPolarHBondContact O-CB 3.48Å; P88-Y91 PolarHBondContact O-N 3.21Å; P88-W92 PolarHBondContact O-N 3.38Å
89A68.9Low75.2Confident33 Ų3389 Ų8927%0.27351%0.506SS..Hα-helixtrans-66.9-38.6177.800000112.1V85 L86 P87 Y91 W92 Y93V85-A89 PolarHBondContact O-N 2.65Å; L86-A89 WeakPolarHBondContact O-CB 3.02Å; L86-A89 PolarHBondContact O-N 3.32Å; L86-A89 VanDerWaalsContact O-N 3.11Å; P87-A89 VanDerWaalsContact C-N 3.31Å; P87-A89 PolarHBondContact O-N 3.45Å; A89-Y91 VanDerWaalsContact C-N 3.32Å; A89-Y91 PolarHBondContact O-N 2.97Å; A89-W92 PolarHBondContact O-N 2.81Å; A89-Y93 PolarHBondContact O-N 2.74Å
90C68.1Low75Confident74 Ų7493.9 Ų93.950%0.553%0.53SS..Hα-helixtrans-64.8-35.6173.1-68.40000112.3L86 P87 Y93 S94L86-C90 PolarHBondContact O-N 3.36Å; L86-C90 PolarHBondContact O-SG 3.41Å; L86-C90 VanDerWaalsContact O-SG 3.37Å; P87-C90 PolarHBondContact O-N 3.4Å; C90-Y93 WeakPolarHBondContact O-CB 3.49Å; C90-Y93 PolarHBondContact O-N 3.06Å; C90-S94 PolarHBondContact O-N 2.62Å; C90-S94 VanDerWaalsContact O-N 3.15Å
91Y78.6Confident74.9Confident152 Ų15297 Ų9760%0.59654%0.539SS*.Hα-helixtrans-67.1-38.6174.2-176.2-102.4000112.3P87 P88 A89 Y93 S94P87-Y91 PolarHBondContact O-N 2.97Å; P88-Y91 WeakPolarHBondContact O-CB 3.48Å; P88-Y91 PolarHBondContact O-N 3.21Å; A89-Y91 VanDerWaalsContact C-N 3.32Å; A89-Y91 PolarHBondContact O-N 2.97Å; Y91-Y93 VanDerWaalsContact C-N 3.33Å; Y91-S94 PolarHBondContact O-N 3.01Å; Y91-S94 PolarHBondContact O-OG 3.15Å
92W72.3Confident74.8Confident170 Ų17094.7 Ų94.764%0.64453%0.53SS*.Hα-helixtrans-70.1-29.2171.7-80.915.7000113P88 A89 Q95P88-W92 PolarHBondContact O-N 3.38Å; A89-W92 PolarHBondContact O-N 2.81Å; W92-Q95 WeakPolarHBondContact O-CB 3.17Å; W92-Q95 PolarHBondContact O-N 3.2Å
93Y66.1Low74.7Confident87 Ų8793.9 Ų93.934%0.34152%0.524SS..Hα-helixtrans-64.1-41.7173.1179.9-120000112.5A89 C90 Y91 Q95 G96 L98 V103A89-Y93 PolarHBondContact O-N 2.74Å; C90-Y93 WeakPolarHBondContact O-CB 3.49Å; C90-Y93 PolarHBondContact O-N 3.06Å; Y91-Y93 VanDerWaalsContact C-N 3.33Å; Y93-Q95 PolarHBondContact O-N 3.03Å; Y93-Q95 VanDerWaalsContact O-N 3.11Å; Y93-G96 PolarHBondContact O-N 3.44Å; Y93-L98 HydrophobicContact CD2-CB 3.72Å; Y93-L98 HydrophobicContact CD2-CD1 4.08Å; Y93-L98 HydrophobicContact CD2-CG 4.32Å; Y93-L98 HydrophobicContact CE2-CB 4.12Å; Y93-L98 WeakPolarHBondContact CE2-O 3.3Å; Y93-V103 HydrophobicContact CD2-CG2 3.71Å; Y93-V103 HydrophobicContact CE1-CG2 4.34Å; Y93-V103 HydrophobicContact CE2-CG2 3.27Å; Y93-V103 HydrophobicContact CG-CG2 4.35Å
94S66Low74.8Confident91 Ų9193.5 Ų93.564%0.63653%0.525SS*.THydrogen-bonded Turntrans-65-15.2177.569.10000113.3C90 Y91 G96C90-S94 PolarHBondContact O-N 2.62Å; C90-S94 VanDerWaalsContact O-N 3.15Å; Y91-S94 PolarHBondContact O-N 3.01Å; Y91-S94 PolarHBondContact O-OG 3.15Å; S94-G96 PolarHBondContact O-N 2.87Å
95Q76.4Confident74.9Confident126 Ų12694.2 Ų94.259%0.58953%0.525SS*.THydrogen-bonded Turntrans-81.73172.3-58.1-128.546.500113.3W92 Y93 L97W92-Q95 WeakPolarHBondContact O-CB 3.17Å; W92-Q95 PolarHBondContact O-N 3.2Å; Y93-Q95 PolarHBondContact O-N 3.03Å; Y93-Q95 VanDerWaalsContact O-N 3.11Å; Q95-L97 HydrophobicContact CB-CD1 4.29Å
96G68Low75.1Confident65 Ų6595.1 Ų95.167%0.6753%0.525SS*.THydrogen-bonded Turntrans79.714.2174.900000114.8Y93 S94Y93-G96 PolarHBondContact O-N 3.44Å; S94-G96 PolarHBondContact O-N 2.87Å
97L64.7Low75.2Confident126 Ų12695 Ų9566%0.6653%0.53SS*.  trans-79.7-11.7-176.3-78.8158.2000114.8Q95Q95-L97 HydrophobicContact CB-CD1 4.29Å
98L67.4Low75.7Confident76 Ų7693.2 Ų93.240%0.39853%0.527SS..SBendtrans-124.3141.2-178.9-49.4160.8000112.3Y93 V103Y93-L98 HydrophobicContact CD2-CB 3.72Å; Y93-L98 HydrophobicContact CD2-CD1 4.08Å; Y93-L98 HydrophobicContact CD2-CG 4.32Å; Y93-L98 HydrophobicContact CE2-CB 4.12Å; Y93-L98 WeakPolarHBondContact CE2-O 3.3Å; L98-V103 HydrophobicContact CB-CG2 4.38Å
99T76.6Confident76.1Confident94 Ų9495.5 Ų95.558%0.57753%0.533SS*.  trans-77.1151.3176.2-49.30000111.5N101 T102 V103T99-N101 HydrophobicContact CG2-CB 4.41Å; T99-N101 PolarHBondContact O-N 3.48Å; T99-N101 VanDerWaalsContact O-N 3.11Å; T99-T102 PolarHBondContact N-OG1 2.82Å; T99-T102 PolarHBondContact O-N 3.01Å; T99-T102 PolarHBondContact O-OG1 3.01Å; T99-V103 PolarHBondContact O-N 2.95Å
100L76.8Confident76.7Confident132 Ų13296.3 Ų96.369%0.69154%0.537SS*.Hα-helixtrans-51.6-36.3174.5-83.9163.2000113.4V103 C104L100-V103 PolarHBondContact O-N 3.33Å; L100-C104 WeakPolarHBondContact O-CB 3.2Å; L100-C104 PolarHBondContact O-N 2.89Å
101N80.8Confident77.5Confident121 Ų12194.4 Ų94.465%0.64753%0.53SS*.Hα-helixtrans-63.8-40.5177.3-74.3-14.7000112.9T99 C104 L105T99-N101 HydrophobicContact CG2-CB 4.41Å; T99-N101 PolarHBondContact O-N 3.48Å; T99-N101 VanDerWaalsContact O-N 3.11Å; N101-C104 PolarHBondContact O-N 3.13Å; N101-L105 WeakPolarHBondContact O-CB 3.34Å; N101-L105 WeakPolarHBondContact O-CG 3.41Å; N101-L105 PolarHBondContact O-N 3.33Å
102T79.6Confident78Confident66 Ų6693.6 Ų93.641%0.40553%0.53SS..Hα-helixtrans-71.8-35179.240.50000111.4T99 M106T99-T102 PolarHBondContact N-OG1 2.82Å; T99-T102 PolarHBondContact O-N 3.01Å; T99-T102 PolarHBondContact O-OG1 3.01Å; T102-M106 VanDerWaalsContact O-CB 3.25Å; T102-M106 WeakPolarHBondContact O-CB 3.42Å; T102-M106 PolarHBondContact O-N 3.24Å
103V78.1Confident78.5Confident50 Ų5087.8 Ų87.830%0.30352%0.518SS..Hα-helixtrans-65.1-43.4173178.50000111.8Y93 L98 T99 L100 M106 S107Y93-V103 HydrophobicContact CD2-CG2 3.71Å; Y93-V103 HydrophobicContact CE1-CG2 4.34Å; Y93-V103 HydrophobicContact CE2-CG2 3.27Å; Y93-V103 HydrophobicContact CG-CG2 4.35Å; L98-V103 HydrophobicContact CB-CG2 4.38Å; T99-V103 PolarHBondContact O-N 2.95Å; L100-V103 PolarHBondContact O-N 3.33Å; V103-M106 PolarHBondContact O-N 3.1Å; V103-S107 WeakPolarHBondContact O-CB 3.49Å; V103-S107 PolarHBondContact O-N 2.79Å; V103-S107 PolarHBondContact O-OG 3.33Å
104C83.5Confident79.2Confident89 Ų8987.9 Ų87.960%0.60152%0.524SS*.Hα-helixtrans-64.5-42178.3-165.80000112.2L100 N101 S107 G108L100-C104 WeakPolarHBondContact O-CB 3.2Å; L100-C104 PolarHBondContact O-N 2.89Å; N101-C104 PolarHBondContact O-N 3.13Å; C104-S107 PolarHBondContact O-OG 3.26Å; C104-G108 PolarHBondContact O-N 2.9Å
105L86.2Confident80.1Confident116 Ų11688 Ų8861%0.60752%0.521SS*.Hα-helixtrans-64.9-43174.4-72.1171.5000111.9N101 G108 I109N101-L105 WeakPolarHBondContact O-CB 3.34Å; N101-L105 WeakPolarHBondContact O-CG 3.41Å; N101-L105 PolarHBondContact O-N 3.33Å; L105-G108 PolarHBondContact O-N 3.12Å; L105-I109 WeakPolarHBondContact O-CD1 3.09Å; L105-I109 VanDerWaalsContact O-CG1 3.26Å; L105-I109 WeakPolarHBondContact O-CG1 3.48Å; L105-I109 PolarHBondContact O-N 3.3Å
106M82.6Confident80.5Confident100 Ų10086.2 Ų86.249%0.49351%0.514SS..Hα-helixtrans-65-41.9179.9-173.3168.2-174.100112.2L86 T102 V103 S110L86-M106 HydrophobicContact CD1-CE 4.48Å; T102-M106 VanDerWaalsContact O-CB 3.25Å; T102-M106 WeakPolarHBondContact O-CB 3.42Å; T102-M106 PolarHBondContact O-N 3.24Å; V103-M106 PolarHBondContact O-N 3.1Å; M106-S110 WeakPolarHBondContact O-CB 3.48Å; M106-S110 PolarHBondContact O-N 2.67Å
107S81.5Confident81Confident72 Ų7284.5 Ų84.550%0.50349%0.489SS..Hα-helixtrans-66.6-39.8176.268.80000111.7V103 C104 S110 G111V103-S107 WeakPolarHBondContact O-CB 3.49Å; V103-S107 PolarHBondContact O-N 2.79Å; V103-S107 PolarHBondContact O-OG 3.33Å; C104-S107 PolarHBondContact O-OG 3.26Å; S107-S110 PolarHBondContact O-N 3.09Å; S107-G111 PolarHBondContact O-N 2.92Å
108G88.9Confident81.6Confident43 Ų4382.4 Ų82.444%0.44348%0.484SS..Hα-helixtrans-61.2-47.8174.800000112.9C104 L105 S110 G111 F112C104-G108 PolarHBondContact O-N 2.9Å; L105-G108 PolarHBondContact O-N 3.12Å; G108-S110 VanDerWaalsContact C-N 3.35Å; G108-S110 PolarHBondContact O-N 3.16Å; G108-G111 PolarHBondContact O-N 2.86Å; G108-F112 WeakPolarHBondContact O-CB 3.18Å; G108-F112 PolarHBondContact O-N 2.81Å
109I86.4Confident82.2Confident122 Ų12287.4 Ų87.463%0.62650%0.498SS*.Hα-helixtrans-62.5-43.4176.9-65.7163.6000110.6L105 F112 A113L105-I109 WeakPolarHBondContact O-CD1 3.09Å; L105-I109 VanDerWaalsContact O-CG1 3.26Å; L105-I109 WeakPolarHBondContact O-CG1 3.48Å; L105-I109 PolarHBondContact O-N 3.3Å; I109-F112 PolarHBondContact O-N 3.07Å; I109-A113 VanDerWaalsContact O-CB 3.29Å; I109-A113 WeakPolarHBondContact O-CB 2.9Å; I109-A113 PolarHBondContact O-N 3.43Å
110S82.4Confident81.8Confident50 Ų5086 Ų8635%0.3549%0.486SS..Hα-helixtrans-62.4-45177.3-172.40000111.8M106 S107 G108 A113 L114M106-S110 WeakPolarHBondContact O-CB 3.48Å; M106-S110 PolarHBondContact O-N 2.67Å; S107-S110 PolarHBondContact O-N 3.09Å; G108-S110 VanDerWaalsContact C-N 3.35Å; G108-S110 PolarHBondContact O-N 3.16Å; S110-A113 PolarHBondContact O-N 3.06Å; S110-L114 PolarHBondContact O-N 3.23Å
111G85.5Confident81.3Confident34 Ų3480.5 Ų80.535%0.35146%0.458SS..Hα-helixtrans-65.3-41.6178.300000112.8S107 G108 L114 T115S107-G111 PolarHBondContact O-N 2.92Å; G108-G111 PolarHBondContact O-N 2.86Å; G111-L114 PolarHBondContact O-N 3.48Å; G111-T115 WeakPolarHBondContact O-CB 2.83Å; G111-T115 PolarHBondContact O-N 3.43Å; G111-T115 PolarHBondContact O-OG1 3.01Å
112F88.3Confident80.8Confident136 Ų13681.8 Ų81.860%0.59646%0.455SS*.Hα-helixtrans-63.7-44.6175-177.4-100.5000111.6G108 I109 L114 T115 M116G108-F112 WeakPolarHBondContact O-CB 3.18Å; G108-F112 PolarHBondContact O-N 2.81Å; I109-F112 PolarHBondContact O-N 3.07Å; F112-L114 PolarHBondContact O-N 3.21Å; F112-T115 PolarHBondContact O-N 2.98Å; F112-M116 HydrophobicContact CD1-CG 4.36Å; F112-M116 HydrophobicContact CE1-CG 3.92Å; F112-M116 HydrophobicContact CE2-CE 3.9Å; F112-M116 HydrophobicContact CE2-CG 4.33Å; F112-M116 HydrophobicContact CZ-CE 3.68Å; F112-M116 HydrophobicContact CZ-CG 3.91Å; F112-M116 WeakPolarHBondContact O-CB 3.42Å; F112-M116 PolarHBondContact O-N 2.92Å
113A82.8Confident80.3Confident48 Ų4882.6 Ų82.640%0.39745%0.453SS..Hα-helixtrans-60.8-42.8176.200000111.9I109 S110 L117I109-A113 VanDerWaalsContact O-CB 3.29Å; I109-A113 WeakPolarHBondContact O-CB 2.9Å; I109-A113 PolarHBondContact O-N 3.43Å; S110-A113 PolarHBondContact O-N 3.06Å; A113-L117 VanDerWaalsContact O-CB 3.25Å; A113-L117 WeakPolarHBondContact O-CB 3.43Å; A113-L117 PolarHBondContact O-N 3.46Å
114L81Confident79.5Confident89 Ų8981.3 Ų81.347%0.46644%0.443SS..Hα-helixtrans-61.2-47.1175.2-121.673.8000111.8S110 G111 F112 L117 C118S110-L114 PolarHBondContact O-N 3.23Å; G111-L114 PolarHBondContact O-N 3.48Å; F112-L114 PolarHBondContact O-N 3.21Å; L114-L117 PolarHBondContact O-N 3.15Å; L114-C118 PolarHBondContact O-N 3.42Å; L114-C118 PolarHBondContact O-SG 2.89Å
115T84.9Confident78.4Confident92 Ų9284.4 Ų84.456%0.56444%0.442SS*.Hα-helixtrans-62-48.1-179.3-55.50000110.9G111 F112 L117 C118 W119G111-T115 WeakPolarHBondContact O-CB 2.83Å; G111-T115 PolarHBondContact O-N 3.43Å; G111-T115 PolarHBondContact O-OG1 3.01Å; F112-T115 PolarHBondContact O-N 2.98Å; T115-L117 VanDerWaalsContact C-N 3.28Å; T115-L117 PolarHBondContact O-N 2.88Å; T115-C118 PolarHBondContact O-N 2.9Å; T115-W119 PolarHBondContact O-N 3.07Å
116M84.4Confident77.4Confident89 Ų8981.7 Ų81.744%0.43842%0.424SS..Hα-helixtrans-60.8-38.7175.1-80.4-67.1165.100111.9F112 W119 M120F112-M116 HydrophobicContact CD1-CG 4.36Å; F112-M116 HydrophobicContact CE1-CG 3.92Å; F112-M116 HydrophobicContact CE2-CE 3.9Å; F112-M116 HydrophobicContact CE2-CG 4.33Å; F112-M116 HydrophobicContact CZ-CE 3.68Å; F112-M116 HydrophobicContact CZ-CG 3.91Å; F112-M116 WeakPolarHBondContact O-CB 3.42Å; F112-M116 PolarHBondContact O-N 2.92Å; M116-W119 PolarHBondContact O-N 2.77Å; M116-M120 WeakPolarHBondContact O-CB 3.27Å; M116-M120 WeakPolarHBondContact O-CG 3.3Å; M116-M120 PolarHBondContact O-N 3.06Å
117L79.2Confident76.4Confident29 Ų2977.9 Ų77.915%0.15241%0.406CS..Hα-helixtrans-67.2-42.8177-170.9140.3000112.1K75 L76 T79 A113 L114 T115 W119 M120 S121K75-L117 HydrophobicContact CB-CD1 4.14Å; L76-L117 HydrophobicContact CD2-CD2 4.46Å; T79-L117 HydrophobicContact CG2-CD1 3.64Å; A113-L117 VanDerWaalsContact O-CB 3.25Å; A113-L117 WeakPolarHBondContact O-CB 3.43Å; A113-L117 PolarHBondContact O-N 3.46Å; L114-L117 PolarHBondContact O-N 3.15Å; T115-L117 VanDerWaalsContact C-N 3.28Å; T115-L117 PolarHBondContact O-N 2.88Å; L117-W119 VanDerWaalsContact C-N 3.34Å; L117-W119 PolarHBondContact O-N 2.92Å; L117-M120 PolarHBondContact O-N 3.4Å; L117-S121 VanDerWaalsContact O-CB 3.29Å; L117-S121 WeakPolarHBondContact O-CB 3.11Å; L117-S121 PolarHBondContact O-N 2.92Å; L117-S121 PolarHBondContact O-OG 2.89Å
118C76Confident75.4Confident82 Ų8274.6 Ų74.655%0.55438%0.382SS*.Hα-helixtrans-59.9-44.4174-78.30000111.5L114 T115 S121 Y122L114-C118 PolarHBondContact O-N 3.42Å; L114-C118 PolarHBondContact O-SG 2.89Å; T115-C118 PolarHBondContact O-N 2.9Å; C118-S121 WeakPolarHBondContact O-CB 3.42Å; C118-S121 PolarHBondContact O-N 2.86Å; C118-Y122 PolarHBondContact O-N 3.37Å
119W80.2Confident73.8Confident181 Ų18172.6 Ų72.669%0.68636%0.361SS*.Hα-helixtrans-60.6-48.5176.8-168.7-85.5000112.1T115 M116 L117 S121 Y122 F123T115-W119 PolarHBondContact O-N 3.07Å; M116-W119 PolarHBondContact O-N 2.77Å; L117-W119 VanDerWaalsContact C-N 3.34Å; L117-W119 PolarHBondContact O-N 2.92Å; W119-S121 VanDerWaalsContact C-N 3.3Å; W119-S121 PolarHBondContact O-N 3.44Å; W119-Y122 WeakPolarHBondContact O-CB 3.48Å; W119-Y122 PolarHBondContact O-N 2.85Å; W119-F123 PolarHBondContact O-N 3.49Å
120M67.9Low72.6Confident66 Ų6667.6 Ų67.633%0.32534%0.336SS..Hα-helixtrans-63.2-38.8177-67.7-71.1149.200111.4M116 L117 Y122 F123 F124M116-M120 WeakPolarHBondContact O-CB 3.27Å; M116-M120 WeakPolarHBondContact O-CG 3.3Å; M116-M120 PolarHBondContact O-N 3.06Å; L117-M120 PolarHBondContact O-N 3.4Å; M120-Y122 VanDerWaalsContact C-N 3.34Å; M120-Y122 PolarHBondContact O-N 3.36Å; M120-F123 WeakPolarHBondContact O-CB 3.22Å; M120-F123 PolarHBondContact O-N 3.14Å; M120-F123 VanDerWaalsContact O-N 3.16Å; M120-F124 HydrophobicContact CB-CD2 4.47Å; M120-F124 HydrophobicContact CB-CE2 4.04Å; M120-F124 WeakPolarHBondContact O-CD2 3.36Å; M120-F124 WeakPolarHBondContact O-CG 3.38Å; M120-F124 PolarHBondContact O-N 2.92Å
121S66.6Low71.8Confident16 Ų1665.6 Ų65.611%0.11232%0.321CS..Hα-helixtrans-62.7-40.6176.2-600000112.1L117 C118 W119 F123 F124 R125L117-S121 VanDerWaalsContact O-CB 3.29Å; L117-S121 WeakPolarHBondContact O-CB 3.11Å; L117-S121 PolarHBondContact O-N 2.92Å; L117-S121 PolarHBondContact O-OG 2.89Å; C118-S121 WeakPolarHBondContact O-CB 3.42Å; C118-S121 PolarHBondContact O-N 2.86Å; W119-S121 VanDerWaalsContact C-N 3.3Å; W119-S121 PolarHBondContact O-N 3.44Å; S121-F123 VanDerWaalsContact C-N 3.32Å; S121-F124 PolarHBondContact O-N 3.45Å; S121-R125 WeakPolarHBondContact O-CG 3.28Å; S121-R125 PolarHBondContact O-N 3.36Å
122Y71.3Confident70.7Confident148 Ų14865.2 Ų65.258%0.5831%0.309SS*.Hα-helixtrans-62.8-40.8173.3179.9-103.3000111.6C118 W119 M120 R125C118-Y122 PolarHBondContact O-N 3.37Å; W119-Y122 WeakPolarHBondContact O-CB 3.48Å; W119-Y122 PolarHBondContact O-N 2.85Å; M120-Y122 VanDerWaalsContact C-N 3.34Å; M120-Y122 PolarHBondContact O-N 3.36Å; Y122-R125 PolarHBondContact O-N 3.48Å
123F68Low69.3Low83 Ų8359.6 Ų59.636%0.36429%0.285SS..Hα-helixtrans-63.9-44.5176.6-170.9-102.6000112.4W119 M120 S121 R125 R126 L127 F175W119-F123 PolarHBondContact O-N 3.49Å; M120-F123 WeakPolarHBondContact O-CB 3.22Å; M120-F123 PolarHBondContact O-N 3.14Å; M120-F123 VanDerWaalsContact O-N 3.16Å; S121-F123 VanDerWaalsContact C-N 3.32Å; F123-R125 VanDerWaalsContact C-N 3.32Å; F123-R125 PolarHBondContact O-N 2.69Å; F123-R126 PolarHBondContact O-N 3.21Å; F123-L127 HydrophobicContact CD1-CD1 3.91Å; F123-L127 HydrophobicContact CD1-CG 4.32Å; F123-L127 HydrophobicContact CE1-CD1 3.69Å; F123-L127 HydrophobicContact CE1-CD2 4.15Å; F123-L127 HydrophobicContact CE1-CG 4.06Å; F123-L127 HydrophobicContact CZ-CD2 4.32Å; F123-L127 PolarHBondContact O-N 3.16Å; F123-F175 HydrophobicContact CZ-CE1 4.41Å
124F62.3Low68.1Low22 Ų2257.7 Ų57.710%0.09627%0.268CS..Hα-helixtrans-62.4-36178.8-70.3-55000113.3F68 M120 S121 R126 L127F68-F124 HydrophobicContact CB-CD1 4.48Å; F68-F124 HydrophobicContact CB-CE1 3.99Å; F68-F124 AromaticContact CD1-CE1 3.52Å; F68-F124 HydrophobicContact CD1-CE1 3.52Å; F68-F124 HydrophobicContact CD1-CZ 4.14Å; F68-F124 HydrophobicContact CE1-CE1 4.31Å; F68-F124 HydrophobicContact CG-CE1 4.04Å; M120-F124 HydrophobicContact CB-CD2 4.47Å; M120-F124 HydrophobicContact CB-CE2 4.04Å; M120-F124 WeakPolarHBondContact O-CD2 3.36Å; M120-F124 WeakPolarHBondContact O-CG 3.38Å; M120-F124 PolarHBondContact O-N 2.92Å; S121-F124 PolarHBondContact O-N 3.45Å; F124-R126 PolarHBondContact O-N 3.04Å; F124-R126 VanDerWaalsContact O-N 3.15Å; F124-L127 HydrophobicContact CD1-CD1 3.98Å; F124-L127 HydrophobicContact CE1-CD1 4.42Å; F124-L127 PolarHBondContact O-N 3.08Å
125R61Low66.9Low155 Ų15558.6 Ų58.659%0.58527%0.27SS*.Hα-helixtrans-61.1-21.8174.5-71.1174.8-172.7-155.81.8113S121 Y122 F123S121-R125 WeakPolarHBondContact O-CG 3.28Å; S121-R125 PolarHBondContact O-N 3.36Å; Y122-R125 PolarHBondContact O-N 3.48Å; F123-R125 VanDerWaalsContact C-N 3.32Å; F123-R125 PolarHBondContact O-N 2.69Å
126R63.7Low65.2Low58 Ų5857.4 Ų57.422%0.21927%0.266CS..THydrogen-bonded Turntrans-98-5.6-177.3-145.9164.9166.7-164.5-7.4113.7F123 F124 T186 Y188F123-R126 PolarHBondContact O-N 3.21Å; F124-R126 PolarHBondContact O-N 3.04Å; F124-R126 VanDerWaalsContact O-N 3.15Å; R126-T186 WeakPolarHBondContact CG-O 3.45Å; R126-T186 PolarHBondContact NE-O 2.96Å; R126-T186 PolarHBondContact NE-OG1 3.45Å; R126-T186 VanDerWaalsContact NE-OG1 3.12Å; R126-T186 PolarHBondContact NH2-OG1 3.44Å; R126-Y188 HydrophobicContact CB-CD2 4.09Å; R126-Y188 VanDerWaalsContact CD-CE2 3.43Å; R126-Y188 HydrophobicContact CG-CD2 3.57Å; R126-Y188 HydrophobicContact CG-CE2 3.79Å; R126-Y188 PolarHBondContact NH2-OH 2.92Å; R126-Y188 PolarHBondContact O-N 3.37Å
127L62Low63.7Low21 Ų2154.6 Ų54.611%0.1126%0.26CS..BIsolated β-bridgetrans-88.1131.8177.6-73.3173.5000111.7F123 F124F123-L127 HydrophobicContact CD1-CD1 3.91Å; F123-L127 HydrophobicContact CD1-CG 4.32Å; F123-L127 HydrophobicContact CE1-CD1 3.69Å; F123-L127 HydrophobicContact CE1-CD2 4.15Å; F123-L127 HydrophobicContact CE1-CG 4.06Å; F123-L127 HydrophobicContact CZ-CD2 4.32Å; F123-L127 PolarHBondContact O-N 3.16Å; F124-L127 HydrophobicContact CD1-CD1 3.98Å; F124-L127 HydrophobicContact CE1-CD1 4.42Å; F124-L127 PolarHBondContact O-N 3.08Å
128V61.3Low62.4Low3 Ų356.7 Ų56.72%0.01827%0.274CS..EExtended strand (participates in β ladder)trans-99.5136173175.10000109.1L131 V142 H144 F187 Y188 V189V128-L131 HydrophobicContact CG1-CD1 3.28Å; V128-V142 HydrophobicContact CB-CG1 4.04Å; V128-V142 HydrophobicContact CG1-CG1 3.22Å; V128-V142 HydrophobicContact CG2-CG1 3.64Å; V128-H144 VanDerWaalsContact CG2-CE1 3.48Å; V128-H144 WeakPolarHBondContact CG2-CE1 2.96Å; V128-F187 HydrophobicContact CG2-CB 3.61Å; V128-F187 HydrophobicContact CG2-CD1 4.48Å; V128-F187 HydrophobicContact CG2-CG 4.29Å; V128-Y188 PolarHBondContact N-O 3.04Å; V128-V189 HydrophobicContact CB-CG2 3.81Å; V128-V189 HydrophobicContact CG1-CG2 3.92Å; V128-V189 HydrophobicContact CG2-CG2 4.06Å
129G53.9Low61.3Low0 Ų056.8 Ų56.80%027%0.267CS..EExtended strand (participates in β ladder)trans-125.4-14176.400000117.8F62 A143F62-G129 WeakPolarHBondContact CB-O 3.38Å; F62-G129 PolarHBondContact N-O 3.48Å; G129-A143 PolarHBondContact N-O 3.45Å
130I61.4Low60.2Low17 Ų1748.2 Ų48.29%0.08724%0.235CC..EExtended strand (participates in β ladder)trans-138.7124.7173.5-45.6175.7000108.6M58 Y132 A143M58-I130 HydrophobicContact CE-CG2 4.06Å; I130-Y132 HydrophobicContact CB-CE2 4.06Å; I130-Y132 HydrophobicContact CG2-CD2 4.1Å; I130-Y132 HydrophobicContact CG2-CE1 4.39Å; I130-Y132 HydrophobicContact CG2-CE2 3.49Å; I130-Y132 VanDerWaalsContact CG2-CE2 3.49Å; I130-A143 HydrophobicContact CB-CB 3.7Å; I130-A143 HydrophobicContact CG1-CB 4.3Å; I130-A143 PolarHBondContact N-O 3.25Å; I130-A143 PolarHBondContact O-N 3.41Å
131L65.7Low59.8Low8 Ų847.7 Ų47.74%0.04223%0.229CC..EExtended strand (participates in β ladder)trans-106.9124.4173.9-104.672.8000107.8Y60 V128 L140 R141 V142 I178 V189Y60-L131 HydrophobicContact CD1-CB 4.25Å; Y60-L131 PolarHBondContact O-N 2.92Å; V128-L131 HydrophobicContact CG1-CD1 3.28Å; L131-L140 HydrophobicContact CD2-CD1 3.95Å; L131-L140 HydrophobicContact CD2-CD2 4.08Å; L131-L140 HydrophobicContact CD2-CG 4.33Å; L131-L140 HydrophobicContact CG-CD1 4.45Å; L131-L140 HydrophobicContact CG-CD2 4.13Å; L131-L140 HydrophobicContact CG-CG 4.36Å; L131-R141 WeakPolarHBondContact CA-O 3.29Å; L131-V142 HydrophobicContact CD1-CG1 4.19Å; L131-I178 HydrophobicContact CD2-CD1 4.23Å; L131-V189 HydrophobicContact CD1-CG2 4.11Å
132Y62.9Low59.5Low26 Ų2647 Ų4710%0.10222%0.224CC..EExtended strand (participates in β ladder)trans-110.3139.7166.3-47.7-107.6000109.3M58 I130 L140 R141 A143 R151M58-Y132 HydrophobicContact CE-CD1 4.4Å; M58-Y132 HydrophobicContact CE-CE1 3.31Å; M58-Y132 VanDerWaalsContact CE-CZ 3.45Å; M58-Y132 WeakPolarHBondContact CE-OH 3.35Å; M58-Y132 HydrophobicContact CG-CD1 3.56Å; M58-Y132 HydrophobicContact CG-CE1 3.36Å; M58-Y132 HydrophobicContact SD-CE1 4.13Å; I130-Y132 HydrophobicContact CB-CE2 4.06Å; I130-Y132 HydrophobicContact CG2-CD2 4.1Å; I130-Y132 HydrophobicContact CG2-CE1 4.39Å; I130-Y132 HydrophobicContact CG2-CE2 3.49Å; I130-Y132 VanDerWaalsContact CG2-CE2 3.49Å; Y132-L140 CarbonylContact O-C 3.51Å; Y132-L140 WeakPolarHBondContact O-CA 3.31Å; Y132-R141 HydrophobicContact CD2-CB 4.03Å; Y132-R141 HydrophobicContact CD2-CG 4.08Å; Y132-R141 HydrophobicContact CG-CB 4.36Å; Y132-R141 PolarHBondContact N-O 3.42Å; Y132-R141 PolarHBondContact O-N 3.33Å; Y132-A143 HydrophobicContact CE2-CB 4.33Å; Y132-R151 VanDerWaalsContact OH-CZ 3.3Å; Y132-R151 PolarHBondContact OH-NH2 3.42Å
133L59Low58.9Low18 Ų1840 Ų409%0.09420%0.197CC..EExtended strand (participates in β ladder)trans-110.2135171.6-87.5143.6000108.2W57 F59 L140 L158 V205W57-L133 PolarHBondContact N-O 3.27Å; W57-L133 PolarHBondContact O-N 3.07Å; F59-L133 HydrophobicContact CB-CD1 4.02Å; F59-L133 HydrophobicContact CD1-CD1 3.82Å; F59-L133 HydrophobicContact CG-CD1 4.08Å; L133-L140 HydrophobicContact CD1-CD1 4.45Å; L133-L140 HydrophobicContact CD2-CD1 3.96Å; L133-L140 HydrophobicContact CG-CD1 4Å; L133-L158 HydrophobicContact CD2-CD1 4.47Å; L133-V205 HydrophobicContact CD2-CG2 4.41Å
134N58.2Low58.4Low8 Ų836.9 Ų36.94%0.04318%0.184CC..  trans-71.4147.6166.2-1674.2000109.8E54 F56 S136 G137 M139E54-N134 PolarHBondContact OE1-ND2 3.19Å; E54-N134 PolarHBondContact OE2-ND2 3.05Å; F56-N134 HydrophobicContact CD1-CB 4.44Å; F56-N134 HydrophobicContact CE1-CB 4.26Å; N134-S136 PolarHBondContact ND2-OG 3.14Å; N134-S136 VanDerWaalsContact ND2-OG 3.07Å; N134-S136 PolarHBondContact O-N 3.12Å; N134-S136 VanDerWaalsContact O-N 3.15Å; N134-G137 PolarHBondContact O-N 3.24Å; N134-M139 HydrophobicContact CB-CB 4.09Å; N134-M139 PolarHBondContact N-O 2.83Å
135E54.7Low58Low108 Ų10837.2 Ų37.251%0.50519%0.187SC..THydrogen-bonded Turntrans-57.9-28.5179.6-77.6-176.7168.400112.7K55 W57 G137K55-E135 HydrophobicContact CB-CG 4.44Å; K55-E135 VanDerWaalsContact CB-OE1 3.26Å; K55-E135 WeakPolarHBondContact CB-OE1 3.42Å; K55-E135 WeakPolarHBondContact O-CG 3.26Å; W57-E135 VanDerWaalsContact CD1-OE1 3.26Å; W57-E135 PolarHBondContact NE1-OE1 2.69Å; E135-G137 PolarHBondContact O-N 3.05Å
136S49.6Very low57.7Low68 Ų6831.3 Ų31.348%0.47617%0.169SC..THydrogen-bonded Turntrans-75.6-7176.758.30000113.9N134 T138N134-S136 PolarHBondContact ND2-OG 3.14Å; N134-S136 VanDerWaalsContact ND2-OG 3.07Å; N134-S136 PolarHBondContact O-N 3.12Å; N134-S136 VanDerWaalsContact O-N 3.15Å; S136-T138 PolarHBondContact O-N 2.88Å; S136-T138 VanDerWaalsContact O-N 3.12Å; S136-T138 PolarHBondContact OG-OG1 3.49Å
137G53.3Low57Low30 Ų3031.6 Ų31.631%0.30917%0.172SC..SBendtrans64.112.7-176.500000113.7N134 E135 L158N134-G137 PolarHBondContact O-N 3.24Å; E135-G137 PolarHBondContact O-N 3.05Å; G137-L158 WeakPolarHBondContact O-CB 3.15Å; G137-L158 WeakPolarHBondContact O-CD2 3.31Å
138T50.9Low56.6Low73 Ų7338.7 Ų38.745%0.44820%0.197SC..SBendtrans-94.8-23.6-175.458.10000113.3S136 L158S136-T138 PolarHBondContact O-N 2.88Å; S136-T138 VanDerWaalsContact O-N 3.12Å; S136-T138 PolarHBondContact OG-OG1 3.49Å; T138-L158 PolarHBondContact O-N 2.92Å
139M52.8Low56.1Low83 Ų8339.2 Ų39.241%0.40920%0.203SC..EExtended strand (participates in β ladder)trans-131126.4-173.7-65.5-68.9177.900110.9N134 P157N134-M139 HydrophobicContact CB-CB 4.09Å; N134-M139 PolarHBondContact N-O 2.83Å; M139-P157 HydrophobicContact SD-CB 4.15Å; M139-P157 HydrophobicContact SD-CG 4.39Å
140L57.3Low55.8Low2 Ų248.4 Ų48.41%0.0124%0.238CC..EExtended strand (participates in β ladder)trans-109.7106.8175.3-169.9117.6000108.1L131 Y132 L133 V142 C156 L158 V161 I178L131-L140 HydrophobicContact CD2-CD1 3.95Å; L131-L140 HydrophobicContact CD2-CD2 4.08Å; L131-L140 HydrophobicContact CD2-CG 4.33Å; L131-L140 HydrophobicContact CG-CD1 4.45Å; L131-L140 HydrophobicContact CG-CD2 4.13Å; L131-L140 HydrophobicContact CG-CG 4.36Å; Y132-L140 CarbonylContact O-C 3.51Å; Y132-L140 WeakPolarHBondContact O-CA 3.31Å; L133-L140 HydrophobicContact CD1-CD1 4.45Å; L133-L140 HydrophobicContact CD2-CD1 3.96Å; L133-L140 HydrophobicContact CG-CD1 4Å; L140-V142 HydrophobicContact CD2-CG2 3.35Å; L140-V142 HydrophobicContact CG-CG2 4.37Å; L140-V142 PolarHBondContact O-N 3.49Å; L140-C156 CarbonylContact C-O 3.46Å; L140-C156 WeakPolarHBondContact CA-O 3.47Å; L140-C156 PolarHBondContact N-O 3.19Å; L140-C156 CarbonylContact O-C 3.51Å; L140-C156 WeakPolarHBondContact O-CA 3.25Å; L140-C156 WeakPolarHBondContact O-CB 3.47Å; L140-C156 PolarHBondContact O-N 3.3Å; L140-L158 HydrophobicContact CB-CD1 4.08Å; L140-L158 HydrophobicContact CD1-CD1 3.78Å; L140-V161 HydrophobicContact CD2-CG2 4.49Å; L140-I178 HydrophobicContact CD2-CD1 4.43Å
141R60.1Low55.4Low55 Ų5554.1 Ų54.121%0.20826%0.258CS..EExtended strand (participates in β ladder)trans-82.6117174.5-172-178.2176.3159.13108L131 Y132 D153 Y155L131-R141 WeakPolarHBondContact CA-O 3.29Å; Y132-R141 HydrophobicContact CD2-CB 4.03Å; Y132-R141 HydrophobicContact CD2-CG 4.08Å; Y132-R141 HydrophobicContact CG-CB 4.36Å; Y132-R141 PolarHBondContact N-O 3.42Å; Y132-R141 PolarHBondContact O-N 3.33Å; R141-D153 HydrophobicContact CG-CB 4.31Å; R141-D153 IonicContact CZ-OD2 3.45Å; R141-D153 IonicContact NE-OD1 3.76Å; R141-D153 IonicContact NE-OD2 3.5Å; R141-D153 PolarHBondContact NE-OD2 3.28Å; R141-D153 VanDerWaalsContact NH2-CG 3.33Å; R141-D153 IonicContact NH2-OD2 2.67Å; R141-D153 PolarHBondContact NH2-OD2 2.89Å; R141-Y155 HydrophobicContact CB-CD1 4.46Å; R141-Y155 HydrophobicContact CG-CD1 4.19Å; R141-Y155 HydrophobicContact CG-CE1 4.1Å; R141-Y155 PolarHBondContact NH1-OH 2.96Å
142V61Low54.6Low1 Ų159.4 Ų59.41%0.00628%0.283CS..EExtended strand (participates in β ladder)trans-102.6106.2177.4-168.10000107.6V128 L131 L140 H144 T154 C156V128-V142 HydrophobicContact CB-CG1 4.04Å; V128-V142 HydrophobicContact CG1-CG1 3.22Å; V128-V142 HydrophobicContact CG2-CG1 3.64Å; L131-V142 HydrophobicContact CD1-CG1 4.19Å; L140-V142 HydrophobicContact CD2-CG2 3.35Å; L140-V142 HydrophobicContact CG-CG2 4.37Å; L140-V142 PolarHBondContact O-N 3.49Å; V142-H144 WeakPolarHBondContact CB-NE2 3.45Å; V142-H144 WeakPolarHBondContact CG1-CE1 3.44Å; V142-H144 WeakPolarHBondContact CG1-NE2 3.36Å; V142-H144 PolarHBondContact O-CD2 3.01Å; V142-H144 PolarHBondContact O-N 3.16Å; V142-T154 PolarHBondContact N-O 3.24Å; V142-T154 PolarHBondContact O-N 2.98Å; V142-C156 HydrophobicContact CG2-CB 4.31Å
143A57.5Low54.1Low2 Ų260.2 Ų60.22%0.01729%0.289CS..EExtended strand (participates in β ladder)trans-75.2111.1168.300000108.3G129 I130 Y132 R151 D153G129-A143 PolarHBondContact N-O 3.45Å; I130-A143 HydrophobicContact CB-CB 3.7Å; I130-A143 HydrophobicContact CG1-CB 4.3Å; I130-A143 PolarHBondContact N-O 3.25Å; I130-A143 PolarHBondContact O-N 3.41Å; Y132-A143 HydrophobicContact CE2-CB 4.33Å; A143-R151 HydrophobicContact CB-CG 4.39Å; A143-D153 WeakPolarHBondContact CB-OD1 3.42Å
144H57.3Low54Low16 Ų1661.7 Ų61.77%0.07430%0.299CS..EExtended strand (participates in β ladder)trans-92.1145.7170-62.8-80.6000109.3V128 V142 S146 Q152 T154 F187V128-H144 VanDerWaalsContact CG2-CE1 3.48Å; V128-H144 WeakPolarHBondContact CG2-CE1 2.96Å; V142-H144 WeakPolarHBondContact CB-NE2 3.45Å; V142-H144 WeakPolarHBondContact CG1-CE1 3.44Å; V142-H144 WeakPolarHBondContact CG1-NE2 3.36Å; V142-H144 PolarHBondContact O-CD2 3.01Å; V142-H144 PolarHBondContact O-N 3.16Å; H144-S146 PolarHBondContact O-N 2.69Å; H144-Q152 PolarHBondContact N-O 2.91Å; H144-Q152 PolarHBondContact O-N 3.39Å; H144-T154 PolarHBondContact CD2-OG1 2.9Å; H144-F187 AromaticContact CE1-CD1 3.02Å; H144-F187 WeakPolarHBondContact CE1-CD1 3.31Å; H144-F187 AromaticContact CE1-CE1 3.11Å; H144-F187 WeakPolarHBondContact CE1-CE1 3.44Å; H144-F187 AromaticContact CE1-CG 3.49Å; H144-F187 VanDerWaalsContact CE1-CG 3.49Å; H144-F187 WeakPolarHBondContact CE1-CG 3.41Å; H144-F187 AromaticContact CE1-CZ 3.67Å; H144-F187 AromaticContact ND1-CD1 3.62Å; H144-F187 AromaticContact ND1-CE1 3.69Å; H144-F187 AromaticContact NE2-CD1 3.88Å; H144-F187 AromaticContact NE2-CE1 3.56Å; H144-F187 AromaticContact NE2-CZ 3.67Å
145L55.3Low53.7Low30 Ų3067.8 Ų67.816%0.15732%0.322CS..EExtended strand (participates in β ladder)trans-78.1118.3170.6-158.664.1000107.9I65I65-L145 HydrophobicContact CD1-CB 3.86Å; I65-L145 HydrophobicContact CD1-CD1 3.99Å; I65-L145 HydrophobicContact CD1-CG 4.32Å; I65-L145 HydrophobicContact CG1-CB 4.25Å; I65-L145 HydrophobicContact CG1-CD1 3.98Å; I65-L145 HydrophobicContact CG1-CD2 3.99Å; I65-L145 HydrophobicContact CG1-CG 4.29Å
146S53.6Low53.3Low30 Ų3062.8 Ų62.821%0.2130%0.299CS..PPolyproline II helixtrans-68.7152.8166.570.40000109.9H144 W148 G149 W150H144-S146 PolarHBondContact O-N 2.69Å; S146-W148 PolarHBondContact O-N 3.38Å; S146-G149 PolarHBondContact O-N 2.84Å; S146-W150 VanDerWaalsContact CB-O 3.31Å; S146-W150 WeakPolarHBondContact CB-O 3.27Å; S146-W150 PolarHBondContact N-O 3.5Å; S146-W150 VanDerWaalsContact OG-C 3.29Å; S146-W150 WeakPolarHBondContact OG-CA 3.23Å; S146-W150 WeakPolarHBondContact OG-CB 3.44Å; S146-W150 PolarHBondContact OG-N 3.39Å; S146-W150 PolarHBondContact OG-O 2.96Å
147F49.4Very low53.4Low64 Ų6461.6 Ų61.628%0.28129%0.29SS..THydrogen-bonded Turntrans-44.7-24.7178.9173.3-121.3000115.2L76L76-F147 HydrophobicContact CD1-CE2 4.48Å; L76-F147 HydrophobicContact CD1-CZ 4.39Å; L76-F147 HydrophobicContact CD2-CE2 4.23Å; L76-F147 HydrophobicContact CD2-CZ 3.84Å
148W54.2Low53.1Low170 Ų17062 Ų6264%0.64429%0.285SS*.THydrogen-bonded Turntrans-99.66.4-177.2-124.9-89.1000115S146 W150S146-W148 PolarHBondContact O-N 3.38Å; W148-W150 VanDerWaalsContact C-N 3.27Å
149G50.6Low52.9Low14 Ų1462.8 Ų62.814%0.14430%0.299CS..SBendtrans69.127.7-172.100000112.7R73 S146R73-G149 PolarHBondContact NH2-O 3.29Å; S146-G149 PolarHBondContact O-N 2.84Å
150W47.4Very low52.7Low193 Ų19361.3 Ų61.373%0.73129%0.293SS*.  trans-96.3145.1164.3-9034.8000109.7S146 W148 Q152S146-W150 VanDerWaalsContact CB-O 3.31Å; S146-W150 WeakPolarHBondContact CB-O 3.27Å; S146-W150 PolarHBondContact N-O 3.5Å; S146-W150 VanDerWaalsContact OG-C 3.29Å; S146-W150 WeakPolarHBondContact OG-CA 3.23Å; S146-W150 WeakPolarHBondContact OG-CB 3.44Å; S146-W150 PolarHBondContact OG-N 3.39Å; S146-W150 PolarHBondContact OG-O 2.96Å; W148-W150 VanDerWaalsContact C-N 3.27Å; W150-Q152 PolarHBondContact O-N 3.45Å
151R52.1Low52.4Low137 Ų13762.1 Ų62.152%0.51730%0.297SS..EExtended strand (participates in β ladder)trans-73.3119.2178.7-145.6-178.9-170.51574108.2Y132 A143Y132-R151 VanDerWaalsContact OH-CZ 3.3Å; Y132-R151 PolarHBondContact OH-NH2 3.42Å; A143-R151 HydrophobicContact CB-CG 4.39Å
152Q48.7Very low52Low119 Ų11961.4 Ų61.456%0.55630%0.297SS*.EExtended strand (participates in β ladder)trans-111.4117.5170.1-84-78.3-1.900107.2H144 W150H144-Q152 PolarHBondContact N-O 2.91Å; H144-Q152 PolarHBondContact O-N 3.39Å; W150-Q152 PolarHBondContact O-N 3.45Å
153D53.9Low51.3Low44 Ų4464 Ų6424%0.23531%0.314CS..EExtended strand (participates in β ladder)trans-97110.1-178.6-67.1-45.9000109.6R141 A143R141-D153 HydrophobicContact CG-CB 4.31Å; R141-D153 IonicContact CZ-OD2 3.45Å; R141-D153 IonicContact NE-OD1 3.76Å; R141-D153 IonicContact NE-OD2 3.5Å; R141-D153 PolarHBondContact NE-OD2 3.28Å; R141-D153 VanDerWaalsContact NH2-CG 3.33Å; R141-D153 IonicContact NH2-OD2 2.67Å; R141-D153 PolarHBondContact NH2-OD2 2.89Å; A143-D153 WeakPolarHBondContact CB-OD1 3.42Å
154T55.3Low50.7Low49 Ų4966.4 Ų66.430%0.30133%0.326SS..EExtended strand (participates in β ladder)trans-97123.7173.5-55.30000108.7V142 H144V142-T154 PolarHBondContact N-O 3.24Å; V142-T154 PolarHBondContact O-N 2.98Å; H144-T154 PolarHBondContact CD2-OG1 2.9Å
155Y52.4Low50.2Low135 Ų13570.8 Ų70.853%0.52936%0.355SS..EExtended strand (participates in β ladder)trans-81.1121.1174.2-63.2-89.3000109.4R141 R180R141-Y155 HydrophobicContact CB-CD1 4.46Å; R141-Y155 HydrophobicContact CG-CD1 4.19Å; R141-Y155 HydrophobicContact CG-CE1 4.1Å; R141-Y155 PolarHBondContact NH1-OH 2.96Å; Y155-R180 PolarHBondContact O-NH2 3.5Å
156C47.3Very low49.9Very low4 Ų475.4 Ų75.43%0.02738%0.375CS..EExtended strand (participates in β ladder)trans-115.5124.7174.2-62.80000109.8L140 V142 L158 R180L140-C156 CarbonylContact C-O 3.46Å; L140-C156 WeakPolarHBondContact CA-O 3.47Å; L140-C156 PolarHBondContact N-O 3.19Å; L140-C156 CarbonylContact O-C 3.51Å; L140-C156 WeakPolarHBondContact O-CA 3.25Å; L140-C156 WeakPolarHBondContact O-CB 3.47Å; L140-C156 PolarHBondContact O-N 3.3Å; V142-C156 HydrophobicContact CG2-CB 4.31Å; C156-L158 PolarHBondContact O-N 2.95Å; C156-R180 PolarHBondContact SG-NH2 2.9Å
157P50.8Low49.5Very low42 Ų4276.4 Ų76.427%0.27338%0.38SS..EExtended strand (participates in β ladder)trans-62133.5167.3-14.928.2000109.6M139 A159 D160M139-P157 HydrophobicContact SD-CB 4.15Å; M139-P157 HydrophobicContact SD-CG 4.39Å; P157-A159 PolarHBondContact O-N 3.39Å; P157-D160 PolarHBondContact O-N 3.46Å; P157-D160 VanDerWaalsContact O-N 3.13Å
158L46.7Very low49.2Very low40 Ų4083.6 Ų83.621%0.20941%0.411CS..G310 helixtrans-64.8-28177.6-167.273.2000111.2L133 G137 T138 L140 C156 D160 V161 V205L133-L158 HydrophobicContact CD2-CD1 4.47Å; G137-L158 WeakPolarHBondContact O-CB 3.15Å; G137-L158 WeakPolarHBondContact O-CD2 3.31Å; T138-L158 PolarHBondContact O-N 2.92Å; L140-L158 HydrophobicContact CB-CD1 4.08Å; L140-L158 HydrophobicContact CD1-CD1 3.78Å; C156-L158 PolarHBondContact O-N 2.95Å; L158-D160 PolarHBondContact O-N 2.92Å; L158-V161 HydrophobicContact CD1-CB 4.39Å; L158-V161 HydrophobicContact CD1-CG2 4.39Å; L158-V161 WeakPolarHBondContact O-CB 3.39Å; L158-V161 PolarHBondContact O-N 3.4Å; L158-V205 HydrophobicContact CD1-CG1 4.26Å; L158-V205 HydrophobicContact CD2-CG1 4.21Å
159A48.4Very low48.4Very low89 Ų8981.1 Ų81.174%0.73641%0.411SS*.G310 helixtrans-60.4-24174.200000113.7P157P157-A159 PolarHBondContact O-N 3.39Å
160D47.1Very low48Very low52 Ų5290.5 Ų90.528%0.27844%0.442SS..G310 helixtrans-95.10.4177.5-76.7-21.9000113.1P157 L158 R180 Y181P157-D160 PolarHBondContact O-N 3.46Å; P157-D160 VanDerWaalsContact O-N 3.13Å; L158-D160 PolarHBondContact O-N 2.92Å; D160-R180 HydrophobicContact CB-CG 3.93Å; D160-R180 CarbonylContact O-C 3.6Å; D160-R180 WeakPolarHBondContact O-CA 3.29Å; D160-Y181 PolarHBondContact O-N 3.46Å
161V52.3Low47.8Very low19 Ų1986 Ų8612%0.11544%0.438CS..BIsolated β-bridgetrans-90112.4177.7174.90000108L140 L158 P163 I178L140-V161 HydrophobicContact CD2-CG2 4.49Å; L158-V161 HydrophobicContact CD1-CB 4.39Å; L158-V161 HydrophobicContact CD1-CG2 4.39Å; L158-V161 WeakPolarHBondContact O-CB 3.39Å; L158-V161 PolarHBondContact O-N 3.4Å; V161-P163 WeakPolarHBondContact O-CD 3.01Å; V161-P163 VanDerWaalsContact O-N 3.1Å; V161-I178 HydrophobicContact CG1-CG2 3.98Å; V161-I178 HydrophobicContact CG2-CG2 4.18Å
162I50.8Low47.2Very low39 Ų3987.5 Ų87.520%0.245%0.45CS..  trans-58.5116.3174.1-58.2179.3000108.3E166 Q179 Y181I162-E166 HydrophobicContact CG2-CB 4.22Å; I162-Q179 HydrophobicContact CD1-CB 3.99Å; I162-Q179 PolarHBondContact N-O 2.89Å; I162-Y181 HydrophobicContact CB-CE2 4.22Å; I162-Y181 HydrophobicContact CG1-CD2 3.69Å; I162-Y181 HydrophobicContact CG1-CE1 4.41Å; I162-Y181 HydrophobicContact CG1-CE2 3.5Å; I162-Y181 VanDerWaalsContact CG1-CE2 3.5Å; I162-Y181 HydrophobicContact CG1-CG 4.25Å
163P47Very low47.1Very low57 Ų5789.9 Ų89.937%0.3746%0.462SS..  trans-67.3143.7176.526.3-30.1000109.9V161 T165 E166V161-P163 WeakPolarHBondContact O-CD 3.01Å; V161-P163 VanDerWaalsContact O-N 3.1Å; P163-T165 PolarHBondContact O-N 2.93Å; P163-E166 PolarHBondContact O-N 2.99Å
164L45Very low46.7Very low51 Ų5190.3 Ų90.327%0.26746%0.463SS..THydrogen-bonded Turntrans-62.5-16.5-170.7-7593.4000114.7E166 M176 F206L164-E166 PolarHBondContact O-N 3.5Å; L164-M176 HydrophobicContact CD1-CE 3.16Å; L164-M176 HydrophobicContact CD2-CE 3.32Å; L164-M176 HydrophobicContact CD2-CG 3.74Å; L164-M176 HydrophobicContact CD2-SD 4.28Å; L164-M176 HydrophobicContact CG-CE 3.81Å; L164-F206 HydrophobicContact CD1-CB 4.34Å; L164-F206 HydrophobicContact CD1-CD1 3.26Å; L164-F206 HydrophobicContact CD1-CE1 3.86Å; L164-F206 HydrophobicContact CD1-CG 4.19Å
165T46.4Very low46.4Very low109 Ų10992.9 Ų92.967%0.66947%0.47SS*.THydrogen-bonded Turntrans-64.3-21173.433.50000113.2P163P163-T165 PolarHBondContact O-N 2.93Å
166E47.7Very low46.4Very low126 Ų12687.5 Ų87.559%0.58945%0.45SS*.THydrogen-bonded Turntrans-102.7-17.2-176-154.6174.9-179.400113.6I162 P163 L164 K168 Y181I162-E166 HydrophobicContact CG2-CB 4.22Å; P163-E166 PolarHBondContact O-N 2.99Å; L164-E166 PolarHBondContact O-N 3.5Å; E166-K168 PolarHBondContact O-N 3.28Å; E166-K168 VanDerWaalsContact O-N 3.07Å; E166-Y181 PolarHBondContact OE2-OH 3.11Å
167T46.5Very low46.8Very low52 Ų5293.5 Ų93.532%0.31947%0.472SS..  trans-80.696.6177.9-61.80000110.1D169T167-D169 HydrophobicContact CG2-CB 3.96Å; T167-D169 PolarHBondContact O-N 3.28Å
168K41.9Very low47.1Very low214 Ų21492 Ų9293%0.9346%0.462SS*.  trans-68.923.8177.7-145.9-179-172.7179.80114.3E166E166-K168 PolarHBondContact O-N 3.28Å; E166-K168 VanDerWaalsContact O-N 3.07Å
169D39.1Very low47.5Very low118 Ų11893.1 Ų93.163%0.63147%0.466SS*.SBendtrans-101.8129.1178.5-92.1-44.7000110.3T167T167-D169 HydrophobicContact CG2-CB 3.96Å; T167-D169 PolarHBondContact O-N 3.28Å
170R42.2Very low47.8Very low211 Ų21192.5 Ų92.580%0.79645%0.445SS*.  trans-41.5124.9-179.3-68.9174.1172.1170.9-3.1110.5Q172R170-Q172 HydrophobicContact CB-CG 4.26Å; R170-Q172 PolarHBondContact O-N 3.42Å
171P42.6Very low48.1Very low100 Ų10096 Ų9665%0.64946%0.455SS*.  trans-72.379.7173.531.2-32.5000107.5E173P171-E173 WeakPolarHBondContact O-CG 3.33Å; P171-E173 PolarHBondContact O-N 3.37Å
172Q40.3Very low48.1Very low167 Ų16799.5 Ų99.578%0.7848%0.48SS*.  trans-77.761.6164.2-61.4-154.9-32.900108.5R170 M174R170-Q172 HydrophobicContact CB-CG 4.26Å; R170-Q172 PolarHBondContact O-N 3.42Å; Q172-M174 PolarHBondContact O-N 3.31Å
173E46.1Very low47.9Very low169 Ų16999.8 Ų99.879%0.7949%0.493SS*.THydrogen-bonded Turntrans48.514.9135.8-85175.4-170.200122.9P171P171-E173 WeakPolarHBondContact O-CG 3.33Å; P171-E173 PolarHBondContact O-N 3.37Å
174M45.3Very low48.1Very low54 Ų54107 Ų10727%0.26652%0.518SS..THydrogen-bonded Turntrans-145.4-28.9166.5-152.9137.9172.700116.3Q172 T190 R192 Y193Q172-M174 PolarHBondContact O-N 3.31Å; M174-T190 VanDerWaalsContact O-CA 3.27Å; M174-T190 WeakPolarHBondContact O-CA 3.32Å; M174-T190 WeakPolarHBondContact O-CG2 3.49Å; M174-R192 HydrophobicContact CE-CB 4.2Å; M174-R192 HydrophobicContact CE-CG 4.46Å; M174-R192 HydrophobicContact CG-CB 4.39Å; M174-Y193 HydrophobicContact CE-CD2 4Å; M174-Y193 HydrophobicContact CE-CE2 3.21Å
175F48.3Very low48.4Very low102 Ų102110.4 Ų110.445%0.44753%0.533SS..  trans-122.5108.7-174.8-58.5-96.5000110.9F123 Y188 V189 T190F123-F175 HydrophobicContact CZ-CE1 4.41Å; F175-Y188 HydrophobicContact CB-CD1 3.97Å; F175-V189 CarbonylContact C-O 3.54Å; F175-V189 WeakPolarHBondContact CA-O 3.46Å; F175-T190 HydrophobicContact CB-CG2 4.43Å; F175-T190 HydrophobicContact CD1-CG2 3Å; F175-T190 HydrophobicContact CD2-CG2 4.46Å; F175-T190 HydrophobicContact CE1-CG2 3.1Å; F175-T190 HydrophobicContact CG-CG2 3.73Å; F175-T190 HydrophobicContact CZ-CG2 3.91Å
176M53.2Low48.9Very low22 Ų22106.9 Ų106.911%0.10851%0.511CS..EExtended strand (participates in β ladder)trans-80.8123.2174.3-161.8-170.6-167.600109.5L164 Y188 V189 L191 F202 F206L164-M176 HydrophobicContact CD1-CE 3.16Å; L164-M176 HydrophobicContact CD2-CE 3.32Å; L164-M176 HydrophobicContact CD2-CG 3.74Å; L164-M176 HydrophobicContact CD2-SD 4.28Å; L164-M176 HydrophobicContact CG-CE 3.81Å; M176-Y188 CarbonylContact O-C 3.46Å; M176-Y188 WeakPolarHBondContact O-CA 3.4Å; M176-V189 WeakPolarHBondContact CA-O 3.45Å; M176-V189 HydrophobicContact CB-CB 4.28Å; M176-V189 WeakPolarHBondContact CB-O 3.25Å; M176-V189 PolarHBondContact N-O 3.48Å; M176-V189 PolarHBondContact O-N 2.85Å; M176-L191 HydrophobicContact CB-CD1 3.81Å; M176-L191 HydrophobicContact CE-CD1 4.4Å; M176-L191 HydrophobicContact CG-CD1 4.12Å; M176-L191 HydrophobicContact SD-CD1 3.18Å; M176-L191 WeakPolarHBondContact SD-CD1 3.29Å; M176-L191 HydrophobicContact SD-CD2 4.41Å; M176-L191 HydrophobicContact SD-CG 4.4Å; M176-F202 HydrophobicContact CE-CZ 4.21Å; M176-F206 HydrophobicContact CE-CD1 3.44Å; M176-F206 VanDerWaalsContact CE-CD1 3.44Å; M176-F206 HydrophobicContact CE-CD2 4.46Å; M176-F206 HydrophobicContact CE-CE1 3.45Å; M176-F206 VanDerWaalsContact CE-CE1 3.45Å; M176-F206 HydrophobicContact CE-CG 3.92Å; M176-F206 HydrophobicContact CE-CZ 4.02Å
177R54.6Low49.6Very low130 Ų130101.4 Ų101.449%0.49149%0.485SS..EExtended strand (participates in β ladder)trans-91.4117.6178.9-69.1178.5-172.2-163.4-7.2109.7F187 Y188R177-F187 CarbonylContact C-O 3.6Å; R177-F187 VanDerWaalsContact CA-O 3.3Å; R177-F187 WeakPolarHBondContact CA-O 3.48Å; R177-Y188 HydrophobicContact CG-CD1 3.64Å; R177-Y188 HydrophobicContact CG-CE1 3.45Å; R177-Y188 VanDerWaalsContact CG-CE1 3.45Å; R177-Y188 PolarHBondContact NH2-OH 3.35Å; R177-Y188 VanDerWaalsContact NH2-OH 3.14Å
178I57.3Low50.4Low11 Ų11100.4 Ų100.46%0.05648%0.476CS..EExtended strand (participates in β ladder)trans-92.3111166.3-60.9179.2000106.7L131 L140 V161 F187 V189L131-I178 HydrophobicContact CD2-CD1 4.23Å; L140-I178 HydrophobicContact CD2-CD1 4.43Å; V161-I178 HydrophobicContact CG1-CG2 3.98Å; V161-I178 HydrophobicContact CG2-CG2 4.18Å; I178-F187 HydrophobicContact CB-CB 4.36Å; I178-F187 PolarHBondContact N-O 3.01Å; I178-F187 PolarHBondContact O-N 2.91Å; I178-V189 HydrophobicContact CD1-CG2 3.52Å; I178-V189 HydrophobicContact CG1-CG2 4.02Å
179Q56.6Low51.3Low64 Ų6490.4 Ų90.430%0.29943%0.433SS..EExtended strand (participates in β ladder)trans-101.2131.9172.2-51.4-160.346.500108.5I162 T186I162-Q179 HydrophobicContact CD1-CB 3.99Å; I162-Q179 PolarHBondContact N-O 2.89Å; Q179-T186 HydrophobicContact CG-CG2 3.97Å
180R54.6Low52.1Low75 Ų7585.1 Ų85.128%0.28341%0.405SS..BIsolated β-bridgetrans-83.5130.7173.5-169.5-177-91.2-167.6-7.8109.4Y155 C156 D160 S182 G183Y155-R180 PolarHBondContact O-NH2 3.5Å; C156-R180 PolarHBondContact SG-NH2 2.9Å; D160-R180 HydrophobicContact CB-CG 3.93Å; D160-R180 CarbonylContact O-C 3.6Å; D160-R180 WeakPolarHBondContact O-CA 3.29Å; R180-S182 PolarHBondContact O-N 2.83Å; R180-S182 VanDerWaalsContact O-N 3.16Å; R180-G183 PolarHBondContact O-N 2.97Å; R180-G183 VanDerWaalsContact O-N 3.09Å
181Y51.8Low52.5Low126 Ų12676.7 Ų76.749%0.49438%0.375SS..THydrogen-bonded Turntrans-53.8-32.2175.3-94.8-81.6000113D160 I162 E166 G183D160-Y181 PolarHBondContact O-N 3.46Å; I162-Y181 HydrophobicContact CB-CE2 4.22Å; I162-Y181 HydrophobicContact CG1-CD2 3.69Å; I162-Y181 HydrophobicContact CG1-CE1 4.41Å; I162-Y181 HydrophobicContact CG1-CE2 3.5Å; I162-Y181 VanDerWaalsContact CG1-CE2 3.5Å; I162-Y181 HydrophobicContact CG1-CG 4.25Å; E166-Y181 PolarHBondContact OE2-OH 3.11Å; Y181-G183 PolarHBondContact O-N 3.36Å
182S52.5Low52.6Low92 Ų9281 Ų8164%0.64338%0.378SS*.THydrogen-bonded Turntrans-69.51.2178.5-176.20000115.4R180R180-S182 PolarHBondContact O-N 2.83Å; R180-S182 VanDerWaalsContact O-N 3.16Å
183G47.9Very low52.9Low45 Ų4580.3 Ų80.346%0.46437%0.37SS..SBendtrans87.1131.9165.600000115.3R180 Y181R180-G183 PolarHBondContact O-N 2.97Å; R180-G183 VanDerWaalsContact O-N 3.09Å; Y181-G183 PolarHBondContact O-N 3.36Å
184K50.4Low53.1Low210 Ų21073 Ų7391%0.91334%0.34SS*.SBendtrans93.7-20.3163.8-52.4-178.4-178-1800119.2
185Q52.2Low53.4Low122 Ų12276.9 Ų76.957%0.5736%0.357SS*.  trans-103.2118.4175.2-62.1-165.12800111.2F187Q185-F187 HydrophobicContact CB-CE1 4.29Å; Q185-F187 HydrophobicContact CB-CE2 3.88Å; Q185-F187 HydrophobicContact CB-CZ 3.72Å
186T56.7Low53.9Low34 Ų3474.1 Ų74.121%0.20935%0.346CS..EExtended strand (participates in β ladder)trans-114.3116179.3440000108R126 Q179R126-T186 WeakPolarHBondContact CG-O 3.45Å; R126-T186 PolarHBondContact NE-O 2.96Å; R126-T186 PolarHBondContact NE-OG1 3.45Å; R126-T186 VanDerWaalsContact NE-OG1 3.12Å; R126-T186 PolarHBondContact NH2-OG1 3.44Å; Q179-T186 HydrophobicContact CG-CG2 3.97Å
187F62.5Low54.2Low12 Ų1278.5 Ų78.55%0.05337%0.369CS..EExtended strand (participates in β ladder)trans-106.7137.1-174.2-61.5-64.2000110.6V128 H144 R177 I178 Q185V128-F187 HydrophobicContact CG2-CB 3.61Å; V128-F187 HydrophobicContact CG2-CD1 4.48Å; V128-F187 HydrophobicContact CG2-CG 4.29Å; H144-F187 AromaticContact CE1-CD1 3.02Å; H144-F187 WeakPolarHBondContact CE1-CD1 3.31Å; H144-F187 AromaticContact CE1-CE1 3.11Å; H144-F187 WeakPolarHBondContact CE1-CE1 3.44Å; H144-F187 AromaticContact CE1-CG 3.49Å; H144-F187 VanDerWaalsContact CE1-CG 3.49Å; H144-F187 WeakPolarHBondContact CE1-CG 3.41Å; H144-F187 AromaticContact CE1-CZ 3.67Å; H144-F187 AromaticContact ND1-CD1 3.62Å; H144-F187 AromaticContact ND1-CE1 3.69Å; H144-F187 AromaticContact NE2-CD1 3.88Å; H144-F187 AromaticContact NE2-CE1 3.56Å; H144-F187 AromaticContact NE2-CZ 3.67Å; R177-F187 CarbonylContact C-O 3.6Å; R177-F187 VanDerWaalsContact CA-O 3.3Å; R177-F187 WeakPolarHBondContact CA-O 3.48Å; I178-F187 HydrophobicContact CB-CB 4.36Å; I178-F187 PolarHBondContact N-O 3.01Å; I178-F187 PolarHBondContact O-N 2.91Å; Q185-F187 HydrophobicContact CB-CE1 4.29Å; Q185-F187 HydrophobicContact CB-CE2 3.88Å; Q185-F187 HydrophobicContact CB-CZ 3.72Å
188Y62.8Low54.4Low31 Ų3175.4 Ų75.412%0.12236%0.363CS..EExtended strand (participates in β ladder)trans-101.7123.4176.7-66.1-80.5000110.7R126 V128 F175 M176 R177R126-Y188 HydrophobicContact CB-CD2 4.09Å; R126-Y188 VanDerWaalsContact CD-CE2 3.43Å; R126-Y188 HydrophobicContact CG-CD2 3.57Å; R126-Y188 HydrophobicContact CG-CE2 3.79Å; R126-Y188 PolarHBondContact NH2-OH 2.92Å; R126-Y188 PolarHBondContact O-N 3.37Å; V128-Y188 PolarHBondContact N-O 3.04Å; F175-Y188 HydrophobicContact CB-CD1 3.97Å; M176-Y188 CarbonylContact O-C 3.46Å; M176-Y188 WeakPolarHBondContact O-CA 3.4Å; R177-Y188 HydrophobicContact CG-CD1 3.64Å; R177-Y188 HydrophobicContact CG-CE1 3.45Å; R177-Y188 VanDerWaalsContact CG-CE1 3.45Å; R177-Y188 PolarHBondContact NH2-OH 3.35Å; R177-Y188 VanDerWaalsContact NH2-OH 3.14Å
189V60.7Low54.5Low4 Ų481.5 Ų81.52%0.02439%0.385CS..EExtended strand (participates in β ladder)trans-110.7138.7171.6-177.20000108.2Y60 V128 L131 F175 M176 I178 L191Y60-V189 HydrophobicContact CE1-CG1 4.06Å; V128-V189 HydrophobicContact CB-CG2 3.81Å; V128-V189 HydrophobicContact CG1-CG2 3.92Å; V128-V189 HydrophobicContact CG2-CG2 4.06Å; L131-V189 HydrophobicContact CD1-CG2 4.11Å; F175-V189 CarbonylContact C-O 3.54Å; F175-V189 WeakPolarHBondContact CA-O 3.46Å; M176-V189 WeakPolarHBondContact CA-O 3.45Å; M176-V189 HydrophobicContact CB-CB 4.28Å; M176-V189 WeakPolarHBondContact CB-O 3.25Å; M176-V189 PolarHBondContact N-O 3.48Å; M176-V189 PolarHBondContact O-N 2.85Å; I178-V189 HydrophobicContact CD1-CG2 3.52Å; I178-V189 HydrophobicContact CG1-CG2 4.02Å; V189-L191 HydrophobicContact CG1-CD1 4.32Å
190T55Low54.6Low6 Ų685.9 Ų85.94%0.03741%0.406CS..  trans-112.5102.9-177.333.70000111.6Y60 F62 M174 F175 R192Y60-T190 PolarHBondContact OH-O 2.7Å; F62-T190 WeakPolarHBondContact CE2-O 3.44Å; F62-T190 WeakPolarHBondContact CE2-OG1 3.26Å; F62-T190 WeakPolarHBondContact CZ-OG1 3.38Å; M174-T190 VanDerWaalsContact O-CA 3.27Å; M174-T190 WeakPolarHBondContact O-CA 3.32Å; M174-T190 WeakPolarHBondContact O-CG2 3.49Å; F175-T190 HydrophobicContact CB-CG2 4.43Å; F175-T190 HydrophobicContact CD1-CG2 3Å; F175-T190 HydrophobicContact CD2-CG2 4.46Å; F175-T190 HydrophobicContact CE1-CG2 3.1Å; F175-T190 HydrophobicContact CG-CG2 3.73Å; F175-T190 HydrophobicContact CZ-CG2 3.91Å; T190-R192 VanDerWaalsContact C-N 3.3Å; T190-R192 PolarHBondContact O-N 3.38Å
191L51.8Low54.8Low34 Ų3488.4 Ų88.418%0.17842%0.415CS..G310 helixtrans-65.2-29.5-172.6-99.667000114.2M176 V189 Y193 G194 F202 M211M176-L191 HydrophobicContact CB-CD1 3.81Å; M176-L191 HydrophobicContact CE-CD1 4.4Å; M176-L191 HydrophobicContact CG-CD1 4.12Å; M176-L191 HydrophobicContact SD-CD1 3.18Å; M176-L191 WeakPolarHBondContact SD-CD1 3.29Å; M176-L191 HydrophobicContact SD-CD2 4.41Å; M176-L191 HydrophobicContact SD-CG 4.4Å; V189-L191 HydrophobicContact CG1-CD1 4.32Å; L191-Y193 PolarHBondContact O-N 2.93Å; L191-G194 PolarHBondContact O-N 3.48Å; L191-F202 HydrophobicContact CD1-CZ 4.46Å; L191-F202 HydrophobicContact CD2-CE1 4.19Å; L191-F202 HydrophobicContact CD2-CZ 3.77Å; L191-F202 HydrophobicContact CG-CZ 4.24Å; L191-M211 HydrophobicContact CD2-SD 3.9Å
192R44.8Very low55.2Low191 Ų19183.4 Ų83.472%0.72140%0.396SS*.G310 helixtrans-70.2-23-168.5-160.5173.9-176-176.92.1115.2M174 T190M174-R192 HydrophobicContact CE-CB 4.2Å; M174-R192 HydrophobicContact CE-CG 4.46Å; M174-R192 HydrophobicContact CG-CB 4.39Å; T190-R192 VanDerWaalsContact C-N 3.3Å; T190-R192 PolarHBondContact O-N 3.38Å
193Y45.9Very low55.6Low153 Ų15381.4 Ų81.460%0.638%0.38SS*.G310 helixtrans-113.212.3178.9-59.3-85000113.8F62 M174 L191F62-Y193 VanDerWaalsContact CE2-CB 3.49Å; F62-Y193 HydrophobicContact CE2-CD2 4.35Å; F62-Y193 HydrophobicContact CE2-CG 4.4Å; F62-Y193 HydrophobicContact CZ-CD2 4.47Å; M174-Y193 HydrophobicContact CE-CD2 4Å; M174-Y193 HydrophobicContact CE-CE2 3.21Å; L191-Y193 PolarHBondContact O-N 2.93Å
194G49.6Very low56.1Low15 Ų1586.9 Ų86.916%0.15539%0.393CS..EExtended strand (participates in β ladder)trans-91.2130.4176.300000111.6Y60 L191 I196Y60-G194 VanDerWaalsContact CE2-CA 3.5Å; L191-G194 PolarHBondContact O-N 3.48Å; G194-I196 PolarHBondContact O-N 3.15Å
195H52.3Low56.5Low136 Ų13679.3 Ų79.363%0.6336%0.364SS*.EExtended strand (participates in β ladder)trans-75.1110.2169.7-154.4-84.1000107.9R61 L197R61-H195 PolarHBondContact O-N 3.02Å; H195-L197 PolarHBondContact O-N 3.28Å
196I57.8Low56.9Low43 Ų4374.3 Ų74.322%0.22134%0.341CS..EExtended strand (participates in β ladder)trans-79.4105.1176.5-57.5170.6000106.2G194 D198 R199 F212G194-I196 PolarHBondContact O-N 3.15Å; I196-D198 VanDerWaalsContact C-N 3.27Å; I196-D198 WeakPolarHBondContact CG2-O 3.4Å; I196-R199 HydrophobicContact CG2-CB 4.36Å; I196-R199 HydrophobicContact CG2-CG 4.21Å; I196-F212 HydrophobicContact CD1-CE1 4Å; I196-F212 HydrophobicContact CD1-CE2 4.37Å; I196-F212 HydrophobicContact CD1-CZ 3.41Å; I196-F212 VanDerWaalsContact CD1-CZ 3.41Å
197L60.1Low56.7Low114 Ų11474.2 Ų74.260%0.59735%0.346SS*.SBendtrans-70.9-27.7179.6-82.6109.7000112.1H195H195-L197 PolarHBondContact O-N 3.28Å
198D59.2Low55.8Low65 Ų6584.8 Ų84.835%0.34839%0.386SS..  trans-149.4122-175-172.7-3.2000107.6F59 I196 R201F59-D198 HydrophobicContact CD2-CB 4.08Å; F59-D198 HydrophobicContact CE2-CB 3.61Å; F59-D198 WeakPolarHBondContact CE2-O 3.4Å; F59-D198 WeakPolarHBondContact CZ-O 2.78Å; I196-D198 VanDerWaalsContact C-N 3.27Å; I196-D198 WeakPolarHBondContact CG2-O 3.4Å; D198-R201 IonicContact OD2-NE 3.86Å
199R59.7Low55.1Low139 Ų13987.1 Ų87.153%0.52540%0.398SS..SBendtrans-93.9-29.9-165.9-143.9-179.3-170.4-167.89.7111.8I196 F202 T203I196-R199 HydrophobicContact CG2-CB 4.36Å; I196-R199 HydrophobicContact CG2-CG 4.21Å; R199-F202 WeakPolarHBondContact O-CB 3.44Å; R199-F202 PolarHBondContact O-N 3.28Å; R199-T203 PolarHBondContact O-N 3.25Å; R199-T203 PolarHBondContact O-OG1 3.11Å; R199-T203 VanDerWaalsContact O-OG1 3.14Å
200E59Low54.2Low157 Ų15796.6 Ų96.673%0.73444%0.442SS*.Hα-helixtrans-71.6-42-172.7-63.5-164.9161.700112.1F202 T203 Q204E200-F202 PolarHBondContact O-N 2.92Å; E200-T203 WeakPolarHBondContact CA-OG1 3.34Å; E200-T203 PolarHBondContact O-N 2.93Å; E200-T203 PolarHBondContact O-OG1 3.41Å; E200-Q204 PolarHBondContact O-N 3.22Å
201R57.7Low53.8Low128 Ų128100.8 Ų100.848%0.48346%0.462SS..Hα-helixtrans-70.1-21.4176.2-58.8-174.4-179.5-158.30.4112.5F59 D198 Q204 V205F59-R201 HydrophobicContact CD2-CB 4.4Å; F59-R201 HydrophobicContact CE2-CB 3.63Å; F59-R201 HydrophobicContact CZ-CB 3.94Å; D198-R201 IonicContact OD2-NE 3.86Å; R201-Q204 PolarHBondContact O-N 2.94Å; R201-V205 WeakPolarHBondContact O-CG2 3.41Å; R201-V205 PolarHBondContact O-N 2.98Å
202F60.8Low53.2Low21 Ų21104.1 Ų104.19%0.09248%0.475CS..Hα-helixtrans-70.1-49.1178.2-169.3-84.2000107.2F59 M176 L191 R199 E200 Q204 V205 F206F59-F202 HydrophobicContact CD1-CD2 4.3Å; F59-F202 HydrophobicContact CE1-CB 3.38Å; F59-F202 AromaticContact CE1-CD2 3.47Å; F59-F202 HydrophobicContact CE1-CD2 3.47Å; F59-F202 VanDerWaalsContact CE1-CD2 3.47Å; F59-F202 AromaticContact CE1-CG 3.86Å; F59-F202 HydrophobicContact CE1-CG 3.86Å; F59-F202 HydrophobicContact CZ-CB 3.37Å; F59-F202 HydrophobicContact CZ-CD2 4.29Å; F59-F202 HydrophobicContact CZ-CG 4.32Å; M176-F202 HydrophobicContact CE-CZ 4.21Å; L191-F202 HydrophobicContact CD1-CZ 4.46Å; L191-F202 HydrophobicContact CD2-CE1 4.19Å; L191-F202 HydrophobicContact CD2-CZ 3.77Å; L191-F202 HydrophobicContact CG-CZ 4.24Å; R199-F202 WeakPolarHBondContact O-CB 3.44Å; R199-F202 PolarHBondContact O-N 3.28Å; E200-F202 PolarHBondContact O-N 2.92Å; F202-Q204 PolarHBondContact O-N 3.01Å; F202-V205 PolarHBondContact O-N 3.04Å; F202-F206 HydrophobicContact CD1-CB 4.27Å; F202-F206 AromaticContact CD1-CD2 3.74Å; F202-F206 HydrophobicContact CD1-CD2 3.74Å; F202-F206 HydrophobicContact CD1-CG 4.4Å; F202-F206 AromaticContact CD2-CD2 3.76Å; F202-F206 HydrophobicContact CD2-CD2 3.76Å; F202-F206 AromaticContact CD2-CE2 3.86Å; F202-F206 HydrophobicContact CD2-CE2 3.86Å; F202-F206 HydrophobicContact CE1-CB 3.99Å; F202-F206 AromaticContact CE1-CD2 3.53Å; F202-F206 HydrophobicContact CE1-CD2 3.53Å; F202-F206 HydrophobicContact CE1-CE2 4.29Å; F202-F206 AromaticContact CE1-CG 3.97Å; F202-F206 HydrophobicContact CE1-CG 3.97Å; F202-F206 AromaticContact CE2-CD2 3.5Å; F202-F206 HydrophobicContact CE2-CD2 3.5Å; F202-F206 AromaticContact CE2-CE2 3.43Å; F202-F206 HydrophobicContact CE2-CE2 3.43Å; F202-F206 VanDerWaalsContact CE2-CE2 3.43Å; F202-F206 HydrophobicContact CE2-CZ 4.42Å; F202-F206 AromaticContact CG-CD2 3.82Å; F202-F206 HydrophobicContact CG-CD2 3.82Å; F202-F206 HydrophobicContact CG-CE2 4.39Å; F202-F206 AromaticContact CZ-CD2 3.36Å; F202-F206 HydrophobicContact CZ-CD2 3.36Å; F202-F206 AromaticContact CZ-CE2 3.66Å; F202-F206 HydrophobicContact CZ-CE2 3.66Å; F202-F206 HydrophobicContact CZ-CG 4.01Å; F202-F206 HydrophobicContact CZ-CZ 4.5Å; F202-F206 WeakPolarHBondContact O-CB 3.47Å; F202-F206 WeakPolarHBondContact O-CD2 3.32Å; F202-F206 PolarHBondContact O-N 3.45Å
203T60.3Low52.6Low50 Ų50108.2 Ų108.231%0.30750%0.499SS..Hα-helixtrans-65.8-24.9174.939.70000113.2R199 E200 G207 R208R199-T203 PolarHBondContact O-N 3.25Å; R199-T203 PolarHBondContact O-OG1 3.11Å; R199-T203 VanDerWaalsContact O-OG1 3.14Å; E200-T203 WeakPolarHBondContact CA-OG1 3.34Å; E200-T203 PolarHBondContact O-N 2.93Å; E200-T203 PolarHBondContact O-OG1 3.41Å; T203-G207 CarbonylContact O-C 2.97Å; T203-G207 WeakPolarHBondContact O-CA 3.5Å; T203-G207 PolarHBondContact O-N 3.21Å; T203-G207 VanDerWaalsContact O-N 3.08Å; T203-R208 PolarHBondContact O-N 3.34Å
204Q59.9Low52.9Low159 Ų159106 Ų10674%0.74349%0.493SS*.Hα-helixtrans-75.1-40.9174.9-165.6176.49.300112.2E200 R201 F202E200-Q204 PolarHBondContact O-N 3.22Å; R201-Q204 PolarHBondContact O-N 2.94Å; F202-Q204 PolarHBondContact O-N 3.01Å
205V58.8Low53.1Low51 Ų51110.8 Ų110.831%0.30951%0.511SS..Hα-helixtrans-80.2-41.7-179.4172.90000112.2L133 L158 R201 F202L133-V205 HydrophobicContact CD2-CG2 4.41Å; L158-V205 HydrophobicContact CD1-CG1 4.26Å; L158-V205 HydrophobicContact CD2-CG1 4.21Å; R201-V205 WeakPolarHBondContact O-CG2 3.41Å; R201-V205 PolarHBondContact O-N 2.98Å; F202-V205 PolarHBondContact O-N 3.04Å
206F58.8Low53.1Low18 Ų18109.4 Ų109.48%0.07951%0.505CS..Hα-helixtrans-96.40.3-176.3-65.1-68.9000113.3L164 M176 F202 H209L164-F206 HydrophobicContact CD1-CB 4.34Å; L164-F206 HydrophobicContact CD1-CD1 3.26Å; L164-F206 HydrophobicContact CD1-CE1 3.86Å; L164-F206 HydrophobicContact CD1-CG 4.19Å; M176-F206 HydrophobicContact CE-CD1 3.44Å; M176-F206 VanDerWaalsContact CE-CD1 3.44Å; M176-F206 HydrophobicContact CE-CD2 4.46Å; M176-F206 HydrophobicContact CE-CE1 3.45Å; M176-F206 VanDerWaalsContact CE-CE1 3.45Å; M176-F206 HydrophobicContact CE-CG 3.92Å; M176-F206 HydrophobicContact CE-CZ 4.02Å; F202-F206 HydrophobicContact CD1-CB 4.27Å; F202-F206 AromaticContact CD1-CD2 3.74Å; F202-F206 HydrophobicContact CD1-CD2 3.74Å; F202-F206 HydrophobicContact CD1-CG 4.4Å; F202-F206 AromaticContact CD2-CD2 3.76Å; F202-F206 HydrophobicContact CD2-CD2 3.76Å; F202-F206 AromaticContact CD2-CE2 3.86Å; F202-F206 HydrophobicContact CD2-CE2 3.86Å; F202-F206 HydrophobicContact CE1-CB 3.99Å; F202-F206 AromaticContact CE1-CD2 3.53Å; F202-F206 HydrophobicContact CE1-CD2 3.53Å; F202-F206 HydrophobicContact CE1-CE2 4.29Å; F202-F206 AromaticContact CE1-CG 3.97Å; F202-F206 HydrophobicContact CE1-CG 3.97Å; F202-F206 AromaticContact CE2-CD2 3.5Å; F202-F206 HydrophobicContact CE2-CD2 3.5Å; F202-F206 AromaticContact CE2-CE2 3.43Å; F202-F206 HydrophobicContact CE2-CE2 3.43Å; F202-F206 VanDerWaalsContact CE2-CE2 3.43Å; F202-F206 HydrophobicContact CE2-CZ 4.42Å; F202-F206 AromaticContact CG-CD2 3.82Å; F202-F206 HydrophobicContact CG-CD2 3.82Å; F202-F206 HydrophobicContact CG-CE2 4.39Å; F202-F206 AromaticContact CZ-CD2 3.36Å; F202-F206 HydrophobicContact CZ-CD2 3.36Å; F202-F206 AromaticContact CZ-CE2 3.66Å; F202-F206 HydrophobicContact CZ-CE2 3.66Å; F202-F206 HydrophobicContact CZ-CG 4.01Å; F202-F206 HydrophobicContact CZ-CZ 4.5Å; F202-F206 WeakPolarHBondContact O-CB 3.47Å; F202-F206 WeakPolarHBondContact O-CD2 3.32Å; F202-F206 PolarHBondContact O-N 3.45Å; F206-H209 PolarHBondContact O-CD2 2.97Å; F206-H209 PolarHBondContact O-NE2 3.46Å
207G53.4Low52.9Low31 Ų31113.3 Ų113.332%0.3252%0.521SS..  trans77.6161.3-171.400000112.3T203 H209T203-G207 CarbonylContact O-C 2.97Å; T203-G207 WeakPolarHBondContact O-CA 3.5Å; T203-G207 PolarHBondContact O-N 3.21Å; T203-G207 VanDerWaalsContact O-N 3.08Å; G207-H209 PolarHBondContact O-N 3.11Å
208R44.1Very low52.4Low235 Ų235113.3 Ų113.389%0.88752%0.517SS*.  trans-73.364.4178.7-159.7-168-63.3146.3-1.9110.2T203 Q210T203-R208 PolarHBondContact O-N 3.34Å; R208-Q210 PolarHBondContact O-N 3.02Å
209H48.1Very low52Low79 Ų79116.5 Ų116.537%0.36653%0.528SS..  trans-72.2123.6169.4-74-65.3000108.3F206 G207 M211F206-H209 PolarHBondContact O-CD2 2.97Å; F206-H209 PolarHBondContact O-NE2 3.46Å; G207-H209 PolarHBondContact O-N 3.11Å; H209-M211 HydrophobicContact CB-CB 4.44Å; H209-M211 PolarHBondContact O-N 2.78Å
210Q41.4Very low51.4Low203 Ų203114.9 Ų114.995%0.94953%0.528SS*.  trans-65.265.3171-73.9-176.8-29.500110.5R208R208-Q210 PolarHBondContact O-N 3.02Å
211M46.6Very low50.8Low95 Ų95111.6 Ų111.647%0.46851%0.512SS..  trans-102.19.1-170.8-135.3179.4-168.300113.2L191 H209L191-M211 HydrophobicContact CD2-SD 3.9Å; H209-M211 HydrophobicContact CB-CB 4.44Å; H209-M211 PolarHBondContact O-N 2.78Å
212F39.9Very low50.3Low103 Ų103110.3 Ų110.345%0.45252%0.515SS..  trans-135.485.9178.2-58.9-77.6000109.7I196I196-F212 HydrophobicContact CD1-CE1 4Å; I196-F212 HydrophobicContact CD1-CE2 4.37Å; I196-F212 HydrophobicContact CD1-CZ 3.41Å; I196-F212 VanDerWaalsContact CD1-CZ 3.41Å
213K31.2Very low49.3Very low278 Ų278118.4 Ų118.4100%1.20955%0.553SS**  trans-119.60156.5-168.8176.2-178179.20108

Retrieved 213 of 213 residues in 65.8 ms (Link to these results)