A0A075BJG6_DROME Loading...

Pumilio

AlphaFold DB , UniProt , Accession A0A075BJG6, Species DROME (Drosophila melanogaster, Fruit fly), Gene pum, Length 372 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
1M38Very low42.6Very low243 Ų243160.3 Ų160.3100%1.19784%0.844SS**  01300-74.2-179.6-11500107.8
2K46.4Very low42.2Very low183 Ų183151.9 Ų151.980%0.79683%0.825SS**  trans-82.4133.9-177.2-63.6168.2175.3177.10109.1L4K2-L4 HydrophobicContact CB-CD1 4.43Å
3F40.2Very low42.7Very low211 Ų211160.4 Ų160.493%0.92584%0.838SS**  trans-137.2116.8145.7-80.7-75.5000108.3
4L45.4Very low42.1Very low153 Ų153154.1 Ų154.180%0.80183%0.832SS**  trans-70148.1176.2-88.558.9000109.9K2K2-L4 HydrophobicContact CB-CD1 4.43Å
5G39.2Very low41.8Very low72 Ų72148.9 Ų148.974%0.74283%0.828SS**  trans54.186.5139.100000117
6G38.2Very low41.5Very low75 Ų75147.8 Ų147.877%0.77383%0.826SS**  trans-84107.4150.400000108.1D8G6-D8 PolarHBondContact O-N 3.47Å
7N42.6Very low40.9Very low139 Ų139143.9 Ų143.974%0.74383%0.827SS**  trans-56.4120.9166.6-77.25.5000108.9D9N7-D9 PolarHBondContact O-N 3.19Å
8D40.9Very low40.7Very low154 Ų154143.7 Ų143.782%0.82483%0.828SS**  trans-62.680163.4-92.7-73.7000109.5G6 R10G6-D8 PolarHBondContact O-N 3.47Å; D8-R10 PolarHBondContact O-N 3.46Å
9D45.6Very low40.2Very low139 Ų139139.5 Ų139.574%0.74382%0.819SS**  trans-7684.3162.3-76.5-42.5000108.3N7 N11N7-D9 PolarHBondContact O-N 3.19Å; D9-N11 PolarHBondContact O-N 3.13Å
10R53.6Low39.9Very low234 Ų234138.4 Ų138.488%0.88381%0.814SS**  trans-6381155.1-73.3-176.8-173.5155.93.1108.5D8D8-R10 PolarHBondContact O-N 3.46Å
11N39Very low39.6Very low160 Ų160139 Ų13986%0.85681%0.814SS**  trans-153.3126.5160.2-143.82.4000111.4D9D9-N11 PolarHBondContact O-N 3.13Å
12G37.3Very low39.2Very low60 Ų60131.9 Ų131.962%0.61979%0.793SS**  trans100.979.3178.800000112.1G14G12-G14 PolarHBondContact O-N 3.49Å
13R49.4Very low39.1Very low262 Ų262131.7 Ų131.799%0.98980%0.799SS**  28.879.290.4-75.4-172.3-174.8-178.62.3112
14G33.4Very low38.7Very low73 Ų73128 Ų12875%0.75379%0.793SS**  trans-127.785163.700000108.8G12G12-G14 PolarHBondContact O-N 3.49Å
15G37.4Very low37.9Very low75 Ų75124 Ų12477%0.77379%0.789SS**  trans-83.3119.2158.300000107.8
16V38.2Very low38.1Very low132 Ų132126.1 Ų126.180%0.879%0.793SS**  trans-149.487.2151.3-1700000107.6
17G31.3Very low38Very low81 Ų81134.4 Ų134.484%0.83580%0.801SS**  trans-79.2123.6154.800000107.9
18V36.6Very low37.8Very low141 Ų141131.9 Ų131.986%0.85581%0.808SS**  trans-76135.9175.1-169.60000108.7
19G31.5Very low37.6Very low64 Ų64127 Ų12766%0.6679%0.793SS**  trans154.881.5173.100000111.3
20T33.8Very low37.5Very low117 Ų117126.9 Ų126.972%0.71880%0.798SS**  71.4108.288.9-48.90000112.7
21D33.3Very low37Very low152 Ų152120.2 Ų120.281%0.81379%0.787SS**  trans59.8101.3149.9-52.8-20.2000120.2
22A29.6Very low37Very low92 Ų92119.6 Ų119.676%0.7678%0.779SS**  trans-167.296.2133.100000111V24A22-V24 VanDerWaalsContact C-N 3.3Å; A22-V24 PolarHBondContact O-N 3.48Å; A22-V24 VanDerWaalsContact O-N 3.12Å
23I43.9Very low37.1Very low179 Ų179122.8 Ų122.892%0.91878%0.782SS**  trans-71.591.4152.9-62.1170.6000106.2
24V33.2Very low36.5Very low133 Ų133113.5 Ų113.581%0.80676%0.761SS**  trans-148115.9162179.40000109.5A22A22-V24 VanDerWaalsContact C-N 3.3Å; A22-V24 PolarHBondContact O-N 3.48Å; A22-V24 VanDerWaalsContact O-N 3.12Å
25G28.2Very low36.7Very low69 Ų69113.1 Ų113.171%0.71175%0.751SS**  trans92101146.200000117R27G25-R27 PolarHBondContact O-N 3.47Å
26S43.5Very low36.8Very low117 Ų117115.7 Ų115.782%0.81875%0.747SS**  trans-43.6128.8152.5-48.30000111.6
27R36.3Very low36.9Very low249 Ų249112.3 Ų112.394%0.9473%0.733SS**  trans169.7118.6138.9-91.6157.3-163.6-165.16.6110.9G25G25-R27 PolarHBondContact O-N 3.47Å
28G39Very low37.2Very low86 Ų86111.3 Ų111.389%0.88772%0.716SS**  trans96.6107.1150.900000116.1
29G35.7Very low37.4Very low51 Ų51106.9 Ų106.953%0.52670%0.699SS.*  trans174.427.5169.600000116.9S31G29-S31 PolarHBondContact O-N 3.46Å
30V44.4Very low37.9Very low137 Ų137107 Ų10783%0.8369%0.694SS**THydrogen-bonded Turntrans-70.917.2176.4-82.70000114.1
31S42Very low38.2Very low94 Ų94104.4 Ų104.466%0.65768%0.684SS**THydrogen-bonded Turntrans-115.1-11.8-170.3-55.20000114.8G29G29-S31 PolarHBondContact O-N 3.46Å
32Q38.4Very low38.4Very low148 Ų148100.1 Ų100.169%0.69267%0.67SS**SBendtrans-81.4-41.1173.9-116.293.79.100111.6A34 A35Q32-A34 VanDerWaalsContact C-N 3.34Å; Q32-A34 PolarHBondContact O-N 3.07Å; Q32-A35 PolarHBondContact O-N 3.32Å
33D39.2Very low38.9Very low127 Ų12799 Ų9968%0.67966%0.661SS**Hα-helixtrans-69.2-27.9-174-62.8-50.6000113.9A37D33-A37 WeakPolarHBondContact O-CB 3.34Å; D33-A37 PolarHBondContact O-N 2.79Å
34A38.1Very low38.7Very low66 Ų6694.6 Ų94.655%0.54565%0.651SS.*Hα-helixtrans-74.4-27.7179.700000113.2Q32 A38Q32-A34 VanDerWaalsContact C-N 3.34Å; Q32-A34 PolarHBondContact O-N 3.07Å; A34-A38 WeakPolarHBondContact O-CB 3.28Å; A34-A38 PolarHBondContact O-N 3.35Å; A34-A38 VanDerWaalsContact O-N 3.15Å
35A38.2Very low39Very low66 Ų6692.4 Ų92.455%0.54565%0.647SS.*Hα-helixtrans-76.8-38.317900000111.7Q32 A38 G39Q32-A35 PolarHBondContact O-N 3.32Å; A35-A38 PolarHBondContact O-N 2.93Å; A35-G39 PolarHBondContact O-N 2.85Å; A35-G39 VanDerWaalsContact O-N 3.1Å
36D39.1Very low39.5Very low128 Ų12893.4 Ų93.468%0.68464%0.639SS**Hα-helixtrans-71.8-33.8175.5-78.3-32.1000112G39 A40D36-G39 PolarHBondContact O-N 3.02Å; D36-A40 PolarHBondContact O-N 2.89Å; D36-A40 VanDerWaalsContact O-N 3.15Å
37A40.3Very low39.1Very low62 Ų6291.6 Ų91.651%0.51264%0.639SS.*Hα-helixtrans-67.3-36.9172.500000112.9D33 A41D33-A37 WeakPolarHBondContact O-CB 3.34Å; D33-A37 PolarHBondContact O-N 2.79Å; A37-A41 WeakPolarHBondContact O-CB 3.15Å; A37-A41 PolarHBondContact O-N 3.49Å
38A38Very low38.8Very low59 Ų5988.8 Ų88.849%0.48863%0.63SS.*Hα-helixtrans-70.4-35.5176.400000112.5A34 A35 A41 A42A34-A38 WeakPolarHBondContact O-CB 3.28Å; A34-A38 PolarHBondContact O-N 3.35Å; A34-A38 VanDerWaalsContact O-N 3.15Å; A35-A38 PolarHBondContact O-N 2.93Å; A38-A41 PolarHBondContact O-N 3.45Å; A38-A42 WeakPolarHBondContact O-CB 3.45Å; A38-A42 PolarHBondContact O-N 3.34Å
39G40.3Very low38.5Very low48 Ų4890.8 Ų90.850%0.49563%0.625SS.*Hα-helixtrans-65.8-38.5173.900000113.2A35 D36 A43A35-G39 PolarHBondContact O-N 2.85Å; A35-G39 VanDerWaalsContact O-N 3.1Å; D36-G39 PolarHBondContact O-N 3.02Å; G39-A43 PolarHBondContact O-N 3.19Å
40A42.3Very low38.3Very low66 Ų6697.1 Ų97.155%0.54564%0.638SS.*Hα-helixtrans-71.2-36.9175.600000112.8D36 A43 A44D36-A40 PolarHBondContact O-N 2.89Å; D36-A40 VanDerWaalsContact O-N 3.15Å; A40-A43 PolarHBondContact O-N 3.26Å; A40-A44 PolarHBondContact O-N 3.48Å
41A39Very low37.6Very low63 Ų6399.4 Ų99.452%0.52164%0.639SS.*Hα-helixtrans-70.3-34.6176.500000112.9A37 A38 A43 A44 A45A37-A41 WeakPolarHBondContact O-CB 3.15Å; A37-A41 PolarHBondContact O-N 3.49Å; A38-A41 PolarHBondContact O-N 3.45Å; A41-A43 VanDerWaalsContact C-N 3.34Å; A41-A44 PolarHBondContact O-N 2.64Å; A41-A45 PolarHBondContact O-N 2.82Å
42A38.7Very low37.1Very low62 Ų62103.5 Ų103.551%0.51265%0.648SS.*Hα-helixtrans-69.8-30174.500000112.7A38 A45A38-A42 WeakPolarHBondContact O-CB 3.45Å; A38-A42 PolarHBondContact O-N 3.34Å; A42-A45 PolarHBondContact O-N 2.85Å
43A38.3Very low36.6Very low69 Ų69107.5 Ų107.557%0.5766%0.657SS**Hα-helixtrans-74.9-24.5174.500000113.3G39 A40 A41 A45G39-A43 PolarHBondContact O-N 3.19Å; A40-A43 PolarHBondContact O-N 3.26Å; A41-A43 VanDerWaalsContact C-N 3.34Å; A43-A45 VanDerWaalsContact C-N 3.34Å
44A41Very low36.4Very low86 Ų86107.3 Ų107.371%0.71166%0.663SS**Hα-helixtrans-77.7-19.1172.800000113.2A40 A41A40-A44 PolarHBondContact O-N 3.48Å; A41-A44 PolarHBondContact O-N 2.64Å
45A38.9Very low35.9Very low87 Ų87109.7 Ų109.772%0.71968%0.675SS**SBendtrans-88-12179.300000113.9A41 A42 A43A41-A45 PolarHBondContact O-N 2.82Å; A42-A45 PolarHBondContact O-N 2.85Å; A43-A45 VanDerWaalsContact C-N 3.34Å
46V39.2Very low35.9Very low91 Ų91112.7 Ų112.755%0.55269%0.689SS**SBendtrans-112.9100.8170.5-173.50000106.8Y48V46-Y48 HydrophobicContact CG1-CD2 4.04Å; V46-Y48 HydrophobicContact CG1-CE2 4.25Å; V46-Y48 PolarHBondContact O-N 3.02Å
47G34.4Very low35.6Very low78 Ų78110.5 Ų110.580%0.80470%0.697SS**  trans-61.276.4-17700000114.3
48Y29.4Very low35.2Very low190 Ų190111.3 Ų111.375%0.74571%0.711SS**  trans-105.793.3153.3-78.9-80.8000107.3V46 F50V46-Y48 HydrophobicContact CG1-CD2 4.04Å; V46-Y48 HydrophobicContact CG1-CE2 4.25Å; V46-Y48 PolarHBondContact O-N 3.02Å; Y48-F50 PolarHBondContact O-N 2.69Å
49V34.5Very low35.1Very low129 Ų129115.6 Ų115.678%0.78273%0.731SS**  trans-6293.9160.4175.10000106.6Q51V49-Q51 VanDerWaalsContact C-N 3.3Å; V49-Q51 HydrophobicContact CG1-CG 4.31Å; V49-Q51 PolarHBondContact O-N 3.35Å
50F30.1Very low34.6Very low184 Ų184116.9 Ų116.981%0.80774%0.744SS**  trans-64.8103.4154.2-82.8-85.5000105.7Y48 Q52Y48-F50 PolarHBondContact O-N 2.69Å; F50-Q52 PolarHBondContact O-N 3.1Å
51Q29.9Very low34.1Very low184 Ų184120.5 Ų120.586%0.8676%0.759SS**  trans-5791.9159.5-78.6-178.982.500106.8V49 R53V49-Q51 VanDerWaalsContact C-N 3.3Å; V49-Q51 HydrophobicContact CG1-CG 4.31Å; V49-Q51 PolarHBondContact O-N 3.35Å; Q51-R53 VanDerWaalsContact C-N 3.31Å; Q51-R53 PolarHBondContact O-N 3.07Å
52Q31.5Very low33.7Very low180 Ų180121 Ų12184%0.84177%0.771SS**  trans-63.8101.6164.3-82-175.8100106.4F50 P54F50-Q52 PolarHBondContact O-N 3.1Å; Q52-P54 WeakPolarHBondContact O-CD 3.43Å
53R28.9Very low33.5Very low232 Ų232125.2 Ų125.288%0.87579%0.79SS**  trans-50.6121164.9-126.4-179.7-177.8-131.32.1107.7Q51 S55Q51-R53 VanDerWaalsContact C-N 3.31Å; Q51-R53 PolarHBondContact O-N 3.07Å; R53-S55 PolarHBondContact O-N 3.29Å; R53-S55 VanDerWaalsContact O-N 3.07Å
54P34.3Very low33Very low124 Ų124125.6 Ų125.681%0.80580%0.801SS**  trans-65.3111.9166.9-1428.3000107.1Q52Q52-P54 WeakPolarHBondContact O-CD 3.43Å
55S27.8Very low32.6Very low115 Ų115124.9 Ų124.980%0.80480%0.801SS**  trans-86.6128167.7-148.90000108.1R53R53-S55 PolarHBondContact O-N 3.29Å; R53-S55 VanDerWaalsContact O-N 3.07Å
56P38.1Very low32.4Very low130 Ų130128.3 Ų128.384%0.84481%0.813SS**  trans-78.8125.2-174.9-1.117.2000110.8
57G32.1Very low32Very low81 Ų81127.6 Ų127.684%0.83582%0.824SS**  trans167.9109.1165.600000113.6
58G32.5Very low31.9Very low80 Ų80127.8 Ų127.883%0.82583%0.826SS**  trans147.262.2166.700000114.2
59V35.4Very low32Very low148 Ų148122.1 Ų122.190%0.89783%0.825SS**  trans-81.6113.9165.1-167.30000107.1
60G29.5Very low32.3Very low75 Ų75122.6 Ų122.677%0.77383%0.828SS**  trans-141.493.9176.600000110.5
61V33.2Very low32.7Very low142 Ų142119.5 Ų119.586%0.86183%0.827SS**  trans-70.8136.1172.2174.50000109.5
62G29.7Very low33Very low74 Ų74114.3 Ų114.376%0.76382%0.822SS**  trans171.8117.3167.200000114.8
63V34Very low33.2Very low151 Ų151112.6 Ų112.692%0.91582%0.824SS**  trans-92.9148.3-169.61680000112.5
64G28.7Very low33.4Very low77 Ų77104.7 Ų104.779%0.79481%0.814SS**  trans96.8129.6159.200000113.5
65G31.7Very low33.4Very low70 Ų70102.9 Ų102.972%0.72281%0.81SS**  cis143.813217.500000106.6
66V36.6Very low34.1Very low159 Ų159104.6 Ų104.696%0.96482%0.815SS**  trans81.6104.9167.6-160.70000117.3
67G29.5Very low34.1Very low76 Ų76101.5 Ų101.578%0.78481%0.807SS**  trans128.591.2142.800000117.2
68G33.5Very low34.2Very low83 Ų83103 Ų10386%0.85681%0.805SS**  trans84.2117.5141.500000118.8
69G30.3Very low34.5Very low70 Ų70103.1 Ų103.172%0.72279%0.789SS**  trans92.9115.8156.700000114.2P71G69-P71 WeakPolarHBondContact O-CD 3.41Å
70V40.9Very low34.8Very low139 Ų139104.4 Ų104.484%0.84279%0.79SS**  trans-61.7125.7-177.9178.70000112.2
71P38.6Very low35.4Very low120 Ų120108.7 Ų108.778%0.77979%0.79SS**  trans-127.3118.8156.225.2-2.2000110.8G69G69-P71 WeakPolarHBondContact O-CD 3.41Å
72G37Very low35.7Very low74 Ų74108.7 Ų108.776%0.76378%0.78SS**  trans82.896.2158.600000116.3G74G72-G74 PolarHBondContact O-N 3.13Å
73V35.9Very low36Very low144 Ų144108.1 Ų108.187%0.87377%0.768SS**  trans-87.891.8155.9179.10000107.6
74G31.2Very low36.3Very low66 Ų66103.9 Ų103.968%0.6875%0.75SS**  trans-80.4139.9153.300000109.8G72G72-G74 PolarHBondContact O-N 3.13Å
75A34.9Very low36.7Very low87 Ų87103.6 Ų103.672%0.71974%0.739SS**SBendtrans72.8118.215800000119.6
76V43.2Very low37.1Very low151 Ų151103.3 Ų103.392%0.91573%0.731SS**  trans59.2102132.2-171.90000116.8
77G37Very low37.4Very low64 Ų64102.6 Ų102.666%0.6672%0.717SS**  trans126.9124.2155.700000113.7
78S34.4Very low37.8Very low113 Ų113107 Ų10779%0.7971%0.711SS**  trans70124.717765.80000114.9
79T40.2Very low38.1Very low82 Ų82106.1 Ų106.150%0.50370%0.695SS.*  -155.6114.364.135.40000111.9H81 E82T79-H81 PolarHBondContact O-N 3.27Å; T79-E82 PolarHBondContact OG1-OE2 3.13Å
80L41.4Very low38.7Very low176 Ų176105.6 Ų105.692%0.92169%0.685SS**THydrogen-bonded Turntrans-61.814.8165.7-78124.1000113.9
81H41.4Very low38.5Very low165 Ų165104.5 Ų104.576%0.76467%0.67SS**THydrogen-bonded Turntrans-103-22.5-174-145.780.3000113.4T79T79-H81 PolarHBondContact O-N 3.27Å
82E40.1Very low38.9Very low141 Ų141104.8 Ų104.866%0.65966%0.659SS**SBendtrans-90.4-16.6177.2-79139.5148.700113.5T79T79-E82 PolarHBondContact OG1-OE2 3.13Å
83A35.9Very low39.2Very low62 Ų62104 Ų10451%0.51265%0.646SS.*Hα-helixtrans-71.1-32.9174.800000113.1A86 E87A83-A86 PolarHBondContact O-N 3.49Å; A83-E87 PolarHBondContact O-N 3.45Å
84A39.8Very low39.6Very low63 Ų63102.3 Ų102.352%0.52163%0.628SS.*Hα-helixtrans-73.8-28-179.400000113.4
85A37.4Very low40.1Very low70 Ų70105.4 Ų105.458%0.57962%0.623SS**Hα-helixtrans-74.3-30.617700000112.4
86A40.6Very low40.6Very low65 Ų65107.9 Ų107.954%0.53762%0.619SS.*Hα-helixtrans-71.4-33.3175.700000112.5A83 A89 A90A83-A86 PolarHBondContact O-N 3.49Å; A86-A89 PolarHBondContact O-N 3.48Å; A86-A90 PolarHBondContact O-N 3.06Å
87E42.3Very low40.8Very low143 Ų143107.2 Ų107.267%0.66861%0.607SS**Hα-helixtrans-69.6-33.4178-70.8-179.716700112.7A83 H91A83-E87 PolarHBondContact O-N 3.45Å; E87-H91 PolarHBondContact O-N 3.26Å
88Y37Very low41.2Very low168 Ų168110.5 Ų110.566%0.65961%0.605SS**Hα-helixtrans-71-34.7177.2-163-98.4000112.9F92Y88-F92 HydrophobicContact CE1-CD2 4.28Å; Y88-F92 PolarHBondContact O-N 3.28Å
89A41.3Very low41.7Very low65 Ų65108.8 Ų108.854%0.53759%0.59SS.*Hα-helixtrans-71.3-35.7176.800000112.6A86 F92 A93A86-A89 PolarHBondContact O-N 3.48Å; A89-F92 PolarHBondContact O-N 3.4Å; A89-A93 PolarHBondContact O-N 3.43Å
90A41.5Very low41.6Very low60 Ų60115 Ų11550%0.49660%0.604SS.*Hα-helixtrans-66.3-38.4175.200000112.3A86 F92 A93 Q94A86-A90 PolarHBondContact O-N 3.06Å; A90-F92 VanDerWaalsContact C-N 3.33Å; A90-F92 PolarHBondContact O-N 3.48Å; A90-A93 PolarHBondContact O-N 3.42Å; A90-Q94 PolarHBondContact O-N 3.43Å
91H38.4Very low41.5Very low116 Ų116116.9 Ų116.954%0.53760%0.599SS.*Hα-helixtrans-67.3-31.6178.1-121.5-83.9000113.1E87 K95E87-H91 PolarHBondContact O-N 3.26Å; H91-K95 PolarHBondContact O-N 3.36Å; H91-K95 VanDerWaalsContact O-N 3.17Å
92F45.2Very low41.4Very low126 Ų126112.7 Ų112.755%0.55359%0.593SS**Hα-helixtrans-72.5-39.2175.5-126-87.1000112.3Y88 A89 A90 K95 Q96Y88-F92 HydrophobicContact CE1-CD2 4.28Å; Y88-F92 PolarHBondContact O-N 3.28Å; A89-F92 PolarHBondContact O-N 3.4Å; A90-F92 VanDerWaalsContact C-N 3.33Å; A90-F92 PolarHBondContact O-N 3.48Å; F92-K95 PolarHBondContact O-N 3.35Å; F92-Q96 PolarHBondContact O-N 3.47Å
93A43.3Very low41.3Very low58 Ų58110.8 Ų110.848%0.47959%0.594SS.*Hα-helixtrans-66.5-37.3175.400000112.2A89 A90 Q96 Q97A89-A93 PolarHBondContact O-N 3.43Å; A90-A93 PolarHBondContact O-N 3.42Å; A93-Q96 PolarHBondContact O-N 3.4Å; A93-Q97 PolarHBondContact O-N 2.97Å
94Q44.3Very low41.5Very low107 Ų107111 Ų11150%0.560%0.603SS.*Hα-helixtrans-68.8-37.2176.3-152.6177.623.800112.2A90 Q97 Q98A90-Q94 PolarHBondContact O-N 3.43Å; Q94-Q97 PolarHBondContact O-N 3.26Å; Q94-Q98 PolarHBondContact O-N 3.47Å
95K42.6Very low41.5Very low131 Ų131113.7 Ų113.757%0.5761%0.608SS**Hα-helixtrans-64.2-40173.7-80.5-168.4-177.1-171.40112.6H91 F92 Q97 Q98 T99H91-K95 PolarHBondContact O-N 3.36Å; H91-K95 VanDerWaalsContact O-N 3.17Å; F92-K95 PolarHBondContact O-N 3.35Å; K95-Q97 VanDerWaalsContact C-N 3.29Å; K95-Q97 PolarHBondContact O-N 3.49Å; K95-Q98 PolarHBondContact O-N 3.48Å; K95-Q98 VanDerWaalsContact O-N 3.15Å; K95-T99 PolarHBondContact O-N 3.34Å; K95-T99 PolarHBondContact O-OG1 3.09Å
96Q46.3Very low41.8Very low139 Ų139118.5 Ų118.565%0.6562%0.624SS**Hα-helixtrans-66.1-31.8176.2-68.6-147.5-3.900113.1F92 A93 R100F92-Q96 PolarHBondContact O-N 3.47Å; A93-Q96 PolarHBondContact O-N 3.4Å; Q96-R100 WeakPolarHBondContact O-CB 3.44Å; Q96-R100 PolarHBondContact O-N 3.1Å
97Q46.1Very low42.1Very low138 Ų138117.8 Ų117.865%0.64562%0.623SS**Hα-helixtrans-72.8-27.8172.8-68.3-171.78.600113.1A93 Q94 K95A93-Q97 PolarHBondContact O-N 2.97Å; Q94-Q97 PolarHBondContact O-N 3.26Å; K95-Q97 VanDerWaalsContact C-N 3.29Å; K95-Q97 PolarHBondContact O-N 3.49Å
98Q45.8Very low41.8Very low132 Ų132119.2 Ų119.262%0.61763%0.629SS**Hα-helixtrans-78.7-36.2171.6-71.8178.9-4.400112.1Q94 K95 W101 A102Q94-Q98 PolarHBondContact O-N 3.47Å; K95-Q98 PolarHBondContact O-N 3.48Å; K95-Q98 VanDerWaalsContact O-N 3.15Å; Q98-W101 PolarHBondContact O-N 3.34Å; Q98-A102 PolarHBondContact O-N 3.21Å
99T44.6Very low41.8Very low78 Ų78114.7 Ų114.748%0.47963%0.633SS.*Hα-helixtrans-73.6-31.1179.2-50.30000113K95 W101 A102 C103K95-T99 PolarHBondContact O-N 3.34Å; K95-T99 PolarHBondContact O-OG1 3.09Å; T99-W101 PolarHBondContact O-N 3.18Å; T99-W101 VanDerWaalsContact O-N 3.17Å; T99-A102 PolarHBondContact O-N 3.15Å; T99-C103 PolarHBondContact O-N 3.47Å
100R38.8Very low42.2Very low211 Ų211119.5 Ų119.580%0.79665%0.649SS**THydrogen-bonded Turntrans-65.1-16.2173.3-174.2164.4172-92.9-0.4113.4Q96Q96-R100 WeakPolarHBondContact O-CB 3.44Å; Q96-R100 PolarHBondContact O-N 3.1Å
101W39Very low42.2Very low216 Ų216124.1 Ų124.182%0.81867%0.665SS**THydrogen-bonded Turntrans-101-7.6172.8-69.571.4000113.1Q98 T99Q98-W101 PolarHBondContact O-N 3.34Å; T99-W101 PolarHBondContact O-N 3.18Å; T99-W101 VanDerWaalsContact O-N 3.17Å
102A39.5Very low42.1Very low77 Ų77122.4 Ų122.464%0.63666%0.66SS**THydrogen-bonded Turntrans-103.1-5.418000000113.5Q98 T99Q98-A102 PolarHBondContact O-N 3.21Å; T99-A102 PolarHBondContact O-N 3.15Å
103C37.4Very low42.1Very low101 Ų101120.3 Ų120.368%0.68266%0.658SS**SBendtrans-120.675.2177.5-57.20000109.5T99T99-C103 PolarHBondContact O-N 3.47Å
104G40.8Very low42.3Very low68 Ų68123.3 Ų123.370%0.70167%0.667SS**SBendtrans168.940.5176.800000113.7
105D40.3Very low42.3Very low118 Ų118126.1 Ų126.163%0.63168%0.677SS**  trans-158.958.5162.2-161.130.5000110.3G107D105-G107 VanDerWaalsContact C-N 3.26Å; D105-G107 PolarHBondContact O-N 3.44Å
106D43.5Very low42.3Very low172 Ų172129.6 Ų129.692%0.9269%0.687SS**  trans-75.488.2165.3-68.8-46.7000108.2
107G45.4Very low42.3Very low49 Ų49131.5 Ų131.551%0.50569%0.693SS.*SBendtrans88.396.1163.900000114.7D105D105-G107 VanDerWaalsContact C-N 3.26Å; D105-G107 PolarHBondContact O-N 3.44Å
108H37.4Very low42.1Very low174 Ų174135.1 Ų135.181%0.80670%0.702SS**  -171.6137.799.9-80.7-62.3000107.8
109G37Very low41.9Very low72 Ų72135 Ų13574%0.74271%0.705SS**  trans-45.7139.6-169.900000114.3D111G109-D111 PolarHBondContact O-N 3.04Å
110I49Very low41.7Very low167 Ų167136 Ų13686%0.85671%0.713SS**  trans-55.592164.5-58.9176.2000107.3
111D40.4Very low41.9Very low156 Ų156132 Ų13283%0.83472%0.715SS**  trans-133.4123163.7-108.8-36.6000108.9G109G109-D111 PolarHBondContact O-N 3.04Å
112N36.8Very low41.9Very low81 Ų81129.7 Ų129.743%0.43372%0.715SS.*  trans95.695.3166-146.268000118.2D114N112-D114 PolarHBondContact O-N 3.26Å
113P46.3Very low41.9Very low81 Ų81132 Ų13253%0.52672%0.717SS.*G310 helixtrans-70.4-5.9175.129.6-33.4000114.4K115 W116P113-K115 VanDerWaalsContact C-N 3.33Å; P113-K115 PolarHBondContact O-N 3.49Å; P113-W116 HydrophobicContact CB-CH2 4.05Å; P113-W116 HydrophobicContact CB-CZ2 4.01Å
114D46Very low42.1Very low122 Ų122132.9 Ų132.965%0.65272%0.722SS**G310 helixtrans-84.3-0.4-176.2-63.1-40.4000114.9N112 W116N112-D114 PolarHBondContact O-N 3.26Å; D114-W116 VanDerWaalsContact C-N 3.31Å; D114-W116 PolarHBondContact O-N 3.25Å
115K45.5Very low42.2Very low165 Ų165133.4 Ų133.472%0.71772%0.719SS**G310 helixtrans-79.6-12.5179.8-64.7-96-175172.80113.1P113 K117P113-K115 VanDerWaalsContact C-N 3.33Å; P113-K115 PolarHBondContact O-N 3.49Å; K115-K117 PolarHBondContact O-N 3.08Å
116W42.7Very low42.3Very low205 Ų205135 Ų13578%0.77773%0.728SS**G310 helixtrans-79.1-7.7-176.7-39.9-26.1000113.2P113 D114 Y118P113-W116 HydrophobicContact CB-CH2 4.05Å; P113-W116 HydrophobicContact CB-CZ2 4.01Å; D114-W116 VanDerWaalsContact C-N 3.31Å; D114-W116 PolarHBondContact O-N 3.25Å; W116-Y118 PolarHBondContact O-N 3.38Å
117K45.5Very low42.1Very low179 Ų179131.4 Ų131.478%0.77872%0.722SS**G310 helixtrans-81.83.8-176.1-141.916576.4-175.70114.6K115K115-K117 PolarHBondContact O-N 3.08Å
118Y41.5Very low41.7Very low214 Ų214133 Ų13384%0.83973%0.73SS**  trans-133.275.2170.7-71.6-78.2000110.8W116W116-Y118 PolarHBondContact O-N 3.38Å
119N42Very low41.5Very low128 Ų128130.9 Ų130.968%0.68473%0.732SS**  trans-112.6115154.4-157.355.2000106.8
120P41.1Very low41.4Very low99 Ų99131.3 Ų131.364%0.64374%0.736SS**  trans-61.5152.6170.228-31.2000108.5M122P120-M122 PolarHBondContact O-N 2.92Å
121P43.5Very low40.9Very low128 Ų128126.4 Ų126.483%0.83173%0.727SS**  trans-60.2112.8-179.524.2-31.4000108.7N123P121-N123 PolarHBondContact O-N 3.33Å
122M39Very low40.9Very low167 Ų167124.8 Ų124.882%0.82373%0.725SS**  trans-61.5105.9166.9-84.1-139-69.600107.3P120 P124P120-M122 PolarHBondContact O-N 2.92Å; M122-P124 WeakPolarHBondContact O-CD 3.45Å
123N38.7Very low41Very low125 Ų125127.6 Ų127.667%0.66875%0.747SS**  trans-62.3123.3168.9-171.13.4000108P121 A125P121-N123 PolarHBondContact O-N 3.33Å; N123-A125 PolarHBondContact O-N 3.01Å
124P42.5Very low40.5Very low121 Ų121127.2 Ų127.279%0.78676%0.759SS**G310 helixtrans-62.4-4.9-178.5-22.533000115.1M122 N126M122-P124 WeakPolarHBondContact O-CD 3.45Å; P124-N126 VanDerWaalsContact C-N 3.31Å; P124-N126 PolarHBondContact O-N 3.02Å
125A41.8Very low40.1Very low78 Ų78129.6 Ų129.665%0.64577%0.771SS**G310 helixtrans-75.7-5.2-173.600000115.6N123N123-A125 PolarHBondContact O-N 3.01Å
126N42.5Very low39.6Very low153 Ų153124.8 Ų124.882%0.81877%0.768SS**G310 helixtrans-12517.5-173.2-149.567.6000116.2P124 A128P124-N126 VanDerWaalsContact C-N 3.31Å; P124-N126 PolarHBondContact O-N 3.02Å; N126-A128 VanDerWaalsContact C-N 3.33Å
127A40.4Very low39.5Very low96 Ų96121.1 Ų121.179%0.79377%0.774SS**  trans-97.638.1171.200000112.3
128A35.3Very low39.4Very low82 Ų82120.8 Ų120.868%0.67878%0.781SS**PPolyproline II helixtrans-79.4135.2170.600000109.6N126 G130N126-A128 VanDerWaalsContact C-N 3.33Å; A128-G130 PolarHBondContact O-N 3.09Å
129P34.9Very low39Very low129 Ų129114.2 Ų114.284%0.83878%0.778SS**PPolyproline II helixtrans-55133.3176.5-21.931.9000110.9G131P129-G131 PolarHBondContact O-N 3.49Å
130G34.6Very low38.5Very low81 Ų81111.8 Ų111.884%0.83578%0.783SS**PPolyproline II helixtrans-50.1125.6-173.700000113.8A128A128-G130 PolarHBondContact O-N 3.09Å
131G38.9Very low39Very low64 Ų64113.7 Ų113.766%0.6680%0.795SS**PPolyproline II helixtrans-72.1161.7165.700000111.9P129P129-G131 PolarHBondContact O-N 3.49Å
132P39.2Very low38.5Very low123 Ų123110.7 Ų110.780%0.79979%0.788SS**PPolyproline II helixtrans-63.4153.3-172.327.6-34.2000112.2G134P132-G134 PolarHBondContact O-N 3.45Å
133P38.4Very low39Very low139 Ų139108 Ų10890%0.90379%0.792SS**  trans-67.1106.6-16826.4-33000111.4
134G36Very low39.2Very low74 Ų74109.1 Ų109.176%0.76380%0.797SS**PPolyproline II helixtrans-94.4126.1174.900000111.8P132P132-G134 PolarHBondContact O-N 3.45Å
135N37.9Very low38.9Very low171 Ų171106.1 Ų106.191%0.91479%0.788SS**PPolyproline II helixtrans-48.3135.2-179.5-147.142.8000113.3
136G35.6Very low39.3Very low64 Ų64109.7 Ų109.766%0.6680%0.802SS**PPolyproline II helixtrans-72.1163-167.400000117.3
137S39.6Very low39.2Very low129 Ų129109.3 Ų109.390%0.90280%0.798SS**  trans176.3142.6133.9-79.70000110.2
138N43.2Very low39.1Very low172 Ų172108.1 Ų108.192%0.9280%0.795SS**  trans-41.3146.4-177.8-70.7-33.5000116.8
139G34.2Very low39.4Very low76 Ų76113.7 Ų113.778%0.78481%0.81SS**  trans11998.7130.100000118.2
140G31.5Very low39.6Very low76 Ų76111.1 Ų111.178%0.78481%0.807SS**  trans72.5162.2132.700000120.3
141P50.2Low39.8Very low139 Ų139113.4 Ų113.490%0.90381%0.81SS**  trans-91.2145.1-159.536.2-32.5000113.2
142G34.7Very low39.6Very low66 Ų66113.1 Ų113.168%0.6881%0.806SS**  trans-174106.3169.100000112.2I144G142-I144 PolarHBondContact O-N 3.12Å
143A49.5Very low39.5Very low110 Ų110116.1 Ų116.191%0.90982%0.815SS**  trans-68.8110.9158.800000107.8
144I41.6Very low39.2Very low149 Ų149113.3 Ų113.376%0.76481%0.811SS**  trans-129.2106.7170-60.9-172.8000108.6G142G142-I144 PolarHBondContact O-N 3.12Å
145G35.8Very low39.2Very low58 Ų58113.7 Ų113.760%0.59882%0.815SS**  trans41.1127.7142.800000120.3I147G145-I147 PolarHBondContact O-N 2.96Å
146T50.4Low39Very low152 Ų152109.6 Ų109.693%0.93381%0.814SS**  trans-48.999.3151.1450000110.4G148T146-G148 PolarHBondContact O-N 3.15Å
147I41.3Very low39Very low146 Ų146110.6 Ų110.675%0.74982%0.824SS**  trans-89.4101.2168.4-63.1174000106.8G145 M149G145-I147 PolarHBondContact O-N 2.96Å; I147-M149 PolarHBondContact O-N 3.34Å
148G38.2Very low38.7Very low70 Ų70108 Ų10872%0.72282%0.818SS**  trans-61.1121.616800000110.5T146 G150T146-G148 PolarHBondContact O-N 3.15Å; G148-G150 VanDerWaalsContact C-N 3.34Å; G148-G150 PolarHBondContact O-N 3.34Å
149M42.6Very low38.4Very low200 Ų200104.1 Ų104.199%0.98582%0.818SS**  trans-84.286.2157.7-74.8-172.4-176.300107.8I147I147-M149 PolarHBondContact O-N 3.34Å
150G37.6Very low38.5Very low75 Ų75104.3 Ų104.377%0.77382%0.82SS**  trans-142.272.6173.700000109.1G148G148-G150 VanDerWaalsContact C-N 3.34Å; G148-G150 PolarHBondContact O-N 3.34Å
151S39.6Very low39Very low129 Ų129106 Ų10690%0.90283%0.826SS**  trans-107110.6170.8-160.50000108.8
152G34.9Very low38.3Very low57 Ų57103 Ų10359%0.58882%0.82SS**  trans108.998.8139.100000118.9
153L35.9Very low38.6Very low186 Ų186104 Ų10497%0.97483%0.831SS**  trans58.6119.8137.1-73.587.5000120.6
154G33.3Very low38Very low80 Ų80102.4 Ų102.483%0.82583%0.826SS**  138.9116.7129.100000116.6
155G34.9Very low38.1Very low82 Ų82102.8 Ų102.885%0.84583%0.829SS**  trans100.6106.7145.800000116.3
156G35.1Very low38.5Very low86 Ų86108.3 Ų108.389%0.88785%0.845SS**  trans-73.2178.517200000115
157G34.2Very low37.7Very low85 Ų85104.8 Ų104.888%0.87684%0.839SS**  trans113.2118.4-179.200000109.1
158G34.8Very low37.7Very low75 Ų75101.9 Ų101.977%0.77385%0.845SS**  cis146.2123.714.600000105.7
159G36Very low37.7Very low89 Ų89104.4 Ų104.492%0.91885%0.851SS**  trans68146.5157.300000118.4
160G36.4Very low37.6Very low81 Ų8198.3 Ų98.384%0.83584%0.84SS**  trans136.593.3153.500000114.4
161A41.5Very low38Very low111 Ų111101.5 Ų101.592%0.91785%0.845SS**  trans-55.7162.8164.100000112.9
162G36.2Very low38.4Very low75 Ų75103.6 Ų103.677%0.77385%0.846SS**  trans137.4112.9152.900000114
163G40.9Very low38.6Very low88 Ų88103.9 Ų103.991%0.90785%0.849SS**  trans-64.1161.7162.800000111.9
164G36.2Very low39.1Very low77 Ų7797.9 Ų97.979%0.79483%0.832SS**  trans172.1110.4174.800000111.3
165N44.6Very low39.7Very low157 Ų157102.5 Ų102.584%0.8484%0.837SS**  trans-56.9157.1166-66.4-1.8000111.1
166N43.3Very low40.2Very low173 Ų173105.7 Ų105.793%0.92583%0.83SS**  trans90.6128161.9-74.16.9000120.1
167G35Very low40.6Very low79 Ų79109.2 Ų109.281%0.81482%0.823SS**  trans14873.1167.700000108.7
168G39.6Very low41.1Very low84 Ų84113.8 Ų113.887%0.86682%0.821SS**  77.575.357.900000110
169S38.5Very low41.4Very low123 Ų123114.3 Ų114.386%0.8681%0.813SS**  trans-138.489.9166.8-165.60000111
170G41.6Very low41.7Very low73 Ų73116.8 Ų116.875%0.75380%0.803SS**  trans66.456.9137.600000120.2N172G170-N172 PolarHBondContact O-N 3.25Å
171T46Very low42Very low142 Ų142116.4 Ų116.487%0.87179%0.791SS**  trans-80.766.4160.3-36.20000110.7
172N46.4Very low41.9Very low172 Ų172114.1 Ų114.192%0.9277%0.773SS**  trans-10377.6159.3-86.4-14.5000108G170G170-N172 PolarHBondContact O-N 3.25Å
173G39.1Very low42.2Very low64 Ų64112.8 Ų112.866%0.6675%0.754SS**  trans-141.663.1170.900000108.2
174G46.7Very low42.2Very low60 Ų60111.6 Ų111.662%0.61974%0.736SS**  trans-62.4151.6-177.700000113.1
175L47.7Very low42.6Very low176 Ų176111 Ų11192%0.92172%0.724SS**SBendtrans828.3154.2-53.1173000120.2
176H45.2Very low42.5Very low150 Ų150108.9 Ų108.969%0.69471%0.712SS**SBendtrans-119.614-179.8-74.9-91.9000116.9
177H43.1Very low42.3Very low159 Ų159106.5 Ų106.574%0.73670%0.697SS**SBendtrans-1265.7-178.3-83.9-90.8000116.4
178Q44Very low42.4Very low181 Ų181105.3 Ų105.385%0.84668%0.679SS**Hα-helixtrans-86.4-21.9171.4-82.8-173.2-4.600113.6
179S40.7Very low42.6Very low86 Ų86103.8 Ų103.860%0.60166%0.659SS**Hα-helixtrans-80.1-28.2-177.257.40000114.5A183S179-A183 PolarHBondContact O-N 3.43Å
180M42.3Very low42.6Very low142 Ų142104.3 Ų104.370%0.765%0.649SS**Hα-helixtrans-79.3-32.3178.8-82.4-170-167.300113.8A182 A183 A184M180-A182 VanDerWaalsContact C-N 3.34Å; M180-A183 PolarHBondContact O-N 3.43Å; M180-A184 PolarHBondContact O-N 3.04Å; M180-A184 VanDerWaalsContact O-N 3.14Å
181A42.9Very low43Very low72 Ų72108 Ų10860%0.59565%0.647SS**Hα-helixtrans-67.5-36.4177.200000111.7A185A181-A185 PolarHBondContact O-N 3.36Å
182A40.5Very low43Very low64 Ų64107.9 Ų107.953%0.52964%0.636SS.*Hα-helixtrans-72.2-34.7174.800000113.1M180 N186M180-A182 VanDerWaalsContact C-N 3.34Å; A182-N186 WeakPolarHBondContact O-CB 3.35Å; A182-N186 PolarHBondContact O-N 3.12Å; A182-N186 VanDerWaalsContact O-N 3.13Å
183A42.6Very low42.8Very low47 Ų47102.5 Ų102.539%0.38862%0.616SS.*Hα-helixtrans-69.9-34.8177.300000113.1S179 M180 N186 M187S179-A183 PolarHBondContact O-N 3.43Å; M180-A183 PolarHBondContact O-N 3.43Å; A183-N186 PolarHBondContact O-N 3.38Å; A183-M187 WeakPolarHBondContact O-CE 3.49Å; A183-M187 PolarHBondContact O-N 2.98Å
184A40.6Very low42.9Very low63 Ų63102.4 Ų102.452%0.52161%0.609SS.*Hα-helixtrans-69.6-38.2175.300000112.6M180 N186 M187 A188M180-A184 PolarHBondContact O-N 3.04Å; M180-A184 VanDerWaalsContact O-N 3.14Å; A184-N186 VanDerWaalsContact C-N 3.35Å; A184-M187 PolarHBondContact O-N 3.42Å; A184-A188 PolarHBondContact O-N 3.03Å
185A43.5Very low42.6Very low65 Ų65102.6 Ų102.654%0.53761%0.605SS.*Hα-helixtrans-66.1-36.617400000112.3A181 A188 A189A181-A185 PolarHBondContact O-N 3.36Å; A185-A188 PolarHBondContact O-N 3.17Å; A185-A189 PolarHBondContact O-N 3.36Å
186N42.7Very low42.4Very low111 Ų11199.4 Ų99.459%0.59459%0.588SS**Hα-helixtrans-71.8-30-179.8-149.515.2000112.9A182 A183 A184 M190A182-N186 WeakPolarHBondContact O-CB 3.35Å; A182-N186 PolarHBondContact O-N 3.12Å; A182-N186 VanDerWaalsContact O-N 3.13Å; A183-N186 PolarHBondContact O-N 3.38Å; A184-N186 VanDerWaalsContact C-N 3.35Å; N186-M190 PolarHBondContact O-N 3.43Å
187M38.9Very low42.5Very low123 Ų12395 Ų9561%0.60658%0.577SS**Hα-helixtrans-74.2-35.5173.5-88.8-178.1-84.500113.3A183 A184 M190 Q191A183-M187 WeakPolarHBondContact O-CE 3.49Å; A183-M187 PolarHBondContact O-N 2.98Å; A184-M187 PolarHBondContact O-N 3.42Å; M187-M190 PolarHBondContact O-N 3.19Å; M187-Q191 PolarHBondContact O-N 3.25Å
188A38.6Very low42.3Very low54 Ų5495.1 Ų95.145%0.44658%0.576SS.*Hα-helixtrans-66.2-37.5175.600000112.1A184 A185 Q191 Q192A184-A188 PolarHBondContact O-N 3.03Å; A185-A188 PolarHBondContact O-N 3.17Å; A188-Q191 PolarHBondContact O-N 3.48Å; A188-Q192 PolarHBondContact O-N 3.38Å
189A42.6Very low42Very low53 Ų5391.8 Ų91.844%0.43856%0.56SS.*Hα-helixtrans-66.9-36.7174.400000112.8A185 Q192 A193A185-A189 PolarHBondContact O-N 3.36Å; A189-Q192 PolarHBondContact O-N 3.44Å; A189-A193 PolarHBondContact O-N 3.39Å; A189-A193 VanDerWaalsContact O-N 3.12Å
190M39.7Very low42.2Very low134 Ų13492.5 Ų92.566%0.6656%0.557SS**Hα-helixtrans-67.3-35.3175.2-89.7-172177.800113.4N186 M187 A193 A194N186-M190 PolarHBondContact O-N 3.43Å; M187-M190 PolarHBondContact O-N 3.19Å; M190-A193 PolarHBondContact O-N 3.47Å; M190-A194 WeakPolarHBondContact O-CB 3.48Å; M190-A194 PolarHBondContact O-N 3.41Å
191Q48.8Very low42.2Very low149 Ų14992 Ų9270%0.69655%0.553SS**Hα-helixtrans-69.5-33.8176.5-82175.1-8.700112.6M187 A188 A194 A195M187-Q191 PolarHBondContact O-N 3.25Å; A188-Q191 PolarHBondContact O-N 3.48Å; Q191-A194 PolarHBondContact O-N 2.95Å; Q191-A195 WeakPolarHBondContact O-CB 3.42Å; Q191-A195 PolarHBondContact O-N 2.86Å
192Q46.8Very low42Very low140 Ų14094.7 Ų94.765%0.65455%0.554SS**Hα-helixtrans-69.5-37.2172.7-73.7178.1-24.500112.1A188 A189 A195 L196A188-Q192 PolarHBondContact O-N 3.38Å; A189-Q192 PolarHBondContact O-N 3.44Å; Q192-A195 PolarHBondContact O-N 3.15Å; Q192-L196 WeakPolarHBondContact O-CB 3.5Å; Q192-L196 WeakPolarHBondContact O-CG 3.45Å; Q192-L196 PolarHBondContact O-N 3.13Å
193A41.9Very low42.3Very low59 Ų5996.1 Ų96.149%0.48855%0.552SS.*Hα-helixtrans-66.3-37.6173.400000112.9A189 M190 A197A189-A193 PolarHBondContact O-N 3.39Å; A189-A193 VanDerWaalsContact O-N 3.12Å; M190-A193 PolarHBondContact O-N 3.47Å; A193-A197 WeakPolarHBondContact O-CB 3.46Å; A193-A197 PolarHBondContact O-N 3.44Å
194A40.8Very low42.3Very low63 Ų6397.3 Ų97.352%0.52156%0.558SS.*Hα-helixtrans-70.4-34.7175.600000112.9M190 Q191 K198M190-A194 WeakPolarHBondContact O-CB 3.48Å; M190-A194 PolarHBondContact O-N 3.41Å; Q191-A194 PolarHBondContact O-N 2.95Å; A194-K198 PolarHBondContact O-N 3.28Å; A194-K198 VanDerWaalsContact O-N 3.08Å
195A40.1Very low42.7Very low64 Ų64100.8 Ų100.853%0.52956%0.563SS.*Hα-helixtrans-69-39.317400000112.2Q191 Q192 K198 H199Q191-A195 WeakPolarHBondContact O-CB 3.42Å; Q191-A195 PolarHBondContact O-N 2.86Å; Q192-A195 PolarHBondContact O-N 3.15Å; A195-K198 PolarHBondContact O-N 3.05Å; A195-H199 PolarHBondContact O-N 3.32Å; A195-H199 VanDerWaalsContact O-N 3.09Å
196L45.3Very low42.9Very low108 Ų108100.7 Ų100.757%0.56556%0.562SS**Hα-helixtrans-69.7-34.3173.9-78.3159.6000112.7Q192 H199 N200Q192-L196 WeakPolarHBondContact O-CB 3.5Å; Q192-L196 WeakPolarHBondContact O-CG 3.45Å; Q192-L196 PolarHBondContact O-N 3.13Å; L196-H199 PolarHBondContact O-N 3.23Å; L196-N200 PolarHBondContact O-N 3.36Å; L196-N200 PolarHBondContact O-ND2 3.4Å
197A45.6Very low43Very low57 Ų5798.4 Ų98.447%0.47156%0.559SS.*Hα-helixtrans-64.5-39.7172.200000111.9A193 H199 N200 H201A193-A197 WeakPolarHBondContact O-CB 3.46Å; A193-A197 PolarHBondContact O-N 3.44Å; A197-H199 VanDerWaalsContact C-N 3.33Å; A197-H199 PolarHBondContact O-N 3.22Å; A197-N200 PolarHBondContact O-N 3.37Å; A197-H201 PolarHBondContact O-N 3.5Å
198K40.4Very low43.4Very low163 Ų16395.5 Ų95.571%0.70955%0.554SS**Hα-helixtrans-68.1-31.6175.4-145.8179.1-173-174.90112.5A194 A195 M202A194-K198 PolarHBondContact O-N 3.28Å; A194-K198 VanDerWaalsContact O-N 3.08Å; A195-K198 PolarHBondContact O-N 3.05Å; K198-M202 PolarHBondContact O-N 3.3Å
199H37Very low43.8Very low111 Ų11195.8 Ų95.851%0.51456%0.557SS.*Hα-helixtrans-71.5-41.6174.5-165.1-122.3000112.3A195 L196 A197 H201 M202 I203A195-H199 PolarHBondContact O-N 3.32Å; A195-H199 VanDerWaalsContact O-N 3.09Å; L196-H199 PolarHBondContact O-N 3.23Å; A197-H199 VanDerWaalsContact C-N 3.33Å; A197-H199 PolarHBondContact O-N 3.22Å; H199-H201 VanDerWaalsContact C-N 3.34Å; H199-H201 PolarHBondContact O-N 3.45Å; H199-M202 PolarHBondContact O-N 3.29Å; H199-I203 PolarHBondContact O-N 3.18Å
200N44Very low44.2Very low101 Ų10197.6 Ų97.654%0.5456%0.562SS.*Hα-helixtrans-66.2-34.1173.9-88.3-46.9000112.9L196 A197 M202 I203 S204L196-N200 PolarHBondContact O-N 3.36Å; L196-N200 PolarHBondContact O-ND2 3.4Å; A197-N200 PolarHBondContact O-N 3.37Å; N200-M202 PolarHBondContact O-N 3.14Å; N200-I203 PolarHBondContact O-N 3Å; N200-S204 PolarHBondContact O-N 3.32Å; N200-S204 VanDerWaalsContact O-N 3.09Å; N200-S204 PolarHBondContact O-OG 3.29Å
201H42.7Very low44.6Very low131 Ų13194.5 Ų94.561%0.60656%0.558SS**Hα-helixtrans-69.4-32.7-179.5-136.9-4000113.2A197 H199 Q205A197-H201 PolarHBondContact O-N 3.5Å; H199-H201 VanDerWaalsContact C-N 3.34Å; H199-H201 PolarHBondContact O-N 3.45Å; H201-Q205 PolarHBondContact O-N 3.02Å
202M39.8Very low44.5Very low128 Ų12890.5 Ų90.563%0.63155%0.551SS**Hα-helixtrans-70.8-39.7173.8-106.8-173.3-65.100112.6K198 H199 N200 S204 Q205 A206K198-M202 PolarHBondContact O-N 3.3Å; H199-M202 PolarHBondContact O-N 3.29Å; N200-M202 PolarHBondContact O-N 3.14Å; M202-S204 VanDerWaalsContact C-N 3.33Å; M202-S204 PolarHBondContact O-N 3.4Å; M202-Q205 PolarHBondContact O-N 3.03Å; M202-A206 PolarHBondContact O-N 3.22Å
203I45.2Very low44.5Very low94 Ų9491.7 Ų91.748%0.48256%0.556SS.*Hα-helixtrans-65.2-37.4177.3-74.7169.2000111.2H199 N200 A206 A207H199-I203 PolarHBondContact O-N 3.18Å; N200-I203 PolarHBondContact O-N 3Å; I203-A206 PolarHBondContact O-N 3.17Å; I203-A207 PolarHBondContact O-N 3.3Å; I203-A207 VanDerWaalsContact O-N 3.1Å
204S43.9Very low44.8Very low72 Ų7296.7 Ų96.750%0.50357%0.569SS.*Hα-helixtrans-72.9-27.3177-66.60000114.1N200 M202 A208N200-S204 PolarHBondContact O-N 3.32Å; N200-S204 VanDerWaalsContact O-N 3.09Å; N200-S204 PolarHBondContact O-OG 3.29Å; M202-S204 VanDerWaalsContact C-N 3.33Å; M202-S204 PolarHBondContact O-N 3.4Å; S204-A208 WeakPolarHBondContact O-CB 3.46Å; S204-A208 PolarHBondContact O-N 2.79Å; S204-A208 VanDerWaalsContact O-N 3.07Å
205Q48.3Very low45.1Very low136 Ų136102.1 Ų102.164%0.63658%0.584SS**Hα-helixtrans-71.6-34.2170.9-78.2-175.32200112.1H201 M202 A209H201-Q205 PolarHBondContact O-N 3.02Å; M202-Q205 PolarHBondContact O-N 3.03Å; Q205-A209 PolarHBondContact O-N 2.94Å; Q205-A209 VanDerWaalsContact O-N 3.13Å
206A47Very low45.3Very low63 Ų63107 Ų10752%0.52160%0.596SS.*Hα-helixtrans-67.8-36.1173.500000112.3M202 I203 V210M202-A206 PolarHBondContact O-N 3.22Å; I203-A206 PolarHBondContact O-N 3.17Å; A206-V210 WeakPolarHBondContact O-CG2 3.4Å
207A45.7Very low45.1Very low63 Ų63110 Ų11052%0.52161%0.607SS.*Hα-helixtrans-72.6-35.3176.200000113.3I203 A211I203-A207 PolarHBondContact O-N 3.3Å; I203-A207 VanDerWaalsContact O-N 3.1Å; A207-A211 PolarHBondContact O-N 3.32Å
208A47.5Very low44.7Very low62 Ų62115.7 Ų115.751%0.51262%0.623SS.*Hα-helixtrans-72.9-31.2176.800000113.2S204 A211 A212S204-A208 WeakPolarHBondContact O-CB 3.46Å; S204-A208 PolarHBondContact O-N 2.79Å; S204-A208 VanDerWaalsContact O-N 3.07Å; A208-A211 PolarHBondContact O-N 2.94Å; A208-A212 PolarHBondContact O-N 3.19Å; A208-A212 VanDerWaalsContact O-N 3.13Å
209A46.9Very low44.8Very low60 Ų60113.7 Ų113.750%0.49663%0.627SS.*Hα-helixtrans-68.8-32.3175.500000112.9Q205 Q213Q205-A209 PolarHBondContact O-N 2.94Å; Q205-A209 VanDerWaalsContact O-N 3.13Å; A209-Q213 PolarHBondContact O-N 3.32Å
210V51.4Low44.9Very low92 Ų92117.8 Ų117.856%0.55865%0.646SS**Hα-helixtrans-75.9-33.5176.1178.70000111.5A206 Q213A206-V210 WeakPolarHBondContact O-CG2 3.4Å; V210-Q213 PolarHBondContact O-N 3.34Å
211A47.6Very low44.6Very low68 Ų68121.2 Ų121.256%0.56266%0.659SS**Hα-helixtrans-69.7-31.5174.200000112.9A207 A208A207-A211 PolarHBondContact O-N 3.32Å; A208-A211 PolarHBondContact O-N 2.94Å
212A46.3Very low44.4Very low66 Ų66122.8 Ų122.855%0.54567%0.666SS.*Hα-helixtrans-74.6-21.9177.200000114A208A208-A212 PolarHBondContact O-N 3.19Å; A208-A212 VanDerWaalsContact O-N 3.13Å
213Q46.2Very low44Very low165 Ų165126 Ų12677%0.77168%0.679SS**Hα-helixtrans-82.1-17.2177.6-93.3-175.3-13.700114.5A209 V210A209-Q213 PolarHBondContact O-N 3.32Å; V210-Q213 PolarHBondContact O-N 3.34Å
214Q48.7Very low44Very low164 Ų164127.2 Ų127.277%0.76669%0.693SS**G310 helixtrans-84-12.9-179.2-79.2-16717.200115.2
215Q48.2Very low44Very low177 Ų177132.6 Ų132.683%0.82771%0.71SS**G310 helixtrans-87.3-1.8-179.1-87-164.3-31.800115.8
216H44.4Very low43.7Very low167 Ų167135.6 Ų135.677%0.77372%0.724SS**G310 helixtrans-101.810.6-173.8-84.487000116.1
217Q41Very low43.4Very low170 Ų170141.9 Ų141.979%0.79474%0.743SS**  trans-124.370.2177.7-73.7-163.135.600113.7
218H37.1Very low43.4Very low177 Ų177148 Ų14882%0.81976%0.761SS**  trans-129.1106.9152.6-77.1-73.4000109.5H220H218-H220 PolarHBondContact O-N 2.93Å
219P42.8Very low43.2Very low120 Ų120154.3 Ų154.378%0.77978%0.779SS**  trans-71.5119.4175.627.5-30.2000109.9Q221P219-Q221 PolarHBondContact O-N 3.49Å
220H37.9Very low43Very low197 Ų197160.6 Ų160.691%0.91280%0.799SS**  trans-82.696.4170.2-123.465.5000108.8H218H218-H220 PolarHBondContact O-N 2.93Å
221Q38.7Very low42.7Very low174 Ų174165.5 Ų165.581%0.81382%0.815SS**  trans-95.1114.5164.2-93-17714.300109.9P219P219-Q221 PolarHBondContact O-N 3.49Å
222Q37.3Very low42.5Very low163 Ų163171.8 Ų171.876%0.76283%0.833SS**  trans45.6122.1140.1-58.3-174.4-4.400120.5
223H33Very low42.3Very low196 Ų196173.5 Ų173.591%0.90785%0.847SS**  -167.5108.6125.2-94.2-75.3000110
224P44.3Very low42.1Very low119 Ų119175.2 Ų175.277%0.77386%0.856SS**  trans-111.293.6167.533.9-21.2000110.5
225Q44.6Very low41.7Very low185 Ų185174.6 Ų174.686%0.86486%0.857SS**  trans-168.697.9161.9-121.1159.3-6.900111.7
226Q41.5Very low41.2Very low200 Ų200175.1 Ų175.194%0.93586%0.86SS**  trans17176.9143.7-96.4177.433.200108.6
227Q41.3Very low40.8Very low194 Ų194170.2 Ų170.291%0.90786%0.855SS**  trans-144.857.1167.8-149.1176.635.400110.2
228Q44.6Very low40.7Very low193 Ų193171.5 Ų171.590%0.90286%0.86SS**  trans-155.260.4171.5-133.417636.300111.9
229Q43.8Very low41.3Very low193 Ų193167.9 Ų167.990%0.90285%0.853SS**SBendtrans-161.462.3163-125.3174.250.500112.5
230Q43.2Very low41.2Very low193 Ų193170.8 Ų170.890%0.90286%0.855SS**  trans-157.549.4165.8-127.8171.237.900113.8
231Q43.8Very low41.4Very low194 Ų194170.1 Ų170.191%0.90785%0.852SS**  trans-142.229.6177.4-116.1155.94100115.8
232Q44.3Very low41.5Very low200 Ų200168.9 Ų168.994%0.93585%0.85SS**SBendtrans-136.572.9166.8-92.7-176.5-24.200111.1
233A42Very low41.7Very low102 Ų102169.2 Ų169.284%0.84385%0.854SS**  trans-162.753.1160.400000110.5
234Q42.3Very low41.9Very low202 Ų202163.8 Ų163.894%0.94485%0.851SS**  trans-134.663.4172.9-127.3-178.11.600109.2
235N39.4Very low41.7Very low150 Ų150162.1 Ų162.180%0.80286%0.856SS**  trans-153.4120.5157-145.58.2000110
236Q38.9Very low41.7Very low188 Ų188156.9 Ų156.988%0.87985%0.851SS**SBendtrans112.1105.8166.4-60.8-174.837.500116.3
237G34.4Very low41.6Very low65 Ų65155.2 Ų155.267%0.6785%0.849SS**  trans8890135.900000116.8
238H39.3Very low41.5Very low196 Ų196149.7 Ų149.791%0.90784%0.844SS**  trans-88.2131.2141.2-68.75.6000107.6
239P49.5Very low41.6Very low102 Ų102149 Ų14966%0.66285%0.845SS**  trans-126.8154.2131.934-23.4000112.1
240H42.1Very low41.5Very low180 Ų180143.3 Ų143.383%0.83384%0.838SS**  trans-58.1137.8-177.1-60.3-100.3000113.8
241H41.6Very low41.6Very low184 Ų184142.4 Ų142.485%0.85284%0.84SS**  trans-122.893.1151.1-60-57.9000109.7
242L40.3Very low41.5Very low147 Ų147136.2 Ų136.277%0.7783%0.828SS**  trans-60.8137158.5177.865.3000109.9
243M41.3Very low41.7Very low171 Ų171135 Ų13584%0.84283%0.828SS**SBendtrans42.6120.3143.4-158.6176.4-72.200119.5
244G36.8Very low41.5Very low81 Ų81133.7 Ų133.784%0.83582%0.824SS**  trans108.1121.814000000116.9
245G41.4Very low41.7Very low85 Ų85132.5 Ų132.588%0.87682%0.823SS**  trans153.6113.7164.700000109.9
246G43.6Very low41.6Very low75 Ų75129 Ų12977%0.77382%0.823SS**  cis-169.4167.56.100000110.1
247N40.2Very low42.2Very low164 Ų164127.7 Ų127.788%0.87782%0.82SS**  trans-55133-172.2-63.9-43.9000115
248G38.9Very low42.3Very low78 Ų78132.8 Ų132.880%0.80483%0.827SS**  trans-126.489.6152.400000108.4G250G248-G250 PolarHBondContact O-N 3.04Å; G248-G250 VanDerWaalsContact O-N 3.13Å
249L45.8Very low42.3Very low179 Ų179131.4 Ų131.494%0.93782%0.82SS**  trans-66.3104.9170.8-75.6158.2000108.4
250G42.6Very low42.1Very low73 Ų73133.3 Ų133.375%0.75383%0.832SS**  trans-155.582.3177.800000109.8G248 G252G248-G250 PolarHBondContact O-N 3.04Å; G248-G250 VanDerWaalsContact O-N 3.13Å; G250-G252 PolarHBondContact O-N 3.39Å
251N45.2Very low42.2Very low175 Ų175128 Ų12894%0.93683%0.826SS**  trans-64.5121.5173.4-160.2-14.3000109
252G41.7Very low42.3Very low64 Ų64127.4 Ų127.466%0.6682%0.824SS**  trans167.5101.817700000113.7G250 G254G250-G252 PolarHBondContact O-N 3.39Å; G252-G254 PolarHBondContact O-N 3.32Å
253N48Very low42.6Very low175 Ų175129.8 Ų129.894%0.93683%0.831SS**  trans-49.6131.4165.1-66.9-61.9000111.2
254G39Very low43Very low73 Ų73130.6 Ų130.675%0.75383%0.833SS**  trans166.986.5173.900000112.6G252 G256G252-G254 PolarHBondContact O-N 3.32Å; G254-G256 PolarHBondContact O-N 3.01Å
255L46.2Very low43.4Very low177 Ų177135 Ų13593%0.92783%0.832SS**PPolyproline II helixtrans-48.2119.5167.7-68.1160.5000109.7
256G37.9Very low43.7Very low78 Ų78139.9 Ų139.980%0.80483%0.832SS**PPolyproline II helixtrans-60.2133.6179.400000112.2G254G254-G256 PolarHBondContact O-N 3.01Å
257I49.6Very low43.9Very low160 Ų160145.3 Ų145.382%0.82184%0.837SS**PPolyproline II helixtrans-79.7118.7161.5-61.1172.7000106.6
258Q36.4Very low44.4Very low171 Ų171146.5 Ų146.580%0.79984%0.837SS**  trans-171111.8153.5-101.7143.630.100113.6
259H40Very low44.8Very low168 Ų168151.5 Ų151.578%0.77884%0.84SS**  trans65.6103.5151.3-53.1-79.9000122G261H259-G261 PolarHBondContact O-N 3.42Å
260P46.1Very low44.9Very low141 Ų141151.9 Ų151.992%0.91684%0.836SS**SBendtrans-89.296.5158.733.9-23.9000109.2
261G43Very low45Very low68 Ų68157.7 Ų157.770%0.70184%0.844SS**SBendtrans-167.9-4.5178.500000118.4H259H259-G261 PolarHBondContact O-N 3.42Å
262Q43.3Very low45Very low173 Ų173158.2 Ų158.281%0.80884%0.841SS**SBendtrans-127.31.2-171.4-72.8-82.57.400114.9
263Q46.8Very low45.4Very low197 Ų197163.5 Ų163.592%0.92185%0.849SS**SBendtrans-96.8-3.8-177.7-80-174.1-9.900115.6
264Q49.6Very low44.9Very low188 Ų188163 Ų16388%0.87984%0.841SS**SBendtrans-96.3-4.9-173.8-122171.56.700115.7
265Q47Very low44.9Very low174 Ų174168.2 Ų168.281%0.81385%0.845SS**SBendtrans-95.1-7.2-178-92.6-177.7-6.300115.7
266Q45.8Very low45Very low186 Ų186166.1 Ų166.187%0.86984%0.842SS**SBendtrans-93.7-4.1-178-98.7179.51300116
267Q49.7Very low45.2Very low190 Ų190165.6 Ų165.689%0.88884%0.837SS**SBendtrans-97.5-4.4-179.9-100.1-17922.600115.9
268Q50Low44.9Very low188 Ų188166.6 Ų166.688%0.87984%0.838SS**SBendtrans-99.8-3-176.5-105-18044.400116.2
269Q48.1Very low45Very low184 Ų184170.1 Ų170.186%0.8685%0.845SS**SBendtrans-101.94.1-178.6-89.4-175.525.100116
270Q45.9Very low45.2Very low186 Ų186167.9 Ų167.987%0.86984%0.839SS**SBendtrans-104.817.2-178.2-94.5-172.84100116.2
271Q45Very low45Very low195 Ų195165.7 Ų165.791%0.91183%0.833SS**SBendtrans-119.621.5175-84.6-168.447.200115.1
272Q45.8Very low44.9Very low187 Ų187167.7 Ų167.787%0.87483%0.828SS**SBendtrans-113.711.6179.1-107.9-172.860.300116.4
273Q50.4Low45.1Very low175 Ų175166.1 Ų166.182%0.81882%0.824SS**SBendtrans-134.5129.1169.9-71.6-176.821.700111.1
274Q37.9Very low45.2Very low165 Ų165165 Ų16577%0.77182%0.823SS**  trans92.788173.9-50.3179.229.800114.6
275H38.9Very low44.5Very low182 Ų182161.8 Ų161.884%0.84381%0.812SS**  -172.1124.3102.2-77.2-62.7000110
276P48.1Very low44Very low133 Ų133161.4 Ų161.486%0.86481%0.81SS**  trans-85.8120.7166.932.7-25.5000108.6
277G42.6Very low43.6Very low67 Ų67157.2 Ų157.269%0.69181%0.807SS**  trans148.7111.9168.300000115.4
278Q41.9Very low43.3Very low180 Ų180152.8 Ų152.884%0.84180%0.803SS**  trans61.2103148.3-55.9-161.518.100118.6
279Y38.8Very low43.1Very low245 Ų245148.1 Ų148.196%0.96180%0.797SS**  -141.9137118.1-77.6-70.6000110.1A281Y279-A281 PolarHBondContact O-N 3.37Å
280N45.5Very low42.7Very low122 Ų122147.8 Ų147.865%0.65280%0.8SS**  trans-92.496-156.5-168.15.6000110.2L283N280-L283 VanDerWaalsContact ND2-CD1 3.28Å; N280-L283 WeakPolarHBondContact ND2-CD1 3.44Å
281A41.5Very low42.5Very low94 Ų94141.9 Ų141.978%0.77779%0.789SS**  trans-96.827173.600000113Y279Y279-A281 PolarHBondContact O-N 3.37Å
282N40.3Very low42.3Very low111 Ų111141.9 Ų141.959%0.59479%0.789SS**  trans-127.114.9-177.5-85.3-43000115.2L284N282-L284 VanDerWaalsContact C-N 3.27Å; N282-L284 PolarHBondContact O-N 2.9Å
283L47.5Very low42Very low139 Ų139142.2 Ų142.273%0.72879%0.793SS**THydrogen-bonded Turntrans-77-11.5169.7-108.467.7000114N280N280-L283 VanDerWaalsContact ND2-CD1 3.28Å; N280-L283 WeakPolarHBondContact ND2-CD1 3.44Å
284L48.4Very low41.2Very low173 Ų173139.9 Ų139.991%0.90680%0.796SS**THydrogen-bonded Turntrans-92.6-3.1179.5-155.162.2000114N282N282-L284 VanDerWaalsContact C-N 3.27Å; N282-L284 PolarHBondContact O-N 2.9Å
285N36.5Very low40.9Very low121 Ų121136.4 Ų136.465%0.64779%0.79SS**SBendtrans-12020.2-175.5-151.7-18.5000114.5
286H35.6Very low40.7Very low166 Ų166138.3 Ų138.377%0.76979%0.791SS**SBendtrans-121.13.9171.4-87.944.1000113.7A288H286-A288 VanDerWaalsContact C-N 3.31Å; H286-A288 PolarHBondContact O-N 3.29Å
287A37.3Very low40.1Very low98 Ų98136.2 Ų136.281%0.8179%0.785SS**THydrogen-bonded Turntrans-82.8-1.3177.500000114.3
288A43.7Very low40Very low98 Ų98142.7 Ų142.781%0.8180%0.797SS**THydrogen-bonded Turntrans-110.79-172.800000115.6H286H286-A288 VanDerWaalsContact C-N 3.31Å; H286-A288 PolarHBondContact O-N 3.29Å
289A44.4Very low39.6Very low89 Ų89139.8 Ų139.874%0.73680%0.797SS**SBendtrans-13532.8-173.400000115.5
290L39.7Very low39.5Very low178 Ų178131.9 Ų131.993%0.93279%0.789SS**  trans-123.250.2167.8-83161.7000111
291G43.6Very low38.8Very low62 Ų62129.9 Ų129.964%0.63980%0.797SS**  trans-102.288.7156.600000108.8
292H39.8Very low38.8Very low195 Ų195131 Ų13190%0.90380%0.8SS**  trans-158.2105.2151.7-90.5-62.2000109.2
293M39Very low38.8Very low194 Ų194134 Ų13496%0.95681%0.812SS**  trans-56.5137163.9-56.6173.1-151.600108.9
294S34.7Very low38.3Very low126 Ų126138.4 Ų138.488%0.88182%0.821SS**  trans-127.7120.4156.5-146.10000109.8
295S31.6Very low37.8Very low92 Ų92137.1 Ų137.164%0.64382%0.815SS**  trans-55.1140-175.7-172.30000112.2A297S295-A297 PolarHBondContact O-N 3.29Å
296Y34.6Very low38.1Very low222 Ų222139 Ų13987%0.87182%0.819SS**  trans-55.6117.9153.347.5-87.4000107.6
297A34.2Very low38.4Very low89 Ų89140 Ų14074%0.73682%0.824SS**  trans-120.7118.8169.300000107.6S295S295-A297 PolarHBondContact O-N 3.29Å
298Q40.6Very low38.3Very low202 Ų202139.4 Ų139.494%0.94483%0.827SS**  trans-51.8134167.5-71163.5-86.100110.2
299S33.6Very low37.8Very low120 Ų120138.6 Ų138.684%0.83983%0.829SS**  trans-147.6115.6155.9-176.10000108.7
300G37.1Very low37.3Very low78 Ų78139.3 Ų139.380%0.80484%0.835SS**  trans-73.6167177.100000113.3
301G31.6Very low37.5Very low80 Ų80140 Ų14083%0.82584%0.836SS**  trans169.880.6172.900000112.8
302S40.5Very low37.3Very low118 Ų118145.6 Ų145.683%0.82585%0.845SS**  trans-59.6160.7152.1-80.90000110.3
303M41.3Very low37.7Very low173 Ų173141.9 Ų141.985%0.85284%0.838SS**  trans112.584.1163.5-57.7-168.1-55.100115.3
304Y36.7Very low37.3Very low233 Ų233136.1 Ų136.191%0.91483%0.828SS**  trans-141.587.2142.9-90.9-83.8000106
305D37.8Very low37.5Very low145 Ų145139.1 Ų139.178%0.77583%0.831SS**  95.9104.683.9-168.247.6000109.8
306H43.4Very low38Very low161 Ų161143 Ų14375%0.74584%0.844SS**  trans-105140.2171.9-85.5-88.7000107.9
307H41.4Very low37.9Very low186 Ų186135.7 Ų135.786%0.86184%0.837SS**  trans106.5116.9157.2-57.9-70.8000118.4
308G34.3Very low37.9Very low86 Ų86134.9 Ų134.989%0.88784%0.836SS**  trans151.6108.7156.300000108.9
309G33.5Very low38Very low81 Ų81134.3 Ų134.384%0.83584%0.836SS**  cis149.1113.713.400000105.6
310A34.4Very low38.7Very low105 Ų105133.9 Ų133.987%0.86883%0.83SS**  trans-157.5121.2161.200000108.7
311M42.9Very low38.9Very low192 Ų192140.3 Ų140.395%0.94684%0.836SS**  trans-79.1147.5-170.9-57.2-149.6-117.800112.6
312H41Very low39Very low180 Ų180144.3 Ų144.383%0.83383%0.834SS**  trans-28.5-179.3157.8-103.9-146.8000117.2
313P47.2Very low39Very low117 Ų117146.7 Ų146.776%0.7683%0.831SS**  cis-142.8167.6-8.225.4-1.1000115.7
314G31Very low39.3Very low72 Ų72144 Ų14474%0.74283%0.827SS**  trans131.1142.7143.400000119.7
315M38.6Very low39.5Very low190 Ų190141.4 Ų141.494%0.93683%0.828SS**  trans86.786.5149.9-55.5171.899.500118.7
316N43Very low39.5Very low172 Ų172137.8 Ų137.892%0.9283%0.825SS**  1.8126.9124.3-151.2-31.2000116
317G31.9Very low40Very low70 Ų70136 Ų13672%0.72283%0.828SS**  trans161.797.316400000116.4
318G33.9Very low40Very low71 Ų71133.6 Ų133.673%0.73283%0.829SS**  trans74.3114.6133.600000118.9
319M43.4Very low40.2Very low191 Ų191133.4 Ų133.494%0.94183%0.827SS**  trans-56.2150.2151.4-59.7177-157.300110.3
320P47.3Very low40.3Very low110 Ų110134.8 Ų134.871%0.71483%0.831SS**  trans-127.3125.7135.429.6-17.8000112.4
321K41.2Very low40.2Very low214 Ų214133.8 Ų133.893%0.9383%0.83SS**  trans-64.6133.1155.6-98.8177.7171.8172.60108.9
322Q34.3Very low39.7Very low164 Ų164128.3 Ų128.377%0.76682%0.823SS**  trans-140.4127.2160.6-78.3-171.211.500104
323Q41.2Very low40Very low167 Ų167125.1 Ų125.178%0.7882%0.818SS**  cis-167.1-17943.8-102.7164.816.500106.9
324P48.1Very low39.8Very low118 Ų118128.2 Ų128.277%0.76682%0.823SS**  cis-138.4147.923.127.2-2.5000117.4
325L39.8Very low40.1Very low177 Ų177131.1 Ų131.193%0.92782%0.821SS**  trans-96.4129155.5-9376.2000108.2
326G38.8Very low40.1Very low70 Ų70133.1 Ų133.172%0.72282%0.82SS**  trans-102.9-162.1155.400000110.3
327P52.7Low39.9Very low123 Ų123131.3 Ų131.380%0.79982%0.815SS**  cis-119.6-175.6-4937.1-22000110.9
328P42.4Very low39.9Very low135 Ų135137.6 Ų137.688%0.87782%0.818SS**  -140138.7124.921.1-0.6000113.7
329G36.8Very low40.1Very low82 Ų82142.7 Ų142.785%0.84583%0.825SS**  trans-94.8173.5-170.800000117
330A36.9Very low39.7Very low111 Ų111136.4 Ų136.492%0.91781%0.81SS**  trans-163.213215600000105.1
331G32Very low39Very low83 Ų83135.2 Ų135.286%0.85682%0.817SS**  cis160.3133.2600000105.9
332G31.8Very low38.7Very low78 Ų78133.8 Ų133.880%0.80481%0.813SS**  trans128.5108.4164.300000116.8
333P48.2Very low38.5Very low112 Ų112131.8 Ų131.873%0.72781%0.813SS**  trans-97.9133.6165.734.4-24.3000110.1
334Q43Very low38.2Very low183 Ų183129.5 Ų129.586%0.85581%0.81SS**  trans-148.8127.8155.2-72.9-52-29.900111
335D37.5Very low37.9Very low132 Ų132130 Ų13071%0.70681%0.811SS**  trans-57.5147.9176.9-59-66.7000113.7
336Y38.2Very low37.7Very low232 Ų232127.9 Ų127.991%0.9181%0.808SS**  trans-161.883131.7-86.7-66.1000109
337V39.6Very low37.5Very low134 Ų134133.8 Ų133.881%0.81282%0.819SS**  trans-86.697.2155.2177.80000106.4
338Y31.7Very low36.4Very low202 Ų202131.1 Ų131.179%0.79281%0.814SS**  trans-97.899.2162.3-173.2-99.5000108.2
339M37.2Very low36Very low178 Ų178129.7 Ų129.788%0.87781%0.813SS**  trans-79.9121.7166.6-114.8167.8152.300108.3
340G35.2Very low35.8Very low60 Ų60130.1 Ų130.162%0.61981%0.809SS**  trans153.3107.1162.200000114
341G32.9Very low35.7Very low84 Ų84133.3 Ų133.387%0.86681%0.807SS**  trans137.799.6161.900000114.6
342Q33.6Very low35.9Very low184 Ų184138.3 Ų138.386%0.8681%0.811SS**  trans-67.6156.5171.3-119.4171.4-25.500112.3
343T31.7Very low36.6Very low122 Ų122139.7 Ų139.775%0.74881%0.805SS**  trans83.9119.5148.9240000121.8
344T34.3Very low36.8Very low119 Ų119140.4 Ų140.473%0.7381%0.81SS**  trans99.9109.6131.1-53.60000119
345V41.4Very low36.8Very low129 Ų129139.3 Ų139.378%0.78281%0.805SS**  trans20.9132.3159.7-107.30000121
346P36.4Very low36.7Very low132 Ų132139.7 Ų139.786%0.85781%0.807SS**  trans-88.7122.8162.733.2-26.7000111.5
347M34Very low37.1Very low194 Ų194138.1 Ų138.196%0.95681%0.808SS**  trans-93.4142.8166.8-167.4159-167.400109
348G29.6Very low37.2Very low67 Ų67142.4 Ų142.469%0.69181%0.811SS**  trans10695.2143.900000118.7
349A34Very low37.9Very low105 Ų105141.1 Ų141.187%0.86881%0.814SS**  59.8152.112100000122.9
350A33.2Very low37.9Very low92 Ų92138.6 Ų138.676%0.7680%0.804SS**  trans85.1123169.900000114
351M34.8Very low38.1Very low177 Ų177141 Ų14187%0.87281%0.812SS**  cis-158.2133.321.7-65.2175.7162.600108.7
352M36.3Very low38.6Very low189 Ų189141.8 Ų141.893%0.93180%0.804SS**  trans-145.8127.4150.1-80.2-161.8154.300109.6
353P45.4Very low39.1Very low106 Ų106136.5 Ų136.569%0.68879%0.792SS**  trans-74.4150.4-174.429.5-33.6000112.4
354P53.1Low39.6Very low127 Ų127136.4 Ų136.483%0.82579%0.791SS**  trans-87.7120.6177.233.5-27.9000109.7
355Q41.7Very low39.8Very low161 Ų161134.6 Ų134.675%0.75279%0.788SS**  trans-134.8114.3170.1-108.3147.3-24.200111.8
356N37.3Very low39.6Very low139 Ų139132.7 Ų132.774%0.74379%0.786SS**  trans82.470.4153.6-56.4-27.2000118.9Y358N356-Y358 VanDerWaalsContact C-N 3.3Å
357Q45.8Very low39.6Very low200 Ų200130.8 Ų130.894%0.93578%0.781SS**SBendtrans-89.624.3155-73.6-162.70.400113.6
358Y42.3Very low40.1Very low223 Ų223128.7 Ų128.788%0.87577%0.774SS**  trans-125.955.7-175.4-116.9-86.6000112N356N356-Y358 VanDerWaalsContact C-N 3.3Å
359M44.7Very low40.6Very low175 Ų175136.7 Ų136.786%0.86278%0.783SS**SBendtrans-159.626.3172-112.1155.1-15900115.5
360N38.2Very low40.7Very low125 Ų125139.9 Ų139.967%0.66879%0.785SS**SBendtrans-142.941.5171.7-151.3-23.3000113.7
361S40Very low41.1Very low112 Ų112140.4 Ų140.478%0.78379%0.79SS**SBendtrans-117.4-3.5169.5-53.90000113
362S43Very low41.2Very low99 Ų99140.2 Ų140.269%0.69282%0.817SS**SBendtrans-99.7-11.5178.739.60000114.3
363A42.8Very low41.4Very low74 Ų74137.8 Ų137.861%0.61281%0.811SS**SBendtrans-82.8-15.6177.300000114
364V43.4Very low41.2Very low119 Ų119139.5 Ų139.572%0.72182%0.818SS**SBendtrans-94.1-11.2-177.5-176.70000112.9
365A38Very low40.6Very low82 Ų82140.2 Ų140.268%0.67882%0.817SS**SBendtrans-95.9-4.9-178.800000115
366A37.2Very low40.5Very low88 Ų88138.9 Ų138.973%0.72782%0.821SS**SBendtrans-98.8-3.2-179.900000114.3
367A37.8Very low40.7Very low93 Ų93138.9 Ų138.977%0.76983%0.826SS**SBendtrans-89.60.8177.900000113.9
368N43.3Very low40.4Very low149 Ų149134.9 Ų134.980%0.79782%0.819SS**SBendtrans-125.553.4-172.9-151.6-1.3000113
369R39.6Very low40.2Very low236 Ų236128.6 Ų128.689%0.89182%0.815SS**  trans-147.332.3171.2-140.9-165.5-83.6174.3-6114.6
370N37.8Very low39.9Very low171 Ų171125 Ų12591%0.91481%0.811SS**  trans-132.149.1174.5-129.811.7000112.3
371A40.5Very low40Very low103 Ų103125 Ų12585%0.85182%0.823SS**  trans-137.878.2164.200000108.1
372A36.8Very low40Very low174 Ų174126.2 Ų126.2100%1.43883%0.826SS**  trans-139.80161.100000106.9

Retrieved 372 of 372 residues in 216.3 ms (Link to these results)