A0A096MVQ8_PAPAN Loading...

Reticulophagy regulator 1

AlphaFold DB , UniProt , Accession A0A096MVQ8, Species PAPAN (Papio anubis, Olive baboon), Gene RETREG1, Length 497 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
1M38.5Very low43.2Very low250 Ų250126.1 Ų126.1100%1.23279%0.793SS**  0126.60-66.2167.6167.700107.3
2A38.1Very low42.3Very low99 Ų99132 Ų13282%0.81880%0.803SS**  cis-154.3147.6-22.900000107.8
3S45Very low41.3Very low114 Ų114127.3 Ų127.380%0.79780%0.798SS**  trans-76.9171.7171.1-128.70000110.2
4P54.1Low40.8Very low125 Ų125127.6 Ų127.681%0.81280%0.804SS**  -149.4170.451.243.3-22.7000119.1
5A43.8Very low41.2Very low83 Ų83127.5 Ų127.569%0.68681%0.805SS**  trans-96.7-154.2156.200000108.6
6P62.8Low40.8Very low113 Ų113125 Ų12573%0.73480%0.8SS**  cis-127.5-145.9-13.645.4-25.9000109.4
7P51.7Low41.3Very low108 Ų108124.8 Ų124.870%0.70180%0.799SS**  cis-118.2163.4-9.629.9-6.8000114.1
8E38.2Very low40.8Very low155 Ų155123 Ų12372%0.72480%0.798SS**  60138.959.7-75.8-163.8111.700113.6
9H35.4Very low40.3Very low163 Ų163121.1 Ų121.176%0.75579%0.793SS**  cis-142.7179.314.9-76.9-51.3000108.9
10A34Very low39.8Very low89 Ų89124.7 Ų124.774%0.73680%0.799SS**  cis-175-179.2-28.500000109
11A34.1Very low39.4Very low88 Ų88126.6 Ų126.673%0.72780%0.797SS**  trans68.5119.3162.100000119.3
12E31.8Very low39Very low197 Ų197122.8 Ų122.892%0.92178%0.776SS**  87.1128.756.5-173179.1-166.800112
13G29.3Very low38.9Very low71 Ų71122.3 Ų122.373%0.73277%0.773SS**  cis-170.6-177.8-0.700000112.9
14C34.5Very low38.9Very low131 Ų131122.5 Ų122.589%0.88577%0.771SS**  trans-92.3169.6164.9-77.10000109.5
15P46.9Very low38.1Very low126 Ų126124.3 Ų124.382%0.81877%0.773SS**  cis-149.1-16333.541.5-17.6000116.9
16A34.1Very low37.5Very low88 Ų88125.4 Ų125.473%0.72778%0.776SS**  trans-86.6-166.4167.800000111.6
17P50.5Low36.8Very low121 Ų121125.5 Ų125.579%0.78678%0.777SS**  cis-140.8-167.6-7.241.4-20.7000116.3
18A31.3Very low37Very low93 Ų93126.2 Ų126.277%0.76978%0.781SS**  trans90.2151.8143.200000124.4
19A31Very low37.5Very low86 Ų86124.6 Ų124.671%0.71178%0.784SS**  trans65.8112.3161.200000118.9
20E31.2Very low38Very low194 Ų194122.7 Ų122.791%0.90779%0.786SS**  7412487.2-77.3-168.8114.300115.5
21E30.6Very low38.8Very low165 Ų165128 Ų12877%0.77180%0.795SS**  164.7134.2118.2-172.4153107.400115.1
22Q30.7Very low39.2Very low169 Ų169127.7 Ų127.779%0.7979%0.794SS**  trans71.6142.5155.9-79.115937.500124.8
23A36Very low40.1Very low89 Ų89123.4 Ų123.474%0.73678%0.783SS**  trans-119177.8175.700000111
24P44.5Very low41Very low119 Ų119126.9 Ų126.977%0.77379%0.792SS**  -156.3155.299.637.7-18.3000119.4
25L36.8Very low41.6Very low162 Ų162122.9 Ų122.985%0.84877%0.773SS**  trans36.2122147.1-80142.2000121.1
26S33.2Very low41.5Very low107 Ų107123.9 Ų123.975%0.74877%0.767SS**  159.5177.67348.40000109.3
27P47.9Very low42.1Very low115 Ų115129.5 Ų129.575%0.74777%0.769SS**  cis-122.2-177.2-22.942-26.6000113.4
28P56Low41.8Very low123 Ų123131.1 Ų131.180%0.79977%0.766SS**  trans-102.9148.1-179.338-32.7000115.3
29P47.3Very low42.5Very low121 Ų121133.5 Ų133.579%0.78676%0.761SS**  -154.5-173.3124.240.1-23.1000113.9
30P46.9Very low43.1Very low122 Ų122136.6 Ų136.679%0.79276%0.761SS**  cis-114.6174.8-45.336.9-23.9000111.9
31Q49.3Very low44Very low200 Ų200133.9 Ų133.994%0.93575%0.748SS**PPolyproline II helixtrans-73.9137.6172.5-71.5176.7-19.200112.2
32A43.8Very low44.8Very low83 Ų83132.9 Ų132.969%0.68674%0.744SS**PPolyproline II helixtrans-103.7155.3171.300000111.1
33P49.5Very low45.4Very low107 Ų107131.9 Ų131.970%0.69574%0.739SS**PPolyproline II helixtrans-80.2162.5-163.932-36.1000114.7G35P33-G35 VanDerWaalsContact C-N 3.29Å; P33-G35 PolarHBondContact O-N 2.89Å
34P49.8Very low46Very low144 Ų144130.9 Ų130.994%0.93573%0.731SS**THydrogen-bonded Turntrans-79.970.7-176.634.8-36.8000112.1
35G46.7Very low46.2Very low46 Ų46132.7 Ų132.747%0.47473%0.729SS.*THydrogen-bonded Turntrans-126.5-40.1175.200000114.2P33P33-G35 VanDerWaalsContact C-N 3.29Å; P33-G35 PolarHBondContact O-N 2.89Å
36E44.5Very low46.6Very low148 Ų148132.2 Ų132.269%0.69272%0.723SS**Hα-helixtrans-86.3-12.3-165.9-62.8-177.8123.100114.7Q38E36-Q38 VanDerWaalsContact C-N 3.33Å; E36-Q38 PolarHBondContact O-N 3.45Å
37R45.9Very low47.1Very low206 Ų206130 Ų13078%0.77771%0.711SS**Hα-helixtrans-73.7-20.4-176.7-144.4-159.4-66.2174-1.3114.1
38Q45.5Very low46.9Very low155 Ų155127.2 Ų127.272%0.72470%0.702SS**Hα-helixtrans-83.8-37.1-179.4-69.5-173.4-6200112.8E36 Q40 E42E36-Q38 VanDerWaalsContact C-N 3.33Å; E36-Q38 PolarHBondContact O-N 3.45Å; Q38-Q40 VanDerWaalsContact C-N 3.33Å; Q38-Q40 PolarHBondContact O-N 3.29Å; Q38-E42 PolarHBondContact O-N 3.39Å
39Q45.1Very low46.3Very low142 Ų142125 Ų12566%0.66469%0.694SS**Hα-helixtrans-67.5-34.4177.7-74178.8-46.900112.3E42 E43Q39-E42 PolarHBondContact O-N 3.43Å; Q39-E43 WeakPolarHBondContact O-CB 3.44Å; Q39-E43 PolarHBondContact O-N 3.07Å; Q39-E43 VanDerWaalsContact O-N 3.07Å
40Q44.9Very low46.1Very low152 Ų152122.8 Ų122.871%0.7169%0.686SS**Hα-helixtrans-77.3-22.5-177.7-146.3169.635.400114.1Q38 A44Q38-Q40 VanDerWaalsContact C-N 3.33Å; Q38-Q40 PolarHBondContact O-N 3.29Å; Q40-A44 WeakPolarHBondContact O-CB 3.42Å
41E48.6Very low45.9Very low136 Ų136124.4 Ų124.464%0.63668%0.683SS**Hα-helixtrans-79.4-35.3169.8-93.1178.2130.500111.8Q45E41-Q45 WeakPolarHBondContact O-CB 3.43Å; E41-Q45 PolarHBondContact O-N 3.3Å
42E48.6Very low45.4Very low144 Ų144116.8 Ų116.867%0.67366%0.659SS**Hα-helixtrans-71.7-44.3-179.5-155.3164.4-170.400111.6Q38 Q39 A44 Q45 E46Q38-E42 PolarHBondContact O-N 3.39Å; Q39-E42 PolarHBondContact O-N 3.43Å; E42-A44 PolarHBondContact O-N 3.15Å; E42-Q45 PolarHBondContact O-N 3.2Å; E42-E46 PolarHBondContact O-N 3.44Å; E42-E46 VanDerWaalsContact O-N 3.15Å
43E42.6Very low45.2Very low148 Ų148114.8 Ų114.869%0.69265%0.646SS**Hα-helixtrans-67.3-33.4178.8-160.6175.2-16600112.7Q39 Q45 A47Q39-E43 WeakPolarHBondContact O-CB 3.44Å; Q39-E43 PolarHBondContact O-N 3.07Å; Q39-E43 VanDerWaalsContact O-N 3.07Å; E43-Q45 VanDerWaalsContact C-N 3.35Å; E43-A47 PolarHBondContact O-N 3.32Å
44A49.2Very low44.8Very low68 Ų68111.7 Ų111.756%0.56263%0.634SS**Hα-helixtrans-71-29.3174.800000113Q40 E42Q40-A44 WeakPolarHBondContact O-CB 3.42Å; E42-A44 PolarHBondContact O-N 3.15Å
45Q47.1Very low44.5Very low158 Ų158111 Ų11174%0.73862%0.622SS**Hα-helixtrans-84.1-28.2-177.7-159.5161.713.800112.4E41 E42 E43E41-Q45 WeakPolarHBondContact O-CB 3.43Å; E41-Q45 PolarHBondContact O-N 3.3Å; E42-Q45 PolarHBondContact O-N 3.2Å; E43-Q45 VanDerWaalsContact C-N 3.35Å
46E45.4Very low44.5Very low152 Ų152115.9 Ų115.971%0.7163%0.632SS**Hα-helixtrans-74.4-39.4172.9-163.5169.6-163.100112.2E42 G48 A49 A50E42-E46 PolarHBondContact O-N 3.44Å; E42-E46 VanDerWaalsContact O-N 3.15Å; E46-G48 PolarHBondContact O-N 3.4Å; E46-A49 PolarHBondContact O-N 3.32Å; E46-A50 PolarHBondContact O-N 3.45Å
47A44.8Very low44.6Very low61 Ų61113.7 Ų113.750%0.50463%0.629SS.*Hα-helixtrans-60.4-44.1176.800000113E43 A49 A50 E51E43-A47 PolarHBondContact O-N 3.32Å; A47-A49 VanDerWaalsContact C-N 3.28Å; A47-A49 PolarHBondContact O-N 3.32Å; A47-A50 PolarHBondContact O-N 3.47Å; A47-E51 PolarHBondContact O-N 3.45Å
48G42.9Very low44.7Very low55 Ų55111.2 Ų111.257%0.56763%0.626SS**Hα-helixtrans-67.4-23.5-179.300000114.7E46E46-G48 PolarHBondContact O-N 3.4Å
49A44.2Very low44.9Very low76 Ų76109.1 Ų109.163%0.62862%0.616SS**Hα-helixtrans-81-32.8178.600000112.8E46 A47E46-A49 PolarHBondContact O-N 3.32Å; A47-A49 VanDerWaalsContact C-N 3.28Å; A47-A49 PolarHBondContact O-N 3.32Å
50A42.6Very low45.1Very low75 Ų75105.1 Ų105.162%0.6261%0.608SS**Hα-helixtrans-73.5-40.8-179.500000112.7E46 A47 G53E46-A50 PolarHBondContact O-N 3.45Å; A47-A50 PolarHBondContact O-N 3.47Å; A50-G53 PolarHBondContact O-N 3.46Å
51E41.9Very low45.2Very low156 Ų156100.6 Ų100.673%0.72960%0.596SS**Hα-helixtrans-70.3-37.6-175.1-158.2178.1156.600112.6A47 G53 G54A47-E51 PolarHBondContact O-N 3.45Å; E51-G53 VanDerWaalsContact C-N 3.29Å; E51-G53 PolarHBondContact O-N 3.44Å; E51-G54 PolarHBondContact O-N 3.34Å
52G38.9Very low45.2Very low41 Ų4196 Ų9642%0.42359%0.586SS.*Hα-helixtrans-68.7-22.2178.400000114.9
53G39.8Very low45.5Very low41 Ų4197.5 Ų97.542%0.42359%0.585SS.*Hα-helixtrans-79.9-37.8176.800000113.4A50 E51 V57A50-G53 PolarHBondContact O-N 3.46Å; E51-G53 VanDerWaalsContact C-N 3.29Å; E51-G53 PolarHBondContact O-N 3.44Å; G53-V57 WeakPolarHBondContact O-CG2 3.41Å; G53-V57 PolarHBondContact O-N 3.46Å
54G40.8Very low45.9Very low42 Ų4293 Ų9343%0.43357%0.574SS.*Hα-helixtrans-63.8-49-179.500000112.8E51 Q56 V57 E58E51-G54 PolarHBondContact O-N 3.34Å; G54-Q56 VanDerWaalsContact C-N 3.34Å; G54-Q56 PolarHBondContact O-N 3.06Å; G54-V57 PolarHBondContact O-N 2.96Å; G54-E58 PolarHBondContact O-N 3.1Å
55L45.4Very low45.9Very low129 Ų12992.4 Ų92.468%0.67557%0.568SS**Hα-helixtrans-60.8-38.9-174.1-129.779.9000113.4E59L55-E59 PolarHBondContact O-N 3.3Å
56Q44.8Very low46.3Very low148 Ų14887.4 Ų87.469%0.69255%0.554SS**Hα-helixtrans-74.1-34180-69.5-17554.700112.7G54 A60G54-Q56 VanDerWaalsContact C-N 3.34Å; G54-Q56 PolarHBondContact O-N 3.06Å; Q56-A60 VanDerWaalsContact O-CB 3.26Å; Q56-A60 WeakPolarHBondContact O-CB 3.26Å; Q56-A60 PolarHBondContact O-N 3.21Å; Q56-A60 VanDerWaalsContact O-N 3.1Å
57V48Very low46.6Very low103 Ų10382.4 Ų82.462%0.62454%0.539SS*.Hα-helixtrans-71.8-37175.4175.30000110.6G53 G54 A61G53-V57 WeakPolarHBondContact O-CG2 3.41Å; G53-V57 PolarHBondContact O-N 3.46Å; G54-V57 PolarHBondContact O-N 2.96Å; V57-A61 WeakPolarHBondContact O-CB 3.21Å; V57-A61 PolarHBondContact O-N 3.39Å
58E48.1Very low46.8Very low153 Ų15383.5 Ų83.572%0.71554%0.539SS*.Hα-helixtrans-70.2-40.3177.4-157.4177.1141.800112.4G54 A61 G62G54-E58 PolarHBondContact O-N 3.1Å; E58-A61 PolarHBondContact O-N 2.86Å; E58-G62 PolarHBondContact O-N 2.68Å
59E50.1Low47.2Very low111 Ų11185.4 Ų85.452%0.51954%0.54SS..Hα-helixtrans-67-38.8174.2-155.1-156.8139.200112L55 G62 R63L55-E59 PolarHBondContact O-N 3.3Å; E59-G62 PolarHBondContact O-N 2.86Å; E59-R63 WeakPolarHBondContact O-CG 3.24Å; E59-R63 PolarHBondContact O-N 2.93Å; E59-R63 IonicContact OE1-CZ 3.19Å; E59-R63 IonicContact OE1-NE 2.86Å; E59-R63 PolarHBondContact OE1-NE 2.89Å; E59-R63 IonicContact OE1-NH2 2.68Å; E59-R63 PolarHBondContact OE1-NH2 3.49Å
60A48.5Very low47.7Very low59 Ų5990.5 Ų90.549%0.48854%0.543SS..Hα-helixtrans-66.6-42.5175.800000112.1Q56 R63 A64Q56-A60 VanDerWaalsContact O-CB 3.26Å; Q56-A60 WeakPolarHBondContact O-CB 3.26Å; Q56-A60 PolarHBondContact O-N 3.21Å; Q56-A60 VanDerWaalsContact O-N 3.1Å; A60-R63 PolarHBondContact O-N 3.42Å; A60-A64 WeakPolarHBondContact O-CB 3.39Å; A60-A64 PolarHBondContact O-N 2.91Å
61A47.8Very low47.9Very low56 Ų5693.2 Ų93.246%0.46355%0.546SS..Hα-helixtrans-64.7-39.5173.500000111.5V57 E58 A64 A65V57-A61 WeakPolarHBondContact O-CB 3.21Å; V57-A61 PolarHBondContact O-N 3.39Å; E58-A61 PolarHBondContact O-N 2.86Å; A61-A64 PolarHBondContact O-N 2.86Å; A61-A65 VanDerWaalsContact O-CB 3.24Å; A61-A65 WeakPolarHBondContact O-CB 3.44Å; A61-A65 PolarHBondContact O-N 2.8Å
62G48.3Very low48.2Very low41 Ų4191.2 Ų91.242%0.42354%0.54SS..Hα-helixtrans-61.7-44174.200000112.8E58 E59 A66E58-G62 PolarHBondContact O-N 2.68Å; E59-G62 PolarHBondContact O-N 2.86Å; G62-A66 VanDerWaalsContact O-CB 3.23Å; G62-A66 WeakPolarHBondContact O-CB 3.29Å; G62-A66 PolarHBondContact O-N 3.46Å
63R54Low48.4Very low174 Ų17490.2 Ų90.266%0.65753%0.529SS*.Hα-helixtrans-67.9-38.3174.4-71.8-178.2-171.4-126.27.4112.6E59 A60 A66 A67E59-R63 WeakPolarHBondContact O-CG 3.24Å; E59-R63 PolarHBondContact O-N 2.93Å; E59-R63 IonicContact OE1-CZ 3.19Å; E59-R63 IonicContact OE1-NE 2.86Å; E59-R63 PolarHBondContact OE1-NE 2.89Å; E59-R63 IonicContact OE1-NH2 2.68Å; E59-R63 PolarHBondContact OE1-NH2 3.49Å; A60-R63 PolarHBondContact O-N 3.42Å; R63-A66 PolarHBondContact O-N 2.81Å; R63-A67 VanDerWaalsContact O-CB 3.29Å; R63-A67 WeakPolarHBondContact O-CB 3.23Å; R63-A67 PolarHBondContact O-N 3.35Å
64A50.5Low48.8Very low55 Ų5593.9 Ų93.946%0.45554%0.536SS..Hα-helixtrans-66.4-44.5175.200000111.7A60 A61 A67 V68A60-A64 WeakPolarHBondContact O-CB 3.39Å; A60-A64 PolarHBondContact O-N 2.91Å; A61-A64 PolarHBondContact O-N 2.86Å; A64-A67 PolarHBondContact O-N 3.32Å; A64-V68 WeakPolarHBondContact O-CB 3.32Å; A64-V68 WeakPolarHBondContact O-CG2 3.47Å; A64-V68 PolarHBondContact O-N 2.67Å
65A50.9Low49.3Very low54 Ų5495.2 Ų95.245%0.44654%0.537SS..Hα-helixtrans-62.7-42.8174.400000111.6A61 V68 T69A61-A65 VanDerWaalsContact O-CB 3.24Å; A61-A65 WeakPolarHBondContact O-CB 3.44Å; A61-A65 PolarHBondContact O-N 2.8Å; A65-V68 PolarHBondContact O-N 2.84Å; A65-T69 VanDerWaalsContact O-CB 3.29Å; A65-T69 WeakPolarHBondContact O-CB 3.11Å; A65-T69 PolarHBondContact O-N 2.89Å; A65-T69 PolarHBondContact O-OG1 3.44Å
66A53.9Low49.4Very low54 Ų5493.8 Ų93.845%0.44653%0.533SS..Hα-helixtrans-62.8-42.5174.700000112.1G62 R63 T69 W70G62-A66 VanDerWaalsContact O-CB 3.23Å; G62-A66 WeakPolarHBondContact O-CB 3.29Å; G62-A66 PolarHBondContact O-N 3.46Å; R63-A66 PolarHBondContact O-N 2.81Å; A66-T69 PolarHBondContact O-N 2.88Å; A66-W70 WeakPolarHBondContact O-CB 3.34Å; A66-W70 PolarHBondContact O-N 3.34Å
67A52.4Low49.5Very low47 Ų4792.5 Ų92.539%0.38853%0.53SS..Hα-helixtrans-66.2-41.4176.800000112.5R63 A64 T69 W70 L71R63-A67 VanDerWaalsContact O-CB 3.29Å; R63-A67 WeakPolarHBondContact O-CB 3.23Å; R63-A67 PolarHBondContact O-N 3.35Å; A64-A67 PolarHBondContact O-N 3.32Å; A67-T69 VanDerWaalsContact C-N 3.34Å; A67-W70 PolarHBondContact O-N 2.85Å; A67-L71 WeakPolarHBondContact O-CB 3.33Å; A67-L71 WeakPolarHBondContact O-CG 3.49Å; A67-L71 PolarHBondContact O-N 3.32Å
68V50Low49.5Very low84 Ų8495.7 Ų95.751%0.50953%0.531SS..Hα-helixtrans-65.9-37.9173.5171.40000111.1A64 A65 L71 L72A64-V68 WeakPolarHBondContact O-CB 3.32Å; A64-V68 WeakPolarHBondContact O-CG2 3.47Å; A64-V68 PolarHBondContact O-N 2.67Å; A65-V68 PolarHBondContact O-N 2.84Å; V68-L71 PolarHBondContact O-N 2.86Å; V68-L72 PolarHBondContact O-N 2.92Å
69T50.9Low49.4Very low95 Ų9594.2 Ų94.258%0.58353%0.527SS*.Iπ-helixtrans-67.6-35.4175.4-53.40000111.6A65 A66 A67 G73A65-T69 VanDerWaalsContact O-CB 3.29Å; A65-T69 WeakPolarHBondContact O-CB 3.11Å; A65-T69 PolarHBondContact O-N 2.89Å; A65-T69 PolarHBondContact O-OG1 3.44Å; A66-T69 PolarHBondContact O-N 2.88Å; A67-T69 VanDerWaalsContact C-N 3.34Å; T69-G73 WeakPolarHBondContact O-CA 3.29Å; T69-G73 PolarHBondContact O-N 3.38Å
70W53.6Low49.3Very low183 Ų18390.6 Ų90.669%0.69352%0.52SS*.Iπ-helixtrans-69.6-42.4171.9-108.875.9000112.7A66 A67A66-W70 WeakPolarHBondContact O-CB 3.34Å; A66-W70 PolarHBondContact O-N 3.34Å; A67-W70 PolarHBondContact O-N 2.85Å
71L48.2Very low49.3Very low131 Ų13191.9 Ų91.969%0.68652%0.524SS*.Iπ-helixtrans-76.7-32.6-175.6-76165.4000114.1A67 V68A67-L71 WeakPolarHBondContact O-CB 3.33Å; A67-L71 WeakPolarHBondContact O-CG 3.49Å; A67-L71 PolarHBondContact O-N 3.32Å; V68-L71 PolarHBondContact O-N 2.86Å
72L46.5Very low49.3Very low115 Ų11596 Ų9660%0.60253%0.528SS*.Iπ-helixtrans-103.3-29.4176.9-91.269.7000113.5V68 V76V68-L72 PolarHBondContact O-N 2.92Å; L72-V76 WeakPolarHBondContact O-CB 3.5Å; L72-V76 WeakPolarHBondContact O-CG2 3.26Å
73G43.8Very low49.1Very low19 Ų1996.4 Ų96.420%0.19653%0.527CS..Iπ-helixtrans-71.9-53.3-172.200000113T69 V76 L77T69-G73 WeakPolarHBondContact O-CA 3.29Å; T69-G73 PolarHBondContact O-N 3.38Å; G73-V76 PolarHBondContact O-N 3.29Å; G73-L77 VanDerWaalsContact O-CB 3.24Å; G73-L77 WeakPolarHBondContact O-CB 3.38Å; G73-L77 WeakPolarHBondContact O-CG 3.32Å; G73-L77 PolarHBondContact O-N 3.48Å
74E49.3Very low48.7Very low119 Ų11992.8 Ų92.856%0.55652%0.521SS*.Hα-helixtrans-59.4-51.4-176.2-66.2-135.1139.600114.1V76 L77 W78E74-V76 VanDerWaalsContact C-N 3.33Å; E74-V76 PolarHBondContact O-N 3.39Å; E74-L77 PolarHBondContact O-N 3.3Å; E74-W78 WeakPolarHBondContact O-CB 3.25Å; E74-W78 PolarHBondContact O-N 3.25Å
75P50.6Low48.4Very low70 Ų7095.2 Ų95.246%0.45552%0.523SS..Hα-helixtrans-66.3-33-178.925.2-33.8000113.1L79P75-L79 WeakPolarHBondContact O-CB 2.95Å; P75-L79 PolarHBondContact O-N 3.4Å
76V46.5Very low48.1Very low99 Ų9995.8 Ų95.860%0.652%0.518SS*.Hα-helixtrans-76.5-40179.5174.80000111.5L72 G73 E74 G80L72-V76 WeakPolarHBondContact O-CB 3.5Å; L72-V76 WeakPolarHBondContact O-CG2 3.26Å; G73-V76 PolarHBondContact O-N 3.29Å; E74-V76 VanDerWaalsContact C-N 3.33Å; E74-V76 PolarHBondContact O-N 3.39Å; V76-G80 PolarHBondContact O-N 2.61Å
77L47.4Very low47.8Very low121 Ų12197.8 Ų97.863%0.63452%0.521SS*.Hα-helixtrans-71-33.9174.1-66.9171.9000111.5G73 E74 G80 C81G73-L77 VanDerWaalsContact O-CB 3.24Å; G73-L77 WeakPolarHBondContact O-CB 3.38Å; G73-L77 WeakPolarHBondContact O-CG 3.32Å; G73-L77 PolarHBondContact O-N 3.48Å; E74-L77 PolarHBondContact O-N 3.3Å; L77-G80 CarbonylContact O-C 3.58Å; L77-G80 WeakPolarHBondContact O-CA 3.45Å; L77-G80 PolarHBondContact O-N 2.71Å; L77-C81 PolarHBondContact O-N 3.11Å; L77-C81 PolarHBondContact O-SG 3.16Å; L77-C81 VanDerWaalsContact O-SG 3.32Å
78W47.7Very low47.8Very low170 Ų17097.7 Ų97.764%0.64452%0.517SS*.Hα-helixtrans-71.5-39.3176.5-157.892.9000112.2E74 G80 R82E74-W78 WeakPolarHBondContact O-CB 3.25Å; E74-W78 PolarHBondContact O-N 3.25Å; W78-G80 VanDerWaalsContact C-N 3.34Å; W78-R82 HydrophobicContact CE3-CG 4.19Å; W78-R82 HydrophobicContact CZ3-CG 4.3Å; W78-R82 WeakPolarHBondContact O-CB 3.24Å; W78-R82 VanDerWaalsContact O-CG 3.22Å; W78-R82 WeakPolarHBondContact O-CG 3.34Å; W78-R82 PolarHBondContact O-N 2.65Å; W78-R82 VanDerWaalsContact O-N 3.15Å
79L46.6Very low48Very low121 Ų12197.9 Ų97.963%0.63451%0.509SS*.Hα-helixtrans-63-41.2165.9-105.669.9000111.3P75 R82 A83P75-L79 WeakPolarHBondContact O-CB 2.95Å; P75-L79 PolarHBondContact O-N 3.4Å; L79-R82 PolarHBondContact O-N 3.15Å; L79-A83 VanDerWaalsContact O-CB 3.31Å; L79-A83 WeakPolarHBondContact O-CB 3.32Å; L79-A83 PolarHBondContact O-N 3.45Å
80G47.5Very low48.1Very low35 Ų35100.3 Ų100.336%0.36151%0.511SS..Hα-helixtrans-57.3-55.7177.100000112.5V76 L77 W78 R82 A83 D84V76-G80 PolarHBondContact O-N 2.61Å; L77-G80 CarbonylContact O-C 3.58Å; L77-G80 WeakPolarHBondContact O-CA 3.45Å; L77-G80 PolarHBondContact O-N 2.71Å; W78-G80 VanDerWaalsContact C-N 3.34Å; G80-R82 VanDerWaalsContact C-N 3.31Å; G80-R82 PolarHBondContact O-N 3.48Å; G80-A83 CarbonylContact O-C 3.58Å; G80-A83 WeakPolarHBondContact O-CB 3.37Å; G80-A83 PolarHBondContact O-N 2.98Å; G80-A83 VanDerWaalsContact O-N 3.13Å; G80-D84 PolarHBondContact O-N 2.83Å
81C48.8Very low47.9Very low86 Ų8698.5 Ų98.558%0.58150%0.504SS*.Hα-helixtrans-62.6-34.6178.3-67.10000112.7L77 D84 E85L77-C81 PolarHBondContact O-N 3.11Å; L77-C81 PolarHBondContact O-SG 3.16Å; L77-C81 VanDerWaalsContact O-SG 3.32Å; C81-D84 PolarHBondContact O-N 3.39Å; C81-E85 PolarHBondContact O-N 2.95Å
82R48.3Very low48.2Very low143 Ų14396.4 Ų96.454%0.5450%0.499SS..Hα-helixtrans-71.4-34174.4-72.5-81.3-81.9-140.8-11.8112.3W78 L79 G80 L86W78-R82 HydrophobicContact CE3-CG 4.19Å; W78-R82 HydrophobicContact CZ3-CG 4.3Å; W78-R82 WeakPolarHBondContact O-CB 3.24Å; W78-R82 VanDerWaalsContact O-CG 3.22Å; W78-R82 WeakPolarHBondContact O-CG 3.34Å; W78-R82 PolarHBondContact O-N 2.65Å; W78-R82 VanDerWaalsContact O-N 3.15Å; L79-R82 PolarHBondContact O-N 3.15Å; G80-R82 VanDerWaalsContact C-N 3.31Å; G80-R82 PolarHBondContact O-N 3.48Å; R82-L86 WeakPolarHBondContact O-CD1 3.21Å; R82-L86 VanDerWaalsContact O-CG 3.28Å; R82-L86 WeakPolarHBondContact O-CG 3.2Å; R82-L86 PolarHBondContact O-N 3.22Å; R82-L86 VanDerWaalsContact O-N 3.12Å
83A44.3Very low48.4Very low49 Ų4997.6 Ų97.641%0.40551%0.505SS..Hα-helixtrans-70.2-38.7171.900000111.5L79 G80 L86 L87L79-A83 VanDerWaalsContact O-CB 3.31Å; L79-A83 WeakPolarHBondContact O-CB 3.32Å; L79-A83 PolarHBondContact O-N 3.45Å; G80-A83 CarbonylContact O-C 3.58Å; G80-A83 WeakPolarHBondContact O-CB 3.37Å; G80-A83 PolarHBondContact O-N 2.98Å; G80-A83 VanDerWaalsContact O-N 3.13Å; A83-L86 WeakPolarHBondContact O-CB 3.34Å; A83-L86 PolarHBondContact O-N 3.45Å; A83-L87 WeakPolarHBondContact O-CB 3.38Å; A83-L87 PolarHBondContact O-N 3.08Å
84D44.3Very low48.9Very low99 Ų99102.8 Ų102.853%0.52952%0.518SS..Hα-helixtrans-61.7-45.6174-128.2-25.8000110.7G80 C81 L86 L87 S88G80-D84 PolarHBondContact O-N 2.83Å; C81-D84 PolarHBondContact O-N 3.39Å; D84-L86 VanDerWaalsContact C-N 3.29Å; D84-L86 PolarHBondContact O-N 3.45Å; D84-L87 CarbonylContact O-C 3.59Å; D84-L87 PolarHBondContact O-N 2.84Å; D84-L87 VanDerWaalsContact O-N 3.17Å; D84-S88 WeakPolarHBondContact O-CB 3.28Å; D84-S88 PolarHBondContact O-N 3.39Å
85E45Very low49.4Very low106 Ų10697.8 Ų97.850%0.49550%0.497SS..Hα-helixtrans-67.2-29177.1-157178.1175.600112.5C81 S88C81-E85 PolarHBondContact O-N 2.95Å; E85-S88 PolarHBondContact O-OG 3.04Å
86L44.4Very low50Low66 Ų6699.2 Ų99.235%0.34650%0.5SS..Hα-helixtrans-72.1-37.4170.6-76.2165.6000113.1R82 A83 D84 R94 S95R82-L86 WeakPolarHBondContact O-CD1 3.21Å; R82-L86 VanDerWaalsContact O-CG 3.28Å; R82-L86 WeakPolarHBondContact O-CG 3.2Å; R82-L86 PolarHBondContact O-N 3.22Å; R82-L86 VanDerWaalsContact O-N 3.12Å; A83-L86 WeakPolarHBondContact O-CB 3.34Å; A83-L86 PolarHBondContact O-N 3.45Å; D84-L86 VanDerWaalsContact C-N 3.29Å; D84-L86 PolarHBondContact O-N 3.45Å; L86-R94 HydrophobicContact CD2-CB 4.06Å; L86-R94 VanDerWaalsContact CD2-O 3.22Å; L86-R94 WeakPolarHBondContact CD2-O 3.43Å; L86-S95 WeakPolarHBondContact O-CB 3.28Å; L86-S95 PolarHBondContact O-OG 3.47Å
87L47.9Very low50.9Low95 Ų95100.3 Ų100.350%0.49750%0.502SS..Hα-helixtrans-74.4-26.9174.3-105.669.4000112.8A83 D84 W89A83-L87 WeakPolarHBondContact O-CB 3.38Å; A83-L87 PolarHBondContact O-N 3.08Å; D84-L87 CarbonylContact O-C 3.59Å; D84-L87 PolarHBondContact O-N 2.84Å; D84-L87 VanDerWaalsContact O-N 3.17Å; L87-W89 PolarHBondContact O-N 3.29Å
88S53Low51.9Low45 Ų4595.9 Ų95.932%0.31549%0.485SS..THydrogen-bonded Turntrans-64-13.4-175.977.10000114.8D84 E85 K90D84-S88 WeakPolarHBondContact O-CB 3.28Å; D84-S88 PolarHBondContact O-N 3.39Å; E85-S88 PolarHBondContact O-OG 3.04Å; S88-K90 PolarHBondContact O-N 3.23Å
89W53.3Low52.8Low89 Ų8991.3 Ų91.334%0.33747%0.47SS..  trans54.35.9-177.5-8853.6000116.3L87 R91 S95 L232L87-W89 PolarHBondContact O-N 3.29Å; W89-R91 PolarHBondContact O-N 3.39Å; W89-S95 PolarHBondContact NE1-OG 2.97Å; W89-L232 HydrophobicContact CD2-CD2 3.9Å; W89-L232 HydrophobicContact CG-CD2 4.13Å; W89-L232 HydrophobicContact CH2-CD1 4.17Å; W89-L232 HydrophobicContact CZ2-CD1 3.47Å; W89-L232 VanDerWaalsContact CZ2-CD1 3.47Å; W89-L232 HydrophobicContact CZ2-CD2 3.72Å; W89-L232 HydrophobicContact CZ2-CG 4.17Å
90K52.5Low53.9Low146 Ų14688.5 Ų88.564%0.63546%0.458SS*.SBendtrans-56.3-17.2175.4-74.2170.6-179.4158.40113.1S88 E163S88-K90 PolarHBondContact O-N 3.23Å; K90-E163 IonicContact NZ-OE1 3.17Å; K90-E163 PolarHBondContact NZ-OE1 3.2Å; K90-E163 VanDerWaalsContact NZ-OE1 3.17Å
91R50.4Low54.9Low145 Ų14589.4 Ų89.455%0.54746%0.462SS..SBendtrans-137.3102.7168.3-60.1-172.3-167.7-141.32.3111W89 L93 R94 S95W89-R91 PolarHBondContact O-N 3.39Å; R91-L93 VanDerWaalsContact C-N 3.29Å; R91-L93 PolarHBondContact O-N 3.04Å; R91-R94 HydrophobicContact CB-CB 4.45Å; R91-R94 HydrophobicContact CB-CG 4.49Å; R91-R94 PolarHBondContact O-N 3.05Å; R91-R94 VanDerWaalsContact O-N 3.13Å; R91-S95 PolarHBondContact O-N 3.25Å
92P53.5Low55.8Low87 Ų8787.3 Ų87.357%0.56545%0.451SS*.Hα-helixtrans-62.6-33.5-171.123.5-34000113.2R94 S95 L96P92-R94 PolarHBondContact O-N 2.99Å; P92-S95 PolarHBondContact O-N 3.35Å; P92-L96 VanDerWaalsContact O-CB 3.23Å; P92-L96 WeakPolarHBondContact O-CB 3.32Å; P92-L96 PolarHBondContact O-N 3.16Å
93L50.8Low56.8Low139 Ų13981.8 Ų81.873%0.72843%0.432SS*.Hα-helixtrans-63.7-35.7177.3-79.4154.2000113.8R91 L97R91-L93 VanDerWaalsContact C-N 3.29Å; R91-L93 PolarHBondContact O-N 3.04Å; L93-L97 WeakPolarHBondContact O-CB 3.43Å; L93-L97 PolarHBondContact O-N 3.47Å
94R55.3Low57.9Low128 Ų12884.9 Ų84.948%0.48344%0.441SS..Hα-helixtrans-77-38.7178-70.7-174.4-178.8166.7-2.5111.3L86 R91 P92 L97 G98L86-R94 HydrophobicContact CD2-CB 4.06Å; L86-R94 VanDerWaalsContact CD2-O 3.22Å; L86-R94 WeakPolarHBondContact CD2-O 3.43Å; R91-R94 HydrophobicContact CB-CB 4.45Å; R91-R94 HydrophobicContact CB-CG 4.49Å; R91-R94 PolarHBondContact O-N 3.05Å; R91-R94 VanDerWaalsContact O-N 3.13Å; P92-R94 PolarHBondContact O-N 2.99Å; R94-L97 PolarHBondContact O-N 3.48Å; R94-G98 PolarHBondContact O-N 2.76Å
95S58.8Low59Low14 Ų1485.1 Ų85.110%0.09844%0.442CS..Hα-helixtrans-66.3-40.5174.2-157.60000111.7L86 W89 R91 P92 L97 G98 F99L86-S95 WeakPolarHBondContact O-CB 3.28Å; L86-S95 PolarHBondContact O-OG 3.47Å; W89-S95 PolarHBondContact NE1-OG 2.97Å; R91-S95 PolarHBondContact O-N 3.25Å; P92-S95 PolarHBondContact O-N 3.35Å; S95-L97 PolarHBondContact O-N 3.34Å; S95-G98 PolarHBondContact O-N 3.3Å; S95-F99 WeakPolarHBondContact O-CB 3.34Å; S95-F99 PolarHBondContact O-N 3.48Å
96L62.7Low60Low101 Ų10181.7 Ų81.753%0.52943%0.425SS..Hα-helixtrans-61.3-41.6171.8-176.267.1000111.7P92 F99 V100P92-L96 VanDerWaalsContact O-CB 3.23Å; P92-L96 WeakPolarHBondContact O-CB 3.32Å; P92-L96 PolarHBondContact O-N 3.16Å; L96-F99 PolarHBondContact O-N 2.95Å; L96-V100 WeakPolarHBondContact O-CB 3.42Å; L96-V100 VanDerWaalsContact O-CG2 3.3Å; L96-V100 WeakPolarHBondContact O-CG2 3.38Å; L96-V100 PolarHBondContact O-N 3.07Å
97L67.1Low61.1Low121 Ų12184.4 Ų84.463%0.63443%0.431SS*.Hα-helixtrans-65.3-39.4174.9-174.963.8000112L93 R94 S95 V100 A101L93-L97 WeakPolarHBondContact O-CB 3.43Å; L93-L97 PolarHBondContact O-N 3.47Å; R94-L97 PolarHBondContact O-N 3.48Å; S95-L97 PolarHBondContact O-N 3.34Å; L97-V100 PolarHBondContact O-N 2.81Å; L97-A101 VanDerWaalsContact O-CB 3.25Å; L97-A101 WeakPolarHBondContact O-CB 3.21Å; L97-A101 PolarHBondContact O-N 3.35Å
98G66.9Low61.7Low28 Ų2886.3 Ų86.329%0.28944%0.435SS..Hα-helixtrans-63.9-40.7172.500000112.6R94 S95 A101 A102R94-G98 PolarHBondContact O-N 2.76Å; S95-G98 PolarHBondContact O-N 3.3Å; G98-A101 PolarHBondContact O-N 2.83Å; G98-A102 VanDerWaalsContact O-CB 3.3Å; G98-A102 WeakPolarHBondContact O-CB 3.44Å; G98-A102 PolarHBondContact O-N 3.37Å
99F66.8Low61.9Low74 Ų7487.7 Ų87.733%0.32544%0.439SS..Hα-helixtrans-63.4-47.7173.4180-99.1000111.3S95 L96 A101 A102 N103 L225S95-F99 WeakPolarHBondContact O-CB 3.34Å; S95-F99 PolarHBondContact O-N 3.48Å; L96-F99 PolarHBondContact O-N 2.95Å; F99-A101 VanDerWaalsContact C-N 3.35Å; F99-A101 PolarHBondContact O-N 3.39Å; F99-A102 PolarHBondContact O-N 2.76Å; F99-N103 VanDerWaalsContact CE1-ND2 3.32Å; F99-N103 WeakPolarHBondContact CE1-ND2 3.43Å; F99-N103 WeakPolarHBondContact CE2-ND2 3.18Å; F99-N103 VanDerWaalsContact CZ-ND2 3.29Å; F99-N103 WeakPolarHBondContact CZ-ND2 2.98Å; F99-N103 WeakPolarHBondContact O-CB 3.24Å; F99-N103 PolarHBondContact O-N 3.19Å; F99-N103 PolarHBondContact O-ND2 2.9Å; F99-L225 HydrophobicContact CE2-CD1 3.76Å; F99-L225 HydrophobicContact CZ-CD1 3.72Å
100V71Confident62.1Low63 Ų6385 Ų8538%0.38244%0.436SS..Hα-helixtrans-63-39.91761700000111.3L96 L97 N103 L104L96-V100 WeakPolarHBondContact O-CB 3.42Å; L96-V100 VanDerWaalsContact O-CG2 3.3Å; L96-V100 WeakPolarHBondContact O-CG2 3.38Å; L96-V100 PolarHBondContact O-N 3.07Å; L97-V100 PolarHBondContact O-N 2.81Å; V100-N103 PolarHBondContact O-N 2.73Å; V100-L104 HydrophobicContact CG1-CD1 3.92Å; V100-L104 HydrophobicContact CG1-CG 4.39Å; V100-L104 WeakPolarHBondContact O-CB 3.43Å; V100-L104 VanDerWaalsContact O-CG 3.3Å; V100-L104 WeakPolarHBondContact O-CG 3.42Å; V100-L104 PolarHBondContact O-N 2.84Å
101A67.3Low62.4Low53 Ų5384.9 Ų84.944%0.43844%0.442SS..Hα-helixtrans-66.6-42.3175.500000112.3L97 G98 F99 N103 L104 L105L97-A101 VanDerWaalsContact O-CB 3.25Å; L97-A101 WeakPolarHBondContact O-CB 3.21Å; L97-A101 PolarHBondContact O-N 3.35Å; G98-A101 PolarHBondContact O-N 2.83Å; F99-A101 VanDerWaalsContact C-N 3.35Å; F99-A101 PolarHBondContact O-N 3.39Å; A101-N103 VanDerWaalsContact C-N 3.33Å; A101-L104 PolarHBondContact O-N 2.71Å; A101-L105 VanDerWaalsContact O-CB 3.27Å; A101-L105 WeakPolarHBondContact O-CB 3.23Å; A101-L105 PolarHBondContact O-N 2.83Å
102A68.8Low62.5Low42 Ų4280.2 Ų80.235%0.34743%0.429SS..Hα-helixtrans-65.3-36.8174.100000111.9G98 F99 F106G98-A102 VanDerWaalsContact O-CB 3.3Å; G98-A102 WeakPolarHBondContact O-CB 3.44Å; G98-A102 PolarHBondContact O-N 3.37Å; F99-A102 PolarHBondContact O-N 2.76Å; A102-F106 WeakPolarHBondContact O-CB 3.37Å; A102-F106 PolarHBondContact O-N 3.32Å
103N68.2Low62.6Low27 Ų2782 Ų8214%0.14444%0.44CS..Hα-helixtrans-64.8-49.3172.4-88.6-102000111.4F99 V100 A101 L105 F106 W107 Y221F99-N103 VanDerWaalsContact CE1-ND2 3.32Å; F99-N103 WeakPolarHBondContact CE1-ND2 3.43Å; F99-N103 WeakPolarHBondContact CE2-ND2 3.18Å; F99-N103 VanDerWaalsContact CZ-ND2 3.29Å; F99-N103 WeakPolarHBondContact CZ-ND2 2.98Å; F99-N103 WeakPolarHBondContact O-CB 3.24Å; F99-N103 PolarHBondContact O-N 3.19Å; F99-N103 PolarHBondContact O-ND2 2.9Å; V100-N103 PolarHBondContact O-N 2.73Å; A101-N103 VanDerWaalsContact C-N 3.33Å; N103-L105 VanDerWaalsContact C-N 3.33Å; N103-L105 PolarHBondContact O-N 2.93Å; N103-F106 WeakPolarHBondContact O-CB 3.27Å; N103-F106 PolarHBondContact O-N 3.35Å; N103-W107 PolarHBondContact O-N 3.46Å; N103-Y221 WeakPolarHBondContact OD1-CE2 3.2Å; N103-Y221 PolarHBondContact OD1-OH 2.99Å
104L66.9Low62.7Low115 Ų11581 Ų8160%0.60243%0.427SS*.Hα-helixtrans-61.4-41.2177.3-75.9168.5000111.6V100 A101 W107 F108V100-L104 HydrophobicContact CG1-CD1 3.92Å; V100-L104 HydrophobicContact CG1-CG 4.39Å; V100-L104 WeakPolarHBondContact O-CB 3.43Å; V100-L104 VanDerWaalsContact O-CG 3.3Å; V100-L104 WeakPolarHBondContact O-CG 3.42Å; V100-L104 PolarHBondContact O-N 2.84Å; A101-L104 PolarHBondContact O-N 2.71Å; L104-W107 PolarHBondContact O-N 3.25Å; L104-F108 WeakPolarHBondContact O-CB 3.12Å; L104-F108 PolarHBondContact O-N 3.47Å
105L67.8Low62.7Low104 Ų10485.7 Ų85.755%0.54545%0.445SS..Hα-helixtrans-64.3-42.2174.4-176.663.7000111.5A101 N103 F108 L109A101-L105 VanDerWaalsContact O-CB 3.27Å; A101-L105 WeakPolarHBondContact O-CB 3.23Å; A101-L105 PolarHBondContact O-N 2.83Å; N103-L105 VanDerWaalsContact C-N 3.33Å; N103-L105 PolarHBondContact O-N 2.93Å; L105-F108 PolarHBondContact O-N 3.01Å; L105-L109 HydrophobicContact CD1-CD1 3.84Å; L105-L109 HydrophobicContact CG-CD1 4.27Å; L105-L109 WeakPolarHBondContact O-CD1 3.45Å; L105-L109 PolarHBondContact O-N 3.32Å
106F66.4Low62.5Low34 Ų3489.5 Ų89.515%0.14947%0.467CS..Hα-helixtrans-61.7-49174.9176.3-89000111.8A102 N103 F108 L109 A110 V217 Y221 L224A102-F106 WeakPolarHBondContact O-CB 3.37Å; A102-F106 PolarHBondContact O-N 3.32Å; N103-F106 WeakPolarHBondContact O-CB 3.27Å; N103-F106 PolarHBondContact O-N 3.35Å; F106-F108 VanDerWaalsContact C-N 3.32Å; F106-F108 PolarHBondContact O-N 2.83Å; F106-L109 PolarHBondContact O-N 2.8Å; F106-A110 HydrophobicContact CE1-CB 4.43Å; F106-A110 VanDerWaalsContact O-CB 3.28Å; F106-A110 WeakPolarHBondContact O-CB 3.42Å; F106-A110 PolarHBondContact O-N 3.24Å; F106-V217 HydrophobicContact CE1-CG1 3.76Å; F106-V217 HydrophobicContact CZ-CG1 3.59Å; F106-V217 WeakPolarHBondContact CZ-O 3.48Å; F106-Y221 AromaticContact CD1-CD2 3.69Å; F106-Y221 HydrophobicContact CD1-CD2 3.69Å; F106-Y221 HydrophobicContact CD1-CE2 4.44Å; F106-Y221 HydrophobicContact CD1-CG 4.41Å; F106-Y221 AromaticContact CE1-CD2 3.7Å; F106-Y221 HydrophobicContact CE1-CD2 3.7Å; F106-Y221 AromaticContact CE1-CG 3.97Å; F106-Y221 HydrophobicContact CE1-CG 3.97Å; F106-Y221 HydrophobicContact CG-CD2 4.24Å; F106-Y221 HydrophobicContact CZ-CD2 4.24Å; F106-Y221 HydrophobicContact CZ-CG 4.34Å; F106-L224 HydrophobicContact CD2-CD2 4.17Å
107W68Low62.2Low122 Ų12290.5 Ų90.546%0.46247%0.465SS..Hα-helixtrans-64.6-35.2176.4-77.8106.8000112N103 L104 A110 L111N103-W107 PolarHBondContact O-N 3.46Å; L104-W107 PolarHBondContact O-N 3.25Å; W107-A110 PolarHBondContact O-N 2.84Å; W107-L111 VanDerWaalsContact O-CB 3.31Å; W107-L111 WeakPolarHBondContact O-CB 3.49Å; W107-L111 WeakPolarHBondContact O-CD1 3.25Å; W107-L111 WeakPolarHBondContact O-CG 3.44Å; W107-L111 PolarHBondContact O-N 3.14Å
108F59.5Low61.5Low135 Ų13589.3 Ų89.359%0.59246%0.456SS*.Hα-helixtrans-64.3-44.6173179.7-104.8000112.1L104 L105 F106 A110 T112L104-F108 WeakPolarHBondContact O-CB 3.12Å; L104-F108 PolarHBondContact O-N 3.47Å; L105-F108 PolarHBondContact O-N 3.01Å; F106-F108 VanDerWaalsContact C-N 3.32Å; F106-F108 PolarHBondContact O-N 2.83Å; F108-A110 VanDerWaalsContact C-N 3.32Å; F108-A110 PolarHBondContact O-N 3.44Å; F108-T112 WeakPolarHBondContact O-CB 3.42Å; F108-T112 PolarHBondContact O-N 2.81Å; F108-T112 PolarHBondContact O-OG1 2.83Å
109L57.8Low60.6Low74 Ų7493.6 Ų93.639%0.38747%0.472SS..Hα-helixtrans-65.8-33.4173-95.965.2000112.5L105 F106 W114L105-L109 HydrophobicContact CD1-CD1 3.84Å; L105-L109 HydrophobicContact CG-CD1 4.27Å; L105-L109 WeakPolarHBondContact O-CD1 3.45Å; L105-L109 PolarHBondContact O-N 3.32Å; F106-L109 PolarHBondContact O-N 2.8Å; L109-W114 HydrophobicContact CD2-CZ3 4.46Å
110A57.8Low60.4Low34 Ų3493.8 Ų93.828%0.28148%0.475SS..Hα-helixtrans-74.4-34.5178.300000113.8F106 W107 F108 V217F106-A110 HydrophobicContact CE1-CB 4.43Å; F106-A110 VanDerWaalsContact O-CB 3.28Å; F106-A110 WeakPolarHBondContact O-CB 3.42Å; F106-A110 PolarHBondContact O-N 3.24Å; W107-A110 PolarHBondContact O-N 2.84Å; F108-A110 VanDerWaalsContact C-N 3.32Å; F108-A110 PolarHBondContact O-N 3.44Å; A110-V217 HydrophobicContact CB-CG1 3.51Å; A110-V217 HydrophobicContact CB-CG2 4.48Å
111L59Low60Low143 Ų14394.1 Ų94.175%0.74948%0.481SS*.Hα-helixtrans-81.4-22.2176.3-69.3168.3000112.2W107W107-L111 VanDerWaalsContact O-CB 3.31Å; W107-L111 WeakPolarHBondContact O-CB 3.49Å; W107-L111 WeakPolarHBondContact O-CD1 3.25Å; W107-L111 WeakPolarHBondContact O-CG 3.44Å; W107-L111 PolarHBondContact O-N 3.14Å
112T52.8Low60Low47 Ų4795.6 Ų95.629%0.28848%0.484SS..SBendtrans-70.5136166.4-54.90000108.8F108 W114F108-T112 WeakPolarHBondContact O-CB 3.42Å; F108-T112 PolarHBondContact O-N 2.81Å; F108-T112 PolarHBondContact O-OG1 2.83Å; T112-W114 HydrophobicContact CG2-CG 4.48Å; T112-W114 PolarHBondContact O-N 3.3Å
113P54Low59.4Low123 Ų12399.3 Ų99.380%0.79950%0.496SS*.  trans-72.869-178.729.1-35.4000112.6R115P113-R115 VanDerWaalsContact C-N 3.34Å; P113-R115 PolarHBondContact O-N 3.49Å
114W54.4Low59.3Low118 Ų118102.9 Ų102.945%0.44751%0.513SS..  trans-93.921.5-174.7-110.146.1000113.8L109 T112 V116 Y117 H118L109-W114 HydrophobicContact CD2-CZ3 4.46Å; T112-W114 HydrophobicContact CG2-CG 4.48Å; T112-W114 PolarHBondContact O-N 3.3Å; W114-V116 PolarHBondContact O-N 3.43Å; W114-Y117 HydrophobicContact CB-CD2 4.28Å; W114-Y117 AromaticContact CD1-CD2 3.63Å; W114-Y117 AromaticContact CD1-CE2 3.76Å; W114-Y117 HydrophobicContact CD2-CD1 4.44Å; W114-Y117 AromaticContact CD2-CD2 3.26Å; W114-Y117 HydrophobicContact CD2-CD2 3.26Å; W114-Y117 AromaticContact CD2-CE2 3.85Å; W114-Y117 HydrophobicContact CD2-CE2 3.85Å; W114-Y117 AromaticContact CD2-CG 3.6Å; W114-Y117 HydrophobicContact CD2-CG 3.6Å; W114-Y117 AromaticContact CE2-CD2 3.3Å; W114-Y117 AromaticContact CE2-CE2 3.34Å; W114-Y117 AromaticContact CE2-CG 3.79Å; W114-Y117 AromaticContact CE2-CZ 3.87Å; W114-Y117 VanDerWaalsContact CE3-CB 3.47Å; W114-Y117 HydrophobicContact CE3-CD1 4.3Å; W114-Y117 AromaticContact CE3-CD2 3.79Å; W114-Y117 HydrophobicContact CE3-CD2 3.79Å; W114-Y117 AromaticContact CE3-CG 3.59Å; W114-Y117 HydrophobicContact CE3-CG 3.59Å; W114-Y117 AromaticContact CG-CD2 3.49Å; W114-Y117 HydrophobicContact CG-CD2 3.49Å; W114-Y117 VanDerWaalsContact CG-CD2 3.49Å; W114-Y117 HydrophobicContact CG-CE2 4.09Å; W114-Y117 HydrophobicContact CG-CG 4.22Å; W114-Y117 AromaticContact CH2-CD1 3.85Å; W114-Y117 HydrophobicContact CH2-CD1 3.85Å; W114-Y117 HydrophobicContact CH2-CD2 4.29Å; W114-Y117 HydrophobicContact CH2-CE1 4.06Å; W114-Y117 HydrophobicContact CH2-CE2 4.49Å; W114-Y117 AromaticContact CH2-CG 3.95Å; W114-Y117 HydrophobicContact CH2-CG 3.95Å; W114-Y117 HydrophobicContact CZ2-CD1 4.01Å; W114-Y117 AromaticContact CZ2-CD2 3.85Å; W114-Y117 HydrophobicContact CZ2-CD2 3.85Å; W114-Y117 AromaticContact CZ2-CE1 3.89Å; W114-Y117 HydrophobicContact CZ2-CE1 3.89Å; W114-Y117 AromaticContact CZ2-CE2 3.72Å; W114-Y117 HydrophobicContact CZ2-CE2 3.72Å; W114-Y117 AromaticContact CZ2-CG 3.97Å; W114-Y117 HydrophobicContact CZ2-CG 3.97Å; W114-Y117 AromaticContact CZ2-CZ 3.72Å; W114-Y117 AromaticContact CZ3-CD1 4Å; W114-Y117 HydrophobicContact CZ3-CD1 4Å; W114-Y117 HydrophobicContact CZ3-CD2 4.27Å; W114-Y117 AromaticContact CZ3-CG 3.77Å; W114-Y117 HydrophobicContact CZ3-CG 3.77Å; W114-Y117 AromaticContact NE1-CD2 3.52Å; W114-Y117 AromaticContact NE1-CE2 3.3Å; W114-Y117 VanDerWaalsContact NE1-CE2 3.3Å; W114-Y117 PolarHBondContact O-N 2.8Å; W114-H118 PolarHBondContact O-N 2.82Å
115R55.7Low59.4Low228 Ų228102 Ų10286%0.8651%0.509SS*.Hα-helixtrans-49.3-34.8176.2-134.3-179.5-168.9178.53.3112.1P113 L119P113-R115 VanDerWaalsContact C-N 3.34Å; P113-R115 PolarHBondContact O-N 3.49Å; R115-L119 WeakPolarHBondContact O-CB 3.45Å; R115-L119 PolarHBondContact O-N 3.21Å; R115-L119 VanDerWaalsContact O-N 3.11Å
116V53.4Low59.4Low93 Ų9398.6 Ų98.656%0.56450%0.499SS*.Hα-helixtrans-63.4-45.3177.5-173.60000112.1W114 L119 I120W114-V116 PolarHBondContact O-N 3.43Å; V116-L119 PolarHBondContact O-N 3.47Å; V116-I120 HydrophobicContact CG1-CD1 3.77Å; V116-I120 HydrophobicContact CG1-CG1 4.42Å; V116-I120 WeakPolarHBondContact O-CB 3.21Å; V116-I120 VanDerWaalsContact O-CG1 3.25Å; V116-I120 WeakPolarHBondContact O-CG1 3.31Å; V116-I120 PolarHBondContact O-N 2.85Å
117Y55.8Low59.1Low122 Ų122105.5 Ų105.548%0.47852%0.524SS..Hα-helixtrans-70.5-34.3-179.2-70.8-91.7000112.4W114 L119 I120 S121W114-Y117 HydrophobicContact CB-CD2 4.28Å; W114-Y117 AromaticContact CD1-CD2 3.63Å; W114-Y117 AromaticContact CD1-CE2 3.76Å; W114-Y117 HydrophobicContact CD2-CD1 4.44Å; W114-Y117 AromaticContact CD2-CD2 3.26Å; W114-Y117 HydrophobicContact CD2-CD2 3.26Å; W114-Y117 AromaticContact CD2-CE2 3.85Å; W114-Y117 HydrophobicContact CD2-CE2 3.85Å; W114-Y117 AromaticContact CD2-CG 3.6Å; W114-Y117 HydrophobicContact CD2-CG 3.6Å; W114-Y117 AromaticContact CE2-CD2 3.3Å; W114-Y117 AromaticContact CE2-CE2 3.34Å; W114-Y117 AromaticContact CE2-CG 3.79Å; W114-Y117 AromaticContact CE2-CZ 3.87Å; W114-Y117 VanDerWaalsContact CE3-CB 3.47Å; W114-Y117 HydrophobicContact CE3-CD1 4.3Å; W114-Y117 AromaticContact CE3-CD2 3.79Å; W114-Y117 HydrophobicContact CE3-CD2 3.79Å; W114-Y117 AromaticContact CE3-CG 3.59Å; W114-Y117 HydrophobicContact CE3-CG 3.59Å; W114-Y117 AromaticContact CG-CD2 3.49Å; W114-Y117 HydrophobicContact CG-CD2 3.49Å; W114-Y117 VanDerWaalsContact CG-CD2 3.49Å; W114-Y117 HydrophobicContact CG-CE2 4.09Å; W114-Y117 HydrophobicContact CG-CG 4.22Å; W114-Y117 AromaticContact CH2-CD1 3.85Å; W114-Y117 HydrophobicContact CH2-CD1 3.85Å; W114-Y117 HydrophobicContact CH2-CD2 4.29Å; W114-Y117 HydrophobicContact CH2-CE1 4.06Å; W114-Y117 HydrophobicContact CH2-CE2 4.49Å; W114-Y117 AromaticContact CH2-CG 3.95Å; W114-Y117 HydrophobicContact CH2-CG 3.95Å; W114-Y117 HydrophobicContact CZ2-CD1 4.01Å; W114-Y117 AromaticContact CZ2-CD2 3.85Å; W114-Y117 HydrophobicContact CZ2-CD2 3.85Å; W114-Y117 AromaticContact CZ2-CE1 3.89Å; W114-Y117 HydrophobicContact CZ2-CE1 3.89Å; W114-Y117 AromaticContact CZ2-CE2 3.72Å; W114-Y117 HydrophobicContact CZ2-CE2 3.72Å; W114-Y117 AromaticContact CZ2-CG 3.97Å; W114-Y117 HydrophobicContact CZ2-CG 3.97Å; W114-Y117 AromaticContact CZ2-CZ 3.72Å; W114-Y117 AromaticContact CZ3-CD1 4Å; W114-Y117 HydrophobicContact CZ3-CD1 4Å; W114-Y117 HydrophobicContact CZ3-CD2 4.27Å; W114-Y117 AromaticContact CZ3-CG 3.77Å; W114-Y117 HydrophobicContact CZ3-CG 3.77Å; W114-Y117 AromaticContact NE1-CD2 3.52Å; W114-Y117 AromaticContact NE1-CE2 3.3Å; W114-Y117 VanDerWaalsContact NE1-CE2 3.3Å; W114-Y117 PolarHBondContact O-N 2.8Å; Y117-L119 VanDerWaalsContact C-N 3.34Å; Y117-I120 PolarHBondContact O-N 3.45Å; Y117-S121 VanDerWaalsContact O-CB 3.24Å; Y117-S121 WeakPolarHBondContact O-CB 3.23Å; Y117-S121 PolarHBondContact O-N 2.75Å
118H53.9Low59.1Low97 Ų97102.5 Ų102.545%0.44952%0.519SS..Hα-helixtrans-68.7-36.1174.5-152-45.3000111.6W114 V122W114-H118 PolarHBondContact O-N 2.82Å; H118-V122 WeakPolarHBondContact O-CB 3.18Å; H118-V122 VanDerWaalsContact O-CG2 3.28Å; H118-V122 WeakPolarHBondContact O-CG2 3.34Å; H118-V122 PolarHBondContact O-N 2.8Å
119L48Very low59.2Low118 Ų11899.9 Ų99.962%0.61851%0.51SS*.Hα-helixtrans-72.6-38.2175.3-165.9144.6000112R115 V116 Y117 V122 M123R115-L119 WeakPolarHBondContact O-CB 3.45Å; R115-L119 PolarHBondContact O-N 3.21Å; R115-L119 VanDerWaalsContact O-N 3.11Å; V116-L119 PolarHBondContact O-N 3.47Å; Y117-L119 VanDerWaalsContact C-N 3.34Å; L119-V122 PolarHBondContact O-N 3.44Å; L119-M123 HydrophobicContact CD2-CG 4.23Å; L119-M123 WeakPolarHBondContact O-CB 3.35Å; L119-M123 WeakPolarHBondContact O-CG 3.45Å; L119-M123 PolarHBondContact O-N 2.83Å
120I60.8Low59.4Low77 Ų77102.5 Ų102.540%0.39552%0.522SS..Hα-helixtrans-63.2-44.6170.5-71.7168.1000110.7V116 Y117 V122 M123 I124V116-I120 HydrophobicContact CG1-CD1 3.77Å; V116-I120 HydrophobicContact CG1-CG1 4.42Å; V116-I120 WeakPolarHBondContact O-CB 3.21Å; V116-I120 VanDerWaalsContact O-CG1 3.25Å; V116-I120 WeakPolarHBondContact O-CG1 3.31Å; V116-I120 PolarHBondContact O-N 2.85Å; Y117-I120 PolarHBondContact O-N 3.45Å; I120-V122 PolarHBondContact O-N 2.78Å; I120-M123 PolarHBondContact O-N 3.21Å; I120-I124 HydrophobicContact CG2-CD1 3.62Å; I120-I124 HydrophobicContact CG2-CG1 4.29Å; I120-I124 WeakPolarHBondContact O-CB 3.22Å; I120-I124 VanDerWaalsContact O-CG1 3.28Å; I120-I124 WeakPolarHBondContact O-CG1 3.38Å; I120-I124 PolarHBondContact O-N 3.44Å
121S63.2Low59.4Low71 Ų71106.3 Ų106.350%0.49753%0.534SS..Hα-helixtrans-61.6-42.5176.9-175.70000111.6Y117 I124 L125Y117-S121 VanDerWaalsContact O-CB 3.24Å; Y117-S121 WeakPolarHBondContact O-CB 3.23Å; Y117-S121 PolarHBondContact O-N 2.75Å; S121-I124 PolarHBondContact O-N 2.74Å; S121-L125 WeakPolarHBondContact O-CB 3.39Å; S121-L125 PolarHBondContact O-N 3.28Å
122V66.9Low59.5Low84 Ų84104.1 Ų104.151%0.50952%0.522SS..Hα-helixtrans-68.3-35.7174.3170.30000112H118 L119 I120 G126H118-V122 WeakPolarHBondContact O-CB 3.18Å; H118-V122 VanDerWaalsContact O-CG2 3.28Å; H118-V122 WeakPolarHBondContact O-CG2 3.34Å; H118-V122 PolarHBondContact O-N 2.8Å; L119-V122 PolarHBondContact O-N 3.44Å; I120-V122 PolarHBondContact O-N 2.78Å; V122-G126 PolarHBondContact O-N 3.02Å
123M57Low60Low120 Ų120105.9 Ų105.959%0.59153%0.529SS*.Hα-helixtrans-66.7-41.9173.2-82.7-92.180.200112.6L119 I120 G126 R127L119-M123 HydrophobicContact CD2-CG 4.23Å; L119-M123 WeakPolarHBondContact O-CB 3.35Å; L119-M123 WeakPolarHBondContact O-CG 3.45Å; L119-M123 PolarHBondContact O-N 2.83Å; I120-M123 PolarHBondContact O-N 3.21Å; M123-G126 PolarHBondContact O-N 3.15Å; M123-R127 WeakPolarHBondContact O-CB 3.12Å; M123-R127 WeakPolarHBondContact O-CG 3.28Å; M123-R127 PolarHBondContact O-N 3.36Å
124I65Low60.2Low101 Ų101106.6 Ų106.652%0.51852%0.519SS..Hα-helixtrans-67.7-45175.7-68.5168.8000109.7I120 S121 G126 R127 V128I120-I124 HydrophobicContact CG2-CD1 3.62Å; I120-I124 HydrophobicContact CG2-CG1 4.29Å; I120-I124 WeakPolarHBondContact O-CB 3.22Å; I120-I124 VanDerWaalsContact O-CG1 3.28Å; I120-I124 WeakPolarHBondContact O-CG1 3.38Å; I120-I124 PolarHBondContact O-N 3.44Å; S121-I124 PolarHBondContact O-N 2.74Å; I124-G126 VanDerWaalsContact C-N 3.32Å; I124-G126 PolarHBondContact O-N 2.84Å; I124-R127 WeakPolarHBondContact O-CB 3.42Å; I124-R127 PolarHBondContact O-N 2.82Å; I124-V128 HydrophobicContact CG2-CG2 4.41Å; I124-V128 WeakPolarHBondContact O-CB 3.47Å; I124-V128 VanDerWaalsContact O-CG2 3.32Å; I124-V128 WeakPolarHBondContact O-CG2 3.38Å; I124-V128 PolarHBondContact O-N 3.28Å
125L69.9Low59.8Low97 Ų97105.4 Ų105.451%0.50852%0.522SS..Hα-helixtrans-61.6-40.6174.8-17761.3000111.3S121 V128 I129S121-L125 WeakPolarHBondContact O-CB 3.39Å; S121-L125 PolarHBondContact O-N 3.28Å; L125-V128 PolarHBondContact O-N 3.45Å; L125-I129 HydrophobicContact CD1-CD1 4.04Å; L125-I129 HydrophobicContact CD1-CG1 4.25Å; L125-I129 HydrophobicContact CD2-CD1 4.49Å; L125-I129 HydrophobicContact CG-CD1 3.8Å; L125-I129 HydrophobicContact CG-CG1 4.42Å; L125-I129 VanDerWaalsContact O-CB 3.31Å; L125-I129 WeakPolarHBondContact O-CB 3.31Å; L125-I129 WeakPolarHBondContact O-CG1 3.46Å; L125-I129 PolarHBondContact O-N 3.37Å
126G68.3Low59.2Low32 Ų3299.7 Ų99.733%0.3351%0.506SS..Hα-helixtrans-64.8-39.9173.400000113V122 M123 I124 M130V122-G126 PolarHBondContact O-N 3.02Å; M123-G126 PolarHBondContact O-N 3.15Å; I124-G126 VanDerWaalsContact C-N 3.32Å; I124-G126 PolarHBondContact O-N 2.84Å; G126-M130 VanDerWaalsContact O-CB 3.24Å; G126-M130 WeakPolarHBondContact O-CB 3.46Å; G126-M130 PolarHBondContact O-N 3.11Å
127R60.8Low59.3Low180 Ų180100 Ų10068%0.67951%0.508SS*.Hα-helixtrans-62.3-44.4171.4-80.7-75.8-170.9111.5-1111.7M123 I124 M130 Q131M123-R127 WeakPolarHBondContact O-CB 3.12Å; M123-R127 WeakPolarHBondContact O-CG 3.28Å; M123-R127 PolarHBondContact O-N 3.36Å; I124-R127 WeakPolarHBondContact O-CB 3.42Å; I124-R127 PolarHBondContact O-N 2.82Å; R127-M130 PolarHBondContact O-N 3.13Å; R127-Q131 WeakPolarHBondContact O-CB 3.24Å; R127-Q131 WeakPolarHBondContact O-CG 3.45Å; R127-Q131 PolarHBondContact O-N 2.75Å
128V66.1Low59Low58 Ų5899.1 Ų99.135%0.35251%0.511SS..Hα-helixtrans-68.1-42.9178.2168.60000110.8I124 L125 M130 Q131 I132I124-V128 HydrophobicContact CG2-CG2 4.41Å; I124-V128 WeakPolarHBondContact O-CB 3.47Å; I124-V128 VanDerWaalsContact O-CG2 3.32Å; I124-V128 WeakPolarHBondContact O-CG2 3.38Å; I124-V128 PolarHBondContact O-N 3.28Å; L125-V128 PolarHBondContact O-N 3.45Å; V128-M130 VanDerWaalsContact C-N 3.34Å; V128-M130 PolarHBondContact O-N 3.32Å; V128-Q131 PolarHBondContact O-N 2.95Å; V128-I132 HydrophobicContact CG1-CD1 3.68Å; V128-I132 HydrophobicContact CG1-CG1 4.37Å; V128-I132 WeakPolarHBondContact O-CB 3.09Å; V128-I132 WeakPolarHBondContact O-CG1 3.19Å; V128-I132 PolarHBondContact O-N 3.03Å
129I62.5Low58.5Low81 Ų8196 Ų9642%0.41550%0.5SS..Hα-helixtrans-63.3-40.5173.6-71.8168.1000110.4L125 I132 I133L125-I129 HydrophobicContact CD1-CD1 4.04Å; L125-I129 HydrophobicContact CD1-CG1 4.25Å; L125-I129 HydrophobicContact CD2-CD1 4.49Å; L125-I129 HydrophobicContact CG-CD1 3.8Å; L125-I129 HydrophobicContact CG-CG1 4.42Å; L125-I129 VanDerWaalsContact O-CB 3.31Å; L125-I129 WeakPolarHBondContact O-CB 3.31Å; L125-I129 WeakPolarHBondContact O-CG1 3.46Å; L125-I129 PolarHBondContact O-N 3.37Å; I129-I132 CarbonylContact O-C 3.58Å; I129-I132 PolarHBondContact O-N 2.78Å; I129-I133 HydrophobicContact CG2-CD1 3.66Å; I129-I133 HydrophobicContact CG2-CG1 4.31Å; I129-I133 WeakPolarHBondContact O-CB 3.21Å; I129-I133 VanDerWaalsContact O-CG1 3.23Å; I129-I133 WeakPolarHBondContact O-CG1 3.35Å; I129-I133 PolarHBondContact O-N 3.16Å
130M61.9Low58.6Low129 Ų129100.6 Ų100.664%0.63551%0.509SS*.Hα-helixtrans-71.6-32177.3-169.4148.466.700112.5G126 R127 V128 K134G126-M130 VanDerWaalsContact O-CB 3.24Å; G126-M130 WeakPolarHBondContact O-CB 3.46Å; G126-M130 PolarHBondContact O-N 3.11Å; R127-M130 PolarHBondContact O-N 3.13Å; V128-M130 VanDerWaalsContact C-N 3.34Å; V128-M130 PolarHBondContact O-N 3.32Å; M130-K134 WeakPolarHBondContact O-CB 3.17Å; M130-K134 PolarHBondContact O-N 2.98Å
131Q57.2Low57.8Low114 Ų114103.3 Ų103.353%0.53353%0.53SS..Hα-helixtrans-64.9-48.5166.7-79.4175.5-21.800111R127 V128 I133 K134 D135R127-Q131 WeakPolarHBondContact O-CB 3.24Å; R127-Q131 WeakPolarHBondContact O-CG 3.45Å; R127-Q131 PolarHBondContact O-N 2.75Å; V128-Q131 PolarHBondContact O-N 2.95Å; Q131-I133 VanDerWaalsContact C-N 3.32Å; Q131-I133 PolarHBondContact O-N 3.48Å; Q131-K134 CarbonylContact O-C 3.59Å; Q131-K134 PolarHBondContact O-N 2.8Å; Q131-D135 VanDerWaalsContact O-CB 3.26Å; Q131-D135 WeakPolarHBondContact O-CB 3.35Å; Q131-D135 VanDerWaalsContact O-CG 3.29Å; Q131-D135 PolarHBondContact O-N 3.2Å
132I61.6Low56.9Low96 Ų96108.4 Ų108.449%0.49254%0.538SS..Hα-helixtrans-60.7-39176.5-70.1164.5000111.1V128 I129 D135 M136V128-I132 HydrophobicContact CG1-CD1 3.68Å; V128-I132 HydrophobicContact CG1-CG1 4.37Å; V128-I132 WeakPolarHBondContact O-CB 3.09Å; V128-I132 WeakPolarHBondContact O-CG1 3.19Å; V128-I132 PolarHBondContact O-N 3.03Å; I129-I132 CarbonylContact O-C 3.58Å; I129-I132 PolarHBondContact O-N 2.78Å; I132-D135 CarbonylContact O-C 3.6Å; I132-M136 WeakPolarHBondContact O-CA 3.32Å; I132-M136 WeakPolarHBondContact O-CB 3.47Å; I132-M136 PolarHBondContact O-N 3.46Å
133I63.5Low56Low85 Ų85105.4 Ų105.444%0.43652%0.524SS..Hα-helixtrans-69.4-44.4175.9-70.7166.4000110.3I129 Q131 D135 M136 V137I129-I133 HydrophobicContact CG2-CD1 3.66Å; I129-I133 HydrophobicContact CG2-CG1 4.31Å; I129-I133 WeakPolarHBondContact O-CB 3.21Å; I129-I133 VanDerWaalsContact O-CG1 3.23Å; I129-I133 WeakPolarHBondContact O-CG1 3.35Å; I129-I133 PolarHBondContact O-N 3.16Å; Q131-I133 VanDerWaalsContact C-N 3.32Å; Q131-I133 PolarHBondContact O-N 3.48Å; I133-D135 VanDerWaalsContact C-N 3.33Å; I133-D135 PolarHBondContact O-N 2.83Å; I133-M136 HydrophobicContact CG1-CE 4.25Å; I133-M136 PolarHBondContact O-N 2.66Å; I133-V137 WeakPolarHBondContact O-CB 3.16Å; I133-V137 VanDerWaalsContact O-CG2 3.27Å; I133-V137 WeakPolarHBondContact O-CG2 3.32Å; I133-V137 PolarHBondContact O-N 2.99Å
134K57.3Low55.7Low138 Ų138103.1 Ų103.160%0.652%0.524SS*.Hα-helixtrans-60.4-43.7175.2179.5169.9177.51700111.3M130 Q131 V137 L138M130-K134 WeakPolarHBondContact O-CB 3.17Å; M130-K134 PolarHBondContact O-N 2.98Å; Q131-K134 CarbonylContact O-C 3.59Å; Q131-K134 PolarHBondContact O-N 2.8Å; K134-V137 PolarHBondContact O-N 3.39Å; K134-L138 HydrophobicContact CG-CD1 3.93Å; K134-L138 WeakPolarHBondContact O-CB 3.33Å; K134-L138 VanDerWaalsContact O-CG 3.25Å; K134-L138 WeakPolarHBondContact O-CG 3.28Å; K134-L138 PolarHBondContact O-N 2.72Å
135D47.9Very low54.7Low93 Ų93104.3 Ų104.350%0.49753%0.528SS..Hα-helixtrans-76.3-23.4178-68.4-17.5000112.2Q131 I132 I133 S139Q131-D135 VanDerWaalsContact O-CB 3.26Å; Q131-D135 WeakPolarHBondContact O-CB 3.35Å; Q131-D135 VanDerWaalsContact O-CG 3.29Å; Q131-D135 PolarHBondContact O-N 3.2Å; I132-D135 CarbonylContact O-C 3.6Å; I133-D135 VanDerWaalsContact C-N 3.33Å; I133-D135 PolarHBondContact O-N 2.83Å; D135-S139 VanDerWaalsContact O-CA 3.32Å; D135-S139 WeakPolarHBondContact O-CA 3.49Å; D135-S139 WeakPolarHBondContact O-CB 3.48Å; D135-S139 PolarHBondContact O-N 3.29Å; D135-S139 PolarHBondContact O-OG 3.18Å
136M43Very low53.5Low108 Ų108104 Ų10453%0.53253%0.526SS..Hα-helixtrans-78.9-30.3170.9-178.9173.355.600111.6I132 I133 S139 R140I132-M136 WeakPolarHBondContact O-CA 3.32Å; I132-M136 WeakPolarHBondContact O-CB 3.47Å; I132-M136 PolarHBondContact O-N 3.46Å; I133-M136 HydrophobicContact CG1-CE 4.25Å; I133-M136 PolarHBondContact O-N 2.66Å; M136-S139 WeakPolarHBondContact CA-OG 3.45Å; M136-S139 CarbonylContact O-C 3.59Å; M136-R140 PolarHBondContact O-N 2.99Å
137V54.7Low52.6Low99 Ų99111.3 Ų111.360%0.654%0.544SS*.Hα-helixtrans-72.8-46.3169.6169.80000110.1I133 K134 S139 R140I133-V137 WeakPolarHBondContact O-CB 3.16Å; I133-V137 VanDerWaalsContact O-CG2 3.27Å; I133-V137 WeakPolarHBondContact O-CG2 3.32Å; I133-V137 PolarHBondContact O-N 2.99Å; K134-V137 PolarHBondContact O-N 3.39Å; V137-S139 VanDerWaalsContact C-N 3.32Å; V137-S139 PolarHBondContact O-N 3.36Å; V137-R140 WeakPolarHBondContact O-CB 3.45Å; V137-R140 PolarHBondContact O-N 2.67Å
138L49.5Very low52Low103 Ų103109.3 Ų109.354%0.53954%0.536SS..Hα-helixtrans-71.3-23.1174.5-69.3169.5000113.4K134 T141K134-L138 HydrophobicContact CG-CD1 3.93Å; K134-L138 WeakPolarHBondContact O-CB 3.33Å; K134-L138 VanDerWaalsContact O-CG 3.25Å; K134-L138 WeakPolarHBondContact O-CG 3.28Å; K134-L138 PolarHBondContact O-N 2.72Å; L138-T141 PolarHBondContact O-OG1 3.15Å
139S42.6Very low51Low33 Ų33109.8 Ų109.823%0.23154%0.542CS..THydrogen-bonded Turntrans-974.6170.973.80000113.3D135 M136 V137 T141 R142 G143D135-S139 VanDerWaalsContact O-CA 3.32Å; D135-S139 WeakPolarHBondContact O-CA 3.49Å; D135-S139 WeakPolarHBondContact O-CB 3.48Å; D135-S139 PolarHBondContact O-N 3.29Å; D135-S139 PolarHBondContact O-OG 3.18Å; M136-S139 WeakPolarHBondContact CA-OG 3.45Å; M136-S139 CarbonylContact O-C 3.59Å; V137-S139 VanDerWaalsContact C-N 3.32Å; V137-S139 PolarHBondContact O-N 3.36Å; S139-T141 PolarHBondContact O-N 3.49Å; S139-T141 VanDerWaalsContact O-N 3.15Å; S139-R142 PolarHBondContact O-N 3.26Å; S139-R142 VanDerWaalsContact O-N 3.08Å; S139-G143 VanDerWaalsContact O-CA 3.23Å; S139-G143 WeakPolarHBondContact O-CA 3.33Å; S139-G143 PolarHBondContact O-N 3.26Å
140R50.4Low50.2Low214 Ų214111.7 Ų111.781%0.80855%0.552SS**THydrogen-bonded Turntrans-60.8-22.6160.4-166.1170.1-179.8171.50.1111.3M136 V137M136-R140 PolarHBondContact O-N 2.99Å; V137-R140 WeakPolarHBondContact O-CB 3.45Å; V137-R140 PolarHBondContact O-N 2.67Å
141T45.5Very low49.7Very low134 Ų134108.3 Ų108.382%0.82254%0.541SS*.THydrogen-bonded Turntrans-100.7-10.117152.60000114.7L138 S139L138-T141 PolarHBondContact O-OG1 3.15Å; S139-T141 PolarHBondContact O-N 3.49Å; S139-T141 VanDerWaalsContact O-N 3.15Å
142R44Very low49.1Very low177 Ų177109.1 Ų109.167%0.66855%0.545SS*.THydrogen-bonded Turntrans-128-12.9-173.2-159.4175-178.2175.51115.5S139 A144 Q145 L146S139-R142 PolarHBondContact O-N 3.26Å; S139-R142 VanDerWaalsContact O-N 3.08Å; R142-A144 PolarHBondContact O-N 3.35Å; R142-Q145 WeakPolarHBondContact O-CB 3.49Å; R142-Q145 PolarHBondContact O-N 2.84Å; R142-Q145 VanDerWaalsContact O-N 3.11Å; R142-L146 PolarHBondContact O-N 2.87Å
143G47.3Very low48.1Very low21 Ų21107.3 Ų107.322%0.21654%0.541CS..Hα-helixtrans-74.5-26.6-166.800000113.9S139 Q145 L146 W147S139-G143 VanDerWaalsContact O-CA 3.23Å; S139-G143 WeakPolarHBondContact O-CA 3.33Å; S139-G143 PolarHBondContact O-N 3.26Å; G143-Q145 PolarHBondContact O-N 3.19Å; G143-Q145 VanDerWaalsContact O-N 3.16Å; G143-L146 PolarHBondContact O-N 3.38Å; G143-W147 WeakPolarHBondContact O-CB 3.47Å; G143-W147 PolarHBondContact O-N 3.27Å
144A50.7Low47.3Very low72 Ų72111 Ų11160%0.59555%0.549SS*.Hα-helixtrans-60.5-21169.500000113R142 R148R142-A144 PolarHBondContact O-N 3.35Å; A144-R148 PolarHBondContact O-NH1 2.94Å
145Q43.9Very low46.8Very low126 Ų126112 Ų11259%0.58956%0.557SS**Hα-helixtrans-89.1-44.6174.4-63.4-64.9-8.100112R142 G143 W147 R148 S149R142-Q145 WeakPolarHBondContact O-CB 3.49Å; R142-Q145 PolarHBondContact O-N 2.84Å; R142-Q145 VanDerWaalsContact O-N 3.11Å; G143-Q145 PolarHBondContact O-N 3.19Å; G143-Q145 VanDerWaalsContact O-N 3.16Å; Q145-W147 VanDerWaalsContact C-N 3.31Å; Q145-W147 PolarHBondContact O-N 3.42Å; Q145-R148 PolarHBondContact O-N 2.9Å; Q145-S149 PolarHBondContact O-N 3.47Å
146L44.6Very low46.6Very low90 Ų90112.7 Ų112.747%0.47156%0.564SS.*Hα-helixtrans-64.7-33.8179.2-68.4171.2000112.7R142 G143 S149 L150R142-L146 PolarHBondContact O-N 2.87Å; G143-L146 PolarHBondContact O-N 3.38Å; L146-S149 PolarHBondContact O-N 3.5Å; L146-L150 WeakPolarHBondContact O-CG 3.27Å; L146-L150 PolarHBondContact O-N 3.09Å
147W49Very low46.7Very low187 Ų187113.1 Ų113.171%0.70857%0.567SS**Hα-helixtrans-64.3-39.7176.9-167.276.2000112.4G143 Q145 L150 S151G143-W147 WeakPolarHBondContact O-CB 3.47Å; G143-W147 PolarHBondContact O-N 3.27Å; Q145-W147 VanDerWaalsContact C-N 3.31Å; Q145-W147 PolarHBondContact O-N 3.42Å; W147-L150 PolarHBondContact O-N 3.43Å; W147-S151 PolarHBondContact O-N 2.95Å; W147-S151 PolarHBondContact O-OG 3.43Å
148R48.8Very low46Very low138 Ų138113.4 Ų113.452%0.52157%0.565SS.*Hα-helixtrans-64.4-46.9174.1-66.3-169.9-17195.51.4112A144 Q145 L150 S151 E152A144-R148 PolarHBondContact O-NH1 2.94Å; Q145-R148 PolarHBondContact O-N 2.9Å; R148-L150 VanDerWaalsContact C-N 3.3Å; R148-L150 PolarHBondContact O-N 3.34Å; R148-S151 PolarHBondContact O-N 2.89Å; R148-S151 VanDerWaalsContact O-N 3.16Å; R148-E152 PolarHBondContact O-N 3.12Å
149S44.5Very low45.4Very low68 Ų68113.1 Ų113.148%0.47657%0.572SS.*Hα-helixtrans-61.1-36.2179174.40000112.9Q145 L146 S153Q145-S149 PolarHBondContact O-N 3.47Å; L146-S149 PolarHBondContact O-N 3.5Å; S149-S153 VanDerWaalsContact O-CB 3.28Å; S149-S153 WeakPolarHBondContact O-CB 3.42Å; S149-S153 PolarHBondContact O-N 2.96Å
150L46Very low45.1Very low120 Ų120121 Ų12163%0.62860%0.602SS**Hα-helixtrans-73.2-35.7175.3-74.9167.2000112.7L146 W147 R148 W154L146-L150 WeakPolarHBondContact O-CG 3.27Å; L146-L150 PolarHBondContact O-N 3.09Å; W147-L150 PolarHBondContact O-N 3.43Å; R148-L150 VanDerWaalsContact C-N 3.3Å; R148-L150 PolarHBondContact O-N 3.34Å; L150-W154 WeakPolarHBondContact O-CB 3.4Å; L150-W154 PolarHBondContact O-N 3.23Å
151S52.7Low45.1Very low58 Ų58116.4 Ų116.441%0.40660%0.6SS.*Hα-helixtrans-63.2-47.7172.1-72.60000112.1W147 R148 S153 W154 E155W147-S151 PolarHBondContact O-N 2.95Å; W147-S151 PolarHBondContact O-OG 3.43Å; R148-S151 PolarHBondContact O-N 2.89Å; R148-S151 VanDerWaalsContact O-N 3.16Å; S151-S153 PolarHBondContact O-N 3.46Å; S151-W154 PolarHBondContact O-N 2.77Å; S151-E155 PolarHBondContact O-N 2.84Å
152E44.7Very low44.7Very low132 Ų132116.9 Ų116.962%0.61760%0.597SS**Hα-helixtrans-61.5-42.8176.5-71.1174.9142.100111.7R148 W154 E155 V156R148-E152 PolarHBondContact O-N 3.12Å; E152-W154 VanDerWaalsContact C-N 3.31Å; E152-W154 PolarHBondContact O-N 3.17Å; E152-E155 PolarHBondContact O-N 3.38Å; E152-V156 WeakPolarHBondContact O-CG2 3.46Å; E152-V156 PolarHBondContact O-N 3.2Å
153S39.2Very low44.6Very low57 Ų57115.6 Ų115.640%0.39960%0.599SS.*Hα-helixtrans-62-36.8177-175.70000112.8S149 S151 V156 I157S149-S153 VanDerWaalsContact O-CB 3.28Å; S149-S153 WeakPolarHBondContact O-CB 3.42Å; S149-S153 PolarHBondContact O-N 2.96Å; S151-S153 PolarHBondContact O-N 3.46Å; S153-V156 PolarHBondContact O-N 3.34Å; S153-I157 WeakPolarHBondContact O-CD1 3.46Å; S153-I157 WeakPolarHBondContact O-CG1 3.36Å; S153-I157 PolarHBondContact O-N 3.19Å
154W47.5Very low44.8Very low162 Ų162124.7 Ų124.761%0.61463%0.627SS**Hα-helixtrans-69.6-32.3177.3-170.9-99.8000112.8L150 S151 E152 N158L150-W154 WeakPolarHBondContact O-CB 3.4Å; L150-W154 PolarHBondContact O-N 3.23Å; S151-W154 PolarHBondContact O-N 2.77Å; E152-W154 VanDerWaalsContact C-N 3.31Å; E152-W154 PolarHBondContact O-N 3.17Å; W154-N158 PolarHBondContact O-ND2 3.03Å
155E46.7Very low44.6Very low161 Ų161125 Ų12575%0.75262%0.623SS**Hα-helixtrans-66.9-39.7175.2-116.3173.9161.100112.3S151 E152 I157S151-E155 PolarHBondContact O-N 2.84Å; E152-E155 PolarHBondContact O-N 3.38Å; E155-I157 PolarHBondContact O-N 2.73Å
156V44Very low44.9Very low107 Ų107128.1 Ų128.165%0.64863%0.629SS**Hα-helixtrans-68.3-33-178.5174.10000113.2E152 S153 S159E152-V156 WeakPolarHBondContact O-CG2 3.46Å; E152-V156 PolarHBondContact O-N 3.2Å; S153-V156 PolarHBondContact O-N 3.34Å; V156-S159 PolarHBondContact O-OG 3.32Å; V156-S159 VanDerWaalsContact O-OG 3.04Å
157I44.4Very low44.9Very low117 Ų117126.9 Ų126.960%0.662%0.622SS**Hα-helixtrans-80.9-15.8-170.2-69168.3000113.4S153 E155 S159S153-I157 WeakPolarHBondContact O-CD1 3.46Å; S153-I157 WeakPolarHBondContact O-CG1 3.36Å; S153-I157 PolarHBondContact O-N 3.19Å; E155-I157 PolarHBondContact O-N 2.73Å; I157-S159 PolarHBondContact O-N 3.49Å; I157-S159 VanDerWaalsContact O-N 3.14Å
158N39.4Very low45.2Very low104 Ų104120.6 Ų120.656%0.55661%0.607SS**THydrogen-bonded Turntrans-80.515.5-176.8-80.7-72.6000115.1W154 K160W154-N158 PolarHBondContact O-ND2 3.03Å; N158-K160 PolarHBondContact O-N 2.84Å
159S37.5Very low45.5Very low98 Ų98120 Ų12069%0.68561%0.61SS**  trans-88.89.4-167.449.70000116.8V156 I157V156-S159 PolarHBondContact O-OG 3.32Å; V156-S159 VanDerWaalsContact O-OG 3.04Å; I157-S159 PolarHBondContact O-N 3.49Å; I157-S159 VanDerWaalsContact O-N 3.14Å
160K36.8Very low45.5Very low199 Ų199117.8 Ų117.887%0.86559%0.594SS**  trans-133.2109.8171.6-89.7-172.1174.2178.20113.3N158N158-K160 PolarHBondContact O-N 2.84Å
161P49.3Very low45.9Very low116 Ų116117.6 Ų117.675%0.75359%0.593SS**  trans-95.9129.2176.135.1-29.7000112
162D37.8Very low46Very low144 Ų144116.1 Ų116.177%0.7758%0.584SS**SBend-169.3161.8109.6-117-36.8000111R164D162-R164 PolarHBondContact O-N 3.28Å
163E41.7Very low46.5Very low150 Ų150113.8 Ų113.870%0.70157%0.573SS**SBendtrans53.7-24-176.2-77.7-171.7139.100118.8K90 P165K90-E163 IonicContact NZ-OE1 3.17Å; K90-E163 PolarHBondContact NZ-OE1 3.2Å; K90-E163 VanDerWaalsContact NZ-OE1 3.17Å; E163-P165 WeakPolarHBondContact O-CD 3.37Å
164R50.8Low46.8Very low213 Ų213114.9 Ų114.980%0.80458%0.581SS**THydrogen-bonded Turntrans-67.8-21.3174.4-86.2-175176.3177.80.1118.9D162 R166 S168D162-R164 PolarHBondContact O-N 3.28Å; R164-R166 PolarHBondContact O-N 2.9Å; R164-S168 PolarHBondContact O-N 3.37Å; R164-S168 PolarHBondContact O-OG 2.86Å
165P46.7Very low47.4Very low79 Ų79115.5 Ų115.551%0.51358%0.583SS.*Hα-helixtrans-72.3-20.1-158.826.2-34000115.6E163 S168 H169E163-P165 WeakPolarHBondContact O-CD 3.37Å; P165-S168 WeakPolarHBondContact CA-OG 3.19Å; P165-S168 PolarHBondContact O-OG 2.71Å; P165-H169 WeakPolarHBondContact O-CB 3.29Å; P165-H169 PolarHBondContact O-N 3.37Å
166R50.7Low47.7Very low190 Ų190113.8 Ų113.872%0.71758%0.577SS**Hα-helixtrans-79-40.3-175.2-67-174.2-179.2-170.80.2113.4R164 C170R164-R166 PolarHBondContact O-N 2.9Å; R166-C170 WeakPolarHBondContact O-CB 3.06Å; R166-C170 PolarHBondContact O-N 3.35Å
167L44.1Very low48.2Very low64 Ų64113.6 Ų113.634%0.33557%0.572SS.*Hα-helixtrans-77.6-39.7176.6-64.6-179.5000111H169 C170 I171 P231L167-H169 VanDerWaalsContact C-N 3.35Å; L167-H169 PolarHBondContact O-N 3.48Å; L167-C170 PolarHBondContact O-N 3.04Å; L167-I171 VanDerWaalsContact O-CB 3.29Å; L167-I171 WeakPolarHBondContact O-CB 3.3Å; L167-I171 WeakPolarHBondContact O-CD1 3.29Å; L167-I171 WeakPolarHBondContact O-CG1 3.11Å; L167-I171 PolarHBondContact O-N 3.06Å; L167-P231 HydrophobicContact CD2-CB 3.8Å; L167-P231 HydrophobicContact CD2-CG 4.02Å
168S56.7Low48.2Very low55 Ų55113 Ų11339%0.38557%0.565SS.*Hα-helixtrans-61.8-42.4173.563.70000111.6R164 P165 I171 A172R164-S168 PolarHBondContact O-N 3.37Å; R164-S168 PolarHBondContact O-OG 2.86Å; P165-S168 WeakPolarHBondContact CA-OG 3.19Å; P165-S168 PolarHBondContact O-OG 2.71Å; S168-I171 PolarHBondContact O-N 2.98Å; S168-A172 WeakPolarHBondContact O-CB 3.32Å; S168-A172 PolarHBondContact O-N 3.39Å
169H54.3Low48.6Very low125 Ų125110.3 Ų110.358%0.57955%0.554SS**Hα-helixtrans-64.9-44.7175.1-170.5-66.7000112.2P165 L167 I171 A172 E173P165-H169 WeakPolarHBondContact O-CB 3.29Å; P165-H169 PolarHBondContact O-N 3.37Å; L167-H169 VanDerWaalsContact C-N 3.35Å; L167-H169 PolarHBondContact O-N 3.48Å; H169-I171 PolarHBondContact O-N 2.78Å; H169-A172 PolarHBondContact O-N 2.96Å; H169-E173 IonicContact CE1-OE2 3.96Å; H169-E173 IonicContact ND1-OE2 3.67Å; H169-E173 WeakPolarHBondContact O-CB 3.25Å; H169-E173 PolarHBondContact O-N 2.8Å
170C44.7Very low49.9Very low22 Ų22109.8 Ų109.815%0.14954%0.543CS..Hα-helixtrans-68.6-33.5179.6-168.70000112.8R166 L167 S174 K234R166-C170 WeakPolarHBondContact O-CB 3.06Å; R166-C170 PolarHBondContact O-N 3.35Å; L167-C170 PolarHBondContact O-N 3.04Å; C170-S174 VanDerWaalsContact O-CB 3.3Å; C170-S174 WeakPolarHBondContact O-CB 3.4Å; C170-S174 PolarHBondContact O-N 3.47Å; C170-K234 PolarHBondContact SG-NZ 3.5Å
171I53.4Low50.6Low117 Ų117105.6 Ų105.660%0.653%0.525SS*.Hα-helixtrans-70.9-45.7173.4-69.1165.9000109.7L167 S168 H169 E173 S174 W175L167-I171 VanDerWaalsContact O-CB 3.29Å; L167-I171 WeakPolarHBondContact O-CB 3.3Å; L167-I171 WeakPolarHBondContact O-CD1 3.29Å; L167-I171 WeakPolarHBondContact O-CG1 3.11Å; L167-I171 PolarHBondContact O-N 3.06Å; S168-I171 PolarHBondContact O-N 2.98Å; H169-I171 PolarHBondContact O-N 2.78Å; I171-E173 VanDerWaalsContact C-N 3.34Å; I171-E173 PolarHBondContact O-N 2.77Å; I171-S174 PolarHBondContact O-N 3.45Å; I171-W175 WeakPolarHBondContact O-CB 3.29Å; I171-W175 PolarHBondContact O-N 2.72Å
172A55.5Low50.9Low26 Ų26104.3 Ų104.322%0.21551%0.512CS..Hα-helixtrans-62.1-40.3176.400000111.8S168 H169 W175 M176S168-A172 WeakPolarHBondContact O-CB 3.32Å; S168-A172 PolarHBondContact O-N 3.39Å; H169-A172 PolarHBondContact O-N 2.96Å; A172-W175 CarbonylContact O-C 3.59Å; A172-W175 PolarHBondContact O-N 2.77Å; A172-M176 VanDerWaalsContact O-CB 3.25Å; A172-M176 WeakPolarHBondContact O-CB 3.21Å; A172-M176 WeakPolarHBondContact O-CG 3.26Å; A172-M176 PolarHBondContact O-N 3.21Å
173E54.9Low51.7Low83 Ų83102.7 Ų102.739%0.38850%0.5SS..Hα-helixtrans-67.1-45.4176.1-175.9177.6-159.600111.3H169 I171 W175 M176 N177H169-E173 IonicContact CE1-OE2 3.96Å; H169-E173 IonicContact ND1-OE2 3.67Å; H169-E173 WeakPolarHBondContact O-CB 3.25Å; H169-E173 PolarHBondContact O-N 2.8Å; I171-E173 VanDerWaalsContact C-N 3.34Å; I171-E173 PolarHBondContact O-N 2.77Å; E173-W175 VanDerWaalsContact C-N 3.31Å; E173-W175 PolarHBondContact O-N 2.94Å; E173-M176 PolarHBondContact O-N 2.74Å; E173-N177 PolarHBondContact O-N 3.37Å; E173-N177 PolarHBondContact O-ND2 3.46Å
174S45.3Very low52.4Low81 Ų81100.8 Ų100.857%0.56649%0.491SS*.Hα-helixtrans-65-35.5173.9-1690000112.3C170 I171 F178C170-S174 VanDerWaalsContact O-CB 3.3Å; C170-S174 WeakPolarHBondContact O-CB 3.4Å; C170-S174 PolarHBondContact O-N 3.47Å; I171-S174 PolarHBondContact O-N 3.45Å; S174-F178 VanDerWaalsContact O-CB 3.29Å; S174-F178 WeakPolarHBondContact O-CB 3.5Å; S174-F178 PolarHBondContact O-N 3.37Å
175W61.8Low52.5Low174 Ų17491.9 Ų91.966%0.65946%0.459SS*.Hα-helixtrans-71.7-38.6176.4-177.8-96.6000111.6I171 A172 E173 F178 S179I171-W175 WeakPolarHBondContact O-CB 3.29Å; I171-W175 PolarHBondContact O-N 2.72Å; A172-W175 CarbonylContact O-C 3.59Å; A172-W175 PolarHBondContact O-N 2.77Å; E173-W175 VanDerWaalsContact C-N 3.31Å; E173-W175 PolarHBondContact O-N 2.94Å; W175-F178 PolarHBondContact O-N 3.46Å; W175-S179 WeakPolarHBondContact O-CB 3.44Å; W175-S179 PolarHBondContact O-N 3.5Å; W175-S179 PolarHBondContact O-OG 2.86Å
176M53Low52.8Low126 Ų12691.3 Ų91.362%0.62146%0.456SS*.Hα-helixtrans-63.1-49.2173.1-80.7174.8171.800110.4A172 E173 F178 S179 L180A172-M176 VanDerWaalsContact O-CB 3.25Å; A172-M176 WeakPolarHBondContact O-CB 3.21Å; A172-M176 WeakPolarHBondContact O-CG 3.26Å; A172-M176 PolarHBondContact O-N 3.21Å; E173-M176 PolarHBondContact O-N 2.74Å; M176-F178 VanDerWaalsContact C-N 3.34Å; M176-F178 PolarHBondContact O-N 2.79Å; M176-S179 WeakPolarHBondContact CA-OG 3.36Å; M176-S179 PolarHBondContact O-N 3.42Å; M176-S179 PolarHBondContact O-OG 3.44Å; M176-L180 VanDerWaalsContact O-CB 3.32Å; M176-L180 WeakPolarHBondContact O-CB 3.39Å; M176-L180 PolarHBondContact O-N 3.42Å
177N54.4Low53Low102 Ų10286.9 Ų86.955%0.54545%0.446SS..Hα-helixtrans-59.8-42.1174.9-78.2-76.6000112.3E173 L180 F181E173-N177 PolarHBondContact O-N 3.37Å; E173-N177 PolarHBondContact O-ND2 3.46Å; N177-L180 PolarHBondContact O-N 3.39Å; N177-F181 WeakPolarHBondContact O-CB 3.45Å; N177-F181 PolarHBondContact O-N 2.94Å
178F44.2Very low53.4Low105 Ų10589 Ų8946%0.46145%0.453SS..Hα-helixtrans-67.1-39.4175.4-177.4-111.9000112.6S174 W175 M176 F181 L182S174-F178 VanDerWaalsContact O-CB 3.29Å; S174-F178 WeakPolarHBondContact O-CB 3.5Å; S174-F178 PolarHBondContact O-N 3.37Å; W175-F178 PolarHBondContact O-N 3.46Å; M176-F178 VanDerWaalsContact C-N 3.34Å; M176-F178 PolarHBondContact O-N 2.79Å; F178-F181 PolarHBondContact O-N 2.85Å; F178-L182 HydrophobicContact CD1-CD1 3.89Å; F178-L182 HydrophobicContact CD1-CG 4.44Å; F178-L182 HydrophobicContact CE1-CD1 3.44Å; F178-L182 VanDerWaalsContact CE1-CD1 3.44Å; F178-L182 HydrophobicContact CE1-CG 4.13Å; F178-L182 HydrophobicContact CE2-CG 4.43Å; F178-L182 HydrophobicContact CZ-CD1 3.83Å; F178-L182 HydrophobicContact CZ-CD2 4.32Å; F178-L182 HydrophobicContact CZ-CG 4.12Å; F178-L182 WeakPolarHBondContact O-CB 3.36Å; F178-L182 WeakPolarHBondContact O-CG 3.4Å; F178-L182 PolarHBondContact O-N 2.92Å
179S47.3Very low53.3Low47 Ų4791.9 Ų91.933%0.32946%0.459SS..Hα-helixtrans-68.6-35.7176.2730000112.2W175 M176 L182 Q183W175-S179 WeakPolarHBondContact O-CB 3.44Å; W175-S179 PolarHBondContact O-N 3.5Å; W175-S179 PolarHBondContact O-OG 2.86Å; M176-S179 WeakPolarHBondContact CA-OG 3.36Å; M176-S179 PolarHBondContact O-N 3.42Å; M176-S179 PolarHBondContact O-OG 3.44Å; S179-L182 PolarHBondContact O-N 2.81Å; S179-Q183 WeakPolarHBondContact O-CB 3.42Å; S179-Q183 PolarHBondContact O-N 3Å
180L63.9Low53.4Low87 Ų8793.3 Ų93.346%0.45547%0.466SS..Hα-helixtrans-66.8-44.5173.8-176.965000110.4M176 N177 L182 Q183 E184M176-L180 VanDerWaalsContact O-CB 3.32Å; M176-L180 WeakPolarHBondContact O-CB 3.39Å; M176-L180 PolarHBondContact O-N 3.42Å; N177-L180 PolarHBondContact O-N 3.39Å; L180-L182 PolarHBondContact O-N 3.09Å; L180-Q183 CarbonylContact O-C 3.58Å; L180-Q183 WeakPolarHBondContact O-CB 3.38Å; L180-Q183 PolarHBondContact O-N 2.87Å; L180-Q183 VanDerWaalsContact O-N 3.16Å; L180-E184 WeakPolarHBondContact O-CG 3.38Å; L180-E184 PolarHBondContact O-N 2.85Å
181F52.1Low53.8Low111 Ų111100.3 Ų100.349%0.48750%0.496SS..Hα-helixtrans-60.8-43.4172.4179-102.1000112.1N177 F178 Q183 E184 M185N177-F181 WeakPolarHBondContact O-CB 3.45Å; N177-F181 PolarHBondContact O-N 2.94Å; F178-F181 PolarHBondContact O-N 2.85Å; F181-Q183 VanDerWaalsContact C-N 3.32Å; F181-Q183 PolarHBondContact O-N 3.47Å; F181-E184 PolarHBondContact O-N 3.49Å; F181-M185 HydrophobicContact CD2-CE 4.33Å; F181-M185 HydrophobicContact CE1-CE 3.78Å; F181-M185 HydrophobicContact CE2-CE 3.56Å; F181-M185 HydrophobicContact CZ-CE 3.25Å; F181-M185 VanDerWaalsContact O-CB 3.26Å; F181-M185 WeakPolarHBondContact O-CB 3.4Å; F181-M185 PolarHBondContact O-N 3.24Å
182L55.8Low53.9Low89 Ų8995.9 Ų95.947%0.46648%0.475SS..Hα-helixtrans-65-34.9173.3-74.4178.9000112.4F178 S179 L180 M185 S186F178-L182 HydrophobicContact CD1-CD1 3.89Å; F178-L182 HydrophobicContact CD1-CG 4.44Å; F178-L182 HydrophobicContact CE1-CD1 3.44Å; F178-L182 VanDerWaalsContact CE1-CD1 3.44Å; F178-L182 HydrophobicContact CE1-CG 4.13Å; F178-L182 HydrophobicContact CE2-CG 4.43Å; F178-L182 HydrophobicContact CZ-CD1 3.83Å; F178-L182 HydrophobicContact CZ-CD2 4.32Å; F178-L182 HydrophobicContact CZ-CG 4.12Å; F178-L182 WeakPolarHBondContact O-CB 3.36Å; F178-L182 WeakPolarHBondContact O-CG 3.4Å; F178-L182 PolarHBondContact O-N 2.92Å; S179-L182 PolarHBondContact O-N 2.81Å; L180-L182 PolarHBondContact O-N 3.09Å; L182-M185 PolarHBondContact O-N 3.46Å; L182-S186 WeakPolarHBondContact O-CB 3.43Å; L182-S186 PolarHBondContact O-N 2.97Å
183Q54.9Low54.4Low111 Ų11199.4 Ų99.452%0.51950%0.496SS..Hα-helixtrans-69.4-44.6177.3-178.8174.2-27.300111S179 L180 F181 S186 L187S179-Q183 WeakPolarHBondContact O-CB 3.42Å; S179-Q183 PolarHBondContact O-N 3Å; L180-Q183 CarbonylContact O-C 3.58Å; L180-Q183 WeakPolarHBondContact O-CB 3.38Å; L180-Q183 PolarHBondContact O-N 2.87Å; L180-Q183 VanDerWaalsContact O-N 3.16Å; F181-Q183 VanDerWaalsContact C-N 3.32Å; F181-Q183 PolarHBondContact O-N 3.47Å; Q183-S186 WeakPolarHBondContact O-CB 3.25Å; Q183-S186 PolarHBondContact O-N 3.34Å; Q183-S186 PolarHBondContact O-OG 3.06Å; Q183-L187 PolarHBondContact O-N 3.24Å
184E55.9Low55Low109 Ų10997.6 Ų97.651%0.50950%0.5SS..Hα-helixtrans-61.9-43.5170.2-72.4-172.9163.700111.6L180 F181 S186 L187 F188L180-E184 WeakPolarHBondContact O-CG 3.38Å; L180-E184 PolarHBondContact O-N 2.85Å; F181-E184 PolarHBondContact O-N 3.49Å; E184-S186 PolarHBondContact O-N 3.29Å; E184-L187 WeakPolarHBondContact O-CB 3.46Å; E184-L187 PolarHBondContact O-N 3.36Å; E184-L187 VanDerWaalsContact O-N 3.09Å; E184-F188 WeakPolarHBondContact O-CD2 3.45Å; E184-F188 PolarHBondContact O-N 2.84Å
185M52.3Low56Low27 Ų27100.6 Ų100.613%0.13350%0.503CS..Hα-helixtrans-64.3-28.2175.4-151.264.266.700112.3F181 L182 K189 F196 L199F181-M185 HydrophobicContact CD2-CE 4.33Å; F181-M185 HydrophobicContact CE1-CE 3.78Å; F181-M185 HydrophobicContact CE2-CE 3.56Å; F181-M185 HydrophobicContact CZ-CE 3.25Å; F181-M185 VanDerWaalsContact O-CB 3.26Å; F181-M185 WeakPolarHBondContact O-CB 3.4Å; F181-M185 PolarHBondContact O-N 3.24Å; L182-M185 PolarHBondContact O-N 3.46Å; M185-K189 PolarHBondContact O-N 3.45Å; M185-K189 VanDerWaalsContact O-N 3.15Å; M185-F196 HydrophobicContact CG-CD2 4.15Å; M185-F196 HydrophobicContact CG-CE2 4.1Å; M185-L199 HydrophobicContact CE-CD1 3.83Å; M185-L199 HydrophobicContact CE-CD2 4.1Å; M185-L199 HydrophobicContact CG-CD2 4.3Å; M185-L199 HydrophobicContact SD-CD1 3.75Å; M185-L199 HydrophobicContact SD-CD2 3.81Å; M185-L199 HydrophobicContact SD-CG 4.39Å
186S52.8Low56.2Low66 Ų6694.9 Ų94.946%0.46248%0.483SS..Hα-helixtrans-74.7-32.6172.9840000112.9L182 Q183 E184 K189 Q190L182-S186 WeakPolarHBondContact O-CB 3.43Å; L182-S186 PolarHBondContact O-N 2.97Å; Q183-S186 WeakPolarHBondContact O-CB 3.25Å; Q183-S186 PolarHBondContact O-N 3.34Å; Q183-S186 PolarHBondContact O-OG 3.06Å; E184-S186 PolarHBondContact O-N 3.29Å; S186-K189 WeakPolarHBondContact O-CB 3.36Å; S186-K189 PolarHBondContact O-N 3.48Å; S186-Q190 PolarHBondContact O-N 3.46Å
187L56.8Low56.9Low98 Ų9892.3 Ų92.351%0.51348%0.476SS..Hα-helixtrans-67.8-42.5170.2-73.3165.3000110.8Q183 E184 K189 Q190 Q191Q183-L187 PolarHBondContact O-N 3.24Å; E184-L187 WeakPolarHBondContact O-CB 3.46Å; E184-L187 PolarHBondContact O-N 3.36Å; E184-L187 VanDerWaalsContact O-N 3.09Å; L187-K189 PolarHBondContact O-N 2.97Å; L187-Q190 WeakPolarHBondContact O-CB 3.22Å; L187-Q190 PolarHBondContact O-N 3.19Å; L187-Q191 PolarHBondContact O-N 3.34Å
188F51.8Low57.7Low108 Ų10893.5 Ų93.547%0.47448%0.482SS..Hα-helixtrans-57-35.4172-93.8-75.6000113.1E184 Q190 Q191 S192E184-F188 WeakPolarHBondContact O-CD2 3.45Å; E184-F188 PolarHBondContact O-N 2.84Å; F188-Q190 PolarHBondContact O-N 3.04Å; F188-Q191 PolarHBondContact O-N 3Å; F188-S192 PolarHBondContact O-N 2.97Å
189K53.7Low58.9Low116 Ų11691.9 Ų91.950%0.50448%0.478SS..Hα-helixtrans-64.5-26.7175.7-165.8179-177.1177.80113.1M185 S186 L187 F196M185-K189 PolarHBondContact O-N 3.45Å; M185-K189 VanDerWaalsContact O-N 3.15Å; S186-K189 WeakPolarHBondContact O-CB 3.36Å; S186-K189 PolarHBondContact O-N 3.48Å; L187-K189 PolarHBondContact O-N 2.97Å; K189-F196 HydrophobicContact CB-CD2 4.02Å; K189-F196 HydrophobicContact CB-CE2 4.46Å; K189-F196 HydrophobicContact CB-CG 4.18Å; K189-F196 HydrophobicContact CD-CD1 4.29Å; K189-F196 HydrophobicContact CD-CD2 4.47Å; K189-F196 HydrophobicContact CD-CE1 4.09Å; K189-F196 HydrophobicContact CD-CE2 4.27Å; K189-F196 HydrophobicContact CD-CG 4.49Å; K189-F196 HydrophobicContact CD-CZ 4.09Å; K189-F196 HydrophobicContact CG-CD1 4.13Å; K189-F196 HydrophobicContact CG-CD2 4.24Å; K189-F196 HydrophobicContact CG-CE1 4.43Å; K189-F196 HydrophobicContact CG-CG 4.04Å
190Q56.2Low60.1Low155 Ų15592.9 Ų92.972%0.72448%0.482SS*.Hα-helixtrans-85.4-23.9177.4-165.1167.61500112.8S186 L187 F188S186-Q190 PolarHBondContact O-N 3.46Å; L187-Q190 WeakPolarHBondContact O-CB 3.22Å; L187-Q190 PolarHBondContact O-N 3.19Å; F188-Q190 PolarHBondContact O-N 3.04Å
191Q53.8Low60Low168 Ų16891.9 Ų91.979%0.78548%0.481SS*.Hα-helixtrans-100.3-25.2-175.2-144.8173.115.900113.9L187 F188L187-Q191 PolarHBondContact O-N 3.34Å; F188-Q191 PolarHBondContact O-N 3Å
192S55.9Low60.6Low24 Ų2490.3 Ų90.317%0.16848%0.484CS..  trans-158.297.5175.354.30000113.1F188 G194 K195 F196F188-S192 PolarHBondContact O-N 2.97Å; S192-G194 VanDerWaalsContact C-N 3.33Å; S192-G194 PolarHBondContact O-N 3.35Å; S192-K195 PolarHBondContact O-N 3.32Å; S192-F196 PolarHBondContact O-N 3.13Å
193P65.6Low61.2Low101 Ų10189.2 Ų89.266%0.65648%0.481SS*.Hα-helixtrans-64.8-33.2-174.624.4-33.6000113.5F196 C197P193-F196 PolarHBondContact O-N 3.22Å; P193-C197 PolarHBondContact O-N 3.17Å
194G68.3Low61.4Low45 Ų4587.5 Ų87.546%0.46448%0.48SS..Hα-helixtrans-64.5-39.6178.500000113.9S192 C197 L198S192-G194 VanDerWaalsContact C-N 3.33Å; S192-G194 PolarHBondContact O-N 3.35Å; G194-C197 WeakPolarHBondContact O-CB 3.2Å; G194-C197 PolarHBondContact O-N 2.82Å; G194-L198 WeakPolarHBondContact O-CG 3.17Å; G194-L198 PolarHBondContact O-N 3.42Å
195K64.8Low61.9Low143 Ų14386 Ų8662%0.62248%0.478SS*.Hα-helixtrans-69.4-37.3179.2-63.6-176.2-173.9169.50111.8S192 L198 L199S192-K195 PolarHBondContact O-N 3.32Å; K195-L198 PolarHBondContact O-N 2.96Å; K195-L199 WeakPolarHBondContact O-CB 3.39Å; K195-L199 PolarHBondContact O-N 3.06Å
196F67.7Low62.7Low55 Ų5590.1 Ų90.124%0.24150%0.496CS..Hα-helixtrans-62.3-43.7172.1179.6-92.4000111.4M185 K189 S192 P193 L199 V200M185-F196 HydrophobicContact CG-CD2 4.15Å; M185-F196 HydrophobicContact CG-CE2 4.1Å; K189-F196 HydrophobicContact CB-CD2 4.02Å; K189-F196 HydrophobicContact CB-CE2 4.46Å; K189-F196 HydrophobicContact CB-CG 4.18Å; K189-F196 HydrophobicContact CD-CD1 4.29Å; K189-F196 HydrophobicContact CD-CD2 4.47Å; K189-F196 HydrophobicContact CD-CE1 4.09Å; K189-F196 HydrophobicContact CD-CE2 4.27Å; K189-F196 HydrophobicContact CD-CG 4.49Å; K189-F196 HydrophobicContact CD-CZ 4.09Å; K189-F196 HydrophobicContact CG-CD1 4.13Å; K189-F196 HydrophobicContact CG-CD2 4.24Å; K189-F196 HydrophobicContact CG-CE1 4.43Å; K189-F196 HydrophobicContact CG-CG 4.04Å; S192-F196 PolarHBondContact O-N 3.13Å; P193-F196 PolarHBondContact O-N 3.22Å; F196-L199 PolarHBondContact O-N 2.77Å; F196-V200 HydrophobicContact CD1-CG2 4.23Å; F196-V200 HydrophobicContact CE1-CG2 3.76Å; F196-V200 HydrophobicContact CE2-CG2 4.23Å; F196-V200 HydrophobicContact CZ-CG2 3.76Å; F196-V200 WeakPolarHBondContact O-CG2 3.3Å; F196-V200 PolarHBondContact O-N 2.79Å
197C66.3Low63.2Low71 Ų7192.7 Ų92.748%0.4850%0.499SS..Hα-helixtrans-59.4-50.6175.3-170.20000111.7P193 G194 L199 V200 C201P193-C197 PolarHBondContact O-N 3.17Å; G194-C197 WeakPolarHBondContact O-CB 3.2Å; G194-C197 PolarHBondContact O-N 2.82Å; C197-L199 VanDerWaalsContact C-N 3.31Å; C197-L199 PolarHBondContact O-N 3.48Å; C197-V200 PolarHBondContact O-N 3.23Å; C197-C201 WeakPolarHBondContact O-CB 3.2Å; C197-C201 PolarHBondContact O-N 3.31Å; C197-C201 PolarHBondContact O-SG 3.05Å; C197-C201 VanDerWaalsContact O-SG 3.36Å
198L71.3Confident63.8Low128 Ų12892.4 Ų92.467%0.6750%0.501SS*.Hα-helixtrans-59.9-37.9177.5-70.8173.5000112.8G194 K195 S202G194-L198 WeakPolarHBondContact O-CG 3.17Å; G194-L198 PolarHBondContact O-N 3.42Å; K195-L198 PolarHBondContact O-N 2.96Å; L198-S202 WeakPolarHBondContact O-CB 3.48Å; L198-S202 PolarHBondContact O-N 2.81Å
199L69.9Low64.5Low71 Ų7191.8 Ų91.837%0.37250%0.502SS..Hα-helixtrans-67.2-45.2176.3-176.5138.8000111.9M185 K195 F196 C197 S202 V203M185-L199 HydrophobicContact CE-CD1 3.83Å; M185-L199 HydrophobicContact CE-CD2 4.1Å; M185-L199 HydrophobicContact CG-CD2 4.3Å; M185-L199 HydrophobicContact SD-CD1 3.75Å; M185-L199 HydrophobicContact SD-CD2 3.81Å; M185-L199 HydrophobicContact SD-CG 4.39Å; K195-L199 WeakPolarHBondContact O-CB 3.39Å; K195-L199 PolarHBondContact O-N 3.06Å; F196-L199 PolarHBondContact O-N 2.77Å; C197-L199 VanDerWaalsContact C-N 3.31Å; C197-L199 PolarHBondContact O-N 3.48Å; L199-S202 PolarHBondContact O-N 3.32Å; L199-V203 WeakPolarHBondContact O-CB 3.31Å; L199-V203 VanDerWaalsContact O-CG2 3.3Å; L199-V203 WeakPolarHBondContact O-CG2 3.28Å; L199-V203 PolarHBondContact O-N 2.92Å
200V72.2Confident65Low68 Ų6888.4 Ų88.441%0.41249%0.489SS..Hα-helixtrans-64.6-43.3176.21730000111.3F196 C197 V203 C204F196-V200 HydrophobicContact CD1-CG2 4.23Å; F196-V200 HydrophobicContact CE1-CG2 3.76Å; F196-V200 HydrophobicContact CE2-CG2 4.23Å; F196-V200 HydrophobicContact CZ-CG2 3.76Å; F196-V200 WeakPolarHBondContact O-CG2 3.3Å; F196-V200 PolarHBondContact O-N 2.79Å; C197-V200 PolarHBondContact O-N 3.23Å; V200-V203 PolarHBondContact O-N 2.87Å; V200-C204 WeakPolarHBondContact O-CB 3.46Å; V200-C204 PolarHBondContact O-N 3.44Å
201C62.6Low65.3Low65 Ų6583.1 Ų83.144%0.43948%0.476SS..Hα-helixtrans-64.8-38.4175.8-71.50000112.4C197 T205C197-C201 WeakPolarHBondContact O-CB 3.2Å; C197-C201 PolarHBondContact O-N 3.31Å; C197-C201 PolarHBondContact O-SG 3.05Å; C197-C201 VanDerWaalsContact O-SG 3.36Å; C201-T205 VanDerWaalsContact O-CB 3.22Å; C201-T205 WeakPolarHBondContact O-CB 3.26Å; C201-T205 PolarHBondContact O-N 3.47Å; C201-T205 PolarHBondContact O-OG1 3.45Å
202S64.9Low65.9Low78 Ų7879.8 Ų79.855%0.54547%0.471SS..Hα-helixtrans-63.1-49.3174.6178.50000111.3L198 L199 C204 T205 F206L198-S202 WeakPolarHBondContact O-CB 3.48Å; L198-S202 PolarHBondContact O-N 2.81Å; L199-S202 PolarHBondContact O-N 3.32Å; S202-C204 PolarHBondContact O-N 2.83Å; S202-T205 PolarHBondContact O-N 2.85Å; S202-F206 WeakPolarHBondContact O-CB 3.18Å; S202-F206 PolarHBondContact O-N 3.39Å
203V67.7Low66.1Low67 Ų6787.8 Ų87.841%0.40650%0.499SS..Hα-helixtrans-62.2-43176.9171.30000111.5L199 V200 F206 F207L199-V203 WeakPolarHBondContact O-CB 3.31Å; L199-V203 VanDerWaalsContact O-CG2 3.3Å; L199-V203 WeakPolarHBondContact O-CG2 3.28Å; L199-V203 PolarHBondContact O-N 2.92Å; V200-V203 PolarHBondContact O-N 2.87Å; V203-F206 PolarHBondContact O-N 2.81Å; V203-F207 HydrophobicContact CG1-CD2 3.75Å; V203-F207 HydrophobicContact CG1-CE2 3.47Å; V203-F207 VanDerWaalsContact CG1-CE2 3.47Å; V203-F207 WeakPolarHBondContact O-CD2 2.99Å; V203-F207 PolarHBondContact O-N 2.82Å
204C59.6Low66.1Low75 Ų7585.1 Ų85.151%0.50748%0.479SS..Hα-helixtrans-63.7-45.8176.7-171.20000112.1V200 S202 F206 F207 T208V200-C204 WeakPolarHBondContact O-CB 3.46Å; V200-C204 PolarHBondContact O-N 3.44Å; S202-C204 PolarHBondContact O-N 2.83Å; C204-F206 VanDerWaalsContact C-N 3.35Å; C204-F206 PolarHBondContact O-N 3.38Å; C204-F207 PolarHBondContact O-N 2.86Å; C204-T208 WeakPolarHBondContact O-CB 3.3Å; C204-T208 PolarHBondContact O-N 2.85Å; C204-T208 PolarHBondContact O-OG1 3.45Å
205T66.8Low66Low76 Ų7686.9 Ų86.947%0.46648%0.482SS..Hα-helixtrans-62.6-42176.5-56.90000111C201 S202 T208 I209C201-T205 VanDerWaalsContact O-CB 3.22Å; C201-T205 WeakPolarHBondContact O-CB 3.26Å; C201-T205 PolarHBondContact O-N 3.47Å; C201-T205 PolarHBondContact O-OG1 3.45Å; S202-T205 PolarHBondContact O-N 2.85Å; T205-T208 WeakPolarHBondContact O-CB 3.36Å; T205-T208 PolarHBondContact O-N 3.33Å; T205-I209 HydrophobicContact CG2-CD1 3.79Å; T205-I209 HydrophobicContact CG2-CG1 4.38Å; T205-I209 VanDerWaalsContact O-CG1 3.31Å; T205-I209 WeakPolarHBondContact O-CG1 3.41Å; T205-I209 PolarHBondContact O-N 2.82Å
206F68Low66Low114 Ų11481.9 Ų81.950%0.547%0.471SS..Hα-helixtrans-59.4-48.2175.1176-99.9000112.1S202 V203 C204 T208 I209 L210S202-F206 WeakPolarHBondContact O-CB 3.18Å; S202-F206 PolarHBondContact O-N 3.39Å; V203-F206 PolarHBondContact O-N 2.81Å; C204-F206 VanDerWaalsContact C-N 3.35Å; C204-F206 PolarHBondContact O-N 3.38Å; F206-T208 VanDerWaalsContact C-N 3.31Å; F206-T208 PolarHBondContact O-N 3.11Å; F206-I209 PolarHBondContact O-N 3.2Å; F206-L210 HydrophobicContact CD1-CD1 4.49Å; F206-L210 HydrophobicContact CD1-CD2 4.37Å; F206-L210 HydrophobicContact CD2-CD1 4.05Å; F206-L210 HydrophobicContact CE1-CD1 4.08Å; F206-L210 HydrophobicContact CE1-CD2 3.6Å; F206-L210 HydrophobicContact CE1-CG 4.46Å; F206-L210 HydrophobicContact CE2-CD1 3.58Å; F206-L210 HydrophobicContact CE2-CD2 4.5Å; F206-L210 HydrophobicContact CG-CD1 4.48Å; F206-L210 HydrophobicContact CZ-CD1 3.6Å; F206-L210 HydrophobicContact CZ-CD2 3.67Å; F206-L210 HydrophobicContact CZ-CG 4.31Å; F206-L210 WeakPolarHBondContact O-CB 3.22Å; F206-L210 PolarHBondContact O-N 3.25Å
207F63.1Low65.6Low121 Ų12181.7 Ų81.753%0.53147%0.474SS..Hα-helixtrans-65.3-33.1175.4-74.9-57.2000113.1V203 C204 G211V203-F207 HydrophobicContact CG1-CD2 3.75Å; V203-F207 HydrophobicContact CG1-CE2 3.47Å; V203-F207 VanDerWaalsContact CG1-CE2 3.47Å; V203-F207 WeakPolarHBondContact O-CD2 2.99Å; V203-F207 PolarHBondContact O-N 2.82Å; C204-F207 PolarHBondContact O-N 2.86Å; F207-G211 PolarHBondContact O-N 3.4Å
208T68.8Low65.3Low91 Ų9182.1 Ų82.156%0.55847%0.471SS*.Hα-helixtrans-65.9-46.2174.9-57.30000110.9C204 T205 F206 G211 S212C204-T208 WeakPolarHBondContact O-CB 3.3Å; C204-T208 PolarHBondContact O-N 2.85Å; C204-T208 PolarHBondContact O-OG1 3.45Å; T205-T208 WeakPolarHBondContact O-CB 3.36Å; T205-T208 PolarHBondContact O-N 3.33Å; F206-T208 VanDerWaalsContact C-N 3.31Å; F206-T208 PolarHBondContact O-N 3.11Å; T208-G211 PolarHBondContact O-N 3.3Å; T208-S212 PolarHBondContact O-N 3.49Å; T208-S212 PolarHBondContact O-OG 2.87Å
209I68.1Low64.8Low96 Ų9677.8 Ų77.849%0.49245%0.448SS..Hα-helixtrans-63.1-46.6176.1-68.4167.5000110.3T205 F206 G211 S212 Y213T205-I209 HydrophobicContact CG2-CD1 3.79Å; T205-I209 HydrophobicContact CG2-CG1 4.38Å; T205-I209 VanDerWaalsContact O-CG1 3.31Å; T205-I209 WeakPolarHBondContact O-CG1 3.41Å; T205-I209 PolarHBondContact O-N 2.82Å; F206-I209 PolarHBondContact O-N 3.2Å; I209-G211 VanDerWaalsContact C-N 3.32Å; I209-G211 PolarHBondContact O-N 2.8Å; I209-S212 WeakPolarHBondContact CA-OG 3.14Å; I209-S212 PolarHBondContact O-N 2.77Å; I209-S212 VanDerWaalsContact O-N 3.14Å; I209-S212 PolarHBondContact O-OG 3.35Å; I209-Y213 WeakPolarHBondContact O-CB 3.39Å; I209-Y213 PolarHBondContact O-N 3.45Å
210L62.9Low64.8Low45 Ų4576.3 Ų76.324%0.23644%0.444CS..Hα-helixtrans-59-41.9174.6-102.462.6000112.3F206 S212 Y213 I214 L219F206-L210 HydrophobicContact CD1-CD1 4.49Å; F206-L210 HydrophobicContact CD1-CD2 4.37Å; F206-L210 HydrophobicContact CD2-CD1 4.05Å; F206-L210 HydrophobicContact CE1-CD1 4.08Å; F206-L210 HydrophobicContact CE1-CD2 3.6Å; F206-L210 HydrophobicContact CE1-CG 4.46Å; F206-L210 HydrophobicContact CE2-CD1 3.58Å; F206-L210 HydrophobicContact CE2-CD2 4.5Å; F206-L210 HydrophobicContact CG-CD1 4.48Å; F206-L210 HydrophobicContact CZ-CD1 3.6Å; F206-L210 HydrophobicContact CZ-CD2 3.67Å; F206-L210 HydrophobicContact CZ-CG 4.31Å; F206-L210 WeakPolarHBondContact O-CB 3.22Å; F206-L210 PolarHBondContact O-N 3.25Å; L210-S212 VanDerWaalsContact C-N 3.31Å; L210-S212 PolarHBondContact O-N 2.9Å; L210-Y213 PolarHBondContact O-N 2.96Å; L210-I214 WeakPolarHBondContact O-CB 3.28Å; L210-I214 PolarHBondContact O-N 2.86Å; L210-L219 HydrophobicContact CB-CD1 4.26Å; L210-L219 HydrophobicContact CD2-CD1 4.31Å; L210-L219 HydrophobicContact CG-CD1 4.43Å
211G62.8Low64.3Low43 Ų4375.7 Ų75.744%0.44343%0.434SS..Hα-helixtrans-68.8-25.2176.700000114.3F207 T208 I209F207-G211 PolarHBondContact O-N 3.4Å; T208-G211 PolarHBondContact O-N 3.3Å; I209-G211 VanDerWaalsContact C-N 3.32Å; I209-G211 PolarHBondContact O-N 2.8Å
212S65.9Low64Low98 Ų9877 Ų7769%0.68544%0.437SS*.Hα-helixtrans-82.1-33.1170.868.50000113.5T208 I209 L210T208-S212 PolarHBondContact O-N 3.49Å; T208-S212 PolarHBondContact O-OG 2.87Å; I209-S212 WeakPolarHBondContact CA-OG 3.14Å; I209-S212 PolarHBondContact O-N 2.77Å; I209-S212 VanDerWaalsContact O-N 3.14Å; I209-S212 PolarHBondContact O-OG 3.35Å; L210-S212 VanDerWaalsContact C-N 3.31Å; L210-S212 PolarHBondContact O-N 2.9Å
213Y61.8Low63.8Low193 Ų19379.1 Ų79.176%0.75744%0.441SS*.Hα-helixtrans-82.2-30.7-177.4-174.2-116.4000112.3I209 L210I209-Y213 WeakPolarHBondContact O-CB 3.39Å; I209-Y213 PolarHBondContact O-N 3.45Å; L210-Y213 PolarHBondContact O-N 2.96Å
214I64.1Low63.6Low45 Ų4579.5 Ų79.523%0.23144%0.441CS..SBendtrans-128.5123.1-174.8-62176.2000108.5L210 G216 I218 L219L210-I214 WeakPolarHBondContact O-CB 3.28Å; L210-I214 PolarHBondContact O-N 2.86Å; I214-G216 PolarHBondContact O-N 3.24Å; I214-I218 HydrophobicContact CG2-CB 3.53Å; I214-I218 HydrophobicContact CG2-CG2 3.58Å; I214-L219 HydrophobicContact CB-CD1 4.06Å; I214-L219 HydrophobicContact CD1-CD1 4.15Å; I214-L219 HydrophobicContact CG2-CD1 4.01Å
215P67.6Low63.7Low82 Ų8277.8 Ų77.853%0.53243%0.426SS..  trans-46.2126.7170.5-28.733.1000111V217 I218 L219P215-V217 CarbonylContact O-C 3.58Å; P215-V217 PolarHBondContact O-N 3.43Å; P215-I218 HydrophobicContact CB-CD1 4.41Å; P215-I218 HydrophobicContact CG-CD1 4.19Å; P215-I218 WeakPolarHBondContact O-CB 3.5Å; P215-I218 PolarHBondContact O-N 3.26Å; P215-L219 PolarHBondContact O-N 3.38Å
216G63.1Low63.1Low38 Ų3877.4 Ų77.439%0.39243%0.426SS..Hα-helixtrans-54.9-22.8-172.700000115.1I214 L219 S220I214-G216 PolarHBondContact O-N 3.24Å; G216-L219 PolarHBondContact O-N 3.39Å; G216-S220 WeakPolarHBondContact O-CB 3.5Å; G216-S220 PolarHBondContact O-N 2.85Å; G216-S220 PolarHBondContact O-OG 2.89Å
217V60Low62.8Low51 Ų5175 Ų7531%0.30943%0.427SS..Hα-helixtrans-55.6-51.4165.9175.30000112F106 A110 P215 L219 S220 Y221F106-V217 HydrophobicContact CE1-CG1 3.76Å; F106-V217 HydrophobicContact CZ-CG1 3.59Å; F106-V217 WeakPolarHBondContact CZ-O 3.48Å; A110-V217 HydrophobicContact CB-CG1 3.51Å; A110-V217 HydrophobicContact CB-CG2 4.48Å; P215-V217 CarbonylContact O-C 3.58Å; P215-V217 PolarHBondContact O-N 3.43Å; V217-L219 VanDerWaalsContact C-N 3.28Å; V217-L219 PolarHBondContact O-N 3.48Å; V217-S220 PolarHBondContact O-N 3.35Å; V217-S220 PolarHBondContact O-OG 2.87Å; V217-Y221 VanDerWaalsContact O-CB 3.3Å; V217-Y221 WeakPolarHBondContact O-CB 3.28Å; V217-Y221 PolarHBondContact O-N 3.28Å
218I60.9Low62.5Low80 Ų8073.4 Ų73.441%0.4142%0.42SS..Hα-helixtrans-67.5-32.3-179.7-62174000110.5I214 P215 L222I214-I218 HydrophobicContact CG2-CB 3.53Å; I214-I218 HydrophobicContact CG2-CG2 3.58Å; P215-I218 HydrophobicContact CB-CD1 4.41Å; P215-I218 HydrophobicContact CG-CD1 4.19Å; P215-I218 WeakPolarHBondContact O-CB 3.5Å; P215-I218 PolarHBondContact O-N 3.26Å; I218-L222 WeakPolarHBondContact O-CB 3.27Å; I218-L222 PolarHBondContact O-N 2.9Å
219L60.9Low62Low37 Ų3771.5 Ų71.519%0.19441%0.406CS..Hα-helixtrans-68.1-44.1174-138.184.4000111.9L210 I214 P215 G216 V217 L222 L223L210-L219 HydrophobicContact CB-CD1 4.26Å; L210-L219 HydrophobicContact CD2-CD1 4.31Å; L210-L219 HydrophobicContact CG-CD1 4.43Å; I214-L219 HydrophobicContact CB-CD1 4.06Å; I214-L219 HydrophobicContact CD1-CD1 4.15Å; I214-L219 HydrophobicContact CG2-CD1 4.01Å; P215-L219 PolarHBondContact O-N 3.38Å; G216-L219 PolarHBondContact O-N 3.39Å; V217-L219 VanDerWaalsContact C-N 3.28Å; V217-L219 PolarHBondContact O-N 3.48Å; L219-L222 PolarHBondContact O-N 2.92Å; L219-L223 WeakPolarHBondContact O-CG 3.46Å; L219-L223 PolarHBondContact O-N 3.28Å
220S68Low61.2Low39 Ų3970 Ų7027%0.27340%0.404SS..Hα-helixtrans-69.2-34175.766.90000112.2G216 V217 L223 L224G216-S220 WeakPolarHBondContact O-CB 3.5Å; G216-S220 PolarHBondContact O-N 2.85Å; G216-S220 PolarHBondContact O-OG 2.89Å; V217-S220 PolarHBondContact O-N 3.35Å; V217-S220 PolarHBondContact O-OG 2.87Å; S220-L223 PolarHBondContact O-N 2.72Å; S220-L224 VanDerWaalsContact O-CB 3.22Å; S220-L224 WeakPolarHBondContact O-CB 3.28Å; S220-L224 PolarHBondContact O-N 2.89Å
221Y62.8Low60.6Low55 Ų5569.6 Ų69.622%0.21640%0.404CS..Hα-helixtrans-60.5-46.8169.1179.4-108.6000111.6N103 F106 V217 L223 L224 L225N103-Y221 WeakPolarHBondContact OD1-CE2 3.2Å; N103-Y221 PolarHBondContact OD1-OH 2.99Å; F106-Y221 AromaticContact CD1-CD2 3.69Å; F106-Y221 HydrophobicContact CD1-CD2 3.69Å; F106-Y221 HydrophobicContact CD1-CE2 4.44Å; F106-Y221 HydrophobicContact CD1-CG 4.41Å; F106-Y221 AromaticContact CE1-CD2 3.7Å; F106-Y221 HydrophobicContact CE1-CD2 3.7Å; F106-Y221 AromaticContact CE1-CG 3.97Å; F106-Y221 HydrophobicContact CE1-CG 3.97Å; F106-Y221 HydrophobicContact CG-CD2 4.24Å; F106-Y221 HydrophobicContact CZ-CD2 4.24Å; F106-Y221 HydrophobicContact CZ-CG 4.34Å; V217-Y221 VanDerWaalsContact O-CB 3.3Å; V217-Y221 WeakPolarHBondContact O-CB 3.28Å; V217-Y221 PolarHBondContact O-N 3.28Å; Y221-L223 PolarHBondContact O-N 3.2Å; Y221-L224 PolarHBondContact O-N 3Å; Y221-L225 HydrophobicContact CE1-CD2 4.36Å; Y221-L225 WeakPolarHBondContact O-CB 3.15Å; Y221-L225 PolarHBondContact O-N 3.41Å
222L56.2Low60.2Low93 Ų9369.4 Ų69.449%0.48739%0.392SS..Hα-helixtrans-63.8-41.1178.4-176.963.1000111.6I218 L219 L225 C226I218-L222 WeakPolarHBondContact O-CB 3.27Å; I218-L222 PolarHBondContact O-N 2.9Å; L219-L222 PolarHBondContact O-N 2.92Å; L222-L225 PolarHBondContact O-N 3.4Å; L222-C226 WeakPolarHBondContact O-CB 3.33Å; L222-C226 PolarHBondContact O-N 3.35Å; L222-C226 PolarHBondContact O-SG 3.14Å
223L61.3Low59.8Low122 Ų12267.9 Ų67.964%0.63937%0.374SS*.Hα-helixtrans-65.7-43.7174.8-73.4172.8000112.3L219 S220 Y221 C226 A227L219-L223 WeakPolarHBondContact O-CG 3.46Å; L219-L223 PolarHBondContact O-N 3.28Å; S220-L223 PolarHBondContact O-N 2.72Å; Y221-L223 PolarHBondContact O-N 3.2Å; L223-C226 PolarHBondContact O-N 2.86Å; L223-A227 WeakPolarHBondContact O-CB 3.41Å; L223-A227 PolarHBondContact O-N 3.48Å
224L62.9Low59.5Low76 Ų7664.5 Ų64.540%0.39836%0.363SS..Hα-helixtrans-63.5-42.5175.9-174.366.5000111.1F106 S220 Y221 A227 F228F106-L224 HydrophobicContact CD2-CD2 4.17Å; S220-L224 VanDerWaalsContact O-CB 3.22Å; S220-L224 WeakPolarHBondContact O-CB 3.28Å; S220-L224 PolarHBondContact O-N 2.89Å; Y221-L224 PolarHBondContact O-N 3Å; L224-A227 PolarHBondContact O-N 3.43Å; L224-F228 HydrophobicContact CD1-CD2 4.12Å; L224-F228 HydrophobicContact CD1-CE2 3.7Å; L224-F228 HydrophobicContact CD2-CE2 4.37Å; L224-F228 HydrophobicContact CG-CD2 3.95Å; L224-F228 HydrophobicContact CG-CE2 3.81Å; L224-F228 VanDerWaalsContact O-CD2 3.26Å; L224-F228 WeakPolarHBondContact O-CD2 3.46Å; L224-F228 PolarHBondContact O-N 2.89Å
225L60.7Low58.7Low39 Ų3965.3 Ų65.320%0.20437%0.371CS..Hα-helixtrans-60.6-48.1174.5-174.672.9000110.4F99 Y221 L222 A227 F228 L229F99-L225 HydrophobicContact CE2-CD1 3.76Å; F99-L225 HydrophobicContact CZ-CD1 3.72Å; Y221-L225 HydrophobicContact CE1-CD2 4.36Å; Y221-L225 WeakPolarHBondContact O-CB 3.15Å; Y221-L225 PolarHBondContact O-N 3.41Å; L222-L225 PolarHBondContact O-N 3.4Å; L225-A227 VanDerWaalsContact C-N 3.33Å; L225-A227 PolarHBondContact O-N 3.21Å; L225-F228 PolarHBondContact O-N 3.34Å; L225-L229 HydrophobicContact CD1-CD1 3.77Å; L225-L229 HydrophobicContact CG-CD1 4.06Å; L225-L229 HydrophobicContact CG-CD2 4.28Å; L225-L229 VanDerWaalsContact O-CB 3.28Å; L225-L229 WeakPolarHBondContact O-CB 3.41Å; L225-L229 VanDerWaalsContact O-CD1 3.32Å; L225-L229 WeakPolarHBondContact O-CD1 3.3Å; L225-L229 PolarHBondContact O-N 3.02Å
226C54.8Low58.1Low68 Ų6863.3 Ų63.346%0.45936%0.357SS..Hα-helixtrans-60.5-39.6174.1-74.80000112.6L222 L223 L229 C230L222-C226 WeakPolarHBondContact O-CB 3.33Å; L222-C226 PolarHBondContact O-N 3.35Å; L222-C226 PolarHBondContact O-SG 3.14Å; L223-C226 PolarHBondContact O-N 2.86Å; C226-L229 PolarHBondContact O-N 2.82Å; C226-C230 VanDerWaalsContact O-CB 3.28Å; C226-C230 WeakPolarHBondContact O-CB 3.48Å; C226-C230 PolarHBondContact O-N 2.85Å
227A62.4Low57.8Low64 Ų6468.4 Ų68.453%0.52938%0.375SS..Hα-helixtrans-65.8-36.9176.200000112.5L223 L224 L225 P231L223-A227 WeakPolarHBondContact O-CB 3.41Å; L223-A227 PolarHBondContact O-N 3.48Å; L224-A227 PolarHBondContact O-N 3.43Å; L225-A227 VanDerWaalsContact C-N 3.33Å; L225-A227 PolarHBondContact O-N 3.21Å; A227-P231 WeakPolarHBondContact O-CD 3.35Å
228F56.2Low57.6Low87 Ų8770.3 Ų70.338%0.38238%0.382SS..Hα-helixtrans-73.6-37.5171.3-82.4-66.2000112.9L224 L225 P231 L232L224-F228 HydrophobicContact CD1-CD2 4.12Å; L224-F228 HydrophobicContact CD1-CE2 3.7Å; L224-F228 HydrophobicContact CD2-CE2 4.37Å; L224-F228 HydrophobicContact CG-CD2 3.95Å; L224-F228 HydrophobicContact CG-CE2 3.81Å; L224-F228 VanDerWaalsContact O-CD2 3.26Å; L224-F228 WeakPolarHBondContact O-CD2 3.46Å; L224-F228 PolarHBondContact O-N 2.89Å; L225-F228 PolarHBondContact O-N 3.34Å; F228-P231 WeakPolarHBondContact O-CD 3.28Å; F228-L232 VanDerWaalsContact O-CG 3.31Å; F228-L232 WeakPolarHBondContact O-CG 3.35Å
229L57.8Low57.7Low50 Ų5066.7 Ų66.726%0.26237%0.365SS..Hα-helixtrans-75.7-27-178.4-94.958.3000113.2L225 C226 L232 F233L225-L229 HydrophobicContact CD1-CD1 3.77Å; L225-L229 HydrophobicContact CG-CD1 4.06Å; L225-L229 HydrophobicContact CG-CD2 4.28Å; L225-L229 VanDerWaalsContact O-CB 3.28Å; L225-L229 WeakPolarHBondContact O-CB 3.41Å; L225-L229 VanDerWaalsContact O-CD1 3.32Å; L225-L229 WeakPolarHBondContact O-CD1 3.3Å; L225-L229 PolarHBondContact O-N 3.02Å; C226-L229 PolarHBondContact O-N 2.82Å; L229-L232 HydrophobicContact CD1-CD1 4.35Å; L229-L232 CarbonylContact O-C 3.59Å; L229-L232 WeakPolarHBondContact O-CA 3.31Å; L229-L232 WeakPolarHBondContact O-CB 3.14Å; L229-L232 PolarHBondContact O-N 3.48Å; L229-F233 HydrophobicContact CB-CD2 4.01Å; L229-F233 HydrophobicContact CB-CE2 3.68Å; L229-F233 HydrophobicContact CB-CZ 4.47Å; L229-F233 HydrophobicContact CD2-CE2 3.91Å; L229-F233 HydrophobicContact CD2-CZ 4.03Å; L229-F233 HydrophobicContact CG-CE2 4.08Å; L229-F233 HydrophobicContact CG-CZ 4.4Å; L229-F233 WeakPolarHBondContact O-CD2 3.22Å; L229-F233 PolarHBondContact O-N 2.7Å
230C53Low57.7Low66 Ų6669.6 Ų69.645%0.44638%0.377SS..Hα-helixtrans-59.8-48179.3-1730000112.8C226 L232 K234C226-C230 VanDerWaalsContact O-CB 3.28Å; C226-C230 WeakPolarHBondContact O-CB 3.48Å; C226-C230 PolarHBondContact O-N 2.85Å; C230-L232 VanDerWaalsContact C-N 3.28Å; C230-L232 PolarHBondContact O-N 2.87Å; C230-K234 PolarHBondContact O-N 2.86Å
231P50.3Low57.7Low35 Ų3574.9 Ų74.923%0.22740%0.395CS..Hα-helixtrans-50.8-42.6164.2-29.835000114L167 A227 F228 K234 C235L167-P231 HydrophobicContact CD2-CB 3.8Å; L167-P231 HydrophobicContact CD2-CG 4.02Å; A227-P231 WeakPolarHBondContact O-CD 3.35Å; F228-P231 WeakPolarHBondContact O-CD 3.28Å; P231-K234 PolarHBondContact O-N 3.4Å; P231-C235 WeakPolarHBondContact O-CB 3.3Å; P231-C235 PolarHBondContact O-N 2.91Å
232L52.8Low57.7Low39 Ų3975.9 Ų75.920%0.20440%0.404CS..Hα-helixtrans-74.9-35.3-172.5-56.2178.4000113.2W89 F228 L229 C230 G239W89-L232 HydrophobicContact CD2-CD2 3.9Å; W89-L232 HydrophobicContact CG-CD2 4.13Å; W89-L232 HydrophobicContact CH2-CD1 4.17Å; W89-L232 HydrophobicContact CZ2-CD1 3.47Å; W89-L232 VanDerWaalsContact CZ2-CD1 3.47Å; W89-L232 HydrophobicContact CZ2-CD2 3.72Å; W89-L232 HydrophobicContact CZ2-CG 4.17Å; F228-L232 VanDerWaalsContact O-CG 3.31Å; F228-L232 WeakPolarHBondContact O-CG 3.35Å; L229-L232 HydrophobicContact CD1-CD1 4.35Å; L229-L232 CarbonylContact O-C 3.59Å; L229-L232 WeakPolarHBondContact O-CA 3.31Å; L229-L232 WeakPolarHBondContact O-CB 3.14Å; L229-L232 PolarHBondContact O-N 3.48Å; C230-L232 VanDerWaalsContact C-N 3.28Å; C230-L232 PolarHBondContact O-N 2.87Å; L232-G239 WeakPolarHBondContact O-CA 3.28Å
233F57.8Low58Low67 Ų6777.5 Ų77.529%0.29440%0.404SS..Hα-helixtrans-70.4-31.1174.4-70.6-53.6000112.6L229 Q240 I242 I246L229-F233 HydrophobicContact CB-CD2 4.01Å; L229-F233 HydrophobicContact CB-CE2 3.68Å; L229-F233 HydrophobicContact CB-CZ 4.47Å; L229-F233 HydrophobicContact CD2-CE2 3.91Å; L229-F233 HydrophobicContact CD2-CZ 4.03Å; L229-F233 HydrophobicContact CG-CE2 4.08Å; L229-F233 HydrophobicContact CG-CZ 4.4Å; L229-F233 WeakPolarHBondContact O-CD2 3.22Å; L229-F233 PolarHBondContact O-N 2.7Å; F233-Q240 PolarHBondContact O-NE2 3.45Å; F233-I242 HydrophobicContact CE1-CB 4.39Å; F233-I242 HydrophobicContact CE1-CG2 3.89Å; F233-I246 HydrophobicContact CE1-CD1 4.44Å; F233-I246 HydrophobicContact CZ-CD1 4.43Å
234K55.8Low58.4Low121 Ų12174.8 Ų74.853%0.52640%0.396SS..Hα-helixtrans-92.2-36.8-178.9-76.9-70.3-166.280.90114.5C170 C230 P231C170-K234 PolarHBondContact SG-NZ 3.5Å; C230-K234 PolarHBondContact O-N 2.86Å; P231-K234 PolarHBondContact O-N 3.4Å
235C46.6Very low58.9Low62 Ų6278.2 Ų78.242%0.41941%0.407SS..Hα-helixtrans-99.6-3.3-169.1-61.40000115.4P231P231-C235 WeakPolarHBondContact O-CB 3.3Å; P231-C235 PolarHBondContact O-N 2.91Å
236N55.4Low59.4Low41 Ų4180.2 Ų80.222%0.21942%0.417CS..  trans-130.1135.5-176.9-171.3-2.1000110.9I238 G239 Q240N236-I238 PolarHBondContact O-N 2.77Å; N236-I238 WeakPolarHBondContact OD1-CG1 3.33Å; N236-I238 PolarHBondContact OD1-N 3.49Å; N236-G239 VanDerWaalsContact O-CA 3.32Å; N236-G239 WeakPolarHBondContact O-CA 3.45Å; N236-G239 PolarHBondContact O-N 2.85Å; N236-Q240 PolarHBondContact O-N 3.28Å
237D57.8Low60.2Low144 Ų14482.6 Ų82.677%0.7742%0.42SS*.Hα-helixtrans-57.6-30.4174.4-81.3-53.7000112.4G239 Q240 K241D237-G239 PolarHBondContact O-N 3.35Å; D237-Q240 PolarHBondContact O-N 3.46Å; D237-K241 WeakPolarHBondContact O-CB 3.23Å; D237-K241 PolarHBondContact O-N 2.87Å
238I55.8Low60.6Low91 Ų9182.8 Ų82.847%0.46742%0.417SS..Hα-helixtrans-61.4-35.2172.8-54.6177.8000110.4N236 K241 I242N236-I238 PolarHBondContact O-N 2.77Å; N236-I238 WeakPolarHBondContact OD1-CG1 3.33Å; N236-I238 PolarHBondContact OD1-N 3.49Å; I238-K241 CarbonylContact O-C 3.56Å; I238-K241 PolarHBondContact O-N 3.41Å; I238-I242 HydrophobicContact CG2-CD1 3.82Å; I238-I242 HydrophobicContact CG2-CG1 4.34Å; I238-I242 WeakPolarHBondContact O-CB 3.39Å; I238-I242 VanDerWaalsContact O-CG1 3.26Å; I238-I242 WeakPolarHBondContact O-CG1 3.3Å; I238-I242 PolarHBondContact O-N 2.85Å
239G62.2Low61Low4 Ų482.7 Ų82.74%0.04142%0.424CS..Hα-helixtrans-62.2-46.5175.400000112.8L232 N236 D237 K241 I242 Y243L232-G239 WeakPolarHBondContact O-CA 3.28Å; N236-G239 VanDerWaalsContact O-CA 3.32Å; N236-G239 WeakPolarHBondContact O-CA 3.45Å; N236-G239 PolarHBondContact O-N 2.85Å; D237-G239 PolarHBondContact O-N 3.35Å; G239-K241 VanDerWaalsContact C-N 3.34Å; G239-K241 PolarHBondContact O-N 3.47Å; G239-I242 PolarHBondContact O-N 2.95Å; G239-Y243 WeakPolarHBondContact O-CB 3.32Å; G239-Y243 PolarHBondContact O-N 3.37Å
240Q60.8Low61.3Low98 Ų9885.6 Ų85.646%0.45844%0.439SS..Hα-helixtrans-65.4-35.6173.5-69.2-64-31.600112.4F233 N236 D237 Y243 S244F233-Q240 PolarHBondContact O-NE2 3.45Å; N236-Q240 PolarHBondContact O-N 3.28Å; D237-Q240 PolarHBondContact O-N 3.46Å; Q240-Y243 PolarHBondContact O-N 2.85Å; Q240-S244 WeakPolarHBondContact O-CB 3.29Å; Q240-S244 PolarHBondContact O-N 2.95Å; Q240-S244 PolarHBondContact O-OG 2.98Å
241K67.4Low61.9Low151 Ų15187.8 Ų87.866%0.65745%0.445SS*.Hα-helixtrans-70-31.1175.6-160.9168-171.1169.40113.2D237 I238 G239 S244 K245D237-K241 WeakPolarHBondContact O-CB 3.23Å; D237-K241 PolarHBondContact O-N 2.87Å; I238-K241 CarbonylContact O-C 3.56Å; I238-K241 PolarHBondContact O-N 3.41Å; G239-K241 VanDerWaalsContact C-N 3.34Å; G239-K241 PolarHBondContact O-N 3.47Å; K241-S244 WeakPolarHBondContact CA-OG 3.48Å; K241-S244 PolarHBondContact O-OG 3.38Å; K241-K245 WeakPolarHBondContact O-CG 3.47Å; K241-K245 PolarHBondContact O-N 3.31Å
242I63.4Low62.7Low76 Ų7693.6 Ų93.639%0.3947%0.467SS..Hα-helixtrans-78.1-42.7171.7-67.3166.8000110.1F233 I238 G239 S244 K245 I246F233-I242 HydrophobicContact CE1-CB 4.39Å; F233-I242 HydrophobicContact CE1-CG2 3.89Å; I238-I242 HydrophobicContact CG2-CD1 3.82Å; I238-I242 HydrophobicContact CG2-CG1 4.34Å; I238-I242 WeakPolarHBondContact O-CB 3.39Å; I238-I242 VanDerWaalsContact O-CG1 3.26Å; I238-I242 WeakPolarHBondContact O-CG1 3.3Å; I238-I242 PolarHBondContact O-N 2.85Å; G239-I242 PolarHBondContact O-N 2.95Å; I242-S244 PolarHBondContact O-N 3.15Å; I242-K245 CarbonylContact O-C 3.6Å; I242-K245 WeakPolarHBondContact O-CB 3.31Å; I242-K245 PolarHBondContact O-N 2.68Å; I242-K245 VanDerWaalsContact O-N 3.16Å; I242-I246 HydrophobicContact CG2-CD1 3.63Å; I242-I246 HydrophobicContact CG2-CG1 4.13Å; I242-I246 WeakPolarHBondContact O-CG1 3.33Å; I242-I246 PolarHBondContact O-N 2.84Å
243Y62.7Low63.3Low126 Ų12696.1 Ų96.149%0.49448%0.481SS..Hα-helixtrans-60.1-43176.8176.9-109.8000112.1G239 Q240 I246 K247G239-Y243 WeakPolarHBondContact O-CB 3.32Å; G239-Y243 PolarHBondContact O-N 3.37Å; Q240-Y243 PolarHBondContact O-N 2.85Å; Y243-I246 PolarHBondContact O-N 3.13Å; Y243-K247 VanDerWaalsContact O-CB 3.24Å; Y243-K247 WeakPolarHBondContact O-CB 3.32Å; Y243-K247 PolarHBondContact O-N 2.99Å
244S70.3Confident63.7Low66 Ų6698.6 Ų98.646%0.46250%0.497SS..Hα-helixtrans-65.4-37.2174.148.60000112.9Q240 K241 I242 S248Q240-S244 WeakPolarHBondContact O-CB 3.29Å; Q240-S244 PolarHBondContact O-N 2.95Å; Q240-S244 PolarHBondContact O-OG 2.98Å; K241-S244 WeakPolarHBondContact CA-OG 3.48Å; K241-S244 PolarHBondContact O-OG 3.38Å; I242-S244 PolarHBondContact O-N 3.15Å; S244-S248 WeakPolarHBondContact O-CB 3.18Å; S244-S248 PolarHBondContact O-N 3.22Å
245K73Confident63.8Low147 Ų147100.3 Ų100.364%0.63951%0.505SS*.Hα-helixtrans-64.8-46.7170.4-82.6-171.3172.6-167.70112.5K241 I242 S248 V249K241-K245 WeakPolarHBondContact O-CG 3.47Å; K241-K245 PolarHBondContact O-N 3.31Å; I242-K245 CarbonylContact O-C 3.6Å; I242-K245 WeakPolarHBondContact O-CB 3.31Å; I242-K245 PolarHBondContact O-N 2.68Å; I242-K245 VanDerWaalsContact O-N 3.16Å; K245-S248 PolarHBondContact O-N 3.45Å; K245-V249 WeakPolarHBondContact O-CG2 3.37Å; K245-V249 PolarHBondContact O-N 2.83Å
246I70.9Confident64.7Low82 Ų8299.2 Ų99.242%0.42150%0.504SS..Hα-helixtrans-62.2-45.4177.3-69.3172000109.6F233 I242 Y243 S248 V249 L250F233-I246 HydrophobicContact CE1-CD1 4.44Å; F233-I246 HydrophobicContact CZ-CD1 4.43Å; I242-I246 HydrophobicContact CG2-CD1 3.63Å; I242-I246 HydrophobicContact CG2-CG1 4.13Å; I242-I246 WeakPolarHBondContact O-CG1 3.33Å; I242-I246 PolarHBondContact O-N 2.84Å; Y243-I246 PolarHBondContact O-N 3.13Å; I246-S248 VanDerWaalsContact C-N 3.31Å; I246-S248 PolarHBondContact O-N 3.3Å; I246-V249 CarbonylContact O-C 3.57Å; I246-V249 PolarHBondContact O-N 3.47Å; I246-L250 WeakPolarHBondContact O-CB 3.38Å; I246-L250 PolarHBondContact O-N 2.83Å
247K72Confident65.3Low117 Ų117101 Ų10151%0.50951%0.512SS..Hα-helixtrans-59.2-40.4175.1-174.5175.4-179.5-179.70111.9Y243 L250 L251Y243-K247 VanDerWaalsContact O-CB 3.24Å; Y243-K247 WeakPolarHBondContact O-CB 3.32Å; Y243-K247 PolarHBondContact O-N 2.99Å; K247-L250 PolarHBondContact O-N 3.42Å; K247-L251 HydrophobicContact CG-CD1 3.97Å; K247-L251 WeakPolarHBondContact O-CB 3.33Å; K247-L251 VanDerWaalsContact O-CD1 3.24Å; K247-L251 WeakPolarHBondContact O-CD1 3.25Å; K247-L251 PolarHBondContact O-N 2.79Å
248S70.1Confident65.9Low68 Ų6895.5 Ų95.548%0.47649%0.49SS..Hα-helixtrans-67.9-40.5175.1-177.60000112.9S244 K245 I246 K252S244-S248 WeakPolarHBondContact O-CB 3.18Å; S244-S248 PolarHBondContact O-N 3.22Å; K245-S248 PolarHBondContact O-N 3.45Å; I246-S248 VanDerWaalsContact C-N 3.31Å; I246-S248 PolarHBondContact O-N 3.3Å; S248-K252 WeakPolarHBondContact O-CG 3.47Å; S248-K252 PolarHBondContact O-N 2.95Å
249V65.9Low66.8Low85 Ų8597 Ų9752%0.51550%0.495SS..Hα-helixtrans-68.3-38.3174.5170.90000111.1K245 I246 K252 L253K245-V249 WeakPolarHBondContact O-CG2 3.37Å; K245-V249 PolarHBondContact O-N 2.83Å; I246-V249 CarbonylContact O-C 3.57Å; I246-V249 PolarHBondContact O-N 3.47Å; V249-K252 CarbonylContact O-C 3.6Å; V249-K252 WeakPolarHBondContact O-CB 3.28Å; V249-K252 PolarHBondContact O-N 2.82Å; V249-L253 HydrophobicContact CG1-CD1 4.49Å; V249-L253 WeakPolarHBondContact O-CB 3.42Å; V249-L253 PolarHBondContact O-N 2.83Å
250L62.9Low67Low111 Ų111103.4 Ų103.458%0.58152%0.519SS*.Hα-helixtrans-69.8-40.5178.8-161.772.2000110.9I246 K247 K252 L253 D254I246-L250 WeakPolarHBondContact O-CB 3.38Å; I246-L250 PolarHBondContact O-N 2.83Å; K247-L250 PolarHBondContact O-N 3.42Å; L250-K252 VanDerWaalsContact C-N 3.33Å; L250-K252 PolarHBondContact O-N 2.91Å; L250-L253 PolarHBondContact O-N 2.95Å; L250-D254 VanDerWaalsContact O-CB 3.24Å; L250-D254 WeakPolarHBondContact O-CB 3.42Å; L250-D254 PolarHBondContact O-N 2.85Å
251L66.5Low67.6Low112 Ų112103.4 Ų103.459%0.58652%0.521SS*.Hα-helixtrans-61.6-39.3169.2-100.387.3000112.2K247 D254 F255K247-L251 HydrophobicContact CG-CD1 3.97Å; K247-L251 WeakPolarHBondContact O-CB 3.33Å; K247-L251 VanDerWaalsContact O-CD1 3.24Å; K247-L251 WeakPolarHBondContact O-CD1 3.25Å; K247-L251 PolarHBondContact O-N 2.79Å; L251-D254 PolarHBondContact O-N 2.98Å; L251-F255 PolarHBondContact O-N 3.33Å
252K67.4Low67.9Low158 Ų158101 Ų10169%0.68752%0.515SS*.Hα-helixtrans-66.3-37.3174.5-79.5-175.3172.6-170.80112.3S248 V249 L250 G256S248-K252 WeakPolarHBondContact O-CG 3.47Å; S248-K252 PolarHBondContact O-N 2.95Å; V249-K252 CarbonylContact O-C 3.6Å; V249-K252 WeakPolarHBondContact O-CB 3.28Å; V249-K252 PolarHBondContact O-N 2.82Å; L250-K252 VanDerWaalsContact C-N 3.33Å; L250-K252 PolarHBondContact O-N 2.91Å; K252-G256 PolarHBondContact O-N 2.82Å; K252-G256 VanDerWaalsContact O-N 3.14Å
253L64.9Low68.5Low92 Ų92101.6 Ų101.648%0.48252%0.516SS..Hα-helixtrans-68.8-43.4174.5-121.479.5000111.1V249 L250 F255 G256 I257V249-L253 HydrophobicContact CG1-CD1 4.49Å; V249-L253 WeakPolarHBondContact O-CB 3.42Å; V249-L253 PolarHBondContact O-N 2.83Å; L250-L253 PolarHBondContact O-N 2.95Å; L253-F255 VanDerWaalsContact C-N 3.3Å; L253-F255 PolarHBondContact O-N 2.78Å; L253-G256 CarbonylContact O-C 3.51Å; L253-G256 PolarHBondContact O-N 3.44Å; L253-G256 VanDerWaalsContact O-N 3.15Å; L253-I257 HydrophobicContact CB-CD1 4.34Å; L253-I257 HydrophobicContact CD2-CD1 3.79Å; L253-I257 HydrophobicContact CG-CD1 3.92Å; L253-I257 WeakPolarHBondContact O-CB 3.46Å; L253-I257 PolarHBondContact O-N 3.29Å
254D66.3Low69.1Low119 Ų119101.2 Ų101.264%0.63652%0.517SS*.Hα-helixtrans-60.8-40.2179.8-164.640.2000111L250 L251 G258L250-D254 VanDerWaalsContact O-CB 3.24Å; L250-D254 WeakPolarHBondContact O-CB 3.42Å; L250-D254 PolarHBondContact O-N 2.85Å; L251-D254 PolarHBondContact O-N 2.98Å; D254-G258 WeakPolarHBondContact O-CA 3.36Å; D254-G258 PolarHBondContact O-N 3.31Å
255F56.7Low69.3Low157 Ų157105.2 Ų105.269%0.68953%0.526SS*.Hα-helixtrans-63.5-50.3171-157.9-94.9000112L251 L253 I257 G258 E259L251-F255 PolarHBondContact O-N 3.33Å; L253-F255 VanDerWaalsContact C-N 3.3Å; L253-F255 PolarHBondContact O-N 2.78Å; F255-I257 PolarHBondContact O-N 3.48Å; F255-G258 PolarHBondContact O-N 2.91Å; F255-E259 WeakPolarHBondContact O-CB 3.42Å; F255-E259 PolarHBondContact O-N 2.87Å
256G66.9Low69.4Low39 Ų39105.2 Ų105.240%0.40252%0.522SS..Hα-helixtrans-69.4-30.5-179.300000115K252 L253 Y260K252-G256 PolarHBondContact O-N 2.82Å; K252-G256 VanDerWaalsContact O-N 3.14Å; L253-G256 CarbonylContact O-C 3.51Å; L253-G256 PolarHBondContact O-N 3.44Å; L253-G256 VanDerWaalsContact O-N 3.15Å; G256-Y260 VanDerWaalsContact O-CB 3.24Å; G256-Y260 WeakPolarHBondContact O-CB 3.32Å; G256-Y260 PolarHBondContact O-N 3.27Å
257I67.7Low69.6Low78 Ų78105.9 Ų105.940%0.452%0.524SS..Hα-helixtrans-82-35.1176.7-79.2163.5000110.6L253 F255 E259 Y260 I261L253-I257 HydrophobicContact CB-CD1 4.34Å; L253-I257 HydrophobicContact CD2-CD1 3.79Å; L253-I257 HydrophobicContact CG-CD1 3.92Å; L253-I257 WeakPolarHBondContact O-CB 3.46Å; L253-I257 PolarHBondContact O-N 3.29Å; F255-I257 PolarHBondContact O-N 3.48Å; I257-E259 VanDerWaalsContact C-N 3.35Å; I257-Y260 PolarHBondContact O-N 2.92Å; I257-I261 HydrophobicContact CG2-CD1 3.54Å; I257-I261 HydrophobicContact CG2-CG1 4.17Å; I257-I261 VanDerWaalsContact O-CB 3.23Å; I257-I261 WeakPolarHBondContact O-CB 3.21Å; I257-I261 WeakPolarHBondContact O-CG1 3.48Å; I257-I261 PolarHBondContact O-N 3.34Å
258G70.3Confident69.3Low29 Ų29110.2 Ų110.230%0.29954%0.537SS..Hα-helixtrans-58.2-47.9167.300000111.3D254 F255 N262D254-G258 WeakPolarHBondContact O-CA 3.36Å; D254-G258 PolarHBondContact O-N 3.31Å; F255-G258 PolarHBondContact O-N 2.91Å; G258-N262 WeakPolarHBondContact O-CB 3.48Å; G258-N262 PolarHBondContact O-N 2.9Å; G258-N262 PolarHBondContact O-ND2 3.18Å; G258-N262 VanDerWaalsContact O-ND2 3.08Å
259E74.1Confident68.9Low121 Ų121109.5 Ų109.557%0.56553%0.532SS*.Hα-helixtrans-61.1-48.9174.5-149.573-156.900111.4F255 I257 I261 N262 Q263F255-E259 WeakPolarHBondContact O-CB 3.42Å; F255-E259 PolarHBondContact O-N 2.87Å; I257-E259 VanDerWaalsContact C-N 3.35Å; E259-I261 PolarHBondContact O-N 2.95Å; E259-N262 PolarHBondContact O-N 3.35Å; E259-Q263 VanDerWaalsContact O-CB 3.3Å; E259-Q263 WeakPolarHBondContact O-CB 3.41Å; E259-Q263 PolarHBondContact O-N 3.45Å
260Y66.3Low68.9Low139 Ų139109.5 Ų109.555%0.54553%0.526SS..Hα-helixtrans-64.8-38.1179.8179.2-103.2000113.4G256 I257 K264G256-Y260 VanDerWaalsContact O-CB 3.24Å; G256-Y260 WeakPolarHBondContact O-CB 3.32Å; G256-Y260 PolarHBondContact O-N 3.27Å; I257-Y260 PolarHBondContact O-N 2.92Å; Y260-K264 HydrophobicContact CE1-CD 4.22Å; Y260-K264 WeakPolarHBondContact O-CB 3.39Å; Y260-K264 PolarHBondContact O-N 3.41Å
261I74.9Confident68.9Low99 Ų99107 Ų10751%0.50852%0.522SS..Hα-helixtrans-68.6-41.5175.1-71.7169.4000110.1I257 E259 K265I257-I261 HydrophobicContact CG2-CD1 3.54Å; I257-I261 HydrophobicContact CG2-CG1 4.17Å; I257-I261 VanDerWaalsContact O-CB 3.23Å; I257-I261 WeakPolarHBondContact O-CB 3.21Å; I257-I261 WeakPolarHBondContact O-CG1 3.48Å; I257-I261 PolarHBondContact O-N 3.34Å; E259-I261 PolarHBondContact O-N 2.95Å; I261-K265 WeakPolarHBondContact O-CB 3.43Å; I261-K265 PolarHBondContact O-N 3.44Å
262N73.3Confident68.4Low101 Ų101107.3 Ų107.354%0.5452%0.524SS..Hα-helixtrans-66.2-42.2175.8-78.4-39.8000111.8G258 E259 K265 R266G258-N262 WeakPolarHBondContact O-CB 3.48Å; G258-N262 PolarHBondContact O-N 2.9Å; G258-N262 PolarHBondContact O-ND2 3.18Å; G258-N262 VanDerWaalsContact O-ND2 3.08Å; E259-N262 PolarHBondContact O-N 3.35Å; N262-K265 PolarHBondContact O-N 3.47Å; N262-R266 VanDerWaalsContact O-CB 3.27Å; N262-R266 WeakPolarHBondContact O-CB 3.48Å; N262-R266 PolarHBondContact O-N 2.9Å
263Q76.1Confident68Low88 Ų88106.5 Ų106.541%0.41152%0.52SS..Hα-helixtrans-61.6-49.2174.4179.958.624.400111.2E259 K265 R266 E267E259-Q263 VanDerWaalsContact O-CB 3.3Å; E259-Q263 WeakPolarHBondContact O-CB 3.41Å; E259-Q263 PolarHBondContact O-N 3.45Å; Q263-K265 VanDerWaalsContact C-N 3.32Å; Q263-K265 PolarHBondContact O-N 2.93Å; Q263-R266 WeakPolarHBondContact O-CB 3.24Å; Q263-R266 PolarHBondContact O-N 3.47Å; Q263-R266 VanDerWaalsContact O-N 3.12Å; Q263-E267 WeakPolarHBondContact CG-OE1 3.33Å; Q263-E267 PolarHBondContact NE2-OE1 2.94Å; Q263-E267 WeakPolarHBondContact O-CG 3.32Å; Q263-E267 PolarHBondContact O-N 2.91Å
264K75.3Confident67.4Low118 Ų118109.6 Ų109.651%0.51353%0.532SS..Hα-helixtrans-64.9-33.1177-172.3167.9-172.4165.60113Y260 R268Y260-K264 HydrophobicContact CE1-CD 4.22Å; Y260-K264 WeakPolarHBondContact O-CB 3.39Å; Y260-K264 PolarHBondContact O-N 3.41Å; K264-R268 WeakPolarHBondContact O-CB 3.48Å; K264-R268 PolarHBondContact O-N 3.41Å; K264-R268 VanDerWaalsContact O-N 3.09Å
265K74.2Confident66.8Low149 Ų149111.8 Ų111.865%0.64854%0.536SS*.Hα-helixtrans-70-37.8173-176.7-178.4177.6-1740111.3I261 N262 Q263 R268 S269I261-K265 WeakPolarHBondContact O-CB 3.43Å; I261-K265 PolarHBondContact O-N 3.44Å; N262-K265 PolarHBondContact O-N 3.47Å; Q263-K265 VanDerWaalsContact C-N 3.32Å; Q263-K265 PolarHBondContact O-N 2.93Å; K265-R268 PolarHBondContact O-N 3.28Å; K265-S269 PolarHBondContact O-N 3.49Å
266R75.3Confident66.5Low147 Ų147107.3 Ų107.356%0.55553%0.525SS*.Hα-helixtrans-65-52.3175.2-179.5177.9-178.1166.74.7111.1N262 Q263 R268 S269 E270N262-R266 VanDerWaalsContact O-CB 3.27Å; N262-R266 WeakPolarHBondContact O-CB 3.48Å; N262-R266 PolarHBondContact O-N 2.9Å; Q263-R266 WeakPolarHBondContact O-CB 3.24Å; Q263-R266 PolarHBondContact O-N 3.47Å; Q263-R266 VanDerWaalsContact O-N 3.12Å; R266-R268 VanDerWaalsContact C-N 3.25Å; R266-R268 PolarHBondContact O-N 2.94Å; R266-S269 CarbonylContact O-C 3.53Å; R266-S269 WeakPolarHBondContact O-CA 3.47Å; R266-S269 PolarHBondContact O-N 2.72Å; R266-S269 PolarHBondContact O-OG 2.87Å; R266-E270 HydrophobicContact CG-CG 4.43Å; R266-E270 WeakPolarHBondContact CG-OE1 3.48Å; R266-E270 IonicContact CZ-OE1 3.52Å; R266-E270 IonicContact NE-OE1 2.77Å; R266-E270 PolarHBondContact NE-OE1 2.81Å; R266-E270 IonicContact NH2-OE1 3.37Å; R266-E270 PolarHBondContact NH2-OE1 2.83Å; R266-E270 WeakPolarHBondContact O-CG 3.26Å; R266-E270 PolarHBondContact O-N 2.89Å
267E74.9Confident65.4Low96 Ų96113.2 Ų113.245%0.44954%0.541SS..Hα-helixtrans-53.6-42.9174.1-72.4164.8-173.300111.4Q263 S269 E270 A271Q263-E267 WeakPolarHBondContact CG-OE1 3.33Å; Q263-E267 PolarHBondContact NE2-OE1 2.94Å; Q263-E267 WeakPolarHBondContact O-CG 3.32Å; Q263-E267 PolarHBondContact O-N 2.91Å; E267-S269 VanDerWaalsContact C-N 3.32Å; E267-S269 PolarHBondContact O-N 2.79Å; E267-E270 PolarHBondContact O-N 2.86Å; E267-A271 WeakPolarHBondContact O-CB 3.45Å; E267-A271 PolarHBondContact O-N 3.44Å
268R65.4Low64.2Low208 Ų208118.5 Ų118.579%0.78556%0.561SS**Hα-helixtrans-65.6-32.7175.8-151.2-179-150.8-164.85.4113.1K264 K265 R266 D272K264-R268 WeakPolarHBondContact O-CB 3.48Å; K264-R268 PolarHBondContact O-N 3.41Å; K264-R268 VanDerWaalsContact O-N 3.09Å; K265-R268 PolarHBondContact O-N 3.28Å; R266-R268 VanDerWaalsContact C-N 3.25Å; R266-R268 PolarHBondContact O-N 2.94Å; R268-D272 PolarHBondContact O-N 3.25Å
269S61.9Low62.9Low53 Ų53123.9 Ų123.937%0.37158%0.583SS.*Hα-helixtrans-80.3-23.1175.6740000113.9K265 R266 E267 K273K265-S269 PolarHBondContact O-N 3.49Å; R266-S269 CarbonylContact O-C 3.53Å; R266-S269 WeakPolarHBondContact O-CA 3.47Å; R266-S269 PolarHBondContact O-N 2.72Å; R266-S269 PolarHBondContact O-OG 2.87Å; E267-S269 VanDerWaalsContact C-N 3.32Å; E267-S269 PolarHBondContact O-N 2.79Å; S269-K273 WeakPolarHBondContact O-CG 3.39Å; S269-K273 PolarHBondContact O-N 3.26Å
270E66Low61.3Low85 Ų85124.4 Ų124.440%0.39759%0.59SS.*Hα-helixtrans-80.6-39.4174.8-73.2170176.800109.8R266 E267 D272 K273 E274R266-E270 HydrophobicContact CG-CG 4.43Å; R266-E270 WeakPolarHBondContact CG-OE1 3.48Å; R266-E270 IonicContact CZ-OE1 3.52Å; R266-E270 IonicContact NE-OE1 2.77Å; R266-E270 PolarHBondContact NE-OE1 2.81Å; R266-E270 IonicContact NH2-OE1 3.37Å; R266-E270 PolarHBondContact NH2-OE1 2.83Å; R266-E270 WeakPolarHBondContact O-CG 3.26Å; R266-E270 PolarHBondContact O-N 2.89Å; E267-E270 PolarHBondContact O-N 2.86Å; E270-D272 VanDerWaalsContact C-N 3.32Å; E270-D272 PolarHBondContact O-N 3.19Å; E270-K273 PolarHBondContact O-N 3.15Å; E270-E274 WeakPolarHBondContact O-CB 3.48Å; E270-E274 PolarHBondContact O-N 3.37Å
271A61.8Low60.4Low59 Ų59122.5 Ų122.549%0.48860%0.597SS.*Hα-helixtrans-62.9-32.7170.300000113.7E267 K275E267-A271 WeakPolarHBondContact O-CB 3.45Å; E267-A271 PolarHBondContact O-N 3.44Å; A271-K275 WeakPolarHBondContact O-CB 3.34Å; A271-K275 PolarHBondContact O-N 3.28Å; A271-K275 VanDerWaalsContact O-N 3.14Å
272D57.7Low59.1Low119 Ų119126.4 Ų126.464%0.63661%0.613SS**Hα-helixtrans-71.4-36.4176.1-147.334.5000111.5R268 E270 K275 S276R268-D272 PolarHBondContact O-N 3.25Å; E270-D272 VanDerWaalsContact C-N 3.32Å; E270-D272 PolarHBondContact O-N 3.19Å; D272-K275 PolarHBondContact O-N 2.98Å; D272-S276 PolarHBondContact O-N 3.32Å
273K57.5Low57.5Low140 Ų140129.6 Ų129.661%0.60963%0.629SS**Hα-helixtrans-74.2-35.8174.1-73.6174.7179.4-179.20113.6S269 E270 K275 S276 H277S269-K273 WeakPolarHBondContact O-CG 3.39Å; S269-K273 PolarHBondContact O-N 3.26Å; E270-K273 PolarHBondContact O-N 3.15Å; K273-K275 PolarHBondContact O-N 2.8Å; K273-S276 PolarHBondContact O-N 3.49Å; K273-S276 PolarHBondContact O-OG 3.31Å; K273-S276 VanDerWaalsContact O-OG 3.14Å; K273-H277 WeakPolarHBondContact O-CB 3.33Å; K273-H277 PolarHBondContact O-N 3.45Å
274E53.3Low56.1Low157 Ų157132.7 Ų132.773%0.73465%0.649SS**Hα-helixtrans-65.7-32.5173.4-171.8174.3-178.400110.9E270E270-E274 WeakPolarHBondContact O-CB 3.48Å; E270-E274 PolarHBondContact O-N 3.37Å
275K53.5Low54.7Low166 Ų166136.1 Ų136.172%0.72266%0.664SS**Hα-helixtrans-72.6-35171.8-158.3178.4-178.3-169.50112.9A271 D272 K273A271-K275 WeakPolarHBondContact O-CB 3.34Å; A271-K275 PolarHBondContact O-N 3.28Å; A271-K275 VanDerWaalsContact O-N 3.14Å; D272-K275 PolarHBondContact O-N 2.98Å; K273-K275 PolarHBondContact O-N 2.8Å
276S50.1Low53.2Low63 Ų63134.7 Ų134.744%0.44167%0.673SS.*Hα-helixtrans-74.4-39177.279.30000113.3D272 K273 K278 D279D272-S276 PolarHBondContact O-N 3.32Å; K273-S276 PolarHBondContact O-N 3.49Å; K273-S276 PolarHBondContact O-OG 3.31Å; K273-S276 VanDerWaalsContact O-OG 3.14Å; S276-K278 PolarHBondContact O-N 3.1Å; S276-D279 PolarHBondContact O-N 3.5Å
277H43.7Very low52Low162 Ų162132.5 Ų132.575%0.7569%0.686SS**THydrogen-bonded Turntrans-66.6-1.2-178.2-162.9-60.3000113.6K273K273-H277 WeakPolarHBondContact O-CB 3.33Å; K273-H277 PolarHBondContact O-N 3.45Å
278K43.1Very low50.5Low189 Ų189135.8 Ų135.882%0.82271%0.706SS**THydrogen-bonded Turntrans-109.2-1176-155.8153.8-173.8168.20114.3S276S276-K278 PolarHBondContact O-N 3.1Å
279D42.6Very low49.3Very low142 Ų142131.8 Ų131.876%0.75971%0.708SS**SBendtrans-125.815.3-177.1-119.62.4000112.5S276 S281S276-D279 PolarHBondContact O-N 3.5Å; D279-S281 VanDerWaalsContact C-N 3.32Å; D279-S281 PolarHBondContact O-N 3.25Å; D279-S281 VanDerWaalsContact O-N 3.12Å
280D41.1Very low48.2Very low133 Ų133135.6 Ų135.671%0.71173%0.732SS**  trans-84.674.5171.1-76.3-43.1000110.5
281S47.7Very low46.9Very low99 Ų99141 Ų14169%0.69275%0.754SS**  trans-140144.2154.7-74.80000108.7D279D279-S281 VanDerWaalsContact C-N 3.32Å; D279-S281 PolarHBondContact O-N 3.25Å; D279-S281 VanDerWaalsContact O-N 3.12Å
282E46.2Very low46.1Very low180 Ų180146 Ų14684%0.84177%0.771SS**SBendtrans5192.7171.557.2-164.1160.900117.5
283L39.3Very low45Very low168 Ų168143.8 Ų143.888%0.8876%0.764SS**  -175.2132.3100-91.1169.3000112.7
284D47.5Very low44.4Very low153 Ų153145 Ų14582%0.81878%0.777SS**  trans-99.986.3-170.3-1665.8000111.4
285F46.3Very low44.2Very low191 Ų191143.1 Ų143.184%0.83878%0.776SS**  trans-146.580178.8-100.7-78.8000113.6
286S42.3Very low43.8Very low119 Ų119140.6 Ų140.683%0.83278%0.775SS**  trans-158.238.3156.6-87.40000113.7L288S286-L288 PolarHBondContact O-N 3.22Å
287A51.1Low43.6Very low101 Ų101141.9 Ų141.984%0.83579%0.789SS**  trans-7771.5163.700000110.7
288L43Very low43.8Very low164 Ų164138.7 Ų138.786%0.85979%0.791SS**  trans-175.276.6163.8-104.8163.2000112.8S286S286-L288 PolarHBondContact O-N 3.22Å
289C39.2Very low44.2Very low124 Ų124138.1 Ų138.184%0.83879%0.788SS**  trans-166.5124.5150-102.30000110.9
290P38.4Very low44.7Very low134 Ų134139 Ų13987%0.8779%0.787SS**  trans-76.3149.1-17830.1-33.5000113
291K39.8Very low44.8Very low197 Ų197140.8 Ų140.886%0.85780%0.796SS**  trans-112.5112-170.7-177174-170.1165.20110.7
292I45.3Very low44.2Very low166 Ų166141.9 Ų141.985%0.85180%0.804SS**  trans169.5152.4155.842152.8000109.4
293S34.2Very low43.8Very low71 Ų71140.3 Ų140.350%0.49781%0.806SS.*  cis-171.7113.4-31.348.80000108T295S293-T295 PolarHBondContact O-N 3.24Å
294L44.1Very low43.7Very low167 Ų167137.6 Ų137.687%0.87480%0.802SS**THydrogen-bonded Turntrans-79.739.5-173.7-161.373.3000113.8
295T48.9Very low43.4Very low116 Ų116138.1 Ų138.171%0.71280%0.804SS**THydrogen-bonded Turntrans-119.97.3-175.1420000113.8S293S293-T295 PolarHBondContact O-N 3.24Å
296V46.9Very low43.2Very low114 Ų114134.6 Ų134.669%0.69180%0.799SS**SBendtrans-105.3-23.3174.7178.90000112.3A298V296-A298 PolarHBondContact O-N 3.45Å
297A45.5Very low43Very low90 Ų90135.8 Ų135.874%0.74480%0.796SS**THydrogen-bonded Turntrans-83-4-174.400000115.7
298A47.9Very low42.2Very low95 Ų95136.8 Ų136.879%0.78579%0.791SS**THydrogen-bonded Turntrans-118.119.2-179.600000112.9V296V296-A298 PolarHBondContact O-N 3.45Å
299K50.3Low42Very low177 Ų177134.7 Ų134.777%0.7779%0.79SS**SBendtrans-115.427178.3-157.4-167.9163.360.80112.3
300E54.6Low42.2Very low159 Ų159136.4 Ų136.474%0.74379%0.786SS**SBendtrans-133.9145.7165.6-71.5-64.8155.200105.6
301L41.9Very low42.4Very low172 Ų172135.8 Ų135.890%0.90178%0.779SS**SBendtrans73.673.7-176.5-46.2175.2000117
302S35.7Very low42.6Very low121 Ų121131 Ų13185%0.84677%0.77SS**  167.498.7115.2-1700000111.1
303V37.7Very low42.8Very low147 Ų147134.5 Ų134.589%0.89177%0.773SS**  trans-135.7119.6166.9170.90000107
304S38.2Very low43.1Very low112 Ų112136.2 Ų136.278%0.78378%0.781SS**  trans-168.8108.1151.4-142.30000109.5
305D39.7Very low42.5Very low164 Ų164135 Ų13588%0.87778%0.775SS**  trans-156.9147.4142.7-118.6-21.4000110
306T42Very low42Very low117 Ų117136 Ų13672%0.71878%0.776SS**  trans-98.4129.9-153.425.90000116.2
307D37.9Very low41.7Very low144 Ų144134.3 Ų134.377%0.7778%0.782SS**  trans48.8132.2132-80.3-43.5000124.8
308V35Very low41.2Very low122 Ų122136.4 Ų136.474%0.73979%0.786SS**  trans72.2110142.6179.30000120
309S38.1Very low40.6Very low119 Ų119141 Ų14183%0.83279%0.789SS**  -156.2141.7116.9-167.50000111.7
310E43.2Very low40Very low160 Ų160137.1 Ų137.175%0.74878%0.776SS**  trans-97.2155.9-179.963.4-142.6124.200112.6
311V44.1Very low39.2Very low122 Ų122136.6 Ų136.674%0.73978%0.777SS**  trans166.7128138.6150.90000109.4
312S43.5Very low39.2Very low95 Ų95133.9 Ų133.966%0.66477%0.773SS**  trans-95.6141167.975.20000110.9
313W49.5Very low39.6Very low241 Ų241137 Ų13791%0.91377%0.774SS**  trans-127.1110.5148.8-7798.7000109.2
314T40Very low39.6Very low107 Ų107133.4 Ų133.466%0.65677%0.766SS**  trans-77157.9170.151.80000110.8
315D32.6Very low39.6Very low140 Ų140138.5 Ų138.575%0.74977%0.77SS**  trans69.5151.3150.8-149.135000113.6
316N36.6Very low40Very low137 Ų137136 Ų13673%0.73376%0.761SS**  cis-156156.116.57.569.3000108
317G41.5Very low40.4Very low80 Ų80136.3 Ų136.383%0.82577%0.765SS**  trans166.553.7175.400000119.2
318T36.2Very low40.2Very low134 Ų134136.5 Ų136.582%0.82276%0.761SS**  trans-71.2157.8177.7-62.50000114.1
319F34.2Very low40.3Very low192 Ų192137.3 Ų137.384%0.84277%0.766SS**  trans106.9134.4153.4-158.2-82000117
320N37.6Very low40.3Very low94 Ų94137.3 Ų137.350%0.50376%0.757SS.*  cis-161.5161.8-29.2-116.7-81000108.3
321L38.5Very low39.8Very low148 Ų148135.9 Ų135.978%0.77576%0.76SS**  trans19.8123.3149.9-56.7167.2000120.6
322S41.6Very low39.7Very low115 Ų115134.8 Ų134.880%0.80476%0.757SS**  161.2163.5101.7-880000115.6
323E43.1Very low39.4Very low188 Ų188137.2 Ų137.288%0.87976%0.763SS**  trans79.4112.1150.2-150.6155.4-155.400118.6
324G39.5Very low39Very low70 Ų70132.3 Ų132.372%0.72276%0.755SS**  trans-100.6154.2166.600000111
325Y38Very low39Very low220 Ų220134.2 Ų134.286%0.86376%0.76SS**  trans-147.3125.3169-149.9-104000109.9
326T47.2Very low39.3Very low111 Ų111133.8 Ų133.868%0.68176%0.757SS**  trans-74.4161.7165.7370000110.2
327P51.3Low39.3Very low123 Ų123138.1 Ų138.180%0.79976%0.764SS**  trans-119.8123.6131-4.624.2000111.6
328Q32.9Very low39.4Very low149 Ų149138.7 Ų138.770%0.69675%0.752SS**  trans-87.2137.3162175.1178.8-10.200107.7D330Q328-D330 PolarHBondContact NE2-OD2 3.35Å
329T37Very low39.4Very low138 Ų138137.4 Ų137.485%0.84775%0.749SS**  trans-130.899.8166.1530000109.4
330D38.3Very low39.5Very low119 Ų119137.6 Ų137.664%0.63675%0.753SS**  trans-82.4151.3168-74.8-60.3000111.9Q328Q328-D330 PolarHBondContact NE2-OD2 3.35Å
331T33Very low39.5Very low131 Ų131141.7 Ų141.780%0.80477%0.769SS**  trans167.292.7149.922.80000106.1
332S42.1Very low39.5Very low99 Ų99140 Ų14069%0.69276%0.764SS**  65.4140.382.391.80000112.7
333D37.3Very low39.2Very low145 Ų145145.1 Ų145.178%0.77577%0.772SS**  cis-136.5141.35.7-69.3-116.1000106.3
334D40.6Very low39.2Very low139 Ų139140.9 Ų140.974%0.74376%0.764SS**  52.1118.965-154.120.5000117.9
335L40.7Very low38.9Very low147 Ų147148.7 Ų148.777%0.7777%0.771SS**  trans169.4106.7139-93.9172.5000113.1
336D38.6Very low38.7Very low130 Ų130145.1 Ų145.170%0.69577%0.767SS**  trans35.9114.5136.2-74.1-40000122.5
337R36.3Very low38.5Very low229 Ų229147 Ų14786%0.86477%0.773SS**  -178.6162.390.7-100.6-159.9109.379.8-7113.9
338P43.7Very low37.8Very low91 Ų91146.2 Ų146.259%0.59177%0.77SS**  trans-107167.3-169.341.3-35.9000115.7
339S35.5Very low37.7Very low107 Ų107146.7 Ų146.775%0.74878%0.777SS**  trans51.6117.8144.564.80000120.7
340E37.4Very low37.8Very low197 Ų197149.7 Ų149.792%0.92178%0.779SS**  trans-149.8143.6131.850.9-162.1149.200111.8
341E37.2Very low38.3Very low179 Ų179149.9 Ų149.984%0.83679%0.786SS**  trans-99.6-164.5-175.9-59.8175.2169.100110.3
342V38Very low38.2Very low113 Ų113148.6 Ų148.669%0.68578%0.783SS**  trans75.394.4162-162.40000116.9
343F36.3Very low37.8Very low222 Ų222150.7 Ų150.797%0.97479%0.786SS**  trans-125.676145-117.1-88.5000109.9
344S42.3Very low37.7Very low99 Ų99150.7 Ų150.769%0.69278%0.781SS**  trans-158136.6170.8-74.20000107.6
345R32.4Very low37.5Very low234 Ų234150.4 Ų150.488%0.88378%0.779SS**  trans84.6118.5-168.6-156.2175.1-159.9127.13.7111.7
346D33.7Very low37.3Very low146 Ų146146.9 Ų146.978%0.78178%0.778SS**  -146.7168.456-121.3-33.4000116.5
347L44.1Very low37.3Very low151 Ų151149.1 Ų149.179%0.79179%0.787SS**  trans-105166.8167.5-86.4167.5000110.4
348S35.7Very low37.3Very low106 Ų106140.9 Ų140.974%0.74177%0.774SS**  trans82129.9178-25.10000112.7
349D31.8Very low37Very low158 Ų158143.1 Ų143.185%0.84579%0.785SS**  cis-148.6157.548.5-92-39.7000115
350F37.9Very low37.1Very low201 Ų201144.3 Ų144.388%0.88278%0.784SS**  trans-81.1168.4165.6-78.6-95.3000111.7
351P49.1Very low37.2Very low123 Ų123141.7 Ų141.780%0.79978%0.776SS**  trans-115.6126.5136.232.7-26.8000112.2
352S31.6Very low37.4Very low104 Ų104139.8 Ų139.873%0.72777%0.767SS**  trans-68.8153.5153.446.10000109.9
353L33.8Very low37.5Very low144 Ų144141.3 Ų141.375%0.75477%0.771SS**  167.6158.395.2-14476.1000103.5
354E34.2Very low37.6Very low145 Ų145138.4 Ų138.468%0.67876%0.761SS**  cis-172.1168.429.7-17948.7-83.800108.4
355N37.4Very low37Very low132 Ų132139.9 Ų139.971%0.70676%0.76SS**  trans83.587.8153.4-125.586.1000119.2
356G37Very low36.9Very low73 Ų73133.3 Ų133.375%0.75375%0.75SS**  trans-89.5140.7152.800000112.1
357M37.2Very low36.7Very low177 Ų177134.9 Ų134.987%0.87276%0.758SS**  trans-168.8135158.4-162.469.4164.800105.9
358G36.1Very low36Very low57 Ų57131.4 Ų131.459%0.58876%0.758SS**  cis130.756.48.500000111.1
359T37.8Very low35.8Very low137 Ų137134.4 Ų134.484%0.8477%0.765SS**  trans-140.1100.316554.70000109
360N38.9Very low36.5Very low133 Ų133131.8 Ų131.871%0.71176%0.756SS**  trans-64.5162.9145.7-167.737.6000108.1
361D39.3Very low35.9Very low141 Ų141128.3 Ų128.375%0.75475%0.752SS**  trans162.2112.1147.5-80.9-9.8000110.6
362E40.6Very low35.1Very low140 Ų140130.2 Ų130.265%0.65475%0.75SS**  trans55.7101.1136.9-38.4-48.881.100121
363D40.8Very low34.9Very low145 Ų145132 Ų13278%0.77575%0.75SS**  60.8145.3108-81.7-27.5000125.1
364E38.8Very low34.7Very low160 Ų160133.2 Ų133.275%0.74875%0.75SS**  trans84.3114148.8-75.7-167.6177.800123.9
365L30.1Very low34.4Very low131 Ų131135.5 Ų135.569%0.68675%0.752SS**  75.7103.1126.9-65.3172.1000121.5
366S30.4Very low34Very low96 Ų96137.6 Ų137.667%0.67176%0.755SS**  72.4145.8108.2-64.50000122.6
367L29.3Very low33.6Very low179 Ų179142.3 Ų142.394%0.93776%0.755SS**  trans80.2121.1156.9-65.1154.4000119.4
368G28.1Very low33.2Very low77 Ų77142 Ų14279%0.79475%0.751SS**  10589128.100000118.5
369L32.2Very low32.7Very low169 Ų169148.6 Ų148.689%0.88577%0.767SS**  trans-64.6169.2142.2-79100.6000110.3
370P45.6Very low32.4Very low103 Ų103149.5 Ų149.567%0.66977%0.766SS**  cis-132.7176.9-10.124.5-1.5000113.9
371T27Very low31.8Very low128 Ų128149.5 Ų149.579%0.78577%0.766SS**  167.9141.4114.235.60000115.1
372E30.4Very low31.3Very low164 Ų164148.1 Ų148.177%0.76677%0.767SS**  trans49.7123.8147.5-70.3-60.3133.100122.9
373L28.2Very low30.7Very low140 Ų140144.8 Ų144.873%0.73377%0.77SS**  -174.3123100.6-156.989.6000114.7
374K30.6Very low30.1Very low170 Ų170146.5 Ų146.574%0.73977%0.773SS**  trans67.9147.4150.5-92.3174.9-168.4168.30119.3
375R27.6Very low29.8Very low194 Ų194149.1 Ų149.173%0.73278%0.776SS**  cis-166.7139.115169.1-172.3-178.491.1-11.1112.8
376K27.9Very low30.6Very low176 Ų176147.8 Ų147.877%0.76578%0.775SS**  trans64146.8162.6-89.7-173.9169.3-1750117.4
377K29.3Very low30.4Very low172 Ų172149.1 Ų149.175%0.74879%0.785SS**  cis-153.7150.9-3-176.6-173.5175.2-162.90107.9
378E28.7Very low30.8Very low169 Ų169150.2 Ų150.279%0.7978%0.782SS**  trans-62.1149.4179.7-47.9105.6102.700114.3
379Q24.5Very low30.7Very low197 Ų197155.4 Ų155.492%0.92179%0.786SS**  -160.5143.8104.2-157.7165.3-70.500111.7
380L32.8Very low30.7Very low156 Ų156152.5 Ų152.582%0.81778%0.775SS**  trans-93.6155.9179.1-154.593.7000110.8
381D26.9Very low29.8Very low133 Ų133156.4 Ų156.471%0.71178%0.784SS**  154.1137.2120-170.433.6000115.6
382S27.5Very low29.7Very low111 Ų111156.4 Ų156.478%0.77679%0.79SS**  trans55.8163.716482.30000118.6
383G27.7Very low29.7Very low71 Ų71153.2 Ų153.273%0.73279%0.791SS**  cis179.7133-5.100000111.9
384H28.9Very low29.8Very low180 Ų180151.2 Ų151.283%0.83380%0.795SS**  trans21.4111.1159.1-127.560.8000123.4
385R32.1Very low29.8Very low215 Ų215146.3 Ų146.381%0.81179%0.792SS**  74.5175.3129.1-119.6-160.8175-142.4-1.6119
386P46.5Very low29.9Very low103 Ų103144.7 Ų144.767%0.66980%0.797SS**  -125.2163.4-11241.7-25.3000115.7
387S27.5Very low30Very low124 Ų124142.8 Ų142.887%0.86780%0.801SS**  trans-151.6161.1154.9-160.30000112.8
388K36.5Very low30.4Very low203 Ų203140.2 Ų140.288%0.88380%0.795SS**  trans-80.3134.6-179.7-66.9169.6172.5176.70110.6
389E27Very low30.9Very low186 Ų186138.2 Ų138.287%0.86980%0.797SS**  trans-143.8112.5152.9-160.5153.2-169.900112.1
390T31.1Very low31.7Very low107 Ų107133 Ų13366%0.65677%0.774SS**  trans6.7134141.1-51.90000120
391Q28.3Very low32.8Very low185 Ų185131 Ų13186%0.86477%0.765SS**  trans66.7116.6159.5-70.2160.929.200119.1
392S24.1Very low34.3Very low129 Ų129128 Ų12890%0.90275%0.754SS**  -168.5167.8105-160.60000112
393A29.9Very low35.8Very low96 Ų96127.6 Ų127.679%0.79374%0.743SS**  trans-85.5142.2-174.500000114.1
394A30.4Very low37.3Very low98 Ų98129.9 Ų129.981%0.8174%0.735SS**  trans-167.3130.8145.900000105.8
395G30.4Very low38.8Very low67 Ų67124.5 Ų124.569%0.69172%0.715SS**  83.355.556.900000109T397G395-T397 PolarHBondContact O-N 3.16Å
396L30.3Very low40.2Very low160 Ų160121.9 Ų121.984%0.83871%0.709SS**  trans-80.171.7-175.4-158.4144.1000110.1L398L396-L398 VanDerWaalsContact C-N 3.34Å; L396-L398 HydrophobicContact CD2-CB 4.24Å; L396-L398 PolarHBondContact O-N 2.93Å; L396-L398 VanDerWaalsContact O-N 3.11Å
397T30.2Very low41.1Very low136 Ų136123.5 Ų123.583%0.83471%0.708SS**  trans-79.684.4171.554.30000109.3G395G395-T397 PolarHBondContact O-N 3.16Å
398L36.3Very low43.2Very low118 Ų118122.7 Ų122.762%0.61869%0.693SS**  trans-79.2126.3166-16072.1000108.1L396 L400L396-L398 VanDerWaalsContact C-N 3.34Å; L396-L398 HydrophobicContact CD2-CB 4.24Å; L396-L398 PolarHBondContact O-N 2.93Å; L396-L398 VanDerWaalsContact O-N 3.11Å; L398-L400 VanDerWaalsContact C-N 3.28Å; L398-L400 HydrophobicContact CD2-CD1 3.88Å; L398-L400 HydrophobicContact CD2-CG 4.11Å; L398-L400 HydrophobicContact CG-CG 4.49Å; L398-L400 PolarHBondContact O-N 3.39Å
399P40.4Very low44.5Very low128 Ų128119.5 Ų119.583%0.83168%0.683SS**  trans-78.680.1179.432.4-34000109.6
400L41.8Very low46.5Very low87 Ų87114.4 Ų114.446%0.45567%0.668SS.*  trans-95.6133.9169.8-82169.6000110.2L398L398-L400 VanDerWaalsContact C-N 3.28Å; L398-L400 HydrophobicContact CD2-CD1 3.88Å; L398-L400 HydrophobicContact CD2-CG 4.11Å; L398-L400 HydrophobicContact CG-CG 4.49Å; L398-L400 PolarHBondContact O-N 3.39Å
401N54.2Low48.6Very low114 Ų114114 Ų11461%0.6166%0.662SS**  trans-57.4142.4178.4-167.29.4000110.7D403 Q404 T405N401-D403 PolarHBondContact O-N 3.02Å; N401-D403 VanDerWaalsContact O-N 3.1Å; N401-Q404 PolarHBondContact O-N 3.49Å; N401-T405 PolarHBondContact O-N 2.89Å
402S59.1Low50.9Low70 Ų70110.5 Ų110.549%0.4965%0.649SS.*Hα-helixtrans-51.9-41.4-169.445.90000113.1Q404 T405 F406S402-Q404 PolarHBondContact O-N 3.2Å; S402-T405 WeakPolarHBondContact O-CB 3.43Å; S402-T405 PolarHBondContact O-N 2.92Å; S402-F406 PolarHBondContact O-N 2.91Å; S402-F406 VanDerWaalsContact O-N 3.16Å
403D58.8Low53Low103 Ų103106.6 Ų106.655%0.55162%0.624SS**Hα-helixtrans-74.6-31.1-167.3-52.5-10.7000111.5N401 H407N401-D403 PolarHBondContact O-N 3.02Å; N401-D403 VanDerWaalsContact O-N 3.1Å; D403-H407 PolarHBondContact O-N 3.48Å
404Q58.6Low55Low118 Ų118103.5 Ų103.555%0.55160%0.601SS**Hα-helixtrans-74.2-30.2175.8-160.2169.232.900111.6N401 S402 L408N401-Q404 PolarHBondContact O-N 3.49Å; S402-Q404 PolarHBondContact O-N 3.2Å; Q404-L408 WeakPolarHBondContact O-CG 3.42Å; Q404-L408 PolarHBondContact O-N 3.36Å
405T62.1Low57.2Low67 Ų67104.3 Ų104.341%0.41159%0.592SS.*Hα-helixtrans-70-41.2175.8-55.20000111.3N401 S402 L408 M409N401-T405 PolarHBondContact O-N 2.89Å; S402-T405 WeakPolarHBondContact O-CB 3.43Å; S402-T405 PolarHBondContact O-N 2.92Å; T405-L408 PolarHBondContact O-N 3.3Å; T405-M409 WeakPolarHBondContact O-CB 3.4Å; T405-M409 PolarHBondContact O-N 3.39Å
406F61.7Low59.2Low160 Ų160105.4 Ų105.470%0.70259%0.585SS**Hα-helixtrans-61.8-43.3176.4-101.4-85.6000112.8S402 M409 S410S402-F406 PolarHBondContact O-N 2.91Å; S402-F406 VanDerWaalsContact O-N 3.16Å; F406-M409 PolarHBondContact O-N 2.75Å; F406-S410 WeakPolarHBondContact O-CB 3.48Å; F406-S410 PolarHBondContact O-N 3.16Å
407H64.7Low61.1Low137 Ų137103 Ų10363%0.63457%0.572SS**Hα-helixtrans-64.4-42.1176.8-90.2-77000112.9D403 S410 N411D403-H407 PolarHBondContact O-N 3.48Å; H407-S410 PolarHBondContact O-N 2.95Å; H407-N411 WeakPolarHBondContact O-CB 3.35Å; H407-N411 VanDerWaalsContact O-CG 3.23Å; H407-N411 PolarHBondContact O-N 2.88Å
408L70.4Confident63.2Low108 Ų108100.5 Ų100.557%0.56556%0.557SS**Hα-helixtrans-66.7-40176.7-69.5173.9000112Q404 T405 N411 L412Q404-L408 WeakPolarHBondContact O-CG 3.42Å; Q404-L408 PolarHBondContact O-N 3.36Å; T405-L408 PolarHBondContact O-N 3.3Å; L408-N411 PolarHBondContact O-N 3.37Å; L408-L412 WeakPolarHBondContact O-CB 3.4Å; L408-L412 PolarHBondContact O-N 3.16Å
409M64.3Low65Low135 Ų13597.9 Ų97.967%0.66555%0.552SS**Hα-helixtrans-69.2-36.6177.8-165.1171.3-17300112.3T405 F406 A413T405-M409 WeakPolarHBondContact O-CB 3.4Å; T405-M409 PolarHBondContact O-N 3.39Å; F406-M409 PolarHBondContact O-N 2.75Å; M409-A413 VanDerWaalsContact O-CB 3.25Å; M409-A413 WeakPolarHBondContact O-CB 3.46Å; M409-A413 PolarHBondContact O-N 3.46Å
410S69.1Low66.3Low80 Ų8094.7 Ų94.756%0.55954%0.536SS*.Hα-helixtrans-64.9-43.3173.1-171.60000112F406 H407 A413 G414F406-S410 WeakPolarHBondContact O-CB 3.48Å; F406-S410 PolarHBondContact O-N 3.16Å; H407-S410 PolarHBondContact O-N 2.95Å; S410-A413 PolarHBondContact O-N 3.43Å; S410-G414 PolarHBondContact O-N 2.77Å
411N75.4Confident67.7Low98 Ų9894.2 Ų94.252%0.52454%0.537SS..Hα-helixtrans-67.1-44.4178.2-69.5-8.1000111.1H407 L408 A413 G414 D415H407-N411 WeakPolarHBondContact O-CB 3.35Å; H407-N411 VanDerWaalsContact O-CG 3.23Å; H407-N411 PolarHBondContact O-N 2.88Å; L408-N411 PolarHBondContact O-N 3.37Å; N411-A413 VanDerWaalsContact C-N 3.35Å; N411-A413 PolarHBondContact O-N 3.34Å; N411-G414 PolarHBondContact O-N 2.9Å; N411-D415 PolarHBondContact O-N 3.35Å
412L76.1Confident68.6Low112 Ų11293 Ų9359%0.58653%0.534SS*.Hα-helixtrans-63.3-38.9176.3-175.665000112.3L408 D415 V416L408-L412 WeakPolarHBondContact O-CB 3.4Å; L408-L412 PolarHBondContact O-N 3.16Å; L412-D415 PolarHBondContact O-N 2.77Å; L412-V416 WeakPolarHBondContact O-CB 3.37Å; L412-V416 VanDerWaalsContact O-CG2 3.27Å; L412-V416 WeakPolarHBondContact O-CG2 3.49Å; L412-V416 PolarHBondContact O-N 3.41Å
413A68.7Low69Low46 Ų4692.4 Ų92.438%0.3853%0.533SS..Hα-helixtrans-65-41173.300000111.7M409 S410 N411 V416 I417M409-A413 VanDerWaalsContact O-CB 3.25Å; M409-A413 WeakPolarHBondContact O-CB 3.46Å; M409-A413 PolarHBondContact O-N 3.46Å; S410-A413 PolarHBondContact O-N 3.43Å; N411-A413 VanDerWaalsContact C-N 3.35Å; N411-A413 PolarHBondContact O-N 3.34Å; A413-V416 PolarHBondContact O-N 3.4Å; A413-I417 WeakPolarHBondContact O-CB 3.24Å; A413-I417 WeakPolarHBondContact O-CD1 3.36Å; A413-I417 WeakPolarHBondContact O-CG1 3.35Å; A413-I417 PolarHBondContact O-N 3.28Å
414G73.1Confident69.3Low31 Ų3190.2 Ų90.232%0.3253%0.529SS..Hα-helixtrans-59.5-47173.900000112.8S410 N411 I417 T418S410-G414 PolarHBondContact O-N 2.77Å; N411-G414 PolarHBondContact O-N 2.9Å; G414-I417 PolarHBondContact O-N 2.85Å; G414-T418 WeakPolarHBondContact O-CB 3.49Å; G414-T418 PolarHBondContact O-N 3.2Å; G414-T418 PolarHBondContact O-OG1 3.38Å
415D75.9Confident69.9Low115 Ų11589.9 Ų89.962%0.61553%0.53SS*.Hα-helixtrans-64.6-40.8177.4-75.3-17000112N411 L412 T418 A419N411-D415 PolarHBondContact O-N 3.35Å; L412-D415 PolarHBondContact O-N 2.77Å; D415-T418 PolarHBondContact O-N 3.29Å; D415-A419 WeakPolarHBondContact O-CB 3.24Å; D415-A419 PolarHBondContact O-N 2.71Å
416V71.6Confident70.3Confident91 Ų9192 Ų9255%0.55253%0.534SS*.Hα-helixtrans-68.1-39.6177.2170.70000111.8L412 A413 A420L412-V416 WeakPolarHBondContact O-CB 3.37Å; L412-V416 VanDerWaalsContact O-CG2 3.27Å; L412-V416 WeakPolarHBondContact O-CG2 3.49Å; L412-V416 PolarHBondContact O-N 3.41Å; A413-V416 PolarHBondContact O-N 3.4Å; V416-A420 VanDerWaalsContact O-CB 3.28Å; V416-A420 WeakPolarHBondContact O-CB 3.2Å; V416-A420 PolarHBondContact O-N 3.36Å
417I71.3Confident70.4Confident108 Ų10890.1 Ų90.155%0.55453%0.531SS*.Hα-helixtrans-66.3-44.8174.9-68.7163.7000110.1A413 G414 A419 A420 V421A413-I417 WeakPolarHBondContact O-CB 3.24Å; A413-I417 WeakPolarHBondContact O-CD1 3.36Å; A413-I417 WeakPolarHBondContact O-CG1 3.35Å; A413-I417 PolarHBondContact O-N 3.28Å; G414-I417 PolarHBondContact O-N 2.85Å; I417-A419 PolarHBondContact O-N 3.49Å; I417-A420 PolarHBondContact O-N 2.9Å; I417-V421 HydrophobicContact CG2-CG2 4.36Å; I417-V421 WeakPolarHBondContact O-CB 3.48Å; I417-V421 VanDerWaalsContact O-CG2 3.32Å; I417-V421 WeakPolarHBondContact O-CG2 3.24Å; I417-V421 PolarHBondContact O-N 3.47Å
418T74.4Confident69.9Low85 Ų8590.8 Ų90.852%0.52153%0.534SS..Hα-helixtrans-63.9-41.2178-560000111.2G414 D415 T422G414-T418 WeakPolarHBondContact O-CB 3.49Å; G414-T418 PolarHBondContact O-N 3.2Å; G414-T418 PolarHBondContact O-OG1 3.38Å; D415-T418 PolarHBondContact O-N 3.29Å; T418-T422 VanDerWaalsContact O-CB 3.28Å; T418-T422 WeakPolarHBondContact O-CB 3.44Å; T418-T422 PolarHBondContact O-N 3.23Å; T418-T422 PolarHBondContact O-OG1 2.96Å
419A72.9Confident68.9Low62 Ų6291 Ų9151%0.51254%0.536SS..Hα-helixtrans-64.6-41.9174.200000112.4D415 I417 T422 A423D415-A419 WeakPolarHBondContact O-CB 3.24Å; D415-A419 PolarHBondContact O-N 2.71Å; I417-A419 PolarHBondContact O-N 3.49Å; A419-T422 PolarHBondContact O-N 2.79Å; A419-A423 VanDerWaalsContact O-CB 3.29Å; A419-A423 WeakPolarHBondContact O-CB 3.23Å; A419-A423 PolarHBondContact O-N 3.25Å
420A67.4Low68.4Low61 Ų6189 Ų8950%0.50452%0.524SS..Hα-helixtrans-66.6-41.9177.100000112.3V416 I417 A423 A424V416-A420 VanDerWaalsContact O-CB 3.28Å; V416-A420 WeakPolarHBondContact O-CB 3.2Å; V416-A420 PolarHBondContact O-N 3.36Å; I417-A420 PolarHBondContact O-N 2.9Å; A420-A423 PolarHBondContact O-N 3.06Å; A420-A424 WeakPolarHBondContact O-CB 3.21Å; A420-A424 PolarHBondContact O-N 2.76Å
421V71.6Confident67.5Low78 Ų7887.3 Ų87.347%0.47352%0.52SS..Hα-helixtrans-65.7-42.8174.8170.60000111I417 A423 A424 I425I417-V421 HydrophobicContact CG2-CG2 4.36Å; I417-V421 WeakPolarHBondContact O-CB 3.48Å; I417-V421 VanDerWaalsContact O-CG2 3.32Å; I417-V421 WeakPolarHBondContact O-CG2 3.24Å; I417-V421 PolarHBondContact O-N 3.47Å; V421-A423 VanDerWaalsContact C-N 3.33Å; V421-A423 PolarHBondContact O-N 3.48Å; V421-A424 PolarHBondContact O-N 3.48Å; V421-I425 HydrophobicContact CG1-CD1 3.73Å; V421-I425 HydrophobicContact CG1-CG1 4.46Å; V421-I425 VanDerWaalsContact O-CG1 3.28Å; V421-I425 WeakPolarHBondContact O-CG1 3.24Å; V421-I425 PolarHBondContact O-N 3.24Å
422T73.4Confident66.2Low87 Ų8786.6 Ų86.653%0.53452%0.519SS..Hα-helixtrans-63.9-39.2176.1-55.40000111.4T418 A419 K426T418-T422 VanDerWaalsContact O-CB 3.28Å; T418-T422 WeakPolarHBondContact O-CB 3.44Å; T418-T422 PolarHBondContact O-N 3.23Å; T418-T422 PolarHBondContact O-OG1 2.96Å; A419-T422 PolarHBondContact O-N 2.79Å; T422-K426 WeakPolarHBondContact O-CB 3.17Å; T422-K426 PolarHBondContact O-N 3.48Å
423A68.4Low64.8Low58 Ų5887.2 Ų87.248%0.47952%0.519SS..Hα-helixtrans-65-44.8174.200000112A419 A420 V421 I425 K426 D427A419-A423 VanDerWaalsContact O-CB 3.29Å; A419-A423 WeakPolarHBondContact O-CB 3.23Å; A419-A423 PolarHBondContact O-N 3.25Å; A420-A423 PolarHBondContact O-N 3.06Å; V421-A423 VanDerWaalsContact C-N 3.33Å; V421-A423 PolarHBondContact O-N 3.48Å; A423-I425 PolarHBondContact O-N 2.71Å; A423-K426 PolarHBondContact O-N 3.15Å; A423-D427 WeakPolarHBondContact O-CB 3.49Å; A423-D427 PolarHBondContact O-N 3.4Å
424A64.1Low63.7Low57 Ų5791.3 Ų91.347%0.47153%0.53SS..Hα-helixtrans-65.7-35.7178.600000113.2A420 V421 Q428A420-A424 WeakPolarHBondContact O-CB 3.21Å; A420-A424 PolarHBondContact O-N 2.76Å; V421-A424 PolarHBondContact O-N 3.48Å; A424-Q428 PolarHBondContact O-N 3.14Å; A424-Q428 VanDerWaalsContact O-N 3.15Å
425I71.9Confident62.4Low111 Ų11193.7 Ų93.757%0.56955%0.546SS*.Hα-helixtrans-69-40.3173.9-67.9166.8000110.4V421 A423 L429V421-I425 HydrophobicContact CG1-CD1 3.73Å; V421-I425 HydrophobicContact CG1-CG1 4.46Å; V421-I425 VanDerWaalsContact O-CG1 3.28Å; V421-I425 WeakPolarHBondContact O-CG1 3.24Å; V421-I425 PolarHBondContact O-N 3.24Å; A423-I425 PolarHBondContact O-N 2.71Å; I425-L429 WeakPolarHBondContact O-CB 3.19Å; I425-L429 PolarHBondContact O-N 2.78Å
426K69.4Low60.9Low112 Ų11295.1 Ų95.149%0.48755%0.553SS.*Hα-helixtrans-65.6-41.7176.4-169.7176179.7-79.90112.1T422 A423 L429 E430T422-K426 WeakPolarHBondContact O-CB 3.17Å; T422-K426 PolarHBondContact O-N 3.48Å; A423-K426 PolarHBondContact O-N 3.15Å; K426-L429 PolarHBondContact O-N 2.99Å; K426-E430 IonicContact NZ-OE1 2.67Å; K426-E430 PolarHBondContact NZ-OE1 3.41Å; K426-E430 IonicContact NZ-OE2 2.72Å; K426-E430 PolarHBondContact NZ-OE2 3.06Å; K426-E430 WeakPolarHBondContact O-CB 3.14Å; K426-E430 PolarHBondContact O-N 3.27Å
427D63.2Low59.5Low121 Ų12195.1 Ų95.165%0.64756%0.558SS**Hα-helixtrans-65.1-39.9179.1-162.562.9000111.9A423 G431A423-D427 WeakPolarHBondContact O-CB 3.49Å; A423-D427 PolarHBondContact O-N 3.4Å; D427-G431 PolarHBondContact O-N 2.87Å
428Q56Low58.2Low151 Ų15198 Ų9871%0.70657%0.569SS**Hα-helixtrans-66.1-39170.1-82.8-141.471.600113.1A424 G431 V432A424-Q428 PolarHBondContact O-N 3.14Å; A424-Q428 VanDerWaalsContact O-N 3.15Å; Q428-G431 PolarHBondContact O-N 3.08Å; Q428-V432 WeakPolarHBondContact O-CG2 3.48Å; Q428-V432 PolarHBondContact O-N 2.93Å
429L48.5Very low56.3Low113 Ų11398.5 Ų98.559%0.59258%0.581SS**Hα-helixtrans-69.8-41.2179.9-168.765.2000111.9I425 K426 V432 Q433I425-L429 WeakPolarHBondContact O-CB 3.19Å; I425-L429 PolarHBondContact O-N 2.78Å; K426-L429 PolarHBondContact O-N 2.99Å; L429-V432 PolarHBondContact O-N 3.47Å; L429-Q433 VanDerWaalsContact O-CB 3.32Å; L429-Q433 WeakPolarHBondContact O-CB 3.36Å; L429-Q433 PolarHBondContact O-N 2.83Å
430E53.2Low54.4Low91 Ų91100.2 Ų100.243%0.42560%0.596SS.*Hα-helixtrans-66.8-38172.8-75.3174.8146.100111.1K426 V432 Q433 Q434K426-E430 IonicContact NZ-OE1 2.67Å; K426-E430 PolarHBondContact NZ-OE1 3.41Å; K426-E430 IonicContact NZ-OE2 2.72Å; K426-E430 PolarHBondContact NZ-OE2 3.06Å; K426-E430 WeakPolarHBondContact O-CB 3.14Å; K426-E430 PolarHBondContact O-N 3.27Å; E430-V432 PolarHBondContact O-N 2.95Å; E430-Q433 PolarHBondContact O-N 2.84Å; E430-Q434 WeakPolarHBondContact O-CB 3.4Å; E430-Q434 PolarHBondContact O-N 3.47Å
431G50Low53.2Low45 Ų45103.4 Ų103.446%0.46461%0.611SS.*Hα-helixtrans-60-41.7172.800000113.9D427 Q428 A435D427-G431 PolarHBondContact O-N 2.87Å; Q428-G431 PolarHBondContact O-N 3.08Å; G431-A435 WeakPolarHBondContact O-CB 3.34Å; G431-A435 PolarHBondContact O-N 3.09Å
432V49.8Very low51.2Low83 Ų83107.6 Ų107.650%0.50363%0.629SS.*Hα-helixtrans-72-43.2175.8172.70000111.5Q428 L429 E430 Q434 A435 L436Q428-V432 WeakPolarHBondContact O-CG2 3.48Å; Q428-V432 PolarHBondContact O-N 2.93Å; L429-V432 PolarHBondContact O-N 3.47Å; E430-V432 PolarHBondContact O-N 2.95Å; V432-Q434 VanDerWaalsContact C-N 3.32Å; V432-Q434 PolarHBondContact O-N 2.79Å; V432-A435 PolarHBondContact O-N 3.43Å; V432-L436 HydrophobicContact CG1-CD1 4.49Å; V432-L436 PolarHBondContact O-N 3.12Å; V432-L436 VanDerWaalsContact O-N 3.09Å
433Q45.3Very low49.9Very low125 Ų125108 Ų10858%0.58463%0.633SS**Hα-helixtrans-67-33-179.9-172.3172.6-21.500112.5L429 E430 L436 S437L429-Q433 VanDerWaalsContact O-CB 3.32Å; L429-Q433 WeakPolarHBondContact O-CB 3.36Å; L429-Q433 PolarHBondContact O-N 2.83Å; E430-Q433 PolarHBondContact O-N 2.84Å; Q433-L436 PolarHBondContact O-N 3.37Å; Q433-S437 WeakPolarHBondContact O-CB 3.37Å; Q433-S437 PolarHBondContact O-N 2.85Å; Q433-S437 PolarHBondContact O-OG 2.8Å
434Q46.8Very low48.2Very low133 Ų133113.3 Ų113.362%0.62165%0.648SS**Hα-helixtrans-79.2-27.2177.9-165.3161.3-15.600112.6E430 V432E430-Q434 WeakPolarHBondContact O-CB 3.4Å; E430-Q434 PolarHBondContact O-N 3.47Å; V432-Q434 VanDerWaalsContact C-N 3.32Å; V432-Q434 PolarHBondContact O-N 2.79Å
435A45.7Very low46.7Very low80 Ų80120 Ų12066%0.66167%0.67SS**Hα-helixtrans-69.5-35.5168.100000112.6G431 V432 S437G431-A435 WeakPolarHBondContact O-CB 3.34Å; G431-A435 PolarHBondContact O-N 3.09Å; V432-A435 PolarHBondContact O-N 3.43Å; A435-S437 VanDerWaalsContact C-N 3.34Å
436L44.2Very low45.1Very low145 Ų145122 Ų12276%0.75968%0.681SS**Hα-helixtrans-78.3-12.4178.5-115.2144.5000114.3V432 Q433V432-L436 HydrophobicContact CG1-CD1 4.49Å; V432-L436 PolarHBondContact O-N 3.12Å; V432-L436 VanDerWaalsContact O-N 3.09Å; Q433-L436 PolarHBondContact O-N 3.37Å
437S42.4Very low43.5Very low92 Ų92123.3 Ų123.364%0.64370%0.699SS**THydrogen-bonded Turntrans-102.88.5-175.4-56.10000114.6Q433 A435Q433-S437 WeakPolarHBondContact O-CB 3.37Å; Q433-S437 PolarHBondContact O-N 2.85Å; Q433-S437 PolarHBondContact O-OG 2.8Å; A435-S437 VanDerWaalsContact C-N 3.34Å
438Q42.6Very low42.4Very low169 Ų169125.1 Ų125.179%0.7971%0.709SS**SBendtrans-108.818.5-176.7-100.6-174.120.800115.3
439A35.9Very low41.7Very low94 Ų94125.2 Ų125.278%0.77772%0.72SS**  trans-138.179.3179.800000113.8
440A32.8Very low41.7Very low99 Ų99128.6 Ų128.682%0.81873%0.733SS**  trans-171.7150.9146.600000111.9
441P41.6Very low41.6Very low127 Ų127133.6 Ų133.683%0.82576%0.756SS**  trans-115.4-173-167.739-24.4000115.5
442I30.6Very low41.4Very low166 Ų166134.7 Ų134.785%0.85177%0.767SS**  trans-131.3144.4-180-50.3175.8000105.9
443P44.5Very low41.3Very low96 Ų96137 Ų13762%0.62378%0.777SS**  -118.1-159.7-129.418.55.2000116.2
444E34.1Very low41.7Very low170 Ų170138.2 Ų138.279%0.79479%0.787SS**  trans80.999.5166.7-30.9-59.5154.100117.9
445E31.4Very low41.9Very low198 Ų198139.6 Ų139.693%0.92579%0.792SS**  -179.8134119.7-167.8141.6104.700111
446D38.3Very low42.7Very low152 Ų152144.5 Ų144.581%0.81380%0.801SS**  trans-68.6138-173.5-73.5-49.4000114.9
447T35.9Very low43.6Very low139 Ų139145.1 Ų145.185%0.85380%0.804SS**  -172.1132.6119.912.80000112.2
448D39.9Very low44.5Very low160 Ų160145.8 Ų145.886%0.85680%0.8SS**  trans-62.2143.5-179.6-62.4-64.3000113.8
449T41.9Very low46.1Very low152 Ų152143.6 Ų143.693%0.93379%0.793SS**  trans-146.6126.8141.8-8.40000110.3
450E49.4Very low47.7Very low185 Ų185146.7 Ų146.786%0.86479%0.792SS**  trans-83.1131-166.3179.6-175155.400112.8
451E49.9Very low49.3Very low195 Ų195146 Ų14691%0.91178%0.781SS**  trans150.777.9151.5-88.3-171.6153.300109.9
452G47.1Very low51Low68 Ų68144.5 Ų144.570%0.70176%0.763SS**  trans-104.3117.715900000108D454G452-D454 PolarHBondContact O-N 2.82Å
453D46.6Very low53Low133 Ų133141.3 Ų141.371%0.71175%0.747SS**  trans-74.192.1-179.5-154.913.6000108.6F455D453-F455 HydrophobicContact CB-CD2 4.47Å; D453-F455 HydrophobicContact CB-CE2 4Å; D453-F455 WeakPolarHBondContact O-CD2 3.37Å; D453-F455 PolarHBondContact O-N 3.35Å; D453-F455 WeakPolarHBondContact OD2-CE2 3.3Å; D453-F455 WeakPolarHBondContact OD2-CZ 3.27Å
454D53.5Low54.3Low150 Ų150141.6 Ų141.680%0.80274%0.743SS**  trans-68.891.7176.7-96.8-24.6000109.2G452 E456G452-D454 PolarHBondContact O-N 2.82Å; D454-E456 PolarHBondContact O-N 3.28Å
455F52Low56.3Low162 Ų162139.8 Ų139.871%0.71174%0.735SS**  trans-69.584.6164.8-71.7-84.5000109.2D453 L457D453-F455 HydrophobicContact CB-CD2 4.47Å; D453-F455 HydrophobicContact CB-CE2 4Å; D453-F455 WeakPolarHBondContact O-CD2 3.37Å; D453-F455 PolarHBondContact O-N 3.35Å; D453-F455 WeakPolarHBondContact OD2-CE2 3.3Å; D453-F455 WeakPolarHBondContact OD2-CZ 3.27Å; F455-L457 PolarHBondContact O-N 3.48Å
456E62.5Low58.1Low183 Ų183133.8 Ų133.886%0.85571%0.708SS**  trans-53.6114.2164.4-70.6-172.1156.600108.4D454 L458D454-E456 PolarHBondContact O-N 3.28Å; E456-L458 PolarHBondContact O-N 2.92Å
457L62.8Low59.6Low158 Ų158131 Ų13183%0.82769%0.69SS**  trans-70.2114.7176.6-66.6173.3000107.8F455 D459F455-L457 PolarHBondContact O-N 3.48Å; L457-D459 PolarHBondContact O-N 3.28Å; L457-D459 VanDerWaalsContact O-N 3.13Å
458L61.1Low61.1Low106 Ų106127.9 Ų127.956%0.55568%0.675SS**  trans-53119.1173.4-68.2170.5000109.6E456 E462 I466E456-L458 PolarHBondContact O-N 2.92Å; L458-E462 HydrophobicContact CD2-CB 4.47Å; L458-E462 VanDerWaalsContact CD2-OE2 3.28Å; L458-E462 WeakPolarHBondContact CD2-OE2 3.46Å; L458-I466 HydrophobicContact CD1-CD1 4.23Å
459D75.3Confident62.6Low122 Ų122128.3 Ų128.365%0.65267%0.671SS**  trans-63.9147.9174.9-100.5-25.2000109.6L457 S461 E462 L463L457-D459 PolarHBondContact O-N 3.28Å; L457-D459 VanDerWaalsContact O-N 3.13Å; D459-S461 PolarHBondContact O-N 3.42Å; D459-E462 PolarHBondContact O-N 2.71Å; D459-L463 PolarHBondContact O-N 2.85Å
460Q69.9Low63.5Low160 Ų160127 Ų12775%0.74866%0.658SS**Hα-helixtrans-56.1-29.7-169.5-69-177.9-16.500113.6E462 L463 D464Q460-E462 VanDerWaalsContact C-N 3.33Å; Q460-E462 PolarHBondContact O-N 3.29Å; Q460-L463 PolarHBondContact O-N 2.93Å; Q460-D464 VanDerWaalsContact O-CG 3.26Å; Q460-D464 PolarHBondContact O-N 3.02Å
461S67.5Low63.8Low83 Ų83120.4 Ų120.458%0.5864%0.639SS**Hα-helixtrans-66.8-28175.2500000114.7D459 Q465D459-S461 PolarHBondContact O-N 3.42Å; S461-Q465 WeakPolarHBondContact O-CB 3.42Å; S461-Q465 PolarHBondContact O-N 3.14Å; S461-Q465 VanDerWaalsContact O-N 3.15Å
462E76.1Confident64.1Low96 Ų96117.1 Ų117.145%0.44963%0.627SS.*Hα-helixtrans-79.2-33.9174.2-62.4-168.7152.200110.7L458 D459 Q460 Q465 I466L458-E462 HydrophobicContact CD2-CB 4.47Å; L458-E462 VanDerWaalsContact CD2-OE2 3.28Å; L458-E462 WeakPolarHBondContact CD2-OE2 3.46Å; D459-E462 PolarHBondContact O-N 2.71Å; Q460-E462 VanDerWaalsContact C-N 3.33Å; Q460-E462 PolarHBondContact O-N 3.29Å; E462-Q465 WeakPolarHBondContact O-CB 3.39Å; E462-Q465 PolarHBondContact O-N 3.4Å; E462-I466 WeakPolarHBondContact O-CD1 3.42Å; E462-I466 VanDerWaalsContact O-CG1 3.24Å; E462-I466 WeakPolarHBondContact O-CG1 3.49Å; E462-I466 PolarHBondContact O-N 3.35Å
463L73.5Confident64.3Low100 Ų100118.8 Ų118.852%0.52462%0.624SS.*Hα-helixtrans-64.3-45.5172.3-167.866.4000111.5D459 Q460 Q465 I466 E467D459-L463 PolarHBondContact O-N 2.85Å; Q460-L463 PolarHBondContact O-N 2.93Å; L463-Q465 VanDerWaalsContact C-N 3.25Å; L463-Q465 PolarHBondContact O-N 3.26Å; L463-I466 PolarHBondContact O-N 3.03Å; L463-E467 PolarHBondContact O-N 3.47Å
464D71.2Confident64.5Low102 Ų102120.7 Ų120.755%0.54563%0.629SS.*Hα-helixtrans-60.4-35.3173.4-67.7-11.9000111.6Q460 E467 S468Q460-D464 VanDerWaalsContact O-CG 3.26Å; Q460-D464 PolarHBondContact O-N 3.02Å; D464-E467 PolarHBondContact O-N 2.92Å; D464-S468 WeakPolarHBondContact O-CB 3.49Å; D464-S468 PolarHBondContact O-N 2.89Å
465Q75.7Confident64.3Low131 Ų131121.6 Ų121.661%0.61263%0.634SS**Hα-helixtrans-68.8-40.2176.2-173168.226.400112S461 E462 L463 S468 E469S461-Q465 WeakPolarHBondContact O-CB 3.42Å; S461-Q465 PolarHBondContact O-N 3.14Å; S461-Q465 VanDerWaalsContact O-N 3.15Å; E462-Q465 WeakPolarHBondContact O-CB 3.39Å; E462-Q465 PolarHBondContact O-N 3.4Å; L463-Q465 VanDerWaalsContact C-N 3.25Å; L463-Q465 PolarHBondContact O-N 3.26Å; Q465-S468 PolarHBondContact O-N 3.37Å; Q465-E469 WeakPolarHBondContact O-CB 3.34Å; Q465-E469 PolarHBondContact O-N 2.86Å
466I69.9Low63.9Low73 Ų73123 Ų12337%0.37464%0.642SS.*Hα-helixtrans-67.6-38.1174.8-64.6158.5000110.8L458 E462 L463 E469 L470L458-I466 HydrophobicContact CD1-CD1 4.23Å; E462-I466 WeakPolarHBondContact O-CD1 3.42Å; E462-I466 VanDerWaalsContact O-CG1 3.24Å; E462-I466 WeakPolarHBondContact O-CG1 3.49Å; E462-I466 PolarHBondContact O-N 3.35Å; L463-I466 PolarHBondContact O-N 3.03Å; I466-E469 PolarHBondContact O-N 3.24Å; I466-L470 HydrophobicContact CG2-CD1 3.93Å; I466-L470 WeakPolarHBondContact O-CB 3.42Å; I466-L470 PolarHBondContact O-N 3.14Å
467E70.6Confident62.9Low92 Ų92123.5 Ų123.543%0.4365%0.645SS.*Hα-helixtrans-64.4-40.2173.9-175.2168.9-177.400111.9L463 D464 G471 L472L463-E467 PolarHBondContact O-N 3.47Å; D464-E467 PolarHBondContact O-N 2.92Å; E467-G471 PolarHBondContact O-N 3.01Å; E467-L472 HydrophobicContact CG-CB 4.17Å; E467-L472 HydrophobicContact CG-CD1 4.4Å; E467-L472 PolarHBondContact O-N 2.94Å
468S66.8Low61.7Low75 Ų75120.2 Ų120.252%0.52464%0.64SS.*Hα-helixtrans-67.1-34.7173.1-1770000113D464 Q465 G471D464-S468 WeakPolarHBondContact O-CB 3.49Å; D464-S468 PolarHBondContact O-N 2.89Å; Q465-S468 PolarHBondContact O-N 3.37Å; S468-G471 PolarHBondContact O-N 2.77Å
469E70.8Confident60.4Low169 Ų169123.9 Ų123.979%0.7966%0.655SS**Hα-helixtrans-78.6-29178.5-166.3169.6-146.900112.2Q465 I466 G471Q465-E469 WeakPolarHBondContact O-CB 3.34Å; Q465-E469 PolarHBondContact O-N 2.86Å; I466-E469 PolarHBondContact O-N 3.24Å; E469-G471 PolarHBondContact O-N 3.47Å
470L61.6Low59Low125 Ų125122.6 Ų122.665%0.65466%0.66SS**THydrogen-bonded Turntrans-72.9-6.2167.6-83.5162000113.8I466 L472I466-L470 HydrophobicContact CG2-CD1 3.93Å; I466-L470 WeakPolarHBondContact O-CB 3.42Å; I466-L470 PolarHBondContact O-N 3.14Å; L470-L472 VanDerWaalsContact C-N 3.34Å; L470-L472 PolarHBondContact O-N 3.06Å
471G56Low57.5Low45 Ų45123 Ų12346%0.46466%0.662SS.*THydrogen-bonded Turntrans7221.4170.900000115E467 S468 E469 T473E467-G471 PolarHBondContact O-N 3.01Å; S468-G471 PolarHBondContact O-N 2.77Å; E469-G471 PolarHBondContact O-N 3.47Å; G471-T473 PolarHBondContact O-N 3.12Å
472L55.5Low55.9Low127 Ų127127.7 Ų127.767%0.66568%0.675SS**  trans-72.6-10.8-179.5-69.6176.3000113.6E467 L470 Q474E467-L472 HydrophobicContact CG-CB 4.17Å; E467-L472 HydrophobicContact CG-CD1 4.4Å; E467-L472 PolarHBondContact O-N 2.94Å; L470-L472 VanDerWaalsContact C-N 3.34Å; L470-L472 PolarHBondContact O-N 3.06Å; L472-Q474 PolarHBondContact O-N 2.92Å
473T51.9Low53.7Low103 Ų103128.3 Ų128.363%0.63268%0.682SS**  trans-98.656.9172.261.40000112.5G471G471-T473 PolarHBondContact O-N 3.12Å
474Q51.3Low51.8Low173 Ų173131.8 Ų131.881%0.80869%0.692SS**SBendtrans-131.136.5166.2-151.2-173.4-5.400114.2L472L472-Q474 PolarHBondContact O-N 2.92Å
475D47.6Very low50.7Low169 Ų169137 Ų13790%0.90471%0.71SS**SBendtrans-149.620.5165.1-100.9-33.9000114.2
476Q45.6Very low49.1Very low190 Ų190136 Ų13689%0.88872%0.718SS**SBendtrans-135.325.1177-150.9169.7-0.700115.2
477E40.7Very low48Very low195 Ų195138 Ų13891%0.91174%0.738SS**SBendtrans-141.341.9166.5-132.5177.1-177.600113.8
478A37.6Very low46.6Very low89 Ų89135.6 Ų135.674%0.73674%0.738SS**SBendtrans-112135.4158.100000109.7
479E33.8Very low45.8Very low183 Ų183141.8 Ų141.886%0.85576%0.756SS**  trans73.435.2172.8-51.3-150.5123.200119Q481E479-Q481 PolarHBondContact O-N 3.24Å
480A44.7Very low44.8Very low94 Ų94141.5 Ų141.578%0.77776%0.759SS**  trans-70.250.8146.500000112.2
481Q39.2Very low44.4Very low168 Ų168139.4 Ų139.479%0.78576%0.755SS**  trans-178.893.6166.5-108.4166.268.700113.2E479E479-Q481 PolarHBondContact O-N 3.24Å
482Q33.7Very low44Very low182 Ų182144.2 Ų144.285%0.8577%0.77SS**  -178.9128.7123.8-100.2175.856.800115.8
483N30Very low43.7Very low110 Ų110145.3 Ų145.359%0.58878%0.776SS**  trans49.6116.3146.3-88.6-65.6000122.4
484K34.6Very low43.7Very low172 Ų172148.3 Ų148.375%0.74879%0.787SS**  trans63.6114.5130.7-68168-175145.60120.4
485K46.8Very low43.1Very low211 Ų211143.7 Ų143.792%0.91779%0.786SS**  29.698.8124.6-65.7-177.5176-178.40118.2
486S41.8Very low43Very low112 Ų112139.7 Ų139.778%0.78379%0.785SS**  -162.4129.1128.949.10000107.7
487S47.2Very low42.6Very low113 Ų113142.8 Ų142.879%0.7980%0.799SS**  cis6868.148.7-168.80000114.1
488G42.2Very low42.6Very low42 Ų42140.2 Ų140.243%0.43379%0.793SS.*  87.8105.9125.300000119S491G488-S491 WeakPolarHBondContact CA-OG 3.42Å; G488-S491 PolarHBondContact O-OG 2.71Å
489F50Low42.9Very low206 Ų206142.9 Ų142.990%0.90480%0.796SS**SBendtrans-92.7-26.7155.9-92.3-86.9000113.1
490L48.9Very low43.4Very low162 Ų162140.7 Ų140.785%0.84879%0.793SS**G310 helixtrans-80.2-16.7175.9-63.9-179.1000113.8N492L490-N492 PolarHBondContact O-N 3.4Å
491S53Low43.3Very low81 Ų81143.4 Ų143.457%0.56679%0.794SS**G310 helixtrans-8010.6177.956.40000114.5G488G488-S491 WeakPolarHBondContact CA-OG 3.42Å; G488-S491 PolarHBondContact O-OG 2.71Å
492N47.2Very low43.6Very low146 Ų146141.9 Ų141.978%0.78179%0.794SS**G310 helixtrans-124.42-179.2-99.8-43.5000114.5L490L490-N492 PolarHBondContact O-N 3.4Å
493L49.9Very low44.3Very low151 Ų151139.2 Ų139.279%0.79179%0.791SS**THydrogen-bonded Turntrans-118.5-28.3-176-141.385.5000116
494L52.2Low45.3Very low165 Ų165141.3 Ų141.386%0.86481%0.805SS**SBendtrans-106.297.1170.1-98.667.2000108.7
495G38.5Very low46.1Very low76 Ų76138.9 Ų138.978%0.78481%0.809SS**  trans-73.1166.6-172.400000114.7
496G44.9Very low46Very low85 Ų85132.9 Ų132.988%0.87680%0.8SS**  trans-69163.5-174.500000116.9
497H36.8Very low46.4Very low256 Ų256134.8 Ų134.8100%1.18580%0.802SS**  trans-141.70130-167-61.9000108.1

Retrieved 497 of 497 residues in 143.8 ms (Link to these results)