A0A087Y929_POEFO Loading...

Dystrobrevin binding protein 1b

AlphaFold DB , UniProt , Accession A0A087Y929, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 227 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
1M45.7Very low47.2Very low239 Ų239136.6 Ų136.6100%1.17785%0.852SS**  0121.30-62.418091.700107.1
2S45.3Very low47.4Very low129 Ų129140.6 Ų140.690%0.90285%0.853SS**  trans158.7101.7155.5-80.70000107.1
3T47.1Very low47.5Very low131 Ų131147.4 Ų147.480%0.80485%0.853SS**  trans-105138.1176.446.50000109.9
4S42.7Very low46.6Very low113 Ų113145.1 Ų145.179%0.7985%0.85SS**  trans80.4162.4147.8-56.60000119.8
5P58.8Low46Very low133 Ų133142.5 Ų142.586%0.86484%0.843SS**  cis-133.5176.9-20.728.3-6.4000114.3
6G43.6Very low46.1Very low80 Ų80143.4 Ų143.483%0.82584%0.842SS**  trans17893.5162.300000114
7A49.7Very low45.7Very low97 Ų97145.6 Ų145.680%0.80284%0.842SS**  trans-86.1148.9171.500000111.8
8R51Low45.6Very low241 Ų241146.6 Ų146.691%0.90984%0.843SS**  trans156.995.9149.2-88.1162.7170-162.2-6.3107.4
9D48.1Very low45Very low173 Ų173146.9 Ų146.993%0.92584%0.841SS**  50.6124.787.2-165.643.3000114.6
10G44.3Very low45.1Very low62 Ų62143.6 Ų143.664%0.63983%0.832SS**  trans145.381.5177.200000114.1
11S42.8Very low45.1Very low105 Ų105144.5 Ų144.573%0.73483%0.829SS**  trans21114.9134.2-146.70000115.6
12Q49.9Very low45Very low184 Ų184142.6 Ų142.686%0.8682%0.817SS**  -163.6158.864.9-78.5-179.9-27.500110
13R48.5Very low44.8Very low229 Ų229141.2 Ų141.286%0.86481%0.807SS**  trans-86.7156-162.8-56.2166.8-154.5174.46.9110.1
14S35.8Very low44.3Very low116 Ų116142.4 Ų142.481%0.81180%0.803SS**  trans63.396.415460.50000118.1
15S37.2Very low44.2Very low106 Ų106145.1 Ų145.174%0.74180%0.801SS**  trans-43.5170133.9-51.10000113.8
16L47.2Very low43.4Very low157 Ų157144 Ų14482%0.82279%0.792SS**  trans93.794.5172.6-46.2178.8000111.4
17E39.3Very low43.7Very low181 Ų181146.4 Ų146.485%0.84679%0.793SS**  40.788.659.1-162.1-173.1172.400111.4
18L44.3Very low42.9Very low163 Ų163144.9 Ų144.985%0.85379%0.787SS**  trans-159.2100.5145.2-72.6-171.3000105.5
19D34.2Very low42.6Very low153 Ų153137.7 Ų137.782%0.81878%0.779SS**  87.9142.784.4-167.739.1000112.1
20A46.7Very low42.2Very low80 Ų80138.2 Ų138.266%0.66178%0.776SS**  trans-63.9127.4-166.700000113.9
21E45.8Very low42.1Very low163 Ų163143 Ų14376%0.76278%0.781SS**  trans-165.170.2152.1-127.8178.277.900113S23E21-S23 VanDerWaalsContact C-N 3.25Å; E21-S23 PolarHBondContact O-N 3.41Å
22H42.7Very low42.1Very low199 Ų199142.8 Ų142.892%0.92179%0.786SS**  trans-92.162.3157.5-73.463.5000109
23S40.8Very low42.2Very low100 Ų100137.4 Ų137.470%0.69978%0.78SS**  trans-17689.1163.1-89.70000111.3E21E21-S23 VanDerWaalsContact C-N 3.25Å; E21-S23 PolarHBondContact O-N 3.41Å
24Q36.8Very low42.3Very low155 Ų155131.7 Ų131.772%0.72477%0.77SS**  trans-174.4126.7130.4-112.4-173.21300113.7
25K41.1Very low43.3Very low170 Ų170128.8 Ų128.874%0.73975%0.748SS**  79.8117126.8-152150.6165.8-171.30114.7
26V40.8Very low44.3Very low110 Ų110126.9 Ų126.967%0.66773%0.732SS**  -167.9132.555169.60000110.1G28V26-G28 WeakPolarHBondContact CG1-O 3.22Å
27P50Low44.9Very low131 Ų131124.6 Ų124.685%0.85173%0.727SS**  trans-90.1130.7158.433.1-24.8000110.7
28G34.6Very low45.9Very low65 Ų65122.7 Ų122.767%0.6772%0.718SS**  trans87.6141175.600000113.7V26V26-G28 WeakPolarHBondContact CG1-O 3.22Å
29A43.2Very low46.7Very low90 Ų90118.3 Ų118.374%0.74470%0.698SS**  cis-170121.412.900000107.8
30E40.9Very low48.5Very low184 Ų184116.2 Ų116.286%0.8668%0.682SS**  trans176.278.6154.951.5-166.8116.400111.8
31Q41.8Very low49.8Very low162 Ų162117.4 Ų117.476%0.75768%0.676SS**  trans-12263.1130.2-80.5-163.284.700106.7G33Q31-G33 PolarHBondContact O-N 3.19Å
32A42.6Very low51.7Low101 Ų101117 Ų11784%0.83567%0.672SS**  trans-63.8113.3160.500000107.8
33G51.1Low53.7Low71 Ų71113.6 Ų113.673%0.73266%0.657SS**SBendtrans116.4-21138.400000118.5Q31Q31-G33 PolarHBondContact O-N 3.19Å
34V50.6Low56Low108 Ų108116.9 Ų116.966%0.65565%0.654SS**  trans-149.5108.6172.5-172.90000109.3T36V34-T36 PolarHBondContact O-N 3.18Å
35P57.3Low58.6Low55 Ų55115.3 Ų115.336%0.35765%0.646SS.*  trans-61.3124.5167-921.8000106.9K40P35-K40 HydrophobicContact CB-CD 4.33Å; P35-K40 HydrophobicContact CB-CG 3.66Å; P35-K40 VanDerWaalsContact CD-CE 3.49Å; P35-K40 HydrophobicContact CG-CD 4.43Å; P35-K40 HydrophobicContact CG-CG 4.16Å
36T57.5Low61.1Low66 Ų66113.4 Ų113.441%0.40564%0.638SS.*  trans-51.7140173.1570000108.1V34 Q38 V39 K40V34-T36 PolarHBondContact O-N 3.18Å; T36-Q38 PolarHBondContact O-N 3.19Å; T36-V39 WeakPolarHBondContact O-CA 3.07Å; T36-V39 WeakPolarHBondContact O-CB 3.4Å; T36-V39 PolarHBondContact O-N 3.3Å; T36-V39 WeakPolarHBondContact OG1-CG2 3.23Å; T36-K40 PolarHBondContact O-N 3.37Å
37P61.1Low63.6Low110 Ų110114.9 Ų114.971%0.71464%0.636SS**Hα-helixtrans-56.2-27.9-170.915.4-27.8000113.4K40 L41P37-K40 PolarHBondContact O-N 3.29Å; P37-L41 PolarHBondContact O-N 3.48Å; P37-L41 VanDerWaalsContact O-N 3.14Å
38Q60.3Low65.7Low141 Ų141115.1 Ų115.166%0.65962%0.624SS**Hα-helixtrans-63.6-42.2170.2-84.4-84.146.900113.6T36 K40 L41 K42T36-Q38 PolarHBondContact O-N 3.19Å; Q38-K40 VanDerWaalsContact C-N 3.31Å; Q38-K40 PolarHBondContact O-N 3.49Å; Q38-L41 PolarHBondContact O-N 3.48Å; Q38-K42 WeakPolarHBondContact O-CB 3.48Å; Q38-K42 PolarHBondContact O-N 2.89Å
39V61.6Low68.6Low71 Ų71118.3 Ų118.343%0.4362%0.621SS.*Hα-helixtrans-67.9-34.5178.9178.80000110.4T36 K42 E43T36-V39 WeakPolarHBondContact O-CA 3.07Å; T36-V39 WeakPolarHBondContact O-CB 3.4Å; T36-V39 PolarHBondContact O-N 3.3Å; T36-V39 WeakPolarHBondContact OG1-CG2 3.23Å; V39-K42 PolarHBondContact O-N 2.8Å; V39-E43 VanDerWaalsContact O-CB 3.23Å; V39-E43 WeakPolarHBondContact O-CB 3.47Å; V39-E43 PolarHBondContact O-N 3.46Å
40K71.8Confident71Confident109 Ų109118.4 Ų118.447%0.47461%0.606SS.*Hα-helixtrans-66.4-37.4172.4-61.2-168.8173.2174.60113P35 T36 P37 Q38 R44P35-K40 HydrophobicContact CB-CD 4.33Å; P35-K40 HydrophobicContact CB-CG 3.66Å; P35-K40 VanDerWaalsContact CD-CE 3.49Å; P35-K40 HydrophobicContact CG-CD 4.43Å; P35-K40 HydrophobicContact CG-CG 4.16Å; T36-K40 PolarHBondContact O-N 3.37Å; P37-K40 PolarHBondContact O-N 3.29Å; Q38-K40 VanDerWaalsContact C-N 3.31Å; Q38-K40 PolarHBondContact O-N 3.49Å; K40-R44 WeakPolarHBondContact O-CB 3.49Å; K40-R44 PolarHBondContact O-N 2.82Å
41L74.1Confident73.6Confident105 Ų105111.2 Ų111.255%0.5558%0.578SS.*Hα-helixtrans-68.4-43.3177.3-172.768000110.6P37 Q38 R44 Q45P37-L41 PolarHBondContact O-N 3.48Å; P37-L41 VanDerWaalsContact O-N 3.14Å; Q38-L41 PolarHBondContact O-N 3.48Å; L41-R44 PolarHBondContact O-N 3.08Å; L41-Q45 WeakPolarHBondContact O-CB 3.47Å; L41-Q45 PolarHBondContact O-N 3Å
42K84.5Confident76.2Confident155 Ų155109.6 Ų109.667%0.67457%0.569SS**Hα-helixtrans-65.2-40.3175.9-175.9-178.9166.51790112.5Q38 V39 Q45 K46Q38-K42 WeakPolarHBondContact O-CB 3.48Å; Q38-K42 PolarHBondContact O-N 2.89Å; V39-K42 PolarHBondContact O-N 2.8Å; K42-Q45 PolarHBondContact O-N 3.39Å; K42-K46 PolarHBondContact O-N 2.94Å
43E86.3Confident78.7Confident127 Ų127109.5 Ų109.559%0.59355%0.551SS**Hα-helixtrans-67.6-40.1175.4-171.3177.6-16200111.3V39 K46 F47V39-E43 VanDerWaalsContact O-CB 3.23Å; V39-E43 WeakPolarHBondContact O-CB 3.47Å; V39-E43 PolarHBondContact O-N 3.46Å; E43-K46 PolarHBondContact O-N 2.86Å; E43-F47 PolarHBondContact O-N 3.47Å
44R88.9Confident80.9Confident169 Ų169111.8 Ų111.864%0.63854%0.543SS*.Hα-helixtrans-63.5-41.3172.5-179.1179.7-68.7-169.4-2.8111.9K40 L41 F47 F48K40-R44 WeakPolarHBondContact O-CB 3.49Å; K40-R44 PolarHBondContact O-N 2.82Å; L41-R44 PolarHBondContact O-N 3.08Å; R44-F47 WeakPolarHBondContact O-CB 3.44Å; R44-F47 PolarHBondContact O-N 3.36Å; R44-F48 HydrophobicContact CG-CD2 4.02Å; R44-F48 HydrophobicContact CG-CE2 3.59Å; R44-F48 WeakPolarHBondContact O-CD2 3.15Å; R44-F48 PolarHBondContact O-N 3.47Å
45Q91.1Very high82.9Confident122 Ų122111.5 Ų111.557%0.5754%0.538SS*.Hα-helixtrans-60.2-47.3174.3-179.4-179.9-800110.8L41 K42 F47 F48 E49L41-Q45 WeakPolarHBondContact O-CB 3.47Å; L41-Q45 PolarHBondContact O-N 3Å; K42-Q45 PolarHBondContact O-N 3.39Å; Q45-F47 VanDerWaalsContact C-N 3.26Å; Q45-F47 PolarHBondContact O-N 2.96Å; Q45-F48 PolarHBondContact O-N 3.24Å; Q45-E49 PolarHBondContact O-N 3.14Å
46K94.2Very high84.7Confident129 Ų129112.7 Ų112.756%0.56154%0.539SS*.Hα-helixtrans-57.8-38.4176.3-166.5-142.7170.5-1360112.1K42 E43 E49 E50K42-K46 PolarHBondContact O-N 2.94Å; E43-K46 PolarHBondContact O-N 2.86Å; K46-E49 PolarHBondContact O-N 2.84Å; K46-E50 IonicContact NZ-OE2 2.8Å; K46-E50 PolarHBondContact NZ-OE2 3.47Å; K46-E50 VanDerWaalsContact O-CB 3.27Å; K46-E50 WeakPolarHBondContact O-CB 3.18Å; K46-E50 PolarHBondContact O-N 3.32Å
47F92.4Very high86.3Confident142 Ų142114.5 Ų114.562%0.62354%0.543SS*.Hα-helixtrans-63.8-42.2178.2-177.3-91.9000112.7E43 R44 Q45 A51E43-F47 PolarHBondContact O-N 3.47Å; R44-F47 WeakPolarHBondContact O-CB 3.44Å; R44-F47 PolarHBondContact O-N 3.36Å; Q45-F47 VanDerWaalsContact C-N 3.26Å; Q45-F47 PolarHBondContact O-N 2.96Å; F47-A51 WeakPolarHBondContact O-CB 3.38Å; F47-A51 PolarHBondContact O-N 3.24Å
48F94.4Very high87.7Confident136 Ų136115.1 Ų115.160%0.59654%0.537SS*.Hα-helixtrans-70-37.7177.6-73.6-65.9000112.4R44 Q45 A51 F52R44-F48 HydrophobicContact CG-CD2 4.02Å; R44-F48 HydrophobicContact CG-CE2 3.59Å; R44-F48 WeakPolarHBondContact O-CD2 3.15Å; R44-F48 PolarHBondContact O-N 3.47Å; Q45-F48 PolarHBondContact O-N 3.24Å; F48-A51 PolarHBondContact O-N 2.79Å; F48-F52 WeakPolarHBondContact O-CB 3.33Å; F48-F52 PolarHBondContact O-N 3.18Å
49E94.8Very high89.1Confident131 Ų131116.9 Ų116.961%0.61254%0.538SS*.Hα-helixtrans-65.2-41.8175.1-171.6141.6-138.700111.7Q45 K46 F52 Q53Q45-E49 PolarHBondContact O-N 3.14Å; K46-E49 PolarHBondContact O-N 2.84Å; E49-F52 PolarHBondContact O-N 3.18Å; E49-Q53 WeakPolarHBondContact O-CB 3.33Å; E49-Q53 PolarHBondContact O-N 3.21Å
50E94.8Very high90.2Very high92 Ų92117.4 Ų117.443%0.4354%0.538SS..Hα-helixtrans-65.9-39.7174.6-171.4172.8157.600112.2K46 Q53 Q54K46-E50 IonicContact NZ-OE2 2.8Å; K46-E50 PolarHBondContact NZ-OE2 3.47Å; K46-E50 VanDerWaalsContact O-CB 3.27Å; K46-E50 WeakPolarHBondContact O-CB 3.18Å; K46-E50 PolarHBondContact O-N 3.32Å; E50-Q53 PolarHBondContact O-N 3.42Å; E50-Q54 PolarHBondContact O-N 2.97Å
51A95.5Very high90.4Very high33 Ų33116.7 Ų116.727%0.27355%0.547SS..Hα-helixtrans-65.4-43.3175.500000111.9F47 F48 Q54 D55F47-A51 WeakPolarHBondContact O-CB 3.38Å; F47-A51 PolarHBondContact O-N 3.24Å; F48-A51 PolarHBondContact O-N 2.79Å; A51-Q54 PolarHBondContact O-N 3.33Å; A51-D55 PolarHBondContact O-N 2.8Å
52F95.7Very high90.2Very high128 Ų128117 Ų11756%0.56155%0.554SS**Hα-helixtrans-63.8-42.2176.3-179.7-98000111.8F48 E49 Q54 D55 M56F48-F52 WeakPolarHBondContact O-CB 3.33Å; F48-F52 PolarHBondContact O-N 3.18Å; E49-F52 PolarHBondContact O-N 3.18Å; F52-Q54 VanDerWaalsContact C-N 3.31Å; F52-Q54 PolarHBondContact O-N 3.25Å; F52-D55 PolarHBondContact O-N 3.36Å; F52-M56 HydrophobicContact CD1-CG 4.29Å; F52-M56 HydrophobicContact CD1-SD 4.4Å; F52-M56 HydrophobicContact CE1-CG 3.75Å; F52-M56 HydrophobicContact CE1-SD 3.44Å; F52-M56 WeakPolarHBondContact CE1-SD 3.27Å; F52-M56 HydrophobicContact CE2-CG 4.33Å; F52-M56 HydrophobicContact CZ-CG 3.77Å; F52-M56 HydrophobicContact CZ-SD 3.6Å; F52-M56 WeakPolarHBondContact O-CB 3.4Å; F52-M56 PolarHBondContact O-N 3.44Å
53Q95.6Very high89.2Confident100 Ų100112.5 Ų112.547%0.46755%0.551SS.*Hα-helixtrans-59.3-43175.6-170.163.441.700111.3E49 E50 M56 E57E49-Q53 WeakPolarHBondContact O-CB 3.33Å; E49-Q53 PolarHBondContact O-N 3.21Å; E50-Q53 PolarHBondContact O-N 3.42Å; Q53-M56 PolarHBondContact O-N 3.06Å; Q53-E57 WeakPolarHBondContact CG-OE1 3.49Å; Q53-E57 PolarHBondContact NE2-OE1 2.91Å; Q53-E57 VanDerWaalsContact NE2-OE1 3.17Å; Q53-E57 WeakPolarHBondContact O-CB 3.44Å; Q53-E57 VanDerWaalsContact O-CG 3.27Å; Q53-E57 WeakPolarHBondContact O-CG 3.34Å; Q53-E57 PolarHBondContact O-N 3.5Å
54Q95.6Very high87.9Confident118 Ų118115.2 Ų115.255%0.55156%0.557SS**Hα-helixtrans-63.3-45.4174-78.3-171.9-8.200113E50 A51 F52 M56 E57 Q58E50-Q54 PolarHBondContact O-N 2.97Å; A51-Q54 PolarHBondContact O-N 3.33Å; F52-Q54 VanDerWaalsContact C-N 3.31Å; F52-Q54 PolarHBondContact O-N 3.25Å; Q54-M56 VanDerWaalsContact C-N 3.3Å; Q54-M56 PolarHBondContact O-N 3.19Å; Q54-E57 PolarHBondContact O-N 3.3Å; Q54-Q58 WeakPolarHBondContact O-CB 3.27Å; Q54-Q58 PolarHBondContact O-N 2.94Å
55D93.8Very high86.5Confident103 Ų103113.6 Ų113.655%0.55156%0.56SS**Hα-helixtrans-61-42179.1-82.65.7000111.1A51 F52 Q58 Y59A51-D55 PolarHBondContact O-N 2.8Å; F52-D55 PolarHBondContact O-N 3.36Å; D55-Q58 PolarHBondContact O-N 3.45Å; D55-Y59 WeakPolarHBondContact O-CB 3.13Å; D55-Y59 PolarHBondContact O-N 3.41Å
56M94.1Very high85Confident79 Ų79116.2 Ų116.239%0.38957%0.572SS.*Hα-helixtrans-64.7-46.2175.1-84.4-1485300112.7F52 Q53 Q54 Q58 Y59 L60F52-M56 HydrophobicContact CD1-CG 4.29Å; F52-M56 HydrophobicContact CD1-SD 4.4Å; F52-M56 HydrophobicContact CE1-CG 3.75Å; F52-M56 HydrophobicContact CE1-SD 3.44Å; F52-M56 WeakPolarHBondContact CE1-SD 3.27Å; F52-M56 HydrophobicContact CE2-CG 4.33Å; F52-M56 HydrophobicContact CZ-CG 3.77Å; F52-M56 HydrophobicContact CZ-SD 3.6Å; F52-M56 WeakPolarHBondContact O-CB 3.4Å; F52-M56 PolarHBondContact O-N 3.44Å; Q53-M56 PolarHBondContact O-N 3.06Å; Q54-M56 VanDerWaalsContact C-N 3.3Å; Q54-M56 PolarHBondContact O-N 3.19Å; M56-Q58 VanDerWaalsContact C-N 3.28Å; M56-Q58 PolarHBondContact O-N 3.44Å; M56-Y59 PolarHBondContact O-N 2.91Å; M56-L60 HydrophobicContact CE-CD1 4.47Å; M56-L60 WeakPolarHBondContact O-CG 3.47Å; M56-L60 PolarHBondContact O-N 2.93Å
57E91.4Very high83.3Confident105 Ų105116.9 Ų116.949%0.49158%0.581SS.*Hα-helixtrans-60.9-39.2176.3-76.5172.5-163.100111.3Q53 Q54 S61Q53-E57 WeakPolarHBondContact CG-OE1 3.49Å; Q53-E57 PolarHBondContact NE2-OE1 2.91Å; Q53-E57 VanDerWaalsContact NE2-OE1 3.17Å; Q53-E57 WeakPolarHBondContact O-CB 3.44Å; Q53-E57 VanDerWaalsContact O-CG 3.27Å; Q53-E57 WeakPolarHBondContact O-CG 3.34Å; Q53-E57 PolarHBondContact O-N 3.5Å; Q54-E57 PolarHBondContact O-N 3.3Å; E57-S61 WeakPolarHBondContact O-CB 3.37Å; E57-S61 PolarHBondContact O-N 3.28Å; E57-S61 PolarHBondContact O-OG 3.25Å
58Q90.6Very high81.5Confident123 Ų123115 Ų11558%0.57558%0.581SS**Hα-helixtrans-67.8-44.5176-172.8-1794100112Q54 D55 M56 L60 S61 T62Q54-Q58 WeakPolarHBondContact O-CB 3.27Å; Q54-Q58 PolarHBondContact O-N 2.94Å; D55-Q58 PolarHBondContact O-N 3.45Å; M56-Q58 VanDerWaalsContact C-N 3.28Å; M56-Q58 PolarHBondContact O-N 3.44Å; Q58-L60 VanDerWaalsContact C-N 3.35Å; Q58-L60 PolarHBondContact O-N 2.99Å; Q58-S61 PolarHBondContact O-N 2.91Å; Q58-T62 HydrophobicContact CG-CG2 4.4Å; Q58-T62 WeakPolarHBondContact O-CB 3.41Å; Q58-T62 WeakPolarHBondContact O-CG2 3.12Å; Q58-T62 PolarHBondContact O-N 3.45Å; Q58-T62 PolarHBondContact O-OG1 3.08Å
59Y89.8Confident79.6Confident178 Ų178117.9 Ų117.970%0.69860%0.596SS**Hα-helixtrans-58.9-46.4178176.5-102.4000111.3D55 M56 T62 G63D55-Y59 WeakPolarHBondContact O-CB 3.13Å; D55-Y59 PolarHBondContact O-N 3.41Å; M56-Y59 PolarHBondContact O-N 2.91Å; Y59-T62 PolarHBondContact O-OG1 3.43Å; Y59-G63 PolarHBondContact O-N 3.43Å
60L85.9Confident77.6Confident82 Ų82122.7 Ų122.743%0.42961%0.609SS.*Hα-helixtrans-68.4-46.7176.8-65.8174.1000111.4M56 Q58 T62 G63 Y64M56-L60 HydrophobicContact CE-CD1 4.47Å; M56-L60 WeakPolarHBondContact O-CG 3.47Å; M56-L60 PolarHBondContact O-N 2.93Å; Q58-L60 VanDerWaalsContact C-N 3.35Å; Q58-L60 PolarHBondContact O-N 2.99Å; L60-T62 VanDerWaalsContact C-N 3.26Å; L60-T62 PolarHBondContact O-N 3.17Å; L60-G63 PolarHBondContact O-N 2.94Å; L60-G63 VanDerWaalsContact O-N 3.09Å; L60-Y64 HydrophobicContact CB-CE2 4.48Å; L60-Y64 WeakPolarHBondContact O-CD2 3.34Å; L60-Y64 PolarHBondContact O-N 3.02Å
61S75.7Confident76Confident94 Ų94130.4 Ų130.466%0.65763%0.634SS**Hα-helixtrans-61.2-33-178.2-62.90000113.4E57 Q58E57-S61 WeakPolarHBondContact O-CB 3.37Å; E57-S61 PolarHBondContact O-N 3.28Å; E57-S61 PolarHBondContact O-OG 3.25Å; Q58-S61 PolarHBondContact O-N 2.91Å
62T68.2Low74.5Confident112 Ų112132 Ų13269%0.68765%0.653SS**Hα-helixtrans-89.2-19.1176.758.50000113.2Q58 Y59 L60Q58-T62 HydrophobicContact CG-CG2 4.4Å; Q58-T62 WeakPolarHBondContact O-CB 3.41Å; Q58-T62 WeakPolarHBondContact O-CG2 3.12Å; Q58-T62 PolarHBondContact O-N 3.45Å; Q58-T62 PolarHBondContact O-OG1 3.08Å; Y59-T62 PolarHBondContact O-OG1 3.43Å; L60-T62 VanDerWaalsContact C-N 3.26Å; L60-T62 PolarHBondContact O-N 3.17Å
63G63.6Low72.6Confident59 Ų59131.8 Ų131.861%0.60867%0.668SS**Hα-helixtrans-82.9-15.217800000115.2Y59 L60 L65Y59-G63 PolarHBondContact O-N 3.43Å; L60-G63 PolarHBondContact O-N 2.94Å; L60-G63 VanDerWaalsContact O-N 3.09Å; G63-L65 PolarHBondContact O-N 3.34Å
64Y60.6Low71Confident184 Ų184135.2 Ų135.272%0.72269%0.686SS**  trans-78.883.5173.4-81.1-79.3000111.1L60 Q66L60-Y64 HydrophobicContact CB-CE2 4.48Å; L60-Y64 WeakPolarHBondContact O-CD2 3.34Å; L60-Y64 PolarHBondContact O-N 3.02Å; Y64-Q66 PolarHBondContact O-N 3.43Å
65L59.6Low69.1Low135 Ų135135.3 Ų135.371%0.70770%0.7SS**  trans-62.5107.7157.3-169.265000106.9G63 I67G63-L65 PolarHBondContact O-N 3.34Å; L65-I67 HydrophobicContact CB-CG1 4.24Å; L65-I67 HydrophobicContact CD2-CD1 4.07Å; L65-I67 HydrophobicContact CD2-CG1 3.88Å; L65-I67 HydrophobicContact CG-CG1 3.87Å; L65-I67 PolarHBondContact O-N 3.4Å
66Q59.7Low67.2Low177 Ų177134.8 Ų134.883%0.82770%0.704SS**  trans-63.184.8169.2-86.9179.31.700108.8Y64 T68Y64-Q66 PolarHBondContact O-N 3.43Å; Q66-T68 PolarHBondContact O-N 3.04Å; Q66-T68 VanDerWaalsContact O-N 3.12Å
67I57.9Low65.6Low144 Ų144139.4 Ų139.474%0.73873%0.727SS**  trans-84.852.2166.5-44175.6000108L65L65-I67 HydrophobicContact CB-CG1 4.24Å; L65-I67 HydrophobicContact CD2-CD1 4.07Å; L65-I67 HydrophobicContact CD2-CG1 3.88Å; L65-I67 HydrophobicContact CG-CG1 3.87Å; L65-I67 PolarHBondContact O-N 3.4Å
68T53.4Low64.4Low103 Ų103141 Ų14163%0.63273%0.734SS**SBendtrans-12479.3171.8280000108.3Q66 R70Q66-T68 PolarHBondContact O-N 3.04Å; Q66-T68 VanDerWaalsContact O-N 3.12Å; T68-R70 PolarHBondContact O-N 3.41Å
69E55.5Low63.5Low195 Ų195139.8 Ų139.891%0.91174%0.735SS**  trans45.746.9138.8-157.2-166.4174.500116.5
70R53.3Low62.9Low233 Ų233134.9 Ų134.988%0.87972%0.721SS**  trans-141.483.8167.5-65.5-163.5-161.4-153.511112.4T68 G72T68-R70 PolarHBondContact O-N 3.41Å; R70-G72 PolarHBondContact O-N 3.43Å
71R61.5Low62Low254 Ų254135.6 Ų135.696%0.95873%0.728SS**  trans13.492.6139.1-168.6-165.969.5-153.80115
72G62.3Low61.7Low66 Ų66136.9 Ų136.968%0.6873%0.728SS**  trans171.386.9170.500000115.3R70R70-G72 PolarHBondContact O-N 3.43Å
73S57.1Low61.6Low123 Ų123137.5 Ų137.586%0.8672%0.724SS**  trans41.291.5150.6-61.60000119.1
74M61.5Low62.1Low173 Ų173139.3 Ų139.385%0.85272%0.719SS**SBendtrans-139.399.4143.7-70.6-168.8-73.600108.8
75S55.4Low62.5Low120 Ų120137.1 Ų137.184%0.83972%0.716SS**  trans49.168.6158.4-170.30000117.3M77S75-M77 PolarHBondContact O-N 3.48Å
76S54.8Low62.7Low92 Ų92136.5 Ų136.564%0.64371%0.709SS**  trans-80.590.9157.9-54.90000108.6E78S76-E78 VanDerWaalsContact CB-OE1 3.24Å; S76-E78 WeakPolarHBondContact CB-OE1 3.4Å; S76-E78 PolarHBondContact O-N 3.24Å
77M58.9Low63Low175 Ų175133.4 Ų133.486%0.86270%0.696SS**  trans-76.665.1148-168.1153.368.500106.3S75 V79S75-M77 PolarHBondContact O-N 3.48Å; M77-V79 PolarHBondContact O-N 2.93Å; M77-V79 VanDerWaalsContact O-N 3.15Å
78E66.6Low63.1Low140 Ų140131.9 Ų131.965%0.65469%0.69SS**  trans-73105.2171.557.3-167.3117.200106.4S76 N80S76-E78 VanDerWaalsContact CB-OE1 3.24Å; S76-E78 WeakPolarHBondContact CB-OE1 3.4Å; S76-E78 PolarHBondContact O-N 3.24Å; E78-N80 PolarHBondContact O-N 3.43Å
79V72.6Confident63.4Low97 Ų97133.5 Ų133.559%0.58869%0.694SS**  trans-71.5115164.9177.60000105.2M77 V81 L84M77-V79 PolarHBondContact O-N 2.93Å; M77-V79 VanDerWaalsContact O-N 3.15Å; V79-V81 VanDerWaalsContact C-N 3.34Å; V79-V81 PolarHBondContact O-N 3.3Å; V79-L84 HydrophobicContact CG1-CD2 4.47Å
80N76.8Confident63.6Low75 Ų75130.1 Ų130.140%0.40168%0.68SS.*  trans-64.696.3175.9-62.3-27.8000108.5E78 D82 M83 L84E78-N80 PolarHBondContact O-N 3.43Å; N80-D82 PolarHBondContact O-N 3.47Å; N80-M83 HydrophobicContact CB-CB 4.09Å; N80-M83 HydrophobicContact CB-CE 4.05Å; N80-M83 HydrophobicContact CB-CG 3.8Å; N80-M83 HydrophobicContact CB-SD 4.38Å; N80-M83 WeakPolarHBondContact ND2-CE 3.45Å; N80-M83 PolarHBondContact O-N 3.3Å; N80-L84 PolarHBondContact O-N 2.96Å; N80-L84 VanDerWaalsContact O-N 3.16Å
81V67Low64.1Low97 Ų97124.9 Ų124.959%0.58867%0.669SS**Hα-helixtrans-55.9-33176.8-177.60000110.1V79 M83 L84 E85V79-V81 VanDerWaalsContact C-N 3.34Å; V79-V81 PolarHBondContact O-N 3.3Å; V81-M83 VanDerWaalsContact C-N 3.32Å; V81-M83 PolarHBondContact O-N 3.09Å; V81-L84 CarbonylContact O-C 3.58Å; V81-L84 WeakPolarHBondContact O-CB 3.24Å; V81-L84 PolarHBondContact O-N 3.26Å; V81-L84 VanDerWaalsContact O-N 3.1Å; V81-E85 WeakPolarHBondContact O-CB 3.38Å; V81-E85 PolarHBondContact O-N 3.22Å
82D69.3Low63.9Low120 Ų120120.1 Ų120.164%0.64266%0.659SS**Hα-helixtrans-65.8-28.6176.9-51.5-27.4000114N80 Q86N80-D82 PolarHBondContact O-N 3.47Å; D82-Q86 PolarHBondContact O-N 3Å
83M66.7Low63.7Low126 Ų126121.3 Ų121.362%0.62166%0.657SS**Hα-helixtrans-83.6-28.1172.9-61.3-162.9-39.100111.3N80 V81 M87N80-M83 HydrophobicContact CB-CB 4.09Å; N80-M83 HydrophobicContact CB-CE 4.05Å; N80-M83 HydrophobicContact CB-CG 3.8Å; N80-M83 HydrophobicContact CB-SD 4.38Å; N80-M83 WeakPolarHBondContact ND2-CE 3.45Å; N80-M83 PolarHBondContact O-N 3.3Å; V81-M83 VanDerWaalsContact C-N 3.32Å; V81-M83 PolarHBondContact O-N 3.09Å; M83-M87 PolarHBondContact O-N 2.84Å
84L74.4Confident63.9Low96 Ų96119.6 Ų119.650%0.50364%0.638SS.*Hα-helixtrans-75.4-39177.7-157.869.9000111.5V79 N80 V81 M87 D88V79-L84 HydrophobicContact CG1-CD2 4.47Å; N80-L84 PolarHBondContact O-N 2.96Å; N80-L84 VanDerWaalsContact O-N 3.16Å; V81-L84 CarbonylContact O-C 3.58Å; V81-L84 WeakPolarHBondContact O-CB 3.24Å; V81-L84 PolarHBondContact O-N 3.26Å; V81-L84 VanDerWaalsContact O-N 3.1Å; L84-M87 HydrophobicContact CD1-CE 4.01Å; L84-M87 PolarHBondContact O-N 2.87Å; L84-D88 PolarHBondContact O-N 3.41Å
85E69.4Low63.8Low138 Ų138118.4 Ų118.465%0.64563%0.63SS**Hα-helixtrans-69.6-33.2175.7-173.2174.8-162.800111.8V81 L89V81-E85 WeakPolarHBondContact O-CB 3.38Å; V81-E85 PolarHBondContact O-N 3.22Å; E85-L89 PolarHBondContact O-N 3.41Å
86Q63.6Low64.1Low123 Ų123120.5 Ų120.558%0.57563%0.627SS**Hα-helixtrans-72.9-24.9173.3-83.3-165.892.700114.1D82 M90D82-Q86 PolarHBondContact O-N 3Å; Q86-M90 WeakPolarHBondContact O-CG 3.48Å; Q86-M90 PolarHBondContact O-N 2.65Å
87M64.2Low64.3Low111 Ų111118.5 Ų118.555%0.54762%0.616SS.*Hα-helixtrans-69.7-40.7175.6-169.8178.769.700111.4M83 L84 M90 D91M83-M87 PolarHBondContact O-N 2.84Å; L84-M87 HydrophobicContact CD1-CE 4.01Å; L84-M87 PolarHBondContact O-N 2.87Å; M87-M90 PolarHBondContact O-N 2.88Å; M87-D91 PolarHBondContact O-N 2.93Å
88D60.9Low64.3Low113 Ų113116 Ų11660%0.60461%0.605SS**Hα-helixtrans-70.7-32.8-179.4-160.630000112.5L84L84-D88 PolarHBondContact O-N 3.41Å
89L60.7Low63.9Low137 Ų137113 Ų11372%0.71759%0.593SS**Hα-helixtrans-76.2-27.4177.2-168.859.6000113.1E85E85-L89 PolarHBondContact O-N 3.41Å
90M59Low63.3Low124 Ų124113 Ų11361%0.61159%0.593SS**Hα-helixtrans-78-34.3176.3-75.2-168.9163.100112.6Q86 M87 M92 S93Q86-M90 WeakPolarHBondContact O-CG 3.48Å; Q86-M90 PolarHBondContact O-N 2.65Å; M87-M90 PolarHBondContact O-N 2.88Å; M90-M92 VanDerWaalsContact C-N 3.26Å; M90-M92 PolarHBondContact O-N 3.12Å; M90-S93 PolarHBondContact O-N 3.35Å; M90-S93 VanDerWaalsContact O-N 3.08Å; M90-S93 PolarHBondContact O-OG 3.3Å
91D62.6Low62.5Low122 Ų122117.9 Ų117.965%0.65261%0.612SS**Hα-helixtrans-68.2-22.1-179.9-85.7-4.1000113.7M87M87-D91 PolarHBondContact O-N 2.93Å
92M58.3Low62.3Low155 Ų155119.9 Ų119.976%0.76462%0.618SS**THydrogen-bonded Turntrans-88.4-10.1173.3-66.2-67.5-165.700113.7M90M90-M92 VanDerWaalsContact C-N 3.26Å; M90-M92 PolarHBondContact O-N 3.12Å
93S57.1Low61.7Low90 Ų90121 Ų12163%0.62962%0.619SS**THydrogen-bonded Turntrans-89.1-16-178.274.90000113.8M90 H95M90-S93 PolarHBondContact O-N 3.35Å; M90-S93 VanDerWaalsContact O-N 3.08Å; M90-S93 PolarHBondContact O-OG 3.3Å; S93-H95 PolarHBondContact O-N 3.31Å
94D62.9Low61.2Low87 Ų87119.7 Ų119.747%0.46562%0.623SS.*  trans-81.464.7172.5-169.88.2000111.1E96 A97D94-E96 PolarHBondContact O-N 3.41Å; D94-E96 PolarHBondContact OD1-N 3.33Å; D94-A97 PolarHBondContact O-N 3.09Å; D94-A97 PolarHBondContact OD1-N 2.79Å; D94-A97 WeakPolarHBondContact OD2-CB 3.49Å
95H57.8Low60.5Low148 Ų148118.9 Ų118.969%0.68564%0.637SS**THydrogen-bonded Turntrans-71.4-0.1173.5-159.5-63.9000112S93S93-H95 PolarHBondContact O-N 3.31Å
96E61.7Low59.9Low165 Ų165115.1 Ų115.177%0.77164%0.636SS**THydrogen-bonded Turntrans-89.8-25.4176.6-57.7-162.4138.500112.2D94 L98 D99D94-E96 PolarHBondContact O-N 3.41Å; D94-E96 PolarHBondContact OD1-N 3.33Å; E96-L98 VanDerWaalsContact C-N 3.3Å; E96-L98 PolarHBondContact O-N 3.27Å; E96-D99 PolarHBondContact O-N 3.44Å
97A58.9Low59.5Low49 Ų49117.9 Ų117.941%0.40565%0.649SS.*THydrogen-bonded Turntrans-69.2-23.1174.900000114.5D94D94-A97 PolarHBondContact O-N 3.09Å; D94-A97 PolarHBondContact OD1-N 2.79Å; D94-A97 WeakPolarHBondContact OD2-CB 3.49Å
98L59.7Low59Low123 Ų123118.9 Ų118.964%0.64466%0.657SS**THydrogen-bonded Turntrans-83.7-14.6180-61.2-178.2000113.4E96E96-L98 VanDerWaalsContact C-N 3.3Å; E96-L98 PolarHBondContact O-N 3.27Å
99D58.7Low58.4Low76 Ų76120 Ų12041%0.40666%0.662SS.*THydrogen-bonded Turntrans-90.7-15-175.4-139.9-2.4000113E96 F101 L102 H103E96-D99 PolarHBondContact O-N 3.44Å; D99-F101 VanDerWaalsContact C-N 3.29Å; D99-F101 PolarHBondContact O-N 3.42Å; D99-L102 PolarHBondContact O-N 3.18Å; D99-H103 VanDerWaalsContact CG-CE1 3.4Å; D99-H103 PolarHBondContact O-N 3.3Å; D99-H103 PolarHBondContact O-ND1 3.29Å; D99-H103 IonicContact OD1-CE1 3.33Å; D99-H103 PolarHBondContact OD1-CE1 3.07Å; D99-H103 IonicContact OD1-ND1 3.48Å; D99-H103 PolarHBondContact OD1-ND1 3.49Å; D99-H103 IonicContact OD2-CE1 3.47Å; D99-H103 PolarHBondContact OD2-CE1 3.26Å
100V60.6Low58.2Low97 Ų97118.8 Ų118.859%0.58867%0.666SS**THydrogen-bonded Turntrans-65.1-33177.8177.50000112.3
101F59.1Low57.7Low179 Ų179117.5 Ų117.579%0.78568%0.675SS**THydrogen-bonded Turntrans-74-27.3179.1-77.1-84.7000113.2D99D99-F101 VanDerWaalsContact C-N 3.29Å; D99-F101 PolarHBondContact O-N 3.42Å
102L62.4Low56.8Low139 Ų139116.5 Ų116.573%0.72868%0.683SS**THydrogen-bonded Turntrans-87.2-20.6-179.4-70.5167.3000112.7D99 S104D99-L102 PolarHBondContact O-N 3.18Å; L102-S104 VanDerWaalsContact C-N 3.34Å
103H56.6Low56.1Low142 Ų142114.7 Ų114.766%0.65769%0.686SS**THydrogen-bonded Turntrans-81.5-8.2173.4-71.688.2000114.2D99D99-H103 VanDerWaalsContact CG-CE1 3.4Å; D99-H103 PolarHBondContact O-N 3.3Å; D99-H103 PolarHBondContact O-ND1 3.29Å; D99-H103 IonicContact OD1-CE1 3.33Å; D99-H103 PolarHBondContact OD1-CE1 3.07Å; D99-H103 IonicContact OD1-ND1 3.48Å; D99-H103 PolarHBondContact OD1-ND1 3.49Å; D99-H103 IonicContact OD2-CE1 3.47Å; D99-H103 PolarHBondContact OD2-CE1 3.26Å
104S56.6Low55.7Low100 Ų100116.4 Ų116.470%0.69970%0.695SS**THydrogen-bonded Turntrans-96.212.6177-650000114.3L102 G106L102-S104 VanDerWaalsContact C-N 3.34Å; S104-G106 VanDerWaalsContact C-N 3.32Å; S104-G106 PolarHBondContact O-N 3.42Å
105G59.2Low55.3Low78 Ų78118.5 Ų118.580%0.80471%0.71SS**  trans-79.872.5170.800000112.4
106G56.8Low54.8Low60 Ų60117.8 Ų117.862%0.61972%0.717SS**SBendtrans172.679.3174.700000115.9S104S104-G106 VanDerWaalsContact C-N 3.32Å; S104-G106 PolarHBondContact O-N 3.42Å
107E54.8Low54Low180 Ų180113 Ų11384%0.84171%0.712SS**  trans61.4142153.267.9174.7114.400121.2
108D54Low53.5Low133 Ų133116.9 Ų116.971%0.71173%0.733SS**  trans87130.8158.494.9-101000122.5
109N48.2Very low53.1Low135 Ų135118.5 Ų118.572%0.72274%0.742SS**  trans90.383.1162.1-82.9-77.3000122.4
110S57.9Low52.6Low113 Ų113121.5 Ų121.579%0.7976%0.757SS**  18.1120.5119.6-57.40000119.6
111A48.1Very low52.2Low97 Ų97125.5 Ų125.580%0.80277%0.769SS**  153.7134.510700000114.5
112A43.9Very low51.8Low101 Ų101120.9 Ų120.984%0.83576%0.759SS**  trans76.596.3143.600000120.1
113S44Very low51.2Low116 Ų116124 Ų12481%0.81177%0.767SS**PPolyproline II helixtrans-78.1127.3151.5-177.30000109.5V115S113-V115 PolarHBondContact O-N 2.75Å
114P47.2Very low50.7Low127 Ų127123.3 Ų123.383%0.82577%0.773SS**PPolyproline II helixtrans-83.5119.7175.331.5-28.7000110.5
115V56.1Low50.7Low130 Ų130124.6 Ų124.679%0.78878%0.776SS**PPolyproline II helixtrans-86.1151.3163.4660000109.3S113S113-V115 PolarHBondContact O-N 2.75Å
116T47.1Very low50.8Low134 Ų134128.4 Ų128.482%0.82277%0.773SS**  trans116.3119.6155.6-40.70000115.8
117G43.9Very low51.2Low65 Ų65132 Ų13267%0.6778%0.777SS**  trans-90.6-158.5-178.700000115.5
118P49.7Very low51.6Low130 Ų130128 Ų12884%0.84477%0.769SS**  trans-139.4153.6138.835.7-20.3000114.7
119D50.7Low52.5Low156 Ų156128.9 Ų128.983%0.83477%0.773SS**  trans-62.9123176.3-177.128.1000113.1
120I47.9Very low54Low139 Ų139130.3 Ų130.371%0.71378%0.775SS**  trans-144109.1159.2-52.8176.8000107.6S122I120-S122 PolarHBondContact O-N 3.37Å
121E51.5Low55.2Low182 Ų182130.9 Ų130.985%0.8577%0.773SS**  trans-50.295.2162.6-160.5172.5-158.500109.7
122S51.1Low56.6Low81 Ų81130.1 Ų130.157%0.56676%0.76SS**  trans-142.590.6174.6-88.90000109.1I120 T124I120-S122 PolarHBondContact O-N 3.37Å; S122-T124 WeakPolarHBondContact O-CG2 3.23Å; S122-T124 PolarHBondContact O-N 3.01Å
123F49.7Very low58.5Low206 Ų206128.8 Ų128.890%0.90474%0.742SS**  trans8.573.3158-57-83.9000115.8T125F123-T125 VanDerWaalsContact C-N 3.33Å; F123-T125 PolarHBondContact O-N 3Å; F123-T125 VanDerWaalsContact O-N 3.14Å
124T45.5Very low60Low126 Ų126130.1 Ų130.177%0.77374%0.735SS**  trans-83.382.1168.457.80000107.9S122 E126S122-T124 WeakPolarHBondContact O-CG2 3.23Å; S122-T124 PolarHBondContact O-N 3.01Å; T124-E126 PolarHBondContact O-N 3.39Å
125T57.2Low61.3Low127 Ų127126.9 Ų126.978%0.77972%0.719SS**  trans-69.786.1156.1-54.70000106F123 I127F123-T125 VanDerWaalsContact C-N 3.33Å; F123-T125 PolarHBondContact O-N 3Å; F123-T125 VanDerWaalsContact O-N 3.14Å; T125-I127 PolarHBondContact O-N 2.79Å
126E60.9Low62.2Low159 Ų159125.6 Ų125.674%0.74370%0.704SS**  trans-64.499174.9-174.6-17015500108.3T124 S128T124-E126 PolarHBondContact O-N 3.39Å; E126-S128 PolarHBondContact O-N 2.95Å
127I65.4Low63.2Low135 Ų135124.3 Ų124.369%0.69269%0.692SS**  trans-76.793.8171.3-60.6170.2000106.7T125 L129T125-I127 PolarHBondContact O-N 2.79Å; I127-L129 HydrophobicContact CG2-CD2 3.81Å; I127-L129 HydrophobicContact CG2-CG 4.21Å; I127-L129 PolarHBondContact O-N 3.37Å
128S64.4Low64.4Low95 Ų95129.4 Ų129.466%0.66469%0.691SS**  trans-69.7104.5165.3-95.50000109E126 Q130E126-S128 PolarHBondContact O-N 2.95Å; S128-Q130 PolarHBondContact O-N 2.77Å
129L72.9Confident65Low152 Ų152130 Ų13080%0.79668%0.682SS**  trans-77.297.5169.4-65.2178000108.6I127 V131I127-L129 HydrophobicContact CG2-CD2 3.81Å; I127-L129 HydrophobicContact CG2-CG 4.21Å; I127-L129 PolarHBondContact O-N 3.37Å; L129-V131 PolarHBondContact O-N 3.04Å
130Q79.3Confident65.4Low166 Ų166130.6 Ų130.678%0.77668%0.677SS**PPolyproline II helixtrans-68.1122.7176-173.4174.425.700110.1S128 P132S128-Q130 PolarHBondContact O-N 2.77Å; Q130-P132 WeakPolarHBondContact O-CD 3.36Å
131V82.1Confident66Low124 Ų124129.4 Ų129.475%0.75267%0.672SS**PPolyproline II helixtrans-72.4124.6171.9179.90000108.5L129 T133L129-V131 PolarHBondContact O-N 3.04Å; V131-T133 PolarHBondContact O-N 3.22Å
132P79Confident66.4Low82 Ų82125.2 Ų125.253%0.53266%0.663SS.*PPolyproline II helixtrans-57.5137.4176.2-25.234.6000111.5Q130Q130-P132 WeakPolarHBondContact O-CD 3.36Å
133T82.6Confident66.6Low73 Ų73126.3 Ų126.345%0.44867%0.671SS.*PPolyproline II helixtrans-72.9155.817963.80000111.1V131 A135 E136 L137V131-T133 PolarHBondContact O-N 3.22Å; T133-A135 PolarHBondContact O-N 3.21Å; T133-A135 VanDerWaalsContact O-N 3.11Å; T133-E136 PolarHBondContact N-OE2 3.17Å; T133-E136 PolarHBondContact O-N 3.24Å; T133-E136 WeakPolarHBondContact OG1-CG 3.47Å; T133-E136 PolarHBondContact OG1-OE2 3.28Å; T133-L137 PolarHBondContact O-N 3.23Å
134Q75.2Confident66.9Low144 Ų144123 Ų12367%0.67366%0.661SS**Hα-helixtrans-57.3-29.3179.6-171-178.515.100113.2R138Q134-R138 VanDerWaalsContact O-CG 3.23Å; Q134-R138 WeakPolarHBondContact O-CG 3.46Å; Q134-R138 PolarHBondContact O-N 3.38Å
135A75.4Confident67.3Low58 Ų58122.3 Ų122.348%0.47966%0.662SS.*Hα-helixtrans-67-43.6176.500000111.7T133 L137 R138 H139T133-A135 PolarHBondContact O-N 3.21Å; T133-A135 VanDerWaalsContact O-N 3.11Å; A135-L137 VanDerWaalsContact C-N 3.27Å; A135-L137 PolarHBondContact O-N 3.21Å; A135-R138 PolarHBondContact O-N 3.27Å; A135-H139 PolarHBondContact O-CD2 3.27Å; A135-H139 PolarHBondContact O-N 3.22Å
136E73.9Confident67.1Low103 Ų103121.2 Ų121.248%0.48166%0.659SS.*Hα-helixtrans-64.4-33.9178.5-68.4164.4131.200111.9T133T133-E136 PolarHBondContact N-OE2 3.17Å; T133-E136 PolarHBondContact O-N 3.24Å; T133-E136 WeakPolarHBondContact OG1-CG 3.47Å; T133-E136 PolarHBondContact OG1-OE2 3.28Å
137L69.3Low66.5Low107 Ų107120.4 Ų120.456%0.5667%0.665SS**Hα-helixtrans-67-38.7175.1-123.3120.8000112.5T133 A135 K140T133-L137 PolarHBondContact O-N 3.23Å; A135-L137 VanDerWaalsContact C-N 3.27Å; A135-L137 PolarHBondContact O-N 3.21Å; L137-K140 PolarHBondContact O-N 3.09Å
138R67.7Low65.5Low172 Ų172119.7 Ų119.765%0.64967%0.671SS**Hα-helixtrans-65.5-40.3178.8-67.2-99.4-169.9160.82111.9Q134 A135 K140 L141 S142Q134-R138 VanDerWaalsContact O-CG 3.23Å; Q134-R138 WeakPolarHBondContact O-CG 3.46Å; Q134-R138 PolarHBondContact O-N 3.38Å; A135-R138 PolarHBondContact O-N 3.27Å; R138-K140 VanDerWaalsContact C-N 3.31Å; R138-K140 PolarHBondContact O-N 3.31Å; R138-L141 PolarHBondContact O-N 3.01Å; R138-S142 PolarHBondContact O-N 3.15Å
139H62.8Low64.8Low142 Ų142121.3 Ų121.366%0.65768%0.677SS**Hα-helixtrans-66.8-29.3-179.9-75.5-70000113.5A135A135-H139 PolarHBondContact O-CD2 3.27Å; A135-H139 PolarHBondContact O-N 3.22Å
140K59.7Low63.4Low169 Ų169121.1 Ų121.174%0.73568%0.677SS**Hα-helixtrans-74.8-31.3176.5-70.3-150.1166.6-166.40113.8L137 R138L137-K140 PolarHBondContact O-N 3.09Å; R138-K140 VanDerWaalsContact C-N 3.31Å; R138-K140 PolarHBondContact O-N 3.31Å
141L60.7Low61.8Low114 Ų114118.4 Ų118.460%0.59768%0.676SS**Hα-helixtrans-78-28.5178.3-65.7174.4000112.6R138 S143 L144R138-L141 PolarHBondContact O-N 3.01Å; L141-S143 PolarHBondContact O-N 3.36Å; L141-L144 PolarHBondContact O-N 3.4Å
142S58.8Low60.1Low95 Ų95116.6 Ų116.666%0.66467%0.674SS**Hα-helixtrans-62.4-27173.3-83.90000113.6R138 L144R138-S142 PolarHBondContact O-N 3.15Å; S142-L144 VanDerWaalsContact C-N 3.27Å; S142-L144 PolarHBondContact O-N 3.45Å
143S55.8Low58.4Low104 Ų104118.5 Ų118.573%0.72769%0.69SS**THydrogen-bonded Turntrans-78.4-4.6179.3-58.80000114.7L141L141-S143 PolarHBondContact O-N 3.36Å
144L56.3Low56.6Low136 Ų136124.1 Ų124.171%0.71271%0.711SS**THydrogen-bonded Turntrans-105.51.9-178-63.5178.6000114.3L141 S142 S146L141-L144 PolarHBondContact O-N 3.4Å; S142-L144 VanDerWaalsContact C-N 3.27Å; S142-L144 PolarHBondContact O-N 3.45Å; L144-S146 VanDerWaalsContact C-N 3.31Å; L144-S146 PolarHBondContact O-N 2.79Å; L144-S146 VanDerWaalsContact O-N 3.09Å
145S53Low54.9Low112 Ų112124.5 Ų124.578%0.78372%0.718SS**  trans-8378.2169.3-75.60000110.4
146S54.3Low53.3Low103 Ų103127.5 Ų127.572%0.7273%0.73SS**  trans-101.2107156.7560000108.3L144 C148L144-S146 VanDerWaalsContact C-N 3.31Å; L144-S146 PolarHBondContact O-N 2.79Å; L144-S146 VanDerWaalsContact O-N 3.09Å; S146-C148 PolarHBondContact O-N 3.1Å
147T48.9Very low51.9Low142 Ų142131.4 Ų131.487%0.87175%0.748SS**  trans-64.4105.9165.4400000109
148C43.7Very low50.8Low120 Ų120131.5 Ų131.581%0.81177%0.765SS**  trans-86.9114.7165.352.90000108.8S146 D150S146-C148 PolarHBondContact O-N 3.1Å; C148-D150 PolarHBondContact O-N 3.37Å
149T48.6Very low49.3Very low129 Ų129127.1 Ų127.179%0.79177%0.773SS**  trans-80.6102.7161.945.40000107.4S151T149-S151 PolarHBondContact O-N 3.48Å
150D45.2Very low48.1Very low148 Ų148129.4 Ų129.479%0.79178%0.784SS**  trans-59119170.6-177.657.1000109.7C148C148-D150 PolarHBondContact O-N 3.37Å
151S45.6Very low47Very low110 Ų110129.1 Ų129.177%0.76979%0.79SS**  trans-109.196173.4-66.80000107.7T149 S153T149-S151 PolarHBondContact O-N 3.48Å; S151-S153 PolarHBondContact O-N 3Å
152A44.9Very low46Very low86 Ų86130.1 Ų130.171%0.71180%0.796SS**  trans-81.4109.5173.200000109.9Q154A152-Q154 PolarHBondContact O-N 3.2Å
153S44.7Very low45.2Very low122 Ų122134.7 Ų134.785%0.85381%0.807SS**  trans-71.2114.6163.447.80000109.4S151S151-S153 PolarHBondContact O-N 3Å
154Q44.5Very low44.6Very low191 Ų191136.6 Ų136.689%0.89381%0.809SS**  trans-103.1106.7170.2-161.7178.414.400108.3A152A152-Q154 PolarHBondContact O-N 3.2Å
155D40.1Very low43.8Very low152 Ų152138.9 Ų138.981%0.81382%0.816SS**  trans-90.9153.7173.9-169.831000110.5
156T40.8Very low43.4Very low121 Ų121142.4 Ų142.474%0.74282%0.82SS**  trans-104.7128.9-162.9530000112.7
157E45.4Very low42.7Very low185 Ų185145.7 Ų145.786%0.86482%0.824SS**  trans-161.1118150.156.3-176.8-165.400107.4
158A44.8Very low42.4Very low109 Ų109142.9 Ų142.990%0.90182%0.816SS**  60.583.855.500000112.6
159G37.8Very low42.4Very low80 Ų80145.8 Ų145.883%0.82582%0.817SS**  trans-164.9106172.800000110.9
160E37.1Very low42.1Very low190 Ų190148.4 Ų148.489%0.88882%0.821SS**  trans-74.9139.5177.5-57.4155.7163.100109.9
161D35.9Very low41.7Very low162 Ų162145.3 Ų145.387%0.86682%0.824SS**  178.8129117.7-110.9-22.8000112.2
162D40.5Very low41.2Very low135 Ų135143.7 Ų143.772%0.72282%0.824SS**  trans-58.6137.9163.3-79.8-74000111.6
163E41.3Very low41Very low191 Ų191145.6 Ų145.689%0.89383%0.832SS**  trans-153.696.4138.3-67.4-162.116500109.5
164D42.3Very low40.7Very low145 Ų145143.6 Ų143.678%0.77583%0.831SS**  trans-75.5125.9165.3-74.9-53.1000110.3
165E40.9Very low40.3Very low184 Ų184138.3 Ų138.386%0.8683%0.828SS**  trans-129.587.3160.1-72.5-166.6165.300109.8
166E43.6Very low40.3Very low186 Ų186135.3 Ų135.387%0.86983%0.833SS**  trans-91.6108.9164-72.8-120175.500109.4A168E166-A168 PolarHBondContact O-N 2.86Å
167E41.1Very low40.2Very low171 Ų171132.9 Ų132.980%0.79983%0.832SS**  trans-67.7106.2168.7-80.9-77.7160.600110.2
168A42.4Very low39.9Very low84 Ų84130.8 Ų130.869%0.69483%0.831SS**  trans-89.298.9173.200000110.9E166E166-A168 PolarHBondContact O-N 2.86Å
169E43.6Very low40Very low181 Ų181132.3 Ų132.385%0.84683%0.829SS**  trans-90.9117.9165-83.7-78132.200110.5
170Q42.6Very low40.3Very low184 Ų184132 Ų13286%0.8683%0.826SS**  trans-78.7133.5-177.8-691734500112.2
171G35.3Very low40.5Very low83 Ų83126.9 Ų126.986%0.85682%0.824SS**  86.4123.9126.500000119
172G36.6Very low40.7Very low76 Ų76123 Ų12378%0.78482%0.822SS**  trans150.498.7146.400000117.7
173S39.5Very low41.2Very low125 Ų125120.1 Ų120.187%0.87482%0.824SS**  trans67.4103.2142.6-170.20000120.7
174G39.4Very low41.6Very low80 Ų80114 Ų11483%0.82581%0.813SS**  48.3123.7117.500000121.2
175G35.7Very low42.4Very low80 Ų80117.1 Ų117.183%0.82581%0.814SS**  trans147.2112.7156.600000112.9
176G40.3Very low43.5Very low89 Ų89120 Ų12092%0.91882%0.817SS**  trans-69.9168.9-17200000116.3
177G37.2Very low44.6Very low70 Ų70121.3 Ų121.372%0.72281%0.814SS**  trans146.3117.8161.100000115.2
178V39.8Very low46Very low141 Ų141122.7 Ų122.786%0.85582%0.817SS**  trans84.8116144.8-175.90000118.5
179V48Very low47.2Very low141 Ų141123.9 Ų123.986%0.85582%0.818SS**  trans-32.3135.4158.7-68.50000116
180G42.3Very low48.2Very low73 Ų73121 Ų12175%0.75381%0.814SS**  trans-174114.9166.100000109.9G182G180-G182 PolarHBondContact O-N 3.16Å
181G43.3Very low49.1Very low84 Ų84118.4 Ų118.487%0.86681%0.811SS**  trans-52119.7-164.400000115.8G183G181-G183 PolarHBondContact O-N 3.33Å
182G39.8Very low50.6Low79 Ų79120.4 Ų120.481%0.81481%0.807SS**  trans-67.3108.1166.500000110.3G180 G184G180-G182 PolarHBondContact O-N 3.16Å; G182-G184 PolarHBondContact O-N 3.12Å
183G49.9Very low51.8Low75 Ų75122.1 Ų122.177%0.77380%0.801SS**  trans-65.480.7162.100000109.4G181 R185G181-G183 PolarHBondContact O-N 3.33Å; G183-R185 PolarHBondContact O-N 3.25Å
184G49.1Very low52.8Low63 Ų63121.8 Ų121.865%0.64979%0.794SS**  trans-60.3103.917600000109.7G182 R186G182-G184 PolarHBondContact O-N 3.12Å; G184-R186 PolarHBondContact O-N 3.26Å
185R60.3Low53.5Low211 Ų211125.3 Ų125.380%0.79679%0.793SS**  trans-56.2102.6163.7-66.9177.8126.6-149.8-2.6106.4G183 R187G183-R185 PolarHBondContact O-N 3.25Å; R185-R187 VanDerWaalsContact C-N 3.26Å; R185-R187 PolarHBondContact O-N 3.19Å
186R64.7Low54.9Low243 Ų243128.7 Ų128.792%0.91779%0.792SS**  trans-61.993.6171.8-70.7-171.7176.8-120.62.1107.3G184 K188G184-R186 PolarHBondContact O-N 3.26Å; R186-K188 PolarHBondContact O-N 3.37Å; R186-K188 VanDerWaalsContact O-N 3.08Å
187R66.6Low56.1Low215 Ų215133.6 Ų133.681%0.81179%0.791SS**  trans-60.7108.6167-64.9-87176176.7-1105.4R185R185-R187 VanDerWaalsContact C-N 3.26Å; R185-R187 PolarHBondContact O-N 3.19Å
188K68.8Low57.2Low200 Ų200137.9 Ų137.987%0.8779%0.793SS**PPolyproline II helixtrans-62.5130.4170.4-96.5167.4170.8170.90107.3R186R186-K188 PolarHBondContact O-N 3.37Å; R186-K188 VanDerWaalsContact O-N 3.08Å
189P68.3Low58.4Low109 Ų109138.6 Ų138.671%0.70879%0.787SS**PPolyproline II helixtrans-64.9148.8175.927.1-32.4000110.1V191P189-V191 PolarHBondContact O-N 3.42Å
190P63.8Low59Low119 Ų119137.3 Ų137.377%0.77378%0.779SS**PPolyproline II helixtrans-62.8135.9177.426.2-32.5000110.1V192P190-V192 PolarHBondContact O-N 3.3Å
191V61.4Low59.4Low130 Ų130140.6 Ų140.679%0.78878%0.775SS**  trans-70.9114.6176.3175.90000107.6P189 V193P189-V191 PolarHBondContact O-N 3.42Å; V191-V193 HydrophobicContact CG1-CG2 4.34Å; V191-V193 PolarHBondContact O-N 3.48Å
192V66.9Low59.9Low126 Ų126142.3 Ų142.376%0.76477%0.77SS**  trans-80.3108.7172.1-178.40000107.1P190P190-V192 PolarHBondContact O-N 3.3Å
193V61.8Low60.3Low111 Ų111145.5 Ų145.567%0.67377%0.769SS**  trans-83.4111.4171.4-1790000107.2V191 L195V191-V193 HydrophobicContact CG1-CG2 4.34Å; V191-V193 PolarHBondContact O-N 3.48Å; V193-L195 PolarHBondContact O-N 3.33Å
194T60.9Low60.6Low118 Ų118146.2 Ų146.272%0.72477%0.768SS**  trans-76.4116.4167.751.10000107.6D196T194-D196 PolarHBondContact O-N 3.32Å
195L54.3Low60.8Low155 Ų155148.7 Ų148.781%0.81277%0.77SS**  trans-71.9112.8170-64.2174.7000107.3V193 E197V193-L195 PolarHBondContact O-N 3.33Å; L195-E197 PolarHBondContact O-N 3.11Å
196D65Low60.4Low150 Ų150145 Ų14580%0.80277%0.765SS**  trans-81.2113.9173.5-143.7-120.6000107.2T194 E198T194-D196 PolarHBondContact O-N 3.32Å; D196-E198 PolarHBondContact O-N 3.06Å
197E65.2Low59.9Low192 Ų192136.8 Ų136.890%0.89775%0.749SS**  trans-83.287.7-178.7-55.6-173.3122.900108.9L195L195-E197 PolarHBondContact O-N 3.11Å
198E61.8Low59.4Low160 Ų160132.8 Ų132.875%0.74874%0.744SS**  trans-83.2112.1170.5-168.1179.7101.500109.9D196 V200D196-E198 PolarHBondContact O-N 3.06Å; E198-V200 PolarHBondContact O-N 3.46Å
199E63.9Low58.8Low157 Ų157130.8 Ų130.873%0.73473%0.731SS**  trans-76.498.8174.2-170.4178.1137.800109.8H201E199-H201 PolarHBondContact O-N 2.79Å; E199-H201 IonicContact OE1-CE1 3.18Å; E199-H201 PolarHBondContact OE1-CE1 3.22Å; E199-H201 IonicContact OE1-ND1 3.93Å; E199-H201 IonicContact OE1-NE2 3.97Å
200V61.6Low58.3Low114 Ų114132.2 Ų132.269%0.69173%0.728SS**  trans-81.5111.4176.7178.10000109.8E198E198-V200 PolarHBondContact O-N 3.46Å
201H51.1Low57.9Low142 Ų142131.6 Ų131.666%0.65772%0.718SS**PPolyproline II helixtrans-75.7134.6171-67.6-57.7000111.1E199 D203E199-H201 PolarHBondContact O-N 2.79Å; E199-H201 IonicContact OE1-CE1 3.18Å; E199-H201 PolarHBondContact OE1-CE1 3.22Å; E199-H201 IonicContact OE1-ND1 3.93Å; E199-H201 IonicContact OE1-NE2 3.97Å; H201-D203 PolarHBondContact O-N 2.75Å
202P52.3Low57.7Low120 Ų120131.6 Ų131.678%0.77971%0.71SS**PPolyproline II helixtrans-72129.6176.328.3-32.7000111.2A204P202-A204 PolarHBondContact O-N 3.41Å
203D47.7Very low57.3Low145 Ų145130.2 Ų130.278%0.77570%0.695SS**PPolyproline II helixtrans-66.5119179.7-111.8-19.9000111.5H201 V205H201-D203 PolarHBondContact O-N 2.75Å; D203-V205 PolarHBondContact O-N 3.3Å; D203-V205 VanDerWaalsContact O-N 3.08Å
204A56.5Low57.2Low91 Ų91129 Ų12975%0.75268%0.684SS**G310 helixtrans-76.615.1-176.500000114.8P202 L206P202-A204 PolarHBondContact O-N 3.41Å; A204-L206 VanDerWaalsContact C-N 3.33Å; A204-L206 PolarHBondContact O-N 3.37Å
205V54.5Low57.1Low115 Ų115129.5 Ų129.570%0.69768%0.679SS**G310 helixtrans-78.7-13.6-172.1176.80000113.1D203 A207D203-V205 PolarHBondContact O-N 3.3Å; D203-V205 VanDerWaalsContact O-N 3.08Å; V205-A207 VanDerWaalsContact C-N 3.35Å; V205-A207 PolarHBondContact O-N 3.18Å
206L52.1Low57.5Low134 Ų134125.2 Ų125.270%0.70266%0.662SS**G310 helixtrans-74.9-18.4-177.6-67.8179000114.7A204 D208A204-L206 VanDerWaalsContact C-N 3.33Å; A204-L206 PolarHBondContact O-N 3.37Å; L206-D208 VanDerWaalsContact C-N 3.3Å; L206-D208 PolarHBondContact O-N 3.17Å
207A54.5Low57.5Low70 Ų70120.7 Ų120.758%0.57964%0.642SS**Hα-helixtrans-70.8-21.2-176.400000114.1V205V205-A207 VanDerWaalsContact C-N 3.35Å; V205-A207 PolarHBondContact O-N 3.18Å
208D55.1Low57.7Low131 Ų131119.1 Ų119.170%0.70163%0.628SS**Hα-helixtrans-86.8-17.2-176.5-162.868.5000113.1L206L206-D208 VanDerWaalsContact C-N 3.3Å; L206-D208 PolarHBondContact O-N 3.17Å
209R56.7Low57.9Low157 Ų157116.6 Ų116.659%0.59262%0.62SS**Hα-helixtrans-77.9-31.8-177.1-173.2180162.7105.98.1112.7Q212 E213R209-Q212 PolarHBondContact O-N 2.74Å; R209-E213 IonicContact CZ-OE1 3.5Å; R209-E213 IonicContact NE-OE1 3.52Å; R209-E213 IonicContact NE-OE2 3.72Å; R209-E213 IonicContact NH2-OE1 2.75Å; R209-E213 PolarHBondContact NH2-OE1 2.99Å; R209-E213 PolarHBondContact O-N 3.04Å
210E56.8Low58Low139 Ų139113 Ų11365%0.6561%0.611SS**Hα-helixtrans-67.3-40.7-175.1-48.6-173.516700111.1Q212 D214E210-Q212 VanDerWaalsContact C-N 3.33Å; E210-Q212 PolarHBondContact O-N 3.08Å; E210-D214 PolarHBondContact O-N 3.32Å
211D56.6Low58.4Low107 Ų107113.6 Ų113.657%0.57261%0.606SS**Hα-helixtrans-70.8-26.5178.3-77.5-39.4000113.2Q215D211-Q215 WeakPolarHBondContact O-CG 3.36Å
212Q56.5Low59.3Low129 Ų129113 Ų11360%0.60360%0.604SS**Hα-helixtrans-75-38.7178.9-174.876.293.300112R209 E210 S216R209-Q212 PolarHBondContact O-N 2.74Å; E210-Q212 VanDerWaalsContact C-N 3.33Å; E210-Q212 PolarHBondContact O-N 3.08Å; Q212-S216 PolarHBondContact O-N 3.06Å
213E59Low60.1Low97 Ų97117 Ų11745%0.45360%0.603SS.*Hα-helixtrans-71.4-37.3-179.6-73.1179.413900111.4R209 Q215 S216 S217R209-E213 IonicContact CZ-OE1 3.5Å; R209-E213 IonicContact NE-OE1 3.52Å; R209-E213 IonicContact NE-OE2 3.72Å; R209-E213 IonicContact NH2-OE1 2.75Å; R209-E213 PolarHBondContact NH2-OE1 2.99Å; R209-E213 PolarHBondContact O-N 3.04Å; E213-Q215 PolarHBondContact O-N 3.2Å; E213-S216 PolarHBondContact O-N 3.42Å; E213-S216 PolarHBondContact O-OG 3.33Å; E213-S217 PolarHBondContact O-N 3.48Å; E213-S217 VanDerWaalsContact O-N 3.09Å
214D59.6Low61.1Low85 Ų85120.4 Ų120.446%0.45561%0.605SS.*Hα-helixtrans-69.8-28.6-179.9-116-2.2000113.9E210 S217 R218E210-D214 PolarHBondContact O-N 3.32Å; D214-S217 PolarHBondContact O-OG 3.46Å; D214-S217 VanDerWaalsContact O-OG 3.04Å; D214-R218 WeakPolarHBondContact O-CG 3.43Å; D214-R218 IonicContact OD2-NH2 3.82Å
215Q58.2Low61.6Low129 Ų129123.2 Ų123.260%0.60360%0.603SS**Hα-helixtrans-75.5-36.5173-69.9-176.34600111.9D211 E213 D219D211-Q215 WeakPolarHBondContact O-CG 3.36Å; E213-Q215 PolarHBondContact O-N 3.2Å; Q215-D219 PolarHBondContact O-N 3.2Å
216S62.3Low61.8Low65 Ų65125.8 Ų125.846%0.45561%0.607SS.*Hα-helixtrans-69.8-32.5179.377.70000112.9Q212 E213 C220Q212-S216 PolarHBondContact O-N 3.06Å; E213-S216 PolarHBondContact O-N 3.42Å; E213-S216 PolarHBondContact O-OG 3.33Å; S216-C220 PolarHBondContact O-N 3.4Å; S216-C220 PolarHBondContact O-SG 3.26Å
217S66.4Low61.6Low56 Ų56128.6 Ų128.639%0.39263%0.629SS.*Hα-helixtrans-69.8-39.9179.570.80000111.6E213 D214 C220 E221E213-S217 PolarHBondContact O-N 3.48Å; E213-S217 VanDerWaalsContact O-N 3.09Å; D214-S217 PolarHBondContact O-OG 3.46Å; D214-S217 VanDerWaalsContact O-OG 3.04Å; S217-C220 PolarHBondContact O-N 2.89Å; S217-E221 PolarHBondContact O-N 3.14Å
218R68.9Low62Low159 Ų159131.6 Ų131.660%0.663%0.632SS**Hα-helixtrans-66.3-41.4177.8-68175.4-172.9156.210.8112.4D214 C220 E221 E222D214-R218 WeakPolarHBondContact O-CG 3.43Å; D214-R218 IonicContact OD2-NH2 3.82Å; R218-C220 PolarHBondContact O-N 2.84Å; R218-E221 PolarHBondContact O-N 3.47Å; R218-E222 PolarHBondContact O-N 3.44Å; R218-E222 VanDerWaalsContact O-N 3.07Å
219D66.4Low62.3Low107 Ų107131.6 Ų131.657%0.57263%0.628SS**Hα-helixtrans-63.9-39.6176.8-175.2-96.5000112.1Q215 E221 R223Q215-D219 PolarHBondContact O-N 3.2Å; D219-E221 VanDerWaalsContact C-N 3.32Å; D219-E221 PolarHBondContact O-N 3.28Å; D219-R223 PolarHBondContact O-N 3.46Å
220C66Low62.6Low81 Ų81130.2 Ų130.255%0.54763%0.63SS.*Hα-helixtrans-65.1-34.2175.7-71.10000113S216 S217 R218S216-C220 PolarHBondContact O-N 3.4Å; S216-C220 PolarHBondContact O-SG 3.26Å; S217-C220 PolarHBondContact O-N 2.89Å; R218-C220 PolarHBondContact O-N 2.84Å
221E68.9Low63Low126 Ų126129.6 Ų129.659%0.58963%0.629SS**Hα-helixtrans-78.2-37.4-178.3-153.1-177.7161.900112.3S217 R218 D219 R224 Q225S217-E221 PolarHBondContact O-N 3.14Å; R218-E221 PolarHBondContact O-N 3.47Å; D219-E221 VanDerWaalsContact C-N 3.32Å; D219-E221 PolarHBondContact O-N 3.28Å; E221-R224 PolarHBondContact O-N 3.35Å; E221-Q225 PolarHBondContact O-NE2 2.74Å
222E70.6Confident63.4Low131 Ų131131.1 Ų131.161%0.61263%0.633SS**Hα-helixtrans-65.2-40.4176.1-173.7172.4174.900111.5R218 R224 Q225R218-E222 PolarHBondContact O-N 3.44Å; R218-E222 VanDerWaalsContact O-N 3.07Å; E222-R224 PolarHBondContact O-N 2.89Å; E222-Q225 PolarHBondContact O-N 3.07Å
223R68.3Low63.8Low202 Ų202131.2 Ų131.276%0.76264%0.635SS**Hα-helixtrans-64.9-27.4177.5-163.2175.4-153.8-133.83.4113.5D219D219-R223 PolarHBondContact O-N 3.46Å
224R68.6Low64.2Low217 Ų217133.6 Ų133.682%0.81965%0.648SS**Hα-helixtrans-75.7-21.6177.2-87-176.7162.7165.2-1.6113.6E221 E222E221-R224 PolarHBondContact O-N 3.35Å; E222-R224 PolarHBondContact O-N 2.89Å
225Q67.2Low64.5Low150 Ų150137.4 Ų137.470%0.70166%0.663SS**THydrogen-bonded Turntrans-89.6-4.2-177.9-69.6170.656.400113.3E221 E222E221-Q225 PolarHBondContact O-NE2 2.74Å; E222-Q225 PolarHBondContact O-N 3.07Å
226Q58.6Low65.1Low170 Ų170138.1 Ų138.179%0.79467%0.668SS**THydrogen-bonded Turntrans-106.817.2-176.1-146171.386.800113.7
227V48.6Very low65.3Low193 Ų193144.7 Ų144.7100%1.1769%0.687SS**  trans-112.70174.5179.40000110.8

Retrieved 227 of 227 residues in 80.6 ms (Link to these results)