A0A096N313_PAPAN Loading...

Protein phosphatase inhibitor 2

Inhibitor of protein-phosphatase 1.

AlphaFold DB (A0A2K5KNV1), UniProt , Accession A0A096N313, Species PAPAN (Papio anubis, Olive baboon), Gene n/a, Length 204 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
1M43.3Very low64Low248 Ų248146.2 Ų146.2100%1.22286%0.859SS**  0104.70-69.3-79-151.500107.3
2A48.7Very low65.8Low105 Ų105150.3 Ų150.387%0.86886%0.858SS**  trans-94.9123.8177.700000108.8
3A50.3Low67.5Low97 Ų97144.5 Ų144.580%0.80285%0.851SS**  trans-84.5113.8178.600000109.7T5A3-T5 PolarHBondContact O-N 3.23Å
4S57.9Low69.2Low125 Ų125145.3 Ų145.387%0.87485%0.847SS**  trans-67.9112171.3-780000110.1A6S4-A6 PolarHBondContact O-N 3.26Å
5T60.1Low70.6Confident137 Ų137146.9 Ų146.984%0.8485%0.85SS**  trans-78.599.1168.355.40000108.9A3 S7A3-T5 PolarHBondContact O-N 3.23Å; T5-S7 PolarHBondContact O-N 3.21Å
6A61.8Low71.6Confident85 Ų85148.8 Ų148.870%0.70285%0.845SS**  trans-69108.7170.900000109.3S4 H8S4-A6 PolarHBondContact O-N 3.26Å; A6-H8 PolarHBondContact O-N 3.19Å
7S68.6Low72.4Confident117 Ų117145.2 Ų145.282%0.81882%0.823SS**  trans-68.3110.6174178.90000109.5T5 R9T5-S7 PolarHBondContact O-N 3.21Å; S7-R9 PolarHBondContact O-N 3.48Å
8H73.5Confident72.3Confident179 Ų179148.5 Ų148.583%0.82983%0.826SS**PPolyproline II helixtrans-69.7126.9174-90.6-80.6000110A6A6-H8 PolarHBondContact O-N 3.19Å
9R78.3Confident71.6Confident228 Ų228146.4 Ų146.486%0.8682%0.818SS**PPolyproline II helixtrans-69.6141.4173.6-66.1-178.2-174.1-108.82.9109.8S7S7-R9 PolarHBondContact O-N 3.48Å
10P78.4Confident70.9Confident116 Ų116142.8 Ų142.875%0.75380%0.803SS**PPolyproline II helixtrans-62.9137.2177.223.6-31.7000111.5
11I82.9Confident70Confident171 Ų171141.9 Ų141.988%0.87780%0.801SS**PPolyproline II helixtrans-72.2126.1178.3-58.6171.9000108.5
12K85.9Confident70.4Confident196 Ų196136.4 Ų136.485%0.85278%0.782SS**PPolyproline II helixtrans-90.6120.1177.4-59.2170.2-178.8-176.80108.6
13G88.3Confident70.6Confident74 Ų74136.7 Ų136.776%0.76378%0.777SS**PPolyproline II helixtrans-82.2160.4175.600000113.2
14I90.9Very high70.7Confident156 Ų156137 Ų13780%0.877%0.774SS**  trans-102.8-5177.762.8168.8000114.1K16I14-K16 PolarHBondContact O-N 2.84Å; I14-K16 VanDerWaalsContact O-N 3.15Å
15L90.4Very high69.7Low170 Ų170139.9 Ų139.989%0.8978%0.776SS**  trans-69.3109.5177.6-177.364.3000109.2
16K86.6Confident69Low177 Ų177140.5 Ų140.577%0.7778%0.779SS**  trans-107118.3176.6-62.8154.1-174.9175.70107.6I14I14-K16 PolarHBondContact O-N 2.84Å; I14-K16 VanDerWaalsContact O-N 3.15Å
17N85.3Confident67.9Low87 Ų87140.8 Ų140.847%0.46578%0.781SS.*  trans-97.3139.916858.5-13.6000109T19 S20N17-T19 PolarHBondContact O-N 2.92Å; N17-T19 VanDerWaalsContact O-N 3.08Å; N17-S20 PolarHBondContact ND2-OG 3.4Å; N17-S20 WeakPolarHBondContact OD1-CB 3.28Å; N17-S20 PolarHBondContact OD1-OG 3.21Å
18K69.8Low66.6Low205 Ų205141.2 Ų141.289%0.89178%0.784SS**THydrogen-bonded Turntrans-71.3-1.5-177.2-60.2174.270.8173.70113.3
19T60Low65.1Low108 Ų108137.2 Ų137.266%0.66378%0.782SS**THydrogen-bonded Turntrans-110.6-9.8-17255.30000114.8N17N17-T19 PolarHBondContact O-N 2.92Å; N17-T19 VanDerWaalsContact O-N 3.08Å
20S56.5Low63.7Low74 Ų74135 Ų13552%0.51778%0.782SS.*G310 helixtrans-92-0.2-175.2-75.30000115.7N17 T22N17-S20 PolarHBondContact ND2-OG 3.4Å; N17-S20 WeakPolarHBondContact OD1-CB 3.28Å; N17-S20 PolarHBondContact OD1-OG 3.21Å; S20-T22 PolarHBondContact O-N 3.34Å
21T53.6Low61.9Low124 Ų124138 Ų13876%0.76179%0.786SS**G310 helixtrans-75.2-5.7179-49.20000113.5
22T50.5Low60Low134 Ų134134.9 Ų134.982%0.82278%0.777SS**G310 helixtrans-100.63-177.960.80000115.4S20S20-T22 PolarHBondContact O-N 3.34Å
23S53.9Low58.2Low111 Ų111137.7 Ų137.778%0.77678%0.782SS**SBendtrans-11756.1-179.9-1610000112.6
24S51.8Low56Low104 Ų104137.1 Ų137.173%0.72778%0.776SS**SBendtrans-159.7125.1151.3-154.10000109.4
25M36.7Very low54.1Low185 Ų185133.1 Ų133.191%0.91176%0.762SS**  trans85.682.7179-53.4-166.9168.400116.4
26V44.6Very low52.3Low149 Ų149131.4 Ų131.490%0.90376%0.759SS**  trans-69.7119145.2-750000109
27A38.6Very low50.6Low92 Ų92128.8 Ų128.876%0.7675%0.753SS**  trans177.2102.6137.600000111.9
28S42.3Very low49Very low125 Ų125131 Ų13187%0.87476%0.76SS**  trans65.6126.2145-64.50000123.2
29A42.3Very low48.1Very low96 Ų96128.3 Ų128.379%0.79375%0.751SS**  trans94.7107.6148.700000119.4
30E48.4Very low47.9Very low181 Ų181129.3 Ų129.385%0.84675%0.752SS**  trans20110.8155-72.2178.7116.600120
31Q40Very low47.9Very low179 Ų179130 Ų13084%0.83676%0.756SS**  trans-156.8153.3141.4-88.4-42.8-76.200110.6
32P44.6Very low48.5Very low106 Ų106132.1 Ų132.169%0.68876%0.755SS**  trans-70.1154.7-165.830.8-34.6000111.7G34P32-G34 PolarHBondContact O-N 3.13Å
33R47.4Very low50Low254 Ų254134.1 Ų134.196%0.95875%0.752SS**  trans-55.495.4178.2-64.9178.2172.7-143.2-1.7110.4S35R33-S35 PolarHBondContact O-N 3Å
34G42.2Very low51.5Low63 Ų63134 Ų13465%0.64975%0.752SS**  trans-59.8122.8165.500000108.5P32 V36P32-G34 PolarHBondContact O-N 3.13Å; G34-V36 PolarHBondContact O-N 3.41Å
35S50.3Low53.5Low72 Ų72136.1 Ų136.150%0.50375%0.75SS.*  trans-58.6135.8178.153.80000109.3R33 D37 E38R33-S35 PolarHBondContact O-N 3Å; S35-D37 PolarHBondContact O-N 3.33Å; S35-E38 PolarHBondContact O-N 2.97Å; S35-E38 VanDerWaalsContact O-N 3.13Å
36V52.1Low56.3Low134 Ų134136 Ų13681%0.81274%0.744SS**THydrogen-bonded Turntrans-56.3-5.4171-102.90000113.7G34G34-V36 PolarHBondContact O-N 3.41Å
37D51.7Low58.8Low121 Ų121137.7 Ų137.765%0.64774%0.735SS**THydrogen-bonded Turntrans-79.7-25.1178.5-158.552.7000112.7S35 E39S35-D37 PolarHBondContact O-N 3.33Å; D37-E39 VanDerWaalsContact C-N 3.35Å; D37-E39 PolarHBondContact O-N 2.87Å
38E51.3Low61.5Low133 Ų133138.2 Ų138.262%0.62173%0.725SS**THydrogen-bonded Turntrans-82.5-8.5-171.7-156.6163.3-171.400114.1S35 S41S35-E38 PolarHBondContact O-N 2.97Å; S35-E38 VanDerWaalsContact O-N 3.13Å; E38-S41 PolarHBondContact O-OG 3.44Å
39E52.3Low63.9Low150 Ų150138.1 Ų138.170%0.70171%0.71SS**THydrogen-bonded Turntrans-94.7-20.3176.5-163.9170.7-173.400113.3D37 S41D37-E39 VanDerWaalsContact C-N 3.35Å; D37-E39 PolarHBondContact O-N 2.87Å; E39-S41 PolarHBondContact O-N 3.13Å
40L55.3Low66.3Low129 Ų129140.1 Ų140.168%0.67571%0.705SS**G310 helixtrans-73.4-16177.8-45.2-179.6000112.1K42L40-K42 PolarHBondContact O-N 3.12Å
41S56.7Low68.3Low87 Ų87135.8 Ų135.861%0.60869%0.688SS**G310 helixtrans-83.7-1.9-171.564.10000115.3E38 E39E38-S41 PolarHBondContact O-OG 3.44Å; E39-S41 PolarHBondContact O-N 3.13Å
42K66.1Low70.6Confident170 Ų170130.7 Ų130.774%0.73967%0.665SS**G310 helixtrans-97-1.1-166.7-64.3178.2-175.7173.30115.8L40L40-K42 PolarHBondContact O-N 3.12Å
43K81.1Confident72.6Confident176 Ų176131 Ų13177%0.76566%0.66SS**  trans-146.1122.6168.155.8161.692.9-149.80110.8
44S85.7Confident74.4Confident109 Ų109122.4 Ų122.476%0.76264%0.644SS**  trans-88.4149165.8-170.60000109.7
45Q94.1Very high76.4Confident147 Ų147123.9 Ų123.969%0.68764%0.64SS**  trans-64.9135167.7178.7174.4-37.700108.9
46K95.4Very high77.5Confident184 Ų184127.6 Ų127.680%0.864%0.644SS**  trans-131.8146.9175.6-61.4-176.173-156.30108.8
47W96.1Very high78.1Confident184 Ų184126.3 Ų126.370%0.69763%0.629SS**  trans-91.4150.7171.7-61.5109.5000110.6
48D96.4Very high78.6Confident103 Ų103123 Ų12355%0.55161%0.614SS**  trans-92.493.2171.61798.9000108.6M50 N51 I52D48-M50 PolarHBondContact O-N 3.41Å; D48-M50 VanDerWaalsContact O-N 3.11Å; D48-M50 PolarHBondContact OD1-N 2.93Å; D48-N51 HydrophobicContact CB-CB 4Å; D48-N51 WeakPolarHBondContact O-CA 3.18Å; D48-N51 WeakPolarHBondContact O-CB 3.37Å; D48-N51 PolarHBondContact O-N 3.11Å; D48-I52 PolarHBondContact O-N 2.94Å; D48-I52 VanDerWaalsContact O-N 3.12Å
49E93.5Very high78.8Confident123 Ų123121.8 Ų121.858%0.57563%0.627SS**Hα-helixtrans-56.8-29.1-175.8-54-55.1151.500112.7I52 L53E49-I52 PolarHBondContact O-N 2.77Å; E49-L53 WeakPolarHBondContact O-CB 3.29Å; E49-L53 VanDerWaalsContact O-CG 3.29Å; E49-L53 WeakPolarHBondContact O-CG 3.48Å; E49-L53 PolarHBondContact O-N 2.98Å
50M92Very high79Confident138 Ų138122.2 Ų122.268%0.6863%0.634SS**Hα-helixtrans-69.6-35.9176.4-170.661.462.500111.7D48 A54D48-M50 PolarHBondContact O-N 3.41Å; D48-M50 VanDerWaalsContact O-N 3.11Å; D48-M50 PolarHBondContact OD1-N 2.93Å; M50-A54 VanDerWaalsContact O-CB 3.28Å; M50-A54 WeakPolarHBondContact O-CB 3.24Å; M50-A54 PolarHBondContact O-N 2.78Å
51N89.9Confident79.3Confident90 Ų90121.3 Ų121.348%0.48163%0.625SS.*Hα-helixtrans-69.4-38.8174.4-179.6-104.8000111.9D48 A54 T55D48-N51 HydrophobicContact CB-CB 4Å; D48-N51 WeakPolarHBondContact O-CA 3.18Å; D48-N51 WeakPolarHBondContact O-CB 3.37Å; D48-N51 PolarHBondContact O-N 3.11Å; N51-A54 PolarHBondContact O-N 2.95Å; N51-T55 PolarHBondContact O-N 3.44Å; N51-T55 PolarHBondContact O-OG1 3.31Å
52I89.2Confident79.4Confident71 Ų71122.2 Ų122.236%0.36462%0.622SS.*Hα-helixtrans-61.4-52174.8-55.9-54.2000109.6D48 E49 A54 T55 Y56D48-I52 PolarHBondContact O-N 2.94Å; D48-I52 VanDerWaalsContact O-N 3.12Å; E49-I52 PolarHBondContact O-N 2.77Å; I52-A54 VanDerWaalsContact C-N 3.32Å; I52-A54 PolarHBondContact O-N 2.85Å; I52-T55 PolarHBondContact O-N 3.29Å; I52-T55 VanDerWaalsContact O-N 3.13Å; I52-T55 PolarHBondContact O-OG1 3.33Å; I52-T55 VanDerWaalsContact O-OG1 3.13Å; I52-Y56 WeakPolarHBondContact O-CB 3.49Å; I52-Y56 PolarHBondContact O-N 3.18Å
53L85.7Confident79Confident113 Ų113119.5 Ų119.559%0.59261%0.609SS**Hα-helixtrans-60-38.6177.8-70.5170.5000113.1E49 T55 Y56E49-L53 WeakPolarHBondContact O-CB 3.29Å; E49-L53 VanDerWaalsContact O-CG 3.29Å; E49-L53 WeakPolarHBondContact O-CG 3.48Å; E49-L53 PolarHBondContact O-N 2.98Å; L53-T55 PolarHBondContact O-N 3.48Å; L53-Y56 PolarHBondContact O-N 3.15Å
54A85.1Confident78Confident73 Ų73113.2 Ų113.260%0.60359%0.594SS**Hα-helixtrans-66.8-25.717900000113.5M50 N51 I52M50-A54 VanDerWaalsContact O-CB 3.28Å; M50-A54 WeakPolarHBondContact O-CB 3.24Å; M50-A54 PolarHBondContact O-N 2.78Å; N51-A54 PolarHBondContact O-N 2.95Å; I52-A54 VanDerWaalsContact C-N 3.32Å; I52-A54 PolarHBondContact O-N 2.85Å
55T84.1Confident76.6Confident94 Ų94112.5 Ų112.558%0.57758%0.581SS**Hα-helixtrans-100.3-16.6179.255.80000113.1N51 I52 L53 H57N51-T55 PolarHBondContact O-N 3.44Å; N51-T55 PolarHBondContact O-OG1 3.31Å; I52-T55 PolarHBondContact O-N 3.29Å; I52-T55 VanDerWaalsContact O-N 3.13Å; I52-T55 PolarHBondContact O-OG1 3.33Å; I52-T55 VanDerWaalsContact O-OG1 3.13Å; L53-T55 PolarHBondContact O-N 3.48Å; T55-H57 PolarHBondContact O-N 3.15Å
56Y73.4Confident75Confident151 Ų151112.8 Ų112.859%0.59258%0.584SS**SBendtrans-84.3107.2176.9-168.7-107.6000110.3I52 L53I52-Y56 WeakPolarHBondContact O-CB 3.49Å; I52-Y56 PolarHBondContact O-N 3.18Å; L53-Y56 PolarHBondContact O-N 3.15Å
57H65.4Low73.6Confident106 Ų106113.4 Ų113.449%0.49159%0.587SS.*SBendtrans55.376.1-177.4-52.2121.8000115.1T55 A59T55-H57 PolarHBondContact O-N 3.15Å; H57-A59 PolarHBondContact O-N 3.35Å
58P62.3Low72.1Confident52 Ų52110.6 Ų110.634%0.33858%0.584SS.*  trans-54.8136.5174.2-19.530.4000111D60 K61P58-D60 PolarHBondContact O-N 3.46Å; P58-K61 PolarHBondContact O-N 3.28Å
59A55.4Low70.7Confident107 Ų107113.5 Ų113.588%0.88460%0.599SS**THydrogen-bonded Turntrans-53.1-24.1-174.900000114.7H57 K61H57-A59 PolarHBondContact O-N 3.35Å; A59-K61 VanDerWaalsContact C-N 3.33Å
60D57.1Low69.9Low159 Ų159114.3 Ų114.385%0.8560%0.603SS**THydrogen-bonded Turntrans-89.44.1179.7-55.7-29.1000113.6P58P58-D60 PolarHBondContact O-N 3.46Å
61K59.8Low69.1Low111 Ų111113.1 Ų113.148%0.48361%0.606SS.*  trans-134.777.8-174.8-61.9-174.7-173.6175.20110.5P58 A59 Y63P58-K61 PolarHBondContact O-N 3.28Å; A59-K61 VanDerWaalsContact C-N 3.33Å; K61-Y63 HydrophobicContact CB-CD2 4.19Å; K61-Y63 HydrophobicContact CB-CE2 3.82Å; K61-Y63 HydrophobicContact CD-CE1 4.33Å; K61-Y63 HydrophobicContact CD-CE2 4.26Å; K61-Y63 WeakPolarHBondContact CD-OH 3.24Å; K61-Y63 PolarHBondContact O-N 2.96Å
62D58.9Low68.3Low105 Ų105113.5 Ų113.556%0.56162%0.616SS**  trans-76.597.5153.6-176.715000107.2G64 L65D62-G64 PolarHBondContact O-N 3.39Å; D62-L65 WeakPolarHBondContact OD1-CB 3.34Å; D62-L65 WeakPolarHBondContact OD2-CB 3.39Å
63Y58.7Low67.4Low114 Ų114114.5 Ų114.545%0.44763%0.625SS.*  trans-69.883.2-178.5-71.7-81000109.7K61K61-Y63 HydrophobicContact CB-CD2 4.19Å; K61-Y63 HydrophobicContact CB-CE2 3.82Å; K61-Y63 HydrophobicContact CD-CE1 4.33Å; K61-Y63 HydrophobicContact CD-CE2 4.26Å; K61-Y63 WeakPolarHBondContact CD-OH 3.24Å; K61-Y63 PolarHBondContact O-N 2.96Å
64G60.5Low67.3Low44 Ų44115.1 Ų115.145%0.45464%0.636SS.*SBendtrans96.2-1.3162.200000116.9D62 M66D62-G64 PolarHBondContact O-N 3.39Å; G64-M66 VanDerWaalsContact C-N 3.33Å; G64-M66 PolarHBondContact O-N 3.13Å
65L54.9Low66.2Low93 Ų93122.1 Ų122.149%0.48765%0.648SS.*  trans-89.515.6178.1-102.784.6000115D62 K67D62-L65 WeakPolarHBondContact OD1-CB 3.34Å; D62-L65 WeakPolarHBondContact OD2-CB 3.39Å; L65-K67 PolarHBondContact O-N 2.84Å
66M61.1Low65.1Low153 Ų153123.5 Ų123.575%0.75465%0.648SS**  trans-63.7102.5169.5-97.4-172.665.100109.9G64 I68G64-M66 VanDerWaalsContact C-N 3.33Å; G64-M66 PolarHBondContact O-N 3.13Å; M66-I68 VanDerWaalsContact C-N 3.34Å; M66-I68 PolarHBondContact O-N 2.68Å
67K66.3Low64Low198 Ų198120.4 Ų120.486%0.86165%0.649SS**  trans-64.899.1160.3-52.5-65.3-81.9-173.20106.1L65 D69L65-K67 PolarHBondContact O-N 2.84Å; K67-D69 PolarHBondContact O-N 3.24Å
68I65.2Low63.3Low124 Ų124122.7 Ų122.764%0.63666%0.661SS**  trans-64.2126.5167-40.6173.4000104.9M66 E70M66-I68 VanDerWaalsContact C-N 3.34Å; M66-I68 PolarHBondContact O-N 2.68Å; I68-E70 HydrophobicContact CB-CG 4.45Å; I68-E70 PolarHBondContact O-N 3.08Å
69D66.8Low62.6Low164 Ų164128.5 Ų128.588%0.87769%0.686SS**  trans-73.672.7177.3-153.113.1000107.8K67K67-D69 PolarHBondContact O-N 3.24Å
70E76.1Confident62Low140 Ų140126.6 Ų126.665%0.65468%0.676SS**  trans-63.4129.2173-68.5-174.6-17500107.2I68 S72I68-E70 HydrophobicContact CB-CG 4.45Å; I68-E70 PolarHBondContact O-N 3.08Å; E70-S72 PolarHBondContact O-N 3.5Å
71P75.1Confident61.9Low113 Ų113126.6 Ų126.673%0.73468%0.677SS**  trans-55.2130.4177.923.1-32.4000108.7T73P71-T73 PolarHBondContact O-N 2.99Å
72S74.4Confident61.2Low99 Ų99128.1 Ų128.169%0.69269%0.69SS**  trans-45112.4-177.8-177.30000110E70E70-S72 PolarHBondContact O-N 3.5Å
73T70.2Confident60.8Low91 Ų91130.4 Ų130.456%0.55870%0.697SS**  trans-64.4134.3173.759.90000107P71 Y75 H76P71-T73 PolarHBondContact O-N 2.99Å; T73-Y75 PolarHBondContact O-N 3.03Å; T73-H76 PolarHBondContact O-N 3.19Å
74P81.7Confident60.1Low126 Ų126132.6 Ų132.682%0.81872%0.717SS**THydrogen-bonded Turntrans-57.65.4-170.7-29.535.5000118
75Y62.2Low59.6Low221 Ų221135.1 Ų135.187%0.86773%0.733SS**THydrogen-bonded Turntrans-113.912.1-179-69-78.9000114.6T73 S77T73-Y75 PolarHBondContact O-N 3.03Å; Y75-S77 PolarHBondContact O-N 2.8Å; Y75-S77 VanDerWaalsContact O-N 3.08Å
76H61Low59Low122 Ų122136.7 Ų136.757%0.56575%0.75SS**  trans-81.588.5176.3-163.855.7000112.2T73 M78T73-H76 PolarHBondContact O-N 3.19Å; H76-M78 WeakPolarHBondContact CD2-CE 3.32Å; H76-M78 VanDerWaalsContact CD2-SD 3.53Å; H76-M78 WeakPolarHBondContact NE2-CE 3.17Å; H76-M78 PolarHBondContact NE2-SD 3.08Å
77S50.4Low58.2Low87 Ų87134.6 Ų134.661%0.60875%0.751SS**  trans-88.8106.6171.2167.70000109.9Y75 M79Y75-S77 PolarHBondContact O-N 2.8Å; Y75-S77 VanDerWaalsContact O-N 3.08Å; S77-M79 PolarHBondContact O-N 3.46Å
78M51.7Low56.8Low153 Ų153131.9 Ų131.975%0.75475%0.746SS**  trans-66.593.6165.9-44.4-69.7-169.800108.9H76H76-M78 WeakPolarHBondContact CD2-CE 3.32Å; H76-M78 VanDerWaalsContact CD2-SD 3.53Å; H76-M78 WeakPolarHBondContact NE2-CE 3.17Å; H76-M78 PolarHBondContact NE2-SD 3.08Å
79M47.4Very low55.9Low175 Ų175130.9 Ų130.986%0.86275%0.746SS**  trans-99.7129.8152.7-67.5-79-16200104.4S77S77-M79 PolarHBondContact O-N 3.46Å
80G43.2Very low54.7Low66 Ų66132.3 Ų132.368%0.6875%0.747SS**  cis-170.7153.7-3.100000104.4D82G80-D82 PolarHBondContact O-N 2.88Å
81D55.1Low53.1Low160 Ų160131.1 Ų131.186%0.85675%0.749SS**  trans-72.8111.7172.8-175.635.8000109.2
82D44Very low51.9Low142 Ų142132.8 Ų132.876%0.75976%0.758SS**  trans-147116155.36314.3000108.5G80G80-D82 PolarHBondContact O-N 2.88Å
83E51.5Low50.9Low153 Ų153135.9 Ų135.972%0.71576%0.762SS**  50.591.277.4-58.2-69.8-177.900112
84D43.4Very low50.2Low161 Ų161136 Ų13686%0.86177%0.772SS**  -176.1126.3120.5-93.5-32.2000113.5
85A50.5Low49.3Very low97 Ų97135.9 Ų135.980%0.80276%0.761SS**  trans-67.413316500000110.8
86C42.8Very low50Low125 Ų125127.3 Ų127.385%0.84574%0.736SS**  trans-134.179.4156.4-156.50000109.3
87S44.5Very low50.7Low110 Ų110126.3 Ų126.377%0.76974%0.741SS**  trans-77.5154.8151.5179.10000108.4
88D36.5Very low52Low140 Ų140128 Ų12875%0.74974%0.743SS**  trans88.5129.4171.3-124.116.4000113.3
89T46.2Very low53.5Low104 Ų104124.4 Ų124.464%0.63873%0.726SS**  cis-161.5119.82843.50000107.8
90E40.6Very low55.1Low193 Ų193119.9 Ų119.990%0.90271%0.705SS**  trans-101.299.4157.9-165.7171.2130.700107.8T92E90-T92 PolarHBondContact O-N 3.32Å; E90-T92 VanDerWaalsContact O-N 3.16Å
91T42.5Very low57.1Low115 Ų115119.5 Ų119.571%0.70670%0.695SS**  trans-45.2115.517122.30000110.9E93T91-E93 PolarHBondContact O-N 3.36Å
92T50.5Low58.4Low148 Ų148119.8 Ų119.891%0.90869%0.689SS**  trans-63.679.3160.146.80000109.1E90 A94E90-T92 PolarHBondContact O-N 3.32Å; E90-T92 VanDerWaalsContact O-N 3.16Å; T92-A94 PolarHBondContact O-N 2.99Å
93E53.4Low60.3Low165 Ų165118.9 Ų118.977%0.77168%0.678SS**  trans-77.6112.5172.7-161.9-179.2-16500108T91 M95T91-E93 PolarHBondContact O-N 3.36Å; E93-M95 PolarHBondContact O-N 3.06Å
94A56.1Low61.7Low93 Ų93117.2 Ų117.277%0.76967%0.674SS**  trans-59.5112.3178.500000110T92 A96T92-A94 PolarHBondContact O-N 2.99Å; A94-A96 PolarHBondContact O-N 3.02Å
95M61.2Low63.7Low123 Ų123112.6 Ų112.661%0.60666%0.658SS**  trans-63.4100.2177.8-75.8-174.4150.100110.7E93 L100E93-M95 PolarHBondContact O-N 3.06Å; M95-L100 HydrophobicContact CB-CD1 4.23Å
96A78.4Confident65.1Low41 Ų41111.7 Ų111.734%0.33965%0.65SS.*  trans-63.8144172.500000111A94 D98 I99 L100A94-A96 PolarHBondContact O-N 3.02Å; A96-D98 PolarHBondContact O-N 3.25Å; A96-D98 VanDerWaalsContact O-N 3.14Å; A96-I99 HydrophobicContact CB-CD1 4Å; A96-I99 HydrophobicContact CB-CG1 4.17Å; A96-I99 WeakPolarHBondContact O-CB 3.4Å; A96-I99 PolarHBondContact O-N 2.83Å; A96-L100 PolarHBondContact O-N 3.16Å
97P75.1Confident66.5Low101 Ų101108.2 Ų108.266%0.65663%0.631SS**Hα-helixtrans-58.6-30.3-17619.5-30.6000113.5I99 L100 A101P97-I99 VanDerWaalsContact C-N 3.33Å; P97-I99 PolarHBondContact O-N 3.02Å; P97-L100 WeakPolarHBondContact O-CB 3.39Å; P97-L100 PolarHBondContact O-N 3.42Å; P97-A101 PolarHBondContact O-N 2.95Å
98D78.6Confident68Low124 Ų124111.1 Ų111.166%0.66363%0.632SS**Hα-helixtrans-69.6-30.8177.4-62-17000112.8A96 K102A96-D98 PolarHBondContact O-N 3.25Å; A96-D98 VanDerWaalsContact O-N 3.14Å; D98-K102 PolarHBondContact O-N 3.15Å; D98-K102 VanDerWaalsContact O-N 3.11Å
99I82.3Confident69.3Low77 Ų77107.9 Ų107.940%0.39563%0.632SS.*Hα-helixtrans-71.1-38.8174.8-56.9174000109.3A96 P97 K102 K103A96-I99 HydrophobicContact CB-CD1 4Å; A96-I99 HydrophobicContact CB-CG1 4.17Å; A96-I99 WeakPolarHBondContact O-CB 3.4Å; A96-I99 PolarHBondContact O-N 2.83Å; P97-I99 VanDerWaalsContact C-N 3.33Å; P97-I99 PolarHBondContact O-N 3.02Å; I99-K102 PolarHBondContact O-N 3.05Å; I99-K103 HydrophobicContact CG2-CD 4.49Å; I99-K103 WeakPolarHBondContact O-CG 3.45Å; I99-K103 PolarHBondContact O-N 3.42Å
100L81.3Confident70.3Confident80 Ų80109.5 Ų109.542%0.41964%0.636SS.*Hα-helixtrans-62.9-46.8174.1-108.6143.8000111.7M95 A96 P97 K102 K103 L104M95-L100 HydrophobicContact CB-CD1 4.23Å; A96-L100 PolarHBondContact O-N 3.16Å; P97-L100 WeakPolarHBondContact O-CB 3.39Å; P97-L100 PolarHBondContact O-N 3.42Å; L100-K102 PolarHBondContact O-N 2.94Å; L100-K103 PolarHBondContact O-N 3.39Å; L100-L104 WeakPolarHBondContact O-CG 3.42Å; L100-L104 PolarHBondContact O-N 3.45Å
101A84.5Confident71.4Confident58 Ų58108.3 Ų108.348%0.47963%0.63SS.*Hα-helixtrans-60.8-43177.300000112.2P97 K103 L104 A105P97-A101 PolarHBondContact O-N 2.95Å; A101-K103 VanDerWaalsContact C-N 3.35Å; A101-K103 PolarHBondContact O-N 2.9Å; A101-L104 PolarHBondContact O-N 3.3Å; A101-A105 WeakPolarHBondContact O-CB 3.32Å; A101-A105 PolarHBondContact O-N 3.36Å
102K83.6Confident72.3Confident166 Ų166107.8 Ų107.872%0.72263%0.629SS**Hα-helixtrans-62.2-39.7174.3-82.9178.8177.3174.50112.7D98 I99 L100 A106D98-K102 PolarHBondContact O-N 3.15Å; D98-K102 VanDerWaalsContact O-N 3.11Å; I99-K102 PolarHBondContact O-N 3.05Å; L100-K102 PolarHBondContact O-N 2.94Å; K102-A106 WeakPolarHBondContact O-CB 3.45Å; K102-A106 PolarHBondContact O-N 2.95Å
103K82.8Confident72.5Confident123 Ų123108.1 Ų108.154%0.53562%0.618SS.*Hα-helixtrans-66.5-40.5177-77-179.9170.9-175.70112.1I99 L100 A101 A106 A107I99-K103 HydrophobicContact CG2-CD 4.49Å; I99-K103 WeakPolarHBondContact O-CG 3.45Å; I99-K103 PolarHBondContact O-N 3.42Å; L100-K103 PolarHBondContact O-N 3.39Å; A101-K103 VanDerWaalsContact C-N 3.35Å; A101-K103 PolarHBondContact O-N 2.9Å; K103-A106 PolarHBondContact O-N 3.24Å; K103-A107 PolarHBondContact O-N 3.25Å; K103-A107 VanDerWaalsContact O-N 3.14Å
104L82Confident72.5Confident118 Ų118109.1 Ų109.162%0.61862%0.616SS**Hα-helixtrans-65.4-45.8176.4-70173000111.7L100 A101 A106 A107 E108L100-L104 WeakPolarHBondContact O-CG 3.42Å; L100-L104 PolarHBondContact O-N 3.45Å; A101-L104 PolarHBondContact O-N 3.3Å; L104-A106 VanDerWaalsContact C-N 3.29Å; L104-A106 PolarHBondContact O-N 3.49Å; L104-A107 PolarHBondContact O-N 2.78Å; L104-A107 VanDerWaalsContact O-N 3.08Å; L104-E108 PolarHBondContact O-N 2.86Å; L104-E108 VanDerWaalsContact O-N 3.11Å
105A84.8Confident72.1Confident63 Ų63114.9 Ų114.952%0.52162%0.618SS.*Hα-helixtrans-62.6-34.9176.300000112.6A101 A107A101-A105 WeakPolarHBondContact O-CB 3.32Å; A101-A105 PolarHBondContact O-N 3.36Å; A105-A107 VanDerWaalsContact C-N 3.31Å; A105-A107 PolarHBondContact O-N 3.4Å
106A79.6Confident71.3Confident79 Ų79112.9 Ų112.965%0.65361%0.608SS**Hα-helixtrans-70.7-25.6175.100000113.2K102 K103 L104K102-A106 WeakPolarHBondContact O-CB 3.45Å; K102-A106 PolarHBondContact O-N 2.95Å; K103-A106 PolarHBondContact O-N 3.24Å; L104-A106 VanDerWaalsContact C-N 3.29Å; L104-A106 PolarHBondContact O-N 3.49Å
107A73.1Confident69.5Low52 Ų52117.4 Ų117.443%0.4362%0.623SS.*Hα-helixtrans-88.2-14.7178.100000113.5K103 L104 A105 G109 L110K103-A107 PolarHBondContact O-N 3.25Å; K103-A107 VanDerWaalsContact O-N 3.14Å; L104-A107 PolarHBondContact O-N 2.78Å; L104-A107 VanDerWaalsContact O-N 3.08Å; A105-A107 VanDerWaalsContact C-N 3.31Å; A105-A107 PolarHBondContact O-N 3.4Å; A107-G109 PolarHBondContact O-N 2.7Å; A107-L110 PolarHBondContact O-N 3.03Å; A107-L110 VanDerWaalsContact O-N 3.14Å
108E74.1Confident68.3Low171 Ų171121.9 Ų121.980%0.79964%0.635SS**THydrogen-bonded Turntrans-66.3-2-174.7-164.6170.9-177.100114.8L104L104-E108 PolarHBondContact O-N 2.86Å; L104-E108 VanDerWaalsContact O-N 3.11Å
109G65.7Low66.7Low72 Ų72124.4 Ų124.474%0.74264%0.642SS**THydrogen-bonded Turntrans-120.22.7175.600000115A107A107-G109 PolarHBondContact O-N 2.7Å
110L66.5Low64.6Low138 Ų138125.7 Ų125.772%0.72365%0.647SS**SBendtrans-91.8116.7177.5-63.7176000108.4A107A107-L110 PolarHBondContact O-N 3.03Å; A107-L110 VanDerWaalsContact O-N 3.14Å
111E62.7Low63Low168 Ų168126.5 Ų126.579%0.78566%0.659SS**PPolyproline II helixtrans-53.4141.8171.2-77.2-136.212900109.8K113E111-K113 PolarHBondContact O-N 2.91Å
112P61.2Low61.3Low104 Ų104126 Ų12668%0.67565%0.653SS**PPolyproline II helixtrans-50.1122.1176.9-24.932.7000110.1Y114P112-Y114 PolarHBondContact O-N 3.03Å
113K56.6Low59.3Low154 Ų154120 Ų12067%0.6764%0.637SS**G310 helixtrans-55.46.5177.3-88.3179.3170.6-172.40115.3E111 R115 I116E111-K113 PolarHBondContact O-N 2.91Å; K113-R115 PolarHBondContact O-N 2.79Å; K113-R115 VanDerWaalsContact O-N 3.13Å; K113-I116 PolarHBondContact O-N 3.06Å
114Y52.6Low57.6Low186 Ų186122.5 Ų122.573%0.72965%0.651SS**G310 helixtrans-52.8-31.6174.4138.9-105000112.5P112 I116P112-Y114 PolarHBondContact O-N 3.03Å; Y114-I116 VanDerWaalsContact C-N 3.33Å; Y114-I116 PolarHBondContact O-N 2.94Å
115R48.6Very low56.1Low215 Ų215124.1 Ų124.181%0.81166%0.655SS**G310 helixtrans-79.8-9.8179.7-150.4169.9-159.1171.45115K113K113-R115 PolarHBondContact O-N 2.79Å; K113-R115 VanDerWaalsContact O-N 3.13Å
116I43.9Very low54.4Low81 Ų81121.6 Ų121.642%0.41563%0.633SS.*THydrogen-bonded Turntrans-102.8-7.1-179.8-42.8-179.1000111K113 Y114 E118 Q119 E120K113-I116 PolarHBondContact O-N 3.06Å; Y114-I116 VanDerWaalsContact C-N 3.33Å; Y114-I116 PolarHBondContact O-N 2.94Å; I116-E118 PolarHBondContact O-N 3.29Å; I116-E118 VanDerWaalsContact O-N 3.13Å; I116-Q119 PolarHBondContact O-N 2.89Å; I116-E120 WeakPolarHBondContact CB-OE1 3.4Å; I116-E120 HydrophobicContact CG2-CG 4.17Å; I116-E120 WeakPolarHBondContact CG2-OE1 3.27Å; I116-E120 WeakPolarHBondContact O-CG 3.42Å; I116-E120 PolarHBondContact O-N 3.28Å
117Q40.6Very low53.3Low136 Ų136121.7 Ų121.764%0.63663%0.629SS**Hα-helixtrans-64.9-23-175.7-161.9167.425.200114.3Q119 S121Q117-Q119 VanDerWaalsContact C-N 3.26Å; Q117-Q119 PolarHBondContact O-N 3.5Å; Q117-S121 PolarHBondContact O-N 2.89Å
118E49.6Very low52.8Low195 Ų195126.6 Ų126.691%0.91165%0.648SS**Hα-helixtrans-71.1-20.1175-64.9-169.4173.400113.2I116I116-E118 PolarHBondContact O-N 3.29Å; I116-E118 VanDerWaalsContact O-N 3.13Å
119Q45.2Very low52.4Low176 Ų176121.3 Ų121.382%0.82263%0.625SS**Hα-helixtrans-99.1-19.2-177.4-161.5172-34.100113.3I116 Q117I116-Q119 PolarHBondContact O-N 2.89Å; Q117-Q119 VanDerWaalsContact C-N 3.26Å; Q117-Q119 PolarHBondContact O-N 3.5Å
120E38.7Very low53Low104 Ų104119.5 Ų119.549%0.48660%0.601SS.*Hα-helixtrans-113.6-1.3-175.728.9-178.8115.500114.4I116 S122 G123I116-E120 WeakPolarHBondContact CB-OE1 3.4Å; I116-E120 HydrophobicContact CG2-CG 4.17Å; I116-E120 WeakPolarHBondContact CG2-OE1 3.27Å; I116-E120 WeakPolarHBondContact O-CG 3.42Å; I116-E120 PolarHBondContact O-N 3.28Å; E120-S122 PolarHBondContact O-N 3.43Å; E120-G123 PolarHBondContact O-N 2.71Å
121S46.5Very low53.7Low98 Ų98118.3 Ų118.369%0.68560%0.602SS**THydrogen-bonded Turntrans-62.6-3.5172.8-170.60000114.3Q117Q117-S121 PolarHBondContact O-N 2.89Å
122S49.1Very low54.4Low48 Ų48116 Ų11634%0.33659%0.59SS.*THydrogen-bonded Turntrans-89-1.5173.9-172.60000113.6E120 D126E120-S122 PolarHBondContact O-N 3.43Å; S122-D126 WeakPolarHBondContact O-CB 3.47Å
123G42.3Very low55.3Low39 Ų39113.7 Ų113.740%0.40257%0.571SS.*SBendtrans-80.7-41.7-171.100000115.4E120 S127E120-G123 PolarHBondContact O-N 2.71Å; G123-S127 PolarHBondContact O-OG 3.1Å; G123-S127 VanDerWaalsContact O-OG 3.05Å
124E46.2Very low56.6Low176 Ų176111.2 Ų111.282%0.82256%0.557SS**SBendtrans-87.4-47.9-164.6-167.6160.6-174.200113.3D126E124-D126 PolarHBondContact O-N 2.66Å
125E50.1Low58.2Low152 Ų152105.9 Ų105.971%0.7154%0.539SS*.THydrogen-bonded Turntrans-73.9-10179.1-68.5-172.7158.600114.8
126D50.6Low60.1Low9 Ų9101.9 Ų101.95%0.04853%0.527CS..THydrogen-bonded Turntrans-99.7-4.2-172.3-151.437.5000111.1S122 E124 L129 R134S122-D126 WeakPolarHBondContact O-CB 3.47Å; E124-D126 PolarHBondContact O-N 2.66Å; D126-L129 WeakPolarHBondContact OD1-CD1 3.47Å; D126-R134 VanDerWaalsContact CG-NE 3.31Å; D126-R134 PolarHBondContact O-NH1 3.18Å; D126-R134 IonicContact OD1-NE 3.96Å; D126-R134 WeakPolarHBondContact OD2-CG 3.31Å; D126-R134 IonicContact OD2-CZ 3.19Å; D126-R134 IonicContact OD2-NE 2.7Å; D126-R134 PolarHBondContact OD2-NE 3.34Å; D126-R134 IonicContact OD2-NH2 3.03Å; D126-R134 PolarHBondContact OD2-NH2 2.97Å
127S56.3Low62.1Low81 Ų81100.7 Ų100.757%0.56652%0.519SS*.SBendtrans-79.1-27.4178.3-63.60000113G123G123-S127 PolarHBondContact O-OG 3.1Å; G123-S127 VanDerWaalsContact O-OG 3.05Å
128D61.9Low64.5Low156 Ų156101.2 Ų101.283%0.83452%0.516SS*.SBendtrans-90.3-4.6177.5-66-26.9000113.1
129L65.8Low66.7Low59 Ų5995.8 Ų95.831%0.30949%0.49SS..SBendtrans-85.7145.8-178.5-65-176.8000111.9D126 E133 K137D126-L129 WeakPolarHBondContact OD1-CD1 3.47Å; L129-E133 HydrophobicContact CB-CB 4.27Å; L129-K137 HydrophobicContact CD1-CD 4.2Å
130S79.1Confident69Low35 Ų3593.3 Ų93.325%0.24548%0.477CS..  trans-58.1147168.7171.90000110.2E132 E133 R134S130-E132 PolarHBondContact O-N 2.96Å; S130-E133 WeakPolarHBondContact CB-OE2 3.38Å; S130-E133 PolarHBondContact N-OE2 3.37Å; S130-E133 PolarHBondContact O-N 3.26Å; S130-R134 PolarHBondContact O-N 2.86Å
131P80.2Confident71.7Confident113 Ų11391.6 Ų91.673%0.73447%0.469SS*.Hα-helixtrans-54-29.8176.321.3-34.2000113.4E135P131-E135 PolarHBondContact O-N 2.96Å
132E77.9Confident74.1Confident118 Ų11892.4 Ų92.455%0.55146%0.463SS*.Hα-helixtrans-72.3-41.7176.3-174.5175.8173.300112.7S130 R134 E135 K136S130-E132 PolarHBondContact O-N 2.96Å; E132-R134 VanDerWaalsContact C-N 3.34Å; E132-E135 PolarHBondContact O-N 3.1Å; E132-K136 PolarHBondContact O-N 2.99Å
133E80.4Confident76.4Confident57 Ų5797.5 Ų97.527%0.26648%0.479SS..Hα-helixtrans-67.8-38.4179.1-66.1175.8129.600111.4L129 S130 E135 K136 K137L129-E133 HydrophobicContact CB-CB 4.27Å; S130-E133 WeakPolarHBondContact CB-OE2 3.38Å; S130-E133 PolarHBondContact N-OE2 3.37Å; S130-E133 PolarHBondContact O-N 3.26Å; E133-E135 PolarHBondContact O-N 3.3Å; E133-K136 PolarHBondContact O-N 3.26Å; E133-K137 WeakPolarHBondContact O-CB 3.44Å; E133-K137 PolarHBondContact O-N 3.48Å
134R83.3Confident79Confident101 Ų101101.5 Ų101.538%0.38148%0.482SS..Hα-helixtrans-57.7-47.1173.5-173.8168.3-146.7146.29112D126 S130 E132 K137 R138D126-R134 VanDerWaalsContact CG-NE 3.31Å; D126-R134 PolarHBondContact O-NH1 3.18Å; D126-R134 IonicContact OD1-NE 3.96Å; D126-R134 WeakPolarHBondContact OD2-CG 3.31Å; D126-R134 IonicContact OD2-CZ 3.19Å; D126-R134 IonicContact OD2-NE 2.7Å; D126-R134 PolarHBondContact OD2-NE 3.34Å; D126-R134 IonicContact OD2-NH2 3.03Å; D126-R134 PolarHBondContact OD2-NH2 2.97Å; S130-R134 PolarHBondContact O-N 2.86Å; E132-R134 VanDerWaalsContact C-N 3.34Å; R134-K137 PolarHBondContact O-N 3.28Å; R134-R138 WeakPolarHBondContact O-CB 3.09Å; R134-R138 PolarHBondContact O-N 3.14Å
135E86.9Confident81.4Confident74 Ų74101.6 Ų101.635%0.34648%0.48SS..Hα-helixtrans-65.7-41.4176.8-178.953.8-144.500111.4P131 E132 E133 K137 R138 Q139P131-E135 PolarHBondContact O-N 2.96Å; E132-E135 PolarHBondContact O-N 3.1Å; E133-E135 PolarHBondContact O-N 3.3Å; E135-K137 PolarHBondContact O-N 3.5Å; E135-R138 VanDerWaalsContact CD-NH2 3.3Å; E135-R138 WeakPolarHBondContact O-CB 3.33Å; E135-R138 PolarHBondContact O-N 3.13Å; E135-R138 IonicContact OE1-CZ 3.22Å; E135-R138 IonicContact OE1-NE 3.1Å; E135-R138 PolarHBondContact OE1-NE 3.47Å; E135-R138 VanDerWaalsContact OE1-NE 3.1Å; E135-R138 IonicContact OE1-NH2 2.66Å; E135-R138 PolarHBondContact OE1-NH2 2.98Å; E135-R138 IonicContact OE2-CZ 3.12Å; E135-R138 IonicContact OE2-NE 2.96Å; E135-R138 PolarHBondContact OE2-NE 2.92Å; E135-R138 IonicContact OE2-NH1 3.92Å; E135-R138 IonicContact OE2-NH2 3.18Å; E135-R138 PolarHBondContact OE2-NH2 2.98Å; E135-Q139 VanDerWaalsContact O-CG 3.32Å; E135-Q139 WeakPolarHBondContact O-CG 3.18Å; E135-Q139 PolarHBondContact O-N 3.06Å; E135-Q139 WeakPolarHBondContact OE1-CG 3.4Å; E135-Q139 PolarHBondContact OE1-NE2 3.4Å
136K87Confident83.7Confident131 Ų131101 Ų10157%0.5748%0.481SS*.Hα-helixtrans-61.9-41.3176.1-172.4177-176.7171.30112.4E132 E133 Q139 F140E132-K136 PolarHBondContact O-N 2.99Å; E133-K136 PolarHBondContact O-N 3.26Å; K136-Q139 PolarHBondContact O-N 3.17Å; K136-F140 WeakPolarHBondContact O-CB 3.47Å; K136-F140 PolarHBondContact O-N 3.04Å
137K86.1Confident85.9Confident57 Ų57106.3 Ų106.325%0.24851%0.505CS..Hα-helixtrans-61.9-47.1174-175.3179.9178.7-178.90110.6L129 E133 R134 E135 Q139 F140 E141L129-K137 HydrophobicContact CD1-CD 4.2Å; E133-K137 WeakPolarHBondContact O-CB 3.44Å; E133-K137 PolarHBondContact O-N 3.48Å; R134-K137 PolarHBondContact O-N 3.28Å; E135-K137 PolarHBondContact O-N 3.5Å; K137-Q139 PolarHBondContact O-N 3.39Å; K137-F140 WeakPolarHBondContact O-CB 3.33Å; K137-F140 PolarHBondContact O-N 3.44Å; K137-F140 VanDerWaalsContact O-N 3.15Å; K137-E141 WeakPolarHBondContact CE-OE1 3.5Å; K137-E141 WeakPolarHBondContact O-CG 3.33Å; K137-E141 PolarHBondContact O-N 2.72Å
138R91.7Very high87.9Confident147 Ų147109.7 Ų109.756%0.55551%0.506SS*.Hα-helixtrans-56.3-46.9175.2-170.7-17077.2151.10.1112.3R134 E135 E141 M142R134-R138 WeakPolarHBondContact O-CB 3.09Å; R134-R138 PolarHBondContact O-N 3.14Å; E135-R138 VanDerWaalsContact CD-NH2 3.3Å; E135-R138 WeakPolarHBondContact O-CB 3.33Å; E135-R138 PolarHBondContact O-N 3.13Å; E135-R138 IonicContact OE1-CZ 3.22Å; E135-R138 IonicContact OE1-NE 3.1Å; E135-R138 PolarHBondContact OE1-NE 3.47Å; E135-R138 VanDerWaalsContact OE1-NE 3.1Å; E135-R138 IonicContact OE1-NH2 2.66Å; E135-R138 PolarHBondContact OE1-NH2 2.98Å; E135-R138 IonicContact OE2-CZ 3.12Å; E135-R138 IonicContact OE2-NE 2.96Å; E135-R138 PolarHBondContact OE2-NE 2.92Å; E135-R138 IonicContact OE2-NH1 3.92Å; E135-R138 IonicContact OE2-NH2 3.18Å; E135-R138 PolarHBondContact OE2-NH2 2.98Å; R138-E141 PolarHBondContact O-N 3.07Å; R138-M142 WeakPolarHBondContact O-CB 3.31Å; R138-M142 PolarHBondContact O-N 3.11Å
139Q95.1Very high89.6Confident80 Ų80106.7 Ų106.737%0.37449%0.491SS..Hα-helixtrans-62.9-42.4177.3-69-61-25.500111.8E135 K136 K137 M142 K143E135-Q139 VanDerWaalsContact O-CG 3.32Å; E135-Q139 WeakPolarHBondContact O-CG 3.18Å; E135-Q139 PolarHBondContact O-N 3.06Å; E135-Q139 WeakPolarHBondContact OE1-CG 3.4Å; E135-Q139 PolarHBondContact OE1-NE2 3.4Å; K136-Q139 PolarHBondContact O-N 3.17Å; K137-Q139 PolarHBondContact O-N 3.39Å; Q139-M142 PolarHBondContact O-N 3.01Å; Q139-K143 WeakPolarHBondContact O-CB 3.44Å; Q139-K143 PolarHBondContact O-N 3.37Å
140F94.7Very high91Very high125 Ų125108.8 Ų108.855%0.54850%0.499SS..Hα-helixtrans-62.3-44.9176.4174.8-98.9000111.7K136 K137 K143 R144K136-F140 WeakPolarHBondContact O-CB 3.47Å; K136-F140 PolarHBondContact O-N 3.04Å; K137-F140 WeakPolarHBondContact O-CB 3.33Å; K137-F140 PolarHBondContact O-N 3.44Å; K137-F140 VanDerWaalsContact O-N 3.15Å; F140-K143 PolarHBondContact O-N 2.95Å; F140-R144 VanDerWaalsContact O-CB 3.27Å; F140-R144 WeakPolarHBondContact O-CB 3.07Å; F140-R144 PolarHBondContact O-N 3.13Å
141E95.1Very high91.8Very high67 Ų67109.7 Ų109.731%0.31351%0.514SS..Hα-helixtrans-62.8-43.5177.5-73.8178.4-17200112.1K137 R138 K143 R144 K145K137-E141 WeakPolarHBondContact CE-OE1 3.5Å; K137-E141 WeakPolarHBondContact O-CG 3.33Å; K137-E141 PolarHBondContact O-N 2.72Å; R138-E141 PolarHBondContact O-N 3.07Å; E141-K143 PolarHBondContact O-N 3.36Å; E141-R144 PolarHBondContact O-N 3.17Å; E141-K145 WeakPolarHBondContact O-CB 3.39Å; E141-K145 PolarHBondContact O-N 3.03Å
142M96.5Very high92.6Very high115 Ų115111.1 Ų111.157%0.56751%0.514SS*.Hα-helixtrans-61.4-44.5174.8-174.3176.967.500111.3R138 Q139 K145 L146R138-M142 WeakPolarHBondContact O-CB 3.31Å; R138-M142 PolarHBondContact O-N 3.11Å; Q139-M142 PolarHBondContact O-N 3.01Å; M142-K145 PolarHBondContact O-N 3.44Å; M142-L146 WeakPolarHBondContact O-CB 3.49Å; M142-L146 PolarHBondContact O-N 3.08Å
143K97.2Very high93.5Very high156 Ų156109.5 Ų109.568%0.67851%0.51SS*.Hα-helixtrans-63.4-43.5176.5-173.9177.1-178.6177.90111.7Q139 F140 E141 K145 L146 H147Q139-K143 WeakPolarHBondContact O-CB 3.44Å; Q139-K143 PolarHBondContact O-N 3.37Å; F140-K143 PolarHBondContact O-N 2.95Å; E141-K143 PolarHBondContact O-N 3.36Å; K143-K145 VanDerWaalsContact C-N 3.35Å; K143-L146 PolarHBondContact O-N 3.41Å; K143-H147 VanDerWaalsContact O-CB 3.31Å; K143-H147 WeakPolarHBondContact O-CB 3Å; K143-H147 PolarHBondContact O-N 3.14Å
144R97.3Very high94.4Very high123 Ų123110.7 Ų110.746%0.46452%0.517SS..Hα-helixtrans-60.1-45.7176.3-177.9178.866.9-177.5-2.9110.9F140 E141 L146 H147 Y148F140-R144 VanDerWaalsContact O-CB 3.27Å; F140-R144 WeakPolarHBondContact O-CB 3.07Å; F140-R144 PolarHBondContact O-N 3.13Å; E141-R144 PolarHBondContact O-N 3.17Å; R144-L146 VanDerWaalsContact C-N 3.33Å; R144-L146 PolarHBondContact O-N 3.47Å; R144-H147 PolarHBondContact O-N 3.49Å; R144-Y148 HydrophobicContact CG-CD2 3.67Å; R144-Y148 HydrophobicContact CG-CE2 3.74Å; R144-Y148 WeakPolarHBondContact O-CD2 3.49Å; R144-Y148 PolarHBondContact O-N 2.84Å; R144-Y148 VanDerWaalsContact O-N 3.1Å
145K97.1Very high95Very high178 Ų178114 Ų11477%0.77453%0.534SS*.Hα-helixtrans-61.5-40.5176.8-179.1177.6179.7176.50112.1E141 M142 K143E141-K145 WeakPolarHBondContact O-CB 3.39Å; E141-K145 PolarHBondContact O-N 3.03Å; M142-K145 PolarHBondContact O-N 3.44Å; K143-K145 VanDerWaalsContact C-N 3.35Å
146L96.8Very high95.5Very high138 Ų138114.8 Ų114.872%0.72354%0.54SS*.Hα-helixtrans-70.7-35.1176.8-17763.4000112.3M142 K143 R144M142-L146 WeakPolarHBondContact O-CB 3.49Å; M142-L146 PolarHBondContact O-N 3.08Å; K143-L146 PolarHBondContact O-N 3.41Å; R144-L146 VanDerWaalsContact C-N 3.33Å; R144-L146 PolarHBondContact O-N 3.47Å
147H97.9Very high96Very high121 Ų121110.7 Ų110.756%0.5653%0.531SS*.Hα-helixtrans-71.4-47.2-176.2-177.959.1000112.8K143 R144 N149K143-H147 VanDerWaalsContact O-CB 3.31Å; K143-H147 WeakPolarHBondContact O-CB 3Å; K143-H147 PolarHBondContact O-N 3.14Å; R144-H147 PolarHBondContact O-N 3.49Å; H147-N149 VanDerWaalsContact C-N 3.33Å; H147-N149 PolarHBondContact O-N 3.11Å
148Y97.8Very high96.5Very high152 Ų152116.1 Ų116.160%0.59655%0.55SS*.  trans-8377.6-176.9-69.2-62000111.5R144 E150R144-Y148 HydrophobicContact CG-CD2 3.67Å; R144-Y148 HydrophobicContact CG-CE2 3.74Å; R144-Y148 WeakPolarHBondContact O-CD2 3.49Å; R144-Y148 PolarHBondContact O-N 2.84Å; R144-Y148 VanDerWaalsContact O-N 3.1Å; Y148-E150 WeakPolarHBondContact CA-OE2 3.43Å
149N96.9Very high96.8Very high94 Ų94115.3 Ų115.350%0.50355%0.553SS.*  trans-1119.1179.970.75.9000113.7H147 G151 L152H147-N149 VanDerWaalsContact C-N 3.33Å; H147-N149 PolarHBondContact O-N 3.11Å; N149-G151 PolarHBondContact O-N 3.41Å; N149-L152 VanDerWaalsContact O-CB 3.31Å; N149-L152 WeakPolarHBondContact O-CB 3.36Å; N149-L152 PolarHBondContact O-N 2.96Å
150E96.1Very high96.9Very high102 Ų102115.9 Ų115.948%0.47756%0.558SS.*Hα-helixtrans-57-30.8-172.7-60.987.7163.400112.3Y148 L152 N153 I154Y148-E150 WeakPolarHBondContact CA-OE2 3.43Å; E150-L152 PolarHBondContact O-N 3.19Å; E150-N153 PolarHBondContact O-N 2.84Å; E150-I154 WeakPolarHBondContact O-CG1 3.45Å; E150-I154 PolarHBondContact O-N 3.43Å
151G96.8Very high96.9Very high55 Ų55115.3 Ų115.357%0.56756%0.559SS**Hα-helixtrans-52.4-34.3175.100000114.2N149 N153N149-G151 PolarHBondContact O-N 3.41Å; G151-N153 VanDerWaalsContact C-N 3.3Å; G151-N153 PolarHBondContact O-N 3.14Å
152L96.6Very high96.9Very high142 Ų142115.9 Ų115.974%0.74357%0.571SS**Hα-helixtrans-63.5-37.5178.8-177.660.9000111.9N149 E150N149-L152 VanDerWaalsContact O-CB 3.31Å; N149-L152 WeakPolarHBondContact O-CB 3.36Å; N149-L152 PolarHBondContact O-N 2.96Å; E150-L152 PolarHBondContact O-N 3.19Å
153N96.6Very high96.8Very high85 Ų85116.3 Ų116.346%0.45557%0.569SS.*Hα-helixtrans-93.1-4.9-172.1-67-20000113.4E150 G151 K155 L156 A157E150-N153 PolarHBondContact O-N 2.84Å; G151-N153 VanDerWaalsContact C-N 3.3Å; G151-N153 PolarHBondContact O-N 3.14Å; N153-K155 VanDerWaalsContact C-N 3.32Å; N153-K155 PolarHBondContact O-N 3.41Å; N153-L156 PolarHBondContact O-N 2.9Å; N153-A157 WeakPolarHBondContact O-CB 3.49Å; N153-A157 PolarHBondContact O-N 3.03Å
154I98.1Very high96.6Very high82 Ų82114 Ų11442%0.42156%0.564SS.*Hα-helixtrans-55.7-44.3-176.7-67.6177.9000112.1E150 R158E150-I154 WeakPolarHBondContact O-CG1 3.45Å; E150-I154 PolarHBondContact O-N 3.43Å; I154-R158 VanDerWaalsContact O-CG 3.31Å; I154-R158 WeakPolarHBondContact O-CG 3.46Å; I154-R158 PolarHBondContact O-N 3.49Å
155K97.3Very high96.3Very high169 Ų169114 Ų11474%0.73557%0.573SS**Hα-helixtrans-67.7-44.5-179.2-69.3-179.7-177.6175.90111.7N153 R158 Q159N153-K155 VanDerWaalsContact C-N 3.32Å; N153-K155 PolarHBondContact O-N 3.41Å; K155-R158 PolarHBondContact O-N 2.91Å; K155-Q159 WeakPolarHBondContact O-CG 3.38Å; K155-Q159 PolarHBondContact O-N 3.11Å
156L97Very high95.5Very high92 Ų92110.5 Ų110.548%0.48256%0.559SS.*Hα-helixtrans-62.9-45.1178178.261000111N153 R158 Q159 L160N153-L156 PolarHBondContact O-N 2.9Å; L156-R158 VanDerWaalsContact C-N 3.33Å; L156-R158 PolarHBondContact O-N 3.22Å; L156-Q159 WeakPolarHBondContact O-CB 3.35Å; L156-Q159 PolarHBondContact O-N 3.27Å; L156-Q159 VanDerWaalsContact O-N 3.14Å; L156-L160 HydrophobicContact CD1-CG 4.41Å; L156-L160 HydrophobicContact CG-CD1 4.26Å; L156-L160 WeakPolarHBondContact O-CG 3.24Å; L156-L160 PolarHBondContact O-N 3.42Å
157A97.4Very high94Very high45 Ų45108.6 Ų108.637%0.37255%0.55SS..Hα-helixtrans-59.4-42.8176.500000111.8N153 Q159 L160 I161N153-A157 WeakPolarHBondContact O-CB 3.49Å; N153-A157 PolarHBondContact O-N 3.03Å; A157-Q159 VanDerWaalsContact C-N 3.35Å; A157-Q159 PolarHBondContact O-N 3.06Å; A157-L160 PolarHBondContact O-N 3.32Å; A157-I161 WeakPolarHBondContact O-CD1 3.38Å; A157-I161 VanDerWaalsContact O-CG1 3.24Å; A157-I161 WeakPolarHBondContact O-CG1 3.31Å; A157-I161 PolarHBondContact O-N 3.14Å
158R97.5Very high92.1Very high171 Ų171109.4 Ų109.465%0.64556%0.558SS**Hα-helixtrans-59.6-43.9173.9-73173.8-174.2-169.11.8112I154 K155 L156 I161 S162I154-R158 VanDerWaalsContact O-CG 3.31Å; I154-R158 WeakPolarHBondContact O-CG 3.46Å; I154-R158 PolarHBondContact O-N 3.49Å; K155-R158 PolarHBondContact O-N 2.91Å; L156-R158 VanDerWaalsContact C-N 3.33Å; L156-R158 PolarHBondContact O-N 3.22Å; R158-I161 PolarHBondContact O-N 3Å; R158-S162 PolarHBondContact O-N 3.03Å; R158-S162 PolarHBondContact O-OG 3.3Å; R158-S162 VanDerWaalsContact O-OG 3.11Å
159Q96.9Very high90.2Very high130 Ų130108.7 Ų108.761%0.60756%0.56SS**Hα-helixtrans-64.1-42.4177.6-73.1177.1-19.300112.3K155 L156 A157 S162 K163K155-Q159 WeakPolarHBondContact O-CG 3.38Å; K155-Q159 PolarHBondContact O-N 3.11Å; L156-Q159 WeakPolarHBondContact O-CB 3.35Å; L156-Q159 PolarHBondContact O-N 3.27Å; L156-Q159 VanDerWaalsContact O-N 3.14Å; A157-Q159 VanDerWaalsContact C-N 3.35Å; A157-Q159 PolarHBondContact O-N 3.06Å; Q159-S162 PolarHBondContact O-N 3Å; Q159-K163 WeakPolarHBondContact O-CB 3.48Å; Q159-K163 PolarHBondContact O-N 3.37Å
160L96.5Very high88.1Confident92 Ų92109.5 Ų109.548%0.48256%0.564SS.*Hα-helixtrans-62-45.4175.7-70.3172.7000111.2L156 A157 S162 K163 D164L156-L160 HydrophobicContact CD1-CG 4.41Å; L156-L160 HydrophobicContact CG-CD1 4.26Å; L156-L160 WeakPolarHBondContact O-CG 3.24Å; L156-L160 PolarHBondContact O-N 3.42Å; A157-L160 PolarHBondContact O-N 3.32Å; L160-S162 VanDerWaalsContact C-N 3.33Å; L160-S162 PolarHBondContact O-N 3.07Å; L160-K163 PolarHBondContact O-N 3.47Å; L160-D164 WeakPolarHBondContact O-CB 3.38Å; L160-D164 PolarHBondContact O-N 2.95Å
161I95.8Very high86.1Confident113 Ų113114 Ų11458%0.57959%0.585SS**Hα-helixtrans-60.9-42.5175.2-65.8162.1000111.1A157 R158 K163 L165A157-I161 WeakPolarHBondContact O-CD1 3.38Å; A157-I161 VanDerWaalsContact O-CG1 3.24Å; A157-I161 WeakPolarHBondContact O-CG1 3.31Å; A157-I161 PolarHBondContact O-N 3.14Å; R158-I161 PolarHBondContact O-N 3Å; I161-K163 VanDerWaalsContact C-N 3.32Å; I161-K163 PolarHBondContact O-N 3.5Å; I161-L165 WeakPolarHBondContact O-CB 3.49Å; I161-L165 PolarHBondContact O-N 3.19Å
162S95.8Very high84Confident79 Ų79119.7 Ų119.755%0.55260%0.597SS**Hα-helixtrans-63.6-38.2176.6-67.90000112.5R158 Q159 L160 H166R158-S162 PolarHBondContact O-N 3.03Å; R158-S162 PolarHBondContact O-OG 3.3Å; R158-S162 VanDerWaalsContact O-OG 3.11Å; Q159-S162 PolarHBondContact O-N 3Å; L160-S162 VanDerWaalsContact C-N 3.33Å; L160-S162 PolarHBondContact O-N 3.07Å; S162-H166 WeakPolarHBondContact O-CB 3.43Å; S162-H166 PolarHBondContact O-N 3.34Å
163K94.2Very high81.6Confident124 Ų124121 Ų12154%0.53960%0.602SS.*Hα-helixtrans-68.9-49.7176.3-175.9-176.7173.4-175.30111.2Q159 L160 I161 L165 H166 D167Q159-K163 WeakPolarHBondContact O-CB 3.48Å; Q159-K163 PolarHBondContact O-N 3.37Å; L160-K163 PolarHBondContact O-N 3.47Å; I161-K163 VanDerWaalsContact C-N 3.32Å; I161-K163 PolarHBondContact O-N 3.5Å; K163-L165 PolarHBondContact O-N 3.12Å; K163-H166 PolarHBondContact O-N 2.89Å; K163-D167 WeakPolarHBondContact CE-OD2 3.48Å; K163-D167 PolarHBondContact O-N 2.96Å
164D92.9Very high79.4Confident107 Ų107125.6 Ų125.657%0.57263%0.625SS**Hα-helixtrans-57.3-32.7179-73.23.2000111.5L160L160-D164 WeakPolarHBondContact O-CB 3.38Å; L160-D164 PolarHBondContact O-N 2.95Å
165L90.7Very high77Confident123 Ų123129.4 Ų129.464%0.64464%0.641SS**Hα-helixtrans-78.9-23.8176.2-162.468.7000113.7I161 K163I161-L165 WeakPolarHBondContact O-CB 3.49Å; I161-L165 PolarHBondContact O-N 3.19Å; K163-L165 PolarHBondContact O-N 3.12Å
166H80.9Confident74.1Confident105 Ų105127.7 Ų127.749%0.48665%0.645SS.*Hα-helixtrans-90.8-30.4-179.8-166.850.7000112.6S162 K163 D168 E169S162-H166 WeakPolarHBondContact O-CB 3.43Å; S162-H166 PolarHBondContact O-N 3.34Å; K163-H166 PolarHBondContact O-N 2.89Å; H166-D168 PolarHBondContact O-N 3.2Å; H166-D168 VanDerWaalsContact O-N 3.12Å; H166-E169 PolarHBondContact O-N 2.89Å
167D63.9Low71.7Confident98 Ų98127.8 Ų127.852%0.52466%0.659SS.*THydrogen-bonded Turntrans-62.3-14.4173.8-92-11.7000112.3K163K163-D167 WeakPolarHBondContact CE-OD2 3.48Å; K163-D167 PolarHBondContact O-N 2.96Å
168D59.3Low69.1Low138 Ų138133.9 Ų133.974%0.73869%0.685SS**THydrogen-bonded Turntrans-86.5-9.2172.5-72.5-28.9000113.7H166H166-D168 PolarHBondContact O-N 3.2Å; H166-D168 VanDerWaalsContact O-N 3.12Å
169E56.7Low66.4Low137 Ų137129 Ų12964%0.6469%0.688SS**THydrogen-bonded Turntrans-105.6-7.9-179.3-65.8-168.9166.200113.7H166 E171H166-E169 PolarHBondContact O-N 2.89Å; E169-E171 PolarHBondContact O-N 3.04Å
170D54.1Low63.6Low110 Ų110131.4 Ų131.459%0.58870%0.699SS**THydrogen-bonded Turntrans-91.923.3-175.2-77.3-19.8000114.7
171E53.1Low61Low197 Ų197131.7 Ų131.792%0.92171%0.709SS**THydrogen-bonded Turntrans-95.9-1.5162.1-87.1-169.2178.200113.9E169E169-E171 PolarHBondContact O-N 3.04Å
172E52Low58.2Low174 Ų174134 Ų13481%0.81372%0.72SS**SBendtrans-14384.7170-82.9-163169.500112.2
173M46.7Very low55.6Low170 Ų170136.1 Ų136.184%0.83773%0.725SS**  trans158.774.1137.9-86.6-147.6-61.500111.8E175M173-E175 PolarHBondContact O-N 3.41Å
174L51.1Low53Low182 Ų182137.1 Ų137.195%0.95374%0.742SS**  trans-89.675147-79.5170.8000109.1
175E46.8Very low50.9Low161 Ų161140.9 Ų140.975%0.75276%0.756SS**  trans-173.499.1153.5-118.4174.5174.900111.2M173M173-E175 PolarHBondContact O-N 3.41Å
176T37.7Very low48.8Very low133 Ų133142.7 Ų142.782%0.81676%0.761SS**  167118.2111410000112.3
177A46.1Very low47.1Very low94 Ų94142.9 Ų142.978%0.77777%0.774SS**  trans15.4123.914600000121.2
178D42.5Very low46.4Very low173 Ų173144.5 Ų144.593%0.92578%0.782SS**  77.7125.8124.7-149.720.7000118.9
179G39.8Very low45.8Very low68 Ų68146 Ų14670%0.70179%0.785SS**  trans16469.5177.400000115.2
180E38.8Very low44.9Very low181 Ų181143.1 Ų143.185%0.84679%0.793SS**  trans32.5116.5145.8-81.6176.8108.300120.8
181S42.3Very low44.2Very low99 Ų99143.5 Ų143.569%0.69280%0.804SS**  41.1113115.6152.80000117.8
182M36.6Very low43.7Very low161 Ų161140.6 Ų140.679%0.79380%0.8SS**  -174.9122.4119.3-102.2-161.9172.700114.2
183N40.5Very low43.5Very low123 Ų123138 Ų13866%0.65880%0.798SS**  trans6492143.1-49.7-40.2000120.1
184T41.6Very low43.1Very low146 Ų146134.8 Ų134.890%0.89679%0.792SS**  trans-85.798.8150.3490000109.1
185E47.3Very low42.5Very low186 Ų186134.3 Ų134.387%0.86979%0.79SS**  trans-70.4133.1170.1-70-171.2138.400110.9S187E185-S187 PolarHBondContact O-N 3.5Å
186E47.1Very low42.3Very low161 Ų161133.7 Ų133.775%0.75279%0.788SS**  trans-70.9105.3-171.2-166.4-166.9141.600111.3N188E186-N188 PolarHBondContact O-N 3.06Å; E186-N188 PolarHBondContact OE1-ND2 3.36Å
187S45.6Very low42.5Very low108 Ų108135 Ų13576%0.75579%0.785SS**  trans-91.592.8169.7-152.20000109.8E185 Q189E185-S187 PolarHBondContact O-N 3.5Å; S187-Q189 PolarHBondContact O-N 3.13Å
188N49.4Very low42.3Very low132 Ų132140 Ų14071%0.70679%0.792SS**  trans-59.1101.4170.1-87.2-78.2000110.5E186E186-N188 PolarHBondContact O-N 3.06Å; E186-N188 PolarHBondContact OE1-ND2 3.36Å
189Q47Very low42.4Very low169 Ų169139.3 Ų139.379%0.7979%0.788SS**  trans-106.5106.6159.1-68-164.78.800108.6S187 S191S187-Q189 PolarHBondContact O-N 3.13Å; Q189-S191 PolarHBondContact O-N 2.79Å; Q189-S191 VanDerWaalsContact O-N 3.13Å
190G37.6Very low42.8Very low78 Ų78145.1 Ų145.180%0.80479%0.794SS**  trans-56.1113.9177.900000111.4
191S39.7Very low43.2Very low118 Ų118144.1 Ų144.183%0.82579%0.794SS**  trans-77.6114.7161.7-73.70000108.5Q189Q189-S191 PolarHBondContact O-N 2.79Å; Q189-S191 VanDerWaalsContact O-N 3.13Å
192T42.1Very low43.3Very low136 Ų136150.9 Ų150.983%0.83480%0.804SS**  trans-87.6125.5161.348.60000108.5
193P46.7Very low43.8Very low119 Ų119148.8 Ų148.877%0.77381%0.806SS**  trans-79.4141.1174.330.9-30.8000110.8D195P193-D195 PolarHBondContact O-N 3.38Å
194S38.8Very low44.1Very low103 Ų103151.7 Ų151.772%0.7284%0.835SS**  trans-34.4118.5161.6173.70000113.8
195D39.8Very low44.3Very low171 Ų171152 Ų15291%0.91483%0.832SS**  trans-99.5103.6166.7-122-11.1000109.7P193P193-D195 PolarHBondContact O-N 3.38Å
196Q40.9Very low44.1Very low148 Ų148150.2 Ų150.269%0.69283%0.831SS**  trans-104.1129173.7-137.5-179.264.600107.4
197Q41.4Very low44Very low162 Ų162149.6 Ų149.676%0.75784%0.835SS**  trans72.6113.4161.6-58.4175-9.900118.2
198Q43Very low43.9Very low197 Ų197152.1 Ų152.192%0.92184%0.84SS**  -14785.7122.3-70.6-154.3-12.100110.8
199N45.1Very low43.5Very low159 Ų159153.3 Ų153.385%0.8585%0.848SS**  trans-91.289.9160.5-59.9-9000107.7
200K47.4Very low43.3Very low190 Ų190152.3 Ų152.383%0.82685%0.852SS**  trans-172.2138.7153.6-123.8168.9-175.5-174.80113.4
201L47.1Very low43.7Very low161 Ų161157.6 Ų157.684%0.84386%0.855SS**  trans87.788.9160.6-48.2177.4000117
202R44.3Very low44Very low240 Ų240160.6 Ų160.691%0.90686%0.858SS**  -150.983.8125.3-150.5170.5175.2-161.6-2.8111.4
203S48.4Very low44.1Very low118 Ų118162.7 Ų162.783%0.82586%0.859SS**  trans-98.3118.7150.8-75.20000107.9
204S46.8Very low43.9Very low184 Ų184166.6 Ų166.6100%1.28787%0.867SS**  trans158.10154.6-76.40000107.7

Retrieved 204 of 204 residues in 93.9 ms (Link to these results)