A0A087YMZ8_POEFO Loading...

MAP7 domain-containing protein 2-like

AlphaFold DB , UniProt , Accession A0A087YMZ8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 883 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M36.7Very low37.1Very low253 Ų253144.8 Ų144.8100%1.24687%0.872SS**  0155.10-73.1175.1170.400108.5
2A38.4Very low37.3Very low94 Ų94144.4 Ų144.478%0.77787%0.871SS**  trans-98.3156.8-17100000113.2
3K37.2Very low37Very low208 Ų208139.3 Ų139.390%0.90487%0.866SS**  -166.9121.9122.3-103.6162.3-175.5-178.90111.3
4T42.9Very low36.7Very low133 Ų133140.3 Ų140.382%0.81686%0.855SS**  trans-82.6161.815744.90000109.1
5N35.9Very low37Very low173 Ų173141.3 Ų141.393%0.92584%0.843SS**  trans-147.3138.5159.9-104.3-8.8000108.8
6A34.3Very low37.1Very low99 Ų99143.2 Ų143.282%0.81884%0.843SS**  trans-132.4141.7170.700000107.8
7S35.6Very low37.4Very low133 Ų133140 Ų14093%0.9384%0.837SS**  trans-84.7142.7178.2-66.70000111.3
8S33.8Very low38.8Very low115 Ų115138.9 Ų138.980%0.80483%0.834SS**  trans-124.2154.4169.5-175.50000109
9I38.2Very low39.5Very low169 Ų169138.4 Ų138.487%0.86783%0.834SS**  trans-120.4141.9172-67.1-179.8000108.5
10A37.7Very low39.3Very low87 Ų87137.1 Ų137.172%0.71983%0.831SS**  trans-123.5178.7-170.200000109.4
11V36.9Very low39.1Very low129 Ų129137.9 Ų137.978%0.78283%0.829SS**  cis-160.9165.6-1.390.10000109.6
12T40Very low38.9Very low140 Ų140131.5 Ų131.586%0.85981%0.805SS**  trans147.1140.9154.139.80000108
13G33.4Very low38.6Very low78 Ų78134.8 Ų134.880%0.80481%0.808SS**  cis130.1125.56.800000108.8
14E32.8Very low38.6Very low153 Ų153132 Ų13272%0.71580%0.802SS**  cis-157.2152.93.1-161-154.4137.800111.5
15K40.8Very low39.1Very low155 Ų155131.4 Ų131.467%0.67480%0.801SS**  trans77.1151147.6-118.3-170.5-162.597.40124.1
16M38.9Very low39Very low172 Ų172128 Ų12885%0.84778%0.783SS**  trans82.5157.6164-58-46.8-156.800120.5
17A41.7Very low39Very low89 Ų89130.7 Ų130.774%0.73678%0.776SS**  trans-123.5165.5-158.200000112.7
18P63Low38.9Very low121 Ų121133.2 Ų133.279%0.78677%0.77SS**  trans-91162.4-159.136.6-37.2000115.2
19P52.3Low39Very low128 Ų128133.2 Ų133.283%0.83177%0.771SS**  -141.5-177.9120.939.5-26.4000115.5
20S35.4Very low39.6Very low112 Ų112130.7 Ų130.778%0.78377%0.765SS**  trans-86.3-166.5-169.5-41.60000116
21I35.2Very low39.6Very low154 Ų154133.2 Ų133.279%0.7977%0.772SS**  trans98.4103.4167.2-56.5174.5000113
22T33.1Very low39.2Very low119 Ų119134.3 Ų134.373%0.7377%0.773SS**  77.8122.567.6-53.20000114.3
23L32.1Very low38.9Very low163 Ų163130.4 Ų130.485%0.85376%0.761SS**  175.9156.7126.2-95.3169.3000115.1
24L36.9Very low38.8Very low149 Ų149135.2 Ų135.278%0.7876%0.762SS**  trans-88.5171.7167.1-85.995.8000111.5
25P53.5Low38.6Very low122 Ų122133 Ų13379%0.79276%0.763SS**  -141.7118.3102.232.9-17000113.4
26D32.4Very low38.5Very low100 Ų100131.2 Ų131.254%0.53577%0.77SS.*  65.3113.883.5-17538.9000115.7
27K34.6Very low38.5Very low156 Ų156129.3 Ų129.368%0.67877%0.771SS**  -169.5121.5128.2-84.9-22.6160-1660116.4
28K33.3Very low38.1Very low186 Ų186128.2 Ų128.281%0.80977%0.768SS**  trans83.7137.7137.1-64.7174.7-178.9-178.10121
29S36.9Very low37Very low116 Ų116134.1 Ų134.181%0.81177%0.774SS**  trans-97-158.2-173.9-19.70000110.9
30P50.2Low36.1Very low116 Ų116135 Ų13575%0.75378%0.778SS**  cis-139.1167.96.642.2-24.4000118.1
31T37.3Very low35.8Very low140 Ų140133.1 Ų133.186%0.85978%0.776SS**  trans-151.5159.6140.830.20000111.5
32N30.4Very low36.2Very low152 Ų152135.3 Ų135.381%0.81378%0.78SS**  trans-60.4162.2-172.1-51.4-35.4000114.7
33G32.7Very low36.3Very low58 Ų58136.6 Ų136.660%0.59879%0.788SS**  cis122.5141.22.500000112.8
34H30.8Very low36.6Very low179 Ų179135.2 Ų135.283%0.82979%0.787SS**  trans71.4144-178.3-45.2-67.9000116.1
35S30Very low37.2Very low105 Ų105133.7 Ų133.773%0.73479%0.785SS**  cis-160.2147.7-18.1-99.90000110.1
36S37.5Very low36.4Very low119 Ų119132.9 Ų132.983%0.83278%0.783SS**  trans-78.1155.4165.9-47.90000111.5
37P39.7Very low36.3Very low132 Ų132135.8 Ų135.886%0.85780%0.798SS**  trans-111.1141.3144.4-3.824000111.2
38G33.5Very low36.3Very low65 Ų65132.3 Ų132.367%0.6780%0.799SS**  trans-165.2150.3172.500000112.3
39R38.7Very low36.5Very low245 Ų245131.5 Ų131.593%0.92580%0.798SS**  trans70.9137.6-167.8-43.317083.1-114.16.9110.7
40T33.7Very low36.9Very low147 Ų147136 Ų13690%0.90280%0.803SS**  cis-95.6170.424.753.60000113.7
41G30.4Very low36.4Very low73 Ų73140.8 Ų140.875%0.75381%0.806SS**  cis175.4-172.14500000109.1
42K43.2Very low36.6Very low200 Ų200140 Ų14087%0.8780%0.803SS**  trans-102.5160.3-168.1-64.2177.1-179174.90114.7
43T34.6Very low36.9Very low145 Ų145140.8 Ų140.889%0.8980%0.802SS**  trans98.2130.7159.666.10000120.7
44T38.3Very low37.2Very low135 Ų135145.9 Ų145.983%0.82881%0.812SS**  trans-82.1178.2173.113.10000111.7
45P49.7Very low37.4Very low116 Ų116143.9 Ų143.975%0.75381%0.807SS**  cis-142.9166.122.242.4-22.8000120
46S36.2Very low37.8Very low106 Ų106142.1 Ų142.174%0.74181%0.806SS**  trans45.3117.9139.8-164.40000123.3
47N30.8Very low37.7Very low161 Ų161145.3 Ų145.386%0.86181%0.807SS**  -156.1175.2109.4-139.4-79.6000112.1
48A35.3Very low37.7Very low83 Ų83143.5 Ų143.569%0.68680%0.804SS**  trans-104154.4-162.100000116.2
49E36.6Very low38.3Very low169 Ų169145.5 Ų145.579%0.7981%0.807SS**  trans-66.8151.4170.5-59.3-170.8129.300112.7
50K46Very low38.7Very low210 Ų210139.8 Ų139.891%0.91380%0.802SS**  trans-123112163.1-73.1-177.6179176.20110.4
51R39.5Very low39Very low216 Ų216137.7 Ų137.782%0.81579%0.793SS**  trans-117.8141.7163.5-80.6-178.4166168.5-1.8109.5
52P41.4Very low39.4Very low125 Ų125143 Ų14381%0.81280%0.798SS**PPolyproline II helixtrans-67.5133.9-179.927.9-34000110.7
53H36Very low39.3Very low168 Ų168141.2 Ų141.278%0.77880%0.797SS**PPolyproline II helixtrans-74.9132.3-178.4-149.280.4000110.2
54M38.9Very low39.8Very low164 Ų164141.1 Ų141.181%0.80880%0.796SS**PPolyproline II helixtrans-86.7130.1168.2-76.3-7994.500109.1G56M54-G56 VanDerWaalsContact C-N 3.3Å; M54-G56 PolarHBondContact O-N 3.38Å
55N36.5Very low39.9Very low138 Ų138140.5 Ų140.574%0.73880%0.798SS**  trans-72.879-176.2-74.1-3.1000112.1H57N55-H57 PolarHBondContact O-N 2.79Å
56G37Very low39.7Very low68 Ų68141.2 Ų141.270%0.70180%0.795SS**  trans-70.3115.4157.300000109.2M54 A58M54-G56 VanDerWaalsContact C-N 3.3Å; M54-G56 PolarHBondContact O-N 3.38Å; G56-A58 PolarHBondContact O-N 3.15Å
57H35.5Very low40Very low185 Ų185142.1 Ų142.186%0.85679%0.792SS**  trans-69.199.9174.3-74.2-81.9000109.9N55N55-H57 PolarHBondContact O-N 2.79Å
58A39.7Very low40.6Very low95 Ų95144.2 Ų144.279%0.78580%0.796SS**  trans-65.6139.2178.300000111.9G56G56-A58 PolarHBondContact O-N 3.15Å
59S45.8Very low40.8Very low107 Ų107144.2 Ų144.275%0.74880%0.804SS**  trans-64.1142.9168.1-60.50000110.6S61S59-S61 PolarHBondContact O-N 2.9Å; S59-S61 VanDerWaalsContact O-N 3.09Å
60P48.3Very low40.9Very low125 Ų125139.5 Ų139.581%0.81280%0.801SS**  trans-70108174.628.8-33.4000110.3
61S39.5Very low40.9Very low103 Ų103138.5 Ų138.572%0.7280%0.797SS**  trans-69.2130.4167.847.80000110.2S59 L63S59-S61 PolarHBondContact O-N 2.9Å; S59-S61 VanDerWaalsContact O-N 3.09Å; S61-L63 PolarHBondContact O-N 3.24Å
62H39.1Very low41.1Very low183 Ų183136.9 Ų136.985%0.84780%0.798SS**  trans-63116.6171.5-87.6-106.7000110.3
63L40.7Very low40.9Very low163 Ų163136 Ų13685%0.85380%0.796SS**  trans-84.2111.7162.5-73.2174.2000108.7S61 S65S61-L63 PolarHBondContact O-N 3.24Å; L63-S65 PolarHBondContact O-N 3.07Å
64T44.8Very low41.5Very low143 Ų143137.4 Ų137.488%0.87780%0.802SS**  trans-79.3102.6167.942.30000109.6
65S40Very low42Very low123 Ų123138.5 Ų138.586%0.8681%0.806SS**  trans-126.7145.9159.2-167.70000108.7L63L63-S65 PolarHBondContact O-N 3.07Å
66N45.2Very low43Very low130 Ų130134.8 Ų134.870%0.69580%0.799SS**  trans-111.1158.5-155.1-160.215000113.8
67N43.7Very low43.6Very low125 Ų125142.3 Ų142.367%0.66881%0.808SS**  trans58.590.4163.9-60.7-35.8000118.1
68H43.8Very low45.1Very low205 Ų205139 Ų13995%0.94979%0.794SS**  -140.3147.2123-786.3000105.7
69G39.5Very low47.1Very low84 Ų84141.4 Ų141.487%0.86679%0.787SS**  cis151.741.22.200000114
70G38.6Very low48.8Very low70 Ų70141.7 Ų141.772%0.72279%0.785SS**  trans138.6123.3171.500000117.1
71K46.1Very low50.6Low189 Ų189140.3 Ų140.382%0.82277%0.771SS**  trans19.8138.8145-59.7178.6-179.4177.90121.1
72Q44Very low52.9Low181 Ų181137.4 Ų137.485%0.84675%0.747SS**  trans72.1143.9157.9-64.7159.5-4.200115.1
73S37.1Very low55.3Low108 Ų108136.6 Ų136.676%0.75574%0.737SS**  cis-139.2173.19.1-120.50000114.3E75S73-E75 PolarHBondContact O-N 3.08Å
74Q46.8Very low57.5Low197 Ų197134.6 Ų134.692%0.92172%0.724SS**  trans-65.582.5-178.2178.9-170.5-22.400113.5
75E51.2Low59.7Low187 Ų187135.4 Ų135.487%0.87471%0.711SS**  trans-150146.2175.5-151.6152.8-143.300113.3S73S73-E75 PolarHBondContact O-N 3.08Å
76G56.5Low62.1Low59 Ų59133.1 Ų133.161%0.60869%0.689SS**  trans88.37.5171.600000118.3M78G76-M78 PolarHBondContact O-N 3.49Å
77Y50.5Low64.2Low226 Ų226129.1 Ų129.189%0.88667%0.674SS**  trans-7663.2174.6-113.5-84.6000113.1K79Y77-K79 PolarHBondContact O-N 3.39Å
78M65.4Low66.5Low115 Ų115129.9 Ų129.957%0.56767%0.671SS**  trans-55.8130158.5-63.3-54.4-5700108.2G76 D82G76-M78 PolarHBondContact O-N 3.49Å; M78-D82 HydrophobicContact CB-CB 4.24Å; M78-D82 HydrophobicContact CE-CB 3.73Å
79K82.9Confident68.7Low146 Ų146124.9 Ų124.964%0.63565%0.648SS**  trans-60.9157.1-175.6-75.8178.7173.9176.90110.5Y77 D81 D82 R83Y77-K79 PolarHBondContact O-N 3.39Å; K79-D81 PolarHBondContact O-N 3.47Å; K79-D81 VanDerWaalsContact O-N 3.12Å; K79-D82 WeakPolarHBondContact CB-OD2 3.01Å; K79-D82 PolarHBondContact N-OD2 3.03Å; K79-D82 WeakPolarHBondContact O-CB 3.4Å; K79-D82 PolarHBondContact O-N 3.02Å; K79-R83 PolarHBondContact O-N 3.39Å
80T81.6Confident71.3Confident114 Ų114126.9 Ų126.970%0.69963%0.63SS**Hα-helixtrans-52.1-37.8177.8-490000111.2R83 M84T80-R83 PolarHBondContact O-N 2.62Å; T80-M84 VanDerWaalsContact O-CB 3.3Å; T80-M84 WeakPolarHBondContact O-CB 3.12Å; T80-M84 PolarHBondContact O-N 3.47Å
81D84.8Confident73.6Confident96 Ų96132.2 Ų132.251%0.51363%0.628SS.*Hα-helixtrans-65.3-39.4176-48-57000113K79 M84 R85K79-D81 PolarHBondContact O-N 3.47Å; K79-D81 VanDerWaalsContact O-N 3.12Å; D81-M84 PolarHBondContact O-N 3.39Å; D81-R85 WeakPolarHBondContact O-CB 3.48Å; D81-R85 PolarHBondContact O-N 2.94Å
82D89.3Confident75.6Confident42 Ų42126.8 Ų126.823%0.22561%0.606CS.*Hα-helixtrans-70.6-40.1177.2-56.5-38.3000111.3M78 K79 M84 R85 L86M78-D82 HydrophobicContact CB-CB 4.24Å; M78-D82 HydrophobicContact CE-CB 3.73Å; K79-D82 WeakPolarHBondContact CB-OD2 3.01Å; K79-D82 PolarHBondContact N-OD2 3.03Å; K79-D82 WeakPolarHBondContact O-CB 3.4Å; K79-D82 PolarHBondContact O-N 3.02Å; D82-M84 VanDerWaalsContact C-N 3.34Å; D82-R85 PolarHBondContact O-N 3.1Å; D82-R85 IonicContact OD1-CZ 2.86Å; D82-R85 IonicContact OD1-NE 3.19Å; D82-R85 IonicContact OD1-NH2 2.6Å; D82-R85 PolarHBondContact OD1-NH2 3.03Å; D82-L86 WeakPolarHBondContact O-CB 3.2Å; D82-L86 PolarHBondContact O-N 3.19Å
83R88.5Confident77.8Confident166 Ų166123.9 Ų123.963%0.62659%0.592SS**Hα-helixtrans-63-41.4173.7-170.7-179.1-61.4-113.8-2.2111.1K79 T80 A87K79-R83 PolarHBondContact O-N 3.39Å; T80-R83 PolarHBondContact O-N 2.62Å; R83-A87 VanDerWaalsContact O-CB 3.31Å; R83-A87 WeakPolarHBondContact O-CB 3.29Å; R83-A87 PolarHBondContact O-N 2.84Å
84M86.5Confident80.2Confident120 Ų120126.1 Ų126.159%0.59158%0.584SS**Hα-helixtrans-67.7-41.2174.6179.2167.457.500111.9T80 D81 D82 A87 K88T80-M84 VanDerWaalsContact O-CB 3.3Å; T80-M84 WeakPolarHBondContact O-CB 3.12Å; T80-M84 PolarHBondContact O-N 3.47Å; D81-M84 PolarHBondContact O-N 3.39Å; D82-M84 VanDerWaalsContact C-N 3.34Å; M84-A87 PolarHBondContact O-N 2.81Å; M84-K88 WeakPolarHBondContact O-CB 3.31Å; M84-K88 PolarHBondContact O-N 2.86Å
85R91.9Very high82.3Confident160 Ų160123 Ų12360%0.60457%0.57SS**Hα-helixtrans-60.1-50175.9-166.1-167.5-41.5-162.58.4111.1D81 D82 A87 K88 E89D81-R85 WeakPolarHBondContact O-CB 3.48Å; D81-R85 PolarHBondContact O-N 2.94Å; D82-R85 PolarHBondContact O-N 3.1Å; D82-R85 IonicContact OD1-CZ 2.86Å; D82-R85 IonicContact OD1-NE 3.19Å; D82-R85 IonicContact OD1-NH2 2.6Å; D82-R85 PolarHBondContact OD1-NH2 3.03Å; R85-A87 VanDerWaalsContact C-N 3.31Å; R85-A87 PolarHBondContact O-N 3.38Å; R85-K88 WeakPolarHBondContact O-CB 3.36Å; R85-K88 PolarHBondContact O-N 3.46Å; R85-E89 WeakPolarHBondContact O-CB 3.43Å; R85-E89 PolarHBondContact O-N 3.23Å
86L90.7Very high84.2Confident75 Ų75120.6 Ų120.639%0.39355%0.552SS.*Hα-helixtrans-66.6-31.3177.2-173.163.2000112.5D82 E89 R90D82-L86 WeakPolarHBondContact O-CB 3.2Å; D82-L86 PolarHBondContact O-N 3.19Å; L86-E89 WeakPolarHBondContact CD1-OE2 3.34Å; L86-R90 WeakPolarHBondContact O-CG 3.18Å; L86-R90 PolarHBondContact O-N 3.27Å; L86-R90 VanDerWaalsContact O-N 3.09Å
87A89.3Confident85.7Confident46 Ų46121.7 Ų121.738%0.3855%0.55SS.*Hα-helixtrans-70.2-36.8172.100000112.5R83 M84 R85 R91R83-A87 VanDerWaalsContact O-CB 3.31Å; R83-A87 WeakPolarHBondContact O-CB 3.29Å; R83-A87 PolarHBondContact O-N 2.84Å; M84-A87 PolarHBondContact O-N 2.81Å; R85-A87 VanDerWaalsContact C-N 3.31Å; R85-A87 PolarHBondContact O-N 3.38Å; A87-R91 WeakPolarHBondContact O-CG 3.29Å; A87-R91 PolarHBondContact O-N 2.83Å
88K91.9Very high87.4Confident141 Ų141116.3 Ų116.361%0.61354%0.537SS*.Hα-helixtrans-68.2-46.6172.2-176-177.3175.2-174.40111M84 R85 R90 R91 E92M84-K88 WeakPolarHBondContact O-CB 3.31Å; M84-K88 PolarHBondContact O-N 2.86Å; R85-K88 WeakPolarHBondContact O-CB 3.36Å; R85-K88 PolarHBondContact O-N 3.46Å; K88-R90 PolarHBondContact O-N 2.86Å; K88-R91 WeakPolarHBondContact O-CA 3.24Å; K88-R91 WeakPolarHBondContact O-CB 3.44Å; K88-R91 PolarHBondContact O-N 3.25Å; K88-E92 PolarHBondContact O-N 2.9Å
89E90.1Very high88.7Confident100 Ų100112.7 Ų112.747%0.46753%0.525SS..Hα-helixtrans-56.2-46.2177.9-178.7170.3-142.500111.7R85 L86 R91 E92 E93R85-E89 WeakPolarHBondContact O-CB 3.43Å; R85-E89 PolarHBondContact O-N 3.23Å; L86-E89 WeakPolarHBondContact CD1-OE2 3.34Å; E89-R91 VanDerWaalsContact C-N 3.25Å; E89-R91 PolarHBondContact O-N 2.84Å; E89-E92 CarbonylContact O-C 3.56Å; E89-E92 PolarHBondContact O-N 3.47Å; E89-E93 VanDerWaalsContact O-CB 3.32Å; E89-E93 WeakPolarHBondContact O-CB 3.44Å; E89-E93 PolarHBondContact O-N 2.93Å
90R94.2Very high89.1Confident126 Ų126108.3 Ų108.348%0.47552%0.516SS..Hα-helixtrans-66.3-20.9173.6-69.8-179.1-172.4130.8-4.6114.1L86 K88 R94L86-R90 WeakPolarHBondContact O-CG 3.18Å; L86-R90 PolarHBondContact O-N 3.27Å; L86-R90 VanDerWaalsContact O-N 3.09Å; K88-R90 PolarHBondContact O-N 2.86Å; R90-R94 WeakPolarHBondContact O-CG 3.17Å; R90-R94 PolarHBondContact O-NH1 2.92Å
91R86.6Confident89.1Confident183 Ų183111.2 Ų111.269%0.69151%0.514SS*.Hα-helixtrans-77.1-47.9170.6-72.3175-179.7173.90.8109.5A87 K88 E89 E93 R94 E95A87-R91 WeakPolarHBondContact O-CG 3.29Å; A87-R91 PolarHBondContact O-N 2.83Å; K88-R91 WeakPolarHBondContact O-CA 3.24Å; K88-R91 WeakPolarHBondContact O-CB 3.44Å; K88-R91 PolarHBondContact O-N 3.25Å; E89-R91 VanDerWaalsContact C-N 3.25Å; E89-R91 PolarHBondContact O-N 2.84Å; R91-E93 VanDerWaalsContact C-N 3.32Å; R91-E93 PolarHBondContact O-N 3.27Å; R91-R94 WeakPolarHBondContact O-CB 3.37Å; R91-R94 PolarHBondContact O-N 3.34Å; R91-E95 PolarHBondContact O-N 3.48Å
92E88.5Confident89Confident75 Ų75110.9 Ų110.935%0.3551%0.509SS..Hα-helixtrans-62.4-36.3178.3-156.7-175.9139.600112.2K88 E89 E95 R96K88-E92 PolarHBondContact O-N 2.9Å; E89-E92 CarbonylContact O-C 3.56Å; E89-E92 PolarHBondContact O-N 3.47Å; E92-E95 WeakPolarHBondContact O-CB 3.41Å; E92-E95 PolarHBondContact O-N 3.16Å; E92-R96 WeakPolarHBondContact O-CB 3.4Å; E92-R96 WeakPolarHBondContact O-CG 3.23Å; E92-R96 PolarHBondContact O-N 2.87Å; E92-R96 IonicContact OE1-CZ 3.42Å; E92-R96 IonicContact OE1-NE 2.83Å; E92-R96 PolarHBondContact OE1-NE 2.84Å; E92-R96 IonicContact OE1-NH2 2.6Å; E92-R96 PolarHBondContact OE1-NH2 2.75Å; E92-R96 IonicContact OE2-NH2 2.99Å
93E89.6Confident89Confident119 Ų119115.4 Ų115.456%0.55653%0.529SS*.Hα-helixtrans-62.6-43.7173.4-177.2-176.7-151.400112.2E89 R91 E95 S97E89-E93 VanDerWaalsContact O-CB 3.32Å; E89-E93 WeakPolarHBondContact O-CB 3.44Å; E89-E93 PolarHBondContact O-N 2.93Å; R91-E93 VanDerWaalsContact C-N 3.32Å; R91-E93 PolarHBondContact O-N 3.27Å; E93-E95 VanDerWaalsContact C-N 3.33Å; E93-S97 WeakPolarHBondContact O-CB 3.43Å; E93-S97 PolarHBondContact O-N 3.44Å
94R87.5Confident89.1Confident155 Ų155111.7 Ų111.759%0.58552%0.521SS*.Hα-helixtrans-65.3-39.1173.6-68.2176-172.4106.1-12.2111.3R90 R91 S97 L98R90-R94 WeakPolarHBondContact O-CG 3.17Å; R90-R94 PolarHBondContact O-NH1 2.92Å; R91-R94 WeakPolarHBondContact O-CB 3.37Å; R91-R94 PolarHBondContact O-N 3.34Å; R94-S97 WeakPolarHBondContact O-CB 3.48Å; R94-S97 PolarHBondContact O-N 2.84Å; R94-L98 WeakPolarHBondContact O-CG 3.36Å; R94-L98 PolarHBondContact O-N 2.75Å
95E91.2Very high89.3Confident133 Ų133110.7 Ų110.762%0.62152%0.517SS*.Hα-helixtrans-65.3-46177-169172.8178.200111.6R91 E92 E93 S97 L98 A99R91-E95 PolarHBondContact O-N 3.48Å; E92-E95 WeakPolarHBondContact O-CB 3.41Å; E92-E95 PolarHBondContact O-N 3.16Å; E93-E95 VanDerWaalsContact C-N 3.33Å; E95-S97 VanDerWaalsContact C-N 3.31Å; E95-S97 PolarHBondContact O-N 3.3Å; E95-L98 PolarHBondContact O-N 3.03Å; E95-A99 WeakPolarHBondContact O-CB 3.21Å; E95-A99 PolarHBondContact O-N 2.9Å
96R91.6Very high89Confident136 Ų136109.5 Ų109.551%0.51351%0.513SS..Hα-helixtrans-58.2-40.7170.8-68.7168.5-162.3161.5-1.1111.7E92 A99 A100E92-R96 WeakPolarHBondContact O-CB 3.4Å; E92-R96 WeakPolarHBondContact O-CG 3.23Å; E92-R96 PolarHBondContact O-N 2.87Å; E92-R96 IonicContact OE1-CZ 3.42Å; E92-R96 IonicContact OE1-NE 2.83Å; E92-R96 PolarHBondContact OE1-NE 2.84Å; E92-R96 IonicContact OE1-NH2 2.6Å; E92-R96 PolarHBondContact OE1-NH2 2.75Å; E92-R96 IonicContact OE2-NH2 2.99Å; R96-A99 PolarHBondContact O-N 3.37Å; R96-A100 WeakPolarHBondContact O-CB 3.24Å; R96-A100 PolarHBondContact O-N 3.2Å
97S86.8Confident89Confident81 Ų81109 Ų10957%0.56651%0.509SS*.Hα-helixtrans-65.7-42.8176.7-172.90000112.4E93 R94 E95 A100 R101E93-S97 WeakPolarHBondContact O-CB 3.43Å; E93-S97 PolarHBondContact O-N 3.44Å; R94-S97 WeakPolarHBondContact O-CB 3.48Å; R94-S97 PolarHBondContact O-N 2.84Å; E95-S97 VanDerWaalsContact C-N 3.31Å; E95-S97 PolarHBondContact O-N 3.3Å; S97-A100 PolarHBondContact O-N 2.83Å; S97-R101 PolarHBondContact O-N 3.5Å
98L87.4Confident88.7Confident114 Ų114113.2 Ų113.260%0.59752%0.518SS*.Hα-helixtrans-64.1-45.1173.4-71.7170.5000111.4R94 E95 A100 R101 E102R94-L98 WeakPolarHBondContact O-CG 3.36Å; R94-L98 PolarHBondContact O-N 2.75Å; E95-L98 PolarHBondContact O-N 3.03Å; L98-A100 PolarHBondContact O-N 2.98Å; L98-R101 WeakPolarHBondContact O-CB 3.41Å; L98-R101 PolarHBondContact O-N 2.83Å; L98-E102 WeakPolarHBondContact O-CB 3.25Å; L98-E102 PolarHBondContact O-N 3.02Å
99A91.5Very high88.4Confident38 Ų38110.7 Ų110.731%0.31451%0.509SS..Hα-helixtrans-62.3-40.8176.900000112.3E95 R96 E102 Q103E95-A99 WeakPolarHBondContact O-CB 3.21Å; E95-A99 PolarHBondContact O-N 2.9Å; R96-A99 PolarHBondContact O-N 3.37Å; A99-E102 PolarHBondContact O-N 2.91Å; A99-Q103 WeakPolarHBondContact O-CB 3.42Å; A99-Q103 WeakPolarHBondContact O-CG 3.15Å; A99-Q103 PolarHBondContact O-N 2.95Å
100A91.4Very high88.2Confident55 Ų55112.6 Ų112.646%0.45551%0.511SS..Hα-helixtrans-63.7-40.6174.200000111.9R96 S97 L98 Q103 L104R96-A100 WeakPolarHBondContact O-CB 3.24Å; R96-A100 PolarHBondContact O-N 3.2Å; S97-A100 PolarHBondContact O-N 2.83Å; L98-A100 PolarHBondContact O-N 2.98Å; A100-Q103 PolarHBondContact O-N 3.3Å; A100-L104 PolarHBondContact O-N 2.79Å
101R82.3Confident87.7Confident175 Ų175113.6 Ų113.666%0.6652%0.515SS*.Hα-helixtrans-64.3-39.4172.9-178.5178.8176.1-179.9-1111.9S97 L98 L104 I105S97-R101 PolarHBondContact O-N 3.5Å; L98-R101 WeakPolarHBondContact O-CB 3.41Å; L98-R101 PolarHBondContact O-N 2.83Å; R101-L104 PolarHBondContact O-N 2.8Å; R101-I105 HydrophobicContact CG-CD1 4.29Å; R101-I105 VanDerWaalsContact O-CG1 3.32Å; R101-I105 WeakPolarHBondContact O-CG1 3.4Å; R101-I105 PolarHBondContact O-N 2.9Å
102E83Confident87.7Confident89 Ų89107.8 Ų107.842%0.41651%0.506SS..Hα-helixtrans-68.7-39.5177.7-161.7-170.9155.900112L98 A99 I105 R106L98-E102 WeakPolarHBondContact O-CB 3.25Å; L98-E102 PolarHBondContact O-N 3.02Å; A99-E102 PolarHBondContact O-N 2.91Å; E102-I105 PolarHBondContact O-N 3.41Å; E102-R106 VanDerWaalsContact CD-NH1 3.27Å; E102-R106 PolarHBondContact O-N 2.94Å; E102-R106 IonicContact OE1-CZ 3.22Å; E102-R106 IonicContact OE1-NH1 2.86Å; E102-R106 PolarHBondContact OE1-NH1 2.89Å; E102-R106 IonicContact OE1-NH2 3.31Å; E102-R106 PolarHBondContact OE1-NH2 3.36Å
103Q89.3Confident87.7Confident137 Ų137111.9 Ų111.964%0.6452%0.518SS*.Hα-helixtrans-61.2-44171.1-74.9179.98.400111.7A99 A100 I105 R106 E107A99-Q103 WeakPolarHBondContact O-CB 3.42Å; A99-Q103 WeakPolarHBondContact O-CG 3.15Å; A99-Q103 PolarHBondContact O-N 2.95Å; A100-Q103 PolarHBondContact O-N 3.3Å; Q103-I105 VanDerWaalsContact C-N 3.28Å; Q103-I105 PolarHBondContact O-N 3.26Å; Q103-R106 PolarHBondContact O-N 3.29Å; Q103-E107 WeakPolarHBondContact O-CB 3.49Å; Q103-E107 PolarHBondContact O-N 3.26Å
104L89.8Confident87.8Confident88 Ų88110.1 Ų110.146%0.46151%0.512SS..Hα-helixtrans-62.7-34.3175.3-178.662.8000112.3A100 R101 K108A100-L104 PolarHBondContact O-N 2.79Å; R101-L104 PolarHBondContact O-N 2.8Å; L104-K108 WeakPolarHBondContact O-CB 3.49Å; L104-K108 VanDerWaalsContact O-CG 3.31Å; L104-K108 WeakPolarHBondContact O-CG 3.39Å; L104-K108 PolarHBondContact O-N 3.43Å
105I90.3Very high87.8Confident98 Ų98108.3 Ų108.350%0.50351%0.51SS..Hα-helixtrans-67.5-50.5173.2-69.8163.9000110.4R101 E102 Q103 E107 K108 E109R101-I105 HydrophobicContact CG-CD1 4.29Å; R101-I105 VanDerWaalsContact O-CG1 3.32Å; R101-I105 WeakPolarHBondContact O-CG1 3.4Å; R101-I105 PolarHBondContact O-N 2.9Å; E102-I105 PolarHBondContact O-N 3.41Å; Q103-I105 VanDerWaalsContact C-N 3.28Å; Q103-I105 PolarHBondContact O-N 3.26Å; I105-E107 VanDerWaalsContact C-N 3.27Å; I105-E107 PolarHBondContact O-N 2.95Å; I105-K108 PolarHBondContact O-N 3.5Å; I105-E109 WeakPolarHBondContact O-CB 3.4Å; I105-E109 PolarHBondContact O-N 3.39Å
106R85.6Confident87.5Confident136 Ų136110 Ų11051%0.51351%0.513SS..Hα-helixtrans-60.3-34.9176.6-74.4-165178.989.911.7113E102 Q103 R110E102-R106 VanDerWaalsContact CD-NH1 3.27Å; E102-R106 PolarHBondContact O-N 2.94Å; E102-R106 IonicContact OE1-CZ 3.22Å; E102-R106 IonicContact OE1-NH1 2.86Å; E102-R106 PolarHBondContact OE1-NH1 2.89Å; E102-R106 IonicContact OE1-NH2 3.31Å; E102-R106 PolarHBondContact OE1-NH2 3.36Å; Q103-R106 PolarHBondContact O-N 3.29Å; R106-R110 WeakPolarHBondContact O-CB 3.36Å; R106-R110 PolarHBondContact O-N 3Å
107E90.8Very high87.4Confident65 Ų65108.3 Ų108.330%0.30451%0.51SS..Hα-helixtrans-69.4-45.1174.2-178.8173-155.700111.9Q103 I105 E109 R110 R111Q103-E107 WeakPolarHBondContact O-CB 3.49Å; Q103-E107 PolarHBondContact O-N 3.26Å; I105-E107 VanDerWaalsContact C-N 3.27Å; I105-E107 PolarHBondContact O-N 2.95Å; E107-E109 VanDerWaalsContact C-N 3.26Å; E107-E109 PolarHBondContact O-N 3.04Å; E107-R110 WeakPolarHBondContact O-CB 3.47Å; E107-R110 PolarHBondContact O-N 2.99Å; E107-R111 HydrophobicContact CG-CG 4.3Å; E107-R111 WeakPolarHBondContact O-CG 3.45Å; E107-R111 PolarHBondContact O-N 3.05Å; E107-R111 IonicContact OE1-CZ 2.57Å; E107-R111 VanDerWaalsContact OE1-CZ 3.29Å; E107-R111 IonicContact OE1-NE 2.95Å; E107-R111 PolarHBondContact OE1-NE 2.89Å; E107-R111 VanDerWaalsContact OE1-NE 3.1Å; E107-R111 IonicContact OE1-NH2 3.87Å; E107-R111 PolarHBondContact OE1-NH2 3.32Å; E107-R111 IonicContact OE2-NH2 3.76Å; E107-R111 PolarHBondContact OE2-NH2 2.7Å
108K83.2Confident87.5Confident134 Ų134112.2 Ų112.258%0.58351%0.513SS*.Hα-helixtrans-59-40.4174.5-76.7176.7179.1-1740111.4L104 I105 R111 A112L104-K108 WeakPolarHBondContact O-CB 3.49Å; L104-K108 VanDerWaalsContact O-CG 3.31Å; L104-K108 WeakPolarHBondContact O-CG 3.39Å; L104-K108 PolarHBondContact O-N 3.43Å; I105-K108 PolarHBondContact O-N 3.5Å; K108-R111 PolarHBondContact O-N 3.22Å; K108-A112 WeakPolarHBondContact O-CB 3.42Å; K108-A112 PolarHBondContact O-N 3.02Å
109E85Confident87.2Confident88 Ų88110.7 Ų110.741%0.41151%0.508SS..Hα-helixtrans-63-45.9174.1-162.6-163151.300111.9I105 E107 R111 A112 R113I105-E109 WeakPolarHBondContact O-CB 3.4Å; I105-E109 PolarHBondContact O-N 3.39Å; E107-E109 VanDerWaalsContact C-N 3.26Å; E107-E109 PolarHBondContact O-N 3.04Å; E109-R111 VanDerWaalsContact C-N 3.35Å; E109-R111 PolarHBondContact O-N 3.47Å; E109-A112 PolarHBondContact O-N 2.87Å; E109-R113 WeakPolarHBondContact O-CB 3.47Å; E109-R113 WeakPolarHBondContact O-CG 3.46Å; E109-R113 PolarHBondContact O-N 3.08Å; E109-R113 IonicContact OE1-CZ 2.68Å; E109-R113 IonicContact OE1-NE 2.61Å; E109-R113 PolarHBondContact OE1-NE 3.42Å; E109-R113 IonicContact OE1-NH2 3.77Å; E109-R113 PolarHBondContact OE1-NH2 3.38Å
110R86.6Confident86.9Confident139 Ų139111.4 Ų111.453%0.52551%0.508SS..Hα-helixtrans-58.6-44.6174.5-166.9-165.8-54.2121.21.8111.7R106 E107 R113 L114R106-R110 WeakPolarHBondContact O-CB 3.36Å; R106-R110 PolarHBondContact O-N 3Å; E107-R110 WeakPolarHBondContact O-CB 3.47Å; E107-R110 PolarHBondContact O-N 2.99Å; R110-R113 PolarHBondContact O-N 2.9Å; R110-L114 HydrophobicContact CG-CD1 4.25Å; R110-L114 WeakPolarHBondContact O-CB 3.27Å; R110-L114 VanDerWaalsContact O-CG 3.31Å; R110-L114 WeakPolarHBondContact O-CG 3.34Å; R110-L114 PolarHBondContact O-N 2.96Å
111R84.5Confident86.8Confident148 Ų148113.6 Ų113.656%0.55851%0.509SS*.Hα-helixtrans-64.4-38.6176.8-68.8175.6-174.2-162.97.2111.6E107 K108 E109 Q115E107-R111 HydrophobicContact CG-CG 4.3Å; E107-R111 WeakPolarHBondContact O-CG 3.45Å; E107-R111 PolarHBondContact O-N 3.05Å; E107-R111 IonicContact OE1-CZ 2.57Å; E107-R111 VanDerWaalsContact OE1-CZ 3.29Å; E107-R111 IonicContact OE1-NE 2.95Å; E107-R111 PolarHBondContact OE1-NE 2.89Å; E107-R111 VanDerWaalsContact OE1-NE 3.1Å; E107-R111 IonicContact OE1-NH2 3.87Å; E107-R111 PolarHBondContact OE1-NH2 3.32Å; E107-R111 IonicContact OE2-NH2 3.76Å; E107-R111 PolarHBondContact OE2-NH2 2.7Å; K108-R111 PolarHBondContact O-N 3.22Å; E109-R111 VanDerWaalsContact C-N 3.35Å; E109-R111 PolarHBondContact O-N 3.47Å; R111-Q115 WeakPolarHBondContact O-CG 3.44Å; R111-Q115 PolarHBondContact O-N 3.15Å; R111-Q115 VanDerWaalsContact O-N 3.1Å
112A86.6Confident87Confident60 Ų60109.9 Ų109.950%0.49650%0.499SS..Hα-helixtrans-67.6-43.1175.300000112.5K108 E109 Q115 Y116K108-A112 WeakPolarHBondContact O-CB 3.42Å; K108-A112 PolarHBondContact O-N 3.02Å; E109-A112 PolarHBondContact O-N 2.87Å; A112-Q115 PolarHBondContact O-N 2.9Å; A112-Y116 PolarHBondContact O-N 3.46Å
113R88.1Confident86.9Confident161 Ų161114.6 Ų114.661%0.60851%0.514SS*.Hα-helixtrans-57.2-49.8173.2-72.5167.8176.6-111.77.2111.2E109 R110 Q115 Y116 E117E109-R113 WeakPolarHBondContact O-CB 3.47Å; E109-R113 WeakPolarHBondContact O-CG 3.46Å; E109-R113 PolarHBondContact O-N 3.08Å; E109-R113 IonicContact OE1-CZ 2.68Å; E109-R113 IonicContact OE1-NE 2.61Å; E109-R113 PolarHBondContact OE1-NE 3.42Å; E109-R113 IonicContact OE1-NH2 3.77Å; E109-R113 PolarHBondContact OE1-NH2 3.38Å; R110-R113 PolarHBondContact O-N 2.9Å; R113-Q115 VanDerWaalsContact C-N 3.3Å; R113-Q115 PolarHBondContact O-N 3.15Å; R113-Y116 PolarHBondContact O-N 2.91Å; R113-E117 VanDerWaalsContact O-CB 3.25Å; R113-E117 WeakPolarHBondContact O-CB 3.35Å; R113-E117 PolarHBondContact O-N 3.46Å
114L91.5Very high86.1Confident82 Ų82116.4 Ų116.443%0.42952%0.515SS..Hα-helixtrans-61.5-31.9177.4-73.5165.2000113.7R110 R118R110-L114 HydrophobicContact CG-CD1 4.25Å; R110-L114 WeakPolarHBondContact O-CB 3.27Å; R110-L114 VanDerWaalsContact O-CG 3.31Å; R110-L114 WeakPolarHBondContact O-CG 3.34Å; R110-L114 PolarHBondContact O-N 2.96Å; L114-R118 WeakPolarHBondContact O-CB 3.46Å; L114-R118 VanDerWaalsContact O-CG 3.24Å; L114-R118 WeakPolarHBondContact O-CG 3.33Å; L114-R118 PolarHBondContact O-N 3Å; L114-R118 VanDerWaalsContact O-N 3.1Å
115Q87.1Confident86.1Confident117 Ų117120.2 Ų120.255%0.54752%0.523SS..Hα-helixtrans-72.6-45.2174.5-73.4-70.6-0.100111.5R111 A112 R113 R118 T119R111-Q115 WeakPolarHBondContact O-CG 3.44Å; R111-Q115 PolarHBondContact O-N 3.15Å; R111-Q115 VanDerWaalsContact O-N 3.1Å; A112-Q115 PolarHBondContact O-N 2.9Å; R113-Q115 VanDerWaalsContact C-N 3.3Å; R113-Q115 PolarHBondContact O-N 3.15Å; Q115-R118 PolarHBondContact O-N 3.44Å; Q115-T119 WeakPolarHBondContact O-CG2 3.45Å; Q115-T119 PolarHBondContact O-N 2.66Å; Q115-T119 PolarHBondContact O-OG1 2.87Å
116Y84.9Confident86.1Confident170 Ų170122.9 Ų122.967%0.66753%0.527SS*.Hα-helixtrans-58.7-49.4174.4176.1-100.6000111.3A112 R113 R118 T119 V120A112-Y116 PolarHBondContact O-N 3.46Å; R113-Y116 PolarHBondContact O-N 2.91Å; Y116-R118 PolarHBondContact O-N 2.9Å; Y116-T119 PolarHBondContact O-N 3.17Å; Y116-T119 VanDerWaalsContact O-N 3.1Å; Y116-T119 PolarHBondContact O-OG1 3.38Å; Y116-V120 HydrophobicContact CD1-CG2 4.33Å; Y116-V120 HydrophobicContact CD2-CG2 4.44Å; Y116-V120 HydrophobicContact CE1-CG2 3.89Å; Y116-V120 HydrophobicContact CE2-CG2 4.01Å; Y116-V120 WeakPolarHBondContact O-CG2 3.41Å; Y116-V120 PolarHBondContact O-N 3.2Å
117E89.8Confident86Confident100 Ų100120.9 Ų120.947%0.46753%0.526SS..Hα-helixtrans-51.7-53.2175.6-172.7164.8-133.500111.4R113 T119 V120 E121R113-E117 VanDerWaalsContact O-CB 3.25Å; R113-E117 WeakPolarHBondContact O-CB 3.35Å; R113-E117 PolarHBondContact O-N 3.46Å; E117-T119 PolarHBondContact O-N 3.1Å; E117-V120 PolarHBondContact O-N 3.38Å; E117-V120 VanDerWaalsContact O-N 3.14Å; E117-E121 WeakPolarHBondContact O-CB 3.3Å; E117-E121 WeakPolarHBondContact O-CG 3.36Å; E117-E121 PolarHBondContact O-N 3.26Å
118R88.6Confident85.8Confident162 Ų162120.9 Ų120.961%0.61153%0.526SS*.Hα-helixtrans-55.4-44.6174.3-76.8173.2-179.5-150.9-0.9113.7L114 Q115 Y116 V120 E121 E122L114-R118 WeakPolarHBondContact O-CB 3.46Å; L114-R118 VanDerWaalsContact O-CG 3.24Å; L114-R118 WeakPolarHBondContact O-CG 3.33Å; L114-R118 PolarHBondContact O-N 3Å; L114-R118 VanDerWaalsContact O-N 3.1Å; Q115-R118 PolarHBondContact O-N 3.44Å; Y116-R118 PolarHBondContact O-N 2.9Å; R118-V120 VanDerWaalsContact C-N 3.3Å; R118-V120 PolarHBondContact O-N 3.27Å; R118-E121 PolarHBondContact O-N 3.1Å; R118-E122 WeakPolarHBondContact O-CB 3.4Å; R118-E122 PolarHBondContact O-N 3.41Å
119T82.1Confident86.1Confident83 Ų83118.7 Ų118.751%0.50952%0.517SS..Hα-helixtrans-67.3-31.8179.959.40000112.8Q115 Y116 E117 R123Q115-T119 WeakPolarHBondContact O-CG2 3.45Å; Q115-T119 PolarHBondContact O-N 2.66Å; Q115-T119 PolarHBondContact O-OG1 2.87Å; Y116-T119 PolarHBondContact O-N 3.17Å; Y116-T119 VanDerWaalsContact O-N 3.1Å; Y116-T119 PolarHBondContact O-OG1 3.38Å; E117-T119 PolarHBondContact O-N 3.1Å; T119-R123 WeakPolarHBondContact O-CB 3.32Å; T119-R123 PolarHBondContact O-N 3.27Å
120V83.9Confident86.2Confident52 Ų52121.1 Ų121.132%0.31553%0.529SS..Hα-helixtrans-74-47.6174.3173.80000110.3Y116 E117 R118 E122 R123 W124Y116-V120 HydrophobicContact CD1-CG2 4.33Å; Y116-V120 HydrophobicContact CD2-CG2 4.44Å; Y116-V120 HydrophobicContact CE1-CG2 3.89Å; Y116-V120 HydrophobicContact CE2-CG2 4.01Å; Y116-V120 WeakPolarHBondContact O-CG2 3.41Å; Y116-V120 PolarHBondContact O-N 3.2Å; E117-V120 PolarHBondContact O-N 3.38Å; E117-V120 VanDerWaalsContact O-N 3.14Å; R118-V120 VanDerWaalsContact C-N 3.3Å; R118-V120 PolarHBondContact O-N 3.27Å; V120-E122 VanDerWaalsContact C-N 3.34Å; V120-E122 PolarHBondContact O-N 2.91Å; V120-R123 PolarHBondContact O-N 2.91Å; V120-W124 PolarHBondContact O-N 3.2Å
121E89.8Confident86.4Confident102 Ų102121 Ų12148%0.47753%0.528SS..Hα-helixtrans-56.5-43.5174.9-75.8-175.9162.400112.4E117 R118 W124 R125E117-E121 WeakPolarHBondContact O-CB 3.3Å; E117-E121 WeakPolarHBondContact O-CG 3.36Å; E117-E121 PolarHBondContact O-N 3.26Å; R118-E121 PolarHBondContact O-N 3.1Å; E121-W124 PolarHBondContact O-N 2.97Å; E121-R125 VanDerWaalsContact O-CB 3.25Å; E121-R125 WeakPolarHBondContact O-CB 3.35Å; E121-R125 PolarHBondContact O-N 2.81Å
122E86.6Confident86.3Confident96 Ų96118.8 Ų118.845%0.44952%0.524SS..Hα-helixtrans-67.7-39179.5-163.6-173.9161.200111.5R118 V120 R125 R126R118-E122 WeakPolarHBondContact O-CB 3.4Å; R118-E122 PolarHBondContact O-N 3.41Å; V120-E122 VanDerWaalsContact C-N 3.34Å; V120-E122 PolarHBondContact O-N 2.91Å; E122-R125 PolarHBondContact O-N 3.08Å; E122-R126 VanDerWaalsContact O-CG 3.32Å; E122-R126 WeakPolarHBondContact O-CG 3.36Å; E122-R126 PolarHBondContact O-N 3.4Å; E122-R126 IonicContact OE1-CZ 2.69Å; E122-R126 IonicContact OE1-NE 2.84Å; E122-R126 PolarHBondContact OE1-NE 2.88Å; E122-R126 IonicContact OE1-NH2 3.16Å; E122-R126 PolarHBondContact OE1-NH2 3.29Å
123R81.1Confident86.5Confident189 Ų189121 Ų12171%0.71352%0.523SS*.Hα-helixtrans-63.5-43.1173.6-173.9178.1179.4-174.9-0.2111.7T119 V120 L127T119-R123 WeakPolarHBondContact O-CB 3.32Å; T119-R123 PolarHBondContact O-N 3.27Å; V120-R123 PolarHBondContact O-N 2.91Å; R123-L127 WeakPolarHBondContact O-CG 3.39Å; R123-L127 PolarHBondContact O-N 3.48Å
124W72.7Confident86.5Confident175 Ų175117.6 Ų117.666%0.66351%0.514SS*.Hα-helixtrans-65.1-42.7174.8-89.394.7000112.3V120 E121 R126 L127 E128V120-W124 PolarHBondContact O-N 3.2Å; E121-W124 PolarHBondContact O-N 2.97Å; W124-R126 VanDerWaalsContact C-N 3.33Å; W124-R126 PolarHBondContact O-N 3.05Å; W124-L127 WeakPolarHBondContact O-CB 3.39Å; W124-L127 PolarHBondContact O-N 3.22Å; W124-L127 VanDerWaalsContact O-N 3.11Å; W124-E128 PolarHBondContact O-N 2.69Å
125R90.4Very high86.3Confident168 Ų168118.6 Ų118.663%0.63452%0.516SS*.Hα-helixtrans-57.3-44.5176.3-174.3-173-56.4-120.7-1.2111.8E121 E122 L127 E128 E129E121-R125 VanDerWaalsContact O-CB 3.25Å; E121-R125 WeakPolarHBondContact O-CB 3.35Å; E121-R125 PolarHBondContact O-N 2.81Å; E122-R125 PolarHBondContact O-N 3.08Å; R125-L127 VanDerWaalsContact C-N 3.32Å; R125-L127 PolarHBondContact O-N 3.06Å; R125-E128 PolarHBondContact O-N 2.84Å; R125-E129 VanDerWaalsContact O-CB 3.31Å; R125-E129 WeakPolarHBondContact O-CB 3.45Å; R125-E129 PolarHBondContact O-N 3.15Å
126R88.3Confident86.4Confident154 Ų154119 Ų11958%0.58152%0.522SS*.Hα-helixtrans-64.8-33.6177-68.4172.2-173.1-159.44.7112.6E122 W124 Q130E122-R126 VanDerWaalsContact O-CG 3.32Å; E122-R126 WeakPolarHBondContact O-CG 3.36Å; E122-R126 PolarHBondContact O-N 3.4Å; E122-R126 IonicContact OE1-CZ 2.69Å; E122-R126 IonicContact OE1-NE 2.84Å; E122-R126 PolarHBondContact OE1-NE 2.88Å; E122-R126 IonicContact OE1-NH2 3.16Å; E122-R126 PolarHBondContact OE1-NH2 3.29Å; W124-R126 VanDerWaalsContact C-N 3.33Å; W124-R126 PolarHBondContact O-N 3.05Å; R126-Q130 WeakPolarHBondContact O-CG 3.3Å; R126-Q130 PolarHBondContact O-N 2.93Å
127L84.6Confident86.7Confident94 Ų94119.6 Ų119.649%0.49252%0.522SS..Hα-helixtrans-72.5-44174.5-71.1169.8000112R123 W124 R125 E129 Q130 R131R123-L127 WeakPolarHBondContact O-CG 3.39Å; R123-L127 PolarHBondContact O-N 3.48Å; W124-L127 WeakPolarHBondContact O-CB 3.39Å; W124-L127 PolarHBondContact O-N 3.22Å; W124-L127 VanDerWaalsContact O-N 3.11Å; R125-L127 VanDerWaalsContact C-N 3.32Å; R125-L127 PolarHBondContact O-N 3.06Å; L127-E129 VanDerWaalsContact C-N 3.33Å; L127-E129 PolarHBondContact O-N 3.33Å; L127-Q130 WeakPolarHBondContact O-CB 3.32Å; L127-Q130 PolarHBondContact O-N 3.34Å; L127-R131 PolarHBondContact O-N 2.88Å
128E86.7Confident86.8Confident65 Ų65122.2 Ų122.230%0.30453%0.528SS..Hα-helixtrans-67.5-33.8177.4-168.562.7-158.800111.4W124 R125 R131 Q132W124-E128 PolarHBondContact O-N 2.69Å; R125-E128 PolarHBondContact O-N 2.84Å; E128-R131 VanDerWaalsContact CD-NH1 3.3Å; E128-R131 WeakPolarHBondContact O-CB 3.16Å; E128-R131 PolarHBondContact O-N 2.66Å; E128-R131 IonicContact OE1-CZ 3.46Å; E128-R131 IonicContact OE1-NE 2.67Å; E128-R131 IonicContact OE1-NH1 3.4Å; E128-R131 PolarHBondContact OE1-NH1 2.97Å; E128-R131 WeakPolarHBondContact OE2-CD 3.5Å; E128-R131 IonicContact OE2-CZ 2.67Å; E128-R131 IonicContact OE2-NH1 2.97Å; E128-R131 PolarHBondContact OE2-NH1 3.19Å; E128-Q132 WeakPolarHBondContact O-CB 3.49Å; E128-Q132 WeakPolarHBondContact O-CG 3.45Å; E128-Q132 PolarHBondContact O-N 2.82Å
129E90.1Very high86.8Confident88 Ų88116.9 Ų116.941%0.41152%0.518SS..Hα-helixtrans-65.2-38.4171.1-168.2-166.8150.600112.1R125 L127 K133R125-E129 VanDerWaalsContact O-CB 3.31Å; R125-E129 WeakPolarHBondContact O-CB 3.45Å; R125-E129 PolarHBondContact O-N 3.15Å; L127-E129 VanDerWaalsContact C-N 3.33Å; L127-E129 PolarHBondContact O-N 3.33Å; E129-K133 HydrophobicContact CG-CD 4.48Å; E129-K133 WeakPolarHBondContact O-CB 3.49Å; E129-K133 VanDerWaalsContact O-CG 3.3Å; E129-K133 WeakPolarHBondContact O-CG 3.42Å; E129-K133 PolarHBondContact O-N 2.85Å; E129-K133 VanDerWaalsContact OE1-CE 3.29Å; E129-K133 WeakPolarHBondContact OE1-CE 3.32Å; E129-K133 IonicContact OE1-NZ 3.19Å; E129-K133 PolarHBondContact OE1-NZ 2.87Å
130Q86.8Confident87.3Confident138 Ų138115.2 Ų115.265%0.64551%0.513SS*.Hα-helixtrans-65.5-42.2171.9-78.3-171.8-6.600111.7R126 L127 K133 E134R126-Q130 WeakPolarHBondContact O-CG 3.3Å; R126-Q130 PolarHBondContact O-N 2.93Å; L127-Q130 WeakPolarHBondContact O-CB 3.32Å; L127-Q130 PolarHBondContact O-N 3.34Å; Q130-K133 PolarHBondContact O-N 3.44Å; Q130-E134 PolarHBondContact O-N 3.01Å
131R89.8Confident87.8Confident136 Ų136117.7 Ų117.751%0.51353%0.528SS..Hα-helixtrans-60-47.9174.5177-175.8160.5-154.3-4.2111.5L127 E128 K133 E134 E135L127-R131 PolarHBondContact O-N 2.88Å; E128-R131 VanDerWaalsContact CD-NH1 3.3Å; E128-R131 WeakPolarHBondContact O-CB 3.16Å; E128-R131 PolarHBondContact O-N 2.66Å; E128-R131 IonicContact OE1-CZ 3.46Å; E128-R131 IonicContact OE1-NE 2.67Å; E128-R131 IonicContact OE1-NH1 3.4Å; E128-R131 PolarHBondContact OE1-NH1 2.97Å; E128-R131 WeakPolarHBondContact OE2-CD 3.5Å; E128-R131 IonicContact OE2-CZ 2.67Å; E128-R131 IonicContact OE2-NH1 2.97Å; E128-R131 PolarHBondContact OE2-NH1 3.19Å; R131-K133 VanDerWaalsContact C-N 3.32Å; R131-K133 PolarHBondContact O-N 2.98Å; R131-E134 CarbonylContact O-C 3.56Å; R131-E134 WeakPolarHBondContact O-CA 3.5Å; R131-E134 WeakPolarHBondContact O-CB 3.48Å; R131-E134 PolarHBondContact O-N 3.13Å; R131-E135 WeakPolarHBondContact O-CB 3.42Å; R131-E135 PolarHBondContact O-N 2.91Å
132Q83Confident87.9Confident103 Ų103119.4 Ų119.448%0.48154%0.536SS..Hα-helixtrans-62-37.9176.3-73.4176.66.400112.2E128 E134 E135 L136E128-Q132 WeakPolarHBondContact O-CB 3.49Å; E128-Q132 WeakPolarHBondContact O-CG 3.45Å; E128-Q132 PolarHBondContact O-N 2.82Å; Q132-E134 VanDerWaalsContact C-N 3.31Å; Q132-E134 PolarHBondContact O-N 3.32Å; Q132-E135 PolarHBondContact O-N 3.45Å; Q132-L136 WeakPolarHBondContact O-CB 3.46Å; Q132-L136 VanDerWaalsContact O-CG 3.32Å; Q132-L136 WeakPolarHBondContact O-CG 3.28Å; Q132-L136 PolarHBondContact O-N 3.3Å
133K90.3Very high88.2Confident106 Ų106120 Ų12046%0.46154%0.539SS..Hα-helixtrans-67.6-28.7173.2-75.4172.3-177.8173.30113.1E129 Q130 R131 R137E129-K133 HydrophobicContact CG-CD 4.48Å; E129-K133 WeakPolarHBondContact O-CB 3.49Å; E129-K133 VanDerWaalsContact O-CG 3.3Å; E129-K133 WeakPolarHBondContact O-CG 3.42Å; E129-K133 PolarHBondContact O-N 2.85Å; E129-K133 VanDerWaalsContact OE1-CE 3.29Å; E129-K133 WeakPolarHBondContact OE1-CE 3.32Å; E129-K133 IonicContact OE1-NZ 3.19Å; E129-K133 PolarHBondContact OE1-NZ 2.87Å; Q130-K133 PolarHBondContact O-N 3.44Å; R131-K133 VanDerWaalsContact C-N 3.32Å; R131-K133 PolarHBondContact O-N 2.98Å; K133-R137 WeakPolarHBondContact O-CD 3.5Å; K133-R137 VanDerWaalsContact O-CG 3.28Å; K133-R137 WeakPolarHBondContact O-CG 3.47Å
134E88.1Confident88.7Confident90 Ų90117.9 Ų117.942%0.42154%0.535SS..Hα-helixtrans-75.6-42.7169.7-154.7-157.1159.500111.5Q130 R131 Q132 L136 R137 R138Q130-E134 PolarHBondContact O-N 3.01Å; R131-E134 CarbonylContact O-C 3.56Å; R131-E134 WeakPolarHBondContact O-CA 3.5Å; R131-E134 WeakPolarHBondContact O-CB 3.48Å; R131-E134 PolarHBondContact O-N 3.13Å; Q132-E134 VanDerWaalsContact C-N 3.31Å; Q132-E134 PolarHBondContact O-N 3.32Å; E134-L136 PolarHBondContact O-N 3.27Å; E134-R137 CarbonylContact O-C 3.6Å; E134-R137 WeakPolarHBondContact O-CA 3.41Å; E134-R137 WeakPolarHBondContact O-CB 3.3Å; E134-R137 PolarHBondContact O-N 2.66Å; E134-R138 WeakPolarHBondContact O-CG 3.38Å; E134-R138 PolarHBondContact O-N 3.37Å; E134-R138 IonicContact OE1-CZ 3.84Å; E134-R138 IonicContact OE1-NE 3.38Å; E134-R138 PolarHBondContact OE1-NE 3.48Å; E134-R138 IonicContact OE1-NH2 3.34Å; E134-R138 PolarHBondContact OE1-NH2 3.2Å; E134-R138 IonicContact OE2-CZ 3.8Å; E134-R138 IonicContact OE2-NE 3.15Å; E134-R138 IonicContact OE2-NH2 2.66Å; E134-R138 PolarHBondContact OE2-NH2 3.07Å; E134-R138 VanDerWaalsContact OE2-NH2 3.16Å
135E88.4Confident89.3Confident103 Ų103118.6 Ų118.648%0.48154%0.538SS..Hα-helixtrans-61.8-42179.5-170.2160.6-157.100111.6R131 Q132 R137 R138 A139R131-E135 WeakPolarHBondContact O-CB 3.42Å; R131-E135 PolarHBondContact O-N 2.91Å; Q132-E135 PolarHBondContact O-N 3.45Å; E135-R137 VanDerWaalsContact C-N 3.32Å; E135-R137 PolarHBondContact O-N 3.11Å; E135-R138 PolarHBondContact O-N 2.93Å; E135-A139 VanDerWaalsContact O-CB 3.25Å; E135-A139 WeakPolarHBondContact O-CB 3.46Å; E135-A139 PolarHBondContact O-N 3.18Å
136L89.3Confident89.2Confident126 Ų126118 Ų11866%0.6654%0.535SS*.Hα-helixtrans-61.4-36170.7-73.2169.7000113Q132 E134 A140Q132-L136 WeakPolarHBondContact O-CB 3.46Å; Q132-L136 VanDerWaalsContact O-CG 3.32Å; Q132-L136 WeakPolarHBondContact O-CG 3.28Å; Q132-L136 PolarHBondContact O-N 3.3Å; E134-L136 PolarHBondContact O-N 3.27Å; L136-A140 WeakPolarHBondContact O-CB 3.41Å; L136-A140 PolarHBondContact O-N 3.16Å
137R90.9Very high89.5Confident181 Ų181114.2 Ų114.268%0.68352%0.524SS*.Hα-helixtrans-71.2-41.4175.3-71.5166.5176.8165.2-2.9111.6K133 E134 E135 A140 V141K133-R137 WeakPolarHBondContact O-CD 3.5Å; K133-R137 VanDerWaalsContact O-CG 3.28Å; K133-R137 WeakPolarHBondContact O-CG 3.47Å; E134-R137 CarbonylContact O-C 3.6Å; E134-R137 WeakPolarHBondContact O-CA 3.41Å; E134-R137 WeakPolarHBondContact O-CB 3.3Å; E134-R137 PolarHBondContact O-N 2.66Å; E135-R137 VanDerWaalsContact C-N 3.32Å; E135-R137 PolarHBondContact O-N 3.11Å; R137-A140 PolarHBondContact O-N 3.28Å; R137-V141 WeakPolarHBondContact O-CG2 3.37Å; R137-V141 PolarHBondContact O-N 2.78Å; R137-V141 VanDerWaalsContact O-N 3.11Å
138R90.8Very high89.9Confident156 Ų156114.9 Ų114.959%0.58953%0.525SS*.Hα-helixtrans-62.4-47.9174.5-69.1176.6-177.8-1686110.3E134 E135 A140 V141 E142E134-R138 WeakPolarHBondContact O-CG 3.38Å; E134-R138 PolarHBondContact O-N 3.37Å; E134-R138 IonicContact OE1-CZ 3.84Å; E134-R138 IonicContact OE1-NE 3.38Å; E134-R138 PolarHBondContact OE1-NE 3.48Å; E134-R138 IonicContact OE1-NH2 3.34Å; E134-R138 PolarHBondContact OE1-NH2 3.2Å; E134-R138 IonicContact OE2-CZ 3.8Å; E134-R138 IonicContact OE2-NE 3.15Å; E134-R138 IonicContact OE2-NH2 2.66Å; E134-R138 PolarHBondContact OE2-NH2 3.07Å; E134-R138 VanDerWaalsContact OE2-NH2 3.16Å; E135-R138 PolarHBondContact O-N 2.93Å; R138-A140 PolarHBondContact O-N 2.98Å; R138-V141 PolarHBondContact O-N 3.32Å; R138-V141 VanDerWaalsContact O-N 3.15Å; R138-E142 WeakPolarHBondContact O-CB 3.45Å; R138-E142 PolarHBondContact O-N 3.47Å
139A88.4Confident90.2Very high49 Ų49116.8 Ų116.841%0.40554%0.537SS..Hα-helixtrans-60-42.9177.100000112.3E135 V141 E142 E143E135-A139 VanDerWaalsContact O-CB 3.25Å; E135-A139 WeakPolarHBondContact O-CB 3.46Å; E135-A139 PolarHBondContact O-N 3.18Å; A139-V141 VanDerWaalsContact C-N 3.32Å; A139-V141 PolarHBondContact O-N 3.46Å; A139-E142 PolarHBondContact O-N 3.28Å; A139-E143 VanDerWaalsContact O-CB 3.3Å; A139-E143 WeakPolarHBondContact O-CB 3.49Å; A139-E143 PolarHBondContact O-N 3.15Å
140A92.9Very high90.2Very high49 Ų49116.1 Ų116.141%0.40553%0.533SS..Hα-helixtrans-66.5-30.8175.900000113.4L136 R137 R138 K144L136-A140 WeakPolarHBondContact O-CB 3.41Å; L136-A140 PolarHBondContact O-N 3.16Å; R137-A140 PolarHBondContact O-N 3.28Å; R138-A140 PolarHBondContact O-N 2.98Å; A140-K144 WeakPolarHBondContact O-CG 3.28Å; A140-K144 PolarHBondContact O-N 3.41Å; A140-K144 VanDerWaalsContact O-N 3.17Å
141V95.2Very high90.5Very high103 Ų103114.5 Ų114.562%0.62453%0.526SS*.Hα-helixtrans-75-39.2173.3169.60000111.3R137 R138 A139 K144 R145R137-V141 WeakPolarHBondContact O-CG2 3.37Å; R137-V141 PolarHBondContact O-N 2.78Å; R137-V141 VanDerWaalsContact O-N 3.11Å; R138-V141 PolarHBondContact O-N 3.32Å; R138-V141 VanDerWaalsContact O-N 3.15Å; A139-V141 VanDerWaalsContact C-N 3.32Å; A139-V141 PolarHBondContact O-N 3.46Å; V141-K144 PolarHBondContact O-N 3.03Å; V141-R145 WeakPolarHBondContact O-CB 3.33Å; V141-R145 PolarHBondContact O-N 2.83Å
142E92Very high90.7Very high139 Ų139113.8 Ų113.865%0.6553%0.529SS*.Hα-helixtrans-68.6-39175.6-174.3165.8-159.700111.9R138 A139 R145 R146R138-E142 WeakPolarHBondContact O-CB 3.45Å; R138-E142 PolarHBondContact O-N 3.47Å; A139-E142 PolarHBondContact O-N 3.28Å; E142-R145 WeakPolarHBondContact O-CB 3.29Å; E142-R145 PolarHBondContact O-N 2.57Å; E142-R146 WeakPolarHBondContact O-CB 3.35Å; E142-R146 PolarHBondContact O-N 2.99Å
143E92.2Very high91.3Very high109 Ų109116.4 Ų116.451%0.50953%0.534SS..Hα-helixtrans-60.2-49.5171.6-166.6-156.4168.300110.5A139 R145 R146 Q147A139-E143 VanDerWaalsContact O-CB 3.3Å; A139-E143 WeakPolarHBondContact O-CB 3.49Å; A139-E143 PolarHBondContact O-N 3.15Å; E143-R145 VanDerWaalsContact C-N 3.28Å; E143-R145 PolarHBondContact O-N 3.43Å; E143-R146 CarbonylContact O-C 3.6Å; E143-R146 WeakPolarHBondContact O-CA 3.49Å; E143-R146 WeakPolarHBondContact O-CB 3.44Å; E143-R146 PolarHBondContact O-N 3.49Å; E143-R146 VanDerWaalsContact O-N 3.09Å; E143-Q147 VanDerWaalsContact CD-NE2 3.32Å; E143-Q147 HydrophobicContact CG-CG 4.5Å; E143-Q147 WeakPolarHBondContact O-CG 3.42Å; E143-Q147 PolarHBondContact O-N 3.11Å; E143-Q147 PolarHBondContact OE1-NE2 3.09Å
144K92.3Very high91.6Very high144 Ų144117.7 Ų117.763%0.62654%0.541SS*.Hα-helixtrans-59.4-38.6174.6-79.6-167.9173.2-164.10112.9A140 V141 R146 Q147 Q148A140-K144 WeakPolarHBondContact O-CG 3.28Å; A140-K144 PolarHBondContact O-N 3.41Å; A140-K144 VanDerWaalsContact O-N 3.17Å; V141-K144 PolarHBondContact O-N 3.03Å; K144-R146 VanDerWaalsContact C-N 3.33Å; K144-Q147 PolarHBondContact O-N 3.23Å; K144-Q148 WeakPolarHBondContact O-CG 3.42Å; K144-Q148 PolarHBondContact O-N 3.28Å
145R85.7Confident92Very high190 Ų190122.2 Ų122.272%0.71756%0.555SS**Hα-helixtrans-65.7-37.9175.4-172.2176.8-173.4156.94.2111.7V141 E142 E143 L149V141-R145 WeakPolarHBondContact O-CB 3.33Å; V141-R145 PolarHBondContact O-N 2.83Å; E142-R145 WeakPolarHBondContact O-CB 3.29Å; E142-R145 PolarHBondContact O-N 2.57Å; E143-R145 VanDerWaalsContact C-N 3.28Å; E143-R145 PolarHBondContact O-N 3.43Å; R145-L149 WeakPolarHBondContact O-CG 3.43Å; R145-L149 PolarHBondContact O-N 3.46Å
146R88.4Confident92.4Very high154 Ų154123 Ų12358%0.58156%0.562SS**Hα-helixtrans-67-48.4173.4178.3-174.8162.5166.50.6111.3E142 E143 K144 Q148 L149 E150E142-R146 WeakPolarHBondContact O-CB 3.35Å; E142-R146 PolarHBondContact O-N 2.99Å; E143-R146 CarbonylContact O-C 3.6Å; E143-R146 WeakPolarHBondContact O-CA 3.49Å; E143-R146 WeakPolarHBondContact O-CB 3.44Å; E143-R146 PolarHBondContact O-N 3.49Å; E143-R146 VanDerWaalsContact O-N 3.09Å; K144-R146 VanDerWaalsContact C-N 3.33Å; R146-Q148 VanDerWaalsContact C-N 3.27Å; R146-Q148 PolarHBondContact O-N 3.34Å; R146-L149 CarbonylContact O-C 3.59Å; R146-L149 PolarHBondContact O-N 3.06Å; R146-E150 IonicContact CZ-OE2 2.66Å; R146-E150 IonicContact NE-OE2 3.37Å; R146-E150 PolarHBondContact NE-OE2 2.76Å; R146-E150 IonicContact NH2-OE1 3.16Å; R146-E150 PolarHBondContact NH2-OE1 2.81Å; R146-E150 IonicContact NH2-OE2 3.23Å; R146-E150 PolarHBondContact NH2-OE2 3.18Å; R146-E150 VanDerWaalsContact NH2-OE2 3.11Å; R146-E150 WeakPolarHBondContact O-CB 3.43Å; R146-E150 PolarHBondContact O-N 2.83Å
147Q93.9Very high92.7Very high76 Ų76120.5 Ų120.536%0.35555%0.546SS..Hα-helixtrans-52.4-46176.5-73169.5-000110.7E143 K144 L149 E150 E151E143-Q147 VanDerWaalsContact CD-NE2 3.32Å; E143-Q147 HydrophobicContact CG-CG 4.5Å; E143-Q147 WeakPolarHBondContact O-CG 3.42Å; E143-Q147 PolarHBondContact O-N 3.11Å; E143-Q147 PolarHBondContact OE1-NE2 3.09Å; K144-Q147 PolarHBondContact O-N 3.23Å; Q147-L149 PolarHBondContact O-N 3.31Å; Q147-E150 CarbonylContact O-C 3.56Å; Q147-E150 PolarHBondContact O-N 3.47Å; Q147-E151 WeakPolarHBondContact O-CB 3.47Å; Q147-E151 WeakPolarHBondContact O-CG 3.33Å; Q147-E151 PolarHBondContact O-N 2.96Å
148Q93.3Very high92.9Very high108 Ų108114.5 Ų114.551%0.50554%0.536SS..Hα-helixtrans-61.7-40.8175.7-70.6-66.7-80.100113.7K144 R146 E150 E151 E152K144-Q148 WeakPolarHBondContact O-CG 3.42Å; K144-Q148 PolarHBondContact O-N 3.28Å; R146-Q148 VanDerWaalsContact C-N 3.27Å; R146-Q148 PolarHBondContact O-N 3.34Å; Q148-E150 VanDerWaalsContact C-N 3.33Å; Q148-E151 PolarHBondContact NE2-OE1 3.17Å; Q148-E151 VanDerWaalsContact NE2-OE1 3.15Å; Q148-E151 PolarHBondContact NE2-OE2 2.77Å; Q148-E152 WeakPolarHBondContact O-CB 3.33Å; Q148-E152 WeakPolarHBondContact O-CG 3.4Å; Q148-E152 PolarHBondContact O-N 3.45Å
149L92Very high93.2Very high105 Ų105111.8 Ų111.855%0.5553%0.533SS..Hα-helixtrans-69.3-31.3175-68.8168.8000112.6R145 R146 Q147 R153R145-L149 WeakPolarHBondContact O-CG 3.43Å; R145-L149 PolarHBondContact O-N 3.46Å; R146-L149 CarbonylContact O-C 3.59Å; R146-L149 PolarHBondContact O-N 3.06Å; Q147-L149 PolarHBondContact O-N 3.31Å; L149-R153 VanDerWaalsContact O-CB 3.26Å; L149-R153 WeakPolarHBondContact O-CB 3.47Å; L149-R153 PolarHBondContact O-N 3.37Å
150E90.2Very high93.6Very high73 Ų73115 Ų11534%0.34154%0.54SS..Hα-helixtrans-75.2-40.4177.8-152.3136.5-14700110R146 Q147 Q148 R153 E154R146-E150 IonicContact CZ-OE2 2.66Å; R146-E150 IonicContact NE-OE2 3.37Å; R146-E150 PolarHBondContact NE-OE2 2.76Å; R146-E150 IonicContact NH2-OE1 3.16Å; R146-E150 PolarHBondContact NH2-OE1 2.81Å; R146-E150 IonicContact NH2-OE2 3.23Å; R146-E150 PolarHBondContact NH2-OE2 3.18Å; R146-E150 VanDerWaalsContact NH2-OE2 3.11Å; R146-E150 WeakPolarHBondContact O-CB 3.43Å; R146-E150 PolarHBondContact O-N 2.83Å; Q147-E150 CarbonylContact O-C 3.56Å; Q147-E150 PolarHBondContact O-N 3.47Å; Q148-E150 VanDerWaalsContact C-N 3.33Å; E150-R153 WeakPolarHBondContact O-CB 3.32Å; E150-R153 PolarHBondContact O-N 3.03Å; E150-E154 WeakPolarHBondContact O-CB 3.23Å; E150-E154 WeakPolarHBondContact O-CG 3.31Å; E150-E154 PolarHBondContact O-N 3.31Å
151E93.6Very high93.7Very high105 Ų105118.4 Ų118.449%0.49155%0.546SS..Hα-helixtrans-61.9-45.3168.9-75.5171.2-140.800112.8Q147 Q148 R153 E154 R155Q147-E151 WeakPolarHBondContact O-CB 3.47Å; Q147-E151 WeakPolarHBondContact O-CG 3.33Å; Q147-E151 PolarHBondContact O-N 2.96Å; Q148-E151 PolarHBondContact NE2-OE1 3.17Å; Q148-E151 VanDerWaalsContact NE2-OE1 3.15Å; Q148-E151 PolarHBondContact NE2-OE2 2.77Å; E151-R153 VanDerWaalsContact C-N 3.33Å; E151-R153 PolarHBondContact O-N 3.5Å; E151-E154 PolarHBondContact O-N 2.78Å; E151-R155 VanDerWaalsContact O-CB 3.23Å; E151-R155 WeakPolarHBondContact O-CB 3.47Å; E151-R155 PolarHBondContact O-N 3.45Å
152E94.8Very high93.8Very high121 Ų121121.4 Ų121.457%0.56555%0.546SS*.Hα-helixtrans-63-40.7175.5-78.9-169.6150.600111.4Q148 R155 L156Q148-E152 WeakPolarHBondContact O-CB 3.33Å; Q148-E152 WeakPolarHBondContact O-CG 3.4Å; Q148-E152 PolarHBondContact O-N 3.45Å; E152-R155 PolarHBondContact O-N 2.91Å; E152-L156 WeakPolarHBondContact O-CG 3.26Å; E152-L156 PolarHBondContact O-N 3.03Å
153R95.4Very high93.9Very high157 Ų157117.7 Ų117.759%0.59254%0.536SS*.Hα-helixtrans-62.9-49.4174.2178.3-175.1173-166.6-1.9111.7L149 E150 E151 R155 L156 E157L149-R153 VanDerWaalsContact O-CB 3.26Å; L149-R153 WeakPolarHBondContact O-CB 3.47Å; L149-R153 PolarHBondContact O-N 3.37Å; E150-R153 WeakPolarHBondContact O-CB 3.32Å; E150-R153 PolarHBondContact O-N 3.03Å; E151-R153 VanDerWaalsContact C-N 3.33Å; E151-R153 PolarHBondContact O-N 3.5Å; R153-R155 VanDerWaalsContact C-N 3.29Å; R153-R155 PolarHBondContact O-N 2.86Å; R153-L156 PolarHBondContact O-N 3.41Å; R153-E157 WeakPolarHBondContact O-CB 3.49Å; R153-E157 PolarHBondContact O-N 2.98Å
154E95.8Very high94Very high133 Ų133117.6 Ų117.662%0.62154%0.538SS*.Hα-helixtrans-61.2-38.4176.9-77.7-169173.200111.7E150 E151 E157 A158E150-E154 WeakPolarHBondContact O-CB 3.23Å; E150-E154 WeakPolarHBondContact O-CG 3.31Å; E150-E154 PolarHBondContact O-N 3.31Å; E151-E154 PolarHBondContact O-N 2.78Å; E154-E157 PolarHBondContact O-N 3.42Å; E154-A158 VanDerWaalsContact O-CB 3.22Å; E154-A158 WeakPolarHBondContact O-CB 3.45Å; E154-A158 PolarHBondContact O-N 3.42Å
155R97.1Very high94Very high186 Ų186115.9 Ų115.970%0.70253%0.532SS*.Hα-helixtrans-63.4-42.4175.1-178.5177.5-179.5163.90.6112.3E151 E152 R153 L159E151-R155 VanDerWaalsContact O-CB 3.23Å; E151-R155 WeakPolarHBondContact O-CB 3.47Å; E151-R155 PolarHBondContact O-N 3.45Å; E152-R155 PolarHBondContact O-N 2.91Å; R153-R155 VanDerWaalsContact C-N 3.29Å; R153-R155 PolarHBondContact O-N 2.86Å; R155-L159 WeakPolarHBondContact O-CB 3.35Å; R155-L159 VanDerWaalsContact O-CG 3.31Å; R155-L159 WeakPolarHBondContact O-CG 3.25Å; R155-L159 PolarHBondContact O-N 3.24Å
156L96.6Very high94.4Very high120 Ų120113 Ų11363%0.62852%0.522SS*.Hα-helixtrans-66.9-41.1174.3-72.2168.6000111.6E152 R153 L159 M160E152-L156 WeakPolarHBondContact O-CG 3.26Å; E152-L156 PolarHBondContact O-N 3.03Å; R153-L156 PolarHBondContact O-N 3.41Å; L156-L159 PolarHBondContact O-N 2.99Å; L156-M160 WeakPolarHBondContact O-CB 3.42Å; L156-M160 PolarHBondContact O-N 3Å
157E95.3Very high94.5Very high72 Ų72108.7 Ų108.734%0.33652%0.515SS..Hα-helixtrans-66-39.9176.6-165.7-178.812800111.9R153 E154 M160 K161R153-E157 WeakPolarHBondContact O-CB 3.49Å; R153-E157 PolarHBondContact O-N 2.98Å; E154-E157 PolarHBondContact O-N 3.42Å; E157-M160 PolarHBondContact O-N 3.44Å; E157-K161 HydrophobicContact CG-CD 4.4Å; E157-K161 WeakPolarHBondContact O-CB 3.22Å; E157-K161 WeakPolarHBondContact O-CG 3.39Å; E157-K161 PolarHBondContact O-N 3.27Å; E157-K161 WeakPolarHBondContact OE1-CE 3.45Å; E157-K161 IonicContact OE1-NZ 2.93Å; E157-K161 PolarHBondContact OE1-NZ 3Å
158A95.8Very high94.2Very high56 Ų56109.5 Ų109.546%0.46352%0.521SS..Hα-helixtrans-66.1-38.4174.200000112.1E154 R162E154-A158 VanDerWaalsContact O-CB 3.22Å; E154-A158 WeakPolarHBondContact O-CB 3.45Å; E154-A158 PolarHBondContact O-N 3.42Å; A158-R162 VanDerWaalsContact O-CB 3.22Å; A158-R162 WeakPolarHBondContact O-CB 3.45Å; A158-R162 PolarHBondContact O-N 3.42Å
159L96.8Very high93.7Very high99 Ų99109 Ų10952%0.51852%0.519SS..Hα-helixtrans-63.1-42.2170.9-77.6168.7000111.5R155 L156 R162 S163R155-L159 WeakPolarHBondContact O-CB 3.35Å; R155-L159 VanDerWaalsContact O-CG 3.31Å; R155-L159 WeakPolarHBondContact O-CG 3.25Å; R155-L159 PolarHBondContact O-N 3.24Å; L156-L159 PolarHBondContact O-N 2.99Å; L159-R162 PolarHBondContact O-N 2.78Å; L159-S163 WeakPolarHBondContact O-CB 3.48Å; L159-S163 PolarHBondContact O-N 3.37Å
160M95.9Very high93.1Very high115 Ų115109.3 Ų109.357%0.56752%0.521SS*.Hα-helixtrans-64.8-48.4176.6-170.6174.670.300111.5L156 E157 R162 S163 L164L156-M160 WeakPolarHBondContact O-CB 3.42Å; L156-M160 PolarHBondContact O-N 3Å; E157-M160 PolarHBondContact O-N 3.44Å; M160-R162 PolarHBondContact O-N 3.21Å; M160-S163 WeakPolarHBondContact O-CA 3.34Å; M160-S163 WeakPolarHBondContact O-CB 3.25Å; M160-S163 PolarHBondContact O-N 3.05Å; M160-L164 HydrophobicContact CG-CD1 4.27Å; M160-L164 WeakPolarHBondContact O-CG 3.45Å; M160-L164 PolarHBondContact O-N 2.75Å
161K95.7Very high92.6Very high121 Ų121110.3 Ų110.353%0.52653%0.525SS..Hα-helixtrans-56.4-48174.1-75.4172179.5168.40111.6E157 S163 L164 E165E157-K161 HydrophobicContact CG-CD 4.4Å; E157-K161 WeakPolarHBondContact O-CB 3.22Å; E157-K161 WeakPolarHBondContact O-CG 3.39Å; E157-K161 PolarHBondContact O-N 3.27Å; E157-K161 WeakPolarHBondContact OE1-CE 3.45Å; E157-K161 IonicContact OE1-NZ 2.93Å; E157-K161 PolarHBondContact OE1-NZ 3Å; K161-S163 PolarHBondContact O-N 3.43Å; K161-L164 PolarHBondContact O-N 3.1Å; K161-E165 WeakPolarHBondContact O-CB 3.31Å; K161-E165 PolarHBondContact O-N 3.14Å
162R96.4Very high91.9Very high166 Ų166111.1 Ų111.163%0.62653%0.529SS*.Hα-helixtrans-67.6-21.2175.6-172.6172.9-178.81702.1113.3A158 L159 M160 R166A158-R162 VanDerWaalsContact O-CB 3.22Å; A158-R162 WeakPolarHBondContact O-CB 3.45Å; A158-R162 PolarHBondContact O-N 3.42Å; L159-R162 PolarHBondContact O-N 2.78Å; M160-R162 PolarHBondContact O-N 3.21Å; R162-R166 WeakPolarHBondContact O-CB 3.43Å; R162-R166 VanDerWaalsContact O-CG 3.26Å; R162-R166 WeakPolarHBondContact O-CG 3.48Å; R162-R166 PolarHBondContact O-N 2.93Å; R162-R166 PolarHBondContact O-NE 2.91Å
163S95.3Very high90.7Very high61 Ų61113.3 Ų113.343%0.42753%0.532SS..Hα-helixtrans-76-49.3170.9-151.90000110.8L159 M160 K161 E165 R166 S167L159-S163 WeakPolarHBondContact O-CB 3.48Å; L159-S163 PolarHBondContact O-N 3.37Å; M160-S163 WeakPolarHBondContact O-CA 3.34Å; M160-S163 WeakPolarHBondContact O-CB 3.25Å; M160-S163 PolarHBondContact O-N 3.05Å; K161-S163 PolarHBondContact O-N 3.43Å; S163-E165 VanDerWaalsContact C-N 3.33Å; S163-E165 PolarHBondContact O-N 3.47Å; S163-R166 PolarHBondContact O-N 2.98Å; S163-R166 VanDerWaalsContact O-N 3.16Å; S163-S167 PolarHBondContact O-N 3.37Å; S163-S167 PolarHBondContact O-OG 3.41Å
164L94.2Very high89.2Confident108 Ų108110.5 Ų110.557%0.56553%0.532SS*.Hα-helixtrans-58.8-43.1176.7-69.2168.4000111.9M160 K161 S167 L168M160-L164 HydrophobicContact CG-CD1 4.27Å; M160-L164 WeakPolarHBondContact O-CG 3.45Å; M160-L164 PolarHBondContact O-N 2.75Å; K161-L164 PolarHBondContact O-N 3.1Å; L164-S167 VanDerWaalsContact CA-OG 3.29Å; L164-S167 WeakPolarHBondContact CA-OG 3.38Å; L164-S167 PolarHBondContact O-N 3.24Å; L164-S167 PolarHBondContact O-OG 2.95Å; L164-L168 WeakPolarHBondContact O-CB 3.32Å; L164-L168 PolarHBondContact O-N 3.44Å
165E92.9Very high87.5Confident108 Ų108110.9 Ų110.951%0.50553%0.532SS..Hα-helixtrans-61.5-45.3174.7-165.9-162.6164.600111.6K161 S163 S167 L168 Q169K161-E165 WeakPolarHBondContact O-CB 3.31Å; K161-E165 PolarHBondContact O-N 3.14Å; S163-E165 VanDerWaalsContact C-N 3.33Å; S163-E165 PolarHBondContact O-N 3.47Å; E165-S167 PolarHBondContact O-N 2.81Å; E165-L168 PolarHBondContact O-N 3.26Å; E165-Q169 WeakPolarHBondContact O-CB 3.49Å; E165-Q169 VanDerWaalsContact O-CG 3.31Å; E165-Q169 WeakPolarHBondContact O-CG 3.3Å; E165-Q169 PolarHBondContact O-N 3.34Å; E165-Q169 PolarHBondContact OE1-NE2 3.05Å
166R92.9Very high85.6Confident130 Ų130112 Ų11249%0.49154%0.536SS..Hα-helixtrans-64.3-38.8176.6-78-178.7-61.9158.17.3112.4R162 S163 Q169 L170R162-R166 WeakPolarHBondContact O-CB 3.43Å; R162-R166 VanDerWaalsContact O-CG 3.26Å; R162-R166 WeakPolarHBondContact O-CG 3.48Å; R162-R166 PolarHBondContact O-N 2.93Å; R162-R166 PolarHBondContact O-NE 2.91Å; S163-R166 PolarHBondContact O-N 2.98Å; S163-R166 VanDerWaalsContact O-N 3.16Å; R166-Q169 PolarHBondContact O-N 2.86Å; R166-L170 WeakPolarHBondContact O-CB 3.42Å; R166-L170 VanDerWaalsContact O-CG 3.29Å; R166-L170 WeakPolarHBondContact O-CG 3.49Å; R166-L170 PolarHBondContact O-N 3.44Å
167S89.8Confident83.7Confident63 Ų63115.9 Ų115.944%0.44154%0.543SS..Hα-helixtrans-64.6-40173.141.20000112.2S163 L164 E165 L170 E171S163-S167 PolarHBondContact O-N 3.37Å; S163-S167 PolarHBondContact O-OG 3.41Å; L164-S167 VanDerWaalsContact CA-OG 3.29Å; L164-S167 WeakPolarHBondContact CA-OG 3.38Å; L164-S167 PolarHBondContact O-N 3.24Å; L164-S167 PolarHBondContact O-OG 2.95Å; E165-S167 PolarHBondContact O-N 2.81Å; S167-L170 PolarHBondContact O-N 3.04Å; S167-E171 WeakPolarHBondContact O-CB 3.26Å; S167-E171 PolarHBondContact O-N 3.39Å
168L88.8Confident81.9Confident92 Ų92115.6 Ų115.648%0.48256%0.559SS.*Hα-helixtrans-66.3-41.1176.3-177.364.2000111.9L164 E165 E171 Q172L164-L168 WeakPolarHBondContact O-CB 3.32Å; L164-L168 PolarHBondContact O-N 3.44Å; E165-L168 PolarHBondContact O-N 3.26Å; L168-E171 PolarHBondContact O-N 2.87Å; L168-Q172 WeakPolarHBondContact O-CG 3.44Å; L168-Q172 PolarHBondContact O-N 2.79Å
169Q82.4Confident79.9Confident97 Ų97123.9 Ų123.945%0.45358%0.578SS.*Hα-helixtrans-63.7-40.1173.2-71.3176.913.200111.7E165 R166 Q172 R173E165-Q169 WeakPolarHBondContact O-CB 3.49Å; E165-Q169 VanDerWaalsContact O-CG 3.31Å; E165-Q169 WeakPolarHBondContact O-CG 3.3Å; E165-Q169 PolarHBondContact O-N 3.34Å; E165-Q169 PolarHBondContact OE1-NE2 3.05Å; R166-Q169 PolarHBondContact O-N 2.86Å; Q169-Q172 PolarHBondContact O-N 2.81Å; Q169-R173 WeakPolarHBondContact O-CG 3.5Å; Q169-R173 PolarHBondContact O-N 2.86Å
170L79.8Confident77.9Confident113 Ų113122 Ų12259%0.59258%0.583SS**Hα-helixtrans-63.3-46.7173.7-77168.8000111.2R166 S167 Q172 R173 T174R166-L170 WeakPolarHBondContact O-CB 3.42Å; R166-L170 VanDerWaalsContact O-CG 3.29Å; R166-L170 WeakPolarHBondContact O-CG 3.49Å; R166-L170 PolarHBondContact O-N 3.44Å; S167-L170 PolarHBondContact O-N 3.04Å; L170-Q172 VanDerWaalsContact C-N 3.31Å; L170-Q172 PolarHBondContact O-N 3.39Å; L170-R173 CarbonylContact O-C 3.56Å; L170-R173 WeakPolarHBondContact O-CA 3.49Å; L170-R173 PolarHBondContact O-N 3.39Å; L170-T174 PolarHBondContact O-N 2.79Å; L170-T174 PolarHBondContact O-OG1 2.86Å; L170-T174 VanDerWaalsContact O-OG1 3.09Å
171E80Confident75.5Confident93 Ų93127.6 Ų127.644%0.43560%0.599SS.*Hα-helixtrans-58.7-41.8177.2-162.6-163.8150.800111.9S167 L168 T174 K175S167-E171 WeakPolarHBondContact O-CB 3.26Å; S167-E171 PolarHBondContact O-N 3.39Å; L168-E171 PolarHBondContact O-N 2.87Å; E171-T174 PolarHBondContact O-N 2.83Å; E171-K175 WeakPolarHBondContact O-CG 3.22Å; E171-K175 PolarHBondContact O-N 2.88Å; E171-K175 WeakPolarHBondContact OE1-CE 3.43Å; E171-K175 IonicContact OE1-NZ 3.03Å; E171-K175 PolarHBondContact OE1-NZ 3.41Å
172Q77.8Confident73.3Confident123 Ų123127 Ų12758%0.57561%0.608SS**Hα-helixtrans-65.4-35.6173.3-72-176.228.100113L168 Q169 L170 R176L168-Q172 WeakPolarHBondContact O-CG 3.44Å; L168-Q172 PolarHBondContact O-N 2.79Å; Q169-Q172 PolarHBondContact O-N 2.81Å; L170-Q172 VanDerWaalsContact C-N 3.31Å; L170-Q172 PolarHBondContact O-N 3.39Å; Q172-R176 PolarHBondContact O-N 3.11Å
173R69.4Low71.3Confident167 Ų167125.7 Ų125.763%0.6362%0.621SS**Hα-helixtrans-69.4-43173-70.7-175.587.4160.45.3111.1Q169 L170 K175 R176 W177Q169-R173 WeakPolarHBondContact O-CG 3.5Å; Q169-R173 PolarHBondContact O-N 2.86Å; L170-R173 CarbonylContact O-C 3.56Å; L170-R173 WeakPolarHBondContact O-CA 3.49Å; L170-R173 PolarHBondContact O-N 3.39Å; R173-K175 VanDerWaalsContact C-N 3.3Å; R173-K175 PolarHBondContact O-N 2.83Å; R173-R176 WeakPolarHBondContact O-CA 3.34Å; R173-R176 WeakPolarHBondContact O-CB 3.42Å; R173-R176 PolarHBondContact O-N 2.84Å; R173-W177 VanDerWaalsContact O-CD1 3.32Å; R173-W177 PolarHBondContact O-N 2.77Å
174T63.7Low68.7Low97 Ų97126.2 Ų126.260%0.59564%0.636SS**Hα-helixtrans-57.4-43.4174.6-54.90000111.2L170 E171 R176 W177 G178L170-T174 PolarHBondContact O-N 2.79Å; L170-T174 PolarHBondContact O-OG1 2.86Å; L170-T174 VanDerWaalsContact O-OG1 3.09Å; E171-T174 PolarHBondContact O-N 2.83Å; T174-R176 PolarHBondContact O-N 2.86Å; T174-W177 PolarHBondContact O-N 2.81Å; T174-G178 PolarHBondContact O-N 3.33Å
175K61.8Low66.5Low142 Ų142126.2 Ų126.262%0.61765%0.651SS**Hα-helixtrans-64.9-20.5174.4-70.9173.2-174.1174.80114.3E171 R173E171-K175 WeakPolarHBondContact O-CG 3.22Å; E171-K175 PolarHBondContact O-N 2.88Å; E171-K175 WeakPolarHBondContact OE1-CE 3.43Å; E171-K175 IonicContact OE1-NZ 3.03Å; E171-K175 PolarHBondContact OE1-NZ 3.41Å; R173-K175 VanDerWaalsContact C-N 3.3Å; R173-K175 PolarHBondContact O-N 2.83Å
176R55.7Low64.1Low210 Ų210124.3 Ų124.379%0.79266%0.661SS**Hα-helixtrans-87.1-33.1173.8-170.6-179.4-68.5-105.13.7113Q172 R173 T174Q172-R176 PolarHBondContact O-N 3.11Å; R173-R176 WeakPolarHBondContact O-CA 3.34Å; R173-R176 WeakPolarHBondContact O-CB 3.42Å; R173-R176 PolarHBondContact O-N 2.84Å; T174-R176 PolarHBondContact O-N 2.86Å
177W56.5Low61.8Low201 Ų201126.1 Ų126.176%0.76168%0.68SS**Hα-helixtrans-89.5-21.8179.4-74.781.5000113.6R173 T174 R179R173-W177 VanDerWaalsContact O-CD1 3.32Å; R173-W177 PolarHBondContact O-N 2.77Å; T174-W177 PolarHBondContact O-N 2.81Å; W177-R179 PolarHBondContact O-N 3.26Å
178G57.4Low59.5Low66 Ų66129 Ų12968%0.6870%0.699SS**SBendtrans-73.725.2178.700000116.3T174T174-G178 PolarHBondContact O-N 3.33Å
179R55.5Low57.6Low230 Ų230132.7 Ų132.787%0.86871%0.714SS**SBendtrans-128.961.8-178.4-82.5-90.3-79.4-89.70.5109.9W177W177-R179 PolarHBondContact O-N 3.26Å
180G54.1Low55.8Low60 Ų60134.5 Ų134.562%0.61973%0.726SS**SBendtrans-163.29.9-170.100000119.2
181Y46.1Very low54.1Low232 Ų232134.6 Ų134.691%0.9173%0.732SS**  trans-139.7127.4171.5-91-84.5000111.6
182P49.5Very low53Low108 Ų108136 Ų13670%0.70175%0.748SS**  trans-81.4153.7169.134.2-33.5000111.1G184P182-G184 VanDerWaalsContact C-N 3.32Å; P182-G184 PolarHBondContact O-N 3.34Å
183P52.9Low51.4Low139 Ų139138.2 Ų138.290%0.90376%0.763SS**  trans-7682.2172.432.1-34000110.5
184G40.6Very low50.8Low71 Ų71135 Ų13573%0.73277%0.765SS**  trans-76.3124.5168.800000110.7P182P182-G184 VanDerWaalsContact C-N 3.32Å; P182-G184 PolarHBondContact O-N 3.34Å
185A47.9Very low49.5Very low108 Ų108140.2 Ų140.289%0.89378%0.779SS**  trans-71.5153.2176.900000112.1
186G43.2Very low49Very low69 Ų69139.4 Ų139.471%0.71179%0.791SS**  trans-176.2103.3175.300000110.8
187D44.2Very low48.3Very low168 Ų168134.5 Ų134.590%0.89880%0.796SS**  trans-72137.7-177.6-60.7-65.3000112.6
188C42.6Very low47.5Very low122 Ų122129.5 Ų129.582%0.82480%0.798SS**  trans-156.492.1154.741.30000111.4
189E48Very low46.8Very low171 Ų171132.1 Ų132.180%0.79981%0.805SS**  trans-53136.9158.4-78.2-77.216400110.9
190N44.7Very low46Very low134 Ų134124.2 Ų124.272%0.71779%0.789SS**  154.3120.3128.8-88.3-82.5000114.3
191V45.4Very low45.2Very low116 Ų116130.9 Ų130.970%0.70380%0.802SS**  trans56.9127.3139.9-172.30000120.3
192P56.4Low45.1Very low121 Ų121123.9 Ų123.979%0.78679%0.787SS**  trans-81.1143.7176.633.5-35.5000114.1
193L43.1Very low44.5Very low170 Ų170127.7 Ų127.789%0.8979%0.794SS**  trans-120.4129.5174.7-81170.2000112.5
194P56.6Low43.9Very low101 Ų101124.3 Ų124.366%0.65679%0.785SS**  trans-105.9166170.239.3-32.7000113.3
195F37.7Very low43.8Very low205 Ų205128.8 Ų128.890%0.89979%0.791SS**  trans68.1132.1172.4-68.8-84.3000118.8
196S51.8Low43.1Very low125 Ų125127.9 Ų127.987%0.87478%0.783SS**  trans-114.9155.7161.7-72.40000110
197A40.3Very low43Very low108 Ų108129.9 Ų129.989%0.89379%0.786SS**  trans-82.4176.6-159.600000116
198A40.4Very low43.4Very low96 Ų96127.9 Ų127.979%0.79378%0.782SS**  trans-124.1-173.2-179.100000112
199S41.5Very low43.1Very low120 Ų120130.7 Ų130.784%0.83978%0.783SS**  trans78.3152.9175.4-120.30000115.3
200A39.1Very low43.2Very low65 Ų65128.2 Ų128.254%0.53778%0.782SS.*  cis-156163.75.900000115.1
201F37.8Very low42.7Very low200 Ų200126 Ų12688%0.87778%0.781SS**  trans71.1142.4151.1-59.7-55.3000124.2
202S42.5Very low42Very low85 Ų85130.2 Ų130.259%0.59479%0.791SS**  trans-73.2155.1178.347.40000115.1
203H37Very low41Very low187 Ų187129 Ų12987%0.86679%0.786SS**  -174166.1110.4-92.2-64.9000109.9
204G40.3Very low40.5Very low68 Ų68124.3 Ų124.370%0.70178%0.778SS**  trans-141.9127.2176.800000112.5
205I38.4Very low39.4Very low166 Ų166125.1 Ų125.185%0.85179%0.786SS**  trans-140.3164.8167.6-71.9100.6000107
206A34.9Very low39.3Very low88 Ų88120 Ų12073%0.72778%0.782SS**  trans-75.8170.5-166.900000117
207S41.1Very low38.9Very low112 Ų112119.9 Ų119.978%0.78378%0.778SS**  trans-6.9150.3152.5-58.20000119.2
208P51.9Low38.6Very low126 Ų126120.9 Ų120.982%0.81878%0.777SS**  cis-146.2176.845.541.6-21.8000119.4
209H35.6Very low38.7Very low181 Ų181122.1 Ų122.184%0.83878%0.779SS**  trans-60.8155.7162.1-89.4-57.3000112.2
210P51.5Low38.5Very low119 Ų119122.5 Ų122.577%0.77378%0.779SS**  -155.2166.973.942.3-22000120.6
211A33.2Very low38.4Very low86 Ų86128 Ų12871%0.71179%0.794SS**  trans69.2130.2142.600000124
212F30Very low38.4Very low205 Ų205129.1 Ų129.190%0.89979%0.792SS**  trans58.9142.5144.6-102.1-120.9000120.7
213S36.2Very low38.8Very low97 Ų97130.6 Ų130.668%0.67880%0.802SS**  cis-174.2138-22.1-101.70000108.9
214G31.9Very low39.3Very low71 Ų71127.6 Ų127.673%0.73280%0.799SS**  trans150123.5164.700000118
215S35Very low38.9Very low118 Ų118133.6 Ų133.683%0.82581%0.806SS**  trans48.499.9158.359.90000121.3
216A34.8Very low38.6Very low97 Ų97130.8 Ų130.880%0.80280%0.8SS**  52.5156.1119.500000122.8
217P43.3Very low38.4Very low122 Ų122134.5 Ų134.579%0.79281%0.808SS**  cis-132152.2-34.436.2-21.2000113.5
218C34Very low38Very low130 Ų130133.7 Ų133.788%0.87881%0.808SS**  trans-142.5150.3165.7-115.20000111.6
219S42.3Very low37.4Very low121 Ų121134.9 Ų134.985%0.84681%0.806SS**PPolyproline II helixtrans-71.3128.8-162.1-530000115.2
220P37.1Very low37.4Very low128 Ų128133.3 Ų133.383%0.83180%0.804SS**PPolyproline II helixtrans-79.6134.1170.8-13.429.8000113.1
221H36.9Very low36.4Very low182 Ų182131.9 Ų131.984%0.84380%0.803SS**PPolyproline II helixtrans-86.4139.5165.8-125.5-62.1000110.1
222R37.7Very low36.4Very low223 Ų223133 Ų13384%0.84281%0.812SS**SBendtrans55.1113.5159.5-86.2-178155.3-145.4-3.3119.6
223S51.9Low36.6Very low116 Ų116127.9 Ų127.981%0.81181%0.808SS**  trans70.6159147.782.20000116.2
224P46.5Very low37.5Very low123 Ų123128.2 Ų128.280%0.79981%0.808SS**  -134.9-174.261.241.3-25.7000116.2
225F32.1Very low37.6Very low195 Ų195131.5 Ų131.586%0.85581%0.808SS**  trans-34.5140.6167.1-114.5-120000116.6
226C33.8Very low37.7Very low107 Ų107136.5 Ų136.572%0.72381%0.809SS**  178128.3103.9-101.50000112.9
227N29.5Very low37.7Very low165 Ų165136.8 Ų136.888%0.88281%0.811SS**  -177.6119.9127.7-97-14.4000109.8
228A33.2Very low37.3Very low95 Ų95134 Ų13479%0.78581%0.805SS**  trans-117.8144.916600000107.9
229L39.1Very low37.7Very low151 Ų151135.5 Ų135.579%0.79180%0.803SS**  trans-163.699.3149.1-101.5178.4000109.5
230N35.5Very low37.4Very low148 Ų148138.6 Ų138.679%0.79180%0.804SS**  trans66.2159142.9-60.2-7.3000121.7
231A30.6Very low37.2Very low90 Ų90136.3 Ų136.374%0.74480%0.804SS**  cis-172.6118.2-35.500000109.7
232A32.2Very low37Very low109 Ų109131.3 Ų131.390%0.90180%0.802SS**  trans-168.511115700000111.9
233A35Very low37.1Very low98 Ų98126.1 Ų126.181%0.8180%0.8SS**  trans-123.3175.8159.500000106.1
234P54.5Low36.3Very low104 Ų104128.8 Ų128.868%0.67580%0.799SS**  cis-127.9168.319.127.6-3.1000114.5
235N34.6Very low35.8Very low139 Ų139128 Ų12874%0.74380%0.797SS**  176.9160.882.3-86.8-77.2000108.8
236R37Very low36Very low224 Ų224125 Ų12585%0.84580%0.795SS**  cis-172135.4-15.1169.4-178.3-176.7-148.23109.2
237A35.6Very low36.6Very low102 Ų102125.3 Ų125.384%0.84380%0.795SS**  trans63.2156.4168.300000117.8
238G34.1Very low36.6Very low65 Ų65122.9 Ų122.967%0.6779%0.791SS**  cis169.4168.7-800000113.5
239L42.2Very low36.7Very low160 Ų160124.6 Ų124.684%0.83879%0.792SS**  trans71123.7-176.1-53166.7000113.4
240Q37.1Very low37.5Very low186 Ų186123 Ų12387%0.86979%0.79SS**  64.8127.754.7-61.9-175.41.300113.3
241G33Very low37.5Very low80 Ų80126.1 Ų126.183%0.82580%0.797SS**  cis161.6171.6-5.600000111.7
242G32.1Very low37.9Very low77 Ų77131.9 Ų131.979%0.79481%0.805SS**  trans101.268.5158.700000120
243S39Very low37.9Very low114 Ų114134 Ų13480%0.79780%0.796SS**  33.3125.1123.3-62.90000123.5
244Q35.5Very low37.8Very low173 Ų173138.7 Ų138.781%0.80879%0.793SS**  98.2144.5129.3-69.7-74.817.700123.9
245S35.7Very low36.8Very low107 Ų107140.7 Ų140.775%0.74880%0.798SS**  trans70.4127.4158.252.80000122.8
246T37.5Very low36.8Very low132 Ų132142.6 Ų142.681%0.8180%0.795SS**  trans-83.9175.2157.651.70000109.6
247P45.2Very low36.7Very low113 Ų113140.6 Ų140.673%0.73479%0.787SS**  cis-154.8-163.833.345.6-22.5000118.9
248S30.3Very low36.6Very low113 Ų113141.8 Ų141.879%0.7978%0.779SS**  trans90.8174.9160.583.10000119.1
249T35.7Very low36.8Very low132 Ų132147 Ų14781%0.8178%0.778SS**  trans-131-162.5-144.366.80000113.8
250P55.6Low37Very low116 Ų116148.7 Ų148.775%0.75377%0.774SS**  -122.8164.3-119.534.8-13.8000116.4
251K34.8Very low36.9Very low215 Ų215146.3 Ų146.394%0.93577%0.772SS**  trans-140.5141.7165.4-72.6-173.6180176.40112.8
252K39.7Very low36.9Very low210 Ų210146.7 Ų146.791%0.91377%0.768SS**  trans-93.3140.3165.6-65.5175.8177176.40108.9
253E31.9Very low37.3Very low153 Ų153148.3 Ų148.372%0.71577%0.767SS**  trans-152152.4141.8-161.9141.8-172.800113.6
254R32.3Very low37.8Very low197 Ų197148.5 Ų148.574%0.74377%0.765SS**  trans-8.9133170.9-67.5162.4166.5133.8-8.8118.5
255L33.4Very low37.6Very low147 Ų147146 Ų14677%0.7776%0.762SS**  65.6115.655.8-178.575.8000114.3
256R35.6Very low37.6Very low179 Ų179147.1 Ų147.168%0.67577%0.768SS**  trans-174.8129.5131.6-91.8-81.9152.677.51.3109.5
257R34.8Very low37.3Very low182 Ų182144.4 Ų144.469%0.68777%0.766SS**  41149129.7-72.1-173.6-161.5141.90.7120.2
258D33.4Very low37Very low126 Ų126144.8 Ų144.867%0.67477%0.772SS**  cis-158167.68.4-108.6-27.3000105.8
259R37.8Very low37.7Very low175 Ų175145.3 Ų145.366%0.6677%0.772SS**  cis162.7146.7-4.8-167.6-174.6178.6-169.22.7105.4
260R47.4Very low37.6Very low195 Ų195144.6 Ų144.674%0.73677%0.768SS**  trans69152.8172.6-63.5156174.2176.6-6.6114.7
261T34.1Very low36.9Very low136 Ų136147.9 Ų147.983%0.83477%0.765SS**  cis-159.8159.5-7.710.20000107.4
262A32.6Very low36.9Very low89 Ų89147.9 Ų147.974%0.73676%0.759SS**  cis-149.8173.93.900000110.9
263S40.4Very low36.7Very low111 Ų111142.2 Ų142.278%0.77675%0.746SS**  trans-115.1166.4161.4-51.30000109.4
264P50.1Low36.7Very low118 Ų118142.8 Ų142.877%0.76675%0.748SS**  -139.4132.4102.836.8-23.2000113.8
265V30.4Very low36.8Very low121 Ų121138.8 Ų138.873%0.73375%0.751SS**  77.1108.8104.2174.60000112.7
266C36.3Very low37.8Very low129 Ų129137.9 Ų137.987%0.87275%0.754SS**  80.5130.952-62.40000114.6
267G31.6Very low37.6Very low75 Ų75133.5 Ų133.577%0.77376%0.756SS**  trans160.277.8168.500000116.6
268S39.2Very low37.6Very low122 Ų122130.1 Ų130.185%0.85376%0.76SS**  trans-142.6118.2169.5-61.40000112.5
269P45.5Very low37.6Very low124 Ų124130.9 Ų130.981%0.80577%0.769SS**  trans-138.4156.9143.419.82000112
270V33.1Very low37.5Very low117 Ų117128.3 Ų128.371%0.70977%0.773SS**  cis170.6123.8-16.3126.50000105
271R40.5Very low37Very low185 Ų185128.7 Ų128.770%0.69877%0.774SS**  trans72.5118.6164.2-51.3-79.2161.980.4-3.2116.7
272R34.3Very low37.1Very low215 Ų215128.7 Ų128.781%0.81177%0.765SS**  113.715074.5-89.7178.4-177.1160.1-0.8108.3
273S36.4Very low37.2Very low91 Ų91130.6 Ų130.664%0.63676%0.762SS**  cis-140173.513.363.60000115.2
274E31.6Very low36.7Very low164 Ų164131 Ų13177%0.76676%0.76SS**  trans60.499.4148.1-73.9154.6121.300123.6
275S33.6Very low36.1Very low113 Ų113130.4 Ų130.479%0.7976%0.758SS**  74.8151.6112.1-62.20000121.6
276P56Low36.9Very low128 Ų128130.3 Ų130.383%0.83176%0.761SS**  trans-126.3162.6-143.541-26.6000116.6
277A30.9Very low36.5Very low88 Ų88129.8 Ų129.873%0.72776%0.758SS**  trans-145.9132.9162.600000112.5
278S33.4Very low36.4Very low111 Ų111130.3 Ų130.378%0.77676%0.755SS**  trans33110.3158.159.80000119.9
279V35Very low36Very low142 Ų142129.5 Ų129.586%0.86175%0.749SS**  trans-109.5129.8149.6-172.60000108.6
280T35.6Very low35.4Very low120 Ų120135.2 Ų135.274%0.73676%0.755SS**  trans-132.2148.7172.1-550000107.4
281R37.6Very low35.6Very low203 Ų203137.5 Ų137.577%0.76676%0.762SS**  trans80.9155.2-176.2-54.1174.8160.5-118.89.6113.9
282Q35.3Very low35.2Very low137 Ų137132.4 Ų132.464%0.6476%0.76SS**  cis-169.2-176.8-14.4-110.4171.7-34.900108.4
283L33.6Very low35.2Very low128 Ų128127 Ų12767%0.6776%0.755SS**  cis-156.2-177.14.7-132.8-177.9000110
284T30.4Very low35.3Very low120 Ų120131.8 Ų131.874%0.73676%0.764SS**  trans74.5131.1145.536.90000122.9
285S37.5Very low35.6Very low105 Ų105130.3 Ų130.373%0.73477%0.767SS**  trans-86.4176.7162.3-38.60000111.9
286P48Very low35.4Very low120 Ų120135.1 Ų135.178%0.77977%0.768SS**  -120.5160.691.1-1.723.6000112.8
287S28.4Very low34.4Very low117 Ų117135.3 Ų135.382%0.81877%0.766SS**  68.5133.659.2-131.10000113
288A29.4Very low34.6Very low86 Ų86138.5 Ų138.571%0.71177%0.766SS**  cis-160.4179.49.800000113.4
289S31Very low34.8Very low105 Ų105138.3 Ų138.373%0.73477%0.765SS**  trans72.9130.8146.3-162.30000121.6
290R32.8Very low35.4Very low245 Ų245137.4 Ų137.493%0.92576%0.762SS**  trans-137.4128.5147.9-66.1-169.886.2-157.98110.5
291L36.2Very low35.2Very low165 Ų165135 Ų13586%0.86476%0.761SS**  trans-139.5157.7162.9-69.4174.7000105.8
292A32.5Very low35Very low78 Ų78131 Ų13165%0.64576%0.764SS**  cis-153.4172.912.500000112.6
293S35Very low34.9Very low101 Ų101130 Ų13071%0.70677%0.772SS**  trans64.7151.1150.7490000120.5
294K37Very low34.7Very low191 Ų191128.9 Ų128.983%0.8378%0.775SS**  cis-161.4144.2-14.1-97.5155.9-169.9170.30104.2
295T38.6Very low34.8Very low133 Ų133131.6 Ų131.682%0.81678%0.78SS**  -165.6134.767.337.90000109
296R29.8Very low34.5Very low215 Ų215136.3 Ų136.381%0.81178%0.783SS**  81.889.276.5-168.5-165.5164.1149.2-2.4116.5
297T35Very low33.8Very low131 Ų131139.9 Ų139.980%0.80479%0.789SS**  trans-154.7105.213523.50000106.6
298Q35.1Very low33.8Very low156 Ų156145.4 Ų145.473%0.72979%0.791SS**  65.5115.489.8-74.8-68.78.900114.2
299S37.5Very low34Very low107 Ų107146.4 Ų146.475%0.74879%0.793SS**  trans-150146.3178.7-44.70000110.6
300P48Very low34.7Very low122 Ų122146.7 Ų146.779%0.79279%0.793SS**  trans-106.2147.9152.735.1-26.4000110.1
301G30.9Very low34.6Very low71 Ų71141.5 Ų141.573%0.73279%0.788SS**  cis89.11237.900000112.1
302S33.1Very low34.2Very low118 Ų118144.5 Ų144.583%0.82579%0.788SS**  cis-160.5-179.8-0.155.30000112
303S32.6Very low34Very low115 Ų115145.5 Ų145.580%0.80479%0.79SS**  trans-48.8144176.452.10000118.8
304S30.8Very low33.7Very low105 Ų105149 Ų14973%0.73479%0.794SS**  trans-167112.1134.8-155.10000108.7
305Q32.8Very low33.7Very low178 Ų178146 Ų14683%0.83279%0.794SS**  83.4140.184.7-157.1166.2-16.700114.1
306Y30.2Very low33.3Very low203 Ų203146.9 Ų146.980%0.79679%0.794SS**  trans-44.9148-167.9-59-97.1000117.4
307H34.1Very low33.5Very low195 Ų195144.8 Ų144.890%0.90379%0.794SS**  -166-173.3109.1-101.1-65.1000113.1
308R28.2Very low33.3Very low233 Ų233146.3 Ų146.388%0.87980%0.797SS**  trans-110.8151.1-155.8-178176.5178.1-116.510.9112.7
309S33.6Very low33.3Very low107 Ų107146 Ų14675%0.74880%0.8SS**  trans-30151.6175.6-37.50000117.2
310P44.8Very low33.1Very low112 Ų112146.9 Ų146.973%0.72780%0.796SS**  -158.4142.377.839-17.4000120.8
311T32Very low32.6Very low135 Ų135151.3 Ų151.383%0.82880%0.797SS**  trans69.5156.9133.8-490000122
312R27.6Very low32.8Very low228 Ų228158.1 Ų158.186%0.8681%0.807SS**  trans77.7145.9179.3-66.6-165.4173.2-137.90.5115.6
313C26.9Very low32.8Very low100 Ų100155.6 Ų155.668%0.67680%0.799SS**  cis-150.2169-6.8-122.70000111.8
314H30.4Very low32.9Very low174 Ų174159.5 Ų159.581%0.80681%0.805SS**  trans-73.8153.9175.9-52-105.1000112.8
315P35.8Very low33Very low128 Ų128159.8 Ų159.883%0.83180%0.798SS**  trans-85135.7144.934.3-28.3000110.3
316N30.1Very low33.4Very low151 Ų151159 Ų15981%0.80779%0.792SS**  trans-153.5130.4166.4-174.323.9000109
317Q34.2Very low33.6Very low172 Ų172157.4 Ų157.480%0.80479%0.789SS**  trans-152.7118170.7-104.3-175.8-14.900109.9
318N30.9Very low33.6Very low163 Ų163154 Ų15487%0.87278%0.777SS**  trans-170134152.3-90.7-45.1000105.6
319D34.1Very low33.6Very low149 Ų149149.8 Ų149.880%0.79777%0.767SS**  trans-94.5164.7-164.1-64.4-69.1000114.7
320D35.2Very low33.7Very low125 Ų125151.8 Ų151.867%0.66876%0.763SS**  trans56.9123148.4-10610.5000118.3
321R36.3Very low33Very low215 Ų215155.6 Ų155.681%0.81177%0.768SS**  cis-158.6175.828.4-65.1-165.6161.9-178.1-6.2113.6
322K35.3Very low32.8Very low215 Ų215152.6 Ų152.694%0.93576%0.764SS**  trans-10.6146.5163.4-58.6-172.1172.9-164.10118.6
323G33.1Very low32.9Very low65 Ų65150.7 Ų150.767%0.6776%0.764SS**  cis147.1151.7-1.300000112.6
324E34Very low33Very low196 Ų196154 Ų15492%0.91677%0.77SS**  trans67145.5171.4-61-178.3139.500115.9
325D34.5Very low33.8Very low112 Ų112150.8 Ų150.860%0.59976%0.764SS**  cis-157.8159.5-8.4-150.92.4000113.6
326K40.3Very low33.4Very low162 Ų162153.6 Ų153.670%0.70476%0.764SS**  trans35.8115.9151.9-77164.5-16377.10125.1
327K34.9Very low33.4Very low168 Ų168150.8 Ų150.873%0.7376%0.761SS**  92.5153.7106.5-162-179.5177.8-71.10122.7
328L33.3Very low33Very low124 Ų124150.8 Ų150.865%0.64976%0.761SS**  trans81.8131.6175.5-66.5112.8000115.4
329E27.9Very low32.9Very low144 Ų144148.7 Ų148.767%0.67376%0.76SS**  66.7139.761.7-79.4-146.6130.400113.6
330K36.4Very low32.7Very low150 Ų150145.7 Ų145.765%0.65276%0.755SS**  cis-158.1148.719.5-143.7174.1-172.775.40113
331K29Very low32.3Very low191 Ų191144.2 Ų144.283%0.8376%0.761SS**  trans28.8145150-76.4-167.4168.4-157.60124.4
332G28.6Very low32Very low72 Ų72145.1 Ų145.174%0.74276%0.764SS**  trans110.1141141.200000115.7
333E30.1Very low31.8Very low188 Ų188141.1 Ų141.188%0.87976%0.758SS**  cis-158.6-177-21.5-142.4154.1-138.500108.9
334Q29.1Very low31.5Very low171 Ų171143.2 Ų143.280%0.79976%0.762SS**  trans-80.7173.3-177-77-80.9-37.600112.3
335P46.3Very low31.2Very low105 Ų105137.9 Ų137.968%0.68275%0.751SS**  cis-148.8-177.120.544.6-24.3000119.8
336K28.3Very low30.9Very low188 Ų188140.6 Ų140.682%0.81776%0.76SS**  trans83.4130141.7-94.2-179.8175.3-177.50123
337A29Very low30.4Very low91 Ų91137.9 Ų137.975%0.75276%0.758SS**  trans66.2157.9143.100000119.5
338E26.8Very low30.4Very low172 Ų172139 Ų13980%0.80476%0.763SS**  cis-170138.2-29.1173.7168.4-169.500108.3
339S29Very low30.2Very low120 Ų120140.1 Ų140.184%0.83977%0.769SS**  trans61177.8176.983.10000115.3
340A28.6Very low30.5Very low86 Ų86140.4 Ų140.471%0.71177%0.774SS**  cis-160.9163.2-49.100000109.2
341A27.8Very low30.1Very low94 Ų94139.8 Ų139.878%0.77778%0.778SS**  trans63.8134.1177.200000115.4
342R30.1Very low30.2Very low233 Ų233135.8 Ų135.888%0.87977%0.774SS**  49.3124.671.2-61.8-175178.6-163.6-0.2112.6
343T29.8Very low30.2Very low131 Ų131138 Ų13880%0.80478%0.779SS**  cis-163.7161.31.8140000106.3
344S26.6Very low30.3Very low109 Ų109134.2 Ų134.276%0.76277%0.773SS**  168.1178.570.2-159.30000110.9
345A29.3Very low30.3Very low84 Ų84135.8 Ų135.869%0.69478%0.78SS**  trans69153159.400000117.4
346E27.6Very low29.5Very low169 Ų169134.1 Ų134.179%0.7978%0.782SS**  cis-157.9138-7.4-138.2-173.1124.100110
347T30.3Very low29.6Very low105 Ų105134 Ų13464%0.64479%0.785SS**  166.4173.589.640.30000110.2
348K34.1Very low29.6Very low192 Ų192139.8 Ų139.884%0.83579%0.793SS**  trans92.178.1160.1-56179-173.4176.90120
349N29.1Very low29.8Very low148 Ų148136.9 Ų136.979%0.79179%0.787SS**  -6.3140.1116.9-85.4-24.7000116.5
350L33.9Very low29.9Very low149 Ų149142 Ų14278%0.7879%0.788SS**  cis-138.3-155.3-1.9-63.6106.1000108.1
351N29.8Very low29.9Very low137 Ų137143.9 Ų143.973%0.73379%0.786SS**  cis-163.1166.86.5-1562.2000112.9
352S30.3Very low30.2Very low107 Ų107147.3 Ų147.375%0.74879%0.79SS**  trans66.2154.916880.60000116.7
353S28.9Very low30.2Very low119 Ų119142.7 Ų142.783%0.83278%0.783SS**  cis-142.7175-3.9-162.90000110.8
354S31.8Very low30.1Very low108 Ų108147.3 Ų147.376%0.75579%0.786SS**  trans-120.8137.7-164.2600000116.1
355Q29.7Very low30.2Very low205 Ų205148.1 Ų148.196%0.95878%0.782SS**  trans-161.8158.2151.2-110.2-179.8-10.500108.5
356G28.5Very low30.3Very low70 Ų70151.5 Ų151.572%0.72279%0.793SS**  cis172.9117.1-2.400000108.3
357Q31.2Very low30.6Very low186 Ų186150.5 Ų150.587%0.86979%0.793SS**  trans-74.2150.6-161.4-66.7166-52.800115
358F27.8Very low30.7Very low211 Ų211153.2 Ų153.293%0.92580%0.798SS**  trans-73.2145.3153.2-94.2-101.9000110.3
359V30.6Very low30.6Very low111 Ų111151.6 Ų151.667%0.67379%0.791SS**  trans-129.2133.2169.2-171.30000109.7N361V359-N361 WeakPolarHBondContact CG1-OD1 3.22Å
360R31.4Very low30.7Very low229 Ų229152.2 Ų152.286%0.86479%0.794SS**  trans-149.498164.6-176.9-176.2-69.9158.9-2.3108.7
361N28.5Very low30.6Very low124 Ų124153.4 Ų153.466%0.66380%0.796SS**  trans-87.7142.1176.3-65.83.3000110.4V359V359-N361 WeakPolarHBondContact CG1-OD1 3.22Å
362L34.4Very low30.7Very low166 Ų166151.9 Ų151.987%0.86980%0.796SS**  trans-114.4135.3147.1-103.376000107.1
363N30.1Very low31.6Very low136 Ų136152.3 Ų152.373%0.72780%0.796SS**  trans-92.6140.7173.1-56.8-22.8000109.2
364R28.6Very low31.6Very low228 Ų228152.7 Ų152.786%0.8679%0.789SS**  trans-160.293.4132.1-142.2174.6-164-138.5-0.6114.4
365D29.2Very low31.5Very low127 Ų127158.8 Ų158.868%0.67980%0.795SS**  36.1109.4128.4-33.3-39.7000119.8
366T30.7Very low31.6Very low154 Ų154158.9 Ų158.995%0.94579%0.787SS**  trans-138.7139132.4-26.10000108.8
367L34.5Very low31.8Very low148 Ų148161.8 Ų161.878%0.77579%0.786SS**  trans-124.2148.9-172.4-179.470.3000110.9
368E31.3Very low32.2Very low163 Ų163161.2 Ų161.276%0.76278%0.783SS**  trans135.977.2165.1-76.9-83.988.300108.5
369K32.7Very low32.4Very low158 Ų158159.7 Ų159.769%0.68778%0.781SS**  68.589.169.3-163.3-178.4180-177.90113.8
370N31Very low32.7Very low160 Ų160159.3 Ų159.386%0.85678%0.783SS**  trans-99.9163.8155.3-89.7-79000110.3
371H32.8Very low33.3Very low175 Ų175153.9 Ų153.981%0.8178%0.778SS**  trans-82.8154.6-167.9-84.1-93.9000115.9
372S31.1Very low33.2Very low105 Ų105159.3 Ų159.373%0.73479%0.789SS**  trans-39173.2158.8-50.30000117
373P49.8Very low32.9Very low116 Ų116155.2 Ų155.275%0.75378%0.779SS**  cis-134.8168.7-0.327-3.9000117.2
374D27.1Very low32.6Very low126 Ų126156.1 Ų156.167%0.67478%0.784SS**  trans23121.6134.6-165.850.1000120.3
375R30.7Very low33.7Very low237 Ų237150.1 Ų150.189%0.89478%0.775SS**  -152.9138.299.1-109.3-175.3-177.1-158.20116
376R31.5Very low33.7Very low206 Ų206149.4 Ų149.478%0.77778%0.779SS**  trans-111.3175.2169.1-155-166-62.7-168.80.6109.6
377N32.5Very low33.8Very low132 Ų132148.2 Ų148.271%0.70676%0.763SS**  trans85.2130.8168.7-48-26000113.7
378Q40.3Very low33.8Very low173 Ų173149.1 Ų149.181%0.80876%0.756SS**  cis80138.841.6-72.2-8654.800114.5
379M32.6Very low34Very low180 Ų180148.4 Ų148.489%0.88775%0.747SS**  trans83.8137.5173.7-49.5-14672.500117.9
380S35.3Very low34.3Very low103 Ų103149.2 Ų149.272%0.7276%0.757SS**  trans-96.9159.1168.5-1650000108.6
381P45.6Very low34.5Very low115 Ų115147.9 Ų147.975%0.74775%0.746SS**  -150.815489.638-20.2000117.5
382R25.6Very low34.6Very low238 Ų238144.7 Ų144.790%0.89874%0.738SS**  trans65.5142.1149.6-84.2-173.1169.1-118.9-0.5122.4
383A28.3Very low34.6Very low80 Ų80146.9 Ų146.966%0.66174%0.742SS**  trans68.9100.8148.100000120.1
384D24.5Very low33.6Very low155 Ų155144.6 Ų144.683%0.82974%0.739SS**  41.7152.3114.4-58.8-5000122
385P50.5Low34.1Very low102 Ų102146.7 Ų146.766%0.66275%0.745SS**  cis-141.5171.9-43.339.6-23.8000113.4
386S29.9Very low34.3Very low111 Ų111142.7 Ų142.778%0.77674%0.741SS**  trans69173.6162.8-37.70000115.1
387E32.3Very low34.6Very low130 Ų130136.6 Ų136.661%0.60774%0.743SS**  cis-142.5149.213.3-101.2-146.7150.700113.5
388R35.5Very low34.7Very low166 Ų166136.4 Ų136.463%0.62674%0.742SS**  trans55.7150.3138.1-63.1-169.5-164.8179.224.6121.2
389R34.3Very low34.9Very low149 Ų149136.9 Ų136.956%0.56274%0.741SS**  cis-163.2150-18.6-119.1178-166-167.10.5109.4H391R389-H391 WeakPolarHBondContact CD-NE2 3.36Å
390L39.4Very low35.3Very low174 Ų174137.3 Ų137.391%0.91174%0.741SS**SBendtrans-80.8132.7136.7-67.2173.8000108
391H35Very low35.5Very low132 Ų132136.9 Ų136.961%0.61174%0.743SS**  trans-106.6147.5175.1-85.2100.3000107.5R389R389-H391 WeakPolarHBondContact CD-NE2 3.36Å
392V34.6Very low35.1Very low108 Ų108136.1 Ų136.166%0.65575%0.747SS**  cis-157.9165.5-2.580.20000105.5
393N31Very low35.7Very low151 Ų151128.5 Ų128.581%0.80774%0.735SS**  cis-161163.740.7-149.7-9.1000111.5
394G28.3Very low36.2Very low68 Ų68131.5 Ų131.570%0.70174%0.74SS**  trans158.155.7173.900000119.1
395Q37.6Very low36.8Very low171 Ų171130.3 Ų130.380%0.79974%0.739SS**  trans40.2132.3148.4-80.5176.1-22.800123.7
396N35.7Very low37.2Very low152 Ų152131.1 Ų131.181%0.81375%0.747SS**  trans82130.3145.9-54.4-12.8000121.4
397G37.2Very low38Very low79 Ų79133 Ų13381%0.81475%0.753SS**  113.378.4126.900000119.3
398D36.3Very low38.2Very low128 Ų128130.1 Ų130.168%0.68476%0.759SS**  trans-24.9138.3162.6-88.429.7000120.4
399K44.3Very low39.4Very low183 Ų183132.3 Ų132.380%0.79677%0.773SS**  trans86.6151.6134.3-73172179.7124.50122.5
400E41.1Very low39.8Very low189 Ų189131.8 Ų131.888%0.88379%0.786SS**  trans-74.3160.5175.3-49.6167.591.700112.7
401A37.6Very low40.7Very low93 Ų93127.3 Ų127.377%0.76978%0.782SS**  -168.1112.9118.300000113.1
402A38.3Very low41.2Very low100 Ų100125.5 Ų125.583%0.82679%0.79SS**  trans52.2166.5133.300000124
403A38.3Very low42.2Very low78 Ų78123.4 Ų123.465%0.64579%0.79SS**  trans91.5101.5143.800000121.1
404N38.5Very low43.2Very low143 Ų143122.4 Ų122.477%0.76579%0.79SS**  104.7118.3118.4-66.5-6.1000122.4
405T36.7Very low44.9Very low130 Ų130126.2 Ų126.280%0.79880%0.8SS**  trans60.3103.7136.659.10000120.1
406S58.6Low46.2Very low119 Ų119120.9 Ų120.983%0.83278%0.777SS**  trans-75.2123.7144.147.20000110.8
407T47.1Very low48.2Very low149 Ų149117.4 Ų117.491%0.91477%0.769SS**  trans-171.1124.3149.1-75.70000107.9
408G35.9Very low50.1Low71 Ų71121 Ų12173%0.73276%0.764SS**  trans164.7115.4177.700000112.2
409K62.4Low52.3Low212 Ų212120 Ų12092%0.92276%0.756SS**  trans-111.883.2-174.9-173.4-176.5178.3-177.60110.7
410V41.8Very low54.1Low137 Ų137114 Ų11483%0.8374%0.74SS**  trans-143146.1167-91.20000109
411G57.9Low56.3Low80 Ų80109.6 Ų109.683%0.82573%0.726SS**  cis102.927.99.100000113.9
412A45.6Very low58.8Low95 Ų95113.4 Ų113.479%0.78572%0.721SS**  trans-142.1145.6168.600000109.2
413G55.5Low61.3Low64 Ų64114 Ų11466%0.6671%0.71SS**  trans-82140.2174.700000111.5T415G413-T415 PolarHBondContact O-N 2.91Å; G413-T415 VanDerWaalsContact O-N 3.12Å
414T52.2Low63.9Low129 Ų129114.5 Ų114.579%0.79170%0.701SS**  trans-71.9100.8165.949.30000108.7N416T414-N416 PolarHBondContact O-N 2.89Å
415T63.7Low66.5Low149 Ų149109.2 Ų109.291%0.91468%0.677SS**  trans-77.858.1-170.551.40000113.6G413G413-T415 PolarHBondContact O-N 2.91Å; G413-T415 VanDerWaalsContact O-N 3.12Å
416N66.6Low69.3Low59 Ų59106.1 Ų106.132%0.31665%0.654SS.*  trans-143.5111.6165.5-169.4-4.9000111.2T414 E418 E419 A420T414-N416 PolarHBondContact O-N 2.89Å; N416-E418 VanDerWaalsContact C-N 3.29Å; N416-E418 PolarHBondContact O-N 3.03Å; N416-E418 PolarHBondContact OD1-N 2.88Å; N416-E418 VanDerWaalsContact OD1-N 3.12Å; N416-E419 HydrophobicContact CB-CB 4.26Å; N416-E419 HydrophobicContact CB-CG 4.3Å; N416-E419 PolarHBondContact ND2-OE1 3.28Å; N416-E419 PolarHBondContact O-N 2.86Å; N416-A420 PolarHBondContact O-N 3.43Å
417A75.8Confident71Confident79 Ų79109.2 Ų109.265%0.65365%0.647SS**Hα-helixtrans-68.7-27-178.800000112.9T421A417-T421 WeakPolarHBondContact O-CB 3.39Å; A417-T421 PolarHBondContact O-N 2.89Å; A417-T421 PolarHBondContact O-OG1 3.33Å
418E78.9Confident73.3Confident153 Ų153109.6 Ų109.672%0.71563%0.632SS**Hα-helixtrans-72.4-39.1179.7-58.9-169.3161.100111.4N416 T421 R422N416-E418 VanDerWaalsContact C-N 3.29Å; N416-E418 PolarHBondContact O-N 3.03Å; N416-E418 PolarHBondContact OD1-N 2.88Å; N416-E418 VanDerWaalsContact OD1-N 3.12Å; E418-T421 WeakPolarHBondContact O-CB 3.45Å; E418-T421 PolarHBondContact O-N 3.46Å; E418-R422 WeakPolarHBondContact O-CB 3.46Å; E418-R422 PolarHBondContact O-N 3.15Å
419E80.9Confident76.1Confident109 Ų109112.6 Ų112.651%0.50962%0.621SS.*Hα-helixtrans-67.1-42.5175.8-76.7170.6-15100112.1N416 T421 R422 L423N416-E419 HydrophobicContact CB-CB 4.26Å; N416-E419 HydrophobicContact CB-CG 4.3Å; N416-E419 PolarHBondContact ND2-OE1 3.28Å; N416-E419 PolarHBondContact O-N 2.86Å; E419-T421 VanDerWaalsContact C-N 3.28Å; E419-T421 PolarHBondContact O-N 3.5Å; E419-R422 PolarHBondContact O-N 2.79Å; E419-L423 WeakPolarHBondContact O-CB 3.38Å; E419-L423 WeakPolarHBondContact O-CG 3.48Å; E419-L423 PolarHBondContact O-N 3.31Å
420A83.1Confident77.6Confident56 Ų56107.9 Ų107.946%0.46360%0.602SS.*Hα-helixtrans-59.4-41172.700000111.6N416 L424N416-A420 PolarHBondContact O-N 3.43Å; A420-L424 WeakPolarHBondContact O-CB 3.29Å; A420-L424 PolarHBondContact O-N 2.94Å
421T87.4Confident80.1Confident96 Ų96104 Ų10459%0.58959%0.585SS**Hα-helixtrans-66.2-42.9175.8-59.10000111.7A417 E418 E419 L424 A425A417-T421 WeakPolarHBondContact O-CB 3.39Å; A417-T421 PolarHBondContact O-N 2.89Å; A417-T421 PolarHBondContact O-OG1 3.33Å; E418-T421 WeakPolarHBondContact O-CB 3.45Å; E418-T421 PolarHBondContact O-N 3.46Å; E419-T421 VanDerWaalsContact C-N 3.28Å; E419-T421 PolarHBondContact O-N 3.5Å; T421-L424 PolarHBondContact O-N 3.35Å; T421-A425 WeakPolarHBondContact O-CB 3.26Å; T421-A425 PolarHBondContact O-N 2.87Å
422R90.8Very high81.8Confident174 Ų174109.3 Ų109.366%0.65758%0.58SS**Hα-helixtrans-62.3-46.9176.3-177.8176.9175.3172-0.7111.5E418 E419 L424 A425 E426E418-R422 WeakPolarHBondContact O-CB 3.46Å; E418-R422 PolarHBondContact O-N 3.15Å; E419-R422 PolarHBondContact O-N 2.79Å; R422-L424 VanDerWaalsContact C-N 3.34Å; R422-L424 PolarHBondContact O-N 3.48Å; R422-A425 CarbonylContact O-C 3.6Å; R422-A425 WeakPolarHBondContact O-CB 3.41Å; R422-A425 PolarHBondContact O-N 3.47Å; R422-E426 WeakPolarHBondContact O-CB 3.31Å; R422-E426 PolarHBondContact O-N 2.9Å
423L90.4Very high84.1Confident113 Ų113107.1 Ų107.159%0.59256%0.562SS**Hα-helixtrans-63.4-37.3176.9-72.6170.6000112.3E419 E426 R427E419-L423 WeakPolarHBondContact O-CB 3.38Å; E419-L423 WeakPolarHBondContact O-CG 3.48Å; E419-L423 PolarHBondContact O-N 3.31Å; L423-E426 WeakPolarHBondContact O-CB 3.29Å; L423-E426 PolarHBondContact O-N 2.85Å; L423-R427 PolarHBondContact O-N 3.23Å
424L91.8Very high85.8Confident87 Ų87110.8 Ų110.846%0.45556%0.562SS.*Hα-helixtrans-69.3-37.1174.6-174.160.6000111.9A420 T421 R422 R428A420-L424 WeakPolarHBondContact O-CB 3.29Å; A420-L424 PolarHBondContact O-N 2.94Å; T421-L424 PolarHBondContact O-N 3.35Å; R422-L424 VanDerWaalsContact C-N 3.34Å; R422-L424 PolarHBondContact O-N 3.48Å; L424-R428 WeakPolarHBondContact O-CB 3.41Å; L424-R428 WeakPolarHBondContact O-CD 3.44Å; L424-R428 WeakPolarHBondContact O-CG 3.44Å; L424-R428 PolarHBondContact O-N 3.16Å
425A94.2Very high87.8Confident33 Ų33110.1 Ų110.127%0.27355%0.548SS..Hα-helixtrans-66.6-38.8171.500000112.2T421 R422 R428 R429T421-A425 WeakPolarHBondContact O-CB 3.26Å; T421-A425 PolarHBondContact O-N 2.87Å; R422-A425 CarbonylContact O-C 3.6Å; R422-A425 WeakPolarHBondContact O-CB 3.41Å; R422-A425 PolarHBondContact O-N 3.47Å; A425-R428 PolarHBondContact O-N 3.03Å; A425-R429 PolarHBondContact O-N 3.3Å
426E94.1Very high89.3Confident64 Ų64109.3 Ų109.330%0.29953%0.534SS..Hα-helixtrans-59.8-51.7174.5-152.371.4-94.100111R422 L423 R428 R429 Q430R422-E426 WeakPolarHBondContact O-CB 3.31Å; R422-E426 PolarHBondContact O-N 2.9Å; L423-E426 WeakPolarHBondContact O-CB 3.29Å; L423-E426 PolarHBondContact O-N 2.85Å; E426-R428 VanDerWaalsContact C-N 3.3Å; E426-R428 PolarHBondContact O-N 2.81Å; E426-R429 WeakPolarHBondContact O-CB 3.36Å; E426-R429 PolarHBondContact O-N 2.98Å; E426-R429 VanDerWaalsContact O-N 3.09Å; E426-R429 IonicContact OE1-CZ 2.7Å; E426-R429 VanDerWaalsContact OE1-CZ 3.26Å; E426-R429 IonicContact OE1-NE 2.69Å; E426-R429 PolarHBondContact OE1-NE 2.96Å; E426-R429 IonicContact OE1-NH2 2.72Å; E426-R429 PolarHBondContact OE1-NH2 2.95Å; E426-R429 IonicContact OE2-NH2 3.15Å; E426-R429 PolarHBondContact OE2-NH2 3.36Å; E426-Q430 WeakPolarHBondContact O-CG 3.49Å; E426-Q430 PolarHBondContact O-N 2.97Å
427R94.3Very high90.6Very high185 Ų185112.6 Ų112.670%0.69855%0.55SS**Hα-helixtrans-62.2-35.6176.1-74.6-176.8173.6-173.5-0.9112.4L423 Q430 A431L423-R427 PolarHBondContact O-N 3.23Å; R427-Q430 PolarHBondContact O-N 3.36Å; R427-A431 WeakPolarHBondContact O-CB 3.33Å; R427-A431 PolarHBondContact O-N 2.82Å
428R96.3Very high91.3Very high157 Ų157114.4 Ų114.459%0.59255%0.545SS*.Hα-helixtrans-67-35.6173.1-75.6166.9175.6168.7-1.5112.6L424 A425 E426 R432L424-R428 WeakPolarHBondContact O-CB 3.41Å; L424-R428 WeakPolarHBondContact O-CD 3.44Å; L424-R428 WeakPolarHBondContact O-CG 3.44Å; L424-R428 PolarHBondContact O-N 3.16Å; A425-R428 PolarHBondContact O-N 3.03Å; E426-R428 VanDerWaalsContact C-N 3.3Å; E426-R428 PolarHBondContact O-N 2.81Å; R428-R432 VanDerWaalsContact O-CG 3.32Å; R428-R432 WeakPolarHBondContact O-CG 3.45Å; R428-R432 PolarHBondContact O-N 3.09Å
429R95.4Very high92Very high134 Ų134112 Ų11251%0.50653%0.534SS..Hα-helixtrans-65.5-47.7170.7-75.1-171.8-72.9-100.36.8111.2A425 E426 A431 R432 A433A425-R429 PolarHBondContact O-N 3.3Å; E426-R429 WeakPolarHBondContact O-CB 3.36Å; E426-R429 PolarHBondContact O-N 2.98Å; E426-R429 VanDerWaalsContact O-N 3.09Å; E426-R429 IonicContact OE1-CZ 2.7Å; E426-R429 VanDerWaalsContact OE1-CZ 3.26Å; E426-R429 IonicContact OE1-NE 2.69Å; E426-R429 PolarHBondContact OE1-NE 2.96Å; E426-R429 IonicContact OE1-NH2 2.72Å; E426-R429 PolarHBondContact OE1-NH2 2.95Å; E426-R429 IonicContact OE2-NH2 3.15Å; E426-R429 PolarHBondContact OE2-NH2 3.36Å; R429-A431 PolarHBondContact O-N 3.42Å; R429-R432 PolarHBondContact O-N 3.32Å; R429-A433 PolarHBondContact O-N 3.44Å
430Q93.4Very high92.5Very high112 Ų112112.6 Ų112.652%0.52354%0.535SS..Hα-helixtrans-59.6-45.2178.3-70.7171.7-15.100112.1E426 R427 R432 A433 Q434E426-Q430 WeakPolarHBondContact O-CG 3.49Å; E426-Q430 PolarHBondContact O-N 2.97Å; R427-Q430 PolarHBondContact O-N 3.36Å; Q430-R432 VanDerWaalsContact C-N 3.33Å; Q430-R432 PolarHBondContact O-N 2.91Å; Q430-A433 PolarHBondContact O-N 2.9Å; Q430-Q434 WeakPolarHBondContact O-CG 3.41Å; Q430-Q434 PolarHBondContact O-N 3.23Å
431A93.1Very high92.8Very high56 Ų56116.7 Ų116.746%0.46354%0.543SS..Hα-helixtrans-63.1-36.1176.400000112.9R427 R429 K435R427-A431 WeakPolarHBondContact O-CB 3.33Å; R427-A431 PolarHBondContact O-N 2.82Å; R429-A431 PolarHBondContact O-N 3.42Å; A431-K435 PolarHBondContact O-N 3.02Å
432R94.6Very high92.8Very high192 Ų192116.6 Ų116.673%0.72554%0.535SS*.Hα-helixtrans-67.4-46.5173.2-73.9175.7-176.2-161.60.6111.8R428 R429 Q430 Q434 K435 E436R428-R432 VanDerWaalsContact O-CG 3.32Å; R428-R432 WeakPolarHBondContact O-CG 3.45Å; R428-R432 PolarHBondContact O-N 3.09Å; R429-R432 PolarHBondContact O-N 3.32Å; Q430-R432 VanDerWaalsContact C-N 3.33Å; Q430-R432 PolarHBondContact O-N 2.91Å; R432-Q434 VanDerWaalsContact C-N 3.31Å; R432-Q434 PolarHBondContact O-N 2.94Å; R432-K435 PolarHBondContact O-N 3.42Å; R432-E436 WeakPolarHBondContact O-CB 3.46Å; R432-E436 PolarHBondContact O-N 3.39Å
433A94.1Very high92.9Very high49 Ų49114.4 Ų114.441%0.40553%0.532SS..Hα-helixtrans-63.4-35.9178.100000112.5R429 Q430 L437R429-A433 PolarHBondContact O-N 3.44Å; Q430-A433 PolarHBondContact O-N 2.9Å; A433-L437 WeakPolarHBondContact O-CB 3.25Å; A433-L437 WeakPolarHBondContact O-CG 3.24Å; A433-L437 PolarHBondContact O-N 3.1Å
434Q90.4Very high92.7Very high141 Ų141113.5 Ų113.566%0.65953%0.528SS*.Hα-helixtrans-65.4-46171.5-76.4-179-28.500111.9Q430 R432 E436 L437 E438Q430-Q434 WeakPolarHBondContact O-CG 3.41Å; Q430-Q434 PolarHBondContact O-N 3.23Å; R432-Q434 VanDerWaalsContact C-N 3.31Å; R432-Q434 PolarHBondContact O-N 2.94Å; Q434-E436 VanDerWaalsContact C-N 3.34Å; Q434-E436 PolarHBondContact O-N 2.9Å; Q434-L437 PolarHBondContact O-N 3.22Å; Q434-E438 PolarHBondContact O-N 3.01Å
435K95Very high92.6Very high115 Ų115113.7 Ų113.750%0.553%0.527SS..Hα-helixtrans-60.4-43174.5-174.9-179.8-179.8-73.90111.6A431 R432 L437 E438 E439A431-K435 PolarHBondContact O-N 3.02Å; R432-K435 PolarHBondContact O-N 3.42Å; K435-L437 PolarHBondContact O-N 2.97Å; K435-E438 PolarHBondContact O-N 3.33Å; K435-E439 IonicContact NZ-OE1 3.1Å; K435-E439 PolarHBondContact NZ-OE1 3.5Å; K435-E439 IonicContact NZ-OE2 2.69Å; K435-E439 PolarHBondContact NZ-OE2 2.9Å; K435-E439 WeakPolarHBondContact O-CB 3.37Å; K435-E439 PolarHBondContact O-N 3.25Å
436E94.4Very high92.3Very high132 Ų132118 Ų11862%0.61754%0.541SS*.Hα-helixtrans-63.6-40.4179.6-170.4-177.4154.200111.9R432 Q434 K440R432-E436 WeakPolarHBondContact O-CB 3.46Å; R432-E436 PolarHBondContact O-N 3.39Å; Q434-E436 VanDerWaalsContact C-N 3.34Å; Q434-E436 PolarHBondContact O-N 2.9Å; E436-K440 WeakPolarHBondContact O-CB 3.34Å; E436-K440 PolarHBondContact O-N 2.83Å
437L93.8Very high92.2Very high127 Ų127119.2 Ų119.267%0.66555%0.547SS*.Hα-helixtrans-66.5-36.3173.3-74.4169.6000112.8A433 Q434 K435 K441A433-L437 WeakPolarHBondContact O-CB 3.25Å; A433-L437 WeakPolarHBondContact O-CG 3.24Å; A433-L437 PolarHBondContact O-N 3.1Å; Q434-L437 PolarHBondContact O-N 3.22Å; K435-L437 PolarHBondContact O-N 2.97Å; L437-K441 WeakPolarHBondContact O-CB 3.45Å; L437-K441 PolarHBondContact O-N 2.95Å
438E91.5Very high91.9Very high117 Ų117112.1 Ų112.155%0.54753%0.532SS..Hα-helixtrans-70.3-47175-172-17817600111.9Q434 K435 K440 K441 Q442Q434-E438 PolarHBondContact O-N 3.01Å; K435-E438 PolarHBondContact O-N 3.33Å; E438-K440 PolarHBondContact O-N 2.86Å; E438-K441 CarbonylContact O-C 3.59Å; E438-K441 WeakPolarHBondContact O-CA 3.46Å; E438-K441 WeakPolarHBondContact O-CB 3.15Å; E438-K441 PolarHBondContact O-N 3.42Å; E438-Q442 WeakPolarHBondContact O-CG 3.47Å; E438-Q442 PolarHBondContact O-N 3.39Å; E438-Q442 PolarHBondContact OE1-NE2 3.38Å
439E92.8Very high91.6Very high104 Ų104111.9 Ų111.949%0.48653%0.53SS..Hα-helixtrans-61.4-43.9178.8-171.7159.4-147.200110.6K435 K441 Q442 E443K435-E439 IonicContact NZ-OE1 3.1Å; K435-E439 PolarHBondContact NZ-OE1 3.5Å; K435-E439 IonicContact NZ-OE2 2.69Å; K435-E439 PolarHBondContact NZ-OE2 2.9Å; K435-E439 WeakPolarHBondContact O-CB 3.37Å; K435-E439 PolarHBondContact O-N 3.25Å; E439-K441 VanDerWaalsContact C-N 3.33Å; E439-K441 PolarHBondContact O-N 3.4Å; E439-Q442 PolarHBondContact O-N 3.1Å; E439-E443 WeakPolarHBondContact O-CB 3.39Å; E439-E443 PolarHBondContact O-N 3.24Å
440K91.8Very high91.1Very high120 Ų120110.9 Ų110.952%0.52253%0.533SS..Hα-helixtrans-65.2-32.5172.1-169.6166.1-170.6164.10112.9E436 E438 N444E436-K440 WeakPolarHBondContact O-CB 3.34Å; E436-K440 PolarHBondContact O-N 2.83Å; E438-K440 PolarHBondContact O-N 2.86Å; K440-N444 PolarHBondContact O-N 3.42Å; K440-N444 VanDerWaalsContact O-N 3.1Å; K440-N444 PolarHBondContact O-ND2 2.6Å
441K89.1Confident90.9Very high143 Ų143112 Ų11262%0.62253%0.532SS*.Hα-helixtrans-67.4-43.8171.7-176.1-170.3170.8-1650111L437 E438 E439 N444 E445L437-K441 WeakPolarHBondContact O-CB 3.45Å; L437-K441 PolarHBondContact O-N 2.95Å; E438-K441 CarbonylContact O-C 3.59Å; E438-K441 WeakPolarHBondContact O-CA 3.46Å; E438-K441 WeakPolarHBondContact O-CB 3.15Å; E438-K441 PolarHBondContact O-N 3.42Å; E439-K441 VanDerWaalsContact C-N 3.33Å; E439-K441 PolarHBondContact O-N 3.4Å; K441-N444 PolarHBondContact O-N 2.99Å; K441-E445 WeakPolarHBondContact O-CB 3.42Å; K441-E445 PolarHBondContact O-N 3.47Å
442Q87.6Confident90.9Very high94 Ų94115 Ų11544%0.43954%0.537SS..Hα-helixtrans-65.2-37.8177.2-67.5-178.122.200112E438 E439 E445 Q446E438-Q442 WeakPolarHBondContact O-CG 3.47Å; E438-Q442 PolarHBondContact O-N 3.39Å; E438-Q442 PolarHBondContact OE1-NE2 3.38Å; E439-Q442 PolarHBondContact O-N 3.1Å; Q442-E445 PolarHBondContact O-N 2.87Å; Q442-Q446 WeakPolarHBondContact O-CB 3.45Å; Q442-Q446 WeakPolarHBondContact O-CG 3.37Å; Q442-Q446 PolarHBondContact O-N 2.97Å
443E92.3Very high90.8Very high127 Ų127111.9 Ų111.959%0.59353%0.531SS*.Hα-helixtrans-60.1-52.3172.8-178.6-178.3-142.700111.5E439 E445 Q446 E447E439-E443 WeakPolarHBondContact O-CB 3.39Å; E439-E443 PolarHBondContact O-N 3.24Å; E443-E445 VanDerWaalsContact C-N 3.27Å; E443-E445 PolarHBondContact O-N 3.25Å; E443-Q446 PolarHBondContact O-N 2.85Å; E443-E447 PolarHBondContact O-N 2.99Å
444N86.3Confident90.6Very high95 Ų95115.1 Ų115.151%0.50854%0.537SS..Hα-helixtrans-60.9-35176.4-79.8-80.8000112.4K440 K441 G448K440-N444 PolarHBondContact O-N 3.42Å; K440-N444 VanDerWaalsContact O-N 3.1Å; K440-N444 PolarHBondContact O-ND2 2.6Å; K441-N444 PolarHBondContact O-N 2.99Å; N444-G448 PolarHBondContact O-N 2.68Å
445E90.8Very high90.7Very high91 Ų91114.4 Ų114.443%0.42553%0.534SS..Hα-helixtrans-70.8-39.3176.3-160.6-171.5127.800112K441 Q442 E443 G448 R449K441-E445 WeakPolarHBondContact O-CB 3.42Å; K441-E445 PolarHBondContact O-N 3.47Å; Q442-E445 PolarHBondContact O-N 2.87Å; E443-E445 VanDerWaalsContact C-N 3.27Å; E443-E445 PolarHBondContact O-N 3.25Å; E445-G448 PolarHBondContact O-N 3.25Å; E445-R449 WeakPolarHBondContact O-CB 3.25Å; E445-R449 WeakPolarHBondContact O-CD 3.47Å; E445-R449 WeakPolarHBondContact O-CG 3.37Å; E445-R449 PolarHBondContact O-N 3.17Å; E445-R449 IonicContact OE1-CZ 3.29Å; E445-R449 VanDerWaalsContact OE1-CZ 3.23Å; E445-R449 IonicContact OE1-NE 3.1Å; E445-R449 PolarHBondContact OE1-NE 3.24Å; E445-R449 IonicContact OE1-NH2 2.59Å; E445-R449 PolarHBondContact OE1-NH2 3.03Å
446Q87.7Confident90.6Very high122 Ų122115.5 Ų115.557%0.5754%0.539SS*.Hα-helixtrans-66.2-43.6174.1-74.2178.350.600111.6Q442 E443 G448 R449 M450Q442-Q446 WeakPolarHBondContact O-CB 3.45Å; Q442-Q446 WeakPolarHBondContact O-CG 3.37Å; Q442-Q446 PolarHBondContact O-N 2.97Å; E443-Q446 PolarHBondContact O-N 2.85Å; Q446-G448 VanDerWaalsContact C-N 3.33Å; Q446-G448 PolarHBondContact O-N 2.95Å; Q446-R449 PolarHBondContact O-N 2.88Å; Q446-M450 WeakPolarHBondContact O-CG 3.31Å; Q446-M450 PolarHBondContact O-N 3.01Å
447E90.6Very high90.5Very high91 Ų91116.4 Ų116.443%0.42554%0.541SS..Hα-helixtrans-63.3-40.8175.2-157.6-163.6-170.300111.4E443 M450 R451E443-E447 PolarHBondContact O-N 2.99Å; E447-M450 PolarHBondContact O-N 2.92Å; E447-R451 VanDerWaalsContact O-CG 3.28Å; E447-R451 WeakPolarHBondContact O-CG 3.32Å; E447-R451 PolarHBondContact O-N 2.86Å; E447-R451 IonicContact OE1-CZ 3.37Å; E447-R451 VanDerWaalsContact OE1-CZ 3.31Å; E447-R451 IonicContact OE1-NE 2.67Å; E447-R451 PolarHBondContact OE1-NE 3.38Å; E447-R451 IonicContact OE1-NH2 3.3Å; E447-R451 PolarHBondContact OE1-NH2 3.12Å; E447-R451 IonicContact OE2-CZ 2.69Å; E447-R451 IonicContact OE2-NE 2.69Å; E447-R451 IonicContact OE2-NH1 3.43Å; E447-R451 IonicContact OE2-NH2 2.66Å; E447-R451 PolarHBondContact OE2-NH2 3.39Å
448G88.8Confident90.4Very high36 Ų36116.4 Ų116.437%0.37154%0.537SS..Hα-helixtrans-58.2-47.4172.600000112.8N444 E445 Q446 R451 E452N444-G448 PolarHBondContact O-N 2.68Å; E445-G448 PolarHBondContact O-N 3.25Å; Q446-G448 VanDerWaalsContact C-N 3.33Å; Q446-G448 PolarHBondContact O-N 2.95Å; G448-R451 PolarHBondContact O-N 2.86Å; G448-E452 PolarHBondContact O-N 3.32Å
449R90Very high90.6Very high151 Ų151115.4 Ų115.457%0.5754%0.535SS*.Hα-helixtrans-61.6-42176.6-72.7160.9177.4-93.56112.2E445 Q446 E452 E453E445-R449 WeakPolarHBondContact O-CB 3.25Å; E445-R449 WeakPolarHBondContact O-CD 3.47Å; E445-R449 WeakPolarHBondContact O-CG 3.37Å; E445-R449 PolarHBondContact O-N 3.17Å; E445-R449 IonicContact OE1-CZ 3.29Å; E445-R449 VanDerWaalsContact OE1-CZ 3.23Å; E445-R449 IonicContact OE1-NE 3.1Å; E445-R449 PolarHBondContact OE1-NE 3.24Å; E445-R449 IonicContact OE1-NH2 2.59Å; E445-R449 PolarHBondContact OE1-NH2 3.03Å; Q446-R449 PolarHBondContact O-N 2.88Å; R449-E452 PolarHBondContact O-N 3.39Å; R449-E453 PolarHBondContact O-N 3.27Å
450M83.9Confident90.7Very high113 Ų113113 Ų11356%0.55753%0.533SS*.Hα-helixtrans-63-45.7176-72.2-59.3-58.400111.7Q446 E447 E452 E453 E454Q446-M450 WeakPolarHBondContact O-CG 3.31Å; Q446-M450 PolarHBondContact O-N 3.01Å; E447-M450 PolarHBondContact O-N 2.92Å; M450-E452 VanDerWaalsContact C-N 3.34Å; M450-E452 PolarHBondContact O-N 3.19Å; M450-E453 PolarHBondContact O-N 3.44Å; M450-E454 WeakPolarHBondContact O-CG 3.49Å; M450-E454 PolarHBondContact O-N 3.22Å
451R90.6Very high90.7Very high136 Ų136114 Ų11451%0.51354%0.54SS..Hα-helixtrans-63-38.3176.3-68.8168.2179.5-179.22112.1E447 G448 Q455E447-R451 VanDerWaalsContact O-CG 3.28Å; E447-R451 WeakPolarHBondContact O-CG 3.32Å; E447-R451 PolarHBondContact O-N 2.86Å; E447-R451 IonicContact OE1-CZ 3.37Å; E447-R451 VanDerWaalsContact OE1-CZ 3.31Å; E447-R451 IonicContact OE1-NE 2.67Å; E447-R451 PolarHBondContact OE1-NE 3.38Å; E447-R451 IonicContact OE1-NH2 3.3Å; E447-R451 PolarHBondContact OE1-NH2 3.12Å; E447-R451 IonicContact OE2-CZ 2.69Å; E447-R451 IonicContact OE2-NE 2.69Å; E447-R451 IonicContact OE2-NH1 3.43Å; E447-R451 IonicContact OE2-NH2 2.66Å; E447-R451 PolarHBondContact OE2-NH2 3.39Å; G448-R451 PolarHBondContact O-N 2.86Å; R451-Q455 WeakPolarHBondContact O-CG 3.46Å; R451-Q455 PolarHBondContact O-N 3.35Å; R451-Q455 VanDerWaalsContact O-N 3.09Å
452E92.1Very high90.9Very high119 Ų119112.8 Ų112.856%0.55654%0.536SS*.Hα-helixtrans-65.6-44.3173.6-165.9-163.7142.100111.5G448 R449 M450 E454 Q455 K456G448-E452 PolarHBondContact O-N 3.32Å; R449-E452 PolarHBondContact O-N 3.39Å; M450-E452 VanDerWaalsContact C-N 3.34Å; M450-E452 PolarHBondContact O-N 3.19Å; E452-E454 VanDerWaalsContact C-N 3.35Å; E452-E454 PolarHBondContact O-N 2.95Å; E452-Q455 PolarHBondContact O-N 2.88Å; E452-K456 WeakPolarHBondContact O-CB 3.38Å; E452-K456 PolarHBondContact O-N 3.19Å
453E92.4Very high91Very high127 Ų127113.5 Ų113.559%0.59354%0.54SS*.Hα-helixtrans-63-40.1177.9-170.3173.8156.400111.8R449 M450 K456 K457R449-E453 PolarHBondContact O-N 3.27Å; M450-E453 PolarHBondContact O-N 3.44Å; E453-K456 PolarHBondContact O-N 2.93Å; E453-K457 WeakPolarHBondContact O-CB 3.3Å; E453-K457 PolarHBondContact O-N 3.3Å
454E91.3Very high90.9Very high116 Ų116114 Ų11454%0.54254%0.542SS..Hα-helixtrans-62-46.8173.4-74.3-171.6161.100112.6M450 E452 K456 K457 Q458M450-E454 WeakPolarHBondContact O-CG 3.49Å; M450-E454 PolarHBondContact O-N 3.22Å; E452-E454 VanDerWaalsContact C-N 3.35Å; E452-E454 PolarHBondContact O-N 2.95Å; E454-K456 PolarHBondContact O-N 3.39Å; E454-K457 WeakPolarHBondContact O-CB 3.33Å; E454-K457 PolarHBondContact O-N 3.39Å; E454-Q458 WeakPolarHBondContact O-CG 3.5Å; E454-Q458 PolarHBondContact O-N 2.6Å
455Q90.8Very high91Very high126 Ų126111.1 Ų111.159%0.58953%0.534SS*.Hα-helixtrans-62.1-43.2176.2-72.4179.212.200111.7R451 E452 K457 Q458 L459R451-Q455 WeakPolarHBondContact O-CG 3.46Å; R451-Q455 PolarHBondContact O-N 3.35Å; R451-Q455 VanDerWaalsContact O-N 3.09Å; E452-Q455 PolarHBondContact O-N 2.88Å; Q455-K457 VanDerWaalsContact C-N 3.32Å; Q455-K457 PolarHBondContact O-N 2.86Å; Q455-Q458 PolarHBondContact O-N 3.1Å; Q455-L459 WeakPolarHBondContact O-CG 3.33Å; Q455-L459 PolarHBondContact O-N 2.59Å
456K93.3Very high90.9Very high139 Ų139112.1 Ų112.160%0.60454%0.539SS*.Hα-helixtrans-62.6-37.9176.6-171.5174.2-172.8169.50112.1E452 E453 E454 A460E452-K456 WeakPolarHBondContact O-CB 3.38Å; E452-K456 PolarHBondContact O-N 3.19Å; E453-K456 PolarHBondContact O-N 2.93Å; E454-K456 PolarHBondContact O-N 3.39Å; K456-A460 WeakPolarHBondContact O-CB 3.31Å; K456-A460 PolarHBondContact O-N 3.2Å
457K93.3Very high90.9Very high151 Ų151112.2 Ų112.266%0.65754%0.54SS*.Hα-helixtrans-68.3-41.4174.9-174.2176.6-179179.10112E453 E454 Q455 A460 Q461E453-K457 WeakPolarHBondContact O-CB 3.3Å; E453-K457 PolarHBondContact O-N 3.3Å; E454-K457 WeakPolarHBondContact O-CB 3.33Å; E454-K457 PolarHBondContact O-N 3.39Å; Q455-K457 VanDerWaalsContact C-N 3.32Å; Q455-K457 PolarHBondContact O-N 2.86Å; K457-A460 PolarHBondContact O-N 2.98Å; K457-Q461 WeakPolarHBondContact O-CB 3.2Å; K457-Q461 PolarHBondContact O-N 3.04Å
458Q92.3Very high90.9Very high126 Ų126110.5 Ų110.559%0.58954%0.541SS*.Hα-helixtrans-63-45.1172.8-70.7178.737.600111.7E454 Q455 Q461 Q462E454-Q458 WeakPolarHBondContact O-CG 3.5Å; E454-Q458 PolarHBondContact O-N 2.6Å; Q455-Q458 PolarHBondContact O-N 3.1Å; Q458-Q461 PolarHBondContact O-N 2.84Å; Q458-Q462 WeakPolarHBondContact O-CB 3.49Å; Q458-Q462 PolarHBondContact O-N 3.47Å
459L95.3Very high91.1Very high96 Ų96116 Ų11650%0.50356%0.555SS.*Hα-helixtrans-62.5-43.7175.9-73.5169.3000112.1Q455 Q461 Q462 Q463Q455-L459 WeakPolarHBondContact O-CG 3.33Å; Q455-L459 PolarHBondContact O-N 2.59Å; L459-Q461 PolarHBondContact O-N 3.25Å; L459-Q462 PolarHBondContact O-N 3.2Å; L459-Q463 WeakPolarHBondContact O-CG 3.45Å; L459-Q463 PolarHBondContact O-N 2.69Å
460A93.6Very high91.1Very high55 Ų55111.5 Ų111.546%0.45555%0.55SS..Hα-helixtrans-62-42.5175.400000112K456 K457 Q463 Q464K456-A460 WeakPolarHBondContact O-CB 3.31Å; K456-A460 PolarHBondContact O-N 3.2Å; K457-A460 PolarHBondContact O-N 2.98Å; A460-Q463 PolarHBondContact O-N 3.09Å; A460-Q464 WeakPolarHBondContact O-CB 3.48Å; A460-Q464 PolarHBondContact O-N 3.49Å
461Q93.4Very high91.4Very high140 Ų140112.1 Ų112.165%0.65455%0.551SS**Hα-helixtrans-65.1-39175.8-169.917725.600111.9K457 Q458 L459 Q464 G465K457-Q461 WeakPolarHBondContact O-CB 3.2Å; K457-Q461 PolarHBondContact O-N 3.04Å; Q458-Q461 PolarHBondContact O-N 2.84Å; L459-Q461 PolarHBondContact O-N 3.25Å; Q461-Q464 PolarHBondContact O-N 3.4Å; Q461-G465 PolarHBondContact O-N 3.01Å
462Q91.8Very high91.3Very high118 Ų118112 Ų11255%0.55156%0.556SS**Hα-helixtrans-65.1-45.1175.3-171-175.481.300111.4Q458 L459 G465 Q466Q458-Q462 WeakPolarHBondContact O-CB 3.49Å; Q458-Q462 PolarHBondContact O-N 3.47Å; L459-Q462 PolarHBondContact O-N 3.2Å; Q462-G465 PolarHBondContact O-N 3.47Å; Q462-Q466 WeakPolarHBondContact O-CG 3.32Å; Q462-Q466 PolarHBondContact O-N 3.28Å
463Q90.9Very high91.3Very high109 Ų109111 Ų11151%0.50955%0.552SS.*Hα-helixtrans-62.7-43.6175.4-72.4179.719.700111.8L459 A460 G465 Q466 Q467L459-Q463 WeakPolarHBondContact O-CG 3.45Å; L459-Q463 PolarHBondContact O-N 2.69Å; A460-Q463 PolarHBondContact O-N 3.09Å; Q463-G465 VanDerWaalsContact C-N 3.32Å; Q463-G465 PolarHBondContact O-N 2.83Å; Q463-Q466 PolarHBondContact O-N 2.69Å; Q463-Q467 WeakPolarHBondContact O-CG 3.47Å; Q463-Q467 PolarHBondContact O-N 2.66Å
464Q88.9Confident91.1Very high137 Ų137110.5 Ų110.564%0.6455%0.549SS*.Hα-helixtrans-61.3-41175.3-168.7-179.628.400111.5A460 Q461 Q467 A468A460-Q464 WeakPolarHBondContact O-CB 3.48Å; A460-Q464 PolarHBondContact O-N 3.49Å; Q461-Q464 PolarHBondContact O-N 3.4Å; Q464-Q467 PolarHBondContact O-N 3.3Å; Q464-A468 WeakPolarHBondContact O-CB 3.39Å; Q464-A468 PolarHBondContact O-N 3.22Å
465G90.3Very high91.2Very high34 Ų34109 Ų10935%0.35155%0.548SS..Hα-helixtrans-64.9-35.2174.100000113.7Q461 Q462 Q463 K469Q461-G465 PolarHBondContact O-N 3.01Å; Q462-G465 PolarHBondContact O-N 3.47Å; Q463-G465 VanDerWaalsContact C-N 3.32Å; Q463-G465 PolarHBondContact O-N 2.83Å; G465-K469 VanDerWaalsContact O-CG 3.31Å; G465-K469 WeakPolarHBondContact O-CG 3.42Å; G465-K469 PolarHBondContact O-N 3.15Å; G465-K469 VanDerWaalsContact O-N 3.16Å
466Q87.5Confident91.1Very high113 Ų113111.5 Ų111.553%0.52855%0.552SS.*Hα-helixtrans-69.3-44.5172.8-72.4175.710.900111.7Q462 Q463 A468 K469 A470Q462-Q466 WeakPolarHBondContact O-CG 3.32Å; Q462-Q466 PolarHBondContact O-N 3.28Å; Q463-Q466 PolarHBondContact O-N 2.69Å; Q466-A468 PolarHBondContact O-N 2.99Å; Q466-K469 PolarHBondContact O-N 2.91Å; Q466-A470 WeakPolarHBondContact O-CB 3.42Å; Q466-A470 PolarHBondContact O-N 3.3Å
467Q87.7Confident91Very high123 Ų123112.4 Ų112.458%0.57555%0.552SS**Hα-helixtrans-61.9-43.5176.7-721785.800112Q463 Q464 K469 A470 Q471Q463-Q467 WeakPolarHBondContact O-CG 3.47Å; Q463-Q467 PolarHBondContact O-N 2.66Å; Q464-Q467 PolarHBondContact O-N 3.3Å; Q467-K469 VanDerWaalsContact C-N 3.34Å; Q467-K469 PolarHBondContact O-N 2.9Å; Q467-A470 PolarHBondContact O-N 3.47Å; Q467-Q471 WeakPolarHBondContact O-CG 3.39Å; Q467-Q471 PolarHBondContact O-N 3.03Å
468A91.8Very high90.7Very high55 Ų55109 Ų10946%0.45554%0.541SS..Hα-helixtrans-62.6-39.3175.900000112.4Q464 Q466 Q472Q464-A468 WeakPolarHBondContact O-CB 3.39Å; Q464-A468 PolarHBondContact O-N 3.22Å; Q466-A468 PolarHBondContact O-N 2.99Å; A468-Q472 WeakPolarHBondContact O-CB 3.22Å; A468-Q472 PolarHBondContact O-N 3.1Å
469K91.5Very high90.6Very high153 Ų153107.9 Ų107.967%0.66554%0.539SS*.Hα-helixtrans-66.6-42173.7-76.2175.4178.6-177.20112.2G465 Q466 Q467 Q472 E473G465-K469 VanDerWaalsContact O-CG 3.31Å; G465-K469 WeakPolarHBondContact O-CG 3.42Å; G465-K469 PolarHBondContact O-N 3.15Å; G465-K469 VanDerWaalsContact O-N 3.16Å; Q466-K469 PolarHBondContact O-N 2.91Å; Q467-K469 VanDerWaalsContact C-N 3.34Å; Q467-K469 PolarHBondContact O-N 2.9Å; K469-Q472 PolarHBondContact O-N 3.33Å; K469-E473 PolarHBondContact O-N 3.4Å
470A90.6Very high90.5Very high56 Ų56108.2 Ų108.246%0.46354%0.544SS..Hα-helixtrans-61.8-45.8176.900000111.6Q466 Q467 Q472 E473 E474Q466-A470 WeakPolarHBondContact O-CB 3.42Å; Q466-A470 PolarHBondContact O-N 3.3Å; Q467-A470 PolarHBondContact O-N 3.47Å; A470-Q472 PolarHBondContact O-N 3Å; A470-E473 PolarHBondContact O-N 3.01Å; A470-E474 WeakPolarHBondContact O-CB 3.49Å; A470-E474 PolarHBondContact O-N 2.69Å
471Q89.1Confident90.2Very high126 Ų126111.6 Ų111.659%0.58955%0.553SS**Hα-helixtrans-61.6-40.8173.8-72.2176.4-3.800112.1Q467 E474 V475Q467-Q471 WeakPolarHBondContact O-CG 3.39Å; Q467-Q471 PolarHBondContact O-N 3.03Å; Q471-E474 PolarHBondContact O-N 3.43Å; Q471-V475 WeakPolarHBondContact O-CB 3.34Å; Q471-V475 VanDerWaalsContact O-CG2 3.3Å; Q471-V475 WeakPolarHBondContact O-CG2 3.49Å; Q471-V475 PolarHBondContact O-N 3.17Å
472Q90Very high90Very high132 Ų132108.2 Ų108.262%0.61754%0.539SS*.Hα-helixtrans-64-40.2175.4-172.1178.947.500111.8A468 K469 A470 R476A468-Q472 WeakPolarHBondContact O-CB 3.22Å; A468-Q472 PolarHBondContact O-N 3.1Å; K469-Q472 PolarHBondContact O-N 3.33Å; A470-Q472 PolarHBondContact O-N 3Å; Q472-R476 WeakPolarHBondContact O-CG 3.43Å; Q472-R476 PolarHBondContact O-N 3.27Å
473E91.1Very high89.9Confident99 Ų99109 Ų10946%0.46354%0.542SS..Hα-helixtrans-69.4-41.7177.2-157.1-164.714100111.9K469 A470 V475 R476 R477K469-E473 PolarHBondContact O-N 3.4Å; A470-E473 PolarHBondContact O-N 3.01Å; E473-V475 PolarHBondContact O-N 2.93Å; E473-R476 CarbonylContact O-C 3.58Å; E473-R476 PolarHBondContact O-N 2.89Å; E473-R476 VanDerWaalsContact O-N 3.11Å; E473-R477 WeakPolarHBondContact O-CG 3.33Å; E473-R477 PolarHBondContact O-N 3.31Å; E473-R477 IonicContact OE1-CZ 2.71Å; E473-R477 IonicContact OE1-NE 2.68Å; E473-R477 PolarHBondContact OE1-NE 2.87Å; E473-R477 IonicContact OE1-NH2 2.99Å; E473-R477 PolarHBondContact OE1-NH2 2.89Å
474E89.3Confident89.9Confident116 Ų116110 Ų11054%0.54255%0.547SS..Hα-helixtrans-58.1-46.7173.4-174.3179.1-175.900111.3A470 Q471 R476 R477 N478A470-E474 WeakPolarHBondContact O-CB 3.49Å; A470-E474 PolarHBondContact O-N 2.69Å; Q471-E474 PolarHBondContact O-N 3.43Å; E474-R476 VanDerWaalsContact C-N 3.32Å; E474-R476 PolarHBondContact O-N 3.34Å; E474-R477 PolarHBondContact O-N 2.73Å; E474-N478 WeakPolarHBondContact O-CB 3.34Å; E474-N478 VanDerWaalsContact O-CG 3.24Å; E474-N478 PolarHBondContact O-N 3.45Å; E474-N478 PolarHBondContact O-ND2 2.72Å
475V92.2Very high90.1Very high84 Ų84110.3 Ų110.351%0.50954%0.542SS..Hα-helixtrans-59.8-40.4173.4169.30000111.4Q471 E473 N478 N479Q471-V475 WeakPolarHBondContact O-CB 3.34Å; Q471-V475 VanDerWaalsContact O-CG2 3.3Å; Q471-V475 WeakPolarHBondContact O-CG2 3.49Å; Q471-V475 PolarHBondContact O-N 3.17Å; E473-V475 PolarHBondContact O-N 2.93Å; V475-N478 PolarHBondContact O-N 2.83Å; V475-N479 PolarHBondContact O-N 2.69Å; V475-N479 PolarHBondContact O-ND2 3.28Å
476R89.7Confident90.2Very high180 Ų180114.4 Ų114.468%0.67956%0.555SS**Hα-helixtrans-66.4-41.7175.2-72.9-174.876.586.73.1112.5Q472 E473 E474 N479 V480Q472-R476 WeakPolarHBondContact O-CG 3.43Å; Q472-R476 PolarHBondContact O-N 3.27Å; E473-R476 CarbonylContact O-C 3.58Å; E473-R476 PolarHBondContact O-N 2.89Å; E473-R476 VanDerWaalsContact O-N 3.11Å; E474-R476 VanDerWaalsContact C-N 3.32Å; E474-R476 PolarHBondContact O-N 3.34Å; R476-N479 PolarHBondContact O-N 2.86Å; R476-V480 WeakPolarHBondContact O-CG2 3.47Å; R476-V480 PolarHBondContact O-N 3.26Å
477R90.9Very high90.4Very high157 Ų157114.5 Ų114.559%0.59255%0.554SS**Hα-helixtrans-60.2-46.2175-70.9170.6179.9-151.34.6110.6E473 E474 V480 M481E473-R477 WeakPolarHBondContact O-CG 3.33Å; E473-R477 PolarHBondContact O-N 3.31Å; E473-R477 IonicContact OE1-CZ 2.71Å; E473-R477 IonicContact OE1-NE 2.68Å; E473-R477 PolarHBondContact OE1-NE 2.87Å; E473-R477 IonicContact OE1-NH2 2.99Å; E473-R477 PolarHBondContact OE1-NH2 2.89Å; E474-R477 PolarHBondContact O-N 2.73Å; R477-V480 PolarHBondContact O-N 2.92Å; R477-M481 WeakPolarHBondContact O-CG 3.37Å; R477-M481 PolarHBondContact O-N 3.4Å
478N86.6Confident90.6Very high81 Ų81114 Ų11443%0.43356%0.555SS.*Hα-helixtrans-62-45.3177.5-68-15000111.8E474 V475 V480 M481 D482E474-N478 WeakPolarHBondContact O-CB 3.34Å; E474-N478 VanDerWaalsContact O-CG 3.24Å; E474-N478 PolarHBondContact O-N 3.45Å; E474-N478 PolarHBondContact O-ND2 2.72Å; V475-N478 PolarHBondContact O-N 2.83Å; N478-V480 VanDerWaalsContact C-N 3.3Å; N478-V480 PolarHBondContact O-N 2.82Å; N478-M481 PolarHBondContact O-N 2.67Å; N478-M481 VanDerWaalsContact O-N 3.16Å; N478-D482 WeakPolarHBondContact O-CB 3.48Å; N478-D482 PolarHBondContact O-N 2.7Å
479N90.5Very high90.6Very high102 Ų102115.5 Ų115.555%0.54555%0.552SS.*Hα-helixtrans-59.5-37.3174.7-84.2-91.7000113V475 R476 H483V475-N479 PolarHBondContact O-N 2.69Å; V475-N479 PolarHBondContact O-ND2 3.28Å; R476-N479 PolarHBondContact O-N 2.86Å; N479-H483 WeakPolarHBondContact O-CB 3.35Å; N479-H483 PolarHBondContact O-N 3.44Å
480V92.4Very high90.6Very high102 Ų102113.1 Ų113.162%0.61854%0.544SS*.Hα-helixtrans-69.3-41.5175.5171.10000111.4R476 R477 N478 H483 H484R476-V480 WeakPolarHBondContact O-CG2 3.47Å; R476-V480 PolarHBondContact O-N 3.26Å; R477-V480 PolarHBondContact O-N 2.92Å; N478-V480 VanDerWaalsContact C-N 3.3Å; N478-V480 PolarHBondContact O-N 2.82Å; V480-H483 PolarHBondContact O-N 3.46Å; V480-H484 WeakPolarHBondContact O-CB 3.34Å; V480-H484 PolarHBondContact O-N 3.04Å
481M87Confident90.6Very high127 Ų127113.6 Ų113.663%0.62654%0.538SS*.Hα-helixtrans-65-40.4175.2-69.3-61.6-65.500112.2R477 N478 H484 R485R477-M481 WeakPolarHBondContact O-CG 3.37Å; R477-M481 PolarHBondContact O-N 3.4Å; N478-M481 PolarHBondContact O-N 2.67Å; N478-M481 VanDerWaalsContact O-N 3.16Å; M481-H484 PolarHBondContact O-N 2.9Å; M481-R485 WeakPolarHBondContact O-CB 3.5Å; M481-R485 PolarHBondContact O-N 2.64Å
482D89.3Confident90.7Very high69 Ų69113.1 Ų113.137%0.36953%0.534SS..Hα-helixtrans-64.2-44.9174.9-73.5-32.6000111.4N478 H484 R485 L486N478-D482 WeakPolarHBondContact O-CB 3.48Å; N478-D482 PolarHBondContact O-N 2.7Å; D482-H484 VanDerWaalsContact C-N 3.35Å; D482-H484 PolarHBondContact O-N 3.47Å; D482-R485 PolarHBondContact O-N 3.32Å; D482-R485 IonicContact OD1-CZ 3.11Å; D482-R485 IonicContact OD1-NH1 3.4Å; D482-R485 PolarHBondContact OD1-NH1 3.04Å; D482-R485 IonicContact OD1-NH2 3.42Å; D482-R485 PolarHBondContact OD1-NH2 3.37Å; D482-L486 WeakPolarHBondContact O-CB 3.4Å; D482-L486 PolarHBondContact O-N 3.28Å
483H90.4Very high90.8Very high134 Ų134113.4 Ų113.462%0.6253%0.529SS*.Hα-helixtrans-62.7-39.6174.9-175.3-65.5000112N479 V480 K487N479-H483 WeakPolarHBondContact O-CB 3.35Å; N479-H483 PolarHBondContact O-N 3.44Å; V480-H483 PolarHBondContact O-N 3.46Å; H483-K487 WeakPolarHBondContact O-CB 3.46Å; H483-K487 PolarHBondContact O-N 2.91Å
484H91.1Very high90.7Very high130 Ų130112.5 Ų112.560%0.60252%0.524SS*.Hα-helixtrans-65.7-42.4175.2-170.7-72.3000111.7V480 M481 D482 K487 L488V480-H484 WeakPolarHBondContact O-CB 3.34Å; V480-H484 PolarHBondContact O-N 3.04Å; M481-H484 PolarHBondContact O-N 2.9Å; D482-H484 VanDerWaalsContact C-N 3.35Å; D482-H484 PolarHBondContact O-N 3.47Å; H484-K487 PolarHBondContact O-N 3.39Å; H484-L488 WeakPolarHBondContact O-CB 3.03Å; H484-L488 PolarHBondContact O-N 2.76Å
485R93.5Very high90.7Very high144 Ų144113.2 Ų113.254%0.54353%0.528SS..Hα-helixtrans-62.2-46.2175.4-174.5177.367.6-104.8-3.5111.4M481 D482 K487 L488 E489M481-R485 WeakPolarHBondContact O-CB 3.5Å; M481-R485 PolarHBondContact O-N 2.64Å; D482-R485 PolarHBondContact O-N 3.32Å; D482-R485 IonicContact OD1-CZ 3.11Å; D482-R485 IonicContact OD1-NH1 3.4Å; D482-R485 PolarHBondContact OD1-NH1 3.04Å; D482-R485 IonicContact OD1-NH2 3.42Å; D482-R485 PolarHBondContact OD1-NH2 3.37Å; R485-K487 VanDerWaalsContact C-N 3.32Å; R485-K487 PolarHBondContact O-N 3.09Å; R485-L488 PolarHBondContact O-N 3.21Å; R485-E489 PolarHBondContact O-N 2.88Å
486L92.9Very high90.6Very high119 Ų119113.4 Ų113.462%0.62352%0.523SS*.Hα-helixtrans-62-41.2-179.9-156.879.1000111.5D482 E489 E490D482-L486 WeakPolarHBondContact O-CB 3.4Å; D482-L486 PolarHBondContact O-N 3.28Å; L486-E489 PolarHBondContact O-N 3.41Å; L486-E490 WeakPolarHBondContact O-CB 3.43Å; L486-E490 PolarHBondContact O-N 2.93Å
487K91.3Very high90.6Very high115 Ų115110.8 Ų110.850%0.552%0.518SS..Hα-helixtrans-67.4-41.7177.2-173.1169.1-177.6177.50112.7H483 H484 R485 E489 E490 D491H483-K487 WeakPolarHBondContact O-CB 3.46Å; H483-K487 PolarHBondContact O-N 2.91Å; H484-K487 PolarHBondContact O-N 3.39Å; R485-K487 VanDerWaalsContact C-N 3.32Å; R485-K487 PolarHBondContact O-N 3.09Å; K487-E489 VanDerWaalsContact C-N 3.26Å; K487-E489 PolarHBondContact O-N 3.34Å; K487-E490 PolarHBondContact O-N 3.38Å; K487-D491 PolarHBondContact O-N 3.46Å
488L91.5Very high90.6Very high114 Ų114109.1 Ų109.160%0.59752%0.517SS*.Hα-helixtrans-61-37.5174-177.664.2000111.7H484 R485 K492H484-L488 WeakPolarHBondContact O-CB 3.03Å; H484-L488 PolarHBondContact O-N 2.76Å; R485-L488 PolarHBondContact O-N 3.21Å; L488-K492 WeakPolarHBondContact O-CB 3.16Å; L488-K492 PolarHBondContact O-N 3.4Å
489E91.4Very high90.7Very high85 Ų85111.5 Ų111.540%0.39753%0.526SS..Hα-helixtrans-70.2-38.4175-157.9-170.6144.500112.3R485 L486 K487 R493R485-E489 PolarHBondContact O-N 2.88Å; L486-E489 PolarHBondContact O-N 3.41Å; K487-E489 VanDerWaalsContact C-N 3.26Å; K487-E489 PolarHBondContact O-N 3.34Å; E489-R493 WeakPolarHBondContact O-CG 3.47Å; E489-R493 PolarHBondContact O-N 2.78Å; E489-R493 IonicContact OE1-CZ 2.82Å; E489-R493 IonicContact OE1-NE 3.72Å; E489-R493 PolarHBondContact OE1-NE 2.97Å; E489-R493 IonicContact OE1-NH2 2.66Å; E489-R493 PolarHBondContact OE1-NH2 3.43Å
490E91.3Very high90.8Very high104 Ų104111.2 Ų111.249%0.48653%0.527SS..Hα-helixtrans-63.5-45174.5-162.3-158.3134.200111.8L486 K487 R493 K494L486-E490 WeakPolarHBondContact O-CB 3.43Å; L486-E490 PolarHBondContact O-N 2.93Å; K487-E490 PolarHBondContact O-N 3.38Å; E490-R493 PolarHBondContact O-N 3.48Å; E490-K494 WeakPolarHBondContact O-CG 3.49Å; E490-K494 PolarHBondContact O-N 2.94Å; E490-K494 VanDerWaalsContact O-N 3.1Å; E490-K494 WeakPolarHBondContact OE1-CE 3.41Å; E490-K494 IonicContact OE1-NZ 3.38Å; E490-K494 PolarHBondContact OE1-NZ 2.86Å
491D89.9Confident90.7Very high66 Ų66112.7 Ų112.735%0.35353%0.527SS..Hα-helixtrans-69.5-37.5179.4-68.9-27.2000111.4K487 R493 K494 E495K487-D491 PolarHBondContact O-N 3.46Å; D491-R493 PolarHBondContact O-N 2.86Å; D491-K494 WeakPolarHBondContact O-CB 3.35Å; D491-K494 PolarHBondContact O-N 3.01Å; D491-K494 VanDerWaalsContact O-N 3.15Å; D491-K494 IonicContact OD1-NZ 3.75Å; D491-K494 PolarHBondContact OD1-NZ 3.17Å; D491-E495 PolarHBondContact O-N 3.29Å
492K93.3Very high90.9Very high115 Ų115110.4 Ų110.450%0.552%0.517SS..Hα-helixtrans-60.8-41.3170-175.2171.7-174.8-72.80112.6L488 K494 E495 E496L488-K492 WeakPolarHBondContact O-CB 3.16Å; L488-K492 PolarHBondContact O-N 3.4Å; K492-K494 VanDerWaalsContact C-N 3.28Å; K492-K494 PolarHBondContact O-N 2.98Å; K492-E495 PolarHBondContact O-N 3.32Å; K492-E496 IonicContact NZ-OE1 3.87Å; K492-E496 PolarHBondContact NZ-OE1 3.16Å; K492-E496 WeakPolarHBondContact O-CG 3.32Å; K492-E496 PolarHBondContact O-N 2.81Å
493R90.6Very high90.9Very high138 Ų138113.5 Ų113.552%0.52153%0.529SS..Hα-helixtrans-64.7-30.1175.1-72.1166.2-177.6-143.56.9112.4E489 E490 D491 Q497E489-R493 WeakPolarHBondContact O-CG 3.47Å; E489-R493 PolarHBondContact O-N 2.78Å; E489-R493 IonicContact OE1-CZ 2.82Å; E489-R493 IonicContact OE1-NE 3.72Å; E489-R493 PolarHBondContact OE1-NE 2.97Å; E489-R493 IonicContact OE1-NH2 2.66Å; E489-R493 PolarHBondContact OE1-NH2 3.43Å; E490-R493 PolarHBondContact O-N 3.48Å; D491-R493 PolarHBondContact O-N 2.86Å; R493-Q497 WeakPolarHBondContact O-CB 3.5Å; R493-Q497 VanDerWaalsContact O-CG 3.25Å; R493-Q497 WeakPolarHBondContact O-CG 3.4Å; R493-Q497 PolarHBondContact O-N 3.2Å; R493-Q497 VanDerWaalsContact O-N 3.12Å
494K89.6Confident91Very high81 Ų81108.7 Ų108.735%0.35251%0.513SS..Hα-helixtrans-71.6-42.2173.1-66.1165-160.4159.30111.5E490 D491 K492 Q497 Q498E490-K494 WeakPolarHBondContact O-CG 3.49Å; E490-K494 PolarHBondContact O-N 2.94Å; E490-K494 VanDerWaalsContact O-N 3.1Å; E490-K494 WeakPolarHBondContact OE1-CE 3.41Å; E490-K494 IonicContact OE1-NZ 3.38Å; E490-K494 PolarHBondContact OE1-NZ 2.86Å; D491-K494 WeakPolarHBondContact O-CB 3.35Å; D491-K494 PolarHBondContact O-N 3.01Å; D491-K494 VanDerWaalsContact O-N 3.15Å; D491-K494 IonicContact OD1-NZ 3.75Å; D491-K494 PolarHBondContact OD1-NZ 3.17Å; K492-K494 VanDerWaalsContact C-N 3.28Å; K492-K494 PolarHBondContact O-N 2.98Å; K494-Q497 PolarHBondContact O-N 3.42Å; K494-Q498 WeakPolarHBondContact O-CG 3.38Å; K494-Q498 PolarHBondContact O-N 2.8Å
495E89.3Confident91Very high131 Ų131109 Ų10961%0.61252%0.515SS*.Hα-helixtrans-61.3-47.2175.7-172.7173.1-157.500111.1D491 K492 Q497 Q498 Q499D491-E495 PolarHBondContact O-N 3.29Å; K492-E495 PolarHBondContact O-N 3.32Å; E495-Q497 VanDerWaalsContact C-N 3.34Å; E495-Q497 PolarHBondContact O-N 2.89Å; E495-Q498 PolarHBondContact O-N 2.66Å; E495-Q499 WeakPolarHBondContact O-CB 3.42Å; E495-Q499 PolarHBondContact O-N 2.78Å
496E90.8Very high90.9Very high88 Ų88108.1 Ų108.141%0.41152%0.515SS..Hα-helixtrans-57.5-43.4173.5-73171178.500112.3K492 Q499 V500K492-E496 IonicContact NZ-OE1 3.87Å; K492-E496 PolarHBondContact NZ-OE1 3.16Å; K492-E496 WeakPolarHBondContact O-CG 3.32Å; K492-E496 PolarHBondContact O-N 2.81Å; E496-Q499 PolarHBondContact O-N 2.94Å; E496-V500 WeakPolarHBondContact O-CG2 3.35Å; E496-V500 PolarHBondContact O-N 3.48Å
497Q88.8Confident90.9Very high124 Ų124108.3 Ų108.358%0.57951%0.512SS*.Hα-helixtrans-65.3-39.5176.1-76.8174.534.900113.1R493 K494 E495 Q501R493-Q497 WeakPolarHBondContact O-CB 3.5Å; R493-Q497 VanDerWaalsContact O-CG 3.25Å; R493-Q497 WeakPolarHBondContact O-CG 3.4Å; R493-Q497 PolarHBondContact O-N 3.2Å; R493-Q497 VanDerWaalsContact O-N 3.12Å; K494-Q497 PolarHBondContact O-N 3.42Å; E495-Q497 VanDerWaalsContact C-N 3.34Å; E495-Q497 PolarHBondContact O-N 2.89Å; Q497-Q501 WeakPolarHBondContact O-CG 3.18Å; Q497-Q501 PolarHBondContact O-N 3.46Å
498Q90.4Very high90.9Very high123 Ų123110 Ų11058%0.57552%0.52SS*.Hα-helixtrans-65.6-41.2174.6-72.317824.900111.1K494 E495 V500 Q501 I502K494-Q498 WeakPolarHBondContact O-CG 3.38Å; K494-Q498 PolarHBondContact O-N 2.8Å; E495-Q498 PolarHBondContact O-N 2.66Å; Q498-V500 PolarHBondContact O-N 3.22Å; Q498-Q501 PolarHBondContact O-N 2.8Å; Q498-I502 VanDerWaalsContact O-CG1 3.3Å; Q498-I502 WeakPolarHBondContact O-CG1 3.37Å; Q498-I502 PolarHBondContact O-N 2.99Å
499Q88.7Confident91Very high131 Ų131107.4 Ų107.461%0.61252%0.515SS*.Hα-helixtrans-64.1-41.2178.1-167166.29.500111.8E495 E496 I502 E503E495-Q499 WeakPolarHBondContact O-CB 3.42Å; E495-Q499 PolarHBondContact O-N 2.78Å; E496-Q499 PolarHBondContact O-N 2.94Å; Q499-I502 PolarHBondContact O-N 2.86Å; Q499-E503 WeakPolarHBondContact O-CB 3.46Å; Q499-E503 PolarHBondContact O-N 2.84Å
500V93.2Very high91Very high95 Ų95109.8 Ų109.858%0.57652%0.524SS*.Hα-helixtrans-64.5-38.5172.9170.10000112.2E496 Q498 E503 A504E496-V500 WeakPolarHBondContact O-CG2 3.35Å; E496-V500 PolarHBondContact O-N 3.48Å; Q498-V500 PolarHBondContact O-N 3.22Å; V500-E503 PolarHBondContact O-N 3.39Å; V500-A504 WeakPolarHBondContact O-CB 3.31Å; V500-A504 PolarHBondContact O-N 2.96Å
501Q91.1Very high91.1Very high133 Ų133108.6 Ų108.662%0.62152%0.523SS*.Hα-helixtrans-63.9-45.8174.4-74.4178.636.900111.8Q497 Q498 E503 A504 E505Q497-Q501 WeakPolarHBondContact O-CG 3.18Å; Q497-Q501 PolarHBondContact O-N 3.46Å; Q498-Q501 PolarHBondContact O-N 2.8Å; Q501-E503 VanDerWaalsContact C-N 3.31Å; Q501-E503 PolarHBondContact O-N 3.06Å; Q501-A504 PolarHBondContact O-N 2.92Å; Q501-E505 WeakPolarHBondContact O-CB 3.45Å; Q501-E505 PolarHBondContact O-N 3.11Å
502I90.2Very high91.2Very high80 Ų80111.1 Ų111.141%0.4153%0.533SS..Hα-helixtrans-63.6-36.7177.4-69164.7000111.2Q498 Q499 K506Q498-I502 VanDerWaalsContact O-CG1 3.3Å; Q498-I502 WeakPolarHBondContact O-CG1 3.37Å; Q498-I502 PolarHBondContact O-N 2.99Å; Q499-I502 PolarHBondContact O-N 2.86Å; I502-K506 HydrophobicContact CG2-CD 4.02Å; I502-K506 VanDerWaalsContact CG2-NZ 3.33Å; I502-K506 WeakPolarHBondContact O-CB 3.47Å; I502-K506 WeakPolarHBondContact O-CD 3.39Å; I502-K506 WeakPolarHBondContact O-CG 3.47Å; I502-K506 PolarHBondContact O-N 2.79Å
503E88.6Confident91.1Very high133 Ų133108.8 Ų108.862%0.62154%0.535SS*.Hα-helixtrans-70-43.9175.1-176.8151.6-133.700112.1Q499 V500 Q501 E505 K506 E507Q499-E503 WeakPolarHBondContact O-CB 3.46Å; Q499-E503 PolarHBondContact O-N 2.84Å; V500-E503 PolarHBondContact O-N 3.39Å; Q501-E503 VanDerWaalsContact C-N 3.31Å; Q501-E503 PolarHBondContact O-N 3.06Å; E503-E505 VanDerWaalsContact C-N 3.33Å; E503-E505 PolarHBondContact O-N 3.03Å; E503-K506 CarbonylContact O-C 3.58Å; E503-K506 PolarHBondContact O-N 2.87Å; E503-E507 PolarHBondContact O-N 3.12Å
504A93.9Very high91Very high34 Ų34109.4 Ų109.428%0.28154%0.542SS..Hα-helixtrans-64.6-33.9176.100000112.9V500 Q501 K508V500-A504 WeakPolarHBondContact O-CB 3.31Å; V500-A504 PolarHBondContact O-N 2.96Å; Q501-A504 PolarHBondContact O-N 2.92Å; A504-K508 VanDerWaalsContact O-CG 3.26Å; A504-K508 WeakPolarHBondContact O-CG 3.37Å; A504-K508 PolarHBondContact O-N 2.88Å
505E91.4Very high91.2Very high137 Ų137109.9 Ų109.964%0.6455%0.545SS*.Hα-helixtrans-67.1-46.2171.4-173178.7-166.900111.3Q501 E503 E507 K508 A509Q501-E505 WeakPolarHBondContact O-CB 3.45Å; Q501-E505 PolarHBondContact O-N 3.11Å; E503-E505 VanDerWaalsContact C-N 3.33Å; E503-E505 PolarHBondContact O-N 3.03Å; E505-E507 VanDerWaalsContact C-N 3.28Å; E505-E507 PolarHBondContact O-N 3.33Å; E505-K508 PolarHBondContact O-N 3.43Å; E505-A509 WeakPolarHBondContact O-CB 3.48Å; E505-A509 PolarHBondContact O-N 3.23Å
506K91Very high91.4Very high124 Ų124107.3 Ų107.354%0.53954%0.535SS..Hα-helixtrans-62.4-32.6174.2-74.5167.5-177.2170.10112.6I502 E503 K510I502-K506 HydrophobicContact CG2-CD 4.02Å; I502-K506 VanDerWaalsContact CG2-NZ 3.33Å; I502-K506 WeakPolarHBondContact O-CB 3.47Å; I502-K506 WeakPolarHBondContact O-CD 3.39Å; I502-K506 WeakPolarHBondContact O-CG 3.47Å; I502-K506 PolarHBondContact O-N 2.79Å; E503-K506 CarbonylContact O-C 3.58Å; E503-K506 PolarHBondContact O-N 2.87Å; K506-K510 WeakPolarHBondContact O-CB 3.3Å; K506-K510 WeakPolarHBondContact O-CD 3.32Å; K506-K510 WeakPolarHBondContact O-CG 3.4Å; K506-K510 PolarHBondContact O-N 2.87Å; K506-K510 VanDerWaalsContact O-N 3.13Å
507E91.8Very high91.5Very high123 Ų123105.5 Ų105.558%0.57554%0.535SS*.Hα-helixtrans-68.2-50.9172.9-171.1-177.3-168.300110.9E503 E505 A509 K510 V511E503-E507 PolarHBondContact O-N 3.12Å; E505-E507 VanDerWaalsContact C-N 3.28Å; E505-E507 PolarHBondContact O-N 3.33Å; E507-A509 VanDerWaalsContact C-N 3.3Å; E507-A509 PolarHBondContact O-N 3.43Å; E507-K510 CarbonylContact O-C 3.55Å; E507-K510 WeakPolarHBondContact O-CA 3.42Å; E507-K510 WeakPolarHBondContact O-CB 3.45Å; E507-K510 PolarHBondContact O-N 3.47Å; E507-V511 HydrophobicContact CG-CG2 4.4Å; E507-V511 WeakPolarHBondContact O-CG2 3.41Å; E507-V511 PolarHBondContact O-N 3.26Å
508K92.6Very high91.8Very high152 Ų152104.8 Ų104.866%0.66153%0.532SS*.Hα-helixtrans-54.5-45.6176.5-73.8167.6-176.4176.60111.8A504 E505 K510 V511 Q512A504-K508 VanDerWaalsContact O-CG 3.26Å; A504-K508 WeakPolarHBondContact O-CG 3.37Å; A504-K508 PolarHBondContact O-N 2.88Å; E505-K508 PolarHBondContact O-N 3.43Å; K508-K510 PolarHBondContact O-N 2.99Å; K508-V511 PolarHBondContact O-N 2.94Å; K508-Q512 WeakPolarHBondContact O-CB 3.47Å; K508-Q512 PolarHBondContact O-N 3.27Å
509A92.6Very high91.9Very high59 Ų59105.8 Ų105.849%0.48853%0.531SS..Hα-helixtrans-61.3-39.7175.400000112.8E505 E507 A513E505-A509 WeakPolarHBondContact O-CB 3.48Å; E505-A509 PolarHBondContact O-N 3.23Å; E507-A509 VanDerWaalsContact C-N 3.3Å; E507-A509 PolarHBondContact O-N 3.43Å; A509-A513 VanDerWaalsContact O-CB 3.28Å; A509-A513 WeakPolarHBondContact O-CB 3.3Å; A509-A513 PolarHBondContact O-N 2.88Å
510K92.1Very high92.2Very high134 Ų134104.9 Ų104.958%0.58353%0.526SS*.Hα-helixtrans-68.2-33.2174.2-72.2163.6-173171.10113K506 E507 K508 K514K506-K510 WeakPolarHBondContact O-CB 3.3Å; K506-K510 WeakPolarHBondContact O-CD 3.32Å; K506-K510 WeakPolarHBondContact O-CG 3.4Å; K506-K510 PolarHBondContact O-N 2.87Å; K506-K510 VanDerWaalsContact O-N 3.13Å; E507-K510 CarbonylContact O-C 3.55Å; E507-K510 WeakPolarHBondContact O-CA 3.42Å; E507-K510 WeakPolarHBondContact O-CB 3.45Å; E507-K510 PolarHBondContact O-N 3.47Å; K508-K510 PolarHBondContact O-N 2.99Å; K510-K514 VanDerWaalsContact O-CG 3.3Å; K510-K514 WeakPolarHBondContact O-CG 3.37Å; K510-K514 PolarHBondContact O-N 3.45Å
511V93.8Very high92.2Very high79 Ų79108.1 Ų108.148%0.47953%0.528SS..Hα-helixtrans-71.6-48.6175.9172.30000109.9E507 K508 A513 K514 E515E507-V511 HydrophobicContact CG-CG2 4.4Å; E507-V511 WeakPolarHBondContact O-CG2 3.41Å; E507-V511 PolarHBondContact O-N 3.26Å; K508-V511 PolarHBondContact O-N 2.94Å; V511-A513 PolarHBondContact O-N 3.49Å; V511-K514 WeakPolarHBondContact O-CB 3.41Å; V511-K514 PolarHBondContact O-N 3.39Å; V511-E515 PolarHBondContact O-N 3.37Å
512Q90.9Very high92.4Very high120 Ų120105.8 Ų105.856%0.56152%0.518SS*.Hα-helixtrans-59.5-45.8177.6-172.9173.5-5.100111.8K508 K514 E515 D516K508-Q512 WeakPolarHBondContact O-CB 3.47Å; K508-Q512 PolarHBondContact O-N 3.27Å; Q512-K514 PolarHBondContact O-N 2.88Å; Q512-E515 WeakPolarHBondContact O-CB 3.41Å; Q512-E515 PolarHBondContact O-N 3.18Å; Q512-D516 PolarHBondContact O-N 3.43Å
513A92.8Very high92.6Very high65 Ų65103.7 Ų103.754%0.53752%0.516SS..Hα-helixtrans-62.7-25.7175.800000113.9A509 V511 A517A509-A513 VanDerWaalsContact O-CB 3.28Å; A509-A513 WeakPolarHBondContact O-CB 3.3Å; A509-A513 PolarHBondContact O-N 2.88Å; V511-A513 PolarHBondContact O-N 3.49Å; A513-A517 WeakPolarHBondContact O-CB 3.19Å; A513-A517 PolarHBondContact O-N 2.93Å
514K88Confident92.8Very high152 Ų152104 Ų10466%0.66151%0.511SS*.Hα-helixtrans-76.4-41.9170.4-74.3169.9179.7179.80111.5K510 V511 Q512 A517 E518K510-K514 VanDerWaalsContact O-CG 3.3Å; K510-K514 WeakPolarHBondContact O-CG 3.37Å; K510-K514 PolarHBondContact O-N 3.45Å; V511-K514 WeakPolarHBondContact O-CB 3.41Å; V511-K514 PolarHBondContact O-N 3.39Å; Q512-K514 PolarHBondContact O-N 2.88Å; K514-A517 PolarHBondContact O-N 3.26Å; K514-E518 PolarHBondContact O-N 2.67Å
515E94.2Very high92.9Very high90 Ų90107.8 Ų107.842%0.42152%0.523SS..Hα-helixtrans-61.8-46.1177.5-164.2-168.3150.100111.1V511 Q512 A517 E518 R519V511-E515 PolarHBondContact O-N 3.37Å; Q512-E515 WeakPolarHBondContact O-CB 3.41Å; Q512-E515 PolarHBondContact O-N 3.18Å; E515-A517 VanDerWaalsContact C-N 3.31Å; E515-A517 PolarHBondContact O-N 2.67Å; E515-E518 CarbonylContact O-C 3.59Å; E515-E518 PolarHBondContact O-N 3.4Å; E515-E518 VanDerWaalsContact O-N 3.08Å; E515-R519 WeakPolarHBondContact O-CG 3.4Å; E515-R519 PolarHBondContact O-N 3.49Å; E515-R519 IonicContact OE1-CZ 2.66Å; E515-R519 IonicContact OE1-NE 2.84Å; E515-R519 PolarHBondContact OE1-NE 2.9Å; E515-R519 IonicContact OE1-NH2 2.84Å; E515-R519 PolarHBondContact OE1-NH2 3.16Å
516D92.5Very high93.1Very high77 Ų77106.6 Ų106.641%0.41252%0.517SS..Hα-helixtrans-63.3-36.7176.2-71.2-39.1000112.1Q512 E518 Q520Q512-D516 PolarHBondContact O-N 3.43Å; D516-E518 VanDerWaalsContact C-N 3.35Å; D516-Q520 WeakPolarHBondContact O-CB 3.47Å; D516-Q520 PolarHBondContact O-N 2.92Å
517A93.3Very high93.3Very high50 Ų50107 Ų10741%0.41352%0.521SS..Hα-helixtrans-68.6-31.1172.800000113A513 K514 E515 R521A513-A517 WeakPolarHBondContact O-CB 3.19Å; A513-A517 PolarHBondContact O-N 2.93Å; K514-A517 PolarHBondContact O-N 3.26Å; E515-A517 VanDerWaalsContact C-N 3.31Å; E515-A517 PolarHBondContact O-N 2.67Å; A517-R521 WeakPolarHBondContact O-CG 3.31Å; A517-R521 PolarHBondContact O-N 2.9Å
518E94.3Very high93.4Very high109 Ų109105.3 Ų105.351%0.50952%0.519SS..Hα-helixtrans-74.1-45.3173.3-166.6-179.214900111.5K514 E515 D516 Q520 R521 Q522K514-E518 PolarHBondContact O-N 2.67Å; E515-E518 CarbonylContact O-C 3.59Å; E515-E518 PolarHBondContact O-N 3.4Å; E515-E518 VanDerWaalsContact O-N 3.08Å; D516-E518 VanDerWaalsContact C-N 3.35Å; E518-Q520 PolarHBondContact O-N 2.93Å; E518-R521 CarbonylContact O-C 3.6Å; E518-R521 WeakPolarHBondContact O-CA 3.38Å; E518-R521 WeakPolarHBondContact O-CB 3.48Å; E518-R521 PolarHBondContact O-N 3.29Å; E518-Q522 WeakPolarHBondContact O-CG 3.32Å; E518-Q522 PolarHBondContact O-N 3.33Å; E518-Q522 PolarHBondContact OE1-NE2 2.87Å; E518-Q522 VanDerWaalsContact OE1-NE2 3.1Å
519R93.7Very high93.6Very high145 Ų145103 Ų10355%0.54751%0.511SS..Hα-helixtrans-53.5-41.4171.2-69.8170176.9-146.93.1111.1E515 R521 Q522 G523E515-R519 WeakPolarHBondContact O-CG 3.4Å; E515-R519 PolarHBondContact O-N 3.49Å; E515-R519 IonicContact OE1-CZ 2.66Å; E515-R519 IonicContact OE1-NE 2.84Å; E515-R519 PolarHBondContact OE1-NE 2.9Å; E515-R519 IonicContact OE1-NH2 2.84Å; E515-R519 PolarHBondContact OE1-NH2 3.16Å; R519-R521 PolarHBondContact O-N 3.18Å; R519-Q522 PolarHBondContact O-N 3.46Å; R519-G523 PolarHBondContact O-N 3.28Å
520Q93.8Very high93.8Very high111 Ų111106.6 Ų106.652%0.51952%0.518SS..Hα-helixtrans-67-31.4174.6-164.9-173.981.100113.3D516 E518 R524D516-Q520 WeakPolarHBondContact O-CB 3.47Å; D516-Q520 PolarHBondContact O-N 2.92Å; E518-Q520 PolarHBondContact O-N 2.93Å; Q520-R524 VanDerWaalsContact CD-NH2 3.31Å; Q520-R524 WeakPolarHBondContact O-CG 3.38Å; Q520-R524 PolarHBondContact O-N 2.85Å
521R93.9Very high93.9Very high164 Ų164106.1 Ų106.162%0.61952%0.518SS*.Hα-helixtrans-68.7-48.8171.3-73.2170.9173.7-120.21.4111A517 E518 R519 G523 R524 E525A517-R521 WeakPolarHBondContact O-CG 3.31Å; A517-R521 PolarHBondContact O-N 2.9Å; E518-R521 CarbonylContact O-C 3.6Å; E518-R521 WeakPolarHBondContact O-CA 3.38Å; E518-R521 WeakPolarHBondContact O-CB 3.48Å; E518-R521 PolarHBondContact O-N 3.29Å; R519-R521 PolarHBondContact O-N 3.18Å; R521-G523 VanDerWaalsContact C-N 3.3Å; R521-G523 PolarHBondContact O-N 2.94Å; R521-R524 PolarHBondContact O-N 3.5Å; R521-R524 VanDerWaalsContact O-N 3.17Å; R521-E525 PolarHBondContact O-N 3.48Å
522Q94.2Very high94Very high84 Ų84108 Ų10839%0.39352%0.521SS..Hα-helixtrans-59-40.6178.4-65.7176.411.200111.6E518 R519 E525 Q526E518-Q522 WeakPolarHBondContact O-CG 3.32Å; E518-Q522 PolarHBondContact O-N 3.33Å; E518-Q522 PolarHBondContact OE1-NE2 2.87Å; E518-Q522 VanDerWaalsContact OE1-NE2 3.1Å; R519-Q522 PolarHBondContact O-N 3.46Å; Q522-E525 PolarHBondContact O-N 3.29Å; Q522-Q526 WeakPolarHBondContact O-CG 3.5Å; Q522-Q526 PolarHBondContact O-N 2.91Å
523G95.4Very high94.2Very high36 Ų36108.5 Ų108.537%0.37152%0.523SS..Hα-helixtrans-62.9-42.8174.600000113.6R519 R521 E525 Q527R519-G523 PolarHBondContact O-N 3.28Å; R521-G523 VanDerWaalsContact C-N 3.3Å; R521-G523 PolarHBondContact O-N 2.94Å; G523-E525 VanDerWaalsContact C-N 3.34Å; G523-Q527 WeakPolarHBondContact O-CB 3.19Å; G523-Q527 PolarHBondContact O-N 3.28Å
524R93.6Very high94.3Very high138 Ų138111 Ų11152%0.52152%0.524SS..Hα-helixtrans-63.8-39.4172.7-71.9177.6-177.8119.94112Q520 R521 Q527 T528Q520-R524 VanDerWaalsContact CD-NH2 3.31Å; Q520-R524 WeakPolarHBondContact O-CG 3.38Å; Q520-R524 PolarHBondContact O-N 2.85Å; R521-R524 PolarHBondContact O-N 3.5Å; R521-R524 VanDerWaalsContact O-N 3.17Å; R524-Q527 PolarHBondContact O-N 2.92Å; R524-T528 WeakPolarHBondContact O-CB 3.37Å; R524-T528 PolarHBondContact O-N 3.43Å; R524-T528 PolarHBondContact O-OG1 3.26Å
525E95Very high94.7Very high114 Ų114112.5 Ų112.553%0.53353%0.525SS..Hα-helixtrans-65.3-46.4178.6-167.9179.6162.400111.4R521 Q522 G523 Q527 T528 Q529R521-E525 PolarHBondContact O-N 3.48Å; Q522-E525 PolarHBondContact O-N 3.29Å; G523-E525 VanDerWaalsContact C-N 3.34Å; E525-Q527 PolarHBondContact O-N 3.41Å; E525-T528 WeakPolarHBondContact O-CB 3.39Å; E525-T528 PolarHBondContact O-N 2.86Å; E525-T528 VanDerWaalsContact O-N 3.15Å; E525-Q529 WeakPolarHBondContact O-CG 3.22Å; E525-Q529 PolarHBondContact O-N 3.46Å; E525-Q529 PolarHBondContact OE1-NE2 3.3Å
526Q96.2Very high94.8Very high112 Ų112112.6 Ų112.652%0.52353%0.526SS..Hα-helixtrans-60.4-42.9174.1-71.3174.726.400112.1Q522 T528 Q529 Q530Q522-Q526 WeakPolarHBondContact O-CG 3.5Å; Q522-Q526 PolarHBondContact O-N 2.91Å; Q526-T528 VanDerWaalsContact C-N 3.33Å; Q526-T528 PolarHBondContact O-N 2.9Å; Q526-Q529 PolarHBondContact O-N 2.94Å; Q526-Q530 WeakPolarHBondContact O-CG 3.42Å; Q526-Q530 PolarHBondContact O-N 3.09Å
527Q94.8Very high95Very high133 Ų133114.2 Ų114.262%0.62153%0.534SS*.Hα-helixtrans-61.1-41.2173.8-173.1178.76.800111.9G523 R524 E525 Q530 E531G523-Q527 WeakPolarHBondContact O-CB 3.19Å; G523-Q527 PolarHBondContact O-N 3.28Å; R524-Q527 PolarHBondContact O-N 2.92Å; E525-Q527 PolarHBondContact O-N 3.41Å; Q527-Q530 PolarHBondContact O-N 3.46Å; Q527-E531 PolarHBondContact O-N 2.93Å
528T94.7Very high95.1Very high87 Ų87119.6 Ų119.653%0.53454%0.544SS..Hα-helixtrans-65-39.9176.7-49.90000111.6R524 E525 Q526 E531 E532R524-T528 WeakPolarHBondContact O-CB 3.37Å; R524-T528 PolarHBondContact O-N 3.43Å; R524-T528 PolarHBondContact O-OG1 3.26Å; E525-T528 WeakPolarHBondContact O-CB 3.39Å; E525-T528 PolarHBondContact O-N 2.86Å; E525-T528 VanDerWaalsContact O-N 3.15Å; Q526-T528 VanDerWaalsContact C-N 3.33Å; Q526-T528 PolarHBondContact O-N 2.9Å; T528-E531 PolarHBondContact O-N 2.91Å; T528-E532 PolarHBondContact O-N 3.36Å
529Q96Very high95.2Very high104 Ų104121.2 Ų121.249%0.48655%0.549SS..Hα-helixtrans-64.8-42.6175.9-69.9172.313.300111.5E525 Q526 E532 E533E525-Q529 WeakPolarHBondContact O-CG 3.22Å; E525-Q529 PolarHBondContact O-N 3.46Å; E525-Q529 PolarHBondContact OE1-NE2 3.3Å; Q526-Q529 PolarHBondContact O-N 2.94Å; Q529-E532 PolarHBondContact O-N 2.93Å; Q529-E533 PolarHBondContact O-N 2.92Å
530Q95.9Very high95.3Very high135 Ų135120.1 Ų120.163%0.63155%0.548SS*.Hα-helixtrans-63.3-41.3174.2-72.7178.91.100112.4Q526 Q527 E532 E533 E534Q526-Q530 WeakPolarHBondContact O-CG 3.42Å; Q526-Q530 PolarHBondContact O-N 3.09Å; Q527-Q530 PolarHBondContact O-N 3.46Å; Q530-E532 VanDerWaalsContact C-N 3.34Å; Q530-E532 PolarHBondContact O-N 3.37Å; Q530-E533 PolarHBondContact O-N 3.34Å; Q530-E534 PolarHBondContact O-N 2.68Å
531E95.3Very high95.5Very high124 Ų124123.1 Ų123.158%0.57956%0.555SS**Hα-helixtrans-62.3-41.3173.8-168.1-170.6147.100111.1Q527 T528 E534 R535Q527-E531 PolarHBondContact O-N 2.93Å; T528-E531 PolarHBondContact O-N 2.91Å; E531-E534 PolarHBondContact O-N 3.47Å; E531-R535 WeakPolarHBondContact O-CB 3.47Å; E531-R535 PolarHBondContact O-N 2.89Å
532E95.1Very high95.5Very high118 Ų118119.3 Ų119.355%0.55155%0.546SS*.Hα-helixtrans-66.5-39.7176.4-173.3167.9-172.600112.4T528 Q529 Q530 R535 Q536T528-E532 PolarHBondContact O-N 3.36Å; Q529-E532 PolarHBondContact O-N 2.93Å; Q530-E532 VanDerWaalsContact C-N 3.34Å; Q530-E532 PolarHBondContact O-N 3.37Å; E532-R535 PolarHBondContact O-N 3.28Å; E532-Q536 WeakPolarHBondContact O-CG 3.38Å; E532-Q536 PolarHBondContact O-N 2.88Å
533E95.2Very high95.5Very high131 Ų131119.5 Ų119.561%0.61255%0.547SS*.Hα-helixtrans-63.4-44.7173.3-74-168.8167.700112.1Q529 Q530 R535 Q536 L537Q529-E533 PolarHBondContact O-N 2.92Å; Q530-E533 PolarHBondContact O-N 3.34Å; E533-R535 VanDerWaalsContact C-N 3.31Å; E533-R535 PolarHBondContact O-N 2.92Å; E533-Q536 PolarHBondContact O-N 3.47Å; E533-L537 WeakPolarHBondContact O-CG 3.37Å; E533-L537 PolarHBondContact O-N 3.45Å
534E95.9Very high95.4Very high117 Ų117124 Ų12455%0.54756%0.558SS.*Hα-helixtrans-60.9-42.6173.4-162.3-147.1120.800110.6Q530 E531 Q536 L537 R538Q530-E534 PolarHBondContact O-N 2.68Å; E531-E534 PolarHBondContact O-N 3.47Å; E534-Q536 VanDerWaalsContact C-N 3.29Å; E534-Q536 PolarHBondContact O-N 3.19Å; E534-L537 PolarHBondContact O-N 3.33Å; E534-L537 VanDerWaalsContact O-N 3.16Å; E534-R538 WeakPolarHBondContact O-CB 3.39Å; E534-R538 PolarHBondContact O-N 3.36Å
535R95.6Very high95.4Very high183 Ų183120.5 Ų120.569%0.69155%0.549SS*.Hα-helixtrans-63.3-34.7177.3-164.1171.8-166-104.83.2111.8E531 E532 E533 K539E531-R535 WeakPolarHBondContact O-CB 3.47Å; E531-R535 PolarHBondContact O-N 2.89Å; E532-R535 PolarHBondContact O-N 3.28Å; E533-R535 VanDerWaalsContact C-N 3.31Å; E533-R535 PolarHBondContact O-N 2.92Å; R535-K539 VanDerWaalsContact O-CB 3.24Å; R535-K539 WeakPolarHBondContact O-CB 3.45Å; R535-K539 PolarHBondContact O-N 2.98Å
536Q96.3Very high95.1Very high92 Ų92118.6 Ų118.643%0.4354%0.541SS..Hα-helixtrans-70.4-42.6171-73.8-173.342.500112.6E532 E533 E534 K539 K540E532-Q536 WeakPolarHBondContact O-CG 3.38Å; E532-Q536 PolarHBondContact O-N 2.88Å; E533-Q536 PolarHBondContact O-N 3.47Å; E534-Q536 VanDerWaalsContact C-N 3.29Å; E534-Q536 PolarHBondContact O-N 3.19Å; Q536-K539 PolarHBondContact O-N 2.94Å; Q536-K540 VanDerWaalsContact O-CG 3.29Å; Q536-K540 WeakPolarHBondContact O-CG 3.37Å; Q536-K540 PolarHBondContact O-N 3.3Å
537L96.4Very high95Very high112 Ų112119 Ų11959%0.58654%0.541SS*.Hα-helixtrans-64.2-43.8175.7-71.6170.6000111.4E533 E534 K540 R541E533-L537 WeakPolarHBondContact O-CG 3.37Å; E533-L537 PolarHBondContact O-N 3.45Å; E534-L537 PolarHBondContact O-N 3.33Å; E534-L537 VanDerWaalsContact O-N 3.16Å; L537-K540 PolarHBondContact O-N 2.86Å; L537-R541 WeakPolarHBondContact O-CB 3.38Å; L537-R541 PolarHBondContact O-N 2.61Å
538R95.5Very high94.7Very high162 Ų162120.5 Ų120.561%0.61154%0.541SS*.Hα-helixtrans-62-41.3173.4-173.3172.3176.9178-1.4111.4E534 R541 I542E534-R538 WeakPolarHBondContact O-CB 3.39Å; E534-R538 PolarHBondContact O-N 3.36Å; R538-R541 PolarHBondContact O-N 3.03Å; R538-I542 HydrophobicContact CG-CD1 4.07Å; R538-I542 WeakPolarHBondContact O-CB 3.28Å; R538-I542 WeakPolarHBondContact O-CD1 3.19Å; R538-I542 VanDerWaalsContact O-CG1 3.23Å; R538-I542 WeakPolarHBondContact O-CG1 3.42Å; R538-I542 PolarHBondContact O-N 2.84Å
539K96.8Very high94.1Very high143 Ų143120.3 Ų120.362%0.62254%0.54SS*.Hα-helixtrans-62-46.2172.1-176.8-176.7176.1-173.40111.9R535 Q536 I542 E543R535-K539 VanDerWaalsContact O-CB 3.24Å; R535-K539 WeakPolarHBondContact O-CB 3.45Å; R535-K539 PolarHBondContact O-N 2.98Å; Q536-K539 PolarHBondContact O-N 2.94Å; K539-I542 PolarHBondContact O-N 3.44Å; K539-E543 WeakPolarHBondContact O-CB 3.46Å; K539-E543 PolarHBondContact O-N 3.21Å
540K96.9Very high93.4Very high122 Ų122123.9 Ų123.953%0.5355%0.549SS..Hα-helixtrans-59.4-46.5176.2-72.8164.9-175.7169.70111.3Q536 L537 I542 E543 E544Q536-K540 VanDerWaalsContact O-CG 3.29Å; Q536-K540 WeakPolarHBondContact O-CG 3.37Å; Q536-K540 PolarHBondContact O-N 3.3Å; L537-K540 PolarHBondContact O-N 2.86Å; K540-I542 PolarHBondContact O-N 3.43Å; K540-E543 PolarHBondContact O-N 2.96Å; K540-E544 WeakPolarHBondContact O-CB 3.35Å; K540-E544 PolarHBondContact O-N 3.4Å
541R96.4Very high91.8Very high175 Ų175124 Ų12466%0.6655%0.547SS*.Hα-helixtrans-62.1-39.4176-170.6-178.8-178-161.51.2112.3L537 R538 I545L537-R541 WeakPolarHBondContact O-CB 3.38Å; L537-R541 PolarHBondContact O-N 2.61Å; R538-R541 PolarHBondContact O-N 3.03Å; R541-I545 HydrophobicContact CG-CD1 4.15Å; R541-I545 WeakPolarHBondContact O-CB 3.33Å; R541-I545 WeakPolarHBondContact O-CD1 3.48Å; R541-I545 WeakPolarHBondContact O-CG1 3.46Å; R541-I545 PolarHBondContact O-N 2.79Å
542I95.4Very high90Very high83 Ų83121.2 Ų121.243%0.42654%0.542SS..Hα-helixtrans-66.8-43.8173.9-71.4164.9000110.7R538 K539 K540 E544 I545 M546R538-I542 HydrophobicContact CG-CD1 4.07Å; R538-I542 WeakPolarHBondContact O-CB 3.28Å; R538-I542 WeakPolarHBondContact O-CD1 3.19Å; R538-I542 VanDerWaalsContact O-CG1 3.23Å; R538-I542 WeakPolarHBondContact O-CG1 3.42Å; R538-I542 PolarHBondContact O-N 2.84Å; K539-I542 PolarHBondContact O-N 3.44Å; K540-I542 PolarHBondContact O-N 3.43Å; I542-E544 VanDerWaalsContact C-N 3.34Å; I542-E544 PolarHBondContact O-N 3.19Å; I542-I545 PolarHBondContact O-N 3.06Å; I542-M546 HydrophobicContact CG2-CG 4.4Å; I542-M546 HydrophobicContact CG2-SD 3.79Å; I542-M546 WeakPolarHBondContact O-CB 3.45Å; I542-M546 VanDerWaalsContact O-CG 3.24Å; I542-M546 WeakPolarHBondContact O-CG 3.32Å; I542-M546 PolarHBondContact O-N 3Å
543E93.6Very high88.1Confident88 Ų88124 Ų12441%0.41156%0.555SS.*Hα-helixtrans-63.9-38.3177.3-167.1-172.5137.900112.1K539 K540 M546 K547K539-E543 WeakPolarHBondContact O-CB 3.46Å; K539-E543 PolarHBondContact O-N 3.21Å; K540-E543 PolarHBondContact O-N 2.96Å; E543-M546 PolarHBondContact O-N 2.82Å; E543-K547 HydrophobicContact CG-CD 4.36Å; E543-K547 WeakPolarHBondContact O-CB 3.42Å; E543-K547 VanDerWaalsContact O-CG 3.31Å; E543-K547 WeakPolarHBondContact O-CG 3.13Å; E543-K547 PolarHBondContact O-N 2.66Å; E543-K547 VanDerWaalsContact OE1-CE 3.29Å; E543-K547 WeakPolarHBondContact OE1-CE 3.39Å; E543-K547 IonicContact OE1-NZ 2.62Å; E543-K547 PolarHBondContact OE1-NZ 2.75Å
544E93.5Very high86.2Confident131 Ų131121.3 Ų121.361%0.61255%0.554SS**Hα-helixtrans-63.1-47.9171.7-179.1-175.2-165.100111.6K540 I542 M546 K547 R548K540-E544 WeakPolarHBondContact O-CB 3.35Å; K540-E544 PolarHBondContact O-N 3.4Å; I542-E544 VanDerWaalsContact C-N 3.34Å; I542-E544 PolarHBondContact O-N 3.19Å; E544-M546 VanDerWaalsContact C-N 3.28Å; E544-M546 PolarHBondContact O-N 3.04Å; E544-K547 PolarHBondContact O-N 3.06Å; E544-K547 VanDerWaalsContact O-N 3.1Å; E544-R548 PolarHBondContact O-N 3.1Å
545I92.4Very high84.1Confident64 Ų64120.7 Ų120.733%0.32856%0.555SS.*Hα-helixtrans-58.3-41.5174.4-72165.2000110.8R541 I542 R548 T549R541-I545 HydrophobicContact CG-CD1 4.15Å; R541-I545 WeakPolarHBondContact O-CB 3.33Å; R541-I545 WeakPolarHBondContact O-CD1 3.48Å; R541-I545 WeakPolarHBondContact O-CG1 3.46Å; R541-I545 PolarHBondContact O-N 2.79Å; I542-I545 PolarHBondContact O-N 3.06Å; I545-R548 WeakPolarHBondContact O-CG 3.17Å; I545-T549 WeakPolarHBondContact O-CG2 3.45Å; I545-T549 PolarHBondContact O-N 3.48Å; I545-T549 PolarHBondContact O-OG1 3.22Å
546M89.4Confident82Confident75 Ų75119.6 Ų119.637%0.36956%0.56SS.*Hα-helixtrans-70.5-31.9175.6-69.5171.170.800112.7I542 E543 E544 T549 R550I542-M546 HydrophobicContact CG2-CG 4.4Å; I542-M546 HydrophobicContact CG2-SD 3.79Å; I542-M546 WeakPolarHBondContact O-CB 3.45Å; I542-M546 VanDerWaalsContact O-CG 3.24Å; I542-M546 WeakPolarHBondContact O-CG 3.32Å; I542-M546 PolarHBondContact O-N 3Å; E543-M546 PolarHBondContact O-N 2.82Å; E544-M546 VanDerWaalsContact C-N 3.28Å; E544-M546 PolarHBondContact O-N 3.04Å; M546-T549 PolarHBondContact O-OG1 3.49Å; M546-R550 WeakPolarHBondContact O-CB 3.36Å; M546-R550 WeakPolarHBondContact O-CD 3.48Å; M546-R550 WeakPolarHBondContact O-CG 3.33Å; M546-R550 PolarHBondContact O-N 2.91Å
547K93.5Very high79.9Confident119 Ų119124.6 Ų124.652%0.51758%0.58SS.*Hα-helixtrans-71.2-43176.5-83.4168.8172169.80111.8E543 E544 R550 K551E543-K547 HydrophobicContact CG-CD 4.36Å; E543-K547 WeakPolarHBondContact O-CB 3.42Å; E543-K547 VanDerWaalsContact O-CG 3.31Å; E543-K547 WeakPolarHBondContact O-CG 3.13Å; E543-K547 PolarHBondContact O-N 2.66Å; E543-K547 VanDerWaalsContact OE1-CE 3.29Å; E543-K547 WeakPolarHBondContact OE1-CE 3.39Å; E543-K547 IonicContact OE1-NZ 2.62Å; E543-K547 PolarHBondContact OE1-NZ 2.75Å; E544-K547 PolarHBondContact O-N 3.06Å; E544-K547 VanDerWaalsContact O-N 3.1Å; K547-R550 PolarHBondContact O-N 3.19Å; K547-K551 WeakPolarHBondContact O-CB 3.43Å; K547-K551 WeakPolarHBondContact O-CG 3.2Å; K547-K551 PolarHBondContact O-N 3.42Å; K547-K551 VanDerWaalsContact O-N 3.08Å
548R88.8Confident77.7Confident166 Ų166128.6 Ų128.663%0.62659%0.592SS**Hα-helixtrans-65.1-42.1175.667.6-177.6-168.9175.38.2112E544 I545 K551 S552E544-R548 PolarHBondContact O-N 3.1Å; I545-R548 WeakPolarHBondContact O-CG 3.17Å; R548-K551 PolarHBondContact O-N 2.83Å; R548-S552 PolarHBondContact O-N 3.42Å; R548-S552 PolarHBondContact O-OG 3.02Å
549T82.8Confident75.1Confident83 Ų83130 Ų13051%0.50961%0.606SS.*Hα-helixtrans-76.8-19.2179.758.20000114.3I545 M546 S552I545-T549 WeakPolarHBondContact O-CG2 3.45Å; I545-T549 PolarHBondContact O-N 3.48Å; I545-T549 PolarHBondContact O-OG1 3.22Å; M546-T549 PolarHBondContact O-OG1 3.49Å; T549-S552 PolarHBondContact O-OG 3.36Å
550R81.2Confident72.8Confident178 Ų178131.7 Ų131.767%0.67262%0.616SS**Hα-helixtrans-85.7-21.9170.7-73.2171.1175-175.6-4.8113.8M546 K547M546-R550 WeakPolarHBondContact O-CB 3.36Å; M546-R550 WeakPolarHBondContact O-CD 3.48Å; M546-R550 WeakPolarHBondContact O-CG 3.33Å; M546-R550 PolarHBondContact O-N 2.91Å; K547-R550 PolarHBondContact O-N 3.19Å
551K62.4Low70.1Confident138 Ų138134.2 Ų134.260%0.663%0.63SS**Hα-helixtrans-81.1-34.7174.8-79.9-171.9168.5-157.60113K547 R548 E553 A554 D555K547-K551 WeakPolarHBondContact O-CB 3.43Å; K547-K551 WeakPolarHBondContact O-CG 3.2Å; K547-K551 PolarHBondContact O-N 3.42Å; K547-K551 VanDerWaalsContact O-N 3.08Å; R548-K551 PolarHBondContact O-N 2.83Å; K551-E553 PolarHBondContact O-N 3.19Å; K551-A554 PolarHBondContact O-N 3.46Å; K551-D555 PolarHBondContact O-N 2.9Å; K551-D555 VanDerWaalsContact O-N 3.15Å
552S57.3Low67.4Low66 Ų66131.5 Ų131.546%0.46263%0.632SS.*Hα-helixtrans-56.8-25.5-18045.30000114.3R548 T549 M556R548-S552 PolarHBondContact O-N 3.42Å; R548-S552 PolarHBondContact O-OG 3.02Å; T549-S552 PolarHBondContact O-OG 3.36Å; S552-M556 WeakPolarHBondContact O-CG 3.39Å
553E54.5Low64.7Low177 Ų177135.4 Ų135.483%0.82765%0.649SS**Hα-helixtrans-79.7-20.8175.8-165.9170.9-153.600113.4K551K551-E553 PolarHBondContact O-N 3.19Å
554A54.7Low61.8Low73 Ų73137.4 Ų137.460%0.60367%0.667SS**Hα-helixtrans-91.6-37.7179.900000113.1K551K551-A554 PolarHBondContact O-N 3.46Å
555D52.1Low59.7Low105 Ų105139 Ų13956%0.56168%0.679SS**Hα-helixtrans-86.3-14.3-171.6-63.5-42.8000113.6K551 K557 K558K551-D555 PolarHBondContact O-N 2.9Å; K551-D555 VanDerWaalsContact O-N 3.15Å; D555-K557 PolarHBondContact O-N 3.46Å; D555-K558 PolarHBondContact O-N 3.43Å
556M52.3Low58.2Low160 Ų160141.4 Ų141.479%0.78870%0.699SS**THydrogen-bonded Turntrans-65.320.1177.3-77.2-98.560.400115.6S552S552-M556 WeakPolarHBondContact O-CG 3.39Å
557K52.3Low55.2Low196 Ų196144.1 Ų144.185%0.85272%0.719SS**THydrogen-bonded Turntrans-131.911.7179.1-76-166.7173.2-175.30114.8D555D555-K557 PolarHBondContact O-N 3.46Å
558K49.1Very low53Low196 Ų196143.5 Ų143.585%0.85273%0.73SS**SBendtrans-134.3-9.7-171.4-78.2-161.1171.2-169.40119.1D555D555-K558 PolarHBondContact O-N 3.43Å
559E42.4Very low51.8Low192 Ų192141.4 Ų141.490%0.89774%0.738SS**  trans-128.650.8-168.9-145155.7-146.400113.8
560E47.6Very low50.5Low179 Ų179143 Ų14384%0.83675%0.75SS**  trans-97.781.3159.8-173.5-173.3171.600109.6
561Q40.2Very low48.2Very low175 Ų175137.8 Ų137.882%0.81875%0.752SS**  trans-173.1131.5153-108.5147.5105.700114
562V40.1Very low47.2Very low117 Ų117138.3 Ų138.371%0.70976%0.761SS**  trans39.499.8134.4-174.10000116.7
563Q38.8Very low46.3Very low165 Ų165140.7 Ų140.777%0.77177%0.773SS**  81.6143.567.5-166.7-166.25.600114.3
564T32.6Very low45.7Very low131 Ų131138.6 Ų138.680%0.80477%0.766SS**  trans89.8139.6170.974.70000120.9
565L48.7Very low45Very low164 Ų164141.6 Ų141.686%0.85978%0.776SS**  trans-92-166.4169.1-62.5152.7000108.8
566P61.3Low44.5Very low114 Ų114145.8 Ų145.874%0.7479%0.79SS**  cis-130.4-164.6-16.728.3-4.9000113.1
567V26.6Very low44.1Very low132 Ų132142.1 Ų142.180%0.879%0.785SS**  151.2140.7129.5164.70000114.3
568S47.3Very low43.5Very low107 Ų107140.5 Ų140.575%0.74878%0.78SS**  trans-141.9-173.7172.3-470000108.4
569P64.2Low42.8Very low121 Ų121137.2 Ų137.279%0.78678%0.776SS**  cis-116.2-100.8-10.921.95.4000110.5
570P54.7Low42.6Very low117 Ų117134 Ų13476%0.7676%0.764SS**  cis-131.1162.5-40.739.4-22.6000117.4
571G32.6Very low42.4Very low69 Ų69133.5 Ų133.571%0.71176%0.759SS**  trans90.1140.5151.100000118.9
572D41Very low42.4Very low148 Ų148132.8 Ų132.879%0.79176%0.756SS**  cis-157.7-154.3-20.3-138.8-130.7000108.1
573V39.9Very low42.4Very low117 Ų117131.2 Ų131.271%0.70976%0.755SS**  cis-152.1172.314.7790000113.2
574I41.8Very low42.4Very low133 Ų133127.7 Ų127.768%0.68275%0.749SS**  trans-52.1138.5-176.9-64.9155.3000116.1
575T38.6Very low42.9Very low135 Ų135130.3 Ų130.383%0.82875%0.749SS**  trans-152.8-177.4150.6-200000112
576K42.7Very low42.3Very low193 Ų193131 Ų13184%0.83975%0.745SS**  trans-153.1158.6-168.4-72.6178-178.1174.40109.4
577A43.8Very low41Very low84 Ų84130.6 Ų130.669%0.69474%0.74SS**  cis-170164.8-17.600000112.6
578H40.4Very low41.3Very low161 Ų161131.7 Ų131.775%0.74574%0.736SS**  trans76.8127.3145.9-103.986.6000125.3
579V32.7Very low40.5Very low127 Ų127134 Ų13477%0.7773%0.733SS**  trans149.693.1140.3163.70000107.6
580I38.1Very low38.9Very low126 Ų126135 Ų13565%0.64673%0.727SS**  64.4126.183.7-63.6172.9000113.3
581K44.1Very low37.9Very low168 Ų168135.4 Ų135.473%0.7373%0.727SS**  cis-168.3140-34.4-117.5-172.3179.6-173.30107.5
582Q40.7Very low37.7Very low160 Ų160139.5 Ų139.575%0.74873%0.726SS**  55.9148.4107.8-66.3178-19.900116.9
583A40.9Very low37.3Very low83 Ų83139.2 Ų139.269%0.68672%0.72SS**  cis-150.4152.119.500000111.2
584S36.9Very low36.9Very low92 Ų92141.1 Ų141.164%0.64372%0.721SS**  67.8145.677.4-60.40000115.5
585K43.2Very low36.4Very low186 Ų186140.8 Ų140.881%0.80972%0.719SS**  cis-171.1164.81.3-114.2166.9-164.7176.10111.2
586K36.8Very low36Very low178 Ų178142 Ų14277%0.77472%0.717SS**  trans67.3146.4154.3-96.9-162.9157.7-148.40117.9
587V34.5Very low35.7Very low105 Ų105137.7 Ų137.764%0.63671%0.707SS**  cis77.6114.614.7-170.90000112.7
588E33.1Very low35.2Very low156 Ų156142.1 Ų142.173%0.72971%0.713SS**  cis-168.3-174.142.5-144165148.800113.8
589F30.9Very low34.6Very low155 Ų155141 Ų14168%0.6872%0.717SS**  trans90.8101.5146-113.8-119000123.3
590Q30.5Very low34.6Very low142 Ų142141.2 Ų141.266%0.66471%0.71SS**  73.2101.4111.6-160.9165.5107.400123.7
591V31.9Very low34.2Very low125 Ų125141.7 Ų141.776%0.75872%0.719SS**  81.2134.7129.5168.80000123.5
592K29.6Very low33.8Very low156 Ų156140.6 Ų140.668%0.67871%0.714SS**  trans81141157.2-98.5167.7159.4-84.50120.9
593E31.6Very low33.5Very low142 Ų142141.4 Ų141.466%0.66472%0.718SS**  trans39.3147.7148.3-69.7148.7161.800121.1
594E33.2Very low32.9Very low156 Ų156142.4 Ų142.473%0.72972%0.72SS**  cis-170.6175.3-30.3-143.8-169.4155.700107.1
595I30.2Very low32.6Very low126 Ų126143.5 Ų143.565%0.64672%0.722SS**  trans66101.2152.8-64.7164.1000119.4
596M30.7Very low32Very low162 Ų162140.7 Ų140.780%0.79872%0.721SS**  64.1124126.7-7217344.200125.4
597V36.1Very low31.6Very low102 Ų102139.5 Ų139.562%0.61872%0.722SS**  98.4126.2116.5162.30000123.3
598Q33.3Very low31.5Very low177 Ų177143.4 Ų143.483%0.82773%0.731SS**  trans62.1164.4159-74.3166.947.800116.7
599V28Very low31.5Very low136 Ų136144 Ų14482%0.82473%0.731SS**  cis-141.4168.828.7173.80000112.1
600E32.7Very low31.4Very low133 Ų133144 Ų14462%0.62173%0.733SS**  trans-97.5151.2-178.4174.5-168.2-164.900113.7K602E600-K602 VanDerWaalsContact CD-NZ 3.34Å; E600-K602 WeakPolarHBondContact OE1-CE 3.39Å; E600-K602 IonicContact OE1-NZ 3.26Å; E600-K602 PolarHBondContact OE1-NZ 2.89Å
601T29Very low31.2Very low136 Ų136141.7 Ų141.783%0.83474%0.738SS**  trans-179.4179.5142.723.20000113.7
602K37.2Very low30.9Very low145 Ų145140.5 Ų140.563%0.6374%0.742SS**  trans-137.8176.6-161.5-45.698.1-176.4-177.70111.6E600E600-K602 VanDerWaalsContact CD-NZ 3.34Å; E600-K602 WeakPolarHBondContact OE1-CE 3.39Å; E600-K602 IonicContact OE1-NZ 3.26Å; E600-K602 PolarHBondContact OE1-NZ 2.89Å
603E32.3Very low30.6Very low176 Ų176137.7 Ų137.782%0.82275%0.747SS**  cis-131.6-113.512.6-60.8-177.8173.200114.2
604S30Very low30.5Very low104 Ų104135.6 Ų135.673%0.72776%0.755SS**  cis-157.1145.68.156.60000117.3
605V29.7Very low30.1Very low115 Ų115132.9 Ų132.970%0.69776%0.759SS**  trans50.490.5144.1-171.30000122.6
606T30Very low29.8Very low127 Ų127131.9 Ų131.978%0.77977%0.769SS**  40.2140.5129.772.10000125.4
607L29.6Very low29.5Very low153 Ų153128.4 Ų128.480%0.80177%0.766SS**  -152.6120.8126.6-112.7179.5000112.6
608K32.1Very low29Very low188 Ų188128.1 Ų128.182%0.81777%0.774SS**SBendtrans52.6134.4164.7-65.7173.5-177.1177.90120.2
609K33.8Very low28.8Very low167 Ų167124.2 Ų124.273%0.72677%0.773SS**  cis-164.4124-30.1-127.6-176.1-176.1-80.40107.8
610E27.4Very low28.8Very low155 Ų155126.2 Ų126.272%0.72477%0.773SS**  35.4141.9126-63.4-179.8120.100120.7
611A26.3Very low28.7Very low94 Ų94126.8 Ų126.878%0.77778%0.777SS**  cis-165176.1-8.200000107.7
612A25.9Very low28.6Very low101 Ų101126.6 Ų126.684%0.83577%0.771SS**  cis-142.9171.64.100000110.1
613A24.6Very low28.2Very low96 Ų96125.5 Ų125.579%0.79378%0.782SS**  trans-98.3144.8175.400000112.6
614A28Very low28.1Very low99 Ų99123 Ų12382%0.81877%0.774SS**  trans37.7144.6145.700000123
615A24.6Very low28.1Very low99 Ų99126 Ų12682%0.81877%0.774SS**  trans89152.5160.300000118.1
616A24.6Very low28.3Very low104 Ų104126 Ų12686%0.8678%0.779SS**  trans61.7154.4-173.800000115.7
617A24.1Very low28.5Very low89 Ų89128.6 Ų128.674%0.73678%0.78SS**  cis-161.5165.2-31.100000108.9
618A25.4Very low28.4Very low96 Ų96129.3 Ų129.379%0.79378%0.779SS**  trans36.9118.9151.800000121.3
619A28.8Very low28.4Very low96 Ų96127.2 Ų127.279%0.79378%0.782SS**  trans88.6151.6132.600000121.8
620Q28.8Very low28.4Very low177 Ų177127.6 Ų127.683%0.82779%0.786SS**  trans76.2107.1157.2-74.9-177.3-26.700122
621M30.2Very low28.4Very low145 Ų145127 Ų12771%0.71479%0.788SS**  80.8146.3122.4-59-103.849.700119.6
622D28.2Very low28.5Very low133 Ų133129.7 Ų129.771%0.71179%0.789SS**  trans23128.1157.3-59-24.8000118.7
623S28.5Very low28.5Very low121 Ų121130.3 Ų130.385%0.84678%0.782SS**  -167.1163.563.729.30000115.6
624D29.9Very low28.9Very low123 Ų123134 Ų13466%0.65878%0.783SS**  trans-64.9166.2170.8-159.96.1000113.2
625K30.5Very low30.2Very low167 Ų167134.5 Ų134.573%0.72678%0.778SS**  trans70.2114.5162.2-69149.8-178.6118.30121.4
626S33.3Very low30.3Very low115 Ų115136 Ų13680%0.80478%0.777SS**  66.7132.3115.4-155.30000121.6Q628S626-Q628 PolarHBondContact O-N 3.29Å
627K34.1Very low30.5Very low182 Ų182136.2 Ų136.279%0.79177%0.767SS**  trans-49.4131.5151.8-57.7172.3-174.7179.10108.6
628Q26.7Very low30.8Very low168 Ų168140.6 Ų140.679%0.78577%0.773SS**  61.288.162.8-166.3-16637.400113.3S626S626-Q628 PolarHBondContact O-N 3.29Å
629V32.8Very low31Very low145 Ų145139.9 Ų139.988%0.87977%0.767SS**  trans-135.7157.1138-178.70000106.6
630Q33.9Very low31.1Very low175 Ų175143 Ų14382%0.81877%0.769SS**  trans-89.4167.5-159.8-66.6160.9-49.200115.3
631N26.3Very low31Very low143 Ų143139.1 Ų139.177%0.76576%0.762SS**  trans-62.8152.3176.9-52.1-48.6000113.3
632N29.1Very low31.2Very low150 Ų150138.5 Ų138.580%0.80277%0.766SS**  179.5148.1100.5-89.7-40.2000114.5
633T25.9Very low32.9Very low113 Ų113137.4 Ų137.469%0.69377%0.766SS**  trans66.893.5153.4-48.40000120.7
634H32.4Very low32.8Very low173 Ų173138.5 Ų138.580%0.80176%0.758SS**  38.5159.7114.4-56.2-55.6000122.9
635P56.5Low32.9Very low110 Ų110140.2 Ų140.271%0.71476%0.759SS**  cis-139.4-151.5-29.134.9-12000112.7
636V26.6Very low32.9Very low131 Ų131143.4 Ų143.479%0.79477%0.767SS**  trans75.6136.8156.9160.50000116.4
637T27.7Very low34.1Very low108 Ų108142.6 Ų142.666%0.66376%0.759SS**  cis-164.7170-7-990000111.7
638Q31.9Very low34Very low181 Ų181140.7 Ų140.785%0.84675%0.753SS**  trans-12.3160.3161-61.9164.1-0.200120.3
639A29.2Very low34.5Very low82 Ų82140 Ų14068%0.67875%0.747SS**  cis-177.5-177.2-16.900000110.9
640L30.1Very low34.8Very low160 Ų160140.9 Ų140.984%0.83874%0.739SS**  trans74.3117.7152.4-75.4162.6000123.3
641S26.8Very low34.9Very low96 Ų96138.8 Ų138.867%0.67173%0.729SS**  trans49.7108.5137.259.70000124.5
642V34.8Very low35.3Very low132 Ų132136.7 Ų136.780%0.872%0.722SS**  29.914396.3-1750000118.2
643P64.4Low35.7Very low110 Ų110134 Ų13471%0.71472%0.715SS**  cis-134.8-176-9.132.3-9.8000116
644E26.7Very low36.4Very low144 Ų144136.6 Ų136.667%0.67372%0.716SS**  153149.1128-80.9-106.786.600118
645K31.2Very low36.5Very low159 Ų159134.7 Ų134.769%0.69171%0.708SS**  trans4.4132.4159.9-64.2161.5-173.5133.20123.7
646R31.5Very low35.4Very low235 Ų235135.1 Ų135.189%0.88770%0.704SS**  36.3164.2102.4-104.9-169.7169.4171.1-1120.2
647P57.3Low35.7Very low97 Ų97134.6 Ų134.663%0.6371%0.705SS**  cis-141.6-159.7-6.127.10.6000114.8
648E31.7Very low35.9Very low143 Ų143132.7 Ų132.767%0.66871%0.707SS**  trans80.9150.6154.3-50.1-138.5123.900118.3
649K38.6Very low36.2Very low152 Ų152129.6 Ų129.666%0.66171%0.705SS**  cis-153.3172.8-11.7-115.8168.1-178.3141.20105.3
650K38.6Very low36.6Very low164 Ų164133.6 Ų133.671%0.71371%0.71SS**  cis-156.8177.19.1-132.9-171.5-177.6-160.70104.3
651Q36.6Very low36.8Very low132 Ų132132.4 Ų132.462%0.61770%0.703SS**  cis-163.2177-3.1-149-175.3-108.200104.2
652T33.9Very low37.1Very low99 Ų99132.3 Ų132.361%0.60770%0.702SS**  cis-159.3172.310-30.10000109.1
653S37.9Very low37.2Very low94 Ų94134.4 Ų134.466%0.65770%0.7SS**  trans10.7144.2145.5610000121.8
654K39.3Very low35.6Very low166 Ų166135.9 Ų135.972%0.72270%0.698SS**  cis-177.5179.24.4-109.9-163.2176.4-70.60106.5
655E34.3Very low35.7Very low134 Ų134133.1 Ų133.163%0.62670%0.7SS**  cis176.5168-36.2-117-179.9-114.800107.4
656N35Very low35.7Very low119 Ų119131.2 Ų131.264%0.63671%0.706SS**  cis-158.9165.7-8.1-148.9-27.4000109.8
657C32.6Very low35.4Very low120 Ų120124.4 Ų124.481%0.81170%0.701SS**  trans61.5153.9166.5-59.70000119.2
658G31.4Very low34Very low67 Ų67124.2 Ų124.269%0.69170%0.702SS**  cis163158.5-9.500000113.5
659S38.8Very low33.9Very low117 Ų117123.4 Ų123.482%0.81871%0.706SS**  trans70.5147.5171.1-71.30000118.1
660Q36.6Very low33.4Very low166 Ų166122.2 Ų122.278%0.77671%0.707SS**  cis-169.1146.5-14.9-129.6-179.70.700107.7
661I35.3Very low33Very low134 Ų134122.8 Ų122.869%0.68771%0.709SS**  166.8150.183.1-103145.7000109.4
662S32.2Very low33.1Very low94 Ų94124.4 Ų124.466%0.65772%0.717SS**  trans48.6126.7166.957.80000120.9
663K38Very low32.9Very low176 Ų176128.4 Ų128.477%0.76573%0.728SS**  69.613857.9-68.7166153.5-107.30113.1
664E29.1Very low32.5Very low142 Ų142127 Ų12766%0.66473%0.729SS**  cis-146.4147.46.3-114.3140.3-14400109.2
665A29Very low32.3Very low86 Ų86129.2 Ų129.271%0.71173%0.733SS**  58.3134.496.400000114.9
666S31.1Very low32.2Very low118 Ų118130.1 Ų130.183%0.82574%0.737SS**  cis-152171.817.8-67.10000113.7
667A26.7Very low32Very low93 Ų93132.6 Ų132.677%0.76975%0.747SS**  trans-58.7173.5157.100000111.7
668S28.2Very low32.1Very low93 Ų93135 Ų13565%0.6575%0.746SS**  175.1165.154.6-173.10000112.4
669T27.9Very low32.3Very low126 Ų126139.3 Ų139.377%0.77375%0.753SS**  trans63.8156150.742.50000119.1
670L29.3Very low31.9Very low127 Ų127141.1 Ų141.167%0.66575%0.753SS**  cis-174.9120.8-19.4170.376.3000111
671K30.2Very low31.7Very low175 Ų175140.6 Ų140.676%0.76176%0.755SS**  trans59.7167.4167.8-61.9168.3-178.8173.20113.9
672Q37.7Very low31.3Very low167 Ų167141.2 Ų141.278%0.7876%0.759SS**  cis-144.7161.3-6.3-139.2161.8-24.400104.3
673Q30.2Very low31.2Very low182 Ų182141.2 Ų141.285%0.8576%0.755SS**  cis176.5152.739.5-178.1174.69.200107.7
674G30.5Very low31Very low65 Ų65139.9 Ų139.967%0.6775%0.752SS**  trans130.898.9157.700000119.3
675R34.5Very low31Very low213 Ų213140.5 Ų140.580%0.80475%0.754SS**  trans34.9116.1135.1-58.8-179.1-162.9-89.46.4118.6
676E32.2Very low31Very low153 Ų153146.3 Ų146.372%0.71576%0.758SS**  68.8140.583.4-67.6161.5-169.800113.5
677M30.9Very low31.1Very low170 Ų170145.7 Ų145.784%0.83775%0.754SS**  cis-152.5179.211.4-146.8172.2-7400111.6
678E33.6Very low31.3Very low172 Ų172148.2 Ų148.280%0.80475%0.752SS**  trans-90.5161.8-175.4-71.2-170.6109.400116.8
679L37.2Very low31.3Very low157 Ų157149.6 Ų149.682%0.82276%0.757SS**  trans3.6139.2145.1-50.2172.9000119.5
680N30.5Very low31.5Very low155 Ų155151.9 Ų151.983%0.82976%0.756SS**  178.7179.399.4-150.3-12.5000112.7
681L30.8Very low31.6Very low154 Ų154153.5 Ų153.581%0.80676%0.764SS**  trans-88176.1178.4-87.970.8000114.2
682N26.8Very low31.6Very low148 Ų148150.1 Ų150.179%0.79176%0.758SS**  trans83.2148.2160.7-124.98.8000115.1
683T31.2Very low31.2Very low93 Ų93147.9 Ų147.957%0.57176%0.756SS**  cis-153.2154.511.2-33.50000112
684H32.9Very low31.1Very low148 Ų148147.2 Ų147.269%0.68575%0.753SS**  trans66.8125.7141.5-916.9000123.9
685H29.6Very low31Very low155 Ų155149.3 Ų149.372%0.71875%0.752SS**  55.5156.3123.6-68-23.3000122.3
686R30.3Very low30.7Very low208 Ų208146.6 Ų146.679%0.78575%0.748SS**  cis162.883.5-16.6172.5-134.4177.5-177.8-1.4106.7
687S32.4Very low30.7Very low106 Ų106144.1 Ų144.174%0.74174%0.744SS**  trans-166.9115.8159.347.60000107.4
688I31.2Very low30.6Very low145 Ų145144.1 Ų144.174%0.74474%0.742SS**  52.39768.9-51.2173.6000111.2
689V28.5Very low30.6Very low122 Ų122141.6 Ų141.674%0.73974%0.743SS**  -167.4127.9121.8142.30000110.6
690K30.7Very low30.4Very low174 Ų174139.2 Ų139.276%0.75774%0.735SS**  trans9.3130.7149.6-43.6167.4-172.41740119.2
691I32.6Very low30.5Very low161 Ų161139.5 Ų139.583%0.82673%0.732SS**  176.5109.3120.3-87.6152.3000104.4
692T29.6Very low30.9Very low105 Ų105138 Ų13864%0.64472%0.724SS**  74.7106.857.3-54.30000112.4
693T28.4Very low31Very low119 Ų119137.3 Ų137.373%0.7373%0.725SS**  trans62.9161.6168.3540000115.9
694Q28.6Very low31.1Very low169 Ų169135.9 Ų135.979%0.7973%0.729SS**  cis-146.5-180-0.2-137.3163.256.400111.3
695V28.3Very low31Very low109 Ų109133.5 Ų133.566%0.66174%0.735SS**  trans-58.5146.7167.2-82.50000113
696H29.1Very low31.4Very low155 Ų155130.4 Ų130.472%0.71874%0.736SS**  172.6111.4116.5-97.7-73.2000110.1
697T31.7Very low31.7Very low102 Ų102129.8 Ų129.863%0.62674%0.739SS**  64.4121.2100.861.30000116.8
698E28.2Very low31.8Very low169 Ų169129 Ų12979%0.7974%0.739SS**  trans62.2100.9138.2-61.9174174.300120.1
699S33.9Very low32Very low119 Ų119127.9 Ų127.983%0.83274%0.739SS**  -157.4130.3113.5-76.40000108.5
700T32.2Very low32.3Very low107 Ų107130.2 Ų130.266%0.65674%0.742SS**  cis93.111340.1-62.30000111.4
701E34Very low32.6Very low162 Ų162131.4 Ų131.476%0.75774%0.741SS**  trans68.5159.2157.6-74.5-165.1133.800119.4
702L39.2Very low32.5Very low122 Ų122131.5 Ų131.564%0.63974%0.739SS**  cis-148.2129.5-9-105.9154.3000105.7
703T29.2Very low32.5Very low133 Ų133129.6 Ų129.682%0.81674%0.74SS**  78.3142.394.5-73.40000117.6
704G31.5Very low32.7Very low63 Ų63129.7 Ų129.765%0.64975%0.745SS**  trans120.499.6178.800000111.4
705A31.8Very low33.1Very low99 Ų99127.6 Ų127.682%0.81874%0.744SS**  cis58125.925.500000112.1
706A37.3Very low33.5Very low89 Ų89129.6 Ų129.674%0.73675%0.747SS**  cis-157.7-155.48.800000108.9
707K37.6Very low33.8Very low195 Ų195129.2 Ų129.285%0.84875%0.751SS**  cis-170.1149.97.6-145.8164.3-172.2175.90110.1
708A35.1Very low33.9Very low89 Ų89128 Ų12874%0.73676%0.758SS**  trans59.8172155.800000116.7
709T35Very low34.2Very low122 Ų122124.5 Ų124.575%0.74876%0.759SS**  cis-152.7172.15.2-14.90000107.3
710Q33.5Very low34.3Very low172 Ų172125.1 Ų125.180%0.80476%0.757SS**  cis-136.6-1087.4-175.8131.4-102.700112.4
711R36.9Very low34.6Very low198 Ų198129.9 Ų129.975%0.74777%0.769SS**  trans-163.4149.1-161.2-90.6176.5165.6-117.45113.2
712Q31.6Very low34.6Very low164 Ų164125.9 Ų125.977%0.76677%0.771SS**  trans59.9141.1143.6-64.4171-85.400120.2
713G30.5Very low34.5Very low65 Ų65130 Ų13067%0.6779%0.787SS**  cis171.1178.1-5.200000113
714S30.9Very low34.7Very low121 Ų121127 Ų12785%0.84678%0.783SS**  trans70.2154.5177.4-61.60000115.2
715V36.9Very low34.8Very low124 Ų124129.7 Ų129.775%0.75279%0.792SS**  cis-162.4167.1-17.3-95.60000106.4
716M36.9Very low34.8Very low151 Ų151129.8 Ų129.874%0.74479%0.792SS**  cis-158.6163.40.3-129.5177.2-170.400110.2
717N35.7Very low34.6Very low147 Ų147133.6 Ų133.679%0.78680%0.799SS**  trans54.9140.9150.2-60.3-18.4000122.3
718G33.5Very low34.3Very low76 Ų76134.4 Ų134.478%0.78480%0.803SS**  trans95.991.7166.100000114.6
719A35.3Very low34Very low97 Ų97135.7 Ų135.780%0.80281%0.805SS**  cis102.3140.230.800000114.3
720V36.6Very low33.8Very low132 Ų132135.2 Ų135.280%0.881%0.807SS**  trans86.295169.3-167.40000119
721K36.8Very low33.5Very low206 Ų206135.1 Ų135.190%0.89681%0.806SS**  trans39.2138.5133.3-59.9-176.6176.3-177.10121.9
722G35Very low33.9Very low79 Ų79130.9 Ų130.981%0.81480%0.804SS**  trans-169.36.4162.100000120.3
723E37.4Very low33.7Very low208 Ų208128.9 Ų128.997%0.97280%0.803SS**  trans-97.4143.4-173.4-67.8-154.2157.800116.2
724G32Very low33.6Very low70 Ų70130.5 Ų130.572%0.72281%0.805SS**  trans-170.889169.200000108.3
725S34.6Very low33.4Very low119 Ų119134.5 Ų134.583%0.83281%0.81SS**  72.7114.878.8-170.20000112.8
726A31.5Very low33Very low101 Ų101132 Ų13284%0.83581%0.809SS**  trans-111.5135-179.400000110.8
727L33.9Very low32.8Very low169 Ų169129.2 Ų129.289%0.88581%0.805SS**  trans-90.2129.2-179.2-65.7172.5000112
728K30.9Very low32.7Very low213 Ų213130.8 Ų130.893%0.92680%0.804SS**  trans-137.4146.9154.6-76-167.6175.5-178.50109.4
729C28.8Very low32.6Very low116 Ų116134.9 Ų134.978%0.78480%0.803SS**  trans-119.9134.4-176.4-179.90000110
730S30.1Very low32.7Very low112 Ų112138.6 Ų138.678%0.78380%0.804SS**  trans-162.8120.7167.753.50000111.4
731H28.7Very low32.6Very low170 Ų170137.3 Ų137.379%0.78780%0.801SS**  trans-69.5162157-63.9-78.1000108.9
732P43.7Very low32.3Very low109 Ų109134.8 Ų134.871%0.70880%0.797SS**  -155.2-18052.539.8-15.5000120.1
733T27.4Very low32.2Very low121 Ų121134.9 Ų134.974%0.74279%0.79SS**  trans65.2112.8145.841.40000124.1
734S29.6Very low32Very low100 Ų100130.1 Ų130.170%0.69978%0.78SS**  56127.5125.266.60000124.3
735E26.9Very low31.9Very low204 Ų204134.6 Ų134.695%0.95379%0.785SS**  trans60146.6145.9-59.9-172.9173.700120.2
736G27.7Very low31.8Very low71 Ų71134.3 Ų134.373%0.73278%0.783SS**  cis175.1147.2-9.700000115.6
737S32.6Very low31.9Very low94 Ų94133.1 Ų133.166%0.65777%0.774SS**  trans64106.2149.7-176.70000123.5
738K33.5Very low31.6Very low179 Ų179133.8 Ų133.878%0.77877%0.773SS**  trans72.7161.7140.3-59.3167.7-160.7162.10116.5
739Q32.6Very low31.6Very low162 Ų162130 Ų13076%0.75776%0.758SS**  cis-150.6131.624.6-153.9149.6-61.200110.3
740Q36.6Very low31.9Very low175 Ų175132.9 Ų132.982%0.81876%0.757SS**  39.4144.7106.6-67.7179.3-43.100117.6
741S35.5Very low32.1Very low105 Ų105131.4 Ų131.473%0.73475%0.752SS**  cis-126.5-131.219.656.90000113.6
742N28.5Very low32.6Very low154 Ų154132.9 Ų132.982%0.82476%0.756SS**  cis-152.5-168.29.4-154.5-7.6000112.6
743A32.8Very low32.1Very low80 Ų80138 Ų13866%0.66177%0.767SS**  trans-90.1-177.7-173.600000114.8
744S35.1Very low32.3Very low109 Ų109135.8 Ų135.876%0.76277%0.768SS**  cis-147.2-175.114.5-44.90000110.3
745I29.9Very low33.1Very low163 Ų163136.6 Ų136.684%0.83677%0.771SS**  cis-163.2158.149.9-62.3167.2000111.3
746S31.4Very low33.2Very low113 Ų113132.9 Ų132.979%0.7976%0.763SS**  trans-37.2173.3160.7-72.40000120.8
747A32.8Very low33.5Very low77 Ų77137.2 Ų137.264%0.63677%0.769SS**  cis-174.9173.5-17.300000112.9
748E28.6Very low33.6Very low183 Ų183136 Ų13686%0.85577%0.771SS**  trans57.6169151.8-72.7169.1154.900122.1
749E31.1Very low33.8Very low132 Ų132135 Ų13562%0.61778%0.78SS**  -160.3139.3-56.9-149.7-148.5103.300112.2
750K34.8Very low33.9Very low177 Ų177130.6 Ų130.677%0.7778%0.777SS**  trans48.4157.9156.7-79.2-166.1-156.7108.10121.6
751A35.1Very low33.8Very low81 Ų81134.1 Ų134.167%0.66978%0.783SS**  cis-169173.2-12.700000113.7
752K37.7Very low33.7Very low201 Ų201134.6 Ų134.687%0.87479%0.786SS**  trans85.5123.3152.9-86.9178.2177173.10122.1
753K34.6Very low33.8Very low216 Ų216132 Ų13294%0.93978%0.78SS**  trans44.8109.6152.3-77.2-164.4171.6-169.40119.8
754G30.5Very low33.7Very low75 Ų75135.9 Ų135.977%0.77379%0.789SS**  trans-168.4155.2158.700000111.1
755P47.2Very low33.5Very low117 Ų117136.1 Ų136.176%0.7679%0.786SS**  trans-123.8170.8-169.340.4-26.3000116.9
756V29.5Very low33.6Very low127 Ų127135.9 Ų135.977%0.7778%0.783SS**  trans68.2148.9160.6-68.80000122.4
757D33.8Very low33.6Very low162 Ų162136.1 Ų136.187%0.86678%0.78SS**  trans67.5132.6162.3-59.9-19.3000123.3
758G34.3Very low35.1Very low69 Ų69138 Ų13871%0.71179%0.786SS**  12256.3125.700000122
759V37.7Very low35.1Very low158 Ų158137.2 Ų137.296%0.95879%0.786SS**  trans54.2119.2147.3-176.40000120.3
760G33.5Very low35.1Very low68 Ų68136.2 Ų136.270%0.70179%0.789SS**  trans127.691.6134.200000120.9
761R35.6Very low35Very low250 Ų250136 Ų13694%0.94379%0.79SS**  trans43.4143.5145.7-82.4-176.8170.3-166.7-3.5120.9
762S32.5Very low34.9Very low114 Ų114140.3 Ų140.380%0.79780%0.801SS**  cis-160.9153.82.8-174.80000109.2
763S31.2Very low34.6Very low100 Ų100135.3 Ų135.370%0.69979%0.792SS**  trans-150158.6-154.4-30.90000116.5
764L32Very low35.1Very low162 Ų162131.1 Ų131.185%0.84879%0.787SS**  trans74.8155.5152.5-61.1173.4000119.6
765T30.6Very low35.6Very low113 Ų113133.3 Ų133.369%0.69379%0.787SS**  cis-172.9159.7-32.8-103.20000112.5
766M30.6Very low35Very low158 Ų158133.7 Ų133.778%0.77879%0.787SS**  trans-6.9163.4153.7-49.1-88.881.100120
767V32.9Very low35.5Very low119 Ų119135.4 Ų135.472%0.72179%0.79SS**  cis-165.7160.7-3.4120.30000109
768P63.9Low35.5Very low117 Ų117136.6 Ų136.676%0.7679%0.788SS**  trans-98.2159.5-171.837.7-36.7000116.7
769L28.6Very low35.9Very low165 Ų165141.8 Ų141.886%0.86480%0.798SS**  trans-153.9132.9160.4-168.358.7000115.4
770V31Very low35.9Very low111 Ų111143.2 Ų143.267%0.67380%0.795SS**  trans4.8131.61551670000121.8
771H32.5Very low36.8Very low172 Ų172145.7 Ų145.780%0.79680%0.798SS**  trans13.7143.4146.5-59.5-99.1000122.5
772L32Very low36.9Very low172 Ų172142.2 Ų142.290%0.90180%0.798SS**  -164.9173.7116.4-104.8167.9000114
773S31.6Very low37.2Very low97 Ų97143.9 Ų143.968%0.67880%0.797SS**PPolyproline II helixtrans-70159.3-158.6-48.40000118.7
774P46.3Very low37.5Very low128 Ų128145.8 Ų145.883%0.83180%0.804SS**PPolyproline II helixtrans-86.6137.2172.934.3-33.7000113.6
775P39.7Very low37.8Very low120 Ų120146.3 Ų146.378%0.77980%0.8SS**PPolyproline II helixtrans-101144.5173.535.8-31.5000114.5
776V35.8Very low37.8Very low126 Ų126151.9 Ų151.976%0.76481%0.808SS**PPolyproline II helixtrans-48.9142.2171.6176.50000113.9K778V776-K778 HydrophobicContact CG1-CG 4.47Å
777I38.9Very low37.9Very low162 Ų162149.4 Ų149.483%0.83180%0.802SS**  trans-112.9137.4158.6-62.7178.8000108.7
778K33.9Very low37.8Very low187 Ų187152.4 Ų152.481%0.81381%0.808SS**  trans-97.1156.9178.3-61.3177.6-179.2177.70110.8V776V776-K778 HydrophobicContact CG1-CG 4.47Å
779L44.1Very low36.6Very low179 Ų179151.6 Ų151.694%0.93781%0.805SS**  trans-107.7142.3164.6-67.6173.7000109.7
780E36.2Very low36.9Very low188 Ų188149.3 Ų149.388%0.87980%0.802SS**  trans-142.2135.2171.2-170.8166.7-172.600108.3
781P52.9Low37.2Very low120 Ų120151.7 Ų151.778%0.77981%0.811SS**  trans-96.6157.4-172.437.3-34.7000113.3
782L37.7Very low37.3Very low177 Ų177146.7 Ų146.793%0.92781%0.806SS**  trans-134.8126.8171.4-89.2167.5000112
783D38.9Very low37.4Very low148 Ų148144.3 Ų144.379%0.79180%0.798SS**  trans-90.3129172.7-111.4-37.3000110.5
784V36.7Very low37.5Very low140 Ų140147.3 Ų147.385%0.84880%0.802SS**  trans-142.3143.4157-173.60000109
785K38.2Very low37.3Very low173 Ų173146.4 Ų146.475%0.75280%0.798SS**  trans-111.2168.6-175.4-60.4176.7179.3174.70111.8
786R31.1Very low37.2Very low230 Ų230147.9 Ų147.987%0.86880%0.796SS**  trans71.8154.8156.1-81.3-169.5-176.6-170.31.8117.1
787T33.1Very low37.3Very low107 Ų107149.6 Ų149.666%0.65680%0.801SS**  cis-160.7-174.2-33.711.90000107
788E31.5Very low37.5Very low182 Ų182146.2 Ų146.285%0.8579%0.788SS**  trans87.3142.8171.6-63.4158-136.500115.2
789S37Very low38Very low99 Ų99142.2 Ų142.269%0.69278%0.784SS**  cis-156.9166.2-6.547.40000112
790C36.6Very low38.4Very low117 Ų117139.9 Ų139.979%0.79178%0.779SS**  trans60.4128166-57.10000116.9
791D35.9Very low38.3Very low162 Ų162135.9 Ų135.987%0.86678%0.778SS**  cis65.7134.836.4-158.416.2000114.4
792G35.1Very low37.8Very low67 Ų67135.2 Ų135.269%0.69178%0.777SS**  trans144.581.7-172.600000115.5
793V33.8Very low38Very low121 Ų121134.4 Ų134.473%0.73377%0.766SS**  trans-55.7167.9157.8-65.60000111.6
794Q33.3Very low38.2Very low161 Ų161134.3 Ų134.375%0.75276%0.76SS**  cis-170.3157.120.5-146.5159.428.900110.7
795S42.5Very low38.8Very low108 Ų108136.5 Ų136.576%0.75576%0.761SS**  trans59168153.947.50000119
796M37.2Very low39Very low151 Ų151136 Ų13674%0.74477%0.766SS**  cis-171.9137.6-33.5172.4-164.67700105.8V798M796-V798 HydrophobicContact CE-CG2 3.9Å; M796-V798 HydrophobicContact CG-CG2 3.49Å; M796-V798 VanDerWaalsContact CG-CG2 3.49Å; M796-V798 HydrophobicContact SD-CG2 3.6Å; M796-V798 VanDerWaalsContact SD-CG2 3.6Å
797D39Very low39.4Very low162 Ų162133.3 Ų133.387%0.86677%0.767SS**  trans-147.3153.1151.5-138.9-25.2000111.3
798V42.8Very low39.6Very low91 Ų91133.3 Ų133.355%0.55277%0.771SS**  trans-142.5155.2-154.7-162.70000112.8M796M796-V798 HydrophobicContact CE-CG2 3.9Å; M796-V798 HydrophobicContact CG-CG2 3.49Å; M796-V798 VanDerWaalsContact CG-CG2 3.49Å; M796-V798 HydrophobicContact SD-CG2 3.6Å; M796-V798 VanDerWaalsContact SD-CG2 3.6Å
799S44Very low39.9Very low104 Ų104132.1 Ų132.173%0.72777%0.769SS**  trans95.7160.7157.1-43.10000116.8
800P51.9Low40Very low130 Ų130132.8 Ų132.884%0.84477%0.771SS**  cis-116.9166.6-10.116.56.3000113.6
801A34.9Very low40.3Very low103 Ų103136 Ų13685%0.85177%0.774SS**  trans-117.6156.4172.300000112.2
802S43.2Very low40.2Very low107 Ų107138.7 Ų138.775%0.74877%0.774SS**  trans-145.6115.9156.156.90000106.6
803K42.1Very low40.5Very low160 Ų160140.7 Ų140.770%0.69678%0.777SS**  54.9129.399.1-67.6-175.7152.4-72.40113
804E41.8Very low41.3Very low146 Ų146140 Ų14068%0.68278%0.776SS**  cis-164.7170.1-2.9-124.7136.9-159.100106.9
805E50.5Low41Very low185 Ų185138.8 Ų138.886%0.86477%0.774SS**  cis-122.5-155.39.8-57.6176.193.600111.5
806L41.9Very low41.2Very low163 Ų163141.7 Ų141.785%0.85378%0.781SS**  trans-137.4144.1172.2-70.7171.1000110.9
807I39.2Very low41.2Very low174 Ų174143.1 Ų143.189%0.89279%0.786SS**  trans-130.6122.2157.8-57.5-178.8000107.7
808S37.8Very low41.7Very low106 Ų106142.4 Ų142.474%0.74178%0.781SS**PPolyproline II helixtrans-78.8141.9-161.8-46.60000114.6
809I38.3Very low41.4Very low158 Ų158147.4 Ų147.481%0.8180%0.798SS**PPolyproline II helixtrans-99.8121.2157.2-59.9175000107.1
810P39.1Very low41.4Very low112 Ų112149 Ų14973%0.72779%0.794SS**PPolyproline II helixtrans-74.1122.9170.2-14.429.9000110.5
811E41.4Very low40.6Very low185 Ų185146.4 Ų146.486%0.86479%0.79SS**PPolyproline II helixtrans-75.2131.7163.8-69.1-170.1124.800110.2
812Y33.8Very low40.8Very low218 Ų218149.6 Ų149.686%0.85579%0.785SS**  trans-147.8106157.6-99.5-80.1000109.9
813S41.4Very low41.1Very low109 Ų109151.4 Ų151.476%0.76278%0.784SS**  trans-81.5152.6139.9-750000107
814P50.9Low41.6Very low108 Ų108146.9 Ų146.970%0.70177%0.772SS**  -150.1-16050.440.6-18000116.1
815N27.8Very low42.1Very low135 Ų135146.4 Ų146.472%0.72277%0.77SS**  trans87.7119.6162.7-63.30.7000118.7
816N46.7Very low42.5Very low169 Ų169143.3 Ų143.390%0.90476%0.759SS**  trans-77.9126.8149.5-67.1-67.1000107.7
817E36.9Very low43.9Very low180 Ų180140 Ų14084%0.84174%0.739SS**  trans-142.5145.3164.1-138.9159.6-142.600109.8
818I48.8Very low45.4Very low147 Ų147134.2 Ų134.275%0.75472%0.717SS**  trans-106.598.4-163.8-59.2170.1000109.6Q820I818-Q820 HydrophobicContact CG2-CG 4.02Å
819E36.3Very low46.7Very low196 Ų196133 Ų13392%0.91670%0.702SS**  trans-99.4100.1159.9-74.4-137.8129.900110.5G821E819-G821 VanDerWaalsContact C-N 3.35Å; E819-G821 PolarHBondContact O-N 2.92Å
820Q44.2Very low48.3Very low139 Ų139131.4 Ų131.465%0.6569%0.689SS**  trans-72.191.6166-74177.5-20.400109.2I818 F822I818-Q820 HydrophobicContact CG2-CG 4.02Å; Q820-F822 HydrophobicContact CB-CD2 3.84Å; Q820-F822 HydrophobicContact CB-CE2 3.6Å; Q820-F822 HydrophobicContact CB-CZ 4.38Å; Q820-F822 HydrophobicContact CG-CE2 4.45Å; Q820-F822 VanDerWaalsContact O-CD2 3.25Å; Q820-F822 WeakPolarHBondContact O-CD2 3.42Å; Q820-F822 PolarHBondContact O-N 2.96Å; Q820-F822 VanDerWaalsContact OE1-CE2 3.24Å
821G35.5Very low49.9Very low74 Ų74129.6 Ų129.676%0.76367%0.674SS**  trans-63.483.816600000110.8E819 M823E819-G821 VanDerWaalsContact C-N 3.35Å; E819-G821 PolarHBondContact O-N 2.92Å; G821-M823 VanDerWaalsContact C-N 3.27Å; G821-M823 PolarHBondContact O-N 2.81Å
822F39.9Very low51.6Low170 Ų170125.5 Ų125.575%0.74666%0.657SS**  trans-66.180179.8-83.9-86000111.6Q820 S824Q820-F822 HydrophobicContact CB-CD2 3.84Å; Q820-F822 HydrophobicContact CB-CE2 3.6Å; Q820-F822 HydrophobicContact CB-CZ 4.38Å; Q820-F822 HydrophobicContact CG-CE2 4.45Å; Q820-F822 VanDerWaalsContact O-CD2 3.25Å; Q820-F822 WeakPolarHBondContact O-CD2 3.42Å; Q820-F822 PolarHBondContact O-N 2.96Å; Q820-F822 VanDerWaalsContact OE1-CE2 3.24Å; F822-S824 VanDerWaalsContact C-N 3.29Å; F822-S824 PolarHBondContact O-N 3.39Å
823M48.1Very low53.4Low145 Ų145122 Ų12271%0.71465%0.65SS**  trans-63.795.9156.6-70.1-156.675.500108.1G821 H825G821-M823 VanDerWaalsContact C-N 3.27Å; G821-M823 PolarHBondContact O-N 2.81Å; M823-H825 PolarHBondContact O-N 3.22Å
824S52.9Low54.7Low65 Ų65122.4 Ų122.446%0.45564%0.644SS.*  trans-50.9130.7178178.60000110.1F822 N826 Q827F822-S824 VanDerWaalsContact C-N 3.29Å; F822-S824 PolarHBondContact O-N 3.39Å; S824-N826 PolarHBondContact O-N 2.91Å; S824-N826 PolarHBondContact OG-ND2 3.01Å; S824-Q827 PolarHBondContact O-N 3.46Å
825H52.2Low55.4Low136 Ų136124.7 Ų124.763%0.6365%0.649SS**Hα-helixtrans-52.6-26.1179.8-168.6-34.9000112.4M823 L829M823-H825 PolarHBondContact O-N 3.22Å; H825-L829 WeakPolarHBondContact ND1-CD1 3.44Å; H825-L829 WeakPolarHBondContact O-CB 3.42Å; H825-L829 WeakPolarHBondContact O-CG 3.34Å; H825-L829 PolarHBondContact O-N 3.03Å
826N59.3Low57.1Low120 Ų120122.1 Ų122.164%0.64264%0.639SS**Hα-helixtrans-67.4-34.3175-66.5-81.5000113.6S824 K830S824-N826 PolarHBondContact O-N 2.91Å; S824-N826 PolarHBondContact OG-ND2 3.01Å; N826-K830 WeakPolarHBondContact O-CB 3.43Å; N826-K830 PolarHBondContact O-N 3.09Å
827Q70.8Confident57.1Low94 Ų94116.7 Ų116.744%0.43962%0.623SS.*Hα-helixtrans-72.3-46.1176.9-170.561.547.200110.6S824 L829 K830 D831S824-Q827 PolarHBondContact O-N 3.46Å; Q827-L829 VanDerWaalsContact C-N 3.28Å; Q827-L829 PolarHBondContact O-N 2.9Å; Q827-K830 WeakPolarHBondContact O-CA 3.43Å; Q827-K830 WeakPolarHBondContact O-CB 3.38Å; Q827-K830 PolarHBondContact O-N 2.9Å; Q827-D831 PolarHBondContact NE2-OD1 3.37Å; Q827-D831 VanDerWaalsContact O-CG 3.28Å; Q827-D831 PolarHBondContact O-N 3.31Å
828A70.5Confident57.6Low52 Ų52113.4 Ų113.443%0.4362%0.62SS.*Hα-helixtrans-61-35.3175.600000112.7L832A828-L832 VanDerWaalsContact O-CB 3.27Å; A828-L832 WeakPolarHBondContact O-CB 3.45Å; A828-L832 PolarHBondContact O-N 2.78Å; A828-L832 VanDerWaalsContact O-N 3.15Å
829L66.5Low57.1Low81 Ų81111 Ų11142%0.42461%0.612SS.*Hα-helixtrans-67.6-35.3171.1-80.7170.7000112.8H825 Q827 M833H825-L829 WeakPolarHBondContact ND1-CD1 3.44Å; H825-L829 WeakPolarHBondContact O-CB 3.42Å; H825-L829 WeakPolarHBondContact O-CG 3.34Å; H825-L829 PolarHBondContact O-N 3.03Å; Q827-L829 VanDerWaalsContact C-N 3.28Å; Q827-L829 PolarHBondContact O-N 2.9Å; L829-M833 WeakPolarHBondContact O-CG 3.49Å; L829-M833 PolarHBondContact O-N 3.24Å
830K71.4Confident57.1Low124 Ų124108 Ų10854%0.53961%0.607SS.*Hα-helixtrans-71.1-49.1179-172.8160.2-174.7173.80111.5N826 Q827 L832 M833 D834N826-K830 WeakPolarHBondContact O-CB 3.43Å; N826-K830 PolarHBondContact O-N 3.09Å; Q827-K830 WeakPolarHBondContact O-CA 3.43Å; Q827-K830 WeakPolarHBondContact O-CB 3.38Å; Q827-K830 PolarHBondContact O-N 2.9Å; K830-L832 PolarHBondContact O-N 3.36Å; K830-M833 PolarHBondContact O-N 2.79Å; K830-D834 PolarHBondContact O-N 2.99Å
831D73.1Confident56.8Low75 Ų75109.2 Ų109.240%0.40161%0.613SS.*Hα-helixtrans-56.3-37.5175-59.4-7.2000110.9Q827 L835Q827-D831 PolarHBondContact NE2-OD1 3.37Å; Q827-D831 VanDerWaalsContact O-CG 3.28Å; Q827-D831 PolarHBondContact O-N 3.31Å; D831-L835 WeakPolarHBondContact O-CB 3.4Å; D831-L835 PolarHBondContact O-N 3.12Å
832L76.4Confident56.8Low99 Ų99112.2 Ų112.252%0.51862%0.616SS.*Hα-helixtrans-68.7-39.8174.7-178.762.1000113.1A828 K830 L835 T836A828-L832 VanDerWaalsContact O-CB 3.27Å; A828-L832 WeakPolarHBondContact O-CB 3.45Å; A828-L832 PolarHBondContact O-N 2.78Å; A828-L832 VanDerWaalsContact O-N 3.15Å; K830-L832 PolarHBondContact O-N 3.36Å; L832-L835 PolarHBondContact O-N 2.71Å; L832-T836 VanDerWaalsContact O-CB 3.3Å; L832-T836 WeakPolarHBondContact O-CB 3.49Å; L832-T836 PolarHBondContact O-N 2.99Å; L832-T836 VanDerWaalsContact O-N 3.1Å; L832-T836 PolarHBondContact O-OG1 3.07Å
833M70.9Confident56.5Low143 Ų143114 Ų11470%0.70462%0.624SS**Hα-helixtrans-68.9-39.8176.2-80.3-164.115900112.2L829 K830 L835 T836 G837L829-M833 WeakPolarHBondContact O-CG 3.49Å; L829-M833 PolarHBondContact O-N 3.24Å; K830-M833 PolarHBondContact O-N 2.79Å; M833-L835 VanDerWaalsContact C-N 3.26Å; M833-L835 PolarHBondContact O-N 3.4Å; M833-T836 PolarHBondContact O-N 3.29Å; M833-T836 VanDerWaalsContact O-N 3.08Å; M833-G837 PolarHBondContact O-N 3.42Å
834D68.6Low55.9Low119 Ų119114.7 Ų114.764%0.63663%0.63SS**Hα-helixtrans-65.7-31.1175.8-66.8-21.9000111K830K830-D834 PolarHBondContact O-N 2.99Å
835L67.1Low55.4Low155 Ų155117.6 Ų117.681%0.81265%0.647SS**Hα-helixtrans-72.8-26.8170.1-126.975.4000114.5D831 L832 M833D831-L835 WeakPolarHBondContact O-CB 3.4Å; D831-L835 PolarHBondContact O-N 3.12Å; L832-L835 PolarHBondContact O-N 2.71Å; M833-L835 VanDerWaalsContact C-N 3.26Å; M833-L835 PolarHBondContact O-N 3.4Å
836T63.1Low54.9Low81 Ų81116.9 Ų116.950%0.49766%0.657SS.*Hα-helixtrans-99.7-9.7-167.2-55.30000113.5L832 M833L832-T836 VanDerWaalsContact O-CB 3.3Å; L832-T836 WeakPolarHBondContact O-CB 3.49Å; L832-T836 PolarHBondContact O-N 2.99Å; L832-T836 VanDerWaalsContact O-N 3.1Å; L832-T836 PolarHBondContact O-OG1 3.07Å; M833-T836 PolarHBondContact O-N 3.29Å; M833-T836 VanDerWaalsContact O-N 3.08Å
837G46.8Very low53.7Low56 Ų56120.4 Ų120.458%0.57767%0.67SS**THydrogen-bonded Turntrans67.243165.200000115.6M833M833-G837 PolarHBondContact O-N 3.42Å
838S46.2Very low52.2Low111 Ų111120.9 Ų120.978%0.77668%0.683SS**  trans5558.616862.20000117T840S838-T840 PolarHBondContact O-N 3.12Å
839V39.5Very low50.5Low95 Ų95124.8 Ų124.858%0.57670%0.702SS**  trans-72.5112.3164-174.80000109.8H841V839-H841 WeakPolarHBondContact CG1-NE2 3.35Å; V839-H841 PolarHBondContact O-N 3.37Å
840T36.4Very low49.7Very low135 Ų135129.5 Ų129.583%0.82873%0.726SS**  trans-75.189.8-179.9510000111.9S838S838-T840 PolarHBondContact O-N 3.12Å
841H37Very low48Very low164 Ų164126.3 Ų126.376%0.75973%0.728SS**PPolyproline II helixtrans-85.9125.6168.5-69.9-73.2000111.5V839 K843V839-H841 WeakPolarHBondContact CG1-NE2 3.35Å; V839-H841 PolarHBondContact O-N 3.37Å; H841-K843 PolarHBondContact O-N 2.84Å
842T35Very low46.4Very low137 Ų137128.8 Ų128.884%0.8474%0.741SS**PPolyproline II helixtrans-70.2125.3175.146.10000111.3L844T842-L844 PolarHBondContact O-N 3.5Å
843K33.6Very low44.8Very low207 Ų207130.7 Ų130.790%0.976%0.761SS**PPolyproline II helixtrans-58.3132.8172-88-176.5171.8-179.20111.7H841H841-K843 PolarHBondContact O-N 2.84Å
844L36.3Very low43.7Very low160 Ų160130.4 Ų130.484%0.83876%0.763SS**  trans-122.2150146.6-71.4176.3000107.7T842T842-L844 PolarHBondContact O-N 3.5Å
845P42.5Very low43Very low125 Ų125132.8 Ų132.881%0.81277%0.767SS**  trans-74.2151.9-170.229.8-35.2000112.9
846S41.7Very low42Very low121 Ų121133.3 Ų133.385%0.84677%0.771SS**  trans-81.9137.3172.352.70000111.5
847E34.5Very low41.2Very low195 Ų195137.2 Ų137.291%0.91179%0.788SS**  trans-138.4134.4157.8-167.9155.4-141.600110.7
848S39.5Very low41.1Very low103 Ų103140.9 Ų140.972%0.7279%0.793SS**  trans-100.1135.9-179.853.70000110.6
849T35Very low40.6Very low134 Ų134147.4 Ų147.482%0.82280%0.801SS**  trans-162.7133.5147.2-80.70000110.3
850I48.5Very low40.4Very low181 Ų181146.6 Ų146.693%0.92881%0.812SS**  trans-87.5119.8161.6-73.3170.1000106.7
851G35.9Very low40.7Very low57 Ų57147.2 Ų147.259%0.58882%0.815SS**  trans-174108.5-177.800000117.2
852D39.2Very low40.6Very low126 Ų126145.5 Ų145.567%0.67482%0.815SS**  trans4973.1141-157.918.1000119.2N854D852-N854 PolarHBondContact O-N 2.88Å
853C42.9Very low40.9Very low140 Ų140143 Ų14395%0.94680%0.804SS**SBendtrans-73.249.7173.7-610000114.5
854N49.3Very low41.5Very low136 Ų136138.8 Ų138.873%0.72780%0.798SS**  trans-150.546.8-179.4-156.15.4000117.5D852D852-N854 PolarHBondContact O-N 2.88Å
855K53.9Low41.3Very low170 Ų170139.4 Ų139.474%0.73980%0.798SS**  trans-138.5158.6164-66.9-173.8-177.5162.70112.4
856N45.1Very low41.9Very low165 Ų165139.7 Ų139.788%0.88280%0.798SS**  trans75.151.4174.9-50.9-25.4000116.8
857L45.8Very low41.3Very low163 Ų163140.3 Ų140.385%0.85379%0.792SS**  trans-67.4154.7138.7-165.373.5000108.9
858I45.6Very low41.8Very low134 Ų134135.1 Ų135.169%0.68778%0.777SS**SBendtrans86.4113.1167.3-49.9-177.5000117.5
859R36.3Very low42Very low248 Ų248138.4 Ų138.494%0.93678%0.778SS**  trans57.6131.3154-67.6173.4178-153.8-0.6120.2
860G34.3Very low42.4Very low78 Ų78138.3 Ų138.380%0.80477%0.772SS**  trans168.499.2158.300000113.2
861V43.3Very low41.7Very low148 Ų148137.3 Ų137.390%0.89777%0.767SS**  trans-76129.3170.8-173.90000109
862V33.8Very low41.6Very low127 Ų127137.7 Ų137.777%0.7777%0.771SS**  trans-177.9143.4138.8140.70000109.4
863S41.3Very low41.3Very low86 Ų86138.2 Ų138.260%0.60178%0.778SS**  trans-127.8128.4166.8-55.30000109
864P47.3Very low41Very low118 Ų118135.8 Ų135.877%0.76677%0.768SS**  trans-86.9100.2150.730.5-22.2000106.8
865M30.8Very low41Very low172 Ų172134.7 Ų134.785%0.84777%0.769SS**  54.8115.788.9-70-169.572.400113.2
866T56.3Low41Very low132 Ų132132.1 Ų132.181%0.8177%0.769SS**  trans-63.4162.3166.148.30000111
867D29.8Very low40.4Very low134 Ų134130 Ų13072%0.71777%0.767SS**  trans-136.1123.3142.1-148.7-1.1000109.9K869D867-K869 IonicContact OD1-NZ 2.64Å; D867-K869 PolarHBondContact OD1-NZ 2.99Å
868S44.8Very low40.1Very low86 Ų86126.2 Ų126.260%0.60175%0.754SS**  trans-124.5126.1175.7166.90000106.9
869K42.3Very low39.6Very low171 Ų171127.2 Ų127.274%0.74376%0.761SS**  trans-168.3154161.9-88.3118.8-150.9163.20111.2D867D867-K869 IonicContact OD1-NZ 2.64Å; D867-K869 PolarHBondContact OD1-NZ 2.99Å
870L43Very low40.1Very low132 Ų132124.7 Ų124.769%0.69176%0.757SS**  cis-174.5-177.7-34.2-144.580.4000108
871I34.7Very low40.5Very low160 Ų160129.4 Ų129.482%0.82176%0.763SS**  trans72.7136166-52.3128.2000113.7
872G32.8Very low40.2Very low65 Ų65127.1 Ų127.167%0.6775%0.753SS**  cis-170-176.1-2.800000108.1
873V33Very low40.5Very low138 Ų138131.7 Ų131.784%0.83678%0.781SS**  cis-154.1144.519.5166.90000108.9
874A37.4Very low40.5Very low88 Ų88134 Ų13473%0.72779%0.79SS**  trans-111.9156.8154.400000106.8
875P50.1Low40.1Very low114 Ų114134.8 Ų134.874%0.7479%0.791SS**  -155.1-137.661.345.7-22.9000110.7
876P53.1Low40.6Very low115 Ų115132.8 Ų132.875%0.74779%0.788SS**  cis-124.4169.8-34.138-24.2000113.2
877S32.3Very low39.7Very low120 Ų120132.8 Ų132.884%0.83979%0.787SS**  168.7155115.3-164.50000111.9
878S40.7Very low40.3Very low84 Ų84132.8 Ų132.859%0.58779%0.792SS**  trans-98.2145.8177.1173.60000110.5
879N34Very low40.1Very low156 Ų156135.9 Ų135.983%0.83480%0.804SS**  -174158.4109.9-90.2-26000114.8
880K47.7Very low39.9Very low195 Ų195133.4 Ų133.485%0.84881%0.809SS**  trans-84.1155.3177.7-49174.1-176.3179.10110.4
881L41.4Very low39.6Very low176 Ų176133.5 Ų133.592%0.92182%0.818SS**  trans-158.4162.8131.9-113168.2000110.3
882S37.1Very low40.1Very low100 Ų100131.3 Ų131.370%0.69982%0.817SS**  trans-122.5133.2-177.453.10000110.7
883V41.2Very low40.7Very low224 Ų224137.3 Ų137.3100%1.35883%0.831SS**  trans-138.20149.6-178.40000106.1

Retrieved 883 of 883 residues in 152.2 ms (Link to these results)