A0A096LP59_HUMAN Loading...

Transcriptional regulator ATRX

AlphaFold DB , UniProt , Accession A0A096LP59, Species HUMAN (Homo sapiens, Human), Gene ATRX, Length 293 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
1T34.8Very low51.8Low179 Ų179154 Ų154100%1.09881%0.808SS**  0108.2034.80000107.1
2T41.4Very low52Low120 Ų120157.4 Ų157.474%0.73680%0.802SS**  63.812179.359.90000109.9
3D41.8Very low51.9Low142 Ų142154.4 Ų154.476%0.75979%0.789SS**  cis-145.6-17519.9-120.6-128.7000110.4
4G46.5Very low52.5Low61 Ų61158.6 Ų158.663%0.62980%0.799SS**  cis137.1160.74.600000112.4
5E45.5Very low52.4Low147 Ų147157.3 Ų157.369%0.68780%0.803SS**  trans62.689.6157.7-57.9-131.3117.500122.1
6K59Low52.4Low204 Ų204155.3 Ų155.389%0.88781%0.807SS**  trans-19.3141.9138.5-50.2162-174.9169.90115
7K58.5Low52.2Low169 Ų169157.8 Ų157.874%0.73581%0.81SS**  trans-150.6116147.217.4-109.7168.8-160.50112.3
8S53.2Low51.9Low117 Ų117160.2 Ų160.282%0.81881%0.814SS**  trans-82.3154167480000110.7
9K66.4Low51.7Low196 Ų196159.7 Ų159.785%0.85281%0.806SS**  trans-132.6101.1168.5-73.9-168.7176.4-177.40110.9
10K56.6Low51.1Low195 Ų195157.4 Ų157.485%0.84880%0.795SS**  trans-75.7127.1167.1177.4179-179.3175.80108.3
11I66.4Low50.6Low164 Ų164157.1 Ų157.184%0.84179%0.791SS**  trans-115.6149.7165.1-58.7-177.8000107.5
12R54.4Low51.1Low195 Ų195156.8 Ų156.874%0.73678%0.782SS**  trans-128.6146.5-153.1-179.6-179.5179.3-169.90.1111.7
13D50Low51.4Low118 Ų118156.3 Ų156.363%0.63178%0.783SS**  trans8123.9159.7-27.8-34.3000117.7
14K60.4Low51.2Low213 Ų213157.1 Ų157.193%0.92679%0.788SS**  trans-133.9113142.9-74.3-163.1176.3-175.30110.3
15T51.7Low50.9Low140 Ų140163.5 Ų163.586%0.85979%0.794SS**  trans-82.1151.1170.440.80000110.7
16S51.7Low50.8Low124 Ų124160.7 Ų160.787%0.86780%0.796SS**  trans-135.890.3171.357.30000110.8
17K49.2Very low49.9Very low198 Ų198156.5 Ų156.586%0.86178%0.779SS**  trans-90.3117.5166.4-89.2-172.4172.7-176.90110.1
18K45.8Very low49.4Very low201 Ų201156.9 Ų156.987%0.87478%0.781SS**  trans-140.4123.4139.2-71.4-158.8174.7-1680105.4
19K48Very low49Very low152 Ų152156 Ų15666%0.66178%0.775SS**  cis83.8132.625.1-129.5-69.8-177-1750110.9E21K19-E21 IonicContact NZ-OE1 3.71Å
20D40.1Very low47.9Very low112 Ų112153.4 Ų153.460%0.59978%0.776SS**  trans79137.3172-46.9-44.7000116.6
21E41.7Very low47.1Very low153 Ų153147.6 Ų147.672%0.71577%0.772SS**  cis-165.7-177.7-18.8-128.2160.6-15500111.1K19K19-E21 IonicContact NZ-OE1 3.71Å
22L43.8Very low46.1Very low171 Ų171150.2 Ų150.290%0.89578%0.777SS**  trans73.1147.6177-48.1173.7000115.9
23S47.9Very low45.4Very low110 Ų110144 Ų14477%0.76977%0.774SS**  cis-137.3139.56.557.50000113.3
24D39.2Very low44.9Very low160 Ų160146.2 Ų146.286%0.85679%0.785SS**  trans-68.8147.9165-80.3-63.6000112.7
25Y38.6Very low44.2Very low195 Ų195140.6 Ų140.677%0.76577%0.773SS**  trans-130.1114.8144.8179.5-90.7000108E27Y25-E27 HydrophobicContact CE1-CB 4.12Å; Y25-E27 PolarHBondContact OH-OE2 3.1Å; Y25-E27 VanDerWaalsContact OH-OE2 3.1Å
26A43.2Very low43.7Very low87 Ų87139.7 Ų139.772%0.71977%0.771SS**  trans-107.9124.4-171.200000111.8
27E40.4Very low43.3Very low116 Ų116140.4 Ų140.454%0.54277%0.765SS.*  trans-147.7100.6166.6-169.5142.2-142.900113Y25Y25-E27 HydrophobicContact CE1-CB 4.12Å; Y25-E27 PolarHBondContact OH-OE2 3.1Å; Y25-E27 VanDerWaalsContact OH-OE2 3.1Å
28K49.1Very low43.3Very low178 Ų178135.9 Ų135.977%0.77476%0.758SS**  trans55.5140.8138.4-60.2166.3-157.5158.20118.3
29S44.6Very low43.7Very low98 Ų98131.9 Ų131.969%0.68576%0.755SS**  cis-165.6166.510.847.70000111.6
30T43.1Very low43.7Very low141 Ų141132.1 Ų132.187%0.86576%0.759SS**  trans59.7133.9157.145.50000118.9
31G39.8Very low44.2Very low74 Ų74133.3 Ų133.376%0.76377%0.765SS**  cis-177.4-166.62.100000113.1
32K44.5Very low44.8Very low219 Ų219134.3 Ų134.395%0.95277%0.768SS**  trans-47.7155173.3-48.6-77-172.7165.30111.3
33G40.9Very low45.3Very low65 Ų65134.8 Ų134.867%0.6776%0.762SS**  cis146.3168.416.700000108.7
34D39.3Very low45.5Very low163 Ų163134.6 Ų134.687%0.87276%0.761SS**  trans60.9142.7-171.1-65.9-33.5000115.9
35S45.3Very low46.2Very low95 Ų95136.7 Ų136.766%0.66476%0.763SS**  cis93.6141.519.5-162.60000115.3
36C41.4Very low46.7Very low121 Ų121135.7 Ų135.782%0.81877%0.77SS**  trans66.1154.7174.9-62.50000116.1
37D44.3Very low46.5Very low139 Ų139135.3 Ų135.374%0.74378%0.775SS**  cis-156.6173.4-27.5-172.515.4000107.9
38S48.6Very low46.7Very low104 Ų104134.7 Ų134.773%0.72779%0.79SS**  trans-50.4142.1176.6-44.50000114.9
39S54.5Low46.4Very low116 Ų116137.8 Ų137.881%0.81180%0.798SS**  trans-152.1127.4148.251.10000112
40E47.7Very low46.4Very low157 Ų157136.2 Ų136.273%0.73480%0.797SS**  trans-77.8139.4153.8-74.4-171.192.500108.4K42E40-K42 IonicContact OE1-NZ 2.73Å; E40-K42 PolarHBondContact OE1-NZ 3.14Å
41D49.8Very low47.1Very low137 Ų137141.2 Ų141.273%0.73380%0.8SS**  trans-133109.6150.4-170.50.7000109.8
42K54.2Low47.5Very low175 Ų175144.8 Ų144.876%0.76180%0.797SS**  trans-95.889173.9-79.2-178.8175.1125.90109.5E40E40-K42 IonicContact OE1-NZ 2.73Å; E40-K42 PolarHBondContact OE1-NZ 3.14Å
43K54Low48Very low181 Ų181141.8 Ų141.879%0.78778%0.784SS**  trans-11497.9173.8-149.4161-161157.50113
44S52.2Low48.4Very low106 Ų106147 Ų14774%0.74179%0.788SS**  trans-68.5143.1170.453.50000111.6
45K54.8Low49.2Very low204 Ų204149.8 Ų149.889%0.88779%0.787SS**  trans-159.7122.2150.9-116.4170.2-174.4-177.60111
46N49.2Very low48.8Very low173 Ų173151.1 Ų151.193%0.92579%0.794SS**  trans-77135.5172.4-60.4-35.9000109.3
47G38Very low49.3Very low79 Ų79155.4 Ų155.481%0.81480%0.799SS**  trans176.9108.5176.500000111
48A45.7Very low49.5Very low104 Ų104156.7 Ų156.786%0.8681%0.805SS**  trans-94.6129.8-170.200000113
49Y43.2Very low49.5Very low243 Ų243160 Ų16095%0.95381%0.814SS**  trans-154.5165.1151.9-145.5-100.9000111.4
50G44.4Very low48.8Very low64 Ų64158.1 Ų158.166%0.6681%0.813SS**  trans88.892170.800000115.2
51R56.7Low49.3Very low247 Ų247159.7 Ų159.793%0.93282%0.817SS**  trans-74.9128154.3-52.2172.9-172.7173.71.8106.8
52E49.2Very low49.1Very low148 Ų148158.7 Ų158.769%0.69282%0.82SS**  trans-176125.2130.4-102.1-166.7141.800116.7
53K54.7Low48.9Very low157 Ų157155.4 Ų155.468%0.68382%0.82SS**  31.496.1123.8-56.6175.5-157.4153.90118.7
54K50.3Low48.4Very low174 Ų174158 Ų15876%0.75783%0.825SS**  167.5116.897-89149.7-173.8169.90114.7
55R54.1Low48.1Very low222 Ų222161.5 Ų161.584%0.83883%0.826SS**  trans50.284.2138.6-52.9-174.2-58.9-167.92.2117.8K57R55-K57 PolarHBondContact O-N 3.38Å
56C37Very low47.7Very low122 Ų122162.2 Ų162.282%0.82482%0.824SS**  trans-57.5132.6149.9-59.10000109.5
57K52.5Low47.8Very low212 Ų212161.9 Ų161.992%0.92282%0.816SS**  trans-91.194.9166.6-79.7-171.5177.2-178.40108.9R55R55-K57 PolarHBondContact O-N 3.38Å
58L48Very low48.4Very low165 Ų165164.2 Ų164.286%0.86481%0.81SS**  trans-119.3125.1163.7-68.2176.4000108.8
59L49.3Very low48.1Very low175 Ų175164.7 Ų164.792%0.91681%0.806SS**  trans-83.9132.5174.3-82.9154.3000108.9
60G39.3Very low48.2Very low76 Ų76158.8 Ų158.878%0.78480%0.8SS**  trans-158.589.9176.700000110.7
61K59.6Low48.2Very low190 Ų190160.9 Ų160.983%0.82681%0.805SS**  trans-87.8121.5176.1-67.1177.4-179.1173.70109.8
62S44.3Very low47.7Very low115 Ų115154.3 Ų154.380%0.80480%0.796SS**  trans-133.2130.9150.859.40000107.4
63S51Low47.8Very low107 Ų107154 Ų15475%0.74880%0.8SS**  cis72.679.327.2-157.80000114.4
64R42.2Very low47.4Very low236 Ų236151.9 Ų151.989%0.89180%0.8SS**  -165122.2115.4-105167.9-175.8179.52.8113.8
65K46Very low47.2Very low178 Ų178152.6 Ų152.677%0.77481%0.806SS**  trans41.199.6130.7-168.6173.7-177174.30117.5
66R48Very low47.1Very low220 Ų220150.3 Ų150.383%0.8380%0.802SS**  trans-112.6145.8134-74.3-163.2168.4-151.2-2.2109.8D68R66-D68 VanDerWaalsContact CB-OD2 3.32Å; R66-D68 WeakPolarHBondContact CB-OD2 3.23Å
67Q50.7Low47.3Very low166 Ų166154.5 Ų154.578%0.77680%0.802SS**  trans-11380.2175.9179.6-178.3-20.100106.6
68D50.1Low47.1Very low127 Ų127150 Ų15068%0.67980%0.798SS**  trans-97.9141.4175-64.8-58.6000109R66R66-D68 VanDerWaalsContact CB-OD2 3.32Å; R66-D68 WeakPolarHBondContact CB-OD2 3.23Å
69C40.4Very low47.1Very low114 Ų114150.1 Ų150.177%0.7780%0.796SS**  trans-90150.9-162.7-62.90000114.2
70S43.6Very low47.1Very low120 Ų120150.3 Ų150.384%0.83979%0.789SS**  trans115.5161.5150-49.20000117.5
71S46.3Very low47.5Very low107 Ų107153.2 Ų153.275%0.74878%0.782SS**  trans78.983.6163.8-163.10000119.1
72S45.6Very low46.7Very low109 Ų109151.9 Ų151.976%0.76278%0.784SS**  47.298.1124.2-510000119.6T74S72-T74 PolarHBondContact O-N 3.02Å
73D51.2Low47Very low142 Ų142149.8 Ų149.876%0.75978%0.781SS**  trans-50.9126143.9164.234.6000111.5
74T46.7Very low46.7Very low112 Ų112150.3 Ų150.369%0.68778%0.783SS**  trans-176.7129.4131.817.30000111.3S72S72-T74 PolarHBondContact O-N 3.02Å
75E45.3Very low47.3Very low190 Ų190145.5 Ų145.589%0.88878%0.775SS**  trans-66.2155-179.8-58.7178.6144.400112.8
76K51.9Low47.8Very low174 Ų174141.3 Ų141.376%0.75777%0.768SS**  trans-112.895.7-174.4-71.9-66.3-176.3-173.40112.7
77Y40.8Very low48.1Very low210 Ų210134 Ų13482%0.82475%0.75SS**  trans66.5143.3164.5-65-97.6000114.4
78S48.8Very low48.3Very low118 Ų118129.9 Ų129.983%0.82573%0.734SS**  cis-140.9156.136.8-640000114.7
79M48.6Very low48.6Very low167 Ų167132.1 Ų132.182%0.82374%0.737SS**  trans-81.5130.8175.8-84-83.2-140.800112.7
80K48.3Very low49.3Very low178 Ų178135.4 Ų135.477%0.77473%0.734SS**  -149.1106.9120.9-79.7-46.9-164.31680107
81E48.8Very low49.9Very low137 Ų137134.4 Ų134.464%0.6472%0.719SS**  77.978.975.4-171.1165.8-150.400111.7
82D42.4Very low50.5Low163 Ų163135 Ų13587%0.87271%0.707SS**  trans-165.3157.7132-119.5-34.9000114.5C84D82-C84 PolarHBondContact O-N 3.17Å
83G50.5Low51.2Low71 Ų71139.4 Ų139.473%0.73271%0.708SS**  trans76.7-1.3148.100000123.2N85G83-N85 PolarHBondContact O-N 3.21Å
84C44.4Very low51.6Low117 Ų117137.4 Ų137.479%0.79170%0.696SS**  trans-91.4106.2-176.4-1640000114.8D82 S86D82-C84 PolarHBondContact O-N 3.17Å; C84-S86 PolarHBondContact O-N 3.08Å
85N55.3Low52.1Low136 Ų136136 Ų13673%0.72768%0.681SS**  trans-61.398.7-176-86.3-47.5000114.9G83 S87G83-N85 PolarHBondContact O-N 3.21Å; N85-S87 PolarHBondContact O-N 2.99Å
86S55.9Low52.7Low90 Ų90131.6 Ų131.663%0.62966%0.663SS**THydrogen-bonded Turntrans-75.61.7-178.2-1570000115.2C84C84-S86 PolarHBondContact O-N 3.08Å
87S54.5Low53Low65 Ų65131.9 Ų131.946%0.45566%0.66SS.*THydrogen-bonded Turntrans-68-40176.350.80000112.7N85 K89 R90 L91N85-S87 PolarHBondContact O-N 2.99Å; S87-K89 VanDerWaalsContact C-N 3.31Å; S87-K89 PolarHBondContact O-N 3.45Å; S87-R90 WeakPolarHBondContact O-CA 2.95Å; S87-R90 WeakPolarHBondContact O-CB 3.22Å; S87-R90 PolarHBondContact O-N 3.28Å; S87-L91 PolarHBondContact O-N 3.5Å
88D54.2Low53.8Low80 Ų80127.1 Ų127.143%0.42865%0.645SS.*Hα-helixtrans-67.8-30.3-166.2-149.842.6000113.4R90 K92D88-R90 VanDerWaalsContact C-N 3.3Å; D88-R90 PolarHBondContact O-N 3.16Å; D88-K92 IonicContact OD2-NZ 2.8Å; D88-K92 PolarHBondContact OD2-NZ 2.99Å
89K57.5Low54.3Low174 Ų174129.6 Ų129.676%0.75764%0.636SS**Hα-helixtrans-73-20.6174-64.2177.4-176.8173.60112.7S87S87-K89 VanDerWaalsContact C-N 3.31Å; S87-K89 PolarHBondContact O-N 3.45Å
90R55.8Low54.8Low183 Ų183130 Ų13069%0.69163%0.628SS**Hα-helixtrans-92.6-39.5177.1-66.6-178.365.6162.6-2.2112.2S87 D88 K92 R93 I94S87-R90 WeakPolarHBondContact O-CA 2.95Å; S87-R90 WeakPolarHBondContact O-CB 3.22Å; S87-R90 PolarHBondContact O-N 3.28Å; D88-R90 VanDerWaalsContact C-N 3.3Å; D88-R90 PolarHBondContact O-N 3.16Å; R90-K92 PolarHBondContact O-N 2.86Å; R90-R93 PolarHBondContact O-N 3.18Å; R90-I94 PolarHBondContact O-N 2.9Å
91L55.1Low55.3Low100 Ų100126.6 Ų126.652%0.52462%0.619SS.*Hα-helixtrans-52.8-52.3178-75.3168.9000111.9S87 R93 I94 E95S87-L91 PolarHBondContact O-N 3.5Å; L91-R93 PolarHBondContact O-N 3.28Å; L91-R93 VanDerWaalsContact O-N 3.17Å; L91-I94 PolarHBondContact O-N 3.44Å; L91-E95 PolarHBondContact O-N 3Å
92K59.9Low55.8Low118 Ų118126.9 Ų126.951%0.51362%0.624SS.*Hα-helixtrans-59.7-30.1-178-67.4166-177156.20113.5D88 R90 L96D88-K92 IonicContact OD2-NZ 2.8Å; D88-K92 PolarHBondContact OD2-NZ 2.99Å; R90-K92 PolarHBondContact O-N 2.86Å; K92-L96 WeakPolarHBondContact O-CB 3.4Å; K92-L96 WeakPolarHBondContact O-CD1 3.47Å; K92-L96 VanDerWaalsContact O-CG 3.29Å; K92-L96 WeakPolarHBondContact O-CG 3.34Å; K92-L96 PolarHBondContact O-N 2.91Å
93R59.2Low56.7Low203 Ų203123.9 Ų123.977%0.76662%0.616SS**Hα-helixtrans-75.7-33.2174.7-173.9180-69.8-179.6-1112.3R90 L91 R97R90-R93 PolarHBondContact O-N 3.18Å; L91-R93 PolarHBondContact O-N 3.28Å; L91-R93 VanDerWaalsContact O-N 3.17Å; R93-R97 WeakPolarHBondContact O-CB 3.43Å; R93-R97 PolarHBondContact O-N 3.41Å
94I60.2Low57.1Low99 Ų99124.7 Ų124.751%0.50861%0.61SS.*Hα-helixtrans-76.9-50.3-179.8-64.7170.3000109.8R90 L91 L96 R97 E98R90-I94 PolarHBondContact O-N 2.9Å; L91-I94 PolarHBondContact O-N 3.44Å; I94-L96 VanDerWaalsContact C-N 3.33Å; I94-L96 PolarHBondContact O-N 3.4Å; I94-R97 CarbonylContact O-C 3.56Å; I94-R97 WeakPolarHBondContact O-CA 3.47Å; I94-R97 WeakPolarHBondContact O-CB 3.26Å; I94-R97 PolarHBondContact O-N 2.63Å; I94-E98 WeakPolarHBondContact O-CB 3.48Å; I94-E98 PolarHBondContact O-N 3.3Å
95E57.5Low57.8Low82 Ų82128.4 Ų128.438%0.38361%0.613SS.*Hα-helixtrans-55.8-44.2179.5-171.4-170.6179.800112.4L91 R97 E98 R99L91-E95 PolarHBondContact O-N 3Å; E95-R97 VanDerWaalsContact C-N 3.3Å; E95-R97 PolarHBondContact O-N 2.8Å; E95-E98 PolarHBondContact O-N 2.66Å; E95-R99 PolarHBondContact O-N 3.04Å; E95-R99 IonicContact OE1-CZ 3.16Å; E95-R99 IonicContact OE1-NH1 2.65Å; E95-R99 PolarHBondContact OE1-NH1 3.41Å; E95-R99 IonicContact OE1-NH2 2.89Å; E95-R99 PolarHBondContact OE1-NH2 3.09Å
96L56.3Low58.1Low98 Ų98133.7 Ų133.751%0.51362%0.623SS.*Hα-helixtrans-71.3-20176.4-68.2176.4000113.7K92 I94 R100K92-L96 WeakPolarHBondContact O-CB 3.4Å; K92-L96 WeakPolarHBondContact O-CD1 3.47Å; K92-L96 VanDerWaalsContact O-CG 3.29Å; K92-L96 WeakPolarHBondContact O-CG 3.34Å; K92-L96 PolarHBondContact O-N 2.91Å; I94-L96 VanDerWaalsContact C-N 3.33Å; I94-L96 PolarHBondContact O-N 3.4Å; L96-R100 PolarHBondContact O-NH1 3.05Å
97R58.5Low58.1Low181 Ų181136 Ų13668%0.68363%0.628SS**Hα-helixtrans-84.1-40.3172.4-167.3177.5-173.1-173.12.1110.7R93 I94 E95 R100 N101R93-R97 WeakPolarHBondContact O-CB 3.43Å; R93-R97 PolarHBondContact O-N 3.41Å; I94-R97 CarbonylContact O-C 3.56Å; I94-R97 WeakPolarHBondContact O-CA 3.47Å; I94-R97 WeakPolarHBondContact O-CB 3.26Å; I94-R97 PolarHBondContact O-N 2.63Å; E95-R97 VanDerWaalsContact C-N 3.3Å; E95-R97 PolarHBondContact O-N 2.8Å; R97-R100 PolarHBondContact O-N 3.44Å; R97-N101 PolarHBondContact O-N 3.29Å; R97-N101 PolarHBondContact O-ND2 3.17Å
98E57.3Low57.6Low109 Ų109140 Ų14051%0.50965%0.65SS.*Hα-helixtrans-61.6-48.4177.7-172.6176.1173.500112I94 E95 R100 N101 L102I94-E98 WeakPolarHBondContact O-CB 3.48Å; I94-E98 PolarHBondContact O-N 3.3Å; E95-E98 PolarHBondContact O-N 2.66Å; E98-R100 PolarHBondContact O-N 3.37Å; E98-N101 PolarHBondContact O-N 3.31Å; E98-L102 PolarHBondContact O-N 3.46Å
99R60.2Low57.7Low170 Ų170145 Ų14564%0.64267%0.668SS**Hα-helixtrans-60.5-16.7175.1-75.7-164.3177.9107.514.1114.2E95E95-R99 PolarHBondContact O-N 3.04Å; E95-R99 IonicContact OE1-CZ 3.16Å; E95-R99 IonicContact OE1-NH1 2.65Å; E95-R99 PolarHBondContact OE1-NH1 3.41Å; E95-R99 IonicContact OE1-NH2 2.89Å; E95-R99 PolarHBondContact OE1-NH2 3.09Å
100R58.1Low57.4Low175 Ų175145.1 Ų145.166%0.6667%0.671SS**Hα-helixtrans-91.3-18.9171.9-66.7-175.4-177.8101.4-14114L96 R97 E98 S103L96-R100 PolarHBondContact O-NH1 3.05Å; R97-R100 PolarHBondContact O-N 3.44Å; E98-R100 PolarHBondContact O-N 3.37Å; R100-S103 PolarHBondContact O-OG 3.41Å
101N58.9Low57Low107 Ų107143.4 Ų143.457%0.57267%0.674SS**Hα-helixtrans-86.7-22.1-177.2-71.3-21.2000113.2R97 E98R97-N101 PolarHBondContact O-N 3.29Å; R97-N101 PolarHBondContact O-ND2 3.17Å; E98-N101 PolarHBondContact O-N 3.31Å
102L59.8Low56.5Low144 Ų144147.1 Ų147.175%0.75469%0.689SS**THydrogen-bonded Turntrans-81.8-14.1-178.6-62.7179000114.5E98E98-L102 PolarHBondContact O-N 3.46Å
103S61.3Low55.7Low99 Ų99147.5 Ų147.569%0.69271%0.706SS**THydrogen-bonded Turntrans-87.3-8.517853.50000114.4R100R100-S103 PolarHBondContact O-OG 3.41Å
104S58.3Low55.1Low89 Ų89141.1 Ų141.162%0.62270%0.704SS**  trans-110.351.6-172.1-171.10000114.2
105K60.7Low54.3Low194 Ų194141.5 Ų141.584%0.84372%0.715SS**  trans-129.371.3167.8-79.4-165.3173.4-174.60112.8
106R60.1Low53.4Low247 Ų247142.8 Ų142.893%0.93273%0.733SS**  trans-144.240.3172.2-69.6-164-1731350.3114.8
107N56.2Low52.9Low140 Ų140144.1 Ų144.175%0.74975%0.751SS**  trans-163.765.1173.356.7-21.5000114.9
108T44.4Very low52.4Low148 Ų148140.3 Ų140.391%0.90875%0.752SS**  trans-142.6144.3158-1.10000111.4
109K55.8Low52.1Low185 Ų185141.8 Ų141.880%0.80476%0.763SS**  trans-103.8164.1172.1-58.5174.1-177.6175.10108.4
110E51.3Low51.6Low177 Ų177136.7 Ų136.783%0.82776%0.758SS**  trans64.4161.9168.4-87.3170.4102.600115.2
111I47.1Very low51Low146 Ų146136.3 Ų136.375%0.74976%0.763SS**  cis-119.6167.25.4-64172.9000110.5
112Q46.5Very low50.1Low178 Ų178138.9 Ų138.983%0.83277%0.772SS**  trans-58.5153.1175.8-58.8153.7-34.800114.9
113S42.7Very low49.2Very low126 Ų126136.8 Ų136.888%0.88177%0.769SS**  trans-163131.8155.5-800000112.1
114G45.3Very low48.2Very low69 Ų69137.4 Ų137.471%0.71177%0.774SS**  trans74.194.4151.900000120.8
115S43.2Very low47.5Very low107 Ų107141.2 Ų141.275%0.74878%0.781SS**  trans62.9131.6134.7-52.50000123.3K271S115-K271 PolarHBondContact O-NZ 2.98Å
116S38.7Very low46.5Very low110 Ų110138.7 Ų138.777%0.76978%0.777SS**  178.4158.2109.8-830000110.8
117S47.1Very low45.9Very low126 Ų126131.9 Ų131.988%0.88176%0.759SS**  trans-90.3-163.3-170.449.10000115.5
118S47.7Very low45.5Very low100 Ų100133.2 Ų133.270%0.69976%0.758SS**  trans-104.4-162-151.360.60000116.8
119D51.4Low45.7Very low141 Ų141135.6 Ų135.675%0.75476%0.756SS**  trans76.5144.7169.3-73.340.6000118.7
120A49.4Very low45.3Very low63 Ų63136.9 Ų136.952%0.52176%0.762SS.*  cis-165.8169-20.800000108.5
121E45.4Very low45.5Very low167 Ų167138.1 Ų138.178%0.7876%0.764SS**  trans59.9160.7163.7-48.8-41.876.300118.9
122E38.8Very low45.4Very low161 Ų161139.7 Ų139.775%0.75277%0.769SS**  cis-165159.6-36.3-166.7-144.596.200107
123S41.2Very low45.6Very low100 Ų100141.5 Ų141.570%0.69977%0.768SS**  trans64.2154.6153.9148.10000119.9
124S40.8Very low45.7Very low112 Ų112141.6 Ų141.678%0.78376%0.763SS**  cis-144.6-177.5-8.461.80000111.9
125E42.9Very low45.8Very low168 Ų168144.2 Ų144.279%0.78577%0.77SS**  trans-81.6158.5-179.4-60.3160.47400115.6
126D39.8Very low45.8Very low142 Ų142144.1 Ų144.176%0.75977%0.77SS**  -155.8-175.8120.2-16114.9000111.6
127N48.8Very low45.9Very low104 Ų104147.7 Ų147.756%0.55677%0.772SS**  trans-131177-138-79.1-88.5000117.5
128K46.8Very low45.7Very low167 Ų167150.5 Ų150.573%0.72677%0.768SS**  trans89.5109.6155.9-65.9149.6-173.2159.20119.6
129K49.6Very low45.7Very low198 Ų198155.5 Ų155.586%0.86178%0.777SS**  44.5132.3117.7-57.7166.3-173.81760117.2
130K47.3Very low45.4Very low213 Ų213153 Ų15393%0.92678%0.776SS**  -167.4170.763-147.1172-176.7178.90112.1
131K55.5Low44.9Very low202 Ų202156.3 Ų156.388%0.87879%0.79SS**  trans-105.6152.2-177.3-52.5173.6-178.6176.90113.1
132Q44.2Very low45.2Very low179 Ų179155.8 Ų155.884%0.83679%0.79SS**  trans-166.5130.1137.5-99.4174.9200108
133R50.5Low45.6Very low217 Ų217154.4 Ų154.482%0.81979%0.793SS**  70.992.267.6-65.9-171.478.4152.92.3113
134T46.1Very low46Very low128 Ų128158.5 Ų158.579%0.78580%0.798SS**  77.6107.579.660.40000115.7
135S45.9Very low46.6Very low123 Ų123162.5 Ų162.586%0.8680%0.804SS**  trans-153.7173.9159.167.60000110.7
136S44.9Very low47Very low106 Ų106162.4 Ų162.474%0.74180%0.801SS**  -159.2156.1-121.662.60000118.7
137K39.9Very low47.4Very low185 Ų185164.5 Ų164.580%0.80480%0.804SS**  trans81.7149.2141.3-153.2178.3-175.3171.90118.3
138K43.5Very low47.7Very low184 Ų184170.4 Ų170.480%0.882%0.818SS**  trans77.5142.4170.3-48.5176.5-172.5173.10115.2
139K46.2Very low48.1Very low205 Ų205169.7 Ų169.789%0.89182%0.822SS**  cis-150.6157-18.5-122.2-161.4-179.3-168.90108.5
140A46.8Very low48.3Very low88 Ų88166 Ų16673%0.72782%0.821SS**  trans-95.2148.9177.700000112.4
141V38.1Very low48.3Very low134 Ų134163 Ų16381%0.81282%0.815SS**  trans-134.7129.8155.2175.70000107.2V143V141-V143 HydrophobicContact CG1-CG2 4.1Å
142I52.1Low48.1Very low155 Ų155164.2 Ų164.280%0.79581%0.814SS**  trans-120123.1172.3-62.8171.6000106.2
143V46.4Very low48.4Very low133 Ų133162.4 Ų162.481%0.80682%0.815SS**  trans-119.4136.6166.9-178.30000108V141V141-V143 HydrophobicContact CG1-CG2 4.1Å
144K50.4Low48.6Very low185 Ų185157.6 Ų157.680%0.80482%0.815SS**  trans-131.798-164.3171.7-169.6173.5-179.30108.5
145E54Low48.7Very low196 Ų196158.1 Ų158.192%0.91682%0.818SS**  trans-97.2151.4177.6-164.8158.9-17300112.4
146K50.7Low48.8Very low167 Ų167161.1 Ų161.173%0.72682%0.816SS**  trans-151.899.9-155.6172.2-139.8171.5-177.10112.2
147K48.3Very low49Very low186 Ų186167.5 Ų167.581%0.80982%0.823SS**  trans62.8148.6163.2-63.1-166.9174.2-170.20114.5
148R55.6Low49.4Very low228 Ų228166.1 Ų166.186%0.8682%0.817SS**  -164.816574.1-84160.8-74.71710.7112.7
149N53.9Low49.5Very low151 Ų151163.5 Ų163.581%0.80781%0.808SS**  trans-72.2155.6170.451.5-38.4000113.2
150S53.7Low49.4Very low120 Ų120158 Ų15884%0.83980%0.8SS**  trans-148.9151153.9-169.50000109.4
151L48.4Very low49.4Very low152 Ų152159.3 Ų159.380%0.79680%0.795SS**  trans-161.1132.6-171-132.1171.8000109.9
152R50.5Low50.4Low227 Ų227160.3 Ų160.386%0.85780%0.795SS**  trans67.1156.4-176.1-69.4172168.6171-5.6112.2
153T50.6Low49.9Very low141 Ų141159.3 Ų159.387%0.86580%0.796SS**  cis-135.5175.646.849.90000115.7
154S54.3Low49.4Very low115 Ų115158 Ų15880%0.80479%0.793SS**  trans-125.8148.7-176.355.20000111.5
155T48.4Very low49Very low139 Ų139154.7 Ų154.785%0.85379%0.793SS**  trans-136.9146.6179.3-46.80000112
156K48.6Very low48.3Very low187 Ų187150.9 Ų150.981%0.81379%0.788SS**  trans-157.5155-177.1-93.8-109.4-175.5-178.50112.4
157R49.3Very low47.9Very low239 Ų239147.4 Ų147.490%0.90278%0.784SS**  trans81.2156.2176.1-51.3172.8-69.9-174.81.1114.4
158K48.5Very low47.7Very low157 Ų157143.9 Ų143.968%0.68378%0.783SS**  cis-95.9180-5.6-86.4-77.7-119.2136.60111.7
159Q44.8Very low47.3Very low128 Ų128139.6 Ų139.660%0.59878%0.778SS**  cis89.493.5-5.5-173.6-104.9-34.800122.3D161Q159-D161 PolarHBondContact NE2-OD2 3.46Å
160A44.9Very low46.9Very low89 Ų89139.2 Ų139.274%0.73677%0.774SS**  trans-149.9142148.100000107
161D45Very low46.6Very low116 Ų116141.9 Ų141.962%0.6277%0.773SS**  cis76.6122.430.9-52.5-49.1000111.7Q159Q159-D161 PolarHBondContact NE2-OD2 3.46Å
162I60.6Low46.6Very low156 Ų156142.2 Ų142.280%0.878%0.776SS**  cis-156.2177.415.444.8170.3000112.1
163T41.6Very low46.7Very low134 Ų134137.7 Ų137.782%0.82277%0.768SS**  trans123.9153.1154.4-47.20000115.1
164S35.1Very low46.9Very low106 Ų106136.6 Ų136.674%0.74176%0.757SS**  trans-134.7159.7-152.2-46.60000117.4
165S42.6Very low47.5Very low114 Ų114139.8 Ų139.880%0.79776%0.76SS**  trans78.1110.9147.6-56.30000122.3
166S38.8Very low47.6Very low116 Ų116139.4 Ų139.481%0.81175%0.752SS**  trans166.3136.3146.9-74.70000106.9
167S43.5Very low48Very low94 Ų94136.1 Ų136.166%0.65775%0.753SS**  cis114.4119.314.967.10000111.5
168S43.4Very low48.4Very low112 Ų112132.9 Ų132.978%0.78375%0.752SS**  trans64.6153.8170.874.60000115.8
169D46Very low48.7Very low139 Ų139128.8 Ų128.874%0.74375%0.754SS**  cis-160.4178-11-134.1-46.4000111.8
170I47.5Very low49.2Very low143 Ų143132.6 Ų132.673%0.73377%0.772SS**  trans75.9147.3155.2-67.9156.3000120
171E47.3Very low49.5Very low175 Ų175131.7 Ų131.782%0.81877%0.772SS**  trans-50.2164.6178.5-54.3169.4136.500114.3
172D48.4Very low49.9Very low159 Ų159132 Ų13285%0.8578%0.782SS**  -170.8177.774.4-16313.7000114
173D51.3Low49.9Very low132 Ų132129.5 Ų129.571%0.70678%0.779SS**  trans89.2125.9152.4-152.521.2000121
174D55.8Low51Low118 Ų118128.8 Ų128.863%0.63177%0.77SS**  trans-52.6140.9-174.7-81.9-31000114.9
175Q65.9Low52.2Low183 Ų183129.8 Ų129.886%0.85576%0.763SS**  trans-124.581.2153.1-71.6-62.4-64.500110.8
176N51.6Low53.4Low130 Ų130131.1 Ų131.170%0.69576%0.757SS**  trans-56.9136.8164.748.880.9000111.9
177S55.8Low55Low118 Ų118133.5 Ų133.583%0.82575%0.753SS**  trans-169.2114.1137.2-158.20000111.2
178I59.1Low56.2Low172 Ų172136.4 Ų136.488%0.88276%0.759SS**  trans-70.2139.1167-164.775.4000108.9
179G53.9Low57.7Low71 Ų71139.6 Ų139.673%0.73276%0.759SS**  trans-134.1120.6-177.100000112.3
180E55.2Low58.7Low207 Ų207138.5 Ų138.597%0.96776%0.759SS**  trans-70.6150.3-172.3-60.5173.611100113.4
181G50.2Low59.7Low71 Ų71138.3 Ų138.373%0.73276%0.764SS**  trans173.536.1-178.400000116.3S183G181-S183 PolarHBondContact O-N 3.32Å; G181-S183 VanDerWaalsContact O-N 3.14Å
182S54.7Low60Low121 Ų121134.9 Ų134.985%0.84676%0.756SS**  trans-78.590.717755.20000111.7D184S182-D184 PolarHBondContact O-N 3.41Å; S182-D184 VanDerWaalsContact O-N 3.11Å
183S60.3Low60.8Low104 Ų104136.1 Ų136.173%0.72776%0.756SS**  trans-68.3103.4166.8-62.80000110.3G181 E185G181-S183 PolarHBondContact O-N 3.32Å; G181-S183 VanDerWaalsContact O-N 3.14Å; S183-E185 PolarHBondContact O-N 3.04Å
184D63.9Low61.2Low119 Ų119136.2 Ų136.264%0.63676%0.757SS**  trans-73.688.8175.6-174.921.4000110.6S182 Q186S182-D184 PolarHBondContact O-N 3.41Å; S182-D184 VanDerWaalsContact O-N 3.11Å; D184-Q186 PolarHBondContact O-N 3.4Å; D184-Q186 PolarHBondContact OD1-NE2 3.28Å; D184-Q186 WeakPolarHBondContact OD2-CG 3.22Å; D184-Q186 PolarHBondContact OD2-NE2 3.3Å
185E60.5Low61.3Low127 Ų127138.4 Ų138.459%0.59377%0.768SS**  trans-7370.6175.4-67.7174.5-166.100110.3S183 K187S183-E185 PolarHBondContact O-N 3.04Å; E185-K187 VanDerWaalsContact C-N 3.31Å; E185-K187 WeakPolarHBondContact O-CG 3.21Å; E185-K187 PolarHBondContact O-N 2.89Å; E185-K187 IonicContact OE2-NZ 3.94Å
186Q69.3Low60.9Low142 Ų142134.9 Ų134.966%0.66476%0.758SS**  trans-58.886.5173.6-72.8-75.8-15.600110.9D184 I188D184-Q186 PolarHBondContact O-N 3.4Å; D184-Q186 PolarHBondContact OD1-NE2 3.28Å; D184-Q186 WeakPolarHBondContact OD2-CG 3.22Å; D184-Q186 PolarHBondContact OD2-NE2 3.3Å; Q186-I188 VanDerWaalsContact C-N 3.28Å; Q186-I188 PolarHBondContact O-N 3.46Å
187K70.4Confident61.2Low167 Ų167135.5 Ų135.573%0.72676%0.761SS**  trans-74.880.8179-71.9178.6-171.1-178.30110.6E185 K189E185-K187 VanDerWaalsContact C-N 3.31Å; E185-K187 WeakPolarHBondContact O-CG 3.21Å; E185-K187 PolarHBondContact O-N 2.89Å; E185-K187 IonicContact OE2-NZ 3.94Å; K187-K189 PolarHBondContact O-N 2.65Å
188I69.3Low60.9Low154 Ų154135.3 Ų135.379%0.7976%0.759SS**  trans-54.1109.1162-57.5176.4000106.9Q186Q186-I188 VanDerWaalsContact C-N 3.28Å; Q186-I188 PolarHBondContact O-N 3.46Å
189K75.8Confident60.7Low179 Ų179131.7 Ų131.778%0.77875%0.75SS**  trans-68127165.8-63.1176.6-176.2174.30106.2K187 V191K187-K189 PolarHBondContact O-N 2.65Å; K189-V191 PolarHBondContact O-N 3.48Å; K189-V191 VanDerWaalsContact O-N 3.1Å
190P65.6Low60.8Low116 Ų116137.7 Ų137.775%0.75376%0.758SS**  trans-59.8120.7167.425.8-32000107.5T192P190-T192 PolarHBondContact O-N 3.42Å; P190-T192 VanDerWaalsContact O-N 3.12Å
191V68.6Low60.9Low139 Ų139133.9 Ų133.984%0.84275%0.749SS**  trans-69.4108.3169.3176.80000105.8K189 E193K189-V191 PolarHBondContact O-N 3.48Å; K189-V191 VanDerWaalsContact O-N 3.1Å; V191-E193 PolarHBondContact O-N 3.37Å
192T54.9Low61Low104 Ų104133.4 Ų133.464%0.63874%0.744SS**  trans-55.4131.4176.1460000109.5P190 N194P190-T192 PolarHBondContact O-N 3.42Å; P190-T192 VanDerWaalsContact O-N 3.12Å; T192-N194 PolarHBondContact O-N 3.47Å
193E64.3Low60.6Low185 Ų185135.7 Ų135.786%0.86474%0.739SS**SBendtrans-72.245.5-168.562.1-144.313200115V191 L195V191-E193 PolarHBondContact O-N 3.37Å; E193-L195 PolarHBondContact O-N 2.92Å
194N59.9Low59.8Low134 Ų134136.1 Ų136.172%0.71774%0.741SS**  trans-83.112.2178.4-70.7-3000113.5T192 V196T192-N194 PolarHBondContact O-N 3.47Å; N194-V196 PolarHBondContact O-N 2.91Å
195L57.9Low59.5Low163 Ų163138 Ų13885%0.85375%0.746SS**  trans-83.361.9161.9-166.462.8000109.4E193 L197E193-L195 PolarHBondContact O-N 2.92Å; L195-L197 PolarHBondContact O-N 3.3Å
196V58.9Low59.1Low109 Ų109136.8 Ų136.866%0.66175%0.752SS**  trans-54.4121.9170.4169.50000108.4N194N194-V196 PolarHBondContact O-N 2.91Å
197L56.1Low58.4Low143 Ų143135.4 Ų135.475%0.74976%0.758SS**  trans52.485.6166.2-56.6171.8000114.5L195 S199L195-L197 PolarHBondContact O-N 3.3Å; L197-S199 PolarHBondContact O-N 3.17Å
198S51.1Low57.7Low114 Ų114131.7 Ų131.780%0.79777%0.767SS**  trans-56.5111.4149.3-170.90000107.4H200S198-H200 PolarHBondContact O-N 2.95Å
199S54.9Low57.4Low97 Ų97131.2 Ų131.268%0.67877%0.766SS**  trans-63.5104.2-161.5-600000112.4L197 T201L197-S199 PolarHBondContact O-N 3.17Å; S199-T201 PolarHBondContact O-N 3.41Å
200H55.1Low56.4Low197 Ų197130.4 Ų130.491%0.91277%0.765SS**  trans-72.368171.3-173.5-70000110.5S198S198-H200 PolarHBondContact O-N 2.95Å
201T57Low55.5Low127 Ų127128.5 Ų128.578%0.77976%0.759SS**  trans-13478.9168.8-174.20000108S199S199-T201 PolarHBondContact O-N 3.41Å
202G52.5Low54.5Low61 Ų61129.7 Ų129.763%0.62976%0.76SS**  trans-139.532.3-175.200000111.7C204G202-C204 PolarHBondContact O-N 3.4Å
203F46.1Very low53.9Low169 Ų169130.8 Ų130.874%0.74177%0.772SS**  trans-78.574.3178.5-167.7-115.2000109.7Q205F203-Q205 HydrophobicContact CD1-CG 3.99Å; F203-Q205 HydrophobicContact CE1-CB 4.46Å; F203-Q205 HydrophobicContact CE1-CG 3.54Å; F203-Q205 HydrophobicContact CZ-CG 3.89Å; F203-Q205 PolarHBondContact O-N 3.46Å
204C43Very low53.3Low113 Ų113131.7 Ų131.776%0.76477%0.773SS**  trans-73.268.3-178.2-650000112.2G202 S206G202-C204 PolarHBondContact O-N 3.4Å; C204-S206 VanDerWaalsContact C-N 3.26Å; C204-S206 PolarHBondContact O-N 2.75Å
205Q57.7Low52.7Low157 Ų157130.5 Ų130.573%0.73478%0.775SS**  trans-75.680.4161.2-79.3-169.5-23.800109.9F203F203-Q205 HydrophobicContact CD1-CG 3.99Å; F203-Q205 HydrophobicContact CE1-CB 4.46Å; F203-Q205 HydrophobicContact CE1-CG 3.54Å; F203-Q205 HydrophobicContact CZ-CG 3.89Å; F203-Q205 PolarHBondContact O-N 3.46Å
206S52.1Low52.4Low103 Ų103128 Ų12872%0.7277%0.767SS**  trans-108.697.8170-64.60000109.9C204 G208C204-S206 VanDerWaalsContact C-N 3.26Å; C204-S206 PolarHBondContact O-N 2.75Å; S206-G208 PolarHBondContact O-N 3.1Å
207S55.3Low51.7Low113 Ų113128.7 Ų128.779%0.7977%0.773SS**  trans1798.2155.456.10000117.2D209S207-D209 PolarHBondContact O-N 2.77Å
208G56.5Low51.5Low89 Ų89127.7 Ų127.792%0.91877%0.773SS**  trans-74106.6155.200000108.9S206S206-G208 PolarHBondContact O-N 3.1Å
209D61.4Low51.4Low143 Ų143128.2 Ų128.277%0.76577%0.771SS**  trans-85.9172.2178.4-1619.8000111.6S207S207-D209 PolarHBondContact O-N 2.77Å
210E56.5Low51.4Low162 Ų162129.9 Ų129.976%0.75778%0.777SS**  trans69.595.2170.4-65.2-75.867.400118.7
211A45.2Very low51.2Low77 Ų77127.4 Ų127.464%0.63677%0.77SS**  73.2110.1123.100000122
212L47.8Very low51.3Low164 Ų164128.3 Ų128.386%0.85977%0.771SS**  trans64.5106.6135.4-54173.5000119.8
213S43.7Very low51.5Low127 Ų127132 Ų13289%0.88878%0.776SS**  -177.5157.2104.8-840000115
214K50.8Low52.2Low203 Ų203130.6 Ų130.688%0.88378%0.776SS**  trans-83.7139.1-170.1-54.4154.6-174.7172.20112.1
215S47.9Very low53.1Low110 Ų110132.3 Ų132.377%0.76978%0.778SS**  140.6156.6125.667.20000116.2
216V50.6Low53.5Low111 Ų111131.1 Ų131.167%0.67378%0.777SS**  trans64.8101.2169.3-166.80000117.5V218V216-V218 HydrophobicContact CG1-CG2 4.04Å
217P45Very low53.9Low123 Ų123132.6 Ų132.680%0.79978%0.776SS**PPolyproline II helixtrans-74.5125.8148.631.9-29.8000109.4
218V51.5Low54.5Low122 Ų122131.2 Ų131.274%0.73976%0.76SS**PPolyproline II helixtrans-86.2130.1169.2170.30000108.8V216V216-V218 HydrophobicContact CG1-CG2 4.04Å
219T48.8Very low54.9Low125 Ų125131.4 Ų131.477%0.76775%0.745SS**PPolyproline II helixtrans-82.3123.218048.70000112.2
220V56Low55Low131 Ų131132.3 Ų132.379%0.79475%0.745SS**  trans-146.6102.4153.2-114.20000103.1
221D49.4Very low55.2Low145 Ų145128.4 Ų128.478%0.77573%0.729SS**  cis61.470.843.9-134.962.8000107.4
222D58.6Low55.8Low147 Ų147132.2 Ų132.279%0.78673%0.727SS**  94.2173.278.2-157.710.1000109.9
223D56.8Low56.2Low139 Ų139132.2 Ų132.274%0.74372%0.717SS**  trans66.897.3-176-73.8-17.1000118.2
224D60.7Low56.9Low139 Ų139130 Ų13074%0.74370%0.695SS**  52.9142.5118.5-76.5-7.7000125.7D226D224-D226 PolarHBondContact O-N 2.81Å; D224-D226 VanDerWaalsContact O-N 3.1Å
225D62.6Low57.4Low149 Ų149123.4 Ų123.480%0.79767%0.674SS**  trans60.211144.4-84.5-7000123.1N227D225-N227 PolarHBondContact O-N 3.02Å
226D65.4Low58Low132 Ų132122.7 Ų122.771%0.70666%0.661SS**THydrogen-bonded Turntrans-73.334174.4-139.86.7000114.7D224 N231D224-D226 PolarHBondContact O-N 2.81Å; D224-D226 VanDerWaalsContact O-N 3.1Å; D226-N231 PolarHBondContact OD1-ND2 3.33Å
227N61.7Low58.4Low134 Ų134120.5 Ų120.572%0.71765%0.65SS**THydrogen-bonded Turntrans-102.613.9174.1-159.827.8000113.1D225 P229D225-N227 PolarHBondContact O-N 3.02Å; N227-P229 WeakPolarHBondContact O-CD 3.43Å
228D67.3Low59.1Low84 Ų84118.9 Ų118.945%0.44963%0.63SS.*  trans-66.3120.6171.1-171.9-24.6000110.7E230D228-E230 VanDerWaalsContact C-N 3.26Å; D228-E230 PolarHBondContact O-N 3.2Å; D228-E230 WeakPolarHBondContact OD1-CB 3.29Å; D228-E230 PolarHBondContact OD1-N 3.25Å
229P65.9Low59.5Low93 Ų93116.8 Ų116.860%0.60462%0.615SS**Hα-helixtrans-66.3-22.5178.528.3-35.9000114N227 Y233N227-P229 WeakPolarHBondContact O-CD 3.43Å; P229-Y233 VanDerWaalsContact O-CD2 3.29Å; P229-Y233 WeakPolarHBondContact O-CD2 3.43Å
230E63.6Low60Low161 Ų161117.4 Ų117.475%0.75261%0.607SS**Hα-helixtrans-73.6-36.5-174-165.9157.3-15100112D228 R232D228-E230 VanDerWaalsContact C-N 3.26Å; D228-E230 PolarHBondContact O-N 3.2Å; D228-E230 WeakPolarHBondContact OD1-CB 3.29Å; D228-E230 PolarHBondContact OD1-N 3.25Å; E230-R232 VanDerWaalsContact C-N 3.32Å; E230-R232 PolarHBondContact O-N 3.27Å
231N58.8Low60.2Low81 Ų81117.9 Ų117.943%0.43360%0.598SS.*Hα-helixtrans-67.9-28.4179.4-16420.2000113.1D226 Y233 D234D226-N231 PolarHBondContact OD1-ND2 3.33Å; N231-Y233 PolarHBondContact O-N 3.24Å; N231-D234 PolarHBondContact O-N 3.16Å
232R58.2Low60.8Low157 Ų157117.9 Ų117.959%0.59259%0.592SS**Hα-helixtrans-66.9-35.7-172.9-170.2171.4-66.2173.45114.1E230E230-R232 VanDerWaalsContact C-N 3.32Å; E230-R232 PolarHBondContact O-N 3.27Å
233Y56.6Low60.8Low163 Ų163116.6 Ų116.664%0.63958%0.583SS**Hα-helixtrans-81.7-28.3-177.9-64.6-81.6000112.8P229 N231 S235 I236 C237P229-Y233 VanDerWaalsContact O-CD2 3.29Å; P229-Y233 WeakPolarHBondContact O-CD2 3.43Å; N231-Y233 PolarHBondContact O-N 3.24Å; Y233-S235 VanDerWaalsContact C-N 3.35Å; Y233-S235 PolarHBondContact O-N 2.94Å; Y233-I236 PolarHBondContact O-N 3Å; Y233-C237 PolarHBondContact O-N 3.24Å
234D59.3Low61Low82 Ų82116.7 Ų116.744%0.43958%0.582SS.*Hα-helixtrans-71-31.2-169.5-160.132.8000112.2N231 C237 K238N231-D234 PolarHBondContact O-N 3.16Å; D234-C237 PolarHBondContact O-N 3.42Å; D234-K238 VanDerWaalsContact CG-NZ 3.29Å; D234-K238 WeakPolarHBondContact O-CD 3.43Å; D234-K238 WeakPolarHBondContact O-CE 3.37Å; D234-K238 WeakPolarHBondContact O-CG 3.5Å; D234-K238 PolarHBondContact O-N 3.48Å; D234-K238 WeakPolarHBondContact OD2-CE 3.29Å; D234-K238 IonicContact OD2-NZ 2.63Å; D234-K238 PolarHBondContact OD2-NZ 3.48Å
235S59.9Low60.8Low63 Ų63114.8 Ų114.844%0.44158%0.576SS.*Hα-helixtrans-61.5-47.9171.4-67.80000112.8Y233 C237 K238 D239Y233-S235 VanDerWaalsContact C-N 3.35Å; Y233-S235 PolarHBondContact O-N 2.94Å; S235-C237 VanDerWaalsContact C-N 3.28Å; S235-C237 PolarHBondContact O-N 3.28Å; S235-K238 WeakPolarHBondContact O-CB 3.36Å; S235-K238 PolarHBondContact O-N 3.19Å; S235-D239 PolarHBondContact O-N 3.25Å
236I60.9Low60.1Low96 Ų96116 Ų11649%0.49258%0.577SS.*Hα-helixtrans-59.6-41.7179.1-56.9173.6000110.3Y233 K238 D239 F240Y233-I236 PolarHBondContact O-N 3Å; I236-K238 VanDerWaalsContact C-N 3.26Å; I236-K238 PolarHBondContact O-N 2.8Å; I236-D239 PolarHBondContact O-N 3.32Å; I236-F240 HydrophobicContact CG2-CD2 4.21Å; I236-F240 HydrophobicContact CG2-CE2 3.83Å; I236-F240 WeakPolarHBondContact O-CD2 3.46Å
237C58.7Low59.6Low65 Ų65115.3 Ų115.344%0.43958%0.579SS.*Hα-helixtrans-70.1-14.9178.6-68.20000114.8Y233 D234 S235 K241Y233-C237 PolarHBondContact O-N 3.24Å; D234-C237 PolarHBondContact O-N 3.42Å; S235-C237 VanDerWaalsContact C-N 3.28Å; S235-C237 PolarHBondContact O-N 3.28Å; C237-K241 VanDerWaalsContact O-CD 3.26Å; C237-K241 WeakPolarHBondContact O-CD 3.45Å; C237-K241 VanDerWaalsContact O-CE 3.29Å; C237-K241 WeakPolarHBondContact O-CE 3.48Å; C237-K241 WeakPolarHBondContact O-CG 3.29Å
238K61Low59.2Low89 Ų89121 Ų12139%0.38759%0.591SS.*Hα-helixtrans-84.7-37176.3-69.9156.6-163.1163.60111.8D234 S235 I236 K241 K242D234-K238 VanDerWaalsContact CG-NZ 3.29Å; D234-K238 WeakPolarHBondContact O-CD 3.43Å; D234-K238 WeakPolarHBondContact O-CE 3.37Å; D234-K238 WeakPolarHBondContact O-CG 3.5Å; D234-K238 PolarHBondContact O-N 3.48Å; D234-K238 WeakPolarHBondContact OD2-CE 3.29Å; D234-K238 IonicContact OD2-NZ 2.63Å; D234-K238 PolarHBondContact OD2-NZ 3.48Å; S235-K238 WeakPolarHBondContact O-CB 3.36Å; S235-K238 PolarHBondContact O-N 3.19Å; I236-K238 VanDerWaalsContact C-N 3.26Å; I236-K238 PolarHBondContact O-N 2.8Å; K238-K241 PolarHBondContact O-N 2.83Å; K238-K242 PolarHBondContact O-N 3.06Å
239D59.4Low58.4Low78 Ų78124.2 Ų124.242%0.41760%0.603SS.*Hα-helixtrans-75.7-40.2-173.8-71.7-30.8000113.9S235 I236 K241 K242 I243S235-D239 PolarHBondContact O-N 3.25Å; I236-D239 PolarHBondContact O-N 3.32Å; D239-K241 PolarHBondContact O-N 3.45Å; D239-K241 VanDerWaalsContact O-N 3.16Å; D239-K242 WeakPolarHBondContact O-CB 3.49Å; D239-K242 PolarHBondContact O-N 3.49Å; D239-K242 WeakPolarHBondContact OD1-CD 3.32Å; D239-K242 WeakPolarHBondContact OD1-CE 3.32Å; D239-K242 IonicContact OD1-NZ 2.66Å; D239-K242 PolarHBondContact OD1-NZ 2.95Å; D239-I243 PolarHBondContact O-N 3.02Å
240F58.5Low57.4Low137 Ų137123 Ų12360%0.60161%0.607SS**Hα-helixtrans-59.5-28.5173.1-72.8-69.3000113.2I236 I243I236-F240 HydrophobicContact CG2-CD2 4.21Å; I236-F240 HydrophobicContact CG2-CE2 3.83Å; I236-F240 WeakPolarHBondContact O-CD2 3.46Å; F240-I243 HydrophobicContact CD1-CD1 4.45Å
241K61.2Low56.9Low141 Ų141123.6 Ų123.661%0.61361%0.609SS**Hα-helixtrans-73.9-31.3175.8-66.9171.7-173159.40112.8C237 K238 D239 T245C237-K241 VanDerWaalsContact O-CD 3.26Å; C237-K241 WeakPolarHBondContact O-CD 3.45Å; C237-K241 VanDerWaalsContact O-CE 3.29Å; C237-K241 WeakPolarHBondContact O-CE 3.48Å; C237-K241 WeakPolarHBondContact O-CG 3.29Å; K238-K241 PolarHBondContact O-N 2.83Å; D239-K241 PolarHBondContact O-N 3.45Å; D239-K241 VanDerWaalsContact O-N 3.16Å; K241-T245 PolarHBondContact O-OG1 3.31Å; K241-T245 VanDerWaalsContact O-OG1 3.09Å
242K60.8Low56.7Low146 Ų146129.3 Ų129.364%0.63563%0.63SS**Hα-helixtrans-66.3-44.3173.7-64171.7-170.9162.80111K238 D239 I244 T245K238-K242 PolarHBondContact O-N 3.06Å; D239-K242 WeakPolarHBondContact O-CB 3.49Å; D239-K242 PolarHBondContact O-N 3.49Å; D239-K242 WeakPolarHBondContact OD1-CD 3.32Å; D239-K242 WeakPolarHBondContact OD1-CE 3.32Å; D239-K242 IonicContact OD1-NZ 2.66Å; D239-K242 PolarHBondContact OD1-NZ 2.95Å; K242-I244 VanDerWaalsContact C-N 3.33Å; K242-I244 PolarHBondContact O-N 2.95Å; K242-T245 PolarHBondContact O-N 2.79Å
243I59.4Low56.3Low119 Ų119131.3 Ų131.361%0.6165%0.646SS**Hα-helixtrans-61-39.3-176.2-64.5168.7000112.2D239 F240 T245D239-I243 PolarHBondContact O-N 3.02Å; F240-I243 HydrophobicContact CD1-CD1 4.45Å; I243-T245 VanDerWaalsContact C-N 3.34Å; I243-T245 PolarHBondContact O-N 3.27Å
244I60.3Low56.3Low141 Ų141132.7 Ų132.772%0.72366%0.658SS**Hα-helixtrans-76-19.8-175.4-65.8170.2000112.8K242K242-I244 VanDerWaalsContact C-N 3.33Å; K242-I244 PolarHBondContact O-N 2.95Å
245T57.4Low56.1Low99 Ų99136.1 Ų136.161%0.60767%0.672SS**  trans-117.172.4-165-41.50000112.8K241 K242 I243 P247K241-T245 PolarHBondContact O-OG1 3.31Å; K241-T245 VanDerWaalsContact O-OG1 3.09Å; K242-T245 PolarHBondContact O-N 2.79Å; I243-T245 VanDerWaalsContact C-N 3.34Å; I243-T245 PolarHBondContact O-N 3.27Å; T245-P247 VanDerWaalsContact O-CD 3.23Å; T245-P247 WeakPolarHBondContact O-CD 3.5Å
246H47.4Very low55.7Low176 Ų176144.4 Ų144.482%0.81569%0.693SS**  trans-58116171.4-69.4-57000111.5R248H246-R248 PolarHBondContact O-N 3.1Å
247P55Low55.6Low116 Ų116146.4 Ų146.475%0.75371%0.705SS**  trans-88.3108.6-175.532.7-30.4000111.2T245 H249T245-P247 VanDerWaalsContact O-CD 3.23Å; T245-P247 WeakPolarHBondContact O-CD 3.5Å; P247-H249 PolarHBondContact O-N 3.37Å
248R53.5Low55.3Low254 Ų254147.8 Ų147.896%0.95872%0.716SS**  trans-72.881.8159.6-69-163.180.1163.34.7109.4H246H246-R248 PolarHBondContact O-N 3.1Å
249H49.4Very low55.2Low152 Ų152153.4 Ų153.470%0.70474%0.74SS**  trans9.9115.8163.4-156.18000117.6P247 H251P247-H249 PolarHBondContact O-N 3.37Å; H249-H251 AromaticContact CE1-CD2 3.28Å; H249-H251 PolarHBondContact CE1-CD2 3.05Å; H249-H251 AromaticContact CE1-NE2 3.54Å; H249-H251 AromaticContact NE2-CD2 3.88Å
250G45.9Very low54.7Low67 Ų67157.1 Ų157.169%0.69176%0.755SS**  trans-134.4107165.200000111.3K252G250-K252 PolarHBondContact O-N 2.76Å
251H53.3Low54.5Low174 Ų174156.8 Ų156.881%0.80676%0.764SS**PPolyproline II helixtrans-71.1125.8168.4-99.9-78.2000109.8H249H249-H251 AromaticContact CE1-CD2 3.28Å; H249-H251 PolarHBondContact CE1-CD2 3.05Å; H249-H251 AromaticContact CE1-NE2 3.54Å; H249-H251 AromaticContact NE2-CD2 3.88Å
252K54.3Low53.9Low201 Ų201154.8 Ų154.887%0.87476%0.763SS**PPolyproline II helixtrans-84.2127.7171.9-63.2178.2-178.3175.70109.3G250G250-K252 PolarHBondContact O-N 2.76Å
253Q50.3Low53.7Low198 Ų198156.9 Ų156.993%0.92577%0.772SS**PPolyproline II helixtrans-87.6158162.3-115.3-177.50.500110.8
254Q56.8Low53.6Low192 Ų192156.8 Ų156.890%0.89778%0.778SS**PPolyproline II helixtrans-77.3165.7-163.8-72.5172.9-41.200114.8
255Q53.8Low53.2Low155 Ų155161 Ų16172%0.72478%0.784SS**PPolyproline II helixtrans-57.1147.7179.6-62.5-177.3-2.900113.5N257Q255-N257 PolarHBondContact OE1-ND2 2.77Å
256R52.6Low53Low236 Ų236162.4 Ų162.489%0.89180%0.798SS**  trans-133.2114.7148.2-75.1-171.2168.7152.8-1.4109.7S258R256-S258 VanDerWaalsContact C-N 3.31Å; R256-S258 PolarHBondContact O-N 3.12Å
257N59.4Low53.2Low138 Ų138158.8 Ų158.874%0.73880%0.799SS**  trans-82.171.6-175.9-64.9-34.4000111.2Q255 K259Q255-N257 PolarHBondContact OE1-ND2 2.77Å; N257-K259 PolarHBondContact O-N 3.48Å
258S52.2Low52.9Low94 Ų94158 Ų15866%0.65780%0.795SS**  trans-84.4102.3179.956.90000112.3R256 Q260R256-S258 VanDerWaalsContact C-N 3.31Å; R256-S258 PolarHBondContact O-N 3.12Å; S258-Q260 PolarHBondContact O-N 3.11Å
259K57.5Low52.8Low208 Ų208154.5 Ų154.590%0.90479%0.794SS**  trans-67.494166.4-66.3177-179.7175.30109.8N257N257-K259 PolarHBondContact O-N 3.48Å
260Q49.6Very low52.9Low156 Ų156157.1 Ų157.173%0.72980%0.798SS**  trans-108.5113.6168.9-72.7-159.46.800111.7S258 V262S258-Q260 PolarHBondContact O-N 3.11Å; Q260-V262 HydrophobicContact CB-CG2 4.17Å; Q260-V262 PolarHBondContact O-N 2.87Å
261V55Low53.1Low130 Ų130162 Ų16279%0.78880%0.8SS**  trans-81.886.9170.1179.50000108.6K263V261-K263 HydrophobicContact CG1-CG 4.28Å; V261-K263 PolarHBondContact O-N 2.86Å; V261-K263 VanDerWaalsContact O-N 3.1Å
262V48Very low53.3Low98 Ų98160.4 Ų160.459%0.59480%0.803SS**  trans-81.388.3177.5-176.80000110.1Q260 T264Q260-V262 HydrophobicContact CB-CG2 4.17Å; Q260-V262 PolarHBondContact O-N 2.87Å; V262-T264 HydrophobicContact CG1-CG2 3.7Å; V262-T264 PolarHBondContact O-N 3.01Å; V262-T264 VanDerWaalsContact O-N 3.14Å
263K57.1Low52.9Low190 Ų190160.9 Ų160.983%0.82680%0.799SS**  trans-75.287.9168.3-77.9-178.8177.1177.20110.6V261V261-K263 HydrophobicContact CG1-CG 4.28Å; V261-K263 PolarHBondContact O-N 2.86Å; V261-K263 VanDerWaalsContact O-N 3.1Å
264T57Low52.7Low118 Ų118156.7 Ų156.772%0.72479%0.792SS**  trans-109.982.2172.445.90000112.8V262V262-T264 HydrophobicContact CG1-CG2 3.7Å; V262-T264 PolarHBondContact O-N 3.01Å; V262-T264 VanDerWaalsContact O-N 3.14Å
265R51.3Low52.6Low228 Ų228155.2 Ų155.286%0.8679%0.785SS**  trans24.6114.3145.1-55.7176.177.4175.16117.1
266S53.1Low52.2Low130 Ų130153.4 Ų153.491%0.90979%0.789SS**  trans-54.9135.3150.240.70000110.7
267A52.4Low52Low99 Ų99147.3 Ų147.382%0.81878%0.783SS**  trans-143.3153.3172.500000109.4
268C48.7Very low51.3Low101 Ų101146.7 Ų146.768%0.68279%0.788SS**  trans-80.3145.3-164.8600000114.7
269L50.2Low51.1Low179 Ų179152 Ų15294%0.93780%0.799SS**  trans-114.3116.4145.4-75.9173.4000108.2
270R51.4Low50.3Low207 Ų207150.2 Ų150.278%0.78179%0.792SS**  trans-73140.1-172.2-72.8177.9162.8-166.4-8.5111.5T272R270-T272 PolarHBondContact O-N 3.14Å
271K51.9Low50.3Low171 Ų171151.8 Ų151.874%0.74380%0.799SS**  trans-68.2106.8170.3-71.3174.3179.4168.70110.2S115 R273S115-K271 PolarHBondContact O-NZ 2.98Å; K271-R273 PolarHBondContact O-N 2.8Å; K271-R273 VanDerWaalsContact O-N 3.08Å
272T56.8Low50Low140 Ų140155.5 Ų155.586%0.85980%0.799SS**  trans-8084171.741.60000111.5R270 S274R270-T272 PolarHBondContact O-N 3.14Å; T272-S274 PolarHBondContact O-N 3.44Å
273R45.3Very low50Low211 Ų211160.7 Ų160.780%0.79681%0.813SS**  trans-7287.7174.8-178.7-172.8172.6-169.5-1.7111K271 Q275K271-R273 PolarHBondContact O-N 2.8Å; K271-R273 VanDerWaalsContact O-N 3.08Å; R273-Q275 PolarHBondContact O-N 2.71Å
274S47Very low49.4Very low109 Ų109156 Ų15676%0.76281%0.811SS**  trans-64.2129.2169.5-172.20000110.8T272T272-S274 PolarHBondContact O-N 3.44Å
275Q54Low49.1Very low161 Ų161162.7 Ų162.775%0.75282%0.823SS**  trans-104.4113179.5-60.1-173.521.900110.4R273R273-Q275 PolarHBondContact O-N 2.71Å
276S46.1Very low49.2Very low117 Ų117160.3 Ų160.382%0.81882%0.818SS**  trans-148.834.3175.858.50000114.1
277S47.6Very low48.9Very low109 Ų109165.5 Ų165.576%0.76282%0.818SS**  trans-130.6158.116860.50000111.4
278C46.1Very low48.8Very low125 Ų125165.1 Ų165.185%0.84582%0.815SS**  trans63.972.7177.5-620000117.1
279K46Very low48.9Very low204 Ų204170.2 Ų170.289%0.88783%0.826SS**SBendtrans-125.8127.2138.4-74-170.2178.1178.60110.3
280F40.9Very low48.8Very low171 Ų171167.1 Ų167.175%0.7581%0.814SS**  trans66.457.6169.7-93.5-92.3000119.8R282F280-R282 VanDerWaalsContact C-N 3.29Å; F280-R282 HydrophobicContact CD1-CB 3.95Å; F280-R282 HydrophobicContact CE1-CB 3.97Å; F280-R282 PolarHBondContact O-N 3.1Å; F280-R282 VanDerWaalsContact O-N 3.16Å
281E50Low48.5Very low190 Ų190165.9 Ų165.989%0.88882%0.817SS**  trans-70.491.9135.1-175.5-177.8-163.600109
282R49.8Very low48.3Very low208 Ų208166.2 Ų166.279%0.78582%0.819SS**  trans-173.2141.1162-104.3154.4-164.3-161.54.1110.4F280F280-R282 VanDerWaalsContact C-N 3.29Å; F280-R282 HydrophobicContact CD1-CB 3.95Å; F280-R282 HydrophobicContact CE1-CB 3.97Å; F280-R282 PolarHBondContact O-N 3.1Å; F280-R282 VanDerWaalsContact O-N 3.16Å
283K47.3Very low48.3Very low206 Ų206168.3 Ų168.390%0.89684%0.835SS**  trans75.268.7178-55.7-178.2178.5178.70117.6
284A44Very low48.4Very low93 Ų93166.2 Ų166.277%0.76984%0.837SS**  trans-138.112.6153.900000114.8K286A284-K286 PolarHBondContact O-N 2.73Å
285R51.1Low48.5Very low258 Ų258169.2 Ų169.297%0.97484%0.841SS**  trans-77.248.7167.5-74.9-166.1177.2-150.72112.2
286K53.7Low48.2Very low177 Ų177169.6 Ų169.677%0.7785%0.845SS**  trans-156117.3164.5-62.9-169-179.8-170.60103.1A284A284-K286 PolarHBondContact O-N 2.73Å
287W45.7Very low48.3Very low239 Ų239172.7 Ų172.791%0.90585%0.847SS**  cis-126.4112.834.2-55.8-67.2000114.4
288A51.2Low48.4Very low92 Ų92176.7 Ų176.776%0.7685%0.852SS**SBendtrans-120.5138.6146.100000106.6
289K51.3Low48.5Very low208 Ų208180.1 Ų180.190%0.90485%0.853SS**SBendtrans65.174-175.9-56.6-176.4177.1-176.30117
290T47Very low48.7Very low113 Ų113178.4 Ų178.469%0.69385%0.85SS**  trans-175.4126.1140.239.60000107.1
291Q45.8Very low49.3Very low181 Ų181179 Ų17985%0.84686%0.858SS**  cis-151.1154.9-3.1-130.4177.52.500108.7
292K47.9Very low49.3Very low179 Ų179178.1 Ų178.178%0.77886%0.856SS**  trans-80151.1150-84.2-166.6176.1-167.60107.5
293P56.6Low49.2Very low183 Ų183175.4 Ų175.4100%1.18886%0.862SS**  -82.5059.9-23.837.2000115.7

Retrieved 293 of 293 residues in 32.1 ms (Link to these results)