A0A087Y3X2_POEFO Loading...

RNA polymerase III subunit D

AlphaFold DB , UniProt , Accession A0A087Y3X2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 387 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M39.6Very low38.7Very low239 Ų239141.5 Ų141.5100%1.17784%0.841SS**  0930-71.3177.6163.100105.3
2A39Very low38.7Very low100 Ų100136.9 Ų136.983%0.82683%0.83SS**  59.9119.988.200000110.1
3D36.1Very low39.2Very low144 Ų144136.3 Ų136.377%0.7783%0.831SS**  -171.7125.755.9-158.922.8000108.7
4S46.8Very low39.1Very low106 Ų106132.9 Ų132.974%0.74182%0.824SS**  55.1113.591.9-21.40000115.9
5G38.5Very low39.9Very low78 Ų78133 Ų13380%0.80483%0.827SS**  118.3156100.700000109.7
6D41.3Very low39.4Very low147 Ų147130.1 Ų130.179%0.78683%0.831SS**  cis-169.2174.52.5-144.3-5.4000110.5
7H43Very low39.1Very low172 Ų172126.7 Ų126.780%0.79683%0.826SS**  trans-52.2160-174-61.4-69.3000121.8
8S35.6Very low39Very low121 Ų121134.3 Ų134.385%0.84684%0.836SS**  -171.5130.9124.961.80000113.3
9G37Very low38.7Very low71 Ų71130.8 Ų130.873%0.73283%0.829SS**  trans-101.9175.9167.700000113.4
10Q36.8Very low38.8Very low188 Ų188129.7 Ų129.788%0.87983%0.825SS**  trans169.2111151.5-95.817234.600107.3
11Q32.3Very low39Very low190 Ų190131.5 Ų131.589%0.88883%0.827SS**  80.1124.882.6-154.1168.123.100114.7
12A38.7Very low38.8Very low87 Ų87123 Ų12372%0.71980%0.8SS**  trans-72.9177.8-178.500000114
13P44.4Very low38.8Very low129 Ų129123.2 Ų123.284%0.83880%0.796SS**  -144.9159.1105.234.4-17.5000115.9
14A38.8Very low39Very low89 Ų89123.5 Ų123.574%0.73680%0.796SS**  trans-91.3173.7163.300000110.5
15P50.5Low38.6Very low134 Ų134126.1 Ų126.187%0.8780%0.799SS**  -158.61648937.9-16.8000119.1
16G32.1Very low38.5Very low86 Ų86126.7 Ų126.789%0.88779%0.791SS**  trans104.3129.5144.800000117.6
17G34.7Very low38.5Very low73 Ų73130.3 Ų130.375%0.75379%0.794SS**  cis165.6157.7-2.700000112.8
18R36.8Very low38.6Very low264 Ų264133.3 Ų133.3100%0.99680%0.798SS**  trans80.5134.2162.5-68.6179.5168-153.1-3.6119.2
19G32.9Very low39.4Very low68 Ų68133.2 Ų133.270%0.70179%0.794SS**  cis-163.3148.44.600000110.6
20S42.3Very low39.6Very low108 Ų108134.7 Ų134.776%0.75580%0.799SS**  96.413091.2169.60000110.5
21I41.5Very low39.7Very low167 Ų167130.9 Ų130.986%0.85680%0.8SS**  cis-170154.211.4-94.7161.5000102.7
22G35.3Very low40.1Very low61 Ų61125.4 Ų125.463%0.62980%0.795SS**  cis-168.614510.100000108.1
23S40.1Very low40.7Very low105 Ų105130.1 Ų130.173%0.73481%0.806SS**  94.694.696.7-157.30000111.4
24L38.9Very low40.8Very low149 Ų149129.4 Ų129.478%0.7880%0.804SS**  71.4131.994.1-68.8171.2000111.3
25M39.1Very low41.6Very low161 Ų161131.3 Ų131.379%0.79381%0.812SS**  cis-166.8137.620.8-98.5151.9105.100107.3
26S36.1Very low41.5Very low91 Ų91128.3 Ų128.364%0.63681%0.805SS**  77.5114100.8-156.60000117.8
27R41.9Very low42.7Very low223 Ų223136 Ų13684%0.84281%0.807SS**  trans38.5128.2132.6-58.6179.1-160.4-129.92.1117.4
28R44.1Very low43.7Very low235 Ų235140.5 Ų140.589%0.88781%0.813SS**  cis-175.6177.346.7-120.1179.9-179-1791.1109
29P53.8Low44.4Very low118 Ų118133.3 Ų133.377%0.76680%0.801SS**  trans-103.5174.2-155.340.9-38.4000118.1
30A41.6Very low45.4Very low102 Ų102135.3 Ų135.384%0.84380%0.804SS**  trans77.7113.2151.600000121.2
31A38.3Very low45.9Very low108 Ų108136.6 Ų136.689%0.89381%0.807SS**  trans-166.3139.7140.900000111.3
32G39.9Very low46.6Very low75 Ų75139.5 Ų139.577%0.77381%0.807SS**  trans108.670.815000000118S34G32-S34 PolarHBondContact O-N 2.88Å
33I51.9Low47.4Very low186 Ų186142 Ų14295%0.95482%0.815SS**  trans-59118.3147.427.2167.6000108.9
34S47.3Very low48.3Very low115 Ų115147.5 Ų147.580%0.80482%0.82SS**  trans-123.7130.2158.764.70000109.1G32G32-S34 PolarHBondContact O-N 2.88Å
35S53.5Low49Very low129 Ų129146.5 Ų146.590%0.90282%0.815SS**  trans-82119.8174.557.80000109
36G49.4Very low50Low70 Ų70146.3 Ų146.372%0.72282%0.817SS**  trans16787.3175.600000114.4
37R56.7Low50.8Low247 Ų247147.2 Ų147.293%0.93282%0.818SS**  trans41.2101.9155.3-76.5178.3167.4-123.4-1117.3
38L55.4Low51.4Low168 Ų168145.1 Ų145.188%0.8882%0.823SS**  trans-60.7138.8159.1-64.4173.5000110.3
39P51.4Low52.1Low113 Ų113137.9 Ų137.973%0.73482%0.821SS**  trans-66.813517628.2-31.7000109.6V41P39-V41 PolarHBondContact O-N 3.25Å
40S55Low52.1Low111 Ų111135.6 Ų135.678%0.77682%0.819SS**  trans-55.8110.4176.5173.70000110.2R42S40-R42 VanDerWaalsContact C-N 3.31Å; S40-R42 PolarHBondContact O-N 3.28Å
41V53.7Low53.1Low135 Ų135137.3 Ų137.382%0.81882%0.819SS**  trans-67.795.1167.8177.70000106.5P39 S43P39-V41 PolarHBondContact O-N 3.25Å; V41-S43 PolarHBondContact O-N 3.17Å; V41-S43 VanDerWaalsContact O-N 3.09Å
42R54.4Low54.2Low227 Ų227141.8 Ų141.886%0.85782%0.818SS**  trans-56.6114.5162.2-83.6175.9158149.3-5.9107.1S40 R44S40-R42 VanDerWaalsContact C-N 3.31Å; S40-R42 PolarHBondContact O-N 3.28Å; R42-R44 PolarHBondContact O-N 3.01Å
43S53.6Low55.4Low113 Ų113147.8 Ų147.879%0.7982%0.823SS**  trans-56104.5169.7520000108.6V41 D45V41-S43 PolarHBondContact O-N 3.17Å; V41-S43 VanDerWaalsContact O-N 3.09Å; S43-D45 PolarHBondContact O-N 3.07Å
44R57.8Low56.2Low222 Ų222148.6 Ų148.684%0.83882%0.82SS**  trans-67.1113.1170-168.7174.6179.5151.7-1.2107.1R42 L46R42-R44 PolarHBondContact O-N 3.01Å; R44-L46 PolarHBondContact O-N 3.3Å
45D53.4Low57Low128 Ų128149.3 Ų149.368%0.68482%0.819SS**  trans-65.3111.8178.3-163.5-13.3000109.2S43 T47S43-D45 PolarHBondContact O-N 3.07Å; D45-T47 WeakPolarHBondContact OD1-CB 3.4Å; D45-T47 PolarHBondContact OD1-N 3.31Å; D45-T47 VanDerWaalsContact OD1-N 3.09Å; D45-T47 PolarHBondContact OD1-OG1 3.37Å
46L60.6Low57.4Low156 Ų156151.5 Ų151.582%0.81781%0.813SS**  trans-100.428.2175.9-75.3173.5000111.3R44 L48R44-L46 PolarHBondContact O-N 3.3Å; L46-L48 PolarHBondContact O-N 2.78Å
47T52.9Low57.9Low110 Ų110153.6 Ų153.668%0.67581%0.812SS**  trans-96.281.9172.662.40000111.2D45 G49D45-T47 WeakPolarHBondContact OD1-CB 3.4Å; D45-T47 PolarHBondContact OD1-N 3.31Å; D45-T47 VanDerWaalsContact OD1-N 3.09Å; D45-T47 PolarHBondContact OD1-OG1 3.37Å; T47-G49 PolarHBondContact O-N 2.68Å
48L54.3Low58.4Low180 Ų180146.2 Ų146.294%0.94280%0.796SS**  trans-60.8103.6154.1-81.4165.8000108.1L46L46-L48 PolarHBondContact O-N 2.78Å
49G58.5Low58.8Low82 Ų82145.3 Ų145.385%0.84579%0.792SS**SBendtrans40.589.6156.900000117.4T47T47-G49 PolarHBondContact O-N 2.68Å
50G54.4Low59.5Low70 Ų70147 Ų14772%0.72279%0.793SS**  trans-162.4104.8171.300000113.2
51V62.8Low59.6Low139 Ų139148.9 Ų148.984%0.84279%0.793SS**  trans32.1118.3161.4-168.40000118.1K53V51-K53 PolarHBondContact O-N 3.24Å
52K60.6Low59.8Low201 Ų201145.2 Ų145.287%0.87478%0.782SS**  trans-54.3111.9171.5-63.3-179.4-179.31800110.7K54K52-K54 PolarHBondContact O-N 2.76Å
53K64.9Low59.8Low201 Ų201146 Ų14687%0.87479%0.785SS**  trans-63.3122.2170.1-66.5-175179.9-179.60108.6V51 T55V51-K53 PolarHBondContact O-N 3.24Å; K53-T55 PolarHBondContact O-N 3.34Å
54K69.9Low59.9Low204 Ų204150.5 Ų150.589%0.88779%0.791SS**  trans-71.3110.9172.1-69-176178.7179.90108.1K52 F56K52-K54 PolarHBondContact O-N 2.76Å; K54-F56 PolarHBondContact O-N 3.4Å
55T63.4Low59.7Low129 Ų129146.3 Ų146.379%0.79179%0.79SS**  trans-66.4112.3169.4-54.40000108.2K53 T57K53-T55 PolarHBondContact O-N 3.34Å; T55-T57 PolarHBondContact O-N 3.05Å
56F62.5Low59.5Low175 Ų175149.5 Ų149.577%0.76880%0.798SS**  trans-77.2104.5177.4-175.9-98000109.4K54 P58K54-F56 PolarHBondContact O-N 3.4Å; F56-P58 HydrophobicContact CE1-CB 4.16Å
57T60.4Low58.9Low115 Ų115151 Ų15171%0.70680%0.8SS**  trans-84.1114.3165.749.40000108.2T55 N59T55-T57 PolarHBondContact O-N 3.05Å; T57-N59 PolarHBondContact O-N 3.45Å
58P66.1Low58.3Low91 Ų91153.9 Ų153.959%0.59181%0.806SS**  trans-62.8128.6179.425-32.4000110.3F56 I60F56-P58 HydrophobicContact CE1-CB 4.16Å; P58-I60 PolarHBondContact O-N 3.14Å; P58-I60 VanDerWaalsContact O-N 3.14Å
59N64.6Low57.6Low150 Ų150151.2 Ų151.280%0.80280%0.799SS**  trans-78.794.5177.7-164.715.4000109.1T57 I61T57-N59 PolarHBondContact O-N 3.45Å; N59-I61 PolarHBondContact O-N 2.95Å
60I66.5Low56.7Low147 Ų147157.3 Ų157.375%0.75480%0.803SS**  trans-75.3110.2176.5-58.6172.6000107.8P58 G62P58-I60 PolarHBondContact O-N 3.14Å; P58-I60 VanDerWaalsContact O-N 3.14Å; I60-G62 PolarHBondContact O-N 3.41Å
61I55.7Low55.9Low151 Ų151160.3 Ų160.377%0.77481%0.807SS**  trans-68.2103.4175.3-60.5167.5000108N59 R63N59-I61 PolarHBondContact O-N 2.95Å; I61-R63 PolarHBondContact O-N 2.9Å
62G57.5Low54.5Low58 Ų58162.9 Ų162.960%0.59881%0.81SS**  trans-60.2123.9172.200000110.5I60 K64I60-G62 PolarHBondContact O-N 3.41Å; G62-K64 PolarHBondContact O-N 2.94Å; G62-K64 VanDerWaalsContact O-N 3.11Å
63R55.8Low53.2Low244 Ų244156.8 Ų156.892%0.92180%0.804SS**  trans-61112171.6-68.1179.6177.2175.3-1.4108.2I61 V65I61-R63 PolarHBondContact O-N 2.9Å; R63-V65 PolarHBondContact O-N 2.91Å
64K55.1Low51.9Low207 Ų207153.6 Ų153.690%0.980%0.801SS**  trans-68.3111.2171.7-74.8-175176.6-177.50108.6G62G62-K64 PolarHBondContact O-N 2.94Å; G62-K64 VanDerWaalsContact O-N 3.11Å
65V53.2Low50.6Low135 Ų135149.7 Ų149.782%0.81880%0.797SS**  trans-66.8130.9162.4174.60000107.3R63 E67R63-V65 PolarHBondContact O-N 2.91Å; V65-E67 PolarHBondContact O-N 2.84Å
66K50Low49.1Very low195 Ų195154.7 Ų154.785%0.84880%0.801SS**  trans-71.1111.1178.4-177.4175.6178.9-177.90108.4
67E47.3Very low47.8Very low188 Ų188155.9 Ų155.988%0.87980%0.8SS**  trans-113.1133.1168-134.9178.6-173.900108.8V65V65-E67 PolarHBondContact O-N 2.84Å
68E40.6Very low46.5Very low169 Ų169159.8 Ų159.879%0.7981%0.811SS**PPolyproline II helixtrans-73.4154-169.6-65.4-174.5156.700113.1
69P40.1Very low45.1Very low124 Ų124164.6 Ų164.681%0.80582%0.817SS**PPolyproline II helixtrans-78.3128.7-174.131.1-33.2000112.1
70K38.9Very low43.8Very low210 Ų210169.5 Ų169.591%0.91382%0.824SS**PPolyproline II helixtrans-99.3137159.3-81.8-177.6177.8176.70110.6
71V38Very low42.3Very low133 Ų133169.9 Ų169.981%0.80683%0.828SS**PPolyproline II helixtrans-79.8165.5-177.1179.90000110.7
72E32.9Very low41.4Very low193 Ų193166.2 Ų166.290%0.90283%0.827SS**  trans96.5133.2168.8-53.7-178.3176.800114.8
73G33.8Very low40.4Very low73 Ų73170.3 Ų170.375%0.75384%0.836SS**  cis-170.8163.74.600000110.4
74V38Very low39.8Very low135 Ų135170.1 Ų170.182%0.81884%0.835SS**  trans-82.2147.2-178.1174.60000111.4
75P41.9Very low39Very low122 Ų122167.6 Ų167.679%0.79283%0.831SS**  -142.6130.1115.529.2-10.6000112.6
76R31.7Very low38.5Very low233 Ų233173 Ų17388%0.87984%0.837SS**  88.4107.573.9-126.5-177.8-168169.62.9114.8
77R36.4Very low37.7Very low200 Ų200166.9 Ų166.976%0.75583%0.83SS**  trans19.9137.2150-76.9-179172.5168.8-1.2120.7
78E32.7Very low37.3Very low198 Ų198170.1 Ų170.193%0.92583%0.834SS**  -143.6128.2127.9-119.3178.5-172.600111.6
79R37.3Very low37.1Very low192 Ų192166 Ų16673%0.72584%0.836SS**  trans-96.4145.6169.1-72.9-179.5173.8172.7-4.8107.4
80R37Very low37.2Very low253 Ų253172.5 Ų172.596%0.95585%0.845SS**  trans-131.4109.7161-122.2179.8-157.9-165.45.2110.1
81D35Very low37.2Very low154 Ų154165.8 Ų165.882%0.82484%0.836SS**  trans-73.9148.6168.2-69.1-61.9000110.7
82G36.8Very low37.3Very low75 Ų75166.7 Ų166.777%0.77383%0.831SS**  trans-156.363.6-179.100000112.2
83D36.5Very low37.9Very low144 Ų144168.1 Ų168.177%0.7783%0.828SS**  trans33.5112.5131.1-144-2.4000119.7
84R42Very low38.3Very low239 Ų239168.1 Ų168.190%0.90283%0.828SS**  177.1102.7124.7-95.9174.5-138.1-177.64.6112.8
85D39.7Very low39.1Very low154 Ų154174.4 Ų174.482%0.82484%0.837SS**  trans-65.4127.1158.2-89.8-54000112.2
86R41.1Very low39.2Very low248 Ų248171.8 Ų171.894%0.93683%0.833SS**  trans-146.486146-77.3-164.6-175.2155.61.8109.7
87G34.2Very low40.4Very low68 Ų68172.9 Ų172.970%0.70184%0.837SS**  trans-73.3137162.300000111.4
88R38.6Very low41Very low256 Ų256166.7 Ų166.797%0.96684%0.835SS**  trans-172.7111.3149.2-102.6174.9-162.1-152.65.1108.8
89G37.2Very low42.2Very low81 Ų81168.9 Ų168.984%0.83584%0.835SS**  trans164.881.617300000113.6
90R42.4Very low43.4Very low261 Ų261162.9 Ų162.999%0.98583%0.832SS**  trans-68.7135.8160.8-113.6-170.8-179.8-99.63.5108.4
91G38.8Very low44.7Very low70 Ų70160.2 Ų160.272%0.72283%0.831SS**  trans130.4103.3153.100000116.8
92E39.5Very low46.3Very low152 Ų152159 Ų15971%0.7183%0.829SS**  trans71.9119142-72.6-166.1121.500122.8
93R46.2Very low47.8Very low223 Ų223163.1 Ų163.184%0.84283%0.831SS**  trans70.586.4139.5-60.5174-159.8-166.46.8117.1
94G41.2Very low49.7Very low73 Ų73164.6 Ų164.675%0.75383%0.833SS**  trans-152.2112159.200000110.7G96G94-G96 PolarHBondContact O-N 2.93Å; G94-G96 VanDerWaalsContact O-N 3.12Å
95R55Low51.3Low266 Ų266158.4 Ų158.4100%1.00483%0.827SS**  trans-56.5109.8177.1-65.4173.9176.6-177.4-1.9110.2
96G44.7Very low53Low68 Ų68158.1 Ų158.170%0.70182%0.82SS**  trans-149.4111.4174.700000109.2G94 G98G94-G96 PolarHBondContact O-N 2.93Å; G94-G96 VanDerWaalsContact O-N 3.12Å; G96-G98 PolarHBondContact O-N 2.7Å
97R56.6Low54.9Low255 Ų255149.5 Ų149.596%0.96280%0.798SS**  trans-60.997175.4-67.1175.8178.3175.9-1.9108.5R99R97-R99 PolarHBondContact O-N 3.42Å
98G47.7Very low56.6Low70 Ų70153.2 Ų153.272%0.72280%0.8SS**  trans-58.2125.1160.500000107.5G96 G100G96-G98 PolarHBondContact O-N 2.7Å; G98-G100 VanDerWaalsContact C-N 3.33Å; G98-G100 PolarHBondContact O-N 3.09Å
99R59.3Low57.8Low245 Ų245149.8 Ų149.893%0.92579%0.793SS**  trans-62.1100167.5-77.6-177.3174.6-171-1.7106.8R97 E101R97-R99 PolarHBondContact O-N 3.42Å; R99-E101 PolarHBondContact O-N 2.89Å
100G62.5Low59.2Low65 Ų65151.6 Ų151.667%0.6778%0.779SS**  trans-65.4119.8166.300000107.9G98 V102G98-G100 VanDerWaalsContact C-N 3.33Å; G98-G100 PolarHBondContact O-N 3.09Å; G100-V102 PolarHBondContact O-N 3.08Å; G100-V102 VanDerWaalsContact O-N 3.16Å
101E63Low60.3Low198 Ų198145.4 Ų145.493%0.92576%0.762SS**SBendtrans-72.57.5173.1-68.7-178.2155.300112.6R99R99-E101 PolarHBondContact O-N 2.89Å
102V69.6Low61.7Low128 Ų128143.6 Ų143.678%0.77674%0.743SS**  trans-104.1113.5176.7-175.10000108.6G100 Q104G100-V102 PolarHBondContact O-N 3.08Å; G100-V102 VanDerWaalsContact O-N 3.16Å; V102-Q104 PolarHBondContact O-N 3.08Å
103I68.3Low62.7Low162 Ų162142 Ų14283%0.83175%0.746SS**  trans-80.5112.3171.1-58.8173.7000107.3S105I103-S105 PolarHBondContact O-N 3.27Å
104Q75.5Confident63.4Low174 Ų174133.8 Ų133.881%0.81373%0.731SS**  trans-77.4109.6171.8-155.4173.11.100107.6V102V102-Q104 PolarHBondContact O-N 3.08Å
105S75.5Confident64.4Low109 Ų109133.5 Ų133.576%0.76271%0.71SS**PPolyproline II helixtrans-80.3132.6177.355.50000110.5I103I103-S105 PolarHBondContact O-N 3.27Å
106H76.9Confident64.5Low148 Ų148125.4 Ų125.469%0.68569%0.69SS**PPolyproline II helixtrans-80.6159.9177.4-75-91.7000112.7E110H106-E110 IonicContact CE1-OE2 2.82Å; H106-E110 IonicContact CG-OE2 3.84Å; H106-E110 IonicContact ND1-OE1 3.42Å; H106-E110 IonicContact ND1-OE2 3.49Å; H106-E110 PolarHBondContact ND1-OE2 2.93Å
107S79.4Confident65.1Low67 Ų67129.4 Ų129.447%0.46969%0.692SS.*PPolyproline II helixtrans-75.4145.2-179.8-175.60000111.8F109 E110S107-F109 PolarHBondContact O-N 3.3Å; S107-E110 PolarHBondContact N-OE1 2.74Å; S107-E110 PolarHBondContact O-N 3.43Å; S107-E110 VanDerWaalsContact O-N 3.15Å
108I71.4Confident65.3Low147 Ų147124.6 Ų124.675%0.75468%0.683SS**G310 helixtrans-63.2-18.6-176.2108.9154.3000112.9E110I108-E110 VanDerWaalsContact C-N 3.34Å
109F64Low65.8Low184 Ų184128.2 Ų128.281%0.80768%0.678SS**G310 helixtrans-85.2-2.6-178.2-60.1-77.5000113.9S107 Q111S107-F109 PolarHBondContact O-N 3.3Å; F109-Q111 VanDerWaalsContact C-N 3.33Å
110E66.7Low65.6Low118 Ų118127.6 Ų127.655%0.55168%0.676SS**G310 helixtrans-81.6-12178.6-68.9172.8-147.200113.1H106 S107 I108 G112H106-E110 IonicContact CE1-OE2 2.82Å; H106-E110 IonicContact CG-OE2 3.84Å; H106-E110 IonicContact ND1-OE1 3.42Å; H106-E110 IonicContact ND1-OE2 3.49Å; H106-E110 PolarHBondContact ND1-OE2 2.93Å; S107-E110 PolarHBondContact N-OE1 2.74Å; S107-E110 PolarHBondContact O-N 3.43Å; S107-E110 VanDerWaalsContact O-N 3.15Å; I108-E110 VanDerWaalsContact C-N 3.34Å; E110-G112 PolarHBondContact O-N 2.85Å
111Q64.8Low65.2Low131 Ų131135.6 Ų135.661%0.61269%0.686SS**  trans-79.667.9180-167.6140.251.600111F109 E115F109-Q111 VanDerWaalsContact C-N 3.33Å; Q111-E115 VanDerWaalsContact CD-OE2 3.3Å; Q111-E115 VanDerWaalsContact CG-OE2 3.26Å; Q111-E115 WeakPolarHBondContact CG-OE2 3.33Å; Q111-E115 VanDerWaalsContact NE2-CD 3.33Å; Q111-E115 PolarHBondContact NE2-OE1 2.81Å; Q111-E115 PolarHBondContact NE2-OE2 2.92Å
112G67.4Low65Low33 Ų33129.5 Ų129.534%0.3468%0.676SS.*  trans-77.1166.3171.900000112.4E110 G114 E115E110-G112 PolarHBondContact O-N 2.85Å; G112-G114 PolarHBondContact O-N 2.85Å; G112-E115 PolarHBondContact O-N 3.07Å; G112-E115 VanDerWaalsContact O-N 3.11Å
113P61.1Low64.4Low119 Ų119126.5 Ų126.577%0.77367%0.672SS**THydrogen-bonded Turntrans-53.1-21.6-178.4-26.934000115.6E115 T116P113-E115 PolarHBondContact O-N 2.79Å; P113-T116 PolarHBondContact O-OG1 2.76Å
114G61.3Low63.7Low50 Ų50130.1 Ų130.152%0.51568%0.677SS.*THydrogen-bonded Turntrans-68.5-21.9178.200000115.7G112 T116 M117G112-G114 PolarHBondContact O-N 2.85Å; G114-T116 VanDerWaalsContact C-N 3.3Å; G114-T116 PolarHBondContact O-N 2.88Å; G114-M117 PolarHBondContact O-N 3.28Å
115E61.6Low62.3Low67 Ų67131.1 Ų131.131%0.31368%0.681SS.*Hα-helixtrans-72.3-26.1-178.7-153.5-165.5141.500112.4Q111 G112 P113 M117 M118 K119Q111-E115 VanDerWaalsContact CD-OE2 3.3Å; Q111-E115 VanDerWaalsContact CG-OE2 3.26Å; Q111-E115 WeakPolarHBondContact CG-OE2 3.33Å; Q111-E115 VanDerWaalsContact NE2-CD 3.33Å; Q111-E115 PolarHBondContact NE2-OE1 2.81Å; Q111-E115 PolarHBondContact NE2-OE2 2.92Å; G112-E115 PolarHBondContact O-N 3.07Å; G112-E115 VanDerWaalsContact O-N 3.11Å; P113-E115 PolarHBondContact O-N 2.79Å; E115-M117 VanDerWaalsContact C-N 3.29Å; E115-M117 PolarHBondContact O-N 2.76Å; E115-M118 PolarHBondContact O-N 2.76Å; E115-K119 PolarHBondContact O-N 2.71Å; E115-K119 VanDerWaalsContact OE1-CE 3.3Å; E115-K119 WeakPolarHBondContact OE1-CE 3.44Å; E115-K119 IonicContact OE1-NZ 3.86Å; E115-K119 PolarHBondContact OE1-NZ 2.77Å
116T57.9Low60.9Low95 Ų95130.6 Ų130.658%0.58368%0.677SS**Hα-helixtrans-68.9-26.4179.364.90000113P113 G114P113-T116 PolarHBondContact O-OG1 2.76Å; G114-T116 VanDerWaalsContact C-N 3.3Å; G114-T116 PolarHBondContact O-N 2.88Å
117M57.1Low59.8Low152 Ų152132.7 Ų132.775%0.74969%0.688SS**Hα-helixtrans-80.9-25178-64.2-164-177.200112.9G114 E115G114-M117 PolarHBondContact O-N 3.28Å; E115-M117 VanDerWaalsContact C-N 3.29Å; E115-M117 PolarHBondContact O-N 2.76Å
118M59.7Low58.5Low154 Ų154140 Ų14076%0.75971%0.705SS**Hα-helixtrans-79.8-34.8177.5-79.7160.5149.300112.6E115 R120 R121E115-M118 PolarHBondContact O-N 2.76Å; M118-R120 PolarHBondContact O-N 2.89Å; M118-R121 PolarHBondContact O-N 2.82Å
119K58.2Low57.5Low146 Ų146140.5 Ų140.564%0.63571%0.709SS**Hα-helixtrans-67.7-19176.1-74.5178-177.2157.90113.7E115E115-K119 PolarHBondContact O-N 2.71Å; E115-K119 VanDerWaalsContact OE1-CE 3.3Å; E115-K119 WeakPolarHBondContact OE1-CE 3.44Å; E115-K119 IonicContact OE1-NZ 3.86Å; E115-K119 PolarHBondContact OE1-NZ 2.77Å
120R56.9Low56.7Low232 Ų232135.7 Ų135.788%0.87570%0.703SS**THydrogen-bonded Turntrans-92.10.5175.1-70.3-164.3-178.7-168.41.7114.6M118M118-R120 PolarHBondContact O-N 2.89Å
121R54Low55.8Low233 Ų233135.3 Ų135.388%0.87971%0.711SS**SBendtrans-123.431.1-175.3-151.3-175-179.7-165.40.3114.4M118M118-R121 PolarHBondContact O-N 2.82Å
122G57.3Low55.1Low70 Ų70134.4 Ų134.472%0.72272%0.719SS**SBendtrans-164.194.3175.300000111.9
123G57.6Low54.5Low66 Ų66141.6 Ų141.668%0.6875%0.746SS**SBendtrans160-1.7168.200000119.1
124Y53.3Low54.5Low238 Ų238138 Ų13893%0.93373%0.731SS**SBendtrans-147.351178.4-85.9-80.5000113.3
125E46.8Very low54.2Low194 Ų194141.9 Ų141.991%0.90775%0.747SS**  trans-149.380.4163.8-151.5178.5-171.600109.4
126S46.6Very low53.9Low98 Ų98143 Ų14369%0.68576%0.762SS**  trans-147.664161.2176.40000107.4R128S126-R128 PolarHBondContact O-N 3Å
127E54Low53.9Low192 Ų192143.8 Ų143.890%0.89777%0.769SS**  trans-6885.1158.4-85176.4150.500107.7D129E127-D129 PolarHBondContact O-N 3.5Å
128R52.2Low54.1Low221 Ų221141.2 Ų141.283%0.83476%0.757SS**  trans-79.2104.4151.7-72.1-171-178.9-165.9-0.1105.4S126 A130S126-R128 PolarHBondContact O-N 3Å; R128-A130 VanDerWaalsContact C-N 3.35Å; R128-A130 PolarHBondContact O-N 3.22Å
129D49.5Very low54.2Low158 Ų158140 Ų14085%0.84575%0.752SS**  trans-46.9101.5161.8-89.3-37.3000109E127E127-D129 PolarHBondContact O-N 3.5Å
130A47.8Very low54.2Low82 Ų82137.6 Ų137.668%0.67875%0.746SS**  trans-68.8128.7160.300000105.9R128 S132R128-A130 VanDerWaalsContact C-N 3.35Å; R128-A130 PolarHBondContact O-N 3.22Å; A130-S132 PolarHBondContact O-N 3.13Å
131P46.2Very low54.3Low111 Ų111133.6 Ų133.672%0.72174%0.741SS**  trans-63.5102.6178.725.4-32.1000108.4M133P131-M133 PolarHBondContact O-N 3Å
132S51.7Low54.5Low111 Ų111132 Ų13278%0.77674%0.74SS**  trans-63.890.5168-177.40000107.2A130 G134A130-S132 PolarHBondContact O-N 3.13Å; S132-G134 VanDerWaalsContact C-N 3.26Å; S132-G134 PolarHBondContact O-N 3.01Å
133M54Low54.4Low184 Ų184135.5 Ų135.591%0.90674%0.736SS**  trans-70.586.7172.9-79.9-83.9163.500108.5P131P131-M133 PolarHBondContact O-N 3Å
134G61Low54.3Low44 Ų44140.8 Ų140.845%0.45474%0.743SS.*SBendtrans160.7122.6164.500000111.6S132 S136S132-G134 VanDerWaalsContact C-N 3.26Å; S132-G134 PolarHBondContact O-N 3.01Å; G134-S136 PolarHBondContact O-N 2.99Å
135P55.8Low54.3Low131 Ų131138.5 Ų138.585%0.85174%0.738SS**  trans-63.6111.6169.926.7-30.2000107.2P137P135-P137 WeakPolarHBondContact O-CD 3.2Å
136S54.7Low54.5Low90 Ų90138.7 Ų138.763%0.62973%0.73SS**  trans-65.3115.5170.9430000107.4G134 I138G134-S136 PolarHBondContact O-N 2.99Å; S136-I138 PolarHBondContact O-N 3.23Å
137P58.1Low54.8Low113 Ų113138.4 Ų138.473%0.73472%0.718SS**  trans-72.493.6170.229.7-28.9000106P135 I139P135-P137 WeakPolarHBondContact O-CD 3.2Å; P137-I139 VanDerWaalsContact C-N 3.27Å; P137-I139 PolarHBondContact O-N 2.93Å
138I60Low55.3Low97 Ų97132.8 Ų132.850%0.49770%0.697SS.*  trans-66.895.4169.7-55.7175.6000105.8S136 N140S136-I138 PolarHBondContact O-N 3.23Å; I138-N140 VanDerWaalsContact C-N 3.33Å; I138-N140 WeakPolarHBondContact CG2-OD1 3.44Å; I138-N140 PolarHBondContact O-N 2.66Å
139I62.7Low55.7Low128 Ų128129.8 Ų129.866%0.65669%0.692SS**  trans-70.595.7172.5-60.7176.3000106.5P137 I141P137-I139 VanDerWaalsContact C-N 3.27Å; P137-I139 PolarHBondContact O-N 2.93Å; I139-I141 HydrophobicContact CG2-CB 4.17Å; I139-I141 HydrophobicContact CG2-CD1 3.62Å; I139-I141 HydrophobicContact CG2-CG1 3.74Å; I139-I141 PolarHBondContact O-N 3.34Å
140N57.1Low56.5Low96 Ų96129.8 Ų129.851%0.51369%0.687SS.*THydrogen-bonded Turntrans-67.120.2-174.8-80.8-14.6000115.4I138I138-N140 VanDerWaalsContact C-N 3.33Å; I138-N140 WeakPolarHBondContact CG2-OD1 3.44Å; I138-N140 PolarHBondContact O-N 2.66Å
141I60.8Low57.4Low149 Ų149130.2 Ų130.276%0.76468%0.675SS**THydrogen-bonded Turntrans-88.7-12.9-172-53.3173.3000111.9I139I139-I141 HydrophobicContact CG2-CB 4.17Å; I139-I141 HydrophobicContact CG2-CD1 3.62Å; I139-I141 HydrophobicContact CG2-CG1 3.74Å; I139-I141 PolarHBondContact O-N 3.34Å
142K56.8Low58.6Low198 Ų198127.7 Ų127.786%0.86166%0.658SS**  trans-120.569.1171.2-66.9-173.7178-174.40110.7E144K142-E144 VanDerWaalsContact C-N 3.26Å; K142-E144 PolarHBondContact O-N 3.39Å
143K54.7Low59.8Low145 Ų145129.4 Ų129.463%0.6365%0.651SS**  trans-87.674.1160.8-65.5-176.7-176.1-179.10107.9
144E55.9Low60.9Low176 Ų176125.4 Ų125.482%0.82263%0.63SS**SBendtrans-61.1134.2140.1-177.5178.7178.400105.4K142 R146K142-E144 VanDerWaalsContact C-N 3.26Å; K142-E144 PolarHBondContact O-N 3.39Å; E144-R146 PolarHBondContact O-N 3.36Å
145K53.8Low61.5Low190 Ų190126.5 Ų126.583%0.82663%0.625SS**  trans-3699.8-172-60.7172.6-178179.40111.1E147K145-E147 PolarHBondContact O-N 3.09Å
146R50Low62.3Low198 Ų198125 Ų12575%0.74761%0.609SS**  trans-75.587161.2-81.1-172.6177.3175.2-2.6105.4E144E144-R146 PolarHBondContact O-N 3.36Å
147E53.9Low63.2Low92 Ų92128.6 Ų128.643%0.4361%0.609SS.*  trans-55.4134.2150.9-73.6173.8-18000106.7K145 E151 T152 I155K145-E147 PolarHBondContact O-N 3.09Å; E147-E151 WeakPolarHBondContact CA-OE2 3.39Å; E147-E151 HydrophobicContact CB-CB 3.95Å; E147-E151 HydrophobicContact CG-CB 4.47Å; E147-T152 HydrophobicContact CB-CG2 3.99Å; E147-I155 WeakPolarHBondContact OE2-CD1 3.35Å
148T63.5Low63.8Low74 Ų74129.1 Ų129.145%0.45460%0.6SS.*  trans-57.9151.4175.953.90000109.2E150 E151 T152T148-E150 PolarHBondContact O-N 3.45Å; T148-E151 PolarHBondContact N-OE2 3.45Å; T148-E151 PolarHBondContact O-N 3.24Å; T148-E151 VanDerWaalsContact OG1-CG 3.28Å; T148-E151 WeakPolarHBondContact OG1-CG 3.45Å; T148-E151 PolarHBondContact OG1-OE2 2.82Å; T148-T152 PolarHBondContact O-N 2.79Å; T148-T152 VanDerWaalsContact O-N 3.13Å
149E62.1Low64.2Low158 Ų158130.8 Ų130.874%0.73861%0.609SS**Hα-helixtrans-56.8-19.8179.3-68.8-176.2-179.800112.5T152 K153E149-T152 WeakPolarHBondContact CA-OG1 3.39Å; E149-T152 PolarHBondContact O-OG1 3.22Å; E149-K153 WeakPolarHBondContact O-CG 3.17Å; E149-K153 PolarHBondContact O-N 3.36Å
150E64.7Low64.5Low159 Ų159131.9 Ų131.974%0.74361%0.612SS**Hα-helixtrans-74.3-43.3173.7-59.2-175.1166.100112.3T148 K153 E154T148-E150 PolarHBondContact O-N 3.45Å; E150-K153 PolarHBondContact O-N 2.9Å; E150-E154 PolarHBondContact O-N 3.37Å
151E67.6Low64.9Low90 Ų90133.6 Ų133.642%0.42161%0.611SS.*Hα-helixtrans-66.1-40.5176.6-72.9164.6159.400111.3E147 T148 K153 E154 I155E147-E151 WeakPolarHBondContact CA-OE2 3.39Å; E147-E151 HydrophobicContact CB-CB 3.95Å; E147-E151 HydrophobicContact CG-CB 4.47Å; T148-E151 PolarHBondContact N-OE2 3.45Å; T148-E151 PolarHBondContact O-N 3.24Å; T148-E151 VanDerWaalsContact OG1-CG 3.28Å; T148-E151 WeakPolarHBondContact OG1-CG 3.45Å; T148-E151 PolarHBondContact OG1-OE2 2.82Å; E151-K153 PolarHBondContact O-N 2.98Å; E151-E154 PolarHBondContact O-N 3.46Å; E151-I155 WeakPolarHBondContact O-CD1 3.47Å; E151-I155 VanDerWaalsContact O-CG1 3.22Å; E151-I155 WeakPolarHBondContact O-CG1 3.38Å; E151-I155 PolarHBondContact O-N 2.89Å
152T71.8Confident64.5Low58 Ų58135.3 Ų135.336%0.35662%0.615SS.*Hα-helixtrans-65.1-38.4176.660.20000112.4E147 T148 E149 I155 L156E147-T152 HydrophobicContact CB-CG2 3.99Å; T148-T152 PolarHBondContact O-N 2.79Å; T148-T152 VanDerWaalsContact O-N 3.13Å; E149-T152 WeakPolarHBondContact CA-OG1 3.39Å; E149-T152 PolarHBondContact O-OG1 3.22Å; T152-I155 PolarHBondContact O-N 2.9Å; T152-L156 WeakPolarHBondContact O-CG 3.09Å; T152-L156 PolarHBondContact O-N 2.96Å
153K77.2Confident64.5Low147 Ų147132.4 Ų132.464%0.63961%0.609SS**Hα-helixtrans-67.1-36.7172.3-82.5174.9-179.81660112.1E149 E150 E151 R157E149-K153 WeakPolarHBondContact O-CG 3.17Å; E149-K153 PolarHBondContact O-N 3.36Å; E150-K153 PolarHBondContact O-N 2.9Å; E151-K153 PolarHBondContact O-N 2.98Å; K153-R157 WeakPolarHBondContact O-CB 3.3Å; K153-R157 PolarHBondContact O-N 2.88Å
154E77.4Confident64.6Low100 Ų100134.6 Ų134.647%0.46762%0.619SS.*Hα-helixtrans-67.6-39176.4-164.5-176.3153.100111.8E150 E151 R157 K158E150-E154 PolarHBondContact O-N 3.37Å; E151-E154 PolarHBondContact O-N 3.46Å; E154-R157 PolarHBondContact O-N 2.76Å; E154-K158 WeakPolarHBondContact O-CG 3.28Å; E154-K158 PolarHBondContact O-N 2.94Å; E154-K158 VanDerWaalsContact OE1-CE 3.23Å; E154-K158 WeakPolarHBondContact OE1-CE 3.2Å; E154-K158 IonicContact OE1-NZ 2.7Å; E154-K158 PolarHBondContact OE1-NZ 2.85Å
155I72.2Confident64.5Low68 Ų68133.4 Ų133.435%0.34962%0.617SS.*Hα-helixtrans-65.8-45.4176-68.2161.4000110.7E147 E151 T152 R157 K158 L159E147-I155 WeakPolarHBondContact OE2-CD1 3.35Å; E151-I155 WeakPolarHBondContact O-CD1 3.47Å; E151-I155 VanDerWaalsContact O-CG1 3.22Å; E151-I155 WeakPolarHBondContact O-CG1 3.38Å; E151-I155 PolarHBondContact O-N 2.89Å; T152-I155 PolarHBondContact O-N 2.9Å; I155-R157 VanDerWaalsContact C-N 3.3Å; I155-R157 PolarHBondContact O-N 2.82Å; I155-K158 PolarHBondContact O-N 2.94Å; I155-K158 VanDerWaalsContact O-N 3.09Å; I155-L159 HydrophobicContact CG2-CD1 3.94Å; I155-L159 HydrophobicContact CG2-CG 4.46Å; I155-L159 WeakPolarHBondContact O-CG 3.08Å; I155-L159 PolarHBondContact O-N 3.19Å
156L73.6Confident64.3Low99 Ų99131.8 Ų131.852%0.51862%0.617SS.*Hα-helixtrans-59.7-41.1173.8-74.5169.1000111.8T152 K158 L159 E160T152-L156 WeakPolarHBondContact O-CG 3.09Å; T152-L156 PolarHBondContact O-N 2.96Å; L156-K158 VanDerWaalsContact C-N 3.28Å; L156-K158 PolarHBondContact O-N 3.47Å; L156-L159 PolarHBondContact O-N 2.81Å; L156-E160 WeakPolarHBondContact O-CB 3.48Å; L156-E160 WeakPolarHBondContact O-CG 3.29Å; L156-E160 PolarHBondContact O-N 2.96Å
157R73.4Confident64.4Low165 Ų165126.2 Ų126.262%0.62360%0.603SS**Hα-helixtrans-68.5-24.3175.9-162.1-174.3-171.4173.35.6113.5K153 E154 I155 R161K153-R157 WeakPolarHBondContact O-CB 3.3Å; K153-R157 PolarHBondContact O-N 2.88Å; E154-R157 PolarHBondContact O-N 2.76Å; I155-R157 VanDerWaalsContact C-N 3.3Å; I155-R157 PolarHBondContact O-N 2.82Å; R157-R161 WeakPolarHBondContact O-CG 3.36Å; R157-R161 PolarHBondContact O-NH1 3.4Å
158K69.7Low64.5Low125 Ų125127.1 Ų127.154%0.54362%0.616SS.*Hα-helixtrans-79.7-35.8172.3-77.7175-175.9162.90111.2E154 I155 L156E154-K158 WeakPolarHBondContact O-CG 3.28Å; E154-K158 PolarHBondContact O-N 2.94Å; E154-K158 VanDerWaalsContact OE1-CE 3.23Å; E154-K158 WeakPolarHBondContact OE1-CE 3.2Å; E154-K158 IonicContact OE1-NZ 2.7Å; E154-K158 PolarHBondContact OE1-NZ 2.85Å; I155-K158 PolarHBondContact O-N 2.94Å; I155-K158 VanDerWaalsContact O-N 3.09Å; L156-K158 VanDerWaalsContact C-N 3.28Å; L156-K158 PolarHBondContact O-N 3.47Å
159L69.2Low64Low131 Ų131131.6 Ų131.669%0.68663%0.63SS**Hα-helixtrans-71.8-34.9176.4-70.2168.1000112.9I155 L156 R161I155-L159 HydrophobicContact CG2-CD1 3.94Å; I155-L159 HydrophobicContact CG2-CG 4.46Å; I155-L159 WeakPolarHBondContact O-CG 3.08Å; I155-L159 PolarHBondContact O-N 3.19Å; L156-L159 PolarHBondContact O-N 2.81Å; L159-R161 VanDerWaalsContact C-N 3.29Å; L159-R161 PolarHBondContact O-N 3.04Å
160E68.4Low63.6Low152 Ų152130.3 Ų130.371%0.7163%0.627SS**THydrogen-bonded Turntrans-77.7-8.7177.9-72.6177.1176.400114.1L156 E162L156-E160 WeakPolarHBondContact O-CB 3.48Å; L156-E160 WeakPolarHBondContact O-CG 3.29Å; L156-E160 PolarHBondContact O-N 2.96Å; E160-E162 PolarHBondContact O-N 3.17Å; E160-E162 VanDerWaalsContact O-N 3.14Å
161R66.4Low63.2Low131 Ų131132.8 Ų132.849%0.49463%0.63SS.*  trans-8290.6172.2-78.9-173.9-177.3104.8-13.2109.3R157 L159 N163R157-R161 WeakPolarHBondContact O-CG 3.36Å; R157-R161 PolarHBondContact O-NH1 3.4Å; L159-R161 VanDerWaalsContact C-N 3.29Å; L159-R161 PolarHBondContact O-N 3.04Å; R161-N163 PolarHBondContact O-N 3.28Å
162E51.4Low62.7Low185 Ų185133.9 Ų133.986%0.86465%0.648SS**  trans-70.460.7168.9-64.5-164.9167.100112.3E160E160-E162 PolarHBondContact O-N 3.17Å; E160-E162 VanDerWaalsContact O-N 3.14Å
163N56.8Low62.1Low137 Ų137137.4 Ų137.473%0.73366%0.66SS**  trans-105.930.8167.6-69.6-11.1000110.7R161 I165R161-N163 PolarHBondContact O-N 3.28Å; N163-I165 VanDerWaalsContact C-N 3.28Å; N163-I165 PolarHBondContact O-N 3.08Å
164F56.8Low61.1Low192 Ų192139.6 Ų139.684%0.84267%0.672SS**SBendtrans-83.32.8-171.9-120.8-86000114.4
165I54.2Low60.2Low151 Ų151145.7 Ų145.777%0.77469%0.691SS**SBendtrans-128.3-24-169-60.9169.8000114.5N163N163-I165 VanDerWaalsContact C-N 3.28Å; N163-I165 PolarHBondContact O-N 3.08Å
166D50.5Low59.5Low155 Ų155146.8 Ų146.883%0.82971%0.705SS**  trans-112.261.1-179.3-78.7-19.1000112.3P168D166-P168 WeakPolarHBondContact O-CD 3.5Å
167D52.1Low58.7Low82 Ų82145.9 Ų145.944%0.43971%0.706SS.*  trans-92.5109161.1-171.8-8000109.2F169 L170D167-F169 PolarHBondContact O-N 2.77Å; D167-F169 WeakPolarHBondContact OD1-CB 3.38Å; D167-F169 PolarHBondContact OD1-N 3.48Å; D167-L170 HydrophobicContact CB-CB 4.2Å; D167-L170 HydrophobicContact CB-CD1 3.84Å; D167-L170 HydrophobicContact CB-CG 4.42Å; D167-L170 WeakPolarHBondContact O-CB 3.49Å; D167-L170 PolarHBondContact O-N 2.73Å
168P55.8Low57.9Low111 Ų111144.1 Ų144.172%0.72172%0.716SS**THydrogen-bonded Turntrans-65.7-7178.826.3-33.1000113.9D166D166-P168 WeakPolarHBondContact O-CD 3.5Å
169F52.6Low57.4Low168 Ų168144.2 Ų144.274%0.73773%0.726SS**THydrogen-bonded Turntrans-98-1.3173.5-62.5-80.2000114.1D167 R171D167-F169 PolarHBondContact O-N 2.77Å; D167-F169 WeakPolarHBondContact OD1-CB 3.38Å; D167-F169 PolarHBondContact OD1-N 3.48Å; F169-R171 PolarHBondContact O-N 3.41Å
170L54.6Low56.2Low130 Ų130146 Ų14668%0.68173%0.731SS**  trans-73.855171.6-114.5152.8000110.7D167D167-L170 HydrophobicContact CB-CB 4.2Å; D167-L170 HydrophobicContact CB-CD1 3.84Å; D167-L170 HydrophobicContact CB-CG 4.42Å; D167-L170 WeakPolarHBondContact O-CB 3.49Å; D167-L170 PolarHBondContact O-N 2.73Å
171R55.8Low55.5Low211 Ų211145.2 Ų145.280%0.79673%0.731SS**  trans-74.3130.7156-65.4-169.3179.8-158.5-0.1105.7F169 E173F169-R171 PolarHBondContact O-N 3.41Å; R171-E173 PolarHBondContact O-N 2.77Å
172S57.5Low54.6Low114 Ų114145 Ų14580%0.79775%0.747SS**  trans-57.885.1172.921.20000109.7Q174S172-Q174 PolarHBondContact O-N 2.69Å
173E58.3Low54.4Low132 Ų132143 Ų14362%0.61774%0.742SS**  trans-63.4134.6173-71.4-170.817000107.7R171 R175 S176R171-E173 PolarHBondContact O-N 2.77Å; E173-R175 PolarHBondContact O-N 3.13Å; E173-S176 PolarHBondContact O-N 2.93Å; E173-S176 PolarHBondContact O-OG 3.09Å; E173-S176 VanDerWaalsContact O-OG 3.13Å
174Q56.8Low54.2Low193 Ų193141.7 Ų141.790%0.90275%0.75SS**THydrogen-bonded Turntrans-57.3-3.2178.3-78.6173.4-31.600114.3S172S172-Q174 PolarHBondContact O-N 2.69Å
175R58.2Low53.3Low228 Ų228138.8 Ų138.886%0.8675%0.747SS**THydrogen-bonded Turntrans-92.6-13.3176.2-60.9-176-180-141.3-0.5113.9E173 C177E173-R175 PolarHBondContact O-N 3.13Å; R175-C177 VanDerWaalsContact C-N 3.35Å
176S58.4Low52.8Low91 Ų91137.3 Ų137.364%0.63675%0.75SS**  trans-99.835.8176.672.80000111.9E173E173-S176 PolarHBondContact O-N 2.93Å; E173-S176 PolarHBondContact O-OG 3.09Å; E173-S176 VanDerWaalsContact O-OG 3.13Å
177C55.9Low52.6Low79 Ų79132.9 Ų132.953%0.53474%0.742SS.*SBendtrans-75.5146.616649.70000109.4R175 V179R175-C177 VanDerWaalsContact C-N 3.35Å; C177-V179 PolarHBondContact O-N 3.48Å; C177-V179 VanDerWaalsContact O-N 3.08Å
178P57Low51.9Low129 Ų129141.5 Ų141.584%0.83877%0.768SS**  trans-58.4119.5176.923.6-32.2000109.2Q180P178-Q180 PolarHBondContact O-N 3.13Å; P178-Q180 VanDerWaalsContact O-N 3.17Å
179V59.1Low51.6Low126 Ų126139.6 Ų139.676%0.76477%0.769SS**  trans-73109.5177.9179.50000107.9C177 L181C177-V179 PolarHBondContact O-N 3.48Å; C177-V179 VanDerWaalsContact O-N 3.08Å; V179-L181 PolarHBondContact O-N 3.27Å
180Q43.8Very low50.9Low168 Ų168141.6 Ų141.679%0.78578%0.777SS**  trans-72114.1171.8-172.4170.3-900108.4P178P178-Q180 PolarHBondContact O-N 3.13Å; P178-Q180 VanDerWaalsContact O-N 3.17Å
181L54.8Low50.2Low137 Ų137142.6 Ų142.672%0.71778%0.78SS**  trans-59.9138.4172.3-65.7173.4000108.9V179 L183V179-L181 PolarHBondContact O-N 3.27Å; L181-L183 VanDerWaalsContact C-N 3.31Å; L181-L183 PolarHBondContact O-N 3.3Å
182P45.7Very low50Low127 Ų127141.5 Ų141.583%0.82578%0.784SS**  trans-66.592.6179.326.2-33.2000109.7A184P182-A184 PolarHBondContact O-N 2.81Å
183L49.1Very low49.4Very low143 Ų143143.6 Ų143.675%0.74978%0.782SS**  trans-67.6122.6153.3-67.4172.5000105.7L181 V185L181-L183 VanDerWaalsContact C-N 3.31Å; L181-L183 PolarHBondContact O-N 3.3Å; L183-V185 PolarHBondContact O-N 3.23Å
184A51.1Low48.4Very low109 Ų109145.8 Ų145.890%0.90179%0.789SS**  trans-48.9106.5-179.500000110.8P182P182-A184 PolarHBondContact O-N 2.81Å
185V38.5Very low47.5Very low131 Ų131144 Ų14479%0.79479%0.786SS**  trans-133111.2160.4-173.10000106.2L183L183-V185 PolarHBondContact O-N 3.23Å
186S43.3Very low46.4Very low119 Ų119138 Ų13883%0.83278%0.779SS**  trans-53.5132.9170.7480000111.9
187G46.8Very low45.2Very low63 Ų63139.5 Ų139.565%0.64979%0.789SS**  trans118.6130.1150.300000116.2
188W37.3Very low44Very low263 Ų263140.4 Ų140.4100%0.99680%0.803SS**  trans92.3107.4151.6-66.936.9000116.3
189G50Low42.8Very low71 Ų71141.9 Ų141.973%0.73280%0.802SS**  trans-72.6151.8167.100000111.9
190F36.8Very low41.4Very low209 Ų209145 Ų14592%0.91781%0.805SS**  trans-163148.9147.7-134.7-98.4000110.3
191M40.9Very low40.9Very low151 Ų151143.6 Ų143.674%0.74481%0.808SS**  trans83.157.3177-62.7-161.573.400117.7
192E50.2Low39.7Very low188 Ų188145.9 Ų145.988%0.87982%0.815SS**  -74.7114.7124.6-172.1169.1-155.700107.7
193E45.6Very low39.3Very low159 Ų159149.2 Ų149.274%0.74382%0.816SS**  trans168.7143.9150-94172.5-167.500110.8
194F38.1Very low39Very low177 Ų177147.4 Ų147.478%0.77681%0.813SS**  trans84.196.1-170.5-63.4-85000114.5
195N36.7Very low37.9Very low156 Ų156149.4 Ų149.483%0.83481%0.809SS**  cis-144.8124.848.6-75.1-45.2000112.9
196S34.6Very low38.2Very low102 Ų102148.3 Ų148.371%0.71380%0.804SS**  trans-80.8159.516249.40000111.3
197S33Very low37.6Very low122 Ų122150.2 Ų150.285%0.85381%0.805SS**  trans83.7129.1169.980.70000115.8
198A31.4Very low37Very low99 Ų99156 Ų15682%0.81882%0.815SS**  cis-155.71456.900000111.2
199I32.5Very low37.5Very low159 Ų159148.8 Ų148.882%0.81580%0.802SS**  trans-65.6138.5168.7-67.6151.3000110.5
200K28.7Very low36.5Very low191 Ų191154.4 Ų154.483%0.8381%0.812SS**  -175.7115.7128.8-103.4174-178.8-1740112.2
201V34Very low36.2Very low140 Ų140152.9 Ų152.985%0.84881%0.807SS**  trans-114.3120.2158.2169.60000105.9
202E30Very low35.6Very low184 Ų184150.9 Ų150.986%0.8681%0.808SS**  trans-146.3135.6156-73.5-169.8161.600109.3
203K35.9Very low34.5Very low198 Ų198146.9 Ų146.986%0.86180%0.801SS**  trans-118.5165.6157.9-75.1-172.7175.2-175.80105.9
204P42.8Very low33.8Very low105 Ų105145.5 Ų145.568%0.68280%0.803SS**  cis-148.3171.624.736.1-11.7000119.5
205D29.3Very low33.6Very low150 Ų150146.1 Ų146.180%0.80281%0.809SS**  trans52166.1146.4-52.8-17.2000124.2
206P44.2Very low33.4Very low108 Ų108144.7 Ų144.770%0.70181%0.805SS**  cis-131.2175.7-31.333.3-12.9000114.2
207D31.8Very low33.6Very low159 Ų159149.6 Ų149.685%0.8581%0.814SS**  trans156.8134.8141.1-78.3-17.1000113.6
208E32.4Very low33.7Very low186 Ų186152.3 Ų152.387%0.86981%0.813SS**  trans-78.4-166.8-175.7-61.2-174.3157.400114.5
209P48Very low33.6Very low110 Ų110156.6 Ų156.671%0.71482%0.816SS**  -127.3164.2-59.833.2-17000112.7
210M30.3Very low34Very low189 Ų189158 Ų15893%0.93182%0.819SS**  trans-174.8149.2137.7-118.8177.2179.200115.3
211E29.1Very low34.3Very low178 Ų178157.7 Ų157.783%0.83282%0.82SS**  trans-68.4154.6-177-54.4170.1146.200114.7
212S28.9Very low34.3Very low108 Ų108159.2 Ų159.276%0.75582%0.818SS**  176118.2115.462.50000112.5
213S27Very low34.9Very low105 Ų105156.8 Ų156.873%0.73482%0.816SS**  trans9.9138139.857.20000120.2
214V32.3Very low34.9Very low130 Ų130155.3 Ų155.379%0.78881%0.812SS**  -173.2124105162.30000108.9V216V214-V216 HydrophobicContact CG1-CG2 4.23Å
215E32.9Very low34.8Very low190 Ų190157.6 Ų157.689%0.88882%0.817SS**  trans-80.5134.5166.9-65.5177.2146.100110.2
216V32.3Very low35.3Very low126 Ų126158.4 Ų158.476%0.76481%0.813SS**  trans-132.8103.7153.3179.10000107.8V214V214-V216 HydrophobicContact CG1-CG2 4.23Å
217K38Very low35.2Very low205 Ų205162.8 Ų162.889%0.89182%0.821SS**  trans-75128.8159-96.7177170176.40108.2
218Q35.6Very low35.8Very low179 Ų179161.6 Ų161.684%0.83682%0.819SS**  trans-149.8148.2145.8-129.5169.1-2.100112.2
219E30.3Very low36.5Very low188 Ų188160.7 Ų160.788%0.87982%0.815SS**  trans-71.6170.2-149.7-73.9158.5164.800117.7
220E41Very low36.6Very low189 Ų189159.5 Ų159.588%0.88382%0.815SS**  trans-80.1135.6-175.7-55169.4154.300112.6
221E33.4Very low37.7Very low184 Ų184156 Ų15686%0.8680%0.804SS**  trans172.8132.1152.6-104.4176.4-178.400105.6
222E34.2Very low38.8Very low172 Ų172156.4 Ų156.480%0.80480%0.803SS**  cis-146.3164.719-62-179.2129.800109.8E224E222-E224 PolarHBondContact O-N 3.12Å
223V43.5Very low40.3Very low133 Ų133159.6 Ų159.681%0.80680%0.804SS**  trans-66.7104.6-166.4-169.70000113I225V223-I225 PolarHBondContact O-N 2.9Å; V223-I225 VanDerWaalsContact O-N 3.15Å
224E36.7Very low41.8Very low167 Ų167159.4 Ų159.478%0.7880%0.8SS**  trans-67.4107158.2-82.8-172161.300109.1E222 K226E222-E224 PolarHBondContact O-N 3.12Å; E224-K226 PolarHBondContact O-N 2.95Å
225I40.2Very low43.5Very low154 Ų154158 Ų15879%0.7979%0.794SS**  trans-66.589.7165.3-57.5170000106.7V223 K227V223-I225 PolarHBondContact O-N 2.9Å; V223-I225 VanDerWaalsContact O-N 3.15Å; I225-K227 PolarHBondContact O-N 3.18Å
226K39.2Very low45.3Very low167 Ų167154.9 Ų154.973%0.72679%0.789SS**  trans-55.3110.7163.5-72.9-179.5179.2175.40106.8E224 V228E224-K226 PolarHBondContact O-N 2.95Å; K226-V228 VanDerWaalsContact C-N 3.31Å; K226-V228 PolarHBondContact O-N 3.11Å
227K41.7Very low46.9Very low199 Ų199156.5 Ų156.587%0.86579%0.793SS**  trans-50.3106.1155.5-93.9179.3174.11770105.7I225 E229I225-K227 PolarHBondContact O-N 3.18Å; K227-E229 PolarHBondContact O-N 3.28Å
228V45.1Very low48.3Very low134 Ų134152.4 Ų152.481%0.81279%0.787SS**  trans-69.187.7164.4-166.80000104K226 A230K226-V228 VanDerWaalsContact C-N 3.31Å; K226-V228 PolarHBondContact O-N 3.11Å; V228-A230 PolarHBondContact O-N 3.31Å
229E47.2Very low50Low168 Ų168152.3 Ų152.379%0.78579%0.787SS**  trans-57.699.6164.5-168.2172-162.500104.6K227 T231K227-E229 PolarHBondContact O-N 3.28Å; E229-T231 PolarHBondContact O-N 3.28Å
230A49.3Very low51.9Low85 Ų85148.9 Ų148.970%0.70278%0.781SS**  trans-62.194.1175.600000105.8V228 F232V228-A230 PolarHBondContact O-N 3.31Å; A230-F232 PolarHBondContact O-N 3.41Å
231T53.2Low53.7Low114 Ų114144.9 Ų144.970%0.69976%0.762SS**  trans-58.692.6167.538.70000106.3E229 K233E229-T231 PolarHBondContact O-N 3.28Å; T231-K233 PolarHBondContact O-N 3.41Å
232F52.8Low56.4Low187 Ų187139.9 Ų139.982%0.8274%0.744SS**  trans-68.483.5169.1-157.9-91.8000105.7A230 P234A230-F232 PolarHBondContact O-N 3.41Å; F232-P234 VanDerWaalsContact O-CD 3.29Å; F232-P234 WeakPolarHBondContact O-CD 3.43Å
233K60.8Low59.1Low176 Ų176132.2 Ų132.277%0.76571%0.708SS**PPolyproline II helixtrans-65.7117.1167.8-75.2-173.5177.6-178.50105.3T231T231-K233 PolarHBondContact O-N 3.41Å
234P59Low61.5Low101 Ų101126.9 Ų126.966%0.65668%0.677SS**PPolyproline II helixtrans-53.9139.7171.323.7-31.7000107.4F232F232-P234 VanDerWaalsContact O-CD 3.29Å; F232-P234 WeakPolarHBondContact O-CD 3.43Å
235P66.2Low64.2Low101 Ų101123.7 Ų123.766%0.65667%0.665SS**PPolyproline II helixtrans-50.5137176.920.6-31.2000108.4L237P235-L237 PolarHBondContact O-N 2.83Å; P235-L237 VanDerWaalsContact O-N 3.11Å
236P72.1Confident66.6Low123 Ų123116.6 Ų116.680%0.79963%0.629SS**PPolyproline II helixtrans-53.6125.8-178.421.4-31.2000108.3
237L65.4Low69.1Low160 Ų160110.3 Ų110.384%0.83860%0.603SS**PPolyproline II helixtrans-56133.9174.8-70.9167.1000107.5P235 E239P235-L237 PolarHBondContact O-N 2.83Å; P235-L237 VanDerWaalsContact O-N 3.11Å; L237-E239 PolarHBondContact O-N 2.87Å
238P67.9Low71.5Confident119 Ų119106.4 Ų106.477%0.77359%0.587SS**PPolyproline II helixtrans-56.8133.6179.123-31.6000109.1
239E70.9Confident73.7Confident178 Ų178107.4 Ų107.483%0.83258%0.576SS**PPolyproline II helixtrans-56.6138.9176.1-70.4-179.7177.500109.5L237 E241L237-E239 PolarHBondContact O-N 2.87Å; E239-E241 PolarHBondContact O-N 2.83Å
240P70.6Confident75.7Confident115 Ų115100.9 Ų100.975%0.74755%0.545SS*.PPolyproline II helixtrans-60.7129.4179.825.9-33.3000109.3V242P240-V242 PolarHBondContact O-N 3.46Å
241E78.7Confident77.7Confident105 Ų105101.6 Ų101.649%0.49154%0.544SS..PPolyproline II helixtrans-63.4130.9179.3-59.5-171.1146.100110.4E239 L246 L341 H371E239-E241 PolarHBondContact O-N 2.83Å; E241-L246 HydrophobicContact CB-CD1 3.84Å; E241-L246 HydrophobicContact CB-CD2 4.19Å; E241-L246 HydrophobicContact CB-CG 4.1Å; E241-L246 HydrophobicContact CG-CD2 4.4Å; E241-L341 VanDerWaalsContact O-CD1 3.26Å; E241-L341 WeakPolarHBondContact O-CD1 3.26Å; E241-H371 IonicContact OE2-CE1 2.73Å; E241-H371 PolarHBondContact OE2-CE1 3.49Å; E241-H371 IonicContact OE2-ND1 2.77Å
242V89.6Confident79.5Confident79 Ų79102 Ų10248%0.47954%0.542SS..PPolyproline II helixtrans-100.3133.6178.6-156.60000109.5P240 P244 D245 L246P240-V242 PolarHBondContact O-N 3.46Å; V242-P244 VanDerWaalsContact C-CD 3.45Å; V242-P244 HydrophobicContact CG1-CG 4.45Å; V242-D245 PolarHBondContact O-N 2.97Å; V242-L246 PolarHBondContact O-N 3.05Å; V242-L246 VanDerWaalsContact O-N 3.09Å
243L91.8Very high81.3Confident11 Ų1195.6 Ų95.66%0.05852%0.52CS..Hα-helixtrans-54.1-43.8-175.1-173.759.1000115D245 L246 L247 W250 V328 V339 L341 M373L243-D245 VanDerWaalsContact C-N 3.34Å; L243-D245 PolarHBondContact O-N 3Å; L243-L246 PolarHBondContact O-N 3.05Å; L243-L247 HydrophobicContact CD1-CD1 4.17Å; L243-L247 HydrophobicContact CD1-CG 4.19Å; L243-L247 HydrophobicContact CG-CD1 3.93Å; L243-L247 HydrophobicContact CG-CG 4.4Å; L243-L247 WeakPolarHBondContact O-CB 3.45Å; L243-L247 WeakPolarHBondContact O-CG 3.34Å; L243-L247 PolarHBondContact O-N 2.99Å; L243-W250 HydrophobicContact CD1-CH2 4.48Å; L243-W250 HydrophobicContact CD1-CZ3 4.28Å; L243-V328 HydrophobicContact CB-CG2 4.35Å; L243-V328 HydrophobicContact CD2-CB 3.81Å; L243-V328 HydrophobicContact CD2-CG1 4.02Å; L243-V328 HydrophobicContact CD2-CG2 3.86Å; L243-V328 HydrophobicContact CG-CB 4.45Å; L243-V328 HydrophobicContact CG-CG2 3.99Å; L243-V339 HydrophobicContact CD2-CB 4.25Å; L243-V339 HydrophobicContact CD2-CG1 3.92Å; L243-V339 WeakPolarHBondContact CD2-O 3.41Å; L243-L341 HydrophobicContact CB-CD1 4.17Å; L243-L341 HydrophobicContact CB-CG 3.93Å; L243-L341 HydrophobicContact CD1-CD2 3.66Å; L243-L341 HydrophobicContact CD1-CG 3.92Å; L243-L341 HydrophobicContact CG-CG 4.39Å; L243-M373 HydrophobicContact CD1-CE 4.21Å; L243-M373 HydrophobicContact CD1-CG 4.41Å; L243-M373 HydrophobicContact CD1-SD 4.25Å
244P93.6Very high82.6Confident21 Ų2197.4 Ų97.414%0.13653%0.528CS..Hα-helixtrans-61.2-42.3179.5-24.337.2000112.6V242 L247 H248 V322 G326 V328V242-P244 VanDerWaalsContact C-CD 3.45Å; V242-P244 HydrophobicContact CG1-CG 4.45Å; P244-L247 PolarHBondContact O-N 3.06Å; P244-H248 WeakPolarHBondContact O-CB 3.47Å; P244-H248 PolarHBondContact O-N 3.13Å; P244-V322 HydrophobicContact CB-CG1 3.83Å; P244-V322 HydrophobicContact CG-CG1 4.48Å; P244-G326 WeakPolarHBondContact CG-O 3.25Å; P244-V328 HydrophobicContact CG-CG2 3.89Å
245D92.2Very high84Confident101 Ų10196.1 Ų96.154%0.5453%0.526SS..Hα-helixtrans-69.3-38.7-179-62.1-21.4000110.6V242 L243 H248 R249V242-D245 PolarHBondContact O-N 2.97Å; L243-D245 VanDerWaalsContact C-N 3.34Å; L243-D245 PolarHBondContact O-N 3Å; D245-H248 PolarHBondContact O-N 2.8Å; D245-R249 WeakPolarHBondContact O-CB 3.42Å; D245-R249 VanDerWaalsContact O-CG 3.29Å; D245-R249 WeakPolarHBondContact O-CG 3.49Å; D245-R249 PolarHBondContact O-N 2.88Å
246L91.4Very high84.9Confident4 Ų4100.9 Ų100.92%0.02154%0.539CS..Hα-helixtrans-61.9-48.5172.1-71.6-179.4000111.9E241 V242 L243 H248 R249 W250 L341E241-L246 HydrophobicContact CB-CD1 3.84Å; E241-L246 HydrophobicContact CB-CD2 4.19Å; E241-L246 HydrophobicContact CB-CG 4.1Å; E241-L246 HydrophobicContact CG-CD2 4.4Å; V242-L246 PolarHBondContact O-N 3.05Å; V242-L246 VanDerWaalsContact O-N 3.09Å; L243-L246 PolarHBondContact O-N 3.05Å; L246-H248 VanDerWaalsContact C-N 3.27Å; L246-H248 PolarHBondContact O-N 2.81Å; L246-R249 WeakPolarHBondContact O-CB 3.4Å; L246-R249 PolarHBondContact O-N 2.82Å; L246-R249 VanDerWaalsContact O-N 3.12Å; L246-W250 HydrophobicContact CB-CD2 4.32Å; L246-W250 HydrophobicContact CB-CE3 4.28Å; L246-W250 HydrophobicContact CB-CH2 3.59Å; L246-W250 HydrophobicContact CB-CZ2 3.67Å; L246-W250 HydrophobicContact CB-CZ3 3.9Å; L246-W250 HydrophobicContact CD1-CH2 3.87Å; L246-W250 HydrophobicContact CD1-CZ2 3.89Å; L246-W250 HydrophobicContact CD2-CZ2 4.27Å; L246-W250 HydrophobicContact CG-CH2 4.33Å; L246-W250 HydrophobicContact CG-CZ2 4.18Å; L246-W250 PolarHBondContact O-N 2.87Å; L246-L341 HydrophobicContact CD1-CD1 3.87Å; L246-L341 HydrophobicContact CD1-CD2 4.01Å
247L92.3Very high85.8Confident35 Ų3597.5 Ų97.518%0.18351%0.513CS..Hα-helixtrans-59.2-39.4176.7-75.3166.5000111.9L243 P244 W250 S251 M320 V322 V328L243-L247 HydrophobicContact CD1-CD1 4.17Å; L243-L247 HydrophobicContact CD1-CG 4.19Å; L243-L247 HydrophobicContact CG-CD1 3.93Å; L243-L247 HydrophobicContact CG-CG 4.4Å; L243-L247 WeakPolarHBondContact O-CB 3.45Å; L243-L247 WeakPolarHBondContact O-CG 3.34Å; L243-L247 PolarHBondContact O-N 2.99Å; P244-L247 PolarHBondContact O-N 3.06Å; L247-W250 HydrophobicContact CB-CE3 4.48Å; L247-W250 HydrophobicContact CD2-CE3 3.79Å; L247-W250 HydrophobicContact CD2-CZ3 3.86Å; L247-W250 HydrophobicContact CG-CE3 4.13Å; L247-W250 HydrophobicContact CG-CZ3 4.02Å; L247-S251 WeakPolarHBondContact O-CB 3.29Å; L247-S251 PolarHBondContact O-N 2.75Å; L247-M320 HydrophobicContact CD1-CG 4.38Å; L247-V322 HydrophobicContact CB-CG2 4.5Å; L247-V322 HydrophobicContact CD1-CG2 3.88Å; L247-V328 HydrophobicContact CD1-CB 4.49Å; L247-V328 HydrophobicContact CD1-CG1 3.62Å; L247-V328 HydrophobicContact CD1-CG2 4.03Å
248H91.2Very high87.1Confident117 Ų11792.8 Ų92.854%0.54249%0.488SS..Hα-helixtrans-63.8-46.8174.2-173.564.9000111.6P244 D245 L246 W250 S251 L252P244-H248 WeakPolarHBondContact O-CB 3.47Å; P244-H248 PolarHBondContact O-N 3.13Å; D245-H248 PolarHBondContact O-N 2.8Å; L246-H248 VanDerWaalsContact C-N 3.27Å; L246-H248 PolarHBondContact O-N 2.81Å; H248-W250 PolarHBondContact O-N 3.01Å; H248-S251 WeakPolarHBondContact O-CB 3.38Å; H248-S251 PolarHBondContact O-N 3.15Å; H248-L252 WeakPolarHBondContact O-CG 3.48Å; H248-L252 PolarHBondContact O-N 2.99Å; H248-L252 VanDerWaalsContact O-N 3.13Å
249R90.8Very high88.3Confident155 Ų15590.8 Ų90.859%0.58547%0.467SS*.Hα-helixtrans-60.1-44.8176.2-75.3173.758.1-172.9-7.6112.3D245 L246 S251 L252 S253D245-R249 WeakPolarHBondContact O-CB 3.42Å; D245-R249 VanDerWaalsContact O-CG 3.29Å; D245-R249 WeakPolarHBondContact O-CG 3.49Å; D245-R249 PolarHBondContact O-N 2.88Å; L246-R249 WeakPolarHBondContact O-CB 3.4Å; L246-R249 PolarHBondContact O-N 2.82Å; L246-R249 VanDerWaalsContact O-N 3.12Å; R249-S251 VanDerWaalsContact C-N 3.34Å; R249-L252 PolarHBondContact O-N 2.75Å; R249-S253 PolarHBondContact O-N 3.05Å
250W90.8Very high89.4Confident32 Ų3287.3 Ų87.312%0.12145%0.45CS..Hα-helixtrans-64.2-39.7177.4-61.6-39.4000111.6L243 L246 L247 H248 L252 S253 E257 F259 H371 M373L243-W250 HydrophobicContact CD1-CH2 4.48Å; L243-W250 HydrophobicContact CD1-CZ3 4.28Å; L246-W250 HydrophobicContact CB-CD2 4.32Å; L246-W250 HydrophobicContact CB-CE3 4.28Å; L246-W250 HydrophobicContact CB-CH2 3.59Å; L246-W250 HydrophobicContact CB-CZ2 3.67Å; L246-W250 HydrophobicContact CB-CZ3 3.9Å; L246-W250 HydrophobicContact CD1-CH2 3.87Å; L246-W250 HydrophobicContact CD1-CZ2 3.89Å; L246-W250 HydrophobicContact CD2-CZ2 4.27Å; L246-W250 HydrophobicContact CG-CH2 4.33Å; L246-W250 HydrophobicContact CG-CZ2 4.18Å; L246-W250 PolarHBondContact O-N 2.87Å; L247-W250 HydrophobicContact CB-CE3 4.48Å; L247-W250 HydrophobicContact CD2-CE3 3.79Å; L247-W250 HydrophobicContact CD2-CZ3 3.86Å; L247-W250 HydrophobicContact CG-CE3 4.13Å; L247-W250 HydrophobicContact CG-CZ3 4.02Å; H248-W250 PolarHBondContact O-N 3.01Å; W250-L252 PolarHBondContact O-N 2.82Å; W250-S253 PolarHBondContact O-N 2.9Å; W250-S253 VanDerWaalsContact O-N 3.13Å; W250-S253 PolarHBondContact O-OG 3.38Å; W250-E257 PolarHBondContact NE1-OE2 3.15Å; W250-F259 HydrophobicContact CB-CZ 4.34Å; W250-F259 AromaticContact CD2-CE1 3.58Å; W250-F259 HydrophobicContact CD2-CE1 3.58Å; W250-F259 AromaticContact CD2-CZ 3.58Å; W250-F259 HydrophobicContact CD2-CZ 3.58Å; W250-F259 AromaticContact CE2-CE1 3.51Å; W250-F259 AromaticContact CE2-CZ 3.94Å; W250-F259 AromaticContact CE3-CE1 3.7Å; W250-F259 HydrophobicContact CE3-CE1 3.7Å; W250-F259 AromaticContact CE3-CZ 3.77Å; W250-F259 HydrophobicContact CE3-CZ 3.77Å; W250-F259 HydrophobicContact CG-CE1 4.24Å; W250-F259 AromaticContact CG-CZ 3.83Å; W250-F259 HydrophobicContact CG-CZ 3.83Å; W250-F259 HydrophobicContact CH2-CD1 4.31Å; W250-F259 AromaticContact CH2-CE1 3.83Å; W250-F259 HydrophobicContact CH2-CE1 3.83Å; W250-F259 HydrophobicContact CZ2-CD1 4.42Å; W250-F259 AromaticContact CZ2-CE1 3.64Å; W250-F259 HydrophobicContact CZ2-CE1 3.64Å; W250-F259 HydrophobicContact CZ2-CZ 4.48Å; W250-F259 HydrophobicContact CZ3-CD1 4.43Å; W250-F259 AromaticContact CZ3-CE1 3.87Å; W250-F259 HydrophobicContact CZ3-CE1 3.87Å; W250-F259 HydrophobicContact CZ3-CZ 4.36Å; W250-H371 HydrophobicContact CH2-CB 4.16Å; W250-H371 HydrophobicContact CZ2-CB 4.03Å; W250-H371 AromaticContact CZ2-CD2 3.42Å; W250-H371 VanDerWaalsContact CZ2-CD2 3.42Å; W250-H371 WeakPolarHBondContact CZ2-CD2 3.34Å; W250-H371 AromaticContact CZ2-CG 3.53Å; W250-H371 AromaticContact CZ2-ND1 3.91Å; W250-H371 AromaticContact CZ2-NE2 3.77Å; W250-M373 HydrophobicContact CE3-CE 4.17Å; W250-M373 HydrophobicContact CH2-CE 3.53Å; W250-M373 HydrophobicContact CZ3-CE 3.19Å
251S89.6Confident90.6Very high99 Ų9985.3 Ų85.369%0.69243%0.432SS*.Hα-helixtrans-62.9-28.6175.7-178.60000113.6L247 H248 R249L247-S251 WeakPolarHBondContact O-CB 3.29Å; L247-S251 PolarHBondContact O-N 2.75Å; H248-S251 WeakPolarHBondContact O-CB 3.38Å; H248-S251 PolarHBondContact O-N 3.15Å; R249-S251 VanDerWaalsContact C-N 3.34Å
252L92.2Very high91.4Very high123 Ų12384.4 Ų84.464%0.64443%0.428SS*.Hα-helixtrans-86.6-23176.3-65.8175.2000112.4H248 R249 W250H248-L252 WeakPolarHBondContact O-CG 3.48Å; H248-L252 PolarHBondContact O-N 2.99Å; H248-L252 VanDerWaalsContact O-N 3.13Å; R249-L252 PolarHBondContact O-N 2.75Å; W250-L252 PolarHBondContact O-N 2.82Å
253S89.6Confident91.7Very high52 Ų5282.7 Ų82.736%0.36442%0.416SS..  trans-72.6140.7-179.5810000110.9R249 W250R249-S253 PolarHBondContact O-N 3.05Å; W250-S253 PolarHBondContact O-N 2.9Å; W250-S253 VanDerWaalsContact O-N 3.13Å; W250-S253 PolarHBondContact O-OG 3.38Å
254K87.8Confident91.8Very high215 Ų21583.5 Ų83.594%0.93542%0.422SS*.  trans-93.5-0.4170.6-63.4-176.8-179.2179.50112.5
255A88.4Confident91.6Very high73 Ų7389.8 Ų89.860%0.60345%0.454SS*.SBendtrans-81.5141.7179.700000109.2
256E86.9Confident91.5Very high201 Ų20187.7 Ų87.794%0.93945%0.447SS*.  trans-80.2127.9170.6-64.6177179.700108.5
257E89.6Confident91.4Very high52 Ų5288 Ų8824%0.24345%0.449CS..  trans-129.8139.6178.5-170.3156.9-145.600109.4W250 F259 R370 H371W250-E257 PolarHBondContact NE1-OE2 3.15Å; E257-F259 HydrophobicContact CB-CZ 4.1Å; E257-F259 HydrophobicContact CG-CE1 4.17Å; E257-F259 HydrophobicContact CG-CZ 4.24Å; E257-R370 WeakPolarHBondContact OE1-CD 3.47Å; E257-R370 IonicContact OE1-NH1 3.42Å; E257-H371 IonicContact OE1-CD2 3.89Å; E257-H371 IonicContact OE1-NE2 2.84Å
258L93Very high91.1Very high61 Ų6189.1 Ų89.132%0.31946%0.458SS..EExtended strand (participates in β ladder)trans-95.8126.7-179.5-63.3174.4000110L351 V369L258-L351 HydrophobicContact CD1-CB 4.07Å; L258-L351 HydrophobicContact CD1-CD2 4Å; L258-V369 HydrophobicContact CB-CG2 4.37Å
259F93.1Very high90.5Very high78 Ų7885.5 Ų85.534%0.34245%0.453SS..EExtended strand (participates in β ladder)trans-107.3140.9177.1-55-69.2000110.6W250 E257 I261 H371 M373W250-F259 HydrophobicContact CB-CZ 4.34Å; W250-F259 AromaticContact CD2-CE1 3.58Å; W250-F259 HydrophobicContact CD2-CE1 3.58Å; W250-F259 AromaticContact CD2-CZ 3.58Å; W250-F259 HydrophobicContact CD2-CZ 3.58Å; W250-F259 AromaticContact CE2-CE1 3.51Å; W250-F259 AromaticContact CE2-CZ 3.94Å; W250-F259 AromaticContact CE3-CE1 3.7Å; W250-F259 HydrophobicContact CE3-CE1 3.7Å; W250-F259 AromaticContact CE3-CZ 3.77Å; W250-F259 HydrophobicContact CE3-CZ 3.77Å; W250-F259 HydrophobicContact CG-CE1 4.24Å; W250-F259 AromaticContact CG-CZ 3.83Å; W250-F259 HydrophobicContact CG-CZ 3.83Å; W250-F259 HydrophobicContact CH2-CD1 4.31Å; W250-F259 AromaticContact CH2-CE1 3.83Å; W250-F259 HydrophobicContact CH2-CE1 3.83Å; W250-F259 HydrophobicContact CZ2-CD1 4.42Å; W250-F259 AromaticContact CZ2-CE1 3.64Å; W250-F259 HydrophobicContact CZ2-CE1 3.64Å; W250-F259 HydrophobicContact CZ2-CZ 4.48Å; W250-F259 HydrophobicContact CZ3-CD1 4.43Å; W250-F259 AromaticContact CZ3-CE1 3.87Å; W250-F259 HydrophobicContact CZ3-CE1 3.87Å; W250-F259 HydrophobicContact CZ3-CZ 4.36Å; E257-F259 HydrophobicContact CB-CZ 4.1Å; E257-F259 HydrophobicContact CG-CE1 4.17Å; E257-F259 HydrophobicContact CG-CZ 4.24Å; F259-I261 HydrophobicContact CB-CG1 4.28Å; F259-H371 HydrophobicContact CD1-CB 4.15Å; F259-M373 HydrophobicContact CB-CE 4.44Å; F259-M373 HydrophobicContact CD1-CE 3.76Å; F259-M373 HydrophobicContact CE1-CE 4.27Å; F259-M373 HydrophobicContact CG-CE 4.12Å
260F95.1Very high89.6Confident104 Ų10485.2 Ų85.246%0.45646%0.458SS..EExtended strand (participates in β ladder)trans-101.4111168.7178.5-118.1000109.7V369 H371 K372 M373F260-V369 HydrophobicContact CB-CG1 3.65Å; F260-H371 PolarHBondContact N-O 3.21Å; F260-K372 HydrophobicContact CD1-CB 4.26Å; F260-K372 HydrophobicContact CD1-CD 3.68Å; F260-K372 HydrophobicContact CD1-CG 3.66Å; F260-K372 HydrophobicContact CE1-CD 3.86Å; F260-K372 HydrophobicContact CE1-CG 4.26Å; F260-K372 CarbonylContact O-C 3.42Å; F260-K372 VanDerWaalsContact O-CA 3.26Å; F260-K372 WeakPolarHBondContact O-CA 3.47Å; F260-M373 PolarHBondContact O-N 3.23Å
261I95.4Very high88.6Confident73 Ų7385.4 Ų85.437%0.37446%0.463SS..EExtended strand (participates in β ladder)trans-110.7121.8-177-54.9179000108.7F259 L263 M373F259-I261 HydrophobicContact CB-CG1 4.28Å; I261-L263 HydrophobicContact CG2-CD2 4.05Å; I261-L263 HydrophobicContact CG2-CG 4.49Å; I261-M373 HydrophobicContact CG1-CB 4.34Å; I261-M373 HydrophobicContact CG1-SD 4.43Å
262Q95.9Very high87.4Confident87 Ų8784.5 Ų84.541%0.40746%0.455SS..EExtended strand (participates in β ladder)trans-92.3118.1171.9-179.4176.4-21.100109.1M373 V374 C375Q262-M373 PolarHBondContact N-O 3.25Å; Q262-V374 HydrophobicContact CB-CG2 4.41Å; Q262-C375 PolarHBondContact O-N 3.11Å
263L95Very high85.8Confident43 Ų4383.4 Ų83.423%0.22545%0.453CS..PPolyproline II helixtrans-96.4164.2174.8-63177.9000110.8I261 L267 L309 L330 C375I261-L263 HydrophobicContact CG2-CD2 4.05Å; I261-L263 HydrophobicContact CG2-CG 4.49Å; L263-L267 HydrophobicContact CB-CD2 4.07Å; L263-L267 HydrophobicContact CD1-CD1 4.26Å; L263-L267 HydrophobicContact CD1-CD2 4.08Å; L263-L309 HydrophobicContact CD1-CD1 3.66Å; L263-L309 HydrophobicContact CD1-CD2 3.77Å; L263-L309 HydrophobicContact CD1-CG 3.79Å; L263-L330 HydrophobicContact CD2-CD2 4.05Å; L263-C375 HydrophobicContact CD2-CB 3.9Å
264P93.6Very high84.2Confident28 Ų2889.5 Ų89.518%0.18247%0.474CS..PPolyproline II helixtrans-60.3156.1169.5-20.332.8000111.9S266 L337 C375 P377P264-S266 PolarHBondContact O-N 3.22Å; P264-L337 HydrophobicContact CG-CD1 3.83Å; P264-L337 HydrophobicContact CG-CD2 4.13Å; P264-C375 WeakPolarHBondContact CD-O 3.19Å; P264-P377 HydrophobicContact CB-CG 4.28Å; P264-P377 HydrophobicContact CG-CG 3.99Å
265D90.1Very high82.2Confident153 Ų15387.3 Ų87.382%0.81847%0.467SS*.SBendtrans-62.2-25.5-179-64.3-23.6000113.2N308D265-N308 PolarHBondContact O-OD1 2.89Å
266S89.7Confident80.1Confident57 Ų5790 Ų9040%0.39947%0.466SS..SBendtrans-131.1127.4172.4-168.90000110.8P264 S306 C307P264-S266 PolarHBondContact O-N 3.22Å; S266-S306 WeakPolarHBondContact OG-CA 3.42Å; S266-C307 PolarHBondContact OG-N 3.37Å
267L90.1Very high77.8Confident11 Ų1189 Ų896%0.05846%0.459CS..BIsolated β-bridgetrans-88.4152.1176.5-62.3-178.2000111L263 G269 C307 L309 L312 L332L263-L267 HydrophobicContact CB-CD2 4.07Å; L263-L267 HydrophobicContact CD1-CD1 4.26Å; L263-L267 HydrophobicContact CD1-CD2 4.08Å; L267-G269 PolarHBondContact O-N 3.49Å; L267-C307 WeakPolarHBondContact CB-O 3.29Å; L267-C307 PolarHBondContact N-O 2.79Å; L267-C307 WeakPolarHBondContact O-CB 3.26Å; L267-L309 HydrophobicContact CD1-CD2 3.58Å; L267-L309 HydrophobicContact CD1-CG 3.84Å; L267-L312 HydrophobicContact CD1-CD1 3.96Å; L267-L332 HydrophobicContact CD2-CD1 4.34Å
268P85.4Confident75.5Confident57 Ų5792 Ų9237%0.3748%0.481SS..SBendtrans-66.2110171.529.3-35.2000109.4L332 V335P268-L332 HydrophobicContact CG-CB 3.75Å; P268-V335 HydrophobicContact CB-CB 4.17Å; P268-V335 HydrophobicContact CB-CG2 3.88Å; P268-V335 HydrophobicContact CG-CB 4.12Å; P268-V335 HydrophobicContact CG-CG2 4.39Å
269G78.9Confident73.2Confident42 Ų4294.9 Ų94.943%0.43350%0.501SS..SBendtrans170.1159.7179.300000110.8L267 C307L267-G269 PolarHBondContact O-N 3.49Å; G269-C307 VanDerWaalsContact O-CB 3.29Å; G269-C307 WeakPolarHBondContact O-CB 3.47Å
270Q72.4Confident70.8Confident149 Ų149100.2 Ų100.270%0.69652%0.524SS*.PPolyproline II helixtrans-99.2126.6167.8-166.2164.1-2.200107.2
271P68.6Low68.6Low35 Ų35100.5 Ų100.523%0.22753%0.534CS..PPolyproline II helixtrans-56.2146.8172.324.4-32000108.6T273 D311P271-T273 PolarHBondContact O-N 2.8Å; P271-D311 HydrophobicContact CB-CB 4.34Å
272P64.5Low66.3Low80 Ų80104.5 Ų104.552%0.51955%0.551SS.*PPolyproline II helixtrans-56.4116.4177.823.9-30.7000107.6K274 D311P272-K274 PolarHBondContact O-N 3.44Å; P272-D311 WeakPolarHBondContact CD-O 3.48Å
273T59.4Low64.1Low100 Ų100106.1 Ų106.161%0.61357%0.567SS**  trans-50.6112.6-179.246.30000108.2P271 E275P271-T273 PolarHBondContact O-N 2.8Å; T273-E275 PolarHBondContact O-N 2.73Å
274K55.2Low61.8Low181 Ų181112.2 Ų112.279%0.78759%0.594SS**  trans-64.699161.9-73.4179.1-177.5170.90104.5P272 H276P272-K274 PolarHBondContact O-N 3.44Å; K274-H276 PolarHBondContact O-CD2 3.23Å; K274-H276 PolarHBondContact O-N 3.22Å
275E45.6Very low59.9Low168 Ų168115.3 Ų115.379%0.78562%0.617SS**  trans-59.794.2173.5-68.9-176.5-17600107.7T273 K277T273-E275 PolarHBondContact O-N 2.73Å; E275-K277 PolarHBondContact O-N 3.45Å
276H45.2Very low58.3Low130 Ų130117.2 Ų117.260%0.60262%0.621SS**  trans-68.684.7162-80.6-94.9000106.1K274 T278K274-H276 PolarHBondContact O-CD2 3.23Å; K274-H276 PolarHBondContact O-N 3.22Å; H276-T278 VanDerWaalsContact C-N 3.3Å; H276-T278 PolarHBondContact O-N 3.14Å
277K37.8Very low56.7Low180 Ų180121.4 Ų121.478%0.78364%0.639SS**  trans-59.9100.7169.2-150.1176.1-168.3175.50105.4E275 V279E275-K277 PolarHBondContact O-N 3.45Å; K277-V279 VanDerWaalsContact C-N 3.34Å; K277-V279 PolarHBondContact O-N 2.83Å
278T41.8Very low55Low116 Ų116125 Ų12571%0.71268%0.678SS**  trans-57.7102.1175.554.30000106.9H276 K280H276-T278 VanDerWaalsContact C-N 3.3Å; H276-T278 PolarHBondContact O-N 3.14Å; T278-K280 VanDerWaalsContact C-N 3.33Å; T278-K280 PolarHBondContact O-N 3.04Å
279V44.2Very low53.2Low120 Ų120129.6 Ų129.673%0.72770%0.695SS**  trans-72.297.5175.6-179.10000105.7K277 T281K277-V279 VanDerWaalsContact C-N 3.34Å; K277-V279 PolarHBondContact O-N 2.83Å; V279-T281 VanDerWaalsContact C-N 3.32Å; V279-T281 PolarHBondContact O-N 2.81Å
280K43.8Very low51.6Low190 Ų190133 Ų13383%0.82671%0.712SS**  trans-71.693.7166.2-67.8-177179.4-178.80106.9T278 E282T278-K280 VanDerWaalsContact C-N 3.33Å; T278-K280 PolarHBondContact O-N 3.04Å; K280-E282 PolarHBondContact O-N 2.98Å
281T47.9Very low50.6Low110 Ų110130.8 Ų130.868%0.67571%0.708SS**  trans-82.1104.8167.7-51.20000107.5V279 V283V279-T281 VanDerWaalsContact C-N 3.32Å; V279-T281 PolarHBondContact O-N 2.81Å; T281-V283 HydrophobicContact CG2-CG2 4.28Å; T281-V283 PolarHBondContact O-N 2.8Å
282E46.9Very low49.4Very low157 Ų157137.6 Ų137.673%0.73474%0.742SS**  trans-76.7111.7171-166.5173.9-15800108.1K280K280-E282 PolarHBondContact O-N 2.98Å
283V50.4Low48.4Very low122 Ų122140.6 Ų140.674%0.73975%0.753SS**  trans-97.3112.7173.5-173.10000107.5T281T281-V283 HydrophobicContact CG2-CG2 4.28Å; T281-V283 PolarHBondContact O-N 2.8Å
284Q45.5Very low47.7Very low171 Ų171145 Ų14580%0.79976%0.763SS**  trans-82.2121.3172.8-65.2-176.212.600109.1
285S54.6Low47Very low93 Ų93141.8 Ų141.865%0.6576%0.759SS**  trans-86.5149.8166.1-64.10000110.3D287S285-D287 PolarHBondContact O-N 2.83Å; S285-D287 VanDerWaalsContact O-N 3.09Å
286E56.4Low47.1Very low192 Ų192142.5 Ų142.590%0.89776%0.762SS**SBendtrans-67.7-5.4-16963.4-171.5170.100116.2
287D56.9Low47.1Very low145 Ų145140.3 Ų140.378%0.77576%0.762SS**SBendtrans-113.555.2176.3-74.8-46000112.2S285 Q289S285-D287 PolarHBondContact O-N 2.83Å; S285-D287 VanDerWaalsContact O-N 3.09Å; D287-Q289 PolarHBondContact O-N 3.32Å
288G54.7Low47.2Very low86 Ų86139.4 Ų139.489%0.88776%0.76SS**SBendtrans54.9415600000120.1
289Q46.7Very low47.1Very low155 Ų155142.3 Ų142.372%0.72477%0.766SS**  trans-114.9103.7-174.8-165.6170-2.800109.9D287 V291D287-Q289 PolarHBondContact O-N 3.32Å; Q289-V291 HydrophobicContact CG-CG2 4.44Å; Q289-V291 PolarHBondContact O-N 2.9Å
290S45.4Very low47.1Very low113 Ų113145.8 Ų145.879%0.7977%0.774SS**  trans-70.7108.8174.358.30000110
291V50.3Low47.2Very low103 Ų103144.4 Ų144.462%0.62477%0.771SS**  trans-105.4112.5170.3-175.90000108.5Q289 L293Q289-V291 HydrophobicContact CG-CG2 4.44Å; Q289-V291 PolarHBondContact O-N 2.9Å; V291-L293 HydrophobicContact CG1-CD2 4.36Å; V291-L293 HydrophobicContact CG1-CG 4.22Å; V291-L293 PolarHBondContact O-N 2.84Å
292L44.6Very low47.1Very low178 Ų178143 Ų14393%0.93277%0.77SS**  trans-69.989.5171-77.1163.3000109.2K294L292-K294 PolarHBondContact O-N 2.85Å
293L44.3Very low47.6Very low143 Ų143143.1 Ų143.175%0.74977%0.77SS**  trans-80.2103.4166.5-71170.8000108.4V291 T295V291-L293 HydrophobicContact CG1-CD2 4.36Å; V291-L293 HydrophobicContact CG1-CG 4.22Å; V291-L293 PolarHBondContact O-N 2.84Å; L293-T295 VanDerWaalsContact C-N 3.32Å; L293-T295 PolarHBondContact O-N 2.92Å
294K44.3Very low48.1Very low191 Ų191143.6 Ų143.683%0.8377%0.769SS**  trans-63.897.6158.6-90.1-179.1171.4-176.50107.2L292 E296L292-K294 PolarHBondContact O-N 2.85Å; K294-E296 VanDerWaalsContact C-N 3.34Å; K294-E296 PolarHBondContact O-N 3.38Å; K294-E296 VanDerWaalsContact O-N 3.13Å
295T40.2Very low49.2Very low115 Ų115141 Ų14171%0.70676%0.761SS**  trans-75.694.5163.4-35.60000106.8L293 S297L293-T295 VanDerWaalsContact C-N 3.32Å; L293-T295 PolarHBondContact O-N 2.92Å; T295-S297 WeakPolarHBondContact CG2-OG 3.5Å; T295-S297 PolarHBondContact O-N 2.94Å
296E48Very low50.5Low182 Ų182139 Ų13985%0.8575%0.747SS**  trans-67.288.6160-73176.4178.600107K294K294-E296 VanDerWaalsContact C-N 3.34Å; K294-E296 PolarHBondContact O-N 3.38Å; K294-E296 VanDerWaalsContact O-N 3.13Å
297S44.6Very low51.9Low84 Ų84129.9 Ų129.959%0.58770%0.704SS**  trans-148.579.6169.862.40000108.8T295T295-S297 WeakPolarHBondContact CG2-OG 3.5Å; T295-S297 PolarHBondContact O-N 2.94Å
298Q40.3Very low53.5Low161 Ų161126.2 Ų126.275%0.75268%0.684SS**  trans-149.6116.2143-109.6164.110.900105.7E300Q298-E300 PolarHBondContact O-N 3.13Å
299E38.3Very low55.1Low178 Ų178127 Ų12783%0.83267%0.668SS**  trans-40.9124.4168.5-67.5161.9158.800107.7E301E299-E301 PolarHBondContact O-N 3.46Å
300E45.1Very low57.2Low193 Ų193129 Ų12990%0.90267%0.674SS**  trans-62.578.9163.1-67.1179.5166.900106.3Q298 A302Q298-E300 PolarHBondContact O-N 3.13Å; E300-A302 VanDerWaalsContact C-N 3.31Å; E300-A302 PolarHBondContact O-N 2.89Å
301E46.9Very low59.3Low161 Ų161126.5 Ų126.575%0.75265%0.652SS**  trans-56.3110.7152.8-72.9-160.3164.700103.6E299 E303E299-E301 PolarHBondContact O-N 3.46Å; E301-E303 PolarHBondContact O-N 3.18Å
302A44.5Very low61Low79 Ų79124.3 Ų124.365%0.65364%0.637SS**  trans-45.4110.5172.500000106.3E300 D304E300-A302 VanDerWaalsContact C-N 3.31Å; E300-A302 PolarHBondContact O-N 2.89Å; A302-D304 PolarHBondContact O-N 3.39Å
303E58.5Low63.1Low160 Ų160126.8 Ų126.875%0.74863%0.633SS**  trans-63.295.6178.2-71.3-175.1168.400105.4E301 N305E301-E303 PolarHBondContact O-N 3.18Å; E303-N305 PolarHBondContact O-N 3.33Å; E303-N305 PolarHBondContact O-ND2 2.99Å
304D59.8Low65.3Low133 Ų133129.6 Ų129.671%0.71164%0.643SS**  trans-6295.6175.3-82.2-28.7000105.7A302 S306A302-D304 PolarHBondContact O-N 3.39Å; D304-S306 PolarHBondContact O-N 3.02Å
305N68.3Low67.6Low116 Ų116123.4 Ų123.462%0.6263%0.633SS**  trans-67.123.6178-72.3-58.3000112.1E303E303-N305 PolarHBondContact O-N 3.33Å; E303-N305 PolarHBondContact O-ND2 2.99Å
306S81.3Confident70.1Confident52 Ų52124.5 Ų124.536%0.36464%0.639SS.*  trans-79.2120.7175.666.60000109.7S266 D304S266-S306 WeakPolarHBondContact OG-CA 3.42Å; D304-S306 PolarHBondContact O-N 3.02Å
307C87.1Confident72.1Confident0 Ų0119.2 Ų119.20%062%0.619CS.*BIsolated β-bridgetrans-99131.9173.8-179.90000110.9S266 L267 G269S266-C307 PolarHBondContact OG-N 3.37Å; L267-C307 WeakPolarHBondContact CB-O 3.29Å; L267-C307 PolarHBondContact N-O 2.79Å; L267-C307 WeakPolarHBondContact O-CB 3.26Å; G269-C307 VanDerWaalsContact O-CB 3.29Å; G269-C307 WeakPolarHBondContact O-CB 3.47Å
308N90.4Very high74.4Confident67 Ų67116.6 Ų116.636%0.35861%0.605SS.*  trans-117.1166.7178-68-18.9000111.9D265 K310 D311D265-N308 PolarHBondContact O-OD1 2.89Å; N308-K310 PolarHBondContact O-N 3.46Å; N308-D311 WeakPolarHBondContact CB-OD2 3.39Å; N308-D311 PolarHBondContact N-OD2 3.09Å; N308-D311 WeakPolarHBondContact O-CB 3.37Å; N308-D311 PolarHBondContact O-N 2.93Å
309L89.1Confident77Confident102 Ų102116.2 Ų116.253%0.53460%0.601SS.*THydrogen-bonded Turntrans-55.3-27.9175.8-75.6-179.7000113.6L263 L267 D311 L312L263-L309 HydrophobicContact CD1-CD1 3.66Å; L263-L309 HydrophobicContact CD1-CD2 3.77Å; L263-L309 HydrophobicContact CD1-CG 3.79Å; L267-L309 HydrophobicContact CD1-CD2 3.58Å; L267-L309 HydrophobicContact CD1-CG 3.84Å; L309-D311 VanDerWaalsContact C-N 3.26Å; L309-D311 PolarHBondContact O-N 2.9Å; L309-L312 HydrophobicContact CD2-CD1 4.22Å; L309-L312 PolarHBondContact O-N 3.37Å
310K89.6Confident79.7Confident197 Ų197111.5 Ų111.586%0.85758%0.58SS**THydrogen-bonded Turntrans-70.7-23.3179.3-61.9179-176.9174.80113N308N308-K310 PolarHBondContact O-N 3.46Å
311D88.8Confident82Confident62 Ų62105.5 Ų105.533%0.33255%0.554SS.*THydrogen-bonded Turntrans-89.2-16.9-177.5-52.9-47.2000111.7P271 P272 N308 L309P271-D311 HydrophobicContact CB-CB 4.34Å; P272-D311 WeakPolarHBondContact CD-O 3.48Å; N308-D311 WeakPolarHBondContact CB-OD2 3.39Å; N308-D311 PolarHBondContact N-OD2 3.09Å; N308-D311 WeakPolarHBondContact O-CB 3.37Å; N308-D311 PolarHBondContact O-N 2.93Å; L309-D311 VanDerWaalsContact C-N 3.26Å; L309-D311 PolarHBondContact O-N 2.9Å
312L87.5Confident84.4Confident57 Ų57101.1 Ų101.130%0.29854%0.538SS..SBendtrans-81.3143.7179.2-57.5-179000110.7L267 L309 V317L267-L312 HydrophobicContact CD1-CD1 3.96Å; L309-L312 HydrophobicContact CD2-CD1 4.22Å; L309-L312 PolarHBondContact O-N 3.37Å; L312-V317 HydrophobicContact CD1-CG1 3.88Å
313R88.2Confident86.7Confident229 Ų229103.2 Ų103.286%0.86453%0.529SS*.PPolyproline II helixtrans-75.2153.4171.2-60.4-173.4-164.4179.55.2110.2
314E90.7Very high88.3Confident203 Ų203106.5 Ų106.595%0.94954%0.541SS*.SBendtrans-57.3139.9172.6-63.6-179.7-179.300111.2
315G92.6Very high89.9Confident61 Ų61104.9 Ų104.963%0.62954%0.54SS*.SBendtrans148.6-166.7179.900000112.8V317G315-V317 PolarHBondContact O-N 2.86Å
316V91.6Very high90.9Very high137 Ų137101 Ų10183%0.8353%0.527SS*.  trans-73.6111.7175179.80000108.7
317V90.6Very high91.4Very high72 Ų72103 Ų10344%0.43653%0.527SS..  trans-84.6-33-179.7-170.40000111.7L312 G315 L332L312-V317 HydrophobicContact CD1-CG1 3.88Å; G315-V317 PolarHBondContact O-N 2.86Å; V317-L332 HydrophobicContact CB-CD2 4.43Å; V317-L332 HydrophobicContact CG1-CD2 3.62Å; V317-L332 WeakPolarHBondContact O-CD2 3.37Å
318G92.6Very high91.9Very high28 Ų28103.3 Ų103.329%0.28953%0.529SS..  trans-172.3-170.6-176.300000113.9I331G318-I331 CarbonylContact C-O 3.59Å; G318-I331 WeakPolarHBondContact CA-O 3.28Å
319K95Very high92.2Very high154 Ų154100.3 Ų100.367%0.6751%0.512SS*.EExtended strand (participates in β ladder)trans-129.6130.6179.4-63.9179.2-177.7175.30110.9I331K319-I331 PolarHBondContact N-O 3.39Å; K319-I331 PolarHBondContact O-N 2.87Å
320M95.1Very high92.5Very high78 Ų7896.6 Ų96.638%0.38449%0.493SS..EExtended strand (participates in β ladder)trans-82.5125.6169.6-168.767.674.500109.5L247 V328 L330 V339L247-M320 HydrophobicContact CD1-CG 4.38Å; M320-V328 HydrophobicContact CG-CG1 4.14Å; M320-V328 HydrophobicContact SD-CG1 3.56Å; M320-V328 VanDerWaalsContact SD-CG1 3.56Å; M320-L330 HydrophobicContact CE-CD1 4.42Å; M320-L330 HydrophobicContact SD-CB 4.38Å; M320-V339 HydrophobicContact CE-CG1 4.33Å; M320-V339 HydrophobicContact CE-CG2 4.19Å; M320-V339 HydrophobicContact SD-CB 4.35Å; M320-V339 HydrophobicContact SD-CG2 3.81Å
321L94.7Very high92.7Very high67 Ų6789.8 Ų89.835%0.35147%0.466SS..EExtended strand (participates in β ladder)trans-118.8124.8-178.7178.866.9000110.2R323 V328 Q329 I331L321-R323 HydrophobicContact CD2-CG 4.38Å; L321-V328 CarbonylContact O-C 3.5Å; L321-V328 WeakPolarHBondContact O-CA 3.26Å; L321-Q329 PolarHBondContact N-O 3.45Å; L321-Q329 PolarHBondContact O-N 2.9Å; L321-I331 HydrophobicContact CB-CD1 4.23Å; L321-I331 HydrophobicContact CD2-CD1 4.08Å
322V95.7Very high92.8Very high69 Ų6987.6 Ų87.642%0.41845%0.454SS..EExtended strand (participates in β ladder)trans-102.7117.3171.2-176.80000108.5P244 L247 V328P244-V322 HydrophobicContact CB-CG1 3.83Å; P244-V322 HydrophobicContact CG-CG1 4.48Å; L247-V322 HydrophobicContact CB-CG2 4.5Å; L247-V322 HydrophobicContact CD1-CG2 3.88Å; V322-V328 HydrophobicContact CG2-CG2 4.35Å
323R93.3Very high92.8Very high124 Ų12488.1 Ų88.147%0.46847%0.473SS..  trans-84.3158.2178.2-65.4-175.2175-107.63111.2L321 S325 G326 R327 Q329L321-R323 HydrophobicContact CD2-CG 4.38Å; R323-S325 PolarHBondContact O-N 3Å; R323-S325 VanDerWaalsContact O-N 3.14Å; R323-G326 PolarHBondContact O-N 3.28Å; R323-R327 WeakPolarHBondContact CB-O 3.4Å; R323-R327 PolarHBondContact N-O 2.94Å; R323-Q329 VanDerWaalsContact CZ-OE1 3.29Å
324K92.8Very high92.6Very high228 Ų22886.8 Ų86.899%0.99148%0.477SS*.THydrogen-bonded Turntrans-57.5-26.9174.3-67-174.2178.9-178.30113.5G326K324-G326 PolarHBondContact O-N 3Å
325S92.1Very high92.5Very high99 Ų9978.9 Ų78.969%0.69244%0.442SS*.THydrogen-bonded Turntrans-75.7-5.4176.157.40000114.1R323 R327R323-S325 PolarHBondContact O-N 3Å; R323-S325 VanDerWaalsContact O-N 3.14Å; S325-R327 VanDerWaalsContact C-N 3.29Å
326G90.9Very high92.5Very high35 Ų3578 Ų7836%0.36142%0.424SS..SBendtrans84.6-4.6-171.800000114.2P244 R323 K324 V328P244-G326 WeakPolarHBondContact CG-O 3.25Å; R323-G326 PolarHBondContact O-N 3.28Å; K324-G326 PolarHBondContact O-N 3Å; G326-V328 PolarHBondContact O-N 3.24Å
327R92.2Very high92.7Very high95 Ų9571.6 Ų71.636%0.35839%0.386SS..  trans-68.3129.3172.4-169.5172.5178.2-172-4.5109.7R323 S325 Q329 D338 D378R323-R327 WeakPolarHBondContact CB-O 3.4Å; R323-R327 PolarHBondContact N-O 2.94Å; S325-R327 VanDerWaalsContact C-N 3.29Å; R327-Q329 HydrophobicContact CG-CG 4.21Å; R327-D338 IonicContact CZ-OD1 3.79Å; R327-D338 VanDerWaalsContact CZ-OD1 3.27Å; R327-D338 IonicContact CZ-OD2 3.79Å; R327-D338 IonicContact NE-OD1 3.71Å; R327-D338 PolarHBondContact NE-OD1 3.11Å; R327-D338 IonicContact NE-OD2 2.91Å; R327-D338 PolarHBondContact NE-OD2 2.95Å; R327-D338 IonicContact NH2-OD1 3.75Å; R327-D338 PolarHBondContact NH2-OD1 3.42Å; R327-D338 IonicContact NH2-OD2 2.76Å; R327-D338 PolarHBondContact NH2-OD2 2.89Å; R327-D378 IonicContact CZ-OD2 3.41Å; R327-D378 VanDerWaalsContact NH2-CG 3.32Å; R327-D378 IonicContact NH2-OD1 3.27Å; R327-D378 IonicContact NH2-OD2 3.86Å; R327-D378 PolarHBondContact NH2-OD2 3.31Å
328V96.6Very high93Very high5 Ų570 Ų703%0.0337%0.374CS..EExtended strand (participates in β ladder)trans-108.4131.8177.7-175.90000109L243 P244 L247 M320 L321 V322 G326 V339L243-V328 HydrophobicContact CB-CG2 4.35Å; L243-V328 HydrophobicContact CD2-CB 3.81Å; L243-V328 HydrophobicContact CD2-CG1 4.02Å; L243-V328 HydrophobicContact CD2-CG2 3.86Å; L243-V328 HydrophobicContact CG-CB 4.45Å; L243-V328 HydrophobicContact CG-CG2 3.99Å; P244-V328 HydrophobicContact CG-CG2 3.89Å; L247-V328 HydrophobicContact CD1-CB 4.49Å; L247-V328 HydrophobicContact CD1-CG1 3.62Å; L247-V328 HydrophobicContact CD1-CG2 4.03Å; M320-V328 HydrophobicContact CG-CG1 4.14Å; M320-V328 HydrophobicContact SD-CG1 3.56Å; M320-V328 VanDerWaalsContact SD-CG1 3.56Å; L321-V328 CarbonylContact O-C 3.5Å; L321-V328 WeakPolarHBondContact O-CA 3.26Å; V322-V328 HydrophobicContact CG2-CG2 4.35Å; G326-V328 PolarHBondContact O-N 3.24Å; V328-V339 HydrophobicContact CB-CB 4.33Å; V328-V339 HydrophobicContact CG1-CB 4Å; V328-V339 HydrophobicContact CG1-CG2 4.47Å; V328-V339 PolarHBondContact O-N 3.32Å
329Q95.9Very high93.2Very high4 Ų469.1 Ų69.12%0.01936%0.364CS..EExtended strand (participates in β ladder)trans-133.7139.9-176.9-59.8-170.1-5600111.2L321 R323 R327 L337 D338L321-Q329 PolarHBondContact N-O 3.45Å; L321-Q329 PolarHBondContact O-N 2.9Å; R323-Q329 VanDerWaalsContact CZ-OE1 3.29Å; R327-Q329 HydrophobicContact CG-CG 4.21Å; Q329-L337 CarbonylContact C-O 3.55Å; Q329-L337 WeakPolarHBondContact CA-O 3.4Å; Q329-D338 WeakPolarHBondContact CG-OD1 3.47Å; Q329-D338 PolarHBondContact NE2-OD1 2.87Å
330L96.3Very high93.2Very high24 Ų2464.6 Ų64.613%0.12635%0.351CS..EExtended strand (participates in β ladder)trans-100113.7170177.564.7000108.6L263 M320 L332 L337 V339L263-L330 HydrophobicContact CD2-CD2 4.05Å; M320-L330 HydrophobicContact CE-CD1 4.42Å; M320-L330 HydrophobicContact SD-CB 4.38Å; L330-L332 HydrophobicContact CD2-CD1 3.95Å; L330-L332 HydrophobicContact CD2-CD2 4.43Å; L330-L332 HydrophobicContact CD2-CG 4.13Å; L330-L332 HydrophobicContact CG-CD1 4.29Å; L330-L332 HydrophobicContact CG-CD2 4.49Å; L330-L332 HydrophobicContact CG-CG 4.02Å; L330-L337 HydrophobicContact CB-CB 4.38Å; L330-L337 PolarHBondContact N-O 3.39Å; L330-L337 PolarHBondContact O-N 3.28Å; L330-V339 HydrophobicContact CB-CG2 3.67Å
331I94.6Very high93.2Very high55 Ų5563.5 Ų63.528%0.28235%0.347SS..EExtended strand (participates in β ladder)trans-88.1112.5177.3-52179.8000108.3G318 K319 L321 T336G318-I331 CarbonylContact C-O 3.59Å; G318-I331 WeakPolarHBondContact CA-O 3.28Å; K319-I331 PolarHBondContact N-O 3.39Å; K319-I331 PolarHBondContact O-N 2.87Å; L321-I331 HydrophobicContact CB-CD1 4.23Å; L321-I331 HydrophobicContact CD2-CD1 4.08Å; I331-T336 HydrophobicContact CG1-CG2 4.22Å
332L91.1Very high93Very high16 Ų1661.2 Ų61.28%0.08434%0.339CS..EExtended strand (participates in β ladder)trans-114.596177.3-72.8166.6000109.1L267 P268 V317 L330 Q334 V335 L337L267-L332 HydrophobicContact CD2-CD1 4.34Å; P268-L332 HydrophobicContact CG-CB 3.75Å; V317-L332 HydrophobicContact CB-CD2 4.43Å; V317-L332 HydrophobicContact CG1-CD2 3.62Å; V317-L332 WeakPolarHBondContact O-CD2 3.37Å; L330-L332 HydrophobicContact CD2-CD1 3.95Å; L330-L332 HydrophobicContact CD2-CD2 4.43Å; L330-L332 HydrophobicContact CD2-CG 4.13Å; L330-L332 HydrophobicContact CG-CD1 4.29Å; L330-L332 HydrophobicContact CG-CD2 4.49Å; L330-L332 HydrophobicContact CG-CG 4.02Å; L332-Q334 PolarHBondContact O-N 3.45Å; L332-Q334 VanDerWaalsContact O-N 3.08Å; L332-V335 PolarHBondContact N-O 3.21Å; L332-V335 PolarHBondContact O-N 2.86Å; L332-V335 VanDerWaalsContact O-N 3.09Å; L332-L337 HydrophobicContact CD1-CD1 3.43Å; L332-L337 VanDerWaalsContact CD1-CD1 3.43Å; L332-L337 HydrophobicContact CD1-CG 4.06Å
333G85.6Confident92.7Very high68 Ų6863.8 Ų63.870%0.70136%0.355SS*.THydrogen-bonded Turntrans61.8-111.9-174.600000111.5
334Q84.6Confident92.2Very high201 Ų20163.3 Ų63.394%0.93937%0.37SS*.THydrogen-bonded Turntrans-95.4-14.2-179.8-60.5177.615.900113.2L332L332-Q334 PolarHBondContact O-N 3.45Å; L332-Q334 VanDerWaalsContact O-N 3.08Å
335V89.1Confident91.6Very high37 Ų3754.3 Ų54.322%0.22434%0.336CS..EExtended strand (participates in β ladder)trans-100.4139.7-176.2178.90000109.8P268 L332 L337 L382P268-V335 HydrophobicContact CB-CB 4.17Å; P268-V335 HydrophobicContact CB-CG2 3.88Å; P268-V335 HydrophobicContact CG-CB 4.12Å; P268-V335 HydrophobicContact CG-CG2 4.39Å; L332-V335 PolarHBondContact N-O 3.21Å; L332-V335 PolarHBondContact O-N 2.86Å; L332-V335 VanDerWaalsContact O-N 3.09Å; V335-L337 HydrophobicContact CG1-CD2 4.13Å; V335-L382 HydrophobicContact CG1-CD2 4.44Å
336T93.4Very high91Very high41 Ų4155.7 Ų55.725%0.25235%0.346SS..EExtended strand (participates in β ladder)trans-104.9127.7172.654.80000109.9I331I331-T336 HydrophobicContact CG1-CG2 4.22Å
337L95.4Very high90.9Very high4 Ų460.7 Ų60.72%0.02136%0.358CS..EExtended strand (participates in β ladder)trans-103135.6170.7-53.6-175.9000109.2P264 Q329 L330 L332 V335 C375 S376 P377P264-L337 HydrophobicContact CG-CD1 3.83Å; P264-L337 HydrophobicContact CG-CD2 4.13Å; Q329-L337 CarbonylContact C-O 3.55Å; Q329-L337 WeakPolarHBondContact CA-O 3.4Å; L330-L337 HydrophobicContact CB-CB 4.38Å; L330-L337 PolarHBondContact N-O 3.39Å; L330-L337 PolarHBondContact O-N 3.28Å; L332-L337 HydrophobicContact CD1-CD1 3.43Å; L332-L337 VanDerWaalsContact CD1-CD1 3.43Å; L332-L337 HydrophobicContact CD1-CG 4.06Å; V335-L337 HydrophobicContact CG1-CD2 4.13Å; L337-C375 HydrophobicContact CB-CB 4.27Å; L337-C375 HydrophobicContact CD1-CB 3.98Å; L337-S376 CarbonylContact C-O 3.57Å; L337-S376 VanDerWaalsContact CA-O 3.3Å; L337-S376 WeakPolarHBondContact CA-O 3.23Å; L337-P377 HydrophobicContact CD2-CB 4.11Å; L337-P377 HydrophobicContact CD2-CG 4.14Å
338D95.8Very high90.9Very high37 Ų3761.9 Ų61.920%0.19837%0.371CS..EExtended strand (participates in β ladder)trans-75.1139.1168.2-77.4-25.2000110.5R327 Q329 C375 S376R327-D338 IonicContact CZ-OD1 3.79Å; R327-D338 VanDerWaalsContact CZ-OD1 3.27Å; R327-D338 IonicContact CZ-OD2 3.79Å; R327-D338 IonicContact NE-OD1 3.71Å; R327-D338 PolarHBondContact NE-OD1 3.11Å; R327-D338 IonicContact NE-OD2 2.91Å; R327-D338 PolarHBondContact NE-OD2 2.95Å; R327-D338 IonicContact NH2-OD1 3.75Å; R327-D338 PolarHBondContact NH2-OD1 3.42Å; R327-D338 IonicContact NH2-OD2 2.76Å; R327-D338 PolarHBondContact NH2-OD2 2.89Å; Q329-D338 WeakPolarHBondContact CG-OD1 3.47Å; Q329-D338 PolarHBondContact NE2-OD1 2.87Å; D338-C375 CarbonylContact O-C 3.59Å; D338-C375 VanDerWaalsContact O-CA 3.28Å; D338-C375 WeakPolarHBondContact O-CA 3.41Å; D338-S376 PolarHBondContact N-O 3.35Å; D338-S376 PolarHBondContact O-N 3.18Å
339V96.9Very high90.7Very high11 Ų1164.4 Ų64.47%0.06738%0.382CS..EExtended strand (participates in β ladder)trans-115.9125.8-179.6-169.40000109L243 M320 V328 L330 M373 V374L243-V339 HydrophobicContact CD2-CB 4.25Å; L243-V339 HydrophobicContact CD2-CG1 3.92Å; L243-V339 WeakPolarHBondContact CD2-O 3.41Å; M320-V339 HydrophobicContact CE-CG1 4.33Å; M320-V339 HydrophobicContact CE-CG2 4.19Å; M320-V339 HydrophobicContact SD-CB 4.35Å; M320-V339 HydrophobicContact SD-CG2 3.81Å; V328-V339 HydrophobicContact CB-CB 4.33Å; V328-V339 HydrophobicContact CG1-CB 4Å; V328-V339 HydrophobicContact CG1-CG2 4.47Å; V328-V339 PolarHBondContact O-N 3.32Å; L330-V339 HydrophobicContact CB-CG2 3.67Å; V339-M373 HydrophobicContact CG1-CB 4.12Å; V339-M373 HydrophobicContact CG1-SD 4.36Å; V339-V374 WeakPolarHBondContact CA-O 3.23Å
340S95.3Very high90.6Very high58 Ų5869 Ų6941%0.40640%0.404SS..EExtended strand (participates in β ladder)trans-126.1155.9176.9570000110.5G342 M373 V374S340-G342 PolarHBondContact O-N 3.01Å; S340-M373 CarbonylContact O-C 3.44Å; S340-M373 WeakPolarHBondContact O-CA 3.48Å; S340-V374 PolarHBondContact N-O 2.76Å; S340-V374 PolarHBondContact O-N 3.3Å; S340-V374 PolarHBondContact OG-O 3.03Å
341L94.5Very high90.6Very high56 Ų5671.6 Ų71.629%0.29342%0.417SS..EExtended strand (participates in β ladder)trans-67.7130.1168.7-75168000108.8E241 L243 L246E241-L341 VanDerWaalsContact O-CD1 3.26Å; E241-L341 WeakPolarHBondContact O-CD1 3.26Å; L243-L341 HydrophobicContact CB-CD1 4.17Å; L243-L341 HydrophobicContact CB-CG 3.93Å; L243-L341 HydrophobicContact CD1-CD2 3.66Å; L243-L341 HydrophobicContact CD1-CG 3.92Å; L243-L341 HydrophobicContact CG-CG 4.39Å; L246-L341 HydrophobicContact CD1-CD1 3.87Å; L246-L341 HydrophobicContact CD1-CD2 4.01Å
342G91.9Very high90.7Very high18 Ų1871.5 Ų71.519%0.18642%0.419CS..  trans-73179169.200000111.3S340 S344 K372S340-G342 PolarHBondContact O-N 3.01Å; G342-S344 PolarHBondContact O-N 2.92Å; G342-K372 PolarHBondContact N-O 2.91Å
343T88.8Confident91Very high124 Ų12473.5 Ų73.576%0.76143%0.434SS*.PPolyproline II helixtrans-56.1127.6175.4-43.80000111C345T343-C345 PolarHBondContact O-N 3.43Å
344S82.7Confident91.6Very high113 Ų11374.8 Ų74.879%0.7943%0.428SS*.PPolyproline II helixtrans-61.8129.8175.356.30000110.5G342G342-S344 PolarHBondContact O-N 2.92Å
345C79.3Confident92.1Very high40 Ų4071.3 Ų71.327%0.2741%0.412SS..PPolyproline II helixtrans-94.7120.8177.8-179.70000110.2T343 F347 Q349T343-C345 PolarHBondContact O-N 3.43Å; C345-F347 WeakPolarHBondContact SG-CD1 3.43Å; C345-F347 VanDerWaalsContact SG-CD2 3.52Å; C345-F347 WeakPolarHBondContact SG-CE1 3.19Å; C345-F347 VanDerWaalsContact SG-CE2 3.54Å; C345-F347 WeakPolarHBondContact SG-CG 3.49Å; C345-F347 WeakPolarHBondContact SG-CZ 3.28Å; C345-F347 PolarHBondContact SG-O 3.15Å; C345-Q349 VanDerWaalsContact SG-CD 3.55Å; C345-Q349 PolarHBondContact SG-NE2 2.77Å
346S81.2Confident92.3Very high128 Ų12875.3 Ų75.390%0.89544%0.437SS*.  trans-92.91.8177.163.80000113.7
347F88.8Confident92.2Very high139 Ų13975.7 Ų75.761%0.6145%0.449SS*.SBendtrans-109.2157.1176.160.4-92000111.2C345 Q349C345-F347 WeakPolarHBondContact SG-CD1 3.43Å; C345-F347 VanDerWaalsContact SG-CD2 3.52Å; C345-F347 WeakPolarHBondContact SG-CE1 3.19Å; C345-F347 VanDerWaalsContact SG-CE2 3.54Å; C345-F347 WeakPolarHBondContact SG-CG 3.49Å; C345-F347 WeakPolarHBondContact SG-CZ 3.28Å; C345-F347 PolarHBondContact SG-O 3.15Å; F347-Q349 HydrophobicContact CD2-CG 3.77Å; F347-Q349 HydrophobicContact CE2-CG 3.45Å; F347-Q349 VanDerWaalsContact CE2-CG 3.45Å; F347-Q349 HydrophobicContact CZ-CG 4.32Å; F347-Q349 PolarHBondContact O-N 3.05Å
348L90.4Very high91.8Very high120 Ų12084.9 Ų84.963%0.62849%0.492SS*.  trans-68.3123.5177.2179.967.1000110.1E350 N368L348-E350 HydrophobicContact CG-CG 4.28Å; L348-N368 VanDerWaalsContact CD1-ND2 3.28Å; L348-N368 WeakPolarHBondContact CD1-ND2 3.37Å
349Q93.7Very high91.5Very high59 Ų5992.7 Ų92.728%0.27652%0.524SS..EExtended strand (participates in β ladder)trans-116.3131171.6-66.4-175.8-11.700109.4C345 F347 N368 V369C345-Q349 VanDerWaalsContact SG-CD 3.55Å; C345-Q349 PolarHBondContact SG-NE2 2.77Å; F347-Q349 HydrophobicContact CD2-CG 3.77Å; F347-Q349 HydrophobicContact CE2-CG 3.45Å; F347-Q349 VanDerWaalsContact CE2-CG 3.45Å; F347-Q349 HydrophobicContact CZ-CG 4.32Å; F347-Q349 PolarHBondContact O-N 3.05Å; Q349-N368 CarbonylContact O-C 3.56Å; Q349-N368 VanDerWaalsContact O-CA 3.23Å; Q349-N368 WeakPolarHBondContact O-CA 3.42Å; Q349-V369 HydrophobicContact CB-CB 4.1Å; Q349-V369 PolarHBondContact O-N 3.06Å
350E94.4Very high91.2Very high100 Ų10097.8 Ų97.847%0.46756%0.555SS.*EExtended strand (participates in β ladder)trans-121.7130.1178.7-67.7-176.3164.200110.1L348 V352 V365 G367L348-E350 HydrophobicContact CG-CG 4.28Å; E350-V352 HydrophobicContact CB-CG2 4.37Å; E350-V365 HydrophobicContact CB-CG1 4.24Å; E350-V365 HydrophobicContact CG-CG1 4.42Å; E350-G367 CarbonylContact C-O 3.49Å; E350-G367 WeakPolarHBondContact CA-O 3.34Å
351L95.9Very high91.2Very high79 Ų7997.4 Ų97.441%0.41456%0.561SS.*EExtended strand (participates in β ladder)trans-82.8126.8169-178.566.5000108.6L258 L366 G367 V369L258-L351 HydrophobicContact CD1-CB 4.07Å; L258-L351 HydrophobicContact CD1-CD2 4Å; L351-L366 HydrophobicContact CB-CB 4.46Å; L351-L366 HydrophobicContact CD2-CB 4.31Å; L351-L366 HydrophobicContact CD2-CD1 3.89Å; L351-L366 HydrophobicContact CG-CB 4.33Å; L351-L366 HydrophobicContact CG-CD1 4.06Å; L351-L366 WeakPolarHBondContact O-CB 3.33Å; L351-L366 PolarHBondContact O-N 2.82Å; L351-G367 PolarHBondContact N-O 3.36Å; L351-G367 PolarHBondContact O-N 3.4Å; L351-V369 HydrophobicContact CB-CG2 4.24Å
352V97Very high91.2Very high52 Ų5299.6 Ų99.632%0.31557%0.572SS.*EExtended strand (participates in β ladder)trans-127.6132.1-174.8-176.20000109.5E350 V354 L363 T364 V365E350-V352 HydrophobicContact CB-CG2 4.37Å; V352-V354 HydrophobicContact CG1-CG2 4.14Å; V352-L363 HydrophobicContact CG1-CD1 4.1Å; V352-L363 HydrophobicContact CG1-CD2 3.49Å; V352-L363 VanDerWaalsContact CG1-CD2 3.49Å; V352-L363 HydrophobicContact CG1-CG 3.46Å; V352-L363 VanDerWaalsContact CG1-CG 3.46Å; V352-T364 CarbonylContact C-O 3.45Å; V352-T364 WeakPolarHBondContact CA-O 2.99Å; V352-T364 WeakPolarHBondContact CG1-O 3.22Å; V352-V365 HydrophobicContact CG2-CG2 4.27Å
353S96.9Very high91.4Very high58 Ų58104.5 Ų104.541%0.40659%0.594SS.*EExtended strand (participates in β ladder)trans-87.4125.6167.8-178.30000109.4L363 T364S353-L363 WeakPolarHBondContact O-CA 3.42Å; S353-T364 PolarHBondContact N-O 3.33Å; S353-T364 PolarHBondContact O-N 3.27Å
354V96.6Very high91.8Very high96 Ų96102.3 Ų102.358%0.58258%0.58SS**EExtended strand (participates in β ladder)trans-118.4112.7177.7-176.40000108.3V352 T356 L363V352-V354 HydrophobicContact CG1-CG2 4.14Å; V354-T356 HydrophobicContact CG1-CG2 4.17Å; V354-L363 HydrophobicContact CG2-CD1 4.27Å; V354-L363 HydrophobicContact CG2-CG 4.38Å
355Q95.8Very high92.5Very high128 Ų128100.4 Ų100.460%0.59856%0.564SS**EExtended strand (participates in β ladder)trans-109110.7174.1-173.6-179.623.400108.9G361 N362Q355-G361 CarbonylContact O-C 3.55Å; Q355-G361 WeakPolarHBondContact O-CA 3.4Å; Q355-N362 HydrophobicContact CB-CB 4.41Å; Q355-N362 PolarHBondContact N-O 3.14Å; Q355-N362 PolarHBondContact O-N 2.87Å
356T94.3Very high93.2Very high121 Ų121103.5 Ų103.574%0.74258%0.577SS**EExtended strand (participates in β ladder)trans-91.9121.5178.6550000110.5V354V354-T356 HydrophobicContact CG1-CG2 4.17Å
357G91.4Very high93.9Very high48 Ų4898.2 Ų98.250%0.49554%0.543SS..  trans-97.4177.9162.500000111.3K359 T360G357-K359 VanDerWaalsContact C-N 3.27Å; G357-K359 PolarHBondContact O-N 2.79Å; G357-T360 CarbonylContact C-O 3.59Å; G357-T360 WeakPolarHBondContact CA-O 3.07Å; G357-T360 PolarHBondContact N-O 2.84Å
358E87Confident94.1Very high198 Ų19895.1 Ų95.193%0.92553%0.533SS*.SBendtrans-61.4-30.2-176.2-65.5-179175.200114.3
359K87.8Confident94.2Very high200 Ų20090.4 Ų90.487%0.8751%0.509SS*.SBendtrans-132.8-26.6-176.1-66.7-179.3-177.9173.50114.3G357G357-K359 VanDerWaalsContact C-N 3.27Å; G357-K359 PolarHBondContact O-N 2.79Å
360T92Very high94Very high118 Ų11895.6 Ų95.672%0.72453%0.526SS*.  trans-135.3150.7177.859.10000108.6G357G357-T360 CarbonylContact C-O 3.59Å; G357-T360 WeakPolarHBondContact CA-O 3.07Å; G357-T360 PolarHBondContact N-O 2.84Å
361G93.8Very high93.9Very high51 Ų5192.3 Ų92.353%0.52651%0.51SS..EExtended strand (participates in β ladder)trans-134.5159.4177.400000111Q355Q355-G361 CarbonylContact O-C 3.55Å; Q355-G361 WeakPolarHBondContact O-CA 3.4Å
362N95.4Very high93.8Very high101 Ų10191.6 Ų91.654%0.5450%0.504SS..EExtended strand (participates in β ladder)trans-105133.8174.5-63.3-34.4000108.9Q355Q355-N362 HydrophobicContact CB-CB 4.41Å; Q355-N362 PolarHBondContact N-O 3.14Å; Q355-N362 PolarHBondContact O-N 2.87Å
363L96.9Very high93.8Very high121 Ų12189.3 Ų89.363%0.63449%0.49SS*.EExtended strand (participates in β ladder)trans-121.9119.2172.3-175.5151.6000107.6V352 S353 V354V352-L363 HydrophobicContact CG1-CD1 4.1Å; V352-L363 HydrophobicContact CG1-CD2 3.49Å; V352-L363 VanDerWaalsContact CG1-CD2 3.49Å; V352-L363 HydrophobicContact CG1-CG 3.46Å; V352-L363 VanDerWaalsContact CG1-CG 3.46Å; S353-L363 WeakPolarHBondContact O-CA 3.42Å; V354-L363 HydrophobicContact CG2-CD1 4.27Å; V354-L363 HydrophobicContact CG2-CG 4.38Å
364T97.3Very high93.8Very high78 Ų7888.4 Ų88.448%0.47948%0.482SS..EExtended strand (participates in β ladder)trans-126.9123.4-177.4-53.10000110V352 S353 L366V352-T364 CarbonylContact C-O 3.45Å; V352-T364 WeakPolarHBondContact CA-O 2.99Å; V352-T364 WeakPolarHBondContact CG1-O 3.22Å; S353-T364 PolarHBondContact N-O 3.33Å; S353-T364 PolarHBondContact O-N 3.27Å; T364-L366 PolarHBondContact O-N 3.33Å
365V96.7Very high93.8Very high74 Ų7484 Ų8445%0.44846%0.456SS..EExtended strand (participates in β ladder)trans-75.8119.6173.9-177.30000108.7E350 V352E350-V365 HydrophobicContact CB-CG1 4.24Å; E350-V365 HydrophobicContact CG-CG1 4.42Å; V352-V365 HydrophobicContact CG2-CG2 4.27Å
366L94.9Very high93.7Very high105 Ų10580.3 Ų80.355%0.5544%0.444SS..EExtended strand (participates in β ladder)trans-86-33.1-179.6-59.6-176.3000111.8L351 T364L351-L366 HydrophobicContact CB-CB 4.46Å; L351-L366 HydrophobicContact CD2-CB 4.31Å; L351-L366 HydrophobicContact CD2-CD1 3.89Å; L351-L366 HydrophobicContact CG-CB 4.33Å; L351-L366 HydrophobicContact CG-CD1 4.06Å; L351-L366 WeakPolarHBondContact O-CB 3.33Å; L351-L366 PolarHBondContact O-N 2.82Å; T364-L366 PolarHBondContact O-N 3.33Å
367G94.4Very high93.7Very high17 Ų1776.1 Ų76.118%0.17542%0.418CS..EExtended strand (participates in β ladder)trans154.5-176.7176.700000113.1E350 L351E350-G367 CarbonylContact C-O 3.49Å; E350-G367 WeakPolarHBondContact CA-O 3.34Å; L351-G367 PolarHBondContact N-O 3.36Å; L351-G367 PolarHBondContact O-N 3.4Å
368N93.8Very high93.7Very high74 Ų7474.3 Ų74.340%0.39640%0.397SS..EExtended strand (participates in β ladder)trans-94141.7-174-57.613.5000110.5L348 Q349L348-N368 VanDerWaalsContact CD1-ND2 3.28Å; L348-N368 WeakPolarHBondContact CD1-ND2 3.37Å; Q349-N368 CarbonylContact O-C 3.56Å; Q349-N368 VanDerWaalsContact O-CA 3.23Å; Q349-N368 WeakPolarHBondContact O-CA 3.42Å
369V92.7Very high93.8Very high21 Ų2171.2 Ų71.213%0.12738%0.381CS..EExtended strand (participates in β ladder)trans-99.8122.7172.7179.80000108.4L258 F260 Q349 L351L258-V369 HydrophobicContact CB-CG2 4.37Å; F260-V369 HydrophobicContact CB-CG1 3.65Å; Q349-V369 HydrophobicContact CB-CB 4.1Å; Q349-V369 PolarHBondContact O-N 3.06Å; L351-V369 HydrophobicContact CB-CG2 4.24Å
370R89.4Confident93.8Very high167 Ų16768.2 Ų68.263%0.6337%0.37SS*.EExtended strand (participates in β ladder)trans-109.2-39.4-178.8-69.2-177.1178.5170.7-1.5113.4E257E257-R370 WeakPolarHBondContact OE1-CD 3.47Å; E257-R370 IonicContact OE1-NH1 3.42Å
371H91.9Very high93.6Very high31 Ų3165.2 Ų65.214%0.14435%0.354CS..EExtended strand (participates in β ladder)trans-116.9131.8-172.1-57.7-78.2000110.7E241 W250 E257 F259 F260E241-H371 IonicContact OE2-CE1 2.73Å; E241-H371 PolarHBondContact OE2-CE1 3.49Å; E241-H371 IonicContact OE2-ND1 2.77Å; W250-H371 HydrophobicContact CH2-CB 4.16Å; W250-H371 HydrophobicContact CZ2-CB 4.03Å; W250-H371 AromaticContact CZ2-CD2 3.42Å; W250-H371 VanDerWaalsContact CZ2-CD2 3.42Å; W250-H371 WeakPolarHBondContact CZ2-CD2 3.34Å; W250-H371 AromaticContact CZ2-CG 3.53Å; W250-H371 AromaticContact CZ2-ND1 3.91Å; W250-H371 AromaticContact CZ2-NE2 3.77Å; E257-H371 IonicContact OE1-CD2 3.89Å; E257-H371 IonicContact OE1-NE2 2.84Å; F259-H371 HydrophobicContact CD1-CB 4.15Å; F260-H371 PolarHBondContact N-O 3.21Å
372K94.5Very high93.3Very high64 Ų6465.9 Ų65.928%0.27835%0.345SS..EExtended strand (participates in β ladder)trans-105137.9171.6179.4172-178.1-176.90109.4F260 G342F260-K372 HydrophobicContact CD1-CB 4.26Å; F260-K372 HydrophobicContact CD1-CD 3.68Å; F260-K372 HydrophobicContact CD1-CG 3.66Å; F260-K372 HydrophobicContact CE1-CD 3.86Å; F260-K372 HydrophobicContact CE1-CG 4.26Å; F260-K372 CarbonylContact O-C 3.42Å; F260-K372 VanDerWaalsContact O-CA 3.26Å; F260-K372 WeakPolarHBondContact O-CA 3.47Å; G342-K372 PolarHBondContact N-O 2.91Å
373M95.8Very high93Very high5 Ų566.8 Ų66.83%0.02535%0.35CS..EExtended strand (participates in β ladder)trans-122.6148.7170.8-57.6177-161.300109.7L243 W250 F259 F260 I261 Q262 V339 S340L243-M373 HydrophobicContact CD1-CE 4.21Å; L243-M373 HydrophobicContact CD1-CG 4.41Å; L243-M373 HydrophobicContact CD1-SD 4.25Å; W250-M373 HydrophobicContact CE3-CE 4.17Å; W250-M373 HydrophobicContact CH2-CE 3.53Å; W250-M373 HydrophobicContact CZ3-CE 3.19Å; F259-M373 HydrophobicContact CB-CE 4.44Å; F259-M373 HydrophobicContact CD1-CE 3.76Å; F259-M373 HydrophobicContact CE1-CE 4.27Å; F259-M373 HydrophobicContact CG-CE 4.12Å; F260-M373 PolarHBondContact O-N 3.23Å; I261-M373 HydrophobicContact CG1-CB 4.34Å; I261-M373 HydrophobicContact CG1-SD 4.43Å; Q262-M373 PolarHBondContact N-O 3.25Å; V339-M373 HydrophobicContact CG1-CB 4.12Å; V339-M373 HydrophobicContact CG1-SD 4.36Å; S340-M373 CarbonylContact O-C 3.44Å; S340-M373 WeakPolarHBondContact O-CA 3.48Å
374V96.9Very high92.8Very high38 Ų3866.6 Ų66.623%0.2335%0.345CS..EExtended strand (participates in β ladder)trans-122.8125175.6-176.70000108.4Q262 V339 S340Q262-V374 HydrophobicContact CB-CG2 4.41Å; V339-V374 WeakPolarHBondContact CA-O 3.23Å; S340-V374 PolarHBondContact N-O 2.76Å; S340-V374 PolarHBondContact O-N 3.3Å; S340-V374 PolarHBondContact OG-O 3.03Å
375C96.5Very high91.8Very high5 Ų567 Ų673%0.03435%0.352CS..EExtended strand (participates in β ladder)trans-101.9120.3175.3-58.90000109.4Q262 L263 P264 L337 D338Q262-C375 PolarHBondContact O-N 3.11Å; L263-C375 HydrophobicContact CD2-CB 3.9Å; P264-C375 WeakPolarHBondContact CD-O 3.19Å; L337-C375 HydrophobicContact CB-CB 4.27Å; L337-C375 HydrophobicContact CD1-CB 3.98Å; D338-C375 CarbonylContact O-C 3.59Å; D338-C375 VanDerWaalsContact O-CA 3.28Å; D338-C375 WeakPolarHBondContact O-CA 3.41Å
376S95.2Very high90.3Very high49 Ų4972 Ų7234%0.34337%0.367SS..EExtended strand (participates in β ladder)trans-119.1141.4178.651.90000110.9L337 D338L337-S376 CarbonylContact C-O 3.57Å; L337-S376 VanDerWaalsContact CA-O 3.3Å; L337-S376 WeakPolarHBondContact CA-O 3.23Å; D338-S376 PolarHBondContact N-O 3.35Å; D338-S376 PolarHBondContact O-N 3.18Å
377P93.6Very high88.1Confident33 Ų3375.6 Ų75.621%0.21439%0.393CS..EExtended strand (participates in β ladder)trans-60.3140.1172.4-18.932.7000111.1P264 L337 F379 L382P264-P377 HydrophobicContact CB-CG 4.28Å; P264-P377 HydrophobicContact CG-CG 3.99Å; L337-P377 HydrophobicContact CD2-CB 4.11Å; L337-P377 HydrophobicContact CD2-CG 4.14Å; P377-F379 HydrophobicContact CB-CE1 4.23Å; P377-F379 HydrophobicContact CB-CE2 4.27Å; P377-F379 HydrophobicContact CB-CZ 4.07Å; P377-F379 HydrophobicContact CG-CE1 4.49Å; P377-F379 HydrophobicContact CG-CE2 4.41Å; P377-F379 HydrophobicContact CG-CZ 4.02Å; P377-F379 WeakPolarHBondContact O-CD2 3.44Å; P377-F379 PolarHBondContact O-N 3.03Å; P377-F379 VanDerWaalsContact O-N 3.08Å; P377-L382 HydrophobicContact CB-CD1 3.98Å
378D90.9Very high87.8Confident10 Ų1078.5 Ų78.55%0.05340%0.404CS..  trans-78.188.2170-175.4-7000109.4R327 E380 S381 L382R327-D378 IonicContact CZ-OD2 3.41Å; R327-D378 VanDerWaalsContact NH2-CG 3.32Å; R327-D378 IonicContact NH2-OD1 3.27Å; R327-D378 IonicContact NH2-OD2 3.86Å; R327-D378 PolarHBondContact NH2-OD2 3.31Å; D378-E380 VanDerWaalsContact C-N 3.28Å; D378-E380 PolarHBondContact O-N 3.18Å; D378-E380 PolarHBondContact OD1-N 3.22Å; D378-S381 VanDerWaalsContact CG-OG 3.24Å; D378-S381 PolarHBondContact OD1-N 2.94Å; D378-S381 WeakPolarHBondContact OD2-CB 3.26Å; D378-S381 PolarHBondContact OD2-OG 3.03Å; D378-L382 WeakPolarHBondContact O-CB 3.47Å; D378-L382 WeakPolarHBondContact O-CG 3.18Å; D378-L382 PolarHBondContact O-N 3.33Å
379F88.7Confident87.4Confident134 Ų13478.7 Ų78.759%0.58841%0.405SS*.Hα-helixtrans-65-30.2-176.9-68.1-73.2000113.3P377 L382 L383P377-F379 HydrophobicContact CB-CE1 4.23Å; P377-F379 HydrophobicContact CB-CE2 4.27Å; P377-F379 HydrophobicContact CB-CZ 4.07Å; P377-F379 HydrophobicContact CG-CE1 4.49Å; P377-F379 HydrophobicContact CG-CE2 4.41Å; P377-F379 HydrophobicContact CG-CZ 4.02Å; P377-F379 WeakPolarHBondContact O-CD2 3.44Å; P377-F379 PolarHBondContact O-N 3.03Å; P377-F379 VanDerWaalsContact O-N 3.08Å; F379-L382 PolarHBondContact O-N 3.31Å; F379-L383 WeakPolarHBondContact O-CB 3.3Å; F379-L383 WeakPolarHBondContact O-CG 3.17Å; F379-L383 PolarHBondContact O-N 3.09Å
380E89.5Confident87.1Confident136 Ų13681.9 Ų81.964%0.63642%0.42SS*.Hα-helixtrans-63.5-55.5177.8-175174.1-160.700109.6D378 L382 L383 E384D378-E380 VanDerWaalsContact C-N 3.28Å; D378-E380 PolarHBondContact O-N 3.18Å; D378-E380 PolarHBondContact OD1-N 3.22Å; E380-L382 VanDerWaalsContact C-N 3.29Å; E380-L382 PolarHBondContact O-N 2.96Å; E380-L383 PolarHBondContact O-N 2.67Å; E380-L383 VanDerWaalsContact O-N 3.17Å; E380-E384 WeakPolarHBondContact O-CG 3.47Å; E380-E384 PolarHBondContact O-N 3.09Å
381S87.6Confident87Confident55 Ų5576.9 Ų76.939%0.38541%0.408SS..Hα-helixtrans-58.8-38.6176.3-64.60000112.7D378 S385D378-S381 VanDerWaalsContact CG-OG 3.24Å; D378-S381 PolarHBondContact OD1-N 2.94Å; D378-S381 WeakPolarHBondContact OD2-CB 3.26Å; D378-S381 PolarHBondContact OD2-OG 3.03Å; S381-S385 PolarHBondContact O-N 3.4Å
382L87.2Confident86.7Confident65 Ų6579.8 Ų79.834%0.3442%0.424SS..Hα-helixtrans-68.8-35179.5-72.7171.5000112.8V335 P377 D378 F379 E380 S385V335-L382 HydrophobicContact CG1-CD2 4.44Å; P377-L382 HydrophobicContact CB-CD1 3.98Å; D378-L382 WeakPolarHBondContact O-CB 3.47Å; D378-L382 WeakPolarHBondContact O-CG 3.18Å; D378-L382 PolarHBondContact O-N 3.33Å; F379-L382 PolarHBondContact O-N 3.31Å; E380-L382 VanDerWaalsContact C-N 3.29Å; E380-L382 PolarHBondContact O-N 2.96Å; L382-S385 PolarHBondContact O-OG 3.12Å
383L89.8Confident86.2Confident121 Ų12180.9 Ų80.963%0.63443%0.434SS*.Hα-helixtrans-79.6-36.6180-70.9171.3000112F379 E380 S385 K386F379-L383 WeakPolarHBondContact O-CB 3.3Å; F379-L383 WeakPolarHBondContact O-CG 3.17Å; F379-L383 PolarHBondContact O-N 3.09Å; E380-L383 PolarHBondContact O-N 2.67Å; E380-L383 VanDerWaalsContact O-N 3.17Å; L383-S385 VanDerWaalsContact C-N 3.26Å; L383-S385 PolarHBondContact O-N 2.89Å; L383-K386 PolarHBondContact O-N 3.32Å
384E91Very high85.5Confident117 Ų11786.3 Ų86.355%0.54746%0.463SS..Hα-helixtrans-62.3-33.7174.6-72.4-179.1173.800112.4E380 K386 T387E380-E384 WeakPolarHBondContact O-CG 3.47Å; E380-E384 PolarHBondContact O-N 3.09Å; E384-K386 PolarHBondContact O-N 2.92Å; E384-T387 PolarHBondContact O-N 3.31Å; E384-T387 PolarHBondContact O-OG1 3.16Å
385S77.2Confident84.6Confident87 Ų8790 Ų9061%0.60848%0.481SS*.THydrogen-bonded Turntrans-65.4-1018074.80000115.3S381 L382 L383S381-S385 PolarHBondContact O-N 3.4Å; L382-S385 PolarHBondContact O-OG 3.12Å; L383-S385 VanDerWaalsContact C-N 3.26Å; L383-S385 PolarHBondContact O-N 2.89Å
386K64.6Low83.6Confident179 Ų17997.1 Ų97.178%0.77852%0.519SS*.THydrogen-bonded Turntrans-102.2-5.2-178.9-71.1-176.1177-179.60114.2L383 E384L383-K386 PolarHBondContact O-N 3.32Å; E384-K386 PolarHBondContact O-N 2.92Å
387T48.6Very low82.6Confident179 Ų179101.5 Ų101.5100%1.09854%0.535SS*.  trans-99.40170.227.30000109.8E384E384-T387 PolarHBondContact O-N 3.31Å; E384-T387 PolarHBondContact O-OG1 3.16Å

Retrieved 387 of 387 residues in 236.7 ms (Link to these results)