A0A096N796_PAPAN Loading...

Homeobox protein Hox-B1

Sequence-specific transcription factor which is part of a developmental regulatory system that provides cells with specific positional identities on the anterior-posterior axis. Acts on the anterior body structures.

AlphaFold DB , UniProt , Accession A0A096N796, Species PAPAN (Papio anubis, Olive baboon), Gene HOXD1, Length 328 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M40.9Very low43.3Very low245 Ų245152.2 Ų152.2100%1.20783%0.833SS**  075.20-72.3152.3151.300108.4
2S41.3Very low43.3Very low130 Ų130150 Ų15091%0.90984%0.837SS**  trans-106.5107171.1-65.50000106.3
3S46.3Very low42.6Very low109 Ų109143.9 Ų143.976%0.76283%0.829SS**  trans-151.7141.1172.6-176.60000109.4
4Y44.5Very low42.3Very low204 Ų204140.1 Ų140.180%0.884%0.836SS**  trans89.383.3160.8-117.3-106.7000118.7
5L56.6Low41.8Very low149 Ų149136 Ų13678%0.7883%0.834SS**  178.295.896.9-97164.1000110.6
6E46.5Very low42Very low178 Ų178137.3 Ų137.383%0.83284%0.842SS**  trans-63135.7153.5-100.3-173.713000110.3
7Y36.7Very low41.8Very low184 Ų184133.9 Ų133.972%0.72284%0.84SS**  61.399.1128.5-145.5-101.9000118.9S9Y7-S9 VanDerWaalsContact OH-CB 3.31Å; Y7-S9 WeakPolarHBondContact OH-CB 3.44Å; Y7-S9 PolarHBondContact OH-OG 2.93Å
8V44.1Very low41.5Very low154 Ų154130.3 Ų130.393%0.93383%0.833SS**  trans-121.797.2139.6179.70000107
9S43.7Very low41.7Very low67 Ų67132.6 Ų132.647%0.46984%0.839SS.*  trans-79.8151167.9-166.20000110Y7Y7-S9 VanDerWaalsContact OH-CB 3.31Å; Y7-S9 WeakPolarHBondContact OH-CB 3.44Å; Y7-S9 PolarHBondContact OH-OG 2.93Å
10C36.9Very low41.9Very low128 Ų128132.3 Ų132.387%0.86584%0.835SS**  trans-54.2138.9-179.4-55.50000112.4
11S38.7Very low42.2Very low126 Ų126133.9 Ų133.988%0.88184%0.836SS**  trans-125.5109.4153.8-158.70000109
12S43.5Very low42Very low126 Ų126127.7 Ų127.788%0.88182%0.817SS**  trans-88131161.4176.50000107.1
13G34.2Very low41.9Very low71 Ų71129.5 Ų129.573%0.73282%0.816SS**  trans177.4102173.800000111.3
14G38.2Very low41.7Very low90 Ų90128 Ų12893%0.92881%0.81SS**  trans-69.3154.2177.800000113.5
15G35.4Very low41.7Very low79 Ų79124.6 Ų124.681%0.81481%0.813SS**  trans-163.3117.4173.600000109.8
16V45.2Very low41.5Very low157 Ų157125.9 Ų125.995%0.95281%0.812SS**  trans-71.1153.8-179-96.20000113.2
17G37.1Very low40.9Very low79 Ų79126.7 Ų126.781%0.81481%0.813SS**  trans111.5101.8170.900000110.7
18G38Very low41.2Very low70 Ų70122.7 Ų122.772%0.72281%0.812SS**  cis98.786.448.900000106.7
19D43.6Very low40.8Very low174 Ų174126.6 Ų126.693%0.9381%0.81SS**  trans-160.4133.1147-93.3-33.8000111.7
20V47.3Very low40.4Very low125 Ų125128.2 Ų128.276%0.75882%0.822SS**  trans-70125.6-175.2165.70000110.1
21L46.8Very low40.4Very low167 Ų167129.1 Ų129.187%0.87482%0.818SS**  trans-152.987.6139.7-77.5-169.9000109.9L23L21-L23 PolarHBondContact O-N 3.48Å
22S37Very low40.4Very low115 Ų115129.1 Ų129.180%0.80481%0.812SS**  trans-73.2112.3164.9-175.60000108.9
23L40.1Very low40Very low168 Ų168134 Ų13488%0.8881%0.811SS**  trans-92.6105.2168.3-78167.1000109L21L21-L23 PolarHBondContact O-N 3.48Å
24A41.3Very low40.8Very low77 Ų77135.8 Ų135.864%0.63681%0.81SS**  trans-71.3140.3171.900000111.8
25P45.5Very low40.9Very low132 Ų132139.9 Ų139.986%0.85781%0.81SS**  trans-88.5111.1156.2-6.224.8000109.5
26K51.4Low41.2Very low176 Ų176140.1 Ų140.177%0.76580%0.804SS**  trans-88.5121.1163.8-69.2-171.2176.9172.20109
27F35Very low40.9Very low195 Ų195141 Ų14186%0.85580%0.803SS**  173132.6101.4-103.6-80.8000110.4
28S43.1Very low41.2Very low101 Ų101145.6 Ų145.671%0.70680%0.803SS**  trans-77.8153.1173.656.80000111.5
29R34.1Very low42.1Very low235 Ų235146.9 Ų146.989%0.88780%0.799SS**  trans-148.5105.5141.5-149.7177.3172.6177-2.6109.9
30S35.6Very low41.7Very low102 Ų102143.5 Ų143.571%0.71380%0.795SS**  trans-81.4135.3167.2-47.10000108.5
31D36.6Very low41.1Very low146 Ų146146.6 Ų146.678%0.78180%0.798SS**  trans-117.8109.1159.7-125.6-45.1000107.1
32V38.8Very low40.7Very low127 Ų127144.8 Ų144.877%0.7780%0.8SS**  trans-115.6121.8171.71760000105.3
33R35.7Very low40.9Very low228 Ų228148 Ų14886%0.8681%0.807SS**  trans-115.5133.9164-110-125.1-78.9-174.5-6110.3
34P50.2Low40.6Very low108 Ų108143.2 Ų143.270%0.70180%0.798SS**  trans-97.8153.3-173.937.8-32.2000111.8
35L41.4Very low40.6Very low177 Ų177145.9 Ų145.993%0.92781%0.812SS**  trans-146119.6155.4-113.4134000109.2
36A41.2Very low40.3Very low84 Ų84143 Ų14369%0.69481%0.807SS**  trans-77.2153176.400000111.3
37L38.2Very low39.9Very low176 Ų176142.8 Ų142.892%0.92181%0.814SS**  -179.3143.5122.2-91.6162.2000110.1
38Q44.7Very low40.2Very low174 Ų174137.3 Ų137.381%0.81381%0.813SS**  trans-82.8-155.3-166.1-72.4-92.520.600113.3
39P55.8Low40.3Very low98 Ų98137 Ų13764%0.63682%0.816SS**  -128.4179.2-90.739.2-20.9000112.9
40A35.8Very low40.4Very low103 Ų103135.1 Ų135.185%0.85182%0.815SS**  trans-155.2118.5153.800000111.8
41F35.2Very low41Very low189 Ų189135.3 Ų135.383%0.82981%0.811SS**  trans-73.2152.2164.8-69.6-89.8000110.4
42S37.7Very low41.2Very low130 Ų130133.2 Ų133.291%0.90981%0.808SS**  trans-138.6129.6141.2-86.90000110.2
43L41.6Very low41.2Very low182 Ų182132.2 Ų132.295%0.95381%0.806SS**  trans-71.5149.9-178.1-14681.5000111.5
44G34.1Very low41.8Very low68 Ų68128.8 Ų128.870%0.70180%0.804SS**  trans159.88216700000110.7
45S40.7Very low41.8Very low133 Ų133128.7 Ų128.793%0.9380%0.803SS**  67107.691.5-165.40000112.5
46G38.7Very low41.7Very low72 Ų72128.4 Ų128.474%0.74280%0.801SS**  trans160.2103.5171.100000112.7
47D44.1Very low41.6Very low171 Ų171129.2 Ų129.291%0.91481%0.808SS**  trans-55.5151.6-177.5-54.7-74000115.2
48G40.6Very low42Very low80 Ų80125.8 Ų125.883%0.82581%0.805SS**  trans16797.3167.600000115
49A44.6Very low41.9Very low95 Ų95122.5 Ų122.579%0.78581%0.808SS**  trans-59.2145.5-176.700000116.7
50F37.7Very low41.6Very low194 Ų194129.3 Ų129.385%0.85182%0.821SS**  62.1120.8122.1-153.8-122.9000116.4
51V46.9Very low42.2Very low106 Ų106130.3 Ų130.364%0.64282%0.818SS**  -169.9127.664.71710000110.8
52S40.7Very low43.1Very low102 Ų102126.8 Ų126.871%0.71382%0.818SS**  trans14.3113.8133.7-138.40000122.1
53C39.4Very low44.1Very low106 Ų106126.3 Ų126.372%0.71681%0.811SS**  36.2124.7113.9-72.10000124.2
54L47.5Very low45.1Very low157 Ų157122.8 Ų122.882%0.82280%0.802SS**  trans80.7164.7141.8-85.2100.6000120.6
55P50.8Low46.8Very low105 Ų105125.2 Ų125.268%0.68281%0.805SS**  -141.7177.8-53.341.8-23.6000114.4
56L39.4Very low47.8Very low171 Ų171124.8 Ų124.890%0.89580%0.799SS**  trans45111.8142.8-164.569.4000120.7
57A40.1Very low48.2Very low101 Ų101126.3 Ų126.384%0.83581%0.805SS**  trans-147.1133.4151.500000112
58A45.1Very low48.9Very low104 Ų104124 Ų12486%0.8680%0.797SS**  trans-71.8143.6-179.600000112.9
59A43Very low50Low105 Ų105126.3 Ų126.387%0.86880%0.797SS**  trans-148.6141.7161.700000112.1
60R50.4Low50.5Low241 Ų241128.5 Ų128.591%0.90980%0.801SS**PPolyproline II helixtrans-69.3169-164.4-89.3167.6138.4-139.2-0.6116.5
61P47.7Very low51.8Low124 Ų124130 Ų13081%0.80580%0.801SS**PPolyproline II helixtrans-76148-173.331-35.6000114.4
62S53.3Low53Low116 Ų116130 Ų13081%0.81180%0.803SS**PPolyproline II helixtrans-73.3143177.3-176.60000112.7
63P59.5Low54.2Low119 Ų119131.1 Ų131.177%0.77381%0.808SS**PPolyproline II helixtrans-80.5142.8179.631.7-33.1000113.5
64S61.8Low55.7Low109 Ų109130.3 Ų130.376%0.76281%0.809SS**PPolyproline II helixtrans-72.5152.2175.634.90000113.7
65P70.3Confident57Low118 Ų118128.4 Ų128.477%0.76681%0.806SS**PPolyproline II helixtrans-80.2155175.131.7-33.6000113.1
66P61.1Low58Low125 Ų125129 Ų12981%0.81281%0.81SS**PPolyproline II helixtrans-75.9147.3-171.429.7-34.7000114.2
67A47.3Very low59.3Low103 Ų103126.9 Ų126.985%0.85181%0.806SS**PPolyproline II helixtrans-65131.4178.100000112.6
68T60.6Low60.1Low124 Ų124126.8 Ų126.876%0.76181%0.805SS**PPolyproline II helixtrans-78.4141.4165.938.90000110.4V70T68-V70 PolarHBondContact O-N 3.34Å
69P61.9Low60.5Low127 Ų127126 Ų12683%0.82580%0.799SS**PPolyproline II helixtrans-71.2123.2178.726.7-30.7000110.7R71P69-R71 PolarHBondContact O-N 3.44Å
70V55.7Low60.9Low141 Ų141126.7 Ų126.786%0.85580%0.795SS**  trans-68.4114.4174.4176.60000109.1T68T68-V70 PolarHBondContact O-N 3.34Å
71R65.1Low60.7Low226 Ų226124.3 Ų124.385%0.85379%0.794SS**PPolyproline II helixtrans-74.4130.4169.2-179.3176.8169.1-172-2.3109P69P69-R71 PolarHBondContact O-N 3.44Å
72P72.5Confident60.6Low105 Ų105129.3 Ų129.368%0.68280%0.798SS**PPolyproline II helixtrans-68.7145.1175.627.2-32.4000110.9
73P66.4Low60.3Low126 Ų126128.2 Ų128.282%0.81880%0.796SS**PPolyproline II helixtrans-69.9137.2175.628.7-33000110.8
74A69.8Low59.5Low89 Ų89131.5 Ų131.574%0.73680%0.801SS**PPolyproline II helixtrans-65.2147.5173.500000111.2
75P74.6Confident58.3Low117 Ų117132.5 Ų132.576%0.7681%0.806SS**PPolyproline II helixtrans-67.9148.1174.828.4-33.6000111.4
76P73.1Confident57.3Low119 Ų119133 Ų13377%0.77381%0.808SS**PPolyproline II helixtrans-69.1145.3177.828.7-33.9000111.5
77P66.4Low56.6Low126 Ų126135.3 Ų135.382%0.81881%0.812SS**PPolyproline II helixtrans-67.6142.7172.928.1-33000111.2
78A56.4Low56.5Low99 Ų99137.8 Ų137.882%0.81881%0.806SS**PPolyproline II helixtrans-56.7140.4179.300000112.4
79A53.6Low55.6Low88 Ų88135.2 Ų135.273%0.72780%0.804SS**PPolyproline II helixtrans-63.1140.7175.500000111.3
80P52.3Low54.5Low119 Ų119133.8 Ų133.877%0.77380%0.797SS**PPolyproline II helixtrans-69.7133.4172.628.2-31.1000110Y82P80-Y82 PolarHBondContact O-N 3.32Å
81Q45.6Very low53.6Low191 Ų191137.9 Ų137.989%0.89380%0.799SS**PPolyproline II helixtrans-64126.7173.8-64.9-173.3-20.100109.6A83Q81-A83 PolarHBondContact O-N 3.34Å
82Y45.3Very low52.7Low229 Ų229135.5 Ų135.590%0.89880%0.797SS**PPolyproline II helixtrans-67.7119.6168.6-89-97.5000108.9P80P80-Y82 PolarHBondContact O-N 3.32Å
83A48Very low51.9Low92 Ų92135.9 Ų135.976%0.7680%0.8SS**PPolyproline II helixtrans-73.4128.5168.300000109.7Q81 C85Q81-A83 PolarHBondContact O-N 3.34Å; A83-C85 PolarHBondContact O-N 3.44Å
84Q41.6Very low50.4Low188 Ų188133.4 Ų133.488%0.87980%0.797SS**PPolyproline II helixtrans-72.2119.4166.6-75.7-176.2-86.200109.2
85C36.4Very low48.7Very low130 Ų130138.7 Ų138.788%0.87881%0.806SS**  trans-88.7102.1164.3-76.30000109.3A83A83-C85 PolarHBondContact O-N 3.44Å
86T50.6Low47.1Very low129 Ų129137.4 Ų137.479%0.79181%0.806SS**  trans-87114.4156.936.60000108.2
87L45.4Very low45.8Very low174 Ų174137.9 Ų137.991%0.91181%0.809SS**  trans-114.794165.5-167.673.5000108.4
88E44.8Very low44.5Very low155 Ų155136.8 Ų136.872%0.72481%0.811SS**  trans-66139.5158.1-125.6-74.6156.300108.2S90E88-S90 PolarHBondContact OE2-OG 3.43Å
89G41.7Very low43.6Very low69 Ų69137 Ų13771%0.71181%0.813SS**  trans-159.963.3-172.500000110.9
90S38.9Very low42.7Very low97 Ų97138.1 Ų138.168%0.67882%0.821SS**  trans-60.1132.8168.2-63.90000112.6E88E88-S90 PolarHBondContact OE2-OG 3.43Å
91Y36.3Very low41.8Very low227 Ų227135.9 Ų135.989%0.8982%0.82SS**  trans-146.1136.114978.3-90.5000111
92E48Very low41.4Very low177 Ų177131.8 Ų131.883%0.82782%0.819SS**  trans-95.3173-168.1-94.4-79.1113.300112.6
93P53.8Low40.9Very low112 Ų112124 Ų12473%0.72781%0.808SS**  trans-98.5167.7-148.539.3-37.6000115.2
94G36.2Very low40.5Very low74 Ų74125.8 Ų125.876%0.76381%0.81SS**  trans-158100.6173.100000114.4
95E34.5Very low40.7Very low200 Ų200123 Ų12394%0.93580%0.801SS**  trans51.8128.4150.7-75.6176.2127.500123.8
96A39.4Very low40.7Very low90 Ų90127.9 Ų127.974%0.74480%0.803SS**  trans-73.8167.6170.900000113
97P47Very low40.2Very low130 Ų130124.9 Ų124.984%0.84480%0.797SS**  -131.3147.3111.735.1-27.1000113.6
98A38.2Very low39.6Very low103 Ų103125.4 Ų125.485%0.85179%0.792SS**  trans-76.7137.3175.100000111.8
99A37Very low39.4Very low104 Ų104126.4 Ų126.486%0.8680%0.801SS**  trans-162.3143.6144.700000110.3
100A36.5Very low39.1Very low110 Ų110125.6 Ų125.691%0.90979%0.793SS**  trans-70.2166.1-166.600000115.6
101G33.3Very low40Very low73 Ų73127.6 Ų127.675%0.75380%0.804SS**  trans137.3105.5149.100000115.2
102A35.4Very low39.9Very low105 Ų105120.2 Ų120.287%0.86880%0.797SS**  trans22.1124.3143.400000120
103G36.3Very low40Very low64 Ų64117.7 Ų117.766%0.6680%0.796SS**  56.6125.1110.200000119.4
104T40.1Very low39.2Very low130 Ų130116.7 Ų116.780%0.79880%0.797SS**  trans73.9119.1151.751.60000118.7
105D44.9Very low39.1Very low130 Ų130124.3 Ų124.370%0.69580%0.804SS**  trans44.1120.714191.1-79.9000121.2
106Y37Very low39.3Very low233 Ų233121.8 Ų121.891%0.91480%0.798SS**  trans-165.2132.1141.5-97-80.9000103.5
107G39.7Very low39.2Very low65 Ų65127 Ų12767%0.6780%0.804SS**  cis121.313030.600000107.8
108F32.7Very low39.5Very low185 Ų185126.3 Ų126.381%0.81180%0.799SS**  trans85.399.1144-150.5-99000120.5
109L41.1Very low39.5Very low176 Ų176124.8 Ų124.892%0.92179%0.794SS**  -134.2116.4116.2-79.5-178.9000108.5
110G35.2Very low39.4Very low52 Ų52126.9 Ų126.954%0.53680%0.795SS.*  trans-85-176.6179.500000114.9
111P56.7Low39.9Very low139 Ų139130 Ų13090%0.90380%0.796SS**  trans-120.2175.1-150.540.3-27.3000115.1
112G34.6Very low39.9Very low72 Ų72130 Ų13074%0.74280%0.795SS**  trans159.616515500000113.7
113P51.4Low40Very low124 Ų124136.2 Ų136.281%0.80580%0.796SS**  cis-118.2148.5-10.934.4-17.4000112.1
114A35.6Very low40Very low92 Ų92137 Ų13776%0.7680%0.796SS**  65.7108.865.100000114.8
115Y34.2Very low40.1Very low233 Ų233135.5 Ų135.591%0.91480%0.797SS**  trans-133.4133.2150.4-119-88.8000108.7
116D39.3Very low39.9Very low148 Ų148136.5 Ų136.579%0.79180%0.802SS**  trans-63.9151.8-163.2-74.3-83.7000117.9
117F36.8Very low40.1Very low200 Ų200132.5 Ų132.588%0.87780%0.797SS**  trans-135.7133.3147.8-140.6-93.8000108.9
118P53.4Low40.1Very low115 Ų115132.4 Ų132.475%0.74780%0.796SS**  trans-79.8141.3-168.431.3-33.7000112.2
119G38.6Very low40.5Very low71 Ų71127.7 Ų127.773%0.73280%0.799SS**  trans-83.7166.4175.800000114.4
120V35.7Very low40.3Very low148 Ų148123.5 Ų123.590%0.89779%0.79SS**  trans-133.9131.1149.4166.30000108.1
121L46.8Very low40.9Very low176 Ų176128.5 Ų128.592%0.92180%0.799SS**  trans-54.3154.9-179.3-74.8132.7000115.6
122G33.4Very low40.1Very low71 Ų71128 Ų12873%0.73279%0.793SS**  trans148.996.4138.600000118.6
123R36Very low40.6Very low237 Ų237131.9 Ų131.989%0.89479%0.792SS**  trans49121.5145.3-66.8-15583-162.34.4123.5
124A36.1Very low39.8Very low79 Ų79136.4 Ų136.465%0.65379%0.794SS**  37.8127.1114.600000123.3
125A42.3Very low40Very low100 Ų100135.3 Ų135.383%0.82679%0.785SS**  trans79.9126.713600000121.3
126D41.3Very low40.3Very low150 Ų150130.5 Ų130.580%0.80278%0.78SS**  trans82.5131.5142.8-133.7-127.1000122
127D42.4Very low40.2Very low150 Ų150128.7 Ų128.780%0.80278%0.779SS**  trans62.1150.7149.2-128-86.8000123.5
128G37.8Very low40.4Very low63 Ų63124 Ų12465%0.64978%0.777SS**  trans90.1110.4151.500000117.8
129G42.1Very low39.8Very low85 Ų85125.8 Ų125.888%0.87679%0.786SS**  trans-66.2146.6168.800000113.5
130A37.3Very low39.7Very low88 Ų88132.2 Ų132.273%0.72779%0.794SS**  trans-164.1121.1153.500000110.4
131H46.8Very low40.1Very low157 Ų157130.7 Ų130.773%0.72779%0.79SS**  trans21108.3134.6-162.933.5000117.7H133H131-H133 AromaticContact CD2-CD2 3.99Å; H131-H133 AromaticContact CE1-CD2 3.71Å; H131-H133 AromaticContact CE1-NE2 3.71Å; H131-H133 AromaticContact NE2-CD2 3.48Å; H131-H133 PolarHBondContact NE2-CD2 3.06Å; H131-H133 AromaticContact NE2-NE2 3.21Å; H131-H133 PolarHBondContact NE2-NE2 3.48Å
132V40.1Very low39.4Very low129 Ų129126.2 Ų126.278%0.78279%0.786SS**  trans-118.7111.7164.6-179.90000109.3Y134V132-Y134 PolarHBondContact O-N 3.4Å
133H44.8Very low39.6Very low154 Ų154126.8 Ų126.871%0.71379%0.792SS**  trans-58.6124.3160-79.6-109.1000109.4H131H131-H133 AromaticContact CD2-CD2 3.99Å; H131-H133 AromaticContact CE1-CD2 3.71Å; H131-H133 AromaticContact CE1-NE2 3.71Å; H131-H133 AromaticContact NE2-CD2 3.48Å; H131-H133 PolarHBondContact NE2-CD2 3.06Å; H131-H133 AromaticContact NE2-NE2 3.21Å; H131-H133 PolarHBondContact NE2-NE2 3.48Å
134Y35.9Very low39.4Very low219 Ų219118.2 Ų118.286%0.85978%0.777SS**  trans-105118.4157.1-165.4-97.7000109.4V132V132-Y134 PolarHBondContact O-N 3.4Å
135A38Very low39.5Very low69 Ų69119.9 Ų119.957%0.5778%0.784SS**  trans-67.2130.4175.900000111
136T42.5Very low39.3Very low132 Ų132124.6 Ų124.681%0.8179%0.786SS**  18.3110.9129-62.70000116.2
137S36.9Very low39.6Very low110 Ų110125.3 Ų125.377%0.76979%0.789SS**  -173.2132110.823.80000113.8
138A40.7Very low39.6Very low100 Ų100128.2 Ų128.283%0.82680%0.795SS**  trans66.684.3151.900000119.9
139V39.6Very low39.6Very low154 Ų154130.5 Ų130.593%0.93380%0.802SS**  trans-100.4113145.7-107.30000108.2
140F38.2Very low39.1Very low205 Ų205130 Ų13090%0.89980%0.796SS**  trans-87131.9167.5-126.7-88.7000109.7
141S43.8Very low39.2Very low116 Ų116133.6 Ų133.681%0.81180%0.798SS**  trans-27.2141.7173-69.10000118.9
142G32.1Very low38.7Very low82 Ų82133 Ų13385%0.84581%0.805SS**  trans-175.333161.200000115G144G142-G144 PolarHBondContact O-N 3.29Å
143G36.5Very low38.6Very low83 Ų83133.7 Ų133.786%0.85680%0.804SS**  trans-87.891.5176.700000111.9
144G32.4Very low38.2Very low57 Ų57137.6 Ų137.659%0.58881%0.814SS**  trans-102.788.3169.800000110.8G142G142-G144 PolarHBondContact O-N 3.29Å
145S38.7Very low38.2Very low114 Ų114131.6 Ų131.680%0.79781%0.81SS**  trans-108.8100.7166-640000108.3L147S145-L147 PolarHBondContact O-N 2.96Å
146F37.6Very low38.1Very low199 Ų199132 Ų13287%0.87381%0.813SS**  trans-81.993.7170-48.6-82000108
147L48.1Very low37.7Very low165 Ų165135.9 Ų135.986%0.86482%0.819SS**  trans-99106.4157.6-70.7179.1000107.5S145 S149S145-L147 PolarHBondContact O-N 2.96Å; L147-S149 PolarHBondContact O-N 3.33Å
148F41.7Very low37.6Very low212 Ų212134.1 Ų134.193%0.9382%0.819SS**  trans-78.7102.3165.7-164.8-91.2000107.3
149S37.9Very low37.4Very low111 Ų111137.6 Ų137.678%0.77682%0.818SS**  trans-151.288.2157.9-160.10000108L147 Q151L147-S149 PolarHBondContact O-N 3.33Å; S149-Q151 PolarHBondContact O-N 3.23Å
150G31.9Very low38Very low73 Ų73135.9 Ų135.975%0.75381%0.81SS**  trans-81.9105.4169.600000109
151Q38.5Very low37.9Very low165 Ų165128.5 Ų128.577%0.77179%0.792SS**  trans-119.8109.2153.3-171.9175.1-45.800105.2S149S149-Q151 PolarHBondContact O-N 3.23Å
152V37.7Very low38.1Very low144 Ų144129.2 Ų129.287%0.87379%0.794SS**  trans-113.6108.1177.2-97.80000108
153D37.2Very low38.5Very low144 Ų144135 Ų13577%0.7780%0.796SS**  trans-78.4139.2164.3-71.8-61.6000109.6
154Y36.7Very low39.2Very low235 Ų235137 Ų13792%0.92279%0.794SS**  trans-99.2115.2-171.1-157.4-85000109.1
155A35.1Very low39.5Very low93 Ų93138.8 Ų138.877%0.76980%0.803SS**  trans-178.3121.115600000114.3
156A35.6Very low39Very low78 Ų78139.2 Ų139.265%0.64581%0.805SS**  103.2133.3122.600000121.3
157F35.4Very low39Very low214 Ų214137 Ų13794%0.93980%0.801SS**  trans74.6130.4166.5-62.8-83.2000116.4
158G34.9Very low38.6Very low73 Ų73136.5 Ų136.575%0.75379%0.792SS**  cis155.1127.99.800000107.1
159E36.3Very low38.1Very low172 Ų172133.7 Ų133.780%0.80478%0.782SS**  trans-47167.5173-96.5-89127.900114.9G161E159-G161 PolarHBondContact OE2-N 3.42Å
160P51.5Low38.5Very low118 Ų118133.2 Ų133.277%0.76678%0.776SS**  cis-14216734.134.8-10.5000120.8
161G36.8Very low39.1Very low51 Ų51133.9 Ų133.953%0.52677%0.774SS.*  trans-62.9-168.1-178.800000118.4E159E159-G161 PolarHBondContact OE2-N 3.42Å
162P47.1Very low39.2Very low131 Ų131134.2 Ų134.285%0.85178%0.782SS**  -145.7154.171.735.5-15.8000116.7
163F40Very low39Very low202 Ų202131.2 Ų131.289%0.88678%0.78SS**  trans-109.6163.4165.8-77.2-82.7000111.3
164P52.2Low39.1Very low125 Ų125133.1 Ų133.181%0.81278%0.784SS**  -138.7168.2121.437.4-25.1000111.2
165A38.1Very low39.9Very low96 Ų96126.8 Ų126.879%0.79377%0.771SS**  cis-177.8140.3-24.200000106
166C28.4Very low39.9Very low123 Ų123126.1 Ų126.183%0.83177%0.773SS**  trans178.299.9148-154.30000108.2
167L38.5Very low39.9Very low151 Ų151126.4 Ų126.479%0.79178%0.776SS**  47.5132.983.7-88.5162.4000113.6
168K39.6Very low40.4Very low156 Ų156125.6 Ų125.668%0.67877%0.772SS**  cis-170153.94.7-158.3177.3159.2178.80105.6
169E31.2Very low40.8Very low153 Ų153131.3 Ų131.372%0.71578%0.779SS**  179.8154.9104.9-91.2-66.398.200111.8
170P46.3Very low41.3Very low101 Ų101129.8 Ų129.866%0.65678%0.782SS**  trans-103.6173.7-153.841.1-35.4000114.9
171A44.8Very low40.7Very low86 Ų86128.3 Ų128.371%0.71178%0.78SS**  trans-96.7146.117600000111.8
172D38.9Very low41.1Very low173 Ų173131.1 Ų131.193%0.92579%0.791SS**  trans-157.7135.9152-89.5-45.1000111.1
173G34.5Very low41.1Very low81 Ų81130.8 Ų130.884%0.83579%0.789SS**  trans96.2115.3148.300000120.8
174H39Very low41.6Very low184 Ų184125.2 Ų125.285%0.85278%0.781SS**  trans-80.4-176.8170.1-151.28.3000111.6
175P52.9Low41.6Very low102 Ų102124.7 Ų124.766%0.66278%0.777SS**  cis-128.9162.5-25.229.2-8000116
176G36.5Very low41.8Very low78 Ų78123.1 Ų123.180%0.80477%0.77SS**  trans74.1117.1140.700000120.6
177A34.6Very low42.7Very low85 Ų85123.8 Ų123.870%0.70277%0.771SS**  168.2122.5127.100000110.3
178F46Very low43.3Very low196 Ų196126.5 Ų126.586%0.8677%0.772SS**  trans-33132.5161.1-6.9-93.4000113
179Q43.9Very low43.8Very low193 Ų193124.9 Ų124.990%0.90278%0.777SS**  trans-154.2121.9135.8-72.2-153.271.700112.2
180T46.1Very low44.6Very low140 Ų140126.9 Ų126.986%0.85978%0.783SS**  trans-33.6127.7148.1-57.40000113.6
181A39.1Very low44.7Very low88 Ų88127.1 Ų127.173%0.72779%0.788SS**  trans-169.2117.4140.600000111
182S44.7Very low44.9Very low110 Ų110129.3 Ų129.377%0.76979%0.792SS**  trans-59.3143163.3-174.60000111.4
183P48.6Very low45.4Very low124 Ų124125.6 Ų125.681%0.80578%0.779SS**  trans-100113.2153.32.517.8000109.5
184A49.5Very low46.3Very low85 Ų85127.8 Ų127.870%0.70278%0.779SS**  trans-66171165.200000111.1
185P52Low46.9Very low114 Ų114123.1 Ų123.174%0.7477%0.772SS**  trans-82128.3-146.533.5-34.5000113.2
186G42.2Very low46.8Very low62 Ų62124 Ų12464%0.63978%0.781SS**  trans-120.3111.4173.100000111.3
187T48.3Very low47.4Very low138 Ų138123.9 Ų123.985%0.84778%0.78SS**  trans50.586.6152.241.50000117.5
188Y49.6Very low48.2Very low207 Ų207127.5 Ų127.581%0.81279%0.786SS**  trans-62.8128.6157.4-54.9-87.5000109.4K190Y188-K190 PolarHBondContact O-N 3.31Å
189P52Low48.4Very low123 Ų123123.5 Ų123.580%0.79978%0.78SS**  trans-64.9126.8164.826-29.3000108.3S191P189-S191 PolarHBondContact O-N 3.11Å
190K46.8Very low48.9Very low194 Ų194119.2 Ų119.284%0.84378%0.777SS**  trans-48.5107.2172.3-159.3170.8-170.1170.80108.5Y188 V192Y188-K190 PolarHBondContact O-N 3.31Å; K190-V192 VanDerWaalsContact C-N 3.35Å; K190-V192 PolarHBondContact O-N 3.21Å
191S49.6Very low49.5Very low107 Ų107116.2 Ų116.275%0.74877%0.767SS**  trans-61.1100.2169.6170.30000107.5P189 S193P189-S191 PolarHBondContact O-N 3.11Å; S191-S193 VanDerWaalsContact C-N 3.33Å; S191-S193 PolarHBondContact O-N 3.21Å
192V48.8Very low50.3Low131 Ų131121.5 Ų121.579%0.79477%0.774SS**  trans-67.399.9168.2-149.60000105.3K190 P194K190-V192 VanDerWaalsContact C-N 3.35Å; K190-V192 PolarHBondContact O-N 3.21Å; V192-P194 WeakPolarHBondContact O-CD 3.47Å
193S48.9Very low51.4Low95 Ų95120.4 Ų120.466%0.66477%0.766SS**  trans-52.3122.6166.6-63.20000108S191 A195S191-S193 VanDerWaalsContact C-N 3.33Å; S191-S193 PolarHBondContact O-N 3.21Å; S193-A195 VanDerWaalsContact C-N 3.34Å; S193-A195 PolarHBondContact O-N 3.06Å
194P53.3Low52.7Low128 Ų128118 Ų11883%0.83175%0.749SS**  trans-73.4100.7165.529-26.3000106.3V192V192-P194 WeakPolarHBondContact O-CD 3.47Å
195A51.2Low54.4Low85 Ų85119.4 Ų119.470%0.70274%0.74SS**  trans-64.7136.4158.100000108.1S193S193-A195 VanDerWaalsContact C-N 3.34Å; S193-A195 PolarHBondContact O-N 3.06Å
196S50.8Low56Low122 Ų122120.6 Ų120.685%0.85374%0.736SS**SBendtrans94.5104.8164.3-400000117
197G50.5Low58.2Low75 Ų75126.9 Ų126.977%0.77374%0.74SS**  trans85.351.5130.600000118.3
198L50.1Low60.2Low160 Ų160124.4 Ų124.484%0.83872%0.72SS**  trans-111.6130.5153.8-64.5176.1000107.2A200L198-A200 PolarHBondContact O-N 2.98Å; L198-A200 VanDerWaalsContact O-N 3.15Å
199P50.9Low61.9Low112 Ų112120 Ų12073%0.72771%0.705SS**  trans-56.1130.316726.3-31.3000105.8A201P199-A201 HydrophobicContact CB-CB 4.46Å; P199-A201 PolarHBondContact O-N 3.03Å
200A54.5Low63.2Low103 Ų103119 Ų11985%0.85170%0.696SS**  trans-65.743.6175.500000112L198 F202L198-A200 PolarHBondContact O-N 2.98Å; L198-A200 VanDerWaalsContact O-N 3.15Å; A200-F202 PolarHBondContact O-N 3.3Å
201A57.9Low64.4Low78 Ų78118.9 Ų118.965%0.64570%0.696SS**  trans-90.856.9173.900000108.9P199 S203P199-A201 HydrophobicContact CB-CB 4.46Å; P199-A201 PolarHBondContact O-N 3.03Å; A201-S203 PolarHBondContact O-N 2.96Å
202F57.1Low65.6Low199 Ų199123.4 Ų123.487%0.87370%0.697SS**SBendtrans-6699.7145.2-82.2-81.8000105.9A200 T204A200-F202 PolarHBondContact O-N 3.3Å; F202-T204 PolarHBondContact O-N 3.42Å
203S66.1Low65.8Low86 Ų86124.5 Ų124.560%0.60170%0.698SS**  trans-5.285.6168-168.90000114.4A201 F205A201-S203 PolarHBondContact O-N 2.96Å; S203-F205 PolarHBondContact O-N 3.47Å
204T77.4Confident66.2Low74 Ų74124.5 Ų124.545%0.45470%0.704SS.*  trans-73.2109.4162.9-55.90000106.2F202 M208 K209F202-T204 PolarHBondContact O-N 3.42Å; T204-M208 HydrophobicContact CG2-CB 3.63Å; T204-M208 HydrophobicContact CG2-SD 4.27Å; T204-K209 HydrophobicContact CG2-CG 3.96Å; T204-K209 VanDerWaalsContact O-CE 3.3Å; T204-K209 WeakPolarHBondContact O-CE 3.46Å
205F85.1Confident66.2Low114 Ų114122 Ų12250%0.569%0.689SS.*  trans-59.5148179.9-64.2-91.7000110.6S203 W207 M208 K209S203-F205 PolarHBondContact O-N 3.47Å; F205-W207 HydrophobicContact CB-CG 4.28Å; F205-W207 AromaticContact CG-NE1 3.8Å; F205-W207 PolarHBondContact O-N 3.41Å; F205-M208 HydrophobicContact CB-CE 4.44Å; F205-M208 HydrophobicContact CB-CG 4.34Å; F205-M208 HydrophobicContact CD2-CE 3.39Å; F205-M208 HydrophobicContact CD2-SD 4.11Å; F205-M208 HydrophobicContact CE2-CE 4.05Å; F205-M208 HydrophobicContact CG-CE 4.32Å; F205-M208 WeakPolarHBondContact O-CA 3.34Å; F205-M208 VanDerWaalsContact O-CB 3.32Å; F205-M208 WeakPolarHBondContact O-CB 3.46Å; F205-M208 PolarHBondContact O-N 3.35Å; F205-K209 PolarHBondContact O-N 2.62Å
206E85.2Confident66.1Low140 Ų140127.9 Ų127.965%0.65470%0.699SS**THydrogen-bonded Turntrans-56-30.7-177-64.6-55.9117.200113.2M208 K209E206-M208 VanDerWaalsContact C-N 3.33Å; E206-M208 PolarHBondContact O-N 2.92Å; E206-K209 WeakPolarHBondContact O-CB 3.29Å; E206-K209 PolarHBondContact O-N 3.02Å; E206-K209 WeakPolarHBondContact OE1-CE 3.48Å; E206-K209 IonicContact OE1-NZ 3.51Å; E206-K209 PolarHBondContact OE1-NZ 2.81Å; E206-K209 IonicContact OE2-NZ 2.84Å
207W87.7Confident65.9Low194 Ų194131.7 Ų131.774%0.73570%0.7SS**THydrogen-bonded Turntrans-68.9-29.4174.872.3-98.2000113.3F205 K209F205-W207 HydrophobicContact CB-CG 4.28Å; F205-W207 AromaticContact CG-NE1 3.8Å; F205-W207 PolarHBondContact O-N 3.41Å; W207-K209 VanDerWaalsContact C-N 3.29Å
208M89.8Confident65.5Low86 Ų86133.1 Ų133.142%0.42470%0.698SS.*THydrogen-bonded Turntrans-74.9-22.3174.1-62.2179.4-169.200111.4T204 F205 E206 V210T204-M208 HydrophobicContact CG2-CB 3.63Å; T204-M208 HydrophobicContact CG2-SD 4.27Å; F205-M208 HydrophobicContact CB-CE 4.44Å; F205-M208 HydrophobicContact CB-CG 4.34Å; F205-M208 HydrophobicContact CD2-CE 3.39Å; F205-M208 HydrophobicContact CD2-SD 4.11Å; F205-M208 HydrophobicContact CE2-CE 4.05Å; F205-M208 HydrophobicContact CG-CE 4.32Å; F205-M208 WeakPolarHBondContact O-CA 3.34Å; F205-M208 VanDerWaalsContact O-CB 3.32Å; F205-M208 WeakPolarHBondContact O-CB 3.46Å; F205-M208 PolarHBondContact O-N 3.35Å; E206-M208 VanDerWaalsContact C-N 3.33Å; E206-M208 PolarHBondContact O-N 2.92Å; M208-V210 VanDerWaalsContact C-N 3.27Å; M208-V210 PolarHBondContact O-N 3.13Å
209K85.3Confident65.5Low113 Ų113135.2 Ų135.249%0.49170%0.701SS.*SBendtrans-77.777.8173.8-61.7179.7-176.81660109.5T204 F205 E206 W207 K211T204-K209 HydrophobicContact CG2-CG 3.96Å; T204-K209 VanDerWaalsContact O-CE 3.3Å; T204-K209 WeakPolarHBondContact O-CE 3.46Å; F205-K209 PolarHBondContact O-N 2.62Å; E206-K209 WeakPolarHBondContact O-CB 3.29Å; E206-K209 PolarHBondContact O-N 3.02Å; E206-K209 WeakPolarHBondContact OE1-CE 3.48Å; E206-K209 IonicContact OE1-NZ 3.51Å; E206-K209 PolarHBondContact OE1-NZ 2.81Å; E206-K209 IonicContact OE2-NZ 2.84Å; W207-K209 VanDerWaalsContact C-N 3.29Å; K209-K211 PolarHBondContact O-N 3.1Å
210V79.3Confident65.5Low102 Ų102137 Ų13762%0.61870%0.703SS**  trans-66.196.1173.9-174.40000108.9M208 R212M208-V210 VanDerWaalsContact C-N 3.27Å; M208-V210 PolarHBondContact O-N 3.13Å; V210-R212 HydrophobicContact CG1-CG 3.72Å; V210-R212 PolarHBondContact O-N 3.12Å
211K73.5Confident64.9Low193 Ų193136.6 Ų136.684%0.83970%0.7SS**  trans-71.473.7171.4-171.1164.3-180175.90109K209 N213K209-K211 PolarHBondContact O-N 3.1Å; K211-N213 PolarHBondContact O-N 3.44Å
212R74.4Confident64.3Low201 Ų201140.1 Ų140.176%0.75870%0.703SS**  trans-62.3127.3160.6-50.8-169.8-147.2107.32.5105.6V210 A214V210-R212 HydrophobicContact CG1-CG 3.72Å; V210-R212 PolarHBondContact O-N 3.12Å; R212-A214 VanDerWaalsContact C-N 3.35Å; R212-A214 PolarHBondContact O-N 3.1Å
213N53.6Low63.5Low155 Ų155140 Ų14083%0.82970%0.698SS**  trans-53.6100.3-179.3-33.8-15.6000107.4K211 S215K211-N213 PolarHBondContact O-N 3.44Å; N213-S215 PolarHBondContact O-N 3.28Å
214A55.9Low62.7Low94 Ų94140.2 Ų140.278%0.77772%0.715SS**  trans-64.6110.7172.700000105.8R212 K216R212-A214 VanDerWaalsContact C-N 3.35Å; R212-A214 PolarHBondContact O-N 3.1Å; A214-K216 PolarHBondContact O-N 2.77Å; A214-K216 VanDerWaalsContact O-N 3.1Å
215S53.8Low61.3Low76 Ų76142.9 Ų142.953%0.53173%0.731SS.*  trans-52.4120.5173.948.80000107.9N213 K217N213-S215 PolarHBondContact O-N 3.28Å; S215-K217 PolarHBondContact O-N 2.82Å; S215-K217 VanDerWaalsContact O-N 3.1Å
216K48.4Very low59.7Low208 Ų208141.8 Ų141.890%0.90474%0.743SS**  trans-48.4121.3177.1-70.5177.6-179.4174.50108.5A214 S218A214-K216 PolarHBondContact O-N 2.77Å; A214-K216 VanDerWaalsContact O-N 3.1Å; K216-S218 PolarHBondContact O-N 3.07Å; K216-S218 VanDerWaalsContact O-N 3.12Å
217K46.3Very low58.1Low203 Ų203140.5 Ų140.588%0.88374%0.741SS**  trans-3.695.3171.2-61.6178.1-178.6177.50114.4S215 K219S215-K217 PolarHBondContact O-N 2.82Å; S215-K217 VanDerWaalsContact O-N 3.1Å; K217-K219 PolarHBondContact O-N 2.92Å
218S42.8Very low56.4Low105 Ų105136 Ų13673%0.73474%0.736SS**  trans-81.1100.1149.7173.70000106.8K216 L220K216-S218 PolarHBondContact O-N 3.07Å; K216-S218 VanDerWaalsContact O-N 3.12Å; S218-L220 PolarHBondContact O-N 3.03Å
219K50Low54.7Low203 Ų203134.7 Ų134.788%0.88374%0.736SS**  trans-74.9101.4159.4-92.2-171.5176.7-177.90106.1K217K217-K219 PolarHBondContact O-N 2.92Å
220L50.4Low53.2Low149 Ų149133.6 Ų133.678%0.7874%0.742SS**  trans14695147.3-169.969.9000109.2S218S218-L220 PolarHBondContact O-N 3.03Å
221A43.1Very low52.5Low96 Ų96133.6 Ų133.679%0.79375%0.753SS**  trans-151.772.3159.200000108
222Q45.3Very low52.9Low151 Ų151130.3 Ų130.371%0.70674%0.743SS**  trans-68.9139.1152.8-168.4161.6-4.500106.2
223Y39.7Very low53.5Low196 Ų196130.2 Ų130.277%0.76974%0.743SS**SBendtrans84.782.3-173.4-51.6-77.5000116.9T225Y223-T225 PolarHBondContact O-N 2.84Å; Y223-T225 PolarHBondContact O-OG1 2.84Å
224G50.5Low55.2Low92 Ų92126.5 Ų126.595%0.94873%0.726SS**  58.45.2123.400000121.1
225T48.1Very low57Low129 Ų129127.9 Ų127.979%0.79172%0.72SS**  trans-102.7119.6-178.5-48.30000109.2Y223 N227Y223-T225 PolarHBondContact O-N 2.84Å; Y223-T225 PolarHBondContact O-OG1 2.84Å; T225-N227 PolarHBondContact O-N 2.98Å; T225-N227 VanDerWaalsContact O-N 3.12Å
226A51.5Low59.1Low91 Ų91127.1 Ų127.175%0.75271%0.707SS**  trans-44.6119.4178.700000110.9P228A226-P228 VanDerWaalsContact O-CD 3.31Å; A226-P228 WeakPolarHBondContact O-CD 3.47Å
227N50.7Low61.5Low113 Ų113119.9 Ų119.960%0.60468%0.683SS**  trans-57.9116.3178.7-179-0.2000110.3T225 S229T225-N227 PolarHBondContact O-N 2.98Å; T225-N227 VanDerWaalsContact O-N 3.12Å; N227-S229 PolarHBondContact ND2-OG 3.47Å; N227-S229 VanDerWaalsContact ND2-OG 3.08Å; N227-S229 PolarHBondContact O-N 3.39Å; N227-S229 VanDerWaalsContact O-N 3.14Å; N227-S229 VanDerWaalsContact OD1-CB 3.31Å; N227-S229 WeakPolarHBondContact OD1-CB 3.33Å; N227-S229 PolarHBondContact OD1-N 2.86Å; N227-S229 PolarHBondContact OD1-OG 3.35Å
228P51.8Low64Low99 Ų99115.7 Ų115.764%0.64368%0.675SS**THydrogen-bonded Turntrans-82.120.7-177.434.4-36.4000113.8A226 I232A226-P228 VanDerWaalsContact O-CD 3.31Å; A226-P228 WeakPolarHBondContact O-CD 3.47Å; P228-I232 HydrophobicContact CB-CD1 4.2Å
229S53.3Low66.6Low60 Ų60118 Ų11842%0.4267%0.671SS.*THydrogen-bonded Turntrans-94.5-2.8-172.359.80000115.5N227 A231N227-S229 PolarHBondContact ND2-OG 3.47Å; N227-S229 VanDerWaalsContact ND2-OG 3.08Å; N227-S229 PolarHBondContact O-N 3.39Å; N227-S229 VanDerWaalsContact O-N 3.14Å; N227-S229 VanDerWaalsContact OD1-CB 3.31Å; N227-S229 WeakPolarHBondContact OD1-CB 3.33Å; N227-S229 PolarHBondContact OD1-N 2.86Å; N227-S229 PolarHBondContact OD1-OG 3.35Å; S229-A231 PolarHBondContact O-N 2.91Å
230S55.6Low68.9Low89 Ų89109.9 Ų109.962%0.62264%0.637SS**SBendtrans-75.9116.5155.846.80000107I232S230-I232 PolarHBondContact O-N 2.89Å
231A64.5Low71.2Confident102 Ų102105.6 Ų105.684%0.84361%0.614SS**  trans-45.399.7-176.800000111S229 R233S229-A231 PolarHBondContact O-N 2.91Å; A231-R233 PolarHBondContact O-N 3.48Å
232I82.3Confident73.9Confident124 Ų124104.4 Ų104.464%0.63660%0.597SS**  trans-63.6117.2-177-66.5172.2000106P228 S230 T234P228-I232 HydrophobicContact CB-CD1 4.2Å; S230-I232 PolarHBondContact O-N 2.89Å; I232-T234 PolarHBondContact O-N 3.37Å
233R86.2Confident76.4Confident199 Ų199100.1 Ų100.175%0.75158%0.577SS**  trans-66.9108.1-179.8-170.7176-179.3-81.43.5108.2A231 N235A231-R233 PolarHBondContact O-N 3.48Å; R233-N235 PolarHBondContact NH1-OD1 3.33Å; R233-N235 VanDerWaalsContact NH1-OD1 3.14Å
234T89.1Confident79.2Confident77 Ų7790.8 Ų90.847%0.47254%0.541SS..PPolyproline II helixtrans-70.3132.1175.3-39.90000109.7I232 Q272I232-T234 PolarHBondContact O-N 3.37Å; T234-Q272 PolarHBondContact OG1-NE2 3.45Å
235N94.6Very high81.5Confident123 Ų12390.3 Ų90.366%0.65851%0.514SS*.PPolyproline II helixtrans-98.9133.5169.1-65.9-66.6000108.9R233R233-N235 PolarHBondContact NH1-OD1 3.33Å; R233-N235 VanDerWaalsContact NH1-OD1 3.14Å
236F97.7Very high83.9Confident60 Ų6089.7 Ų89.726%0.26350%0.5SS..PPolyproline II helixtrans-88.5142.1175.4-57.7-51.3000110.1Q240 L241 L268 Q272 W276F236-Q240 HydrophobicContact CB-CB 4.29Å; F236-L241 HydrophobicContact CB-CD2 3.85Å; F236-L241 HydrophobicContact CB-CG 4.02Å; F236-L241 HydrophobicContact CD2-CD2 4.07Å; F236-L241 HydrophobicContact CG-CD2 4.4Å; F236-L268 HydrophobicContact CD1-CD1 4.17Å; F236-L268 HydrophobicContact CD1-CD2 3.82Å; F236-L268 HydrophobicContact CE1-CD1 4.08Å; F236-L268 HydrophobicContact CE1-CD2 3.73Å; F236-Q272 HydrophobicContact CE1-CB 4.43Å; F236-Q272 HydrophobicContact CZ-CB 4.3Å; F236-W276 AromaticContact CD2-CD1 3.88Å; F236-W276 AromaticContact CE2-CD1 3.68Å
237S98.4Very high86.1Confident57 Ų5786.4 Ų86.440%0.39947%0.469SS..PPolyproline II helixtrans-67.8158.5171.266.20000111.3K239 Q240 L241S237-K239 VanDerWaalsContact C-N 3.28Å; S237-K239 PolarHBondContact O-N 3.35Å; S237-Q240 WeakPolarHBondContact O-CB 3.25Å; S237-Q240 PolarHBondContact O-N 3.45Å; S237-Q240 VanDerWaalsContact O-N 3.12Å; S237-Q240 VanDerWaalsContact OG-CG 3.25Å; S237-Q240 WeakPolarHBondContact OG-CG 3.49Å; S237-Q240 PolarHBondContact OG-N 2.86Å; S237-Q240 PolarHBondContact OG-OE1 3.49Å; S237-Q240 VanDerWaalsContact OG-OE1 3.08Å; S237-L241 WeakPolarHBondContact O-CG 3.33Å; S237-L241 PolarHBondContact O-N 3.14Å
238T98.3Very high88.4Confident114 Ų11481.1 Ų81.170%0.69944%0.441SS*.Hα-helixtrans-54.7-44.9175.4-50.80000111.7Q240 L241 T242T238-Q240 VanDerWaalsContact C-N 3.33Å; T238-Q240 PolarHBondContact O-N 3.09Å; T238-L241 PolarHBondContact O-N 2.97Å; T238-L241 VanDerWaalsContact O-N 3.14Å; T238-T242 PolarHBondContact O-N 3.27Å; T238-T242 PolarHBondContact O-OG1 3.01Å; T238-T242 VanDerWaalsContact O-OG1 3.05Å
239K98.1Very high90.6Very high153 Ų15382.3 Ų82.367%0.66544%0.438SS*.Hα-helixtrans-56.7-45.4177.2-174.9-169.1176-161.20112.1S237 L241 T242 E243S237-K239 VanDerWaalsContact C-N 3.28Å; S237-K239 PolarHBondContact O-N 3.35Å; K239-L241 VanDerWaalsContact C-N 3.35Å; K239-T242 PolarHBondContact O-N 3.13Å; K239-E243 PolarHBondContact O-N 2.6Å; K239-E243 VanDerWaalsContact O-N 3.08Å
240Q98.4Very high92.8Very high34 Ų3487 Ų8716%0.15945%0.451CS..Hα-helixtrans-62.9-42.7178.2-73.1166.9-36.100111.3F236 S237 T238 L244 L266F236-Q240 HydrophobicContact CB-CB 4.29Å; S237-Q240 WeakPolarHBondContact O-CB 3.25Å; S237-Q240 PolarHBondContact O-N 3.45Å; S237-Q240 VanDerWaalsContact O-N 3.12Å; S237-Q240 VanDerWaalsContact OG-CG 3.25Å; S237-Q240 WeakPolarHBondContact OG-CG 3.49Å; S237-Q240 PolarHBondContact OG-N 2.86Å; S237-Q240 PolarHBondContact OG-OE1 3.49Å; S237-Q240 VanDerWaalsContact OG-OE1 3.08Å; T238-Q240 VanDerWaalsContact C-N 3.33Å; T238-Q240 PolarHBondContact O-N 3.09Å; Q240-L244 WeakPolarHBondContact O-CB 3.41Å; Q240-L244 WeakPolarHBondContact O-CD1 3.37Å; Q240-L244 WeakPolarHBondContact O-CG 3.37Å; Q240-L244 PolarHBondContact O-N 2.74Å; Q240-L266 HydrophobicContact CG-CB 4.3Å; Q240-L266 PolarHBondContact NE2-O 2.82Å
241L98.5Very high94.8Very high58 Ų5886 Ų8630%0.30444%0.439SS..Hα-helixtrans-63.2-45.3177.5-65.9174.8000111.8F236 S237 T238 K239 E243 L244 E245F236-L241 HydrophobicContact CB-CD2 3.85Å; F236-L241 HydrophobicContact CB-CG 4.02Å; F236-L241 HydrophobicContact CD2-CD2 4.07Å; F236-L241 HydrophobicContact CG-CD2 4.4Å; S237-L241 WeakPolarHBondContact O-CG 3.33Å; S237-L241 PolarHBondContact O-N 3.14Å; T238-L241 PolarHBondContact O-N 2.97Å; T238-L241 VanDerWaalsContact O-N 3.14Å; K239-L241 VanDerWaalsContact C-N 3.35Å; L241-E243 PolarHBondContact O-N 3.08Å; L241-L244 PolarHBondContact O-N 3.27Å; L241-E245 WeakPolarHBondContact O-CB 3.46Å; L241-E245 VanDerWaalsContact O-CG 3.25Å; L241-E245 WeakPolarHBondContact O-CG 3.42Å; L241-E245 PolarHBondContact O-N 2.78Å
242T98.6Very high96.4Very high71 Ų7184 Ų8444%0.43641%0.411SS..Hα-helixtrans-60.1-47.1178.9-57.40000112T238 K239 E245 K246T238-T242 PolarHBondContact O-N 3.27Å; T238-T242 PolarHBondContact O-OG1 3.01Å; T238-T242 VanDerWaalsContact O-OG1 3.05Å; K239-T242 PolarHBondContact O-N 3.13Å; T242-E245 PolarHBondContact O-N 3.4Å; T242-K246 WeakPolarHBondContact O-CB 3.45Å; T242-K246 PolarHBondContact O-N 3.05Å
243E98.6Very high97.2Very high61 Ų6185.3 Ų85.329%0.28541%0.408SS..Hα-helixtrans-67.9-37.9178.2-72.2-60.6116.500112K239 L241 E245 K246 E247 L266K239-E243 PolarHBondContact O-N 2.6Å; K239-E243 VanDerWaalsContact O-N 3.08Å; L241-E243 PolarHBondContact O-N 3.08Å; E243-E245 VanDerWaalsContact C-N 3.31Å; E243-E245 PolarHBondContact O-N 3.25Å; E243-K246 PolarHBondContact O-N 3.16Å; E243-K246 IonicContact OE1-NZ 2.92Å; E243-K246 IonicContact OE2-NZ 2.66Å; E243-K246 PolarHBondContact OE2-NZ 3.12Å; E243-E247 WeakPolarHBondContact O-CG 3.24Å; E243-E247 PolarHBondContact O-N 3.3Å; E243-L266 HydrophobicContact CB-CD1 4.09Å; E243-L266 HydrophobicContact CB-CD2 3.64Å; E243-L266 HydrophobicContact CB-CG 4.45Å; E243-L266 HydrophobicContact CG-CD2 3.95Å
244L98.6Very high97.7Very high0 Ų076.9 Ų76.90%038%0.378CS..Hα-helixtrans-63-38.4173.7-72.9167000112Q240 L241 F248 I262 L266 L268 V273 W276 F277Q240-L244 WeakPolarHBondContact O-CB 3.41Å; Q240-L244 WeakPolarHBondContact O-CD1 3.37Å; Q240-L244 WeakPolarHBondContact O-CG 3.37Å; Q240-L244 PolarHBondContact O-N 2.74Å; L241-L244 PolarHBondContact O-N 3.27Å; L244-F248 VanDerWaalsContact O-CB 3.27Å; L244-F248 WeakPolarHBondContact O-CB 3.46Å; L244-F248 PolarHBondContact O-N 3.45Å; L244-I262 HydrophobicContact CD2-CG2 4.06Å; L244-L266 HydrophobicContact CD1-CD1 4.48Å; L244-L266 HydrophobicContact CD2-CD1 3.9Å; L244-L266 HydrophobicContact CG-CD1 3.7Å; L244-L268 HydrophobicContact CD1-CD1 4.18Å; L244-V273 HydrophobicContact CD2-CG1 4.12Å; L244-W276 HydrophobicContact CB-CD2 3.98Å; L244-W276 HydrophobicContact CB-CE3 3.93Å; L244-W276 HydrophobicContact CB-CH2 3.65Å; L244-W276 HydrophobicContact CB-CZ2 3.67Å; L244-W276 HydrophobicContact CB-CZ3 3.77Å; L244-W276 HydrophobicContact CD1-CD2 3.87Å; L244-W276 HydrophobicContact CD1-CE3 4.49Å; L244-W276 HydrophobicContact CD1-CG 3.86Å; L244-W276 HydrophobicContact CD2-CD2 4.45Å; L244-W276 HydrophobicContact CD2-CE3 4.31Å; L244-W276 HydrophobicContact CG-CD2 4.32Å; L244-W276 HydrophobicContact CG-CE3 4.48Å; L244-W276 WeakPolarHBondContact O-CH2 3.14Å; L244-W276 WeakPolarHBondContact O-CZ3 3.36Å; L244-F277 HydrophobicContact CD2-CE2 4.02Å
245E98.6Very high98.2Very high83 Ų8377.5 Ų77.539%0.38838%0.382SS..Hα-helixtrans-66.9-46.3175.7-75.7164.6173.200111.4L241 T242 E243 E247 F248 H249 W276L241-E245 WeakPolarHBondContact O-CB 3.46Å; L241-E245 VanDerWaalsContact O-CG 3.25Å; L241-E245 WeakPolarHBondContact O-CG 3.42Å; L241-E245 PolarHBondContact O-N 2.78Å; T242-E245 PolarHBondContact O-N 3.4Å; E243-E245 VanDerWaalsContact C-N 3.31Å; E243-E245 PolarHBondContact O-N 3.25Å; E245-E247 PolarHBondContact O-N 2.86Å; E245-F248 CarbonylContact O-C 3.55Å; E245-F248 WeakPolarHBondContact O-CB 3.31Å; E245-F248 PolarHBondContact O-N 2.85Å; E245-F248 VanDerWaalsContact O-N 3.14Å; E245-H249 PolarHBondContact O-CD2 3.45Å; E245-H249 PolarHBondContact O-N 3.14Å; E245-W276 HydrophobicContact CG-CH2 3.9Å; E245-W276 HydrophobicContact CG-CZ2 3.95Å
246K98.5Very high98.4Very high116 Ų11678.6 Ų78.650%0.50438%0.377SS..Hα-helixtrans-54.3-50.1173.7172.6-177.7157.9-158.70111.6T242 E243 F248 H249 F250T242-K246 WeakPolarHBondContact O-CB 3.45Å; T242-K246 PolarHBondContact O-N 3.05Å; E243-K246 PolarHBondContact O-N 3.16Å; E243-K246 IonicContact OE1-NZ 2.92Å; E243-K246 IonicContact OE2-NZ 2.66Å; E243-K246 PolarHBondContact OE2-NZ 3.12Å; K246-F248 VanDerWaalsContact C-N 3.33Å; K246-F248 PolarHBondContact O-N 3.19Å; K246-H249 WeakPolarHBondContact O-CB 3.36Å; K246-H249 PolarHBondContact O-N 3.44Å; K246-F250 PolarHBondContact O-N 3.38Å
247E98.4Very high98.4Very high22 Ų2278.4 Ų78.410%0.10339%0.387CS..Hα-helixtrans-63.2-38.7176.5-72.1-65.3140.500112.3E243 E245 H249 F250 N251 R258 I262 F277E243-E247 WeakPolarHBondContact O-CG 3.24Å; E243-E247 PolarHBondContact O-N 3.3Å; E245-E247 PolarHBondContact O-N 2.86Å; E247-H249 VanDerWaalsContact C-N 3.3Å; E247-H249 PolarHBondContact O-N 2.92Å; E247-F250 WeakPolarHBondContact O-CB 3.31Å; E247-F250 PolarHBondContact O-N 2.89Å; E247-N251 PolarHBondContact O-N 3.45Å; E247-R258 IonicContact OE1-CZ 3.7Å; E247-R258 IonicContact OE1-NE 3.99Å; E247-R258 IonicContact OE1-NH2 2.77Å; E247-R258 PolarHBondContact OE1-NH2 3.05Å; E247-R258 IonicContact OE2-CZ 3.24Å; E247-R258 VanDerWaalsContact OE2-CZ 3.24Å; E247-R258 IonicContact OE2-NE 3.88Å; E247-R258 PolarHBondContact OE2-NE 3.41Å; E247-R258 IonicContact OE2-NH2 2.82Å; E247-R258 PolarHBondContact OE2-NH2 3.08Å; E247-I262 HydrophobicContact CB-CD1 3.97Å; E247-I262 HydrophobicContact CG-CD1 3.66Å; E247-I262 HydrophobicContact CG-CG1 3.99Å; E247-F277 HydrophobicContact CB-CZ 4.05Å
248F98.8Very high98.4Very high1 Ų179.6 Ų79.60%0.00438%0.383CS..Hα-helixtrans-65.5-34.6175.8-177.7-97.3000112.6L244 E245 K246 N251 K252 W276 F277 R280 R281 Q284L244-F248 VanDerWaalsContact O-CB 3.27Å; L244-F248 WeakPolarHBondContact O-CB 3.46Å; L244-F248 PolarHBondContact O-N 3.45Å; E245-F248 CarbonylContact O-C 3.55Å; E245-F248 WeakPolarHBondContact O-CB 3.31Å; E245-F248 PolarHBondContact O-N 2.85Å; E245-F248 VanDerWaalsContact O-N 3.14Å; K246-F248 VanDerWaalsContact C-N 3.33Å; K246-F248 PolarHBondContact O-N 3.19Å; F248-N251 CarbonylContact O-C 3.59Å; F248-K252 HydrophobicContact CD1-CD 3.98Å; F248-K252 HydrophobicContact CD2-CD 4.24Å; F248-K252 HydrophobicContact CE1-CD 3.41Å; F248-K252 VanDerWaalsContact CE1-CD 3.41Å; F248-K252 HydrophobicContact CE2-CB 4.36Å; F248-K252 HydrophobicContact CE2-CD 3.71Å; F248-K252 HydrophobicContact CG-CD 4.37Å; F248-K252 HydrophobicContact CZ-CD 3.27Å; F248-K252 WeakPolarHBondContact O-CD 3.31Å; F248-K252 PolarHBondContact O-NZ 2.74Å; F248-W276 HydrophobicContact CB-CH2 4.3Å; F248-W276 HydrophobicContact CB-CZ3 4.02Å; F248-W276 HydrophobicContact CG-CZ3 4.44Å; F248-F277 HydrophobicContact CB-CE1 4.09Å; F248-F277 HydrophobicContact CB-CZ 4.17Å; F248-F277 AromaticContact CD2-CD1 3.92Å; F248-F277 HydrophobicContact CD2-CD1 3.92Å; F248-F277 AromaticContact CD2-CE1 3.86Å; F248-F277 HydrophobicContact CD2-CE1 3.86Å; F248-F277 HydrophobicContact CG-CE1 4.49Å; F248-R280 HydrophobicContact CD1-CG 3.8Å; F248-R280 HydrophobicContact CD2-CB 4.25Å; F248-R280 HydrophobicContact CD2-CG 3.62Å; F248-R280 HydrophobicContact CE1-CG 3.82Å; F248-R280 HydrophobicContact CE2-CB 4.18Å; F248-R280 HydrophobicContact CE2-CG 3.64Å; F248-R280 HydrophobicContact CG-CG 3.69Å; F248-R280 HydrophobicContact CZ-CG 3.73Å; F248-R281 HydrophobicContact CE2-CG 3.77Å; F248-R281 HydrophobicContact CZ-CG 4.29Å; F248-Q284 VanDerWaalsContact CZ-OE1 3.31Å
249H98.3Very high98.4Very high125 Ų12576.4 Ų76.458%0.57936%0.358SS*.Hα-helixtrans-65.4-44.5173.2-80-70.9000111E245 K246 E247 K252E245-H249 PolarHBondContact O-CD2 3.45Å; E245-H249 PolarHBondContact O-N 3.14Å; K246-H249 WeakPolarHBondContact O-CB 3.36Å; K246-H249 PolarHBondContact O-N 3.44Å; E247-H249 VanDerWaalsContact C-N 3.3Å; E247-H249 PolarHBondContact O-N 2.92Å; H249-K252 PolarHBondContact O-NZ 2.95Å; H249-K252 VanDerWaalsContact O-NZ 3.16Å
250F98.3Very high98.4Very high159 Ų15972.4 Ų72.470%0.69734%0.343SS*.Hα-helixtrans-61.2-49.7175.8-177.8-103.8000112.7K246 E247K246-F250 PolarHBondContact O-N 3.38Å; E247-F250 WeakPolarHBondContact O-CB 3.31Å; E247-F250 PolarHBondContact O-N 2.89Å
251N97.9Very high98.4Very high68 Ų6875.5 Ų75.536%0.36436%0.357SS..  trans-146.4126.2178-171.3-4.9000111.6E247 F248 Y253E247-N251 PolarHBondContact O-N 3.45Å; F248-N251 CarbonylContact O-C 3.59Å; N251-Y253 PolarHBondContact ND2-O 3.3Å; N251-Y253 PolarHBondContact O-N 2.85Å; N251-Y253 PolarHBondContact OD1-N 3.29Å; N251-Y253 VanDerWaalsContact OD1-N 3.07Å; N251-Y253 PolarHBondContact OD1-O 3Å
252K98.1Very high98.4Very high59 Ų5973.2 Ų73.226%0.25735%0.345SS..SBendtrans-71-18.3-178.8-57.6-69.2171.6-76.60112.7F248 H249 R281F248-K252 HydrophobicContact CD1-CD 3.98Å; F248-K252 HydrophobicContact CD2-CD 4.24Å; F248-K252 HydrophobicContact CE1-CD 3.41Å; F248-K252 VanDerWaalsContact CE1-CD 3.41Å; F248-K252 HydrophobicContact CE2-CB 4.36Å; F248-K252 HydrophobicContact CE2-CD 3.71Å; F248-K252 HydrophobicContact CG-CD 4.37Å; F248-K252 HydrophobicContact CZ-CD 3.27Å; F248-K252 WeakPolarHBondContact O-CD 3.31Å; F248-K252 PolarHBondContact O-NZ 2.74Å; H249-K252 PolarHBondContact O-NZ 2.95Å; H249-K252 VanDerWaalsContact O-NZ 3.16Å; K252-R281 WeakPolarHBondContact O-CD 3.47Å
253Y98.4Very high98.4Very high151 Ų15170 Ų7059%0.59233%0.326SS*.SBendtrans-134.1121.2-177.4-64.2-102.7000110.5N251N251-Y253 PolarHBondContact ND2-O 3.3Å; N251-Y253 PolarHBondContact O-N 2.85Å; N251-Y253 PolarHBondContact OD1-N 3.29Å; N251-Y253 VanDerWaalsContact OD1-N 3.07Å; N251-Y253 PolarHBondContact OD1-O 3Å
254L98.3Very high98.4Very high23 Ų2372.8 Ų72.812%0.1234%0.343CS..  trans-89.7138.1-179.7-59179.8000112.4R258 R259 I262 V273 F277L254-R258 HydrophobicContact CD2-CG 4.02Å; L254-R259 HydrophobicContact CB-CB 4.41Å; L254-R259 HydrophobicContact CD1-CB 4.37Å; L254-R259 HydrophobicContact CD1-CG 4.32Å; L254-I262 HydrophobicContact CD1-CD1 3.65Å; L254-I262 HydrophobicContact CD2-CD1 3.95Å; L254-I262 HydrophobicContact CG-CD1 4.45Å; L254-V273 HydrophobicContact CD1-CG1 3.85Å; L254-F277 HydrophobicContact CD1-CD1 4.08Å; L254-F277 HydrophobicContact CD1-CD2 3.69Å; L254-F277 HydrophobicContact CD1-CE1 3.81Å; L254-F277 HydrophobicContact CD1-CE2 3.41Å; L254-F277 VanDerWaalsContact CD1-CE2 3.41Å; L254-F277 HydrophobicContact CD1-CG 4.03Å; L254-F277 HydrophobicContact CD1-CZ 3.48Å; L254-F277 VanDerWaalsContact CD1-CZ 3.48Å; L254-F277 HydrophobicContact CD2-CD1 4.5Å; L254-F277 HydrophobicContact CD2-CE1 3.73Å; L254-F277 HydrophobicContact CD2-CZ 3.79Å; L254-F277 HydrophobicContact CG-CD1 3.8Å; L254-F277 HydrophobicContact CG-CD2 4.34Å; L254-F277 HydrophobicContact CG-CE1 3.48Å; L254-F277 VanDerWaalsContact CG-CE1 3.48Å; L254-F277 HydrophobicContact CG-CE2 4.09Å; L254-F277 HydrophobicContact CG-CG 4.22Å; L254-F277 HydrophobicContact CG-CZ 3.66Å
255T98.6Very high98.4Very high89 Ų8977.5 Ų77.555%0.54638%0.375SS..  trans-68.1165.4162.665.20000110.6R258 R259T255-R258 WeakPolarHBondContact OG1-CB 3.48Å; T255-R258 PolarHBondContact OG1-N 3.49Å; T255-R259 WeakPolarHBondContact O-CB 3.43Å; T255-R259 PolarHBondContact O-N 3.35Å; T255-R259 VanDerWaalsContact O-N 3.11Å
256R98.3Very high98.3Very high146 Ų14674.2 Ų74.255%0.55136%0.36SS*.Hα-helixtrans-60.6-47.8179178.657.2176.5-177.80.2112R259 I260 D270R256-R259 PolarHBondContact O-N 3.24Å; R256-I260 HydrophobicContact CG-CD1 4.17Å; R256-I260 WeakPolarHBondContact O-CG1 3.38Å; R256-I260 PolarHBondContact O-N 3.08Å; R256-D270 IonicContact CZ-OD1 3.54Å; R256-D270 IonicContact CZ-OD2 3.67Å; R256-D270 IonicContact NH1-OD1 2.81Å; R256-D270 PolarHBondContact NH1-OD1 3.36Å; R256-D270 IonicContact NH1-OD2 2.62Å; R256-D270 PolarHBondContact NH1-OD2 3.12Å
257A98.4Very high98.3Very high57 Ų5777.4 Ų77.447%0.47138%0.376SS..Hα-helixtrans-59.7-52.4-179.300000111.7R259 I260 E261A257-R259 PolarHBondContact O-N 3.04Å; A257-I260 WeakPolarHBondContact O-CB 3.41Å; A257-I260 PolarHBondContact O-N 3.08Å; A257-E261 PolarHBondContact O-N 2.9Å
258R98.4Very high98.2Very high82 Ų8277.2 Ų77.231%0.30938%0.376SS..Hα-helixtrans-59.5-35.7179.1-175.354.8165.6-135.81.4112.6E247 L254 T255 E261 I262E247-R258 IonicContact OE1-CZ 3.7Å; E247-R258 IonicContact OE1-NE 3.99Å; E247-R258 IonicContact OE1-NH2 2.77Å; E247-R258 PolarHBondContact OE1-NH2 3.05Å; E247-R258 IonicContact OE2-CZ 3.24Å; E247-R258 VanDerWaalsContact OE2-CZ 3.24Å; E247-R258 IonicContact OE2-NE 3.88Å; E247-R258 PolarHBondContact OE2-NE 3.41Å; E247-R258 IonicContact OE2-NH2 2.82Å; E247-R258 PolarHBondContact OE2-NH2 3.08Å; L254-R258 HydrophobicContact CD2-CG 4.02Å; T255-R258 WeakPolarHBondContact OG1-CB 3.48Å; T255-R258 PolarHBondContact OG1-N 3.49Å; R258-E261 WeakPolarHBondContact CD-OE2 3.43Å; R258-E261 IonicContact NH1-OE2 3.87Å; R258-E261 PolarHBondContact O-N 3.29Å; R258-I262 HydrophobicContact CG-CD1 3.89Å; R258-I262 WeakPolarHBondContact O-CD1 3.39Å; R258-I262 VanDerWaalsContact O-CG1 3.29Å; R258-I262 WeakPolarHBondContact O-CG1 3.5Å; R258-I262 PolarHBondContact O-N 2.86Å
259R98.6Very high98.2Very high47 Ų4782.4 Ų82.418%0.17740%0.404CS..Hα-helixtrans-63.8-41176.5-164.1179.8-46.6156.43.7112.4L254 T255 R256 A257 A263 D270 V273 K274L254-R259 HydrophobicContact CB-CB 4.41Å; L254-R259 HydrophobicContact CD1-CB 4.37Å; L254-R259 HydrophobicContact CD1-CG 4.32Å; T255-R259 WeakPolarHBondContact O-CB 3.43Å; T255-R259 PolarHBondContact O-N 3.35Å; T255-R259 VanDerWaalsContact O-N 3.11Å; R256-R259 PolarHBondContact O-N 3.24Å; A257-R259 PolarHBondContact O-N 3.04Å; R259-A263 VanDerWaalsContact O-CB 3.25Å; R259-A263 WeakPolarHBondContact O-CB 3.27Å; R259-A263 PolarHBondContact O-N 3.39Å; R259-D270 WeakPolarHBondContact CD-O 3.45Å; R259-D270 WeakPolarHBondContact CD-OD1 3.43Å; R259-D270 WeakPolarHBondContact CG-OD1 3.49Å; R259-D270 IonicContact NH1-OD2 3.94Å; R259-V273 HydrophobicContact CG-CB 3.91Å; R259-V273 HydrophobicContact CG-CG1 3.73Å; R259-K274 VanDerWaalsContact NH1-CD 3.32Å
260I98.5Very high98.2Very high68 Ų6877.8 Ų77.835%0.34938%0.383SS..Hα-helixtrans-65.4-43.6177.3-65.5165.4000110.2R256 A257 I262 A263 N264R256-I260 HydrophobicContact CG-CD1 4.17Å; R256-I260 WeakPolarHBondContact O-CG1 3.38Å; R256-I260 PolarHBondContact O-N 3.08Å; A257-I260 WeakPolarHBondContact O-CB 3.41Å; A257-I260 PolarHBondContact O-N 3.08Å; I260-I262 PolarHBondContact O-N 3.01Å; I260-A263 WeakPolarHBondContact O-CB 3.35Å; I260-A263 PolarHBondContact O-N 3.48Å; I260-N264 PolarHBondContact O-N 3.45Å; I260-N264 PolarHBondContact O-ND2 3.04Å
261E98.4Very high98.1Very high100 Ų10073.7 Ų73.747%0.46737%0.372SS..Hα-helixtrans-56.7-51.3175.9-68.8165.3-162.200111.8A257 R258 A263 N264 C265A257-E261 PolarHBondContact O-N 2.9Å; R258-E261 WeakPolarHBondContact CD-OE2 3.43Å; R258-E261 IonicContact NH1-OE2 3.87Å; R258-E261 PolarHBondContact O-N 3.29Å; E261-A263 VanDerWaalsContact C-N 3.34Å; E261-A263 PolarHBondContact O-N 2.79Å; E261-N264 PolarHBondContact O-N 3.25Å; E261-C265 PolarHBondContact O-N 3.05Å; E261-C265 PolarHBondContact O-SG 3.32Å
262I98.4Very high98.1Very high10 Ų1072.3 Ų72.35%0.05136%0.363CS..Hα-helixtrans-62.4-42.4179.2-65.4163.5000111.1L244 E247 L254 R258 I260 N264 C265 L266 V273L244-I262 HydrophobicContact CD2-CG2 4.06Å; E247-I262 HydrophobicContact CB-CD1 3.97Å; E247-I262 HydrophobicContact CG-CD1 3.66Å; E247-I262 HydrophobicContact CG-CG1 3.99Å; L254-I262 HydrophobicContact CD1-CD1 3.65Å; L254-I262 HydrophobicContact CD2-CD1 3.95Å; L254-I262 HydrophobicContact CG-CD1 4.45Å; R258-I262 HydrophobicContact CG-CD1 3.89Å; R258-I262 WeakPolarHBondContact O-CD1 3.39Å; R258-I262 VanDerWaalsContact O-CG1 3.29Å; R258-I262 WeakPolarHBondContact O-CG1 3.5Å; R258-I262 PolarHBondContact O-N 2.86Å; I260-I262 PolarHBondContact O-N 3.01Å; I262-N264 VanDerWaalsContact C-N 3.3Å; I262-N264 PolarHBondContact O-N 3.34Å; I262-C265 PolarHBondContact O-N 2.9Å; I262-L266 HydrophobicContact CG2-CD1 3.71Å; I262-L266 HydrophobicContact CG2-CG 4.24Å; I262-L266 WeakPolarHBondContact O-CB 3.49Å; I262-L266 WeakPolarHBondContact O-CG 3.48Å; I262-L266 PolarHBondContact O-N 3.14Å; I262-V273 HydrophobicContact CG2-CG1 4.18Å; I262-V273 HydrophobicContact CG2-CG2 4.39Å
263A98.4Very high98.1Very high4 Ų469.5 Ų69.53%0.03335%0.35CS..Hα-helixtrans-57.2-45.6177.300000111.2R259 I260 E261 L266 Q267 L268 V273R259-A263 VanDerWaalsContact O-CB 3.25Å; R259-A263 WeakPolarHBondContact O-CB 3.27Å; R259-A263 PolarHBondContact O-N 3.39Å; I260-A263 WeakPolarHBondContact O-CB 3.35Å; I260-A263 PolarHBondContact O-N 3.48Å; E261-A263 VanDerWaalsContact C-N 3.34Å; E261-A263 PolarHBondContact O-N 2.79Å; A263-L266 PolarHBondContact O-N 3.07Å; A263-Q267 WeakPolarHBondContact O-CA 3.25Å; A263-Q267 PolarHBondContact O-N 2.73Å; A263-L268 CarbonylContact C-O 3.59Å; A263-L268 WeakPolarHBondContact CB-O 3.15Å; A263-L268 PolarHBondContact O-N 3.45Å; A263-V273 HydrophobicContact CB-CG2 4.05Å
264N98.3Very high98.1Very high119 Ų11967 Ų6764%0.63634%0.343SS*.Hα-helixtrans-66-45.6177.8-66.2-14.7000112I260 E261 I262 L266 Q267I260-N264 PolarHBondContact O-N 3.45Å; I260-N264 PolarHBondContact O-ND2 3.04Å; E261-N264 PolarHBondContact O-N 3.25Å; I262-N264 VanDerWaalsContact C-N 3.3Å; I262-N264 PolarHBondContact O-N 3.34Å; N264-L266 VanDerWaalsContact C-N 3.28Å; N264-L266 PolarHBondContact O-N 2.79Å; N264-Q267 PolarHBondContact O-N 3.5Å
265C97.9Very high98.1Very high99 Ų9970.1 Ų70.167%0.66936%0.358SS*.Hα-helixtrans-63.5-32.8179.4-67.90000113.2E261 I262E261-C265 PolarHBondContact O-N 3.05Å; E261-C265 PolarHBondContact O-SG 3.32Å; I262-C265 PolarHBondContact O-N 2.9Å
266L97.8Very high98.1Very high14 Ų1467.2 Ų67.27%0.07334%0.338CS..Hα-helixtrans-99.70.3-176.1-60.4-174.4000114Q240 E243 L244 I262 A263 N264 L268Q240-L266 HydrophobicContact CG-CB 4.3Å; Q240-L266 PolarHBondContact NE2-O 2.82Å; E243-L266 HydrophobicContact CB-CD1 4.09Å; E243-L266 HydrophobicContact CB-CD2 3.64Å; E243-L266 HydrophobicContact CB-CG 4.45Å; E243-L266 HydrophobicContact CG-CD2 3.95Å; L244-L266 HydrophobicContact CD1-CD1 4.48Å; L244-L266 HydrophobicContact CD2-CD1 3.9Å; L244-L266 HydrophobicContact CG-CD1 3.7Å; I262-L266 HydrophobicContact CG2-CD1 3.71Å; I262-L266 HydrophobicContact CG2-CG 4.24Å; I262-L266 WeakPolarHBondContact O-CB 3.49Å; I262-L266 WeakPolarHBondContact O-CG 3.48Å; I262-L266 PolarHBondContact O-N 3.14Å; A263-L266 PolarHBondContact O-N 3.07Å; N264-L266 VanDerWaalsContact C-N 3.28Å; N264-L266 PolarHBondContact O-N 2.79Å; L266-L268 HydrophobicContact CB-CD1 4.1Å; L266-L268 HydrophobicContact CB-CG 4.04Å; L266-L268 HydrophobicContact CD1-CD1 4.47Å; L266-L268 PolarHBondContact O-N 2.99Å
267Q98.1Very high98.1Very high183 Ų18360.6 Ų60.686%0.85531%0.313SS*.THydrogen-bonded Turntrans52.544.6-173.4-58.4-179.5-3.100112A263 N264A263-Q267 WeakPolarHBondContact O-CA 3.25Å; A263-Q267 PolarHBondContact O-N 2.73Å; N264-Q267 PolarHBondContact O-N 3.5Å
268L97.1Very high98.1Very high18 Ų1862 Ų629%0.09431%0.309CS..  trans-114.8159.6176.4-65.1-179000109.8F236 L244 A263 L266 V273F236-L268 HydrophobicContact CD1-CD1 4.17Å; F236-L268 HydrophobicContact CD1-CD2 3.82Å; F236-L268 HydrophobicContact CE1-CD1 4.08Å; F236-L268 HydrophobicContact CE1-CD2 3.73Å; L244-L268 HydrophobicContact CD1-CD1 4.18Å; A263-L268 CarbonylContact C-O 3.59Å; A263-L268 WeakPolarHBondContact CB-O 3.15Å; A263-L268 PolarHBondContact O-N 3.45Å; L266-L268 HydrophobicContact CB-CD1 4.1Å; L266-L268 HydrophobicContact CB-CG 4.04Å; L266-L268 HydrophobicContact CD1-CD1 4.47Å; L266-L268 PolarHBondContact O-N 2.99Å; L268-V273 HydrophobicContact CB-CG2 4.17Å; L268-V273 HydrophobicContact CD1-CG2 4.46Å
269N97.8Very high98.1Very high109 Ų10962.8 Ų62.858%0.58332%0.32SS*.  trans-76.1146.6168.9-69.1-85.9000110.3T271 Q272 V273N269-T271 PolarHBondContact O-N 3.46Å; N269-T271 VanDerWaalsContact O-N 3.13Å; N269-Q272 HydrophobicContact CB-CB 4.49Å; N269-Q272 HydrophobicContact CB-CG 4.14Å; N269-Q272 PolarHBondContact ND2-OE1 3.35Å; N269-Q272 VanDerWaalsContact ND2-OE1 3.09Å; N269-Q272 WeakPolarHBondContact O-CA 3.39Å; N269-Q272 WeakPolarHBondContact O-CB 3.39Å; N269-Q272 PolarHBondContact O-N 3.27Å; N269-V273 PolarHBondContact O-N 3.4Å; N269-V273 VanDerWaalsContact O-N 3.13Å
270D97.8Very high98.1Very high29 Ų2961.9 Ų61.916%0.15532%0.317CS..Hα-helixtrans-51.2-39.6173.5171.394.1000112.4R256 R259 Q272 V273 K274R256-D270 IonicContact CZ-OD1 3.54Å; R256-D270 IonicContact CZ-OD2 3.67Å; R256-D270 IonicContact NH1-OD1 2.81Å; R256-D270 PolarHBondContact NH1-OD1 3.36Å; R256-D270 IonicContact NH1-OD2 2.62Å; R256-D270 PolarHBondContact NH1-OD2 3.12Å; R259-D270 WeakPolarHBondContact CD-O 3.45Å; R259-D270 WeakPolarHBondContact CD-OD1 3.43Å; R259-D270 WeakPolarHBondContact CG-OD1 3.49Å; R259-D270 IonicContact NH1-OD2 3.94Å; D270-Q272 VanDerWaalsContact C-N 3.33Å; D270-Q272 PolarHBondContact O-N 3.08Å; D270-V273 PolarHBondContact O-N 2.89Å; D270-K274 WeakPolarHBondContact O-CB 3.25Å; D270-K274 PolarHBondContact O-N 2.95Å
271T97.3Very high98.1Very high73 Ų7361.7 Ų61.745%0.44831%0.311SS..Hα-helixtrans-63.4-37.6176.1-60.50000112.3N269 K274 I275N269-T271 PolarHBondContact O-N 3.46Å; N269-T271 VanDerWaalsContact O-N 3.13Å; T271-K274 WeakPolarHBondContact O-CB 3.47Å; T271-K274 PolarHBondContact O-N 3.21Å; T271-I275 HydrophobicContact CG2-CD1 3.77Å; T271-I275 HydrophobicContact CG2-CG1 4.36Å; T271-I275 WeakPolarHBondContact O-CB 3.34Å; T271-I275 VanDerWaalsContact O-CG1 3.24Å; T271-I275 WeakPolarHBondContact O-CG1 3.25Å; T271-I275 PolarHBondContact O-N 2.66Å
272Q97.7Very high98.1Very high38 Ų3861.4 Ų61.418%0.17831%0.311CS..Hα-helixtrans-67-43.6177.7-69.6170.6-5600110.7T234 F236 N269 D270 K274 I275 W276T234-Q272 PolarHBondContact OG1-NE2 3.45Å; F236-Q272 HydrophobicContact CE1-CB 4.43Å; F236-Q272 HydrophobicContact CZ-CB 4.3Å; N269-Q272 HydrophobicContact CB-CB 4.49Å; N269-Q272 HydrophobicContact CB-CG 4.14Å; N269-Q272 PolarHBondContact ND2-OE1 3.35Å; N269-Q272 VanDerWaalsContact ND2-OE1 3.09Å; N269-Q272 WeakPolarHBondContact O-CA 3.39Å; N269-Q272 WeakPolarHBondContact O-CB 3.39Å; N269-Q272 PolarHBondContact O-N 3.27Å; D270-Q272 VanDerWaalsContact C-N 3.33Å; D270-Q272 PolarHBondContact O-N 3.08Å; Q272-K274 VanDerWaalsContact C-N 3.34Å; Q272-K274 PolarHBondContact O-N 3.48Å; Q272-I275 PolarHBondContact O-N 3.41Å; Q272-W276 WeakPolarHBondContact O-CB 3.45Å; Q272-W276 PolarHBondContact O-N 3.03Å
273V98.3Very high98.1Very high0 Ų067.2 Ų67.20%034%0.336CS..Hα-helixtrans-61.7-43.6174.4-176.70000110.5L244 L254 R259 I262 A263 L268 N269 D270 I275 W276 F277L244-V273 HydrophobicContact CD2-CG1 4.12Å; L254-V273 HydrophobicContact CD1-CG1 3.85Å; R259-V273 HydrophobicContact CG-CB 3.91Å; R259-V273 HydrophobicContact CG-CG1 3.73Å; I262-V273 HydrophobicContact CG2-CG1 4.18Å; I262-V273 HydrophobicContact CG2-CG2 4.39Å; A263-V273 HydrophobicContact CB-CG2 4.05Å; L268-V273 HydrophobicContact CB-CG2 4.17Å; L268-V273 HydrophobicContact CD1-CG2 4.46Å; N269-V273 PolarHBondContact O-N 3.4Å; N269-V273 VanDerWaalsContact O-N 3.13Å; D270-V273 PolarHBondContact O-N 2.89Å; V273-I275 PolarHBondContact O-N 2.92Å; V273-W276 PolarHBondContact O-N 3.14Å; V273-F277 HydrophobicContact CG1-CD2 3.96Å; V273-F277 HydrophobicContact CG1-CE2 4.09Å; V273-F277 WeakPolarHBondContact O-CD2 3.41Å; V273-F277 PolarHBondContact O-N 2.84Å
274K98.1Very high98Very high100 Ų10069.2 Ų69.244%0.43535%0.345SS..Hα-helixtrans-57-50.5175.7-174.8-179.970.7-178.90112R259 D270 T271 Q272 F277 Q278R259-K274 VanDerWaalsContact NH1-CD 3.32Å; D270-K274 WeakPolarHBondContact O-CB 3.25Å; D270-K274 PolarHBondContact O-N 2.95Å; T271-K274 WeakPolarHBondContact O-CB 3.47Å; T271-K274 PolarHBondContact O-N 3.21Å; Q272-K274 VanDerWaalsContact C-N 3.34Å; Q272-K274 PolarHBondContact O-N 3.48Å; K274-F277 PolarHBondContact O-N 3.21Å; K274-Q278 PolarHBondContact O-N 3.06Å
275I98.2Very high97.9Very high87 Ų8769.6 Ų69.645%0.44634%0.341SS..Hα-helixtrans-64.5-42.7-179.6-69.8168000110.2T271 Q272 V273 F277 Q278 N279T271-I275 HydrophobicContact CG2-CD1 3.77Å; T271-I275 HydrophobicContact CG2-CG1 4.36Å; T271-I275 WeakPolarHBondContact O-CB 3.34Å; T271-I275 VanDerWaalsContact O-CG1 3.24Å; T271-I275 WeakPolarHBondContact O-CG1 3.25Å; T271-I275 PolarHBondContact O-N 2.66Å; Q272-I275 PolarHBondContact O-N 3.41Å; V273-I275 PolarHBondContact O-N 2.92Å; I275-F277 PolarHBondContact O-N 2.94Å; I275-Q278 PolarHBondContact O-N 3.19Å; I275-N279 WeakPolarHBondContact O-CB 3.37Å; I275-N279 VanDerWaalsContact O-CG 3.29Å; I275-N279 PolarHBondContact O-N 2.86Å
276W98.4Very high97.9Very high28 Ų2870.8 Ų70.811%0.10634%0.335CS..Hα-helixtrans-60.3-47.2178.4-170.5101.1000111.4F236 L244 E245 F248 Q272 V273 Q278 N279 R280F236-W276 AromaticContact CD2-CD1 3.88Å; F236-W276 AromaticContact CE2-CD1 3.68Å; L244-W276 HydrophobicContact CB-CD2 3.98Å; L244-W276 HydrophobicContact CB-CE3 3.93Å; L244-W276 HydrophobicContact CB-CH2 3.65Å; L244-W276 HydrophobicContact CB-CZ2 3.67Å; L244-W276 HydrophobicContact CB-CZ3 3.77Å; L244-W276 HydrophobicContact CD1-CD2 3.87Å; L244-W276 HydrophobicContact CD1-CE3 4.49Å; L244-W276 HydrophobicContact CD1-CG 3.86Å; L244-W276 HydrophobicContact CD2-CD2 4.45Å; L244-W276 HydrophobicContact CD2-CE3 4.31Å; L244-W276 HydrophobicContact CG-CD2 4.32Å; L244-W276 HydrophobicContact CG-CE3 4.48Å; L244-W276 WeakPolarHBondContact O-CH2 3.14Å; L244-W276 WeakPolarHBondContact O-CZ3 3.36Å; E245-W276 HydrophobicContact CG-CH2 3.9Å; E245-W276 HydrophobicContact CG-CZ2 3.95Å; F248-W276 HydrophobicContact CB-CH2 4.3Å; F248-W276 HydrophobicContact CB-CZ3 4.02Å; F248-W276 HydrophobicContact CG-CZ3 4.44Å; Q272-W276 WeakPolarHBondContact O-CB 3.45Å; Q272-W276 PolarHBondContact O-N 3.03Å; V273-W276 PolarHBondContact O-N 3.14Å; W276-Q278 VanDerWaalsContact C-N 3.32Å; W276-Q278 PolarHBondContact O-N 3.47Å; W276-N279 PolarHBondContact O-N 3.24Å; W276-R280 HydrophobicContact CD2-CB 4.45Å; W276-R280 HydrophobicContact CE3-CB 3.94Å; W276-R280 HydrophobicContact CE3-CG 4.41Å; W276-R280 HydrophobicContact CH2-CB 4.08Å; W276-R280 HydrophobicContact CH2-CG 3.72Å; W276-R280 HydrophobicContact CZ2-CG 4.44Å; W276-R280 HydrophobicContact CZ3-CB 3.73Å; W276-R280 HydrophobicContact CZ3-CG 3.7Å; W276-R280 VanDerWaalsContact O-CB 3.25Å; W276-R280 WeakPolarHBondContact O-CB 3.07Å; W276-R280 PolarHBondContact O-N 3.5Å
277F98.8Very high97.7Very high7 Ų776.5 Ų76.53%0.03136%0.355CS..Hα-helixtrans-63.8-35.4177.1-92.4-103.8000112.8L244 E247 F248 L254 V273 K274 I275 R281L244-F277 HydrophobicContact CD2-CE2 4.02Å; E247-F277 HydrophobicContact CB-CZ 4.05Å; F248-F277 HydrophobicContact CB-CE1 4.09Å; F248-F277 HydrophobicContact CB-CZ 4.17Å; F248-F277 AromaticContact CD2-CD1 3.92Å; F248-F277 HydrophobicContact CD2-CD1 3.92Å; F248-F277 AromaticContact CD2-CE1 3.86Å; F248-F277 HydrophobicContact CD2-CE1 3.86Å; F248-F277 HydrophobicContact CG-CE1 4.49Å; L254-F277 HydrophobicContact CD1-CD1 4.08Å; L254-F277 HydrophobicContact CD1-CD2 3.69Å; L254-F277 HydrophobicContact CD1-CE1 3.81Å; L254-F277 HydrophobicContact CD1-CE2 3.41Å; L254-F277 VanDerWaalsContact CD1-CE2 3.41Å; L254-F277 HydrophobicContact CD1-CG 4.03Å; L254-F277 HydrophobicContact CD1-CZ 3.48Å; L254-F277 VanDerWaalsContact CD1-CZ 3.48Å; L254-F277 HydrophobicContact CD2-CD1 4.5Å; L254-F277 HydrophobicContact CD2-CE1 3.73Å; L254-F277 HydrophobicContact CD2-CZ 3.79Å; L254-F277 HydrophobicContact CG-CD1 3.8Å; L254-F277 HydrophobicContact CG-CD2 4.34Å; L254-F277 HydrophobicContact CG-CE1 3.48Å; L254-F277 VanDerWaalsContact CG-CE1 3.48Å; L254-F277 HydrophobicContact CG-CE2 4.09Å; L254-F277 HydrophobicContact CG-CG 4.22Å; L254-F277 HydrophobicContact CG-CZ 3.66Å; V273-F277 HydrophobicContact CG1-CD2 3.96Å; V273-F277 HydrophobicContact CG1-CE2 4.09Å; V273-F277 WeakPolarHBondContact O-CD2 3.41Å; V273-F277 PolarHBondContact O-N 2.84Å; K274-F277 PolarHBondContact O-N 3.21Å; I275-F277 PolarHBondContact O-N 2.94Å; F277-R281 WeakPolarHBondContact O-CG 3.44Å; F277-R281 PolarHBondContact O-N 3.02Å; F277-R281 VanDerWaalsContact O-N 3.08Å; F277-R281 PolarHBondContact O-NE 3.15Å
278Q98.6Very high97.5Very high86 Ų8672.7 Ų72.740%0.40234%0.337SS..Hα-helixtrans-64-50.4173.3-174.160.456.600111.2K274 I275 W276 R280 R281 M282K274-Q278 PolarHBondContact O-N 3.06Å; I275-Q278 PolarHBondContact O-N 3.19Å; W276-Q278 VanDerWaalsContact C-N 3.32Å; W276-Q278 PolarHBondContact O-N 3.47Å; Q278-R280 VanDerWaalsContact C-N 3.3Å; Q278-R280 PolarHBondContact O-N 2.82Å; Q278-R281 PolarHBondContact O-N 3.29Å; Q278-M282 WeakPolarHBondContact O-CG 3.3Å; Q278-M282 PolarHBondContact O-N 3.29Å; Q278-M282 VanDerWaalsContact O-N 3.08Å
279N98.3Very high97.2Very high100 Ų10081.3 Ų81.354%0.53537%0.369SS..Hα-helixtrans-61.5-40.4178.2-69.9-14.9000111.6I275 W276 M282 K283I275-N279 WeakPolarHBondContact O-CB 3.37Å; I275-N279 VanDerWaalsContact O-CG 3.29Å; I275-N279 PolarHBondContact O-N 2.86Å; W276-N279 PolarHBondContact O-N 3.24Å; N279-M282 PolarHBondContact O-N 3.06Å; N279-K283 PolarHBondContact O-N 3.27Å
280R98.6Very high96.7Very high28 Ų2880.9 Ų80.911%0.10636%0.363CS..Hα-helixtrans-65-40-179.9-175.862.7-171.6726.2112.3F248 W276 Q278 K283 Q284F248-R280 HydrophobicContact CD1-CG 3.8Å; F248-R280 HydrophobicContact CD2-CB 4.25Å; F248-R280 HydrophobicContact CD2-CG 3.62Å; F248-R280 HydrophobicContact CE1-CG 3.82Å; F248-R280 HydrophobicContact CE2-CB 4.18Å; F248-R280 HydrophobicContact CE2-CG 3.64Å; F248-R280 HydrophobicContact CG-CG 3.69Å; F248-R280 HydrophobicContact CZ-CG 3.73Å; W276-R280 HydrophobicContact CD2-CB 4.45Å; W276-R280 HydrophobicContact CE3-CB 3.94Å; W276-R280 HydrophobicContact CE3-CG 4.41Å; W276-R280 HydrophobicContact CH2-CB 4.08Å; W276-R280 HydrophobicContact CH2-CG 3.72Å; W276-R280 HydrophobicContact CZ2-CG 4.44Å; W276-R280 HydrophobicContact CZ3-CB 3.73Å; W276-R280 HydrophobicContact CZ3-CG 3.7Å; W276-R280 VanDerWaalsContact O-CB 3.25Å; W276-R280 WeakPolarHBondContact O-CB 3.07Å; W276-R280 PolarHBondContact O-N 3.5Å; Q278-R280 VanDerWaalsContact C-N 3.3Å; Q278-R280 PolarHBondContact O-N 2.82Å; R280-K283 PolarHBondContact O-N 3.2Å; R280-Q284 PolarHBondContact O-N 2.9Å
281R98.5Very high95.3Very high63 Ų6380.8 Ų80.824%0.23837%0.369CS..Hα-helixtrans-65-42.7172.6-75.4-177.1-73.5143.40.4111.8F248 K252 F277 Q278 K283 Q284 K285F248-R281 HydrophobicContact CE2-CG 3.77Å; F248-R281 HydrophobicContact CZ-CG 4.29Å; K252-R281 WeakPolarHBondContact O-CD 3.47Å; F277-R281 WeakPolarHBondContact O-CG 3.44Å; F277-R281 PolarHBondContact O-N 3.02Å; F277-R281 VanDerWaalsContact O-N 3.08Å; F277-R281 PolarHBondContact O-NE 3.15Å; Q278-R281 PolarHBondContact O-N 3.29Å; R281-K283 VanDerWaalsContact C-N 3.34Å; R281-K283 PolarHBondContact O-N 2.66Å; R281-Q284 PolarHBondContact O-N 3.47Å; R281-K285 PolarHBondContact O-N 2.99Å
282M98.4Very high93.5Very high95 Ų9583.5 Ų83.547%0.46838%0.38SS..Hα-helixtrans-61.9-42.1176-65.5-59.8-80.300111.8Q278 N279 Q284 K285 K286Q278-M282 WeakPolarHBondContact O-CG 3.3Å; Q278-M282 PolarHBondContact O-N 3.29Å; Q278-M282 VanDerWaalsContact O-N 3.08Å; N279-M282 PolarHBondContact O-N 3.06Å; M282-Q284 PolarHBondContact O-N 3.43Å; M282-K285 PolarHBondContact O-N 2.84Å; M282-K286 WeakPolarHBondContact O-CB 3.41Å; M282-K286 PolarHBondContact O-N 3.23Å
283K97.3Very high91.6Very high132 Ų13288.3 Ų88.357%0.57441%0.407SS*.Hα-helixtrans-63.5-39174.9-171.1177.1-178-178.60112.1N279 R280 R281 R287N279-K283 PolarHBondContact O-N 3.27Å; R280-K283 PolarHBondContact O-N 3.2Å; R281-K283 VanDerWaalsContact C-N 3.34Å; R281-K283 PolarHBondContact O-N 2.66Å; K283-R287 WeakPolarHBondContact O-CG 3.41Å; K283-R287 PolarHBondContact O-N 3.02Å
284Q97.1Very high89.6Confident46 Ų4691.5 Ų91.522%0.21543%0.433CS..Hα-helixtrans-62.4-53.5174.2-179.7170.1-50.900111.3F248 R280 R281 M282 K286 R287 E288F248-Q284 VanDerWaalsContact CZ-OE1 3.31Å; R280-Q284 PolarHBondContact O-N 2.9Å; R281-Q284 PolarHBondContact O-N 3.47Å; M282-Q284 PolarHBondContact O-N 3.43Å; Q284-K286 PolarHBondContact O-N 3.49Å; Q284-R287 CarbonylContact O-C 3.51Å; Q284-R287 PolarHBondContact O-N 2.73Å; Q284-E288 VanDerWaalsContact CD-OE1 3.29Å; Q284-E288 HydrophobicContact CG-CG 4.27Å; Q284-E288 WeakPolarHBondContact CG-OE1 3.44Å; Q284-E288 PolarHBondContact NE2-OE1 3.39Å; Q284-E288 WeakPolarHBondContact O-CG 3.39Å; Q284-E288 PolarHBondContact O-N 2.92Å
285K97.1Very high87.2Confident127 Ų12792.3 Ų92.355%0.55245%0.446SS*.Hα-helixtrans-55.7-39.9178.7-174.9177.968.8171.40112.1R281 M282 E288 R289R281-K285 PolarHBondContact O-N 2.99Å; M282-K285 PolarHBondContact O-N 2.84Å; K285-E288 PolarHBondContact O-N 3.05Å; K285-R289 WeakPolarHBondContact O-CB 3.32Å; K285-R289 PolarHBondContact O-N 2.86Å
286K96.3Very high84.9Confident124 Ų12491.7 Ų91.754%0.53945%0.454SS..Hα-helixtrans-62.5-49.4175.3-175.9174.5178.2178.60111.4M282 Q284 E288 R289 E290M282-K286 WeakPolarHBondContact O-CB 3.41Å; M282-K286 PolarHBondContact O-N 3.23Å; Q284-K286 PolarHBondContact O-N 3.49Å; K286-E288 VanDerWaalsContact C-N 3.33Å; K286-E288 PolarHBondContact O-N 2.89Å; K286-R289 PolarHBondContact O-N 3.36Å; K286-E290 VanDerWaalsContact CE-CD 3.46Å; K286-E290 WeakPolarHBondContact CE-OE1 3.49Å; K286-E290 HydrophobicContact CG-CG 4.44Å; K286-E290 IonicContact NZ-OE1 3.71Å; K286-E290 WeakPolarHBondContact O-CB 3.43Å; K286-E290 WeakPolarHBondContact O-CG 3.33Å; K286-E290 PolarHBondContact O-N 3.24Å
287R94.4Very high82.6Confident134 Ų13496.3 Ų96.351%0.50648%0.48SS..Hα-helixtrans-64.4-32.9177.7-73.6-167.4-58.3174.85.9113.5K283 Q284 G291K283-R287 WeakPolarHBondContact O-CG 3.41Å; K283-R287 PolarHBondContact O-N 3.02Å; Q284-R287 CarbonylContact O-C 3.51Å; Q284-R287 PolarHBondContact O-N 2.73Å; R287-G291 WeakPolarHBondContact O-CA 3.19Å; R287-G291 PolarHBondContact O-N 3.07Å
288E93.3Very high80.1Confident102 Ų102101.3 Ų101.348%0.47751%0.513SS..Hα-helixtrans-69.8-42.9175.7-71.9164.3178.200110.7Q284 K285 K286 G291 L292Q284-E288 VanDerWaalsContact CD-OE1 3.29Å; Q284-E288 HydrophobicContact CG-CG 4.27Å; Q284-E288 WeakPolarHBondContact CG-OE1 3.44Å; Q284-E288 PolarHBondContact NE2-OE1 3.39Å; Q284-E288 WeakPolarHBondContact O-CG 3.39Å; Q284-E288 PolarHBondContact O-N 2.92Å; K285-E288 PolarHBondContact O-N 3.05Å; K286-E288 VanDerWaalsContact C-N 3.33Å; K286-E288 PolarHBondContact O-N 2.89Å; E288-G291 PolarHBondContact O-N 3Å; E288-L292 WeakPolarHBondContact O-CG 2.73Å; E288-L292 PolarHBondContact O-N 3.49Å
289R90.9Very high77.8Confident199 Ų199103.3 Ų103.375%0.75153%0.531SS*.Hα-helixtrans-65.4-44.3176.7-172-179.1-175.2-170.22.3112.6K285 K286K285-R289 WeakPolarHBondContact O-CB 3.32Å; K285-R289 PolarHBondContact O-N 2.86Å; K286-R289 PolarHBondContact O-N 3.36Å
290E87.9Confident75.5Confident101 Ų101102 Ų10247%0.47253%0.534SS..Hα-helixtrans-75.3-33178-68.3172.5170.900111.5K286 L293 A294K286-E290 VanDerWaalsContact CE-CD 3.46Å; K286-E290 WeakPolarHBondContact CE-OE1 3.49Å; K286-E290 HydrophobicContact CG-CG 4.44Å; K286-E290 IonicContact NZ-OE1 3.71Å; K286-E290 WeakPolarHBondContact O-CB 3.43Å; K286-E290 WeakPolarHBondContact O-CG 3.33Å; K286-E290 PolarHBondContact O-N 3.24Å; E290-L293 CarbonylContact O-C 3.46Å; E290-L293 WeakPolarHBondContact O-CA 3.38Å; E290-L293 WeakPolarHBondContact O-CB 3.48Å; E290-L293 PolarHBondContact O-N 3.46Å; E290-A294 PolarHBondContact O-N 2.99Å
291G68.4Low72.9Confident27 Ų27105.8 Ų105.828%0.27856%0.562SS.*Hα-helixtrans-64.9-39.8177.100000112.4R287 E288 L293 A294 T295R287-G291 WeakPolarHBondContact O-CA 3.19Å; R287-G291 PolarHBondContact O-N 3.07Å; E288-G291 PolarHBondContact O-N 3Å; G291-L293 PolarHBondContact O-N 3.47Å; G291-A294 PolarHBondContact O-N 2.89Å; G291-T295 PolarHBondContact O-N 2.87Å; G291-T295 PolarHBondContact O-OG1 3.46Å
292L59.8Low70.2Confident130 Ų130111 Ų11168%0.68159%0.594SS**Hα-helixtrans-59.2-28.3170.7-73.6172.1000112.7E288E288-L292 WeakPolarHBondContact O-CG 2.73Å; E288-L292 PolarHBondContact O-N 3.49Å
293L56.6Low67.6Low139 Ų139114.8 Ų114.873%0.72861%0.61SS**Hα-helixtrans-86.4-26.3174.8-52-163.4000112.3E290 G291E290-L293 CarbonylContact O-C 3.46Å; E290-L293 WeakPolarHBondContact O-CA 3.38Å; E290-L293 WeakPolarHBondContact O-CB 3.48Å; E290-L293 PolarHBondContact O-N 3.46Å; G291-L293 PolarHBondContact O-N 3.47Å
294A56.2Low64.8Low67 Ų67116.4 Ų116.455%0.55462%0.624SS**Hα-helixtrans-83.2-27.7178.700000113.7E290 G291 A296E290-A294 PolarHBondContact O-N 2.99Å; G291-A294 PolarHBondContact O-N 2.89Å; A294-A296 VanDerWaalsContact C-N 3.29Å
295T49Very low62.1Low117 Ų117120 Ų12072%0.71865%0.651SS**THydrogen-bonded Turntrans-80.8-5.9172.739.50000113.8G291 I297G291-T295 PolarHBondContact O-N 2.87Å; G291-T295 PolarHBondContact O-OG1 3.46Å; T295-I297 VanDerWaalsContact C-N 3.27Å; T295-I297 PolarHBondContact O-N 3Å
296A49.8Very low59.4Low74 Ų74122.3 Ų122.361%0.61267%0.669SS**THydrogen-bonded Turntrans-88.716.417400000113.3A294 P298A294-A296 VanDerWaalsContact C-N 3.29Å; A296-P298 VanDerWaalsContact O-CD 3.23Å; A296-P298 WeakPolarHBondContact O-CD 3.23Å
297I49.6Very low56.7Low124 Ų124122.1 Ų122.164%0.63668%0.683SS**SBendtrans-84.4108.3159-57.4179.3000105.7T295 V299T295-I297 VanDerWaalsContact C-N 3.27Å; T295-I297 PolarHBondContact O-N 3Å; I297-V299 VanDerWaalsContact C-N 3.34Å; I297-V299 PolarHBondContact O-N 2.89Å
298P45.3Very low54Low112 Ų112118.9 Ų118.973%0.72769%0.691SS**  trans-61.6106166.126.9-30.9000106.2A296 A300A296-P298 VanDerWaalsContact O-CD 3.23Å; A296-P298 WeakPolarHBondContact O-CD 3.23Å; P298-A300 PolarHBondContact O-N 2.85Å
299V50.4Low51.3Low129 Ų129121.1 Ų121.178%0.78271%0.712SS**  trans-62.592.3159170.10000104.7I297 P301I297-V299 VanDerWaalsContact C-N 3.34Å; I297-V299 PolarHBondContact O-N 2.89Å; V299-P301 WeakPolarHBondContact O-CD 3.45Å
300A49.8Very low48.9Very low73 Ų73118 Ų11860%0.60372%0.716SS**  trans-54.8123.1160.200000106P298 L302P298-A300 PolarHBondContact O-N 2.85Å; A300-L302 PolarHBondContact O-N 2.81Å
301P45.3Very low47.1Very low106 Ų106118.3 Ų118.369%0.68873%0.726SS**  trans-66.6102.3174.526-29.7000107.2V299 Q303V299-P301 WeakPolarHBondContact O-CD 3.45Å; P301-Q303 PolarHBondContact O-N 3.31Å
302L41.9Very low45.5Very low174 Ų174123.5 Ų123.591%0.91175%0.753SS**  trans-67.286.6162.7-83.9168.1000107A300 L304A300-L302 PolarHBondContact O-N 2.81Å; L302-L304 PolarHBondContact O-N 3.27Å
303Q43.1Very low44.9Very low173 Ų173126.4 Ų126.481%0.80876%0.76SS**  trans-62.2116.6166.3-75.8176.6-47.400108.5P301P301-Q303 PolarHBondContact O-N 3.31Å
304L39.1Very low44.1Very low167 Ų167129.7 Ų129.787%0.87477%0.769SS**  trans-68.2127.9160.4-78.8158.6000108.5L302 L306L302-L304 PolarHBondContact O-N 3.27Å; L304-L306 PolarHBondContact O-N 3.41Å
305P41.1Very low43.5Very low120 Ų120133.3 Ų133.378%0.77978%0.777SS**  trans-80.9114.117430.6-28.5000109.2
306L40Very low43.2Very low176 Ų176137.2 Ų137.292%0.92178%0.784SS**  trans-81.7125.6164.8-151.877.1000108.2L304L304-L306 PolarHBondContact O-N 3.41Å
307S39.1Very low42.7Very low121 Ų121140.8 Ų140.885%0.84679%0.793SS**  trans-61.5141.1-178.9-62.40000113.8
308G36.5Very low42.8Very low65 Ų65140.8 Ų140.867%0.6780%0.801SS**  trans98.695.7135.100000117.8
309T37.9Very low42.2Very low150 Ų150138.7 Ų138.792%0.9280%0.8SS**  169.7130.9112.234.80000110.1
310T40.8Very low41.7Very low134 Ų134138.1 Ų138.182%0.82280%0.802SS**  trans-122.5176.2164.7600000107
311P49.6Very low41.5Very low107 Ų107140.8 Ų140.870%0.69581%0.813SS**  cis-129.1163.5-27.926.3-6.7000111.5
312T35.5Very low41.5Very low136 Ų136141.7 Ų141.783%0.83482%0.822SS**  trans-145.6114.8146.6-67.90000109.7
313K46.3Very low41.7Very low191 Ų191141.7 Ų141.783%0.8382%0.817SS**  trans-71.3128.7166.4-63.2175179.3176.60107.7
314F40.6Very low41.7Very low207 Ų207138.6 Ų138.691%0.90882%0.815SS**  trans-135.6126.9146.7-127.6-92.1000109.9
315I44Very low42.3Very low144 Ų144140.3 Ų140.374%0.73882%0.818SS**  trans-78.6144.8-177.3-66.6161000108.1
316K42.2Very low42.6Very low198 Ų198143.2 Ų143.286%0.86182%0.821SS**  144.9106.7124.1-151.8149.7-179.2-177.50113.1
317N38.8Very low43.7Very low149 Ų149139.7 Ų139.780%0.79781%0.809SS**  trans-56.8-179.5152.9-102.2-12.1000111.6
318P52Low44.4Very low125 Ų125143.3 Ų143.381%0.81283%0.834SS**  cis-136.8-177.1-12.928.2-4.9000113
319G31.9Very low44.8Very low67 Ų67147.3 Ų147.369%0.69184%0.843SS**  trans151112.4149.300000118.7
320S40Very low45.1Very low118 Ų118147.1 Ų147.183%0.82584%0.838SS**  trans84.2122.9152.2-56.60000120.3
321P45.1Very low45.4Very low129 Ų129147.8 Ų147.884%0.83884%0.839SS**  -116.7120.2125.332.6-24.1000109.5Q323P321-Q323 PolarHBondContact O-N 3.3Å
322S46.6Very low45.1Very low125 Ų125150.2 Ų150.287%0.87485%0.848SS**  trans-80.4114.4174-156.10000109.2
323Q45.1Very low45.7Very low173 Ų173151.1 Ų151.181%0.80885%0.849SS**  trans-82160.5162.1-79.5-173.111.900110.7P321P321-Q323 PolarHBondContact O-N 3.3Å
324S43Very low45.7Very low109 Ų109148.5 Ų148.576%0.76285%0.85SS**  trans9191.7151.2-48.90000117.5
325Q51.2Low46Very low203 Ų203144.3 Ų144.395%0.94985%0.846SS**  trans-89124.5140.4-88.8-178.5-26.200107.9
326E48.2Very low46.2Very low181 Ų181144.3 Ų144.385%0.84685%0.854SS**  trans-94.3153.5167.5-134.5-134126.100109.6
327P63.8Low46.5Very low101 Ų101139.8 Ų139.866%0.65685%0.853SS**  trans-105.9125.2169.334.6-23.4000112.6
328S52.8Low47.2Very low198 Ų198139 Ų139100%1.38586%0.859SS**  trans176.20138.7-81.60000110.6

Retrieved 328 of 328 residues in 327.8 ms (Link to these results)