A0A076N402_MOUSE Loading...

Truncated Kidins220 isoform m4

AlphaFold DB , UniProt , Accession A0A076N402, Species MOUSE (Mus musculus, Mouse), Gene Kidins220, Length 688 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
1V39.2Very low41Very low180 Ų180153.7 Ų153.7100%1.09183%0.827SS**  0122.20177.20000106.2
2R37.7Very low40.3Very low231 Ų231146.6 Ų146.687%0.87282%0.817SS**  cis-154157.34.3-156.8177-67.3-157.8-1.6108.1
3A45.9Very low40Very low93 Ų93149.2 Ų149.277%0.76983%0.826SS**  trans64.3129.3177.400000115.6
4A45.6Very low39.4Very low90 Ų90144.6 Ų144.674%0.74482%0.818SS**  cis62.2135.55.300000115.7
5R46.3Very low39.3Very low214 Ų214150.2 Ų150.281%0.80882%0.823SS**  cis-143.3179.90.9-98.3161.2176.3162.6-5.2106.4
6E43.7Very low39.7Very low172 Ų172147.9 Ų147.980%0.80482%0.818SS**  cis-156.8146.848.4-74.4174.8155.100108
7Q43.2Very low39.7Very low148 Ų148146.5 Ų146.569%0.69282%0.817SS**  55.5128.972.6-54.6-173.2-99.900112
8I42Very low39.7Very low156 Ų156147.2 Ų147.280%0.882%0.818SS**  cis-142.1142.631.245.3174.1000110.3
9N32.4Very low40Very low152 Ų152146.1 Ų146.181%0.81382%0.818SS**  82.898.153.2-161.436.8000114.6
10I38.7Very low39.6Very low178 Ų178147.3 Ų147.391%0.91382%0.821SS**  trans-153149.5161.7-108.1167.7000108.8
11G35.9Very low39.4Very low77 Ų77148 Ų14879%0.79482%0.818SS**  trans174.5172.7172.100000112.7
12G33.6Very low38.9Very low68 Ų68148.1 Ų148.170%0.70181%0.807SS**  trans147.3119165.600000116.7
13L36.2Very low38.4Very low180 Ų180141 Ų14194%0.94280%0.797SS**  trans64152.3137.7-54.5176.9000119.2
14A30.9Very low38.9Very low86 Ų86142 Ų14271%0.71180%0.796SS**  cis-163.2163.8-20.900000109.9
15Y38.2Very low38.5Very low228 Ų228143.9 Ų143.989%0.89480%0.801SS**  trans-88.7146.5173.3-84.5-96.8000112.8
16P45.3Very low37.7Very low114 Ų114143 Ų14374%0.7480%0.797SS**  trans-91.2164.9159.335.6-31.5000112.9
17P40.2Very low37.7Very low124 Ų124140.4 Ų140.481%0.80580%0.795SS**  trans-115.6175.3-157.942.2-34.1000116.9
18L39.4Very low37.5Very low159 Ų159138.6 Ų138.683%0.83280%0.796SS**PPolyproline II helixtrans-89.3153.6164.6-70171.4000112.3
19P45.3Very low37Very low125 Ų125137.1 Ų137.181%0.81280%0.8SS**PPolyproline II helixtrans-93.4152.4158.6-7.226.8000114.3
20L32.6Very low36.9Very low170 Ų170133 Ų13389%0.8979%0.793SS**PPolyproline II helixtrans-102.5173.1169.3-80166.3000108.3
21H35.9Very low36.3Very low164 Ų164135.1 Ų135.176%0.75979%0.791SS**  cis-172.8-168.4-11.6168.474.8000107.1
22E28Very low36Very low182 Ų182135.2 Ų135.285%0.8578%0.78SS**  trans127.8164.9154-149.7151.3133.800115.7
23A27.7Very low35.9Very low81 Ų81140.2 Ų140.267%0.66979%0.785SS**  trans-138-160.2-140.100000114.6
24P56.5Low36.8Very low115 Ų115137 Ų13775%0.74777%0.774SS**  trans-123.9-177.2-136.742.5-24.5000116.8
25P36.8Very low36.6Very low129 Ų129137.7 Ų137.784%0.83878%0.781SS**  trans-137.6177.913234.5-19.5000115.7
26R29.2Very low36.5Very low196 Ų196132.4 Ų132.474%0.7478%0.777SS**  trans-99-158.6-173.2-55.7177.7-179110.5-5.8112.4
27P42.8Very low35.7Very low116 Ų116134 Ų13475%0.75378%0.784SS**  -121.2-136.2-88.842.7-23.6000110.3
28P40.5Very low35.2Very low110 Ų110133.6 Ų133.671%0.71478%0.783SS**  cis-131.1-175.2-33.140.3-24.2000114.8
29S30.8Very low34.7Very low126 Ų126131.4 Ų131.488%0.88178%0.781SS**  trans73.7150.5153.2-148.50000119.3
30G29.6Very low33.9Very low65 Ų65131.4 Ų131.467%0.6778%0.784SS**  cis165.7168.3-11.500000115.2
31Y27.7Very low33.8Very low222 Ų222128.9 Ų128.987%0.87178%0.781SS**  trans57.9112.4158.2-112.7-108.9000123.2
32S29.3Very low33.5Very low79 Ų79125.6 Ų125.655%0.55278%0.782SS**  38.1128.9128.6-45.70000123.5
33Q31.3Very low33.6Very low174 Ų174122.3 Ų122.381%0.81378%0.779SS**  170.6160.9108.3-85.3-55.7-42.200111.7
34P54Low33.7Very low111 Ų111127.2 Ų127.272%0.72179%0.785SS**  trans-113.5169179.741.3-30.9000114.4
35A26.8Very low32.4Very low102 Ų102128.4 Ų128.484%0.84379%0.786SS**  trans-167.5154.8153.400000113.2
36S36.9Very low32Very low116 Ų116125.6 Ų125.681%0.81178%0.78SS**  trans-96155.3171.2-51.90000112.2
37V29.2Very low32.8Very low147 Ų147122.4 Ų122.489%0.89179%0.785SS**  trans-138154.8161.1-1740000109.6
38C29.1Very low32.5Very low117 Ų117126.8 Ų126.879%0.79179%0.792SS**  trans-107.5176.2-164.3-57.10000115.6
39S28.3Very low32.9Very low113 Ų113127.7 Ų127.779%0.7980%0.798SS**  trans-35.2157.3173.8-38.70000119.6
40S27.8Very low33Very low124 Ų124125.5 Ų125.587%0.86780%0.795SS**  trans-161.9170.8141.6-85.10000112
41S31.3Very low33.1Very low118 Ų118125.9 Ų125.983%0.82580%0.799SS**  trans-141.9161.6-168.8-54.10000114.2
42A29.9Very low33.3Very low94 Ų94122.1 Ų122.178%0.77780%0.799SS**  trans85135.9150.600000122.6
43S30.6Very low33.7Very low113 Ų113125.1 Ų125.179%0.7981%0.814SS**  trans75103.6137.2-61.50000125.2
44F29.2Very low33.9Very low184 Ų184121.1 Ų121.181%0.80781%0.805SS**  76.9148.7111.7-159.2-119.4000123.5
45N29.5Very low33.2Very low141 Ų141121.9 Ų121.975%0.75481%0.81SS**  trans65150.5-176.9-68.4-42.3000116.4
46G28.4Very low33.4Very low70 Ų70125.1 Ų125.172%0.72281%0.808SS**  cis138160.84.700000110
47P45.3Very low34.9Very low129 Ų129123.8 Ų123.884%0.83880%0.796SS**  cis-128.7-169.3-1.443.9-27.3000114.8
48F38Very low34.8Very low207 Ų207125.9 Ų125.991%0.90880%0.796SS**  trans-136.5153.2174.4-83.7-80.8000113.5
49P47.6Very low35Very low130 Ų130124.7 Ų124.784%0.84479%0.789SS**  trans-127.9154.4140.737.7-27.7000112
50G32.6Very low35.3Very low79 Ų79123.4 Ų123.481%0.81478%0.78SS**  cis178.3132.2-7.900000112
51G31.5Very low35.8Very low73 Ų73128.3 Ų128.375%0.75378%0.781SS**  trans82.1135.7179.100000114.5
52V33.3Very low35.9Very low144 Ų144133.5 Ų133.587%0.87378%0.784SS**SBendcis-150.4147-3.4-750000108
53V36.4Very low36.3Very low141 Ų141133.3 Ų133.386%0.85578%0.777SS**  cis-145.9179.2-2.7820000109.5
54S37.1Very low37Very low91 Ų91131.2 Ų131.264%0.63677%0.773SS**  trans-139.2165.2169.9-1620000109.4
55P37.8Very low37.5Very low126 Ų126130.5 Ų130.582%0.81878%0.777SS**  -13716188.238.7-27.3000115.2
56Q32Very low38.4Very low171 Ų171129.4 Ų129.480%0.79978%0.781SS**  trans-99.3-162.3167.9-140.4-149.3-13.300109.6
57P67.2Low39.2Very low87 Ų87129.2 Ų129.257%0.56578%0.778SS**  trans-122.6162.1-131.139.5-20.2000116
58H29Very low39.6Very low192 Ų192129.6 Ų129.689%0.88978%0.781SS**  trans-149.3161.2165.2-67.9-70.6000109.2
59S32.5Very low40.1Very low92 Ų92129 Ų12964%0.64378%0.781SS**  cis-177157.4-27.3-176.80000107
60S34.8Very low39.9Very low86 Ų86129.7 Ų129.760%0.60177%0.773SS**  trans29.5124.4146.760.80000121.8
61Y38.3Very low40.6Very low227 Ų227131.8 Ų131.889%0.8977%0.772SS**  trans55114137.2-75.9-101000120.2
62Y32.8Very low41.5Very low226 Ų226135.9 Ų135.989%0.88677%0.769SS**  -146.6141.9129.2-159-113.2000112.5
63S38.9Very low42.3Very low91 Ų91138.6 Ų138.664%0.63677%0.765SS**  trans-59.5155.1169.9-530000110.9
64G43.9Very low42.6Very low69 Ų69139.8 Ų139.871%0.71177%0.767SS**  cis100.896.827.400000109.6
65L39.6Very low43.1Very low169 Ų169146.7 Ų146.789%0.88578%0.779SS**  trans-138.2102.9174.3-82.1178.7000111.7
66S48.5Very low43.5Very low118 Ų118145.9 Ų145.983%0.82577%0.774SS**  trans32.4109.4146.258.90000120.6
67G46.1Very low43.8Very low65 Ų65147.5 Ų147.567%0.6778%0.778SS**  trans-145.8130.3151.500000109.5Q69G67-Q69 PolarHBondContact O-N 3.3Å
68P54.4Low42.5Very low137 Ų137153 Ų15389%0.8979%0.794SS**  trans-87.997.4-168.632.7-33.7000112.3
69Q48.4Very low42.9Very low195 Ų195147.7 Ų147.791%0.91178%0.783SS**  trans-133140.3176.9-67.7-168.6-5.800114.5G67G67-Q69 PolarHBondContact O-N 3.3Å
70H42.4Very low43.2Very low145 Ų145149.4 Ų149.467%0.67179%0.792SS**  trans-39.2143.3-169.3-108.6-133.3000118.8F72H70-F72 AromaticContact ND1-CD2 3.5Å; H70-F72 PolarHBondContact O-N 3.36Å; H70-F72 VanDerWaalsContact O-N 3.07Å
71P47.6Very low43.3Very low123 Ų123156.2 Ų156.280%0.79981%0.806SS**THydrogen-bonded Turntrans-65.7-3.9171.7-22.233.8000116.9
72F50Low43.1Very low159 Ų159153.8 Ų153.870%0.69781%0.808SS**THydrogen-bonded Turntrans-92.3-6.8-158.8-81.1-86.6000116.3H70H70-F72 AromaticContact ND1-CD2 3.5Å; H70-F72 PolarHBondContact O-N 3.36Å; H70-F72 VanDerWaalsContact O-N 3.07Å
73Y50.7Low43.1Very low201 Ų201153.1 Ų153.179%0.78881%0.805SS**SBendtrans-129.768.5-176.5-64.1-71.7000113
74N42.1Very low43.1Very low166 Ų166154.6 Ų154.689%0.88881%0.81SS**  trans-172.890.8147.4-103.7-47.6000112.6
75R48.5Very low42.8Very low236 Ų236156.2 Ų156.289%0.89181%0.808SS**  trans-155.8133153.5-144.9164.9-171156.83.5111.2
76P44.9Very low42.6Very low109 Ų109158.8 Ų158.871%0.70881%0.806SS**  trans-69.9150.7176.228.9-35.2000111.7F78P76-F78 PolarHBondContact O-N 3.07Å
77F38.8Very low41.8Very low205 Ų205163.7 Ų163.790%0.89981%0.808SS**  trans-68.5123.1-179.6-76.8-99.2000112.1
78F41.3Very low41.1Very low202 Ų202170.2 Ų170.289%0.88681%0.814SS**  trans-138.3157.9157.2-87.8-80.2000109.2P76P76-F78 PolarHBondContact O-N 3.07Å
79A37Very low40.6Very low81 Ų81169.9 Ų169.967%0.66981%0.812SS**PPolyproline II helixtrans-54.8147.8-156.100000116.9
80P39Very low39.8Very low127 Ų127164.6 Ų164.683%0.82581%0.81SS**PPolyproline II helixtrans-73.4131.2174.830.9-34.1000111.8
81Y36.4Very low39.3Very low229 Ų229161.5 Ų161.590%0.89882%0.817SS**PPolyproline II helixtrans-77.1149.4165.9-79.9-104.9000110.6Y83Y81-Y83 PolarHBondContact O-N 3.47Å
82L34.5Very low38.5Very low177 Ų177160.8 Ų160.893%0.92782%0.815SS**PPolyproline II helixtrans-63.3130176-68.2166.7000111.3
83Y32.1Very low37.9Very low211 Ų211160 Ų16083%0.82781%0.814SS**  trans-112.1117.3171.9-170.7-87.8000109.4Y81 P85Y81-Y83 PolarHBondContact O-N 3.47Å; Y83-P85 WeakPolarHBondContact O-CD 3.45Å
84T38.9Very low37.1Very low123 Ų123159.9 Ų159.976%0.75582%0.82SS**PPolyproline II helixtrans-94.5117.4-177.645.30000111.6
85P38.6Very low36.6Very low103 Ų103159 Ų15967%0.66981%0.814SS**PPolyproline II helixtrans-70.2139.4175.9-19.633.8000112.3Y83 Y87Y83-P85 WeakPolarHBondContact O-CD 3.45Å; P85-Y87 PolarHBondContact O-N 3.43Å
86R34.1Very low35.9Very low223 Ų223155.8 Ų155.884%0.84281%0.813SS**PPolyproline II helixtrans-65.1121.4169.9-84.4-74.4-162.5103.81.2110.4
87Y32.3Very low35.1Very low221 Ų221156.2 Ų156.287%0.86782%0.819SS**PPolyproline II helixtrans-74.5137.2162.8-92-99000111.2P85P85-Y87 PolarHBondContact O-N 3.43Å
88Y31Very low34.9Very low201 Ų201157.8 Ų157.879%0.78882%0.819SS**  trans-120135.5160.7-106-83000107.7
89P44Very low34.2Very low130 Ų130153.9 Ų153.984%0.84482%0.816SS**  trans-89.3120.4-177.432.5-32.3000112.5
90G32Very low33.9Very low84 Ų84155 Ų15587%0.86682%0.819SS**  trans161.4119167.700000113.2
91G31.9Very low33.7Very low80 Ų80155 Ų15583%0.82582%0.817SS**  trans173.178.7-176.300000115.3
92S30.9Very low33.3Very low108 Ų108153.3 Ų153.376%0.75581%0.814SS**  trans-14.8131.4164.1-173.20000120.1
93Q37.1Very low33.1Very low144 Ų144151 Ų15167%0.67381%0.807SS**  trans38.3113.1134.2-52.8-88.914.600119.1
94H33.2Very low32.9Very low198 Ų198146.2 Ų146.292%0.91781%0.805SS**  trans-145.4138.1131.4-101.9-80.5000109.4
95L33.3Very low32.8Very low147 Ų147147.7 Ų147.777%0.7781%0.807SS**  trans-97.5136.7-170.3-63.3169.7000111.3
96I32.7Very low32.6Very low168 Ų168148.7 Ų148.786%0.86281%0.814SS**  trans-114121.8162.5-65.7177.1000107.8R98I96-R98 PolarHBondContact O-N 3.46Å
97S27.8Very low32.6Very low119 Ų119147.2 Ų147.283%0.83281%0.808SS**PPolyproline II helixtrans-67.6118.7-169.8-55.70000112.7
98R34.2Very low32.4Very low238 Ų238144.6 Ų144.690%0.89881%0.809SS**PPolyproline II helixtrans-92.9128.2159.3-72.1-171.9172.7-144.4-2.9109.2I96 S100I96-R98 PolarHBondContact O-N 3.46Å; R98-S100 PolarHBondContact O-N 3.33Å
99S27.8Very low32.8Very low119 Ų119141.5 Ų141.583%0.83280%0.802SS**PPolyproline II helixtrans-63.8132.3167.4-173.40000109.5
100S31.3Very low32Very low105 Ų105142.2 Ų142.273%0.73480%0.799SS**  trans-145.994.6-178.5166.30000109.4R98R98-S100 PolarHBondContact O-N 3.33Å
101V33.8Very low32.2Very low128 Ų128145.7 Ų145.778%0.77680%0.797SS**  trans-104.2102.6168.5-176.80000108.4
102K29Very low32Very low193 Ų193145.4 Ų145.484%0.83979%0.794SS**  trans-107.293.1174.3174.5-173.9166.2-177.90108.3
103T29.5Very low32.5Very low128 Ų128149.5 Ų149.579%0.78581%0.807SS**PPolyproline II helixtrans-79.7154166.9160000110.8
104S28.7Very low32.3Very low110 Ų110146.9 Ų146.977%0.76981%0.81SS**PPolyproline II helixtrans-87.2144.9-164.647.40000114.4
105L35.4Very low32.6Very low154 Ų154143.2 Ų143.281%0.80681%0.807SS**PPolyproline II helixtrans-57.1153.9158.1-70.4166.2000110.8
106P34.9Very low32.8Very low125 Ų125142 Ų14281%0.81281%0.805SS**  -104.2162.6109.129.4-35000112.2
107R33.4Very low33.4Very low192 Ų192139.2 Ų139.273%0.72580%0.798SS**  trans-112.4127.1-176.8154.3-172161.2176.6-3.7108.1
108D28.8Very low33.9Very low165 Ų165137.4 Ų137.488%0.88279%0.79SS**  trans-150.3164.3148.5-107.9-43.8000111.4
109Q38.3Very low34.4Very low136 Ų136133 Ų13364%0.63679%0.79SS**  trans-126.4123.6-161.4-60.6174.4-4.500112.5
110N28.7Very low35.3Very low146 Ų146130.9 Ų130.978%0.78179%0.787SS**  -167.7150.7130-116-76.9000115.8
111N34.9Very low36.2Very low156 Ų156130.9 Ų130.983%0.83478%0.783SS**  trans0.2121.2163.4-61.7-16.8000120.7
112G27.8Very low37.7Very low74 Ų74129.9 Ų129.976%0.76378%0.781SS**  trans-171118.1157.900000111.3A114G112-A114 PolarHBondContact O-N 3.4Å; G112-A114 VanDerWaalsContact O-N 3.16Å
113L43Very low40.2Very low194 Ų194124.6 Ų124.6100%1.01676%0.762SS**  trans-76.898.9179.7-82.9160.4000110.8
114A32.3Very low43.1Very low90 Ų90121.9 Ų121.974%0.74474%0.742SS**  trans-128.2129.5168.700000109.7G112 V116G112-A114 PolarHBondContact O-N 3.4Å; G112-A114 VanDerWaalsContact O-N 3.16Å; A114-V116 PolarHBondContact O-N 3.5Å
115S38Very low46.3Very low121 Ų121116.8 Ų116.885%0.84671%0.706SS**PPolyproline II helixtrans-73.3121.4-179.2-168.90000110.6
116V38.2Very low49.1Very low120 Ų120111.2 Ų111.273%0.72768%0.68SS**PPolyproline II helixtrans-62135.8162.6-178.90000108A114 A118A114-V116 PolarHBondContact O-N 3.5Å; V116-A118 PolarHBondContact O-N 3.41Å
117P45.7Very low51.9Low110 Ų110108 Ų10871%0.71466%0.661SS**PPolyproline II helixtrans-68.2120.7172.927.5-33.3000109.5T119P117-T119 PolarHBondContact O-N 3.38Å; P117-T119 VanDerWaalsContact O-N 3.08Å
118A38.3Very low54.9Low81 Ų8199.2 Ų99.267%0.66963%0.628SS**  trans-70.3104.8179.600000110.8V116V116-A118 PolarHBondContact O-N 3.41Å
119T44.9Very low58.1Low145 Ų14594.9 Ų94.989%0.8961%0.608SS**THydrogen-bonded Turntrans-70.1127.5165.241.80000109.6P117P117-T119 PolarHBondContact O-N 3.38Å; P117-T119 VanDerWaalsContact O-N 3.08Å
120G47Very low61Low76 Ų7689.4 Ų89.478%0.78458%0.584SS**THydrogen-bonded Turntrans109.61.4164.200000118.5
121T48.7Very low64.3Low105 Ų10586.6 Ų86.664%0.64457%0.568SS**  trans-89.3103.7164.948.10000110.6L123T121-L123 VanDerWaalsContact C-N 3.29Å; T121-L123 PolarHBondContact O-N 2.96Å
122S65.9Low67.2Low106 Ų10681.9 Ų81.974%0.74154%0.543SS*.  trans-68.984.1173.2-61.20000110.7L124S122-L124 PolarHBondContact O-N 2.96Å
123L82.4Confident70.5Confident82 Ų8278.4 Ų78.443%0.42951%0.507SS..  trans-60.7122.2174.6-73.6170.5000110.3T121 L125 M128 I132 M194T121-L123 VanDerWaalsContact C-N 3.29Å; T121-L123 PolarHBondContact O-N 2.96Å; L123-L125 PolarHBondContact O-N 3.38Å; L123-M128 HydrophobicContact CB-CE 3.71Å; L123-I132 HydrophobicContact CD1-CG2 4.37Å; L123-M194 WeakPolarHBondContact O-CE 3.33Å
124L90.3Very high73.1Confident72 Ų7269.2 Ų69.238%0.37746%0.459SS..  trans-47.7130.6170.8-81.4157.2000110.7S122 S126 S127 E198 V201S122-L124 PolarHBondContact O-N 2.96Å; L124-S126 VanDerWaalsContact C-N 3.33Å; L124-S126 PolarHBondContact O-N 2.82Å; L124-S127 WeakPolarHBondContact O-CB 3.38Å; L124-S127 PolarHBondContact O-N 2.75Å; L124-S127 PolarHBondContact O-OG 2.79Å; L124-E198 WeakPolarHBondContact CB-OE1 3.47Å; L124-E198 HydrophobicContact CD2-CB 4.21Å; L124-E198 HydrophobicContact CD2-CG 3.79Å; L124-E198 WeakPolarHBondContact CD2-OE1 3.42Å; L124-V201 HydrophobicContact CD1-CG1 4.49Å; L124-V201 HydrophobicContact CD2-CB 4.05Å; L124-V201 HydrophobicContact CD2-CG1 3.82Å; L124-V201 HydrophobicContact CG-CG1 4.41Å
125L94.3Very high76.2Confident3 Ų369.3 Ų69.32%0.01644%0.444CS..G310 helixtrans-56.4-48.1-175.6179.358.4000111L123 S127 M128 G162 L165 A166 M194 R195 E198L123-L125 PolarHBondContact O-N 3.38Å; L125-S127 PolarHBondContact O-N 2.94Å; L125-M128 HydrophobicContact CD1-SD 4.45Å; L125-M128 PolarHBondContact O-N 2.73Å; L125-G162 CarbonylContact O-C 3.58Å; L125-G162 WeakPolarHBondContact O-CA 3.47Å; L125-L165 HydrophobicContact CD1-CB 4Å; L125-L165 HydrophobicContact CD2-CB 4.37Å; L125-L165 HydrophobicContact CG-CB 4.39Å; L125-A166 HydrophobicContact CD2-CB 4.12Å; L125-A166 HydrophobicContact CG-CB 4.25Å; L125-M194 HydrophobicContact CB-CB 4.15Å; L125-M194 HydrophobicContact CB-CE 4.05Å; L125-M194 HydrophobicContact CD1-CB 4.05Å; L125-M194 HydrophobicContact CD1-CE 4.02Å; L125-M194 HydrophobicContact CD1-SD 4Å; L125-M194 HydrophobicContact CD2-CB 3.88Å; L125-M194 HydrophobicContact CG-CB 4.24Å; L125-R195 HydrophobicContact CD2-CG 3.7Å; L125-E198 HydrophobicContact CB-CB 4.43Å; L125-E198 WeakPolarHBondContact CB-OE2 3.41Å; L125-E198 PolarHBondContact N-OE1 2.78Å; L125-E198 VanDerWaalsContact N-OE1 3.16Å
126S94.5Very high78.9Confident36 Ų3666.9 Ų66.925%0.25242%0.418SS..G310 helixtrans-59.7-1517668.70000115.4L124 R163 E198L124-S126 VanDerWaalsContact C-N 3.33Å; L124-S126 PolarHBondContact O-N 2.82Å; S126-R163 WeakPolarHBondContact O-CG 3.18Å; S126-E198 WeakPolarHBondContact CB-OE1 3.39Å; S126-E198 WeakPolarHBondContact CB-OE2 3.38Å; S126-E198 VanDerWaalsContact N-CD 3.32Å; S126-E198 PolarHBondContact N-OE1 3.36Å; S126-E198 PolarHBondContact N-OE2 3.07Å; S126-E198 PolarHBondContact OG-OE1 3.36Å
127S94.6Very high81.7Confident59 Ų5961.1 Ų61.141%0.41338%0.383SS..G310 helixtrans-86.6-16176.577.50000113.9L124 L125L124-S127 WeakPolarHBondContact O-CB 3.38Å; L124-S127 PolarHBondContact O-N 2.75Å; L124-S127 PolarHBondContact O-OG 2.79Å; L125-S127 PolarHBondContact O-N 2.94Å
128M95.8Very high84.1Confident6 Ų660.8 Ų60.83%0.0337%0.367CS..  trans-72.4132.1-171.4-63.8-167.2161.300113.2L123 L125 I132 V133 K136 G162 M194L123-M128 HydrophobicContact CB-CE 3.71Å; L125-M128 HydrophobicContact CD1-SD 4.45Å; L125-M128 PolarHBondContact O-N 2.73Å; M128-I132 HydrophobicContact CB-CB 4.2Å; M128-I132 HydrophobicContact CB-CG2 4Å; M128-I132 HydrophobicContact CE-CG2 3.91Å; M128-I132 HydrophobicContact CG-CB 4.47Å; M128-I132 HydrophobicContact CG-CG2 3.73Å; M128-I132 HydrophobicContact SD-CG2 3.74Å; M128-V133 HydrophobicContact CB-CG2 3.99Å; M128-K136 HydrophobicContact CE-CG 3.9Å; M128-K136 HydrophobicContact SD-CG 4.05Å; M128-G162 WeakPolarHBondContact O-CA 3.38Å; M128-G162 PolarHBondContact O-N 3.4Å; M128-M194 HydrophobicContact CE-CE 3.3Å; M128-M194 HydrophobicContact CE-SD 4.06Å; M128-M194 HydrophobicContact SD-CE 3.75Å; M128-M194 HydrophobicContact SD-SD 4.13Å
129T97.4Very high86.9Confident74 Ų7462.5 Ų62.545%0.45436%0.362SS..  trans-75.7164.7166.1650000110.7D131 I132 V133T129-D131 PolarHBondContact O-N 3.08Å; T129-I132 HydrophobicContact CG2-CD1 4.48Å; T129-I132 PolarHBondContact O-N 2.79Å; T129-I132 VanDerWaalsContact O-N 3.09Å; T129-I132 WeakPolarHBondContact OG1-CG1 3.32Å; T129-I132 PolarHBondContact OG1-N 2.8Å; T129-V133 WeakPolarHBondContact O-CG2 3.33Å; T129-V133 PolarHBondContact O-N 3.16Å
130V97.9Very high89.4Confident22 Ų2256.8 Ų56.813%0.13333%0.326CS..Hα-helixtrans-53.5-41.4176.5-176.30000111.8V133 C134 I155 K156 N159 N161V130-V133 WeakPolarHBondContact O-CB 3.45Å; V130-V133 PolarHBondContact O-N 3.29Å; V130-C134 PolarHBondContact O-N 3.37Å; V130-C134 PolarHBondContact O-SG 3.37Å; V130-C134 VanDerWaalsContact O-SG 3.38Å; V130-I155 HydrophobicContact CG1-CG2 3.8Å; V130-K156 HydrophobicContact CG1-CB 4.35Å; V130-K156 HydrophobicContact CG1-CG 3.7Å; V130-N159 WeakPolarHBondContact CG2-OD1 3.45Å; V130-N161 HydrophobicContact CG2-CB 3.88Å
131D97.8Very high91.7Very high86 Ų8662 Ų6246%0.4633%0.329SS..Hα-helixtrans-67.9-37.4177.6-61.2-80.6000113.2T129 V133 C134 E135 K156T129-D131 PolarHBondContact O-N 3.08Å; D131-V133 VanDerWaalsContact C-N 3.31Å; D131-C134 WeakPolarHBondContact O-CB 3.14Å; D131-C134 PolarHBondContact O-N 3.3Å; D131-E135 PolarHBondContact O-N 2.86Å; D131-K156 WeakPolarHBondContact OD1-CE 3.44Å; D131-K156 IonicContact OD1-NZ 3.49Å; D131-K156 PolarHBondContact OD1-NZ 2.86Å
132I96.8Very high93.9Very high57 Ų5760.7 Ų60.729%0.29234%0.337SS..Hα-helixtrans-66.4-36.6174-63.6168.9000110.4L123 M128 T129 C134 E135 K136L123-I132 HydrophobicContact CD1-CG2 4.37Å; M128-I132 HydrophobicContact CB-CB 4.2Å; M128-I132 HydrophobicContact CB-CG2 4Å; M128-I132 HydrophobicContact CE-CG2 3.91Å; M128-I132 HydrophobicContact CG-CB 4.47Å; M128-I132 HydrophobicContact CG-CG2 3.73Å; M128-I132 HydrophobicContact SD-CG2 3.74Å; T129-I132 HydrophobicContact CG2-CD1 4.48Å; T129-I132 PolarHBondContact O-N 2.79Å; T129-I132 VanDerWaalsContact O-N 3.09Å; T129-I132 WeakPolarHBondContact OG1-CG1 3.32Å; T129-I132 PolarHBondContact OG1-N 2.8Å; I132-C134 VanDerWaalsContact C-N 3.34Å; I132-E135 PolarHBondContact O-N 3.48Å; I132-K136 PolarHBondContact O-N 2.89Å
133V97.3Very high95.3Very high2 Ų256.6 Ų56.61%0.01231%0.306CS..Hα-helixtrans-63.7-39.4171.9174.60000111.1M128 T129 V130 D131 K136 L137 I155 L165M128-V133 HydrophobicContact CB-CG2 3.99Å; T129-V133 WeakPolarHBondContact O-CG2 3.33Å; T129-V133 PolarHBondContact O-N 3.16Å; V130-V133 WeakPolarHBondContact O-CB 3.45Å; V130-V133 PolarHBondContact O-N 3.29Å; D131-V133 VanDerWaalsContact C-N 3.31Å; V133-K136 PolarHBondContact O-N 3.45Å; V133-L137 PolarHBondContact O-N 3.01Å; V133-I155 HydrophobicContact CB-CG2 4.43Å; V133-I155 HydrophobicContact CG1-CD1 4.24Å; V133-I155 HydrophobicContact CG1-CG2 4Å; V133-L165 HydrophobicContact CB-CD1 4.38Å; V133-L165 HydrophobicContact CG1-CD1 3.48Å; V133-L165 VanDerWaalsContact CG1-CD1 3.48Å; V133-L165 HydrophobicContact CG2-CD1 3.89Å
134C97.6Very high96Very high1 Ų155.9 Ų55.91%0.00730%0.303CS..Hα-helixtrans-65.7-36.8172.3-66.20000113.3V130 D131 I132 L137 R138V130-C134 PolarHBondContact O-N 3.37Å; V130-C134 PolarHBondContact O-SG 3.37Å; V130-C134 VanDerWaalsContact O-SG 3.38Å; D131-C134 WeakPolarHBondContact O-CB 3.14Å; D131-C134 PolarHBondContact O-N 3.3Å; I132-C134 VanDerWaalsContact C-N 3.34Å; C134-L137 PolarHBondContact O-N 2.98Å; C134-R138 PolarHBondContact O-N 3.41Å; C134-R138 PolarHBondContact O-NH1 3.06Å
135E96.4Very high96.2Very high92 Ų9258.6 Ų58.643%0.4331%0.314SS..Hα-helixtrans-67-37.2171.9-71.1-52.8149.800112.1D131 I132 R138 Q139D131-E135 PolarHBondContact O-N 2.86Å; I132-E135 PolarHBondContact O-N 3.48Å; E135-R138 WeakPolarHBondContact O-CB 3.36Å; E135-R138 PolarHBondContact O-N 2.88Å; E135-R138 IonicContact OE1-CZ 3.1Å; E135-R138 IonicContact OE1-NE 3.47Å; E135-R138 PolarHBondContact OE1-NE 3.38Å; E135-R138 IonicContact OE1-NH2 3.33Å; E135-R138 PolarHBondContact OE1-NH2 3.17Å; E135-R138 IonicContact OE2-CZ 2.7Å; E135-R138 IonicContact OE2-NE 3.59Å; E135-R138 PolarHBondContact OE2-NE 2.91Å; E135-R138 IonicContact OE2-NH2 2.69Å; E135-R138 PolarHBondContact OE2-NH2 2.86Å; E135-Q139 WeakPolarHBondContact O-CG 3.27Å; E135-Q139 PolarHBondContact O-N 3.4Å
136K95.5Very high96.3Very high69 Ų6961.5 Ų61.530%0.334%0.344SS..Hα-helixtrans-66.6-37.4173.9-76.8-53.2-168.5-1790112.7M128 I132 V133 R138 Q139 I140 M190M128-K136 HydrophobicContact CE-CG 3.9Å; M128-K136 HydrophobicContact SD-CG 4.05Å; I132-K136 PolarHBondContact O-N 2.89Å; V133-K136 PolarHBondContact O-N 3.45Å; K136-R138 VanDerWaalsContact C-N 3.28Å; K136-R138 PolarHBondContact O-N 3.29Å; K136-Q139 PolarHBondContact O-N 2.92Å; K136-I140 WeakPolarHBondContact O-CG1 3.45Å; K136-M190 HydrophobicContact CB-CE 4.21Å; K136-M190 HydrophobicContact CB-SD 3.86Å
137L97Very high96.4Very high0 Ų062.9 Ų62.90%035%0.347CS..Hα-helixtrans-59.5-37.6170.2-166.578.2000112.4V133 C134 Q139 I140 L143 L148 I155 M179 F187V133-L137 PolarHBondContact O-N 3.01Å; C134-L137 PolarHBondContact O-N 2.98Å; L137-Q139 PolarHBondContact O-N 3.4Å; L137-I140 HydrophobicContact CD1-CD1 4.11Å; L137-I140 PolarHBondContact O-N 2.86Å; L137-L143 HydrophobicContact CD1-CD1 3.7Å; L137-L143 HydrophobicContact CG-CD1 4.04Å; L137-L148 HydrophobicContact CD2-CG 4.32Å; L137-I155 HydrophobicContact CB-CD1 4.39Å; L137-I155 HydrophobicContact CD2-CD1 3.85Å; L137-I155 HydrophobicContact CG-CD1 4.49Å; L137-M179 HydrophobicContact CD1-CE 3.79Å; L137-F187 HydrophobicContact CD1-CB 4.44Å; L137-F187 HydrophobicContact CD1-CD2 3.47Å; L137-F187 VanDerWaalsContact CD1-CD2 3.47Å; L137-F187 HydrophobicContact CD1-CE2 3.97Å; L137-F187 HydrophobicContact CD1-CG 4.16Å
138R96.8Very high96.5Very high102 Ų10260.6 Ų60.639%0.38533%0.331SS..Hα-helixtrans-68.2-17.6173.3-85.5-178.4-74.7-74.310.4114.9C134 E135 K136 L148 C152C134-R138 PolarHBondContact O-N 3.41Å; C134-R138 PolarHBondContact O-NH1 3.06Å; E135-R138 WeakPolarHBondContact O-CB 3.36Å; E135-R138 PolarHBondContact O-N 2.88Å; E135-R138 IonicContact OE1-CZ 3.1Å; E135-R138 IonicContact OE1-NE 3.47Å; E135-R138 PolarHBondContact OE1-NE 3.38Å; E135-R138 IonicContact OE1-NH2 3.33Å; E135-R138 PolarHBondContact OE1-NH2 3.17Å; E135-R138 IonicContact OE2-CZ 2.7Å; E135-R138 IonicContact OE2-NE 3.59Å; E135-R138 PolarHBondContact OE2-NE 2.91Å; E135-R138 IonicContact OE2-NH2 2.69Å; E135-R138 PolarHBondContact OE2-NH2 2.86Å; K136-R138 VanDerWaalsContact C-N 3.28Å; K136-R138 PolarHBondContact O-N 3.29Å; R138-L148 HydrophobicContact CB-CD1 4.42Å; R138-L148 HydrophobicContact CG-CD1 3.75Å; R138-L148 HydrophobicContact CG-CD2 3.77Å; R138-L148 HydrophobicContact CG-CG 4.38Å; R138-C152 PolarHBondContact NH1-SG 3.48Å
139Q95.9Very high96.6Very high117 Ų11763.9 Ų63.955%0.54735%0.352SS..THydrogen-bonded Turntrans-94.33.4179.7-69.3166.826.600112.6E135 K136 L137 E141E135-Q139 WeakPolarHBondContact O-CG 3.27Å; E135-Q139 PolarHBondContact O-N 3.4Å; K136-Q139 PolarHBondContact O-N 2.92Å; L137-Q139 PolarHBondContact O-N 3.4Å; Q139-E141 PolarHBondContact O-N 2.88Å
140I96.7Very high96.7Very high26 Ų2665.6 Ų65.613%0.13336%0.355CS..  trans-83.2112.7176.1-56.8-172000109.8K136 L137 L143 L186 F187 M190K136-I140 WeakPolarHBondContact O-CG1 3.45Å; L137-I140 HydrophobicContact CD1-CD1 4.11Å; L137-I140 PolarHBondContact O-N 2.86Å; I140-L143 HydrophobicContact CB-CB 4.27Å; I140-L143 HydrophobicContact CB-CD1 3.88Å; I140-L143 HydrophobicContact CD1-CD1 3.97Å; I140-L143 HydrophobicContact CG1-CD1 4.38Å; I140-L143 HydrophobicContact CG2-CB 4.13Å; I140-L143 HydrophobicContact CG2-CD1 4.01Å; I140-L186 HydrophobicContact CG2-CB 3.6Å; I140-L186 HydrophobicContact CG2-CD1 4.25Å; I140-L186 HydrophobicContact CG2-CG 4.43Å; I140-F187 HydrophobicContact CD1-CB 4.22Å; I140-F187 HydrophobicContact CD1-CD2 4.11Å; I140-M190 HydrophobicContact CD1-CB 4.1Å; I140-M190 HydrophobicContact CD1-CE 4.12Å; I140-M190 HydrophobicContact CD1-CG 4.49Å; I140-M190 HydrophobicContact CD1-SD 3.69Å; I140-M190 HydrophobicContact CG1-SD 3.78Å
141E96Very high96.7Very high185 Ų18564.6 Ų64.686%0.86435%0.349SS*.THydrogen-bonded Turntrans-64.9137.9173.6-62.1-175.4177.500111.4Q139Q139-E141 PolarHBondContact O-N 2.88Å
142G94.7Very high96.7Very high77 Ų7761.1 Ų61.179%0.79433%0.331SS*.THydrogen-bonded Turntrans81.64.5176.900000116.4
143L96.6Very high96.7Very high20 Ų2062.2 Ų62.211%0.10534%0.34CS..  trans-81141177.8-161.9158.5000111.4L137 I140 Q145 L148 Y151 D183 L186L137-L143 HydrophobicContact CD1-CD1 3.7Å; L137-L143 HydrophobicContact CG-CD1 4.04Å; I140-L143 HydrophobicContact CB-CB 4.27Å; I140-L143 HydrophobicContact CB-CD1 3.88Å; I140-L143 HydrophobicContact CD1-CD1 3.97Å; I140-L143 HydrophobicContact CG1-CD1 4.38Å; I140-L143 HydrophobicContact CG2-CB 4.13Å; I140-L143 HydrophobicContact CG2-CD1 4.01Å; L143-Q145 PolarHBondContact O-N 3.14Å; L143-L148 HydrophobicContact CD2-CB 4.25Å; L143-L148 HydrophobicContact CD2-CD1 4.33Å; L143-Y151 HydrophobicContact CD2-CD2 3.95Å; L143-Y151 HydrophobicContact CD2-CE2 4.01Å; L143-D183 WeakPolarHBondContact CA-OD1 3.41Å; L143-D183 HydrophobicContact CG-CB 4.11Å; L143-D183 WeakPolarHBondContact CG-OD1 3.44Å; L143-L186 HydrophobicContact CB-CD1 4.35Å
144D95.6Very high96.8Very high68 Ų6863.2 Ų63.236%0.36435%0.347SS..  trans-59.6105178.2-178.5-2.9000112.5G146 M147 L148 D183D144-G146 PolarHBondContact O-N 3.06Å; D144-G146 WeakPolarHBondContact OD1-CA 3.42Å; D144-G146 PolarHBondContact OD1-N 2.83Å; D144-M147 HydrophobicContact CB-CB 4.2Å; D144-M147 PolarHBondContact O-N 3.32Å; D144-M147 PolarHBondContact OD1-N 3.08Å; D144-M147 WeakPolarHBondContact OD2-CG 3.37Å; D144-L148 PolarHBondContact O-N 3.39Å; D144-D183 WeakPolarHBondContact CB-OD2 3.4Å; D144-D183 PolarHBondContact N-OD1 3.29Å
145Q95.8Very high96.8Very high129 Ų12963.2 Ų63.260%0.60335%0.347SS*.THydrogen-bonded Turntrans-65.6-22.7-179.1-171.3558800113.5L143L143-Q145 PolarHBondContact O-N 3.14Å
146G96.7Very high96.9Very high63 Ų6364 Ų6465%0.64935%0.349SS*.THydrogen-bonded Turntrans-76.7-34.3174.700000112.8D144 P149D144-G146 PolarHBondContact O-N 3.06Å; D144-G146 WeakPolarHBondContact OD1-CA 3.42Å; D144-G146 PolarHBondContact OD1-N 2.83Å; G146-P149 WeakPolarHBondContact O-CD 3.48Å
147M96.3Very high97Very high65 Ų6569.6 Ų69.632%0.3237%0.373SS..THydrogen-bonded Turntrans-87.7-19.4176.7-70.5-69.5-74.700113.6D144 P149 Q150 Y151D144-M147 HydrophobicContact CB-CB 4.2Å; D144-M147 PolarHBondContact O-N 3.32Å; D144-M147 PolarHBondContact OD1-N 3.08Å; D144-M147 WeakPolarHBondContact OD2-CG 3.37Å; M147-P149 VanDerWaalsContact C-CD 3.42Å; M147-Q150 WeakPolarHBondContact O-CA 3.41Å; M147-Q150 WeakPolarHBondContact O-CB 3.32Å; M147-Q150 PolarHBondContact O-N 3.3Å; M147-Y151 HydrophobicContact CB-CD2 4.28Å; M147-Y151 HydrophobicContact CB-CE1 4.09Å; M147-Y151 HydrophobicContact CB-CE2 3.61Å; M147-Y151 HydrophobicContact CE-CE1 3.93Å; M147-Y151 PolarHBondContact O-N 3.1Å
148L96.9Very high97Very high12 Ų1271.2 Ų71.26%0.06339%0.386CS..Hα-helixtrans-50.4-39.9178.6-176.7144.9000115.3L137 R138 L143 D144 Q150 Y151 C152L137-L148 HydrophobicContact CD2-CG 4.32Å; R138-L148 HydrophobicContact CB-CD1 4.42Å; R138-L148 HydrophobicContact CG-CD1 3.75Å; R138-L148 HydrophobicContact CG-CD2 3.77Å; R138-L148 HydrophobicContact CG-CG 4.38Å; L143-L148 HydrophobicContact CD2-CB 4.25Å; L143-L148 HydrophobicContact CD2-CD1 4.33Å; D144-L148 PolarHBondContact O-N 3.39Å; L148-Q150 VanDerWaalsContact C-N 3.33Å; L148-Q150 PolarHBondContact O-N 3.29Å; L148-Y151 PolarHBondContact O-N 3.44Å; L148-C152 WeakPolarHBondContact O-CB 3.38Å; L148-C152 PolarHBondContact O-N 3.41Å; L148-C152 PolarHBondContact O-SG 2.89Å
149P97.6Very high97.1Very high74 Ų7471.1 Ų71.148%0.48139%0.394SS..Hα-helixtrans-63.1-37.3175.1-22.834.9000112.9G146 M147 T153G146-P149 WeakPolarHBondContact O-CD 3.48Å; M147-P149 VanDerWaalsContact C-CD 3.42Å; P149-T153 WeakPolarHBondContact O-CB 3.37Å; P149-T153 PolarHBondContact O-N 3.48Å; P149-T153 PolarHBondContact O-OG1 3.23Å
150Q97.9Very high97.2Very high110 Ų11065.8 Ų65.851%0.51437%0.369SS..Hα-helixtrans-67.3-44.9175.3179.9639.900110.5M147 L148 C152 T153 T154M147-Q150 WeakPolarHBondContact O-CA 3.41Å; M147-Q150 WeakPolarHBondContact O-CB 3.32Å; M147-Q150 PolarHBondContact O-N 3.3Å; L148-Q150 VanDerWaalsContact C-N 3.33Å; L148-Q150 PolarHBondContact O-N 3.29Å; Q150-C152 PolarHBondContact O-N 3.08Å; Q150-T153 CarbonylContact O-C 3.58Å; Q150-T153 WeakPolarHBondContact O-CA 3.35Å; Q150-T153 WeakPolarHBondContact O-CB 3.36Å; Q150-T153 PolarHBondContact O-N 2.92Å; Q150-T154 PolarHBondContact O-N 3.47Å; Q150-T154 PolarHBondContact O-OG1 3.28Å
151Y98.1Very high97.2Very high2 Ų266.1 Ų66.11%0.00837%0.371CS..Hα-helixtrans-62.7-41.5176.6-58.2-26.6000112.7L143 M147 L148 T153 T154 I155 M179 N180 D183L143-Y151 HydrophobicContact CD2-CD2 3.95Å; L143-Y151 HydrophobicContact CD2-CE2 4.01Å; M147-Y151 HydrophobicContact CB-CD2 4.28Å; M147-Y151 HydrophobicContact CB-CE1 4.09Å; M147-Y151 HydrophobicContact CB-CE2 3.61Å; M147-Y151 HydrophobicContact CE-CE1 3.93Å; M147-Y151 PolarHBondContact O-N 3.1Å; L148-Y151 PolarHBondContact O-N 3.44Å; Y151-T153 VanDerWaalsContact C-N 3.26Å; Y151-T153 PolarHBondContact O-N 3.25Å; Y151-T154 PolarHBondContact O-N 2.86Å; Y151-I155 VanDerWaalsContact O-CG1 3.32Å; Y151-I155 WeakPolarHBondContact O-CG1 3.48Å; Y151-I155 PolarHBondContact O-N 2.86Å; Y151-M179 HydrophobicContact CD1-CG 3.73Å; Y151-M179 HydrophobicContact CD2-CE 4.29Å; Y151-M179 HydrophobicContact CD2-CG 4.15Å; Y151-M179 HydrophobicContact CE1-CB 4.07Å; Y151-M179 HydrophobicContact CE1-CG 3.64Å; Y151-M179 HydrophobicContact CE2-CG 4.03Å; Y151-M179 HydrophobicContact CG-CE 4.07Å; Y151-M179 HydrophobicContact CG-CG 4Å; Y151-N180 VanDerWaalsContact OH-CG 3.3Å; Y151-N180 PolarHBondContact OH-N 3.04Å; Y151-N180 PolarHBondContact OH-ND2 3.5Å; Y151-D183 HydrophobicContact CE2-CB 3.86Å; Y151-D183 PolarHBondContact OH-OD2 3.18Å
152C98.1Very high97.2Very high12 Ų1257.3 Ų57.38%0.08133%0.33CS..Hα-helixtrans-60.8-37171.8-68.60000112R138 L148 Q150 K156R138-C152 PolarHBondContact NH1-SG 3.48Å; L148-C152 WeakPolarHBondContact O-CB 3.38Å; L148-C152 PolarHBondContact O-N 3.41Å; L148-C152 PolarHBondContact O-SG 2.89Å; Q150-C152 PolarHBondContact O-N 3.08Å; C152-K156 WeakPolarHBondContact O-CB 3.15Å; C152-K156 WeakPolarHBondContact O-CG 3.39Å; C152-K156 PolarHBondContact O-N 3.38Å
153T98.1Very high97.3Very high80 Ų8061.5 Ų61.549%0.49132%0.321SS..Hα-helixtrans-67.3-41.4175.9-58.10000111.3P149 Q150 Y151 K156 K157P149-T153 WeakPolarHBondContact O-CB 3.37Å; P149-T153 PolarHBondContact O-N 3.48Å; P149-T153 PolarHBondContact O-OG1 3.23Å; Q150-T153 CarbonylContact O-C 3.58Å; Q150-T153 WeakPolarHBondContact O-CA 3.35Å; Q150-T153 WeakPolarHBondContact O-CB 3.36Å; Q150-T153 PolarHBondContact O-N 2.92Å; Y151-T153 VanDerWaalsContact C-N 3.26Å; Y151-T153 PolarHBondContact O-N 3.25Å; T153-K156 PolarHBondContact O-N 3.42Å; T153-K157 VanDerWaalsContact O-CB 3.25Å; T153-K157 WeakPolarHBondContact O-CB 3.36Å; T153-K157 PolarHBondContact O-N 2.85Å
154T98.1Very high97.3Very high24 Ų2463.3 Ų63.315%0.14733%0.333CS..Hα-helixtrans-62.6-47.2173.4-52.30000111.7Q150 Y151 K156 K157 A158 E176 M177Q150-T154 PolarHBondContact O-N 3.47Å; Q150-T154 PolarHBondContact O-OG1 3.28Å; Y151-T154 PolarHBondContact O-N 2.86Å; T154-K156 VanDerWaalsContact C-N 3.27Å; T154-K156 PolarHBondContact O-N 3.04Å; T154-K157 PolarHBondContact O-N 3.01Å; T154-A158 WeakPolarHBondContact O-CB 3.35Å; T154-A158 PolarHBondContact O-N 3.37Å; T154-E176 WeakPolarHBondContact CG2-O 3.33Å; T154-M177 HydrophobicContact CG2-CE 3.48Å; T154-M177 VanDerWaalsContact CG2-CE 3.48Å
155I98Very high97.4Very high0 Ų060.1 Ų60.10%032%0.316CS..Hα-helixtrans-54.2-44.6175.5-72.1167000111V130 V133 L137 Y151 N159 I160 M177V130-I155 HydrophobicContact CG1-CG2 3.8Å; V133-I155 HydrophobicContact CB-CG2 4.43Å; V133-I155 HydrophobicContact CG1-CD1 4.24Å; V133-I155 HydrophobicContact CG1-CG2 4Å; L137-I155 HydrophobicContact CB-CD1 4.39Å; L137-I155 HydrophobicContact CD2-CD1 3.85Å; L137-I155 HydrophobicContact CG-CD1 4.49Å; Y151-I155 VanDerWaalsContact O-CG1 3.32Å; Y151-I155 WeakPolarHBondContact O-CG1 3.48Å; Y151-I155 PolarHBondContact O-N 2.86Å; I155-N159 PolarHBondContact O-N 2.92Å; I155-I160 HydrophobicContact CG2-CB 4.28Å; I155-I160 PolarHBondContact O-N 2.8Å; I155-M177 HydrophobicContact CG1-CE 3.61Å; I155-M177 HydrophobicContact CG1-SD 3.86Å
156K98.1Very high97.4Very high109 Ų10955 Ų5547%0.47430%0.295SS..Hα-helixtrans-70.3-43.6178.2-73.1-177.6173.8-157.10113.4V130 D131 C152 T153 T154 N159V130-K156 HydrophobicContact CG1-CB 4.35Å; V130-K156 HydrophobicContact CG1-CG 3.7Å; D131-K156 WeakPolarHBondContact OD1-CE 3.44Å; D131-K156 IonicContact OD1-NZ 3.49Å; D131-K156 PolarHBondContact OD1-NZ 2.86Å; C152-K156 WeakPolarHBondContact O-CB 3.15Å; C152-K156 WeakPolarHBondContact O-CG 3.39Å; C152-K156 PolarHBondContact O-N 3.38Å; T153-K156 PolarHBondContact O-N 3.42Å; T154-K156 VanDerWaalsContact C-N 3.27Å; T154-K156 PolarHBondContact O-N 3.04Å; K156-N159 PolarHBondContact O-N 3.39Å
157K98.1Very high97.4Very high187 Ų18759.8 Ų59.881%0.81330%0.301SS*.Hα-helixtrans-64.6-41.3179.2-176-172.8174.7-166.40112.5T153 T154 N159T153-K157 VanDerWaalsContact O-CB 3.25Å; T153-K157 WeakPolarHBondContact O-CB 3.36Å; T153-K157 PolarHBondContact O-N 2.85Å; T154-K157 PolarHBondContact O-N 3.01Å; K157-N159 VanDerWaalsContact C-N 3.32Å
158A97.4Very high97.4Very high34 Ų3458 Ų5828%0.28130%0.295SS..THydrogen-bonded Turntrans-86.51.9179.600000113.6T154 I160 E176T154-A158 WeakPolarHBondContact O-CB 3.35Å; T154-A158 PolarHBondContact O-N 3.37Å; A158-I160 VanDerWaalsContact C-N 3.26Å; A158-I160 HydrophobicContact CB-CD1 3.7Å; A158-I160 HydrophobicContact CB-CG1 3.79Å; A158-I160 PolarHBondContact O-N 3.1Å; A158-E176 HydrophobicContact CB-CG 3.85Å; A158-E176 WeakPolarHBondContact CB-OE1 3.33Å
159N97.6Very high97.4Very high100 Ų10061 Ų6154%0.53531%0.311SS..THydrogen-bonded Turntrans52.341.1-177.1-171.119.4000113.2V130 I155 K156 K157 N161V130-N159 WeakPolarHBondContact CG2-OD1 3.45Å; I155-N159 PolarHBondContact O-N 2.92Å; K156-N159 PolarHBondContact O-N 3.39Å; K157-N159 VanDerWaalsContact C-N 3.32Å; N159-N161 VanDerWaalsContact C-N 3.3Å; N159-N161 PolarHBondContact O-N 2.94Å; N159-N161 PolarHBondContact O-ND2 2.71Å
160I97.9Very high97.4Very high5 Ų558.3 Ų58.33%0.02629%0.292CS..  trans-76.486-178.6-66.1167.3000108.5I155 A158 L165 L173 E176 M177I155-I160 HydrophobicContact CG2-CB 4.28Å; I155-I160 PolarHBondContact O-N 2.8Å; A158-I160 VanDerWaalsContact C-N 3.26Å; A158-I160 HydrophobicContact CB-CD1 3.7Å; A158-I160 HydrophobicContact CB-CG1 3.79Å; A158-I160 PolarHBondContact O-N 3.1Å; I160-L165 HydrophobicContact CG2-CD1 4.09Å; I160-L165 HydrophobicContact CG2-CD2 3.52Å; I160-L165 HydrophobicContact CG2-CG 3.61Å; I160-L173 HydrophobicContact CD1-CD1 4.11Å; I160-L173 HydrophobicContact CG2-CD1 4.36Å; I160-E176 HydrophobicContact CD1-CG 4.13Å; I160-M177 HydrophobicContact CD1-CE 3.41Å; I160-M177 VanDerWaalsContact CD1-CE 3.41Å; I160-M177 HydrophobicContact CD1-CG 4.47Å; I160-M177 HydrophobicContact CD1-SD 3.9Å
161N97.3Very high97.3Very high33 Ų3357.1 Ų57.118%0.17629%0.289CS..  trans-93.5173.8173.364.277.3000111.2V130 N159 R163 V164 L165V130-N161 HydrophobicContact CG2-CB 3.88Å; N159-N161 VanDerWaalsContact C-N 3.3Å; N159-N161 PolarHBondContact O-N 2.94Å; N159-N161 PolarHBondContact O-ND2 2.71Å; N161-R163 VanDerWaalsContact C-N 3.34Å; N161-R163 PolarHBondContact O-N 2.69Å; N161-R163 WeakPolarHBondContact OD1-CB 3.37Å; N161-R163 PolarHBondContact OD1-N 2.69Å; N161-V164 WeakPolarHBondContact O-CB 3.25Å; N161-V164 PolarHBondContact O-N 2.59Å; N161-V164 VanDerWaalsContact O-N 3.14Å; N161-V164 PolarHBondContact OD1-N 2.94Å; N161-L165 PolarHBondContact O-N 3.5Å
162G96.7Very high97.3Very high0 Ų062.3 Ų62.30%031%0.314CS..Hα-helixtrans-55.5-38.9-178.400000115.6L125 M128 L165 A166L125-G162 CarbonylContact O-C 3.58Å; L125-G162 WeakPolarHBondContact O-CA 3.47Å; M128-G162 WeakPolarHBondContact O-CA 3.38Å; M128-G162 PolarHBondContact O-N 3.4Å; G162-L165 PolarHBondContact O-N 3.11Å; G162-A166 WeakPolarHBondContact O-CB 3.35Å; G162-A166 PolarHBondContact O-N 2.7Å
163R96.1Very high97.3Very high164 Ų16462.1 Ų62.162%0.61931%0.312SS*.Hα-helixtrans-67.5-39178-59.1-177.4-175.7-91-5111.7S126 N161 A166 Q167S126-R163 WeakPolarHBondContact O-CG 3.18Å; N161-R163 VanDerWaalsContact C-N 3.34Å; N161-R163 PolarHBondContact O-N 2.69Å; N161-R163 WeakPolarHBondContact OD1-CB 3.37Å; N161-R163 PolarHBondContact OD1-N 2.69Å; R163-A166 PolarHBondContact O-N 3.33Å; R163-Q167 PolarHBondContact O-N 3.4Å
164V97.7Very high97.2Very high58 Ų5862.7 Ų62.735%0.35231%0.308SS..Hα-helixtrans-62.2-49.2172.8178.10000109.3N161 A166 Q167 C168N161-V164 WeakPolarHBondContact O-CB 3.25Å; N161-V164 PolarHBondContact O-N 2.59Å; N161-V164 VanDerWaalsContact O-N 3.14Å; N161-V164 PolarHBondContact OD1-N 2.94Å; V164-A166 VanDerWaalsContact C-N 3.28Å; V164-A166 PolarHBondContact O-N 2.85Å; V164-Q167 PolarHBondContact O-N 3.04Å; V164-Q167 VanDerWaalsContact O-N 3.13Å; V164-C168 HydrophobicContact CG1-CB 4.19Å; V164-C168 VanDerWaalsContact O-CB 3.24Å; V164-C168 WeakPolarHBondContact O-CB 3.43Å; V164-C168 PolarHBondContact O-N 2.94Å; V164-C168 PolarHBondContact O-SG 3.06Å; V164-C168 VanDerWaalsContact O-SG 3.33Å
165L97.3Very high97.2Very high2 Ų269.1 Ų69.11%0.0133%0.333CS..Hα-helixtrans-65.3-24.4179-72.9-176.9000114.6L125 V133 I160 N161 G162 L173 F187 V191 R195L125-L165 HydrophobicContact CD1-CB 4Å; L125-L165 HydrophobicContact CD2-CB 4.37Å; L125-L165 HydrophobicContact CG-CB 4.39Å; V133-L165 HydrophobicContact CB-CD1 4.38Å; V133-L165 HydrophobicContact CG1-CD1 3.48Å; V133-L165 VanDerWaalsContact CG1-CD1 3.48Å; V133-L165 HydrophobicContact CG2-CD1 3.89Å; I160-L165 HydrophobicContact CG2-CD1 4.09Å; I160-L165 HydrophobicContact CG2-CD2 3.52Å; I160-L165 HydrophobicContact CG2-CG 3.61Å; N161-L165 PolarHBondContact O-N 3.5Å; G162-L165 PolarHBondContact O-N 3.11Å; L165-L173 HydrophobicContact CD2-CD1 3.84Å; L165-L173 HydrophobicContact CD2-CD2 3.66Å; L165-L173 HydrophobicContact CD2-CG 4.42Å; L165-F187 HydrophobicContact CD1-CZ 4.23Å; L165-F187 HydrophobicContact CD2-CE1 4.46Å; L165-F187 HydrophobicContact CD2-CZ 4Å; L165-V191 HydrophobicContact CB-CG1 4.48Å; L165-V191 HydrophobicContact CD1-CG2 4.24Å; L165-V191 HydrophobicContact CD2-CG1 4.41Å; L165-V191 HydrophobicContact CD2-CG2 4.04Å; L165-R195 PolarHBondContact O-NE 3.4Å; L165-R195 PolarHBondContact O-NH2 2.62Å
166A96.2Very high97.1Very high20 Ų2074.1 Ų74.117%0.16536%0.357CS..Hα-helixtrans-72.6-33.3172.800000112.9L125 G162 R163 V164 R195 E198L125-A166 HydrophobicContact CD2-CB 4.12Å; L125-A166 HydrophobicContact CG-CB 4.25Å; G162-A166 WeakPolarHBondContact O-CB 3.35Å; G162-A166 PolarHBondContact O-N 2.7Å; R163-A166 PolarHBondContact O-N 3.33Å; V164-A166 VanDerWaalsContact C-N 3.28Å; V164-A166 PolarHBondContact O-N 2.85Å; A166-R195 VanDerWaalsContact O-CZ 3.28Å; A166-R195 PolarHBondContact O-NE 3.16Å; A166-E198 WeakPolarHBondContact CB-OE2 3.36Å
167Q95.5Very high97.1Very high164 Ų16469 Ų6977%0.76633%0.334SS*.Hα-helixtrans-115-24.2-165.6-62.4-178.50.100115.3R163 V164R163-Q167 PolarHBondContact O-N 3.4Å; V164-Q167 PolarHBondContact O-N 3.04Å; V164-Q167 VanDerWaalsContact O-N 3.13Å
168C96.4Very high96.9Very high28 Ų2863.7 Ų63.719%0.18933%0.326CS..SBendtrans-65.1154.8-171.870.60000113.3V164 I170 R195V164-C168 HydrophobicContact CG1-CB 4.19Å; V164-C168 VanDerWaalsContact O-CB 3.24Å; V164-C168 WeakPolarHBondContact O-CB 3.43Å; V164-C168 PolarHBondContact O-N 2.94Å; V164-C168 PolarHBondContact O-SG 3.06Å; V164-C168 VanDerWaalsContact O-SG 3.33Å; C168-I170 PolarHBondContact O-N 3.34Å; C168-R195 PolarHBondContact O-NH1 3.01Å; C168-R195 VanDerWaalsContact O-NH1 3.12Å; C168-R195 PolarHBondContact O-NH2 3.46Å; C168-R195 PolarHBondContact SG-NH2 3.33Å; C168-R195 VanDerWaalsContact SG-NH2 3.4Å
169N97.5Very high96.9Very high76 Ų7663.2 Ų63.241%0.40632%0.318SS..  trans-66.5131.8167.8-176.9-5.6000109.6D171 E172 L173N169-D171 VanDerWaalsContact C-N 3.29Å; N169-D171 PolarHBondContact O-N 3.44Å; N169-D171 PolarHBondContact OD1-N 3.36Å; N169-D171 VanDerWaalsContact OD1-N 3.13Å; N169-E172 HydrophobicContact CB-CB 4.14Å; N169-E172 HydrophobicContact CB-CG 4.13Å; N169-E172 PolarHBondContact ND2-OE1 3.01Å; N169-E172 PolarHBondContact O-N 3.07Å; N169-L173 WeakPolarHBondContact O-CB 2.97Å; N169-L173 PolarHBondContact O-N 3.48Å
170I97.3Very high96.9Very high16 Ų1661.8 Ų61.88%0.08231%0.31CS..Hα-helixtrans-68.3-30.2-176.4-56.5-63.7000111.4C168 K174 W184 R188 V191 L192C168-I170 PolarHBondContact O-N 3.34Å; I170-K174 PolarHBondContact O-N 3.33Å; I170-W184 HydrophobicContact CG2-CH2 4.09Å; I170-W184 HydrophobicContact CG2-CZ2 3.71Å; I170-W184 WeakPolarHBondContact O-CH2 3.36Å; I170-W184 WeakPolarHBondContact O-CZ2 3.48Å; I170-R188 HydrophobicContact CG2-CG 3.85Å; I170-R188 VanDerWaalsContact CG2-CZ 3.46Å; I170-R188 VanDerWaalsContact CG2-NH1 3.29Å; I170-V191 HydrophobicContact CD1-CG1 4.28Å; I170-L192 HydrophobicContact CD1-CD2 4.18Å; I170-L192 HydrophobicContact CG1-CD2 4.33Å
171D96.6Very high96.8Very high85 Ų8568.8 Ų68.846%0.45534%0.341SS..Hα-helixtrans-85.9-11.2-179.4-59-34.6000113N169 K175 R188N169-D171 VanDerWaalsContact C-N 3.29Å; N169-D171 PolarHBondContact O-N 3.44Å; N169-D171 PolarHBondContact OD1-N 3.36Å; N169-D171 VanDerWaalsContact OD1-N 3.13Å; D171-K175 WeakPolarHBondContact O-CD 3.42Å; D171-K175 WeakPolarHBondContact O-CE 3.39Å; D171-K175 WeakPolarHBondContact O-CG 3.39Å; D171-R188 IonicContact OD1-NH1 2.69Å; D171-R188 PolarHBondContact OD1-NH1 3.28Å; D171-R188 VanDerWaalsContact OD1-NH1 3.13Å
172E96.9Very high96.9Very high111 Ų11169.2 Ų69.252%0.51935%0.353SS..Hα-helixtrans-83.7-46.5163.5-74.1155.4-146.900110.3N169 K174 K175 E176N169-E172 HydrophobicContact CB-CB 4.14Å; N169-E172 HydrophobicContact CB-CG 4.13Å; N169-E172 PolarHBondContact ND2-OE1 3.01Å; N169-E172 PolarHBondContact O-N 3.07Å; E172-K174 PolarHBondContact O-N 3.4Å; E172-K175 WeakPolarHBondContact O-CB 3.49Å; E172-K175 PolarHBondContact O-N 3.43Å; E172-E176 PolarHBondContact O-N 2.92Å
173L97.4Very high96.9Very high9 Ų969.7 Ų69.75%0.04736%0.356CS..Hα-helixtrans-54.4-36.5173-176.866.5000111.9I160 L165 N169 K175 E176 M177 W184 F187I160-L173 HydrophobicContact CD1-CD1 4.11Å; I160-L173 HydrophobicContact CG2-CD1 4.36Å; L165-L173 HydrophobicContact CD2-CD1 3.84Å; L165-L173 HydrophobicContact CD2-CD2 3.66Å; L165-L173 HydrophobicContact CD2-CG 4.42Å; N169-L173 WeakPolarHBondContact O-CB 2.97Å; N169-L173 PolarHBondContact O-N 3.48Å; L173-K175 VanDerWaalsContact C-N 3.35Å; L173-K175 PolarHBondContact O-N 3.09Å; L173-E176 PolarHBondContact O-N 2.94Å; L173-M177 HydrophobicContact CD1-CG 3.74Å; L173-M177 HydrophobicContact CD1-SD 4.28Å; L173-M177 HydrophobicContact CG-CG 4.03Å; L173-M177 VanDerWaalsContact O-CB 3.3Å; L173-M177 WeakPolarHBondContact O-CB 3.4Å; L173-M177 WeakPolarHBondContact O-CG 3.2Å; L173-M177 PolarHBondContact O-N 3.05Å; L173-W184 HydrophobicContact CB-CH2 4.09Å; L173-W184 HydrophobicContact CD2-CH2 4.08Å; L173-W184 HydrophobicContact CD2-CZ3 4.35Å; L173-W184 HydrophobicContact CG-CH2 3.92Å; L173-W184 HydrophobicContact CG-CZ3 4.02Å; L173-F187 HydrophobicContact CD1-CE1 4.43Å; L173-F187 HydrophobicContact CD2-CE1 4.01Å; L173-F187 HydrophobicContact CG-CE1 4.31Å
174K97.5Very high97Very high92 Ų9262 Ų6240%0.433%0.327SS..Hα-helixtrans-58.4-43.8173.6-171.4174.2-175.5179.90112.9I170 E172 A178 W184I170-K174 PolarHBondContact O-N 3.33Å; E172-K174 PolarHBondContact O-N 3.4Å; K174-A178 PolarHBondContact O-N 3.09Å; K174-W184 VanDerWaalsContact CA-CH2 3.48Å; K174-W184 HydrophobicContact CB-CD2 4.19Å; K174-W184 HydrophobicContact CB-CE3 4.44Å; K174-W184 HydrophobicContact CB-CH2 3.8Å; K174-W184 HydrophobicContact CB-CZ2 3.48Å; K174-W184 VanDerWaalsContact CB-CZ2 3.48Å; K174-W184 HydrophobicContact CB-CZ3 4.27Å; K174-W184 HydrophobicContact CD-CD2 4.44Å; K174-W184 HydrophobicContact CD-CG 4.49Å; K174-W184 HydrophobicContact CD-CZ2 4.41Å; K174-W184 HydrophobicContact CG-CD2 3.83Å; K174-W184 HydrophobicContact CG-CE3 4.4Å; K174-W184 HydrophobicContact CG-CG 4.21Å; K174-W184 HydrophobicContact CG-CZ2 3.95Å; K174-W184 VanDerWaalsContact N-CH2 3.33Å
175K97Very high97Very high158 Ų15863.2 Ų63.269%0.68733%0.329SS*.Hα-helixtrans-70.7-42.9-178.1-62.8163.8-170164.20110.5D171 E172 L173D171-K175 WeakPolarHBondContact O-CD 3.42Å; D171-K175 WeakPolarHBondContact O-CE 3.39Å; D171-K175 WeakPolarHBondContact O-CG 3.39Å; E172-K175 WeakPolarHBondContact O-CB 3.49Å; E172-K175 PolarHBondContact O-N 3.43Å; L173-K175 VanDerWaalsContact C-N 3.35Å; L173-K175 PolarHBondContact O-N 3.09Å
176E97.4Very high97.1Very high106 Ų10666.1 Ų66.150%0.49534%0.344SS..Hα-helixtrans-68.3-40179.7-16760.4-150.600112.1T154 A158 I160 E172 L173T154-E176 WeakPolarHBondContact CG2-O 3.33Å; A158-E176 HydrophobicContact CB-CG 3.85Å; A158-E176 WeakPolarHBondContact CB-OE1 3.33Å; I160-E176 HydrophobicContact CD1-CG 4.13Å; E172-E176 PolarHBondContact O-N 2.92Å; L173-E176 PolarHBondContact O-N 2.94Å
177M96.6Very high97.2Very high0 Ų065.2 Ų65.20%034%0.336CS..Hα-helixtrans-74.6-27.7-177.5-66-85.665.200114.1T154 I155 I160 L173 M179 W184 F187T154-M177 HydrophobicContact CG2-CE 3.48Å; T154-M177 VanDerWaalsContact CG2-CE 3.48Å; I155-M177 HydrophobicContact CG1-CE 3.61Å; I155-M177 HydrophobicContact CG1-SD 3.86Å; I160-M177 HydrophobicContact CD1-CE 3.41Å; I160-M177 VanDerWaalsContact CD1-CE 3.41Å; I160-M177 HydrophobicContact CD1-CG 4.47Å; I160-M177 HydrophobicContact CD1-SD 3.9Å; L173-M177 HydrophobicContact CD1-CG 3.74Å; L173-M177 HydrophobicContact CD1-SD 4.28Å; L173-M177 HydrophobicContact CG-CG 4.03Å; L173-M177 VanDerWaalsContact O-CB 3.3Å; L173-M177 WeakPolarHBondContact O-CB 3.4Å; L173-M177 WeakPolarHBondContact O-CG 3.2Å; L173-M177 PolarHBondContact O-N 3.05Å; M177-M179 HydrophobicContact CB-CE 4.2Å; M177-M179 HydrophobicContact CB-CG 4.09Å; M177-M179 HydrophobicContact CB-SD 3.98Å; M177-M179 HydrophobicContact CG-CE 4.4Å; M177-M179 PolarHBondContact O-N 2.95Å; M177-M179 HydrophobicContact SD-CE 3.84Å; M177-W184 HydrophobicContact CB-CE3 4.42Å; M177-W184 HydrophobicContact CB-CZ3 4.29Å; M177-W184 HydrophobicContact CG-CZ3 4.24Å; M177-F187 HydrophobicContact CG-CD1 4.46Å; M177-F187 HydrophobicContact CG-CE1 3.9Å; M177-F187 HydrophobicContact SD-CD1 4.4Å; M177-F187 HydrophobicContact SD-CE1 3.6Å; M177-F187 VanDerWaalsContact SD-CE1 3.6Å; M177-F187 HydrophobicContact SD-CZ 3.9Å
178A95.3Very high97.3Very high77 Ų7761 Ų6164%0.63631%0.313SS*.  trans48.933177.300000114.5K174K174-A178 PolarHBondContact O-N 3.09Å
179M96.8Very high97.4Very high23 Ų2363 Ų6311%0.11333%0.327CS..  trans-73157.6-179.1-74.3165.1174.400112.6L137 Y151 M177 D183 W184 F187L137-M179 HydrophobicContact CD1-CE 3.79Å; Y151-M179 HydrophobicContact CD1-CG 3.73Å; Y151-M179 HydrophobicContact CD2-CE 4.29Å; Y151-M179 HydrophobicContact CD2-CG 4.15Å; Y151-M179 HydrophobicContact CE1-CB 4.07Å; Y151-M179 HydrophobicContact CE1-CG 3.64Å; Y151-M179 HydrophobicContact CE2-CG 4.03Å; Y151-M179 HydrophobicContact CG-CE 4.07Å; Y151-M179 HydrophobicContact CG-CG 4Å; M177-M179 HydrophobicContact CB-CE 4.2Å; M177-M179 HydrophobicContact CB-CG 4.09Å; M177-M179 HydrophobicContact CB-SD 3.98Å; M177-M179 HydrophobicContact CG-CE 4.4Å; M177-M179 PolarHBondContact O-N 2.95Å; M177-M179 HydrophobicContact SD-CE 3.84Å; M179-D183 HydrophobicContact CB-CB 4.25Å; M179-W184 HydrophobicContact CB-CB 3.93Å; M179-W184 HydrophobicContact SD-CE3 4.09Å; M179-F187 HydrophobicContact CE-CB 4.2Å; M179-F187 HydrophobicContact CE-CD1 3.83Å; M179-F187 HydrophobicContact CE-CD2 4.28Å; M179-F187 HydrophobicContact CE-CE1 4.24Å; M179-F187 HydrophobicContact CE-CG 3.85Å; M179-F187 HydrophobicContact SD-CB 3.83Å; M179-F187 HydrophobicContact SD-CD1 3.75Å; M179-F187 HydrophobicContact SD-CG 3.93Å
180N96.6Very high97.3Very high70 Ų7060.7 Ų60.737%0.37432%0.315SS..  trans-57.1157.2166.5-61.7-43.1000109.8Y151 G182 D183 W184Y151-N180 VanDerWaalsContact OH-CG 3.3Å; Y151-N180 PolarHBondContact OH-N 3.04Å; Y151-N180 PolarHBondContact OH-ND2 3.5Å; N180-G182 VanDerWaalsContact C-N 3.33Å; N180-G182 PolarHBondContact O-N 2.93Å; N180-D183 HydrophobicContact CB-CB 4.35Å; N180-D183 VanDerWaalsContact CB-OD2 3.29Å; N180-D183 WeakPolarHBondContact CB-OD2 3.47Å; N180-D183 PolarHBondContact ND2-OD2 3.45Å; N180-D183 PolarHBondContact O-N 3.31Å; N180-W184 VanDerWaalsContact O-CB 3.25Å; N180-W184 WeakPolarHBondContact O-CB 3.39Å; N180-W184 PolarHBondContact O-N 3.47Å
181F97.6Very high97.3Very high153 Ų15360 Ų6067%0.67131%0.311SS*.Hα-helixtrans-55.9-44.6-177.8-179.5-95.5000113.1H185F181-H185 AromaticContact CE2-CD2 3.8Å; F181-H185 AromaticContact CE2-NE2 3.6Å; F181-H185 AromaticContact CZ-CD2 3.7Å; F181-H185 AromaticContact CZ-NE2 3.6Å; F181-H185 PolarHBondContact O-CD2 3.19Å; F181-H185 VanDerWaalsContact O-CD2 3.3Å; F181-H185 PolarHBondContact O-N 2.92Å
182G97.7Very high97.3Very high42 Ų4259.6 Ų59.643%0.43331%0.308SS..Hα-helixtrans-64.5-58176.900000112.6N180 W184 H185 L186N180-G182 VanDerWaalsContact C-N 3.33Å; N180-G182 PolarHBondContact O-N 2.93Å; G182-W184 PolarHBondContact O-N 2.9Å; G182-H185 WeakPolarHBondContact O-CA 3.34Å; G182-H185 PolarHBondContact O-N 2.86Å; G182-L186 PolarHBondContact O-N 3.18Å
183D97.9Very high97.2Very high9 Ų960.3 Ų60.35%0.04831%0.312CS..Hα-helixtrans-52.8-41.9179.4-59.1-38.7000112.4L143 D144 Y151 M179 N180 H185 L186 F187L143-D183 WeakPolarHBondContact CA-OD1 3.41Å; L143-D183 HydrophobicContact CG-CB 4.11Å; L143-D183 WeakPolarHBondContact CG-OD1 3.44Å; D144-D183 WeakPolarHBondContact CB-OD2 3.4Å; D144-D183 PolarHBondContact N-OD1 3.29Å; Y151-D183 HydrophobicContact CE2-CB 3.86Å; Y151-D183 PolarHBondContact OH-OD2 3.18Å; M179-D183 HydrophobicContact CB-CB 4.25Å; N180-D183 HydrophobicContact CB-CB 4.35Å; N180-D183 VanDerWaalsContact CB-OD2 3.29Å; N180-D183 WeakPolarHBondContact CB-OD2 3.47Å; N180-D183 PolarHBondContact ND2-OD2 3.45Å; N180-D183 PolarHBondContact O-N 3.31Å; D183-H185 PolarHBondContact O-N 3.26Å; D183-L186 PolarHBondContact O-N 3.37Å; D183-F187 WeakPolarHBondContact O-CB 3.4Å; D183-F187 PolarHBondContact O-N 2.96Å
184W98.1Very high97Very high3 Ų361.2 Ų61.21%0.01132%0.316CS..Hα-helixtrans-59.9-43.5174.9171.8-107.9000112.5I170 L173 K174 M177 M179 N180 G182 F187 R188I170-W184 HydrophobicContact CG2-CH2 4.09Å; I170-W184 HydrophobicContact CG2-CZ2 3.71Å; I170-W184 WeakPolarHBondContact O-CH2 3.36Å; I170-W184 WeakPolarHBondContact O-CZ2 3.48Å; L173-W184 HydrophobicContact CB-CH2 4.09Å; L173-W184 HydrophobicContact CD2-CH2 4.08Å; L173-W184 HydrophobicContact CD2-CZ3 4.35Å; L173-W184 HydrophobicContact CG-CH2 3.92Å; L173-W184 HydrophobicContact CG-CZ3 4.02Å; K174-W184 VanDerWaalsContact CA-CH2 3.48Å; K174-W184 HydrophobicContact CB-CD2 4.19Å; K174-W184 HydrophobicContact CB-CE3 4.44Å; K174-W184 HydrophobicContact CB-CH2 3.8Å; K174-W184 HydrophobicContact CB-CZ2 3.48Å; K174-W184 VanDerWaalsContact CB-CZ2 3.48Å; K174-W184 HydrophobicContact CB-CZ3 4.27Å; K174-W184 HydrophobicContact CD-CD2 4.44Å; K174-W184 HydrophobicContact CD-CG 4.49Å; K174-W184 HydrophobicContact CD-CZ2 4.41Å; K174-W184 HydrophobicContact CG-CD2 3.83Å; K174-W184 HydrophobicContact CG-CE3 4.4Å; K174-W184 HydrophobicContact CG-CG 4.21Å; K174-W184 HydrophobicContact CG-CZ2 3.95Å; K174-W184 VanDerWaalsContact N-CH2 3.33Å; M177-W184 HydrophobicContact CB-CE3 4.42Å; M177-W184 HydrophobicContact CB-CZ3 4.29Å; M177-W184 HydrophobicContact CG-CZ3 4.24Å; M179-W184 HydrophobicContact CB-CB 3.93Å; M179-W184 HydrophobicContact SD-CE3 4.09Å; N180-W184 VanDerWaalsContact O-CB 3.25Å; N180-W184 WeakPolarHBondContact O-CB 3.39Å; N180-W184 PolarHBondContact O-N 3.47Å; G182-W184 PolarHBondContact O-N 2.9Å; W184-F187 HydrophobicContact CE3-CD1 4.2Å; W184-F187 AromaticContact CZ3-CD1 3.87Å; W184-F187 HydrophobicContact CZ3-CD1 3.87Å; W184-F187 HydrophobicContact CZ3-CE1 4.31Å; W184-R188 HydrophobicContact CH2-CB 4.47Å; W184-R188 HydrophobicContact CZ2-CB 4.03Å; W184-R188 HydrophobicContact CZ2-CG 4.26Å; W184-R188 WeakPolarHBondContact O-CB 3.44Å; W184-R188 PolarHBondContact O-N 3.38Å
185H98.3Very high96.9Very high84 Ų8458.9 Ų58.939%0.38931%0.305SS..Hα-helixtrans-69.1-35.1179.6-91.1-83.6000112.1F181 G182 D183 S189F181-H185 AromaticContact CE2-CD2 3.8Å; F181-H185 AromaticContact CE2-NE2 3.6Å; F181-H185 AromaticContact CZ-CD2 3.7Å; F181-H185 AromaticContact CZ-NE2 3.6Å; F181-H185 PolarHBondContact O-CD2 3.19Å; F181-H185 VanDerWaalsContact O-CD2 3.3Å; F181-H185 PolarHBondContact O-N 2.92Å; G182-H185 WeakPolarHBondContact O-CA 3.34Å; G182-H185 PolarHBondContact O-N 2.86Å; D183-H185 PolarHBondContact O-N 3.26Å; H185-S189 WeakPolarHBondContact O-CB 3.42Å; H185-S189 PolarHBondContact O-N 3.4Å; H185-S189 VanDerWaalsContact O-N 3.1Å; H185-S189 PolarHBondContact O-OG 2.91Å
186L98.3Very high96.7Very high63 Ų6354 Ų5433%0.3329%0.291SS..Hα-helixtrans-66.9-50.2173.4-60.4171.5000111.3I140 L143 G182 D183 R188 S189 M190I140-L186 HydrophobicContact CG2-CB 3.6Å; I140-L186 HydrophobicContact CG2-CD1 4.25Å; I140-L186 HydrophobicContact CG2-CG 4.43Å; L143-L186 HydrophobicContact CB-CD1 4.35Å; G182-L186 PolarHBondContact O-N 3.18Å; D183-L186 PolarHBondContact O-N 3.37Å; L186-R188 PolarHBondContact O-N 2.88Å; L186-S189 WeakPolarHBondContact O-CB 3.49Å; L186-S189 PolarHBondContact O-N 2.97Å; L186-S189 VanDerWaalsContact O-N 3.14Å; L186-M190 PolarHBondContact O-N 3.49Å; L186-M190 VanDerWaalsContact O-N 3.07Å
187F98.1Very high96.4Very high0 Ų052 Ų520%029%0.285CS..Hα-helixtrans-61.9-43.3177.2179.8-112.9000112.8L137 I140 L165 L173 M177 M179 D183 W184 S189 M190 V191L137-F187 HydrophobicContact CD1-CB 4.44Å; L137-F187 HydrophobicContact CD1-CD2 3.47Å; L137-F187 VanDerWaalsContact CD1-CD2 3.47Å; L137-F187 HydrophobicContact CD1-CE2 3.97Å; L137-F187 HydrophobicContact CD1-CG 4.16Å; I140-F187 HydrophobicContact CD1-CB 4.22Å; I140-F187 HydrophobicContact CD1-CD2 4.11Å; L165-F187 HydrophobicContact CD1-CZ 4.23Å; L165-F187 HydrophobicContact CD2-CE1 4.46Å; L165-F187 HydrophobicContact CD2-CZ 4Å; L173-F187 HydrophobicContact CD1-CE1 4.43Å; L173-F187 HydrophobicContact CD2-CE1 4.01Å; L173-F187 HydrophobicContact CG-CE1 4.31Å; M177-F187 HydrophobicContact CG-CD1 4.46Å; M177-F187 HydrophobicContact CG-CE1 3.9Å; M177-F187 HydrophobicContact SD-CD1 4.4Å; M177-F187 HydrophobicContact SD-CE1 3.6Å; M177-F187 VanDerWaalsContact SD-CE1 3.6Å; M177-F187 HydrophobicContact SD-CZ 3.9Å; M179-F187 HydrophobicContact CE-CB 4.2Å; M179-F187 HydrophobicContact CE-CD1 3.83Å; M179-F187 HydrophobicContact CE-CD2 4.28Å; M179-F187 HydrophobicContact CE-CE1 4.24Å; M179-F187 HydrophobicContact CE-CG 3.85Å; M179-F187 HydrophobicContact SD-CB 3.83Å; M179-F187 HydrophobicContact SD-CD1 3.75Å; M179-F187 HydrophobicContact SD-CG 3.93Å; D183-F187 WeakPolarHBondContact O-CB 3.4Å; D183-F187 PolarHBondContact O-N 2.96Å; W184-F187 HydrophobicContact CE3-CD1 4.2Å; W184-F187 AromaticContact CZ3-CD1 3.87Å; W184-F187 HydrophobicContact CZ3-CD1 3.87Å; W184-F187 HydrophobicContact CZ3-CE1 4.31Å; F187-S189 VanDerWaalsContact C-N 3.26Å; F187-S189 PolarHBondContact O-N 2.79Å; F187-M190 HydrophobicContact CD2-CE 3.73Å; F187-M190 HydrophobicContact CE2-CE 3.69Å; F187-M190 PolarHBondContact O-N 2.69Å; F187-V191 HydrophobicContact CD1-CG2 4.45Å; F187-V191 HydrophobicContact CD2-CG2 4.32Å; F187-V191 HydrophobicContact CE1-CG2 4.1Å; F187-V191 HydrophobicContact CE2-CG2 3.97Å; F187-V191 HydrophobicContact CZ-CG2 3.85Å; F187-V191 WeakPolarHBondContact O-CG2 3.44Å; F187-V191 PolarHBondContact O-N 2.89Å
188R97.9Very high96Very high76 Ų7653 Ų5329%0.28729%0.29SS..Hα-helixtrans-58.7-37.5173.7177172.9175138.2-0.3111.8I170 D171 W184 L186 L192I170-R188 HydrophobicContact CG2-CG 3.85Å; I170-R188 VanDerWaalsContact CG2-CZ 3.46Å; I170-R188 VanDerWaalsContact CG2-NH1 3.29Å; D171-R188 IonicContact OD1-NH1 2.69Å; D171-R188 PolarHBondContact OD1-NH1 3.28Å; D171-R188 VanDerWaalsContact OD1-NH1 3.13Å; W184-R188 HydrophobicContact CH2-CB 4.47Å; W184-R188 HydrophobicContact CZ2-CB 4.03Å; W184-R188 HydrophobicContact CZ2-CG 4.26Å; W184-R188 WeakPolarHBondContact O-CB 3.44Å; W184-R188 PolarHBondContact O-N 3.38Å; L186-R188 PolarHBondContact O-N 2.88Å; R188-L192 HydrophobicContact CG-CD1 3.91Å; R188-L192 WeakPolarHBondContact O-CB 3.43Å; R188-L192 VanDerWaalsContact O-CG 3.25Å; R188-L192 WeakPolarHBondContact O-CG 3.4Å; R188-L192 PolarHBondContact O-N 3.42Å; R188-L192 VanDerWaalsContact O-N 3.09Å
189S97.8Very high95.3Very high70 Ų7055.3 Ų55.349%0.4929%0.292SS..Hα-helixtrans-67-49.7178-57.90000111.1H185 L186 F187 V191 L192 E193H185-S189 WeakPolarHBondContact O-CB 3.42Å; H185-S189 PolarHBondContact O-N 3.4Å; H185-S189 VanDerWaalsContact O-N 3.1Å; H185-S189 PolarHBondContact O-OG 2.91Å; L186-S189 WeakPolarHBondContact O-CB 3.49Å; L186-S189 PolarHBondContact O-N 2.97Å; L186-S189 VanDerWaalsContact O-N 3.14Å; F187-S189 VanDerWaalsContact C-N 3.26Å; F187-S189 PolarHBondContact O-N 2.79Å; S189-V191 VanDerWaalsContact C-N 3.34Å; S189-V191 PolarHBondContact O-N 2.76Å; S189-L192 PolarHBondContact O-N 3.02Å; S189-E193 WeakPolarHBondContact O-CB 3.41Å; S189-E193 PolarHBondContact O-N 3.38Å
190M96.7Very high94.1Very high28 Ų2861.7 Ų61.714%0.13832%0.321CS..Hα-helixtrans-56-45.4174.9-176.6-164.472.300112.1K136 I140 L186 F187 L192 E193 M194K136-M190 HydrophobicContact CB-CE 4.21Å; K136-M190 HydrophobicContact CB-SD 3.86Å; I140-M190 HydrophobicContact CD1-CB 4.1Å; I140-M190 HydrophobicContact CD1-CE 4.12Å; I140-M190 HydrophobicContact CD1-CG 4.49Å; I140-M190 HydrophobicContact CD1-SD 3.69Å; I140-M190 HydrophobicContact CG1-SD 3.78Å; L186-M190 PolarHBondContact O-N 3.49Å; L186-M190 VanDerWaalsContact O-N 3.07Å; F187-M190 HydrophobicContact CD2-CE 3.73Å; F187-M190 HydrophobicContact CE2-CE 3.69Å; F187-M190 PolarHBondContact O-N 2.69Å; M190-L192 VanDerWaalsContact C-N 3.35Å; M190-L192 PolarHBondContact O-N 3.34Å; M190-E193 PolarHBondContact O-N 3.32Å; M190-M194 WeakPolarHBondContact O-CB 3.42Å; M190-M194 WeakPolarHBondContact O-CG 3.43Å; M190-M194 PolarHBondContact O-N 3.21Å
191V97.1Very high92.4Very high1 Ų162.2 Ų62.21%0.00633%0.327CS..Hα-helixtrans-64.3-38.4179.6171.90000111.8L165 I170 F187 S189 R195L165-V191 HydrophobicContact CB-CG1 4.48Å; L165-V191 HydrophobicContact CD1-CG2 4.24Å; L165-V191 HydrophobicContact CD2-CG1 4.41Å; L165-V191 HydrophobicContact CD2-CG2 4.04Å; I170-V191 HydrophobicContact CD1-CG1 4.28Å; F187-V191 HydrophobicContact CD1-CG2 4.45Å; F187-V191 HydrophobicContact CD2-CG2 4.32Å; F187-V191 HydrophobicContact CE1-CG2 4.1Å; F187-V191 HydrophobicContact CE2-CG2 3.97Å; F187-V191 HydrophobicContact CZ-CG2 3.85Å; F187-V191 WeakPolarHBondContact O-CG2 3.44Å; F187-V191 PolarHBondContact O-N 2.89Å; S189-V191 VanDerWaalsContact C-N 3.34Å; S189-V191 PolarHBondContact O-N 2.76Å; V191-R195 WeakPolarHBondContact O-CG 3.43Å; V191-R195 PolarHBondContact O-N 3.03Å
192L96.4Very high89.8Confident76 Ų7660.8 Ų60.840%0.39833%0.33SS..Hα-helixtrans-73.7-38.1178.8-70.9171.8000112.8I170 R188 S189 M190 R195 S196I170-L192 HydrophobicContact CD1-CD2 4.18Å; I170-L192 HydrophobicContact CG1-CD2 4.33Å; R188-L192 HydrophobicContact CG-CD1 3.91Å; R188-L192 WeakPolarHBondContact O-CB 3.43Å; R188-L192 VanDerWaalsContact O-CG 3.25Å; R188-L192 WeakPolarHBondContact O-CG 3.4Å; R188-L192 PolarHBondContact O-N 3.42Å; R188-L192 VanDerWaalsContact O-N 3.09Å; S189-L192 PolarHBondContact O-N 3.02Å; M190-L192 VanDerWaalsContact C-N 3.35Å; M190-L192 PolarHBondContact O-N 3.34Å; L192-R195 PolarHBondContact O-N 3.2Å; L192-S196 PolarHBondContact O-N 3.07Å
193E95Very high87.6Confident126 Ų12664 Ų6459%0.58934%0.344SS*.Hα-helixtrans-60.4-48.1170.6-179.4-175.7-170.500110.9S189 M190 R195 S196 V197S189-E193 WeakPolarHBondContact O-CB 3.41Å; S189-E193 PolarHBondContact O-N 3.38Å; M190-E193 PolarHBondContact O-N 3.32Å; E193-R195 VanDerWaalsContact C-N 3.3Å; E193-R195 PolarHBondContact O-N 3.18Å; E193-S196 PolarHBondContact O-N 3.03Å; E193-S196 VanDerWaalsContact O-N 3.09Å; E193-S196 PolarHBondContact O-OG 3.07Å; E193-V197 WeakPolarHBondContact O-CG2 3.1Å; E193-V197 PolarHBondContact O-N 3.37Å
194M93.6Very high85.1Confident28 Ų2872.1 Ų72.114%0.13838%0.381CS..Hα-helixtrans-64.1-32.7178.8-76.5-153.572.200113.2L123 L125 M128 M190 E198L123-M194 WeakPolarHBondContact O-CE 3.33Å; L125-M194 HydrophobicContact CB-CB 4.15Å; L125-M194 HydrophobicContact CB-CE 4.05Å; L125-M194 HydrophobicContact CD1-CB 4.05Å; L125-M194 HydrophobicContact CD1-CE 4.02Å; L125-M194 HydrophobicContact CD1-SD 4Å; L125-M194 HydrophobicContact CD2-CB 3.88Å; L125-M194 HydrophobicContact CG-CB 4.24Å; M128-M194 HydrophobicContact CE-CE 3.3Å; M128-M194 HydrophobicContact CE-SD 4.06Å; M128-M194 HydrophobicContact SD-CE 3.75Å; M128-M194 HydrophobicContact SD-SD 4.13Å; M190-M194 WeakPolarHBondContact O-CB 3.42Å; M190-M194 WeakPolarHBondContact O-CG 3.43Å; M190-M194 PolarHBondContact O-N 3.21Å; M194-E198 WeakPolarHBondContact O-CB 3.48Å; M194-E198 PolarHBondContact O-N 3.06Å
195R95.4Very high81.9Confident43 Ų4376.8 Ų76.816%0.16241%0.406CS..Hα-helixtrans-66.7-40.7170-75.6-179.9-168.9-158.70.8112.5L125 L165 A166 C168 V191 L192 E193 E198 N199L125-R195 HydrophobicContact CD2-CG 3.7Å; L165-R195 PolarHBondContact O-NE 3.4Å; L165-R195 PolarHBondContact O-NH2 2.62Å; A166-R195 VanDerWaalsContact O-CZ 3.28Å; A166-R195 PolarHBondContact O-NE 3.16Å; C168-R195 PolarHBondContact O-NH1 3.01Å; C168-R195 VanDerWaalsContact O-NH1 3.12Å; C168-R195 PolarHBondContact O-NH2 3.46Å; C168-R195 PolarHBondContact SG-NH2 3.33Å; C168-R195 VanDerWaalsContact SG-NH2 3.4Å; V191-R195 WeakPolarHBondContact O-CG 3.43Å; V191-R195 PolarHBondContact O-N 3.03Å; L192-R195 PolarHBondContact O-N 3.2Å; E193-R195 VanDerWaalsContact C-N 3.3Å; E193-R195 PolarHBondContact O-N 3.18Å; R195-E198 PolarHBondContact O-N 3.02Å; R195-N199 WeakPolarHBondContact O-CB 3.46Å; R195-N199 VanDerWaalsContact O-CG 3.25Å; R195-N199 PolarHBondContact O-N 3.06Å; R195-N199 PolarHBondContact O-ND2 3.37Å
196S93.3Very high79.2Confident57 Ų5778.2 Ų78.240%0.39942%0.423SS..Hα-helixtrans-72.8-31.2-179.372.70000112.6L192 E193 Q200L192-S196 PolarHBondContact O-N 3.07Å; E193-S196 PolarHBondContact O-N 3.03Å; E193-S196 VanDerWaalsContact O-N 3.09Å; E193-S196 PolarHBondContact O-OG 3.07Å; S196-Q200 WeakPolarHBondContact O-CG 3.43Å; S196-Q200 PolarHBondContact O-N 2.83Å; S196-Q200 PolarHBondContact O-NE2 3Å
197V89.6Confident76.2Confident62 Ų6283.4 Ų83.438%0.37644%0.438SS..Hα-helixtrans-66.9-49.9169.91740000110.6E193 N199 Q200 V201E193-V197 WeakPolarHBondContact O-CG2 3.1Å; E193-V197 PolarHBondContact O-N 3.37Å; V197-N199 PolarHBondContact O-N 2.81Å; V197-Q200 PolarHBondContact O-N 3.29Å; V197-Q200 VanDerWaalsContact O-N 3.1Å; V197-V201 WeakPolarHBondContact O-CG2 3.35Å
198E88.9Confident73.1Confident23 Ų2392.1 Ų92.111%0.10748%0.477CS..Hα-helixtrans-60.6-41.8179.7175.7154.8-103.800112.8L124 L125 S126 A166 M194 R195 Q200 V201L124-E198 WeakPolarHBondContact CB-OE1 3.47Å; L124-E198 HydrophobicContact CD2-CB 4.21Å; L124-E198 HydrophobicContact CD2-CG 3.79Å; L124-E198 WeakPolarHBondContact CD2-OE1 3.42Å; L125-E198 HydrophobicContact CB-CB 4.43Å; L125-E198 WeakPolarHBondContact CB-OE2 3.41Å; L125-E198 PolarHBondContact N-OE1 2.78Å; L125-E198 VanDerWaalsContact N-OE1 3.16Å; S126-E198 WeakPolarHBondContact CB-OE1 3.39Å; S126-E198 WeakPolarHBondContact CB-OE2 3.38Å; S126-E198 VanDerWaalsContact N-CD 3.32Å; S126-E198 PolarHBondContact N-OE1 3.36Å; S126-E198 PolarHBondContact N-OE2 3.07Å; S126-E198 PolarHBondContact OG-OE1 3.36Å; A166-E198 WeakPolarHBondContact CB-OE2 3.36Å; M194-E198 WeakPolarHBondContact O-CB 3.48Å; M194-E198 PolarHBondContact O-N 3.06Å; R195-E198 PolarHBondContact O-N 3.02Å; E198-Q200 PolarHBondContact O-N 3.29Å; E198-V201 PolarHBondContact O-N 2.88Å; E198-V201 VanDerWaalsContact O-N 3.08Å
199N81.3Confident70.1Confident125 Ų12596.8 Ų96.867%0.66851%0.506SS*.THydrogen-bonded Turntrans-66.2-15.5177.3-73.1-18.6000114.2R195 V197R195-N199 WeakPolarHBondContact O-CB 3.46Å; R195-N199 VanDerWaalsContact O-CG 3.25Å; R195-N199 PolarHBondContact O-N 3.06Å; R195-N199 PolarHBondContact O-ND2 3.37Å; V197-N199 PolarHBondContact O-N 2.81Å
200Q71Confident66.7Low157 Ų157100.2 Ų100.273%0.73452%0.519SS*.THydrogen-bonded Turntrans-961.9174.8-72.2174.5104.100113.3S196 V197 E198S196-Q200 WeakPolarHBondContact O-CG 3.43Å; S196-Q200 PolarHBondContact O-N 2.83Å; S196-Q200 PolarHBondContact O-NE2 3Å; V197-Q200 PolarHBondContact O-N 3.29Å; V197-Q200 VanDerWaalsContact O-N 3.1Å; E198-Q200 PolarHBondContact O-N 3.29Å
201V59.9Low63.5Low81 Ų81106.8 Ų106.849%0.49155%0.55SS..  trans-107.28.2-176.7175.90000112.4L124 V197 E198 P203L124-V201 HydrophobicContact CD1-CG1 4.49Å; L124-V201 HydrophobicContact CD2-CB 4.05Å; L124-V201 HydrophobicContact CD2-CG1 3.82Å; L124-V201 HydrophobicContact CG-CG1 4.41Å; V197-V201 WeakPolarHBondContact O-CG2 3.35Å; E198-V201 PolarHBondContact O-N 2.88Å; E198-V201 VanDerWaalsContact O-N 3.08Å; V201-P203 WeakPolarHBondContact O-CD 3.5Å
202V44Very low60.4Low122 Ų122114.6 Ų114.674%0.73959%0.591SS**SBendtrans-68.4121.1165.7-179.50000108.7
203P51.5Low57.1Low111 Ų111115.9 Ų115.972%0.72161%0.607SS**PPolyproline II helixtrans-76.1133.5-165-2033.6000115.9V201V201-P203 WeakPolarHBondContact O-CD 3.5Å
204E45.7Very low54Low179 Ų179116 Ų11684%0.83662%0.621SS**SBendtrans-65.4160.7139.4-77.2-69.8138.800110.4
205D30.9Very low50.9Low100 Ų100119.3 Ų119.354%0.53565%0.653SS.*PPolyproline II helixtrans-53.1117.3-165.9-178.934.4000115.2R207D205-R207 PolarHBondContact O-N 3.18Å; D205-R207 IonicContact OD1-NE 3.94Å; D205-R207 IonicContact OD2-CZ 3.19Å; D205-R207 IonicContact OD2-NE 2.73Å; D205-R207 PolarHBondContact OD2-NE 3.48Å; D205-R207 IonicContact OD2-NH2 2.79Å; D205-R207 PolarHBondContact OD2-NH2 3.03Å
206P40.9Very low48.2Very low114 Ų114122.7 Ų122.774%0.7468%0.68SS**  trans-81.577.5-171.733.5-37.3000113.1
207R34.3Very low45.2Very low172 Ų172126.9 Ų126.965%0.64970%0.704SS**  trans-126.48176.3-70.8-168.7-64.110510.5116.9D205D205-R207 PolarHBondContact O-N 3.18Å; D205-R207 IonicContact OD1-NE 3.94Å; D205-R207 IonicContact OD2-CZ 3.19Å; D205-R207 IonicContact OD2-NE 2.73Å; D205-R207 PolarHBondContact OD2-NE 3.48Å; D205-R207 IonicContact OD2-NH2 2.79Å; D205-R207 PolarHBondContact OD2-NH2 3.03Å
208F34.1Very low42.2Very low184 Ų184128.6 Ų128.681%0.80772%0.724SS**  trans-130.169.8179.1-67.5-71.4000113.8
209L34Very low39.3Very low173 Ų173136.3 Ų136.391%0.90676%0.76SS**  trans-131.9126.5156.4-81.2-179.9000111.7
210N27.1Very low36.7Very low142 Ų142133.2 Ų133.276%0.75976%0.757SS**  trans63.198.6156.9-171.778000119.2
211E29.9Very low34.6Very low167 Ų167134 Ų13478%0.7876%0.761SS**  -151.499124.7-169.3153.5125.100112.2
212N31.4Very low33.1Very low165 Ų165134.6 Ų134.688%0.88277%0.768SS**  trans-143.859.2166.7-77.3127.5000112
213S28Very low32.3Very low103 Ų103132.8 Ų132.872%0.7277%0.766SS**  trans-111.1110.1166.356.50000110.4
214S29Very low31.2Very low128 Ų128138.6 Ų138.690%0.89577%0.774SS**  trans-78.8122.5-168.2-50.10000114.6
215A27.8Very low30.4Very low98 Ų98140.5 Ų140.581%0.8177%0.773SS**  trans-156.1153.515500000111
216P39.4Very low30.1Very low113 Ų113140.7 Ų140.773%0.73478%0.778SS**  trans-122.4173.6-165.143.3-31.9000116.1
217V29.7Very low29.5Very low146 Ų146139.7 Ų139.789%0.88577%0.774SS**  trans74.9141.3168.5-172.50000112.9
218A27.2Very low29.3Very low97 Ų97139.5 Ų139.580%0.80278%0.78SS**  cis-134.5-178.322.700000116
219H28.7Very low28.9Very low186 Ų186135.1 Ų135.186%0.86177%0.773SS**  trans-106.4157.8-174.8-178.375.3000112.3
220G26.4Very low28.5Very low59 Ų59134.9 Ų134.961%0.60877%0.767SS**  trans153.582.3177.400000112.7
221E26.6Very low28.7Very low174 Ų174135.8 Ų135.881%0.81377%0.771SS**  82.814490.9-80.4-154.2109.100115.1
222S28.1Very low29.3Very low93 Ų93132.2 Ų132.265%0.6576%0.762SS**  cis-167.9146.1-18.3-171.70000112.3
223A26.5Very low29.1Very low84 Ų84132.6 Ų132.669%0.69476%0.758SS**  trans64.3153.5162.700000117.2
224R28.3Very low29Very low233 Ų233134.3 Ų134.388%0.87976%0.764SS**  cis-152.1156.230.3-62.9157.8-162.1171.75.3108
225R30.3Very low29.1Very low219 Ų219136.9 Ų136.983%0.82676%0.762SS**  cis-161.1132.31.5-125.4-163.6179.1-154.82.8107.9
226T24.5Very low29.2Very low104 Ų104140.4 Ų140.464%0.63877%0.767SS**  52.9136.9111.267.60000118.3
227S27.6Very low28.6Very low94 Ų94140 Ų14066%0.65777%0.766SS**  cis-169.6138.712.736.50000114.8
228H31Very low28.8Very low168 Ų168137.6 Ų137.678%0.77876%0.756SS**  trans48.2153.8133.6-60.2-86.7000121
229S24.9Very low29.1Very low92 Ų92141.9 Ų141.964%0.64376%0.759SS**  cis-151170.220.5-91.40000109.9
230E25.8Very low29.2Very low167 Ų167139.4 Ų139.478%0.7876%0.757SS**  cis-162.1176.7-19.7-108.5165.1134.300110.1
231L32.3Very low30.1Very low162 Ų162141.1 Ų141.185%0.84876%0.758SS**  trans-85.7-172.2178.9-78.2171.7000110.9
232P40.8Very low30.7Very low91 Ų91143 Ų14359%0.59176%0.759SS**  cis-159.4-179.329.643-17.9000122.7
233H27.6Very low31Very low174 Ų174145 Ų14581%0.80677%0.768SS**  trans72.8146.9163.3-48.2-48000117.6
234T25.5Very low32Very low138 Ų138147.9 Ų147.985%0.84777%0.771SS**  cis-136.6146.517.1-54.40000112
235E32.3Very low32.8Very low183 Ų183144.1 Ų144.186%0.85577%0.768SS**  trans-92.5139.3176.3-56.2-172.7151.400113
236L29.9Very low34.2Very low172 Ų172139.8 Ų139.890%0.90176%0.755SS**  trans-165.2153.2142.8-146.365.4000113.8
237S25.4Very low35.4Very low104 Ų104138 Ų13873%0.72775%0.746SS**  trans68.194.2155.5-1600000120
238S35.6Very low36.1Very low95 Ų95141 Ų14166%0.66475%0.748SS**  trans-31.5160.8149.656.40000119.6
239Q31.9Very low37.6Very low187 Ų187139.3 Ų139.387%0.87474%0.741SS**  trans103.1140.7157.9-55.2-165.98.400118.1
240T31.9Very low39.5Very low134 Ų134140 Ų14082%0.82273%0.733SS**  trans-87.9175-176.746.20000110.9
241P44.1Very low41.1Very low95 Ų95137.4 Ų137.462%0.61772%0.724SS**  cis-145.4-179.121.844.1-23.9000119
242Y39.4Very low42Very low214 Ų214134.9 Ų134.984%0.83971%0.712SS**  trans55.396.4162.7-52.4-55.6000119.3
243T35.7Very low42.5Very low136 Ų136136.1 Ų136.183%0.83472%0.718SS**  trans-123.699.5152.160.80000109.2N245T243-N245 PolarHBondContact O-N 3.02Å
244L46.2Very low43.5Very low144 Ų144134.6 Ų134.675%0.75472%0.715SS**  trans-82.5107.5171.8-67.9177.5000108.6F246L244-F246 HydrophobicContact CB-CD2 4.41Å; L244-F246 HydrophobicContact CB-CE2 3.95Å; L244-F246 HydrophobicContact CD1-CE2 4.22Å; L244-F246 HydrophobicContact CD2-CZ 4.44Å; L244-F246 HydrophobicContact CG-CE2 4.49Å
245N46.8Very low44.3Very low153 Ų153131 Ų13182%0.81871%0.705SS**  trans-117.279.2-179-174.351.9000109.4T243T243-N245 PolarHBondContact O-N 3.02Å
246F58.4Low45Very low129 Ų129131 Ų13157%0.56671%0.71SS**  trans-72.7139.9176.3-64.9-72.7000111L244 E250L244-F246 HydrophobicContact CB-CD2 4.41Å; L244-F246 HydrophobicContact CB-CE2 3.95Å; L244-F246 HydrophobicContact CD1-CE2 4.22Å; L244-F246 HydrophobicContact CD2-CZ 4.44Å; L244-F246 HydrophobicContact CG-CE2 4.49Å; F246-E250 WeakPolarHBondContact CA-OE2 3.47Å
247S50.8Low45.3Very low65 Ų65130.5 Ų130.546%0.45571%0.709SS.*  trans-72.8151.2170.9-173.70000110.9E249 E250S247-E249 PolarHBondContact O-N 3.31Å; S247-E249 VanDerWaalsContact O-N 3.17Å; S247-E250 PolarHBondContact N-OE2 3.3Å; S247-E250 PolarHBondContact O-N 3.27Å
248F41.5Very low46.2Very low159 Ų159131.9 Ų131.970%0.69770%0.704SS**Hα-helixtrans-56.6-30.4173.2-176.1-99.3000112.3E250 N252F248-E250 VanDerWaalsContact C-N 3.35Å; F248-E250 PolarHBondContact O-N 2.97Å; F248-N252 PolarHBondContact O-N 2.78Å
249E63Low45.9Very low131 Ų131131 Ų13161%0.61271%0.71SS**Hα-helixtrans-63.8-36.9176.8-144.267.8-15900112.7S247 N252S247-E249 PolarHBondContact O-N 3.31Å; S247-E249 VanDerWaalsContact O-N 3.17Å; E249-N252 WeakPolarHBondContact O-CB 3.15Å; E249-N252 PolarHBondContact O-N 3.29Å
250E63.3Low46.2Very low106 Ų106125.7 Ų125.750%0.49570%0.698SS.*Hα-helixtrans-75.7-29.6-174.7-63.3171.7135.100112.2F246 S247 F248 N252 T253F246-E250 WeakPolarHBondContact CA-OE2 3.47Å; S247-E250 PolarHBondContact N-OE2 3.3Å; S247-E250 PolarHBondContact O-N 3.27Å; F248-E250 VanDerWaalsContact C-N 3.35Å; F248-E250 PolarHBondContact O-N 2.97Å; E250-N252 VanDerWaalsContact C-N 3.35Å; E250-T253 PolarHBondContact O-OG1 3.34Å
251L60.7Low46.6Very low113 Ų113125.3 Ų125.359%0.59270%0.697SS**Hα-helixtrans-72.2-30.2172-72.7170.7000112.2T253 L254L251-T253 VanDerWaalsContact C-N 3.27Å; L251-T253 PolarHBondContact O-N 2.85Å; L251-L254 PolarHBondContact O-N 2.97Å
252N51.9Low46.6Very low110 Ų110129.5 Ų129.559%0.58870%0.701SS**Hα-helixtrans-69.3-25.9-178.5-127.31000112.3F248 E249 E250 L254F248-N252 PolarHBondContact O-N 2.78Å; E249-N252 WeakPolarHBondContact O-CB 3.15Å; E249-N252 PolarHBondContact O-N 3.29Å; E250-N252 VanDerWaalsContact C-N 3.35Å; N252-L254 VanDerWaalsContact C-N 3.28Å; N252-L254 PolarHBondContact O-N 2.75Å
253T49.7Very low46.3Very low117 Ų117128 Ų12872%0.71870%0.701SS**THydrogen-bonded Turntrans-76.9-3.4176.235.90000115.3E250 L251E250-T253 PolarHBondContact O-OG1 3.34Å; L251-T253 VanDerWaalsContact C-N 3.27Å; L251-T253 PolarHBondContact O-N 2.85Å
254L50.3Low46.2Very low142 Ų142125.8 Ų125.874%0.74369%0.691SS**THydrogen-bonded Turntrans-95.415.8176.5-66.1172.8000113.5L251 N252L251-L254 PolarHBondContact O-N 2.97Å; N252-L254 VanDerWaalsContact C-N 3.28Å; N252-L254 PolarHBondContact O-N 2.75Å
255G41.3Very low45.4Very low62 Ų62126.1 Ų126.164%0.63969%0.693SS**  trans-68129.9173.300000112.8
256L46.2Very low45Very low183 Ų183126.4 Ų126.496%0.95869%0.694SS**  trans-65.6130.9171.4-71.1161.2000111.1
257D36.7Very low43.7Very low162 Ų162124.7 Ų124.787%0.86670%0.698SS**  trans-125.7142.8162.4-171.727.7000110.5
258E44.5Very low42.7Very low133 Ų133132.7 Ų132.762%0.62172%0.719SS**  trans-105.6105.1-167.3-175.5176.2125.700111.9R262E258-R262 IonicContact OE1-CZ 3.19Å; E258-R262 IonicContact OE1-NH1 3.03Å; E258-R262 PolarHBondContact OE1-NH1 3.27Å; E258-R262 IonicContact OE1-NH2 3.42Å; E258-R262 PolarHBondContact OE1-NH2 3.43Å; E258-R262 IonicContact OE2-NH2 2.89Å
259G29.6Very low42.5Very low77 Ų77133.5 Ų133.579%0.79473%0.725SS**  trans-112.820.9-169.100000117.9
260A38Very low40.9Very low75 Ų75132 Ų13262%0.6273%0.729SS**  trans-102.1112.2-177.800000112.8R262A260-R262 PolarHBondContact O-N 2.88Å
261P39.7Very low39.6Very low126 Ų126136.5 Ų136.582%0.81875%0.75SS**  trans-70.9128.7179.828-33.6000111.9
262R44.3Very low38.3Very low183 Ų183137.3 Ų137.369%0.69176%0.76SS**  trans-97.2133.4-175.8-65.5-179.5174.6974.3113.2E258 A260E258-R262 IonicContact OE1-CZ 3.19Å; E258-R262 IonicContact OE1-NH1 3.03Å; E258-R262 PolarHBondContact OE1-NH1 3.27Å; E258-R262 IonicContact OE1-NH2 3.42Å; E258-R262 PolarHBondContact OE1-NH2 3.43Å; E258-R262 IonicContact OE2-NH2 2.89Å; A260-R262 PolarHBondContact O-N 2.88Å
263H34.1Very low37.9Very low183 Ų183143.5 Ų143.585%0.84778%0.775SS**  trans-131.781.3152.4-54-44.3000107.5
264S32.8Very low37.4Very low88 Ų88149.3 Ų149.362%0.61578%0.783SS**  73.395.791.669.10000115.7
265N29.7Very low36.9Very low151 Ų151148.3 Ų148.381%0.80778%0.784SS**  58.4117.9125.1-49.2-32.2000118
266L39Very low37Very low159 Ų159149.8 Ų149.883%0.83278%0.782SS**  -170.7166.369.4-84144.8000108.2
267S31Very low36.7Very low94 Ų94145.7 Ų145.766%0.65777%0.768SS**  cis-159.6155.60.739.70000111.3
268W30.2Very low37.5Very low232 Ų232146.6 Ų146.688%0.87977%0.772SS**  trans-12.5144.8156.3-39.486.7000117.5
269Q36.1Very low37.9Very low177 Ų177144.1 Ų144.183%0.82777%0.77SS**  cis-142.3166.420.7-53.8164.3-5.800108.3
270S29.4Very low38.7Very low100 Ų100144.4 Ų144.470%0.69976%0.76SS**  cis-160.9145.733.8-640000113.1T272S270-T272 PolarHBondContact O-N 3.19Å
271Q37.2Very low39.7Very low199 Ų199148.4 Ų148.493%0.9377%0.77SS**  trans41.168.7145.8-157.2140.1-27.200121.1
272T32.8Very low40.9Very low130 Ų130150.1 Ų150.180%0.79877%0.772SS**  trans-98.4136.9151.4-60.80000109.5S270 R274S270-T272 PolarHBondContact O-N 3.19Å; T272-R274 PolarHBondContact O-N 3.24Å; T272-R274 VanDerWaalsContact O-N 3.12Å
273R43Very low42.3Very low240 Ų240143.3 Ų143.391%0.90675%0.753SS**  trans-62.4112.6172.9-67.5-178.6-177.4-91.92.1109.1
274R40.5Very low44.3Very low239 Ų239142.2 Ų142.290%0.90275%0.748SS**PPolyproline II helixtrans-64.7137.3168-75.4-171.2175-170.7-1109.1T272T272-R274 PolarHBondContact O-N 3.24Å; T272-R274 VanDerWaalsContact O-N 3.12Å
275T39.5Very low46.6Very low122 Ų122144 Ų14475%0.74875%0.75SS**PPolyproline II helixtrans-57.2132.8159.646.40000108.8S277T275-S277 PolarHBondContact O-N 2.63Å
276P43.4Very low49Very low93 Ų93138.1 Ų138.160%0.60472%0.721SS**PPolyproline II helixtrans-65.7120.617327.6-32.4000108.9L278P276-L278 PolarHBondContact O-N 3.38Å
277S38.3Very low51.1Low96 Ų96133.9 Ų133.967%0.67171%0.705SS**PPolyproline II helixtrans-64.6131.9170.1-59.30000108.8T275 S279T275-S277 PolarHBondContact O-N 2.63Å; S277-S279 PolarHBondContact O-N 2.97Å
278L55Low53.9Low182 Ų182132.8 Ų132.895%0.95369%0.691SS**  trans-74.640176.9-64.4175.6000112.8P276P276-L278 PolarHBondContact O-N 3.38Å
279S51.9Low56.9Low81 Ų81127.2 Ų127.257%0.56667%0.674SS**  trans-98.7115178.2520000109.7S277S277-S279 PolarHBondContact O-N 2.97Å
280S47.6Very low59.5Low83 Ų83123.1 Ų123.158%0.5866%0.657SS**  trans73.290.7178.3-570000116.1N282 S283S280-N282 PolarHBondContact O-N 3.09Å; S280-S283 WeakPolarHBondContact CB-OG 3.36Å; S280-S283 WeakPolarHBondContact O-CB 3.25Å; S280-S283 PolarHBondContact O-N 2.97Å; S280-S283 PolarHBondContact O-OG 2.92Å
281L58Low62.6Low159 Ų159121.2 Ų121.283%0.83264%0.644SS**THydrogen-bonded Turntrans-55.8-13.5165.5-68.9169.2000114.4
282N64.8Low65.3Low161 Ų161118.1 Ų118.186%0.86163%0.628SS**THydrogen-bonded Turntrans-95.612178.1-164.244.9000113.2S280S280-N282 PolarHBondContact O-N 3.09Å
283S75.1Confident68.3Low41 Ų41117.1 Ų117.129%0.28762%0.617SS.*SBendtrans-75.7144.2176.6-54.10000111S280 D285 S286 S287S280-S283 WeakPolarHBondContact CB-OG 3.36Å; S280-S283 WeakPolarHBondContact O-CB 3.25Å; S280-S283 PolarHBondContact O-N 2.97Å; S280-S283 PolarHBondContact O-OG 2.92Å; S283-D285 VanDerWaalsContact C-N 3.27Å; S283-D285 PolarHBondContact O-N 3.32Å; S283-S286 WeakPolarHBondContact O-CB 3.45Å; S283-S286 PolarHBondContact O-N 3.21Å; S283-S287 PolarHBondContact O-N 3.35Å
284Q75.1Confident70.8Confident159 Ų159108.8 Ų108.874%0.74359%0.592SS**Hα-helixtrans-61.1-36.1179.5-173.8171.2-19.700112.2S287 I288Q284-S287 WeakPolarHBondContact O-CB 3.28Å; Q284-S287 PolarHBondContact O-N 3.14Å; Q284-I288 HydrophobicContact CG-CD1 4.47Å; Q284-I288 WeakPolarHBondContact O-CG1 3.45Å; Q284-I288 PolarHBondContact O-N 3.09Å; Q284-I288 VanDerWaalsContact O-N 3.07Å
285D80.6Confident73.4Confident126 Ų126101.8 Ų101.867%0.67457%0.573SS**Hα-helixtrans-64.3-37.7172.6-60.9-78.9000112.8S283 I288 E289S283-D285 VanDerWaalsContact C-N 3.27Å; S283-D285 PolarHBondContact O-N 3.32Å; D285-I288 PolarHBondContact O-N 3.1Å; D285-E289 WeakPolarHBondContact O-CB 3.47Å; D285-E289 PolarHBondContact O-N 3.48Å
286S79.9Confident76.2Confident27 Ų27102.3 Ų102.319%0.18957%0.565CS.*Hα-helixtrans-66.3-37174.4-550000111.8S283 I288 E289 I290S283-S286 WeakPolarHBondContact O-CB 3.45Å; S283-S286 PolarHBondContact O-N 3.21Å; S286-I288 VanDerWaalsContact C-N 3.35Å; S286-E289 PolarHBondContact O-N 2.83Å; S286-I290 WeakPolarHBondContact O-CB 3.37Å; S286-I290 WeakPolarHBondContact O-CD1 3.49Å; S286-I290 WeakPolarHBondContact O-CG1 3.4Å; S286-I290 PolarHBondContact O-N 3.47Å
287S83.1Confident78.8Confident70 Ų70102 Ų10249%0.4956%0.561SS.*Hα-helixtrans-60.6-44.5171.3-176.20000111.4S283 Q284 E289 I290 S291S283-S287 PolarHBondContact O-N 3.35Å; Q284-S287 WeakPolarHBondContact O-CB 3.28Å; Q284-S287 PolarHBondContact O-N 3.14Å; S287-E289 VanDerWaalsContact C-N 3.33Å; S287-E289 PolarHBondContact O-N 2.89Å; S287-I290 PolarHBondContact O-N 3.34Å; S287-S291 PolarHBondContact O-N 2.95Å; S287-S291 PolarHBondContact O-OG 2.83Å
288I91.3Very high81.6Confident72 Ų72102 Ų10237%0.36955%0.55SS.*Hα-helixtrans-64-36.3175.8-67.1164.3000111.8Q284 D285 S286 K292Q284-I288 HydrophobicContact CG-CD1 4.47Å; Q284-I288 WeakPolarHBondContact O-CG1 3.45Å; Q284-I288 PolarHBondContact O-N 3.09Å; Q284-I288 VanDerWaalsContact O-N 3.07Å; D285-I288 PolarHBondContact O-N 3.1Å; S286-I288 VanDerWaalsContact C-N 3.35Å; I288-K292 HydrophobicContact CG2-CD 4.18Å; I288-K292 WeakPolarHBondContact O-CD 3.43Å; I288-K292 VanDerWaalsContact O-CG 3.28Å; I288-K292 WeakPolarHBondContact O-CG 3.49Å; I288-K292 PolarHBondContact O-N 3.34Å; I288-K292 VanDerWaalsContact O-N 3.09Å
289E92.6Very high83.6Confident114 Ų11495.5 Ų95.553%0.53352%0.523SS..Hα-helixtrans-70.6-41.1175.7-172.6164.3-137.300112.4D285 S286 S287 K292 L293D285-E289 WeakPolarHBondContact O-CB 3.47Å; D285-E289 PolarHBondContact O-N 3.48Å; S286-E289 PolarHBondContact O-N 2.83Å; S287-E289 VanDerWaalsContact C-N 3.33Å; S287-E289 PolarHBondContact O-N 2.89Å; E289-K292 PolarHBondContact O-N 2.7Å; E289-L293 WeakPolarHBondContact O-CB 3.44Å; E289-L293 PolarHBondContact O-N 3.47Å
290I91.2Very high85.7Confident91 Ų9197.4 Ų97.447%0.46752%0.523SS..Hα-helixtrans-62.5-42.4173.8-70.3162.4000110.8S286 S287 L293 T294S286-I290 WeakPolarHBondContact O-CB 3.37Å; S286-I290 WeakPolarHBondContact O-CD1 3.49Å; S286-I290 WeakPolarHBondContact O-CG1 3.4Å; S286-I290 PolarHBondContact O-N 3.47Å; S287-I290 PolarHBondContact O-N 3.34Å; I290-L293 PolarHBondContact O-N 2.91Å; I290-T294 WeakPolarHBondContact O-CB 3.24Å; I290-T294 PolarHBondContact O-N 3.38Å; I290-T294 PolarHBondContact O-OG1 3.14Å
291S93.6Very high88.1Confident60 Ų60101.2 Ų101.242%0.4253%0.526SS..Hα-helixtrans-59.7-51.6173.1-63.90000111.2S287 L293 T294 D295S287-S291 PolarHBondContact O-N 2.95Å; S287-S291 PolarHBondContact O-OG 2.83Å; S291-L293 VanDerWaalsContact C-N 3.29Å; S291-L293 PolarHBondContact O-N 3.21Å; S291-T294 CarbonylContact O-C 3.55Å; S291-T294 WeakPolarHBondContact O-CA 3.39Å; S291-T294 WeakPolarHBondContact O-CB 3.37Å; S291-T294 PolarHBondContact O-N 3.19Å; S291-D295 PolarHBondContact O-N 3.41Å
292K95.1Very high90Very high135 Ų135101.3 Ų101.359%0.58752%0.515SS*.Hα-helixtrans-60-36.2178.2-72.4165.4-176.8169.20113.4I288 E289 K296I288-K292 HydrophobicContact CG2-CD 4.18Å; I288-K292 WeakPolarHBondContact O-CD 3.43Å; I288-K292 VanDerWaalsContact O-CG 3.28Å; I288-K292 WeakPolarHBondContact O-CG 3.49Å; I288-K292 PolarHBondContact O-N 3.34Å; I288-K292 VanDerWaalsContact O-N 3.09Å; E289-K292 PolarHBondContact O-N 2.7Å; K292-K296 WeakPolarHBondContact O-CB 3.36Å; K292-K296 PolarHBondContact O-N 3.05Å
293L94.9Very high91.5Very high108 Ų10897.4 Ų97.457%0.56549%0.494SS*.Hα-helixtrans-67.6-41.4174.5-179.660.4000110.9E289 I290 S291 K296 V297E289-L293 WeakPolarHBondContact O-CB 3.44Å; E289-L293 PolarHBondContact O-N 3.47Å; I290-L293 PolarHBondContact O-N 2.91Å; S291-L293 VanDerWaalsContact C-N 3.29Å; S291-L293 PolarHBondContact O-N 3.21Å; L293-K296 PolarHBondContact O-N 2.82Å; L293-V297 HydrophobicContact CD1-CG2 4.5Å; L293-V297 WeakPolarHBondContact O-CG2 3.32Å; L293-V297 PolarHBondContact O-N 3.28Å
294T94.9Very high92.6Very high65 Ų6598.2 Ų98.240%0.39950%0.504SS..Hα-helixtrans-63.4-46.9175.2-55.60000111.1I290 S291 K296 V297 Q298I290-T294 WeakPolarHBondContact O-CB 3.24Å; I290-T294 PolarHBondContact O-N 3.38Å; I290-T294 PolarHBondContact O-OG1 3.14Å; S291-T294 CarbonylContact O-C 3.55Å; S291-T294 WeakPolarHBondContact O-CA 3.39Å; S291-T294 WeakPolarHBondContact O-CB 3.37Å; S291-T294 PolarHBondContact O-N 3.19Å; T294-K296 VanDerWaalsContact C-N 3.32Å; T294-K296 PolarHBondContact O-N 3Å; T294-V297 PolarHBondContact O-N 3.23Å; T294-Q298 WeakPolarHBondContact O-CB 3.14Å; T294-Q298 WeakPolarHBondContact O-CG 3.34Å; T294-Q298 PolarHBondContact O-N 2.88Å
295D96.3Very high93.6Very high93 Ų9396.7 Ų96.750%0.49749%0.492SS..Hα-helixtrans-58.2-43.8175.6-62.5-31.2000111.2S291 Q298 A299S291-D295 PolarHBondContact O-N 3.41Å; D295-Q298 PolarHBondContact O-N 3.29Å; D295-A299 WeakPolarHBondContact O-CB 3.48Å; D295-A299 PolarHBondContact O-N 2.93Å
296K97.4Very high94.4Very high133 Ų13397.5 Ų97.558%0.57849%0.485SS*.Hα-helixtrans-62.5-47.3176.5-173.9-172171.5-1660111.6K292 L293 T294 Q298 A299 E300K292-K296 WeakPolarHBondContact O-CB 3.36Å; K292-K296 PolarHBondContact O-N 3.05Å; L293-K296 PolarHBondContact O-N 2.82Å; T294-K296 VanDerWaalsContact C-N 3.32Å; T294-K296 PolarHBondContact O-N 3Å; K296-Q298 VanDerWaalsContact C-N 3.32Å; K296-Q298 PolarHBondContact O-N 3.34Å; K296-A299 PolarHBondContact O-N 2.85Å; K296-E300 WeakPolarHBondContact O-CB 3.25Å; K296-E300 PolarHBondContact O-N 3.13Å
297V97.8Very high95.2Very high86 Ų86101.7 Ų101.752%0.52150%0.502SS..Hα-helixtrans-65.2-36.3178.7170.80000111.2L293 T294 Y301L293-V297 HydrophobicContact CD1-CG2 4.5Å; L293-V297 WeakPolarHBondContact O-CG2 3.32Å; L293-V297 PolarHBondContact O-N 3.28Å; T294-V297 PolarHBondContact O-N 3.23Å; V297-Y301 WeakPolarHBondContact O-CB 3.45Å; V297-Y301 PolarHBondContact O-N 3.07Å
298Q97.4Very high95.8Very high96 Ų96104.4 Ų104.445%0.44950%0.502SS..Hα-helixtrans-67.5-38.5173.1-72.8-174.127.300112.6T294 D295 K296 R302T294-Q298 WeakPolarHBondContact O-CB 3.14Å; T294-Q298 WeakPolarHBondContact O-CG 3.34Å; T294-Q298 PolarHBondContact O-N 2.88Å; D295-Q298 PolarHBondContact O-N 3.29Å; K296-Q298 VanDerWaalsContact C-N 3.32Å; K296-Q298 PolarHBondContact O-N 3.34Å; Q298-R302 WeakPolarHBondContact O-CB 3.11Å; Q298-R302 VanDerWaalsContact O-CG 3.25Å; Q298-R302 WeakPolarHBondContact O-CG 3.41Å; Q298-R302 PolarHBondContact O-N 3.36Å
299A96.1Very high96Very high46 Ų46105 Ų10538%0.3851%0.506SS..Hα-helixtrans-64.6-48.8173.400000111D295 K296 Y301 R302 D303D295-A299 WeakPolarHBondContact O-CB 3.48Å; D295-A299 PolarHBondContact O-N 2.93Å; K296-A299 PolarHBondContact O-N 2.85Å; A299-Y301 VanDerWaalsContact C-N 3.32Å; A299-Y301 PolarHBondContact O-N 2.79Å; A299-R302 CarbonylContact O-C 3.32Å; A299-R302 PolarHBondContact O-N 3.03Å; A299-R302 VanDerWaalsContact O-N 3.1Å; A299-D303 WeakPolarHBondContact O-CB 3.46Å; A299-D303 VanDerWaalsContact O-CG 3.29Å; A299-D303 PolarHBondContact O-N 3.3Å; A299-D303 VanDerWaalsContact O-OD1 3.12Å
300E96.7Very high96.1Very high120 Ų120102 Ų10256%0.56150%0.5SS*.Hα-helixtrans-59.2-41177.9-166.6167.3163.700111.8K296 D303 A304K296-E300 WeakPolarHBondContact O-CB 3.25Å; K296-E300 PolarHBondContact O-N 3.13Å; E300-D303 PolarHBondContact O-N 3.33Å; E300-A304 WeakPolarHBondContact O-CB 3.35Å; E300-A304 PolarHBondContact O-N 3.4Å
301Y97.8Very high96.2Very high163 Ų163102.6 Ų102.664%0.63950%0.501SS*.Hα-helixtrans-64.3-45.3171.8179.3-94000112.9V297 A299 D303 Y305V297-Y301 WeakPolarHBondContact O-CB 3.45Å; V297-Y301 PolarHBondContact O-N 3.07Å; A299-Y301 VanDerWaalsContact C-N 3.32Å; A299-Y301 PolarHBondContact O-N 2.79Å; Y301-D303 VanDerWaalsContact C-N 3.26Å; Y301-D303 PolarHBondContact O-N 3.48Å; Y301-Y305 VanDerWaalsContact O-CB 3.27Å; Y301-Y305 WeakPolarHBondContact O-CB 3.47Å; Y301-Y305 PolarHBondContact O-N 3.12Å
302R97.3Very high95.9Very high161 Ų161103.7 Ų103.761%0.60850%0.5SS*.Hα-helixtrans-63.3-33.6176.1-76.4173.8-179.8-167.62111.9Q298 A299 R306Q298-R302 WeakPolarHBondContact O-CB 3.11Å; Q298-R302 VanDerWaalsContact O-CG 3.25Å; Q298-R302 WeakPolarHBondContact O-CG 3.41Å; Q298-R302 PolarHBondContact O-N 3.36Å; A299-R302 CarbonylContact O-C 3.32Å; A299-R302 PolarHBondContact O-N 3.03Å; A299-R302 VanDerWaalsContact O-N 3.1Å; R302-R306 WeakPolarHBondContact O-CG 3.25Å; R302-R306 PolarHBondContact O-N 3.07Å; R302-R306 VanDerWaalsContact O-N 3.08Å; R302-R306 PolarHBondContact O-NH1 3.01Å
303D97.6Very high95.5Very high80 Ų80101 Ų10143%0.42850%0.498SS..Hα-helixtrans-74.5-49.4-179.5-7622.2000110.4A299 E300 Y301 Y305 R306 E307A299-D303 WeakPolarHBondContact O-CB 3.46Å; A299-D303 VanDerWaalsContact O-CG 3.29Å; A299-D303 PolarHBondContact O-N 3.3Å; A299-D303 VanDerWaalsContact O-OD1 3.12Å; E300-D303 PolarHBondContact O-N 3.33Å; Y301-D303 VanDerWaalsContact C-N 3.26Å; Y301-D303 PolarHBondContact O-N 3.48Å; D303-Y305 VanDerWaalsContact C-N 3.27Å; D303-Y305 PolarHBondContact O-N 2.84Å; D303-R306 PolarHBondContact O-N 2.9Å; D303-R306 VanDerWaalsContact O-N 3.14Å; D303-R306 IonicContact OD1-CZ 3.5Å; D303-R306 IonicContact OD1-NH1 2.71Å; D303-R306 PolarHBondContact OD1-NH1 3.39Å; D303-R306 IonicContact OD1-NH2 3.13Å; D303-R306 PolarHBondContact OD1-NH2 3.16Å; D303-R306 IonicContact OD2-NH2 2.71Å; D303-R306 PolarHBondContact OD2-NH2 2.88Å; D303-E307 PolarHBondContact O-N 3.13Å
304A97.3Very high94.6Very high58 Ų58103 Ų10348%0.47950%0.504SS..Hα-helixtrans-58.6-36.3172.200000112.6E300 E307 Y308E300-A304 WeakPolarHBondContact O-CB 3.35Å; E300-A304 PolarHBondContact O-N 3.4Å; A304-E307 PolarHBondContact O-N 3.24Å; A304-Y308 WeakPolarHBondContact O-CB 3.46Å; A304-Y308 PolarHBondContact O-N 2.96Å
305Y97.6Very high93.5Very high127 Ų127106.3 Ų106.350%0.49852%0.519SS..Hα-helixtrans-69.9-37.6175.8-171.3-108.7000112.8Y301 D303 I309Y301-Y305 VanDerWaalsContact O-CB 3.27Å; Y301-Y305 WeakPolarHBondContact O-CB 3.47Å; Y301-Y305 PolarHBondContact O-N 3.12Å; D303-Y305 VanDerWaalsContact C-N 3.27Å; D303-Y305 PolarHBondContact O-N 2.84Å; Y305-I309 HydrophobicContact CD1-CD1 3.88Å; Y305-I309 HydrophobicContact CE1-CD1 3.5Å; Y305-I309 VanDerWaalsContact CE1-CD1 3.5Å; Y305-I309 HydrophobicContact CE1-CG1 4.45Å; Y305-I309 WeakPolarHBondContact O-CG1 3.34Å; Y305-I309 PolarHBondContact O-N 2.79Å
306R96.8Very high91.9Very high142 Ų142110.6 Ų110.654%0.53654%0.536SS..Hα-helixtrans-66.3-39.1171.1-72.9-167.2-44-74.89.9111.7R302 D303 I309 A310R302-R306 WeakPolarHBondContact O-CG 3.25Å; R302-R306 PolarHBondContact O-N 3.07Å; R302-R306 VanDerWaalsContact O-N 3.08Å; R302-R306 PolarHBondContact O-NH1 3.01Å; D303-R306 PolarHBondContact O-N 2.9Å; D303-R306 VanDerWaalsContact O-N 3.14Å; D303-R306 IonicContact OD1-CZ 3.5Å; D303-R306 IonicContact OD1-NH1 2.71Å; D303-R306 PolarHBondContact OD1-NH1 3.39Å; D303-R306 IonicContact OD1-NH2 3.13Å; D303-R306 PolarHBondContact OD1-NH2 3.16Å; D303-R306 IonicContact OD2-NH2 2.71Å; D303-R306 PolarHBondContact OD2-NH2 2.88Å; R306-I309 PolarHBondContact O-N 3.01Å; R306-A310 PolarHBondContact O-N 3.01Å
307E95.8Very high90.1Very high115 Ų115107 Ų10754%0.53754%0.537SS..Hα-helixtrans-64.8-45.7175.7-161.2-167.6148.300111.3D303 A304 I309 A310 Q311D303-E307 PolarHBondContact O-N 3.13Å; A304-E307 PolarHBondContact O-N 3.24Å; E307-I309 VanDerWaalsContact C-N 3.32Å; E307-I309 PolarHBondContact O-N 3.47Å; E307-A310 CarbonylContact O-C 3.52Å; E307-A310 WeakPolarHBondContact O-CA 3.11Å; E307-A310 WeakPolarHBondContact O-CB 3.29Å; E307-A310 PolarHBondContact O-N 2.9Å; E307-Q311 HydrophobicContact CG-CG 4.5Å; E307-Q311 WeakPolarHBondContact O-CG 3.3Å; E307-Q311 PolarHBondContact O-N 2.89Å; E307-Q311 PolarHBondContact OE1-NE2 3.29Å
308Y96.1Very high87.5Confident127 Ų127105.7 Ų105.750%0.49854%0.541SS..Hα-helixtrans-56.1-44.5174.3173-103.1000112A304 A310 Q311 M312A304-Y308 WeakPolarHBondContact O-CB 3.46Å; A304-Y308 PolarHBondContact O-N 2.96Å; Y308-A310 VanDerWaalsContact C-N 3.33Å; Y308-A310 PolarHBondContact O-N 3.06Å; Y308-Q311 PolarHBondContact O-N 3.4Å; Y308-M312 HydrophobicContact CD1-CG 4.44Å; Y308-M312 HydrophobicContact CD2-CG 4.07Å; Y308-M312 HydrophobicContact CE1-CG 4.01Å; Y308-M312 HydrophobicContact CE2-CG 3.6Å; Y308-M312 HydrophobicContact CE2-SD 3.98Å; Y308-M312 HydrophobicContact CG-CG 4.46Å; Y308-M312 WeakPolarHBondContact O-CB 3.44Å; Y308-M312 WeakPolarHBondContact O-CG 3.4Å; Y308-M312 PolarHBondContact O-N 2.81Å
309I95.4Very high85.3Confident86 Ų86108.7 Ų108.744%0.44157%0.566SS.*Hα-helixtrans-61.3-41.7173.7-71168.4000111.1Y305 R306 E307 M312 S313Y305-I309 HydrophobicContact CD1-CD1 3.88Å; Y305-I309 HydrophobicContact CE1-CD1 3.5Å; Y305-I309 VanDerWaalsContact CE1-CD1 3.5Å; Y305-I309 HydrophobicContact CE1-CG1 4.45Å; Y305-I309 WeakPolarHBondContact O-CG1 3.34Å; Y305-I309 PolarHBondContact O-N 2.79Å; R306-I309 PolarHBondContact O-N 3.01Å; E307-I309 VanDerWaalsContact C-N 3.32Å; E307-I309 PolarHBondContact O-N 3.47Å; I309-M312 PolarHBondContact O-N 3.46Å; I309-S313 WeakPolarHBondContact O-CB 3.44Å; I309-S313 PolarHBondContact O-N 2.99Å
310A94.6Very high83Confident49 Ų49109.8 Ų109.841%0.40558%0.581SS.*Hα-helixtrans-67.7-34177.300000113.1R306 E307 Y308 Q314R306-A310 PolarHBondContact O-N 3.01Å; E307-A310 CarbonylContact O-C 3.52Å; E307-A310 WeakPolarHBondContact O-CA 3.11Å; E307-A310 WeakPolarHBondContact O-CB 3.29Å; E307-A310 PolarHBondContact O-N 2.9Å; Y308-A310 VanDerWaalsContact C-N 3.33Å; Y308-A310 PolarHBondContact O-N 3.06Å; A310-Q314 WeakPolarHBondContact O-CG 3.16Å; A310-Q314 PolarHBondContact O-N 3.27Å; A310-Q314 PolarHBondContact O-NE2 3.32Å
311Q93.9Very high80.3Confident104 Ų104109 Ų10949%0.48659%0.589SS.*Hα-helixtrans-69.4-46.7173.6-68.9178.614.700111.2E307 Y308 Q314 L315E307-Q311 HydrophobicContact CG-CG 4.5Å; E307-Q311 WeakPolarHBondContact O-CG 3.3Å; E307-Q311 PolarHBondContact O-N 2.89Å; E307-Q311 PolarHBondContact OE1-NE2 3.29Å; Y308-Q311 PolarHBondContact O-N 3.4Å; Q311-Q314 PolarHBondContact O-N 3.3Å; Q311-L315 PolarHBondContact O-N 3.2Å
312M87.9Confident78Confident84 Ų84107.4 Ų107.441%0.41460%0.602SS.*Hα-helixtrans-67.9-35.9178.5-67.3-58.1-64.100112.6Y308 I309 Q314 L315 E316Y308-M312 HydrophobicContact CD1-CG 4.44Å; Y308-M312 HydrophobicContact CD2-CG 4.07Å; Y308-M312 HydrophobicContact CE1-CG 4.01Å; Y308-M312 HydrophobicContact CE2-CG 3.6Å; Y308-M312 HydrophobicContact CE2-SD 3.98Å; Y308-M312 HydrophobicContact CG-CG 4.46Å; Y308-M312 WeakPolarHBondContact O-CB 3.44Å; Y308-M312 WeakPolarHBondContact O-CG 3.4Å; Y308-M312 PolarHBondContact O-N 2.81Å; I309-M312 PolarHBondContact O-N 3.46Å; M312-Q314 VanDerWaalsContact C-N 3.29Å; M312-Q314 PolarHBondContact O-N 2.71Å; M312-L315 HydrophobicContact CE-CD2 4.42Å; M312-L315 WeakPolarHBondContact O-CA 3.21Å; M312-L315 WeakPolarHBondContact O-CB 3.4Å; M312-L315 PolarHBondContact O-N 2.98Å; M312-E316 PolarHBondContact O-N 3.41Å
313S85.7Confident75.4Confident77 Ų77105.9 Ų105.954%0.53861%0.611SS.*Hα-helixtrans-59.5-37.3173.6179.40000112.4I309 L315 G317I309-S313 WeakPolarHBondContact O-CB 3.44Å; I309-S313 PolarHBondContact O-N 2.99Å; S313-L315 PolarHBondContact O-N 3.33Å; S313-G317 PolarHBondContact O-N 2.8Å
314Q76.6Confident72.9Confident150 Ų150110 Ų11070%0.70163%0.631SS**Hα-helixtrans-70.9-17.2173.2-73169.292.600113.7A310 Q311 M312A310-Q314 WeakPolarHBondContact O-CG 3.16Å; A310-Q314 PolarHBondContact O-N 3.27Å; A310-Q314 PolarHBondContact O-NE2 3.32Å; Q311-Q314 PolarHBondContact O-N 3.3Å; M312-Q314 VanDerWaalsContact C-N 3.29Å; M312-Q314 PolarHBondContact O-N 2.71Å
315L72.1Confident70Confident136 Ų136112.9 Ų112.971%0.71265%0.648SS**Hα-helixtrans-92.6-33.1178-162.668.9000112.3Q311 M312 S313Q311-L315 PolarHBondContact O-N 3.2Å; M312-L315 HydrophobicContact CE-CD2 4.42Å; M312-L315 WeakPolarHBondContact O-CA 3.21Å; M312-L315 WeakPolarHBondContact O-CB 3.4Å; M312-L315 PolarHBondContact O-N 2.98Å; S313-L315 PolarHBondContact O-N 3.33Å
316E62.7Low66.8Low182 Ų182110 Ų11085%0.8566%0.657SS**Hα-helixtrans-82.1-23.4173.4-164.9164.1-146.300112.4M312 G318M312-E316 PolarHBondContact O-N 3.41Å; E316-G318 PolarHBondContact O-N 3.13Å
317G58.7Low64.2Low58 Ų58115.2 Ų115.260%0.59868%0.677SS**SBendtrans-6866.6163.300000112.5S313S313-G317 PolarHBondContact O-N 2.8Å
318G44.1Very low61.2Low58 Ų58115.2 Ų115.260%0.59869%0.69SS**  trans-55.7152.2-166.300000116.2E316 G320E316-G318 PolarHBondContact O-N 3.13Å; G318-G320 PolarHBondContact O-N 2.94Å; G318-G320 VanDerWaalsContact O-N 3.07Å
319T51.5Low58Low160 Ų160114.8 Ų114.898%0.98271%0.705SS**SBendtrans-44.6106-175.351.50000114.6
320G47.5Very low55.7Low68 Ų68116 Ų11670%0.70172%0.718SS**  trans-160.9132175.100000114.1G318G318-G320 PolarHBondContact O-N 2.94Å; G318-G320 VanDerWaalsContact O-N 3.07Å
321S40.4Very low52.5Low103 Ų103122 Ų12272%0.7274%0.738SS**  trans6586.5170-160.70000118.5T323S321-T323 PolarHBondContact O-N 3.12Å
322S47.8Very low49.4Very low131 Ų131120.8 Ų120.892%0.91674%0.741SS**  trans-79.499.9159.9-51.80000111.3
323T43.6Very low46.6Very low129 Ų129122.5 Ų122.579%0.79176%0.756SS**  trans-139.6159170.445.20000112.5S321S321-T323 PolarHBondContact O-N 3.12Å
324I45.8Very low44.1Very low166 Ų166129.6 Ų129.685%0.85177%0.773SS**  trans-100.1157-159.3-164.1168.3000114.7
325S35Very low41.8Very low118 Ų118132.8 Ų132.883%0.82578%0.78SS**  trans85.3142155.8-154.20000118.9
326G31.4Very low40Very low68 Ų68134.7 Ų134.770%0.70179%0.789SS**  trans178.222.5-179.300000114S328G326-S328 PolarHBondContact O-N 2.89Å; G326-S328 VanDerWaalsContact O-N 3.11Å
327R40.8Very low38.4Very low251 Ų251129.1 Ų129.195%0.94778%0.781SS**  trans-85.480.5-172.9-170.2-175.5-171.8-97.65.9111.4
328S32.9Very low37.1Very low115 Ų115135.3 Ų135.380%0.80479%0.794SS**  trans-141.9121.2175.458.40000113.7G326G326-S328 PolarHBondContact O-N 2.89Å; G326-S328 VanDerWaalsContact O-N 3.11Å
329S30.6Very low36.4Very low117 Ų117137.9 Ų137.982%0.81880%0.803SS**  trans-151.9149.6165179.90000106.5
330P47.4Very low35.5Very low112 Ų112135.4 Ų135.473%0.72779%0.792SS**  cis-123.8-173.64.234.8-16.5000114
331H26.1Very low34.7Very low174 Ų174138.2 Ų138.281%0.80680%0.801SS**  trans125.4114.3131.3-160.471.1000117.9
332S28.3Very low34.3Very low79 Ų79137 Ų13755%0.55281%0.805SS**  trans67.5131149.7-1640000121
333T29.9Very low33.6Very low120 Ų120134.6 Ų134.674%0.73680%0.8SS**  -145.8106.2123.9-69.60000109.2Y335T333-Y335 HydrophobicContact CG2-CD2 4.29Å
334Y32.4Very low33.1Very low226 Ų226133.3 Ų133.389%0.88680%0.797SS**  trans-94.7138.2144.8-84.8-84.4000107.7
335Y29.9Very low32.6Very low218 Ų218131.9 Ų131.986%0.85579%0.789SS**  trans-70.7131.9-178.1-101.3-99.6000112.8T333T333-Y335 HydrophobicContact CG2-CD2 4.29Å
336I33Very low32.4Very low175 Ų175134 Ų13490%0.89779%0.786SS**  trans-174.1144.6135.7-99.3155.2000108.4
337G29.5Very low32.4Very low66 Ų66136.3 Ų136.368%0.6879%0.791SS**  trans111.273.416300000118
338Q30.9Very low31.8Very low188 Ų188131.3 Ų131.388%0.87978%0.783SS**  trans25.6113.3136.9-58.3173.7-11.300119.9
339S30.3Very low31.7Very low111 Ų111131.6 Ų131.678%0.77678%0.775SS**  147.1128.4119.1-65.50000116.2
340S31.1Very low31.7Very low109 Ų109133.3 Ų133.376%0.76277%0.77SS**  trans49.5120.3144.1-56.60000123.7
341S32Very low30.9Very low126 Ų126135.6 Ų135.688%0.88177%0.771SS**  trans53.7129.8139.761.30000120.5
342G31.9Very low31.1Very low79 Ų79134.2 Ų134.281%0.81477%0.765SS**  cis146.8126.213.800000111.5
343G32.4Very low31.3Very low79 Ų79141 Ų14181%0.81478%0.779SS**  trans83.4174.7168.600000117.2
344S34.3Very low31.4Very low103 Ų103139 Ų13972%0.7278%0.781SS**  cis-170.8117.1-12174.20000114
345I35.5Very low31.4Very low135 Ų135137.7 Ų137.769%0.69278%0.781SS**  trans67.8105.8136.8-59.2176.3000121.5
346H29.9Very low31.3Very low164 Ų164135 Ų13576%0.75978%0.776SS**  61.9148.5126.9-56.6-171.5000125.2
347S30.8Very low31.1Very low115 Ų115132.6 Ų132.680%0.80476%0.764SS**  trans69.7159.9137.456.80000120.9
348N28.3Very low31.1Very low146 Ų146136.8 Ų136.878%0.78177%0.767SS**  cis-176.8162.9-29.9-174.511.5000107.1
349L30.7Very low31.2Very low121 Ų121133.5 Ų133.563%0.63475%0.754SS**  trans89.1117.5150.7-154.669.6000119.9
350E30.4Very low31.2Very low153 Ų153136 Ų13672%0.71575%0.751SS**  trans62.1159.5146.8-72.5173.2172.100120
351Q30.4Very low31.2Very low161 Ų161138.8 Ų138.875%0.75275%0.752SS**  cis-164.4163.6-23.4175.1173.645.200108.8
352E30.1Very low31.1Very low144 Ų144140.1 Ų140.167%0.67375%0.745SS**  trans71160165.5-88.9-104.498.600119.3
353R32.6Very low31Very low222 Ų222142.8 Ų142.884%0.83874%0.736SS**  trans-61153.3-172.4-47157.3-155.9-115.9-0.3113
354G31.9Very low31.1Very low77 Ų77142.5 Ų142.579%0.79473%0.733SS**  trans168.7120.6153.800000114.4
355K33.8Very low31.3Very low200 Ų200145.8 Ų145.887%0.8773%0.729SS**  trans-60.7155.2174.5-57.7168171.7179.60112.6
356E26.8Very low31.4Very low161 Ų161148 Ų14875%0.75273%0.734SS**  trans90.8117.7138.1-156.5165.7158.700120.3
357N29.9Very low31.2Very low124 Ų124143.6 Ų143.666%0.66372%0.721SS**  trans63.9126147-60.4-9.4000124.3
358E29.6Very low31.1Very low155 Ų155147.2 Ų147.272%0.72472%0.723SS**  trans70.7118.3131.1-74.1-160.875.400124.5
359L32.6Very low31.3Very low118 Ų118146.9 Ų146.962%0.61872%0.721SS**  trans76.8108.7133.8-62.4-176.9000122.6
360K30.8Very low31.4Very low164 Ų164148.2 Ų148.271%0.71373%0.725SS**  78146.1123.8-74.6173.4176.4164.30121.3
361Q31.5Very low31.7Very low168 Ų168148.8 Ų148.879%0.78573%0.725SS**  trans70.4147.5153.5-77179.1-65.500117.4
362E29.3Very low32.1Very low154 Ų154151.2 Ų151.272%0.7273%0.728SS**  cis-154176.1-17.4-161.3160.4116.800110.3
363E30.3Very low32.1Very low134 Ų134147.4 Ų147.463%0.62673%0.727SS**  trans-41.2139.4177.5-171.5-177.7-172.600117.3R365E363-R365 VanDerWaalsContact CD-NH2 3.33Å; E363-R365 HydrophobicContact CG-CG 4.26Å; E363-R365 IonicContact OE1-CZ 2.8Å; E363-R365 IonicContact OE1-NE 3.78Å; E363-R365 PolarHBondContact OE1-NE 3.24Å; E363-R365 IonicContact OE1-NH2 3.18Å; E363-R365 PolarHBondContact OE1-NH2 3.46Å; E363-R365 IonicContact OE2-NH2 2.69Å; E363-R365 PolarHBondContact OE2-NH2 3.03Å
364G33Very low32.1Very low73 Ų73143.6 Ų143.675%0.75372%0.723SS**  trans-140.7-12.5-170.400000122
365R39.7Very low32.4Very low172 Ų172145.2 Ų145.265%0.64972%0.717SS**  trans38113.2162.6-55.6172.8178.8174.75.5120.9E363E363-R365 VanDerWaalsContact CD-NH2 3.33Å; E363-R365 HydrophobicContact CG-CG 4.26Å; E363-R365 IonicContact OE1-CZ 2.8Å; E363-R365 IonicContact OE1-NE 3.78Å; E363-R365 PolarHBondContact OE1-NE 3.24Å; E363-R365 IonicContact OE1-NH2 3.18Å; E363-R365 PolarHBondContact OE1-NH2 3.46Å; E363-R365 IonicContact OE2-NH2 2.69Å; E363-R365 PolarHBondContact OE2-NH2 3.03Å
366K36.3Very low32.7Very low183 Ų183143.3 Ų143.380%0.79672%0.716SS**  58157.4128.890.9-167.2172.5-179.30120.2
367S27Very low33Very low70 Ų70141.7 Ų141.749%0.4971%0.713SS.*  cis-179.9177.4-13.3450000108.9
368F27.4Very low33.1Very low192 Ų192146.8 Ų146.884%0.84272%0.724SS**  trans77.8156.3165.8-50.6-52.5000117.6
369L33.6Very low33.6Very low139 Ų139144.1 Ų144.173%0.72872%0.722SS**  cis-173.9147.2-24.3176.8113.6000109.5
370M32.3Very low33.7Very low149 Ų149143.9 Ų143.973%0.73473%0.731SS**  trans68162.7167.2-82.4174.263.200118.2
371K37.2Very low33.8Very low164 Ų164141.6 Ų141.671%0.71374%0.735SS**  cis167.8129.4-34.5167.9175.2176.2172.60109.6
372R38.7Very low33.9Very low213 Ų213136.9 Ų136.980%0.80473%0.732SS**  trans140.4143.8131.9-160.3-176.2-49.5-158.55.4115.1
373G30.1Very low34Very low64 Ų64136.4 Ų136.466%0.6674%0.739SS**  trans108.1136.4154.200000114.5
374D32.2Very low34.3Very low142 Ų142134.2 Ų134.276%0.75974%0.739SS**  cis-155.7143.1-11.5-104.1-13.7000107.7
375V39.2Very low34.2Very low110 Ų110137.6 Ų137.667%0.66775%0.745SS**  52.8126.6102.3-174.70000113
376L40.2Very low34Very low161 Ų161135.6 Ų135.684%0.84375%0.747SS**  cis-133.417636.3-167.754.5000113.9
377D31.5Very low34.1Very low127 Ų127134.7 Ų134.768%0.67975%0.746SS**  trans-135.1160.3-151.4-50.7-102.7000114.8
378Y32.8Very low34.4Very low230 Ų230136.3 Ų136.390%0.90276%0.763SS**  trans-141.5125.1150.5-156.7-93.3000113.1
379S39.2Very low34.7Very low99 Ų99132 Ų13269%0.69276%0.758SS**  trans-59.2173.7179.7-64.80000116
380S35.4Very low35.1Very low113 Ų113131.8 Ų131.879%0.7976%0.764SS**  cis168.7155.6-24.6-168.40000105.6
381S34.2Very low35.3Very low116 Ų116132.5 Ų132.581%0.81177%0.77SS**  cis-135.2-160.510.371.20000109.5
382G33.5Very low35.4Very low70 Ų70131.4 Ų131.472%0.72277%0.772SS**  cis-167.9167.56.700000111
383V30Very low35.9Very low143 Ų143127.2 Ų127.287%0.86777%0.773SS**  trans-113.5146.7-153.473.10000115.5
384S37Very low36.3Very low89 Ų89132 Ų13262%0.62278%0.781SS**  trans5.9141.3156-168.30000121.2
385T30.3Very low36.6Very low143 Ų143131.2 Ų131.288%0.87778%0.782SS**  trans-125138.214351.50000110.5
386N37Very low37Very low130 Ų130135.6 Ų135.670%0.69580%0.795SS**  trans-99.1174.5-178.3-145.855.1000111.6
387E37.6Very low37.7Very low165 Ų165136.4 Ų136.477%0.77179%0.794SS**  trans66105.4166.3-55.4-57146.600119.1
388A34Very low38.1Very low103 Ų103135.5 Ų135.585%0.85179%0.79SS**  trans-158.2141.1146.900000111.3
389S33.9Very low39Very low103 Ų103133.9 Ų133.972%0.7279%0.79SS**PPolyproline II helixtrans-65.6158.7176.3-60.10000113.1L391S389-L391 PolarHBondContact O-N 2.91Å
390P41.8Very low39Very low133 Ų133135.9 Ų135.986%0.86479%0.786SS**PPolyproline II helixtrans-61.4130.5173.126.8-35.2000111
391L34.9Very low38.9Very low164 Ų164135.9 Ų135.986%0.85979%0.787SS**PPolyproline II helixtrans-96.9150.9169.4-66.6174.3000109.7S389S389-L391 PolarHBondContact O-N 2.91Å
392D40Very low39Very low142 Ų142136.5 Ų136.576%0.75978%0.781SS**PPolyproline II helixtrans-61149.9-176.4-61.3-74.1000113.1I394D392-I394 PolarHBondContact O-N 3.46Å; D392-I394 VanDerWaalsContact O-N 3.07Å
393P49.7Very low39Very low125 Ų125140.7 Ų140.781%0.81278%0.782SS**  trans-64.4111174.627-33.8000110.5
394I38.8Very low39.1Very low164 Ų164139.6 Ų139.684%0.84178%0.78SS**  trans-60.5138.4178.849.5172.9000112.5D392D392-I394 PolarHBondContact O-N 3.46Å; D392-I394 VanDerWaalsContact O-N 3.07Å
395T37.2Very low38.8Very low126 Ų126139 Ų13977%0.77379%0.788SS**  trans-73.6134.1173.5460000111.5E397T395-E397 VanDerWaalsContact C-N 3.35Å; T395-E397 PolarHBondContact O-N 3.2Å
396E48.1Very low38.8Very low202 Ų202136.6 Ų136.694%0.94478%0.777SS**  trans-8363-174.957.4-171.6137.800114.2
397E54.1Low38.8Very low178 Ų178139.3 Ų139.383%0.83278%0.783SS**  trans-127.885.6176.7-66.5-165.3121.300113.4T395T395-E397 VanDerWaalsContact C-N 3.35Å; T395-E397 PolarHBondContact O-N 3.2Å
398D40.3Very low38.6Very low108 Ų108139.4 Ų139.458%0.57879%0.788SS**  trans-166.895.5151172.746000113.4K400D398-K400 PolarHBondContact O-NZ 2.95Å; D398-K400 PolarHBondContact OD1-N 2.95Å; D398-K400 WeakPolarHBondContact OD2-CD 3.41Å; D398-K400 IonicContact OD2-NZ 2.86Å; D398-K400 PolarHBondContact OD2-NZ 3.31Å
399E52Low38.6Very low196 Ų196142 Ų14292%0.91679%0.786SS**  trans-109.176.7155.3-162.5172.6131.600110.8
400K39.7Very low39.1Very low140 Ų140143 Ų14361%0.60979%0.79SS**  trans-38.2148.1171.552.5-98.9150.6-150.80115.7D398D398-K400 PolarHBondContact O-NZ 2.95Å; D398-K400 PolarHBondContact OD1-N 2.95Å; D398-K400 WeakPolarHBondContact OD2-CD 3.41Å; D398-K400 IonicContact OD2-NZ 2.86Å; D398-K400 PolarHBondContact OD2-NZ 3.31Å
401S32.5Very low38.4Very low114 Ų114139.9 Ų139.980%0.79778%0.783SS**  trans-148.2145.2144.6-80.90000112.7
402D35.7Very low38.3Very low128 Ų128141.7 Ų141.768%0.68478%0.783SS**  trans64.895.3159.3-68.5-37.1000123.7
403Q34.7Very low37.9Very low159 Ų159144 Ų14474%0.74379%0.787SS**  82.2142.9111.2-75.8-178.359.700123.1
404S31.5Very low36.7Very low120 Ų120143.7 Ų143.784%0.83979%0.788SS**  trans70.9141156-66.20000118.6
405G31.1Very low36.2Very low76 Ų76141.2 Ų141.278%0.78479%0.785SS**  trans165.7-22.5161.600000121.5
406S29.9Very low35.9Very low93 Ų93143.7 Ų143.765%0.6579%0.787SS**  trans38.7110.9161.91620000119.8
407K36.9Very low35.6Very low187 Ų187145.5 Ų145.581%0.81379%0.786SS**  trans93.8136.7141.3-67.7167-167165.70122
408L34.5Very low35.1Very low167 Ų167142.9 Ų142.987%0.87478%0.784SS**  trans84.9117.8148-70.8162.4000121.3
409L34.1Very low34.5Very low157 Ų157141.9 Ų141.982%0.82279%0.786SS**  trans-84.7-179.3149-46.9172.2000108.6
410P43.5Very low33.7Very low124 Ų124140.2 Ų140.281%0.80578%0.782SS**  cis-135.2172.2-6.440.7-24.5000115.7
411G27.8Very low33.5Very low68 Ų68140.7 Ų140.770%0.70178%0.784SS**  9498.6127.600000121.8
412K32.3Very low33.5Very low201 Ų201143.1 Ų143.187%0.87478%0.783SS**  trans53.5131.2137.6-65.9-179.5174.9176.10121.9
413K32.1Very low33.1Very low191 Ų191142.5 Ų142.583%0.8378%0.784SS**  trans72.1144.5143.670168.2176.7177.50121.2
414S24.8Very low32.8Very low119 Ų119141.2 Ų141.283%0.83278%0.783SS**  trans68.7152.4169.976.30000116.1
415S28.4Very low32.8Very low111 Ų111142 Ų14278%0.77678%0.776SS**  cis-154.8-177.8-24.9-155.30000109.7
416E29Very low32.8Very low178 Ų178146.3 Ų146.383%0.83277%0.774SS**  trans-65.1160-169.1-64.6164106.500118.2
417R43.6Very low33Very low241 Ų241149.8 Ų149.891%0.90978%0.784SS**  trans-35.4161.9156.5-85.8174.3166.5158.3-4.2114.7
418P41.7Very low32.7Very low123 Ų123150.6 Ų150.680%0.79979%0.787SS**  -147.8171.4107.339.1-25000117.4
419S28.1Very low32.5Very low87 Ų87146.1 Ų146.161%0.60878%0.782SS**  trans100.3100.1143.8-152.90000120.3
420L35.2Very low32.3Very low161 Ų161144.7 Ų144.784%0.84379%0.785SS**SBend-143.199.3111.4-159.474.2000109.4
421F36.6Very low31.8Very low149 Ų149142.3 Ų142.365%0.65478%0.783SS**  trans27.5113.9161.7-56.6-76.5000120.1
422Q31.3Very low32.2Very low166 Ų166146.5 Ų146.578%0.77679%0.788SS**  81.9126.273.2-172.2175.369.200111.3
423T29Very low32.3Very low115 Ų115147.6 Ų147.671%0.70679%0.787SS**  -146.2151.361.452.40000115.9
424D28.4Very low32.2Very low132 Ų132149.1 Ų149.171%0.70679%0.789SS**  trans34.6147.8137.4-69.7-52000123.8
425L31.3Very low32.6Very low135 Ų135151.8 Ų151.871%0.70779%0.788SS**  cis-171.7155.1-13.4-173.160.3000110.6
426K30.4Very low32.8Very low168 Ų168155.2 Ų155.273%0.7379%0.789SS**  trans65.4108.8160-89152.558.5-171.70119.9
427L34.4Very low33.3Very low166 Ų166154 Ų15487%0.86979%0.788SS**  53.1131.1115.3-93.3156.8000121.3
428K30.1Very low33.4Very low203 Ų203148 Ų14888%0.88378%0.78SS**  trans98.4121.7138.4-167.8-174.6-178.2-178.40118.6
429G30.3Very low32.9Very low73 Ų73146.9 Ų146.975%0.75378%0.775SS**  trans115.3146.1133.800000117.3
430S30.9Very low33.2Very low128 Ų128150 Ų15090%0.89579%0.785SS**  trans-63.9141166.4175.60000111.2
431G31.1Very low33.2Very low73 Ų73151.2 Ų151.275%0.75379%0.786SS**  trans-154.9111.9178.700000112.4
432L37Very low33.5Very low156 Ų156151.9 Ų151.982%0.81780%0.797SS**  trans-73.5-176.5170.3-65.6165.8000111.7
433R35.1Very low34.1Very low224 Ų224152.6 Ų152.685%0.84580%0.8SS**  trans94.778.3157.284.3-123.8-76163.2-4.4120.1
434Y30.2Very low34.5Very low223 Ų223152.8 Ų152.888%0.87581%0.806SS**  39.2150.8115.8-77-75.9000123.3
435Q32.1Very low34.8Very low176 Ų176149.5 Ų149.582%0.82280%0.803SS**  trans83.3145.5169.1-54.2-157.83.500114.9
436K33.2Very low35.1Very low182 Ų182148.9 Ų148.979%0.79181%0.805SS**  cis-147.1135.627.9-175156.8179.8176.90115.6
437L39.4Very low35.4Very low154 Ų154148.6 Ų148.681%0.80681%0.806SS**  trans-83.7159.7162-55169000109.6
438P45.6Very low35.6Very low114 Ų114148.2 Ų148.274%0.7480%0.8SS**  -141.9179.775.325.2-1.9000112.8
439S30.3Very low36Very low99 Ų99143.9 Ų143.969%0.69280%0.796SS**  cis-162.4152.2-22.5-94.10000105.5
440D34.8Very low36Very low152 Ų152145.4 Ų145.481%0.81379%0.786SS**  cis79.58335.8-168.445.8000113.2
441E36.3Very low35.9Very low188 Ų188146.7 Ų146.788%0.87978%0.783SS**  trans-150.4162.6162.6-69.3-164.213400108.9
442D42.2Very low35.9Very low163 Ų163148.5 Ų148.587%0.87278%0.78SS**  trans64.179.9-160.8-72.4-21000113.1
443E43.2Very low36.4Very low180 Ų180146.6 Ų146.684%0.84178%0.777SS**  cis68.7141.427.3-167157.7115.500116.4
444S38Very low36.3Very low119 Ų119143.6 Ų143.683%0.83278%0.777SS**  trans69.4136.4-176.8770000116.6
445G35.1Very low36.3Very low63 Ų63139.6 Ų139.665%0.64977%0.77SS**  cis-179.6148.5-6.900000112.8
446T37Very low36.3Very low122 Ų122138.6 Ų138.675%0.74876%0.762SS**  trans25.3161.5132.757.70000121.2
447E37.4Very low36.1Very low162 Ų162135.1 Ų135.176%0.75775%0.753SS**  cis-139.3142.910.114.6-108.688.200108.8
448E38.2Very low35.9Very low159 Ų159134.7 Ų134.774%0.74375%0.751SS**  79.9118.564.5-172.1-175.5116.400115.2D450E448-D450 HydrophobicContact CG-CB 4.33Å
449S37.8Very low35.2Very low112 Ų112138.2 Ų138.278%0.78376%0.755SS**  trans178.376.4132.240.70000107.3
450D31.6Very low35.5Very low104 Ų104138.6 Ų138.656%0.55675%0.749SS**  12.6125.977.7-147.9-23.6000115.8E448 T452E448-D450 HydrophobicContact CG-CB 4.33Å; D450-T452 PolarHBondContact OD1-N 3.03Å; D450-T452 PolarHBondContact OD1-OG1 3.19Å
451N28.4Very low35.6Very low155 Ų155138.6 Ų138.683%0.82974%0.742SS**  trans-156.5106.1131.4-115.5-97.5000108.1
452T32Very low35.5Very low112 Ų112138.6 Ų138.669%0.68774%0.739SS**  trans-70.6158.2177.117.60000111.8D450D450-T452 PolarHBondContact OD1-N 3.03Å; D450-T452 PolarHBondContact OD1-OG1 3.19Å
453P46.9Very low35.1Very low116 Ų116135.1 Ų135.175%0.75373%0.733SS**  trans-81.8152.8-170.533.8-36.1000112.4
454L32.6Very low34.4Very low161 Ų161135.1 Ų135.184%0.84373%0.733SS**  trans-159.6134.9155.4-102.7166.5000113.3
455L29.3Very low34.1Very low138 Ų138133 Ų13372%0.72373%0.73SS**  trans31.6108.2152.9-65.6172.3000123.3
456K32.2Very low34Very low155 Ų155139.9 Ų139.967%0.67474%0.742SS**  71.9160.5101-123.3176.4153.4-87.10122.5
457D29.6Very low33.7Very low109 Ų109138.7 Ų138.758%0.58375%0.745SS**  trans6496.2159.7-56.3-30.8000117
458D36.1Very low33.2Very low145 Ų145137.8 Ų137.878%0.77574%0.74SS**  97.696.671.4-100.2-54.3000114.7
459K30.9Very low32.9Very low189 Ų189140 Ų14082%0.82274%0.742SS**  trans-162.6108152-130.6139.5-176.1172.60109.1
460D36.1Very low32.5Very low106 Ų106140.8 Ų140.857%0.56774%0.741SS**  65.2135.988.2-77.4-18.1000114.6
461K37.6Very low32.5Very low152 Ų152139.8 Ų139.866%0.66175%0.748SS**  cis-166.4137.92.9-123.4162.5-178.677.90111.5
462K32.7Very low32.4Very low188 Ų188142.3 Ų142.382%0.81775%0.752SS**  trans61.3167.6152.9-67-177.4172.3-166.40116.5
463A35.6Very low32.1Very low90 Ų90142.2 Ų142.274%0.74476%0.756SS**  cis-146.7166.51400000109.4
464E28.2Very low31.7Very low180 Ų180141 Ų14184%0.84175%0.747SS**  cis-169156.5-18.2164.6162.8-135.300107.5
465G31.9Very low31.4Very low76 Ų76141.4 Ų141.478%0.78475%0.745SS**  trans166.599.317200000113.7
466K32.9Very low31.3Very low207 Ų207142.4 Ų142.490%0.975%0.746SS**  trans-112.1133.9177.6-78.8-175.4175-177.90112.2
467A29.1Very low31.2Very low96 Ų96140 Ų14079%0.79375%0.749SS**  trans-166.3161.4146.500000108.9
468E27.3Very low31.2Very low143 Ų143141 Ų14167%0.66876%0.758SS**  cis-166.1135.6-38.8-175.3172.7132.400108.3
469R33.2Very low30.8Very low207 Ų207142.6 Ų142.678%0.78176%0.761SS**  trans66.7135.6159.4-88.9-173.9-108.7-152-1122.9
470V29.2Very low31.8Very low127 Ų127138.4 Ų138.477%0.7775%0.753SS**  trans92.9113.4137.5168.80000121.2
471A30.8Very low31.6Very low84 Ų84140.6 Ų140.669%0.69476%0.763SS**  trans59138.4148.900000120.4
472K27Very low31.6Very low208 Ų208143.9 Ų143.990%0.90477%0.771SS**  cis-153.4159.9-2.1-116.4169.8-177.2179.80109.7
473S24.5Very low31.8Very low110 Ų110140.6 Ų140.677%0.76977%0.768SS**  trans-105-172.1-177.459.80000111.2
474P38.9Very low31.9Very low89 Ų89145.4 Ų145.458%0.57877%0.772SS**  cis-140.9-168.23.443.3-23.6000116.5
475E25.7Very low32.6Very low170 Ų170144.6 Ų144.679%0.79477%0.772SS**  trans70.4144.4148-78.7152.1-153.600120.5
476H28.9Very low32.7Very low159 Ų159150.1 Ų150.174%0.73677%0.774SS**  cis-154146.7-15.6-161.2-61.6000109.1
477S28.5Very low32.8Very low106 Ų106144.5 Ų144.574%0.74177%0.766SS**  trans-102.3136.7171.152.20000111.7
478V29.5Very low32.9Very low130 Ų130147.1 Ų147.179%0.78876%0.76SS**  trans-147.9141.6168-162.70000109.9
479E27.6Very low33.4Very low177 Ų177146.7 Ų146.783%0.82776%0.758SS**  trans-86.5-125.5165.4-62.5180121.900110.8
480P53.6Low33.6Very low101 Ų101145.6 Ų145.666%0.65676%0.755SS**  -118.3170.3-10029.7-12.1000113.5
481I31.1Very low34Very low152 Ų152146.8 Ų146.878%0.77976%0.756SS**  trans-128127.6151.6-78.494.5000110.1
482R38.5Very low34.2Very low221 Ų221146.8 Ų146.883%0.83475%0.751SS**  trans-93.4139.1157.5-67.3173.9174.2162.5-3.5108.3
483T35.9Very low34.6Very low120 Ų120143.8 Ų143.874%0.73675%0.745SS**  trans-136.399.5162.48.30000110.5
484F37.2Very low35.2Very low191 Ų191142.8 Ų142.884%0.83874%0.743SS**  trans-69.5126.2158.7-69.3-96.9000108.1
485I43.1Very low35.4Very low163 Ų163145.7 Ų145.784%0.83675%0.753SS**  trans-119.5138.3153.1-65-174.3000108.2
486K35.1Very low36.5Very low192 Ų192144.9 Ų144.984%0.83575%0.753SS**  trans-109.6165.3-169.6168.8-176.7174.6-1770108.1
487A33.5Very low37.5Very low89 Ų89144.1 Ų144.174%0.73676%0.755SS**  trans73159.3165.800000115.4
488K32.8Very low38.1Very low150 Ų150148.6 Ų148.665%0.65276%0.761SS**  cis174.3159.9-18.1-177.7-153.8161.2-147.90104.7
489E36.3Very low39.4Very low134 Ų134150.9 Ų150.963%0.62676%0.76SS**  trans74.1153.7164.7-42.2-158.5105.100116
490Y37.5Very low39.8Very low185 Ų185149.6 Ų149.673%0.72576%0.759SS**  cis-165129.3-33-121.6-93.7000105.9
491L37Very low39.1Very low151 Ų151149.2 Ų149.279%0.79176%0.759SS**  trans61.8160.2162.6-60.9163.5000117
492S35.4Very low40Very low84 Ų84147.1 Ų147.159%0.58776%0.758SS**  cis-153.9164.8-21.5-125.30000109.7
493D36.3Very low40.1Very low146 Ų146143.5 Ų143.578%0.78176%0.755SS**  trans19116.4148.4-50.7-70.9000119.9
494A36Very low40.6Very low88 Ų88143.5 Ų143.573%0.72776%0.76SS**  178135.9105.700000114.4
495L43.9Very low40.8Very low150 Ų150137.8 Ų137.879%0.78576%0.755SS**  trans47.7114.9139.8-58.6170.8000121.5
496L49Very low41.1Very low153 Ų153136.6 Ų136.680%0.80176%0.755SS**  56.7114.5127.9-61.2173.1000121.2
497D49.2Very low41.6Very low143 Ų143138.9 Ų138.977%0.76576%0.758SS**  53.583.4125.9-170.934.7000119.7
498K40.8Very low42.1Very low200 Ų200139.8 Ų139.887%0.8776%0.759SS**  trans-143.3127.4137.2-65.1-166.8180175.30106.9
499K58.2Low42.2Very low178 Ų178140.1 Ų140.177%0.77477%0.768SS**  80.7104.254.3-178.1174.8176.1171.70113.7
500D35.9Very low42.4Very low151 Ų151141.8 Ų141.881%0.80778%0.775SS**  trans-173.1162.1146.6-99.5-31.9000108.1
501S37.8Very low42.4Very low93 Ų93137.2 Ų137.265%0.6577%0.771SS**  cis178.8159.4-32.9-89.50000106
502S49.9Very low42.4Very low108 Ų108135.7 Ų135.776%0.75577%0.772SS**  cis-95.9-1711.2-650000111.5
503D40.6Very low42.9Very low145 Ų145137.3 Ų137.378%0.77578%0.781SS**  cis80.9106.218.3-179.847.9000118.6
504S46.9Very low43.1Very low120 Ų120138 Ų13884%0.83979%0.785SS**  trans162.1150.6137.248.50000109.7
505G42.4Very low42.9Very low71 Ų71142.8 Ų142.873%0.73279%0.792SS**  cis-171128.8-10.300000109.2
506V48.6Very low42.6Very low137 Ų137140.2 Ų140.283%0.8379%0.786SS**  trans-72.4148.2-170.2-66.50000114.1
507R46.3Very low42Very low241 Ų241140.4 Ų140.491%0.90979%0.787SS**  -170.2123.7128.6-105.8160.1-177.6119.7-0.3113.6
508S43.8Very low41.1Very low107 Ų107141.1 Ų141.175%0.74879%0.786SS**  trans-100.4159.1155.1-52.80000108.7
509N34.2Very low40.7Very low157 Ų157138.4 Ų138.484%0.8478%0.78SS**  170.1101.7127.9-87.911.2000113.4
510E41.8Very low40Very low169 Ų169138.7 Ų138.779%0.7979%0.785SS**  trans-42142.5130.5-163.360.4-107.100109.8
511S37Very low39.9Very low90 Ų90136.1 Ų136.163%0.62978%0.784SS**  cis-159.1178.21.9-150.50000109.7
512S35.9Very low39.8Very low118 Ų118136.1 Ų136.183%0.82579%0.79SS**  trans-169.6144.3152.7-84.80000114.3
513P47.5Very low38.9Very low118 Ų118138.5 Ų138.577%0.76679%0.794SS**  trans-108.8159.5-177.740.3-34.8000116.5
514N39.8Very low38.4Very low161 Ų161138 Ų13886%0.86179%0.792SS**  trans16.3128.2155-67.9-34.7000122
515H31.5Very low37.7Very low189 Ų189137 Ų13788%0.87579%0.785SS**  -149.2162.2127.3-142.3-83.5000111.2
516S38.3Very low37.2Very low95 Ų95141.4 Ų141.466%0.66479%0.786SS**  trans-129.2146.5175.5179.60000110.8
517L35.5Very low36.7Very low158 Ų158141.5 Ų141.583%0.82778%0.781SS**  trans170.6137.2134.3-94.4170.6000113.6
518H30.2Very low36.1Very low158 Ų158138.4 Ų138.473%0.73178%0.777SS**  trans56.8109.6133.5-159.164.4000121.6
519N32.6Very low35.9Very low142 Ų142142.7 Ų142.776%0.75978%0.782SS**  -166.7150.8112.2-113.615.4000111.7
520E44Very low35.9Very low184 Ų184139.1 Ų139.186%0.8678%0.775SS**  trans-107.3155.8165.3-67.8-173.291.500110.4
521A33.5Very low35.6Very low97 Ų97138.3 Ų138.380%0.80278%0.776SS**  trans149.7132.5132.800000113.7
522A36Very low35.6Very low93 Ų93141.9 Ų141.977%0.76979%0.787SS**  trans63.7161.315900000117.6
523D30.4Very low35.7Very low159 Ų159143.7 Ų143.785%0.8579%0.786SS**  cis-145.4-174.21.8-148.2-4000113.2
524D29.2Very low35.2Very low134 Ų134146.3 Ų146.372%0.71779%0.788SS**  trans-78.2154.4-157.7-139.3-32000119.4
525S34.2Very low35.2Very low99 Ų99145.7 Ų145.769%0.69278%0.784SS**  trans73.8154.3135.8-87.10000127.1
526Q31.1Very low35.1Very low163 Ų163145.2 Ų145.276%0.76278%0.782SS**  trans101.6112.1146-92.7-168.4-124.900123.8
527L37.9Very low35.2Very low140 Ų140147.8 Ų147.873%0.73379%0.788SS**  trans74.8153.6147.6-54.4-176.4000118.9
528E33.2Very low35.1Very low176 Ų176147.2 Ų147.282%0.82278%0.781SS**  cis-139.7179.67.3-144.6177.6164.800114
529K39.7Very low35.2Very low197 Ų197142.5 Ų142.586%0.85778%0.775SS**  trans-91.9159.5-167.8-59.2168.7176171.40114.7
530A35.3Very low35.3Very low82 Ų82143.2 Ų143.268%0.67877%0.774SS**  -169.1141.5119.600000113.9
531N34.9Very low34.7Very low152 Ų152140.6 Ų140.681%0.81378%0.776SS**  trans57.396.6158.9-50.2-28.6000117.9
532L36.3Very low34.6Very low165 Ų165139.5 Ų139.586%0.86477%0.774SS**  46129.165.5-122.373.5000112.4
533I38.7Very low34.8Very low155 Ų155144.3 Ų144.380%0.79578%0.777SS**  cis-147.5154.439.3-72.2173.9000111.9
534E37.8Very low35Very low174 Ų174148.5 Ų148.581%0.81378%0.781SS**  trans-116.5178.2166.4-175.1173.1-14900109.7
535L38.8Very low35.1Very low148 Ų148145.5 Ų145.578%0.77578%0.782SS**  trans103.4148.1-173.6-57.5161.6000112.5
536E30.4Very low35.3Very low179 Ų179149.4 Ų149.484%0.83679%0.791SS**  cis-150.2-170.313.4-141.3149.7-120.600112.9
537D39.2Very low36.2Very low148 Ų148146.7 Ų146.779%0.79179%0.788SS**  trans-120.6167.3-160.3-175.732.7000115.8
538E34.1Very low35.9Very low147 Ų147148.3 Ų148.369%0.68779%0.791SS**  trans63.2163.1158.7-111.1-103.468.800120.8H540E538-H540 IonicContact OE1-CE1 3.13Å; E538-H540 PolarHBondContact OE1-CE1 3.47Å; E538-H540 IonicContact OE1-ND1 3.97Å; E538-H540 PolarHBondContact OE1-ND1 3.03Å; E538-H540 IonicContact OE2-CE1 2.63Å
539G31.6Very low35.7Very low59 Ų59144.3 Ų144.361%0.60878%0.783SS**  trans131.459.9155.100000123
540H35.8Very low35.5Very low156 Ų156142.7 Ų142.772%0.72278%0.783SS**  trans53.2120131.9-68.980000124.8E538E538-H540 IonicContact OE1-CE1 3.13Å; E538-H540 PolarHBondContact OE1-CE1 3.47Å; E538-H540 IonicContact OE1-ND1 3.97Å; E538-H540 PolarHBondContact OE1-ND1 3.03Å; E538-H540 IonicContact OE2-CE1 2.63Å
541S30.1Very low35.3Very low130 Ų130144.7 Ų144.791%0.90979%0.792SS**  trans91.7144.3133.3850000123.3
542G32.2Very low35Very low73 Ų73140.6 Ų140.675%0.75379%0.785SS**  trans157.7136.2171.200000112.8
543K39.5Very low34.9Very low194 Ų194140.8 Ų140.884%0.84379%0.787SS**  trans-141151.2-174.5-68.1-174.4-179.7179.10115.2
544R35.2Very low34.6Very low247 Ų247141.1 Ų141.193%0.93279%0.785SS**  trans88.9141.6166.8-60.7169.1-76.5-156.2-2.9115.7
545G30.6Very low34.3Very low71 Ų71140 Ų14073%0.73278%0.784SS**  cis175.8167-5.800000114
546M38.4Very low34.8Very low181 Ų181137.3 Ų137.389%0.89278%0.776SS**  trans-81.1166.9171.7-5095.783.100111.5
547P51.5Low35.1Very low106 Ų106135 Ų13569%0.68877%0.774SS**  -141.8162.996.334.9-19.3000116
548H30.1Very low35Very low174 Ų174134.4 Ų134.481%0.80677%0.769SS**  trans25.3148139.2-52.5-44.1000122.1
549S30.4Very low35Very low93 Ų93131.1 Ų131.165%0.6577%0.767SS**  cis-178.9178.7-8.8-94.20000109.3
550L35.3Very low35.3Very low162 Ų162137.5 Ų137.585%0.84877%0.773SS**  trans93.9138.7157.1-50.2-179.5000119.1
551S30.7Very low35.2Very low124 Ų124138.2 Ų138.287%0.86778%0.778SS**  trans23.5143.7151.2-51.50000121.8
552G29.4Very low35.5Very low66 Ų66136.9 Ų136.968%0.6877%0.769SS**  cis134.7168.26.600000112.1
553L32.6Very low35.9Very low170 Ų170140.8 Ų140.889%0.8977%0.771SS**  trans84.5160.4-179.6-69.8156.6000118.5
554Q32.8Very low35.7Very low162 Ų162137.1 Ų137.176%0.75777%0.768SS**  trans-80.8139.1-163.7-80.38824.300116.5
555D31.2Very low36Very low150 Ų150129.2 Ų129.280%0.80275%0.751SS**  62.4-175.2119-137.235.4000117.8
556P50.5Low36.4Very low92 Ų92133.4 Ų133.460%0.59775%0.752SS**  -124.5171.4-97.240.5-26.8000117.1
557V36.7Very low36.6Very low131 Ų131130.5 Ų130.579%0.79474%0.74SS**  trans70.8130.7165.8-1590000117.5
558I36.5Very low36.1Very low134 Ų134133.6 Ų133.669%0.68774%0.743SS**  trans159.6119130.5-81.9162.9000112.2R560I558-R560 PolarHBondContact O-NH2 2.81Å
559A33.9Very low36.7Very low78 Ų78134.7 Ų134.765%0.64575%0.745SS**  trans59.9152.2160.300000117.6
560R38.8Very low37.1Very low194 Ų194135.4 Ų135.473%0.73275%0.75SS**  cis-173.915142.151.4-134.768.1-168.6-2.8112.5I558I558-R560 PolarHBondContact O-NH2 2.81Å
561M31.9Very low37.9Very low170 Ų170133.2 Ų133.284%0.83775%0.746SS**  trans140.2130.7139.1-77.4156.360.500115.4
562S37.9Very low38.2Very low102 Ų102131.5 Ų131.571%0.71373%0.733SS**  trans63.6130.7157-53.70000119
563I40.8Very low38.5Very low155 Ų155137.1 Ų137.180%0.79574%0.742SS**  cis54.4133.92.869.1168.8000117.6
564C35.1Very low38.4Very low117 Ų117134.5 Ų134.579%0.79174%0.736SS**  cis-158.9-173.7-14.5-980000106.5
565S41.5Very low38.3Very low82 Ų82131.4 Ų131.457%0.57373%0.733SS**  cis-161.7-176.510.7-150.10000110.4
566E38.8Very low38.5Very low158 Ų158132.2 Ų132.274%0.73874%0.736SS**  trans64.2158.5155.7-92.898.2-91.500119.2
567D42.9Very low37.8Very low120 Ų120135.7 Ų135.764%0.64275%0.748SS**  cis-172151.9-12.7-118.7-0.2000107.1
568K40.2Very low37.6Very low172 Ų172133.6 Ų133.675%0.74875%0.745SS**  cis-137.9-159.8-12.1-73-150.9179.2-165.50106.5
569K42.5Very low37.2Very low196 Ų196133 Ų13385%0.85275%0.753SS**  cis-155.912611.4-170.7178.7-180-178.70110.9
570S39.5Very low37.2Very low108 Ų108134.8 Ų134.876%0.75576%0.76SS**  trans-84.1-173.4177.9-13.90000112.1
571P51.7Low38.2Very low117 Ų117130.2 Ų130.276%0.7676%0.755SS**  cis-123.7-164.23.433.4-9000112.1
572S36.3Very low38.4Very low87 Ų87130.7 Ų130.761%0.60876%0.756SS**  cis-158.3150.219.2-23.30000114.2
573E37.3Very low38.6Very low185 Ų185134.3 Ų134.386%0.86476%0.761SS**  trans56.8141.5136.3-63.6165.9166.400120.3
574C30.4Very low38.1Very low114 Ų114131.7 Ų131.777%0.7776%0.757SS**  cis-153.716917.6-142.30000114.2
575S29.6Very low38.1Very low98 Ų98137.8 Ų137.869%0.68576%0.763SS**  trans-0.7132.1169.3-55.30000121.2
576L35Very low38.2Very low166 Ų166139 Ų13987%0.86977%0.769SS**  75.7102.852.4-67.7175.7000116.8
577I35.8Very low37.7Very low165 Ų165136.4 Ų136.485%0.84677%0.769SS**  -170.1123.7127.236.6173.9000107.5
578A32.5Very low37Very low88 Ų88136.3 Ų136.373%0.72778%0.776SS**  72.1125.272.700000113.4
579S28.8Very low36.5Very low122 Ų122136.5 Ų136.585%0.85378%0.78SS**  cis-158.6167-0.7-79.70000112.7
580S32.9Very low36Very low114 Ų114135.7 Ų135.780%0.79778%0.776SS**  trans-94.7-171166.2-139.20000110.4
581P59.9Low35.7Very low98 Ų98135.1 Ų135.164%0.63678%0.778SS**  cis-138.5177.7-7.839.4-19000117
582E37.3Very low35Very low181 Ų181139 Ų13985%0.84678%0.779SS**  trans31.6139.1140.5-60.7168.3113.800125
583E41.2Very low34.8Very low177 Ų177141.9 Ų141.983%0.82779%0.787SS**  142.4130.2112.4-165.4168.2165.300118.7
584S30Very low35Very low101 Ų101141 Ų14171%0.70679%0.788SS**  trans66.4151.7153.3-72.60000125.7
585W36.6Very low35.1Very low244 Ų244142.4 Ų142.492%0.92479%0.788SS**  trans-102.9-175.3179.1-66.289000110.8
586P43.2Very low35.4Very low108 Ų108148.4 Ų148.470%0.70180%0.795SS**  cis-145.4168.18.743.4-23.3000120.2
587S28.8Very low35.2Very low104 Ų104145.5 Ų145.573%0.72779%0.785SS**  trans73.8127140.469.40000124.4
588C27.1Very low35.2Very low118 Ų118144.3 Ų144.380%0.79779%0.788SS**  trans79.7114.2140.2-157.90000121.3
589Q30.1Very low35.1Very low175 Ų175144.6 Ų144.682%0.81879%0.785SS**  -167152.5116.1-109.2-178.748.400114.6
590K31.5Very low35.3Very low180 Ų180145.7 Ų145.778%0.78379%0.786SS**  trans65.5116.9159.9-113169.7-176.8170.40119.3
591A32.9Very low35.8Very low96 Ų96145.8 Ų145.879%0.79378%0.782SS**  trans-101150.9160.100000110.9
592Y37.3Very low34.8Very low198 Ų198146.5 Ų146.578%0.77678%0.784SS**  trans-146.5136.215832.3-96.9000109.7
593N32.3Very low34.8Very low147 Ų147145 Ų14579%0.78678%0.781SS**  trans-83.6131.4-174.5-75.2-79.3000111.5
594L41.7Very low34.1Very low166 Ų166144.5 Ų144.587%0.86978%0.784SS**  trans-133.1102.9162.5-86170.4000109.5
595N33.3Very low34.4Very low145 Ų145145.5 Ų145.578%0.77578%0.782SS**  trans-88.9102.6174.1-77.7-71.8000110.2
596R34.4Very low34.1Very low223 Ų223141.4 Ų141.484%0.84278%0.778SS**  trans178.5126.8137.1-104168.9-173.1-91.3-0.5115
597T32.6Very low33.5Very low106 Ų106142.7 Ų142.765%0.6578%0.784SS**  trans34.6113.9138.957.60000120.2
598P34.7Very low33.7Very low139 Ų139141.7 Ų141.790%0.90378%0.782SS**  trans-78.9119.4148.332.4-28.6000109.9
599S30.2Very low34.8Very low95 Ų95141.6 Ų141.666%0.66478%0.78SS**  trans-148.7119.7163.3-176.90000109.1
600T33.7Very low34.8Very low145 Ų145138.7 Ų138.789%0.8978%0.775SS**  trans-135.699.3179.850.90000108.1
601V42.4Very low34.6Very low115 Ų115137.3 Ų137.370%0.69778%0.776SS**  trans-95.7113.1-170.3171.20000110.3
602T39.4Very low34.6Very low113 Ų113144 Ų14469%0.69378%0.78SS**  trans41.6150.9145.669.50000120.1
603L37.2Very low34.2Very low150 Ų150138.4 Ų138.479%0.78578%0.775SS**  -174.2150.681.4-85171.9000110.6
604N27.3Very low34.1Very low167 Ų167138.1 Ų138.189%0.89377%0.773SS**  trans-133.7149.2142.8-168.212.8000107.4
605N34.9Very low33.7Very low122 Ų122137.2 Ų137.265%0.65277%0.765SS**  trans-140.3142.5-157-173.95.5000111
606N31.5Very low33.3Very low157 Ų157137.8 Ų137.884%0.8477%0.768SS**  trans-159.195.1162.6-123.8-17000113.2
607T29.5Very low33.2Very low135 Ų135135.6 Ų135.683%0.82877%0.765SS**  trans-156.1133.6143.6-68.60000108.8
608A32.8Very low33Very low84 Ų84136.7 Ų136.769%0.69477%0.767SS**  trans-15415917800000107.5
609P51.4Low32.9Very low116 Ų116137.5 Ų137.575%0.75376%0.758SS**  cis-116.9-171.914.143.2-29.3000112.2
610T29.4Very low33.1Very low114 Ų114139.3 Ų139.370%0.69976%0.759SS**  -170.6154.975.3-45.20000111.2
611N28.4Very low33Very low150 Ų150140.9 Ų140.980%0.80276%0.757SS**  trans76.790.9166.4-64-33000121
612R32.3Very low32.3Very low237 Ų237138.4 Ų138.489%0.89475%0.754SS**  -16.3162.6125.1-79.1178.7172.6176.1-3.4117.1
613A28.7Very low32Very low80 Ų80138.3 Ų138.366%0.66175%0.753SS**  cis-168.1154.4-6.900000107.9
614N29.6Very low31.7Very low141 Ų141140.3 Ų140.375%0.75475%0.75SS**  50.6124.370.8-96.9-6.6000113.7
615Q33.5Very low31.8Very low148 Ų148138.5 Ų138.569%0.69274%0.736SS**  cis-160.3163.8-9.4-66.1-173.5-14.100109.1
616N25.5Very low31.5Very low156 Ų156138.6 Ų138.683%0.83474%0.741SS**  -171.9169.3111.9-111.1-73.9000116.8
617F32.9Very low31.3Very low177 Ų177136.3 Ų136.378%0.77674%0.738SS**  trans-74.1159.3-172.3-125.4-119.2000115
618D27.8Very low31.4Very low130 Ų130138.5 Ų138.570%0.69574%0.739SS**  -164.8174.8125.8-126.2-36.3000112.5
619E31.7Very low31.1Very low155 Ų155140.5 Ų140.572%0.72474%0.742SS**  trans-94.4164.6-155.7-155.9176.497.900118.4
620I35.2Very low30.1Very low133 Ų133141.6 Ų141.668%0.68274%0.74SS**  trans104.3136.9139.8-118.3171.5000122
621E31.2Very low30.1Very low179 Ų179144 Ų14484%0.83675%0.748SS**  trans51.7153164.5-71.8-172.7140.200122.1
622G29.1Very low30.3Very low63 Ų63147.8 Ų147.865%0.64975%0.751SS**  cis159.5-179.3-4.600000113.9
623V32.2Very low30.2Very low110 Ų110142.9 Ų142.967%0.66775%0.749SS**  trans74.997.6168.2-1730000116.2
624R32Very low30.2Very low193 Ų193142 Ų14273%0.72875%0.748SS**  77150.187.7-69.1-174.6-63.2133-12.9114.3
625E28.1Very low30.6Very low129 Ų129141.4 Ų141.460%0.60375%0.752SS**  cis-157.7142.613.2-147.6127.2-157.700115.3
626T29.6Very low30.4Very low123 Ų123139.6 Ų139.676%0.75576%0.756SS**  trans61.6149.9147.6500000125.8
627S27.2Very low31Very low109 Ų109136.8 Ų136.876%0.76275%0.746SS**  trans-104.9162.1179.7-23.40000114.1
628Q30.1Very low31.1Very low181 Ų181135.5 Ų135.585%0.84675%0.747SS**  trans-175.5153.7159.3-104.1146.3104.500109.6
629V27.5Very low31.6Very low127 Ų127134.5 Ų134.577%0.7775%0.748SS**  cis-153.7-175.8-10.783.80000111.4
630I29.7Very low31.5Very low139 Ų139132.9 Ų132.971%0.71375%0.749SS**  trans-65137.4-178.9-53.8149.9000114.4
631L30.5Very low31.5Very low164 Ų164130.9 Ų130.986%0.85975%0.752SS**  175.3157.3121.9-96.1175.9000114.4
632R31.9Very low31.4Very low230 Ų230128.3 Ų128.387%0.86875%0.748SS**  trans-74.5155.1164.2-75.4177.3167.8162.6-5109.9
633P31.4Very low31.5Very low133 Ų133131 Ų13186%0.86474%0.744SS**  -126.8137.995.72.418.4000114.2
634G28.3Very low31.4Very low61 Ų61132.8 Ų132.863%0.62975%0.75SS**  trans-124.6-161.7135.100000106.8
635P38Very low32.3Very low129 Ų129131.7 Ų131.784%0.83875%0.753SS**  cis-118.6168.4-17.539.9-28.4000111.6
636S29.2Very low32.3Very low110 Ų110131.1 Ų131.177%0.76975%0.754SS**  trans165.1131.5132.2-172.70000109.6
637P37.2Very low32.4Very low98 Ų98130.2 Ų130.264%0.63674%0.744SS**  trans-87.7150.8173.635.6-33.4000112.1
638N34.9Very low33Very low150 Ų150133.9 Ų133.980%0.80275%0.746SS**  trans66.7169.1155-55.1-21.1000117.4
639P39.3Very low33Very low108 Ų108130 Ų13070%0.70174%0.739SS**  cis-125.9-174.2-18.7203.9000113.5
640T28.6Very low33.3Very low122 Ų122132 Ų13275%0.74874%0.742SS**  trans65.3101.9149.836.30000120.1
641A35Very low33.4Very low91 Ų91129.2 Ų129.275%0.75274%0.74SS**  32.5106.6120.800000119.3
642V29.9Very low33.8Very low125 Ų125130.5 Ų130.576%0.75874%0.741SS**  trans-103.6114.5148.1177.10000105.2
643Q30.6Very low33.9Very low120 Ų120129 Ų12956%0.56174%0.741SS**  61.964.362.2-64.4-157-11.100114.6N646Q643-N646 PolarHBondContact O-ND2 2.98Å
644N30.5Very low34.1Very low146 Ų146134.2 Ų134.278%0.78174%0.743SS**SBendtrans-105136.1131.4-55.2-47.4000105.8
645E52Low34.2Very low170 Ų170136.1 Ų136.179%0.79475%0.747SS**SBendcis-54.1147.7-3.5-46.3-48.6111.800114.5L647E645-L647 PolarHBondContact O-N 3.39Å
646N27.8Very low34.1Very low117 Ų117137.7 Ų137.763%0.62674%0.743SS**  trans-92.795.9176.1-142.2-74.1000112Q643Q643-N646 PolarHBondContact O-ND2 2.98Å
647L31.9Very low34.3Very low104 Ų104143.1 Ų143.155%0.54575%0.747SS.*  trans50.5102.7152.4-64.3174000119.5E645E645-L647 PolarHBondContact O-N 3.39Å
648K38.3Very low33.9Very low187 Ų187143 Ų14381%0.81375%0.748SS**  174.8111.8110.5-91.9146.5-163.41630111
649S30.8Very low33.8Very low99 Ų99140.3 Ų140.369%0.69274%0.741SS**  69.6134.788.577.30000113.4
650M34.7Very low33.3Very low168 Ų168145.6 Ų145.683%0.82875%0.749SS**  cis-135.8143.332-58-179-71.300110
651A31.4Very low33.4Very low81 Ų81145.7 Ų145.767%0.66975%0.749SS**  cis79.2114.443.200000115.1
652H37.7Very low33.3Very low191 Ų191151.6 Ų151.688%0.88475%0.752SS**  trans-163.4172.6132.1-96.8-48.2000112.4
653K35.3Very low33.5Very low198 Ų198153 Ų15386%0.86176%0.755SS**  trans-102.7158.9-162.7-54.3172.9178.2176.60112.3
654R35.1Very low33.4Very low243 Ų243152.6 Ų152.692%0.91777%0.765SS**  170.714798.1-161.6167.8-147.7145.61.4115.1
655S29.6Very low33.3Very low102 Ų102153.9 Ų153.971%0.71376%0.764SS**  trans-30.1129.1164-170.90000115.5
656Q35.5Very low32.2Very low161 Ų161152.5 Ų152.575%0.75276%0.762SS**  74.311870.5-97.8-87.21.700116.3
657R34.7Very low32.4Very low224 Ų224150.8 Ų150.885%0.84576%0.764SS**  trans78120.9151.7-116.8-172.7174.4178.4-1124.2
658S28.9Very low32.4Very low95 Ų95150.4 Ų150.466%0.66477%0.77SS**  96109.5124.7-134.20000124.2
659S32.4Very low32.1Very low95 Ų95148.8 Ų148.866%0.66477%0.765SS**  66.9129.4125.160.90000124.9
660Y28.9Very low32.2Very low219 Ų219151 Ų15186%0.85977%0.768SS**  trans63.7127153.9-90.1-98.4000117.8
661T30.2Very low32.1Very low123 Ų123151.1 Ų151.176%0.75577%0.766SS**  -167.1145.462.942.60000115.7
662R33.3Very low32Very low216 Ų216152.2 Ų152.282%0.81578%0.776SS**  trans34.5139.7138-77.4-171-176.1-127.62.6124.5
663L33.1Very low31.7Very low154 Ų154148.1 Ų148.181%0.80678%0.775SS**  trans97.1155.7133-82.1166.5000122.5
664S28.8Very low31.4Very low111 Ų111143.9 Ų143.978%0.77677%0.77SS**  trans68123.4-177.8-132.10000116.3
665K29.3Very low31.4Very low174 Ų174137 Ų13776%0.75776%0.759SS**  cis102.792.918.1-166.6-177.8176-179.60115
666D28Very low31.6Very low141 Ų141139.9 Ų139.975%0.75477%0.767SS**  74.7172125.7-147.2-0.5000120.5
667A32Very low31.6Very low81 Ų81136.8 Ų136.867%0.66976%0.763SS**  trans76.7121.3-172.500000114.9
668S33.4Very low31.5Very low96 Ų96132.7 Ų132.767%0.67176%0.763SS**  87.9141.656.7-79.20000112.6
669E31Very low31.7Very low153 Ų153131.4 Ų131.472%0.71576%0.764SS**  cis-167.3-165-3.1-121.9168112.500111
670L33.3Very low31.8Very low144 Ų144137.5 Ų137.575%0.75478%0.779SS**  trans93.484.2156.2-50.7-174.7000120.5
671H32.7Very low32.1Very low171 Ų171130.4 Ų130.479%0.79277%0.772SS**  34.7130.5122.1-55.7-64.6000123.2
672A29.5Very low32.6Very low105 Ų105132.1 Ų132.187%0.86877%0.772SS**  -146.4156.8120.400000109.3
673A31.5Very low33.2Very low104 Ų104128 Ų12886%0.8676%0.762SS**  trans-149.3160.5-175.800000112.5
674S28.7Very low33.8Very low110 Ų110129.7 Ų129.777%0.76976%0.758SS**  trans-161.2136.3157.9-155.90000112.4
675S34.9Very low34.8Very low98 Ų98132.9 Ų132.969%0.68576%0.76SS**  trans45.1129.1148-44.60000120.7
676D33.7Very low35.6Very low162 Ų162129.7 Ų129.787%0.86676%0.76SS**  cis99.8141.332.6-83.6-46.7000116.1
677S34.9Very low36.4Very low96 Ų96131 Ų13167%0.67177%0.765SS**  trans82.9113.7155-154.30000121.3
678T33.8Very low36.7Very low139 Ų139138.4 Ų138.485%0.85379%0.792SS**  trans59.9145.9138.653.70000121.3
679G33.1Very low36.9Very low67 Ų67140.5 Ų140.569%0.69180%0.798SS**  cis169166.8-2.500000112.8
680F34.5Very low37.2Very low224 Ų224139.8 Ų139.898%0.98280%0.802SS**  trans9.2145.4168.1-78.8-92.4000123.8
681G34.4Very low37.4Very low69 Ų69139.6 Ų139.671%0.71181%0.805SS**  trans145.487.816800000111.1
682E40.5Very low37.7Very low160 Ų160137.8 Ų137.875%0.74881%0.806SS**  83.611657.2-161.4180-134.100113.7
683E45.9Very low38.2Very low128 Ų128139.8 Ų139.860%0.59880%0.802SS**  trans33.9136.8160.383.7-168.8176.100121.7
684R46.6Very low38.7Very low191 Ų191142.2 Ų142.272%0.72180%0.798SS**  -175.1152.1117.9-109.5144.2-85.8-84.4-0.6112.4
685E49.6Very low39.4Very low177 Ų177144.5 Ų144.583%0.82780%0.8SS**  trans-101.4-179.7-177.6-55.5175.8117.100112.5
686S44.7Very low39.7Very low107 Ų107148.1 Ų148.175%0.74881%0.809SS**  trans73.9109.4153.6-61.50000119.5
687I45.2Very low40.2Very low170 Ų170146.9 Ų146.987%0.87280%0.804SS**  trans-174.6120133.8-87.2146000102.1
688L39.5Very low40.7Very low235 Ų235151.5 Ų151.5100%1.2382%0.816SS**  cis-142.4031.3-143.6163000110.8

Retrieved 688 of 688 residues in 233.1 ms (Link to these results)