A0A087XU85_POEFO Loading...

APC membrane recruitment protein 2

Negative regulator of the canonical Wnt signaling pathway involved in neuroectodermal patterning. Acts by specifically binding phosphatidylinositol 4,5-bisphosphate (PtdIns(4,5)P2), translocating to the cell membrane and interacting with key regulators of the canonical Wnt signaling pathway, such as components of the beta-catenin destruction complex.

AlphaFold DB , UniProt , Accession A0A087XU85, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 658 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
1M43.3Very low45.9Very low234 Ų234148.5 Ų148.5100%1.15383%0.826SS**  0790-74.6176171.400107
2E44.5Very low46Very low179 Ų179147.5 Ų147.584%0.83683%0.827SS**  trans-65.7151.7155.9-61.9107.5117.800109.6
3V48Very low45.4Very low135 Ų135142.9 Ų142.982%0.81882%0.819SS**  trans-127.6105162.7179.20000106.5
4Q43.6Very low45.4Very low172 Ų172141.4 Ų141.480%0.80482%0.817SS**  trans-67.6146.6167.7-66.4163.7-39.400109.2
5S53.3Low44.9Very low118 Ų118143.6 Ų143.683%0.82582%0.817SS**  trans-147.8103.2159.141.90000108.9
6D44.8Very low44.2Very low139 Ų139141.9 Ų141.974%0.74382%0.815SS**  trans-74.2175.3-179.3-84.7-78.9000113.7
7C39.7Very low43.8Very low114 Ų114142.3 Ų142.377%0.7781%0.814SS**  trans74.9105.8142.9-910000120
8V40.5Very low43.8Very low140 Ų140142.1 Ų142.185%0.84882%0.816SS**  159.2138.593.7148.50000113.6
9E43.3Very low43.5Very low175 Ų175143.6 Ų143.682%0.81882%0.815SS**  trans-138.7136.7169.7176.5-179.1155.600105.7
10P55.7Low43.8Very low105 Ų105142.1 Ų142.168%0.68281%0.811SS**  -143.9-160.359.744.6-23.7000112.7
11P48.3Very low44Very low122 Ų122140.1 Ų140.179%0.79281%0.812SS**  cis-135.8174.1-0.442.5-24.4000117.9
12V47.6Very low44.4Very low137 Ų137132.6 Ų132.683%0.8379%0.794SS**  trans-82.4150.4174.5173.20000112.6
13A37.8Very low45Very low88 Ų88133.4 Ų133.473%0.72780%0.795SS**  trans-124.4152164.300000110.6
14P45.3Very low45.8Very low122 Ų122135 Ų13579%0.79280%0.797SS**  trans-87.9154.2-156.833.4-37.1000116.5
15Q38.7Very low46.2Very low174 Ų174134.4 Ų134.481%0.81380%0.799SS**  trans-68.8154.5170.8179.5178.2-22.600112.2
16C33.5Very low46.4Very low117 Ų117139.2 Ų139.279%0.79181%0.806SS**  trans-133142.4171.2-75.50000111.4
17D36.8Very low46.6Very low148 Ų148136.4 Ų136.479%0.79180%0.801SS**  trans-79.3151.8-171.2-71.6-57.5000114.9
18T44.1Very low47Very low139 Ų139135.1 Ų135.185%0.85380%0.799SS**  trans-91.3115.6172.7-57.60000110.7
19Q37.4Very low47.7Very low171 Ų171138.5 Ų138.580%0.79980%0.803SS**PPolyproline II helixtrans-80.9141.9175.3-80.6-80.1-31.300112.2
20P50.3Low48.6Very low112 Ų112138.2 Ų138.273%0.72780%0.799SS**PPolyproline II helixtrans-80149.1-179.232.4-35.4000113.4
21A48.2Very low49Very low102 Ų102141.5 Ų141.584%0.84381%0.81SS**PPolyproline II helixtrans-69130.6-176.700000113.9
22G51Low49Very low75 Ų75144.6 Ų144.677%0.77381%0.811SS**PPolyproline II helixtrans-75.7140.8-179.900000114.2
23K56.3Low49.1Very low197 Ų197141.3 Ų141.386%0.85781%0.805SS**PPolyproline II helixtrans-85.8123.4179-60.7171.3-175.71740110.5
24I66.1Low49.9Very low167 Ų167147.4 Ų147.486%0.85682%0.815SS**PPolyproline II helixtrans-83128.2178.658.5174000112.4
25N51.4Low50.3Low160 Ų160153.1 Ų153.186%0.85682%0.821SS**PPolyproline II helixtrans-82.1125.9179.6-77-50.2000111.7A27N25-A27 PolarHBondContact O-N 3.41Å
26K57.7Low50.8Low220 Ų220156.1 Ų156.196%0.95783%0.825SS**  trans-91.674.9-174.5-163.2172.1-173.9173.30111.8
27A48Very low51.2Low79 Ų79156.6 Ų156.665%0.65382%0.824SS**  trans-123.9114.9-173.800000114.8N25N25-A27 PolarHBondContact O-N 3.41Å
28A49.4Very low51.6Low88 Ų88153 Ų15373%0.72782%0.822SS**  trans368214900000120.9K30A28-K30 PolarHBondContact O-N 3.46Å
29F55Low51.5Low211 Ų211152.7 Ų152.793%0.92583%0.826SS**  trans-84.691.7153.8-79.4-74.6000111.6L31F29-L31 PolarHBondContact O-N 3.5Å
30K62.8Low51.9Low169 Ų169147.2 Ų147.274%0.73582%0.815SS**  trans-78.889.3173.4-74.2165.155.8-177.90111A28 F32A28-K30 PolarHBondContact O-N 3.46Å; K30-F32 PolarHBondContact O-N 2.97Å
31L62.6Low51.9Low174 Ų174151.4 Ų151.491%0.91183%0.827SS**  trans-81.183.6-179.7-162.573.2000112.6F29 G33F29-L31 PolarHBondContact O-N 3.5Å; L31-G33 PolarHBondContact O-N 3.48Å
32F49.9Very low51.9Low186 Ų186149.9 Ų149.982%0.81682%0.815SS**  trans-78.6105.9175.3-99.8-90.1000112.7K30K30-F32 PolarHBondContact O-N 2.97Å
33G47.9Very low51.3Low68 Ų68151.9 Ų151.970%0.70182%0.817SS**  trans16.6129.9155.600000122.1L31L31-G33 PolarHBondContact O-N 3.48Å
34K54.5Low51.1Low217 Ų217150.9 Ų150.994%0.94381%0.813SS**  trans-134.5137.2143.2-108.4164.9-177170.30110.2
35R53.5Low50.2Low242 Ų242151.2 Ų151.291%0.91381%0.808SS**  trans-103.4132.2-176.6-58.9172-70.5-160.3-2.6109.4
36R49.3Very low49.6Very low236 Ų236149.5 Ų149.589%0.89181%0.809SS**  trans-165.4123.7145.7-121-174.4156140.9-3114.5
37T43.4Very low48.8Very low127 Ų127145.8 Ų145.878%0.77979%0.793SS**  trans29.4119.8139.755.40000120.7
38G44.1Very low48.9Very low72 Ų72153.3 Ų153.374%0.74280%0.804SS**  trans154.1115.3150.500000114.2
39S41.9Very low48.6Very low134 Ų134153.6 Ų153.694%0.93779%0.794SS**  trans63.2152.8-178.2-135.90000114.8
40G46.3Very low48.1Very low55 Ų55153.5 Ų153.557%0.56779%0.793SS**  cis154.2144.1-6.700000110.7
41M51.5Low46.7Very low200 Ų200150.3 Ų150.399%0.98580%0.798SS**  trans69.7162.8-175.8-51.5-176.873.200115.1
42A46.4Very low45.5Very low71 Ų71146.7 Ų146.759%0.58779%0.794SS**  trans-109.6146.4-146.200000115.9F44A42-F44 HydrophobicContact CB-CD2 4.24Å; A42-F44 HydrophobicContact CB-CE2 3.83Å; A42-F44 HydrophobicContact CB-CZ 4.21Å
43S38.3Very low44.8Very low116 Ų116142.4 Ų142.481%0.81179%0.793SS**  trans-89106169.6-177.10000110.7F45S43-F45 PolarHBondContact O-N 3.22Å
44F52.4Low44.1Very low177 Ų177147.4 Ų147.478%0.77680%0.803SS**  trans-91.359.7-178.5-75.8-78.1000113.4A42A42-F44 HydrophobicContact CB-CD2 4.24Å; A42-F44 HydrophobicContact CB-CE2 3.83Å; A42-F44 HydrophobicContact CB-CZ 4.21Å
45F47.2Very low43Very low173 Ų173140.6 Ų140.676%0.75980%0.795SS**  trans-141.398.9164-82.7-70.8000111.8S43S43-F45 PolarHBondContact O-N 3.22Å
46S39.1Very low42.1Very low124 Ų124137 Ų13787%0.86779%0.794SS**  trans-158.570.1168-810000111.5R48S46-R48 PolarHBondContact O-N 3.45Å
47F41.9Very low41.5Very low143 Ų143131 Ų13163%0.62779%0.788SS**  trans-68.7111.9164.7-79.8-88.6000109.8
48R49.9Very low40.9Very low236 Ų236130.7 Ų130.789%0.89179%0.791SS**  trans-149.698.4164.3-159.217783.6176.25.3112.3S46 K50S46-R48 PolarHBondContact O-N 3.45Å; R48-K50 PolarHBondContact O-N 3.26Å
49N41.5Very low40.5Very low94 Ų94132.3 Ų132.350%0.50380%0.797SS.*  trans-61.8125.3170.3-72.3-25.6000111.2T89 S90N49-T89 VanDerWaalsContact ND2-CB 3.28Å; N49-T89 WeakPolarHBondContact ND2-CB 3.38Å; N49-T89 PolarHBondContact ND2-OG1 2.89Å; N49-T89 VanDerWaalsContact ND2-OG1 3.16Å; N49-S90 WeakPolarHBondContact ND2-CB 3.4Å; N49-S90 PolarHBondContact ND2-OG 3.11Å; N49-S90 VanDerWaalsContact ND2-OG 3.16Å
50K44.7Very low40.2Very low209 Ų209130.4 Ų130.491%0.90979%0.79SS**  -169.8125.2127.6-158.7147.3-176.3171.40109.6R48R48-K50 PolarHBondContact O-N 3.26Å
51A35.2Very low39.8Very low103 Ų103133.8 Ų133.885%0.85180%0.804SS**  trans-90.6142.3-176.800000112.9
52A36.8Very low39.1Very low98 Ų98128 Ų12881%0.8179%0.789SS**  trans-166.8154156.900000111
53A34.8Very low38.6Very low96 Ų96131.4 Ų131.479%0.79380%0.797SS**  trans71.5104.5164.900000120.5
54N32.8Very low38.5Very low172 Ų172131.7 Ų131.792%0.9279%0.789SS**  trans33.8127.1138.3-64.6-0.5000122.5
55G32.6Very low38Very low75 Ų75129.8 Ų129.877%0.77379%0.791SS**  trans-175109.8156.300000111.9
56N33.8Very low37.6Very low166 Ų166131.6 Ų131.689%0.88879%0.793SS**  trans-95.6124.9-176.4-74.2-0.7000112.8
57S35.9Very low37.6Very low110 Ų110131 Ų13177%0.76979%0.789SS**  trans-177.1118.4141.941.70000108.9
58S32.5Very low37.9Very low121 Ų121133.8 Ų133.885%0.84680%0.801SS**  cis85.772.348.379.50000114.6
59A34.4Very low38Very low106 Ų106129 Ų12988%0.87680%0.798SS**  trans-144.7136.6152.600000107.9
60A36.1Very low37.9Very low94 Ų94133 Ų13378%0.77781%0.813SS**  trans-153.6162.8-171.400000112.6
61S38.6Very low37.5Very low125 Ų125129.9 Ų129.987%0.87481%0.806SS**  trans68152.2178.979.60000115.4
62A36Very low37.5Very low79 Ų79127.7 Ų127.765%0.65379%0.794SS**  cis-141.5156.53.900000112.7
63D35.6Very low37.7Very low142 Ų142130.7 Ų130.776%0.75980%0.795SS**  trans21.2154.4132.4-62.3-64.1000121.5
64L37.1Very low37.7Very low123 Ų123132.2 Ų132.264%0.64480%0.795SS**  cis-152.2158.321.9-153.869.5000108.4
65V41.1Very low37.7Very low136 Ų136127.8 Ų127.882%0.82479%0.79SS**  -176.2156.192.2162.80000108.5
66R39Very low38Very low211 Ų211129.3 Ų129.380%0.79679%0.789SS**  trans-112.5172.9-163.7-69.4174.8160.7129.3-5.4115
67S40Very low38.3Very low112 Ų112129.3 Ų129.378%0.78379%0.789SS**  trans96.8150.1158.1860000116.8
68K47.3Very low38.3Very low201 Ų201130.3 Ų130.387%0.87479%0.786SS**  cis-147.4163.81.5-144.8165.6-176.6177.60111.9
69T52.1Low38.7Very low135 Ų135131.3 Ų131.383%0.82878%0.781SS**  trans-116.6143.9-166.6490000114.9
70H39.3Very low38.9Very low179 Ų179128.7 Ų128.783%0.82976%0.76SS**  trans-177.2117.6151.5-161.7-94.8000106.2
71D35.6Very low38.9Very low143 Ų143126.5 Ų126.577%0.76574%0.737SS**  cis73.9146.348.2-154.825.2000112.8
72G36.2Very low38.7Very low57 Ų57123 Ų12359%0.58872%0.721SS**  cis-100.6-147.3-32.100000111.1
73L40.1Very low38.6Very low161 Ų161126.5 Ų126.584%0.84372%0.723SS**  cis-150.5155.819.8-85.5164.6000112.3
74T36.3Very low38.5Very low129 Ų129130.3 Ų130.379%0.79173%0.727SS**  trans-4.3131.715456.90000117.2
75G32.7Very low38.2Very low79 Ų79127.7 Ų127.781%0.81473%0.73SS**  112.316154.200000108.6
76S39Very low37.7Very low107 Ų107131 Ų13175%0.74874%0.736SS**  cis-151.5156.6-3.154.30000108.5
77N39.3Very low37.4Very low165 Ų165124.7 Ų124.788%0.88274%0.737SS**  trans-138.992.2169.8-128.4-32.4000110.6
78N36.8Very low37.3Very low132 Ų132127.2 Ų127.271%0.70674%0.741SS**  trans-104.6148.3169-67.81.7000107.2
79D39.4Very low36.6Very low141 Ų141122.9 Ų122.975%0.75473%0.731SS**  cis-155.3156.71.8-133.5-49.2000110.9
80A39.2Very low35.8Very low51 Ų51120.5 Ų120.542%0.42172%0.721SS.*  trans171.292.8155.900000111.9
81V36.7Very low35.7Very low48 Ų48119.7 Ų119.729%0.29172%0.721SS.*  trans34.3120.8131.2-172.50000116.7T651 T653V81-T651 WeakPolarHBondContact CB-O 3.16Å; V81-T651 WeakPolarHBondContact CB-OG1 3.32Å; V81-T651 HydrophobicContact CG1-CG2 4.48Å; V81-T651 WeakPolarHBondContact CG2-O 3.33Å; V81-T651 PolarHBondContact O-OG1 3.21Å; V81-T653 HydrophobicContact CG1-CG2 4.07Å; V81-T653 HydrophobicContact CG2-CG2 3.92Å; V81-T653 VanDerWaalsContact CG2-OG1 3.32Å; V81-T653 WeakPolarHBondContact CG2-OG1 3.5Å
82G34.2Very low35.5Very low52 Ų52120 Ų12054%0.53672%0.719SS.*  71.313683.400000113.3
83Q34.1Very low35.4Very low153 Ų153121.4 Ų121.472%0.71572%0.724SS**  cis-163.7160.35.4-152.9-165.487.200110.1
84R32.4Very low35Very low222 Ų222116.5 Ų116.584%0.83871%0.713SS**  trans69.1154.4164.2-48.6-76.2-105.8-83.2-0.8118
85G30.9Very low34.8Very low68 Ų68116.8 Ų116.870%0.70172%0.717SS**  trans117.373158.100000117.8
86E32.1Very low34.9Very low204 Ų204118.6 Ų118.695%0.95371%0.712SS**  trans40.6139.1139.8-55.9176.512100122.5
87G32.8Very low34.9Very low80 Ų80123.7 Ų123.783%0.82572%0.715SS**  trans127.2112.8159.300000115.2
88L37.8Very low34.7Very low165 Ų165121.8 Ų121.886%0.86471%0.714SS**  trans-111.2154.6-177.4-68.4169.7000113.1
89T32.4Very low35.3Very low109 Ų109121.9 Ų121.967%0.66971%0.714SS**  trans72.4154.2167.681.40000116.1N49N49-T89 VanDerWaalsContact ND2-CB 3.28Å; N49-T89 WeakPolarHBondContact ND2-CB 3.38Å; N49-T89 PolarHBondContact ND2-OG1 2.89Å; N49-T89 VanDerWaalsContact ND2-OG1 3.16Å
90S33.8Very low35.2Very low86 Ų86120.9 Ų120.960%0.60172%0.718SS**  cis-145.91605.1-156.20000111.8N49N49-S90 WeakPolarHBondContact ND2-CB 3.4Å; N49-S90 PolarHBondContact ND2-OG 3.11Å; N49-S90 VanDerWaalsContact ND2-OG 3.16Å
91L38.5Very low35.9Very low161 Ų161127.5 Ų127.584%0.84374%0.737SS**  trans-97.1-177.3162.9-138.783.7000110.7
92E30.5Very low36.7Very low151 Ų151130.1 Ų130.171%0.70676%0.758SS**  trans70.8115.8174.9-125.8169.9150.100114.5
93A34.4Very low37.7Very low85 Ų85135.1 Ų135.170%0.70277%0.772SS**  cis74.5128.84500000113.6
94G32.4Very low38.6Very low59 Ų59132.3 Ų132.361%0.60877%0.769SS**  cis177.9-179.7-8.800000110.9
95P32.4Very low39.7Very low135 Ų135128.9 Ų128.988%0.87776%0.76SS**  trans-93127.6166.4-10.129000111.7R97P95-R97 PolarHBondContact O-N 3.33Å
96V33.5Very low40.9Very low117 Ų117132.5 Ų132.571%0.70976%0.757SS**  trans-83.9115.7174.3175.30000110.4
97R39.4Very low42.1Very low213 Ų213126.7 Ų126.780%0.80474%0.739SS**  trans29.7112143.2-51.7173.1-174.994.40.8117.2P95P95-R97 PolarHBondContact O-N 3.33Å
98S35.3Very low43.2Very low125 Ų125130.9 Ų130.987%0.87474%0.735SS**  trans-113.7158.3140-168.80000109.4
99L48.8Very low44.1Very low134 Ų134128.2 Ų128.270%0.70272%0.721SS**  trans-100.6136.7-161-67.8166.5000112.8
100S38.3Very low45.1Very low121 Ų121133.1 Ų133.185%0.84673%0.727SS**  trans-136.273.2168.7-54.50000109.8S102S100-S102 PolarHBondContact O-N 3.19Å
101K52.7Low45.8Very low189 Ų189139.5 Ų139.582%0.82274%0.738SS**  trans-80.498.1175.7-76.2178.2173.6175.60110.3
102S53.6Low46.2Very low104 Ų104135.3 Ų135.373%0.72773%0.734SS**SBendtrans-176.3-32.7155.3510000114.4S100 S104S100-S102 PolarHBondContact O-N 3.19Å; S102-S104 PolarHBondContact O-N 3.4Å
103L55.2Low47.2Very low157 Ų157132.1 Ų132.182%0.82273%0.728SS**THydrogen-bonded Turntrans-97.130-160.9-143.573.7000117
104S54.3Low47.4Very low94 Ų94136.6 Ų136.666%0.65773%0.732SS**THydrogen-bonded Turntrans-99.4-23.8177.858.30000114.8S102 S107S102-S104 PolarHBondContact O-N 3.4Å; S104-S107 WeakPolarHBondContact O-CB 3.45Å; S104-S107 PolarHBondContact O-N 3.36Å
105F55.6Low47.9Very low150 Ų150145.4 Ų145.466%0.65875%0.747SS**Hα-helixtrans-70.3-45.5-168.8-161.7-104.1000113.6S107 F108 L109F105-S107 PolarHBondContact O-N 3.18Å; F105-F108 WeakPolarHBondContact O-CB 3.48Å; F105-F108 PolarHBondContact O-N 3.15Å; F105-L109 HydrophobicContact CD1-CD1 4.09Å; F105-L109 HydrophobicContact CE1-CD1 4.09Å
106F55.6Low48.2Very low144 Ų144145.9 Ų145.963%0.63275%0.748SS**Hα-helixtrans-61.8-26.2178.5-105.7-81.5000113.9F108 R110F106-F108 VanDerWaalsContact C-N 3.26Å; F106-F108 PolarHBondContact O-N 2.93Å; F106-R110 PolarHBondContact O-N 2.84Å
107S57.8Low48.3Very low82 Ų82145.8 Ų145.857%0.57375%0.752SS**Hα-helixtrans-65.9-28.2176.1-57.20000112.9S104 F105S104-S107 WeakPolarHBondContact O-CB 3.45Å; S104-S107 PolarHBondContact O-N 3.36Å; F105-S107 PolarHBondContact O-N 3.18Å
108F54.1Low48.8Very low168 Ų168143.8 Ų143.874%0.73775%0.752SS**Hα-helixtrans-79.2-49.1178.8-168.1-102.4000111.1F105 F106 R110 R111 G112F105-F108 WeakPolarHBondContact O-CB 3.48Å; F105-F108 PolarHBondContact O-N 3.15Å; F106-F108 VanDerWaalsContact C-N 3.26Å; F106-F108 PolarHBondContact O-N 2.93Å; F108-R110 VanDerWaalsContact C-N 3.28Å; F108-R110 PolarHBondContact O-N 3.26Å; F108-R111 PolarHBondContact O-N 2.97Å; F108-G112 PolarHBondContact O-N 3.2Å
109L58.6Low48.8Very low109 Ų109145 Ų14557%0.57175%0.749SS**Hα-helixtrans-53.5-43.4177.3-69168.4000112.1F105 R111F105-L109 HydrophobicContact CD1-CD1 4.09Å; F105-L109 HydrophobicContact CE1-CD1 4.09Å; L109-R111 VanDerWaalsContact C-N 3.28Å; L109-R111 PolarHBondContact O-N 2.84Å
110R53.3Low48.5Very low211 Ų211142.8 Ų142.880%0.79676%0.758SS**THydrogen-bonded Turntrans-813.6-179.3-149.2178.1-66.4-179.2-0.2114.7F106 F108F106-R110 PolarHBondContact O-N 2.84Å; F108-R110 VanDerWaalsContact C-N 3.28Å; F108-R110 PolarHBondContact O-N 3.26Å
111R47.2Very low48.4Very low220 Ų220140.7 Ų140.783%0.8376%0.756SS**THydrogen-bonded Turntrans-123.12.7177.8-155.175.786.9172.26.5113.7F108 L109 S113F108-R111 PolarHBondContact O-N 2.97Å; L109-R111 VanDerWaalsContact C-N 3.28Å; L109-R111 PolarHBondContact O-N 2.84Å; R111-S113 PolarHBondContact O-N 3.29Å
112G47.1Very low48.2Very low73 Ų73139.2 Ų139.275%0.75376%0.763SS**  trans-73.423.5-178.800000116.5F108F108-G112 PolarHBondContact O-N 3.2Å
113S51Low47.6Very low85 Ų85137.3 Ų137.359%0.59476%0.76SS**  trans-135133.2-169.8-158.60000114R111R111-S113 PolarHBondContact O-N 3.29Å
114F40.1Very low47.3Very low179 Ų179138.2 Ų138.279%0.78576%0.764SS**  trans52.289.5173.2-54.5-67.1000119.3
115R42.1Very low46.8Very low243 Ų243139.9 Ų139.992%0.91777%0.77SS**  -144.2107.3122.5-71.9-56.3150.1-168.1-6.1111.2
116T38.1Very low46.6Very low145 Ų145144.5 Ų144.589%0.8978%0.783SS**  trans-76130.4149.840.30000107.7
117S36.7Very low46.4Very low116 Ų116149 Ų14981%0.81180%0.795SS**  trans-122.4132.9164.4-173.60000107.9
118E49.3Very low46Very low170 Ų170148.6 Ų148.679%0.79481%0.805SS**  trans-67.3174.4165.5-156.5172.412300110.4
119N36.1Very low46.2Very low151 Ų151152.8 Ų152.881%0.80782%0.816SS**  trans86.1114.6-178.1-57.5-3.3000115.3
120G41.3Very low46.2Very low87 Ų87150.4 Ų150.490%0.89782%0.817SS**  trans-81.8150.1-178.900000113.6
121G35.9Very low46.7Very low78 Ų78146.8 Ų146.880%0.80481%0.813SS**  trans-159.7111.7171.300000109.8G123G121-G123 PolarHBondContact O-N 3.27Å; G121-G123 VanDerWaalsContact O-N 3.15Å
122T49.6Very low47.3Very low158 Ų158146.1 Ų146.197%0.96982%0.816SS**  trans-74.2101-179.445.10000110.6
123G40.4Very low48Very low64 Ų64144.8 Ų144.866%0.6680%0.803SS**  trans-137.6113.217600000111.6G121 V125G121-G123 PolarHBondContact O-N 3.27Å; G121-G123 VanDerWaalsContact O-N 3.15Å; G123-V125 PolarHBondContact O-N 2.89Å
124I49.5Very low48.4Very low176 Ų176148 Ų14890%0.90381%0.806SS**  trans-79.6100.8-179-61.9170.3000109.3
125V42.9Very low49.3Very low129 Ų129148.2 Ų148.278%0.78281%0.807SS**  trans-125.1130.4164.6-177.40000108.5G123 R127G123-V125 PolarHBondContact O-N 2.89Å; V125-R127 PolarHBondContact O-N 2.8Å
126R52.3Low49.8Very low247 Ų247140.7 Ų140.793%0.93279%0.791SS**  trans-64.597.6-170.1-59.8175.4-173.8167.60.9110.9G128R126-G128 PolarHBondContact O-N 2.96Å
127R50.9Low50.4Low237 Ų237138.6 Ų138.689%0.89478%0.783SS**  trans-68.4129.4170.6-73.5-165.5-178.5-150.54.1110V125V125-R127 PolarHBondContact O-N 2.8Å
128G50.4Low51.1Low75 Ų75140.4 Ų140.477%0.77378%0.78SS**  trans-58.7136.2167.300000111R126 G130R126-G128 PolarHBondContact O-N 2.96Å; G128-G130 PolarHBondContact O-N 3.49Å
129R58.1Low51.9Low256 Ų256142.3 Ų142.397%0.96678%0.78SS**  trans-73.792.1178.9-67.5178176.5175.1-2.4109.5
130G57.2Low52.6Low59 Ų59146.1 Ų146.161%0.60878%0.783SS**  trans-66.4161.2174.600000112.8G128 K132G128-G130 PolarHBondContact O-N 3.49Å; G130-K132 PolarHBondContact O-N 2.95Å
131L63.6Low53.1Low135 Ų135153.5 Ų153.571%0.70778%0.784SS**SBendtrans-65.726.2-173.1-75.682.3000116G133 F134L131-G133 PolarHBondContact O-N 3.05Å; L131-F134 HydrophobicContact CB-CD2 3.78Å; L131-F134 HydrophobicContact CB-CE2 4.1Å; L131-F134 HydrophobicContact CD2-CD2 4.07Å; L131-F134 HydrophobicContact CD2-CE2 4.02Å; L131-F134 HydrophobicContact CG-CD2 3.95Å; L131-F134 HydrophobicContact CG-CE2 3.8Å; L131-F134 PolarHBondContact O-N 3.37Å
132K61.2Low53.8Low206 Ų206161 Ų16190%0.89679%0.788SS**THydrogen-bonded Turntrans-71.1-0-175.7-156.6174.1177.2-176.80114.5G130G130-K132 PolarHBondContact O-N 2.95Å
133G60.6Low53.6Low45 Ų45163.1 Ų163.146%0.46478%0.784SS.*THydrogen-bonded Turntrans-95.8-16.9177.700000115.9L131 F135 S136L131-G133 PolarHBondContact O-N 3.05Å; G133-F135 PolarHBondContact O-N 3.46Å; G133-S136 PolarHBondContact O-OG 2.75Å
134F59.5Low53.4Low151 Ų151168.5 Ų168.566%0.66279%0.792SS**THydrogen-bonded Turntrans-71.8-26.3-169.1-74.6-85.6000114.3L131L131-F134 HydrophobicContact CB-CD2 3.78Å; L131-F134 HydrophobicContact CB-CE2 4.1Å; L131-F134 HydrophobicContact CD2-CD2 4.07Å; L131-F134 HydrophobicContact CD2-CE2 4.02Å; L131-F134 HydrophobicContact CG-CD2 3.95Å; L131-F134 HydrophobicContact CG-CE2 3.8Å; L131-F134 PolarHBondContact O-N 3.37Å
135F59Low52.9Low185 Ų185169 Ų16981%0.81179%0.787SS**THydrogen-bonded Turntrans-97.6-5.8-178-63.6-76.4000114.6G133 S137G133-F135 PolarHBondContact O-N 3.46Å; F135-S137 VanDerWaalsContact C-N 3.33Å
136S52.3Low52.7Low84 Ų84169 Ų16959%0.58779%0.788SS**SBendtrans-82.8-6.9174.841.20000114.2G133G133-S136 PolarHBondContact O-OG 2.75Å
137S50.9Low51.8Low102 Ų102162 Ų16271%0.71377%0.769SS**SBendtrans-81.2-31-177.3-155.80000113.4F135 R139F135-S137 VanDerWaalsContact C-N 3.33Å; S137-R139 PolarHBondContact O-N 3.27Å
138M52.2Low51.1Low153 Ų153158 Ų15875%0.75476%0.761SS**  trans-78.864.5-178.5-70.5178.9174.500112.6W140M138-W140 PolarHBondContact O-N 2.58Å
139R66.4Low50.4Low210 Ų210158.9 Ų158.979%0.79276%0.76SS**  trans-81.791165.4-71.3-172.2-68.4172.7-2.2109.4S137 R141S137-R139 PolarHBondContact O-N 3.27Å; R139-R141 PolarHBondContact O-N 3.01Å
140W49.4Very low49.2Very low231 Ų231156.1 Ų156.188%0.87576%0.759SS**  trans-48.5120.4170.4-64.292000110.5M138 R142M138-W140 PolarHBondContact O-N 2.58Å; W140-R142 VanDerWaalsContact C-N 3.3Å; W140-R142 PolarHBondContact O-N 3.32Å
141R53.3Low48.2Very low243 Ų243157.6 Ų157.692%0.91777%0.765SS**  trans-73.981.1179.5-70.5-66.9-163.5173.36.6110.2R139 K143R139-R141 PolarHBondContact O-N 3.01Å; R141-K143 PolarHBondContact O-N 3.29Å
142R50.5Low46.7Very low236 Ų236159.9 Ų159.989%0.89177%0.772SS**  trans-64.8122.8164.6-174.3170.7-69159.1-0.2108W140 E144W140-R142 VanDerWaalsContact C-N 3.3Å; W140-R142 PolarHBondContact O-N 3.32Å; R142-E144 PolarHBondContact O-N 2.95Å; R142-E144 VanDerWaalsContact O-N 3.11Å
143K45.6Very low45.3Very low201 Ų201158.3 Ų158.387%0.87477%0.768SS**  trans-63.4106.9-179.2-175.7173.5-178.9174.70109.7R141R141-K143 PolarHBondContact O-N 3.29Å
144E34.8Very low44.1Very low178 Ų178163.1 Ų163.183%0.83279%0.788SS**  trans-82.3132.9171.9-162153.1-12300108.4R142R142-E144 PolarHBondContact O-N 2.95Å; R142-E144 VanDerWaalsContact O-N 3.11Å
145K40.6Very low42.8Very low185 Ų185164.8 Ų164.880%0.80480%0.798SS**  trans-109104.6-175.2-177.7-178.4-179.8-177.80107.4
146T37.6Very low41.5Very low131 Ų131159.2 Ų159.280%0.80479%0.793SS**  trans-90.1133.4178.3-43.40000110.1
147N34.4Very low40.8Very low99 Ų99164.7 Ų164.753%0.52981%0.806SS.*  trans-123.7170174.441.2-85.5000109.3
148E35.4Very low40.1Very low153 Ų153169.7 Ų169.772%0.71582%0.815SS**  trans58.4138.2-166.244.7-78.5178.700114.3
149A34.7Very low39.2Very low93 Ų93166.5 Ų166.577%0.76981%0.813SS**  cis68.613945.100000112.2
150E34.3Very low37.7Very low199 Ų199167.2 Ų167.293%0.9382%0.815SS**  cis-144.5-165.914-149.1171.1-160.500112.2
151A35.8Very low36.8Very low90 Ų90161.5 Ų161.574%0.74480%0.802SS**  trans-82.9161.1-161.400000118.3
152E32Very low35.8Very low183 Ų183156 Ų15686%0.85580%0.796SS**  trans-150.1111.6139.3-106.1178.7176.200105.8
153E31Very low34.8Very low173 Ų173152.7 Ų152.781%0.80880%0.796SS**  77.5104.783.5-170.1173.9-123.700115.2
154V36.7Very low34.3Very low146 Ų146147 Ų14789%0.88579%0.786SS**  trans-144134.8146.9176.30000109.3
155E30.8Very low34.3Very low185 Ų185145.4 Ų145.486%0.86479%0.789SS**  trans-78143.8-176.9-172-165.1154.400114
156G33.4Very low34Very low68 Ų68145.6 Ų145.670%0.70179%0.792SS**  trans-161.844.7-16900000122
157K37.8Very low33.7Very low200 Ų200144.1 Ų144.187%0.8779%0.788SS**  trans56.897.9152.4-61.3169.3-176.4166.10121.2
158K35.8Very low33.6Very low206 Ų206147.2 Ų147.290%0.89680%0.799SS**  trans32.4115.8132.9-84.1-171.7175.3-179.50122.2
159A32.2Very low34.1Very low86 Ų86146.9 Ų146.971%0.71180%0.8SS**  108.8128.1104.500000121.6
160R35.5Very low34.3Very low225 Ų225148 Ų14885%0.84980%0.8SS**  trans66.1150.5159.2-69.6-173.7177.4-109.312.9116.8
161D30.1Very low34.5Very low111 Ų111147.1 Ų147.159%0.59479%0.793SS**  cis-155.6-179.4-11.3-121.2-40.6000108.7
162T33.7Very low34.5Very low128 Ų128150.8 Ų150.879%0.78580%0.8SS**  trans65.1110159.745.10000121.3
163D29Very low35Very low167 Ų167149.1 Ų149.189%0.89380%0.795SS**  83.8158.2127.7-138.4-1.9000120.9
164A34.8Very low35.3Very low80 Ų80147 Ų14766%0.66179%0.794SS**  trans-125.7158.5-154.700000115.5
165T35.4Very low35.1Very low146 Ų146147.1 Ų147.190%0.89679%0.79SS**  trans-162.2168.9150.6-2.10000110.6
166E32.8Very low35.2Very low188 Ų188144.6 Ų144.688%0.87979%0.787SS**  trans-99.7-179.4-162.8-61.6174.397.700115.3
167S33.1Very low35Very low101 Ų101149.8 Ų149.871%0.70680%0.798SS**  trans71.8147.4174.2-103.90000117.3
168E32.2Very low34.5Very low163 Ų163148.8 Ų148.876%0.76280%0.796SS**  cis-151.9165.4-3-148.7156.3127.400111
169I44.7Very low34.3Very low146 Ų146144.5 Ų144.575%0.74979%0.789SS**  trans-125.5122.3172.1-59.5172.4000109.7K171I169-K171 HydrophobicContact CG2-CG 4.41Å
170P40.3Very low34.5Very low118 Ų118146 Ų14677%0.76679%0.792SS**  trans-119.7139.7133.3-0.321000111
171K37.9Very low34.4Very low179 Ų179141.3 Ų141.378%0.77879%0.79SS**  trans-126.4141.7163.9-76.5-177.2177.6175.80108.5I169 I173I169-K171 HydrophobicContact CG2-CG 4.41Å; K171-I173 PolarHBondContact O-N 3.09Å
172D35.9Very low34.4Very low168 Ų168145.1 Ų145.190%0.89880%0.804SS**  trans-59.2131.3-174-53-76.1000112.7
173I42.7Very low34.2Very low147 Ų147147.5 Ų147.575%0.75481%0.806SS**  trans-112.397.8176.9-49.3-179.8000108.4K171 L175K171-I173 PolarHBondContact O-N 3.09Å; I173-L175 PolarHBondContact O-N 3.1Å
174T36.9Very low34.2Very low128 Ų128147.5 Ų147.579%0.78580%0.8SS**  trans-70.4115.5173.1-48.30000109.9
175L31.1Very low33.9Very low150 Ų150152 Ų15279%0.78581%0.807SS**  trans-72.6128.1179.5-62.4174.3000111.6I173I173-L175 PolarHBondContact O-N 3.1Å
176T33.5Very low33.7Very low131 Ų131153.9 Ų153.980%0.80481%0.806SS**  trans-127.1124.7162.347.20000108.7
177L30.1Very low33.6Very low178 Ų178151.3 Ų151.393%0.93280%0.799SS**  trans-88.3119.4-175.9-64.6170.4000111
178E26.3Very low33.4Very low179 Ų179152.2 Ų152.284%0.83680%0.803SS**  trans-134.9131.2163.7-168.9174.4157.400107.8
179P33Very low33.2Very low115 Ų115149.1 Ų149.175%0.74781%0.806SS**PPolyproline II helixtrans-76.5136.6-171.429.1-34.5000112.5
180P35.5Very low32.5Very low119 Ų119147.7 Ų147.777%0.77381%0.809SS**PPolyproline II helixtrans-81.2139.7-174.131.4-35.2000113.3
181P33.8Very low32.1Very low125 Ų125146.8 Ų146.881%0.81281%0.811SS**PPolyproline II helixtrans-79.3138.5165.332.1-32.5000111.3H183P181-H183 PolarHBondContact O-N 3.21Å
182H29.3Very low31.9Very low191 Ų191146.5 Ų146.588%0.88481%0.812SS**PPolyproline II helixtrans-65.6129.7170.1-96.4-92.7000111.1
183H29.3Very low31.6Very low178 Ų178143.9 Ų143.982%0.82480%0.803SS**  trans-104137163.9-158.5-60.4000109.4P181P181-H183 PolarHBondContact O-N 3.21Å
184H30.3Very low31.1Very low167 Ų167139.9 Ų139.977%0.77380%0.798SS**  trans-70.9142.2171.7-74.7-104.4000110.6
185Q28.6Very low31Very low174 Ų174140 Ų14081%0.81380%0.804SS**  trans-96.6111.6172.5-177.6174.9-6.600109.4
186E31Very low30.8Very low186 Ų186139.8 Ų139.887%0.86980%0.803SS**  trans-103.6116.5165.1-67-177.812100107.5
187D30.3Very low30.8Very low135 Ų135140.1 Ų140.172%0.72280%0.799SS**  trans-102.5141.1179.5-161.1-11.4000110.1
188C29.1Very low30.8Very low119 Ų119140.2 Ų140.280%0.80480%0.795SS**  trans-146.681.9-169.8-84.70000111.4
189A28.7Very low31.1Very low98 Ų98136.2 Ų136.281%0.8179%0.793SS**  trans-90.2144.216700000111
190S28Very low31Very low117 Ų117135.3 Ų135.382%0.81879%0.789SS**  trans-135.8139-178.2-75.80000113.3
191A33.4Very low30.8Very low98 Ų98136.8 Ų136.881%0.8179%0.79SS**  trans57110.2152.100000120.7
192E32.2Very low30.8Very low173 Ų173136.9 Ų136.981%0.80879%0.789SS**  trans-152.8156.8134.7-102.3-65.7-87.300106.6
193T31.7Very low31.5Very low114 Ų114133 Ų13370%0.69978%0.781SS**  cis-137.1168.81-165.90000111.5
194G31.1Very low31.7Very low62 Ų62130.4 Ų130.464%0.63978%0.778SS**  trans-100160.7-179.900000114.9
195S34Very low31.8Very low131 Ų131128.6 Ų128.692%0.91678%0.778SS**  trans-157173.6162.961.10000111.3
196N27Very low31.9Very low145 Ų145125 Ų12578%0.77577%0.773SS**  trans-144.9147.6-152.6-168.8-121.1000112.9
197L33.9Very low31.9Very low138 Ų138122.2 Ų122.272%0.72377%0.768SS**  trans72.189.4169.4-64.4160.5000120.4
198Q30.4Very low31.9Very low181 Ų181121.2 Ų121.285%0.84677%0.767SS**  48.2139.1113-165168.97.200123.1
199A32.3Very low31.9Very low95 Ų95123.2 Ų123.279%0.78577%0.766SS**  trans79.6142.6164.700000118
200S31.8Very low32.2Very low95 Ų95123.5 Ų123.566%0.66476%0.758SS**  cis-156.6168-15.260.10000113
201D30.1Very low32.8Very low150 Ų150123.6 Ų123.680%0.80276%0.756SS**  trans77.3151.7156.8-54-51.4000122.4
202T34Very low32.9Very low128 Ų128124.1 Ų124.179%0.78575%0.749SS**  trans-102.9165-166.248.40000112.2
203P45.2Very low32.9Very low110 Ų110124.3 Ų124.371%0.71475%0.75SS**  cis-156.1174.444.944.2-22.2000121
204T32.8Very low32.8Very low123 Ų123124.2 Ų124.276%0.75575%0.752SS**  trans49.2109.1149.7-55.80000117.3
205T32.5Very low33Very low128 Ų128127.8 Ų127.879%0.78576%0.761SS**  -157.3-165.152.6-18.80000109.3
206S30.3Very low32.9Very low99 Ų99125.9 Ų125.969%0.69275%0.754SS**  cis-163.9145.13.731.20000113.4
207V32Very low33.4Very low128 Ų128127.1 Ų127.178%0.77676%0.757SS**  18.4132.2124.8171.70000117.2
208T28.9Very low34.4Very low114 Ų114126 Ų12670%0.69976%0.758SS**  cis179.6149.21.6-960000106.6
209M30.3Very low34.5Very low161 Ų161121.1 Ų121.179%0.79376%0.757SS**  cis-161.9-172.7-8.2-107.8-65.9-178.800109.1
210T35Very low35.4Very low103 Ų103122.6 Ų122.663%0.63276%0.758SS**  trans-114.3173167.857.60000111.8T212T210-T212 HydrophobicContact CG2-CG2 4.5Å; T210-T212 WeakPolarHBondContact OG1-CG2 3.16Å
211P39.6Very low35.5Very low119 Ų119124.2 Ų124.277%0.77377%0.769SS**  -141.2156.793.637.9-24.2000113.9
212T34.9Very low35.6Very low109 Ų109120.8 Ų120.867%0.66977%0.769SS**  cis95.9110.913.770.60000119T210T210-T212 HydrophobicContact CG2-CG2 4.5Å; T210-T212 WeakPolarHBondContact OG1-CG2 3.16Å
213H33.1Very low35.6Very low178 Ų178123.7 Ų123.782%0.82477%0.774SS**  trans72.4165.5143.2-130.8-125.8000116.6
214C29.3Very low36.1Very low111 Ų111122.8 Ų122.875%0.7577%0.768SS**  cis-143.7-179.216.1-52.50000113.2
215V36.3Very low36.2Very low137 Ų137124.4 Ų124.483%0.8377%0.772SS**  trans-105141.8167.7172.60000111.1
216A31.5Very low36.3Very low92 Ų92123.2 Ų123.276%0.7677%0.769SS**  trans-176.7107.9152.900000117.4
217M36.8Very low37.5Very low171 Ų171123.9 Ų123.984%0.84277%0.771SS**  trans42.1-166.7136.4-49.1-56.7-68.900121.2
218P55.4Low37.8Very low114 Ų114127.3 Ų127.374%0.7478%0.776SS**  -137.7134.5-108.640.2-18.7000120.3
219G31.4Very low38.9Very low79 Ų79127 Ų12781%0.81478%0.775SS**  trans68.3-173.9157.700000117.9
220P52.8Low39Very low125 Ų125130.1 Ų130.181%0.81278%0.78SS**  cis-136.6-172.8-10.943.2-26.7000115.1
221S33.6Very low39.2Very low129 Ų129130.7 Ų130.790%0.90278%0.784SS**  trans75.5132.9151.9-163.20000121.9
222G32.2Very low39.4Very low78 Ų78131.3 Ų131.380%0.80479%0.788SS**  trans149.8111158.200000118.1
223E33.8Very low39.5Very low190 Ų190132.3 Ų132.389%0.88879%0.794SS**  trans-117.5175.8168.1-115.8-166.6105.800109
224P55.6Low39.4Very low90 Ų90131.2 Ų131.258%0.58479%0.794SS**  cis-136.1-170.3-25.636.8-17.1000114.6
225D33.8Very low39.6Very low158 Ų158130.6 Ų130.685%0.84579%0.791SS**  trans84169.6148-86.9-44.2000124.4
226S35.3Very low40.6Very low102 Ų102128.8 Ų128.871%0.71378%0.782SS**  trans-121.1-167.3-152.968.30000113.7
227P56.7Low40.7Very low114 Ų114132.4 Ų132.474%0.7479%0.787SS**  cis-139.4-166.3-2.840.5-18.4000117
228F36.6Very low40.6Very low200 Ų200135.3 Ų135.388%0.87779%0.789SS**  trans-37.1178.6165.6-70.5-79.4000120.1
229P53.1Low40.5Very low106 Ų106135.2 Ų135.269%0.68879%0.788SS**  cis-133.2-171-15.633.6-13.3000114.1
230Y31.3Very low40.4Very low228 Ų228136.9 Ų136.989%0.89479%0.787SS**  trans-165.8160.9138.5-118.9-79.1000114.1
231T39Very low39.5Very low115 Ų115138.4 Ų138.471%0.70679%0.787SS**  trans-118.5176.8170.658.60000111.4
232P45.3Very low40Very low132 Ų132141.5 Ų141.586%0.85779%0.787SS**  -148.7-174.510638.4-20.7000115.8
233T37Very low40.1Very low130 Ų130147.5 Ų147.580%0.79879%0.791SS**  trans-125.4156.5-167.3-47.20000111.8
234D31.1Very low39.9Very low155 Ų155143.2 Ų143.283%0.82979%0.789SS**  trans-152.7171140.4-148.3-3.6000114.1
235S33.9Very low38.8Very low97 Ų97148.7 Ų148.768%0.67880%0.803SS**  trans-152-149.4-179.1-141.80000108.1
236P56Low38.7Very low99 Ų99145.4 Ų145.464%0.64380%0.798SS**  cis-117.1-171.9-32.326.7-4.1000111.6
237L34.1Very low38.6Very low168 Ų168146 Ų14688%0.8880%0.802SS**  177.7175.793.3-90.4173.9000113.6
238R35.4Very low37.7Very low233 Ų233149.2 Ų149.288%0.87981%0.811SS**  trans-140.1-168.4-172.8-131.4-175.2177-163.12.5107.7
239P51.6Low37.4Very low111 Ų111145 Ų14572%0.72181%0.807SS**  cis-134.8-172.7-21.442.1-25.6000113.8
240S29.9Very low36.5Very low114 Ų114144.3 Ų144.380%0.79780%0.804SS**  trans-163.1157.6139.2-165.90000112.5
241I35.1Very low36.7Very low157 Ų157141 Ų14181%0.80580%0.801SS**  trans-139.8125.2174.7-63.2162.3000109
242Q42.9Very low36.5Very low194 Ų194141.4 Ų141.491%0.90780%0.804SS**  trans-143.6166.8158.1-74.6-156.1-2.700111.6
243K34.1Very low36.4Very low204 Ų204140.4 Ų140.489%0.88780%0.797SS**  trans-151.3102.3-154.7173.5-168.4175.2-178.70112.5
244A29.6Very low36Very low101 Ų101139.7 Ų139.784%0.83580%0.798SS**  trans-165.3121160.300000115.5
245K32.9Very low36.1Very low204 Ų204140 Ų14089%0.88780%0.798SS**  trans34.9137.8143.8-75.8-177.5168.5-177.60124
246A31Very low36Very low89 Ų89142.1 Ų142.174%0.73681%0.807SS**  trans65.9119152.200000117
247S33.9Very low35Very low114 Ų114143.5 Ų143.580%0.79781%0.814SS**  cis75.694.932.3-44.70000115.5
248I38.7Very low35.9Very low183 Ų183141 Ų14194%0.93881%0.808SS**  -155.3175.9121.534.3172.4000109
249S29.8Very low36.4Very low111 Ų111135.1 Ų135.178%0.77680%0.8SS**  trans-102.2163.9-152.6-1370000117.6
250S33.9Very low35.7Very low92 Ų92137.1 Ų137.164%0.64380%0.804SS**  trans-38.514716257.30000115
251L34.9Very low35.8Very low157 Ų157137.7 Ų137.782%0.82280%0.798SS**  cis63.3137.541.1-51.5178.8000113.2
252T35.8Very low35.7Very low125 Ų125140.5 Ų140.577%0.76780%0.798SS**  cis-159.8159.3-11.711.50000109.1
253P42.8Very low35.1Very low111 Ų111137.2 Ų137.272%0.72180%0.795SS**  trans-112.2168.1-179.340.8-33.1000115.8
254S28.3Very low35.2Very low115 Ų115132.4 Ų132.480%0.80479%0.788SS**  trans66.3136.2162.3-59.70000117.7
255L34.1Very low35.3Very low161 Ų161135.5 Ų135.584%0.84379%0.789SS**  cis99.591.833.3-176.176.5000113.6
256T31Very low35.3Very low141 Ų141129.4 Ų129.487%0.86578%0.784SS**  trans-158.1150.1156.8-13.40000112.8
257T35.2Very low35.4Very low128 Ų128133 Ų13379%0.78579%0.79SS**  trans-125.9-174.4168.849.30000108.2
258P52.1Low35.5Very low115 Ų115135.9 Ų135.975%0.74779%0.791SS**  cis-127.9-147.61.944.5-24000111
259P46.1Very low35.7Very low110 Ų110133.1 Ų133.171%0.71479%0.785SS**  cis-134.3178.1-9.440.8-21.4000117.9
260L37.5Very low36.1Very low153 Ų153133.1 Ų133.180%0.80179%0.785SS**  trans4.3147.1154.5-58170.2000120
261D33Very low36.4Very low127 Ų127135.6 Ų135.668%0.67979%0.787SS**  cis-163.9159.543-134.5-26000116.1
262R32.4Very low37.3Very low215 Ų215133.5 Ų133.581%0.81178%0.782SS**  trans37.4127.1158.5-74.6170.7-174-139.8-3.8125.8
263C30.6Very low37.9Very low125 Ų125130 Ų13085%0.84576%0.764SS**  trans70.9146.2137-66.50000120.9
264S34.5Very low38.5Very low104 Ų104129.4 Ų129.473%0.72776%0.757SS**  cis-166.7176.7-10.5-1640000111.8
265I33.5Very low39.9Very low166 Ų166129.6 Ų129.685%0.85175%0.749SS**  trans78.4125.2160.4-63.7153.4000119.8
266G33Very low41.1Very low76 Ų76131 Ų13178%0.78474%0.744SS**  trans82135.2163.400000115.5
267D32.8Very low42.5Very low163 Ų163129.7 Ų129.787%0.87273%0.731SS**  cis-147.4151.40.6178.624.6000108.7
268Q35.5Very low43.5Very low175 Ų175126.2 Ų126.282%0.81871%0.711SS**  trans-150121.7-175.7-167.4176.829.500112.3
269P41.6Very low43.9Very low126 Ų126124.1 Ų124.182%0.81870%0.699SS**  trans-80140.7-174.531-35.2000114
270S38.4Very low44.7Very low111 Ų111122.9 Ų122.978%0.77669%0.685SS**  trans-84.7160.8167.958.10000111.1
271E40.8Very low45.9Very low143 Ų143121.3 Ų121.367%0.66868%0.677SS**  cis-140.2161.53-70.4-172.9159.700111.3S273E271-S273 WeakPolarHBondContact OE2-CB 3.46Å; E271-S273 PolarHBondContact OE2-OG 3.03Å
272P53.3Low47Very low113 Ų113122.4 Ų122.473%0.73468%0.676SS**  trans-105.836.8165.740.6-33.4000113.3
273S49Very low48.2Very low53 Ų53116 Ų11637%0.37166%0.661SS.*Hα-helixtrans-78-34.9-167.352.40000115.3E271E271-S273 WeakPolarHBondContact OE2-CB 3.46Å; E271-S273 PolarHBondContact OE2-OG 3.03Å
274V54.9Low48.9Very low97 Ų97115.2 Ų115.259%0.58865%0.648SS**Hα-helixtrans-70.7-46-173.5-176.60000112.3R276 L277 C278V274-R276 PolarHBondContact O-N 3.4Å; V274-L277 PolarHBondContact O-N 3.49Å; V274-L277 VanDerWaalsContact O-N 3.17Å; V274-C278 PolarHBondContact O-N 3.03Å; V274-C278 VanDerWaalsContact O-N 3.1Å
275D58.9Low49.7Very low119 Ų119114.7 Ų114.764%0.63664%0.64SS**Hα-helixtrans-64.8-27.7-176.1-68.1-38.6000112.9S279D275-S279 VanDerWaalsContact O-CB 3.29Å; D275-S279 WeakPolarHBondContact O-CB 3.33Å; D275-S279 PolarHBondContact O-N 3.1Å; D275-S279 PolarHBondContact O-OG 3.23Å
276R58.4Low50.4Low192 Ų192112.1 Ų112.173%0.72563%0.633SS**Hα-helixtrans-70-38.3177.2-156.4175-166-1292.9111.8V274 S279 I280V274-R276 PolarHBondContact O-N 3.4Å; R276-S279 PolarHBondContact O-N 3.17Å; R276-I280 HydrophobicContact CG-CD1 4.49Å; R276-I280 WeakPolarHBondContact O-CD1 3.29Å; R276-I280 VanDerWaalsContact O-CG1 3.29Å; R276-I280 WeakPolarHBondContact O-CG1 3.43Å; R276-I280 PolarHBondContact O-N 3.27Å; R276-I280 VanDerWaalsContact O-N 3.12Å
277L60.3Low51.1Low113 Ų113112.2 Ų112.259%0.59262%0.621SS**Hα-helixtrans-70.4-42.1174.8-71.6170.4000111.7V274 I280 L281V274-L277 PolarHBondContact O-N 3.49Å; V274-L277 VanDerWaalsContact O-N 3.17Å; L277-I280 PolarHBondContact O-N 3.26Å; L277-L281 WeakPolarHBondContact O-CB 3.31Å; L277-L281 VanDerWaalsContact O-CG 3.32Å; L277-L281 WeakPolarHBondContact O-CG 3.45Å; L277-L281 PolarHBondContact O-N 3.09Å
278C57.2Low52Low55 Ų55111.7 Ų111.737%0.37262%0.618SS.*Hα-helixtrans-59.5-45.7171.9-70.70000111.5V274 I280 L281 F282V274-C278 PolarHBondContact O-N 3.03Å; V274-C278 VanDerWaalsContact O-N 3.1Å; C278-I280 PolarHBondContact O-N 3.41Å; C278-L281 PolarHBondContact O-N 3.11Å; C278-F282 HydrophobicContact CB-CD2 4.47Å; C278-F282 WeakPolarHBondContact O-CD2 3.32Å; C278-F282 PolarHBondContact O-N 3.47Å
279S60Low52.5Low70 Ų70112.8 Ų112.849%0.4962%0.62SS.*Hα-helixtrans-58-48.5179.1-61.60000112D275 R276 F282 T283D275-S279 VanDerWaalsContact O-CB 3.29Å; D275-S279 WeakPolarHBondContact O-CB 3.33Å; D275-S279 PolarHBondContact O-N 3.1Å; D275-S279 PolarHBondContact O-OG 3.23Å; R276-S279 PolarHBondContact O-N 3.17Å; S279-F282 PolarHBondContact O-N 3.16Å; S279-T283 WeakPolarHBondContact O-CG2 3.29Å; S279-T283 PolarHBondContact O-N 3.17Å; S279-T283 PolarHBondContact O-OG1 3.14Å
280I63.2Low52.9Low84 Ų84110.8 Ų110.843%0.43161%0.609SS.*Hα-helixtrans-61.6-47.1178.6-68.4163.8000111R276 L277 C278 F282 T283 D284R276-I280 HydrophobicContact CG-CD1 4.49Å; R276-I280 WeakPolarHBondContact O-CD1 3.29Å; R276-I280 VanDerWaalsContact O-CG1 3.29Å; R276-I280 WeakPolarHBondContact O-CG1 3.43Å; R276-I280 PolarHBondContact O-N 3.27Å; R276-I280 VanDerWaalsContact O-N 3.12Å; L277-I280 PolarHBondContact O-N 3.26Å; C278-I280 PolarHBondContact O-N 3.41Å; I280-F282 VanDerWaalsContact C-N 3.25Å; I280-F282 PolarHBondContact O-N 3.06Å; I280-T283 WeakPolarHBondContact CA-OG1 3.46Å; I280-T283 PolarHBondContact O-N 2.86Å; I280-T283 PolarHBondContact O-OG1 3.14Å; I280-D284 PolarHBondContact O-N 3.21Å
281L63.3Low53.3Low120 Ų120114.1 Ų114.163%0.62861%0.61SS**Hα-helixtrans-65.7-25.4-180-70.8171.6000113.5L277 C278 V285L277-L281 WeakPolarHBondContact O-CB 3.31Å; L277-L281 VanDerWaalsContact O-CG 3.32Å; L277-L281 WeakPolarHBondContact O-CG 3.45Å; L277-L281 PolarHBondContact O-N 3.09Å; C278-L281 PolarHBondContact O-N 3.11Å; L281-V285 VanDerWaalsContact O-CG2 3.31Å; L281-V285 WeakPolarHBondContact O-CG2 3.39Å
282F55.7Low53.7Low150 Ų150114.3 Ų114.366%0.65862%0.615SS**Hα-helixtrans-92-25.5175.7-73.3-59.7000114.1C278 S279 I280C278-F282 HydrophobicContact CB-CD2 4.47Å; C278-F282 WeakPolarHBondContact O-CD2 3.32Å; C278-F282 PolarHBondContact O-N 3.47Å; S279-F282 PolarHBondContact O-N 3.16Å; I280-F282 VanDerWaalsContact C-N 3.25Å; I280-F282 PolarHBondContact O-N 3.06Å
283T56.3Low53.7Low81 Ų81114.2 Ų114.250%0.49762%0.617SS.*Hα-helixtrans-64.4-42.1172.242.90000111.8S279 I280 V285 T286S279-T283 WeakPolarHBondContact O-CG2 3.29Å; S279-T283 PolarHBondContact O-N 3.17Å; S279-T283 PolarHBondContact O-OG1 3.14Å; I280-T283 WeakPolarHBondContact CA-OG1 3.46Å; I280-T283 PolarHBondContact O-N 2.86Å; I280-T283 PolarHBondContact O-OG1 3.14Å; T283-V285 PolarHBondContact O-N 3.34Å; T283-T286 WeakPolarHBondContact O-CB 3.14Å; T283-T286 PolarHBondContact O-N 3.03Å; T283-T286 PolarHBondContact O-OG1 3.08Å
284D47.3Very low54Low109 Ų109118.5 Ų118.558%0.58364%0.635SS**Hα-helixtrans-63.2-30.1-175-69.9-2.2000112.9I280 T286 S287I280-D284 PolarHBondContact O-N 3.21Å; D284-T286 PolarHBondContact O-N 3.17Å; D284-S287 PolarHBondContact O-N 2.91Å
285V51.3Low53.9Low92 Ų92120 Ų12056%0.55865%0.645SS**Hα-helixtrans-68.6-24.2178.3-156.60000112L281 T283 S287L281-V285 VanDerWaalsContact O-CG2 3.31Å; L281-V285 WeakPolarHBondContact O-CG2 3.39Å; T283-V285 PolarHBondContact O-N 3.34Å; V285-S287 VanDerWaalsContact C-N 3.3Å; V285-S287 PolarHBondContact O-N 3.28Å
286T48.2Very low53.7Low113 Ų113117.9 Ų117.969%0.69365%0.651SS**Hα-helixtrans-74.7-19.2179.969.20000113.5T283 D284T283-T286 WeakPolarHBondContact O-CB 3.14Å; T283-T286 PolarHBondContact O-N 3.03Å; T283-T286 PolarHBondContact O-OG1 3.08Å; D284-T286 PolarHBondContact O-N 3.17Å
287S47.4Very low53.3Low78 Ų78114 Ų11455%0.54565%0.652SS.*THydrogen-bonded Turntrans-75.9-21-178.2-169.80000113.8D284 V285 K289 S290D284-S287 PolarHBondContact O-N 2.91Å; V285-S287 VanDerWaalsContact C-N 3.3Å; V285-S287 PolarHBondContact O-N 3.28Å; S287-K289 PolarHBondContact O-N 3.38Å; S287-S290 PolarHBondContact O-N 2.99Å; S287-S290 PolarHBondContact O-OG 3.29Å
288L50.2Low52.8Low151 Ų151111.4 Ų111.479%0.79165%0.653SS**THydrogen-bonded Turntrans-7319.4-172.8-69.5171.5000115.3
289K47.2Very low52.3Low198 Ų198116 Ų11686%0.86167%0.674SS**THydrogen-bonded Turntrans-11220.1174-157-179.4167.163.70113S287S287-K289 PolarHBondContact O-N 3.38Å
290S50.1Low52.1Low84 Ų84120.4 Ų120.459%0.58769%0.69SS**  trans-107.2-15.2-17853.60000114.8S287 D292S287-S290 PolarHBondContact O-N 2.99Å; S287-S290 PolarHBondContact O-OG 3.29Å; S290-D292 VanDerWaalsContact C-N 3.32Å; S290-D292 PolarHBondContact O-N 3.33Å; S290-D292 VanDerWaalsContact O-N 3.09Å
291F46.8Very low51.5Low181 Ų181122.7 Ų122.779%0.79470%0.701SS**  trans-87.259.4-178.5-102.7-85.5000113.5L294F291-L294 HydrophobicContact CD1-CB 4.45Å; F291-L294 HydrophobicContact CE1-CB 4.39Å; F291-L294 HydrophobicContact CE1-CD2 4.45Å
292D48Very low50.7Low147 Ų147121 Ų12179%0.78671%0.705SS**  trans-111.943.8176.6-164.524.6000112.3S290S290-D292 VanDerWaalsContact C-N 3.32Å; S290-D292 PolarHBondContact O-N 3.33Å; S290-D292 VanDerWaalsContact O-N 3.09Å
293S54.9Low50.6Low111 Ų111120.9 Ų120.978%0.77671%0.711SS**SBendtrans-1562.8-177.2-75.90000117
294L54.1Low50.4Low144 Ų144121.7 Ų121.775%0.75473%0.727SS**SBendtrans-113.619.9-178.2-145.274.2000116.1F291F291-L294 HydrophobicContact CD1-CB 4.45Å; F291-L294 HydrophobicContact CE1-CB 4.39Å; F291-L294 HydrophobicContact CE1-CD2 4.45Å
295T54.1Low50.7Low128 Ų128125.6 Ų125.679%0.78574%0.741SS**  trans-125.466.4146.141.80000109.1C297T295-C297 PolarHBondContact O-N 3.45Å
296G53.6Low50.9Low75 Ų75130 Ų13077%0.77376%0.755SS**  trans-65.167.5158.300000110.3G298G296-G298 PolarHBondContact O-N 3.05Å
297C51.1Low51.1Low110 Ų110133.6 Ų133.674%0.74377%0.765SS**  trans-68.277.2162.7-65.80000106.7T295 D299T295-C297 PolarHBondContact O-N 3.45Å; C297-D299 PolarHBondContact O-N 3.47Å
298G49.8Very low50.8Low58 Ų58133 Ų13360%0.59877%0.77SS**  trans-54.2135.5179.400000109.6G296 I300G296-G298 PolarHBondContact O-N 3.05Å; G298-I300 VanDerWaalsContact C-N 3.31Å; G298-I300 PolarHBondContact O-N 3.12Å
299D46.9Very low50.6Low152 Ų152131.6 Ų131.681%0.81377%0.771SS**  trans-61.199.3170.3-78.1-53.2000107.9C297 I301C297-D299 PolarHBondContact O-N 3.47Å; D299-I301 HydrophobicContact CB-CG1 4.07Å; D299-I301 PolarHBondContact O-N 3.5Å
300I55.7Low50.4Low163 Ų163126.3 Ų126.384%0.83677%0.773SS**  trans-72.973.4165.6-51.9177.9000105.9G298 A302G298-I300 VanDerWaalsContact C-N 3.31Å; G298-I300 PolarHBondContact O-N 3.12Å; I300-A302 PolarHBondContact O-N 2.7Å
301I50.7Low49.9Very low131 Ų131125.8 Ų125.867%0.67278%0.78SS**  trans-60.5107.9161.3-52.1178.1000104.4D299 D303D299-I301 HydrophobicContact CB-CG1 4.07Å; D299-I301 PolarHBondContact O-N 3.5Å; I301-D303 VanDerWaalsContact C-N 3.33Å; I301-D303 PolarHBondContact O-N 3.44Å
302A46.1Very low49.5Very low86 Ų86125 Ų12571%0.71178%0.784SS**  trans-70.197.6170.400000107.1I300 A304I300-A302 PolarHBondContact O-N 2.7Å; A302-A304 PolarHBondContact O-N 2.85Å
303D53.1Low48.9Very low146 Ų146122.3 Ų122.378%0.78179%0.792SS**  trans-56.9112.5165.4-86.9-37.6000107.7I301 E305I301-D303 VanDerWaalsContact C-N 3.33Å; I301-D303 PolarHBondContact O-N 3.44Å; D303-E305 PolarHBondContact O-N 3.19Å
304A51.3Low48.1Very low99 Ų99120 Ų12082%0.81879%0.785SS**  trans-79.877.1178.200000109.1A302 E306A302-A304 PolarHBondContact O-N 2.85Å; A304-E306 PolarHBondContact O-N 3.33Å
305E55Low47.5Very low191 Ų191119.5 Ų119.589%0.89379%0.793SS**  trans-69.467168.952.4173.8-159.700111.6D303D303-E305 PolarHBondContact O-N 3.19Å
306E54.2Low46.6Very low183 Ų183117.1 Ų117.186%0.85579%0.794SS**  trans-97.2104.9164.9-166.2169.7175.300110.2A304 G308A304-E306 PolarHBondContact O-N 3.33Å; E306-G308 PolarHBondContact O-N 3.21Å
307E52.5Low45.9Very low189 Ų189120.4 Ų120.488%0.88380%0.799SS**  trans-69.190.4-176.8-170.1179.9142.700112P309E307-P309 WeakPolarHBondContact O-CD 3.48Å
308G41.3Very low45.1Very low65 Ų65121.2 Ų121.267%0.6781%0.807SS**PPolyproline II helixtrans-76.7118.2170.900000111.8E306E306-G308 PolarHBondContact O-N 3.21Å
309P46.1Very low44.5Very low122 Ų122124.3 Ų124.379%0.79282%0.819SS**PPolyproline II helixtrans-70135.2-173.827.1-35000112.8E307 G311E307-P309 WeakPolarHBondContact O-CD 3.48Å; P309-G311 PolarHBondContact O-N 3.22Å
310G44.1Very low43.9Very low88 Ų88123.1 Ų123.191%0.90782%0.822SS**PPolyproline II helixtrans-64.8116.2175.100000112.4
311G37.9Very low42.9Very low72 Ų72121 Ų12174%0.74282%0.822SS**  trans-135.897.4-178.700000112.5P309 G313P309-G311 PolarHBondContact O-N 3.22Å; G311-G313 PolarHBondContact O-N 3.17Å
312N39.2Very low42.2Very low165 Ų165121 Ų12188%0.88283%0.834SS**  trans-57.2125-172.2-78-19.8000115.1G314N312-G314 PolarHBondContact O-N 3.38Å; N312-G314 VanDerWaalsContact O-N 3.13Å
313G34.7Very low41.4Very low91 Ų91120.7 Ų120.794%0.93884%0.839SS**  trans-79.164.2151.200000111.2G311G311-G313 PolarHBondContact O-N 3.17Å
314G39.2Very low40.4Very low61 Ų61117.7 Ų117.763%0.62984%0.843SS**  trans-90.1133.8-171.500000114.7N312N312-G314 PolarHBondContact O-N 3.38Å; N312-G314 VanDerWaalsContact O-N 3.13Å
315S40.1Very low39.5Very low134 Ų134117 Ų11794%0.93785%0.845SS**  trans-65.2151.7169.5-58.10000112.6
316G36.5Very low38.4Very low78 Ų78112 Ų11280%0.80485%0.845SS**  trans154.9111.2158.400000115.5
317T38.8Very low37.2Very low144 Ų144106.6 Ų106.688%0.88384%0.839SS**  trans-82.3124.8164.250.60000110.9
318S33.1Very low36.5Very low128 Ų128103 Ų10390%0.89583%0.834SS**  trans-165.7155.9145.452.60000111.3
319S37.5Very low36.4Very low122 Ų122107 Ų10785%0.85384%0.839SS**  trans-115.1139.3-176.7500000111.5
320S34.1Very low35.9Very low127 Ų127106.1 Ų106.189%0.88884%0.836SS**  trans-158.6158.2148.856.40000109.5
321S35.5Very low35.7Very low119 Ų119107.5 Ų107.583%0.83283%0.827SS**  trans-146.8115.2-165.356.80000113.9
322S35.7Very low35.5Very low130 Ų130110.1 Ų110.191%0.90982%0.824SS**  trans-165.9148.4164.950.10000108.3
323G30.5Very low35.4Very low80 Ų80108.8 Ų108.883%0.82582%0.822SS**  cis159132.2-13.400000112.8
324G30.7Very low35.3Very low83 Ų83107.6 Ų107.686%0.85681%0.81SS**  trans103.4141.5162.800000117.9
325G31.9Very low35.4Very low85 Ų85116.8 Ų116.888%0.87683%0.825SS**  trans78.2132.717300000115.3
326G32Very low35.1Very low86 Ų86114.2 Ų114.289%0.88781%0.812SS**  cis113.4127.12.300000111.8
327G30.5Very low35.2Very low70 Ų70117.6 Ų117.672%0.72282%0.817SS**  cis-130.5175.3-1.700000112.4
328S37.3Very low35Very low112 Ų112113.4 Ų113.478%0.78380%0.802SS**  68.7126.675.9-144.90000112.3
329L39.7Very low35.3Very low149 Ų149114.9 Ų114.978%0.7880%0.799SS**  cis-151.514140.3-79.9160.3000114.9
330S34.9Very low35.2Very low105 Ų105115.5 Ų115.573%0.73480%0.798SS**  trans60147.613483.30000121.1
331T39Very low35.2Very low116 Ų116115 Ų11571%0.71280%0.795SS**  cis-134.8-169.40.457.70000108.3
332N35Very low35.2Very low128 Ų128113.9 Ų113.968%0.68479%0.792SS**  cis-146142.64.6-114.9-33.1000107.7
333V35.8Very low35.1Very low137 Ų137113.9 Ų113.983%0.8379%0.787SS**  47.7118.397.3-172.70000115.1
334G34.1Very low35.4Very low66 Ų66115 Ų11568%0.6878%0.778SS**  cis162.4-168.8-500000114.1
335R40.2Very low35.7Very low254 Ų254119.3 Ų119.396%0.95878%0.775SS**  trans80.2143.9172.5-159.7179.3-173.2171.12.2117
336A34.8Very low35.6Very low80 Ų80120 Ų12066%0.66177%0.773SS**  170.8161.8-57.600000110.4
337V38.3Very low35.9Very low149 Ų149121.5 Ų121.590%0.90377%0.769SS**  trans74.3137173.9-167.40000114.6
338G33.7Very low37.6Very low55 Ų55123.5 Ų123.557%0.56777%0.77SS**  cis-159.1157.2-2.700000111.2
339L39.6Very low37.5Very low159 Ų159125.5 Ų125.583%0.83278%0.778SS**  66.1129.593.1-57.8-179.8000113.5
340T36.8Very low37.3Very low135 Ų135127.8 Ų127.883%0.82878%0.781SS**  cis-153174.315.5-0.80000112.8
341S33.2Very low38.3Very low118 Ų118128.3 Ų128.383%0.82578%0.782SS**  trans-100.2-172.8-169.4-40.50000115.9
342A34.6Very low38Very low94 Ų94128.4 Ų128.478%0.77779%0.787SS**  trans89151.3166.800000116.4
343T35.5Very low38.1Very low130 Ų130129.6 Ų129.680%0.79879%0.792SS**  cis-142.7163.38.8-43.40000111.7
344T36.1Very low39Very low104 Ų104128.4 Ų128.464%0.63879%0.787SS**  trans-73159.5169.538.90000114.2
345H35.8Very low39.1Very low174 Ų174130 Ų13081%0.80679%0.788SS**  156.9150.6118.4-82-66000115.8
346A31Very low39.1Very low100 Ų100126 Ų12683%0.82678%0.78SS**  trans77.4142.7152.100000122.5
347S38.4Very low39.1Very low116 Ų116128.9 Ų128.981%0.81178%0.783SS**  trans-142.8-162.4168.9-280000106.2
348P66.6Low39.1Very low113 Ų113127.9 Ų127.973%0.73478%0.777SS**  cis-125.1179.7-46.339.5-26.1000111.8
349T33.7Very low39.5Very low154 Ų154133.4 Ų133.495%0.94579%0.789SS**  trans-168.3175.5148.56.80000116.4
350K36.2Very low40.5Very low196 Ų196130.6 Ų130.685%0.85278%0.78SS**  trans-109.2-165.2-171.9-81.7-177.9172.9179.30111.7
351P56Low40.9Very low117 Ų117131.3 Ų131.376%0.7678%0.776SS**  -135.4-169.1-58.540.8-24.1000113.2
352S31.9Very low41.3Very low117 Ų117134.1 Ų134.182%0.81877%0.773SS**  157.7171.8125.3-158.20000115.2
353I38.4Very low41.4Very low154 Ų154134.1 Ų134.179%0.7977%0.768SS**  trans-128.5-175.1-173.7-13.8175.2000110.8
354P53.4Low41.6Very low112 Ų112134.5 Ų134.573%0.72777%0.769SS**  cis-127.3-160.145.528.5-2.1000112.8
355S37.2Very low42.8Very low99 Ų99135 Ų13569%0.69277%0.774SS**  cis-155.7-162.722.7-51.10000110.4
356Q38.9Very low42.9Very low169 Ų169135.6 Ų135.679%0.7978%0.778SS**  cis-159.6146.21.6-146.9175.3-200113.9
357I36.7Very low43.3Very low141 Ų141136.4 Ų136.472%0.72378%0.777SS**  trans9.9125.1149.1-57.6166.8000122
358T36.3Very low43.4Very low128 Ų128136.3 Ų136.379%0.78578%0.776SS**  171.1138.6113.9-59.70000112.9
359Q42.6Very low42.1Very low172 Ų172135.2 Ų135.280%0.80478%0.777SS**  trans-154154.3169.4-92.6-79.6-28.100108.1
360P60.7Low43.5Very low100 Ų100133.6 Ų133.665%0.64977%0.769SS**  -159.8153.4104.938.8-18.9000119.9
361M45.1Very low43.3Very low150 Ų150130.7 Ų130.774%0.73977%0.767SS**  trans67.1147.2142-69.3165.5-177.400120.3
362F42.1Very low42.4Very low177 Ų177130.3 Ų130.378%0.77677%0.766SS**  cis-163179.42.3-111.9-37.4000108.2
363S36.3Very low42.6Very low94 Ų94132 Ų13266%0.65777%0.765SS**  cis-161.9168.9-2.7-128.20000111.5
364V40Very low43.1Very low137 Ų137130 Ų13083%0.8376%0.763SS**  trans-155.1-173.7177.8-62.40000110.4
365P60.7Low42.1Very low115 Ų115129.3 Ų129.375%0.74777%0.766SS**  cis-136.5172.1-12.642.1-25.3000116.9
366Q38.2Very low42.2Very low187 Ų187136.4 Ų136.487%0.87478%0.778SS**  trans-146.8129.8152.1-86.3-179.64.100107.9
367S40.2Very low42.3Very low117 Ų117134.7 Ų134.782%0.81878%0.779SS**  cis78130.548.6-155.50000112.6
368S40.5Very low42.4Very low113 Ų113139.7 Ų139.779%0.7979%0.789SS**  cis-150.8-167.617.465.10000114.1
369A39.1Very low42.3Very low91 Ų91140 Ų14075%0.75279%0.79SS**  trans-156.3-177.8173.900000109.3
370P63.9Low42.2Very low119 Ų119139.2 Ų139.277%0.77379%0.791SS**  cis-133.9-167.5-3.244.1-26.7000114.3
371V31.6Very low41.5Very low135 Ų135139.9 Ų139.982%0.81880%0.795SS**  trans166.5164.3142152.20000111.3
372C35.5Very low41.7Very low109 Ų109138.3 Ų138.374%0.73680%0.796SS**  trans-148.6163.5-174.6-84.10000109.1
373L36.8Very low41.6Very low153 Ų153135.9 Ų135.980%0.80180%0.798SS**  cis-159-155.10.2-110.8165.8000105.3
374P49.5Very low41.8Very low113 Ų113140.4 Ų140.473%0.73481%0.809SS**  cis-133.4175.8-5.342.3-24000117.1
375A31.7Very low41.6Very low97 Ų97143 Ų14380%0.80281%0.812SS**  trans37.7120.2145.300000123.7
376R40Very low40.4Very low248 Ų248146.8 Ų146.894%0.93682%0.819SS**  trans-144.8151.2131.8-166.8165.3179.1135-0.9111
377T40.8Very low40.5Very low133 Ų133143.5 Ų143.582%0.81682%0.817SS**  trans-84.7136.7-167.336.20000115.8
378R39.3Very low40.5Very low246 Ų246142.8 Ų142.893%0.92882%0.818SS**  trans-155.7151.6137.7-130173.1-175.7159.91.9111.4
379V33.4Very low40.6Very low135 Ų135141.5 Ų141.582%0.81882%0.822SS**PPolyproline II helixtrans-92.4143.1-170.8174.20000111.2
380L40.3Very low41.1Very low154 Ų154142.9 Ų142.981%0.80683%0.827SS**PPolyproline II helixtrans-101.8150.5164-99.169.9000110.4
381P46.9Very low40.6Very low115 Ų115141 Ų14175%0.74783%0.829SS**PPolyproline II helixtrans-72157.3179.831-35.7000112.8
382P47.8Very low41.6Very low116 Ų116140.7 Ų140.775%0.75383%0.827SS**PPolyproline II helixtrans-76.7151-175.331.4-36.2000113.5
383P40.5Very low42.6Very low127 Ų127142.1 Ų142.183%0.82583%0.832SS**PPolyproline II helixtrans-75.3139.6171.732-33.9000111.3
384Q40.5Very low43.5Very low188 Ų188138.8 Ų138.888%0.87983%0.827SS**PPolyproline II helixtrans-84.7144.3170.1-70.1-162.7-8.800111.6
385Q35.8Very low43.6Very low193 Ų193143.5 Ų143.590%0.90283%0.831SS**PPolyproline II helixtrans-82.6136177.3-63.3172-76.100110.6
386H36.3Very low44.8Very low194 Ų194147.5 Ų147.590%0.89884%0.836SS**PPolyproline II helixtrans-81116.9165.1-69.3-82.8000109.5
387S39.3Very low45.6Very low118 Ų118137.6 Ų137.683%0.82581%0.81SS**PPolyproline II helixtrans-78.3137.3167.545.50000110.5
388A41.8Very low46.3Very low101 Ų101133.9 Ų133.984%0.83580%0.799SS**PPolyproline II helixtrans-74.2132.6173.900000110.1S390A388-S390 PolarHBondContact O-N 3.33Å
389G42.7Very low47.2Very low86 Ų86125.2 Ų125.289%0.88779%0.786SS**  trans-72.5109.3-177.400000112.7
390S48.6Very low48.4Very low120 Ų120127.4 Ų127.484%0.83979%0.787SS**  trans-85.2116.3163-171.20000109.3A388 V392A388-S390 PolarHBondContact O-N 3.33Å; S390-V392 PolarHBondContact O-N 3.34Å
391G53.1Low49.5Very low79 Ų79129.1 Ų129.181%0.81479%0.791SS**  trans-93.976.4-16800000114.8
392V52.4Low49.7Very low129 Ų129131.4 Ų131.478%0.78279%0.794SS**  trans-135.7106.9158.4-179.20000109.1S390S390-V392 PolarHBondContact O-N 3.34Å
393V56.9Low50.3Low139 Ų139130.1 Ų130.184%0.84279%0.793SS**  trans-101106.2164.2176.20000107Y395V393-Y395 PolarHBondContact O-N 3.43Å
394A55.8Low51.1Low84 Ų84128.7 Ų128.769%0.69479%0.786SS**  trans-70.6108.8168.400000108.4M396A394-M396 VanDerWaalsContact C-N 3.31Å; A394-M396 PolarHBondContact O-N 3.21Å
395Y52.1Low52.2Low212 Ų212124.9 Ų124.983%0.83178%0.777SS**  trans-71.988.5172.9172.1-107.6000109.3V393 G397V393-Y395 PolarHBondContact O-N 3.43Å; Y395-G397 PolarHBondContact O-N 2.98Å
396M56.8Low53.4Low181 Ų181123.9 Ų123.989%0.89277%0.773SS**  trans-75.574168.4-161.78481.900108.5A394 G398A394-M396 VanDerWaalsContact C-N 3.31Å; A394-M396 PolarHBondContact O-N 3.21Å; M396-G398 PolarHBondContact O-N 3.33Å
397G56.2Low54.7Low39 Ų39118 Ų11840%0.40277%0.765SS.*  trans-69.895.3-177.400000112.2Y395 G399Y395-G397 PolarHBondContact O-N 2.98Å; G397-G399 PolarHBondContact O-N 3.34Å
398G55.2Low56.2Low56 Ų56116.7 Ų116.758%0.57775%0.752SS**  trans-65.4108.6171.600000111.1M396 E400M396-G398 PolarHBondContact O-N 3.33Å; G398-E400 PolarHBondContact O-N 2.68Å; G398-E400 VanDerWaalsContact O-N 3.11Å
399G59.5Low58Low64 Ų64116.6 Ų116.666%0.6674%0.737SS**  trans-82.944.3177.200000113.3G397 M402G397-G399 PolarHBondContact O-N 3.34Å; G399-M402 WeakPolarHBondContact O-CG 3.25Å
400E58.6Low59.7Low181 Ų181117.6 Ų117.685%0.84672%0.722SS**  trans-87.7-10.9-17467-170.6143.900114.2G398 M402G398-E400 PolarHBondContact O-N 2.68Å; G398-E400 VanDerWaalsContact O-N 3.11Å; E400-M402 PolarHBondContact O-N 3.18Å
401E63Low61.1Low189 Ų189114.7 Ų114.788%0.88371%0.705SS**  trans-73.634.9173.157.8-175.9-137.300113.9A403E401-A403 VanDerWaalsContact C-N 3.31Å; E401-A403 PolarHBondContact O-N 3.04Å
402M50.6Low62.4Low164 Ų164116.3 Ų116.381%0.80870%0.696SS**  trans-80.371.4179.3-75.2-67.8-67.200112.2G399 E400G399-M402 WeakPolarHBondContact O-CG 3.25Å; E400-M402 PolarHBondContact O-N 3.18Å
403A59.5Low63.9Low89 Ų89113.7 Ų113.774%0.73668%0.676SS**  trans52.462.615700000116.9E401E401-A403 VanDerWaalsContact C-N 3.31Å; E401-A403 PolarHBondContact O-N 3.04Å
404S57.8Low65.1Low97 Ų97112.4 Ų112.468%0.67866%0.66SS**  trans-56.9125.9160.4-53.80000110.1E406S404-E406 PolarHBondContact O-N 2.91Å
405P63.4Low66.3Low107 Ų107110.3 Ų110.370%0.69565%0.647SS**  trans-80.233.2-176.735-36.9000113G407P405-G407 PolarHBondContact O-N 3.35Å
406E62.3Low67.8Low172 Ų172106.2 Ų106.280%0.80464%0.639SS**THydrogen-bonded Turntrans-74.826.2-164.2-128.268.4-150.100115.1S404S404-E406 PolarHBondContact O-N 2.91Å
407G62.9Low68.7Low71 Ų71106.3 Ų106.373%0.73263%0.63SS**THydrogen-bonded Turntrans-170.724.6-169.700000116.2P405P405-G407 PolarHBondContact O-N 3.35Å
408V71.4Confident69.7Low90 Ų90112.2 Ų112.255%0.54565%0.646SS.*  trans-94.6118.1161.4-67.20000108.6M413V408-M413 HydrophobicContact CG2-SD 4.27Å
409D79.5Confident70.8Confident99 Ų99117.2 Ų117.253%0.52966%0.657SS.*  trans-79.3151.6176.9-174.677.3000110.9A411 D412 M413D409-A411 PolarHBondContact O-N 3.06Å; D409-A411 WeakPolarHBondContact OD2-CB 3.47Å; D409-A411 PolarHBondContact OD2-N 3.38Å; D409-D412 PolarHBondContact O-N 2.99Å; D409-M413 PolarHBondContact O-N 2.88Å; D409-M413 VanDerWaalsContact O-N 3.14Å
410D77.3Confident71.8Confident107 Ų107119.1 Ų119.157%0.57265%0.651SS**Hα-helixtrans-58.7-29.1177.8-79.8-36.8000112.3M413 Q414D410-M413 WeakPolarHBondContact OD1-CE 3.48Å; D410-Q414 WeakPolarHBondContact O-CB 3.5Å; D410-Q414 VanDerWaalsContact O-CG 3.25Å; D410-Q414 WeakPolarHBondContact O-CG 3.35Å; D410-Q414 PolarHBondContact O-N 2.92Å; D410-Q414 PolarHBondContact O-NE2 3.14Å
411A79.1Confident72.4Confident59 Ų59116.4 Ų116.449%0.48865%0.649SS.*Hα-helixtrans-70.1-37.6175.400000112.8D409 M413 Q414 G415D409-A411 PolarHBondContact O-N 3.06Å; D409-A411 WeakPolarHBondContact OD2-CB 3.47Å; D409-A411 PolarHBondContact OD2-N 3.38Å; A411-M413 VanDerWaalsContact C-N 3.35Å; A411-Q414 PolarHBondContact O-N 3.26Å; A411-G415 PolarHBondContact O-N 3.41Å
412D79.2Confident72.2Confident114 Ų114111.7 Ų111.761%0.6164%0.637SS**Hα-helixtrans-67.8-37.9175.9-81-25.4000110.9D409 G415 L416D409-D412 PolarHBondContact O-N 2.99Å; D412-G415 PolarHBondContact O-N 2.88Å; D412-L416 PolarHBondContact O-N 3.43Å
413M84.9Confident72.5Confident74 Ų74109.3 Ų109.337%0.36564%0.643SS.*Hα-helixtrans-64.6-45.2172.5-67.6-163.5-71.900111.9V408 D409 D410 A411 G415 L416 W417V408-M413 HydrophobicContact CG2-SD 4.27Å; D409-M413 PolarHBondContact O-N 2.88Å; D409-M413 VanDerWaalsContact O-N 3.14Å; D410-M413 WeakPolarHBondContact OD1-CE 3.48Å; A411-M413 VanDerWaalsContact C-N 3.35Å; M413-G415 VanDerWaalsContact C-N 3.31Å; M413-G415 PolarHBondContact O-N 3.17Å; M413-L416 WeakPolarHBondContact O-CB 3.28Å; M413-L416 PolarHBondContact O-N 2.9Å; M413-L416 VanDerWaalsContact O-N 3.17Å; M413-W417 PolarHBondContact O-N 3.34Å
414Q81.4Confident72.4Confident111 Ų111108.7 Ų108.752%0.51965%0.645SS.*Hα-helixtrans-58.9-40175.4-76.1165.172.200112.4D410 A411 L416 W417 H418D410-Q414 WeakPolarHBondContact O-CB 3.5Å; D410-Q414 VanDerWaalsContact O-CG 3.25Å; D410-Q414 WeakPolarHBondContact O-CG 3.35Å; D410-Q414 PolarHBondContact O-N 2.92Å; D410-Q414 PolarHBondContact O-NE2 3.14Å; A411-Q414 PolarHBondContact O-N 3.26Å; Q414-L416 VanDerWaalsContact C-N 3.29Å; Q414-L416 PolarHBondContact O-N 2.87Å; Q414-W417 PolarHBondContact O-N 3.16Å; Q414-H418 PolarHBondContact O-CD2 2.8Å; Q414-H418 PolarHBondContact O-N 3.21Å; Q414-H418 VanDerWaalsContact O-N 3.16Å
415G82.3Confident72.1Confident41 Ų41111.3 Ų111.342%0.42365%0.647SS.*Hα-helixtrans-59.1-35.8175.700000114A411 D412 M413 M419A411-G415 PolarHBondContact O-N 3.41Å; D412-G415 PolarHBondContact O-N 2.88Å; M413-G415 VanDerWaalsContact C-N 3.31Å; M413-G415 PolarHBondContact O-N 3.17Å; G415-M419 PolarHBondContact O-N 2.85Å
416L82.4Confident71.3Confident125 Ų125112.1 Ų112.165%0.65466%0.655SS**Hα-helixtrans-68.5-40.6175.9-72.5163.8000112.3D412 M413 Q414 M419D412-L416 PolarHBondContact O-N 3.43Å; M413-L416 WeakPolarHBondContact O-CB 3.28Å; M413-L416 PolarHBondContact O-N 2.9Å; M413-L416 VanDerWaalsContact O-N 3.17Å; Q414-L416 VanDerWaalsContact C-N 3.29Å; Q414-L416 PolarHBondContact O-N 2.87Å; L416-M419 PolarHBondContact O-N 3.45Å
417W76.6Confident70.1Confident184 Ų184109.6 Ų109.670%0.69766%0.656SS**Hα-helixtrans-64.8-41.2178-66.6111.1000112.2M413 Q414 M419 L420M413-W417 PolarHBondContact O-N 3.34Å; Q414-W417 PolarHBondContact O-N 3.16Å; W417-M419 PolarHBondContact O-N 3.16Å; W417-L420 HydrophobicContact CE3-CD1 3.76Å; W417-L420 HydrophobicContact CZ3-CD1 4Å; W417-L420 PolarHBondContact O-N 3.09Å; W417-L420 VanDerWaalsContact O-N 3.14Å
418H77.4Confident69.1Low163 Ų163112 Ų11276%0.75566%0.66SS**THydrogen-bonded Turntrans-67.7-12.5175.8-69.5-57.3000114.6Q414Q414-H418 PolarHBondContact O-CD2 2.8Å; Q414-H418 PolarHBondContact O-N 3.21Å; Q414-H418 VanDerWaalsContact O-N 3.16Å
419M76.9Confident67.5Low161 Ų161112.5 Ų112.579%0.79367%0.673SS**THydrogen-bonded Turntrans-87.9-7.6173.3-100.5-166.763.200114.1G415 L416 W417G415-M419 PolarHBondContact O-N 2.85Å; L416-M419 PolarHBondContact O-N 3.45Å; W417-M419 PolarHBondContact O-N 3.16Å
420L80.4Confident65.4Low104 Ų104115.6 Ų115.655%0.54569%0.688SS.*SBendtrans-80.2139172.8-61-179.8000110.3W417 S422W417-L420 HydrophobicContact CE3-CD1 3.76Å; W417-L420 HydrophobicContact CZ3-CD1 4Å; W417-L420 PolarHBondContact O-N 3.09Å; W417-L420 VanDerWaalsContact O-N 3.14Å; L420-S422 PolarHBondContact O-N 3.49Å
421P70.9Confident63.4Low123 Ų123116.3 Ų116.380%0.79970%0.699SS**  trans-65.3119.1176-20.232.4000111.5A423P421-A423 PolarHBondContact O-N 2.96Å
422S60.5Low61.4Low91 Ų91123 Ų12364%0.63671%0.712SS**  trans-57.8104.2172.3-640000110.9L420 G424L420-S422 PolarHBondContact O-N 3.49Å; S422-G424 VanDerWaalsContact C-N 3.27Å; S422-G424 PolarHBondContact O-N 3.36Å
423A55.9Low59.1Low113 Ų113126.8 Ų126.893%0.93473%0.726SS**THydrogen-bonded Turntrans-77.272.8-179.200000111.4P421P421-A423 PolarHBondContact O-N 2.96Å
424G57.8Low56.4Low76 Ų76131.7 Ų131.778%0.78474%0.742SS**THydrogen-bonded Turntrans-166.5-31.3176.500000116.6S422S422-G424 VanDerWaalsContact C-N 3.27Å; S422-G424 PolarHBondContact O-N 3.36Å
425E50.6Low54.4Low153 Ų153134.2 Ų134.272%0.71575%0.753SS**SBendtrans-132.162.7-156.158.2-168.3143.300115.8
426S47.5Very low52.5Low123 Ų123138.3 Ų138.386%0.8677%0.772SS**  trans-18010814233.20000112.3
427S36.1Very low50Low119 Ų119137.4 Ų137.483%0.83278%0.777SS**  trans-144.7120.9164.7-151.40000109.7
428P43.7Very low47.8Very low123 Ų123134.3 Ų134.380%0.79978%0.783SS**  trans-73.7130.6-177.429.3-33.5000110.9
429A37.8Very low45.7Very low100 Ų100132.8 Ų132.883%0.82679%0.785SS**  trans-70.8149.4-176.900000113.2
430L34.4Very low43.5Very low163 Ų163134.7 Ų134.785%0.85379%0.792SS**  trans-120.5152.1164.4-73.5179000109.7
431P35.5Very low41.3Very low123 Ų123141 Ų14180%0.79981%0.809SS**  trans-78.8145.7-153.728.7-36000115.5
432R36Very low39.5Very low200 Ų200141 Ų14176%0.75581%0.811SS**  trans-79.8112.7173.3-179.3-175.4-173.7-138.63.5110.2Y434R432-Y434 PolarHBondContact NH1-OH 3.27Å
433Q31.1Very low38.3Very low193 Ų193140.8 Ų140.890%0.90282%0.815SS**PPolyproline II helixtrans-93.3141.4172.6-167165.9-18.900111
434Y30Very low37.2Very low177 Ų177142.4 Ų142.469%0.69480%0.803SS**PPolyproline II helixtrans-92.4166.2-167.1-103.4-106.8000115R432R432-Y434 PolarHBondContact NH1-OH 3.27Å
435Q37.7Very low36.3Very low164 Ų164149.1 Ų149.177%0.76681%0.805SS**PPolyproline II helixtrans-59.5167.6176.5-138.1172.4-2.300113.3
436P42.3Very low35.5Very low127 Ų127151.3 Ų151.383%0.82581%0.812SS**  -140.7-175.99238.2-23000115.2
437S31.8Very low35Very low106 Ų106150.4 Ų150.474%0.74181%0.812SS**  trans-99.4165.3-164.449.80000114.8
438S29.8Very low35.3Very low118 Ų118150.4 Ų150.483%0.82581%0.81SS**  trans-156.1147.3143.154.70000112.1
439T32Very low35.1Very low131 Ų131152 Ų15280%0.80481%0.806SS**  trans-65.5146.7-178.543.70000113.6
440Q31Very low34.9Very low201 Ų201154 Ų15494%0.93981%0.808SS**  trans-85.4136.9154.9-76.3-166.1-32.800110
441R35.2Very low35.4Very low238 Ų238153.6 Ų153.690%0.89880%0.799SS**  trans-123.8134.4166.4-167.3-171.6-62.9-1750.9107.1
442S31.9Very low35.7Very low122 Ų122152.7 Ų152.785%0.85380%0.802SS**  trans-70.2136-178-175.60000112.2
443A36.8Very low35.9Very low87 Ų87151.5 Ų151.572%0.71981%0.81SS**  trans-179.7112.6134.200000112.5
444E31.9Very low36.2Very low146 Ų146145.8 Ų145.868%0.68280%0.803SS**  trans39.9112131.8-142.4-166.1-101.900120.8
445R38.3Very low36.9Very low217 Ų217145.5 Ų145.582%0.81981%0.812SS**  165.9135.9114.2-87.9162.3-165.2-171.54.4114.9
446K35.1Very low37Very low200 Ų200142.7 Ų142.787%0.8781%0.811SS**  trans40.7109.4162.5-76.6-169.2171.3-1760119.4
447A37.5Very low37.2Very low104 Ų104146.5 Ų146.586%0.8682%0.815SS**PPolyproline II helixtrans-71.1132159.800000112.2
448P42.4Very low38Very low119 Ų119148.6 Ų148.677%0.77382%0.816SS**PPolyproline II helixtrans-84144.2171.1-13.330.7000113.4V450P448-V450 PolarHBondContact O-N 2.84Å
449Q38Very low38.6Very low156 Ų156148.3 Ų148.373%0.72981%0.811SS**PPolyproline II helixtrans-63.7122.4176.9177.8-179.279.100112.4
450V34.3Very low39.1Very low143 Ų143148.7 Ų148.787%0.86781%0.813SS**PPolyproline II helixtrans-72.4130.1175.5-164.70000110.1P448P448-V450 PolarHBondContact O-N 2.84Å
451K43.9Very low39.4Very low154 Ų154145.8 Ų145.867%0.6781%0.809SS**  trans-123.1132.2171.6-68.8-174.7-178.31780110L453K451-L453 PolarHBondContact O-N 3.22Å
452A43Very low39.3Very low104 Ų104138.2 Ų138.286%0.8681%0.805SS**  trans-69.7127.4-176.700000111.9
453L40.2Very low39.4Very low174 Ų174136.3 Ų136.391%0.91181%0.805SS**  trans-137.1133.1169.7-60.8173.9000107.1K451K451-L453 PolarHBondContact O-N 3.22Å
454G37.1Very low39.4Very low74 Ų74137.5 Ų137.576%0.76381%0.814SS**  cis-174.1133.2-10.800000109
455L45.3Very low39.8Very low170 Ų170134 Ų13489%0.8982%0.817SS**  trans-79.4132-176.2-72.7171.5000112.2
456S40.1Very low39.9Very low105 Ų105128.9 Ų128.973%0.73482%0.815SS**  trans14108.1156.656.90000118.3
457K46.5Very low40.2Very low207 Ų207130.9 Ų130.990%0.982%0.817SS**  trans-91.9113.6156.5-74-174.5177.1-179.50110.3
458I47.6Very low40.3Very low150 Ų150130.5 Ų130.577%0.76981%0.814SS**  trans-99.7122.5156.6-60.1177000106.5V460I458-V460 PolarHBondContact O-N 3.24Å
459P42.7Very low39.9Very low112 Ų112128.6 Ų128.673%0.72782%0.816SS**  trans-80.3121.2-179.330.7-32.3000111.2
460V41.4Very low40Very low140 Ų140130.9 Ų130.985%0.84882%0.823SS**  trans-109.1115.6159.9179.20000107.3I458I458-V460 PolarHBondContact O-N 3.24Å
461V37.3Very low41.3Very low139 Ų139129.5 Ų129.584%0.84282%0.817SS**  trans-120.6133.4178.9171.30000108.4
462G33.1Very low41.7Very low80 Ų80128.1 Ų128.183%0.82582%0.824SS**  trans124.297.2168.600000114.2
463G34.9Very low41.5Very low82 Ų82131.2 Ų131.285%0.84583%0.825SS**  trans169.697.9174.900000110.2
464A36.7Very low42Very low111 Ų111128 Ų12892%0.91782%0.815SS**  trans-79.7150.4-170.700000113
465G40.2Very low42Very low72 Ų72133.2 Ų133.274%0.74282%0.819SS**  trans-110.4175.8179.300000114.8
466S40.1Very low41.5Very low110 Ų110127.9 Ų127.977%0.76980%0.799SS**  trans-148.9121.5165.8-79.60000107.4
467R41.2Very low41.4Very low242 Ų242132.4 Ų132.491%0.91381%0.808SS**  62.3137.586.9-67.8-179.6177.5-134.32.2113.6
468A39.5Very low40.7Very low97 Ų97126.1 Ų126.180%0.80280%0.802SS**  cis-174.7156.8-2000000109.2
469G34.1Very low39.9Very low78 Ų78131.3 Ų131.380%0.80481%0.812SS**  trans85.1165.5156.200000119.6
470K41.3Very low39.4Very low205 Ų205133.9 Ų133.989%0.89181%0.814SS**  trans-146.5-173.6179.1-63.9-172.7177.6-177.70109.5
471P62Low39.8Very low114 Ų114132.9 Ų132.974%0.7481%0.811SS**  -133.6159.5-70.140.1-24.5000115.4
472P50.5Low39.4Very low124 Ų124130.7 Ų130.781%0.80581%0.807SS**  trans-116.1156.9172.239.2-30000115.8
473L39.1Very low39.8Very low170 Ų170132.2 Ų132.289%0.8981%0.805SS**  trans-156-174.1175.6-61.5176.1000108.3
474P51.8Low40.7Very low106 Ų106134.1 Ų134.169%0.68880%0.802SS**  cis-137.6-170.1-6.742.4-23.4000115.9
475H36.6Very low40.6Very low184 Ų184131.8 Ų131.885%0.85279%0.789SS**  trans75152.8149.9-94.560.1000120.2
476A35.6Very low40.7Very low57 Ų57135.1 Ų135.147%0.47179%0.785SS.*  cis-152175.46.700000114.7
477H36.6Very low40.9Very low201 Ų201137.1 Ų137.193%0.93178%0.78SS**  trans74.5139.7168.2-38.2-72000118.1
478G31.5Very low40.9Very low75 Ų75133 Ų13377%0.77377%0.771SS**  cis172.2142.9-13.700000115.9
479R30.8Very low41Very low259 Ų259135.5 Ų135.598%0.97777%0.77SS**  trans77.5149.7171.4-79.4-168.7179.9-101.52.7121.6
480H33.4Very low41.3Very low166 Ų166139.4 Ų139.477%0.76977%0.772SS**  trans-120.7167.9173-120.5-55.7000108.3
481P49.4Very low41.4Very low119 Ų119134.1 Ų134.177%0.77376%0.761SS**  -135.8-169.159.141.8-23.5000112.7
482A30.2Very low40.7Very low92 Ų92135.4 Ų135.476%0.7676%0.762SS**  cis-142-173.26.600000112.3
483S40.7Very low40.7Very low113 Ų113137 Ų13779%0.7976%0.759SS**  trans-129-171.2-171.7-140.90000109.9
484P52.6Low41.1Very low121 Ų121132.6 Ų132.679%0.78675%0.754SS**  cis-139.8-179.50.342.8-23.7000117.8
485G35.2Very low40.6Very low63 Ų63137 Ų13765%0.64976%0.758SS**  trans138.488.2161.400000113.5
486E42.1Very low41.1Very low141 Ų141139.8 Ų139.866%0.65976%0.762SS**  72.6141.760.1101.9169-169.100113.8
487K45.4Very low41.6Very low152 Ų152143.9 Ų143.966%0.66178%0.775SS**  cis-173.3158.4-12.454.4-164.6169-149.20110.3
488E40.5Very low42.1Very low156 Ų156139.8 Ų139.873%0.72977%0.765SS**  cis-171.9139-39.4-109.6150.789.100111.1
489L42.2Very low43.1Very low149 Ų149142.2 Ų142.278%0.7877%0.767SS**  trans69147154.1-60170.9000123
490L39.5Very low43.5Very low160 Ų160135.1 Ų135.184%0.83876%0.757SS**  trans68.7157.6159-61.1152.5000117.3
491S44.3Very low43.7Very low95 Ų95131.5 Ų131.566%0.66476%0.756SS**  cis-138.5-125.3-3.7-140.40000114.2
492D46.5Very low43.1Very low140 Ų140131.9 Ų131.975%0.74976%0.756SS**  trans-132.6-18.7-135.5-176.252000116.3G494D492-G494 PolarHBondContact O-N 3.04Å
493E50.7Low43.9Very low159 Ų159133.3 Ų133.374%0.74376%0.758SS**  trans-80.1107.4-149.4-68.667.9-15500115.1
494G47.9Very low43.6Very low77 Ų77134.5 Ų134.579%0.79476%0.76SS**  trans-86.4148175.800000115D492D492-G494 PolarHBondContact O-N 3.04Å
495Y40.9Very low43Very low199 Ų199133.1 Ų133.178%0.7876%0.759SS**  trans-141.9147.4172.9-170-108.4000111.3
496W48Very low43.1Very low242 Ų242136.3 Ų136.392%0.91777%0.766SS**  trans-102.193.9-176.3-78.990.1000111.4T498W496-T498 PolarHBondContact O-N 2.83Å
497D45.7Very low43.3Very low142 Ų142135.2 Ų135.276%0.75977%0.771SS**  trans-77.3120.1176.1-90.7-44000113.1
498T46.2Very low43.3Very low116 Ų116134.9 Ų134.971%0.71278%0.777SS**  trans-82.2130.1179-630000109.6W496 S500W496-T498 PolarHBondContact O-N 2.83Å; T498-S500 PolarHBondContact O-N 2.86Å
499P53.1Low43.3Very low126 Ų126137 Ų13782%0.81879%0.787SS**  trans-74.475.617331.4-34.8000110.8A501P499-A501 PolarHBondContact O-N 3.38Å
500S38.8Very low43.4Very low109 Ų109135.5 Ų135.576%0.76279%0.788SS**  trans-73.3117.3161.2-171.50000108.2T498T498-S500 PolarHBondContact O-N 2.86Å
501A38Very low43.4Very low91 Ų91131.3 Ų131.375%0.75278%0.784SS**  trans-135.588-172.100000111.7P499P499-A501 PolarHBondContact O-N 3.38Å
502T37.6Very low43.3Very low126 Ų126134.3 Ų134.377%0.77379%0.791SS**  trans-136.3151.616016.70000108.8
503P45.3Very low43.2Very low122 Ų122135.6 Ų135.679%0.79279%0.793SS**  trans-90.5161.3-148.234.6-37.6000114.3
504T35.4Very low42.6Very low139 Ų139138.9 Ų138.985%0.85380%0.799SS**  trans-138.3125.2162.3-55.40000108.5
505A40.1Very low42.2Very low91 Ų91142.1 Ų142.175%0.75280%0.798SS**PPolyproline II helixtrans-80.1150.6176.800000110.7P507A505-P507 WeakPolarHBondContact O-CD 3.37Å
506T37.1Very low42.4Very low131 Ų131140.5 Ų140.580%0.80480%0.797SS**PPolyproline II helixtrans-85.7121.1173.748.40000111
507P45.5Very low42.2Very low118 Ų118137.9 Ų137.977%0.76679%0.792SS**PPolyproline II helixtrans-88.9119154.933-26.9000109A505A505-P507 WeakPolarHBondContact O-CD 3.37Å
508D45.8Very low42.3Very low144 Ų144137.2 Ų137.277%0.7779%0.787SS**PPolyproline II helixtrans-88132.8171.757.2-50.9000111.3S510D508-S510 PolarHBondContact O-N 2.98Å
509E41.3Very low42.4Very low202 Ų202136.3 Ų136.394%0.94479%0.792SS**  trans-82.7102.6-170.1-61.6-160.5147.500112.3
510S42.7Very low42.2Very low116 Ų116136.4 Ų136.481%0.81179%0.785SS**  trans-105.8131.4159.859.10000110D508D508-S510 PolarHBondContact O-N 2.98Å
511G40.1Very low42.7Very low72 Ų72136.3 Ų136.374%0.74278%0.784SS**  trans-90.6175.2-158.300000117.2
512L43.1Very low43.2Very low158 Ų158141.4 Ų141.483%0.82778%0.784SS**  trans73.3111.7166.4-65.5161.7000118.1
513Q43.6Very low43.5Very low167 Ų167141.7 Ų141.778%0.7878%0.781SS**  trans63.8120.8156.3-49.4-179.521.900116
514R37.7Very low43.8Very low228 Ų228141 Ų14186%0.8678%0.779SS**  cis-169.2136.738.344.8-109.8151.594.2-2.9112.9
515N40.6Very low44.4Very low146 Ų146140.5 Ų140.578%0.78178%0.78SS**  trans7.5139.8148.6-85.3-65.6000122.3
516Q43.8Very low44.8Very low165 Ų165142.4 Ų142.477%0.77179%0.788SS**  trans81.3134.6154.6-65.5173.745.600120.5
517K45.2Very low45.5Very low186 Ų186139.4 Ų139.481%0.80978%0.782SS**  trans66143.1158.8-84.7-178.2176.7179.30115.9
518I47.2Very low46.1Very low128 Ų128141.5 Ų141.566%0.65679%0.787SS**  cis-128.4139.74.2-72.693.7000109L520I518-L520 HydrophobicContact CG2-CB 4.21Å; I518-L520 HydrophobicContact CG2-CD1 3.91Å; I518-L520 HydrophobicContact CG2-CG 3.59Å
519A48Very low46.9Very low98 Ų98143.5 Ų143.581%0.8179%0.792SS**  trans-95.4125.3156.200000108.8
520L49.2Very low47.8Very low127 Ų127141.4 Ų141.467%0.66579%0.786SS**  trans-136.790167.3-83.6174.5000109I518I518-L520 HydrophobicContact CG2-CB 4.21Å; I518-L520 HydrophobicContact CG2-CD1 3.91Å; I518-L520 HydrophobicContact CG2-CG 3.59Å
521S49Very low48.1Very low107 Ų107147 Ų14775%0.74879%0.791SS**  trans-49142.1139-50.80000108.1
522R48.7Very low49Very low199 Ų199150.8 Ų150.875%0.75179%0.794SS**  trans-136.479.9173.5-146.3176.8-173.5102.76.5111.9
523D44.3Very low49.7Very low132 Ų132150.7 Ų150.771%0.70679%0.794SS**  trans29.8131.9136.4-6.7-56.1000119.6
524S51.5Low50.2Low107 Ų107153.4 Ų153.475%0.74880%0.798SS**  trans-70.6165.5178-40.50000115.2
525C48.3Very low50.7Low129 Ų129149 Ų14987%0.87279%0.792SS**  trans52.5107.4141.5-640000120.6
526S48Very low51.1Low131 Ų131149.1 Ų149.192%0.91679%0.792SS**  trans-152.6146.9134.456.10000109.6
527G52Low51.5Low67 Ų67146.1 Ų146.169%0.69179%0.787SS**  trans-172.2-65.3-173.600000115.1
528D57.4Low51.4Low163 Ų163146.2 Ų146.287%0.87279%0.791SS**  trans-110.279.8-167.9-71.1-54.5000114.1
529H62.6Low51.3Low186 Ų186149.1 Ų149.186%0.86180%0.801SS**  trans-139.567.8167-86.90.4000110.4
530L60.1Low51Low157 Ų157153.7 Ų153.782%0.82281%0.806SS**  trans-130.222.4178.7-80.3178000114.6
531Y50.7Low50.5Low235 Ų235150.9 Ų150.992%0.92281%0.807SS**SBendtrans-142.566.3171.2-80.5-70000111.8
532D58.4Low49.8Very low150 Ų150155.1 Ų155.180%0.80282%0.816SS**  trans-15351.3174.8-138.78.5000112.3
533L56.7Low49.2Very low157 Ų157150.9 Ų150.982%0.82281%0.808SS**SBendtrans-140.317.1-178.1-147.577.9000114.2
534Y54.6Low49.2Very low224 Ų224153.7 Ų153.788%0.87882%0.817SS**SBendtrans-148.543-179.5-92.5-69.4000113.5
535N49.5Very low48.7Very low135 Ų135158.9 Ų158.972%0.72282%0.82SS**  trans-153.2145.8153.1-57.7-74.1000104.7
536D48Very low48.2Very low149 Ų149156.3 Ų156.380%0.79782%0.816SS**  cis-150.3-171.8-9.1-125-1.7000108.1
537P52.9Low47.8Very low102 Ų102156.1 Ų156.166%0.66280%0.804SS**  trans-104.7172.9-16042.8-40.8000117.3
538E41.8Very low47.4Very low188 Ų188160.2 Ų160.288%0.87981%0.81SS**  trans63.7111.7157.7-46.6-14113100121.7
539E45.5Very low46.6Very low188 Ų188158.8 Ų158.888%0.87980%0.803SS**  trans-179.3135.5136.5-98.2-175153.100105.6
540E41.9Very low45.8Very low194 Ų194156 Ų15691%0.90780%0.799SS**  cis99.2140.430.5-165.7161.6-119.200114.3
541G37.7Very low44.5Very low68 Ų68156 Ų15670%0.70180%0.799SS**  trans85.4147.7-173.400000114.6
542E35.7Very low43.7Very low197 Ų197149.5 Ų149.592%0.92179%0.788SS**  cis-152.7161.8-10-77.5-167.6107.500106.4
543D36.7Very low43Very low109 Ų109148.5 Ų148.558%0.58379%0.788SS**  cis-155.5164.4-19.2164.353.4000105.8R545D543-R545 PolarHBondContact OD1-N 2.96Å; D543-R545 PolarHBondContact OD2-N 3.05Å
544Q43Very low42.6Very low191 Ų191146.8 Ų146.889%0.89379%0.786SS**  trans-156.6100.4135.4-113.5143.2112.500113.9G546Q544-G546 PolarHBondContact O-N 2.98Å
545R40.8Very low41.7Very low216 Ų216141 Ų14182%0.81578%0.778SS**  trans-49.3119.1167.9-178.6-173.1-176.4-73.8-3.8114.2D543D543-R545 PolarHBondContact OD1-N 2.96Å; D543-R545 PolarHBondContact OD2-N 3.05Å
546G37.4Very low41.7Very low76 Ų76140.2 Ų140.278%0.78478%0.781SS**  trans-155.990.9176.200000114.6Q544Q544-G546 PolarHBondContact O-N 2.98Å
547D39.8Very low41Very low127 Ų127138.4 Ų138.468%0.67978%0.78SS**  trans-75144.9172.8173.231.8000112.1
548N43.3Very low40.3Very low152 Ų152138.5 Ų138.581%0.81379%0.789SS**  trans170.2159.7136.7-99.7-89.8000113.7
549D41Very low39.9Very low134 Ų134138 Ų13872%0.71779%0.786SS**  trans-89.7154.3-166-90.4-62.2000118
550V45.7Very low39.3Very low128 Ų128137.4 Ų137.478%0.77678%0.781SS**  trans46.4135.7148.4-57.90000124.5
551N33.4Very low38.9Very low156 Ų156135 Ų13583%0.83477%0.767SS**  trans84155.2141.6-160.225.8000120.1
552S33.9Very low38.7Very low98 Ų98139.5 Ų139.569%0.68577%0.773SS**  trans93.192.7168.2-410000118.4
553T42.9Very low38.8Very low130 Ų130135.5 Ų135.580%0.79877%0.766SS**  trans-62.2151.1141.4-2.80000109.5
554P48.8Very low39.2Very low121 Ų121135.6 Ų135.679%0.78677%0.773SS**  -146.6166.47440-22.7000116.5
555S35.9Very low38.5Very low103 Ų103132.3 Ų132.372%0.7277%0.766SS**  trans-70.1170.5162.1-42.10000111.4
556P49.8Very low38.2Very low118 Ų118127.2 Ų127.277%0.76676%0.764SS**  -151.7152.793.440-22.9000117.9
557S33.7Very low38Very low111 Ų111132.1 Ų132.178%0.77677%0.766SS**  trans20.1133146.664.30000122.9
558A38.2Very low37.6Very low103 Ų103134.6 Ų134.685%0.85177%0.771SS**  -152.5135.8116.900000110.9
559E33.2Very low37.2Very low177 Ų177132 Ų13283%0.82776%0.764SS**  trans-103.3139.2175.7-52.717212300110.1
560F32.7Very low37.4Very low176 Ų176130.5 Ų130.577%0.77276%0.762SS**  -173.4115.6124.4-120.7-128000115.4
561K34.2Very low36.9Very low143 Ų143132 Ų13262%0.62277%0.765SS**  38.5116.2124.1-60.1-172.872.21780121.6
562M32.5Very low36.9Very low164 Ų164129.3 Ų129.381%0.80876%0.758SS**  trans61.6128.8138-69.389.117700121.5
563S38.2Very low36.8Very low113 Ų113131.2 Ų131.279%0.7977%0.766SS**  trans-58.1165.8163.8-29.70000113.5
564P45.1Very low36.5Very low110 Ų110130 Ų13071%0.71476%0.763SS**  -151.7150.395.840.7-24.1000118
565T28.7Very low35.8Very low122 Ų122129.7 Ų129.775%0.74876%0.764SS**  trans42.6130140.565.20000123.5
566S32.9Very low36Very low110 Ų110130.3 Ų130.377%0.76977%0.768SS**  96145.7123.8-80.60000123.2
567Q34.6Very low35.1Very low178 Ų178129.4 Ų129.483%0.83276%0.764SS**  trans87.6110.4149.7-81.8-178.630.600122
568K30.2Very low35.3Very low180 Ų180127.5 Ų127.578%0.78375%0.751SS**  104.189.4119.7-155.5160.7-174.6178.70119.6
569S34.9Very low35.5Very low97 Ų97131.2 Ų131.268%0.67875%0.748SS**  -4158.4124.654.80000118.2
570P46Very low35.9Very low103 Ų103129.7 Ų129.767%0.66974%0.741SS**  cis-161.3-171.846.247.7-26.2000119.8
571L35.9Very low36.1Very low160 Ų160127.3 Ų127.384%0.83875%0.746SS**  trans60135.7158.2-92.468.1000117.6
572S33.2Very low36.3Very low98 Ų98127.9 Ų127.969%0.68576%0.755SS**  cis-139.4-146.35.1-74.10000108.5
573T31.3Very low36.9Very low139 Ų139129.4 Ų129.485%0.85376%0.757SS**  cis-157.7172.67-33.70000109.9
574S37.5Very low36.9Very low104 Ų104127.8 Ų127.873%0.72776%0.759SS**  trans-111.4155.5-172.1-45.40000112.6
575S33.5Very low36.8Very low115 Ų115127.8 Ų127.880%0.80476%0.761SS**  179.717065.7-81.50000111
576S40.3Very low37.3Very low115 Ų115127 Ų12780%0.80477%0.767SS**  cis-176.9-174.2-23.3-170.20000109.1
577S30.3Very low37.9Very low100 Ų100127.2 Ų127.270%0.69977%0.768SS**  trans74111.6176-1460000116.3
578S37.8Very low38.1Very low70 Ų70126.5 Ų126.549%0.4977%0.769SS.*  cis75.913631.6-149.50000113.3
579F42.3Very low39Very low182 Ų182123.2 Ų123.280%0.79877%0.767SS**  cis-129.7151.615.5-68.4-99.7000110.6
580Q41.5Very low39.6Very low144 Ų144130.1 Ų130.167%0.67378%0.778SS**  cis83.6118.442.2-80-156.889.900117.5
581S36.7Very low39.7Very low126 Ų126132 Ų13288%0.88178%0.782SS**  trans-159.1152.5143.3-83.50000110
582L38.2Very low40.2Very low155 Ų155129.9 Ų129.981%0.81278%0.78SS**  trans-100.3162.1-154.5-91.275.1000116.6
583K46.6Very low41.2Very low197 Ų197134.1 Ų134.186%0.85779%0.786SS**  trans-84.1140.8-178.9-175.4174.5-176.3172.80111.5
584G36.8Very low41.9Very low79 Ų79135 Ų13581%0.81479%0.785SS**  trans-144125.6173.700000111.7
585S43.4Very low42.4Very low110 Ų110135.5 Ų135.577%0.76979%0.785SS**  trans-109.9139.1-173.4-480000111.6
586A40.1Very low42.9Very low105 Ų105136.5 Ų136.587%0.86879%0.786SS**  trans-174.8138.1141.400000111.1
587S45.3Very low42.7Very low115 Ų115136.5 Ų136.580%0.80479%0.786SS**  trans-97.5149.2163.650.80000110.2
588L39.1Very low43.4Very low163 Ų163137.9 Ų137.985%0.85379%0.79SS**  trans-173.6137.4142.6-100.7175.8000108.5
589P48.8Very low43.5Very low111 Ų111144.5 Ų144.572%0.72181%0.805SS**  trans-79.8155.1178.433.6-34.3000111.6
590R48.1Very low43.3Very low242 Ų242144.4 Ų144.491%0.91381%0.807SS**  trans-134.6110.6161.2-75.2-166.5174.3-169.4-1110.6S592R590-S592 PolarHBondContact O-N 2.8Å
591D47.7Very low43Very low143 Ų143143.2 Ų143.277%0.76581%0.809SS**  trans-54.1131.2161.6-77.6-93.4000110.7
592S45.2Very low43Very low114 Ų114142.4 Ų142.480%0.79780%0.804SS**  trans-144.886.2160.7-167.20000109.6R590R590-S592 PolarHBondContact O-N 2.8Å
593K53.7Low43.3Very low187 Ų187140.8 Ų140.881%0.81380%0.802SS**  trans-77.7118.6168.7-69.4172.6-179.7169.40109
594I46.3Very low43.2Very low159 Ų159137.2 Ų137.282%0.81580%0.8SS**  trans-152.4140.6152.5-103.7145.4000107.4
595P49.1Very low42.9Very low113 Ų113142.2 Ų142.273%0.73480%0.801SS**  trans-97.6149.7-140.434.8-36.4000115.9S597P595-S597 PolarHBondContact O-N 3.18Å
596V42.8Very low42.4Very low137 Ų137142.2 Ų142.283%0.8380%0.801SS**  trans-62.8112.6155.5-96.10000109.6T598V596-T598 PolarHBondContact O-N 3.11Å
597S37.7Very low42Very low115 Ų115143.5 Ų143.580%0.80480%0.798SS**  trans-8391.6175.1-171.90000110.3P595P595-S597 PolarHBondContact O-N 3.18Å
598T44.1Very low41.4Very low128 Ų128142.8 Ų142.879%0.78579%0.793SS**  trans-75.8123.116642.10000110.1V596V596-T598 PolarHBondContact O-N 3.11Å
599R39.4Very low41.2Very low209 Ų209143.1 Ų143.179%0.78979%0.79SS**  trans-143.698.6159.1-107.9-171.5-177.1-77.2-2.4112.4
600Q39.5Very low40.4Very low181 Ų181143.2 Ų143.285%0.84679%0.794SS**  trans-63.3145.7141.2-63.5177.1-3.800108.6
601T34.4Very low39.7Very low118 Ų118135.9 Ų135.972%0.72478%0.784SS**  -179.8134.912630.70000109.8
602S35.7Very low39.3Very low110 Ų110136.8 Ų136.877%0.76979%0.788SS**  trans-74.4164.4165.646.40000111.6
603P44.5Very low38.6Very low120 Ų120137 Ų13778%0.77979%0.79SS**  trans-90.6156.7-16235.4-36.9000115
604P44.5Very low37.7Very low123 Ų123133.3 Ų133.380%0.79979%0.788SS**  trans-111.2168.9158.237.6-29000113.2
605H31.4Very low37.1Very low184 Ų184131.4 Ų131.485%0.85278%0.784SS**  trans-102148.6-173.6-51.2-112.1000113.3
606S32Very low36.6Very low110 Ų110133 Ų13377%0.76979%0.785SS**  trans158122.2140.3-74.10000110.1
607V32.1Very low36.3Very low132 Ų132134.7 Ų134.780%0.878%0.784SS**  7097.4721800000114.4
608S32.5Very low36.2Very low100 Ų100133 Ų13370%0.69978%0.777SS**  trans161.9150.2138.4-78.80000110.4
609Q35.3Very low35.6Very low170 Ų170134.3 Ų134.379%0.79477%0.774SS**  cis-168.6175.7-25-118.7179.891.900107.3
610S31.6Very low35.5Very low113 Ų113129.7 Ų129.779%0.7977%0.769SS**  trans73.2121.3176.1-51.40000116.1
611A34.8Very low35.7Very low87 Ų87126.1 Ų126.172%0.71976%0.761SS**  cis86.31284300000112.5
612L38Very low36.2Very low162 Ų162126.1 Ų126.185%0.84876%0.764SS**  cis-145.8160.93-63.4171.9000110.7
613S32Very low36.5Very low120 Ų120126.9 Ų126.984%0.83977%0.766SS**  trans-177135.8133.2-85.50000115.6
614S33.1Very low36.1Very low109 Ų109130.4 Ų130.476%0.76277%0.769SS**  trans52.6117.6149.3-70.70000124.4
615V34Very low35.6Very low119 Ų119130.8 Ų130.872%0.72177%0.769SS**  79.3109.4123.7175.10000119.4
616L39.2Very low36.1Very low147 Ų147129 Ų12977%0.7776%0.761SS**  trans48.1139.9136.9-50.1178000119.6
617E36.8Very low36.6Very low171 Ų171127.3 Ų127.380%0.79975%0.754SS**  cis-152.9179.717.5-14216612800113.2
618A35.2Very low37Very low79 Ų79127.2 Ų127.265%0.65376%0.756SS**  trans-32.8157.4174.300000119.2
619E31.5Very low37.9Very low157 Ų157129.6 Ų129.673%0.73476%0.756SS**  cis-163.5142-9.3-120.3-150.476.200112.6
620T36.7Very low38.6Very low111 Ų111126.7 Ų126.768%0.68175%0.752SS**  trans49179.7143.169.50000119.8
621P43.4Very low39.3Very low106 Ų106126.1 Ų126.169%0.68875%0.753SS**  -130163.2-98.535.3-14.9000116.6
622P45.7Very low40.2Very low119 Ų119133.3 Ų133.377%0.77376%0.762SS**PPolyproline II helixtrans-83.9138.7-179.532.7-34.8000113.8
623P41.6Very low41Very low126 Ų126131.9 Ų131.982%0.81876%0.76SS**PPolyproline II helixtrans-73.9138.9160.631.1-32.1000110.8
624K35.9Very low42.2Very low194 Ų194137.8 Ų137.884%0.84376%0.764SS**PPolyproline II helixtrans-59.9157.2173.2-56.3149.7-175.1172.10110.6
625T35.6Very low43.6Very low130 Ų130139.3 Ų139.380%0.79876%0.762SS**  163.3152.1107.9-63.10000112.3
626H41.1Very low44.7Very low148 Ų148139.3 Ų139.369%0.68577%0.765SS**  trans81.8124.1162.5-135.6-73.4000119
627A41.7Very low45.4Very low74 Ų74138.2 Ų138.261%0.61276%0.764SS**PPolyproline II helixtrans-74.3152.6168.700000111.5Q629A627-Q629 PolarHBondContact O-N 3.26Å
628P40.3Very low46.1Very low130 Ų130135.2 Ų135.284%0.84476%0.762SS**PPolyproline II helixtrans-67.1128.8179.327.2-34.2000111.9
629Q52.9Low47.2Very low150 Ų150140.9 Ų140.970%0.70177%0.772SS**PPolyproline II helixtrans-69.7144.4169.7-71.5-75.5-1400110.2A627A627-Q629 PolarHBondContact O-N 3.26Å
630P49.6Very low48.6Very low109 Ų109138.7 Ų138.771%0.70877%0.769SS**PPolyproline II helixtrans-63.4143.6-177.625.5-33.9000112.3R632P630-R632 PolarHBondContact O-N 3.45Å
631A45.6Very low49.5Very low100 Ų100138.8 Ų138.883%0.82677%0.771SS**  trans-67.6103.4-17100000112.5T633A631-T633 PolarHBondContact O-N 2.86Å
632R53.3Low50.5Low239 Ų239139.9 Ų139.990%0.90278%0.776SS**  trans-63.5113.9170.8-81.6-179.6164.4149.6-3.9110.6P630 R634P630-R632 PolarHBondContact O-N 3.45Å; R632-R634 PolarHBondContact O-N 2.97Å; R632-R634 VanDerWaalsContact O-N 3.14Å
633T55.8Low51.4Low131 Ų131145.7 Ų145.780%0.80478%0.782SS**  trans-62.1108.9176.942.60000111.2A631 I635A631-T633 PolarHBondContact O-N 2.86Å; T633-I635 PolarHBondContact O-N 2.93Å; T633-I635 VanDerWaalsContact O-N 3.08Å
634R58.2Low52.4Low244 Ų244150.7 Ų150.792%0.92179%0.785SS**  trans-8089.9175.3-73.3-168174.9-154.3-0.2110.4R632R632-R634 PolarHBondContact O-N 2.97Å; R632-R634 VanDerWaalsContact O-N 3.14Å
635I61.8Low53.1Low141 Ų141147 Ų14772%0.72378%0.784SS**  trans-55.7126.5167.4-57.5174.9000108.4T633 V637T633-I635 PolarHBondContact O-N 2.93Å; T633-I635 VanDerWaalsContact O-N 3.08Å; I635-V637 PolarHBondContact O-N 3.02Å
636P56.3Low53.6Low119 Ų119144.5 Ų144.577%0.77378%0.783SS**  trans-70.7103.1179.227.7-33.5000110.3S638P636-S638 PolarHBondContact O-N 2.97Å; P636-S638 VanDerWaalsContact O-N 3.11Å
637V54.2Low54Low125 Ų125143 Ų14376%0.75879%0.789SS**  trans-65.2109.1174.2-74.10000110.4I635 K639I635-V637 PolarHBondContact O-N 3.02Å; V637-K639 PolarHBondContact O-N 3.2Å; V637-K639 VanDerWaalsContact O-N 3.09Å
638S51.8Low54.6Low108 Ų108147.8 Ų147.876%0.75580%0.797SS**  trans-66.8107.9177.146.40000110.2P636 V640P636-S638 PolarHBondContact O-N 2.97Å; P636-S638 VanDerWaalsContact O-N 3.11Å; S638-V640 VanDerWaalsContact C-N 3.28Å; S638-V640 PolarHBondContact O-N 3.28Å
639K58.1Low55.2Low197 Ų197146.9 Ų146.986%0.85779%0.79SS**  trans-73.381176.7-75-162.8174.4-173.70111.1V637 P641V637-K639 PolarHBondContact O-N 3.2Å; V637-K639 VanDerWaalsContact O-N 3.09Å; K639-P641 WeakPolarHBondContact O-CD 3.11Å
640V60.5Low54.8Low112 Ų112144 Ų14468%0.67979%0.793SS**  trans-62.5121.6166.5-179.20000108.7S638 V642S638-V640 VanDerWaalsContact C-N 3.28Å; S638-V640 PolarHBondContact O-N 3.28Å; V640-V642 PolarHBondContact O-N 3.06Å; V640-V642 VanDerWaalsContact O-N 3.1Å
641P56.8Low54.6Low113 Ų113141.8 Ų141.873%0.73478%0.777SS**  trans-69.9107.8178.6-20.233.9000111.3K639 R643K639-P641 WeakPolarHBondContact O-CD 3.11Å; P641-R643 PolarHBondContact O-N 3.21Å; P641-R643 VanDerWaalsContact O-N 3.09Å
642V64.7Low54.8Low128 Ų128142.6 Ų142.678%0.77678%0.777SS**  trans-69.9105.2171.5179.10000108.6V640 R644V640-V642 PolarHBondContact O-N 3.06Å; V640-V642 VanDerWaalsContact O-N 3.1Å; V642-R644 PolarHBondContact O-N 3.33Å
643R64.4Low54.4Low242 Ų242136.5 Ų136.591%0.91377%0.766SS**  trans-67.195.8173.6-65.6-178.572.4-177.33109.2P641 S645P641-R643 PolarHBondContact O-N 3.21Å; P641-R643 VanDerWaalsContact O-N 3.09Å; R643-S645 PolarHBondContact O-N 3.22Å
644R62.5Low54.2Low231 Ų231135.8 Ų135.887%0.87277%0.767SS**  trans-65118.7169.3-57-17581.8-129.85.3108.2V642 G646V642-R644 PolarHBondContact O-N 3.33Å; R644-G646 PolarHBondContact O-N 3.24Å
645S50.4Low53.6Low117 Ų117128 Ų12882%0.81876%0.762SS**  trans-66.2117.1169.633.40000109.1R643 S647R643-S645 PolarHBondContact O-N 3.22Å; S645-S647 PolarHBondContact O-N 3.33Å
646G46.3Very low53.2Low77 Ų77125.2 Ų125.279%0.79477%0.768SS**  trans-75.5109.5177.800000110.9R644 K648R644-G646 PolarHBondContact O-N 3.24Å; G646-K648 PolarHBondContact O-N 3.39Å
647S49.8Very low52.7Low116 Ų116124.9 Ų124.981%0.81178%0.775SS**  trans-68.8106.8166.452.10000109.3S645S645-S647 PolarHBondContact O-N 3.33Å
648K54Low52.5Low175 Ų175126.3 Ų126.376%0.76182%0.815SS**PPolyproline II helixtrans-76.1127.3174.6-169.4179.1178.9-169.90109G646G646-K648 PolarHBondContact O-N 3.39Å
649P52.9Low52.5Low110 Ų110127.2 Ų127.271%0.71482%0.818SS**PPolyproline II helixtrans-68.3139.6175.828.7-33.8000110.2
650A44.5Very low52.2Low91 Ų91123.5 Ų123.575%0.75282%0.816SS**PPolyproline II helixtrans-80.7130.1174.200000110.2
651T45.1Very low51.7Low61 Ų61124.2 Ų124.237%0.37482%0.824SS.*  trans-100.9112.8-178.916.60000109.4V81V81-T651 WeakPolarHBondContact CB-O 3.16Å; V81-T651 WeakPolarHBondContact CB-OG1 3.32Å; V81-T651 HydrophobicContact CG1-CG2 4.48Å; V81-T651 WeakPolarHBondContact CG2-O 3.33Å; V81-T651 PolarHBondContact O-OG1 3.21Å
652S49.4Very low51.4Low117 Ų117124.8 Ų124.882%0.81883%0.829SS**  trans-84.9129.2-178.743.40000112.1
653T45.3Very low50.6Low111 Ų111124.6 Ų124.668%0.68183%0.833SS**  trans-129.684.9167.1530000109.9V81 G655V81-T653 HydrophobicContact CG1-CG2 4.07Å; V81-T653 HydrophobicContact CG2-CG2 3.92Å; V81-T653 VanDerWaalsContact CG2-OG1 3.32Å; V81-T653 WeakPolarHBondContact CG2-OG1 3.5Å; T653-G655 PolarHBondContact O-N 3.13Å
654S50.6Low49.7Very low117 Ų117116.8 Ų116.882%0.81883%0.827SS**  trans-71.6115165.550.50000109.3
655G46.2Very low48.8Very low79 Ų79108.6 Ų108.681%0.81482%0.824SS**PPolyproline II helixtrans-66.2131.5169.600000110.6T653T653-G655 PolarHBondContact O-N 3.13Å
656G53.4Low48.7Very low84 Ų84108 Ų10887%0.86683%0.825SS**PPolyproline II helixtrans-81.3137169.500000110.6
657A46.8Very low48.9Very low111 Ų111110.6 Ų110.692%0.91783%0.827SS**PPolyproline II helixtrans-98.7137161.400000108.7
658G48.2Very low48.8Very low155 Ų155110.1 Ų110.1100%1.59883%0.829SS**  trans-178.70-179.100000110

Retrieved 658 of 658 residues in 249.5 ms (Link to these results)