A0A061IAV1_CRIGR Loading...

Putative monooxygenase p33MONOX

Potential NADPH-dependent oxidoreductase. May be involved in the regulation of neuronal survival, differentiation and axonal outgrowth.

AlphaFold DB , UniProt , Accession A0A061IAV1, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Kiaa1191, Length 303 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
1M38.4Very low45.8Very low248 Ų248151.9 Ų151.9100%1.22284%0.843SS**  0119.10-57.4-67.7-169.800106.6
2A41.4Very low45.7Very low99 Ų99145.9 Ų145.982%0.81883%0.828SS**  cis-152.2151.55.200000108.1
3S41.1Very low45.7Very low102 Ų102144.9 Ų144.971%0.71383%0.831SS**PPolyproline II helixtrans-69.2139.9-178.946.70000112.3
4R48.2Very low46Very low246 Ų246143.2 Ų143.293%0.92883%0.832SS**PPolyproline II helixtrans-82.7118.9164.9-71.9-173.6177.5-156.7-0.5108.6
5Q49.3Very low46.2Very low164 Ų164137.3 Ų137.377%0.76681%0.814SS**PPolyproline II helixtrans-72.8140.4167.9-70-77-3000109.5
6P50.1Low46.7Very low113 Ų113137.5 Ų137.573%0.73482%0.82SS**PPolyproline II helixtrans-80.7117.4163.530.5-26.6000109.3V8P6-V8 PolarHBondContact O-N 3.35Å
7E43.8Very low47Very low191 Ų191139.2 Ų139.289%0.89382%0.823SS**PPolyproline II helixtrans-66.6118.8175.5-171.3172.7177.900110
8V49.6Very low47.1Very low125 Ų125135 Ų13576%0.75881%0.814SS**PPolyproline II helixtrans-80.3129.6175.8-1790000108.4P6 A10P6-V8 PolarHBondContact O-N 3.35Å; V8-A10 PolarHBondContact O-N 2.91Å; V8-A10 VanDerWaalsContact O-N 3.1Å
9P51.5Low47.5Very low114 Ų114139 Ų13974%0.7482%0.819SS**  trans-64.6113.7174.5-20.232000110.8L11P9-L11 PolarHBondContact O-N 2.83Å
10A43.9Very low47.5Very low98 Ų98140.9 Ų140.981%0.8182%0.822SS**  trans-63.8118.8166.100000108.6V8 A12V8-A10 PolarHBondContact O-N 2.91Å; V8-A10 VanDerWaalsContact O-N 3.1Å; A10-A12 VanDerWaalsContact C-N 3.31Å; A10-A12 PolarHBondContact O-N 2.98Å
11L46.3Very low48.1Very low171 Ų171139.2 Ų139.290%0.89582%0.818SS**  trans-64.492.4171.1-69.3166.3000108.7P9 P13P9-L11 PolarHBondContact O-N 2.83Å; L11-P13 WeakPolarHBondContact O-CD 3.36Å
12A44.4Very low49.3Very low80 Ų80134.6 Ų134.666%0.66180%0.797SS**  trans-66.5125165.200000108.5A10 S14A10-A12 VanDerWaalsContact C-N 3.31Å; A10-A12 PolarHBondContact O-N 2.98Å; A12-S14 VanDerWaalsContact C-N 3.28Å; A12-S14 PolarHBondContact O-N 2.76Å
13P46.5Very low49.9Very low133 Ų133134.5 Ų134.586%0.86479%0.788SS**  trans-7782.4173.430.7-32.3000109.3L11 G15L11-P13 WeakPolarHBondContact O-CD 3.36Å; P13-G15 PolarHBondContact O-N 2.96Å
14S49.7Very low50.7Low121 Ų121137.7 Ų137.785%0.84680%0.796SS**  trans-8892.8168.564.60000109.6A12A12-S14 VanDerWaalsContact C-N 3.28Å; A12-S14 PolarHBondContact O-N 2.76Å
15G48Very low51.2Low55 Ų55129.3 Ų129.357%0.56779%0.786SS**  trans-152.7137.8169.500000110.2P13 L17P13-G15 PolarHBondContact O-N 2.96Å; G15-L17 PolarHBondContact O-N 3.48Å
16P55.3Low51.3Low140 Ų140128.2 Ų128.291%0.90978%0.783SS**  trans-81.267.3-18035.6-32.4000108.6
17L52.2Low51.4Low167 Ų167128.7 Ų128.787%0.87479%0.787SS**  trans-115.6129.2170.7-119.284.9000109.6G15G15-L17 PolarHBondContact O-N 3.48Å
18G47.6Very low52Low63 Ų63130.5 Ų130.565%0.64979%0.786SS**  trans-50.6149-172.300000113.9M20G18-M20 VanDerWaalsContact C-N 3.27Å; G18-M20 PolarHBondContact O-N 3.19Å
19K54.4Low52.7Low211 Ų211135.4 Ų135.492%0.91779%0.791SS**  trans-55.684.2170.8-47.7174.9-172.3-177.50109.4S21K19-S21 PolarHBondContact O-N 3.36Å
20M48Very low53.2Low177 Ų177134.1 Ų134.187%0.87279%0.79SS**  trans-93.289.9163.7-70.7179.264.800106.6G18 L22G18-M20 VanDerWaalsContact C-N 3.27Å; G18-M20 PolarHBondContact O-N 3.19Å; M20-L22 PolarHBondContact O-N 3.06Å
21S60.2Low53.9Low106 Ų106136.8 Ų136.874%0.74178%0.783SS**  trans-55.1121.5168.151.10000108.4K19K19-S21 PolarHBondContact O-N 3.36Å
22L62.9Low54.8Low151 Ų151130.7 Ų130.779%0.79176%0.755SS**  trans-54.7139.1163.6-66.7166.4000107.7M20 I24M20-L22 PolarHBondContact O-N 3.06Å; L22-I24 PolarHBondContact O-N 2.97Å
23P54.9Low55.4Low96 Ų96136.8 Ų136.862%0.62376%0.762SS**  trans-61.3107.217624-31.2000109G25 M26P23-G25 PolarHBondContact O-N 2.86Å; P23-M26 HydrophobicContact CG-SD 4.36Å
24I58.1Low56.5Low170 Ų170136 Ų13687%0.87275%0.75SS**THydrogen-bonded Turntrans-58.2117.3164.1-8294.1000106.2L22L22-I24 PolarHBondContact O-N 2.97Å
25G57.9Low57.2Low70 Ų70135.3 Ų135.372%0.72274%0.738SS**THydrogen-bonded Turntrans136.4-12.8174.500000115.8P23 C27P23-G25 PolarHBondContact O-N 2.86Å; G25-C27 PolarHBondContact O-N 2.8Å
26M51.1Low57.8Low141 Ų141135.1 Ų135.170%0.69573%0.73SS**  trans-88.390.6170.8-68.3-17970.800109.4P23 R28P23-M26 HydrophobicContact CG-SD 4.36Å; M26-R28 VanDerWaalsContact C-N 3.29Å; M26-R28 PolarHBondContact O-N 3.29Å
27C53.7Low58.3Low123 Ų123135.3 Ų135.383%0.83172%0.723SS**  trans-56.397.5164-73.50000108.1G25 R29G25-C27 PolarHBondContact O-N 2.8Å; C27-R29 PolarHBondContact O-N 3.22Å
28R56.2Low58.9Low228 Ų228134.6 Ų134.686%0.8672%0.715SS**  trans-67.584.4161.1-67.4-169.2179.8-90.50105.8M26 A30M26-R28 VanDerWaalsContact C-N 3.29Å; M26-R28 PolarHBondContact O-N 3.29Å; R28-A30 VanDerWaalsContact C-N 3.26Å; R28-A30 PolarHBondContact O-N 2.68Å
29R63Low59.8Low229 Ų229136.4 Ų136.486%0.86471%0.71SS**  trans-62.3102.3161-134.1-170-60.5-118.43.5103.9C27 F31C27-R29 PolarHBondContact O-N 3.22Å; R29-F31 PolarHBondContact O-N 3.39Å
30A62.9Low60Low87 Ų87132.3 Ų132.372%0.71971%0.705SS**  trans-56.9112.5172.500000105.5R28 S32R28-A30 VanDerWaalsContact C-N 3.26Å; R28-A30 PolarHBondContact O-N 2.68Å; A30-S32 PolarHBondContact O-N 3.26Å
31F58.9Low60.8Low153 Ų153126.5 Ų126.567%0.67169%0.685SS**  trans-66.6102.8175.8-137.5-89.1000105.4R29 A36 M43R29-F31 PolarHBondContact O-N 3.39Å; F31-A36 HydrophobicContact CE1-CB 4.14Å; F31-M43 HydrophobicContact CE1-CE 4.2Å; F31-M43 HydrophobicContact CE1-SD 4.33Å; F31-M43 HydrophobicContact CE2-CE 4.36Å; F31-M43 HydrophobicContact CZ-CE 3.68Å; F31-M43 HydrophobicContact CZ-SD 4.19Å
32S65.8Low60.6Low43 Ų43126.6 Ų126.630%0.30168%0.683SS.*  trans-80.8138.917583.80000107.6A30 D34 D35A30-S32 PolarHBondContact O-N 3.26Å; S32-D34 PolarHBondContact O-N 2.85Å; S32-D35 VanDerWaalsContact OG-CB 3.29Å; S32-D35 WeakPolarHBondContact OG-CB 3.27Å; S32-D35 PolarHBondContact OG-N 3.19Å; S32-D35 VanDerWaalsContact OG-N 3.1Å; S32-D35 PolarHBondContact OG-OD2 3.2Å
33Y56.3Low60.8Low209 Ų209126.2 Ų126.282%0.8268%0.679SS**THydrogen-bonded Turntrans-66.5-25.4176.8-100.9-88.4000111.9L37Y33-L37 WeakPolarHBondContact O-CG 3.44Å
34D68.9Low61.2Low115 Ų115127.3 Ų127.362%0.61568%0.684SS**THydrogen-bonded Turntrans-69-46.3177.3-119.64.3000111.3S32 A36 L37 E38S32-D34 PolarHBondContact O-N 2.85Å; D34-A36 PolarHBondContact O-N 3.07Å; D34-L37 PolarHBondContact O-N 3.41Å; D34-L37 VanDerWaalsContact O-N 3.07Å; D34-E38 PolarHBondContact O-N 3.49Å
35D64.9Low61.4Low108 Ų108124 Ų12458%0.57867%0.674SS**Hα-helixtrans-61.3-29.9177.7-76.3-41.7000112.6S32 L37 D39S32-D35 VanDerWaalsContact OG-CB 3.29Å; S32-D35 WeakPolarHBondContact OG-CB 3.27Å; S32-D35 PolarHBondContact OG-N 3.19Å; S32-D35 VanDerWaalsContact OG-N 3.1Å; S32-D35 PolarHBondContact OG-OD2 3.2Å; D35-L37 VanDerWaalsContact C-N 3.32Å; D35-D39 WeakPolarHBondContact O-CB 3.12Å; D35-D39 PolarHBondContact O-N 3.06Å
36A61.5Low61.7Low50 Ų50125.1 Ų125.141%0.41367%0.668SS.*Hα-helixtrans-76.5-17.9179.700000113.6F31 D34F31-A36 HydrophobicContact CE1-CB 4.14Å; D34-A36 PolarHBondContact O-N 3.07Å
37L64.9Low62.6Low144 Ų144122.7 Ų122.775%0.75466%0.663SS**Hα-helixtrans-91.3-28.2176.2-67.4174.8000111.9Y33 D34 D35Y33-L37 WeakPolarHBondContact O-CG 3.44Å; D34-L37 PolarHBondContact O-N 3.41Å; D34-L37 VanDerWaalsContact O-N 3.07Å; D35-L37 VanDerWaalsContact C-N 3.32Å
38E64.9Low62.9Low153 Ų153123 Ų12372%0.71567%0.667SS**Hα-helixtrans-88.8-22.2-178.9-108.1151.5-177.700114.1D34 P40D34-E38 PolarHBondContact O-N 3.49Å; E38-P40 WeakPolarHBondContact O-CD 3.39Å
39D65.3Low63.3Low100 Ų100119.3 Ų119.354%0.53566%0.664SS.*  trans-93107.7175-165.61.3000112D35 A41D35-D39 WeakPolarHBondContact O-CB 3.12Å; D35-D39 PolarHBondContact O-N 3.06Å; D39-A41 PolarHBondContact O-N 3.33Å; D39-A41 WeakPolarHBondContact OD1-CB 3.41Å; D39-A41 PolarHBondContact OD1-N 3.32Å
40P60Low63.1Low125 Ų125114.4 Ų114.481%0.81265%0.652SS**  trans-761.6174.533.2-36.5000113E38E38-P40 WeakPolarHBondContact O-CD 3.39Å
41A63.4Low62.7Low55 Ų55112.8 Ų112.846%0.45565%0.645SS.*SBendtrans-67.2127.6175.100000110D39 M43D39-A41 PolarHBondContact O-N 3.33Å; D39-A41 WeakPolarHBondContact OD1-CB 3.41Å; D39-A41 PolarHBondContact OD1-N 3.32Å; A41-M43 PolarHBondContact O-N 2.84Å; A41-M43 VanDerWaalsContact O-N 3.1Å
42P57.8Low62.9Low108 Ų108110.9 Ų110.970%0.70165%0.65SS**  trans-59.2122.8175.723.8-31.3000108.6T44P42-T44 PolarHBondContact O-N 3.34Å
43M66.6Low62.6Low143 Ų143114.3 Ų114.370%0.70466%0.664SS**SBendtrans-45.8108.6173.8-79.5-168.26400109.5F31 A41F31-M43 HydrophobicContact CE1-CE 4.2Å; F31-M43 HydrophobicContact CE1-SD 4.33Å; F31-M43 HydrophobicContact CE2-CE 4.36Å; F31-M43 HydrophobicContact CZ-CE 3.68Å; F31-M43 HydrophobicContact CZ-SD 4.19Å; A41-M43 PolarHBondContact O-N 2.84Å; A41-M43 VanDerWaalsContact O-N 3.1Å
44T63.6Low62.9Low119 Ų119108.9 Ų108.973%0.7365%0.654SS**SBendtrans49.6108.1176.7-30.30000114.1P42P42-T44 PolarHBondContact O-N 3.34Å
45P60.9Low62Low101 Ų101114.7 Ų114.766%0.65667%0.667SS**PPolyproline II helixtrans-56.9140.5172.225.3-32.8000109.5
46P65.8Low62Low93 Ų93117.6 Ų117.660%0.60468%0.675SS**PPolyproline II helixtrans-53.8144176.223.3-32.9000109.2S48 M50P46-S48 PolarHBondContact O-N 3.31Å; P46-M50 HydrophobicContact CB-SD 4.28Å
47P69.6Low62.1Low91 Ų91120.4 Ų120.459%0.59169%0.689SS**PPolyproline II helixtrans-52.2135.6-177.920.9-31.5000109.7D49 M50P47-D49 PolarHBondContact O-N 2.88Å; P47-M50 HydrophobicContact CG-CG 4.22Å; P47-M50 HydrophobicContact CG-SD 4.15Å; P47-M50 PolarHBondContact O-N 3.45Å
48S60.6Low62.5Low130 Ų130120 Ų12091%0.90969%0.692SS**THydrogen-bonded Turntrans-60.6-6.6-173.6-53.50000114.7P46 M50P46-S48 PolarHBondContact O-N 3.31Å; S48-M50 VanDerWaalsContact C-N 3.33Å
49D63.4Low62.9Low149 Ų149118.8 Ų118.880%0.79769%0.689SS**THydrogen-bonded Turntrans-80.7-6.8173.2-16630000113.6P47 G51P47-D49 PolarHBondContact O-N 2.88Å; D49-G51 PolarHBondContact O-N 2.94Å
50M58.1Low62.9Low126 Ų126118.7 Ų118.762%0.62169%0.694SS**  trans-85.324.5175.3-71.9-174.764.900113.8P46 P47 S48 S52P46-M50 HydrophobicContact CB-SD 4.28Å; P47-M50 HydrophobicContact CG-CG 4.22Å; P47-M50 HydrophobicContact CG-SD 4.15Å; P47-M50 PolarHBondContact O-N 3.45Å; S48-M50 VanDerWaalsContact C-N 3.33Å; M50-S52 PolarHBondContact O-N 2.84Å; M50-S52 VanDerWaalsContact O-N 3.15Å
51G55Low63.1Low54 Ų54121.3 Ų121.356%0.55770%0.696SS**SBendtrans-63.6112173.100000111.4D49 I53D49-G51 PolarHBondContact O-N 2.94Å; G51-I53 PolarHBondContact O-N 2.88Å
52S62.5Low63Low112 Ų112129.8 Ų129.878%0.78372%0.716SS**  trans45.666.4163.267.90000115.5M50 P54M50-S52 PolarHBondContact O-N 2.84Å; M50-S52 VanDerWaalsContact O-N 3.15Å; S52-P54 WeakPolarHBondContact O-CD 3.16Å
53I59.9Low63.1Low116 Ų116133 Ų13360%0.59572%0.719SS**  trans-85.9102.9157.3-58.1162.4000105.6G51 W55G51-I53 PolarHBondContact O-N 2.88Å; I53-W55 PolarHBondContact O-N 3.31Å
54P62.3Low62.8Low94 Ų94135.9 Ų135.961%0.6172%0.723SS**  trans-60.9109.4167.124-30.1000106.1S52 K56S52-P54 WeakPolarHBondContact O-CD 3.16Å; P54-K56 PolarHBondContact O-N 3.43Å
55W51.2Low62.4Low237 Ų237138.5 Ų138.590%0.89873%0.727SS**  trans-60.186.7170.4-66.490.2000107.6I53 P57I53-W55 PolarHBondContact O-N 3.31Å; W55-P57 WeakPolarHBondContact O-CD 3.24Å
56K65.1Low62.2Low169 Ų169142 Ų14274%0.73574%0.735SS**  trans-77.5116.9170.8-72.3-170.1178.3-176.80106.1P54 V58P54-K56 PolarHBondContact O-N 3.43Å; K56-V58 PolarHBondContact O-N 3.39Å
57P62.5Low61.6Low109 Ų109144.8 Ų144.871%0.70874%0.743SS**  trans-60.2114.7171.624.6-31.3000107.9W55 I59W55-P57 WeakPolarHBondContact O-CD 3.24Å; P57-I59 VanDerWaalsContact C-N 3.3Å; P57-I59 HydrophobicContact CB-CG1 4.43Å; P57-I59 PolarHBondContact O-N 2.85Å
58V74Confident60.6Low135 Ų135147.9 Ų147.982%0.81876%0.755SS**  trans-75.290.8170.2176.50000106.3K56 P60K56-V58 PolarHBondContact O-N 3.39Å; V58-P60 VanDerWaalsContact O-CD 3.27Å; V58-P60 WeakPolarHBondContact O-CD 3.49Å
59I72.8Confident60Low129 Ų129150.6 Ų150.666%0.66275%0.751SS**  trans-76.4116.7173.5-61.5170.5000107.3P57 E61P57-I59 VanDerWaalsContact C-N 3.3Å; P57-I59 HydrophobicContact CB-CG1 4.43Å; P57-I59 PolarHBondContact O-N 2.85Å; I59-E61 PolarHBondContact O-N 2.82Å
60P66Low59Low97 Ų97150.5 Ų150.563%0.6376%0.755SS**  trans-69.2114.8177.4-18.833.4000110.5V58 R62V58-P60 VanDerWaalsContact O-CD 3.27Å; V58-P60 WeakPolarHBondContact O-CD 3.49Å; P60-R62 PolarHBondContact O-N 3.39Å
61E63.4Low58.6Low181 Ų181153.4 Ų153.485%0.84677%0.767SS**SBendtrans-68.217.9-178.5-63-172.7161.800115.2I59I59-E61 PolarHBondContact O-N 2.82Å
62R62.2Low57.8Low232 Ų232160.1 Ų160.188%0.87578%0.784SS**  trans-105.423.2-166.4-68.4-167.8-179.1147.62.1116.2P60P60-R62 PolarHBondContact O-N 3.39Å
63K60.2Low56.4Low177 Ų177158.2 Ų158.277%0.7778%0.783SS**SBendtrans-128.9-5.1-174.7-60-80.7-172.51690116.2
64Y58.8Low55.2Low203 Ų203157.7 Ų157.780%0.79680%0.795SS**SBendtrans-122.513.2-170.8-61.2-73000116.3H66Y64-H66 PolarHBondContact O-N 2.89Å
65Q56.4Low53.9Low173 Ų173157.9 Ų157.981%0.80881%0.805SS**THydrogen-bonded Turntrans-87.37.1-179-78-173.8-0.700115.7
66H56.2Low52.9Low176 Ų176152 Ų15282%0.81580%0.8SS**THydrogen-bonded Turntrans-110.29.5-171.2-88.9-70.6000116.5Y64Y64-H66 PolarHBondContact O-N 2.89Å
67L54.2Low51.5Low151 Ų151150.1 Ų150.179%0.79180%0.803SS**SBendtrans-93.9-11.7179.7-66.4177.5000115
68D47.9Very low50Low156 Ų156150.2 Ų150.283%0.83481%0.806SS**SBendtrans-105.422.1-171.3-59.6-20.2000114.4
69K48.9Very low47.8Very low187 Ų187149.6 Ų149.681%0.81381%0.807SS**  trans-12967.7174.8-65-172.5-178.8-175.50111.3
70T42.3Very low45.8Very low146 Ų146151.9 Ų151.990%0.89682%0.82SS**  trans-145.464.4157-53.40000108.7
71E49.6Very low44.3Very low188 Ų188151.2 Ų151.288%0.87982%0.822SS**  trans-140.6133.7157.9-171.4178.7169.600107.3
72E37.4Very low43Very low194 Ų194149 Ų14991%0.90782%0.821SS**  trans95.1106.2168.4-148.1-179-176.600119.3
73G32.6Very low41.7Very low73 Ų73144.2 Ų144.275%0.75382%0.818SS**  111.173126.900000121.4
74A35.9Very low40.7Very low104 Ų104141.3 Ų141.386%0.8682%0.817SS**  trans34.3126.1141.200000123.4
75A34.7Very low39.6Very low98 Ų98135.3 Ų135.381%0.8181%0.809SS**  162.9135100.900000115.2
76S30.5Very low38.5Very low115 Ų115133.4 Ų133.480%0.80481%0.81SS**  trans73.1121.5160.6-139.90000117
77V34.5Very low37.5Very low129 Ų129129.2 Ų129.278%0.78281%0.806SS**  -159.6140.854.8-131.40000112.5
78S31.3Very low36.4Very low111 Ų111128.5 Ų128.578%0.77681%0.808SS**  trans59.198.7155.5-76.10000123.8
79S29Very low36Very low121 Ų121128.8 Ų128.885%0.84681%0.81SS**  19.2121126.5-51.30000121.4
80L30.7Very low35.4Very low177 Ų177124.1 Ų124.193%0.92780%0.8SS**  -137.4122.1123.3-171.561.5000109.1
81A34.6Very low35.4Very low83 Ų83121.6 Ų121.669%0.68679%0.789SS**  trans-73.2138.2-176.100000112.2
82V35.7Very low34.7Very low136 Ų136119.9 Ų119.982%0.82479%0.786SS**  -153.5116.4126.5178.70000107.7
83T34.9Very low35.2Very low130 Ų130119 Ų11980%0.79878%0.779SS**  trans-132.1147.2153.7-12.10000107.4
84P38.5Very low35.5Very low116 Ų116121 Ų12175%0.75378%0.777SS**  -126.9126.1108.923.2-8000109.9
85A35.4Very low36.1Very low77 Ų77121.2 Ų121.264%0.63677%0.769SS**  56.8135.593.500000113.4
86T33Very low37.1Very low133 Ų133123 Ų12382%0.81677%0.769SS**  cis-172.8159-9.925.60000105.8
87A35.5Very low38.1Very low89 Ų89122.6 Ų122.674%0.73676%0.762SS**  trans72.6111.3158.300000118.3
88T31.4Very low38.9Very low136 Ų136125.2 Ų125.283%0.83476%0.763SS**  -166.513993.918.40000110.6S90T88-S90 PolarHBondContact O-N 2.79Å
89D38.6Very low40.1Very low162 Ų162123.8 Ų123.887%0.86676%0.758SS**  trans-42117.3160.6-176.820.2000111.7
90S38.2Very low41.3Very low89 Ų89126.9 Ų126.962%0.62276%0.756SS**  trans-150.8117.8153.972.70000108.8T88 D92T88-S90 PolarHBondContact O-N 2.79Å; S90-D92 PolarHBondContact O-N 2.68Å
91S41.3Very low42.5Very low93 Ų93121.1 Ų121.165%0.6573%0.734SS**  trans-36.7102167.4590000112K93S91-K93 VanDerWaalsContact C-N 3.25Å; S91-K93 PolarHBondContact O-N 2.68Å
92D35.4Very low43.9Very low152 Ų152121.1 Ų121.181%0.81373%0.725SS**  trans-71.187.3174-101.6-36.4000108.5S90 T94S90-D92 PolarHBondContact O-N 2.68Å; D92-T94 VanDerWaalsContact C-N 3.29Å; D92-T94 PolarHBondContact O-N 3.14Å
93K47.1Very low45.2Very low176 Ų176120.6 Ų120.677%0.76571%0.714SS**  trans-67.596.7162.7-66.9-179-177.4175.80105.9S91 P95S91-K93 VanDerWaalsContact C-N 3.25Å; S91-K93 PolarHBondContact O-N 2.68Å; K93-P95 WeakPolarHBondContact O-CD 3.4Å; K93-P95 VanDerWaalsContact O-N 3.07Å
94T38.3Very low47.2Very low115 Ų115119.2 Ų119.271%0.70671%0.705SS**  trans-46.1117.8168.350.60000108.4D92 V96D92-T94 VanDerWaalsContact C-N 3.29Å; D92-T94 PolarHBondContact O-N 3.14Å; T94-V96 PolarHBondContact O-N 2.86Å
95P49.5Very low49.2Very low108 Ų108119.3 Ų119.370%0.70170%0.698SS**  trans-65.8111.6176.125.4-31.2000107.1K93 V97K93-P95 WeakPolarHBondContact O-CD 3.4Å; K93-P95 VanDerWaalsContact O-N 3.07Å; P95-V97 HydrophobicContact CB-CG2 4.01Å; P95-V97 HydrophobicContact CG-CG2 4.32Å; P95-V97 PolarHBondContact O-N 3.46Å
96V54.8Low51.1Low134 Ų134120.6 Ų120.681%0.81269%0.692SS**  trans-65.780.8161.4178.20000106T94 K98T94-V96 PolarHBondContact O-N 2.86Å; V96-K98 PolarHBondContact O-N 2.91Å
97V51.8Low53.2Low107 Ų107117.9 Ų117.965%0.64867%0.673SS**  trans-69.8104.9171-178.60000105.2P95 A99P95-V97 HydrophobicContact CB-CG2 4.01Å; P95-V97 HydrophobicContact CG-CG2 4.32Å; P95-V97 PolarHBondContact O-N 3.46Å; V97-A99 PolarHBondContact O-N 3.46Å
98K52.3Low55.3Low184 Ų184116.1 Ų116.180%0.866%0.655SS**  trans-42.5128.4173.5-65.3-176.4-153.1174.90108.6V96 K100V96-K98 PolarHBondContact O-N 2.91Å; K98-K100 PolarHBondContact O-N 2.86Å
99A55.5Low57.7Low81 Ų81114.4 Ų114.467%0.66964%0.64SS**SBendtrans-6227.2-168.900000116.8V97 A101 T102V97-A99 PolarHBondContact O-N 3.46Å; A99-A101 VanDerWaalsContact C-N 3.32Å; A99-T102 PolarHBondContact O-OG1 3.26Å
100K55Low59.8Low187 Ų187111 Ų11181%0.81362%0.621SS**THydrogen-bonded Turntrans-86.30.5-179.8-160.3164.5177.2-177.90113.6K98K98-K100 PolarHBondContact O-N 2.86Å
101A56.3Low61.8Low56 Ų56110 Ų11046%0.46361%0.611SS.*THydrogen-bonded Turntrans-98.1-21.417500000113.6A99 I105A99-A101 VanDerWaalsContact C-N 3.32Å; A101-I105 WeakPolarHBondContact O-CD1 3.31Å; A101-I105 WeakPolarHBondContact O-CG1 3.17Å
102T63.4Low63.8Low82 Ų82111.5 Ų111.550%0.50361%0.606SS.*Hα-helixtrans-75.7-31.4-18057.20000112.3A99 V104 I105 M106A99-T102 PolarHBondContact O-OG1 3.26Å; T102-V104 PolarHBondContact O-N 2.87Å; T102-I105 PolarHBondContact O-N 3.4Å; T102-M106 VanDerWaalsContact O-CB 3.24Å; T102-M106 WeakPolarHBondContact O-CB 3.21Å; T102-M106 WeakPolarHBondContact O-CG 3.5Å; T102-M106 PolarHBondContact O-N 3.44Å
103H63.7Low66.2Low125 Ų125110.5 Ų110.558%0.57960%0.596SS**Hα-helixtrans-61.3-40.9178.9-177.7-83.7000112.5N107H103-N107 WeakPolarHBondContact O-CB 3.34Å; H103-N107 PolarHBondContact O-N 3.01Å
104V76.3Confident68.1Low102 Ų102105.4 Ų105.462%0.61858%0.58SS**Hα-helixtrans-68.5-41.4178.6178.80000110.7T102 S108T102-V104 PolarHBondContact O-N 2.87Å; V104-S108 WeakPolarHBondContact O-CB 3.39Å; V104-S108 PolarHBondContact O-N 2.98Å
105I80.7Confident70.4Confident118 Ų118106.5 Ų106.561%0.60558%0.577SS**Hα-helixtrans-67.2-43.9178.8-61.4168.3000110.6A101 T102 S108 L109A101-I105 WeakPolarHBondContact O-CD1 3.31Å; A101-I105 WeakPolarHBondContact O-CG1 3.17Å; T102-I105 PolarHBondContact O-N 3.4Å; I105-S108 PolarHBondContact O-N 3.17Å; I105-L109 WeakPolarHBondContact O-CB 3.33Å; I105-L109 PolarHBondContact O-N 3.17Å
106M76Confident72Confident104 Ų104105.7 Ų105.751%0.51256%0.564SS.*Hα-helixtrans-68.1-44178.5-71.8-67.2-65.500112.1T102 S108 L109 I110T102-M106 VanDerWaalsContact O-CB 3.24Å; T102-M106 WeakPolarHBondContact O-CB 3.21Å; T102-M106 WeakPolarHBondContact O-CG 3.5Å; T102-M106 PolarHBondContact O-N 3.44Å; M106-S108 VanDerWaalsContact C-N 3.33Å; M106-L109 PolarHBondContact O-N 3.33Å; M106-I110 WeakPolarHBondContact O-CB 3.12Å; M106-I110 WeakPolarHBondContact O-CD1 3.17Å; M106-I110 WeakPolarHBondContact O-CG1 3.22Å; M106-I110 PolarHBondContact O-N 2.86Å
107N76.3Confident73.4Confident76 Ų76102.8 Ų102.841%0.40655%0.55SS..Hα-helixtrans-66.8-38.1177.3-160.1-50.6000110.5H103 I110 T111H103-N107 WeakPolarHBondContact O-CB 3.34Å; H103-N107 PolarHBondContact O-N 3.01Å; N107-I110 PolarHBondContact O-N 2.95Å; N107-T111 VanDerWaalsContact O-CB 3.31Å; N107-T111 WeakPolarHBondContact O-CB 3.41Å; N107-T111 VanDerWaalsContact O-CG2 3.23Å; N107-T111 WeakPolarHBondContact O-CG2 3.2Å; N107-T111 PolarHBondContact O-N 3.09Å; N107-T111 PolarHBondContact O-OG1 3.3Å; N107-T111 WeakPolarHBondContact OD1-CG2 3.31Å
108S79.1Confident74.9Confident51 Ų51101.7 Ų101.736%0.35754%0.539SS..Hα-helixtrans-61.7-43170.7-178.10000112.4V104 I105 M106 T111 K112V104-S108 WeakPolarHBondContact O-CB 3.39Å; V104-S108 PolarHBondContact O-N 2.98Å; I105-S108 PolarHBondContact O-N 3.17Å; M106-S108 VanDerWaalsContact C-N 3.33Å; S108-T111 WeakPolarHBondContact CA-OG1 3.23Å; S108-T111 PolarHBondContact O-OG1 3.02Å; S108-K112 VanDerWaalsContact O-CB 3.22Å; S108-K112 WeakPolarHBondContact O-CB 3.1Å; S108-K112 VanDerWaalsContact O-CG 3.27Å; S108-K112 WeakPolarHBondContact O-CG 3.42Å; S108-K112 PolarHBondContact O-N 3.29Å
109L83.1Confident76.5Confident100 Ų10097 Ų9752%0.52452%0.52SS..Hα-helixtrans-64.9-46.7176.7-177.263.5000111.7I105 M106 Q113I105-L109 WeakPolarHBondContact O-CB 3.33Å; I105-L109 PolarHBondContact O-N 3.17Å; M106-L109 PolarHBondContact O-N 3.33Å; L109-Q113 WeakPolarHBondContact O-CB 3.2Å; L109-Q113 PolarHBondContact O-N 2.82Å
110I82.1Confident77.8Confident91 Ų91100.6 Ų100.647%0.46752%0.516SS..Hα-helixtrans-64.7-44.8179.8-66.8162.1000110.6M106 N107 T114M106-I110 WeakPolarHBondContact O-CB 3.12Å; M106-I110 WeakPolarHBondContact O-CD1 3.17Å; M106-I110 WeakPolarHBondContact O-CG1 3.22Å; M106-I110 PolarHBondContact O-N 2.86Å; N107-I110 PolarHBondContact O-N 2.95Å; I110-T114 WeakPolarHBondContact O-CB 3.08Å; I110-T114 PolarHBondContact O-N 3.43Å; I110-T114 PolarHBondContact O-OG1 3.19Å
111T80.3Confident79Confident68 Ų6898.6 Ų98.642%0.41751%0.508SS..Hα-helixtrans-68.1-43.5179.451.30000111.5N107 S108 T114 Q115N107-T111 VanDerWaalsContact O-CB 3.31Å; N107-T111 WeakPolarHBondContact O-CB 3.41Å; N107-T111 VanDerWaalsContact O-CG2 3.23Å; N107-T111 WeakPolarHBondContact O-CG2 3.2Å; N107-T111 PolarHBondContact O-N 3.09Å; N107-T111 PolarHBondContact O-OG1 3.3Å; N107-T111 WeakPolarHBondContact OD1-CG2 3.31Å; S108-T111 WeakPolarHBondContact CA-OG1 3.23Å; S108-T111 PolarHBondContact O-OG1 3.02Å; T111-T114 PolarHBondContact O-N 2.83Å; T111-Q115 WeakPolarHBondContact O-CB 3.45Å; T111-Q115 PolarHBondContact O-N 3.48Å
112K83.8Confident80.3Confident125 Ų12599.3 Ų99.354%0.54350%0.502SS..Hα-helixtrans-63.8-46174.5-76.4-170.4172.9-166.10112.2S108 T114 Q115 E116S108-K112 VanDerWaalsContact O-CB 3.22Å; S108-K112 WeakPolarHBondContact O-CB 3.1Å; S108-K112 VanDerWaalsContact O-CG 3.27Å; S108-K112 WeakPolarHBondContact O-CG 3.42Å; S108-K112 PolarHBondContact O-N 3.29Å; K112-T114 VanDerWaalsContact C-N 3.31Å; K112-T114 PolarHBondContact O-N 3.26Å; K112-Q115 PolarHBondContact O-N 3.48Å; K112-E116 WeakPolarHBondContact O-CB 3.11Å; K112-E116 WeakPolarHBondContact O-CG 3.46Å; K112-E116 PolarHBondContact O-N 3.17Å
113Q85.4Confident81.1Confident130 Ų13099.7 Ų99.761%0.60750%0.498SS*.Hα-helixtrans-61.5-42.3177.5-176.4-178.60.400111.2L109 S117L109-Q113 WeakPolarHBondContact O-CB 3.2Å; L109-Q113 PolarHBondContact O-N 2.82Å; Q113-S117 WeakPolarHBondContact O-CB 3.44Å; Q113-S117 PolarHBondContact O-N 2.87Å
114T86.1Confident81.8Confident69 Ų69102 Ų10242%0.42351%0.509SS..Hα-helixtrans-69.2-43.9178.8-57.80000111I110 T111 K112 S117 I118I110-T114 WeakPolarHBondContact O-CB 3.08Å; I110-T114 PolarHBondContact O-N 3.43Å; I110-T114 PolarHBondContact O-OG1 3.19Å; T111-T114 PolarHBondContact O-N 2.83Å; K112-T114 VanDerWaalsContact C-N 3.31Å; K112-T114 PolarHBondContact O-N 3.26Å; T114-S117 PolarHBondContact O-N 2.99Å; T114-I118 HydrophobicContact CG2-CD1 3.71Å; T114-I118 HydrophobicContact CG2-CG1 4.37Å; T114-I118 WeakPolarHBondContact O-CB 3.27Å; T114-I118 VanDerWaalsContact O-CG1 3.25Å; T114-I118 WeakPolarHBondContact O-CG1 3.23Å; T114-I118 PolarHBondContact O-N 3.38Å
115Q86.1Confident81.6Confident138 Ų138100.2 Ų100.265%0.64550%0.504SS*.Hα-helixtrans-64.7-44.1178.7-174.1175.612.900111.5T111 K112 Q119T111-Q115 WeakPolarHBondContact O-CB 3.45Å; T111-Q115 PolarHBondContact O-N 3.48Å; K112-Q115 PolarHBondContact O-N 3.48Å; Q115-Q119 WeakPolarHBondContact O-CB 3.46Å; Q115-Q119 PolarHBondContact O-N 2.82Å
116E83.3Confident81.2Confident91 Ų9197 Ų9743%0.42550%0.5SS..Hα-helixtrans-67.5-37.9174.4-74.1-171.4-156.500112K112 Q119 R120K112-E116 WeakPolarHBondContact O-CB 3.11Å; K112-E116 WeakPolarHBondContact O-CG 3.46Å; K112-E116 PolarHBondContact O-N 3.17Å; E116-Q119 PolarHBondContact O-N 2.84Å; E116-R120 WeakPolarHBondContact O-CB 3.39Å; E116-R120 WeakPolarHBondContact O-CG 3.37Å; E116-R120 PolarHBondContact O-N 3.25Å; E116-R120 IonicContact OE2-CZ 3.93Å; E116-R120 IonicContact OE2-NH2 2.97Å; E116-R120 PolarHBondContact OE2-NH2 3.01Å
117S85Confident80.8Confident74 Ų7497.6 Ų97.652%0.51751%0.505SS..Hα-helixtrans-62.9-49176.9-178.80000111.5Q113 T114 R120 F121Q113-S117 WeakPolarHBondContact O-CB 3.44Å; Q113-S117 PolarHBondContact O-N 2.87Å; T114-S117 PolarHBondContact O-N 2.99Å; S117-R120 PolarHBondContact O-N 2.86Å; S117-F121 WeakPolarHBondContact O-CB 3.25Å; S117-F121 PolarHBondContact O-N 3.48Å
118I84.1Confident80.6Confident83 Ų8399.9 Ų99.943%0.42651%0.508SS..Hα-helixtrans-61.9-46176.6-68.5168000109.9T114 R120 F121 E122T114-I118 HydrophobicContact CG2-CD1 3.71Å; T114-I118 HydrophobicContact CG2-CG1 4.37Å; T114-I118 WeakPolarHBondContact O-CB 3.27Å; T114-I118 VanDerWaalsContact O-CG1 3.25Å; T114-I118 WeakPolarHBondContact O-CG1 3.23Å; T114-I118 PolarHBondContact O-N 3.38Å; I118-R120 VanDerWaalsContact C-N 3.31Å; I118-R120 PolarHBondContact O-N 3.1Å; I118-F121 WeakPolarHBondContact O-CB 3.43Å; I118-F121 PolarHBondContact O-N 3.46Å; I118-F121 VanDerWaalsContact O-N 3.17Å; I118-E122 HydrophobicContact CG2-CG 4.31Å; I118-E122 WeakPolarHBondContact CG2-OE1 3.29Å; I118-E122 WeakPolarHBondContact O-CB 3.49Å; I118-E122 VanDerWaalsContact O-CG 3.29Å; I118-E122 WeakPolarHBondContact O-CG 3.47Å; I118-E122 PolarHBondContact O-N 3.35Å
119Q84.1Confident79.5Confident87 Ų87106 Ų10641%0.40754%0.537SS..Hα-helixtrans-63-36.7179.6-168.3-173.440.600112.5Q115 E116 Q123 R128Q115-Q119 WeakPolarHBondContact O-CB 3.46Å; Q115-Q119 PolarHBondContact O-N 2.82Å; E116-Q119 PolarHBondContact O-N 2.84Å; Q119-Q123 WeakPolarHBondContact O-CB 3.26Å; Q119-Q123 WeakPolarHBondContact O-CG 3.36Å; Q119-Q123 PolarHBondContact O-N 3.43Å; Q119-R128 VanDerWaalsContact NE2-NH2 3.12Å
120R82.8Confident78.4Confident156 Ų156104.8 Ų104.859%0.58954%0.541SS*.Hα-helixtrans-71.1-40.3174.3-72.6174.9-161.4-159.39.5111.6E116 S117 I118 E122 Q123 Q124E116-R120 WeakPolarHBondContact O-CB 3.39Å; E116-R120 WeakPolarHBondContact O-CG 3.37Å; E116-R120 PolarHBondContact O-N 3.25Å; E116-R120 IonicContact OE2-CZ 3.93Å; E116-R120 IonicContact OE2-NH2 2.97Å; E116-R120 PolarHBondContact OE2-NH2 3.01Å; S117-R120 PolarHBondContact O-N 2.86Å; I118-R120 VanDerWaalsContact C-N 3.31Å; I118-R120 PolarHBondContact O-N 3.1Å; R120-E122 VanDerWaalsContact C-N 3.34Å; R120-Q123 PolarHBondContact O-N 2.64Å; R120-Q124 VanDerWaalsContact O-CB 3.31Å; R120-Q124 WeakPolarHBondContact O-CB 3.42Å; R120-Q124 PolarHBondContact O-N 3.26Å
121F81.1Confident77.3Confident144 Ų144103.4 Ų103.463%0.63255%0.549SS*.Hα-helixtrans-60.1-45.6174172.6-98.2000111S117 I118 Q123 Q124 A125S117-F121 WeakPolarHBondContact O-CB 3.25Å; S117-F121 PolarHBondContact O-N 3.48Å; I118-F121 WeakPolarHBondContact O-CB 3.43Å; I118-F121 PolarHBondContact O-N 3.46Å; I118-F121 VanDerWaalsContact O-N 3.17Å; F121-Q123 PolarHBondContact O-N 3.47Å; F121-Q124 PolarHBondContact O-N 3.19Å; F121-A125 VanDerWaalsContact O-CB 3.23Å; F121-A125 WeakPolarHBondContact O-CB 3.4Å; F121-A125 PolarHBondContact O-N 3.39Å
122E83.7Confident76Confident71 Ų71107.2 Ų107.233%0.33256%0.557SS.*Hα-helixtrans-61-42.6174.9-74.2171.7176.800112I118 R120 A125 G126 L127I118-E122 HydrophobicContact CG2-CG 4.31Å; I118-E122 WeakPolarHBondContact CG2-OE1 3.29Å; I118-E122 WeakPolarHBondContact O-CB 3.49Å; I118-E122 VanDerWaalsContact O-CG 3.29Å; I118-E122 WeakPolarHBondContact O-CG 3.47Å; I118-E122 PolarHBondContact O-N 3.35Å; R120-E122 VanDerWaalsContact C-N 3.34Å; E122-A125 PolarHBondContact O-N 3.49Å; E122-G126 PolarHBondContact O-N 3.27Å; E122-G126 VanDerWaalsContact O-N 3.09Å; E122-L127 PolarHBondContact O-N 3Å
123Q80.9Confident74.9Confident90 Ų90107.1 Ų107.142%0.42157%0.567SS.*Hα-helixtrans-62.8-44.9174.1-75.117128.800112.3Q119 R120 F121 A125 G126 R128Q119-Q123 WeakPolarHBondContact O-CB 3.26Å; Q119-Q123 WeakPolarHBondContact O-CG 3.36Å; Q119-Q123 PolarHBondContact O-N 3.43Å; R120-Q123 PolarHBondContact O-N 2.64Å; F121-Q123 PolarHBondContact O-N 3.47Å; Q123-A125 VanDerWaalsContact C-N 3.31Å; Q123-A125 PolarHBondContact O-N 3.38Å; Q123-G126 PolarHBondContact O-N 2.96Å; Q123-R128 HydrophobicContact CG-CG 4.35Å; Q123-R128 VanDerWaalsContact NE2-CZ 3.28Å
124Q78.1Confident73.6Confident175 Ų175103.3 Ų103.382%0.81855%0.554SS**Hα-helixtrans-65.6-35.6179-168.779.615.600111.6R120 F121 G126R120-Q124 VanDerWaalsContact O-CB 3.31Å; R120-Q124 WeakPolarHBondContact O-CB 3.42Å; R120-Q124 PolarHBondContact O-N 3.26Å; F121-Q124 PolarHBondContact O-N 3.19Å; Q124-G126 VanDerWaalsContact C-N 3.28Å
125A71.6Confident72.4Confident63 Ų63106 Ų10652%0.52156%0.561SS.*THydrogen-bonded Turntrans-82.8-1.5177.500000113.3F121 E122 Q123 L127F121-A125 VanDerWaalsContact O-CB 3.23Å; F121-A125 WeakPolarHBondContact O-CB 3.4Å; F121-A125 PolarHBondContact O-N 3.39Å; E122-A125 PolarHBondContact O-N 3.49Å; Q123-A125 VanDerWaalsContact C-N 3.31Å; Q123-A125 PolarHBondContact O-N 3.38Å; A125-L127 PolarHBondContact O-N 3.02Å
126G71.5Confident71.2Confident50 Ų50110.1 Ų110.152%0.51558%0.577SS.*THydrogen-bonded Turntrans6717.3-177.200000113.9E122 Q123 Q124 R128E122-G126 PolarHBondContact O-N 3.27Å; E122-G126 VanDerWaalsContact O-N 3.09Å; Q123-G126 PolarHBondContact O-N 2.96Å; Q124-G126 VanDerWaalsContact C-N 3.28Å; G126-R128 PolarHBondContact O-N 2.93Å
127L68.9Low70Confident118 Ų118108.9 Ų108.962%0.61859%0.589SS**  trans-93.959-178.7-167.470.7000110.1E122 A125E122-L127 PolarHBondContact O-N 3Å; A125-L127 PolarHBondContact O-N 3.02Å
128R71.8Confident68.3Low123 Ų123110 Ų11046%0.46459%0.588SS.*SBendtrans-94160.7166-60.1-145.9105.11684.7109.9Q119 Q123 G126 A130Q119-R128 VanDerWaalsContact NE2-NH2 3.12Å; Q123-R128 HydrophobicContact CG-CG 4.35Å; Q123-R128 VanDerWaalsContact NE2-CZ 3.28Å; G126-R128 PolarHBondContact O-N 2.93Å; R128-A130 CarbonylContact O-C 3.25Å; R128-A130 VanDerWaalsContact O-C 3.25Å; R128-A130 PolarHBondContact O-N 3.2Å
129D55.8Low66.6Low180 Ų180110.8 Ų110.896%0.96360%0.597SS**SBendtrans-56.4-4.8176.5-15024.7000114.3G131D129-G131 PolarHBondContact O-N 3.2Å
130A59.6Low65.2Low75 Ų75111.7 Ų111.762%0.6261%0.609SS**SBendtrans-84.398.5159.400000107.7R128R128-A130 CarbonylContact O-C 3.25Å; R128-A130 VanDerWaalsContact O-C 3.25Å; R128-A130 PolarHBondContact O-N 3.2Å
131G60.3Low64Low61 Ų61110.7 Ų110.763%0.62961%0.611SS**  trans-38.6147.1-175.800000115.1D129 T133D129-G131 PolarHBondContact O-N 3.2Å; G131-T133 PolarHBondContact O-N 3.14Å
132Y52.4Low62.8Low149 Ų149111.4 Ų111.458%0.58462%0.616SS**  trans-30.4106.3179.5-171.3-99.8000112.1P134 H135 L138Y132-P134 HydrophobicContact CD1-CB 4.28Å; Y132-P134 HydrophobicContact CD1-CG 3.93Å; Y132-P134 HydrophobicContact CE1-CB 3.9Å; Y132-P134 HydrophobicContact CE1-CG 4.03Å; Y132-P134 VanDerWaalsContact O-CD 3.26Å; Y132-P134 WeakPolarHBondContact O-CD 3.45Å; Y132-H135 PolarHBondContact OH-CE1 2.96Å; Y132-L138 HydrophobicContact CE1-CD2 4.42Å
133T60.2Low61.5Low122 Ų122111.3 Ų111.375%0.74862%0.62SS**  trans-88.1105.5169.7-32.50000105.9G131 H135G131-T133 PolarHBondContact O-N 3.14Å; T133-H135 PolarHBondContact O-N 3.46Å
134P58.7Low60.3Low51 Ų51113.7 Ų113.733%0.33163%0.629SS.*  trans-59.2128.9-176.6-1730000108.5Y132 K136 L138Y132-P134 HydrophobicContact CD1-CB 4.28Å; Y132-P134 HydrophobicContact CD1-CG 3.93Å; Y132-P134 HydrophobicContact CE1-CB 3.9Å; Y132-P134 HydrophobicContact CE1-CG 4.03Å; Y132-P134 VanDerWaalsContact O-CD 3.26Å; Y132-P134 WeakPolarHBondContact O-CD 3.45Å; P134-K136 PolarHBondContact O-N 3.46Å; P134-L138 HydrophobicContact CB-CB 4.28Å
135H60Low59.1Low124 Ų124114.8 Ų114.857%0.57463%0.627SS**  trans-53.3139.8164.452.6-77.2000107.8Y132 T133 G137 L138Y132-H135 PolarHBondContact OH-CE1 2.96Å; T133-H135 PolarHBondContact O-N 3.46Å; H135-G137 PolarHBondContact O-N 3.27Å; H135-L138 PolarHBondContact O-N 3.39Å
136K61.2Low58.4Low225 Ų225118.1 Ų118.198%0.97864%0.636SS**THydrogen-bonded Turntrans-58.969.4-167.2-63.2-166.7178.4-164.30114.1P134P134-K136 PolarHBondContact O-N 3.46Å
137G58.1Low57.7Low66 Ų66125.1 Ų125.168%0.6865%0.647SS**THydrogen-bonded Turntrans179.8-12.3-175.400000115.5H135H135-G137 PolarHBondContact O-N 3.27Å
138L48.5Very low57.3Low96 Ų96124.4 Ų124.450%0.50365%0.647SS.*SBendtrans-92.2116.5176.5-145.269.7000110.6Y132 P134 H135Y132-L138 HydrophobicContact CE1-CD2 4.42Å; P134-L138 HydrophobicContact CB-CB 4.28Å; H135-L138 PolarHBondContact O-N 3.39Å
139T48.9Very low56.7Low100 Ų100120.8 Ų120.861%0.61364%0.643SS**  trans-61.5134.2-173.9510000111.5E141T139-E141 PolarHBondContact O-N 3.24Å; T139-E141 PolarHBondContact OG1-OE1 2.71Å
140T55Low56.9Low106 Ų106117.5 Ų117.565%0.6562%0.622SS**THydrogen-bonded Turntrans-76.527.2-167.551.90000114.7
141E58.1Low56.8Low135 Ų135116.5 Ų116.563%0.63161%0.614SS**THydrogen-bonded Turntrans-94.6-23.3-172.464.1-165.9143.700114.3T139T139-E141 PolarHBondContact O-N 3.24Å; T139-E141 PolarHBondContact OG1-OE1 2.71Å
142E55.4Low56.7Low160 Ų160119.2 Ų119.275%0.74861%0.613SS**SBendtrans-95.7-16.1-175.6-58.6-175.9157.200114K144E142-K144 PolarHBondContact O-N 3.47Å
143T56.6Low57.1Low68 Ų68118.4 Ų118.442%0.41762%0.615SS.*THydrogen-bonded Turntrans-84.5-1.5-174.755.20000115
144K55.4Low56.9Low141 Ų141118.7 Ų118.761%0.61361%0.605SS**Hα-helixtrans-74.6-31.4-175.5-65.2179.6-174.8173.70113E142E142-K144 PolarHBondContact O-N 3.47Å
145Y53.4Low56.9Low197 Ų197122.2 Ų122.277%0.77362%0.621SS**Hα-helixtrans-77.9-31.5-177.9-67.4-79.5000113.2
146L57.3Low56.7Low134 Ų134124.5 Ų124.570%0.70263%0.629SS**Hα-helixtrans-69.6-37177.1-71.3171.1000112.5V148 A149 E150L146-V148 PolarHBondContact O-N 3.33Å; L146-A149 PolarHBondContact O-N 3.38Å; L146-E150 PolarHBondContact O-N 3.32Å
147R56.6Low56.6Low197 Ų197120.9 Ų120.974%0.74362%0.62SS**Hα-helixtrans-65-35.8180-173.9177.4-67.4-166.9-1.2113.3A151R147-A151 PolarHBondContact O-N 3.46Å
148V59.7Low56.4Low102 Ų102126 Ų12662%0.61863%0.626SS**Hα-helixtrans-72.6-37.3-179.6178.10000111.2L146 L152L146-V148 PolarHBondContact O-N 3.33Å; V148-L152 PolarHBondContact O-N 3.46Å
149A59.8Low56.6Low47 Ų47126.5 Ų126.539%0.38864%0.638SS.*Hα-helixtrans-66.1-40.3176.300000112.1L146 L152 H153L146-A149 PolarHBondContact O-N 3.38Å; A149-L152 PolarHBondContact O-N 3.4Å; A149-H153 PolarHBondContact O-CD2 3.15Å; A149-H153 PolarHBondContact O-N 3.37Å
150E58.8Low56.8Low112 Ų112124.5 Ų124.552%0.52364%0.637SS.*Hα-helixtrans-68.9-36.5179.1-149.8-167.8152.100112.7L146 L152 H153 K154L146-E150 PolarHBondContact O-N 3.32Å; E150-L152 VanDerWaalsContact C-N 3.34Å; E150-L152 PolarHBondContact O-N 3.01Å; E150-H153 PolarHBondContact O-N 3.29Å; E150-K154 WeakPolarHBondContact O-CG 3.45Å; E150-K154 PolarHBondContact O-N 3.18Å; E150-K154 WeakPolarHBondContact OE1-CE 3.34Å; E150-K154 IonicContact OE1-NZ 3.69Å
151A59Low56.2Low53 Ų53128.6 Ų128.644%0.43865%0.648SS.*Hα-helixtrans-63.7-38.2175.500000112.5R147 H153 K154 L155R147-A151 PolarHBondContact O-N 3.46Å; A151-H153 VanDerWaalsContact C-N 3.34Å; A151-K154 PolarHBondContact O-N 3.33Å; A151-L155 PolarHBondContact O-N 3.21Å; A151-L155 VanDerWaalsContact O-N 3.15Å
152L57.4Low55.4Low118 Ų118128.6 Ų128.662%0.61866%0.658SS**Hα-helixtrans-67.3-36.8177.2-129.3170.7000111.5V148 A149 E150 K156V148-L152 PolarHBondContact O-N 3.46Å; A149-L152 PolarHBondContact O-N 3.4Å; E150-L152 VanDerWaalsContact C-N 3.34Å; E150-L152 PolarHBondContact O-N 3.01Å; L152-K156 PolarHBondContact O-N 3.18Å
153H60Low54.4Low133 Ų133126.7 Ų126.762%0.61666%0.657SS**Hα-helixtrans-72-35.6177.5-66.6-177.4000112.3A149 E150 A151 K156 L157A149-H153 PolarHBondContact O-CD2 3.15Å; A149-H153 PolarHBondContact O-N 3.37Å; E150-H153 PolarHBondContact O-N 3.29Å; A151-H153 VanDerWaalsContact C-N 3.34Å; H153-K156 PolarHBondContact O-N 3.5Å; H153-L157 WeakPolarHBondContact O-CG 3.43Å; H153-L157 PolarHBondContact O-N 3.44Å
154K57.7Low53.5Low127 Ų127134.3 Ų134.355%0.55268%0.678SS**Hα-helixtrans-68.7-39.8175.9-73.3177.5-171.3-87.10112.9E150 A151 K156 L157 Q158E150-K154 WeakPolarHBondContact O-CG 3.45Å; E150-K154 PolarHBondContact O-N 3.18Å; E150-K154 WeakPolarHBondContact OE1-CE 3.34Å; E150-K154 IonicContact OE1-NZ 3.69Å; A151-K154 PolarHBondContact O-N 3.33Å; K154-K156 VanDerWaalsContact C-N 3.31Å; K154-K156 PolarHBondContact O-N 2.95Å; K154-L157 PolarHBondContact O-N 2.93Å; K154-Q158 PolarHBondContact O-N 3.41Å
155L57.8Low52.7Low126 Ų126135.1 Ų135.166%0.6668%0.684SS**Hα-helixtrans-63.6-35.8175.3-104.6155.1000112.6A151 L157 Q158 S159A151-L155 PolarHBondContact O-N 3.21Å; A151-L155 VanDerWaalsContact O-N 3.15Å; L155-L157 VanDerWaalsContact C-N 3.32Å; L155-L157 PolarHBondContact O-N 3.49Å; L155-Q158 PolarHBondContact O-N 3.44Å; L155-S159 PolarHBondContact O-N 2.75Å
156K56.8Low52Low172 Ų172133.7 Ų133.775%0.74869%0.685SS**Hα-helixtrans-70.3-27.2179.8-170.1154.9178.51680113.3L152 H153 K154L152-K156 PolarHBondContact O-N 3.18Å; H153-K156 PolarHBondContact O-N 3.5Å; K154-K156 VanDerWaalsContact C-N 3.31Å; K154-K156 PolarHBondContact O-N 2.95Å
157L58.6Low51.3Low149 Ų149136 Ų13678%0.7869%0.689SS**Hα-helixtrans-84.6-23.9177.6-65.7175000113.5H153 K154 L155H153-L157 WeakPolarHBondContact O-CG 3.43Å; H153-L157 PolarHBondContact O-N 3.44Å; K154-L157 PolarHBondContact O-N 2.93Å; L155-L157 VanDerWaalsContact C-N 3.32Å; L155-L157 PolarHBondContact O-N 3.49Å
158Q54.2Low51.2Low173 Ų173132 Ų13281%0.80869%0.689SS**Hα-helixtrans-85.1-11.2174.9-88.2-178.1-27.500114.1K154 L155 G160K154-Q158 PolarHBondContact O-N 3.41Å; L155-Q158 PolarHBondContact O-N 3.44Å; Q158-G160 VanDerWaalsContact C-N 3.27Å; Q158-G160 PolarHBondContact O-N 3.46Å
159S52Low50.6Low107 Ų107133 Ų13375%0.74870%0.698SS**SBendtrans-87.821.3-177.9-171.70000114.2L155L155-S159 PolarHBondContact O-N 2.75Å
160G52.9Low49.3Very low58 Ų58135.2 Ų135.260%0.59872%0.716SS**SBendtrans-121.395.2177.700000112Q158Q158-G160 VanDerWaalsContact C-N 3.27Å; Q158-G160 PolarHBondContact O-N 3.46Å
161E43.3Very low48.6Very low191 Ų191135.9 Ų135.989%0.89373%0.732SS**  trans71.883.3145.3-150.9156.5163.800118.7
162T41.5Very low47.6Very low136 Ų136137.9 Ų137.983%0.83475%0.749SS**  trans-12784155.758.20000110.1
163T33.3Very low47Very low120 Ų120141 Ų14174%0.73676%0.761SS**  trans-156.3103.4164.6-65.70000110.9
164R38.7Very low46Very low227 Ų227140 Ų14086%0.85777%0.769SS**  trans67.7144.4149.9-49.7-91.8-177.9-179.4-0.7115.9
165E39Very low45.5Very low158 Ų158139.3 Ų139.374%0.73878%0.775SS**  cis-173145.1-8.8179.3-179.5-136.400104.6
166E38.5Very low45Very low167 Ų167139.4 Ų139.478%0.7878%0.783SS**  trans31.3117153-160.1-176.713900121.7
167K41.4Very low44.5Very low183 Ų183136.5 Ų136.580%0.79679%0.785SS**  145.2126.7128.5-168.2152.2-173.1156.40114.3
168P54.3Low43.6Very low113 Ų113134.5 Ų134.573%0.73478%0.783SS**  trans-92.6154.1165.336.4-29.1000110.4
169P47.4Very low43.3Very low124 Ų124131.3 Ų131.381%0.80578%0.776SS**  -151.5178.264.239.4-17.9000117.5
170A32.9Very low43.4Very low93 Ų93132.2 Ų132.277%0.76978%0.779SS**  trans85.3109.1149.400000120.8
171S44.8Very low43.2Very low125 Ų125138.2 Ų138.287%0.87479%0.791SS**  41.3107.2126.9-153.40000119.4
172A36.8Very low43.5Very low96 Ų96134.5 Ų134.579%0.79379%0.786SS**  trans-152.7119.6140.300000110.4S174A172-S174 PolarHBondContact O-N 3.31Å
173Q45.4Very low43.8Very low184 Ų184132.9 Ų132.986%0.8678%0.78SS**  trans-49.9116.4165173.1-176.4-30.600111.2
174S38.3Very low44.9Very low112 Ų112133 Ų13378%0.78378%0.784SS**  trans-108.3106.917061.20000110.6A172A172-S174 PolarHBondContact O-N 3.31Å
175T46.7Very low45.3Very low112 Ų112131.7 Ų131.769%0.68778%0.784SS**  trans-61131.7167.6-33.70000109.8S177T175-S177 PolarHBondContact O-N 3.43Å
176P47.9Very low45.9Very low127 Ų127133.5 Ų133.583%0.82579%0.792SS**  trans-76.191.5168.930-31.4000109.2
177S46.3Very low46.6Very low112 Ų112134.9 Ų134.978%0.78380%0.796SS**  trans-90.193.9161.7-1740000108T175T175-S177 PolarHBondContact O-N 3.43Å
178S39.3Very low47.1Very low106 Ų106131.8 Ų131.874%0.74180%0.797SS**  trans-126.693.7168.2174.40000107.2
179T48.9Very low47.2Very low107 Ų107136.6 Ų136.666%0.65680%0.801SS**  trans-59.6128.116224.70000108.5H181T179-H181 PolarHBondContact O-N 3.21Å; T179-H181 VanDerWaalsContact O-N 3.09Å
180P54.5Low47.1Very low125 Ų125134 Ų13481%0.81280%0.796SS**  trans-66.5115.5174.225-30.4000108.7S182P180-S182 PolarHBondContact O-N 3.22Å
181H48Very low48.1Very low184 Ų184139.8 Ų139.885%0.85280%0.798SS**PPolyproline II helixtrans-59.1127.8173.1-89.7-82.1000110.1T179T179-H181 PolarHBondContact O-N 3.21Å; T179-H181 VanDerWaalsContact O-N 3.09Å
182S48.8Very low48.6Very low114 Ų114143.4 Ų143.480%0.79780%0.799SS**PPolyproline II helixtrans-50.3137.4175.2-173.60000112.8P180P180-S182 PolarHBondContact O-N 3.22Å
183S49.1Very low49.3Very low101 Ų101144.9 Ų144.971%0.70680%0.8SS**PPolyproline II helixtrans-51.9136.3176.9-56.80000113K185S183-K185 PolarHBondContact O-N 3.41Å
184P55.2Low48.9Very low124 Ų124142.4 Ų142.481%0.80580%0.803SS**PPolyproline II helixtrans-62.9121.2172.2-19.531.2000110.6Q186P184-Q186 PolarHBondContact O-N 3.29Å; P184-Q186 VanDerWaalsContact O-N 3.1Å
185K48.7Very low49Very low198 Ų198140.6 Ų140.686%0.86180%0.803SS**  trans-54115172.5-69.2178.2177.7179.50109.3S183 K187S183-K185 PolarHBondContact O-N 3.41Å; K185-K187 PolarHBondContact O-N 3.43Å
186Q51.4Low48.7Very low197 Ų197141.3 Ų141.392%0.92181%0.812SS**  trans-66.3106.9169.7-68.2-147.5-22.600109P184P184-Q186 PolarHBondContact O-N 3.29Å; P184-Q186 VanDerWaalsContact O-N 3.1Å
187K52.3Low48.3Very low196 Ų196140.2 Ų140.285%0.85281%0.808SS**  trans-76.1117.4161.6-67.8176.9177-178.60106.2K185 R189K185-K187 PolarHBondContact O-N 3.43Å; K187-R189 PolarHBondContact O-N 3.24Å
188S51.1Low47.8Very low118 Ų118141.8 Ų141.883%0.82581%0.812SS**  trans-61.3113.8172.1590000108.3G190S188-G190 VanDerWaalsContact C-N 3.32Å; S188-G190 PolarHBondContact O-N 3.39Å
189R56.3Low47.6Very low213 Ų213140.7 Ų140.780%0.80481%0.81SS**  trans-74.492.4168.8178.8-179.8-71.2-85.22.5106.4K187 W191K187-R189 PolarHBondContact O-N 3.24Å; R189-W191 PolarHBondContact O-N 3.43Å
190G47Very low47.3Very low69 Ų69143.5 Ų143.571%0.71182%0.82SS**  trans-62.1125.817300000110.6S188S188-G190 VanDerWaalsContact C-N 3.32Å; S188-G190 PolarHBondContact O-N 3.39Å
191W52.7Low46.9Very low215 Ų215143.3 Ų143.381%0.81482%0.819SS**  trans-102.567.7173.8-89.214.9000109.9R189R189-W191 PolarHBondContact O-N 3.43Å
192F56.8Low46.2Very low201 Ų201138.1 Ų138.188%0.88282%0.815SS**  trans-154.2129.2159.9-66.8-68.6000109.2
193P49.6Very low45.9Very low128 Ų128138.8 Ų138.883%0.83182%0.816SS**  trans-78.4127.7168.630.5-28.1000109.7
194S38.5Very low45.4Very low131 Ų131141.6 Ų141.692%0.91682%0.824SS**  trans-59.4133.4168.2-73.30000111.7
195G40.4Very low45.1Very low75 Ų75140.6 Ų140.677%0.77382%0.817SS**  trans-124.8126.9158.900000110.7
196S39.9Very low44.4Very low127 Ų127140.8 Ų140.889%0.88882%0.821SS**  trans-47.2167.1167.5-79.20000114.7
197S39.5Very low43.9Very low104 Ų104137 Ų13773%0.72781%0.811SS**  cis170.2131.9-19.2173.40000105.8
198T36.7Very low43.7Very low144 Ų144136.5 Ų136.588%0.88381%0.814SS**  trans173.1140.5154.542.50000107.9
199A34.5Very low43Very low83 Ų83137.5 Ų137.569%0.68681%0.81SS**  cis-169.3126.6-12.500000108.4
200L41.7Very low42.2Very low167 Ų167132.6 Ų132.687%0.87481%0.809SS**  trans61.8166.8145.8-49179.5000121.6
201P46.7Very low41.6Very low121 Ų121132.9 Ų132.979%0.78681%0.811SS**  -135.8149.7-6938.7-21.5000116.4
202G33.4Very low41Very low75 Ų75128.6 Ų128.677%0.77381%0.814SS**  trans76.3168.4144.500000120.6
203P43.1Very low40.2Very low127 Ų127122.7 Ų122.783%0.82581%0.81SS**  cis-129.3155.7-13.437.4-19.8000114.8
204N38.8Very low39.7Very low160 Ų160123 Ų12386%0.85681%0.805SS**  trans-95.9179155.5-77.3-37.5000108.2
205P47.5Very low40.2Very low103 Ų103124.2 Ų124.267%0.66980%0.801SS**  cis-131.2169.7-13.329.8-8.9000113.1
206H34.2Very low40.7Very low202 Ų202129 Ų12994%0.93580%0.8SS**  trans-124118155.6-83.5-66.9000112.1
207T41.4Very low41Very low119 Ų119128.9 Ų128.973%0.7379%0.79SS**  trans-64.9134.3167.7-57.60000112.5
208M47.4Very low41.5Very low184 Ų184130.3 Ų130.391%0.90680%0.8SS**  trans-169.297.5134.7-74.6-144.3-174.100104.9
209D38.1Very low42.3Very low139 Ų139125.9 Ų125.974%0.74378%0.778SS**  33.6101.384.7-163.229.7000115.7
210S38.6Very low43.1Very low111 Ų111128.7 Ų128.778%0.77678%0.781SS**  166.5128.1118-84.40000110.8
211G33.6Very low43.9Very low74 Ų74130.2 Ų130.276%0.76378%0.781SS**  trans133.876.7147.200000117.5
212S39.9Very low43.9Very low125 Ų125135.3 Ų135.387%0.87479%0.785SS**  trans69.2100.9130-160.50000119.2
213G40.7Very low45.1Very low77 Ų77136.3 Ų136.379%0.79478%0.78SS**  67.8102.4124.200000117.7
214N38.3Very low45.6Very low134 Ų134137.1 Ų137.172%0.71778%0.777SS**  173.8120.1105.5-165.718000108.3K216N214-K216 PolarHBondContact O-N 2.94Å
215D50Low46.4Very low158 Ų158139.1 Ų139.185%0.84578%0.778SS**  trans-61107.1162.7-74.8-46.8000108.9
216K49.8Very low46.3Very low174 Ų174137.2 Ų137.276%0.75778%0.777SS**  trans-164.3111.4156.8-104.5143.8-175176.90111.4N214N214-K216 PolarHBondContact O-N 2.94Å
217N47.9Very low47Very low126 Ų126132.6 Ų132.667%0.67477%0.774SS**  trans77.295135.1-149.531.8000117.1A219N217-A219 WeakPolarHBondContact ND2-CB 3.17Å; N217-A219 PolarHBondContact O-N 3.4Å
218S50.2Low47.6Very low134 Ų134138 Ų13894%0.93778%0.781SS**SBendtrans-62.354.4158.2460000113.1
219A51.9Low47.7Very low51 Ų51135.4 Ų135.442%0.42178%0.778SS.*  trans-122.45.6-177.100000115.5N217 K221N217-A219 WeakPolarHBondContact ND2-CB 3.17Å; N217-A219 PolarHBondContact O-N 3.4Å; A219-K221 PolarHBondContact O-N 2.99Å
220D52.4Low47.9Very low141 Ų141136.9 Ų136.975%0.75479%0.785SS**G310 helixtrans-91.19.8-177.4-73.2-26.7000114.9W222D220-W222 VanDerWaalsContact C-N 3.28Å; D220-W222 PolarHBondContact O-N 3.32Å
221K57.9Low48.3Very low199 Ų199139.4 Ų139.487%0.86579%0.785SS**G310 helixtrans-816.9178.1-82.1-169.2170.5-159.30115.6A219A219-K221 PolarHBondContact O-N 2.99Å
222W45.7Very low48.9Very low229 Ų229147 Ų14787%0.86779%0.79SS**G310 helixtrans-12214.6178.5-7198.7000115.2D220 L224D220-W222 VanDerWaalsContact C-N 3.28Å; D220-W222 PolarHBondContact O-N 3.32Å; W222-L224 VanDerWaalsContact C-N 3.35Å; W222-L224 PolarHBondContact O-N 3.26Å; W222-L224 VanDerWaalsContact O-N 3.12Å
223S59.1Low48.9Very low96 Ų96145.8 Ų145.867%0.67178%0.781SS**  trans-8772.6172.9-80.40000111.7F225S223-F225 VanDerWaalsContact C-N 3.28Å
224L53.6Low49.3Very low144 Ų144150.1 Ų150.175%0.75479%0.786SS**  trans-87.511.7171.2-96.9154.9000113.9W222W222-L224 VanDerWaalsContact C-N 3.35Å; W222-L224 PolarHBondContact O-N 3.26Å; W222-L224 VanDerWaalsContact O-N 3.12Å
225F55.3Low49.8Very low201 Ų201148 Ų14888%0.88278%0.782SS**  trans-137.676.5167.3-64.4-79.6000110.1S223S223-F225 VanDerWaalsContact C-N 3.28Å
226G45.5Very low49.9Very low64 Ų64144.4 Ų144.466%0.6678%0.783SS**PPolyproline II helixtrans-62.7140.8165.200000110.8R228G226-R228 PolarHBondContact O-N 2.96Å
227A50Low49.9Very low105 Ų105144.7 Ų144.787%0.86878%0.784SS**PPolyproline II helixtrans-58.1118.9177.800000110.7
228R52.6Low50Low233 Ų233143.9 Ų143.988%0.87980%0.795SS**PPolyproline II helixtrans-78.9141.2168.5-67.9-173.7-171.9-1262.9109.6G226 L230G226-R228 PolarHBondContact O-N 2.96Å; R228-L230 PolarHBondContact O-N 3.22Å
229P49.6Very low50.2Low129 Ų129143.9 Ų143.984%0.83879%0.789SS**  trans-67.1114.3170.625.9-29.9000109.3Q231P229-Q231 PolarHBondContact O-N 2.95Å
230L44.1Very low50.4Low169 Ų169149.9 Ų149.989%0.88581%0.808SS**  trans-75.6113.3-179.5-174.663.6000110.2R228 R232R228-L230 PolarHBondContact O-N 3.22Å; L230-R232 PolarHBondContact O-N 3.15Å
231Q46.5Very low50.3Low165 Ų165147.4 Ų147.477%0.77181%0.807SS**  trans-55.6121.8167-178.6178-24.400109.8P229 S233P229-Q231 PolarHBondContact O-N 2.95Å; Q231-S233 PolarHBondContact O-N 3.36Å
232R45.8Very low49.7Very low234 Ų234144.4 Ų144.488%0.88379%0.791SS**  trans-63121.3176.4-71.4-171.7-173.9133.71.5109.4L230L230-R232 PolarHBondContact O-N 3.15Å
233S39.7Very low50.3Low98 Ų98143.3 Ų143.369%0.68579%0.792SS**  trans-117.4118.8158.7-67.30000106.9Q231 S235Q231-S233 PolarHBondContact O-N 3.36Å; S233-S235 PolarHBondContact O-N 2.89Å
234D49.4Very low50.2Low169 Ų169142.3 Ų142.390%0.90480%0.798SS**  trans-70.591.6178.6-66.8-42.1000109.4
235S47.7Very low50.7Low88 Ų88137.8 Ų137.862%0.61578%0.781SS**  trans-126.8118.9165.676.20000108.7S233 F237S233-S235 PolarHBondContact O-N 2.89Å; S235-F237 VanDerWaalsContact C-N 3.32Å; S235-F237 PolarHBondContact O-N 3.31Å
236G53.5Low51.3Low84 Ų84133.9 Ų133.987%0.86678%0.776SS**  trans-67.272.7-167.200000116
237F49.3Very low52.5Low180 Ų180139.5 Ų139.579%0.78978%0.782SS**  trans-117109.1152.6-67.2-80.4000107.2S235 V239S235-F237 VanDerWaalsContact C-N 3.32Å; S235-F237 PolarHBondContact O-N 3.31Å; F237-V239 PolarHBondContact O-N 3.26Å
238A51Low53.4Low108 Ų108137.8 Ų137.889%0.89376%0.762SS**  trans-66.384.1176.800000109.6Q240A238-Q240 PolarHBondContact O-N 3.32Å
239V53.8Low54.6Low134 Ų134129.2 Ų129.281%0.81274%0.738SS**  trans-72.591.8161.9-175.20000105.5F237 A241F237-V239 PolarHBondContact O-N 3.26Å; V239-A241 PolarHBondContact O-N 2.69Å
240Q55.1Low55.4Low178 Ų178127.9 Ų127.983%0.83273%0.729SS**  trans-59109.1172.6-174.4161.611.200107.7A238 Y242A238-Q240 PolarHBondContact O-N 3.32Å; Q240-Y242 PolarHBondContact O-N 2.86Å
241A51.5Low56.8Low88 Ų88125 Ų12573%0.72771%0.712SS**  trans-56.8108.1173.600000107.8V239 K243V239-A241 PolarHBondContact O-N 2.69Å; A241-K243 VanDerWaalsContact C-N 3.35Å; A241-K243 PolarHBondContact O-N 2.99Å
242Y45.8Very low58.2Low137 Ų137121.6 Ų121.654%0.53770%0.696SS.*  trans-70.494.7-175.9-177.5-106.3000109.2Q240 G244 A245 P246Q240-Y242 PolarHBondContact O-N 2.86Å; Y242-G244 VanDerWaalsContact C-N 3.32Å; Y242-G244 PolarHBondContact O-N 2.76Å; Y242-A245 HydrophobicContact CE1-CB 4.31Å; Y242-A245 WeakPolarHBondContact CE1-O 3.49Å; Y242-A245 HydrophobicContact CE2-CB 3.94Å; Y242-A245 WeakPolarHBondContact OH-CA 3.49Å; Y242-A245 WeakPolarHBondContact OH-CB 3.02Å; Y242-A245 PolarHBondContact OH-O 2.93Å; Y242-P246 PolarHBondContact OH-O 3.09Å
243K57Low59.5Low205 Ų205115 Ų11589%0.89168%0.679SS**  trans-71.787.6173.7-161.5-169.5-174.7-147.30108.6A241 A245A241-K243 VanDerWaalsContact C-N 3.35Å; A241-K243 PolarHBondContact O-N 2.99Å; K243-A245 PolarHBondContact O-N 2.81Å; K243-A245 VanDerWaalsContact O-N 3.11Å
244G57.5Low61Low76 Ų76116.4 Ų116.478%0.78468%0.676SS**SBendtrans61.626.6147.400000119.7Y242Y242-G244 VanDerWaalsContact C-N 3.32Å; Y242-G244 PolarHBondContact O-N 2.76Å
245A65Low62Low49 Ų49115 Ų11541%0.40566%0.657SS.*PPolyproline II helixtrans-85.8144.8167.300000110.7Y242 K243 K247Y242-A245 HydrophobicContact CE1-CB 4.31Å; Y242-A245 WeakPolarHBondContact CE1-O 3.49Å; Y242-A245 HydrophobicContact CE2-CB 3.94Å; Y242-A245 WeakPolarHBondContact OH-CA 3.49Å; Y242-A245 WeakPolarHBondContact OH-CB 3.02Å; Y242-A245 PolarHBondContact OH-O 2.93Å; K243-A245 PolarHBondContact O-N 2.81Å; K243-A245 VanDerWaalsContact O-N 3.11Å; A245-K247 PolarHBondContact O-N 3.34Å
246P67.4Low62.8Low118 Ų118113.7 Ų113.777%0.76665%0.652SS**PPolyproline II helixtrans-59128.9174.323-30.7000109.3Y242Y242-P246 PolarHBondContact OH-O 3.09Å
247K70.1Confident63.1Low183 Ų183116.8 Ų116.880%0.79664%0.644SS**PPolyproline II helixtrans-56.7123.4174.6-72.7176.8178.1174.40107.4A245 S249A245-K247 PolarHBondContact O-N 3.34Å; K247-S249 PolarHBondContact O-N 3.4Å
248P69.1Low63.5Low68 Ų68111.8 Ų111.844%0.44264%0.636SS.*PPolyproline II helixtrans-61.1131179.223.5-31.4000108.7E252 L253P248-E252 WeakPolarHBondContact CA-OE2 3.36Å; P248-E252 HydrophobicContact CB-CB 4.24Å; P248-L253 HydrophobicContact CG-CD2 4.46Å
249S77Confident63.8Low54 Ų54112.5 Ų112.538%0.37863%0.63SS.*PPolyproline II helixtrans-59.1145.2177.9170.80000108.8K247 M251 E252 L253K247-S249 PolarHBondContact O-N 3.4Å; S249-M251 PolarHBondContact O-N 2.88Å; S249-M251 PolarHBondContact OG-N 2.98Å; S249-E252 PolarHBondContact N-OE2 2.8Å; S249-E252 WeakPolarHBondContact O-CA 3.45Å; S249-E252 WeakPolarHBondContact O-CB 3.17Å; S249-E252 PolarHBondContact O-N 2.96Å; S249-L253 PolarHBondContact O-N 3.19Å
250P67.5Low63.9Low100 Ų100116.5 Ų116.565%0.64963%0.63SS**Hα-helixtrans-47.7-31.8174.1-29.735.7000113.5L253 M254P250-L253 PolarHBondContact O-N 3.49Å; P250-M254 WeakPolarHBondContact O-CG 2.92Å; P250-M254 PolarHBondContact O-N 2.87Å
251M73.6Confident63.6Low109 Ų109111.9 Ų111.954%0.53763%0.63SS.*Hα-helixtrans-65.2-34.5173.9-72.6-63.4-60.300114S249 R255S249-M251 PolarHBondContact O-N 2.88Å; S249-M251 PolarHBondContact OG-N 2.98Å; M251-R255 WeakPolarHBondContact O-CG 3.11Å; M251-R255 PolarHBondContact O-N 3.11Å
252E74.9Confident63.4Low93 Ų93111.4 Ų111.444%0.43563%0.633SS.*Hα-helixtrans-72.3-37.2177.6-71.4170.9161.500111.6P248 S249 M254 R255 A256P248-E252 WeakPolarHBondContact CA-OE2 3.36Å; P248-E252 HydrophobicContact CB-CB 4.24Å; S249-E252 PolarHBondContact N-OE2 2.8Å; S249-E252 WeakPolarHBondContact O-CA 3.45Å; S249-E252 WeakPolarHBondContact O-CB 3.17Å; S249-E252 PolarHBondContact O-N 2.96Å; E252-M254 VanDerWaalsContact C-N 3.34Å; E252-M254 PolarHBondContact O-N 2.99Å; E252-R255 VanDerWaalsContact CG-NH2 3.32Å; E252-R255 PolarHBondContact O-N 2.93Å; E252-A256 PolarHBondContact O-N 2.99Å
253L74.4Confident63.4Low97 Ų97112.3 Ų112.351%0.50864%0.643SS.*Hα-helixtrans-62.1-42.4173.4-71.9174.4000111.5P248 S249 P250 R255 A256 Q257P248-L253 HydrophobicContact CG-CD2 4.46Å; S249-L253 PolarHBondContact O-N 3.19Å; P250-L253 PolarHBondContact O-N 3.49Å; L253-R255 VanDerWaalsContact C-N 3.34Å; L253-R255 PolarHBondContact O-N 2.86Å; L253-A256 PolarHBondContact O-N 2.9Å; L253-Q257 WeakPolarHBondContact O-CG 3.46Å; L253-Q257 PolarHBondContact O-N 3.18Å; L253-Q257 VanDerWaalsContact O-N 3.14Å
254M70.2Confident62.8Low126 Ų126107.4 Ų107.462%0.62163%0.626SS**Hα-helixtrans-63.8-38.1176.4-69.6-177.366.700112.5P250 E252 A258P250-M254 WeakPolarHBondContact O-CG 2.92Å; P250-M254 PolarHBondContact O-N 2.87Å; E252-M254 VanDerWaalsContact C-N 3.34Å; E252-M254 PolarHBondContact O-N 2.99Å; M254-A258 PolarHBondContact O-N 3.1Å
255R70.3Confident62.6Low139 Ų139109.1 Ų109.153%0.52562%0.624SS.*Hα-helixtrans-70.1-39.8176.8-71.6-166.6-60.8-101.85.1112.7M251 E252 L253 Q257 A258 T259M251-R255 WeakPolarHBondContact O-CG 3.11Å; M251-R255 PolarHBondContact O-N 3.11Å; E252-R255 VanDerWaalsContact CG-NH2 3.32Å; E252-R255 PolarHBondContact O-N 2.93Å; L253-R255 VanDerWaalsContact C-N 3.34Å; L253-R255 PolarHBondContact O-N 2.86Å; R255-Q257 VanDerWaalsContact C-N 3.33Å; R255-Q257 PolarHBondContact O-N 2.81Å; R255-A258 WeakPolarHBondContact O-CB 3.46Å; R255-A258 PolarHBondContact O-N 3.26Å; R255-T259 PolarHBondContact O-N 3.1Å; R255-T259 PolarHBondContact O-OG1 3.21Å
256A64.6Low62.1Low61 Ų61110.5 Ų110.550%0.50464%0.635SS.*Hα-helixtrans-66-35.2178.900000112.7E252 L253E252-A256 PolarHBondContact O-N 2.99Å; L253-A256 PolarHBondContact O-N 2.9Å
257Q60.5Low61.2Low150 Ų150109.9 Ų109.970%0.70163%0.629SS**Hα-helixtrans-71.3-30.6174-69.9-178.3-7.600112.4L253 R255 T259 R260L253-Q257 WeakPolarHBondContact O-CG 3.46Å; L253-Q257 PolarHBondContact O-N 3.18Å; L253-Q257 VanDerWaalsContact O-N 3.14Å; R255-Q257 VanDerWaalsContact C-N 3.33Å; R255-Q257 PolarHBondContact O-N 2.81Å; Q257-T259 VanDerWaalsContact C-N 3.33Å; Q257-T259 PolarHBondContact O-N 2.83Å; Q257-R260 PolarHBondContact O-N 3.26Å
258A56.4Low60.5Low75 Ų75108.7 Ų108.762%0.6262%0.624SS**Hα-helixtrans-69-27.3177.600000113.6M254 R255 R260M254-A258 PolarHBondContact O-N 3.1Å; R255-A258 WeakPolarHBondContact O-CB 3.46Å; R255-A258 PolarHBondContact O-N 3.26Å; A258-R260 VanDerWaalsContact C-N 3.34Å; A258-R260 PolarHBondContact O-N 3.27Å
259T58.7Low60Low123 Ų123114.1 Ų114.176%0.75564%0.641SS**THydrogen-bonded Turntrans-79.6-11.3-179.4-46.40000113.7R255 Q257 G261R255-T259 PolarHBondContact O-N 3.1Å; R255-T259 PolarHBondContact O-OG1 3.21Å; Q257-T259 VanDerWaalsContact C-N 3.33Å; Q257-T259 PolarHBondContact O-N 2.83Å; T259-G261 VanDerWaalsContact C-N 3.33Å
260R55.6Low59Low218 Ų218116.4 Ų116.482%0.82365%0.654SS**THydrogen-bonded Turntrans-85.70.4177.9-70.4-164.9173.9-156.7-2.4114.6Q257 A258 G262Q257-R260 PolarHBondContact O-N 3.26Å; A258-R260 VanDerWaalsContact C-N 3.34Å; A258-R260 PolarHBondContact O-N 3.27Å; R260-G262 PolarHBondContact O-N 2.94Å
261G47.8Very low58.2Low80 Ų80116.9 Ų116.983%0.82566%0.658SS**THydrogen-bonded Turntrans-76.231.9-176.600000115.9T259T259-G261 VanDerWaalsContact C-N 3.33Å
262G47.4Very low56.7Low78 Ų78121.9 Ų121.980%0.80468%0.676SS**THydrogen-bonded Turntrans-137.59-175.600000115.6R260R260-G262 PolarHBondContact O-N 2.94Å
263E46Very low55.9Low157 Ų157124.2 Ų124.273%0.73469%0.69SS**SBendtrans-105.6126.1180-156.6166.4-17900111.1
264D43.8Very low54.8Low102 Ų102127.3 Ų127.355%0.54571%0.707SS.*  trans-55.8124.4-173.5-179.77.1000112.1A266 T267D264-A266 PolarHBondContact O-N 3.19Å; D264-A266 VanDerWaalsContact O-N 3.07Å; D264-A266 PolarHBondContact OD1-N 3.1Å; D264-T267 PolarHBondContact O-OG1 2.75Å
265P53.7Low53.8Low112 Ų112126.3 Ų126.373%0.72771%0.708SS**G310 helixtrans-66.4-6.2-17927.3-35.8000114.5T267P265-T267 VanDerWaalsContact C-N 3.34Å; P265-T267 PolarHBondContact O-N 2.96Å
266A55.7Low52.5Low77 Ų77125.3 Ų125.364%0.63672%0.72SS**G310 helixtrans-73.5-15.8-17700000115.3D264D264-A266 PolarHBondContact O-N 3.19Å; D264-A266 VanDerWaalsContact O-N 3.07Å; D264-A266 PolarHBondContact OD1-N 3.1Å
267T48.4Very low51.6Low106 Ų106129.1 Ų129.165%0.6574%0.736SS**G310 helixtrans-96.6-6.6-173.1-3.30000114.8D264 P265 K269D264-T267 PolarHBondContact O-OG1 2.75Å; P265-T267 VanDerWaalsContact C-N 3.34Å; P265-T267 PolarHBondContact O-N 2.96Å; T267-K269 PolarHBondContact O-N 3.39Å
268F54.6Low51.1Low158 Ų158128.7 Ų128.769%0.69374%0.743SS**  trans-77.890177.8-74.5-79.2000110.9P270F268-P270 WeakPolarHBondContact O-CD 3.29Å
269K57.8Low50.4Low182 Ų182133.7 Ų133.779%0.79175%0.754SS**PPolyproline II helixtrans-65.6121.5165.2-71.8-75.7100.7175.40108.7T267T267-K269 PolarHBondContact O-N 3.39Å
270P56.3Low49.9Very low101 Ų101131 Ų13166%0.65675%0.751SS**PPolyproline II helixtrans-67.4145176.826.5-32.7000110.7F268 K272F268-P270 WeakPolarHBondContact O-CD 3.29Å; P270-K272 PolarHBondContact O-N 3.28Å
271P51.6Low49.4Very low111 Ų111130.4 Ų130.472%0.72175%0.754SS**PPolyproline II helixtrans-62.7126.7175.723.9-30.5000110I273P271-I273 PolarHBondContact O-N 3.07Å
272K42.3Very low49.8Very low213 Ų213136.5 Ų136.593%0.92676%0.758SS**  trans-71.1107.4175.9-70.7177.5178.8177.40108.6P270P270-K272 PolarHBondContact O-N 3.28Å
273I58.7Low50.2Low143 Ų143138.1 Ų138.173%0.73375%0.754SS**  trans-100112.1172-48.9173000105.9P271 V275P271-I273 PolarHBondContact O-N 3.07Å; I273-V275 HydrophobicContact CG2-CG2 4.38Å
274D49.8Very low50.8Low161 Ų161136 Ų13686%0.86175%0.754SS**  trans-87.1120.7177.4-156.59.6000108.7
275V48.8Very low51.3Low105 Ų105137.3 Ų137.364%0.63677%0.768SS**  trans-113.4123.3-175.8-176.10000108.1I273 V277I273-V275 HydrophobicContact CG2-CG2 4.38Å; V275-V277 PolarHBondContact O-N 3.32Å
276P44.8Very low51.7Low119 Ų119143.1 Ų143.177%0.77378%0.776SS**  trans-68.9125.4176.626.5-31.6000110.6V278P276-V278 PolarHBondContact O-N 3.48Å
277V45Very low52Low141 Ų141144.8 Ų144.886%0.85578%0.778SS**  trans-62.7117.7172.3169.40000109.2V275V275-V277 PolarHBondContact O-N 3.32Å
278V49.6Very low52.8Low140 Ų140147 Ų14785%0.84878%0.781SS**  trans-99.7113162.4135.80000108.2P276P276-V278 PolarHBondContact O-N 3.48Å
279E42.3Very low53.2Low181 Ų181146.3 Ų146.385%0.84678%0.784SS**  trans-65.2134.7177.5-169.5179.4179.500110.8
280G47.8Very low53.9Low67 Ų67142.4 Ų142.469%0.69177%0.772SS**  trans-83.7143.8-17100000114.7
281K45.1Very low55.1Low204 Ų204144.6 Ų144.689%0.88777%0.771SS**  trans-137.6111.5147.3-72.5-170.1177.7176.70109.5P283K281-P283 WeakPolarHBondContact O-CD 3.5Å
282K55.7Low56Low209 Ų209144.5 Ų144.591%0.90977%0.77SS**PPolyproline II helixtrans-72.2125.5173.5-103.3173.5176.9165.90109.8
283P55.6Low57.2Low111 Ų111145 Ų14572%0.72177%0.766SS**PPolyproline II helixtrans-76.2149.316029.8-30.6000110.6K281K281-P283 WeakPolarHBondContact O-CD 3.5Å
284P59.2Low57.7Low113 Ų113141.4 Ų141.473%0.73475%0.749SS**PPolyproline II helixtrans-65.3156179.526.3-33.4000112.3R286P284-R286 PolarHBondContact O-N 3.27Å
285P54.8Low58.7Low129 Ų129138.4 Ų138.484%0.83873%0.732SS**  trans-65.3110-175.326.3-33.1000110.7T287P285-T287 PolarHBondContact O-N 3.19Å
286R62.9Low59.4Low234 Ų234139.3 Ų139.388%0.88373%0.733SS**  trans-75.6115.6175.3-169.4164.4-175.484.9-1.5109.1P284 H288P284-R286 PolarHBondContact O-N 3.27Å; R286-H288 PolarHBondContact O-N 3.12Å
287T59.9Low60.2Low112 Ų112139.5 Ų139.569%0.68773%0.732SS**  trans-67.6114.8171.255.30000108.5P285 N289P285-T287 PolarHBondContact O-N 3.19Å; T287-N289 PolarHBondContact O-N 3Å
288H66.2Low61.1Low153 Ų153138.8 Ų138.871%0.70872%0.722SS**  trans-80.1113.217661.1-87.3000108.5R286 L290R286-H288 PolarHBondContact O-N 3.12Å; H288-L290 PolarHBondContact O-N 3.21Å
289N63.4Low62Low144 Ų144136.1 Ų136.177%0.7771%0.707SS**  trans-91.293.9172.1-71.7-70.4000107.9T287T287-N289 PolarHBondContact O-N 3Å
290L72.1Confident63Low100 Ų100133.4 Ų133.452%0.52471%0.705SS.*  trans-75.4128.8170.4-71.8167.2000108.7H288 D294H288-L290 PolarHBondContact O-N 3.21Å; L290-D294 HydrophobicContact CD2-CB 4.45Å
291K82.6Confident63.6Low146 Ų146136.5 Ų136.564%0.63571%0.711SS**  trans-75.3152.5178.3-66176.5-179.9173.30109R293 D294K291-R293 PolarHBondContact O-N 3.33Å; K291-D294 WeakPolarHBondContact CB-OD2 3.18Å; K291-D294 PolarHBondContact N-OD2 3.19Å; K291-D294 VanDerWaalsContact N-OD2 3.17Å; K291-D294 WeakPolarHBondContact O-CB 3.49Å; K291-D294 PolarHBondContact O-N 3.42Å
292P70.1Confident64.4Low109 Ų109130.4 Ų130.471%0.70871%0.706SS**G310 helixtrans-54.6-25.7177.4-27.334.5000114.4D294P292-D294 VanDerWaalsContact C-N 3.33Å
293R67.8Low63.8Low224 Ų224133.7 Ų133.785%0.84572%0.72SS**G310 helixtrans-74.1-21.1176.3-65.3-173.8-179.9162.90.8113.8K291 L295K291-R293 PolarHBondContact O-N 3.33Å; R293-L295 VanDerWaalsContact C-N 3.33Å
294D68.5Low64.3Low68 Ų68134.8 Ų134.836%0.36472%0.72SS.*G310 helixtrans-87-8.5-176.7-52.2-26000111.7L290 K291 P292 N296 V297L290-D294 HydrophobicContact CD2-CB 4.45Å; K291-D294 WeakPolarHBondContact CB-OD2 3.18Å; K291-D294 PolarHBondContact N-OD2 3.19Å; K291-D294 VanDerWaalsContact N-OD2 3.17Å; K291-D294 WeakPolarHBondContact O-CB 3.49Å; K291-D294 PolarHBondContact O-N 3.42Å; P292-D294 VanDerWaalsContact C-N 3.33Å; D294-N296 VanDerWaalsContact C-N 3.26Å; D294-N296 PolarHBondContact O-N 3.07Å; D294-V297 WeakPolarHBondContact O-CB 3.17Å; D294-V297 PolarHBondContact O-N 3.4Å
295L69.8Low64.5Low97 Ų97135.9 Ų135.951%0.50872%0.72SS.*G310 helixtrans-66.3-27.4177.1-68.2173.1000112.7R293 V297 L298R293-L295 VanDerWaalsContact C-N 3.33Å; L295-V297 PolarHBondContact O-N 3.1Å; L295-L298 PolarHBondContact O-N 3.05Å; L295-L298 VanDerWaalsContact O-N 3.1Å
296N64.3Low65.1Low125 Ų125136.3 Ų136.367%0.66871%0.713SS**G310 helixtrans-71.7-11.8178.2-65.2-9000113.1D294 L298 T299D294-N296 VanDerWaalsContact C-N 3.26Å; D294-N296 PolarHBondContact O-N 3.07Å; N296-L298 VanDerWaalsContact C-N 3.3Å; N296-T299 PolarHBondContact O-OG1 3.42Å
297V61.9Low65.2Low122 Ų122130.6 Ų130.674%0.73970%0.703SS**G310 helixtrans-79.7-18.7173.3-1710000111D294 L295D294-V297 WeakPolarHBondContact O-CB 3.17Å; D294-V297 PolarHBondContact O-N 3.4Å; L295-V297 PolarHBondContact O-N 3.1Å
298L64.4Low65.5Low126 Ų126131.8 Ų131.866%0.6670%0.704SS**SBendtrans-97.5-6.3-178-62.1177.3000113.5L295 N296 P300L295-L298 PolarHBondContact O-N 3.05Å; L295-L298 VanDerWaalsContact O-N 3.1Å; N296-L298 VanDerWaalsContact C-N 3.3Å; L298-P300 WeakPolarHBondContact O-CD 3.21Å
299T66.6Low65.5Low85 Ų85130.3 Ų130.352%0.52170%0.704SS.*SBendtrans-75.9118.1170.142.10000108.8N296 T301N296-T299 PolarHBondContact O-OG1 3.42Å; T299-T301 PolarHBondContact O-N 2.82Å
300P64.2Low65.6Low124 Ų124129.4 Ų129.481%0.80570%0.699SS**  trans-60.6115.5173.423.7-29.9000107.8L298 G302L298-P300 WeakPolarHBondContact O-CD 3.21Å; P300-G302 PolarHBondContact O-N 3.05Å
301T61.3Low65.1Low132 Ų132131.6 Ų131.681%0.8171%0.712SS**  trans-63.5101170.747.70000107T299 F303T299-T301 PolarHBondContact O-N 2.82Å; T301-F303 PolarHBondContact O-N 3.07Å
302G61.1Low63.7Low76 Ų76130.4 Ų130.478%0.78472%0.719SS**  trans-64.9111.8174.600000109.8P300P300-G302 PolarHBondContact O-N 3.05Å
303F44.2Very low63.1Low277 Ų277132.4 Ų132.4100%1.21572%0.72SS**  trans-123.70153.2-100.2-80.7000107T301T301-F303 PolarHBondContact O-N 3.07Å

Retrieved 303 of 303 residues in 38.5 ms (Link to these results)