A0A077Z5H3_TRITR Loading...

Zinc finger protein Noc

AlphaFold DB , UniProt , Accession A0A077Z5H3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 543 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M41.3Very low50.8Low241 Ų241151.8 Ų151.8100%1.18780%0.795SS**  0133.90-76159.316400108.1
2V45.7Very low50.5Low129 Ų129150.2 Ų150.278%0.78279%0.788SS**  trans21.8111.4167.5-166.10000118.4T4V2-T4 HydrophobicContact CG1-CG2 3.8Å
3S48.2Very low50.3Low117 Ų117153.2 Ų153.282%0.81879%0.791SS**  trans-94.6116.4160-67.30000110.4H5S3-H5 PolarHBondContact O-N 3.28Å
4T55.5Low50.4Low108 Ų108152.9 Ų152.966%0.66379%0.791SS**  trans-90.871.3-17552.80000112.1V2V2-T4 HydrophobicContact CG1-CG2 3.8Å
5H56.6Low50.6Low171 Ų171149.8 Ų149.879%0.79279%0.787SS**  trans-117.522.6-173.5-146.6-69.1000115.1S3S3-H5 PolarHBondContact O-N 3.28Å
6Q52.1Low50.1Low183 Ų183147.1 Ų147.186%0.85578%0.781SS**  trans-119.328.2-172.9-69.7-72.983.600113.7
7Q60.1Low49.5Very low157 Ų157147.6 Ų147.673%0.73478%0.783SS**SBendtrans-110.110.4-170.6-70.4-176-62.900115.7
8Y43.4Very low49.2Very low223 Ų223145.9 Ų145.988%0.87578%0.782SS**SBendtrans-133.410.1-174.8-78.8-72000116.5
9L51.6Low48.8Very low165 Ų165144.1 Ų144.186%0.86478%0.782SS**SBendtrans-111120.3164.9-91.970.2000108.9
10S51.2Low48.7Very low77 Ų77143.5 Ų143.554%0.53878%0.783SS.*  trans-69.8137.6-173.8-52.60000112.6D12S10-D12 VanDerWaalsContact C-N 3.3Å; S10-D12 PolarHBondContact O-N 3.31Å
11P52.9Low48.3Very low99 Ų99142.7 Ų142.764%0.64379%0.788SS**G310 helixtrans-65.6-22.4-178.4-23.635000115.8F13 L14P11-F13 PolarHBondContact O-N 3.16Å; P11-L14 WeakPolarHBondContact O-CB 3.43Å; P11-L14 PolarHBondContact O-N 3.45Å
12D47.7Very low48.2Very low132 Ų132134.7 Ų134.771%0.70677%0.768SS**G310 helixtrans-58.1-22.7-172-70.3-95.6000115.5S10 L14S10-D12 VanDerWaalsContact C-N 3.3Å; S10-D12 PolarHBondContact O-N 3.31Å; D12-L14 PolarHBondContact O-N 3.47Å
13F47.5Very low47.8Very low190 Ų190135.3 Ų135.383%0.83377%0.772SS**G310 helixtrans-78.16.3176.1-63.8-72.7000114.3P11P11-F13 PolarHBondContact O-N 3.16Å
14L51.9Low47.6Very low149 Ų149134.8 Ų134.878%0.7877%0.768SS**G310 helixtrans-119.510.1-176.4-71.3165.7000114.9P11 D12 P16P11-L14 WeakPolarHBondContact O-CB 3.43Å; P11-L14 PolarHBondContact O-N 3.45Å; D12-L14 PolarHBondContact O-N 3.47Å; L14-P16 WeakPolarHBondContact O-CD 3.24Å
15S53.2Low47.3Very low106 Ų106136.3 Ų136.374%0.74177%0.773SS**  trans-78.6117.9175-67.80000112
16P42.9Very low46.6Very low106 Ų106134.9 Ų134.969%0.68878%0.776SS**  trans-101.3177.2-17539.8-34.5000113.7L14L14-P16 WeakPolarHBondContact O-CD 3.24Å
17L39.7Very low46.7Very low156 Ų156130.3 Ų130.382%0.81777%0.77SS**  trans80.2155.8171.5-57.9152.2000115.3
18P43.9Very low46Very low118 Ų118127.5 Ų127.577%0.76676%0.76SS**  cis-111.2163.33.340.1-30.5000115.1
19S42Very low46.4Very low111 Ų111122.3 Ų122.378%0.77676%0.756SS**  trans-89.1123.617653.40000112.6
20T47.4Very low46.7Very low132 Ų132118.5 Ų118.581%0.8174%0.743SS**  trans-131.3125.3165.153.60000111.4
21S39.4Very low47.4Very low126 Ų126122.2 Ų122.288%0.88175%0.749SS**  trans-49.5139.6172.149.80000114.8
22G38.8Very low48.6Very low74 Ų74120.1 Ų120.176%0.76374%0.737SS**  trans-174.2124.1166.800000112.6
23T38.4Very low50.4Low142 Ų142118.6 Ų118.687%0.87173%0.734SS**  trans-99.4108.9175.748.30000111
24S44.1Very low52.3Low106 Ų106115.7 Ų115.774%0.74173%0.727SS**  trans-171.3121.2166.236.60000107.7
25D48.3Very low53.7Low140 Ų140110 Ų11075%0.74970%0.702SS**  9197.872.3-85-62.5000114.9A27D25-A27 PolarHBondContact O-N 3.3Å
26T42.3Very low55.3Low140 Ų140110.2 Ų110.286%0.85969%0.694SS**  58.631.7121.9-35.90000118.8
27A55.1Low57.4Low88 Ų88110.5 Ų110.573%0.72769%0.689SS**  trans-150.8153.1154.500000108.8D25D25-A27 PolarHBondContact O-N 3.3Å
28D45Very low59.5Low98 Ų98106 Ų10652%0.52467%0.674SS.*  cis-147.769.219.8-156.1-35.4000111.2S30 K31D28-S30 PolarHBondContact O-N 3.19Å; D28-S30 PolarHBondContact OD1-OG 3.29Å; D28-K31 IonicContact OD1-NZ 3.64Å
29S52Low61.3Low114 Ų114106.4 Ų106.480%0.79767%0.666SS**THydrogen-bonded Turntrans-67.312.8-176.4-130.60000114.9
30S58Low63.3Low84 Ų84104.1 Ų104.159%0.58765%0.647SS**THydrogen-bonded Turntrans-104.9-13.4-173.374.60000115D28D28-S30 PolarHBondContact O-N 3.19Å; D28-S30 PolarHBondContact OD1-OG 3.29Å
31K65Low64.9Low156 Ų156102 Ų10268%0.67864%0.636SS**SBendtrans-114-4.6-178.2-85.467.4165.3-161.30114.9D28D28-K31 IonicContact OD1-NZ 3.64Å
32S77.6Confident66.8Low55 Ų55101.5 Ų101.539%0.38562%0.624SS.*  trans-67.6126.5178.5175.70000110.7L34 A35 L36S32-L34 PolarHBondContact O-N 3.34Å; S32-L34 PolarHBondContact OG-N 3.08Å; S32-A35 WeakPolarHBondContact O-CB 3.42Å; S32-A35 PolarHBondContact O-N 2.97Å; S32-L36 PolarHBondContact O-N 3.42Å
33P86.3Confident68.4Low100 Ų100102.2 Ų102.265%0.64962%0.617SS**Hα-helixtrans-63.2-22.8175.225.8-33.7000112.2L37P33-L37 WeakPolarHBondContact O-CG 3.46Å; P33-L37 PolarHBondContact O-N 3.26Å; P33-L37 VanDerWaalsContact O-N 3.11Å
34L86.9Confident70Confident129 Ų129102.1 Ų102.168%0.67561%0.61SS**Hα-helixtrans-73.7-38173-161.7157000111.2S32 L37 A38S32-L34 PolarHBondContact O-N 3.34Å; S32-L34 PolarHBondContact OG-N 3.08Å; L34-L37 PolarHBondContact O-N 3.05Å; L34-A38 PolarHBondContact O-N 3.01Å
35A82.5Confident71Confident30 Ų30100 Ų10025%0.24861%0.605CS.*Hα-helixtrans-66.5-37.317200000111.7S32 L37 A38 Q39S32-A35 WeakPolarHBondContact O-CB 3.42Å; S32-A35 PolarHBondContact O-N 2.97Å; A35-L37 VanDerWaalsContact C-N 3.34Å; A35-L37 PolarHBondContact O-N 3.19Å; A35-A38 PolarHBondContact O-N 2.97Å; A35-Q39 WeakPolarHBondContact O-CB 3.41Å; A35-Q39 PolarHBondContact O-N 3.47Å
36L85.2Confident71.6Confident110 Ų11099.5 Ų99.558%0.57660%0.601SS**Hα-helixtrans-61.4-41.5173.6-166.674.8000111.8S32 Q39 T40S32-L36 PolarHBondContact O-N 3.42Å; L36-Q39 PolarHBondContact O-N 2.95Å; L36-T40 PolarHBondContact O-N 3.34Å; L36-T40 PolarHBondContact O-OG1 3.25Å
37L87.7Confident72.6Confident112 Ų11297.9 Ų97.959%0.58659%0.593SS**Hα-helixtrans-67.2-38.5174.2-72.3168.7000112.6P33 L34 A35 Q39 T40 C41P33-L37 WeakPolarHBondContact O-CG 3.46Å; P33-L37 PolarHBondContact O-N 3.26Å; P33-L37 VanDerWaalsContact O-N 3.11Å; L34-L37 PolarHBondContact O-N 3.05Å; A35-L37 VanDerWaalsContact C-N 3.34Å; A35-L37 PolarHBondContact O-N 3.19Å; L37-Q39 VanDerWaalsContact C-N 3.31Å; L37-Q39 PolarHBondContact O-N 3.22Å; L37-T40 PolarHBondContact O-N 3.49Å; L37-T40 PolarHBondContact O-OG1 3.47Å; L37-T40 VanDerWaalsContact O-OG1 3.09Å; L37-C41 WeakPolarHBondContact O-CB 3.36Å; L37-C41 PolarHBondContact O-N 2.82Å; L37-C41 PolarHBondContact O-SG 2.76Å
38A83.2Confident72.7Confident60 Ų60101.3 Ų101.350%0.49660%0.6SS.*Hα-helixtrans-63.1-39.4172.700000111.6L34 A35 N42L34-A38 PolarHBondContact O-N 3.01Å; A35-A38 PolarHBondContact O-N 2.97Å; A38-N42 PolarHBondContact O-N 2.89Å
39Q82.3Confident73.3Confident128 Ų128103.4 Ų103.460%0.59861%0.61SS**Hα-helixtrans-66.5-44.2176.9-173.2175.2-4.500112.1A35 L36 L37 N42 S43A35-Q39 WeakPolarHBondContact O-CB 3.41Å; A35-Q39 PolarHBondContact O-N 3.47Å; L36-Q39 PolarHBondContact O-N 2.95Å; L37-Q39 VanDerWaalsContact C-N 3.31Å; L37-Q39 PolarHBondContact O-N 3.22Å; Q39-N42 PolarHBondContact O-N 3.37Å; Q39-S43 PolarHBondContact O-N 3.04Å; Q39-S43 PolarHBondContact O-OG 2.87Å
40T83.4Confident73.6Confident63 Ų63103.6 Ų103.639%0.38761%0.608SS.*Hα-helixtrans-66.3-38.6176.255.20000112.1L36 L37 N42 S43 I44L36-T40 PolarHBondContact O-N 3.34Å; L36-T40 PolarHBondContact O-OG1 3.25Å; L37-T40 PolarHBondContact O-N 3.49Å; L37-T40 PolarHBondContact O-OG1 3.47Å; L37-T40 VanDerWaalsContact O-OG1 3.09Å; T40-N42 VanDerWaalsContact C-N 3.32Å; T40-N42 PolarHBondContact O-N 3.42Å; T40-S43 PolarHBondContact O-N 3.47Å; T40-I44 WeakPolarHBondContact O-CB 3.44Å; T40-I44 WeakPolarHBondContact O-CD1 3.39Å; T40-I44 VanDerWaalsContact O-CG1 3.24Å; T40-I44 WeakPolarHBondContact O-CG1 3.41Å; T40-I44 PolarHBondContact O-N 2.93Å
41C81.5Confident73.2Confident87 Ų87104.1 Ų104.159%0.58862%0.618SS**Hα-helixtrans-57.6-43.5171.5-74.80000112.2L37 I44 G45L37-C41 WeakPolarHBondContact O-CB 3.36Å; L37-C41 PolarHBondContact O-N 2.82Å; L37-C41 PolarHBondContact O-SG 2.76Å; C41-I44 PolarHBondContact O-N 3Å; C41-G45 PolarHBondContact O-N 3.24Å; C41-G45 VanDerWaalsContact O-N 3.08Å
42N80.3Confident72.2Confident115 Ų115102.7 Ų102.762%0.61563%0.628SS**Hα-helixtrans-66-36.8176-170.367.3000112.6A38 Q39 T40 I44A38-N42 PolarHBondContact O-N 2.89Å; Q39-N42 PolarHBondContact O-N 3.37Å; T40-N42 VanDerWaalsContact C-N 3.32Å; T40-N42 PolarHBondContact O-N 3.42Å; N42-I44 VanDerWaalsContact C-N 3.34Å
43S72.5Confident70.7Confident90 Ų90110.1 Ų110.163%0.62965%0.653SS**Hα-helixtrans-71.6-23.3175.8-63.10000114.4Q39 T40Q39-S43 PolarHBondContact O-N 3.04Å; Q39-S43 PolarHBondContact O-OG 2.87Å; T40-S43 PolarHBondContact O-N 3.47Å
44I70.3Confident68.4Low139 Ų139108.8 Ų108.871%0.71366%0.658SS**Hα-helixtrans-92.4-20.6179.7-66.5164.1000111.6T40 C41 N42T40-I44 WeakPolarHBondContact O-CB 3.44Å; T40-I44 WeakPolarHBondContact O-CD1 3.39Å; T40-I44 VanDerWaalsContact O-CG1 3.24Å; T40-I44 WeakPolarHBondContact O-CG1 3.41Å; T40-I44 PolarHBondContact O-N 2.93Å; C41-I44 PolarHBondContact O-N 3Å; N42-I44 VanDerWaalsContact C-N 3.34Å
45G66.5Low66.4Low61 Ų61109 Ų10963%0.62967%0.665SS**SBendtrans-82.4-7.3-174.600000116.9C41C41-G45 PolarHBondContact O-N 3.24Å; C41-G45 VanDerWaalsContact O-N 3.08Å
46L60.6Low64.4Low130 Ų130113.6 Ų113.668%0.68169%0.69SS**SBendtrans-94129.6-179.3-94.567.8000111.7D48L46-D48 PolarHBondContact O-N 3.3Å
47P63Low62.1Low106 Ų106113 Ų11369%0.68870%0.701SS**PPolyproline II helixtrans-74.2124.4173.630-32.9000110.9L49P47-L49 PolarHBondContact O-N 3.29Å
48D56.4Low59.9Low161 Ų161113 Ų11386%0.86171%0.71SS**PPolyproline II helixtrans-64.7128.2173.3-174.338.6000110.8L46L46-D48 PolarHBondContact O-N 3.3Å
49L59.1Low58.1Low141 Ų141121.5 Ų121.574%0.73873%0.729SS**  trans-128.2129.2-175.7-82.9158.6000108.7P47P47-L49 PolarHBondContact O-N 3.29Å
50P56.6Low56Low118 Ų118120.5 Ų120.577%0.76674%0.736SS**  trans-77.6139.7-154.628.1-36.4000115.2
51A50.5Low54.5Low96 Ų96123.2 Ų123.279%0.79375%0.753SS**  trans58.9105.1150.200000118.5
52S44.7Very low52.9Low126 Ų126126 Ų12688%0.88176%0.761SS**  trans-43.6134.5166.7-45.80000114.6
53K45.3Very low51.2Low210 Ų210125.1 Ų125.191%0.91377%0.765SS**  trans-103.1112.8155.8-165.3162.5-175171.40108.3
54G38.3Very low50.2Low73 Ų73126.7 Ų126.775%0.75377%0.77SS**  trans-75.1146.8-159.100000116.2
55T45.1Very low49.1Very low134 Ų134126 Ų12682%0.82277%0.773SS**  trans-94.4120.4173.7-15.20000111.1
56T39.7Very low47.9Very low126 Ų126129.7 Ų129.777%0.77378%0.777SS**  trans13.3103.8155.454.60000119.6
57A38Very low47.4Very low98 Ų98132 Ų13281%0.8179%0.789SS**  trans46.2118133.600000120.8
58S40.6Very low46.6Very low110 Ų110132.2 Ų132.277%0.76979%0.788SS**  trans-151.1119.6144.3-90.20000113.2
59R45.6Very low46Very low240 Ų240131.9 Ų131.991%0.90678%0.781SS**  trans51.9113.7147-51.8178.5-173.9-142.4-1.4118.8
60S39.3Very low45.4Very low107 Ų107133.8 Ų133.875%0.74879%0.786SS**  150.2117.4107-168.10000112.4
61V51.4Low44.9Very low120 Ų120133.3 Ų133.373%0.72778%0.783SS**  trans29.3109.3141.3-168.30000117.4
62D46.5Very low44.8Very low145 Ų145136.9 Ų136.978%0.77579%0.788SS**  -161.7176.792.1-130.9-49.8000113.9
63S44.8Very low44.8Very low97 Ų97133.9 Ų133.968%0.67878%0.777SS**  trans-87.2166.2-158.7-50.50000115.6
64T52.2Low45Very low123 Ų123130.9 Ų130.976%0.75577%0.771SS**  trans134.385138.1-53.10000116.4
65T46.3Very low45.2Very low124 Ų124134.3 Ų134.376%0.76177%0.768SS**  86.2133.8123.6-51.10000121.6
66I43.2Very low45.3Very low139 Ų139138 Ų13871%0.71377%0.767SS**  trans71.4101.1172.4-41.3-166.8000118.5
67L49.9Very low45.4Very low178 Ų178138.4 Ų138.493%0.93277%0.769SS**  -147.4149.9110.9-103.9170.5000108.8
68T44.3Very low45.6Very low110 Ų110138.5 Ų138.568%0.67576%0.763SS**  trans-123.6155.4-164.5-330000111.4
69E45.5Very low46Very low154 Ų154139.4 Ų139.472%0.7277%0.765SS**  trans74136.8166.6-50.7-167.4137.700116.1
70H46Very low45.8Very low182 Ų182134.2 Ų134.284%0.84376%0.755SS**  cis-143.7160.4-4.8-101.3160.9000111.1
71P45.7Very low45.8Very low108 Ų108134.1 Ų134.170%0.70175%0.75SS**  trans-99.5172.8-179.240.1-35.9000113.7
72L48.9Very low45.4Very low170 Ų170136.2 Ų136.289%0.8975%0.751SS**  trans-176.5132.9134.4-103.9167000113.5
73G44.5Very low45.2Very low64 Ų64133.7 Ų133.766%0.6675%0.745SS**  trans72.2155.1158.500000120.1
74D48.5Very low45.4Very low146 Ų146134.9 Ų134.978%0.78175%0.754SS**  cis-170.7170.1-37.7-121.4-58.5000109.1
75E43.6Very low45.1Very low146 Ų146133.8 Ų133.868%0.68275%0.751SS**  trans61.9116.9177.3-59.9-110.475.100116.2
76R46.6Very low45.4Very low212 Ų212135.4 Ų135.480%0.875%0.753SS**  72.611157.6-67.4170.8162.2-173.31.3115.4
77T42Very low45.5Very low134 Ų134136.3 Ų136.382%0.82276%0.759SS**  165.5140.1106.6-700000111.6
78S42.2Very low45.1Very low99 Ų99131.4 Ų131.469%0.69275%0.752SS**  trans-83.8160.9178.4-42.50000112.9
79T48.8Very low45.1Very low130 Ų130130.8 Ų130.880%0.79876%0.758SS**  170.6148.8117.334.50000115.7
80N41Very low45Very low131 Ų131133 Ų13370%0.70177%0.765SS**  trans35.5118.9146.9-78.9-35.8000124.6
81T39.3Very low44.7Very low105 Ų105133.1 Ų133.164%0.64477%0.766SS**  59.915497.3-44.60000121
82H44.1Very low44.6Very low163 Ų163135.5 Ų135.576%0.75577%0.772SS**  trans87.4150.1173-54.9-76.1000116.6
83S41.5Very low44.3Very low93 Ų93131.7 Ų131.765%0.6577%0.765SS**  cis-178160.3-31.4-96.30000108.4
84S49Very low44.3Very low122 Ų122135.3 Ų135.385%0.85377%0.77SS**  trans62.2159.8162.244.20000118
85S45.6Very low44.3Very low99 Ų99132.3 Ų132.369%0.69276%0.76SS**  cis-165.5-164-27.4-166.80000107.2
86I53Low44.4Very low158 Ų158133.4 Ų133.481%0.8176%0.762SS**  trans74.2152.5170.693.9177.2000116.6
87D44.7Very low44.2Very low158 Ų158134.5 Ų134.585%0.84577%0.767SS**  -174.3161.9-51.6-113.5-63.9000106.9
88G42.8Very low44.6Very low76 Ų76132.9 Ų132.978%0.78476%0.761SS**  trans135.2122.4169.100000114.8
89A43.3Very low45.1Very low97 Ų97134.2 Ų134.280%0.80277%0.77SS**  trans-133.8158.9-176.800000112.5
90K43.6Very low45.1Very low200 Ų200131 Ų13187%0.8776%0.764SS**  trans15.4131.4158.6-64.5178.8175.2-179.90119.2
91E40.6Very low45.5Very low185 Ų185131.2 Ų131.286%0.86478%0.775SS**  -149.4-174.4120.4-127.5-144.1105.400113.4
92L42.8Very low45.9Very low157 Ų157129.3 Ų129.382%0.82278%0.777SS**  trans-119.3-174.6-172.6-106.878.4000112.1
93A43.9Very low46.2Very low90 Ų90129.4 Ų129.474%0.74478%0.783SS**  trans95.1111.7153.600000120.4
94D43Very low46.3Very low141 Ų141133.9 Ų133.975%0.75479%0.793SS**  40.3119.4126-158.7-96.8000121
95S49.9Very low46Very low83 Ų83133 Ų13358%0.5879%0.794SS**  -177.4131.996.1-130.50000116.8
96K45.2Very low45.9Very low168 Ų168135.3 Ų135.373%0.7380%0.803SS**  trans57139.4136.8-77.2170.1-175.9145.90124.8
97R41.8Very low45.4Very low235 Ų235131.7 Ų131.789%0.88781%0.805SS**  trans73.3151.1148.3-75.3175.2171.7-161.8-4.2117.2
98S50.7Low45.3Very low101 Ų101129.6 Ų129.671%0.70680%0.802SS**  cis177.4151.2-15.949.30000107.4
99S52.7Low45.4Very low126 Ų126131 Ų13188%0.88180%0.8SS**  cis-165.8178.9-3.2-85.90000106.3
100G48.2Very low45.4Very low64 Ų64131.4 Ų131.466%0.6680%0.797SS**  cis171-176.23.700000110.9
101S50.3Low45.4Very low134 Ų134128.1 Ų128.194%0.93779%0.794SS**  trans60.7148.6-178.8-64.40000116.4
102G47.9Very low45.4Very low66 Ų66128.3 Ų128.368%0.6879%0.792SS**  cis164.1149.2-200000107.6
103D49.3Very low45.5Very low165 Ų165125 Ų12588%0.88278%0.782SS**  cis-149.6172.53.6-102.6-77.2000110.7
104Q43.8Very low45.3Very low186 Ų186126.7 Ų126.787%0.86978%0.783SS**  trans-106.5148.9-179.9-66.4-177.988.600113.1
105A42.6Very low45.4Very low105 Ų105128.4 Ų128.487%0.86878%0.784SS**  trans-156.5110147.900000111.8
106V43.6Very low45Very low147 Ų147130.3 Ų130.389%0.89179%0.792SS**  trans-98149.7161-70.90000109.1
107G42.4Very low44.8Very low82 Ų82125.4 Ų125.485%0.84579%0.79SS**  trans-174.990-178.800000113.5
108S42.7Very low45.1Very low113 Ų113121.1 Ų121.179%0.7978%0.783SS**  trans-91.5169-178.7-57.10000113.3
109S44.5Very low45.1Very low105 Ų105124.9 Ų124.973%0.73479%0.789SS**  trans91.199.1146.9-54.30000120.3
110S43.5Very low44.9Very low107 Ų107126.2 Ų126.275%0.74879%0.787SS**  87.5143.4112.4-62.80000123
111T44Very low45Very low130 Ų130129.6 Ų129.680%0.79879%0.789SS**  trans75.292146.1410000121.8
112K41.7Very low44.9Very low190 Ų190128.5 Ų128.583%0.82678%0.777SS**  87.1133.6101.2-176179175.4-174.40120.2
113S44.3Very low44.7Very low87 Ų87130.6 Ų130.661%0.60878%0.781SS**  trans88.4107.9152.3-880000121.8
114T40.2Very low44.5Very low125 Ų125127.6 Ų127.677%0.76777%0.773SS**  57.8115.1114.5-35.70000119.2
115K44Very low44.3Very low177 Ų177123.4 Ų123.477%0.7776%0.764SS**  161.1131.496.7-152.4-166.9170.1-173.90114.6
116T42.4Very low44.4Very low123 Ų123124.9 Ų124.976%0.75576%0.757SS**  trans47.2135150.8510000124.7
117G39.9Very low44.4Very low66 Ų66124.6 Ų124.668%0.6875%0.746SS**  trans161.4116.2164.600000106.9
118I48.2Very low44.4Very low145 Ų145128.2 Ų128.274%0.74474%0.741SS**  54.5131.151.7-26.1177.1000110
119E51.8Low44.4Very low180 Ų180130.3 Ų130.384%0.84174%0.738SS**  cis-149.816118.1-6.1-156.284.600109.5
120D47.9Very low44.4Very low154 Ų154132.5 Ų132.582%0.82474%0.737SS**  cis-165.8-112.5-26.8-172-103.1000109.1
121D51Low44.5Very low135 Ų135135.9 Ų135.972%0.72274%0.741SS**  trans84.986.1163.8-106.6-39.2000121.7
122T47.2Very low44.3Very low111 Ų111135.4 Ų135.468%0.68173%0.734SS**  41.4143.4126.270.70000121.4
123S44.8Very low44.5Very low109 Ų109133.7 Ų133.776%0.76273%0.728SS**  cis-169.6179.1-8.3-93.30000106.8
124S43.8Very low44.6Very low103 Ų103136.9 Ų136.972%0.7273%0.734SS**  cis-154.6161.57.7-122.50000108.3
125S40.4Very low44.9Very low97 Ų97137 Ų13768%0.67873%0.725SS**  59.7129.673.9-145.50000115.2
126L44.4Very low45.1Very low137 Ų137137.6 Ų137.672%0.71773%0.73SS**  cis-167.8170-9.8-119.6177.8000109.6
127Q44.2Very low45.3Very low141 Ų141139.1 Ų139.166%0.65973%0.728SS**  trans57.1134.9165.6-97.999.94.500118.6
128Q40.9Very low46Very low158 Ų158144.9 Ų144.974%0.73874%0.737SS**  94.9142.751.8-169.1174.88.600113.3
129Q43.6Very low45.8Very low156 Ų156145.4 Ų145.473%0.72974%0.741SS**  trans7899.1170-144.3155.6-9.500115.2
130Q44.2Very low45.9Very low151 Ų151145.2 Ų145.271%0.70674%0.74SS**  77.1138.688.3-75.7-176.12.500116.1
131Q45.3Very low45.7Very low178 Ų178146 Ų14683%0.83274%0.739SS**  trans68.4153.2169.9-59.6167.454.700114.5
132N40.3Very low45.4Very low121 Ų121142.8 Ų142.865%0.64774%0.738SS**  cis-168.7-180-20.8-178.716.6000106.4
133H45Very low45.4Very low153 Ų153144.8 Ų144.871%0.70874%0.743SS**  trans88.378.4166.2-45.9104000119.7
134Q47.2Very low45.4Very low155 Ų155145 Ų14572%0.72474%0.739SS**  46146.4114.8-77.8-178.8-24.600124.9
135H47.3Very low45.3Very low128 Ų128147.4 Ų147.459%0.59374%0.744SS**  trans73.6114.9151.4-65.4-50.4000121.1
136H47.6Very low45.4Very low188 Ų188146.2 Ų146.287%0.8775%0.747SS**  -153.7150.697.4-105.965.6000112.1
137H47.1Very low45.4Very low155 Ų155148 Ų14872%0.71875%0.752SS**  trans-105.7156175.9-75.8-98000111.2
138H53.5Low45.3Very low188 Ų188146 Ų14687%0.8775%0.754SS**  trans-143134.6146.1-102.952.2000109.3
139N44.7Very low45.4Very low155 Ų155147.7 Ų147.783%0.82976%0.758SS**  trans-154.1143.1172.7-1704.1000107.8
140H53.1Low45.1Very low176 Ų176147 Ų14782%0.81577%0.765SS**  trans-119.1144.9-170.8-121.7-89.3000112.9
141H45.2Very low45Very low171 Ų171144.7 Ų144.779%0.79277%0.772SS**  trans-115.3153.2-160.7-168.3-99.8000112.4
142G42.9Very low44.7Very low68 Ų68143.2 Ų143.270%0.70178%0.775SS**  trans-164.972.1-172.700000117.3
143L47.7Very low44.9Very low152 Ų152141 Ų14180%0.79678%0.78SS**  trans37115146-53.1173.9000119.4
144V45.7Very low44.8Very low113 Ų113141 Ų14169%0.68579%0.786SS**  cis95.6111.348172.30000115.1
145N40.8Very low44.7Very low154 Ų154137.7 Ų137.782%0.82478%0.78SS**  trans43.4132.2152.3-63.812000123.7
146G42.8Very low44.4Very low72 Ų72139.2 Ų139.274%0.74279%0.792SS**  trans-158104.416500000114.9
147H45.3Very low44.2Very low175 Ų175135 Ų13581%0.8179%0.79SS**  trans-27.9141.8165.4-53.398000115.9
148S41.6Very low44Very low100 Ų100139.3 Ų139.370%0.69980%0.8SS**  cis118.5136.830.3-83.70000111.6
149K42.9Very low43.5Very low193 Ų193135.3 Ų135.384%0.83979%0.793SS**  trans73.2107.7159.1-64.3173.5-177179.20121
150T36.1Very low43.8Very low142 Ų142133.5 Ų133.587%0.87179%0.79SS**  41.7116.4116.9-39.70000121.2
151A42.4Very low43.4Very low102 Ų102131 Ų13184%0.84379%0.786SS**  trans-155.1152.7146.200000111.5
152T39.1Very low43.3Very low146 Ų146132.5 Ų132.590%0.89679%0.791SS**  trans-110.3148.3178.4430000112.1
153G45.9Very low43.5Very low74 Ų74138 Ų13876%0.76380%0.795SS**  trans165.1109.8175.900000110.1
154N41Very low43.5Very low154 Ų154138.9 Ų138.982%0.82480%0.795SS**  cis115.2136.523.5-167.760.2000110.2
155S45.8Very low44.1Very low86 Ų86143.2 Ų143.260%0.60180%0.8SS**  trans75103.9168.8-63.10000122.2
156D40.6Very low45Very low159 Ų159141.2 Ų141.285%0.8580%0.795SS**  39.1122.1121.3-58.6-81.2000123
157A43.9Very low45.9Very low100 Ų100143.3 Ų143.383%0.82680%0.796SS**  -168.6109.6129.900000116.3
158R42.1Very low47.3Very low246 Ų246140.3 Ų140.393%0.92879%0.792SS**  70.1107.7126.3-158.3171-171.1177.92.8122.8
159S43.9Very low49Very low103 Ų103141.2 Ų141.272%0.7280%0.795SS**  trans-60.3170.4161.5-31.70000114.9
160P50.1Low50.5Low118 Ų118137.7 Ų137.777%0.76679%0.792SS**  -156.7139.783.838.8-17.7000120.6
161V45Very low52.3Low122 Ų122137.1 Ų137.174%0.73979%0.791SS**  trans47.9117.4130.6-1750000123K163V161-K163 HydrophobicContact CG1-CB 4.42Å
162K43.8Very low53.3Low204 Ų204137.2 Ų137.289%0.88779%0.791SS**  trans-156.2139.7130.7-93.7167.2-173.3176.20107.2
163K46.2Very low54.2Low182 Ų182134.7 Ų134.779%0.79179%0.785SS**  cis97.71408.6-157.8179.2177.7-175.90116.2V161V161-K163 HydrophobicContact CG1-CB 4.42Å
164E48.3Very low55.4Low171 Ų171137 Ų13780%0.79979%0.787SS**  trans77.4136.9179.7-58.8-148.896.600115.7
165R57.2Low56Low204 Ų204135 Ų13577%0.7778%0.782SS**  cis-160.9134.1-6-175.8-177.9-162.2-94.99.4111.6
166P61.5Low56.2Low113 Ų113137.5 Ų137.573%0.73479%0.794SS**PPolyproline II helixtrans-83.5173.3172.1-15.232.6000115.6
167P60Low56.6Low116 Ų116137.9 Ų137.975%0.75380%0.796SS**PPolyproline II helixtrans-92.3167.4-165.937.1-37.3000116.2
168P76.5Confident56.4Low112 Ų112136.9 Ų136.973%0.72779%0.788SS**PPolyproline II helixtrans-85.5156.8175.635.1-35.5000114.3
169P76.4Confident56.5Low118 Ų118134.9 Ų134.977%0.76679%0.789SS**PPolyproline II helixtrans-91.2165.1179.937.1-36.5000114.4
170P75Confident56.3Low120 Ų120134.3 Ų134.378%0.77979%0.79SS**PPolyproline II helixtrans-79.7155174.433.4-35.8000113.5
171P73.3Confident56Low129 Ų129137.2 Ų137.284%0.83880%0.799SS**PPolyproline II helixtrans-79.6158.9177.933-35.6000113.7
172A62.8Low55.7Low104 Ų104136.7 Ų136.786%0.8680%0.8SS**PPolyproline II helixtrans-89.3165.4-176.100000114.3
173A57.9Low55.6Low93 Ų93131.9 Ų131.977%0.76980%0.799SS**PPolyproline II helixtrans-94.4153.7-179.100000113.7
174P71.3Confident55.5Low124 Ų124128.6 Ų128.681%0.80580%0.798SS**PPolyproline II helixtrans-88.2143.1163.134.8-31.3000111.7
175P54.2Low55.3Low110 Ų110128.6 Ų128.671%0.71480%0.802SS**PPolyproline II helixtrans-100.1169.6-179.338.5-35.2000114.2
176V49.2Very low54.5Low139 Ų139124.1 Ų124.184%0.84280%0.802SS**  trans49.1119.9161.6-65.50000119.8
177N49.5Very low53.6Low167 Ų167121.6 Ų121.689%0.89379%0.791SS**  -145.4153.5115.3-155.2-1000110
178A40.5Very low52.9Low80 Ų80126.8 Ų126.866%0.66180%0.797SS**  trans-127.9131.6176.400000109.5
179Q43.1Very low51Low204 Ų204125 Ų12595%0.95380%0.798SS**  trans-170.1167.2141-109.5168.714.900112.8
180A39.9Very low49.5Very low91 Ų91124.8 Ų124.875%0.75280%0.8SS**  trans-49.3148.8-171.800000116.8
181L44.2Very low48Very low179 Ų179124.9 Ų124.994%0.93780%0.799SS**  -145.1117.8128.2-105.9175000109.4
182S39.5Very low46.7Very low110 Ų110124.4 Ų124.477%0.76980%0.798SS**  trans-92.9130.1177.552.70000110.8
183A42.2Very low45.7Very low104 Ų104122.9 Ų122.986%0.8679%0.793SS**  trans-124.8120.316900000109.8
184S42.2Very low44.8Very low112 Ų112124.3 Ų124.378%0.78380%0.797SS**  trans-82.4155.4-175.6-40.60000112.4
185I45.1Very low43.6Very low171 Ų171123.1 Ų123.188%0.87779%0.792SS**  trans-153.2148140.4-103.3147.4000109.4
186S40Very low43Very low110 Ų110123.6 Ų123.677%0.76980%0.796SS**  trans-71.7175.9-172.8-42.20000112.9
187A43.5Very low42.8Very low61 Ų61122.9 Ų122.950%0.50480%0.795SS.*  cis-159.1-165.418.100000112.6
188Y44.7Very low42.8Very low225 Ų225120.5 Ų120.588%0.88279%0.788SS**  trans44.3119.1160.832-117.7000119.6
189G36.9Very low42.9Very low73 Ų73123.8 Ų123.875%0.75380%0.8SS**  cis128.884.9-8.500000114.6
190S44Very low42.8Very low115 Ų115120.2 Ų120.280%0.80479%0.792SS**  trans-167.4125.3154.8-83.90000112.4
191T44.1Very low43Very low122 Ų122120.5 Ų120.575%0.74879%0.794SS**  trans10.6148.3139.658.40000120.9
192S45.9Very low42.9Very low118 Ų118119 Ų11983%0.82579%0.787SS**  cis-175.6153.3-8.2-930000109.7
193G41.2Very low42.9Very low73 Ų73118.6 Ų118.675%0.75378%0.784SS**  trans116.8112.5151.900000118.1
194S40.6Very low43.2Very low123 Ų123118.6 Ų118.686%0.8678%0.775SS**  trans51.1148148.1-660000122.5
195S46Very low43.2Very low98 Ų98123.7 Ų123.769%0.68578%0.779SS**  cis-175.5156.5-23.348.40000109.2
196C41.3Very low42.9Very low120 Ų120120.7 Ų120.781%0.81177%0.773SS**  trans74.7113.7168.4-54.30000117.9
197P44.9Very low43Very low125 Ų125119.3 Ų119.381%0.81277%0.768SS**  trans-106.9-153.3169.247.1-37.4000110
198P49.4Very low43.1Very low116 Ų116123.4 Ų123.475%0.75378%0.781SS**  trans-113172.6-130.1196.8000115.7
199V42.2Very low42.8Very low149 Ų149121.4 Ų121.490%0.90378%0.777SS**  trans-115.4146.7171.1157.30000110.8
200V41.6Very low42.9Very low130 Ų130122.6 Ų122.679%0.78877%0.774SS**  trans-130.4125.7-171.3-178.20000111.4
201A42.9Very low42.8Very low96 Ų96125.2 Ų125.279%0.79377%0.773SS**  trans-158.7117.7158.500000107
202N42Very low42.3Very low148 Ų148128.8 Ų128.879%0.79178%0.779SS**  cis79.189.831.1-163.438.9000115.6
203S39.7Very low41.7Very low102 Ų102126.9 Ų126.971%0.71378%0.778SS**  156.5130.5120.9-169.80000111.7
204P49.5Very low41.5Very low104 Ų104128.7 Ų128.768%0.67579%0.786SS**  trans-87.6159.916336.5-32.8000111.3
205Y41.7Very low41.2Very low218 Ų218127.8 Ų127.886%0.85579%0.786SS**  trans176.2161.4135.6-117-87.5000111.7
206S39.7Very low40.9Very low109 Ų109128.7 Ų128.776%0.76279%0.792SS**  trans70.4152161.6-61.70000118.7
207A41.8Very low40.6Very low80 Ų80131.1 Ų131.166%0.66180%0.797SS**  cis-163.9138.4-23.100000112.3
208L43.9Very low40.1Very low147 Ų147129.9 Ų129.977%0.7780%0.798SS**  trans52.6125.3136.1-60-179000124
209F39.2Very low39.3Very low183 Ų183128.7 Ų128.780%0.80380%0.798SS**  trans78.1138.4137-79.7-58000123.8
210S40Very low38.8Very low99 Ų99126.5 Ų126.569%0.69280%0.795SS**  trans75.5155.6152.8-66.70000118.7
211H41.3Very low38.4Very low170 Ų170124.9 Ų124.979%0.78780%0.795SS**  cis-140.8171.45.1-135.3-73000113.2
212F33.7Very low38Very low196 Ų196125 Ų12586%0.8680%0.796SS**  trans-56.8134.4179.3-78.9-116.8000116.2
213G32.5Very low37.5Very low79 Ų79122.9 Ų122.981%0.81480%0.799SS**  67.8133.8108.600000122.1
214A36.8Very low37.4Very low110 Ų110122.2 Ų122.291%0.90980%0.8SS**  trans-157.1151.7150.400000110.2
215A35.1Very low36.8Very low104 Ų104125.1 Ų125.186%0.8681%0.809SS**  trans-139.5145.6174.100000110.4
216S39.3Very low36.8Very low118 Ų118121.1 Ų121.183%0.82581%0.807SS**  trans-156.2134174.950.70000111.6
217N36.5Very low36.7Very low170 Ų170123.1 Ų123.191%0.90981%0.81SS**  trans-95.4161.9180-56.8-53.3000111.7
218A32.9Very low37.1Very low100 Ų100123.7 Ų123.783%0.82681%0.806SS**  trans145.3156.1148.600000110.3
219A32.8Very low36.6Very low91 Ų91125.8 Ų125.875%0.75281%0.81SS**  cis163164.4-31.400000106.7
220A32.2Very low36.7Very low103 Ų103123.2 Ų123.285%0.85181%0.808SS**  trans67.2153.8176.100000116.1
221A32.6Very low36.6Very low95 Ų95124.7 Ų124.779%0.78581%0.813SS**  cis-165.9-178.4-20.500000109.9
222A35.1Very low36.4Very low98 Ų98122.5 Ų122.581%0.8181%0.807SS**  trans67115.5178.500000115
223A32.3Very low36.6Very low105 Ų105121.5 Ų121.587%0.86881%0.805SS**  cis86.185.414.700000117.5
224A37.6Very low36.7Very low87 Ų87120.9 Ų120.972%0.71980%0.799SS**  trans-147.4127.1145.700000105.8
225L36.8Very low36.7Very low165 Ų165123.2 Ų123.286%0.86480%0.795SS**  59.9117.465.5-58.6179.9000110.8
226T41.7Very low37.1Very low134 Ų134125.2 Ų125.282%0.82279%0.79SS**  cis-149.4172.910.652.60000113.4
227N36Very low37.2Very low152 Ų152126.8 Ų126.881%0.81380%0.795SS**  trans-140.4166.8163.9-143.23.1000105.8
228P50.5Low37.4Very low91 Ų91121.7 Ų121.759%0.59178%0.783SS**  cis-135.9-152-3.533.6-8.4000113.7
229F34.4Very low37.8Very low192 Ų192122.6 Ų122.684%0.84278%0.783SS**  trans88.6155.6164.3-79.3-80.6000121.3
230V40.2Very low38.1Very low128 Ų128125.5 Ų125.578%0.77679%0.786SS**  trans65.7102.9169.5-1550000115.3
231V37.5Very low38.4Very low131 Ų131127.5 Ų127.579%0.79479%0.787SS**  83.3111.759.7174.90000115.1
232N37.2Very low38.7Very low123 Ų123126.7 Ų126.766%0.65879%0.789SS**  trans81.6145.1152.7-154.816.8000120.7
233H38.1Very low38.8Very low175 Ų175127.2 Ų127.281%0.8179%0.793SS**  trans49.3140.6176-57.1-61.9000118
234G34.8Very low38.9Very low67 Ų67127 Ų12769%0.69179%0.79SS**  cis133.8167.85.800000111.3
235L37.8Very low38.8Very low159 Ų159127 Ų12783%0.83279%0.791SS**  trans85.4104.5164.1-150.676000119.9
236L43.3Very low38.8Very low145 Ų145123.7 Ų123.776%0.75979%0.788SS**  trans49.6119.7139.3-55.9174000122.6
237T41.8Very low38.4Very low151 Ų151121.6 Ų121.693%0.92678%0.784SS**  176.1145.8111.827.70000109.2
238G39.6Very low38.5Very low64 Ų64120.5 Ų120.566%0.6679%0.788SS**  cis177160.5-9.600000111.2
239S40.7Very low38Very low118 Ų118119.7 Ų119.783%0.82580%0.796SS**  trans72.1151.3172.1-59.70000119.6
240L39.8Very low38.2Very low153 Ų153119 Ų11980%0.80180%0.8SS**  cis-172.4172.2-43.8-112.7164.6000110.5
241T39.8Very low38.5Very low144 Ų144117.4 Ų117.488%0.88379%0.793SS**  trans72.3138.9-169.9750000114.1
242G38Very low38.4Very low79 Ų79121.9 Ų121.981%0.81480%0.797SS**  cis157138.4-2.400000108.3
243A37.4Very low38.8Very low109 Ų109121.2 Ų121.290%0.90180%0.799SS**  cis-141.8-177.222.100000113.7
244A33.6Very low39Very low99 Ų99119.2 Ų119.282%0.81880%0.804SS**  trans-94.2-171.9-177.700000111.4
245A36.6Very low38.9Very low89 Ų89126 Ų12674%0.73681%0.814SS**  cis-161.717020.600000115.4
246A35.5Very low38.9Very low95 Ų95124.1 Ų124.179%0.78581%0.814SS**  trans41.312914500000120.8
247A34.6Very low38.3Very low90 Ų90121.2 Ų121.274%0.74482%0.819SS**  cis102.6122.527.800000115.1
248S37.3Very low38.1Very low129 Ų129121.3 Ų121.390%0.90281%0.813SS**  trans55.5108149.5-53.50000120.5
249G39.7Very low37.9Very low74 Ų74124.2 Ų124.276%0.76382%0.823SS**  trans173.966.2164.900000120.9
250L40.3Very low37.4Very low177 Ų177123.5 Ų123.593%0.92781%0.814SS**  trans62.3170.9154.8-73.5168.3000118.1
251P44.8Very low37.4Very low95 Ų95120.3 Ų120.362%0.61781%0.81SS**  trans-109.6156.6-15640.1-34.5000116
252Y36Very low37.1Very low225 Ų225121.4 Ų121.488%0.88281%0.81SS**  173.6155.4124.7-96.1-74.4000108.3
253P46.4Very low36.8Very low108 Ų108120.3 Ų120.370%0.70180%0.798SS**  trans-98.6145.6-158.336.5-34.4000115
254C40.7Very low36.7Very low134 Ų134120.1 Ų120.191%0.90579%0.79SS**  trans-135.1137.3159.7-91.50000110.4
255F33.4Very low37.2Very low210 Ų210119.8 Ų119.892%0.92179%0.787SS**  trans-77133178.5-84.5-116.5000111.3
256S38.7Very low37.5Very low118 Ų118125.3 Ų125.383%0.82579%0.79SS**  trans-144.1113.2157.8-82.90000108.7L258S256-L258 PolarHBondContact O-N 3.35Å
257G30Very low38.4Very low84 Ų84123.2 Ų123.287%0.86677%0.769SS**  trans-78.183.7-16900000113.7
258L36.6Very low39.3Very low154 Ų154130.2 Ų130.281%0.80678%0.776SS**  trans-118.198.7165.9-15076.7000109S256 T260S256-L258 PolarHBondContact O-N 3.35Å; L258-T260 PolarHBondContact O-N 3.09Å
259S35.6Very low40.5Very low124 Ų124128.7 Ų128.787%0.86777%0.766SS**  trans-76.466.4-174-63.70000113.1A261S259-A261 PolarHBondContact O-N 3.38Å; S259-A261 VanDerWaalsContact O-N 3.13Å
260T31.5Very low41.6Very low104 Ų104126.8 Ų126.864%0.63874%0.74SS**  trans-62.5106.2162.3-63.40000109.2L258 L262L258-T260 PolarHBondContact O-N 3.09Å; T260-L262 HydrophobicContact CG2-CB 4.18Å; T260-L262 HydrophobicContact CG2-CD1 3.78Å; T260-L262 HydrophobicContact CG2-CG 4.42Å
261A39Very low42.8Very low85 Ų85123.5 Ų123.570%0.70274%0.738SS**  trans-144.8111.9172.700000109.4S259S259-A261 PolarHBondContact O-N 3.38Å; S259-A261 VanDerWaalsContact O-N 3.13Å
262L34.1Very low43.7Very low168 Ų168120.8 Ų120.888%0.8872%0.719SS**  cis54.2154.9-70.6-178.8000116.2T260T260-L262 HydrophobicContact CG2-CB 4.18Å; T260-L262 HydrophobicContact CG2-CD1 3.78Å; T260-L262 HydrophobicContact CG2-CG 4.42Å
263G30.9Very low45.3Very low56 Ų56114 Ų11458%0.57770%0.702SS**  trans-83.1132.314900000107.3A265G263-A265 PolarHBondContact O-N 2.96Å
264S35.2Very low46.2Very low105 Ų105117.1 Ų117.173%0.73471%0.705SS**  trans-49.7135.8174-56.40000110.1Y266S264-Y266 PolarHBondContact O-N 3.34Å
265A43.3Very low47.5Very low91 Ų91111 Ų11175%0.75266%0.663SS**  trans-7170.5179.900000111.1G263G263-A265 PolarHBondContact O-N 2.96Å
266Y43.4Very low49.1Very low205 Ų205109.4 Ų109.480%0.80466%0.656SS**  trans-52.1123.8165.2-95.6-87.9000107.5S264 R268S264-Y266 PolarHBondContact O-N 3.34Å; Y266-R268 PolarHBondContact O-N 3.11Å
267P55.5Low50.3Low51 Ų51108.8 Ų108.833%0.33165%0.647SS.*  trans-60.3136.6-17926.3-33.9000107.6S269 L282P267-S269 PolarHBondContact O-N 3.32Å; P267-L282 HydrophobicContact CG-CD1 3.84Å
268R54Low51.8Low237 Ų237105.7 Ų105.789%0.89461%0.612SS**  trans-65.791.8172-73.2-70.1-175.1161.4-0107.6Y266 C270Y266-R268 PolarHBondContact O-N 3.11Å; R268-C270 PolarHBondContact O-N 3.02Å
269S61.9Low53Low98 Ų98102.6 Ų102.669%0.68560%0.601SS**  trans-53.7138.3170.543.40000108.8P267 A271P267-S269 PolarHBondContact O-N 3.32Å; S269-A271 PolarHBondContact O-N 2.97Å; S269-A271 VanDerWaalsContact O-N 3.08Å
270C63.4Low53.9Low34 Ų3499.6 Ų99.623%0.2358%0.584CS.*  trans-57.6120.6-178.9-124.10000109.1R268 D272 C275 C305R268-C270 PolarHBondContact O-N 3.02Å; C270-D272 PolarHBondContact O-N 3.44Å; C270-D272 VanDerWaalsContact O-N 3.15Å; C270-C275 HydrophobicContact CB-CB 3.64Å; C270-C275 VanDerWaalsContact SG-CB 3.58Å; C270-C305 WeakPolarHBondContact CB-SG 3.24Å; C270-C305 WeakPolarHBondContact SG-CB 3.49Å; C270-C305 CovalentContact SG-SG 2.04Å; C270-C305 PolarHBondContact SG-SG 2.9Å
271A64.5Low55Low107 Ų10798.8 Ų98.888%0.88458%0.579SS**SBendtrans-70.4-4.3177.400000112.9S269S269-A271 PolarHBondContact O-N 2.97Å; S269-A271 VanDerWaalsContact O-N 3.08Å
272D63.2Low55.4Low39 Ų39100 Ų10021%0.20957%0.573CS.*SBendtrans-85.2125.3179.4-173.3-52.7000111C270 F274 C275C270-D272 PolarHBondContact O-N 3.44Å; C270-D272 VanDerWaalsContact O-N 3.15Å; D272-F274 PolarHBondContact O-N 3.29Å; D272-F274 WeakPolarHBondContact OD1-CA 3.36Å; D272-F274 WeakPolarHBondContact OD1-CB 3.44Å; D272-F274 WeakPolarHBondContact OD1-CD2 3.23Å; D272-F274 PolarHBondContact OD1-N 3.06Å; D272-C275 HydrophobicContact CB-CB 4.02Å; D272-C275 VanDerWaalsContact CG-SG 3.58Å; D272-C275 PolarHBondContact O-N 2.6Å; D272-C275 VanDerWaalsContact O-N 3.14Å
273P69.7Low56Low82 Ų8296.6 Ų96.653%0.53257%0.57SS.*THydrogen-bonded Turntrans-66.2-19-176.228-35.5000114.4K276P273-K276 WeakPolarHBondContact O-CD 3.42Å; P273-K276 VanDerWaalsContact O-CE 3.25Å; P273-K276 WeakPolarHBondContact O-CE 3.31Å
274F65.6Low56.5Low174 Ų17498.1 Ų98.176%0.76357%0.568SS**THydrogen-bonded Turntrans-86.2-20.1177-57.5-78.4000112.5D272 K276D272-F274 PolarHBondContact O-N 3.29Å; D272-F274 WeakPolarHBondContact OD1-CA 3.36Å; D272-F274 WeakPolarHBondContact OD1-CB 3.44Å; D272-F274 WeakPolarHBondContact OD1-CD2 3.23Å; D272-F274 PolarHBondContact OD1-N 3.06Å; F274-K276 VanDerWaalsContact C-N 3.31Å; F274-K276 PolarHBondContact O-N 3.13Å
275C68.1Low56.5Low4 Ų4101.5 Ų101.53%0.02758%0.577CS.*  trans-90.518.5-172.8-60.30000115.3C270 D272 T277 C278 C302C270-C275 HydrophobicContact CB-CB 3.64Å; C270-C275 VanDerWaalsContact SG-CB 3.58Å; D272-C275 HydrophobicContact CB-CB 4.02Å; D272-C275 VanDerWaalsContact CG-SG 3.58Å; D272-C275 PolarHBondContact O-N 2.6Å; D272-C275 VanDerWaalsContact O-N 3.14Å; C275-T277 PolarHBondContact O-N 3.21Å; C275-C278 WeakPolarHBondContact O-CB 3.35Å; C275-C278 PolarHBondContact O-N 3.26Å; C275-C302 WeakPolarHBondContact CA-SG 3.43Å; C275-C302 HydrophobicContact CB-CB 4.08Å; C275-C302 WeakPolarHBondContact CB-SG 3.32Å; C275-C302 WeakPolarHBondContact SG-CA 3.39Å; C275-C302 WeakPolarHBondContact SG-CB 3.29Å; C275-C302 CovalentContact SG-SG 2.04Å; C275-C302 PolarHBondContact SG-SG 3.27Å
276K66.6Low56.1Low177 Ų177100.7 Ų100.777%0.7758%0.577SS**THydrogen-bonded Turntrans-62.4-11.1177-64.9172.7-176.3167.60114.3P273 F274P273-K276 WeakPolarHBondContact O-CD 3.42Å; P273-K276 VanDerWaalsContact O-CE 3.25Å; P273-K276 WeakPolarHBondContact O-CE 3.31Å; F274-K276 VanDerWaalsContact C-N 3.31Å; F274-K276 PolarHBondContact O-N 3.13Å
277T65.2Low55.7Low105 Ų10597.9 Ų97.964%0.64458%0.582SS**THydrogen-bonded Turntrans-99.7-3.8176.951.10000113.9C275C275-T277 PolarHBondContact O-N 3.21Å
278C61.1Low54.5Low19 Ų1999.4 Ų99.413%0.12861%0.607CS.*SBendtrans-68.2125.3169.8-74.60000109.9C275 A280 C298C275-C278 WeakPolarHBondContact O-CB 3.35Å; C275-C278 PolarHBondContact O-N 3.26Å; C278-A280 PolarHBondContact O-N 3.33Å; C278-C298 HydrophobicContact CB-CB 4.48Å; C278-C298 WeakPolarHBondContact CB-SG 3.28Å; C278-C298 WeakPolarHBondContact SG-CB 3.42Å; C278-C298 CovalentContact SG-SG 2.04Å; C278-C298 PolarHBondContact SG-SG 3.39Å
279P62.1Low53.3Low89 Ų8991.8 Ų91.858%0.57860%0.601SS**  trans-71.498.9175.629-33.3000110T281P279-T281 PolarHBondContact O-N 3.12Å; P279-T281 PolarHBondContact O-OG1 3.39Å
280A54.8Low52.1Low61 Ų6191.9 Ų91.950%0.50461%0.609SS.*  trans-56.4113.7172.800000109.2C278 L282C278-A280 PolarHBondContact O-N 3.33Å; A280-L282 VanDerWaalsContact C-N 3.27Å; A280-L282 PolarHBondContact O-N 3.01Å
281T53.9Low50.7Low87 Ų8795.5 Ų95.553%0.53464%0.641SS.*  trans-82.475.8-167.2-33.20000110.2P279 A283 H310P279-T281 PolarHBondContact O-N 3.12Å; P279-T281 PolarHBondContact O-OG1 3.39Å; T281-A283 PolarHBondContact O-N 3.47Å; T281-H310 WeakPolarHBondContact CB-NE2 3.45Å; T281-H310 PolarHBondContact OG1-CD2 3.41Å
282L47.2Very low49.6Very low111 Ų11194.8 Ų94.858%0.58164%0.635SS**  trans-69.178.6177.8-173.376.7000110.6P267 A280 T284P267-L282 HydrophobicContact CG-CD1 3.84Å; A280-L282 VanDerWaalsContact C-N 3.27Å; A280-L282 PolarHBondContact O-N 3.01Å; L282-T284 PolarHBondContact O-N 3.49Å
283A46.3Very low48.6Very low97 Ų9798.8 Ų98.880%0.80266%0.663SS**  trans-73.869.917200000110.4T281T281-A283 PolarHBondContact O-N 3.47Å
284T42.2Very low47.6Very low88 Ų8899.5 Ų99.554%0.5468%0.676SS.*SBendtrans-140.995.7178.9-51.20000110.8L282 G286L282-T284 PolarHBondContact O-N 3.49Å; T284-G286 PolarHBondContact O-N 2.91Å
285L34.4Very low47Very low176 Ų17694.9 Ų94.992%0.92168%0.677SS**  trans30.676.2161.1-64.790.1000116.8
286G35.5Very low46.4Very low74 Ų74105.2 Ų105.276%0.76372%0.715SS**  trans-104.8125.4159.100000110.3T284 G288T284-G286 PolarHBondContact O-N 2.91Å; G286-G288 PolarHBondContact O-N 2.93Å
287T33.8Very low46.3Very low146 Ų146102.8 Ų102.890%0.89672%0.718SS**  trans-78.9110.2-172.649.30000113.4
288G30.3Very low46.2Very low83 Ų83100 Ų10086%0.85670%0.702SS**SBendtrans83.4121155.500000117.2G286G286-G288 PolarHBondContact O-N 2.93Å
289G29.7Very low46.4Very low76 Ų76102.2 Ų102.278%0.78472%0.716SS**  trans131.7124.2165.200000114.5
290A35.7Very low46.4Very low101 Ų101108.8 Ų108.884%0.83574%0.736SS**  trans42.699.1163.800000118A292A290-A292 PolarHBondContact O-N 2.68Å; A290-A292 VanDerWaalsContact O-N 3.13Å
291A35.7Very low46.8Very low109 Ų109108.5 Ų108.590%0.90174%0.739SS**  trans-64.2111.9166.800000111.1
292A40.5Very low47.3Very low92 Ų92105 Ų10576%0.7672%0.718SS**  trans-81.3138.2172.400000110.9A290A290-A292 PolarHBondContact O-N 2.68Å; A290-A292 VanDerWaalsContact O-N 3.13Å
293P41.7Very low48.2Very low123 Ų123105 Ų10580%0.79972%0.723SS**  trans-72.5160.3-179.930.8-35.8000112.7
294A49.6Very low48.8Very low98 Ų98106.6 Ų106.681%0.8171%0.714SS**SBendtrans-6.5122.9173.800000117.5R296A294-R296 PolarHBondContact O-N 3.26Å
295G53Low49.6Very low76 Ų76104.3 Ų104.378%0.78470%0.701SS**PPolyproline II helixtrans-53.1130.6-178.200000113.9
296R55.4Low50.6Low221 Ų221100.4 Ų100.483%0.83469%0.694SS**PPolyproline II helixtrans-64.6136.7175.4-59.6175.472.3-152.23.9109.5A294A294-R296 PolarHBondContact O-N 3.26Å
297P63.7Low51.4Low126 Ų126101.6 Ų101.682%0.81869%0.691SS**PPolyproline II helixtrans-62.1143.7177.126.4-34.3000111
298C63.3Low52.2Low46 Ų4698.5 Ų98.531%0.31168%0.675SS.*PPolyproline II helixtrans-58.8153.9171.2-73.30000111.3C278 C302C278-C298 HydrophobicContact CB-CB 4.48Å; C278-C298 WeakPolarHBondContact CB-SG 3.28Å; C278-C298 WeakPolarHBondContact SG-CB 3.42Å; C278-C298 CovalentContact SG-SG 2.04Å; C278-C298 PolarHBondContact SG-SG 3.39Å; C298-C302 HydrophobicContact CB-CB 3.72Å
299P66.7Low53Low66 Ų6696.7 Ų96.743%0.42966%0.657SS.*PPolyproline II helixtrans-60.7154.2178.325.9-35.2000112.6G301 C302P299-G301 PolarHBondContact O-N 3.33Å; P299-C302 PolarHBondContact O-N 3.05Å
300F60.6Low53.8Low227 Ų22798.3 Ų98.3100%0.99664%0.644SS**THydrogen-bonded Turntrans-53.9114174.9-79.1-89.6000110.4
301G62.9Low54.2Low56 Ų5698 Ų9858%0.57764%0.641SS**THydrogen-bonded Turntrans137.7-37.6-172.900000112.2P299 T303P299-G301 PolarHBondContact O-N 3.33Å; G301-T303 PolarHBondContact O-N 3.19Å
302C64.5Low54.6Low13 Ų1396.2 Ų96.29%0.08863%0.626CS.*  trans-83.465.7-170.2-68.80000115.5C275 C298 P299C275-C302 WeakPolarHBondContact CA-SG 3.43Å; C275-C302 HydrophobicContact CB-CB 4.08Å; C275-C302 WeakPolarHBondContact CB-SG 3.32Å; C275-C302 WeakPolarHBondContact SG-CA 3.39Å; C275-C302 WeakPolarHBondContact SG-CB 3.29Å; C275-C302 CovalentContact SG-SG 2.04Å; C275-C302 PolarHBondContact SG-SG 3.27Å; C298-C302 HydrophobicContact CB-CB 3.72Å; P299-C302 PolarHBondContact O-N 3.05Å
303T67Low54.8Low112 Ų11294.2 Ų94.269%0.68761%0.61SS**G310 helixtrans-69.2-31.3178.157.40000113.6G301 C305G301-T303 PolarHBondContact O-N 3.19Å; T303-C305 VanDerWaalsContact C-N 3.35Å; T303-C305 PolarHBondContact O-N 3.47Å
304Q58Low54.8Low130 Ų13091.6 Ų91.661%0.60760%0.598SS**G310 helixtrans-68.7-26.1-179.2-68.5-78-6.400114.2
305C60.4Low54.4Low40 Ų4090.1 Ų90.127%0.2759%0.586SS.*G310 helixtrans-88.8-11.9-174.6-100.60000114.5C270 T303C270-C305 WeakPolarHBondContact CB-SG 3.24Å; C270-C305 WeakPolarHBondContact SG-CB 3.49Å; C270-C305 CovalentContact SG-SG 2.04Å; C270-C305 PolarHBondContact SG-SG 2.9Å; T303-C305 VanDerWaalsContact C-N 3.35Å; T303-C305 PolarHBondContact O-N 3.47Å
306A55.5Low53.9Low93 Ų9389.4 Ų89.477%0.76957%0.573SS**SBendtrans-91-16.2-171.600000114.6
307S52.6Low53.4Low99 Ų9982 Ų8269%0.69256%0.558SS**SBendtrans-106.2-13.3-167.449.50000114.8G309S307-G309 PolarHBondContact O-N 2.9Å
308S49.2Very low52.5Low81 Ų8179.6 Ų79.657%0.56655%0.549SS*.SBendtrans-101.468-169.346.10000114
309G48.4Very low51.4Low46 Ų4679.6 Ų79.647%0.47455%0.553SS.*SBendtrans107.1-2.115100000119.3S307 A313S307-G309 PolarHBondContact O-N 2.9Å; G309-A313 WeakPolarHBondContact O-CB 3.32Å; G309-A313 PolarHBondContact O-N 3.05Å
310H46.4Very low50.3Low110 Ų11079.4 Ų79.451%0.50956%0.557SS.*Hα-helixtrans-95.4-24.6-178.5-67.6-14.9000115.5T281 A312 A313 A314T281-H310 WeakPolarHBondContact CB-NE2 3.45Å; T281-H310 PolarHBondContact OG1-CD2 3.41Å; H310-A312 VanDerWaalsContact C-N 3.31Å; H310-A312 PolarHBondContact O-N 3.35Å; H310-A313 PolarHBondContact O-N 3.37Å; H310-A314 PolarHBondContact O-N 3.2Å; H310-A314 VanDerWaalsContact O-N 3.12Å
311A44Very low49.5Very low95 Ų9572.8 Ų72.879%0.78554%0.544SS*.Hα-helixtrans-62.6-37.3169.800000112.4
312A43.7Very low48.6Very low71 Ų7173.1 Ų73.159%0.58754%0.542SS*.Hα-helixtrans-75.6-41.2176.300000112.6H310 A314 A315 A316H310-A312 VanDerWaalsContact C-N 3.31Å; H310-A312 PolarHBondContact O-N 3.35Å; A312-A314 PolarHBondContact O-N 3.43Å; A312-A315 PolarHBondContact O-N 3.03Å; A312-A316 PolarHBondContact O-N 2.89Å
313A44.2Very low47.4Very low50 Ų5075.2 Ų75.241%0.41356%0.559SS.*Hα-helixtrans-65.3-38.8-178.800000112.9G309 H310 A315 A316 A317G309-A313 WeakPolarHBondContact O-CB 3.32Å; G309-A313 PolarHBondContact O-N 3.05Å; H310-A313 PolarHBondContact O-N 3.37Å; A313-A315 PolarHBondContact O-N 3.42Å; A313-A316 PolarHBondContact O-N 3.38Å; A313-A317 WeakPolarHBondContact O-CB 3.3Å; A313-A317 PolarHBondContact O-N 3.23Å
314A42.6Very low46.2Very low67 Ų6778 Ų7855%0.55457%0.565SS**Hα-helixtrans-63.8-39.4176.500000112.4H310 A312 A318H310-A314 PolarHBondContact O-N 3.2Å; H310-A314 VanDerWaalsContact O-N 3.12Å; A312-A314 PolarHBondContact O-N 3.43Å; A314-A318 PolarHBondContact O-N 2.79Å
315A40.3Very low45.3Very low67 Ų6779.6 Ų79.655%0.55458%0.577SS**Hα-helixtrans-68-39.517500000112.4A312 A313 A319A312-A315 PolarHBondContact O-N 3.03Å; A313-A315 PolarHBondContact O-N 3.42Å; A315-A319 PolarHBondContact O-N 3.4Å
316A43.3Very low44.4Very low62 Ų6283.5 Ų83.551%0.51260%0.601SS.*Hα-helixtrans-68.2-41177.600000112.8A312 A313 A318 A319 A320A312-A316 PolarHBondContact O-N 2.89Å; A313-A316 PolarHBondContact O-N 3.38Å; A316-A318 VanDerWaalsContact C-N 3.34Å; A316-A318 PolarHBondContact O-N 3.14Å; A316-A319 PolarHBondContact O-N 3.3Å; A316-A320 PolarHBondContact O-N 3.47Å
317A44.5Very low43.7Very low64 Ų6484.6 Ų84.653%0.52960%0.603SS.*Hα-helixtrans-63.7-37.7178.500000112.6A313 A319 A320 A321A313-A317 WeakPolarHBondContact O-CB 3.3Å; A313-A317 PolarHBondContact O-N 3.23Å; A317-A319 VanDerWaalsContact C-N 3.3Å; A317-A319 PolarHBondContact O-N 2.82Å; A317-A320 PolarHBondContact O-N 3.33Å; A317-A321 PolarHBondContact O-N 2.8Å
318A43.6Very low43.1Very low76 Ų7684.8 Ų84.863%0.62861%0.605SS**Hα-helixtrans-66.3-30.117500000113.1A314 A316A314-A318 PolarHBondContact O-N 2.79Å; A316-A318 VanDerWaalsContact C-N 3.34Å; A316-A318 PolarHBondContact O-N 3.14Å
319A41.7Very low42.6Very low46 Ų4687.7 Ų87.738%0.3861%0.613SS.*Hα-helixtrans-78.2-35.6175.300000112.8A315 A316 A317 A321 A322 F338A315-A319 PolarHBondContact O-N 3.4Å; A316-A319 PolarHBondContact O-N 3.3Å; A317-A319 VanDerWaalsContact C-N 3.3Å; A317-A319 PolarHBondContact O-N 2.82Å; A319-A321 VanDerWaalsContact C-N 3.35Å; A319-A321 PolarHBondContact O-N 3.4Å; A319-A322 PolarHBondContact O-N 3.1Å; A319-F338 HydrophobicContact CB-CZ 4.5Å; A319-F338 WeakPolarHBondContact O-CZ 3.41Å
320A42.8Very low42.1Very low63 Ų6396.6 Ų96.652%0.52163%0.633SS.*Hα-helixtrans-65.8-34.3-179.100000113.2A316 A317 A322 A323A316-A320 PolarHBondContact O-N 3.47Å; A317-A320 PolarHBondContact O-N 3.33Å; A320-A322 PolarHBondContact O-N 2.89Å; A320-A322 VanDerWaalsContact O-N 3.16Å; A320-A323 PolarHBondContact O-N 3.33Å
321A43.2Very low41.7Very low88 Ų8898.8 Ų98.873%0.72765%0.647SS**THydrogen-bonded Turntrans-69.4-7.2179.200000114.6A317 A319A317-A321 PolarHBondContact O-N 2.8Å; A319-A321 VanDerWaalsContact C-N 3.35Å; A319-A321 PolarHBondContact O-N 3.4Å
322A44.3Very low41.6Very low63 Ų6399.4 Ų99.452%0.52165%0.646SS.*THydrogen-bonded Turntrans-101.34-179.300000114.2A319 A320A319-A322 PolarHBondContact O-N 3.1Å; A320-A322 PolarHBondContact O-N 2.89Å; A320-A322 VanDerWaalsContact O-N 3.16Å
323A40.5Very low41.7Very low56 Ų56100.8 Ų100.846%0.46365%0.649SS.*SBendtrans-98.8-10.9-175.600000114.8A320 F338A320-A323 PolarHBondContact O-N 3.33Å; A323-F338 HydrophobicContact CB-CD2 4.22Å; A323-F338 HydrophobicContact CB-CE2 3.9Å
324E40.9Very low41.6Very low171 Ų171109.9 Ų109.980%0.79967%0.674SS**  trans-10448.3-164.8-68.6-75.1118.400113.7
325L39.5Very low41.2Very low164 Ų164110.4 Ų110.486%0.85969%0.686SS**  trans-140.3131.1167.5-80.2-179000112.6
326P41.3Very low41.5Very low121 Ų121111.7 Ų111.779%0.78670%0.697SS**  trans-79.7151.5179.832.6-35.3000113.3
327S40Very low42.1Very low116 Ų116112.4 Ų112.481%0.81170%0.696SS**  trans-43.7130.8179.2-46.60000116.2
328S39.8Very low41.7Very low104 Ų104114.6 Ų114.673%0.72769%0.694SS**  -178.7120.8119.4-82.10000115.2
329L39.8Very low41.5Very low142 Ų142117.8 Ų117.874%0.74370%0.699SS**  trans70.2113.1137.7-60.1174.1000121.4
330W38.2Very low41.3Very low232 Ų232122.1 Ų122.188%0.87972%0.722SS**  trans87.9111.2151.9-59111.4000122.1
331L38.2Very low40.9Very low156 Ų156123.5 Ų123.582%0.81773%0.733SS**  trans86.295.2130.2-152.176.5000121.4
332S41.5Very low40.7Very low109 Ų109124.5 Ų124.576%0.76274%0.741SS**  trans72.9161.1149.2-146.20000117.9
333P45.8Very low40.3Very low99 Ų99124.8 Ų124.864%0.64375%0.751SS**SBend-117.4-178.4-61.133.9-20.8000111.5
334Y41.9Very low40.1Very low242 Ų242130.9 Ų130.995%0.94977%0.774SS**SBendtrans63.277.8-175.5-59.9-92.3000114.7
335G34.7Very low40.1Very low77 Ų77131.8 Ų131.879%0.79478%0.778SS**  trans-168.7114.817200000113.3
336A45.5Very low40.2Very low95 Ų95131.8 Ų131.879%0.78578%0.779SS**  trans-88.7-175.5151.400000107.4
337P56Low39.9Very low76 Ų76130.5 Ų130.549%0.49478%0.778SS.*  cis-143.5-150.111.831-3.2000113.6
338F37.1Very low40Very low111 Ų111131.2 Ų131.249%0.48778%0.777SS.*  trans73142.3162.6-64.3-47.7000117.4A319 A323A319-F338 HydrophobicContact CB-CZ 4.5Å; A319-F338 WeakPolarHBondContact O-CZ 3.41Å; A323-F338 HydrophobicContact CB-CD2 4.22Å; A323-F338 HydrophobicContact CB-CE2 3.9Å
339L39.2Very low40.1Very low142 Ų142130.8 Ų130.874%0.74377%0.772SS**  cis-141.4157.8-1.9-108.5155.4000108.5
340T37.3Very low40.2Very low138 Ų138130.7 Ų130.785%0.84778%0.78SS**  -172.5147.388.9-63.50000109.5
341A33.7Very low40.2Very low91 Ų91123.9 Ų123.975%0.75277%0.768SS**  trans-115.9139.5-179.100000113.1
342A40.6Very low40.2Very low109 Ų109123.1 Ų123.190%0.90177%0.769SS**  trans-165.2152.5160.100000110.4
343G34.6Very low40Very low70 Ų70123 Ų12372%0.72278%0.775SS**  trans105.776.8158.600000118.3
344L37.7Very low39.5Very low184 Ų184123.1 Ų123.196%0.96379%0.785SS**  trans33.8109.1134.7-64.2161.8000118.8
345H40.5Very low39.3Very low190 Ų190115.9 Ų115.988%0.8878%0.775SS**  trans-108.1142.1155.959.1-93.2000110.5
346N41.4Very low39.3Very low164 Ų164121.2 Ų121.288%0.87778%0.779SS**  trans-125.6148.5169.1-152.8-15000108.5
347A34.3Very low38.9Very low93 Ų93122.3 Ų122.377%0.76979%0.788SS**  trans-85.3128.4-153.600000115.2
348V42.1Very low37.9Very low131 Ų131121.5 Ų121.579%0.79479%0.794SS**  trans-143.3137.4165.8-176.40000108.5
349P42.4Very low38.2Very low95 Ų95123.7 Ų123.762%0.61781%0.811SS**  trans-73.2160.8-17829.5-36.7000114.1S351P349-S351 PolarHBondContact O-N 2.98Å
350P41.2Very low38.5Very low140 Ų140125.9 Ų125.991%0.90982%0.819SS**SBendtrans-79.679.4-17633.4-36.7000112.8
351S38.7Very low38.9Very low90 Ų90123.8 Ų123.863%0.62982%0.816SS**  trans-140145.4163.648.10000110.2P349P349-S351 PolarHBondContact O-N 2.98Å
352V37.7Very low39.7Very low139 Ų139126.6 Ų126.684%0.84282%0.818SS**  trans65.860.9-174.7-158.20000114.7
353A37.3Very low40Very low107 Ų107127.6 Ų127.688%0.88481%0.808SS**  trans-113.543.517100000112.8
354A35.8Very low40.7Very low102 Ų102128.8 Ų128.884%0.84381%0.811SS**SBendtrans-134.124.3-175.800000113.8
355A38Very low41.5Very low90 Ų90127.3 Ų127.374%0.74480%0.804SS**SBendtrans-154.551.4-174.900000114
356Q34.3Very low41.8Very low188 Ų188123.6 Ų123.688%0.87979%0.794SS**  trans-142.919.9173.1-131.2171.78.100116.4G358Q356-G358 PolarHBondContact O-N 2.98Å
357A36Very low42Very low119 Ų119120.3 Ų120.398%0.98378%0.776SS**SBendtrans-76.664.2164.200000110.5
358G34.9Very low42.8Very low59 Ų59121.9 Ų121.961%0.60878%0.781SS**SBendtrans-175.534.8-166.500000117.7Q356Q356-G358 PolarHBondContact O-N 2.98Å
359N44.9Very low43.2Very low157 Ų157120.4 Ų120.484%0.8477%0.769SS**  trans-16451.8160.8-111.1-23000114.5
360M44.7Very low43.8Very low188 Ų188121.5 Ų121.593%0.92678%0.776SS**  trans-124.144.4171.3-65.6-154.5-6400112.7
361A45.6Very low44.5Very low93 Ų93119.8 Ų119.877%0.76976%0.763SS**SBendtrans-100.51.4176.800000114
362N50Low45.3Very low151 Ų151121.1 Ų121.181%0.80776%0.761SS**SBendtrans-128.331.7-166.8-143.9-15.8000114.6
363L48.1Very low46.1Very low130 Ų130117.8 Ų117.868%0.68174%0.744SS**SBendtrans-116.82.1167.1-79.7169.8000113N365L363-N365 PolarHBondContact O-N 2.95Å
364A49.7Very low46.9Very low94 Ų94117.1 Ų117.178%0.77773%0.733SS**THydrogen-bonded Turntrans-70.7-10.4-179.500000114.3
365N53.3Low47.7Very low153 Ų153117.9 Ų117.982%0.81872%0.722SS**THydrogen-bonded Turntrans-102.816-174.2-15641.7000114.2L363L363-N365 PolarHBondContact O-N 2.95Å
366V48.2Very low48.3Very low112 Ų112118.1 Ų118.168%0.67971%0.71SS**SBendtrans-126.526.9-177.1-155.50000112.1
367L45.3Very low49.2Very low95 Ų95112.2 Ų112.250%0.49769%0.694SS.*  trans-129.345.3176.2-75.996.3000112.8N369L367-N369 PolarHBondContact O-N 2.83Å
368S51.1Low50Low126 Ų126110.2 Ų110.288%0.88167%0.669SS**  trans-76.638.9167.748.50000113.1
369N49.3Very low50.8Low100 Ų100113.5 Ų113.554%0.53567%0.669SS.*  trans-151.7115.4177.8-155.1-19000111L367 T371L367-N369 PolarHBondContact O-N 2.83Å; N369-T371 PolarHBondContact O-N 2.99Å; N369-T371 VanDerWaalsContact O-N 3.08Å; N369-T371 PolarHBondContact OD1-OG1 3.06Å
370P55.2Low51.3Low119 Ų119110.3 Ų110.377%0.77366%0.655SS**THydrogen-bonded Turntrans-74.82.4-166.929.6-36.9000115.6
371T57.2Low51.6Low104 Ų104104.6 Ų104.664%0.63863%0.634SS**THydrogen-bonded Turntrans-89.8-9-170.849.80000115.3N369N369-T371 PolarHBondContact O-N 2.99Å; N369-T371 VanDerWaalsContact O-N 3.08Å; N369-T371 PolarHBondContact OD1-OG1 3.06Å
372M53.9Low51.8Low117 Ų117106 Ų10658%0.57663%0.626SS**SBendtrans-104.8-14.3-172-69.9-73.2-82.400115.1S374 L375M372-S374 VanDerWaalsContact C-N 3.29Å; M372-S374 PolarHBondContact O-N 2.67Å; M372-L375 PolarHBondContact O-N 2.92Å; M372-L375 HydrophobicContact SD-CD1 4.25Å
373S55.4Low51.7Low69 Ų69101.7 Ų101.748%0.48361%0.611SS.*Hα-helixtrans-60.8-31.5-169.8-54.80000114.6L375 L376 A377S373-L375 VanDerWaalsContact C-N 3.34Å; S373-L375 PolarHBondContact O-N 3.39Å; S373-L376 PolarHBondContact O-N 3.26Å; S373-A377 PolarHBondContact O-N 3.12Å; S373-A377 VanDerWaalsContact O-N 3.17Å
374S54.9Low51.8Low94 Ų9498.6 Ų98.666%0.65761%0.605SS**Hα-helixtrans-66.8-31.4-179.7-550000113.3M372 T378M372-S374 VanDerWaalsContact C-N 3.29Å; M372-S374 PolarHBondContact O-N 2.67Å; S374-T378 PolarHBondContact O-N 3.49Å; S374-T378 PolarHBondContact O-OG1 3.11Å
375L51Low52Low117 Ų11797.1 Ų97.161%0.61359%0.592SS**Hα-helixtrans-69.8-44.9176.6-72.4115000111M372 S373 A377 T378 Q379M372-L375 PolarHBondContact O-N 2.92Å; M372-L375 HydrophobicContact SD-CD1 4.25Å; S373-L375 VanDerWaalsContact C-N 3.34Å; S373-L375 PolarHBondContact O-N 3.39Å; L375-A377 PolarHBondContact O-N 2.83Å; L375-T378 PolarHBondContact O-N 3.13Å; L375-T378 VanDerWaalsContact O-N 3.14Å; L375-Q379 PolarHBondContact O-N 3.16Å
376L51.7Low51.9Low95 Ų9592.8 Ų92.850%0.49758%0.578SS.*Hα-helixtrans-66-37.7-178.2-169.862.2000112.4S373 T378 Q379 T380S373-L376 PolarHBondContact O-N 3.26Å; L376-T378 VanDerWaalsContact C-N 3.31Å; L376-T378 PolarHBondContact O-N 3.02Å; L376-Q379 PolarHBondContact O-N 3.31Å; L376-T380 PolarHBondContact O-N 3.25Å
377A52.7Low52.2Low64 Ų6490.4 Ų90.453%0.52957%0.569SS.*Hα-helixtrans-68.2-27.9173.900000113.5S373 L375 T380S373-A377 PolarHBondContact O-N 3.12Å; S373-A377 VanDerWaalsContact O-N 3.17Å; L375-A377 PolarHBondContact O-N 2.83Å; A377-T380 PolarHBondContact O-OG1 3.02Å
378T53.3Low52.7Low77 Ų7788.8 Ų88.847%0.47257%0.57SS.*Hα-helixtrans-80.7-29.2175.6-50.90000111.5S374 L375 L376 S381 M382S374-T378 PolarHBondContact O-N 3.49Å; S374-T378 PolarHBondContact O-OG1 3.11Å; L375-T378 PolarHBondContact O-N 3.13Å; L375-T378 VanDerWaalsContact O-N 3.14Å; L376-T378 VanDerWaalsContact C-N 3.31Å; L376-T378 PolarHBondContact O-N 3.02Å; T378-S381 PolarHBondContact O-OG 3.05Å; T378-M382 HydrophobicContact CG2-CE 4.36Å
379Q50.5Low52.9Low129 Ų12985.8 Ų85.860%0.60355%0.553SS**Hα-helixtrans-70.2-36.6179.5-166.2173.812.300112.7L375 L376 A383L375-Q379 PolarHBondContact O-N 3.16Å; L376-Q379 PolarHBondContact O-N 3.31Å; Q379-A383 PolarHBondContact O-N 3.29Å; Q379-A383 VanDerWaalsContact O-N 3.17Å
380T55.3Low53Low89 Ų8984 Ų8455%0.54655%0.552SS.*Hα-helixtrans-71.2-34.6-179.849.30000113.6L376 A377 A383 A384L376-T380 PolarHBondContact O-N 3.25Å; A377-T380 PolarHBondContact O-OG1 3.02Å; T380-A383 PolarHBondContact O-N 3.3Å; T380-A384 PolarHBondContact O-N 3.2Å; T380-A384 VanDerWaalsContact O-N 3.14Å
381S52.1Low53Low69 Ų6981 Ų8148%0.48354%0.537SS..Hα-helixtrans-68.3-41.3177.864.10000112.2T378 A384 A385T378-S381 PolarHBondContact O-OG 3.05Å; S381-A384 PolarHBondContact O-N 2.87Å; S381-A385 PolarHBondContact O-N 3.07Å; S381-A385 VanDerWaalsContact O-N 3.14Å
382M49.4Very low52.8Low123 Ų12378.9 Ų78.961%0.60653%0.53SS*.Hα-helixtrans-68.7-35.3176-65.6-164.4-69.200112.4T378 A385 A386T378-M382 HydrophobicContact CG2-CE 4.36Å; M382-A385 PolarHBondContact O-N 2.94Å; M382-A386 WeakPolarHBondContact O-CB 3.43Å; M382-A386 PolarHBondContact O-N 2.82Å
383A47.9Very low52.7Low60 Ų6076.3 Ų76.350%0.49653%0.528SS..Hα-helixtrans-62.2-41.7173.300000112.3Q379 T380 A387Q379-A383 PolarHBondContact O-N 3.29Å; Q379-A383 VanDerWaalsContact O-N 3.17Å; T380-A383 PolarHBondContact O-N 3.3Å; A383-A387 VanDerWaalsContact O-CB 3.29Å; A383-A387 WeakPolarHBondContact O-CB 3.41Å; A383-A387 PolarHBondContact O-N 2.88Å
384A51.2Low52.6Low65 Ų6575.8 Ų75.854%0.53753%0.527SS..Hα-helixtrans-65.2-42.5176.700000112.5T380 S381 A387 A388T380-A384 PolarHBondContact O-N 3.2Å; T380-A384 VanDerWaalsContact O-N 3.14Å; S381-A384 PolarHBondContact O-N 2.87Å; A384-A387 PolarHBondContact O-N 3.19Å; A384-A388 WeakPolarHBondContact O-CB 3.36Å; A384-A388 PolarHBondContact O-N 3.24Å
385A53.6Low52.3Low63 Ų6374.1 Ų74.152%0.52152%0.52SS..Hα-helixtrans-65.9-42.5176.800000112.4S381 M382 A388 A389S381-A385 PolarHBondContact O-N 3.07Å; S381-A385 VanDerWaalsContact O-N 3.14Å; M382-A385 PolarHBondContact O-N 2.94Å; A385-A388 PolarHBondContact O-N 2.75Å; A385-A389 WeakPolarHBondContact O-CB 3.38Å; A385-A389 PolarHBondContact O-N 3.49Å
386A51.8Low52.2Low62 Ų6272.1 Ų72.151%0.51252%0.52SS..Hα-helixtrans-64.7-40.8175.400000111.9M382 A389 A390M382-A386 WeakPolarHBondContact O-CB 3.43Å; M382-A386 PolarHBondContact O-N 2.82Å; A386-A389 PolarHBondContact O-N 2.89Å; A386-A390 VanDerWaalsContact O-CB 3.24Å; A386-A390 WeakPolarHBondContact O-CB 3.35Å; A386-A390 PolarHBondContact O-N 3.4Å
387A52.8Low52.1Low61 Ų6171 Ų7150%0.50453%0.525SS..Hα-helixtrans-63.1-41174.100000112A383 A384 A391A383-A387 VanDerWaalsContact O-CB 3.29Å; A383-A387 WeakPolarHBondContact O-CB 3.41Å; A383-A387 PolarHBondContact O-N 2.88Å; A384-A387 PolarHBondContact O-N 3.19Å; A387-A391 WeakPolarHBondContact O-CB 3.48Å; A387-A391 PolarHBondContact O-N 3.21Å
388A55.8Low51.9Low62 Ų6270.5 Ų70.551%0.51252%0.52SS..Hα-helixtrans-65.8-41.6175.600000112.5A384 A385 A391 A392A384-A388 WeakPolarHBondContact O-CB 3.36Å; A384-A388 PolarHBondContact O-N 3.24Å; A385-A388 PolarHBondContact O-N 2.75Å; A388-A391 PolarHBondContact O-N 3.35Å; A388-A392 WeakPolarHBondContact O-CB 3.39Å; A388-A392 PolarHBondContact O-N 3.06Å
389A55.1Low51.2Low63 Ų6369.7 Ų69.752%0.52153%0.527SS..Hα-helixtrans-68.6-41.5176.600000112.4A385 A386 A392 A393A385-A389 WeakPolarHBondContact O-CB 3.38Å; A385-A389 PolarHBondContact O-N 3.49Å; A386-A389 PolarHBondContact O-N 2.89Å; A389-A392 PolarHBondContact O-N 3.31Å; A389-A393 WeakPolarHBondContact O-CB 3.22Å; A389-A393 PolarHBondContact O-N 2.04Å
390A53.2Low51.1Low61 Ų6170.7 Ų70.750%0.50454%0.537SS..Hα-helixtrans-65.4-40173.700000111.6A386 A393 A394A386-A390 VanDerWaalsContact O-CB 3.24Å; A386-A390 WeakPolarHBondContact O-CB 3.35Å; A386-A390 PolarHBondContact O-N 3.4Å; A390-A393 PolarHBondContact O-N 3.14Å; A390-A394 WeakPolarHBondContact O-CB 3.5Å; A390-A394 PolarHBondContact O-N 3.44Å
391A54.8Low50.5Low57 Ų5768.5 Ų68.547%0.47153%0.532SS..Hα-helixtrans-66.2-35.7173.100000112.2A387 A388 A395A387-A391 WeakPolarHBondContact O-CB 3.48Å; A387-A391 PolarHBondContact O-N 3.21Å; A388-A391 PolarHBondContact O-N 3.35Å; A391-A395 WeakPolarHBondContact O-CA 3.4Å; A391-A395 WeakPolarHBondContact O-CB 3.35Å; A391-A395 PolarHBondContact O-N 3.15Å
392A53.5Low49.9Very low60 Ų6069.1 Ų69.150%0.49654%0.541SS..Hα-helixtrans-69.5-41.8174.700000112.2A388 A389 A395 A396A388-A392 WeakPolarHBondContact O-CB 3.39Å; A388-A392 PolarHBondContact O-N 3.06Å; A389-A392 PolarHBondContact O-N 3.31Å; A392-A395 PolarHBondContact O-N 2.04Å; A392-A396 WeakPolarHBondContact O-CB 3.39Å; A392-A396 PolarHBondContact O-N 3.08Å
393A51.8Low49.7Very low63 Ų6371 Ų7152%0.52155%0.554SS.*Hα-helixtrans-66.4-41.7173.700000111.8A389 A390 A395 A396 A397A389-A393 WeakPolarHBondContact O-CB 3.22Å; A389-A393 PolarHBondContact O-N 2.04Å; A390-A393 PolarHBondContact O-N 3.14Å; A393-A395 VanDerWaalsContact C-N 3.34Å; A393-A396 PolarHBondContact O-N 2.75Å; A393-A397 PolarHBondContact O-N 2.74Å
394A52.4Low49.5Very low57 Ų5770.2 Ų70.247%0.47155%0.551SS.*Hα-helixtrans-66.1-33.817300000112.1A390 A397 A398A390-A394 WeakPolarHBondContact O-CB 3.5Å; A390-A394 PolarHBondContact O-N 3.44Å; A394-A397 PolarHBondContact O-N 2.99Å; A394-A398 WeakPolarHBondContact O-CA 3.33Å; A394-A398 WeakPolarHBondContact O-CB 3.48Å; A394-A398 PolarHBondContact O-N 3.5Å
395A48.8Very low49.7Very low60 Ų6073 Ų7350%0.49655%0.553SS.*Hα-helixtrans-77.2-25.1174.700000113A391 A392 A393 G399A391-A395 WeakPolarHBondContact O-CA 3.4Å; A391-A395 WeakPolarHBondContact O-CB 3.35Å; A391-A395 PolarHBondContact O-N 3.15Å; A392-A395 PolarHBondContact O-N 2.04Å; A393-A395 VanDerWaalsContact C-N 3.34Å; A395-G399 VanDerWaalsContact O-CA 3.25Å; A395-G399 WeakPolarHBondContact O-CA 3.43Å; A395-G399 PolarHBondContact O-N 2.84Å
396A49.5Very low49.9Very low74 Ų7478.2 Ų78.261%0.61257%0.567SS**Hα-helixtrans-70.6-43.3167.700000111A392 A393A392-A396 WeakPolarHBondContact O-CB 3.39Å; A392-A396 PolarHBondContact O-N 3.08Å; A393-A396 PolarHBondContact O-N 2.75Å
397A49.1Very low51.2Low73 Ų7377.9 Ų77.960%0.60356%0.559SS**Hα-helixtrans-68.7-44.2175.200000112.7A393 A394 N400 G401A393-A397 PolarHBondContact O-N 2.74Å; A394-A397 PolarHBondContact O-N 2.99Å; A397-N400 PolarHBondContact O-N 2.96Å; A397-G401 PolarHBondContact O-N 3.06Å
398A47.8Very low52.9Low52 Ų5278.7 Ų78.743%0.4355%0.55SS..Hα-helixtrans-80.5-18.3178.600000113.2A394 N400 G401 A402A394-A398 WeakPolarHBondContact O-CA 3.33Å; A394-A398 WeakPolarHBondContact O-CB 3.48Å; A394-A398 PolarHBondContact O-N 3.5Å; A398-N400 PolarHBondContact O-N 2.99Å; A398-G401 VanDerWaalsContact C-N 3.34Å; A398-G401 CarbonylContact O-C 3.56Å; A398-G401 WeakPolarHBondContact O-CA 3.25Å; A398-G401 PolarHBondContact O-N 3.33Å; A398-A402 WeakPolarHBondContact O-CB 3.34Å; A398-A402 PolarHBondContact O-N 2.04Å
399G39.6Very low54.6Low60 Ų6078.4 Ų78.462%0.61954%0.541SS*.Hα-helixtrans-61.6-31.6169.300000112A395A395-G399 VanDerWaalsContact O-CA 3.25Å; A395-G399 WeakPolarHBondContact O-CA 3.43Å; A395-G399 PolarHBondContact O-N 2.84Å
400N47.8Very low56.5Low151 Ų15175.4 Ų75.481%0.80752%0.516SS*.THydrogen-bonded Turntrans-89.9-3.6168.6-107.964.9000113.9A397 A398A397-N400 PolarHBondContact O-N 2.96Å; A398-N400 PolarHBondContact O-N 2.99Å
401G42.1Very low58.3Low43 Ų4378.2 Ų78.244%0.44352%0.523SS..THydrogen-bonded Turntrans-112.7-23-173.300000115.6A397 A398 N403 G404A397-G401 PolarHBondContact O-N 3.06Å; A398-G401 VanDerWaalsContact C-N 3.34Å; A398-G401 CarbonylContact O-C 3.56Å; A398-G401 WeakPolarHBondContact O-CA 3.25Å; A398-G401 PolarHBondContact O-N 3.33Å; G401-N403 VanDerWaalsContact C-N 3.26Å; G401-N403 PolarHBondContact O-N 3.5Å; G401-G404 WeakPolarHBondContact O-CA 3.03Å; G401-G404 PolarHBondContact O-N 2.9Å
402A40.8Very low60Low82 Ų8279.5 Ų79.568%0.67852%0.516SS*.THydrogen-bonded Turntrans-76.1-9.2-174.600000114.4A398A398-A402 WeakPolarHBondContact O-CB 3.34Å; A398-A402 PolarHBondContact O-N 2.04Å
403N44.5Very low61.7Low163 Ų16383.5 Ų83.587%0.87253%0.526SS*.THydrogen-bonded Turntrans-12522.2158.7-85.2-87.2000110.6G401 Q405G401-N403 VanDerWaalsContact C-N 3.26Å; G401-N403 PolarHBondContact O-N 3.5Å; N403-Q405 VanDerWaalsContact C-N 3.26Å; N403-Q405 PolarHBondContact O-N 3.33Å
404G44.4Very low63.3Low43 Ų4382 Ų8244%0.44351%0.51SS..  trans-79.754.9-165.100000114.8G401 Q406G401-G404 WeakPolarHBondContact O-CA 3.03Å; G401-G404 PolarHBondContact O-N 2.9Å; G404-Q406 PolarHBondContact O-N 3.47Å
405Q54Low64.7Low123 Ų12385.5 Ų85.558%0.57553%0.525SS*.PPolyproline II helixtrans-57.9121.6158.4-70.9-167.9-31.400107.8N403 Y408N403-Q405 VanDerWaalsContact C-N 3.26Å; N403-Q405 PolarHBondContact O-N 3.33Å; Q405-Y408 HydrophobicContact CB-CE2 4.48Å; Q405-Y408 PolarHBondContact NE2-OH 3.41Å
406Q58.3Low66Low173 Ų17388.7 Ų88.781%0.80853%0.534SS*.PPolyproline II helixtrans-60.4127.5168.6-69.7-158.215.700107.5G404 Y408G404-Q406 PolarHBondContact O-N 3.47Å; Q406-Y408 PolarHBondContact O-N 2.75Å; Q406-Y408 VanDerWaalsContact O-N 3.11Å
407P79.4Confident67.6Low54 Ų5492.1 Ų92.135%0.35154%0.538SS..PPolyproline II helixtrans-61.8121.1-170.625.3-35.6000109V409 R422 F423P407-V409 WeakPolarHBondContact O-CG2 3.42Å; P407-V409 PolarHBondContact O-N 2.82Å; P407-V409 VanDerWaalsContact O-N 3.16Å; P407-R422 HydrophobicContact CB-CB 4.41Å; P407-F423 CarbonylContact C-O 3.53Å
408Y88.4Confident69.7Low79 Ų7994.7 Ų94.731%0.3153%0.533SS..EExtended strand (participates in β ladder)trans-59.5115.8-168.8-71.5-84.8000110.3Q405 Q406 R422 F423 G426 L429Q405-Y408 HydrophobicContact CB-CE2 4.48Å; Q405-Y408 PolarHBondContact NE2-OH 3.41Å; Q406-Y408 PolarHBondContact O-N 2.75Å; Q406-Y408 VanDerWaalsContact O-N 3.11Å; Y408-R422 CarbonylContact O-C 3.47Å; Y408-R422 WeakPolarHBondContact O-CA 3.42Å; Y408-F423 PolarHBondContact N-O 3.34Å; Y408-F423 WeakPolarHBondContact O-CD2 3.07Å; Y408-F423 PolarHBondContact O-N 3.47Å; Y408-G426 VanDerWaalsContact CE2-N 3.31Å; Y408-L429 HydrophobicContact CD1-CD2 4.11Å; Y408-L429 HydrophobicContact CG-CD2 4.49Å
409V91.8Very high71.8Confident55 Ų5593.7 Ų93.733%0.33352%0.522SS..EExtended strand (participates in β ladder)trans-99.7129.7-176.5-169.90000110.7P407 N411 K421 R422 L429P407-V409 WeakPolarHBondContact O-CG2 3.42Å; P407-V409 PolarHBondContact O-N 2.82Å; P407-V409 VanDerWaalsContact O-N 3.16Å; V409-N411 PolarHBondContact O-N 2.93Å; V409-N411 VanDerWaalsContact O-N 3.12Å; V409-K421 CarbonylContact C-O 3.56Å; V409-K421 WeakPolarHBondContact CA-O 2.96Å; V409-R422 HydrophobicContact CG2-CG 4.21Å; V409-L429 VanDerWaalsContact C-CD1 3.48Å
410C94.4Very high74.3Confident0 Ų092 Ų920%051%0.505CS..  trans-72.7104.3172.4-170.80000110.6W412 C419 G420 K421 F423 L429 H432C410-W412 PolarHBondContact O-N 3.3Å; C410-C419 HydrophobicContact CB-CB 4.29Å; C410-G420 PolarHBondContact O-N 2.84Å; C410-K421 PolarHBondContact N-O 3.12Å; C410-F423 HydrophobicContact CB-CE2 4.19Å; C410-L429 HydrophobicContact CB-CD1 4.08Å; C410-H432 VanDerWaalsContact SG-CD2 3.58Å
411N91.9Very high76.4Confident121 Ų12190.5 Ų90.565%0.64749%0.491SS*.  trans-84.424.3176.7-156.373.3000113.2V409 Y418V409-N411 PolarHBondContact O-N 2.93Å; V409-N411 VanDerWaalsContact O-N 3.12Å; N411-Y418 HydrophobicContact CB-CE2 4.48Å; N411-Y418 WeakPolarHBondContact OD1-CE2 3.38Å; N411-Y418 PolarHBondContact OD1-OH 3.47Å; N411-Y418 VanDerWaalsContact OD1-OH 3.13Å
412W89.7Confident78.8Confident84 Ų8496.6 Ų96.632%0.31850%0.501SS..  trans-71.5137.7176.4-165.9-89.3000110.9C410 C419 L433 H436 D440C410-W412 PolarHBondContact O-N 3.3Å; W412-C419 HydrophobicContact CB-CB 4.4Å; W412-C419 PolarHBondContact O-N 2.85Å; W412-L433 HydrophobicContact CE3-CD2 4.3Å; W412-H436 HydrophobicContact CB-CB 4.37Å; W412-H436 AromaticContact CD1-CE1 3.69Å; W412-H436 AromaticContact CD1-CG 3.44Å; W412-H436 VanDerWaalsContact CD1-CG 3.44Å; W412-H436 AromaticContact CD1-ND1 3.08Å; W412-H436 HydrophobicContact CD2-CB 3.57Å; W412-H436 AromaticContact CD2-CG 3.95Å; W412-H436 HydrophobicContact CE3-CB 4.15Å; W412-H436 HydrophobicContact CG-CB 3.66Å; W412-H436 AromaticContact CG-CD2 3.93Å; W412-H436 AromaticContact CG-CG 3.45Å; W412-H436 VanDerWaalsContact CG-CG 3.45Å; W412-H436 AromaticContact CG-ND1 3.58Å; W412-H436 HydrophobicContact CZ2-CB 4.22Å; W412-H436 AromaticContact NE1-CG 3.85Å; W412-H436 AromaticContact NE1-ND1 3.57Å; W412-D440 PolarHBondContact NE1-OD2 3.34Å
413M88.8Confident81.2Confident143 Ų14394.4 Ų94.470%0.70448%0.476SS*.EExtended strand (participates in β ladder)trans-130.2111.2-177.6166.6-177.2159.800107.5
414T85.8Confident83.3Confident32 Ų3290.5 Ų90.520%0.19647%0.467CS..EExtended strand (participates in β ladder)trans-87.1156.9155.2-51.90000106.9D416 Q417 D440T414-D416 PolarHBondContact O-N 3.4Å; T414-Q417 PolarHBondContact N-O 3.25Å; T414-Q417 PolarHBondContact O-N 3.05Å; T414-Q417 VanDerWaalsContact O-O 3.13Å; T414-D440 WeakPolarHBondContact CG2-OD1 3.01Å; T414-D440 PolarHBondContact OG1-OD1 3.23Å; T414-D440 PolarHBondContact OG1-OD2 3.35Å
415V81.3Confident85.6Confident130 Ų13090.4 Ų90.479%0.78846%0.459SS*.THydrogen-bonded Turntrans-43.5-40.8-173.61780000113.9
416D77.3Confident87.5Confident128 Ų12885.6 Ų85.668%0.68444%0.442SS*.THydrogen-bonded Turntrans-104.2-5.1-177.2-51-85.1000115.3T414T414-D416 PolarHBondContact O-N 3.4Å
417Q83.6Confident89.2Confident146 Ų14682.3 Ų82.368%0.68243%0.43SS*.EExtended strand (participates in β ladder)trans-146.7129.4-168.8-69-65.6-67.900113.9T414T414-Q417 PolarHBondContact N-O 3.25Å; T414-Q417 PolarHBondContact O-N 3.05Å; T414-Q417 VanDerWaalsContact O-O 3.13Å
418Y92Very high89.8Confident127 Ų12783.9 Ų83.950%0.49843%0.433SS..EExtended strand (participates in β ladder)trans-96.4133.8168.9178.6-108.3000110.6N411N411-Y418 HydrophobicContact CB-CE2 4.48Å; N411-Y418 WeakPolarHBondContact OD1-CE2 3.38Å; N411-Y418 PolarHBondContact OD1-OH 3.47Å; N411-Y418 VanDerWaalsContact OD1-OH 3.13Å
419C92.6Very high90.1Very high30 Ų3081.4 Ų81.420%0.20343%0.425CS..  trans-76.3-50.9-175.1-169.40000114C410 W412 K421 H432 H436C410-C419 HydrophobicContact CB-CB 4.29Å; W412-C419 HydrophobicContact CB-CB 4.4Å; W412-C419 PolarHBondContact O-N 2.85Å; C419-K421 PolarHBondContact O-N 3.45Å; C419-H432 PolarHBondContact SG-NE2 3.49Å; C419-H436 WeakPolarHBondContact CB-NE2 3.48Å; C419-H436 PolarHBondContact SG-NE2 3.41Å
420G92Very high90.1Very high25 Ų2583 Ų8326%0.25843%0.431SS..  trans630.7173.200000117.3C410 R422C410-G420 PolarHBondContact O-N 2.84Å; G420-R422 WeakPolarHBondContact O-CG 3.25Å; G420-R422 PolarHBondContact O-N 3.46Å
421K91.9Very high90Very high119 Ų11988.5 Ų88.552%0.51746%0.457SS..  trans-61.2135.9179.8-69.9-179.7-172.3173.20110.8V409 C410 C419 F423V409-K421 CarbonylContact C-O 3.56Å; V409-K421 WeakPolarHBondContact CA-O 2.96Å; C410-K421 PolarHBondContact N-O 3.12Å; C419-K421 PolarHBondContact O-N 3.45Å; K421-F423 HydrophobicContact CB-CE2 3.64Å; K421-F423 HydrophobicContact CB-CZ 3.66Å; K421-F423 HydrophobicContact CD-CZ 4.39Å; K421-F423 WeakPolarHBondContact O-CE2 3.46Å
422R92.4Very high90.2Very high171 Ų17183.8 Ų83.865%0.64543%0.431SS*.EExtended strand (participates in β ladder)trans-110.4133-175.6-41.4-173.385.6-1639.6109.5P407 Y408 V409 G420P407-R422 HydrophobicContact CB-CB 4.41Å; Y408-R422 CarbonylContact O-C 3.47Å; Y408-R422 WeakPolarHBondContact O-CA 3.42Å; V409-R422 HydrophobicContact CG2-CG 4.21Å; G420-R422 WeakPolarHBondContact O-CG 3.25Å; G420-R422 PolarHBondContact O-N 3.46Å
423F91.9Very high90.3Very high36 Ų3682.3 Ų82.316%0.15843%0.429CS..EExtended strand (participates in β ladder)trans-119.9149.8-175.3-60.2-81.8000111.3P407 Y408 C410 K421 S425 E428 L429 H432P407-F423 CarbonylContact C-O 3.53Å; Y408-F423 PolarHBondContact N-O 3.34Å; Y408-F423 WeakPolarHBondContact O-CD2 3.07Å; Y408-F423 PolarHBondContact O-N 3.47Å; C410-F423 HydrophobicContact CB-CE2 4.19Å; K421-F423 HydrophobicContact CB-CE2 3.64Å; K421-F423 HydrophobicContact CB-CZ 3.66Å; K421-F423 HydrophobicContact CD-CZ 4.39Å; K421-F423 WeakPolarHBondContact O-CE2 3.46Å; F423-S425 VanDerWaalsContact C-N 3.32Å; F423-E428 HydrophobicContact CB-CB 3.93Å; F423-E428 HydrophobicContact CD1-CB 3.57Å; F423-E428 HydrophobicContact CE1-CB 4.43Å; F423-E428 HydrophobicContact CG-CB 3.96Å; F423-L429 HydrophobicContact CD2-CB 4.18Å; F423-L429 HydrophobicContact CD2-CD1 3.88Å; F423-L429 HydrophobicContact CE2-CD1 4.31Å; F423-H432 HydrophobicContact CE1-CB 4.19Å; F423-H432 HydrophobicContact CE2-CB 4.15Å; F423-H432 AromaticContact CE2-CD2 3.43Å; F423-H432 VanDerWaalsContact CE2-CD2 3.43Å; F423-H432 WeakPolarHBondContact CE2-CD2 3.12Å; F423-H432 HydrophobicContact CZ-CB 3.64Å; F423-H432 AromaticContact CZ-CD2 3.29Å; F423-H432 WeakPolarHBondContact CZ-CD2 3.14Å; F423-H432 AromaticContact CZ-CG 3.55Å
424A87.9Confident90.5Very high82 Ų8281.3 Ų81.368%0.67842%0.417SS*.SBendtrans-76.1-25176.400000111.5E428A424-E428 PolarHBondContact N-OE2 2.82Å
425S92.2Very high90.7Very high40 Ų4082.2 Ų82.228%0.2843%0.425SS..SBendtrans-129.6157.6-179.672.80000113.5F423 D427 E428 L429F423-S425 VanDerWaalsContact C-N 3.32Å; S425-D427 VanDerWaalsContact C-N 3.32Å; S425-E428 WeakPolarHBondContact CB-OE2 3.06Å; S425-E428 PolarHBondContact N-OE2 2.85Å; S425-E428 VanDerWaalsContact OG-CG 3.24Å; S425-E428 WeakPolarHBondContact OG-CG 3.05Å; S425-E428 PolarHBondContact OG-N 3.4Å; S425-E428 PolarHBondContact OG-OE2 3.13Å; S425-L429 PolarHBondContact O-N 2.83Å
426G94.3Very high91.1Very high22 Ų2277.4 Ų77.423%0.22739%0.394CS..Hα-helixtrans-71.8-22.1174.900000114.1Y408 L430Y408-G426 VanDerWaalsContact CE2-N 3.31Å; G426-L430 VanDerWaalsContact O-CG 3.3Å; G426-L430 WeakPolarHBondContact O-CG 3.49Å; G426-L430 PolarHBondContact O-N 3.33Å; G426-L430 VanDerWaalsContact O-N 3.1Å
427D93.1Very high91.5Very high104 Ų10474 Ų7456%0.55638%0.384SS*.Hα-helixtrans-77.5-39.3177.8-170.4-112.2000112S425 L429 L430 Q431 R434S425-D427 VanDerWaalsContact C-N 3.32Å; D427-L429 VanDerWaalsContact C-N 3.3Å; D427-L429 PolarHBondContact O-N 2.88Å; D427-L430 PolarHBondContact O-N 2.78Å; D427-L430 VanDerWaalsContact O-N 3.14Å; D427-Q431 WeakPolarHBondContact O-CB 3.32Å; D427-Q431 PolarHBondContact O-N 2.94Å; D427-R434 IonicContact OD2-NH2 3.92Å
428E93Very high91.6Very high87 Ų8771.2 Ų71.241%0.40738%0.376SS..Hα-helixtrans-59.2-42170.2-68.8166.111000111.6F423 A424 S425 L430 Q431 H432F423-E428 HydrophobicContact CB-CB 3.93Å; F423-E428 HydrophobicContact CD1-CB 3.57Å; F423-E428 HydrophobicContact CE1-CB 4.43Å; F423-E428 HydrophobicContact CG-CB 3.96Å; A424-E428 PolarHBondContact N-OE2 2.82Å; S425-E428 WeakPolarHBondContact CB-OE2 3.06Å; S425-E428 PolarHBondContact N-OE2 2.85Å; S425-E428 VanDerWaalsContact OG-CG 3.24Å; S425-E428 WeakPolarHBondContact OG-CG 3.05Å; S425-E428 PolarHBondContact OG-N 3.4Å; S425-E428 PolarHBondContact OG-OE2 3.13Å; E428-L430 VanDerWaalsContact C-N 3.34Å; E428-L430 PolarHBondContact O-N 3.46Å; E428-Q431 PolarHBondContact O-N 3.33Å; E428-H432 VanDerWaalsContact O-CB 3.32Å; E428-H432 WeakPolarHBondContact O-CB 3.46Å; E428-H432 PolarHBondContact O-N 2.95Å
429L93.6Very high90.9Very high28 Ų2870.3 Ų70.315%0.14738%0.377CS..Hα-helixtrans-57-48.1173.218080.8000110.8Y408 V409 C410 F423 S425 D427 H432 L433Y408-L429 HydrophobicContact CD1-CD2 4.11Å; Y408-L429 HydrophobicContact CG-CD2 4.49Å; V409-L429 VanDerWaalsContact C-CD1 3.48Å; C410-L429 HydrophobicContact CB-CD1 4.08Å; F423-L429 HydrophobicContact CD2-CB 4.18Å; F423-L429 HydrophobicContact CD2-CD1 3.88Å; F423-L429 HydrophobicContact CE2-CD1 4.31Å; S425-L429 PolarHBondContact O-N 2.83Å; D427-L429 VanDerWaalsContact C-N 3.3Å; D427-L429 PolarHBondContact O-N 2.88Å; L429-H432 PolarHBondContact O-N 3.02Å; L429-L433 HydrophobicContact CD2-CD1 4.16Å; L429-L433 HydrophobicContact CG-CD1 3.9Å; L429-L433 HydrophobicContact CG-CG 4.48Å; L429-L433 WeakPolarHBondContact O-CB 3.02Å; L429-L433 WeakPolarHBondContact O-CG 3.09Å; L429-L433 PolarHBondContact O-N 2.72Å
430L91.8Very high90.2Very high89 Ų8970.2 Ų70.247%0.46637%0.374SS..Hα-helixtrans-66.1-42.1179.7-72.6168.1000112G426 D427 E428 H432 L433 R434G426-L430 VanDerWaalsContact O-CG 3.3Å; G426-L430 WeakPolarHBondContact O-CG 3.49Å; G426-L430 PolarHBondContact O-N 3.33Å; G426-L430 VanDerWaalsContact O-N 3.1Å; D427-L430 PolarHBondContact O-N 2.78Å; D427-L430 VanDerWaalsContact O-N 3.14Å; E428-L430 VanDerWaalsContact C-N 3.34Å; E428-L430 PolarHBondContact O-N 3.46Å; L430-H432 VanDerWaalsContact C-N 3.26Å; L430-H432 PolarHBondContact O-N 3.38Å; L430-L433 HydrophobicContact CD2-CD1 4.42Å; L430-L433 PolarHBondContact O-N 2.94Å; L430-R434 VanDerWaalsContact O-CG 3.28Å; L430-R434 WeakPolarHBondContact O-CG 3.4Å; L430-R434 PolarHBondContact O-N 3.42Å
431Q93.6Very high89.2Confident115 Ų11572.1 Ų72.154%0.53739%0.387SS..Hα-helixtrans-61.2-37.1175177.958.58.600111.8D427 E428 S435D427-Q431 WeakPolarHBondContact O-CB 3.32Å; D427-Q431 PolarHBondContact O-N 2.94Å; E428-Q431 PolarHBondContact O-N 3.33Å; Q431-S435 PolarHBondContact O-N 3.14Å
432H94.7Very high87.9Confident22 Ų2273 Ų7310%0.10240%0.397CS..Hα-helixtrans-76.3-36.9175.5176.342.6000113.2C410 C419 F423 E428 L429 L430 R434 S435 H436C410-H432 VanDerWaalsContact SG-CD2 3.58Å; C419-H432 PolarHBondContact SG-NE2 3.49Å; F423-H432 HydrophobicContact CE1-CB 4.19Å; F423-H432 HydrophobicContact CE2-CB 4.15Å; F423-H432 AromaticContact CE2-CD2 3.43Å; F423-H432 VanDerWaalsContact CE2-CD2 3.43Å; F423-H432 WeakPolarHBondContact CE2-CD2 3.12Å; F423-H432 HydrophobicContact CZ-CB 3.64Å; F423-H432 AromaticContact CZ-CD2 3.29Å; F423-H432 WeakPolarHBondContact CZ-CD2 3.14Å; F423-H432 AromaticContact CZ-CG 3.55Å; E428-H432 VanDerWaalsContact O-CB 3.32Å; E428-H432 WeakPolarHBondContact O-CB 3.46Å; E428-H432 PolarHBondContact O-N 2.95Å; L429-H432 PolarHBondContact O-N 3.02Å; L430-H432 VanDerWaalsContact C-N 3.26Å; L430-H432 PolarHBondContact O-N 3.38Å; H432-R434 VanDerWaalsContact C-N 3.26Å; H432-R434 PolarHBondContact O-N 3.49Å; H432-S435 PolarHBondContact ND1-OG 3.45Å; H432-S435 WeakPolarHBondContact O-CB 3.45Å; H432-S435 PolarHBondContact O-N 3.43Å; H432-S435 PolarHBondContact O-OG 2.92Å; H432-H436 AromaticContact CE1-CD2 3.41Å; H432-H436 PolarHBondContact CE1-CD2 3.34Å; H432-H436 VanDerWaalsContact CE1-CD2 3.41Å; H432-H436 AromaticContact CE1-NE2 3.2Å; H432-H436 PolarHBondContact CE1-NE2 3.33Å; H432-H436 AromaticContact NE2-CD2 3.66Å; H432-H436 AromaticContact NE2-NE2 3.37Å; H432-H436 PolarHBondContact NE2-NE2 2.93Å; H432-H436 PolarHBondContact O-N 3.18Å
433L92.5Very high86.6Confident52 Ų5271.6 Ų71.627%0.27240%0.396SS..Hα-helixtrans-58.9-37.8172.1-78.2163.9000111.8W412 L429 L430 S435 H436 A437W412-L433 HydrophobicContact CE3-CD2 4.3Å; L429-L433 HydrophobicContact CD2-CD1 4.16Å; L429-L433 HydrophobicContact CG-CD1 3.9Å; L429-L433 HydrophobicContact CG-CG 4.48Å; L429-L433 WeakPolarHBondContact O-CB 3.02Å; L429-L433 WeakPolarHBondContact O-CG 3.09Å; L429-L433 PolarHBondContact O-N 2.72Å; L430-L433 HydrophobicContact CD2-CD1 4.42Å; L430-L433 PolarHBondContact O-N 2.94Å; L433-S435 VanDerWaalsContact C-N 3.29Å; L433-S435 PolarHBondContact O-N 3.37Å; L433-H436 PolarHBondContact O-N 3.45Å; L433-A437 PolarHBondContact O-N 3.03Å
434R93Very high85Confident122 Ų12274.4 Ų74.446%0.4642%0.42SS..Hα-helixtrans-57.6-41171.7-64.7162.1-155.6145.54.9111.9D427 L430 H432 H436 A437 T438D427-R434 IonicContact OD2-NH2 3.92Å; L430-R434 VanDerWaalsContact O-CG 3.28Å; L430-R434 WeakPolarHBondContact O-CG 3.4Å; L430-R434 PolarHBondContact O-N 3.42Å; H432-R434 VanDerWaalsContact C-N 3.26Å; H432-R434 PolarHBondContact O-N 3.49Å; R434-H436 VanDerWaalsContact C-N 3.27Å; R434-H436 PolarHBondContact O-N 3.42Å; R434-A437 PolarHBondContact O-N 3.37Å; R434-T438 PolarHBondContact O-N 3.04Å; R434-T438 VanDerWaalsContact O-N 3.13Å; R434-T438 PolarHBondContact O-OG1 3.17Å
435S90.1Very high83Confident51 Ų5174.4 Ų74.436%0.35742%0.415SS..Hα-helixtrans-63.7-30.5-179.473.50000113.5Q431 H432 L433 T438 H439Q431-S435 PolarHBondContact O-N 3.14Å; H432-S435 PolarHBondContact ND1-OG 3.45Å; H432-S435 WeakPolarHBondContact O-CB 3.45Å; H432-S435 PolarHBondContact O-N 3.43Å; H432-S435 PolarHBondContact O-OG 2.92Å; L433-S435 VanDerWaalsContact C-N 3.29Å; L433-S435 PolarHBondContact O-N 3.37Å; S435-T438 WeakPolarHBondContact CA-OG1 3.45Å; S435-T438 PolarHBondContact O-OG1 3.13Å; S435-H439 VanDerWaalsContact O-CB 3.23Å; S435-H439 WeakPolarHBondContact O-CB 3.24Å; S435-H439 PolarHBondContact O-N 3.14Å; S435-H439 VanDerWaalsContact O-N 3.12Å
436H88.8Confident80.8Confident29 Ų2978.6 Ų78.613%0.13444%0.441CS..Hα-helixtrans-69.8-50.1172.7-83.8-74.5000112W412 C419 H432 L433 R434 T438 H439 D440W412-H436 HydrophobicContact CB-CB 4.37Å; W412-H436 AromaticContact CD1-CE1 3.69Å; W412-H436 AromaticContact CD1-CG 3.44Å; W412-H436 VanDerWaalsContact CD1-CG 3.44Å; W412-H436 AromaticContact CD1-ND1 3.08Å; W412-H436 HydrophobicContact CD2-CB 3.57Å; W412-H436 AromaticContact CD2-CG 3.95Å; W412-H436 HydrophobicContact CE3-CB 4.15Å; W412-H436 HydrophobicContact CG-CB 3.66Å; W412-H436 AromaticContact CG-CD2 3.93Å; W412-H436 AromaticContact CG-CG 3.45Å; W412-H436 VanDerWaalsContact CG-CG 3.45Å; W412-H436 AromaticContact CG-ND1 3.58Å; W412-H436 HydrophobicContact CZ2-CB 4.22Å; W412-H436 AromaticContact NE1-CG 3.85Å; W412-H436 AromaticContact NE1-ND1 3.57Å; C419-H436 WeakPolarHBondContact CB-NE2 3.48Å; C419-H436 PolarHBondContact SG-NE2 3.41Å; H432-H436 AromaticContact CE1-CD2 3.41Å; H432-H436 PolarHBondContact CE1-CD2 3.34Å; H432-H436 VanDerWaalsContact CE1-CD2 3.41Å; H432-H436 AromaticContact CE1-NE2 3.2Å; H432-H436 PolarHBondContact CE1-NE2 3.33Å; H432-H436 AromaticContact NE2-CD2 3.66Å; H432-H436 AromaticContact NE2-NE2 3.37Å; H432-H436 PolarHBondContact NE2-NE2 2.93Å; H432-H436 PolarHBondContact O-N 3.18Å; L433-H436 PolarHBondContact O-N 3.45Å; R434-H436 VanDerWaalsContact C-N 3.27Å; R434-H436 PolarHBondContact O-N 3.42Å; H436-T438 PolarHBondContact O-N 3.47Å; H436-H439 PolarHBondContact O-N 2.82Å; H436-D440 PolarHBondContact O-N 3Å
437A85.8Confident78.4Confident57 Ų5780.8 Ų80.847%0.47146%0.463SS..Hα-helixtrans-55.6-38.9178.300000112.7L433 R434 A441L433-A437 PolarHBondContact O-N 3.03Å; R434-A437 PolarHBondContact O-N 3.37Å; A437-A441 WeakPolarHBondContact O-CB 3.41Å; A437-A441 PolarHBondContact O-N 3.34Å
438T85.5Confident76.2Confident87 Ų8781.4 Ų81.453%0.53448%0.476SS..Hα-helixtrans-71.2-34.3173.649.90000113.7R434 S435 H436 L442R434-T438 PolarHBondContact O-N 3.04Å; R434-T438 VanDerWaalsContact O-N 3.13Å; R434-T438 PolarHBondContact O-OG1 3.17Å; S435-T438 WeakPolarHBondContact CA-OG1 3.45Å; S435-T438 PolarHBondContact O-OG1 3.13Å; H436-T438 PolarHBondContact O-N 3.47Å; T438-L442 WeakPolarHBondContact O-CG 3.49Å; T438-L442 PolarHBondContact O-N 3.16Å
439H78.2Confident73.8Confident108 Ų10883.1 Ų83.150%0.550%0.497SS..Hα-helixtrans-78.5-43.7-175.3-177.7-87.1000112.5S435 H436 A441 L442 K443S435-H439 VanDerWaalsContact O-CB 3.23Å; S435-H439 WeakPolarHBondContact O-CB 3.24Å; S435-H439 PolarHBondContact O-N 3.14Å; S435-H439 VanDerWaalsContact O-N 3.12Å; H436-H439 PolarHBondContact O-N 2.82Å; H439-A441 VanDerWaalsContact C-N 3.28Å; H439-A441 PolarHBondContact O-N 3.21Å; H439-L442 PolarHBondContact O-N 3.37Å; H439-K443 WeakPolarHBondContact O-CB 3.29Å; H439-K443 PolarHBondContact O-N 3.46Å
440D77.7Confident71.7Confident28 Ų2890 Ų9015%0.1553%0.531CS..Hα-helixtrans-67.6-30.2176.8-71.3-66.3000111.5W412 T414 H436 S444W412-D440 PolarHBondContact NE1-OD2 3.34Å; T414-D440 WeakPolarHBondContact CG2-OD1 3.01Å; T414-D440 PolarHBondContact OG1-OD1 3.23Å; T414-D440 PolarHBondContact OG1-OD2 3.35Å; H436-D440 PolarHBondContact O-N 3Å; D440-S444 VanDerWaalsContact O-CB 3.31Å; D440-S444 WeakPolarHBondContact O-CB 3.35Å; D440-S444 PolarHBondContact O-N 3.42Å; D440-S444 PolarHBondContact O-OG 3.48Å
441A71.3Confident69.5Low65 Ų6593.2 Ų93.254%0.53755%0.548SS..Hα-helixtrans-63-46.2170.400000112.7A437 H439 S444A437-A441 WeakPolarHBondContact O-CB 3.41Å; A437-A441 PolarHBondContact O-N 3.34Å; H439-A441 VanDerWaalsContact C-N 3.28Å; H439-A441 PolarHBondContact O-N 3.21Å; A441-S444 PolarHBondContact O-N 2.74Å
442L64.8Low67.5Low138 Ų13894.5 Ų94.572%0.72356%0.563SS**Hα-helixtrans-68.3-38.1176.6-69.5171.6000112.3T438 H439 S444 S445T438-L442 WeakPolarHBondContact O-CG 3.49Å; T438-L442 PolarHBondContact O-N 3.16Å; H439-L442 PolarHBondContact O-N 3.37Å; L442-S444 VanDerWaalsContact C-N 3.28Å; L442-S444 PolarHBondContact O-N 3.26Å; L442-S445 PolarHBondContact O-N 3.14Å
443K65.6Low64.9Low141 Ų14199.5 Ų99.561%0.61359%0.591SS**Hα-helixtrans-71.7-21.1179.4-166.1176.4177.2-169.20113.3H439 S445H439-K443 WeakPolarHBondContact O-CB 3.29Å; H439-K443 PolarHBondContact O-N 3.46Å; K443-S445 VanDerWaalsContact C-N 3.35Å
444S57.5Low62.1Low96 Ų96100.3 Ų100.367%0.67161%0.612SS**THydrogen-bonded Turntrans-86.2-0.2177.1-56.40000114.1D440 A441 L442 P446D440-S444 VanDerWaalsContact O-CB 3.31Å; D440-S444 WeakPolarHBondContact O-CB 3.35Å; D440-S444 PolarHBondContact O-N 3.42Å; D440-S444 PolarHBondContact O-OG 3.48Å; A441-S444 PolarHBondContact O-N 2.74Å; L442-S444 VanDerWaalsContact C-N 3.28Å; L442-S444 PolarHBondContact O-N 3.26Å; S444-P446 WeakPolarHBondContact O-CD 3.49Å
445S45.6Very low59.8Low81 Ų8199.6 Ų99.657%0.56663%0.626SS**  trans-108.4101.2-178-165.90000111.8L442 K443 G447L442-S445 PolarHBondContact O-N 3.14Å; K443-S445 VanDerWaalsContact C-N 3.35Å; S445-G447 PolarHBondContact O-N 3.17Å
446P47.3Very low57.3Low129 Ų129103.8 Ų103.884%0.83865%0.649SS**  trans-77.8103.5178.430.6-33.6000111.5S444S444-P446 WeakPolarHBondContact O-CD 3.49Å
447G43.4Very low55.2Low67 Ų67107.4 Ų107.469%0.69168%0.678SS**  trans88.983.8158.500000116.6S445S445-G447 PolarHBondContact O-N 3.17Å
448S46.1Very low53.2Low117 Ų117113 Ų11382%0.81870%0.7SS**  trans-151.471.9157.2-80.90000111.5
449S42.2Very low50.9Low123 Ų123112.6 Ų112.686%0.8671%0.712SS**  trans-87.698.3166.5-700000110.2
450M49.8Very low49Very low172 Ų172112.3 Ų112.385%0.84773%0.729SS**  trans-157.8106.2154.2-81.3-141.6-177.900113.6
451L46.3Very low47.2Very low158 Ų158116 Ų11683%0.82776%0.763SS**  trans64.8157137.5-60.9168000121.4
452V50.5Low45.8Very low142 Ų142119.6 Ų119.686%0.86178%0.779SS**  trans67.3127.9-179.3-176.40000113.9
453N40.6Very low44.5Very low127 Ų127117.2 Ų117.268%0.67979%0.787SS**  cis-127.41377.9-17974.7000111.9S455N453-S455 PolarHBondContact ND2-OG 3.45Å; N453-S455 VanDerWaalsContact ND2-OG 3.16Å
454G34.6Very low43.1Very low69 Ų69114.4 Ų114.471%0.71180%0.798SS**  trans-90121.5174.100000112.5
455S43.9Very low42.2Very low107 Ų107117.1 Ų117.175%0.74881%0.81SS**  trans-119.178.8175.9-64.70000110.9N453N453-S455 PolarHBondContact ND2-OG 3.45Å; N453-S455 VanDerWaalsContact ND2-OG 3.16Å
456T38.7Very low41.6Very low139 Ų139117 Ų11785%0.85382%0.822SS**  trans-118.495.8-178.1-49.90000111.1
457S43.4Very low41.1Very low105 Ų105115.1 Ų115.173%0.73483%0.826SS**  trans-161.3120.8168.943.80000113.8
458N43.5Very low40.7Very low174 Ų174115.4 Ų115.493%0.9383%0.829SS**  trans143.5115.3154.4-78-16000108.7
459G37.8Very low40.6Very low78 Ų78115.4 Ų115.480%0.80483%0.829SS**  cis161.6159.4-2.300000108.6
460A38.9Very low40.7Very low102 Ų102115.6 Ų115.684%0.84383%0.83SS**  cis-149.8154.9-10.200000108.4
461A39.6Very low40.4Very low105 Ų105112.3 Ų112.387%0.86883%0.831SS**  trans-80.8157.2-176.700000113.4
462T42Very low40.3Very low142 Ų142115.5 Ų115.587%0.87183%0.832SS**  trans-81.7125.1-176.148.50000113.9
463G36.4Very low40Very low87 Ų87115.3 Ų115.390%0.89783%0.831SS**  trans78.9143.2157.900000116.4
464G36.4Very low40.1Very low82 Ų82115.2 Ų115.285%0.84583%0.829SS**  trans16596.1178.600000112.3
465V38.7Very low40.5Very low153 Ų153117.2 Ų117.293%0.92783%0.831SS**  trans-73.2134.8-176-77.70000113.9
466G34.5Very low40.3Very low78 Ų78120.7 Ų120.780%0.80484%0.835SS**  79.5107.3129.800000121.4
467G35.9Very low40.3Very low90 Ų90123.7 Ų123.793%0.92883%0.831SS**  trans95.5139.6131.200000119.6
468G35.3Very low40.3Very low73 Ų73124 Ų12475%0.75383%0.831SS**  trans131.899.7154.200000118.6
469S43.1Very low40.2Very low117 Ų117119 Ų11982%0.81881%0.809SS**  trans62.184.5136.4-54.20000122.4
470S44.7Very low40.3Very low127 Ų127121.4 Ų121.489%0.88881%0.808SS**  41.7111.4118.4-55.90000122.8
471A43.6Very low40.3Very low103 Ų103122.1 Ų122.185%0.85181%0.807SS**  -150.7154.2129.300000109.6
472R43.8Very low40.2Very low226 Ų226122.2 Ų122.285%0.85381%0.808SS**  trans-110.3171.2173-49.7-151.5-126.9-145.27.5109.9L474R472-L474 HydrophobicContact CB-CD1 4.47Å
473V44.6Very low40.2Very low138 Ų138118.4 Ų118.484%0.83680%0.797SS**  -149.514770.5171.10000112.6
474L41.8Very low40.7Very low125 Ų125119.1 Ų119.165%0.65479%0.789SS**  trans-36.4160.7163.8-70.263.5000114.8R472R472-L474 HydrophobicContact CB-CD1 4.47Å
475C43Very low41.2Very low110 Ų110122.1 Ų122.174%0.74379%0.785SS**  cis-164.7-168.1-2.9-113.10000107.4
476Q40.5Very low41.5Very low180 Ų180125 Ų12584%0.84178%0.781SS**  cis-150.6-166.26.3-143-179.944.500110.1
477R38.6Very low42.4Very low203 Ų203129.7 Ų129.777%0.76679%0.787SS**  trans-159.8141.5174.2-178.3-174.6155.2-178.4-3.4110.2S479R477-S479 PolarHBondContact NE-OG 3.37Å; R477-S479 PolarHBondContact NH2-OG 2.97Å
478P44.1Very low43.1Very low111 Ų111132.2 Ų132.272%0.72178%0.779SS**  -134.7154.911838.4-26.1000110.4
479S40.1Very low43.9Very low68 Ų68133.9 Ų133.948%0.47678%0.779SS.*  cis65.4131.947.1-55.60000111.7R477R477-S479 PolarHBondContact NE-OG 3.37Å; R477-S479 PolarHBondContact NH2-OG 2.97Å
480T40.3Very low44.4Very low129 Ų129136.7 Ų136.779%0.79178%0.784SS**  cis-164.5174.55.70.50000110.9
481S38.3Very low45.3Very low118 Ų118141 Ų14183%0.82578%0.78SS**  trans96.9134.4158.581.80000120.6
482A39.4Very low45.3Very low106 Ų106145.6 Ų145.688%0.87678%0.782SS**  trans31.3116.515600000121.2
483G40.6Very low46.3Very low63 Ų63140.7 Ų140.765%0.64977%0.768SS**  trans-169.142.3174.300000116.1
484S46.6Very low46.9Very low102 Ų102139.8 Ų139.871%0.71377%0.765SS**  trans-67.2159.9169.5-175.50000111.2
485N46.9Very low47.2Very low144 Ų144144.3 Ų144.377%0.7778%0.775SS**  trans99.215.8166.9-46.9-16.2000118.2L487N485-L487 VanDerWaalsContact C-N 3.31Å; N485-L487 PolarHBondContact O-N 3.4Å
486Y45.7Very low47.4Very low214 Ų214144.3 Ų144.384%0.83978%0.777SS**  trans-82.816.5176.6-81.8-79000116.4
487L52.7Low47.8Very low177 Ų177145.3 Ų145.393%0.92778%0.778SS**  trans-110.536.4-176.1-62.9-179.3000114.2N485N485-L487 VanDerWaalsContact C-N 3.31Å; N485-L487 PolarHBondContact O-N 3.4Å
488N51Low48Very low142 Ų142144.2 Ų144.276%0.75978%0.784SS**  trans-138.945.1-177.7-160.611.9000114.3
489S51.5Low48.3Very low109 Ų109147.3 Ų147.376%0.76279%0.793SS**  trans-142.920.8-179.3-52.20000115.1
490L55.1Low49.3Very low175 Ų175150.3 Ų150.392%0.91681%0.809SS**  trans-110.411.8179-77168.5000114.5F492L490-F492 PolarHBondContact O-N 3.19Å
491R63.2Low50.1Low217 Ų217149.3 Ų149.382%0.81980%0.804SS**  trans-91.878169.5-76.3-168.2172-151.5-1.4111.2H493R491-H493 PolarHBondContact O-N 3.43Å
492F44Very low50.5Low200 Ų200150.1 Ų150.188%0.87781%0.807SS**  trans-68.4112.2168.4-113.8-96.7000110.1L490L490-F492 PolarHBondContact O-N 3.19Å
493H63.2Low50.7Low124 Ų124148.8 Ų148.857%0.57480%0.803SS**  trans-96.6113.2171.4-79.9-96000109.5R491 Y495 S496R491-H493 PolarHBondContact O-N 3.43Å; H493-Y495 PolarHBondContact O-N 3.18Å; H493-S496 PolarHBondContact O-N 3.08Å
494P58.1Low51.1Low119 Ų119150.5 Ų150.577%0.77381%0.811SS**THydrogen-bonded Turntrans-74.516.6-168.429.9-36.5000115.9
495Y47.4Very low51.1Low220 Ų220150.7 Ų150.786%0.86381%0.813SS**THydrogen-bonded Turntrans-128.6-0.6-179.3-86.6-80.5000115.1H493 K497H493-Y495 PolarHBondContact O-N 3.18Å; Y495-K497 VanDerWaalsContact C-N 3.27Å; Y495-K497 PolarHBondContact O-N 3.02Å
496S48.5Very low51.1Low110 Ų110150 Ų15077%0.76981%0.813SS**  trans-80.965.2-177.6-62.20000113H493H493-S496 PolarHBondContact O-N 3.08Å
497K48Very low51Low201 Ų201144.9 Ų144.987%0.87481%0.809SS**  trans-121.968.1178.4-139-172-167.2-172.40112.7Y495Y495-K497 VanDerWaalsContact C-N 3.27Å; Y495-K497 PolarHBondContact O-N 3.02Å
498M43.6Very low50.6Low180 Ų180141.7 Ų141.789%0.88781%0.808SS**  trans-164.186.1154.2-87.9-133-70.500111.1
499L50.6Low50.2Low175 Ų175138.5 Ų138.592%0.91681%0.809SS**  trans-167.4152.5134.5-12765.5000110.2
500V59.6Low49.8Very low132 Ų132138.2 Ų138.280%0.881%0.813SS**  trans-91.6140.4-174.2175.40000110
501P57.2Low49.5Very low108 Ų108140.9 Ų140.970%0.70181%0.813SS**  trans-68.8151.2177.428.8-35.9000112.5G503P501-G503 PolarHBondContact O-N 3.4Å
502P46.6Very low48.9Very low135 Ų135136.3 Ų136.388%0.87781%0.811SS**  trans-75.1114.7-173.529.2-34.4000112.7
503G45.6Very low49.4Very low77 Ų77133.2 Ų133.279%0.79481%0.809SS**  trans-86.1151.916300000111.6P501P501-G503 PolarHBondContact O-N 3.4Å
504A47.8Very low48.8Very low100 Ų100132.9 Ų132.983%0.82682%0.817SS**  trans-86.1-171.7-176.500000113.1
505S47.5Very low48.8Very low106 Ų106135 Ų13574%0.74182%0.819SS**  trans88.494.1169.767.70000119.5
506T45.7Very low49.3Very low128 Ų128129.3 Ų129.379%0.78581%0.809SS**  59.6133.6124.7540000123.7
507S44.3Very low49.3Very low108 Ų108134.3 Ų134.376%0.75582%0.817SS**  trans61.794.3142.958.40000120.5
508A45.1Very low49.4Very low109 Ų109127.9 Ų127.990%0.90181%0.808SS**  33124.8120.400000120.7
509G42.2Very low50Low76 Ų76125 Ų12578%0.78480%0.802SS**  trans159.7116.5154.600000115.6
510A43.4Very low49.9Very low102 Ų102124.4 Ų124.484%0.84380%0.8SS**  trans37.9122.9154.400000121.8
511Y47.6Very low49.3Very low232 Ų232123.8 Ų123.891%0.9180%0.796SS**  trans-64.6153150.1-66.1-90.1000110.6
512P51.5Low48.7Very low121 Ų121121.1 Ų121.179%0.78679%0.789SS**  -147.4172.997.237.9-21.1000116.6
513T53.4Low48.8Very low134 Ų134124.6 Ų124.682%0.82279%0.786SS**  trans-77.5151174.851.90000114.3
514P51.4Low48.6Very low117 Ų117127.4 Ų127.476%0.7678%0.782SS**  -151.4-172.3113.237.3-19.6000113.6
515M57.3Low48.5Very low165 Ų165127.8 Ų127.881%0.81378%0.779SS**  cis-160.2156.4-43.8-94-66.3-78.500108.3
516P58.3Low48.3Very low99 Ų99131 Ų13164%0.64379%0.787SS**  trans-109.7153-170.739.6-32.9000117.3
517F48.1Very low48.1Very low216 Ų216129.1 Ų129.195%0.94779%0.785SS**  trans-153.7160.7163.8-74.2-87.7000107.9
518G51.3Low47.8Very low66 Ų66129.5 Ų129.568%0.6879%0.787SS**  cis-165.8173.81.100000110.6
519P56.2Low47.8Very low118 Ų118129.2 Ų129.277%0.76678%0.779SS**  trans-136.3-179.3-134.345-31.3000119.1
520L47.8Very low47.8Very low164 Ų164133.5 Ų133.586%0.85978%0.782SS**  trans73.3146.6165.1-58.8168.1000116.9
521T46.3Very low47.9Very low118 Ų118134.3 Ų134.372%0.72478%0.78SS**  cis-117.8-176.61.451.30000111.2
522G44.2Very low47.8Very low53 Ų53131.3 Ų131.355%0.54678%0.779SS.*  cis130.3140-8.100000114.2
523Y50.1Low47.3Very low207 Ų207128.9 Ų128.981%0.81278%0.776SS**  trans59.4145.4174.765.6-104.8000118.2
524D41.6Very low46.9Very low136 Ų136130.9 Ų130.973%0.72778%0.776SS**  cis-150.81700.5-147.4-85.4000113.6
525S46Very low46.6Very low108 Ų108134.9 Ų134.976%0.75578%0.776SS**  trans71.1139.3152.9-77.80000122.4
526L41.6Very low46.2Very low175 Ų175133 Ų13392%0.91677%0.769SS**  trans-107.8179.1179.8-72.5160.1000110.9
527A42.4Very low45.9Very low88 Ų88134 Ų13473%0.72778%0.775SS**  trans92.6110.4151.100000120.1
528S38.7Very low46.1Very low115 Ų115127 Ų12780%0.80476%0.763SS**  trans84.5160.1131-59.20000121.4
529S44.5Very low46.4Very low104 Ų104129.8 Ų129.873%0.72777%0.773SS**  trans80.581.9157.5-56.30000119.7
530I42.6Very low46.1Very low165 Ų165131.4 Ų131.485%0.84677%0.774SS**  11.5110.4126.7-51.8162.8000116.5
531C45.5Very low46.9Very low120 Ų120129.6 Ų129.681%0.81177%0.772SS**  trans-136.2134.6155.1-71.30000106.8
532L44.2Very low47Very low169 Ų169131.7 Ų131.789%0.88577%0.774SS**  cis75119.120.7-144.594.2000115.2
533G41.6Very low48.3Very low70 Ų70137.8 Ų137.872%0.72280%0.803SS**  trans86.4139.8176.500000114.2
534Q46.2Very low48.2Very low176 Ų176134.3 Ų134.382%0.82280%0.803SS**  cis104.3103.427.1-79.1-95.514.400114.2
535R45.1Very low48.6Very low201 Ų201134.2 Ų134.276%0.75881%0.807SS**  89.3156.5129.8-138.2-169.9167.2-127.4-8.1120.9
536L48.5Very low48.7Very low126 Ų126135.7 Ų135.766%0.6681%0.81SS**  trans79.4160159.6-70.1165.1000118
537P51.7Low49.1Very low120 Ų120133.4 Ų133.478%0.77980%0.803SS**  cis-130.2160.6137.9-21.6000117.9
538G52.7Low49.5Very low68 Ų68136.2 Ų136.270%0.70181%0.808SS**  trans75.4166.2152.600000118.9
539S57.9Low50.3Low125 Ų125137.6 Ų137.687%0.87481%0.808SS**  cis-161.7157.6-23.1-102.60000111
540L48.7Very low50.7Low152 Ų152140 Ų14080%0.79681%0.814SS**  trans-65.9153.9173.7-101.3141.4000111.9Q542L540-Q542 HydrophobicContact CD2-CB 4.41Å
541P64.6Low51.3Low126 Ų126138.1 Ų138.182%0.81881%0.812SS**  -139.4173.471.439.5-23.2000116.9
542Q49.4Very low51.8Low162 Ų162139.6 Ų139.676%0.75781%0.812SS**  trans-110.9154.7173.1-167.3-159.8-67.200108.7L540L540-Q542 HydrophobicContact CD2-CB 4.41Å
543P70.8Confident52.5Low180 Ų180136.9 Ų136.9100%1.16981%0.805SS**  trans-67.70157.830.9-37.4000112.9

Retrieved 543 of 543 residues in 103.9 ms (Link to these results)