Z4YHQ6_DANRE Loading...

Transmembrane protein 106B

AlphaFold DB , UniProt , Accession Z4YHQ6, Species DANRE (Danio rerio, Zebrafish), Gene tmem106bb, Length 267 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M37.9Very low32.1Very low249 Ų249151.8 Ų151.8100%1.22785%0.851SS**  0108.20-8813566.900108.3
2G37.6Very low31.6Very low77 Ų77147.4 Ų147.479%0.79483%0.83SS**  trans-94.7158-179.700000112.5
3K33.1Very low31.4Very low216 Ų216144.1 Ų144.194%0.93982%0.82SS**  trans-146.9131.8149-76.9-165.4176.3177.10108.9
4A36.4Very low31.1Very low92 Ų92144.9 Ų144.976%0.7681%0.813SS**  trans-87157.417200000110.6
5L35.9Very low30.9Very low168 Ų168142.9 Ų142.988%0.8880%0.8SS**  trans165.6122131-89.6159.1000109.5
6S30.6Very low30.9Very low125 Ų125144.4 Ų144.487%0.87480%0.799SS**  170.7151.6113.149.50000110.7
7H29.6Very low30.7Very low179 Ų179140.6 Ų140.683%0.82978%0.783SS**  trans-119.8170.8-162.6-154.5-80.4000108.1
8V30.3Very low30.7Very low131 Ų131141.3 Ų141.379%0.79478%0.78SS**  trans84.8136.8160.4-167.80000115.1
9A27.8Very low30.5Very low85 Ų85140.7 Ų140.770%0.70278%0.775SS**  cis-172.6164.6-12.200000109.4
10K26.6Very low30.4Very low191 Ų191137.9 Ų137.983%0.8377%0.766SS**  178.8121.8126.3-106.2-166.5162.6170.80109.5
11H27.6Very low30.3Very low157 Ų157138.6 Ų138.673%0.72777%0.767SS**  71.9134.196.3-109.2-88.1000111.5
12T26.3Very low29.9Very low99 Ų99132.4 Ų132.461%0.60774%0.744SS**  cis-175.214617.2-18.90000105.2
13C28.1Very low29.4Very low104 Ų104133.7 Ų133.770%0.70374%0.741SS**  163.9122.798.7-87.90000106.7
14H27.3Very low29.2Very low156 Ų156129.1 Ų129.172%0.72274%0.736SS**  69.3131.3102-80.8-68000113.8
15D29.2Very low29.2Very low114 Ų114130.4 Ų130.461%0.6174%0.737SS**  cis-165.2146.27.9-111.3-18.4000110.9
16E29.5Very low28.9Very low167 Ų167125.9 Ų125.978%0.7873%0.73SS**  trans48.6144.6135.9-60.9-161.714100122.3
17C28.8Very low28.8Very low80 Ų80131.9 Ų131.954%0.54174%0.735SS.*  cis-165.31616-141.60000112.5
18Q30Very low28.9Very low154 Ų154129.2 Ų129.272%0.7274%0.737SS**  trans58.7136.4149.5-106.9103.241.400118.6
19D27.5Very low28.9Very low130 Ų130127.5 Ų127.570%0.69574%0.737SS**  cis-167.4143.934.5-130.2-26.6000112.7
20S28.7Very low29Very low84 Ų84131.8 Ų131.859%0.58774%0.744SS**  trans63.6111.4136.6-65.60000123
21L28.5Very low29.2Very low152 Ų152131.7 Ų131.780%0.79675%0.747SS**  51.3134.9125-63.7132.8000117.7
22T28.3Very low29.3Very low120 Ų120129.8 Ų129.874%0.73675%0.746SS**  -169142.952.3-21.70000110.9
23S28Very low29.6Very low103 Ų103131.7 Ų131.772%0.7275%0.753SS**  trans-18.7138.7160.253.30000121.2
24S29.1Very low29.7Very low120 Ų120133.7 Ų133.784%0.83976%0.757SS**  -163.8157.4127.5-99.40000113.1
25P36.5Very low29.9Very low120 Ų120132 Ų13278%0.77976%0.762SS**  trans-109.4159.2-141.120.5-0.9000115.3
26G29.9Very low30.1Very low72 Ų72136.6 Ų136.674%0.74278%0.777SS**  trans53.398.1132.300000118.8
27Y28.1Very low30.3Very low251 Ų251134.4 Ų134.498%0.98478%0.78SS**  trans-71.8122.7156.9-84.3-105.2000110.1
28S31.3Very low30.5Very low123 Ų123134.1 Ų134.186%0.8679%0.791SS**  trans-130.2141.1158.547.50000109.7
29A30.7Very low30.9Very low95 Ų95130.7 Ų130.779%0.78580%0.796SS**  trans-92.5155.8-166.700000113.4
30M30.2Very low31.6Very low175 Ų175132 Ų13286%0.86280%0.803SS**  trans86113.5139.3-149.4162.1157.900118.6
31Q29.8Very low32.5Very low190 Ų190134.1 Ų134.189%0.88881%0.812SS**  -177.2151.8118.5-101.7172.69.300113
32T30.8Very low33.6Very low116 Ų116130.7 Ų130.771%0.71280%0.801SS**  trans-88.6154-170.87.60000114
33D30.8Very low34.5Very low139 Ų139133 Ų13374%0.74380%0.804SS**  trans77.9123.7148.8-61.3-19.4000124
34D31Very low35.4Very low147 Ų147136.1 Ų136.179%0.78681%0.805SS**  trans60.7105.6140.4-73.3-24.7000121.7
35S31Very low36.1Very low121 Ų121135.6 Ų135.685%0.84680%0.799SS**  173138.5105.7-78.70000113.5
36K34.3Very low36.8Very low209 Ų209137.2 Ų137.291%0.90979%0.79SS**  trans-23.9133.3163.8-84.2163.7164.9167.30116.1
37S32.3Very low38.2Very low122 Ų122138.6 Ų138.685%0.85378%0.784SS**  165.8131.1107.4-1680000112
38G33Very low39.6Very low74 Ų74132.3 Ų132.376%0.76376%0.764SS**  trans70.391.9135.800000119.6
39G39Very low40.6Very low81 Ų81135.1 Ų135.184%0.83576%0.761SS**  68.8106.7125.800000119.1
40D42.1Very low42Very low157 Ų157136.3 Ų136.384%0.8476%0.758SS**  -160.195.8128.2-154.34.9000109.2
41V48.6Very low43Very low129 Ų129130.1 Ų130.178%0.78274%0.739SS**  trans-100.2106.2167.2177.30000105.6Q43V41-Q43 PolarHBondContact O-N 3.42Å
42S50.4Low44.3Very low80 Ų80133 Ų13356%0.55974%0.742SS**  trans-54.7102.4171.843.80000109.6F44S42-F44 WeakPolarHBondContact O-CD2 3.15Å; S42-F44 PolarHBondContact O-N 3.31Å
43Q47.3Very low45.5Very low170 Ų170135 Ų13579%0.79475%0.748SS**  trans-7888.5-179.2-170.8143.2-27.900109V41V41-Q43 PolarHBondContact O-N 3.42Å
44F46.6Very low47Very low167 Ų167131.6 Ų131.673%0.73274%0.736SS**PPolyproline II helixtrans-66128.9166.7-68.8-84.3000108.8S42 Y46S42-F44 WeakPolarHBondContact O-CD2 3.15Å; S42-F44 PolarHBondContact O-N 3.31Å; F44-Y46 PolarHBondContact O-N 3.42Å
45P45.4Very low48.7Very low110 Ų110131.2 Ų131.271%0.71474%0.738SS**PPolyproline II helixtrans-64.4120.2-179.624.2-30.4000109.3V47P45-V47 PolarHBondContact O-N 3.45Å
46Y51.1Low50.3Low153 Ų153130.1 Ų130.160%0.673%0.727SS**PPolyproline II helixtrans-67.9119.6171.8-177.8-111.1000108.6F44 E48 G62F44-Y46 PolarHBondContact O-N 3.42Å; Y46-E48 HydrophobicContact CD1-CG 3.94Å; Y46-E48 HydrophobicContact CE1-CG 3.25Å; Y46-G62 WeakPolarHBondContact CE1-O 3.22Å; Y46-G62 PolarHBondContact OH-O 2.84Å
47V57.7Low51.4Low102 Ų102122.9 Ų122.962%0.61870%0.702SS**  trans-109.6114.5176.7-128.40000108.1P45 F49P45-V47 PolarHBondContact O-N 3.45Å; V47-F49 HydrophobicContact CB-CD2 4.47Å; V47-F49 HydrophobicContact CB-CE2 4.29Å; V47-F49 PolarHBondContact O-N 2.89Å; V47-F49 VanDerWaalsContact O-N 3.17Å
48E57.9Low53Low118 Ų118122.5 Ų122.555%0.55170%0.696SS**  trans-76.599173-73.3175.9169.100109.2Y46 T50Y46-E48 HydrophobicContact CD1-CG 3.94Å; Y46-E48 HydrophobicContact CE1-CG 3.25Å; E48-T50 PolarHBondContact O-N 3.24Å
49F53.3Low54.5Low183 Ų183122.6 Ų122.680%0.80368%0.682SS**  trans-74.481.5165.5-80.3-89.6000109V47 G51V47-F49 HydrophobicContact CB-CD2 4.47Å; V47-F49 HydrophobicContact CB-CE2 4.29Å; V47-F49 PolarHBondContact O-N 2.89Å; V47-F49 VanDerWaalsContact O-N 3.17Å; F49-G51 PolarHBondContact O-N 3.17Å
50T59.2Low55.7Low119 Ų119120 Ų12073%0.7365%0.651SS**  trans-75.867.5166.146.40000109.6E48E48-T50 PolarHBondContact O-N 3.24Å
51G52Low56.8Low45 Ų45119.9 Ų119.946%0.46465%0.645SS.*  trans-66144.7166.100000109.8F49 D53 S54F49-G51 PolarHBondContact O-N 3.17Å; G51-D53 PolarHBondContact O-N 3.38Å; G51-S54 PolarHBondContact O-N 3.45Å; G51-S54 PolarHBondContact O-OG 2.65Å
52R56.2Low57.7Low252 Ų252114.4 Ų114.495%0.95162%0.615SS**THydrogen-bonded Turntrans-54-7.2-168.9-115.8175.4-162.6166.34.6117.5
53D56.1Low58.6Low157 Ų157114.5 Ų114.584%0.8461%0.612SS**THydrogen-bonded Turntrans-129.318.7178.8-61.4-47.7000113.3G51 V55G51-D53 PolarHBondContact O-N 3.38Å; D53-V55 PolarHBondContact O-N 3.12Å
54S62.3Low59.3Low68 Ų68109.1 Ų109.148%0.47660%0.603SS.*  trans-79.8114.4178.365.90000111.5G51 T56G51-S54 PolarHBondContact O-N 3.45Å; G51-S54 PolarHBondContact O-OG 2.65Å; S54-T56 PolarHBondContact O-N 3.23Å
55V67.4Low60.1Low139 Ų139110.6 Ų110.684%0.84260%0.603SS**PPolyproline II helixtrans-78.6117.2171.8-176.90000108.2D53 C57D53-V55 PolarHBondContact O-N 3.12Å; V55-C57 PolarHBondContact O-N 2.97Å
56T63.8Low61Low98 Ų98109.7 Ų109.760%0.60159%0.592SS**PPolyproline II helixtrans-62.8128176.3-0.90000109.9S54 P58S54-T56 PolarHBondContact O-N 3.23Å; T56-P58 WeakPolarHBondContact O-CD 3.33Å
57C58Low61.5Low57 Ų57106.6 Ų106.639%0.38559%0.59SS.*PPolyproline II helixtrans-60.9120.9177.9174.90000109.3V55 T59 C60 Q61V55-C57 PolarHBondContact O-N 2.97Å; C57-T59 PolarHBondContact O-N 2.99Å; C57-T59 VanDerWaalsContact O-N 3.13Å; C57-C60 VanDerWaalsContact CB-SG 3.56Å; C57-C60 PolarHBondContact O-N 3.26Å; C57-Q61 WeakPolarHBondContact O-CA 3.3Å; C57-Q61 PolarHBondContact O-N 3.03Å
58P65.5Low61.6Low114 Ų114112.5 Ų112.574%0.7460%0.602SS**THydrogen-bonded Turntrans-64-23.8-174.624-33.1000112.6T56T56-P58 WeakPolarHBondContact O-CD 3.33Å
59T64.8Low61.7Low75 Ų75110.6 Ų110.646%0.4661%0.614SS.*THydrogen-bonded Turntrans-81-37.5-175.3-43.30000113.4C57 L74C57-T59 PolarHBondContact O-N 2.99Å; C57-T59 VanDerWaalsContact O-N 3.13Å; T59-L74 HydrophobicContact CG2-CD2 3.13Å
60C64Low61.8Low27 Ų27106.9 Ų106.918%0.18260%0.599CS.*THydrogen-bonded Turntrans-113.7-0.1179.465.90000113.2C57 G62 T63C57-C60 VanDerWaalsContact CB-SG 3.56Å; C57-C60 PolarHBondContact O-N 3.26Å; C60-G62 PolarHBondContact O-N 3.21Å; C60-T63 PolarHBondContact O-N 3.4Å; C60-T63 PolarHBondContact O-OG1 3.23Å
61Q66.3Low61.5Low154 Ų154106.2 Ų106.272%0.7259%0.587SS**THydrogen-bonded Turntrans48.526.3-178.3-61.7-178.13.700114.2C57 T63C57-Q61 WeakPolarHBondContact O-CA 3.3Å; C57-Q61 PolarHBondContact O-N 3.03Å; Q61-T63 VanDerWaalsContact C-N 3.35Å
62G67.2Low61.4Low15 Ų15111.9 Ų111.916%0.15561%0.607CS.*THydrogen-bonded Turntrans82.81.9-176.200000115.1Y46 C60Y46-G62 WeakPolarHBondContact CE1-O 3.22Å; Y46-G62 PolarHBondContact OH-O 2.84Å; C60-G62 PolarHBondContact O-N 3.21Å
63T67.9Low61.1Low81 Ų81106.8 Ų106.850%0.49759%0.594SS.*SBendtrans-89.6-6.9-17864.70000114.4C60 Q61 R65C60-T63 PolarHBondContact O-N 3.4Å; C60-T63 PolarHBondContact O-OG1 3.23Å; Q61-T63 VanDerWaalsContact C-N 3.35Å; T63-R65 PolarHBondContact O-N 2.91Å; T63-R65 PolarHBondContact OG1-O 2.03Å
64G62.8Low61Low58 Ų58103 Ų10360%0.59857%0.573SS**SBendtrans64.92.2-178.800000115.4
65R63Low60.7Low197 Ų197104.6 Ų104.674%0.74358%0.58SS**  trans-121.5131.4179.7-65.3-174.1178.41770.2110T63T63-R65 PolarHBondContact O-N 2.91Å; T63-R65 PolarHBondContact OG1-O 2.03Å
66I63.7Low60.3Low91 Ų91102 Ų10247%0.46757%0.574SS.*  trans-100.6125.2178.7-62.4168.7000107.8R68 L74I66-R68 PolarHBondContact O-N 3.26Å; I66-L74 HydrophobicContact CG2-CD1 3.46Å; I66-L74 VanDerWaalsContact CG2-CD1 3.46Å
67P63.3Low59.9Low88 Ų88104.7 Ų104.757%0.57158%0.583SS**  trans-60.3122.8179.7-21.531.4000112.1G69 Q70P67-G69 PolarHBondContact O-N 2.86Å; P67-G69 VanDerWaalsContact O-N 3.1Å; P67-Q70 PolarHBondContact O-N 3.1Å
68R58.8Low59.8Low227 Ų227107.4 Ų107.486%0.85759%0.593SS**THydrogen-bonded Turntrans-7796.7177-66.6-143.5177.7-1721.5110.1I66 E71I66-R68 PolarHBondContact O-N 3.26Å; R68-E71 WeakPolarHBondContact CA-OE1 3.35Å; R68-E71 VanDerWaalsContact CB-OE1 3.25Å; R68-E71 WeakPolarHBondContact CB-OE1 3.26Å; R68-E71 WeakPolarHBondContact CD-OE1 3.34Å; R68-E71 WeakPolarHBondContact CG-OE1 3.34Å
69G59.5Low59Low78 Ų78105.1 Ų105.180%0.80458%0.578SS**THydrogen-bonded Turntrans159.7-19.5-170.700000112.4P67P67-G69 PolarHBondContact O-N 2.86Å; P67-G69 VanDerWaalsContact O-N 3.1Å
70Q56.1Low58.3Low105 Ų105113.4 Ų113.449%0.49160%0.602SS.*  trans-11622.5175.4-155.3164.81.600112.4P67 N72 Q73 L74P67-Q70 PolarHBondContact O-N 3.1Å; Q70-N72 VanDerWaalsContact C-N 3.31Å; Q70-N72 PolarHBondContact O-N 3.27Å; Q70-Q73 HydrophobicContact CG-CB 4Å; Q70-Q73 PolarHBondContact O-N 3.23Å; Q70-L74 VanDerWaalsContact O-CD1 3.26Å; Q70-L74 WeakPolarHBondContact O-CD1 3.44Å; Q70-L74 WeakPolarHBondContact O-CG 3.35Å
71E53.5Low57.7Low105 Ų105117.1 Ų117.149%0.49163%0.629SS.*G310 helixtrans-60.7-38.6-179.3-55.1-173.6-153.500112R68 Q73 L74R68-E71 WeakPolarHBondContact CA-OE1 3.35Å; R68-E71 VanDerWaalsContact CB-OE1 3.25Å; R68-E71 WeakPolarHBondContact CB-OE1 3.26Å; R68-E71 WeakPolarHBondContact CD-OE1 3.34Å; R68-E71 WeakPolarHBondContact CG-OE1 3.34Å; E71-Q73 VanDerWaalsContact C-N 3.26Å; E71-Q73 PolarHBondContact O-N 3.01Å; E71-L74 PolarHBondContact O-N 3.32Å
72N48.6Very low57.3Low164 Ų164112.7 Ų112.788%0.87761%0.61SS**G310 helixtrans-76.1-9.8-177-59.3-20.6000113.8Q70Q70-N72 VanDerWaalsContact C-N 3.31Å; Q70-N72 PolarHBondContact O-N 3.27Å
73Q50.2Low56.6Low144 Ų144119.7 Ų119.767%0.67364%0.639SS**G310 helixtrans-106.2-5.7178.4-158.7176.211.800112.4Q70 E71 V75Q70-Q73 HydrophobicContact CG-CB 4Å; Q70-Q73 PolarHBondContact O-N 3.23Å; E71-Q73 VanDerWaalsContact C-N 3.26Å; E71-Q73 PolarHBondContact O-N 3.01Å; Q73-V75 PolarHBondContact O-N 3.16Å
74L54Low55.9Low77 Ų77127 Ų12740%0.40366%0.657SS.*  trans-80.761.7173.2-71.5149.3000109.5T59 I66 Q70 E71T59-L74 HydrophobicContact CG2-CD2 3.13Å; I66-L74 HydrophobicContact CG2-CD1 3.46Å; I66-L74 VanDerWaalsContact CG2-CD1 3.46Å; Q70-L74 VanDerWaalsContact O-CD1 3.26Å; Q70-L74 WeakPolarHBondContact O-CD1 3.44Å; Q70-L74 WeakPolarHBondContact O-CG 3.35Å; E71-L74 PolarHBondContact O-N 3.32Å
75V56.4Low55.5Low102 Ų102129.9 Ų129.962%0.61866%0.658SS**  trans-78.6122.5163.2179.70000105.7Q73 L77Q73-V75 PolarHBondContact O-N 3.16Å; V75-L77 PolarHBondContact O-N 3.42Å
76A58.6Low55Low86 Ų86129.1 Ų129.171%0.71166%0.655SS**  trans-6093.6164.400000107.4I78A76-I78 PolarHBondContact O-N 2.84Å
77L56.3Low55Low154 Ų154127.4 Ų127.481%0.80665%0.65SS**  trans-71.482.5170.2-72.8167000106V75 P79V75-L77 PolarHBondContact O-N 3.42Å; L77-P79 WeakPolarHBondContact O-CD 3.49Å; L77-P79 VanDerWaalsContact O-N 3.12Å
78I56.3Low55Low113 Ų113133.3 Ų133.358%0.57966%0.661SS**  trans-62.9110.8165.4-59171.5000104.5A76 Y80 L85A76-I78 PolarHBondContact O-N 2.84Å; I78-Y80 PolarHBondContact O-N 3.43Å; I78-L85 HydrophobicContact CG2-CD2 4.46Å
79P48.5Very low55.7Low66 Ų66131.4 Ų131.443%0.42965%0.654SS.*  trans-58.9129.8-176.220.4-26.9000108.3L77 S81 D82L77-P79 WeakPolarHBondContact O-CD 3.49Å; L77-P79 VanDerWaalsContact O-N 3.12Å; P79-S81 PolarHBondContact O-N 3.32Å; P79-D82 HydrophobicContact CG-CB 4.1Å; P79-D82 WeakPolarHBondContact O-CB 3.07Å; P79-D82 PolarHBondContact O-N 3.04Å
80Y49.6Very low56.6Low249 Ų249131.5 Ų131.598%0.97664%0.639SS**THydrogen-bonded Turntrans-58.6-15.8177.1-156.6-91.6000112I78I78-Y80 PolarHBondContact O-N 3.43Å
81S52Low57.7Low106 Ų106133.4 Ų133.474%0.74165%0.645SS**THydrogen-bonded Turntrans-97.314.4176.152.60000114.6P79 Q83P79-S81 PolarHBondContact O-N 3.32Å; S81-Q83 PolarHBondContact O-N 2.71Å
82D56.6Low59.2Low61 Ų61133.5 Ų133.533%0.32665%0.649SS.*  trans-63.7118.3176.3-160.9-23.6000110.9P79 R84 L85 R86P79-D82 HydrophobicContact CG-CB 4.1Å; P79-D82 WeakPolarHBondContact O-CB 3.07Å; P79-D82 PolarHBondContact O-N 3.04Å; D82-R84 PolarHBondContact O-N 3.32Å; D82-R84 PolarHBondContact OD1-N 2.95Å; D82-L85 HydrophobicContact CB-CB 4.49Å; D82-L85 PolarHBondContact O-N 2.92Å; D82-R86 PolarHBondContact O-N 3.21Å
83Q52.6Low61.1Low161 Ų161133 Ų13375%0.75264%0.636SS**THydrogen-bonded Turntrans-67.9-19.2-174-162.5137.2-3200112.6S81S81-Q83 PolarHBondContact O-N 2.71Å
84R53.9Low63Low236 Ų236129.9 Ų129.989%0.89163%0.626SS**THydrogen-bonded Turntrans-72.2-28.2170.2-72.4-164.887-166.97.2112.9D82D82-R84 PolarHBondContact O-N 3.32Å; D82-R84 PolarHBondContact OD1-N 2.95Å
85L52.9Low64.8Low118 Ų118131.6 Ų131.662%0.61863%0.634SS**THydrogen-bonded Turntrans-85.2-9.5177.9-110.272.2000113.2I78 D82 P87I78-L85 HydrophobicContact CG2-CD2 4.46Å; D82-L85 HydrophobicContact CB-CB 4.49Å; D82-L85 PolarHBondContact O-N 2.92Å; L85-P87 WeakPolarHBondContact O-CD 3.42Å
86R53.7Low66.6Low181 Ų181129.1 Ų129.168%0.68362%0.623SS**  trans-7995.1179.1-159.1175.6-171.5-177.53.5109.1D82 R88D82-R86 PolarHBondContact O-N 3.21Å; R86-R88 PolarHBondContact O-N 3.16Å
87P64.3Low68.3Low54 Ų54128.1 Ų128.135%0.35161%0.612SS.*  trans-88.464.9-166.331.6-15.9000107.7L85 R89 T90 K91L85-P87 WeakPolarHBondContact O-CD 3.42Å; P87-R89 PolarHBondContact O-N 3.31Å; P87-T90 WeakPolarHBondContact CB-OG1 3.44Å; P87-T90 PolarHBondContact O-N 3.07Å; P87-K91 HydrophobicContact CG-CG 4.47Å; P87-K91 WeakPolarHBondContact O-CB 3.41Å; P87-K91 WeakPolarHBondContact O-CG 3.34Å; P87-K91 PolarHBondContact O-N 3.29Å
88R63.3Low70.2Confident212 Ų212124 Ų12480%0.859%0.593SS**Hα-helixtrans-64.5-32-175.8-160.6177.2-177.6177.70.3111R86R86-R88 PolarHBondContact O-N 3.16Å
89R72.3Confident72.1Confident188 Ų188123.6 Ų123.671%0.70959%0.59SS**Hα-helixtrans-78.5-44.8173.7-61.4-67.4-175.9177.60.6111.7P87 K91 L92 Y93P87-R89 PolarHBondContact O-N 3.31Å; R89-K91 PolarHBondContact O-N 3.05Å; R89-L92 WeakPolarHBondContact O-CB 3.34Å; R89-L92 PolarHBondContact O-N 2.66Å; R89-L92 VanDerWaalsContact O-N 3.1Å; R89-Y93 HydrophobicContact CB-CD2 4.33Å; R89-Y93 HydrophobicContact CB-CE2 3.88Å; R89-Y93 WeakPolarHBondContact O-CD2 3.26Å; R89-Y93 PolarHBondContact O-N 3.14Å
90T78.3Confident74.4Confident79 Ų79125.2 Ų125.249%0.48560%0.595SS.*Hα-helixtrans-63.6-38.1179.2-31.50000112.8P87 L92 Y93 V94P87-T90 WeakPolarHBondContact CB-OG1 3.44Å; P87-T90 PolarHBondContact O-N 3.07Å; T90-L92 VanDerWaalsContact C-N 3.3Å; T90-L92 PolarHBondContact O-N 3.18Å; T90-Y93 PolarHBondContact O-N 2.86Å; T90-V94 HydrophobicContact CG2-CG2 4.39Å; T90-V94 WeakPolarHBondContact O-CB 3.47Å; T90-V94 VanDerWaalsContact O-CG2 3.25Å; T90-V94 WeakPolarHBondContact O-CG2 3.23Å; T90-V94 PolarHBondContact O-N 2.88Å
91K80.2Confident76.7Confident145 Ų145116.8 Ų116.863%0.6357%0.572SS**Hα-helixtrans-59.8-40.2173-72.6-175-179.4-168.30112P87 R89 M95P87-K91 HydrophobicContact CG-CG 4.47Å; P87-K91 WeakPolarHBondContact O-CB 3.41Å; P87-K91 WeakPolarHBondContact O-CG 3.34Å; P87-K91 PolarHBondContact O-N 3.29Å; R89-K91 PolarHBondContact O-N 3.05Å; K91-M95 WeakPolarHBondContact O-CB 3.5Å; K91-M95 VanDerWaalsContact O-CG 3.23Å; K91-M95 WeakPolarHBondContact O-CG 3.36Å; K91-M95 PolarHBondContact O-N 2.89Å
92L84.9Confident78.8Confident108 Ų108116.8 Ų116.857%0.56556%0.563SS**Hα-helixtrans-68.6-42.1176.4-174.9143.1000111.8R89 T90 M95 A96R89-L92 WeakPolarHBondContact O-CB 3.34Å; R89-L92 PolarHBondContact O-N 2.66Å; R89-L92 VanDerWaalsContact O-N 3.1Å; T90-L92 VanDerWaalsContact C-N 3.3Å; T90-L92 PolarHBondContact O-N 3.18Å; L92-M95 PolarHBondContact O-N 2.99Å; L92-A96 VanDerWaalsContact O-CB 3.23Å; L92-A96 WeakPolarHBondContact O-CB 3.4Å; L92-A96 PolarHBondContact O-N 2.8Å
93Y88Confident80.7Confident153 Ų153118 Ų11860%0.657%0.569SS**Hα-helixtrans-63.6-43.5176.2-68-59.8000112.5R89 T90 A96 S97R89-Y93 HydrophobicContact CB-CD2 4.33Å; R89-Y93 HydrophobicContact CB-CE2 3.88Å; R89-Y93 WeakPolarHBondContact O-CD2 3.26Å; R89-Y93 PolarHBondContact O-N 3.14Å; T90-Y93 PolarHBondContact O-N 2.86Å; Y93-A96 PolarHBondContact O-N 2.81Å; Y93-S97 WeakPolarHBondContact O-CB 3.47Å; Y93-S97 PolarHBondContact O-N 2.77Å; Y93-S97 PolarHBondContact O-OG 2.87Å
94V91.1Very high82.8Confident78 Ų78115.1 Ų115.147%0.47356%0.558SS.*Hα-helixtrans-65.3-43.5177.5173.50000110.8T90 S97 V98T90-V94 HydrophobicContact CG2-CG2 4.39Å; T90-V94 WeakPolarHBondContact O-CB 3.47Å; T90-V94 VanDerWaalsContact O-CG2 3.25Å; T90-V94 WeakPolarHBondContact O-CG2 3.23Å; T90-V94 PolarHBondContact O-N 2.88Å; V94-S97 WeakPolarHBondContact CA-OG 3.21Å; V94-S97 PolarHBondContact O-N 2.82Å; V94-S97 PolarHBondContact O-OG 3.45Å; V94-V98 VanDerWaalsContact O-CG2 3.27Å; V94-V98 WeakPolarHBondContact O-CG2 3.38Å; V94-V98 PolarHBondContact O-N 3.15Å
95M91.6Very high84.9Confident114 Ų114107.1 Ų107.156%0.56254%0.538SS*.Hα-helixtrans-64.5-42.3175.6-72.5-58-61.600111.9K91 L92 S97 V98 I99K91-M95 WeakPolarHBondContact O-CB 3.5Å; K91-M95 VanDerWaalsContact O-CG 3.23Å; K91-M95 WeakPolarHBondContact O-CG 3.36Å; K91-M95 PolarHBondContact O-N 2.89Å; L92-M95 PolarHBondContact O-N 2.99Å; M95-S97 VanDerWaalsContact C-N 3.35Å; M95-S97 PolarHBondContact O-N 2.72Å; M95-V98 PolarHBondContact O-N 2.77Å; M95-I99 VanDerWaalsContact O-CG1 3.28Å; M95-I99 WeakPolarHBondContact O-CG1 3.4Å; M95-I99 PolarHBondContact O-N 3.45Å
96A93.4Very high86.9Confident49 Ų49105.8 Ų105.841%0.40554%0.535SS..Hα-helixtrans-62.7-41175.900000111.7L92 Y93 I99 L100L92-A96 VanDerWaalsContact O-CB 3.23Å; L92-A96 WeakPolarHBondContact O-CB 3.4Å; L92-A96 PolarHBondContact O-N 2.8Å; Y93-A96 PolarHBondContact O-N 2.81Å; A96-I99 PolarHBondContact O-N 2.93Å; A96-L100 VanDerWaalsContact O-CB 3.31Å; A96-L100 WeakPolarHBondContact O-CB 3.29Å; A96-L100 PolarHBondContact O-N 2.62Å
97S94.6Very high88.9Confident66 Ų66100.7 Ų100.746%0.46252%0.52SS..Hα-helixtrans-66.3-38.8176.562.10000112.3Y93 V94 M95 C101Y93-S97 WeakPolarHBondContact O-CB 3.47Å; Y93-S97 PolarHBondContact O-N 2.77Å; Y93-S97 PolarHBondContact O-OG 2.87Å; V94-S97 WeakPolarHBondContact CA-OG 3.21Å; V94-S97 PolarHBondContact O-N 2.82Å; V94-S97 PolarHBondContact O-OG 3.45Å; M95-S97 VanDerWaalsContact C-N 3.35Å; M95-S97 PolarHBondContact O-N 2.72Å; S97-C101 VanDerWaalsContact O-CB 3.28Å; S97-C101 WeakPolarHBondContact O-CB 3.48Å; S97-C101 PolarHBondContact O-N 2.88Å
98V96.6Very high90.3Very high68 Ų68100.3 Ų100.341%0.41252%0.522SS..Hα-helixtrans-64.3-46.7175.5170.70000110.4V94 M95 L100 C101 L102V94-V98 VanDerWaalsContact O-CG2 3.27Å; V94-V98 WeakPolarHBondContact O-CG2 3.38Å; V94-V98 PolarHBondContact O-N 3.15Å; M95-V98 PolarHBondContact O-N 2.77Å; V98-L100 PolarHBondContact O-N 3.26Å; V98-C101 PolarHBondContact O-N 2.93Å; V98-L102 HydrophobicContact CG1-CD1 4.11Å; V98-L102 HydrophobicContact CG1-CG 4.46Å; V98-L102 WeakPolarHBondContact O-CG 3.02Å; V98-L102 PolarHBondContact O-N 3.11Å
99I96.5Very high91.7Very high103 Ų10394.6 Ų94.653%0.52851%0.51SS..Hα-helixtrans-62.3-45.1178.1-68166000111.1M95 A96 C101 L102 L103M95-I99 VanDerWaalsContact O-CG1 3.28Å; M95-I99 WeakPolarHBondContact O-CG1 3.4Å; M95-I99 PolarHBondContact O-N 3.45Å; A96-I99 PolarHBondContact O-N 2.93Å; I99-C101 VanDerWaalsContact C-N 3.34Å; I99-C101 PolarHBondContact O-N 3.48Å; I99-L102 PolarHBondContact O-N 2.93Å; I99-L103 WeakPolarHBondContact O-CB 3.14Å; I99-L103 PolarHBondContact O-N 2.95Å
100L96.8Very high92.6Very high101 Ų10190.5 Ų90.553%0.52950%0.498SS..Hα-helixtrans-60.9-43.8177.5179.763.7000111.3A96 V98 L103 L104A96-L100 VanDerWaalsContact O-CB 3.31Å; A96-L100 WeakPolarHBondContact O-CB 3.29Å; A96-L100 PolarHBondContact O-N 2.62Å; V98-L100 PolarHBondContact O-N 3.26Å; L100-L103 PolarHBondContact O-N 3.46Å; L100-L104 HydrophobicContact CD1-CD1 4.45Å; L100-L104 HydrophobicContact CD1-CG 4.42Å; L100-L104 HydrophobicContact CG-CD1 4.27Å; L100-L104 WeakPolarHBondContact O-CG 3.27Å; L100-L104 PolarHBondContact O-N 3.22Å
101C96.9Very high93.3Very high72 Ų7291.3 Ų91.349%0.48650%0.495SS..Hα-helixtrans-61.8-48.5176.9-173.90000111.4S97 V98 I99 L103 L104 C105S97-C101 VanDerWaalsContact O-CB 3.28Å; S97-C101 WeakPolarHBondContact O-CB 3.48Å; S97-C101 PolarHBondContact O-N 2.88Å; V98-C101 PolarHBondContact O-N 2.93Å; I99-C101 VanDerWaalsContact C-N 3.34Å; I99-C101 PolarHBondContact O-N 3.48Å; C101-L103 VanDerWaalsContact C-N 3.29Å; C101-L103 PolarHBondContact O-N 2.76Å; C101-L104 PolarHBondContact O-N 2.86Å; C101-C105 WeakPolarHBondContact O-CB 3.46Å; C101-C105 PolarHBondContact O-N 2.66Å; C101-C105 PolarHBondContact O-SG 2.82Å
102L96.8Very high93.7Very high106 Ų10689.1 Ų89.156%0.55549%0.49SS*.Hα-helixtrans-57.8-43.9176.1-71175.5000111.4V98 I99 C105 T106V98-L102 HydrophobicContact CG1-CD1 4.11Å; V98-L102 HydrophobicContact CG1-CG 4.46Å; V98-L102 WeakPolarHBondContact O-CG 3.02Å; V98-L102 PolarHBondContact O-N 3.11Å; I99-L102 PolarHBondContact O-N 2.93Å; L102-C105 PolarHBondContact O-N 2.91Å; L102-T106 VanDerWaalsContact O-CG2 3.29Å; L102-T106 WeakPolarHBondContact O-CG2 3.44Å; L102-T106 PolarHBondContact O-N 2.95Å; L102-T106 PolarHBondContact O-OG1 2.99Å
103L97Very high94Very high86 Ų8690.7 Ų90.745%0.4549%0.492SS..Hα-helixtrans-59.9-49.7177.2-172154.2000110.8I99 L100 C101 C105 T106 L107I99-L103 WeakPolarHBondContact O-CB 3.14Å; I99-L103 PolarHBondContact O-N 2.95Å; L100-L103 PolarHBondContact O-N 3.46Å; C101-L103 VanDerWaalsContact C-N 3.29Å; C101-L103 PolarHBondContact O-N 2.76Å; L103-C105 PolarHBondContact O-N 3.29Å; L103-T106 WeakPolarHBondContact CA-OG1 3.09Å; L103-T106 PolarHBondContact O-N 2.96Å; L103-T106 PolarHBondContact O-OG1 3.08Å; L103-L107 HydrophobicContact CD2-CD1 3.46Å; L103-L107 VanDerWaalsContact CD2-CD1 3.46Å; L103-L107 HydrophobicContact CD2-CG 4.11Å; L103-L107 WeakPolarHBondContact O-CG 3.47Å; L103-L107 PolarHBondContact O-N 3.44Å
104L96.6Very high94Very high101 Ų10186.1 Ų86.153%0.52948%0.481SS..Hα-helixtrans-61.8-41.1177.8-68.2175.5000112.4L100 C101 L107 A108L100-L104 HydrophobicContact CD1-CD1 4.45Å; L100-L104 HydrophobicContact CD1-CG 4.42Å; L100-L104 HydrophobicContact CG-CD1 4.27Å; L100-L104 WeakPolarHBondContact O-CG 3.27Å; L100-L104 PolarHBondContact O-N 3.22Å; C101-L104 PolarHBondContact O-N 2.86Å; L104-L107 PolarHBondContact O-N 2.75Å; L104-A108 WeakPolarHBondContact O-CB 3.43Å; L104-A108 PolarHBondContact O-N 2.84Å
105C96.6Very high94Very high68 Ų6886.6 Ų86.646%0.45948%0.475SS..Hα-helixtrans-63.1-44.9175.1-69.90000111.8C101 L102 L103 L107 A108 V109C101-C105 WeakPolarHBondContact O-CB 3.46Å; C101-C105 PolarHBondContact O-N 2.66Å; C101-C105 PolarHBondContact O-SG 2.82Å; L102-C105 PolarHBondContact O-N 2.91Å; L103-C105 PolarHBondContact O-N 3.29Å; C105-L107 PolarHBondContact O-N 2.78Å; C105-A108 PolarHBondContact O-N 2.82Å; C105-V109 WeakPolarHBondContact O-CG2 3.45Å; C105-V109 PolarHBondContact O-N 3.24Å
106T95.3Very high93.8Very high90 Ų9084.5 Ų84.555%0.55247%0.471SS*.Hα-helixtrans-64.4-39.5177.756.90000112.2L102 L103 V109 F110L102-T106 VanDerWaalsContact O-CG2 3.29Å; L102-T106 WeakPolarHBondContact O-CG2 3.44Å; L102-T106 PolarHBondContact O-N 2.95Å; L102-T106 PolarHBondContact O-OG1 2.99Å; L103-T106 WeakPolarHBondContact CA-OG1 3.09Å; L103-T106 PolarHBondContact O-N 2.96Å; L103-T106 PolarHBondContact O-OG1 3.08Å; T106-V109 PolarHBondContact O-N 2.88Å; T106-F110 VanDerWaalsContact O-CB 3.28Å; T106-F110 WeakPolarHBondContact O-CB 3.43Å; T106-F110 PolarHBondContact O-N 2.86Å
107L95Very high93.7Very high73 Ų7382.6 Ų82.638%0.38245%0.454SS..Hα-helixtrans-63.4-46.2173.8-72.6176.7000111L103 L104 C105 V109 F110 F111L103-L107 HydrophobicContact CD2-CD1 3.46Å; L103-L107 VanDerWaalsContact CD2-CD1 3.46Å; L103-L107 HydrophobicContact CD2-CG 4.11Å; L103-L107 WeakPolarHBondContact O-CG 3.47Å; L103-L107 PolarHBondContact O-N 3.44Å; L104-L107 PolarHBondContact O-N 2.75Å; C105-L107 PolarHBondContact O-N 2.78Å; L107-V109 VanDerWaalsContact C-N 3.33Å; L107-V109 PolarHBondContact O-N 2.9Å; L107-F110 PolarHBondContact O-N 2.82Å; L107-F111 HydrophobicContact CB-CD2 4.35Å; L107-F111 HydrophobicContact CB-CE2 4.29Å; L107-F111 HydrophobicContact CD2-CE2 4.06Å; L107-F111 WeakPolarHBondContact O-CD2 3.23Å; L107-F111 PolarHBondContact O-N 2.87Å
108A93.9Very high93.7Very high47 Ų4783 Ų8339%0.38845%0.451SS..Hα-helixtrans-58.3-46178.400000111.4L104 C105 L112L104-A108 WeakPolarHBondContact O-CB 3.43Å; L104-A108 PolarHBondContact O-N 2.84Å; C105-A108 PolarHBondContact O-N 2.82Å; A108-L112 VanDerWaalsContact O-CB 3.22Å; A108-L112 WeakPolarHBondContact O-CB 3.36Å; A108-L112 VanDerWaalsContact O-CG 3.29Å; A108-L112 WeakPolarHBondContact O-CG 3.18Å; A108-L112 PolarHBondContact O-N 2.84Å
109V92.8Very high93.5Very high91 Ų9180.7 Ų80.755%0.55244%0.437SS*.Hα-helixtrans-63.4-46.7174.8175.20000110.7C105 T106 L107 F111 L112 F113C105-V109 WeakPolarHBondContact O-CG2 3.45Å; C105-V109 PolarHBondContact O-N 3.24Å; T106-V109 PolarHBondContact O-N 2.88Å; L107-V109 VanDerWaalsContact C-N 3.33Å; L107-V109 PolarHBondContact O-N 2.9Å; V109-F111 VanDerWaalsContact C-N 3.31Å; V109-F111 PolarHBondContact O-N 3.12Å; V109-L112 PolarHBondContact O-N 2.85Å; V109-F113 HydrophobicContact CG1-CB 4.43Å; V109-F113 WeakPolarHBondContact O-CA 3.39Å; V109-F113 WeakPolarHBondContact O-CB 3.34Å; V109-F113 PolarHBondContact O-N 2.74Å
110F92.6Very high93.4Very high103 Ų10380.3 Ų80.345%0.45244%0.436SS..Hα-helixtrans-59.2-38.8-179.2177.5-95.9000113.7T106 L107 R115 Y153T106-F110 VanDerWaalsContact O-CB 3.28Å; T106-F110 WeakPolarHBondContact O-CB 3.43Å; T106-F110 PolarHBondContact O-N 2.86Å; L107-F110 PolarHBondContact O-N 2.82Å; F110-R115 VanDerWaalsContact CZ-NH2 3.27Å; F110-Y153 HydrophobicContact CD1-CE2 4.35Å; F110-Y153 AromaticContact CE1-CE2 3.73Å; F110-Y153 HydrophobicContact CE1-CE2 3.73Å; F110-Y153 AromaticContact CE1-CZ 3.93Å; F110-Y153 HydrophobicContact CZ-CE2 4.14Å
111F91.5Very high93.1Very high95 Ų9577.1 Ų77.142%0.41742%0.417SS..Hα-helixtrans-82-33.2179.8-71.9-63.5000113.8L107 V109 Y153L107-F111 HydrophobicContact CB-CD2 4.35Å; L107-F111 HydrophobicContact CB-CE2 4.29Å; L107-F111 HydrophobicContact CD2-CE2 4.06Å; L107-F111 WeakPolarHBondContact O-CD2 3.23Å; L107-F111 PolarHBondContact O-N 2.87Å; V109-F111 VanDerWaalsContact C-N 3.31Å; V109-F111 PolarHBondContact O-N 3.12Å; F111-Y153 HydrophobicContact CD1-CD1 4.23Å; F111-Y153 AromaticContact CD1-CD2 3.82Å; F111-Y153 HydrophobicContact CD1-CD2 3.82Å; F111-Y153 HydrophobicContact CD1-CE2 4.33Å; F111-Y153 AromaticContact CD1-CG 3.76Å; F111-Y153 HydrophobicContact CD1-CG 3.76Å; F111-Y153 HydrophobicContact CE1-CD1 4.34Å; F111-Y153 HydrophobicContact CE1-CD2 4.5Å; F111-Y153 HydrophobicContact CE1-CG 4.32Å
112L89.6Confident92.7Very high100 Ų10076.2 Ų76.252%0.52441%0.409SS..Hα-helixtrans-95.4-16.2-176-63.3173.8000113.7A108 V109 F233A108-L112 VanDerWaalsContact O-CB 3.22Å; A108-L112 WeakPolarHBondContact O-CB 3.36Å; A108-L112 VanDerWaalsContact O-CG 3.29Å; A108-L112 WeakPolarHBondContact O-CG 3.18Å; A108-L112 PolarHBondContact O-N 2.84Å; V109-L112 PolarHBondContact O-N 2.85Å; L112-F233 HydrophobicContact CD2-CE2 4.17Å; L112-F233 HydrophobicContact CD2-CZ 3.86Å
113F90.3Very high92.2Very high140 Ų14071.6 Ų71.661%0.61439%0.387SS*.SBendtrans-66.5125.2177.9-167.4-95.9000109.4V109 R115V109-F113 HydrophobicContact CG1-CB 4.43Å; V109-F113 WeakPolarHBondContact O-CA 3.39Å; V109-F113 WeakPolarHBondContact O-CB 3.34Å; V109-F113 PolarHBondContact O-N 2.74Å; F113-R115 PolarHBondContact O-N 2.81Å
114P89.1Confident91.8Very high58 Ų5868 Ų6838%0.37737%0.369SS..PPolyproline II helixtrans-64.6125.2-173.525.8-33.7000110.1Y154 Y232P114-Y154 WeakPolarHBondContact CA-OH 3.39Å; P114-Y232 HydrophobicContact CB-CE2 4.11Å
115R90.7Very high91.5Very high88 Ų8867.8 Ų67.833%0.33236%0.364SS..PPolyproline II helixtrans-93.9156.8168.2-68.7-174.1171.5-172.22.9109.7F110 F113 N151 N152 Y153F110-R115 VanDerWaalsContact CZ-NH2 3.27Å; F113-R115 PolarHBondContact O-N 2.81Å; R115-N151 HydrophobicContact CB-CB 4.41Å; R115-N151 WeakPolarHBondContact CD-O 3.47Å; R115-N152 PolarHBondContact N-OD1 2.93Å; R115-N152 PolarHBondContact O-ND2 2.76Å; R115-N152 VanDerWaalsContact O-ND2 3.08Å; R115-N152 PolarHBondContact O-OD1 3.24Å; R115-Y153 PolarHBondContact NH1-OH 3.27Å; R115-Y153 VanDerWaalsContact NH1-OH 3.16Å; R115-Y153 PolarHBondContact NH2-OH 2.83Å; R115-Y153 VanDerWaalsContact NH2-OH 3.11Å
116S87.4Confident91.3Very high70 Ų7065.1 Ų65.149%0.4935%0.345SS..PPolyproline II helixtrans-59.5143.8179.4590000111.7N151S116-N151 WeakPolarHBondContact O-CB 3.39Å
117I92.4Very high91.2Very high9 Ų961 Ų615%0.04632%0.32CS..EExtended strand (participates in β ladder)trans-102.1119.3169.8-62.8164.1000106.5I148 V156 T230 Y232I117-I148 HydrophobicContact CG2-CG2 3.9Å; I117-V156 HydrophobicContact CD1-CG1 3.96Å; I117-V156 HydrophobicContact CD1-CG2 4.48Å; I117-T230 HydrophobicContact CD1-CG2 4.04Å; I117-T230 VanDerWaalsContact CD1-OG1 3.25Å; I117-T230 WeakPolarHBondContact CD1-OG1 3.14Å; I117-T230 HydrophobicContact CG2-CG2 4.43Å; I117-Y232 HydrophobicContact CD1-CD1 4.47Å; I117-Y232 HydrophobicContact CD1-CE1 4.19Å
118D93.1Very high91.2Very high73 Ų7363.2 Ų63.239%0.3932%0.324SS..EExtended strand (participates in β ladder)trans-92.3122.8-176.8-59.7-38.5000109.1T149 N151D118-T149 PolarHBondContact N-O 2.88Å; D118-T149 VanDerWaalsContact N-O 3.08Å; D118-T149 PolarHBondContact O-N 2.84Å; D118-N151 PolarHBondContact OD2-ND2 3.08Å
119V93.6Very high91.2Very high20 Ų2061.9 Ų61.912%0.12131%0.311CS..EExtended strand (participates in β ladder)trans-107.8117.2173.3-1800000107L146 V228 V239 Q241V119-L146 HydrophobicContact CG1-CD2 3.84Å; V119-V228 HydrophobicContact CB-CG2 4.45Å; V119-V228 HydrophobicContact CG1-CG2 3.78Å; V119-V228 HydrophobicContact CG2-CB 4.04Å; V119-V228 HydrophobicContact CG2-CG1 4.48Å; V119-V228 HydrophobicContact CG2-CG2 3.81Å; V119-V239 HydrophobicContact CB-CG1 4.23Å; V119-V239 HydrophobicContact CG2-CB 4.08Å; V119-V239 HydrophobicContact CG2-CG1 3.9Å; V119-Q241 PolarHBondContact O-OE1 3.11Å; V119-Q241 VanDerWaalsContact O-OE1 3.11Å
120N92.7Very high91.3Very high95 Ų9560.6 Ų60.651%0.50831%0.306SS..EExtended strand (participates in β ladder)trans-119.5128.5177.6-167.425.8000110.8N147N120-N147 PolarHBondContact N-O 3.02Å; N120-N147 PolarHBondContact O-N 2.98Å
121Y90.9Very high91.3Very high34 Ų3459.6 Ų59.613%0.13330%0.3CS..EExtended strand (participates in β ladder)trans-79.4124.7174.9178.5-97.5000110.2G123 V124 N144 L146 M224 I226 M243 Q245Y121-G123 VanDerWaalsContact CE1-CA 3.44Å; Y121-G123 VanDerWaalsContact CZ-C 3.44Å; Y121-G123 VanDerWaalsContact CZ-CA 3.47Å; Y121-G123 VanDerWaalsContact OH-CA 3.32Å; Y121-G123 WeakPolarHBondContact OH-CA 3.4Å; Y121-G123 PolarHBondContact OH-O 2.83Å; Y121-V124 PolarHBondContact OH-N 3.01Å; Y121-N144 HydrophobicContact CE2-CB 4.04Å; Y121-N144 WeakPolarHBondContact CE2-OD1 3.37Å; Y121-N144 PolarHBondContact OH-OD1 2.79Å; Y121-L146 HydrophobicContact CD2-CD2 4.29Å; Y121-M224 HydrophobicContact CD2-CE 4.29Å; Y121-M224 HydrophobicContact CE1-CE 4.14Å; Y121-M224 HydrophobicContact CE2-CE 3.46Å; Y121-M224 VanDerWaalsContact CE2-CE 3.46Å; Y121-M224 WeakPolarHBondContact OH-CE 3.41Å; Y121-I226 HydrophobicContact CD2-CD1 3.92Å; Y121-M243 HydrophobicContact CD1-CG 4.11Å; Y121-M243 HydrophobicContact CD1-SD 4.18Å; Y121-M243 HydrophobicContact CD2-SD 3.71Å; Y121-M243 HydrophobicContact CE1-CG 4.41Å; Y121-M243 HydrophobicContact CE2-SD 4.35Å; Y121-M243 HydrophobicContact CG-CG 4.16Å; Y121-M243 HydrophobicContact CG-SD 3.62Å; Y121-Q245 VanDerWaalsContact OH-CD 3.22Å; Y121-Q245 PolarHBondContact OH-NE2 2.77Å; Y121-Q245 PolarHBondContact OH-OE1 3.13Å
122V88.8Confident91.5Very high54 Ų5456.8 Ų56.833%0.32729%0.289SS..EExtended strand (participates in β ladder)trans-89.7-47.7-177.3-178.10000111S145 N147V122-S145 WeakPolarHBondContact CB-O 3.37Å; V122-S145 PolarHBondContact N-O 2.78Å; V122-N147 HydrophobicContact CG2-CB 4.05Å; V122-N147 WeakPolarHBondContact CG2-OD1 2.95Å
123G86.7Confident91.6Very high8 Ų859.1 Ų59.18%0.08230%0.298CS..EExtended strand (participates in β ladder)trans158.9172.2-174.200000114.3Y121 N144 S145Y121-G123 VanDerWaalsContact CE1-CA 3.44Å; Y121-G123 VanDerWaalsContact CZ-C 3.44Å; Y121-G123 VanDerWaalsContact CZ-CA 3.47Å; Y121-G123 VanDerWaalsContact OH-CA 3.32Å; Y121-G123 WeakPolarHBondContact OH-CA 3.4Å; Y121-G123 PolarHBondContact OH-O 2.83Å; G123-N144 WeakPolarHBondContact O-CA 3.44Å; G123-S145 PolarHBondContact O-N 2.83Å
124V88.6Confident91.6Very high11 Ų1157.4 Ų57.47%0.06730%0.303CS..EExtended strand (participates in β ladder)trans-78.8125.6168.7160.20000106.6Y121 V127 V142 N144 Q245Y121-V124 PolarHBondContact OH-N 3.01Å; V124-V127 HydrophobicContact CG1-CG2 3.6Å; V124-V142 HydrophobicContact CG1-CG1 4.5Å; V124-V142 HydrophobicContact CG2-CG1 3.74Å; V124-N144 WeakPolarHBondContact CG2-OD1 3.45Å; V124-Q245 HydrophobicContact CG2-CG 4.38Å
125K90.2Very high91.7Very high97 Ų9761 Ų6142%0.42231%0.313SS..EExtended strand (participates in β ladder)trans-85.1-41.6175.3-172177.6-172.31780111.1T143 D192 A255K125-T143 HydrophobicContact CB-CG2 4.29Å; K125-T143 HydrophobicContact CD-CG2 4.43Å; K125-T143 PolarHBondContact N-O 3.26Å; K125-D192 IonicContact NZ-OD2 2.63Å; K125-D192 PolarHBondContact NZ-OD2 3.17Å; K125-A255 CarbonylContact C-O 3.55Å; K125-A255 PolarHBondContact O-N 2.82Å
126S92.1Very high91.9Very high11 Ų1162.1 Ų62.18%0.07732%0.317CS..EExtended strand (participates in β ladder)trans-159.8152.3178.864.70000112.4T143 T253S126-T143 PolarHBondContact N-O 3.1Å; S126-T143 PolarHBondContact O-N 2.9Å; S126-T143 VanDerWaalsContact OG-CB 3.3Å; S126-T143 WeakPolarHBondContact OG-CB 3.32Å; S126-T143 PolarHBondContact OG-OG1 3.24Å; S126-T253 CarbonylContact C-O 3.55Å; S126-T253 VanDerWaalsContact CA-O 3.23Å; S126-T253 WeakPolarHBondContact CA-O 3.47Å
127V93.1Very high92.2Very high3 Ų359.9 Ų59.92%0.01830%0.299CS..EExtended strand (participates in β ladder)trans-127.6121.1170.5-172.40000107.6V124 V129 L140 N141 V142 V247 N252 T253V124-V127 HydrophobicContact CG1-CG2 3.6Å; V127-V129 HydrophobicContact CG1-CG2 4.13Å; V127-L140 HydrophobicContact CG1-CD2 4.37Å; V127-N141 WeakPolarHBondContact CA-O 3.41Å; V127-V142 HydrophobicContact CG1-CG2 4.34Å; V127-V142 HydrophobicContact CG2-CG1 4.4Å; V127-V247 HydrophobicContact CB-CG1 4.43Å; V127-V247 HydrophobicContact CG1-CG1 3.71Å; V127-V247 HydrophobicContact CG2-CG1 3.93Å; V127-N252 WeakPolarHBondContact O-CA 3.25Å; V127-T253 WeakPolarHBondContact CB-OG1 3.38Å; V127-T253 PolarHBondContact N-O 3.45Å; V127-T253 PolarHBondContact O-N 2.98Å
128Y94.6Very high92.3Very high120 Ų12059.5 Ų59.547%0.47130%0.297SS..EExtended strand (participates in β ladder)trans-103.4131.4169.3-65.6-83000109.8L140 N141 N252Y128-L140 CarbonylContact O-C 3.48Å; Y128-L140 WeakPolarHBondContact O-CA 3.36Å; Y128-N141 PolarHBondContact N-O 2.89Å; Y128-N141 PolarHBondContact O-N 3.41Å; Y128-N252 WeakPolarHBondContact CA-OD1 3.32Å
129V94.4Very high92.4Very high19 Ų1959.8 Ų59.812%0.11529%0.293CS..EExtended strand (participates in β ladder)trans-115.5133.3-174.5-174.70000109.3V127 Y131 V138 Y139 L140 C249 G251 N252V127-V129 HydrophobicContact CG1-CG2 4.13Å; V129-Y131 HydrophobicContact CG1-CE1 3.78Å; V129-Y131 HydrophobicContact CG1-CE2 3.81Å; V129-Y131 WeakPolarHBondContact CG1-OH 3.4Å; V129-V138 HydrophobicContact CG1-CG1 4.25Å; V129-Y139 WeakPolarHBondContact CA-O 2.93Å; V129-L140 HydrophobicContact CB-CD2 4.16Å; V129-L140 HydrophobicContact CG1-CD2 3.88Å; V129-L140 HydrophobicContact CG2-CD2 3.66Å; V129-C249 WeakPolarHBondContact CG1-O 3.49Å; V129-G251 WeakPolarHBondContact CG2-O 3.34Å; V129-N252 PolarHBondContact N-OD1 2.96Å
130S94.5Very high92.5Very high64 Ų6458.9 Ų58.945%0.44829%0.288SS..EExtended strand (participates in β ladder)trans-140.1157.7168.371.20000111.4Y139S130-Y139 PolarHBondContact N-O 2.86Å; S130-Y139 PolarHBondContact O-N 2.77Å; S130-Y139 WeakPolarHBondContact OG-CB 3.48Å
131Y94Very high92.6Very high83 Ų8357.1 Ų57.133%0.32528%0.279SS..EExtended strand (participates in β ladder)trans-129.9142.9-169.2-56.6-75.9000111.4V129 V138 Y207 C210 T211 C249 G250V129-Y131 HydrophobicContact CG1-CE1 3.78Å; V129-Y131 HydrophobicContact CG1-CE2 3.81Å; V129-Y131 WeakPolarHBondContact CG1-OH 3.4Å; Y131-V138 HydrophobicContact CD1-CB 4.39Å; Y131-V138 HydrophobicContact CD1-CG1 4Å; Y131-V138 HydrophobicContact CD1-CG2 4.03Å; Y131-V138 HydrophobicContact CE1-CG1 3.79Å; Y131-V138 HydrophobicContact CE1-CG2 4.17Å; Y131-Y207 HydrophobicContact CD1-CE2 4.4Å; Y131-C210 HydrophobicContact CE1-CB 3.99Å; Y131-C210 PolarHBondContact OH-O 3.41Å; Y131-T211 HydrophobicContact CD1-CG2 3.85Å; Y131-T211 HydrophobicContact CE1-CG2 3.84Å; Y131-T211 HydrophobicContact CG-CG2 4.27Å; Y131-C249 PolarHBondContact OH-O 3.37Å; Y131-G250 WeakPolarHBondContact OH-CA 3.36Å; Y131-G250 PolarHBondContact OH-O 2.92Å
132D94.1Very high92.7Very high36 Ų3655.6 Ų55.619%0.19327%0.273CS..EExtended strand (participates in β ladder)trans-115.3105.4165.4-175-17.7000109.2S134 K135 R136 I137 Y139D132-S134 VanDerWaalsContact C-N 3.32Å; D132-S134 PolarHBondContact O-N 2.85Å; D132-S134 WeakPolarHBondContact OD1-CB 3.38Å; D132-S134 PolarHBondContact OD1-N 2.8Å; D132-S134 PolarHBondContact OD1-OG 2.87Å; D132-K135 PolarHBondContact OD1-N 2.78Å; D132-K135 WeakPolarHBondContact OD2-CD 3.22Å; D132-R136 WeakPolarHBondContact O-CA 3.42Å; D132-R136 PolarHBondContact O-N 2.89Å; D132-I137 HydrophobicContact CB-CB 4.31Å; D132-I137 PolarHBondContact N-O 2.57Å; D132-I137 PolarHBondContact O-N 2.92Å; D132-I137 VanDerWaalsContact O-N 3.11Å; D132-Y139 HydrophobicContact CB-CE2 4.13Å
133Q91.5Very high92.9Very high149 Ų14954.1 Ų54.170%0.69626%0.264SS*.THydrogen-bonded Turntrans-68.3-31-179.6-172.6171.91600112.8Y207Q133-Y207 WeakPolarHBondContact CA-OH 3.28Å; Q133-Y207 WeakPolarHBondContact CB-OH 3.21Å; Q133-Y207 WeakPolarHBondContact CG-OH 3.3Å
134S92.1Very high93.2Very high104 Ų10453.7 Ų53.773%0.72726%0.26SS*.THydrogen-bonded Turntrans-70.3-36.4-177.1700000111.9D132D132-S134 VanDerWaalsContact C-N 3.32Å; D132-S134 PolarHBondContact O-N 2.85Å; D132-S134 WeakPolarHBondContact OD1-CB 3.38Å; D132-S134 PolarHBondContact OD1-N 2.8Å; D132-S134 PolarHBondContact OD1-OG 2.87Å
135K91.2Very high93.3Very high134 Ų13453.6 Ų53.658%0.58326%0.259SS*.THydrogen-bonded Turntrans-104-3.2-178.1-61.8179.4-172.3169.90113.9D132 I137D132-K135 PolarHBondContact OD1-N 2.78Å; D132-K135 WeakPolarHBondContact OD2-CD 3.22Å; K135-I137 VanDerWaalsContact C-N 3.31Å; K135-I137 HydrophobicContact CB-CD1 3.6Å; K135-I137 HydrophobicContact CB-CG1 3.76Å; K135-I137 HydrophobicContact CD-CD1 4Å; K135-I137 HydrophobicContact CG-CD1 4.46Å; K135-I137 PolarHBondContact O-N 2.63Å
136R93.1Very high93.4Very high111 Ų11149 Ų4942%0.41924%0.239SC..THydrogen-bonded Turntrans55.443.9-174.4-59.2-70.1-168149.911.2112.3D132 Y207 D208D132-R136 WeakPolarHBondContact O-CA 3.42Å; D132-R136 PolarHBondContact O-N 2.89Å; R136-Y207 HydrophobicContact CB-CD1 4.44Å; R136-Y207 HydrophobicContact CB-CD2 4.46Å; R136-Y207 HydrophobicContact CB-CG 4.08Å; R136-Y207 WeakPolarHBondContact O-CB 3.39Å; R136-D208 IonicContact CZ-OD1 3.59Å; R136-D208 IonicContact NH1-OD1 2.65Å; R136-D208 PolarHBondContact NH1-OD1 2.98Å
137I94.8Very high93.5Very high22 Ų2249.8 Ų49.811%0.11324%0.243CC..EExtended strand (participates in β ladder)trans-108140.4-178.4-61.4174000109.9D132 K135 Y139 T198 A200D132-I137 HydrophobicContact CB-CB 4.31Å; D132-I137 PolarHBondContact N-O 2.57Å; D132-I137 PolarHBondContact O-N 2.92Å; D132-I137 VanDerWaalsContact O-N 3.11Å; K135-I137 VanDerWaalsContact C-N 3.31Å; K135-I137 HydrophobicContact CB-CD1 3.6Å; K135-I137 HydrophobicContact CB-CG1 3.76Å; K135-I137 HydrophobicContact CD-CD1 4Å; K135-I137 HydrophobicContact CG-CD1 4.46Å; K135-I137 PolarHBondContact O-N 2.63Å; I137-Y139 HydrophobicContact CB-CE2 4.42Å; I137-Y139 HydrophobicContact CG2-CD1 4.2Å; I137-Y139 HydrophobicContact CG2-CD2 4.32Å; I137-Y139 HydrophobicContact CG2-CE1 3.76Å; I137-Y139 HydrophobicContact CG2-CE2 3.88Å; I137-Y139 HydrophobicContact CG2-CG 4.46Å; I137-T198 HydrophobicContact CG2-CG2 3.6Å; I137-A200 HydrophobicContact CD1-CB 4.23Å; I137-A200 HydrophobicContact CG1-CB 3.97Å; I137-A200 HydrophobicContact CG2-CB 4.31Å
138V94.4Very high93.6Very high1 Ų149.7 Ų49.71%0.00624%0.242CC..EExtended strand (participates in β ladder)trans-111.4126.2170.9-172.10000108.9V129 Y131 L140 I199 Y207 C210V129-V138 HydrophobicContact CG1-CG1 4.25Å; Y131-V138 HydrophobicContact CD1-CB 4.39Å; Y131-V138 HydrophobicContact CD1-CG1 4Å; Y131-V138 HydrophobicContact CD1-CG2 4.03Å; Y131-V138 HydrophobicContact CE1-CG1 3.79Å; Y131-V138 HydrophobicContact CE1-CG2 4.17Å; V138-L140 HydrophobicContact CG1-CD2 4Å; V138-L140 HydrophobicContact CG1-CG 4.2Å; V138-I199 HydrophobicContact CB-CB 4.31Å; V138-I199 PolarHBondContact N-O 2.88Å; V138-I199 VanDerWaalsContact N-O 3.15Å; V138-I199 PolarHBondContact O-N 3.33Å; V138-Y207 HydrophobicContact CG2-CD2 4.16Å; V138-C210 HydrophobicContact CG2-CB 4.24Å
139Y95.3Very high93.6Very high79 Ų7945.7 Ų45.731%0.3123%0.23SC..EExtended strand (participates in β ladder)trans-105.4131.5173.2-57.1-77.8000109.7V129 S130 D132 I137 T197 T198V129-Y139 WeakPolarHBondContact CA-O 2.93Å; S130-Y139 PolarHBondContact N-O 2.86Å; S130-Y139 PolarHBondContact O-N 2.77Å; S130-Y139 WeakPolarHBondContact OG-CB 3.48Å; D132-Y139 HydrophobicContact CB-CE2 4.13Å; I137-Y139 HydrophobicContact CB-CE2 4.42Å; I137-Y139 HydrophobicContact CG2-CD1 4.2Å; I137-Y139 HydrophobicContact CG2-CD2 4.32Å; I137-Y139 HydrophobicContact CG2-CE1 3.76Å; I137-Y139 HydrophobicContact CG2-CE2 3.88Å; I137-Y139 HydrophobicContact CG2-CG 4.46Å; Y139-T197 WeakPolarHBondContact CA-O 3.48Å; Y139-T198 HydrophobicContact CD1-CG2 3.86Å; Y139-T198 HydrophobicContact CE1-CG2 3.68Å
140L94.6Very high93.7Very high1 Ų144.8 Ų44.81%0.00523%0.225CC..EExtended strand (participates in β ladder)trans-127.1120.5-179.5-57.1171.6000108.5V127 Y128 V129 V138 V142 T197 I199 I220 V247 C249V127-L140 HydrophobicContact CG1-CD2 4.37Å; Y128-L140 CarbonylContact O-C 3.48Å; Y128-L140 WeakPolarHBondContact O-CA 3.36Å; V129-L140 HydrophobicContact CB-CD2 4.16Å; V129-L140 HydrophobicContact CG1-CD2 3.88Å; V129-L140 HydrophobicContact CG2-CD2 3.66Å; V138-L140 HydrophobicContact CG1-CD2 4Å; V138-L140 HydrophobicContact CG1-CG 4.2Å; L140-V142 HydrophobicContact CB-CG2 4.27Å; L140-T197 HydrophobicContact CB-CG2 4.46Å; L140-T197 PolarHBondContact N-O 2.9Å; L140-T197 WeakPolarHBondContact O-CA 3.33Å; L140-T197 VanDerWaalsContact O-CB 3.22Å; L140-T197 WeakPolarHBondContact O-CB 3.35Å; L140-T197 PolarHBondContact O-N 2.8Å; L140-I199 HydrophobicContact CD1-CD1 3.7Å; L140-I199 HydrophobicContact CD1-CG1 4.44Å; L140-I220 HydrophobicContact CD1-CD1 3.94Å; L140-V247 HydrophobicContact CD1-CG1 4.48Å; L140-C249 HydrophobicContact CD1-CB 4.29Å; L140-C249 HydrophobicContact CD2-CB 4.05Å
141N95Very high93.6Very high59 Ų5944 Ų4432%0.31622%0.216SC..EExtended strand (participates in β ladder)trans-101.499.8169.3-72.9-18000108.2V127 Y128 M194V127-N141 WeakPolarHBondContact CA-O 3.41Å; Y128-N141 PolarHBondContact N-O 2.89Å; Y128-N141 PolarHBondContact O-N 3.41Å; N141-M194 HydrophobicContact CB-CG 4.22Å; N141-M194 HydrophobicContact CB-SD 3.86Å
142V93.4Very high93.6Very high2 Ų240.1 Ų40.11%0.01220%0.201CC..EExtended strand (participates in β ladder)trans-95.2109.4-176.7-170.80000108.7V124 V127 L140 N144 M194 V195 V247V124-V142 HydrophobicContact CG1-CG1 4.5Å; V124-V142 HydrophobicContact CG2-CG1 3.74Å; V127-V142 HydrophobicContact CG1-CG2 4.34Å; V127-V142 HydrophobicContact CG2-CG1 4.4Å; L140-V142 HydrophobicContact CB-CG2 4.27Å; V142-N144 WeakPolarHBondContact CG1-ND2 3.46Å; V142-M194 WeakPolarHBondContact O-CA 3.4Å; V142-V195 PolarHBondContact N-O 2.81Å; V142-V195 VanDerWaalsContact N-O 3.1Å; V142-V195 PolarHBondContact O-N 2.8Å; V142-V247 HydrophobicContact CG1-CG2 4.44Å; V142-V247 HydrophobicContact CG2-CG1 4.26Å
143T93.4Very high93.6Very high22 Ų2242.1 Ų42.114%0.13521%0.206CC..EExtended strand (participates in β ladder)trans-93.3126.4174.1-52.80000109.6K125 S126 Y193K125-T143 HydrophobicContact CB-CG2 4.29Å; K125-T143 HydrophobicContact CD-CG2 4.43Å; K125-T143 PolarHBondContact N-O 3.26Å; S126-T143 PolarHBondContact N-O 3.1Å; S126-T143 PolarHBondContact O-N 2.9Å; S126-T143 VanDerWaalsContact OG-CB 3.3Å; S126-T143 WeakPolarHBondContact OG-CB 3.32Å; S126-T143 PolarHBondContact OG-OG1 3.24Å; T143-Y193 WeakPolarHBondContact CA-O 3.49Å
144N92.1Very high93.7Very high0 Ų036.1 Ų36.10%018%0.177CC..EExtended strand (participates in β ladder)trans-125.6155-175.3-74.1-74.4000110.9Y121 G123 V124 V142 D192 Y193 M224Y121-N144 HydrophobicContact CE2-CB 4.04Å; Y121-N144 WeakPolarHBondContact CE2-OD1 3.37Å; Y121-N144 PolarHBondContact OH-OD1 2.79Å; G123-N144 WeakPolarHBondContact O-CA 3.44Å; V124-N144 WeakPolarHBondContact CG2-OD1 3.45Å; V142-N144 WeakPolarHBondContact CG1-ND2 3.46Å; N144-D192 CarbonylContact O-C 3.6Å; N144-D192 VanDerWaalsContact O-CA 3.3Å; N144-D192 WeakPolarHBondContact O-CA 3.2Å; N144-Y193 HydrophobicContact CB-CD1 4.09Å; N144-Y193 HydrophobicContact CB-CD2 4.46Å; N144-Y193 HydrophobicContact CB-CE1 3.34Å; N144-Y193 HydrophobicContact CB-CE2 3.84Å; N144-Y193 WeakPolarHBondContact CB-OH 3.19Å; N144-Y193 PolarHBondContact N-O 2.91Å; N144-Y193 WeakPolarHBondContact O-CD1 3.5Å; N144-Y193 PolarHBondContact O-N 3.15Å; N144-M224 PolarHBondContact ND2-SD 3.25Å; N144-M224 VanDerWaalsContact ND2-SD 3.44Å
145S92.2Very high93.7Very high8 Ų834.4 Ų34.46%0.05617%0.165CC..EExtended strand (participates in β ladder)trans-116.6134.3176.1-63.20000111.3V122 G123 D192V122-S145 WeakPolarHBondContact CB-O 3.37Å; V122-S145 PolarHBondContact N-O 2.78Å; G123-S145 PolarHBondContact O-N 2.83Å; S145-D192 WeakPolarHBondContact CB-OD1 3.3Å; S145-D192 PolarHBondContact OG-OD1 2.85Å
146L92.6Very high93.9Very high0 Ų028.1 Ų28.10%014%0.138CC..EExtended strand (participates in β ladder)trans-120.3136.7175.3-77.3155.7000110V119 Y121 I161 Q190 I191 Y193 I226V119-L146 HydrophobicContact CG1-CD2 3.84Å; Y121-L146 HydrophobicContact CD2-CD2 4.29Å; L146-I161 HydrophobicContact CD1-CD1 4.48Å; L146-I161 HydrophobicContact CD1-CG2 4.37Å; L146-Q190 CarbonylContact O-C 3.58Å; L146-Q190 VanDerWaalsContact O-CA 3.28Å; L146-Q190 WeakPolarHBondContact O-CA 3.44Å; L146-I191 PolarHBondContact N-O 2.86Å; L146-I191 PolarHBondContact O-N 3.11Å; L146-Y193 HydrophobicContact CB-CE1 4.41Å; L146-Y193 HydrophobicContact CD1-CD1 3.5Å; L146-Y193 HydrophobicContact CD1-CE1 3.1Å; L146-Y193 HydrophobicContact CG-CD1 4.14Å; L146-Y193 HydrophobicContact CG-CE1 3.47Å; L146-Y193 VanDerWaalsContact CG-CE1 3.47Å; L146-I226 HydrophobicContact CD1-CD1 4.3Å; L146-I226 HydrophobicContact CD1-CG2 3.73Å; L146-I226 HydrophobicContact CD2-CD1 3.89Å; L146-I226 HydrophobicContact CD2-CG2 4.33Å; L146-I226 HydrophobicContact CG-CD1 4.41Å
147N94.1Very high93.9Very high29 Ų2926.5 Ų26.516%0.15514%0.137CC..EExtended strand (participates in β ladder)trans-98.9123.6165.3-75.4-5.1000108.7N120 V122 M188 Q190N120-N147 PolarHBondContact N-O 3.02Å; N120-N147 PolarHBondContact O-N 2.98Å; V122-N147 HydrophobicContact CG2-CB 4.05Å; V122-N147 WeakPolarHBondContact CG2-OD1 2.95Å; N147-M188 HydrophobicContact CB-CG 4.42Å; N147-M188 HydrophobicContact CB-SD 4.08Å; N147-Q190 VanDerWaalsContact OD1-CB 3.27Å; N147-Q190 WeakPolarHBondContact OD1-CB 3.43Å; N147-Q190 VanDerWaalsContact OD1-CG 3.23Å; N147-Q190 WeakPolarHBondContact OD1-CG 3.35Å
148I94.5Very high94Very high0 Ų025.5 Ų25.50%013%0.133CC..EExtended strand (participates in β ladder)trans-112.8117.8174.5-51.8-177.5000107.3I117 V158 I161 I183 M188 K189 I191 V228I117-I148 HydrophobicContact CG2-CG2 3.9Å; I148-V158 HydrophobicContact CD1-CG1 4.31Å; I148-V158 HydrophobicContact CD1-CG2 4.37Å; I148-I161 HydrophobicContact CD1-CD1 4.21Å; I148-I183 HydrophobicContact CB-CD1 3.74Å; I148-I183 HydrophobicContact CG2-CD1 3.47Å; I148-I183 VanDerWaalsContact CG2-CD1 3.47Å; I148-M188 WeakPolarHBondContact O-CA 3.44Å; I148-K189 PolarHBondContact N-O 3.16Å; I148-K189 PolarHBondContact O-N 2.79Å; I148-I191 HydrophobicContact CD1-CD1 3.67Å; I148-I191 HydrophobicContact CG1-CD1 4.37Å; I148-V228 HydrophobicContact CD1-CG1 3.81Å; I148-V228 HydrophobicContact CD1-CG2 4.24Å
149T95.1Very high93.9Very high36 Ų3626.4 Ų26.422%0.22114%0.14CC..EExtended strand (participates in β ladder)trans-107.2124.6-179.8-51.40000109.5D118 N151 M188D118-T149 PolarHBondContact N-O 2.88Å; D118-T149 VanDerWaalsContact N-O 3.08Å; D118-T149 PolarHBondContact O-N 2.84Å; T149-N151 WeakPolarHBondContact CG2-OD1 3.38Å; T149-M188 HydrophobicContact CG2-CB 4.34Å; T149-M188 WeakPolarHBondContact OG1-CG 3.31Å
150N94.9Very high93.9Very high1 Ų123.9 Ų23.91%0.00513%0.132CC..EExtended strand (participates in β ladder)trans-96.4103.4175.817924000110.3N152 Y154 I183 S184 L186 D187N150-N152 PolarHBondContact O-N 3.49Å; N150-N152 WeakPolarHBondContact OD1-CB 3.23Å; N150-N152 PolarHBondContact OD1-N 2.93Å; N150-N152 VanDerWaalsContact OD1-N 3.08Å; N150-N152 PolarHBondContact OD1-ND2 3.08Å; N150-Y154 PolarHBondContact ND2-O 3.36Å; N150-I183 HydrophobicContact CB-CB 4.2Å; N150-I183 HydrophobicContact CB-CG2 3.6Å; N150-S184 PolarHBondContact ND2-O 2.92Å; N150-L186 CarbonylContact O-C 3.59Å; N150-L186 WeakPolarHBondContact O-CA 3.18Å; N150-L186 PolarHBondContact O-N 3.1Å; N150-L186 VanDerWaalsContact O-N 3.1Å; N150-D187 PolarHBondContact N-O 2.94Å; N150-D187 PolarHBondContact O-N 3.38Å
151N93.6Very high94Very high48 Ų4823.9 Ų23.926%0.25713%0.132SC..  trans-84.14.4177.3-61.8-19.4000113.5R115 S116 D118 T149 L186R115-N151 HydrophobicContact CB-CB 4.41Å; R115-N151 WeakPolarHBondContact CD-O 3.47Å; S116-N151 WeakPolarHBondContact O-CB 3.39Å; D118-N151 PolarHBondContact OD2-ND2 3.08Å; T149-N151 WeakPolarHBondContact CG2-OD1 3.38Å; N151-L186 WeakPolarHBondContact O-CD2 3.42Å
152N93.8Very high94Very high1 Ų122 Ų221%0.00512%0.123CC..SBendtrans-80.1156.1177.5-65.1-80.1000112.1R115 N150 Y154 P185 L186R115-N152 PolarHBondContact N-OD1 2.93Å; R115-N152 PolarHBondContact O-ND2 2.76Å; R115-N152 VanDerWaalsContact O-ND2 3.08Å; R115-N152 PolarHBondContact O-OD1 3.24Å; N150-N152 PolarHBondContact O-N 3.49Å; N150-N152 WeakPolarHBondContact OD1-CB 3.23Å; N150-N152 PolarHBondContact OD1-N 2.93Å; N150-N152 VanDerWaalsContact OD1-N 3.08Å; N150-N152 PolarHBondContact OD1-ND2 3.08Å; N152-Y154 HydrophobicContact CB-CD1 4.06Å; N152-Y154 HydrophobicContact CB-CD2 4.1Å; N152-Y154 HydrophobicContact CB-CE1 3.87Å; N152-Y154 HydrophobicContact CB-CE2 3.89Å; N152-Y154 HydrophobicContact CB-CG 4.2Å; N152-Y154 PolarHBondContact O-N 3.25Å; N152-Y154 PolarHBondContact OD1-OH 3.05Å; N152-P185 WeakPolarHBondContact O-CA 3.45Å; N152-L186 PolarHBondContact O-N 2.84Å
153Y93.6Very high94.1Very high78 Ų7822 Ų2231%0.30612%0.123SC..SBendtrans-84.77.1173.5-63.1-75.6000113.5F110 F111 R115 L186F110-Y153 HydrophobicContact CD1-CE2 4.35Å; F110-Y153 AromaticContact CE1-CE2 3.73Å; F110-Y153 HydrophobicContact CE1-CE2 3.73Å; F110-Y153 AromaticContact CE1-CZ 3.93Å; F110-Y153 HydrophobicContact CZ-CE2 4.14Å; F111-Y153 HydrophobicContact CD1-CD1 4.23Å; F111-Y153 AromaticContact CD1-CD2 3.82Å; F111-Y153 HydrophobicContact CD1-CD2 3.82Å; F111-Y153 HydrophobicContact CD1-CE2 4.33Å; F111-Y153 AromaticContact CD1-CG 3.76Å; F111-Y153 HydrophobicContact CD1-CG 3.76Å; F111-Y153 HydrophobicContact CE1-CD1 4.34Å; F111-Y153 HydrophobicContact CE1-CD2 4.5Å; F111-Y153 HydrophobicContact CE1-CG 4.32Å; R115-Y153 PolarHBondContact NH1-OH 3.27Å; R115-Y153 VanDerWaalsContact NH1-OH 3.16Å; R115-Y153 PolarHBondContact NH2-OH 2.83Å; R115-Y153 VanDerWaalsContact NH2-OH 3.11Å; Y153-L186 HydrophobicContact CD1-CD1 3.92Å; Y153-L186 HydrophobicContact CD1-CD2 4.46Å; Y153-L186 HydrophobicContact CD1-CG 4.28Å; Y153-L186 HydrophobicContact CE1-CD1 3.8Å; Y153-L186 HydrophobicContact CE1-CD2 4.34Å; Y153-L186 HydrophobicContact CE1-CG 4.43Å
154Y93.1Very high94.2Very high22 Ų2225.5 Ų25.59%0.08613%0.134CC..SBendtrans-129.4157.7176.752.6-97.1000110.1P114 N150 N152 V156 Y232 F233P114-Y154 WeakPolarHBondContact CA-OH 3.39Å; N150-Y154 PolarHBondContact ND2-O 3.36Å; N152-Y154 HydrophobicContact CB-CD1 4.06Å; N152-Y154 HydrophobicContact CB-CD2 4.1Å; N152-Y154 HydrophobicContact CB-CE1 3.87Å; N152-Y154 HydrophobicContact CB-CE2 3.89Å; N152-Y154 HydrophobicContact CB-CG 4.2Å; N152-Y154 PolarHBondContact O-N 3.25Å; N152-Y154 PolarHBondContact OD1-OH 3.05Å; Y154-V156 HydrophobicContact CD2-CG2 4.09Å; Y154-V156 HydrophobicContact CE2-CG2 3.94Å; Y154-Y232 HydrophobicContact CE2-CD1 4.49Å; Y154-Y232 AromaticContact CE2-CD2 3.81Å; Y154-Y232 HydrophobicContact CE2-CD2 3.81Å; Y154-Y232 AromaticContact CE2-CG 3.75Å; Y154-Y232 HydrophobicContact CE2-CG 3.75Å; Y154-Y232 WeakPolarHBondContact OH-CD2 3.28Å; Y154-F233 AromaticContact CD1-CE2 3.58Å; Y154-F233 HydrophobicContact CD1-CE2 3.58Å; Y154-F233 HydrophobicContact CD1-CZ 4.12Å; Y154-F233 HydrophobicContact CD2-CD2 4.3Å; Y154-F233 AromaticContact CD2-CE2 3.64Å; Y154-F233 HydrophobicContact CD2-CE2 3.64Å; Y154-F233 HydrophobicContact CD2-CZ 4.24Å; Y154-F233 HydrophobicContact CE1-CD2 4.49Å; Y154-F233 AromaticContact CE1-CE2 3.72Å; Y154-F233 HydrophobicContact CE1-CE2 3.72Å; Y154-F233 HydrophobicContact CE2-CD2 4.12Å; Y154-F233 AromaticContact CE2-CE2 3.79Å; Y154-F233 HydrophobicContact CE2-CE2 3.79Å; Y154-F233 AromaticContact CG-CE2 3.52Å; Y154-F233 HydrophobicContact CG-CE2 3.52Å; Y154-F233 AromaticContact CG-CZ 3.87Å; Y154-F233 HydrophobicContact CG-CZ 3.87Å; Y154-F233 AromaticContact CZ-CE2 3.8Å
155S93.8Very high94.4Very high68 Ų6825.6 Ų25.648%0.47613%0.134SC..  trans-71143.7178.6-540000111I183S155-I183 VanDerWaalsContact CA-O 3.3Å; S155-I183 WeakPolarHBondContact CA-O 3.06Å
156V94.4Very high94.5Very high2 Ų226.5 Ų26.51%0.01214%0.137CC..EExtended strand (participates in β ladder)trans-123.5137.8-179.9177.20000109.6I117 Y154 I183 T230 Y232I117-V156 HydrophobicContact CD1-CG1 3.96Å; I117-V156 HydrophobicContact CD1-CG2 4.48Å; Y154-V156 HydrophobicContact CD2-CG2 4.09Å; Y154-V156 HydrophobicContact CE2-CG2 3.94Å; V156-I183 PolarHBondContact N-O 3.03Å; V156-I183 PolarHBondContact O-N 3.08Å; V156-T230 HydrophobicContact CG1-CG2 4Å; V156-Y232 HydrophobicContact CG1-CD1 4.13Å; V156-Y232 HydrophobicContact CG2-CD1 4.29Å
157D94.1Very high94.6Very high77 Ų7727.7 Ų27.741%0.41214%0.143SC..EExtended strand (participates in β ladder)trans-95.7125.5179.8-62.3-29000110.6A159 T182 T230 V231D157-A159 PolarHBondContact O-N 2.64Å; D157-T182 WeakPolarHBondContact OD1-CB 3.47Å; D157-T182 WeakPolarHBondContact OD1-CG2 3.41Å; D157-T230 CarbonylContact O-C 3.59Å; D157-T230 VanDerWaalsContact O-CA 3.29Å; D157-T230 WeakPolarHBondContact O-CA 3.23Å; D157-V231 PolarHBondContact N-O 3.22Å; D157-V231 PolarHBondContact O-N 2.99Å
158V95Very high94.3Very high2 Ų230.7 Ų30.71%0.01217%0.166CC..EExtended strand (participates in β ladder)trans-84.293.7173.3-173.40000108.7I148 I161 I180 T181 I183 V228 T230I148-V158 HydrophobicContact CD1-CG1 4.31Å; I148-V158 HydrophobicContact CD1-CG2 4.37Å; V158-I161 HydrophobicContact CG1-CD1 4.44Å; V158-I161 HydrophobicContact CG1-CG1 4.2Å; V158-I180 HydrophobicContact CB-CB 4.36Å; V158-I180 HydrophobicContact CG1-CB 4.21Å; V158-I180 HydrophobicContact CG1-CD1 3.82Å; V158-I180 PolarHBondContact O-N 3.18Å; V158-I180 VanDerWaalsContact O-N 3.15Å; V158-T181 WeakPolarHBondContact CB-O 3.27Å; V158-T181 PolarHBondContact N-O 2.85Å; V158-I183 HydrophobicContact CG2-CD1 3.68Å; V158-I183 HydrophobicContact CG2-CG1 3.98Å; V158-V228 HydrophobicContact CG1-CG1 4.12Å; V158-T230 HydrophobicContact CG2-CG2 4.42Å
159A93.8Very high94Very high19 Ų1939.4 Ų39.416%0.15721%0.206CC..EExtended strand (participates in β ladder)trans-71.1-45.9-175.100000112.4D157 S178 N179 T229 V231D157-A159 PolarHBondContact O-N 2.64Å; A159-S178 CarbonylContact O-C 3.6Å; A159-S178 WeakPolarHBondContact O-CA 3.44Å; A159-N179 PolarHBondContact O-N 2.9Å; A159-T229 PolarHBondContact N-O 3.41Å; A159-V231 HydrophobicContact CB-CG2 3.66Å
160N95.6Very high93.9Very high27 Ų2740.5 Ų40.514%0.14421%0.213CC..EExtended strand (participates in β ladder)trans-149.7145.9179.7-59.6-77.5000112.4R176 I177 S178 T229N160-R176 PolarHBondContact ND2-NH2 3.3Å; N160-R176 VanDerWaalsContact ND2-NH2 3.12Å; N160-R176 PolarHBondContact OD1-NE 2.95Å; N160-I177 CarbonylContact C-O 3.58Å; N160-I177 WeakPolarHBondContact CA-O 3.34Å; N160-S178 WeakPolarHBondContact OD1-CA 3.21Å; N160-S178 WeakPolarHBondContact OD1-CB 3.28Å; N160-T229 PolarHBondContact N-O 3.34Å; N160-T229 PolarHBondContact O-N 2.8Å
161I95.2Very high93.9Very high1 Ų144.1 Ų44.11%0.00524%0.235CC..EExtended strand (participates in β ladder)trans-116.2122161-66.6172.6000107.5L146 I148 V158 R176 I177 I180 I191 I226 T227 V228L146-I161 HydrophobicContact CD1-CD1 4.48Å; L146-I161 HydrophobicContact CD1-CG2 4.37Å; I148-I161 HydrophobicContact CD1-CD1 4.21Å; V158-I161 HydrophobicContact CG1-CD1 4.44Å; V158-I161 HydrophobicContact CG1-CG1 4.2Å; I161-R176 CarbonylContact O-C 3.49Å; I161-R176 WeakPolarHBondContact O-CA 3.3Å; I161-I177 PolarHBondContact N-O 3.23Å; I161-I177 PolarHBondContact O-N 2.82Å; I161-I180 HydrophobicContact CB-CD1 3.69Å; I161-I180 HydrophobicContact CD1-CD1 3.39Å; I161-I180 HydrophobicContact CG1-CD1 3.27Å; I161-I191 HydrophobicContact CD1-CD1 4.33Å; I161-I191 HydrophobicContact CD1-CG2 3.91Å; I161-I226 HydrophobicContact CG2-CG2 4.24Å; I161-T227 WeakPolarHBondContact CA-O 3.28Å; I161-V228 HydrophobicContact CG1-CG1 4.35Å; I161-V228 HydrophobicContact CG1-CG2 4.25Å
162T95.6Very high93.9Very high19 Ų1942.4 Ų42.412%0.11723%0.226CC..EExtended strand (participates in β ladder)trans-107.6125170.7-56.50000108.1T175 I226 T227T162-T175 WeakPolarHBondContact CA-O 3.41Å; T162-I226 CarbonylContact O-C 3.59Å; T162-I226 WeakPolarHBondContact O-CA 3.29Å; T162-T227 PolarHBondContact N-O 2.88Å; T162-T227 PolarHBondContact O-N 2.79Å
163A95.8Very high94Very high2 Ų242.7 Ų42.72%0.01723%0.229CC..EExtended strand (participates in β ladder)trans-122139.2174.800000110.2K174 T175 Y193 V195 Q225 I226A163-K174 WeakPolarHBondContact O-CA 3.34Å; A163-T175 HydrophobicContact CB-CG2 3.88Å; A163-T175 PolarHBondContact N-O 2.84Å; A163-T175 PolarHBondContact O-N 3.12Å; A163-Y193 HydrophobicContact CB-CD2 3.77Å; A163-Y193 HydrophobicContact CB-CE2 3.46Å; A163-Y193 VanDerWaalsContact CB-CE2 3.46Å; A163-V195 HydrophobicContact CB-CG2 3.8Å; A163-Q225 CarbonylContact C-O 3.56Å; A163-Q225 WeakPolarHBondContact CA-O 3.47Å; A163-I226 HydrophobicContact CB-CG1 4.38Å
164R96.1Very high94.1Very high96 Ų9645.4 Ų45.436%0.36224%0.242SC..EExtended strand (participates in β ladder)trans-126.2136.6176-61175.9-172.8170.1-0108.3G173 K174 M224 Q225R164-G173 CarbonylContact C-O 3.51Å; R164-G173 WeakPolarHBondContact CA-O 3.49Å; R164-K174 HydrophobicContact CG-CG 4.27Å; R164-M224 CarbonylContact O-C 3.57Å; R164-M224 WeakPolarHBondContact O-CA 3.32Å; R164-Q225 HydrophobicContact CB-CB 4.34Å; R164-Q225 PolarHBondContact N-O 3Å; R164-Q225 PolarHBondContact O-N 2.93Å
165V95.6Very high94.2Very high2 Ų245.7 Ų45.71%0.01225%0.246CC..EExtended strand (participates in β ladder)trans-113.3127.8173.7179.90000106.7I172 G173 V195 T197 V222 M224V165-I172 HydrophobicContact CB-CG1 4.35Å; V165-I172 HydrophobicContact CG1-CD1 3.99Å; V165-I172 HydrophobicContact CG1-CG1 3.89Å; V165-I172 WeakPolarHBondContact O-CG1 3.43Å; V165-I172 PolarHBondContact O-N 3.03Å; V165-G173 PolarHBondContact N-O 3.47Å; V165-G173 PolarHBondContact O-N 2.95Å; V165-G173 VanDerWaalsContact O-N 3.12Å; V165-V195 HydrophobicContact CB-CG1 4.48Å; V165-V195 HydrophobicContact CG2-CB 3.86Å; V165-V195 HydrophobicContact CG2-CG1 3.66Å; V165-V195 HydrophobicContact CG2-CG2 4.13Å; V165-T197 HydrophobicContact CB-CG2 4.5Å; V165-T197 HydrophobicContact CG1-CG2 4.14Å; V165-V222 HydrophobicContact CG1-CB 3.83Å; V165-V222 HydrophobicContact CG1-CG1 4.11Å; V165-V222 HydrophobicContact CG1-CG2 4.13Å; V165-M224 HydrophobicContact CG2-CG 4.22Å
166Q94.9Very high94.3Very high27 Ų2750.1 Ų50.113%0.12625%0.253CS..EExtended strand (participates in β ladder)trans-121.5141.9-179.6-51.6-173.811.700110.2T170 V171 V222 M223Q166-T170 CarbonylContact C-O 3.57Å; Q166-T170 WeakPolarHBondContact CA-O 3.43Å; Q166-V171 HydrophobicContact CG-CG2 4Å; Q166-V222 CarbonylContact O-C 3.5Å; Q166-V222 WeakPolarHBondContact O-CA 3.47Å; Q166-M223 HydrophobicContact CB-CB 4.35Å; Q166-M223 HydrophobicContact CB-CE 4.32Å; Q166-M223 HydrophobicContact CG-CE 4.11Å; Q166-M223 PolarHBondContact N-O 3.35Å; Q166-M223 PolarHBondContact O-N 2.84Å
167F93.4Very high94.2Very high25 Ų2552.7 Ų52.711%0.1127%0.266CS..EExtended strand (participates in β ladder)trans-125.6122.8172179.2-94.6000108.5Q169 T170 I172 M203 M206 I220 V221 V222F167-Q169 PolarHBondContact O-N 3.44Å; F167-T170 PolarHBondContact N-O 3.47Å; F167-T170 WeakPolarHBondContact O-CB 3.37Å; F167-T170 PolarHBondContact O-N 3.11Å; F167-I172 HydrophobicContact CB-CD1 3.52Å; F167-I172 HydrophobicContact CB-CG1 4.08Å; F167-I172 HydrophobicContact CB-CG2 4.15Å; F167-M203 HydrophobicContact CB-SD 4.42Å; F167-M203 HydrophobicContact CD1-CG 4.36Å; F167-M203 HydrophobicContact CD1-SD 3.71Å; F167-M206 HydrophobicContact CD1-CE 4.36Å; F167-M206 HydrophobicContact CE1-CE 3.31Å; F167-M206 HydrophobicContact CE2-CE 4.23Å; F167-M206 HydrophobicContact CZ-CE 3.23Å; F167-M206 HydrophobicContact CZ-SD 4.34Å; F167-I220 HydrophobicContact CE2-CB 4.07Å; F167-V221 VanDerWaalsContact CD2-O 3.26Å; F167-V221 WeakPolarHBondContact CD2-O 2.95Å; F167-V222 HydrophobicContact CD2-CG1 4.35Å
168S88.8Confident94.1Very high92 Ų9252.3 Ų52.364%0.64327%0.269SS*.THydrogen-bonded Turntrans49.343.2-176-168.50000113.8T170S168-T170 PolarHBondContact O-N 3.39Å
169Q87.9Confident93.6Very high182 Ų18259 Ų5985%0.8531%0.305SS*.THydrogen-bonded Turntrans71.6-1.2-176.4-52.817180.400115.9F167F167-Q169 PolarHBondContact O-N 3.44Å
170T92.7Very high93.1Very high59 Ų5959.8 Ų59.836%0.36231%0.306SS..EExtended strand (participates in β ladder)trans-93.7128.7174.2-570000110.3Q166 F167 S168 I172 M203Q166-T170 CarbonylContact C-O 3.57Å; Q166-T170 WeakPolarHBondContact CA-O 3.43Å; F167-T170 PolarHBondContact N-O 3.47Å; F167-T170 WeakPolarHBondContact O-CB 3.37Å; F167-T170 PolarHBondContact O-N 3.11Å; S168-T170 PolarHBondContact O-N 3.39Å; T170-I172 PolarHBondContact O-N 2.99Å; T170-M203 HydrophobicContact CG2-CE 3.64Å; T170-M203 HydrophobicContact CG2-SD 4.36Å
171V94.8Very high93Very high78 Ų7861.2 Ų61.247%0.47332%0.316SS..EExtended strand (participates in β ladder)trans-72.7112.3177.4-176.90000109.5Q166Q166-V171 HydrophobicContact CG-CG2 4Å
172I94.5Very high92.9Very high12 Ų1265 Ų656%0.06234%0.339CS..EExtended strand (participates in β ladder)trans-102-13.8-179.851.6167.2000113.2V165 F167 T170 T197 T198 I199 M203 V222V165-I172 HydrophobicContact CB-CG1 4.35Å; V165-I172 HydrophobicContact CG1-CD1 3.99Å; V165-I172 HydrophobicContact CG1-CG1 3.89Å; V165-I172 WeakPolarHBondContact O-CG1 3.43Å; V165-I172 PolarHBondContact O-N 3.03Å; F167-I172 HydrophobicContact CB-CD1 3.52Å; F167-I172 HydrophobicContact CB-CG1 4.08Å; F167-I172 HydrophobicContact CB-CG2 4.15Å; T170-I172 PolarHBondContact O-N 2.99Å; I172-T197 HydrophobicContact CB-CG2 3.84Å; I172-T197 HydrophobicContact CD1-CG2 3.31Å; I172-T197 HydrophobicContact CG1-CG2 3.48Å; I172-T197 VanDerWaalsContact CG1-CG2 3.48Å; I172-T197 CarbonylContact O-C 3.46Å; I172-T197 WeakPolarHBondContact O-CA 3.49Å; I172-T198 PolarHBondContact O-N 2.72Å; I172-I199 HydrophobicContact CD1-CG1 4.13Å; I172-M203 HydrophobicContact CG2-CE 3.43Å; I172-M203 VanDerWaalsContact CG2-CE 3.43Å; I172-M203 HydrophobicContact CG2-SD 3.71Å; I172-V222 HydrophobicContact CD1-CG1 4.14Å
173G94.8Very high92.8Very high6 Ų664.2 Ų64.26%0.06233%0.334CS..EExtended strand (participates in β ladder)trans-151.5144.117800000111.9R164 V165 P196R164-G173 CarbonylContact C-O 3.51Å; R164-G173 WeakPolarHBondContact CA-O 3.49Å; V165-G173 PolarHBondContact N-O 3.47Å; V165-G173 PolarHBondContact O-N 2.95Å; V165-G173 VanDerWaalsContact O-N 3.12Å; G173-P196 WeakPolarHBondContact CA-O 3.36Å
174K95.9Very high92.8Very high136 Ų13666.7 Ų66.759%0.59135%0.351SS*.EExtended strand (participates in β ladder)trans-146.6132.2174.2-177.2177.6177.1-176.60109.7A163 R164A163-K174 WeakPolarHBondContact O-CA 3.34Å; R164-K174 HydrophobicContact CG-CG 4.27Å
175T95.9Very high92.7Very high28 Ų2864.8 Ų64.817%0.17235%0.352CS..EExtended strand (participates in β ladder)trans-136.5150.1172.4-169.20000110T162 A163 V195T162-T175 WeakPolarHBondContact CA-O 3.41Å; A163-T175 HydrophobicContact CB-CG2 3.88Å; A163-T175 PolarHBondContact N-O 2.84Å; A163-T175 PolarHBondContact O-N 3.12Å; T175-V195 HydrophobicContact CG2-CB 4.21Å; T175-V195 HydrophobicContact CG2-CG1 4.11Å; T175-V195 HydrophobicContact CG2-CG2 3.75Å
176R95.4Very high92.6Very high160 Ų16069.6 Ų69.660%0.60438%0.377SS*.EExtended strand (participates in β ladder)trans-135121.4171.5-177.3179.5-176.2143.63.8108.2N160 I161N160-R176 PolarHBondContact ND2-NH2 3.3Å; N160-R176 VanDerWaalsContact ND2-NH2 3.12Å; N160-R176 PolarHBondContact OD1-NE 2.95Å; I161-R176 CarbonylContact O-C 3.49Å; I161-R176 WeakPolarHBondContact O-CA 3.3Å
177I93.4Very high92.6Very high56 Ų5671.3 Ų71.329%0.28739%0.387SS..EExtended strand (participates in β ladder)trans-110.9131176.7-52.7173.2000106.9N160 I161 I180 Y193N160-I177 CarbonylContact C-O 3.58Å; N160-I177 WeakPolarHBondContact CA-O 3.34Å; I161-I177 PolarHBondContact N-O 3.23Å; I161-I177 PolarHBondContact O-N 2.82Å; I177-I180 HydrophobicContact CB-CD1 4.34Å; I177-I180 HydrophobicContact CB-CG1 4.36Å; I177-I180 HydrophobicContact CG2-CD1 4.22Å; I177-I180 HydrophobicContact CG2-CG1 3.72Å; I177-Y193 VanDerWaalsContact CD1-CB 3.44Å
178S92Very high92.6Very high69 Ų6974.6 Ų74.648%0.48340%0.404SS..EExtended strand (participates in β ladder)trans-116.7155.7-177.156.70000111.5A159 N160A159-S178 CarbonylContact O-C 3.6Å; A159-S178 WeakPolarHBondContact O-CA 3.44Å; N160-S178 WeakPolarHBondContact OD1-CA 3.21Å; N160-S178 WeakPolarHBondContact OD1-CB 3.28Å
179N83.9Confident92.9Very high143 Ų14373.4 Ų73.477%0.76539%0.387SS*.EExtended strand (participates in β ladder)trans5159.1176.7-64.1-36.4000112.3A159A159-N179 PolarHBondContact O-N 2.9Å
180I83.6Confident93.1Very high35 Ų3570.1 Ų70.118%0.17937%0.371CS..EExtended strand (participates in β ladder)trans-76.6-70.3-169.2-66.8153000110V158 I161 I177 I191V158-I180 HydrophobicContact CB-CB 4.36Å; V158-I180 HydrophobicContact CG1-CB 4.21Å; V158-I180 HydrophobicContact CG1-CD1 3.82Å; V158-I180 PolarHBondContact O-N 3.18Å; V158-I180 VanDerWaalsContact O-N 3.15Å; I161-I180 HydrophobicContact CB-CD1 3.69Å; I161-I180 HydrophobicContact CD1-CD1 3.39Å; I161-I180 HydrophobicContact CG1-CD1 3.27Å; I177-I180 HydrophobicContact CB-CD1 4.34Å; I177-I180 HydrophobicContact CB-CG1 4.36Å; I177-I180 HydrophobicContact CG2-CD1 4.22Å; I177-I180 HydrophobicContact CG2-CG1 3.72Å; I180-I191 HydrophobicContact CG2-CD1 3.68Å; I180-I191 HydrophobicContact CG2-CG1 4.02Å; I180-I191 HydrophobicContact CG2-CG2 3.94Å
181T91.9Very high93.1Very high58 Ų5868 Ų6836%0.35636%0.358SS..EExtended strand (participates in β ladder)trans-161.1164.6-17957.70000110.5V158V158-T181 WeakPolarHBondContact CB-O 3.27Å; V158-T181 PolarHBondContact N-O 2.85Å
182T93.5Very high93Very high79 Ų7967.7 Ų67.749%0.48535%0.353SS..EExtended strand (participates in β ladder)trans-96.9137.2167.865.20000109.1D157 K189D157-T182 WeakPolarHBondContact OD1-CB 3.47Å; D157-T182 WeakPolarHBondContact OD1-CG2 3.41Å; T182-K189 WeakPolarHBondContact O-CE 3.29Å; T182-K189 PolarHBondContact O-NZ 3.16Å
183I94.9Very high93Very high3 Ų367.3 Ų67.32%0.01535%0.351CS..EExtended strand (participates in β ladder)trans-106128.4178.2-53.9176.9000108I148 N150 S155 V156 V158 D187 K189I148-I183 HydrophobicContact CB-CD1 3.74Å; I148-I183 HydrophobicContact CG2-CD1 3.47Å; I148-I183 VanDerWaalsContact CG2-CD1 3.47Å; N150-I183 HydrophobicContact CB-CB 4.2Å; N150-I183 HydrophobicContact CB-CG2 3.6Å; S155-I183 VanDerWaalsContact CA-O 3.3Å; S155-I183 WeakPolarHBondContact CA-O 3.06Å; V156-I183 PolarHBondContact N-O 3.03Å; V156-I183 PolarHBondContact O-N 3.08Å; V158-I183 HydrophobicContact CG2-CD1 3.68Å; V158-I183 HydrophobicContact CG2-CG1 3.98Å; I183-D187 HydrophobicContact CG2-CB 4.24Å; I183-D187 WeakPolarHBondContact CG2-O 3.38Å; I183-K189 HydrophobicContact CD1-CB 4.43Å; I183-K189 HydrophobicContact CG1-CB 4.25Å; I183-K189 HydrophobicContact CG1-CD 4.14Å; I183-K189 HydrophobicContact CG1-CG 4.27Å; I183-K189 HydrophobicContact CG2-CG 4.39Å
184S94.9Very high92.9Very high54 Ų5471.1 Ų71.138%0.37837%0.368SS..  trans-65.6164179.2-60.40000111.4N150 L186 D187N150-S184 PolarHBondContact ND2-O 2.92Å; S184-L186 PolarHBondContact O-N 2.92Å; S184-D187 WeakPolarHBondContact O-CB 3.25Å; S184-D187 PolarHBondContact O-N 2.8Å
185P94.2Very high93Very high57 Ų5764.7 Ų64.737%0.3734%0.34SS..THydrogen-bonded Turntrans-58136.3173.2-22.834.2000111.6N152 D187N152-P185 WeakPolarHBondContact O-CA 3.45Å; P185-D187 PolarHBondContact O-N 2.94Å; P185-D187 VanDerWaalsContact O-N 3.11Å
186L93.1Very high93Very high103 Ų10366.1 Ų66.154%0.53935%0.35SS..THydrogen-bonded Turntrans5524.5178.2-56.7174.4000114.5N150 N151 N152 Y153 S184N150-L186 CarbonylContact O-C 3.59Å; N150-L186 WeakPolarHBondContact O-CA 3.18Å; N150-L186 PolarHBondContact O-N 3.1Å; N150-L186 VanDerWaalsContact O-N 3.1Å; N151-L186 WeakPolarHBondContact O-CD2 3.42Å; N152-L186 PolarHBondContact O-N 2.84Å; Y153-L186 HydrophobicContact CD1-CD1 3.92Å; Y153-L186 HydrophobicContact CD1-CD2 4.46Å; Y153-L186 HydrophobicContact CD1-CG 4.28Å; Y153-L186 HydrophobicContact CE1-CD1 3.8Å; Y153-L186 HydrophobicContact CE1-CD2 4.34Å; Y153-L186 HydrophobicContact CE1-CG 4.43Å; S184-L186 PolarHBondContact O-N 2.92Å
187D94.9Very high93Very high63 Ų6358.6 Ų58.634%0.33732%0.322SS..  trans-111159.4-175.5-167.323000111.6N150 I183 S184 P185N150-D187 PolarHBondContact N-O 2.94Å; N150-D187 PolarHBondContact O-N 3.38Å; I183-D187 HydrophobicContact CG2-CB 4.24Å; I183-D187 WeakPolarHBondContact CG2-O 3.38Å; S184-D187 WeakPolarHBondContact O-CB 3.25Å; S184-D187 PolarHBondContact O-N 2.8Å; P185-D187 PolarHBondContact O-N 2.94Å; P185-D187 VanDerWaalsContact O-N 3.11Å
188M94.6Very high93Very high94 Ų9458.6 Ų58.646%0.46333%0.325SS..EExtended strand (participates in β ladder)trans-121.2134.1177.5-177.6-167.577.200109.8N147 I148 T149N147-M188 HydrophobicContact CB-CG 4.42Å; N147-M188 HydrophobicContact CB-SD 4.08Å; I148-M188 WeakPolarHBondContact O-CA 3.44Å; T149-M188 HydrophobicContact CG2-CB 4.34Å; T149-M188 WeakPolarHBondContact OG1-CG 3.31Å
189K93.2Very high93.1Very high66 Ų6655.4 Ų55.429%0.28730%0.302SS..EExtended strand (participates in β ladder)trans-123.2134.4171.5-71.4-166.1176-179.40112I148 T182 I183I148-K189 PolarHBondContact N-O 3.16Å; I148-K189 PolarHBondContact O-N 2.79Å; T182-K189 WeakPolarHBondContact O-CE 3.29Å; T182-K189 PolarHBondContact O-NZ 3.16Å; I183-K189 HydrophobicContact CD1-CB 4.43Å; I183-K189 HydrophobicContact CG1-CB 4.25Å; I183-K189 HydrophobicContact CG1-CD 4.14Å; I183-K189 HydrophobicContact CG1-CG 4.27Å; I183-K189 HydrophobicContact CG2-CG 4.39Å
190Q93.6Very high93.5Very high113 Ų11349.2 Ų49.253%0.52827%0.271SS..EExtended strand (participates in β ladder)trans-90.5129.8170.4-173.5170.63.800109.7L146 N147L146-Q190 CarbonylContact O-C 3.58Å; L146-Q190 VanDerWaalsContact O-CA 3.28Å; L146-Q190 WeakPolarHBondContact O-CA 3.44Å; N147-Q190 VanDerWaalsContact OD1-CB 3.27Å; N147-Q190 WeakPolarHBondContact OD1-CB 3.43Å; N147-Q190 VanDerWaalsContact OD1-CG 3.23Å; N147-Q190 WeakPolarHBondContact OD1-CG 3.35Å
191I92.7Very high93.8Very high16 Ų1654.3 Ų54.38%0.08230%0.299CS..EExtended strand (participates in β ladder)trans-126.6128.9-178.9-66.9159.2000108.9L146 I148 I161 I180L146-I191 PolarHBondContact N-O 2.86Å; L146-I191 PolarHBondContact O-N 3.11Å; I148-I191 HydrophobicContact CD1-CD1 3.67Å; I148-I191 HydrophobicContact CG1-CD1 4.37Å; I161-I191 HydrophobicContact CD1-CD1 4.33Å; I161-I191 HydrophobicContact CD1-CG2 3.91Å; I180-I191 HydrophobicContact CG2-CD1 3.68Å; I180-I191 HydrophobicContact CG2-CG1 4.02Å; I180-I191 HydrophobicContact CG2-CG2 3.94Å
192D93.1Very high93.6Very high70 Ų7059.8 Ų59.837%0.37432%0.32SS..EExtended strand (participates in β ladder)trans-96.9134.9174.3-64.8-19.7000110.2K125 N144 S145K125-D192 IonicContact NZ-OD2 2.63Å; K125-D192 PolarHBondContact NZ-OD2 3.17Å; N144-D192 CarbonylContact O-C 3.6Å; N144-D192 VanDerWaalsContact O-CA 3.3Å; N144-D192 WeakPolarHBondContact O-CA 3.2Å; S145-D192 WeakPolarHBondContact CB-OD1 3.3Å; S145-D192 PolarHBondContact OG-OD1 2.85Å
193Y92.8Very high93.4Very high4 Ų457 Ų572%0.01630%0.302CS..EExtended strand (participates in β ladder)trans-137142.6176.966.7-74.9000110.5T143 N144 L146 A163 I177 V195 I226T143-Y193 WeakPolarHBondContact CA-O 3.49Å; N144-Y193 HydrophobicContact CB-CD1 4.09Å; N144-Y193 HydrophobicContact CB-CD2 4.46Å; N144-Y193 HydrophobicContact CB-CE1 3.34Å; N144-Y193 HydrophobicContact CB-CE2 3.84Å; N144-Y193 WeakPolarHBondContact CB-OH 3.19Å; N144-Y193 PolarHBondContact N-O 2.91Å; N144-Y193 WeakPolarHBondContact O-CD1 3.5Å; N144-Y193 PolarHBondContact O-N 3.15Å; L146-Y193 HydrophobicContact CB-CE1 4.41Å; L146-Y193 HydrophobicContact CD1-CD1 3.5Å; L146-Y193 HydrophobicContact CD1-CE1 3.1Å; L146-Y193 HydrophobicContact CG-CD1 4.14Å; L146-Y193 HydrophobicContact CG-CE1 3.47Å; L146-Y193 VanDerWaalsContact CG-CE1 3.47Å; A163-Y193 HydrophobicContact CB-CD2 3.77Å; A163-Y193 HydrophobicContact CB-CE2 3.46Å; A163-Y193 VanDerWaalsContact CB-CE2 3.46Å; I177-Y193 VanDerWaalsContact CD1-CB 3.44Å; Y193-V195 HydrophobicContact CD2-CG2 3.84Å; Y193-V195 HydrophobicContact CE2-CG2 3.76Å; Y193-I226 WeakPolarHBondContact OH-CD1 3.22Å
194M94.4Very high93.1Very high86 Ų8658.5 Ų58.542%0.42431%0.313SS..EExtended strand (participates in β ladder)trans-109.8130.9178.9-175.5-172.171.300110N141 V142N141-M194 HydrophobicContact CB-CG 4.22Å; N141-M194 HydrophobicContact CB-SD 3.86Å; V142-M194 WeakPolarHBondContact O-CA 3.4Å
195V96.3Very high92.9Very high1 Ų162.4 Ų62.41%0.00632%0.32CS..EExtended strand (participates in β ladder)trans-108.8109.5173.8-163.70000109.4V142 A163 V165 T175 Y193 T197V142-V195 PolarHBondContact N-O 2.81Å; V142-V195 VanDerWaalsContact N-O 3.1Å; V142-V195 PolarHBondContact O-N 2.8Å; A163-V195 HydrophobicContact CB-CG2 3.8Å; V165-V195 HydrophobicContact CB-CG1 4.48Å; V165-V195 HydrophobicContact CG2-CB 3.86Å; V165-V195 HydrophobicContact CG2-CG1 3.66Å; V165-V195 HydrophobicContact CG2-CG2 4.13Å; T175-V195 HydrophobicContact CG2-CB 4.21Å; T175-V195 HydrophobicContact CG2-CG1 4.11Å; T175-V195 HydrophobicContact CG2-CG2 3.75Å; Y193-V195 HydrophobicContact CD2-CG2 3.84Å; Y193-V195 HydrophobicContact CE2-CG2 3.76Å; V195-T197 PolarHBondContact O-N 3.38Å; V195-T197 PolarHBondContact O-OG1 2.96Å
196P95.9Very high92.8Very high58 Ų5860.3 Ų60.338%0.37731%0.306SS..EExtended strand (participates in β ladder)trans-69.1127.5168.530.2-32000108.5G173G173-P196 WeakPolarHBondContact CA-O 3.36Å
197T95.3Very high92.8Very high2 Ų256.2 Ų56.21%0.01228%0.283CS..EExtended strand (participates in β ladder)trans-129.8130.7-170.9-59.10000108.3Y139 L140 V165 I172 V195Y139-T197 WeakPolarHBondContact CA-O 3.48Å; L140-T197 HydrophobicContact CB-CG2 4.46Å; L140-T197 PolarHBondContact N-O 2.9Å; L140-T197 WeakPolarHBondContact O-CA 3.33Å; L140-T197 VanDerWaalsContact O-CB 3.22Å; L140-T197 WeakPolarHBondContact O-CB 3.35Å; L140-T197 PolarHBondContact O-N 2.8Å; V165-T197 HydrophobicContact CB-CG2 4.5Å; V165-T197 HydrophobicContact CG1-CG2 4.14Å; I172-T197 HydrophobicContact CB-CG2 3.84Å; I172-T197 HydrophobicContact CD1-CG2 3.31Å; I172-T197 HydrophobicContact CG1-CG2 3.48Å; I172-T197 VanDerWaalsContact CG1-CG2 3.48Å; I172-T197 CarbonylContact O-C 3.46Å; I172-T197 WeakPolarHBondContact O-CA 3.49Å; V195-T197 PolarHBondContact O-N 3.38Å; V195-T197 PolarHBondContact O-OG1 2.96Å
198T95Very high92.7Very high57 Ų5757.2 Ų57.235%0.3529%0.289SS..EExtended strand (participates in β ladder)trans-125.3121.6-176.5-55.60000108.8I137 Y139 I172 A200I137-T198 HydrophobicContact CG2-CG2 3.6Å; Y139-T198 HydrophobicContact CD1-CG2 3.86Å; Y139-T198 HydrophobicContact CE1-CG2 3.68Å; I172-T198 PolarHBondContact O-N 2.72Å; T198-A200 HydrophobicContact CG2-CB 4.17Å
199I94.1Very high92.6Very high1 Ų156.6 Ų56.61%0.00528%0.282CS..EExtended strand (participates in β ladder)trans-101.3108.8173.6-56.9173.8000107.2V138 L140 I172 M203 M206 I220V138-I199 HydrophobicContact CB-CB 4.31Å; V138-I199 PolarHBondContact N-O 2.88Å; V138-I199 VanDerWaalsContact N-O 3.15Å; V138-I199 PolarHBondContact O-N 3.33Å; L140-I199 HydrophobicContact CD1-CD1 3.7Å; L140-I199 HydrophobicContact CD1-CG1 4.44Å; I172-I199 HydrophobicContact CD1-CG1 4.13Å; I199-M203 HydrophobicContact CG2-CB 3.54Å; I199-M203 WeakPolarHBondContact CG2-O 3.33Å; I199-M206 HydrophobicContact CD1-CG 4.4Å; I199-M206 HydrophobicContact CG2-CB 3.75Å; I199-M206 HydrophobicContact CG2-CG 4.32Å; I199-I220 HydrophobicContact CD1-CD1 3.68Å
200A91.9Very high92.5Very high14 Ų1453.5 Ų53.512%0.11627%0.268CS..  trans-144.6-178.2-174.900000111.2I137 T198 E202 M203I137-A200 HydrophobicContact CD1-CB 4.23Å; I137-A200 HydrophobicContact CG1-CB 3.97Å; I137-A200 HydrophobicContact CG2-CB 4.31Å; T198-A200 HydrophobicContact CG2-CB 4.17Å; A200-E202 PolarHBondContact O-N 3.36Å; A200-M203 PolarHBondContact O-N 2.84Å
201D89.1Confident92.5Very high142 Ų14250.5 Ų50.576%0.75926%0.258SS*.G310 helixtrans56.8-118.1172.7-54-41.7000112.8M203 S204D201-M203 PolarHBondContact O-N 3.33Å; D201-S204 PolarHBondContact N-OG 2.92Å; D201-S204 VanDerWaalsContact O-CB 3.29Å; D201-S204 WeakPolarHBondContact O-CB 3.41Å; D201-S204 PolarHBondContact O-N 3.43Å; D201-S204 PolarHBondContact O-OG 3.49Å
202E87.9Confident92.5Very high172 Ų17253.2 Ų53.280%0.80427%0.272SS*.G310 helixtrans-60.4-18.8179.6-62.5-178.3176.600113A200 Y205A200-E202 PolarHBondContact O-N 3.36Å; E202-Y205 WeakPolarHBondContact O-CD1 3.37Å; E202-Y205 VanDerWaalsContact O-CE1 3.26Å; E202-Y205 WeakPolarHBondContact O-CE1 3.15Å
203M90.3Very high92.2Very high21 Ų2159 Ų5910%0.10330%0.297CS..G310 helixtrans-10211.8178.6-60.9167.9-74.900113F167 T170 I172 I199 A200 D201 Y205 M206F167-M203 HydrophobicContact CB-SD 4.42Å; F167-M203 HydrophobicContact CD1-CG 4.36Å; F167-M203 HydrophobicContact CD1-SD 3.71Å; T170-M203 HydrophobicContact CG2-CE 3.64Å; T170-M203 HydrophobicContact CG2-SD 4.36Å; I172-M203 HydrophobicContact CG2-CE 3.43Å; I172-M203 VanDerWaalsContact CG2-CE 3.43Å; I172-M203 HydrophobicContact CG2-SD 3.71Å; I199-M203 HydrophobicContact CG2-CB 3.54Å; I199-M203 WeakPolarHBondContact CG2-O 3.33Å; A200-M203 PolarHBondContact O-N 2.84Å; D201-M203 PolarHBondContact O-N 3.33Å; M203-Y205 PolarHBondContact O-N 2.76Å; M203-Y205 VanDerWaalsContact O-N 3.12Å; M203-M206 WeakPolarHBondContact O-CB 3.45Å; M203-M206 PolarHBondContact O-N 3.16Å
204S88.4Confident91.8Very high35 Ų3563.6 Ų63.625%0.24533%0.33CS..THydrogen-bonded Turntrans-60.7-23-179.5-58.70000113.4D201 M206 Y207D201-S204 PolarHBondContact N-OG 2.92Å; D201-S204 VanDerWaalsContact O-CB 3.29Å; D201-S204 WeakPolarHBondContact O-CB 3.41Å; D201-S204 PolarHBondContact O-N 3.43Å; D201-S204 PolarHBondContact O-OG 3.49Å; S204-M206 PolarHBondContact O-N 3.47Å; S204-M206 VanDerWaalsContact O-N 3.16Å; S204-Y207 VanDerWaalsContact O-CB 3.23Å; S204-Y207 WeakPolarHBondContact O-CB 3.4Å; S204-Y207 PolarHBondContact O-N 2.9Å
205Y90.1Very high91.4Very high136 Ų13662.7 Ų62.753%0.53333%0.326SS..Hα-helixtrans-60.1-22.4173.267.1-93.9000112.8E202 M203 Y207 D208E202-Y205 WeakPolarHBondContact O-CD1 3.37Å; E202-Y205 VanDerWaalsContact O-CE1 3.26Å; E202-Y205 WeakPolarHBondContact O-CE1 3.15Å; M203-Y205 PolarHBondContact O-N 2.76Å; M203-Y205 VanDerWaalsContact O-N 3.12Å; Y205-Y207 PolarHBondContact O-N 3.26Å; Y205-D208 PolarHBondContact O-N 3.3Å
206M92.1Very high90.7Very high12 Ų1272.2 Ų72.26%0.05937%0.367CS..Hα-helixtrans-65.8-25.1176.2-149.563.660.400112.1F167 I199 M203 S204 D208 Y209 C210 I220F167-M206 HydrophobicContact CD1-CE 4.36Å; F167-M206 HydrophobicContact CE1-CE 3.31Å; F167-M206 HydrophobicContact CE2-CE 4.23Å; F167-M206 HydrophobicContact CZ-CE 3.23Å; F167-M206 HydrophobicContact CZ-SD 4.34Å; I199-M206 HydrophobicContact CD1-CG 4.4Å; I199-M206 HydrophobicContact CG2-CB 3.75Å; I199-M206 HydrophobicContact CG2-CG 4.32Å; M203-M206 WeakPolarHBondContact O-CB 3.45Å; M203-M206 PolarHBondContact O-N 3.16Å; S204-M206 PolarHBondContact O-N 3.47Å; S204-M206 VanDerWaalsContact O-N 3.16Å; M206-D208 VanDerWaalsContact C-N 3.32Å; M206-D208 PolarHBondContact O-N 3.41Å; M206-Y209 PolarHBondContact O-N 3.37Å; M206-Y209 HydrophobicContact SD-CD1 4.06Å; M206-C210 WeakPolarHBondContact O-CB 3.04Å; M206-C210 PolarHBondContact O-N 2.86Å; M206-C210 PolarHBondContact O-SG 3.49Å; M206-I220 HydrophobicContact CG-CG2 4.48Å; M206-I220 HydrophobicContact SD-CG2 4.07Å
207Y93.6Very high90.2Very high17 Ų1773 Ų737%0.06737%0.371CS..Hα-helixtrans-57.8-46.1175.5178-83.3000111.6Y131 Q133 R136 V138 S204 Y205 Y209 C210 T211Y131-Y207 HydrophobicContact CD1-CE2 4.4Å; Q133-Y207 WeakPolarHBondContact CA-OH 3.28Å; Q133-Y207 WeakPolarHBondContact CB-OH 3.21Å; Q133-Y207 WeakPolarHBondContact CG-OH 3.3Å; R136-Y207 HydrophobicContact CB-CD1 4.44Å; R136-Y207 HydrophobicContact CB-CD2 4.46Å; R136-Y207 HydrophobicContact CB-CG 4.08Å; R136-Y207 WeakPolarHBondContact O-CB 3.39Å; V138-Y207 HydrophobicContact CG2-CD2 4.16Å; S204-Y207 VanDerWaalsContact O-CB 3.23Å; S204-Y207 WeakPolarHBondContact O-CB 3.4Å; S204-Y207 PolarHBondContact O-N 2.9Å; Y205-Y207 PolarHBondContact O-N 3.26Å; Y207-Y209 VanDerWaalsContact C-N 3.29Å; Y207-Y209 PolarHBondContact O-N 3.29Å; Y207-C210 PolarHBondContact O-N 2.93Å; Y207-T211 HydrophobicContact CD1-CG2 4.41Å; Y207-T211 HydrophobicContact CD2-CG2 4.45Å; Y207-T211 HydrophobicContact CE1-CG2 4.03Å; Y207-T211 HydrophobicContact CE2-CG2 4.1Å; Y207-T211 WeakPolarHBondContact O-CB 3.47Å; Y207-T211 WeakPolarHBondContact O-CG2 3.29Å; Y207-T211 PolarHBondContact O-N 3.32Å; Y207-T211 PolarHBondContact O-OG1 3.43Å
208D92.3Very high89.9Confident84 Ų8473.6 Ų73.645%0.44937%0.373SS..Hα-helixtrans-66-36.2-179.9-68.8-42.8000111.1R136 Y205 M206 L212R136-D208 IonicContact CZ-OD1 3.59Å; R136-D208 IonicContact NH1-OD1 2.65Å; R136-D208 PolarHBondContact NH1-OD1 2.98Å; Y205-D208 PolarHBondContact O-N 3.3Å; M206-D208 VanDerWaalsContact C-N 3.32Å; M206-D208 PolarHBondContact O-N 3.41Å; D208-L212 WeakPolarHBondContact O-CB 3.49Å; D208-L212 PolarHBondContact O-N 2.88Å
209Y92.6Very high89.7Confident82 Ų8274.5 Ų74.532%0.32238%0.376SS..Hα-helixtrans-64.5-55.2173177-105.6000111.4M206 Y207 T211 L212 I215 H218 N219 I220M206-Y209 PolarHBondContact O-N 3.37Å; M206-Y209 HydrophobicContact SD-CD1 4.06Å; Y207-Y209 VanDerWaalsContact C-N 3.29Å; Y207-Y209 PolarHBondContact O-N 3.29Å; Y209-T211 PolarHBondContact O-N 2.93Å; Y209-L212 VanDerWaalsContact O-CB 3.22Å; Y209-L212 WeakPolarHBondContact O-CB 3.26Å; Y209-L212 PolarHBondContact O-N 3.5Å; Y209-L212 VanDerWaalsContact O-N 3.1Å; Y209-I215 HydrophobicContact CE2-CD1 4.2Å; Y209-H218 HydrophobicContact CD1-CB 4.39Å; Y209-H218 HydrophobicContact CE1-CB 3.97Å; Y209-H218 PolarHBondContact O-CD2 2.85Å; Y209-H218 PolarHBondContact O-NE2 3.29Å; Y209-N219 PolarHBondContact OH-O 2.95Å; Y209-I220 HydrophobicContact CD1-CG2 4.37Å; Y209-I220 HydrophobicContact CE1-CG2 4.03Å
210C92.3Very high89.6Confident1 Ų174.9 Ų74.91%0.00738%0.378CS..Hα-helixtrans-64.7-25.3-175.6-60.80000113.6Y131 V138 M206 Y207 C249 G250Y131-C210 HydrophobicContact CE1-CB 3.99Å; Y131-C210 PolarHBondContact OH-O 3.41Å; V138-C210 HydrophobicContact CG2-CB 4.24Å; M206-C210 WeakPolarHBondContact O-CB 3.04Å; M206-C210 PolarHBondContact O-N 2.86Å; M206-C210 PolarHBondContact O-SG 3.49Å; Y207-C210 PolarHBondContact O-N 2.93Å; C210-C249 HydrophobicContact CB-CB 3.97Å; C210-C249 WeakPolarHBondContact CB-O 3.43Å; C210-C249 WeakPolarHBondContact CB-SG 3.18Å; C210-C249 WeakPolarHBondContact SG-CB 3.26Å; C210-C249 CovalentContact SG-SG 2.03Å; C210-C249 PolarHBondContact SG-SG 3.18Å; C210-G250 WeakPolarHBondContact O-CA 3.4Å
211T92.6Very high89.7Confident49 Ų4977.2 Ų77.230%0.30139%0.391SS..THydrogen-bonded Turntrans-971.5178.259.60000113.5Y131 Y207 Y209 Q213Y131-T211 HydrophobicContact CD1-CG2 3.85Å; Y131-T211 HydrophobicContact CE1-CG2 3.84Å; Y131-T211 HydrophobicContact CG-CG2 4.27Å; Y207-T211 HydrophobicContact CD1-CG2 4.41Å; Y207-T211 HydrophobicContact CD2-CG2 4.45Å; Y207-T211 HydrophobicContact CE1-CG2 4.03Å; Y207-T211 HydrophobicContact CE2-CG2 4.1Å; Y207-T211 WeakPolarHBondContact O-CB 3.47Å; Y207-T211 WeakPolarHBondContact O-CG2 3.29Å; Y207-T211 PolarHBondContact O-N 3.32Å; Y207-T211 PolarHBondContact O-OG1 3.43Å; Y209-T211 PolarHBondContact O-N 2.93Å; T211-Q213 PolarHBondContact O-N 2.92Å
212L92Very high89.9Confident74 Ų7470.6 Ų70.639%0.38736%0.355SS..  trans-69.8112.1-173.6-16765.9000111.7D208 Y209 S214 I215 H218D208-L212 WeakPolarHBondContact O-CB 3.49Å; D208-L212 PolarHBondContact O-N 2.88Å; Y209-L212 VanDerWaalsContact O-CB 3.22Å; Y209-L212 WeakPolarHBondContact O-CB 3.26Å; Y209-L212 PolarHBondContact O-N 3.5Å; Y209-L212 VanDerWaalsContact O-N 3.1Å; L212-S214 VanDerWaalsContact C-N 3.25Å; L212-S214 WeakPolarHBondContact CD2-OG 3.48Å; L212-S214 VanDerWaalsContact CG-OG 3.3Å; L212-S214 WeakPolarHBondContact CG-OG 3.47Å; L212-S214 PolarHBondContact O-N 3.35Å; L212-I215 HydrophobicContact CD2-CD1 3.87Å; L212-I215 HydrophobicContact CD2-CG1 4.09Å; L212-I215 PolarHBondContact O-N 3.31Å; L212-I215 VanDerWaalsContact O-O 3.08Å; L212-H218 PolarHBondContact O-CE1 3.47Å; L212-H218 PolarHBondContact O-NE2 3.21Å
213Q86.7Confident90.2Very high192 Ų19263.7 Ų63.790%0.89732%0.323SS*.THydrogen-bonded Turntrans-68.7-18.5-176.5-64.1-177.8300114.7T211 I215T211-Q213 PolarHBondContact O-N 2.92Å; Q213-I215 PolarHBondContact O-N 2.95Å
214S86.1Confident90.3Very high100 Ų10062.8 Ų62.870%0.69932%0.319SS*.THydrogen-bonded Turntrans-72.3-19.7179.160.20000112.9L212L212-S214 VanDerWaalsContact C-N 3.25Å; L212-S214 WeakPolarHBondContact CD2-OG 3.48Å; L212-S214 VanDerWaalsContact CG-OG 3.3Å; L212-S214 WeakPolarHBondContact CG-OG 3.47Å; L212-S214 PolarHBondContact O-N 3.35Å
215I84.9Confident90.6Very high67 Ų6762.8 Ų62.834%0.34432%0.315SS..  trans-113.1132.3179.5-53.8177.4000108Y209 L212 Q213 V217 H218Y209-I215 HydrophobicContact CE2-CD1 4.2Å; L212-I215 HydrophobicContact CD2-CD1 3.87Å; L212-I215 HydrophobicContact CD2-CG1 4.09Å; L212-I215 PolarHBondContact O-N 3.31Å; L212-I215 VanDerWaalsContact O-O 3.08Å; Q213-I215 PolarHBondContact O-N 2.95Å; I215-V217 WeakPolarHBondContact CG2-O 3.46Å; I215-H218 PolarHBondContact O-CE1 3.37Å; I215-H218 PolarHBondContact O-NE2 2.93Å
216K80.9Confident90.8Very high201 Ų20156.4 Ų56.487%0.87429%0.29SS*.SBendtrans-86.1-19.4-179.7-68.9-172.5178.3-177.40114.1
217V85.2Confident91Very high75 Ų7557 Ų5746%0.45530%0.295SS..  trans-134.1120.4-174.6-177.60000108.7I215 N219I215-V217 WeakPolarHBondContact CG2-O 3.46Å; V217-N219 VanDerWaalsContact CG1-ND2 3.34Å; V217-N219 WeakPolarHBondContact CG1-ND2 3.09Å
218H90.5Very high91.1Very high13 Ų1356.3 Ų56.36%0.0629%0.292CS..  trans-112.363.1-174.2-53.791.1000110Y209 L212 I215 I220 D248 C249 G250Y209-H218 HydrophobicContact CD1-CB 4.39Å; Y209-H218 HydrophobicContact CE1-CB 3.97Å; Y209-H218 PolarHBondContact O-CD2 2.85Å; Y209-H218 PolarHBondContact O-NE2 3.29Å; L212-H218 PolarHBondContact O-CE1 3.47Å; L212-H218 PolarHBondContact O-NE2 3.21Å; I215-H218 PolarHBondContact O-CE1 3.37Å; I215-H218 PolarHBondContact O-NE2 2.93Å; H218-I220 PolarHBondContact O-N 2.96Å; H218-D248 WeakPolarHBondContact CA-OD1 3.18Å; H218-D248 PolarHBondContact N-OD1 3.1Å; H218-C249 PolarHBondContact O-N 3.41Å; H218-C249 PolarHBondContact O-SG 3.44Å; H218-G250 VanDerWaalsContact ND1-CA 3.35Å; H218-G250 WeakPolarHBondContact ND1-CA 3.39Å
219N90.9Very high91.2Very high77 Ų7753 Ų5341%0.41228%0.275SS..EExtended strand (participates in β ladder)trans-70.8127.4-179.4-72.1-28.4000111.1Y209 V217 Y246 V247Y209-N219 PolarHBondContact OH-O 2.95Å; V217-N219 VanDerWaalsContact CG1-ND2 3.34Å; V217-N219 WeakPolarHBondContact CG1-ND2 3.09Å; N219-Y246 HydrophobicContact CB-CD1 4.47Å; N219-V247 WeakPolarHBondContact CA-O 3.38Å
220I92.3Very high91.3Very high9 Ų949.1 Ų49.15%0.04626%0.26CS..EExtended strand (participates in β ladder)trans-115.7147169.559.6166.7000109.5L140 F167 I199 M206 Y209 H218 V222 Y246 V247 C249L140-I220 HydrophobicContact CD1-CD1 3.94Å; F167-I220 HydrophobicContact CE2-CB 4.07Å; I199-I220 HydrophobicContact CD1-CD1 3.68Å; M206-I220 HydrophobicContact CG-CG2 4.48Å; M206-I220 HydrophobicContact SD-CG2 4.07Å; Y209-I220 HydrophobicContact CD1-CG2 4.37Å; Y209-I220 HydrophobicContact CE1-CG2 4.03Å; H218-I220 PolarHBondContact O-N 2.96Å; I220-V222 HydrophobicContact CD1-CG1 4.07Å; I220-V222 HydrophobicContact CG1-CG1 4.36Å; I220-Y246 WeakPolarHBondContact O-CA 3.42Å; I220-V247 HydrophobicContact CG1-CB 4.35Å; I220-V247 VanDerWaalsContact CG1-O 3.27Å; I220-V247 WeakPolarHBondContact CG1-O 3.38Å; I220-V247 PolarHBondContact N-O 3.45Å; I220-V247 PolarHBondContact O-N 3.42Å; I220-C249 HydrophobicContact CD1-CB 4.22Å; I220-C249 HydrophobicContact CG1-CB 4.36Å
221V92.5Very high91.3Very high63 Ų6351.2 Ų51.238%0.38227%0.272SS..EExtended strand (participates in β ladder)trans-92.1120.9174.3-178.60000108.9F167 Y244 Q245 Y246F167-V221 VanDerWaalsContact CD2-O 3.26Å; F167-V221 WeakPolarHBondContact CD2-O 2.95Å; V221-Y244 HydrophobicContact CG1-CD1 4.14Å; V221-Q245 WeakPolarHBondContact CA-O 3.02Å; V221-Y246 HydrophobicContact CG2-CD1 3.6Å; V221-Y246 HydrophobicContact CG2-CE1 3.26Å; V221-Y246 HydrophobicContact CG2-CG 4.48Å
222V93.4Very high91.3Very high3 Ų350.2 Ų50.22%0.01826%0.263CS..EExtended strand (participates in β ladder)trans-114.4143.6172.7-62.10000109.9V165 Q166 F167 I172 I220 Y244 Q245 V247V165-V222 HydrophobicContact CG1-CB 3.83Å; V165-V222 HydrophobicContact CG1-CG1 4.11Å; V165-V222 HydrophobicContact CG1-CG2 4.13Å; Q166-V222 CarbonylContact O-C 3.5Å; Q166-V222 WeakPolarHBondContact O-CA 3.47Å; F167-V222 HydrophobicContact CD2-CG1 4.35Å; I172-V222 HydrophobicContact CD1-CG1 4.14Å; I220-V222 HydrophobicContact CD1-CG1 4.07Å; I220-V222 HydrophobicContact CG1-CG1 4.36Å; V222-Y244 WeakPolarHBondContact O-CA 3.01Å; V222-Q245 PolarHBondContact N-O 3.38Å; V222-Q245 PolarHBondContact O-N 3.42Å; V222-V247 HydrophobicContact CG2-CB 4.44Å; V222-V247 HydrophobicContact CG2-CG2 3.69Å
223M94Very high91.2Very high26 Ų2652.9 Ų52.913%0.12827%0.272CS..EExtended strand (participates in β ladder)trans-94.6119.9168.5-171.9-176.183.800108Q166 M243 Y244Q166-M223 HydrophobicContact CB-CB 4.35Å; Q166-M223 HydrophobicContact CB-CE 4.32Å; Q166-M223 HydrophobicContact CG-CE 4.11Å; Q166-M223 PolarHBondContact N-O 3.35Å; Q166-M223 PolarHBondContact O-N 2.84Å; M223-M243 CarbonylContact C-O 3.59Å; M223-M243 WeakPolarHBondContact CA-O 3.45Å; M223-Y244 HydrophobicContact CB-CD1 3.9Å; M223-Y244 HydrophobicContact CB-CE1 3.71Å; M223-Y244 HydrophobicContact CG-CD1 4.17Å; M223-Y244 HydrophobicContact CG-CE1 3.82Å; M223-Y244 HydrophobicContact SD-CE1 4.07Å
224M92.9Very high91.1Very high3 Ų347.4 Ų47.42%0.01527%0.267CS..EExtended strand (participates in β ladder)trans-91.9144.5169.8-65.5-169.5-61.100109Y121 N144 R164 V165 E242 M243 Q245Y121-M224 HydrophobicContact CD2-CE 4.29Å; Y121-M224 HydrophobicContact CE1-CE 4.14Å; Y121-M224 HydrophobicContact CE2-CE 3.46Å; Y121-M224 VanDerWaalsContact CE2-CE 3.46Å; Y121-M224 WeakPolarHBondContact OH-CE 3.41Å; N144-M224 PolarHBondContact ND2-SD 3.25Å; N144-M224 VanDerWaalsContact ND2-SD 3.44Å; R164-M224 CarbonylContact O-C 3.57Å; R164-M224 WeakPolarHBondContact O-CA 3.32Å; V165-M224 HydrophobicContact CG2-CG 4.22Å; M224-E242 WeakPolarHBondContact O-CA 3.25Å; M224-M243 HydrophobicContact CB-CE 3.31Å; M224-M243 HydrophobicContact CB-CG 4.3Å; M224-M243 HydrophobicContact CB-SD 4.28Å; M224-M243 HydrophobicContact CE-CG 3.83Å; M224-M243 HydrophobicContact CE-SD 4.18Å; M224-M243 PolarHBondContact N-O 3.4Å; M224-M243 WeakPolarHBondContact O-CE 3.39Å; M224-M243 PolarHBondContact O-N 3.37Å; M224-M243 VanDerWaalsContact O-N 3.08Å; M224-Q245 HydrophobicContact CE-CB 4.28Å
225Q95.1Very high91.3Very high35 Ų3548.8 Ų48.816%0.16426%0.262CS..EExtended strand (participates in β ladder)trans-132.8116.4172.7-180-177.843.500107A163 R164 Q241 E242A163-Q225 CarbonylContact C-O 3.56Å; A163-Q225 WeakPolarHBondContact CA-O 3.47Å; R164-Q225 HydrophobicContact CB-CB 4.34Å; R164-Q225 PolarHBondContact N-O 3Å; R164-Q225 PolarHBondContact O-N 2.93Å; Q225-Q241 WeakPolarHBondContact CA-O 3.49Å; Q225-E242 HydrophobicContact CB-CG 4.08Å; Q225-E242 HydrophobicContact CG-CG 3.82Å; Q225-E242 PolarHBondContact NE2-OE1 3.28Å
226I94.6Very high91.6Very high1 Ų149.1 Ų49.11%0.00528%0.275CS..EExtended strand (participates in β ladder)trans-116.1137.2-174.8-59.5158.8000107.3Y121 L146 I161 T162 A163 Y193 V228 S240 Q241 M243Y121-I226 HydrophobicContact CD2-CD1 3.92Å; L146-I226 HydrophobicContact CD1-CD1 4.3Å; L146-I226 HydrophobicContact CD1-CG2 3.73Å; L146-I226 HydrophobicContact CD2-CD1 3.89Å; L146-I226 HydrophobicContact CD2-CG2 4.33Å; L146-I226 HydrophobicContact CG-CD1 4.41Å; I161-I226 HydrophobicContact CG2-CG2 4.24Å; T162-I226 CarbonylContact O-C 3.59Å; T162-I226 WeakPolarHBondContact O-CA 3.29Å; A163-I226 HydrophobicContact CB-CG1 4.38Å; Y193-I226 WeakPolarHBondContact OH-CD1 3.22Å; I226-V228 HydrophobicContact CG2-CG2 4.27Å; I226-S240 CarbonylContact O-C 3.58Å; I226-S240 WeakPolarHBondContact O-CA 3.37Å; I226-Q241 PolarHBondContact N-O 3.3Å; I226-Q241 PolarHBondContact O-N 2.93Å; I226-M243 HydrophobicContact CD1-CE 3.54Å; I226-M243 HydrophobicContact CD1-SD 3.62Å; I226-M243 HydrophobicContact CG1-CE 3.87Å
227T95.3Very high92.1Very high26 Ų2642.4 Ų42.416%0.1625%0.246CC..EExtended strand (participates in β ladder)trans-130.4114.6173.9-500000108.2I161 T162 Q238 V239I161-T227 WeakPolarHBondContact CA-O 3.28Å; T162-T227 PolarHBondContact N-O 2.88Å; T162-T227 PolarHBondContact O-N 2.79Å; T227-Q238 HydrophobicContact CG2-CB 4.3Å; T227-V239 CarbonylContact C-O 3.59Å; T227-V239 WeakPolarHBondContact CA-O 3.39Å
228V95.2Very high92.5Very high1 Ų145.3 Ų45.31%0.00626%0.255CS..EExtended strand (participates in β ladder)trans-94.8128.1173.6-176.10000107.6V119 I148 V158 I161 I226 T230 Q238 V239V119-V228 HydrophobicContact CB-CG2 4.45Å; V119-V228 HydrophobicContact CG1-CG2 3.78Å; V119-V228 HydrophobicContact CG2-CB 4.04Å; V119-V228 HydrophobicContact CG2-CG1 4.48Å; V119-V228 HydrophobicContact CG2-CG2 3.81Å; I148-V228 HydrophobicContact CD1-CG1 3.81Å; I148-V228 HydrophobicContact CD1-CG2 4.24Å; V158-V228 HydrophobicContact CG1-CG1 4.12Å; I161-V228 HydrophobicContact CG1-CG1 4.35Å; I161-V228 HydrophobicContact CG1-CG2 4.25Å; I226-V228 HydrophobicContact CG2-CG2 4.27Å; V228-T230 HydrophobicContact CG1-CG2 4.02Å; V228-Q238 WeakPolarHBondContact O-CA 3.35Å; V228-V239 PolarHBondContact N-O 2.75Å; V228-V239 PolarHBondContact O-N 2.85Å
229T95.2Very high92.7Very high14 Ų1446.5 Ų46.59%0.08626%0.263CS..EExtended strand (participates in β ladder)trans-108.8116.5172.6-52.20000108.9A159 N160 E237 Q238A159-T229 PolarHBondContact N-O 3.41Å; N160-T229 PolarHBondContact N-O 3.34Å; N160-T229 PolarHBondContact O-N 2.8Å; T229-E237 CarbonylContact C-O 3.48Å; T229-E237 WeakPolarHBondContact CA-O 3.32Å; T229-Q238 HydrophobicContact CG2-CG 4.02Å
230T93.8Very high92.8Very high2 Ų246.8 Ų46.81%0.01227%0.271CS..EExtended strand (participates in β ladder)trans-110.2146.9177.549.30000110.5I117 V156 D157 V158 V228 A236 E237I117-T230 HydrophobicContact CD1-CG2 4.04Å; I117-T230 VanDerWaalsContact CD1-OG1 3.25Å; I117-T230 WeakPolarHBondContact CD1-OG1 3.14Å; I117-T230 HydrophobicContact CG2-CG2 4.43Å; V156-T230 HydrophobicContact CG1-CG2 4Å; D157-T230 CarbonylContact O-C 3.59Å; D157-T230 VanDerWaalsContact O-CA 3.29Å; D157-T230 WeakPolarHBondContact O-CA 3.23Å; V158-T230 HydrophobicContact CG2-CG2 4.42Å; V228-T230 HydrophobicContact CG1-CG2 4.02Å; T230-A236 CarbonylContact O-C 3.53Å; T230-A236 WeakPolarHBondContact O-CA 3.31Å; T230-E237 PolarHBondContact N-O 3.21Å; T230-E237 PolarHBondContact O-N 3.19Å
231V93.8Very high92.8Very high44 Ų4449.1 Ų49.127%0.26728%0.282SS..EExtended strand (participates in β ladder)trans-127.9134.3-179.2-179.90000109.2D157 A159 H235 A236D157-V231 PolarHBondContact N-O 3.22Å; D157-V231 PolarHBondContact O-N 2.99Å; A159-V231 HydrophobicContact CB-CG2 3.66Å; V231-H235 CarbonylContact C-O 3.49Å; V231-H235 VanDerWaalsContact CA-O 3.26Å; V231-H235 WeakPolarHBondContact CA-O 3.27Å; V231-H235 WeakPolarHBondContact CG1-O 3.23Å; V231-A236 HydrophobicContact CG2-CB 4.04Å
232Y91.8Very high92.9Very high28 Ų2851.4 Ų51.411%0.1129%0.289CS..EExtended strand (participates in β ladder)trans-152.9140.6176.453.5-95.5000109.7P114 I117 Y154 V156 G234 H235 E237P114-Y232 HydrophobicContact CB-CE2 4.11Å; I117-Y232 HydrophobicContact CD1-CD1 4.47Å; I117-Y232 HydrophobicContact CD1-CE1 4.19Å; Y154-Y232 HydrophobicContact CE2-CD1 4.49Å; Y154-Y232 AromaticContact CE2-CD2 3.81Å; Y154-Y232 HydrophobicContact CE2-CD2 3.81Å; Y154-Y232 AromaticContact CE2-CG 3.75Å; Y154-Y232 HydrophobicContact CE2-CG 3.75Å; Y154-Y232 WeakPolarHBondContact OH-CD2 3.28Å; V156-Y232 HydrophobicContact CG1-CD1 4.13Å; V156-Y232 HydrophobicContact CG2-CD1 4.29Å; Y232-G234 PolarHBondContact O-N 3.33Å; Y232-H235 HydrophobicContact CE2-CB 4.33Å; Y232-H235 PolarHBondContact N-O 3.45Å; Y232-H235 WeakPolarHBondContact O-CA 3.5Å; Y232-H235 PolarHBondContact O-N 2.9Å; Y232-E237 HydrophobicContact CE1-CB 4.01Å; Y232-E237 VanDerWaalsContact CE1-OE2 3.31Å; Y232-E237 WeakPolarHBondContact CE1-OE2 3.46Å; Y232-E237 PolarHBondContact OH-OE2 3.27Å
233F89.1Confident92.8Very high131 Ų13152.4 Ų52.458%0.57529%0.293SS*.THydrogen-bonded Turntrans47.730.4-179.1-59.3-62.1000115.3L112 Y154 H235L112-F233 HydrophobicContact CD2-CE2 4.17Å; L112-F233 HydrophobicContact CD2-CZ 3.86Å; Y154-F233 AromaticContact CD1-CE2 3.58Å; Y154-F233 HydrophobicContact CD1-CE2 3.58Å; Y154-F233 HydrophobicContact CD1-CZ 4.12Å; Y154-F233 HydrophobicContact CD2-CD2 4.3Å; Y154-F233 AromaticContact CD2-CE2 3.64Å; Y154-F233 HydrophobicContact CD2-CE2 3.64Å; Y154-F233 HydrophobicContact CD2-CZ 4.24Å; Y154-F233 HydrophobicContact CE1-CD2 4.49Å; Y154-F233 AromaticContact CE1-CE2 3.72Å; Y154-F233 HydrophobicContact CE1-CE2 3.72Å; Y154-F233 HydrophobicContact CE2-CD2 4.12Å; Y154-F233 AromaticContact CE2-CE2 3.79Å; Y154-F233 HydrophobicContact CE2-CE2 3.79Å; Y154-F233 AromaticContact CG-CE2 3.52Å; Y154-F233 HydrophobicContact CG-CE2 3.52Å; Y154-F233 AromaticContact CG-CZ 3.87Å; Y154-F233 HydrophobicContact CG-CZ 3.87Å; Y154-F233 AromaticContact CZ-CE2 3.8Å; F233-H235 PolarHBondContact O-N 2.95Å
234G86.3Confident92.7Very high77 Ų7759.4 Ų59.479%0.79432%0.32SS*.THydrogen-bonded Turntrans78.4-0.8-176.600000115.3Y232Y232-G234 PolarHBondContact O-N 3.33Å
235H88.8Confident92.5Very high129 Ų12960 Ų6060%0.59732%0.322SS*.EExtended strand (participates in β ladder)trans-92142.1169.9-68.2-76.1000110.7V231 Y232 F233V231-H235 CarbonylContact C-O 3.49Å; V231-H235 VanDerWaalsContact CA-O 3.26Å; V231-H235 WeakPolarHBondContact CA-O 3.27Å; V231-H235 WeakPolarHBondContact CG1-O 3.23Å; Y232-H235 HydrophobicContact CE2-CB 4.33Å; Y232-H235 PolarHBondContact N-O 3.45Å; Y232-H235 WeakPolarHBondContact O-CA 3.5Å; Y232-H235 PolarHBondContact O-N 2.9Å; F233-H235 PolarHBondContact O-N 2.95Å
236A92Very high92.3Very high73 Ų7365.5 Ų65.560%0.60334%0.343SS*.EExtended strand (participates in β ladder)trans-112.7129.1173.700000109.5T230 V231T230-A236 CarbonylContact O-C 3.53Å; T230-A236 WeakPolarHBondContact O-CA 3.31Å; V231-A236 HydrophobicContact CG2-CB 4.04Å
237E91.7Very high92.2Very high60 Ų6065.7 Ų65.728%0.2834%0.344SS..EExtended strand (participates in β ladder)trans-116.8144.8177.1-174.7174171.500109.3T229 T230 Y232T229-E237 CarbonylContact C-O 3.48Å; T229-E237 WeakPolarHBondContact CA-O 3.32Å; T230-E237 PolarHBondContact N-O 3.21Å; T230-E237 PolarHBondContact O-N 3.19Å; Y232-E237 HydrophobicContact CE1-CB 4.01Å; Y232-E237 VanDerWaalsContact CE1-OE2 3.31Å; Y232-E237 WeakPolarHBondContact CE1-OE2 3.46Å; Y232-E237 PolarHBondContact OH-OE2 3.27Å
238Q93.9Very high92Very high137 Ų13765.4 Ų65.464%0.6434%0.341SS*.EExtended strand (participates in β ladder)trans-124.7124.9178.7-64.5-175.523.700109.9T227 V228 T229T227-Q238 HydrophobicContact CG2-CB 4.3Å; V228-Q238 WeakPolarHBondContact O-CA 3.35Å; T229-Q238 HydrophobicContact CG2-CG 4.02Å
239V93.7Very high91.9Very high38 Ų3865.4 Ų65.423%0.2334%0.341CS..EExtended strand (participates in β ladder)trans-114.9124175.3-1780000107.8V119 T227 V228V119-V239 HydrophobicContact CB-CG1 4.23Å; V119-V239 HydrophobicContact CG2-CB 4.08Å; V119-V239 HydrophobicContact CG2-CG1 3.9Å; T227-V239 CarbonylContact C-O 3.59Å; T227-V239 WeakPolarHBondContact CA-O 3.39Å; V228-V239 PolarHBondContact N-O 2.75Å; V228-V239 PolarHBondContact O-N 2.85Å
240S93.4Very high91.6Very high83 Ų8365.7 Ų65.758%0.5835%0.347SS*.EExtended strand (participates in β ladder)trans-116.8136.8-179.958.10000111.9I226I226-S240 CarbonylContact O-C 3.58Å; I226-S240 WeakPolarHBondContact O-CA 3.37Å
241Q92.6Very high91.3Very high58 Ų5867 Ų6727%0.27136%0.36SS..EExtended strand (participates in β ladder)trans-130.2142.2177-169174.1800110.2V119 Q225 I226V119-Q241 PolarHBondContact O-OE1 3.11Å; V119-Q241 VanDerWaalsContact O-OE1 3.11Å; Q225-Q241 WeakPolarHBondContact CA-O 3.49Å; I226-Q241 PolarHBondContact N-O 3.3Å; I226-Q241 PolarHBondContact O-N 2.93Å
242E93.4Very high91.1Very high111 Ų11170 Ų7052%0.51938%0.375SS..EExtended strand (participates in β ladder)trans-121.9137176-68.9178.8179.700109.3M224 Q225M224-E242 WeakPolarHBondContact O-CA 3.25Å; Q225-E242 HydrophobicContact CB-CG 4.08Å; Q225-E242 HydrophobicContact CG-CG 3.82Å; Q225-E242 PolarHBondContact NE2-OE1 3.28Å
243M91.6Very high90.9Very high24 Ų2470.6 Ų70.612%0.11838%0.382CS..EExtended strand (participates in β ladder)trans-151.2148.1-179.566.8-97.486.200111.1Y121 M223 M224 I226Y121-M243 HydrophobicContact CD1-CG 4.11Å; Y121-M243 HydrophobicContact CD1-SD 4.18Å; Y121-M243 HydrophobicContact CD2-SD 3.71Å; Y121-M243 HydrophobicContact CE1-CG 4.41Å; Y121-M243 HydrophobicContact CE2-SD 4.35Å; Y121-M243 HydrophobicContact CG-CG 4.16Å; Y121-M243 HydrophobicContact CG-SD 3.62Å; M223-M243 CarbonylContact C-O 3.59Å; M223-M243 WeakPolarHBondContact CA-O 3.45Å; M224-M243 HydrophobicContact CB-CE 3.31Å; M224-M243 HydrophobicContact CB-CG 4.3Å; M224-M243 HydrophobicContact CB-SD 4.28Å; M224-M243 HydrophobicContact CE-CG 3.83Å; M224-M243 HydrophobicContact CE-SD 4.18Å; M224-M243 PolarHBondContact N-O 3.4Å; M224-M243 WeakPolarHBondContact O-CE 3.39Å; M224-M243 PolarHBondContact O-N 3.37Å; M224-M243 VanDerWaalsContact O-N 3.08Å; I226-M243 HydrophobicContact CD1-CE 3.54Å; I226-M243 HydrophobicContact CD1-SD 3.62Å; I226-M243 HydrophobicContact CG1-CE 3.87Å
244Y91.9Very high90.4Very high173 Ų17369.8 Ų69.868%0.67839%0.388SS*.EExtended strand (participates in β ladder)trans-99.2139.8174.8-66.5-85.8000110.3V221 V222 M223V221-Y244 HydrophobicContact CG1-CD1 4.14Å; V222-Y244 WeakPolarHBondContact O-CA 3.01Å; M223-Y244 HydrophobicContact CB-CD1 3.9Å; M223-Y244 HydrophobicContact CB-CE1 3.71Å; M223-Y244 HydrophobicContact CG-CD1 4.17Å; M223-Y244 HydrophobicContact CG-CE1 3.82Å; M223-Y244 HydrophobicContact SD-CE1 4.07Å
245Q89.3Confident89.4Confident16 Ų1667.6 Ų67.68%0.07536%0.362CS..EExtended strand (participates in β ladder)trans-145.7148-179.2-168.5167.535.800112.9Y121 V124 V221 V222 M224Y121-Q245 VanDerWaalsContact OH-CD 3.22Å; Y121-Q245 PolarHBondContact OH-NE2 2.77Å; Y121-Q245 PolarHBondContact OH-OE1 3.13Å; V124-Q245 HydrophobicContact CG2-CG 4.38Å; V221-Q245 WeakPolarHBondContact CA-O 3.02Å; V222-Q245 PolarHBondContact N-O 3.38Å; V222-Q245 PolarHBondContact O-N 3.42Å; M224-Q245 HydrophobicContact CE-CB 4.28Å
246Y90.6Very high87.6Confident150 Ų15069.6 Ų69.659%0.58838%0.376SS*.EExtended strand (participates in β ladder)trans-86.4124.9171.3-63.1-87000110.1N219 I220 V221N219-Y246 HydrophobicContact CB-CD1 4.47Å; I220-Y246 WeakPolarHBondContact O-CA 3.42Å; V221-Y246 HydrophobicContact CG2-CD1 3.6Å; V221-Y246 HydrophobicContact CG2-CE1 3.26Å; V221-Y246 HydrophobicContact CG2-CG 4.48Å
247V91.9Very high85.5Confident4 Ų471.5 Ų71.52%0.02437%0.372CS..EExtended strand (participates in β ladder)trans-123.6128.8177.61710000107.7V127 L140 V142 N219 I220 V222 C249V127-V247 HydrophobicContact CB-CG1 4.43Å; V127-V247 HydrophobicContact CG1-CG1 3.71Å; V127-V247 HydrophobicContact CG2-CG1 3.93Å; L140-V247 HydrophobicContact CD1-CG1 4.48Å; V142-V247 HydrophobicContact CG1-CG2 4.44Å; V142-V247 HydrophobicContact CG2-CG1 4.26Å; N219-V247 WeakPolarHBondContact CA-O 3.38Å; I220-V247 HydrophobicContact CG1-CB 4.35Å; I220-V247 VanDerWaalsContact CG1-O 3.27Å; I220-V247 WeakPolarHBondContact CG1-O 3.38Å; I220-V247 PolarHBondContact N-O 3.45Å; I220-V247 PolarHBondContact O-N 3.42Å; V222-V247 HydrophobicContact CG2-CB 4.44Å; V222-V247 HydrophobicContact CG2-CG2 3.69Å; V247-C249 PolarHBondContact O-N 3.1Å
248D92Very high83.1Confident21 Ų2176.7 Ų76.711%0.11240%0.397CS..EExtended strand (participates in β ladder)trans-78.3118.1173.4-169.4-5.3000109.2H218 G250 T253H218-D248 WeakPolarHBondContact CA-OD1 3.18Å; H218-D248 PolarHBondContact N-OD1 3.1Å; D248-G250 PolarHBondContact OD1-N 2.77Å; D248-T253 HydrophobicContact CB-CG2 3.9Å
249C92.3Very high80.8Confident0 Ų077.4 Ų77.40%039%0.394CS..SBendtrans-92.51176.771.50000113.4V129 Y131 L140 C210 H218 I220 V247V129-C249 WeakPolarHBondContact CG1-O 3.49Å; Y131-C249 PolarHBondContact OH-O 3.37Å; L140-C249 HydrophobicContact CD1-CB 4.29Å; L140-C249 HydrophobicContact CD2-CB 4.05Å; C210-C249 HydrophobicContact CB-CB 3.97Å; C210-C249 WeakPolarHBondContact CB-O 3.43Å; C210-C249 WeakPolarHBondContact CB-SG 3.18Å; C210-C249 WeakPolarHBondContact SG-CB 3.26Å; C210-C249 CovalentContact SG-SG 2.03Å; C210-C249 PolarHBondContact SG-SG 3.18Å; H218-C249 PolarHBondContact O-N 3.41Å; H218-C249 PolarHBondContact O-SG 3.44Å; I220-C249 HydrophobicContact CD1-CB 4.22Å; I220-C249 HydrophobicContact CG1-CB 4.36Å; V247-C249 PolarHBondContact O-N 3.1Å
250G90.4Very high77.9Confident21 Ų2180.2 Ų80.222%0.21642%0.416CS..SBendtrans-93.3-39.9-17400000114.4Y131 C210 H218 D248Y131-G250 WeakPolarHBondContact OH-CA 3.36Å; Y131-G250 PolarHBondContact OH-O 2.92Å; C210-G250 WeakPolarHBondContact O-CA 3.4Å; H218-G250 VanDerWaalsContact ND1-CA 3.35Å; H218-G250 WeakPolarHBondContact ND1-CA 3.39Å; D248-G250 PolarHBondContact OD1-N 2.77Å
251G86.6Confident75.4Confident28 Ų2883.4 Ų83.429%0.28943%0.426SS..SBendtrans-142.1160.4-175.400000113.2V129 T253V129-G251 WeakPolarHBondContact CG2-O 3.34Å; G251-T253 PolarHBondContact O-N 2.72Å
252N90.4Very high72.8Confident108 Ų10887.5 Ų87.558%0.57845%0.449SS*.  trans-65124.5173.1-68-21.6000109.3V127 Y128 V129V127-N252 WeakPolarHBondContact O-CA 3.25Å; Y128-N252 WeakPolarHBondContact CA-OD1 3.32Å; V129-N252 PolarHBondContact N-OD1 2.96Å
253T85.9Confident69.9Low41 Ų4188.3 Ų88.325%0.25246%0.462SS..EExtended strand (participates in β ladder)trans-121.6134.7177.953.20000109.9S126 V127 D248 G251S126-T253 CarbonylContact C-O 3.55Å; S126-T253 VanDerWaalsContact CA-O 3.23Å; S126-T253 WeakPolarHBondContact CA-O 3.47Å; V127-T253 WeakPolarHBondContact CB-OG1 3.38Å; V127-T253 PolarHBondContact N-O 3.45Å; V127-T253 PolarHBondContact O-N 2.98Å; D248-T253 HydrophobicContact CB-CG2 3.9Å; G251-T253 PolarHBondContact O-N 2.72Å
254T80.3Confident67.6Low114 Ų11492.5 Ų92.570%0.69949%0.491SS*.EExtended strand (participates in β ladder)trans-118.6103166.546.40000105.4
255A65.6Low65Low30 Ų3092.8 Ų92.825%0.24850%0.503CS..  trans-114.1131.5-178.600000108.9K125 H257K125-A255 CarbonylContact C-O 3.55Å; K125-A255 PolarHBondContact O-N 2.82Å; A255-H257 HydrophobicContact CB-CB 4.23Å; A255-H257 PolarHBondContact O-N 3.29Å
256L50.5Low62.5Low171 Ų17198.4 Ų98.490%0.89554%0.539SS*.  trans-89.672.6151.6-75.9171.3000105.7E258L256-E258 PolarHBondContact O-N 2.91Å
257H48.3Very low60.1Low114 Ų11498.3 Ų98.353%0.52858%0.584SS.*  trans-79.776.4175.5-131.5-71.2000108.1A255 Y259A255-H257 HydrophobicContact CB-CB 4.23Å; A255-H257 PolarHBondContact O-N 3.29Å; H257-Y259 AromaticContact ND1-CD2 3.99Å; H257-Y259 AromaticContact ND1-CE2 3.78Å; H257-Y259 PolarHBondContact O-N 2.97Å
258E40.8Very low58.5Low169 Ų169103.1 Ų103.179%0.7961%0.612SS**  trans-60.6100.8163.5-99.5-177.2155.500107.5L256 S260L256-E258 PolarHBondContact O-N 2.91Å; E258-S260 PolarHBondContact O-N 2.75Å
259Y44.4Very low56.7Low151 Ų151107.4 Ų107.459%0.59264%0.638SS**  trans-7283.5158.2-93.9-90.7000107.4H257 L261H257-Y259 AromaticContact ND1-CD2 3.99Å; H257-Y259 AromaticContact ND1-CE2 3.78Å; H257-Y259 PolarHBondContact O-N 2.97Å; Y259-L261 HydrophobicContact CD1-CD1 4.4Å; Y259-L261 PolarHBondContact O-N 3.33Å
260S33.7Very low54.8Low97 Ų97113.3 Ų113.368%0.67867%0.674SS**  trans-67.786.1161.1-1770000108E258 N262E258-S260 PolarHBondContact O-N 2.75Å; S260-N262 PolarHBondContact O-N 3.17Å; S260-N262 VanDerWaalsContact O-N 3.14Å
261L41.2Very low52.7Low151 Ų151118.8 Ų118.879%0.79170%0.701SS**  trans-85.561.3171.4-126.2142.2000108.5Y259Y259-L261 HydrophobicContact CD1-CD1 4.4Å; Y259-L261 PolarHBondContact O-N 3.33Å
262N38.6Very low50.5Low143 Ų143124.4 Ų124.477%0.76573%0.726SS**  trans-140.672172.8-89.4-18.1000110S260S260-N262 PolarHBondContact O-N 3.17Å; S260-N262 VanDerWaalsContact O-N 3.14Å
263T31.1Very low47.9Very low129 Ų129125.5 Ų125.579%0.79174%0.736SS**  trans-135.6108154.9-3.80000107.8L265T263-L265 PolarHBondContact O-N 3.17Å
264P42.9Very low45.2Very low112 Ų112131.6 Ų131.673%0.72777%0.771SS**  trans-70.7116.616817.9-10.4000107.9T266P264-T266 VanDerWaalsContact C-N 3.33Å; P264-T266 PolarHBondContact O-N 2.99Å
265L38Very low42.5Very low178 Ų178132.9 Ų132.993%0.93278%0.777SS**  trans-60.299.9160.6-86.3151.1000107.2T263 G267T263-L265 PolarHBondContact O-N 3.17Å; L265-G267 PolarHBondContact O-N 2.89Å
266T37.6Very low40.5Very low134 Ų134141.5 Ų141.582%0.82282%0.821SS**  trans-80.1105.1160.8350000106.5P264P264-T266 VanDerWaalsContact C-N 3.33Å; P264-T266 PolarHBondContact O-N 2.99Å
267G39.4Very low39.6Very low149 Ų149138.8 Ų138.8100%1.53681%0.814SS**  trans-920155.800000109.8L265L265-G267 PolarHBondContact O-N 2.89Å

Retrieved 267 of 267 residues in 47.8 ms (Link to these results)