A0A096N3T3_PAPAN Loading...

Transformer-2 protein homolog beta

Sequence-specific RNA-binding protein which participates in the control of pre-mRNA splicing. Can either activate or suppress exon inclusion. Acts additively with RBMX to promote exon 7 inclusion of the survival motor neuron SMN2. Activates the splicing of MAPT/Tau exon 10. Alters pre-mRNA splicing patterns by antagonizing the effects of splicing regulators, like RBMX. Binds to the AG-rich SE2 domain in the SMN exon 7 RNA. Binds to pre-mRNA.

AlphaFold DB (P62995), UniProt , Accession A0A096N3T3, Species PAPAN (Papio anubis, Olive baboon), Gene TRA2B, Length 288 aa.

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

Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M53.6Low54.2Low236 Ų236152.2 Ų152.2100%1.16385%0.85SS**  01310-74173.8162.100106.8
2S60.1Low54.1Low117 Ų117158 Ų15882%0.81885%0.849SS**  trans54.3108.1173.9-42.50000115.2
3D50.3Low54Low154 Ų154154.6 Ų154.682%0.82483%0.825SS**  cis62.1116.620.7-162.860.1000116.7
4S65.7Low53.5Low120 Ų120152.4 Ų152.484%0.83983%0.828SS**  trans153.6128.7171.2-74.90000107.5
5G53Low53.6Low76 Ų76156.5 Ų156.578%0.78483%0.826SS**  cis175.8141.7-6.200000109.1
6E53.7Low53.2Low173 Ų173154.6 Ų154.681%0.80883%0.83SS**  trans-80.2171.8-172.7-61.8177.690.200114.5
7Q58.7Low53.4Low183 Ų183151.6 Ų151.686%0.85583%0.832SS**  trans133.3147.8157.9-73.1154.997.900111.7
8N55.7Low53.1Low140 Ų140149.9 Ų149.975%0.74983%0.832SS**  cis-142.5167.213.3-156.8-5.2000113.2
9Y46.1Very low53.1Low212 Ų212155.1 Ų155.183%0.83184%0.838SS**  trans-81.3165.8-178.7-68.2-105.8000113.5
10G53.2Low53Low80 Ų80153.6 Ų153.683%0.82584%0.84SS**  trans-171.938.7-177.800000118.4
11E46.1Very low52.7Low183 Ų183150 Ų15086%0.85584%0.838SS**  trans-73.8138.1168.6-71-178.48100112.3
12R53.5Low52.4Low222 Ų222144.4 Ų144.484%0.83882%0.822SS**  trans-179.7155.1130.3-102.7161.3-173.5-87.3-5.7117.5
13E52.2Low52.1Low114 Ų114143.4 Ų143.453%0.53382%0.821SS.*  trans63.689.3151.7-75.1-176.458.900121.4R15E13-R15 IonicContact OE1-CZ 3.42Å; E13-R15 IonicContact OE1-NE 2.74Å; E13-R15 PolarHBondContact OE1-NE 2.89Å; E13-R15 IonicContact OE1-NH2 2.69Å; E13-R15 PolarHBondContact OE1-NH2 2.85Å
14S47.6Very low52Low124 Ų124145.3 Ų145.387%0.86782%0.824SS**  trans-46.6131.8143.55.30000113.3
15R54.3Low51.1Low213 Ų213143.6 Ų143.680%0.80483%0.826SS**  trans-138.1119.2157.2-65.5-168.4-177.8-162.10.2111.1E13E13-R15 IonicContact OE1-CZ 3.42Å; E13-R15 IonicContact OE1-NE 2.74Å; E13-R15 PolarHBondContact OE1-NE 2.89Å; E13-R15 IonicContact OE1-NH2 2.69Å; E13-R15 PolarHBondContact OE1-NH2 2.85Å
16S48.2Very low51.2Low127 Ų127145.7 Ų145.789%0.88883%0.829SS**  trans-87.5140176.646.40000111.1
17A55.9Low51Low104 Ų104140.7 Ų140.786%0.8682%0.823SS**  trans-122.288.2-179.100000110.9
18S48.1Very low50.7Low120 Ų120142.1 Ų142.184%0.83983%0.826SS**  trans-73.9132.4170.248.10000110.6
19R53.1Low50.3Low249 Ų249141.7 Ų141.794%0.9483%0.834SS**  trans-132.8119165.2-92.3-171.4163.8-168.9-5.7110.8
20S51Low50.5Low125 Ų125136.4 Ų136.487%0.87484%0.835SS**  trans-73.9155.717343.60000111.4
21G47Very low50.2Low79 Ų79144.5 Ų144.581%0.81484%0.841SS**  trans-160.358.1-175.500000112.1
22S47.6Very low50.2Low118 Ų118144.9 Ų144.983%0.82584%0.842SS**  trans-76.9123.3179.244.90000112.1
23A53.3Low50.3Low95 Ų95140.1 Ų140.179%0.78584%0.838SS**  trans-141.4137.9171.300000111.2
24H48.8Very low50.1Low194 Ų194140.7 Ų140.790%0.89885%0.851SS**  trans-80.8154.6-169.7-57.2-99.1000113.3
25G45.4Very low50Low84 Ų84139.2 Ų139.287%0.86685%0.846SS**  trans-163.382.7172.700000112.2
26S55.2Low49.5Very low121 Ų121140.8 Ų140.885%0.84685%0.852SS**  trans-98.5137.6-169.251.80000114.7
27G50.6Low49.2Very low67 Ų67140.2 Ų140.269%0.69185%0.848SS**  trans78.4120.4150.500000118.7
28K51.6Low48.7Very low213 Ų213147.3 Ų147.393%0.92685%0.853SS**  179.2110.993.5-93163.3-176.3175.30111.6
29S47Very low48.5Very low131 Ų131147 Ų14792%0.91685%0.851SS**  trans-82.3125.4169.7-64.30000110.4
30A50.9Low48.2Very low102 Ų102144.3 Ų144.384%0.84385%0.846SS**  trans-124.192.3172.700000110.1
31R46.8Very low47.9Very low250 Ų250147.3 Ų147.394%0.94385%0.846SS**  trans-103117.6166.9-70.1-174.1176.6-151.30.6108
32H45.3Very low47.6Very low190 Ų190148.5 Ų148.588%0.8883%0.834SS**  trans-110.7115.9177.4-146.1-41.7000109.8
33T56.4Low47.5Very low123 Ų123148.6 Ų148.676%0.75583%0.834SS**  trans-85.2147.3169.342.70000110.3
34P47.6Very low46.9Very low125 Ų125153.9 Ų153.981%0.81283%0.834SS**  trans-94.7144.2173.735.6-32.1000111.6
35A46.6Very low46.3Very low93 Ų93157 Ų15777%0.76984%0.838SS**  trans-156.1154.3173.500000114.1
36R42.3Very low46Very low246 Ų246158.5 Ų158.593%0.92884%0.835SS**  trans74.8109.9163.8-64.4-173.3168.6-162.6-6.8119
37S43.5Very low45.2Very low115 Ų115164.8 Ų164.880%0.80484%0.84SS**  trans-77.5157.3160.745.30000112.7
38R45.4Very low44.8Very low254 Ų254166.4 Ų166.496%0.95884%0.841SS**  trans-145.7151.8156.1-75.7-166.3166.3167-5109.5
39S43.9Very low44.4Very low113 Ų113165.7 Ų165.779%0.7984%0.838SS**  trans-132.7157.3-17149.90000113.1
40K46.8Very low44.2Very low193 Ų193163.4 Ų163.484%0.83982%0.822SS**  trans164.6131.8161.2-93.6159.2-177.4-171.40106.6
41E43.5Very low43.7Very low188 Ų188170 Ų17088%0.87983%0.825SS**  cis65137.643.3-64.8-170.313100114.1
42D41.9Very low43.6Very low104 Ų104163.2 Ų163.256%0.55682%0.816SS**  cis-150.1162.1-15.2179.814.3000106.1R44D42-R44 IonicContact OD1-NE 3.93Å; D42-R44 IonicContact OD2-CZ 3.71Å; D42-R44 IonicContact OD2-NE 3.42Å; D42-R44 PolarHBondContact OD2-NE 3.42Å; D42-R44 IonicContact OD2-NH2 3.1Å; D42-R44 PolarHBondContact OD2-NH2 3.1Å; D42-R44 VanDerWaalsContact OD2-NH2 3.1Å
43S45.1Very low43.1Very low119 Ų119166.3 Ų166.383%0.83282%0.82SS**  trans176.2153.9145.142.40000112.1
44R39.9Very low42.6Very low207 Ų207165.7 Ų165.778%0.78182%0.821SS**  trans-136.2142.5-165.6-44.3168.9-161.81724.7110.5D42D42-R44 IonicContact OD1-NE 3.93Å; D42-R44 IonicContact OD2-CZ 3.71Å; D42-R44 IonicContact OD2-NE 3.42Å; D42-R44 PolarHBondContact OD2-NE 3.42Å; D42-R44 IonicContact OD2-NH2 3.1Å; D42-R44 PolarHBondContact OD2-NH2 3.1Å; D42-R44 VanDerWaalsContact OD2-NH2 3.1Å
45R37Very low42Very low258 Ų258168.3 Ų168.397%0.97482%0.822SS**  trans-164.8160.7141.9-116.5168.6-179.8-178.6-0.3113.4
46S38.1Very low41.8Very low116 Ų116168.3 Ų168.381%0.81182%0.817SS**  trans-129.6159-169.452.90000111.9
47R38.3Very low41.5Very low254 Ų254167.6 Ų167.696%0.95881%0.814SS**  trans-152.1161.2164.6-122.5173.3179.8167.3-0.5110.3
48S42.6Very low41.5Very low101 Ų101168.2 Ų168.271%0.70682%0.818SS**  trans-151.5167.9-164.9600000113.4
49K43.4Very low41.2Very low197 Ų197167.8 Ų167.886%0.85782%0.816SS**  trans69.2155.4172.4-70178.5176.5177.30117.5
50S43.2Very low41.3Very low83 Ų83168.1 Ų168.158%0.5882%0.819SS**  cis-178.7138.7-34.7540000112.5
51R40.5Very low41Very low240 Ų240170 Ų17091%0.90682%0.82SS**  trans64.7165.2157.9-59.5162.1-176.1-178.7-0.5114.9
52S43.9Very low41Very low109 Ų109171.4 Ų171.476%0.76282%0.818SS**  cis-163.1135.1-14.132.70000106.7
53R35.2Very low40.8Very low254 Ų254170.8 Ų170.896%0.95882%0.822SS**  8186.868.8-158.8-169.8-164.1-170.76.2117
54S46.1Very low40.7Very low110 Ų110169.1 Ų169.177%0.76981%0.81SS**  trans-165.9144154.449.90000107.5
55E35.8Very low40.7Very low181 Ų181170.3 Ų170.385%0.84682%0.815SS**  64.5133.159-86.5-167.7100.400115.2
56S41Very low40.9Very low93 Ų93168.1 Ų168.165%0.6581%0.806SS**  cis-158.2168.92.972.30000115.8
57R35.9Very low41Very low230 Ų230170 Ų17087%0.86880%0.802SS**  trans20.9134.8152.5-60.7171.4-178.51752.1122.5
58S43.8Very low41.1Very low128 Ų128167.9 Ų167.990%0.89580%0.795SS**  -171.4172.9123-88.90000114.3
59R38.8Very low41.2Very low245 Ų245168.2 Ų168.293%0.92579%0.794SS**  trans-135142.4-166.2-63.1169.1167.4164.2-6.8114.5
60S46.6Very low40.9Very low120 Ų120171 Ų17184%0.83980%0.798SS**  trans165.7178.4144.251.40000112.4
61R40.2Very low41Very low232 Ų232171.8 Ų171.888%0.87580%0.804SS**  -156.9148.9-58.7-100.4177.4174.3179.1-1.3110.1
62R43.5Very low41Very low218 Ų218171.6 Ų171.682%0.82380%0.804SS**  trans59.2-177.4157.5-76.8-172.6166.2-170.5-3.2118.9R241R62-R241 VanDerWaalsContact C-NH1 3.34Å; R62-R241 VanDerWaalsContact O-CZ 3.28Å; R62-R241 PolarHBondContact O-NH1 2.82Å; R62-R241 PolarHBondContact O-NH2 2.87Å
63S37.9Very low41.1Very low91 Ų91171.2 Ų171.264%0.63680%0.801SS**  -164.6126.5-58175.80000115.1
64S42.4Very low41.5Very low85 Ų85170.2 Ų170.259%0.59480%0.797SS**  trans-164.2159.8172.5670000109.7
65R40.1Very low41.2Very low232 Ų232170.5 Ų170.588%0.87580%0.799SS**  cis76.5145.38.2-57.1-177.4177-177.9-2.1115.2
66R42.1Very low41.5Very low212 Ų212174 Ų17480%0.881%0.805SS**  cis-160170.2-3.4-129.8-175.2162.3173.9-12.3106.3
67H39.8Very low41.3Very low155 Ų155174.9 Ų174.972%0.71881%0.811SS**  cis-159.7-150.2-3.3-147.3-9.5000110.5
68Y41.2Very low41.4Very low209 Ų209173.1 Ų173.182%0.8281%0.812SS**  trans72.8160163.9111-94.9000120.3
69T43.1Very low41.4Very low109 Ų109177.8 Ų177.867%0.66981%0.81SS**  -176.7133.4-76.734.90000111.1
70R38.4Very low41.5Very low254 Ų254177.8 Ų177.896%0.95881%0.81SS**  trans-157161.9151.2-138.5166.9-176.9159.50.9111.2
71S44.1Very low41.1Very low101 Ų101177.5 Ų177.571%0.70681%0.808SS**  trans-147.1171.9-150.1-40.80000114.2
72R42Very low41.1Very low236 Ų236178.3 Ų178.389%0.89181%0.811SS**  trans92.6145.8168.4-56.7169.7176.1173.7-2.4115.8
73S45.4Very low40.9Very low100 Ų100172.6 Ų172.670%0.69980%0.804SS**  cis-173.4167.2-19.4-98.30000111.7
74R42.5Very low41Very low234 Ų234179.9 Ų179.988%0.88382%0.818SS**  trans75.180.3156.8-71.6167-175.51750.2119.9
75S39.7Very low40.7Very low115 Ų115180.6 Ų180.680%0.80482%0.822SS**  17.2131119.8-35.30000121
76R42.4Very low40.5Very low256 Ų256178.4 Ų178.497%0.96682%0.815SS**  -164.2159.3121.6-106.2165.4-174.5-176.40.9110.7
77S36.5Very low40.4Very low111 Ų111171.6 Ų171.678%0.77680%0.801SS**  trans-116.9152-166.452.30000113.2
78H39.6Very low40.7Very low192 Ų192174.6 Ų174.689%0.88981%0.806SS**  trans-145.3140157.1-129.268.2000112.2
79R43.4Very low40.8Very low227 Ų227170 Ų17086%0.85780%0.795SS**  trans-89.1140.3179.2-58.2177.2-178.6-176.10.3109.5
80R41.3Very low40.9Very low244 Ų244175.7 Ų175.792%0.92181%0.806SS**  trans-153.383153.2-115.3174.9-167.3-161.23.2111.8R82R80-R82 PolarHBondContact O-N 2.9Å
81S38.4Very low41.3Very low114 Ų114173.4 Ų173.480%0.79780%0.797SS**  trans-68.1117.9166.3-28.50000108.9
82R38.8Very low41.4Very low250 Ų250179 Ų17994%0.94380%0.803SS**  trans-140.2126.6158.2-110.1177.4-176.5173.50.9110.5R80R80-R82 PolarHBondContact O-N 2.9Å
83S38.9Very low41.5Very low97 Ų97179.3 Ų179.368%0.67880%0.804SS**  trans-87.9155-167.1-37.10000111.8
84R40.3Very low41.6Very low245 Ų245183.9 Ų183.993%0.92581%0.814SS**  trans64.4123.3161.6-53.4160.1-177.5172.2-1.2113.2
85S35.9Very low41.6Very low99 Ų99176.2 Ų176.269%0.69280%0.796SS**  cis-148.3147.436.847.80000113.7S87S85-S87 PolarHBondContact O-N 3.38Å; S85-S87 VanDerWaalsContact O-N 3.13Å; S85-S87 PolarHBondContact OG-OG 3.17Å
86Y35.9Very low41.8Very low186 Ų186178 Ų17873%0.72979%0.791SS**  trans-79.685.5162.4-176.8-93.7000108.7R88 R91Y86-R88 PolarHBondContact O-N 2.81Å; Y86-R91 PolarHBondContact OH-NH2 3.29Å
87S40.7Very low42.1Very low70 Ų70171 Ų17149%0.4978%0.782SS.*  trans-63.4125.2-178.8-57.30000110.7S85 D89S85-S87 PolarHBondContact O-N 3.38Å; S85-S87 VanDerWaalsContact O-N 3.13Å; S85-S87 PolarHBondContact OG-OG 3.17Å; S87-D89 WeakPolarHBondContact CB-OD2 3.44Å; S87-D89 PolarHBondContact O-N 3.48Å
88R46.4Very low42.5Very low218 Ų218173.6 Ų173.682%0.82378%0.782SS**  trans-78.12.1-170.4-82.1178.3161.5177.3-4.8113.9Y86Y86-R88 PolarHBondContact O-N 2.81Å
89D43.6Very low42.8Very low111 Ų111168.1 Ų168.159%0.59477%0.765SS**G310 helixtrans-83-24.4-152.4-58.8-83.2000114.9S87 R91 R92S87-D89 WeakPolarHBondContact CB-OD2 3.44Å; S87-D89 PolarHBondContact O-N 3.48Å; D89-R91 PolarHBondContact O-N 3.07Å; D89-R91 VanDerWaalsContact O-N 3.1Å; D89-R92 PolarHBondContact O-N 3.38Å
90Y44.4Very low43.4Very low229 Ų229163.3 Ų163.390%0.89876%0.763SS**G310 helixtrans-68.8-7.1179.3-76.2-85.2000114.7
91R47.4Very low43.7Very low207 Ų207155.2 Ų155.278%0.78174%0.737SS**G310 helixtrans-111.318.3177.3-82.6-169-83.7-172.5-6.1115.5Y86 D89Y86-R91 PolarHBondContact OH-NH2 3.29Å; D89-R91 PolarHBondContact O-N 3.07Å; D89-R91 VanDerWaalsContact O-N 3.1Å
92R47Very low44.2Very low218 Ų218154.2 Ų154.282%0.82373%0.73SS**SBendtrans-122.1-2.4171.8-82.9-167.2175-160.4-0117.2D89 H94D89-R92 PolarHBondContact O-N 3.38Å; R92-H94 VanDerWaalsContact C-N 3.31Å; R92-H94 PolarHBondContact O-N 3.19Å
93R43Very low44.4Very low242 Ų242147.9 Ų147.991%0.91372%0.719SS**  trans-80.92.5177.6-71.7-167.8175.3-138-0.7115.9S95R93-S95 PolarHBondContact O-N 3.37Å
94H47.3Very low44.9Very low196 Ų196151.7 Ų151.791%0.90772%0.718SS**  trans-93.766.3170.2-164.386.1000111.6R92R92-H94 VanDerWaalsContact C-N 3.31Å; R92-H94 PolarHBondContact O-N 3.19Å
95S42.6Very low45.2Very low74 Ų74150 Ų15052%0.51771%0.712SS.*  trans-152.2148.8170.456.70000110.3R93R93-S95 PolarHBondContact O-N 3.37Å
96H44.7Very low45.9Very low151 Ų151156.3 Ų156.370%0.69972%0.721SS**  trans68.278.7-176.1-45.496.6000114.3H98H96-H98 PolarHBondContact O-N 3.43Å; H96-H98 PolarHBondContact O-ND1 3.2Å
97S47.3Very low46.5Very low110 Ų110152.6 Ų152.677%0.76971%0.71SS**  trans-54.799.1164.152.20000110.8S99S97-S99 PolarHBondContact O-N 3.1Å
98H45.9Very low46.9Very low166 Ų166156.3 Ų156.377%0.76973%0.729SS**  trans-72.177.6177.2-83.463000110.7H96H96-H98 PolarHBondContact O-N 3.43Å; H96-H98 PolarHBondContact O-ND1 3.2Å
99S46.4Very low47.3Very low76 Ų76148.4 Ų148.453%0.53172%0.715SS.*  trans-62.1127.3161-66.30000107.6S97 M101 S102S97-S99 PolarHBondContact O-N 3.1Å; S99-M101 PolarHBondContact O-N 3.13Å; S99-S102 WeakPolarHBondContact O-CB 3.32Å; S99-S102 PolarHBondContact O-N 3.27Å
100P54.5Low47.9Very low127 Ų127149.3 Ų149.383%0.82572%0.72SS**THydrogen-bonded Turntrans-67.35.4-171.326-35.1000115
101M48.4Very low48.5Very low74 Ų74147.8 Ų147.837%0.36571%0.712SS.*THydrogen-bonded Turntrans-107.2-1.8169.8-69.1-160.4137.400114.4S99 T103 R104 M208S99-M101 PolarHBondContact O-N 3.13Å; M101-T103 PolarHBondContact O-N 3.36Å; M101-T103 VanDerWaalsContact O-N 3.13Å; M101-R104 WeakPolarHBondContact O-CB 3.47Å; M101-R104 PolarHBondContact O-N 3.38Å; M101-R104 PolarHBondContact SD-NH2 3.34Å; M101-M208 HydrophobicContact CE-CB 3.83Å; M101-M208 HydrophobicContact CE-SD 4.42Å
102S48.4Very low49Very low93 Ų93141 Ų14165%0.6570%0.701SS**THydrogen-bonded Turntrans-66.5-13.3178.3-164.20000113S99S99-S102 WeakPolarHBondContact O-CB 3.32Å; S99-S102 PolarHBondContact O-N 3.27Å
103T44.1Very low49.8Very low117 Ų117135.6 Ų135.672%0.71869%0.689SS**THydrogen-bonded Turntrans-86.3-5.3172.343.90000114M101 R105M101-T103 PolarHBondContact O-N 3.36Å; M101-T103 VanDerWaalsContact O-N 3.13Å; T103-R105 PolarHBondContact O-N 2.77Å
104R48Very low51.2Low177 Ų177125.4 Ų125.467%0.66865%0.653SS**SBendtrans-66.583.5147.5-80.5-161.1-70.9-179.3-6.7106.4M101 R106M101-R104 WeakPolarHBondContact O-CB 3.47Å; M101-R104 PolarHBondContact O-N 3.38Å; M101-R104 PolarHBondContact SD-NH2 3.34Å; R104-R106 PolarHBondContact O-N 3.38Å
105R48Very low52.5Low209 Ų209121 Ų12179%0.78964%0.636SS**  trans-46.4117.3-179.3-66.3-177.7178.7-171.1-0.3107.5T103 H107T103-R105 PolarHBondContact O-N 2.77Å; R105-H107 PolarHBondContact O-N 2.92Å
106R48.8Very low54.3Low232 Ų232121 Ų12188%0.87564%0.635SS**  trans-53.3115159.3-63.1178.7-177.6-179.40104.3R104 V108R104-R106 PolarHBondContact O-N 3.38Å; R106-V108 WeakPolarHBondContact O-CG2 3.22Å; R106-V108 PolarHBondContact O-N 3.22Å
107H49.8Very low56.2Low108 Ų108114.4 Ų114.450%0.561%0.605SS.*  trans-51.9116.5-170.8-95.7-117.7000109.2R105 G109 I195R105-H107 PolarHBondContact O-N 2.92Å; H107-G109 PolarHBondContact O-N 2.81Å; H107-I195 HydrophobicContact CB-CG2 3.99Å; H107-I195 VanDerWaalsContact CE1-CG2 3.5Å; H107-I195 WeakPolarHBondContact CE1-CG2 3.29Å; H107-I195 PolarHBondContact CE1-O 2.9Å; H107-I195 VanDerWaalsContact CG-CG2 3.42Å; H107-I195 WeakPolarHBondContact ND1-CG2 3.4Å
108V48.1Very low58.1Low148 Ų148111 Ų11190%0.89758%0.581SS**SBendtrans-83.679.6179.2-174.80000105.8R106R106-V108 WeakPolarHBondContact O-CG2 3.22Å; R106-V108 PolarHBondContact O-N 3.22Å
109G55.2Low60.1Low51 Ų51103.4 Ų103.453%0.52655%0.546SS..SBendtrans-177.9162.5-171.900000109.3H107 R111H107-G109 PolarHBondContact O-N 2.81Å; G109-R111 PolarHBondContact O-N 3.11Å
110N56Low62.2Low131 Ų13199.8 Ų99.870%0.70152%0.521SS*.  trans-70.3100.1-172.5-74-26.3000111A112 N113N110-A112 PolarHBondContact O-N 3.48Å; N110-N113 CarbonylContact O-C 3.57Å; N110-N113 PolarHBondContact O-N 2.88Å; N110-N113 VanDerWaalsContact O-O 3.13Å
111R57.3Low64Low196 Ų19693.8 Ų93.874%0.7448%0.482SS*.THydrogen-bonded Turntrans-57.3-14.7174.8-69.8178.759.386.43.9114.4G109 I195G109-R111 PolarHBondContact O-N 3.11Å; R111-I195 HydrophobicContact CG-CD1 4.36Å
112A58.4Low66Low66 Ų6690.2 Ų90.255%0.54547%0.465SS..THydrogen-bonded Turntrans-91.2-18175.200000113.7N110N110-A112 PolarHBondContact O-N 3.48Å
113N63.6Low68.1Low104 Ų10489.5 Ų89.556%0.55645%0.45SS*.SBendtrans-155.185.7178.7-79.7-56.2000108.9N110N110-N113 CarbonylContact O-C 3.57Å; N110-N113 PolarHBondContact O-N 2.88Å; N110-N113 VanDerWaalsContact O-O 3.13Å
114P71.4Confident70.2Confident27 Ų2785.8 Ų85.818%0.17544%0.435CS..PPolyproline II helixtrans-75.9165.116731.5-29.5000110.7F193 I195P114-F193 HydrophobicContact CG-CB 3.91Å; P114-F193 WeakPolarHBondContact CG-O 3.44Å; P114-I195 HydrophobicContact CB-CG1 4.18Å; P114-I195 HydrophobicContact CG-CG1 4.08Å
115D75.9Confident72.2Confident103 Ų10377.5 Ų77.555%0.55140%0.404SS*.PPolyproline II helixtrans-54.9144.2179.4-36-42.6000111.6N117 K197D115-N117 PolarHBondContact O-N 2.91Å; D115-K197 IonicContact OD2-NZ 3.64Å; D115-K197 PolarHBondContact OD2-NZ 2.83Å
116P80.5Confident74.2Confident76 Ų7667.8 Ų67.849%0.49437%0.368SS..PPolyproline II helixtrans-58.9138.3174.726.2-34.7000111.3V169 F193P116-V169 HydrophobicContact CB-CG1 4.06Å; P116-F193 HydrophobicContact CB-CD2 4.41Å; P116-F193 HydrophobicContact CB-CE1 4.13Å; P116-F193 HydrophobicContact CB-CE2 3.89Å; P116-F193 HydrophobicContact CB-CZ 3.74Å
117N83.7Confident76Confident11 Ų1160.2 Ų60.26%0.05935%0.345CS..  trans-156.6160.1-179.258.8-6.3000110.7D115 C119 F193 S194 K197D115-N117 PolarHBondContact O-N 2.91Å; N117-C119 PolarHBondContact O-N 3.04Å; N117-C119 PolarHBondContact OD1-O 3.3Å; N117-C119 VanDerWaalsContact OD1-O 3.12Å; N117-F193 WeakPolarHBondContact OD1-CB 3.46Å; N117-S194 PolarHBondContact ND2-O 3.36Å; N117-K197 HydrophobicContact CB-CG 4.39Å
118C86.8Confident77.8Confident40 Ų4064.1 Ų64.127%0.2736%0.356SS..SBendtrans-68.14.6178.1-20.60000114.1Y165 F166 E167 N168 V169C118-Y165 CarbonylContact O-C 3.53Å; C118-Y165 WeakPolarHBondContact O-CA 3.24Å; C118-F166 HydrophobicContact CB-CB 4.23Å; C118-F166 WeakPolarHBondContact CB-O 3.47Å; C118-F166 PolarHBondContact O-N 3.47Å; C118-E167 PolarHBondContact SG-O 2.98Å; C118-N168 WeakPolarHBondContact CB-O 3.47Å; C118-V169 VanDerWaalsContact SG-CG2 3.53Å
119C88.7Confident79.6Confident5 Ų557.3 Ų57.33%0.03432%0.315CS..EExtended strand (participates in β ladder)trans-113109-177.7-178.10000110.6N117 V164 Y165 S194N117-C119 PolarHBondContact O-N 3.04Å; N117-C119 PolarHBondContact OD1-O 3.3Å; N117-C119 VanDerWaalsContact OD1-O 3.12Å; C119-V164 CarbonylContact C-O 3.57Å; C119-V164 WeakPolarHBondContact CA-O 3.24Å; C119-Y165 HydrophobicContact CB-CD1 3.89Å; C119-Y165 HydrophobicContact CB-CE1 4.03Å; C119-Y165 WeakPolarHBondContact SG-CE1 3.46Å; C119-S194 VanDerWaalsContact O-CB 3.24Å; C119-S194 WeakPolarHBondContact O-CB 3.3Å; C119-S194 PolarHBondContact O-N 3.09Å; C119-S194 WeakPolarHBondContact SG-CB 3.11Å
120L91.2Very high81.3Confident0 Ų057.6 Ų57.60%031%0.306CS..EExtended strand (participates in β ladder)trans-97.6131.5176-57.7-172.9000110.9F163 V164 F166 A172 A175 K176 V191 D192 F193L120-F163 WeakPolarHBondContact O-CA 3.22Å; L120-V164 PolarHBondContact N-O 3.13Å; L120-V164 PolarHBondContact O-N 2.85Å; L120-F166 HydrophobicContact CD1-CD2 4.32Å; L120-F166 HydrophobicContact CD1-CE2 3.71Å; L120-F166 HydrophobicContact CG-CD2 4.37Å; L120-F166 HydrophobicContact CG-CE2 4.18Å; L120-A172 HydrophobicContact CD1-CB 4.41Å; L120-A172 WeakPolarHBondContact CD1-O 3.37Å; L120-A172 HydrophobicContact CD2-CB 4.11Å; L120-A172 HydrophobicContact CG-CB 4.16Å; L120-A175 HydrophobicContact CD1-CB 3.82Å; L120-K176 HydrophobicContact CD1-CB 4.42Å; L120-K176 HydrophobicContact CD2-CB 4.28Å; L120-V191 HydrophobicContact CB-CG1 4Å; L120-V191 HydrophobicContact CD1-CG1 3.71Å; L120-V191 HydrophobicContact CG-CG1 4.3Å; L120-D192 CarbonylContact C-O 3.06Å; L120-D192 WeakPolarHBondContact CA-O 3.4Å; L120-F193 HydrophobicContact CD2-CD1 3.52Å; L120-F193 HydrophobicContact CD2-CE1 3.82Å; L120-F193 HydrophobicContact CD2-CG 4.47Å
121G91.3Very high83Confident1 Ų154.9 Ų54.91%0.0129%0.29CS..EExtended strand (participates in β ladder)trans-88.1118.6164.500000109.8F123 D192G121-F123 WeakPolarHBondContact O-CD2 3.4Å; G121-F123 WeakPolarHBondContact O-CE2 3.42Å; G121-D192 PolarHBondContact N-O 2.88Å; G121-D192 PolarHBondContact O-N 2.84Å
122V91.7Very high84.6Confident0 Ų054 Ų540%029%0.286CS..EExtended strand (participates in β ladder)trans-104.2123.7177.6-171.30000108.5L125 F138 F161 A162 V164 I189 V191V122-L125 HydrophobicContact CG1-CD2 3.67Å; V122-L125 HydrophobicContact CG1-CG 4.2Å; V122-F138 HydrophobicContact CG1-CE2 4.32Å; V122-F138 HydrophobicContact CG1-CZ 4.26Å; V122-F138 HydrophobicContact CG2-CE2 3.78Å; V122-F138 HydrophobicContact CG2-CZ 3.61Å; V122-F161 CarbonylContact O-C 3.6Å; V122-F161 WeakPolarHBondContact O-CA 3.36Å; V122-F161 VanDerWaalsContact O-CB 3.27Å; V122-F161 WeakPolarHBondContact O-CB 3.44Å; V122-A162 PolarHBondContact N-O 3.04Å; V122-A162 PolarHBondContact O-N 2.86Å; V122-V164 HydrophobicContact CG2-CG2 4.02Å; V122-I189 HydrophobicContact CG1-CB 4.27Å; V122-I189 HydrophobicContact CG1-CD1 4.14Å; V122-V191 HydrophobicContact CG1-CG2 4.33Å; V122-V191 HydrophobicContact CG2-CG2 4.46Å
123F90.8Very high86.2Confident77 Ų7753.4 Ų53.434%0.33827%0.274SS..EExtended strand (participates in β ladder)trans-123.1151.3-174.3-55.8-85.4000111.1G121 F161 I189 R190 D192G121-F123 WeakPolarHBondContact O-CD2 3.4Å; G121-F123 WeakPolarHBondContact O-CE2 3.42Å; F123-F161 HydrophobicContact CD1-CB 3.66Å; F123-F161 HydrophobicContact CD1-CG 4.28Å; F123-F161 HydrophobicContact CE1-CB 4.16Å; F123-F161 HydrophobicContact CE1-CD2 4.45Å; F123-F161 HydrophobicContact CE1-CG 4.4Å; F123-F161 HydrophobicContact CG-CB 4.42Å; F123-I189 CarbonylContact O-C 3.58Å; F123-I189 WeakPolarHBondContact O-CA 3.4Å; F123-R190 HydrophobicContact CB-CB 4.41Å; F123-R190 PolarHBondContact N-O 2.81Å; F123-R190 PolarHBondContact O-N 2.63Å; F123-D192 HydrophobicContact CE2-CB 4.36Å
124G89.3Confident87.6Confident39 Ų3948.5 Ų48.540%0.40225%0.247SC..SBendtrans9011.6178.400000114.5G160 R187G124-G160 PolarHBondContact N-O 2.89Å; G124-R187 WeakPolarHBondContact O-CB 3.26Å
125L90.8Very high88.6Confident3 Ų352 Ų522%0.01626%0.257CS..  trans-59.6162.3-179.5-61-179.9000112.9V122 T129 L134 G160 A162 L184 R187 I189V122-L125 HydrophobicContact CG1-CD2 3.67Å; V122-L125 HydrophobicContact CG1-CG 4.2Å; L125-T129 HydrophobicContact CD2-CG2 4.49Å; L125-L134 HydrophobicContact CD1-CD1 3.98Å; L125-L134 HydrophobicContact CD1-CD2 4.07Å; L125-L134 HydrophobicContact CD2-CD2 3.77Å; L125-G160 PolarHBondContact N-O 3.47Å; L125-A162 HydrophobicContact CD1-CB 3.58Å; L125-L184 HydrophobicContact CD2-CD2 3.88Å; L125-R187 PolarHBondContact O-NH1 3.46Å; L125-I189 HydrophobicContact CD2-CG2 3.81Å
126S89.9Confident89.4Confident5 Ų552.7 Ų52.74%0.03526%0.257CS..  trans-75166.1171.6-163.60000112T129 S158 D185S126-T129 WeakPolarHBondContact CA-OG1 3.45Å; S126-T129 VanDerWaalsContact CB-OG1 3.25Å; S126-T129 WeakPolarHBondContact CB-OG1 3.36Å; S126-T129 PolarHBondContact N-OG1 3.01Å; S126-S158 PolarHBondContact O-OG 2.95Å; S126-S158 VanDerWaalsContact O-OG 3.12Å; S126-D185 WeakPolarHBondContact CB-OD2 3.44Å
127L86.3Confident89.9Confident74 Ų7450.5 Ų50.539%0.38724%0.242SC..SBendtrans-76.3-12.3171.6-64.3176.8000112S158L127-S158 WeakPolarHBondContact CD2-O 3.46Å
128Y86.1Confident90.2Very high190 Ų19050 Ų5075%0.74524%0.239SC*.SBendtrans-104-19.8-178.2-54.5-74.3000113.2T130Y128-T130 PolarHBondContact O-N 2.96Å
129T87.5Confident90.4Very high4 Ų451.2 Ų51.23%0.02525%0.249CC..  trans-57.7128.1177.7-40.60000110.9L125 S126 D133 L134 I149 L184 D185L125-T129 HydrophobicContact CD2-CG2 4.49Å; S126-T129 WeakPolarHBondContact CA-OG1 3.45Å; S126-T129 VanDerWaalsContact CB-OG1 3.25Å; S126-T129 WeakPolarHBondContact CB-OG1 3.36Å; S126-T129 PolarHBondContact N-OG1 3.01Å; T129-D133 HydrophobicContact CG2-CB 4.28Å; T129-L134 HydrophobicContact CG2-CD2 3.99Å; T129-L134 HydrophobicContact CG2-CG 4.03Å; T129-I149 WeakPolarHBondContact O-CD1 3.37Å; T129-L184 HydrophobicContact CG2-CD2 3.55Å; T129-L184 HydrophobicContact CG2-CG 4.45Å; T129-D185 WeakPolarHBondContact CA-OD2 3.46Å; T129-D185 WeakPolarHBondContact CB-OD2 3.29Å; T129-D185 PolarHBondContact N-OD2 3.47Å; T129-D185 PolarHBondContact OG1-OD2 2.87Å
130T90Very high90.6Very high57 Ų5756.7 Ų56.735%0.3527%0.272SS..  trans-105.3169.6179.176.30000112.1Y128 R132 D133 L134 I149Y128-T130 PolarHBondContact O-N 2.96Å; T130-R132 PolarHBondContact O-N 2.81Å; T130-R132 PolarHBondContact OG1-N 3.21Å; T130-D133 WeakPolarHBondContact CA-OD2 3.47Å; T130-D133 VanDerWaalsContact CB-OD2 3.27Å; T130-D133 WeakPolarHBondContact CB-OD2 3.12Å; T130-D133 PolarHBondContact N-OD2 2.99Å; T130-D133 PolarHBondContact O-N 3.34Å; T130-D133 VanDerWaalsContact OG1-CG 3.25Å; T130-D133 PolarHBondContact OG1-N 2.97Å; T130-D133 PolarHBondContact OG1-OD2 2.84Å; T130-L134 WeakPolarHBondContact O-CG 3.41Å; T130-L134 PolarHBondContact O-N 3.46Å; T130-I149 VanDerWaalsContact C-CD1 3.42Å
131E91.3Very high90.6Very high75 Ų7557.9 Ų57.935%0.3528%0.277SS..Hα-helixtrans-65-20.8175.7-72.6159-178.400112.5R135 V147 I149E131-R135 WeakPolarHBondContact O-CB 3.27Å; E131-R135 PolarHBondContact O-N 2.61Å; E131-R135 VanDerWaalsContact O-N 3.12Å; E131-V147 HydrophobicContact CB-CG1 4.22Å; E131-V147 HydrophobicContact CG-CG1 4.15Å; E131-I149 HydrophobicContact CG-CB 4.07Å; E131-I149 HydrophobicContact CG-CD1 3.8Å; E131-I149 HydrophobicContact CG-CG1 3.62Å; E131-I149 PolarHBondContact OE1-N 3.47Å
132R92.1Very high90.5Very high177 Ų17758.5 Ų58.567%0.66828%0.283SS*.Hα-helixtrans-73.1-51.5173.8-68-174.555.5171.3-5.2111.7T130 L134 R135 E136T130-R132 PolarHBondContact O-N 2.81Å; T130-R132 PolarHBondContact OG1-N 3.21Å; R132-L134 PolarHBondContact O-N 3.12Å; R132-R135 CarbonylContact O-C 3.52Å; R132-R135 WeakPolarHBondContact O-CA 3.5Å; R132-R135 WeakPolarHBondContact O-CB 3.25Å; R132-R135 PolarHBondContact O-N 3.14Å; R132-E136 IonicContact NE-OE1 3.31Å; R132-E136 IonicContact NH2-OE1 3.51Å; R132-E136 PolarHBondContact NH2-OE1 2.71Å; R132-E136 WeakPolarHBondContact O-CG 3.46Å; R132-E136 PolarHBondContact O-N 2.97Å
133D91.8Very high90.6Very high54 Ų5461.1 Ų61.129%0.28930%0.3SS..Hα-helixtrans-60.9-38.6-177.7-39.6-52.9000110.5T129 T130 V137T129-D133 HydrophobicContact CG2-CB 4.28Å; T130-D133 WeakPolarHBondContact CA-OD2 3.47Å; T130-D133 VanDerWaalsContact CB-OD2 3.27Å; T130-D133 WeakPolarHBondContact CB-OD2 3.12Å; T130-D133 PolarHBondContact N-OD2 2.99Å; T130-D133 PolarHBondContact O-N 3.34Å; T130-D133 VanDerWaalsContact OG1-CG 3.25Å; T130-D133 PolarHBondContact OG1-N 2.97Å; T130-D133 PolarHBondContact OG1-OD2 2.84Å; D133-V137 VanDerWaalsContact O-CB 3.29Å; D133-V137 WeakPolarHBondContact O-CB 3.34Å; D133-V137 VanDerWaalsContact O-CG2 3.26Å; D133-V137 WeakPolarHBondContact O-CG2 3.47Å; D133-V137 PolarHBondContact O-N 2.72Å
134L91.8Very high90.7Very high0 Ų058.2 Ų58.20%029%0.288CS..Hα-helixtrans-62.6-47.6170.6-66.6178.1000112.2L125 T129 T130 R132 E136 V137 F138 V147 I149 A162 L184L125-L134 HydrophobicContact CD1-CD1 3.98Å; L125-L134 HydrophobicContact CD1-CD2 4.07Å; L125-L134 HydrophobicContact CD2-CD2 3.77Å; T129-L134 HydrophobicContact CG2-CD2 3.99Å; T129-L134 HydrophobicContact CG2-CG 4.03Å; T130-L134 WeakPolarHBondContact O-CG 3.41Å; T130-L134 PolarHBondContact O-N 3.46Å; R132-L134 PolarHBondContact O-N 3.12Å; L134-E136 PolarHBondContact O-N 2.81Å; L134-V137 PolarHBondContact O-N 3.07Å; L134-F138 HydrophobicContact CD2-CE2 4.24Å; L134-F138 WeakPolarHBondContact O-CB 3.26Å; L134-F138 WeakPolarHBondContact O-CD2 3.48Å; L134-F138 PolarHBondContact O-N 2.9Å; L134-V147 HydrophobicContact CB-CG1 3.94Å; L134-V147 HydrophobicContact CD1-CG1 3.9Å; L134-I149 HydrophobicContact CD1-CD1 3.8Å; L134-I149 HydrophobicContact CD1-CG1 3.71Å; L134-A162 HydrophobicContact CD1-CB 3.51Å; L134-L184 HydrophobicContact CD2-CD2 4.06Å
135R93.3Very high90.8Very high100 Ų10059.2 Ų59.238%0.37729%0.292SS..Hα-helixtrans-60.6-45.9178.8-173174.6-72.3-89.43111E131 R132 F138 S139 I144 V147E131-R135 WeakPolarHBondContact O-CB 3.27Å; E131-R135 PolarHBondContact O-N 2.61Å; E131-R135 VanDerWaalsContact O-N 3.12Å; R132-R135 CarbonylContact O-C 3.52Å; R132-R135 WeakPolarHBondContact O-CA 3.5Å; R132-R135 WeakPolarHBondContact O-CB 3.25Å; R132-R135 PolarHBondContact O-N 3.14Å; R135-F138 PolarHBondContact O-N 2.91Å; R135-S139 WeakPolarHBondContact O-CB 3.27Å; R135-S139 PolarHBondContact O-N 3.46Å; R135-I144 HydrophobicContact CG-CD1 4.25Å; R135-I144 PolarHBondContact NH1-O 2.89Å; R135-V147 HydrophobicContact CB-CG2 4.22Å
136E92.1Very high90.8Very high118 Ų11862.6 Ų62.655%0.55131%0.311SS*.Hα-helixtrans-63.1-43.1178.4-68170.6-153.100111.4R132 L134R132-E136 IonicContact NE-OE1 3.31Å; R132-E136 IonicContact NH2-OE1 3.51Å; R132-E136 PolarHBondContact NH2-OE1 2.71Å; R132-E136 WeakPolarHBondContact O-CG 3.46Å; R132-E136 PolarHBondContact O-N 2.97Å; L134-E136 PolarHBondContact O-N 2.81Å
137V90.7Very high91Very high30 Ų3062.7 Ų62.718%0.18231%0.311CS..Hα-helixtrans-72.3-33.5179.5167.30000113.8D133 L134 K140 M182 L184D133-V137 VanDerWaalsContact O-CB 3.29Å; D133-V137 WeakPolarHBondContact O-CB 3.34Å; D133-V137 VanDerWaalsContact O-CG2 3.26Å; D133-V137 WeakPolarHBondContact O-CG2 3.47Å; D133-V137 PolarHBondContact O-N 2.72Å; L134-V137 PolarHBondContact O-N 3.07Å; V137-K140 VanDerWaalsContact O-CD 3.29Å; V137-K140 WeakPolarHBondContact O-CD 3.29Å; V137-K140 WeakPolarHBondContact O-CE 3.49Å; V137-K140 WeakPolarHBondContact O-CG 3.45Å; V137-K140 PolarHBondContact O-NZ 3.36Å; V137-K140 VanDerWaalsContact O-NZ 3.09Å; V137-M182 HydrophobicContact CG1-SD 3.7Å; V137-L184 HydrophobicContact CG2-CD1 3.84Å
138F91Very high91.1Very high0 Ų061.3 Ų61.30%031%0.307CS..Hα-helixtrans-90.9-24.2-179.9-78.9-78000113.9V122 L134 R135 K140 Y141 I144 V164 F166 A175 A179 I189 V191V122-F138 HydrophobicContact CG1-CE2 4.32Å; V122-F138 HydrophobicContact CG1-CZ 4.26Å; V122-F138 HydrophobicContact CG2-CE2 3.78Å; V122-F138 HydrophobicContact CG2-CZ 3.61Å; L134-F138 HydrophobicContact CD2-CE2 4.24Å; L134-F138 WeakPolarHBondContact O-CB 3.26Å; L134-F138 WeakPolarHBondContact O-CD2 3.48Å; L134-F138 PolarHBondContact O-N 2.9Å; R135-F138 PolarHBondContact O-N 2.91Å; F138-K140 PolarHBondContact O-N 3.12Å; F138-K140 VanDerWaalsContact O-N 3.07Å; F138-Y141 HydrophobicContact CD1-CD2 4.05Å; F138-Y141 HydrophobicContact CD1-CE2 4.2Å; F138-Y141 WeakPolarHBondContact O-CD2 3.38Å; F138-Y141 PolarHBondContact O-N 3.22Å; F138-I144 HydrophobicContact CB-CD1 3.61Å; F138-V164 HydrophobicContact CB-CG1 4.36Å; F138-V164 HydrophobicContact CD2-CG2 4Å; F138-V164 HydrophobicContact CE2-CG2 4.27Å; F138-V164 HydrophobicContact CG-CG1 4.48Å; F138-V164 HydrophobicContact CG-CG2 4.41Å; F138-F166 HydrophobicContact CB-CZ 4.05Å; F138-F166 HydrophobicContact CD1-CE2 4.42Å; F138-F166 HydrophobicContact CD1-CZ 4.03Å; F138-F166 HydrophobicContact CG-CZ 4.44Å; F138-A175 HydrophobicContact CD1-CB 4.17Å; F138-A175 HydrophobicContact CE1-CB 4.48Å; F138-A179 HydrophobicContact CE1-CB 3.69Å; F138-A179 HydrophobicContact CZ-CB 4.08Å; F138-I189 HydrophobicContact CZ-CD1 4.26Å; F138-V191 HydrophobicContact CE1-CG2 4.41Å; F138-V191 HydrophobicContact CZ-CG2 4.05Å
139S91.5Very high91.3Very high67 Ų6752.6 Ų52.647%0.46927%0.274SS..THydrogen-bonded Turntrans-65.7-13.5-177.2-176.20000113.7R135 Y141R135-S139 WeakPolarHBondContact O-CB 3.27Å; R135-S139 PolarHBondContact O-N 3.46Å; S139-Y141 PolarHBondContact O-N 2.89Å
140K91.9Very high91.4Very high119 Ų11953.8 Ų53.852%0.51728%0.281SS..THydrogen-bonded Turntrans-74.1-9172.575.3-163.3179.6-149.50114.3V137 F138V137-K140 VanDerWaalsContact O-CD 3.29Å; V137-K140 WeakPolarHBondContact O-CD 3.29Å; V137-K140 WeakPolarHBondContact O-CE 3.49Å; V137-K140 WeakPolarHBondContact O-CG 3.45Å; V137-K140 PolarHBondContact O-NZ 3.36Å; V137-K140 VanDerWaalsContact O-NZ 3.09Å; F138-K140 PolarHBondContact O-N 3.12Å; F138-K140 VanDerWaalsContact O-N 3.07Å
141Y90.7Very high91.2Very high26 Ų2656.4 Ų56.410%0.10229%0.285CS..SBendtrans-104-16.3177.8-55.9-63.7000113.4F138 S139 A175 R178 A179 M182F138-Y141 HydrophobicContact CD1-CD2 4.05Å; F138-Y141 HydrophobicContact CD1-CE2 4.2Å; F138-Y141 WeakPolarHBondContact O-CD2 3.38Å; F138-Y141 PolarHBondContact O-N 3.22Å; S139-Y141 PolarHBondContact O-N 2.89Å; Y141-A175 HydrophobicContact CD2-CB 3.63Å; Y141-A175 HydrophobicContact CE2-CB 4.37Å; Y141-A175 HydrophobicContact CG-CB 3.79Å; Y141-R178 HydrophobicContact CD1-CB 4.38Å; Y141-R178 HydrophobicContact CE1-CB 3.48Å; Y141-R178 VanDerWaalsContact CE1-CB 3.48Å; Y141-R178 HydrophobicContact CE1-CG 4.19Å; Y141-A179 HydrophobicContact CE2-CB 4.03Å; Y141-M182 VanDerWaalsContact OH-CE 3.25Å; Y141-M182 WeakPolarHBondContact OH-CE 3.33Å
142G91Very high90.9Very high14 Ų1455.3 Ų55.314%0.14428%0.281CS..SBendtrans156.4171.5-179.100000113.1
143P93.4Very high90.2Very high55 Ų5553.6 Ų53.636%0.35728%0.281SS..  trans-61.5134178.524.7-36000113.5F166 E167 D171P143-F166 WeakPolarHBondContact O-CA 3.09Å; P143-F166 WeakPolarHBondContact O-CD1 3.36Å; P143-E167 HydrophobicContact CB-CG 4.15Å; P143-E167 WeakPolarHBondContact CB-OE2 3.32Å; P143-E167 HydrophobicContact CG-CB 4.18Å; P143-E167 HydrophobicContact CG-CG 4.33Å; P143-E167 WeakPolarHBondContact CG-OE2 3.24Å; P143-E167 PolarHBondContact O-N 2.81Å; P143-E167 VanDerWaalsContact O-N 3.15Å; P143-D171 WeakPolarHBondContact CD-OD2 3.26Å
144I92.7Very high89.5Confident16 Ų1659.7 Ų59.78%0.08231%0.308CS..EExtended strand (participates in β ladder)trans-109.6108.7-179.3-59.5173.3000110R135 F138 D146 V147 V164 Y165 F166R135-I144 HydrophobicContact CG-CD1 4.25Å; R135-I144 PolarHBondContact NH1-O 2.89Å; F138-I144 HydrophobicContact CB-CD1 3.61Å; I144-D146 WeakPolarHBondContact CG2-O 3.38Å; I144-V147 HydrophobicContact CG2-CG2 3.61Å; I144-V164 HydrophobicContact CD1-CG1 4.24Å; I144-V164 HydrophobicContact CG1-CG1 4.3Å; I144-V164 HydrophobicContact CG2-CG1 3.98Å; I144-Y165 CarbonylContact C-O 3.57Å; I144-F166 HydrophobicContact CG1-CD1 4.3Å; I144-F166 HydrophobicContact CG1-CE1 4.06Å; I144-F166 HydrophobicContact CG1-CZ 4.47Å
145A91.7Very high88.9Confident60 Ų6062.5 Ų62.550%0.49633%0.328SS..EExtended strand (participates in β ladder)trans-61.4-49.2171.900000111.9Y165 E167A145-Y165 PolarHBondContact N-O 3.04Å; A145-E167 HydrophobicContact CB-CG 4.16Å
146D91.2Very high88.3Confident74 Ų7468.1 Ų68.140%0.39635%0.349SS..EExtended strand (participates in β ladder)trans-151.9156.9-176.4-17130.6000113.8I144 Y165I144-D146 WeakPolarHBondContact CG2-O 3.38Å; D146-Y165 HydrophobicContact CB-CD2 3.83Å; D146-Y165 HydrophobicContact CB-CG 4.35Å; D146-Y165 PolarHBondContact N-O 2.81Å; D146-Y165 PolarHBondContact O-N 3.47Å
147V92Very high87.9Confident7 Ų770.1 Ų70.14%0.04235%0.351CS..EExtended strand (participates in β ladder)trans-137.4122.6174-175.10000109E131 L134 R135 I144 F163 V164E131-V147 HydrophobicContact CB-CG1 4.22Å; E131-V147 HydrophobicContact CG-CG1 4.15Å; L134-V147 HydrophobicContact CB-CG1 3.94Å; L134-V147 HydrophobicContact CD1-CG1 3.9Å; R135-V147 HydrophobicContact CB-CG2 4.22Å; I144-V147 HydrophobicContact CG2-CG2 3.61Å; V147-F163 WeakPolarHBondContact CA-O 3.23Å; V147-V164 HydrophobicContact CG1-CG2 4.45Å
148S90.2Very high87.6Confident45 Ų4569.2 Ų69.232%0.31535%0.346SS..EExtended strand (participates in β ladder)trans-126.8109.3-178.1-174.60000111.1A162 F163S148-A162 CarbonylContact O-C 3.55Å; S148-A162 WeakPolarHBondContact O-CA 3.37Å; S148-F163 PolarHBondContact N-O 2.57Å; S148-F163 PolarHBondContact O-N 2.83Å
149I90.5Very high87.4Confident7 Ų775.7 Ų75.74%0.03637%0.371CS..EExtended strand (participates in β ladder)trans-82.2134171-69.9-178.8000109.6T129 T130 E131 L134 Y151 A162T129-I149 WeakPolarHBondContact O-CD1 3.37Å; T130-I149 VanDerWaalsContact C-CD1 3.42Å; E131-I149 HydrophobicContact CG-CB 4.07Å; E131-I149 HydrophobicContact CG-CD1 3.8Å; E131-I149 HydrophobicContact CG-CG1 3.62Å; E131-I149 PolarHBondContact OE1-N 3.47Å; L134-I149 HydrophobicContact CD1-CD1 3.8Å; L134-I149 HydrophobicContact CD1-CG1 3.71Å; I149-Y151 HydrophobicContact CB-CD2 4.42Å; I149-Y151 HydrophobicContact CB-CE2 3.67Å; I149-Y151 HydrophobicContact CG2-CD1 4.28Å; I149-Y151 HydrophobicContact CG2-CD2 4.12Å; I149-Y151 HydrophobicContact CG2-CE1 3.83Å; I149-Y151 HydrophobicContact CG2-CE2 3.66Å; I149-Y151 HydrophobicContact CG2-CG 4.4Å; I149-Y151 VanDerWaalsContact CG2-CZ 3.49Å; I149-Y151 VanDerWaalsContact O-CD2 3.23Å; I149-Y151 WeakPolarHBondContact O-CD2 3.44Å; I149-Y151 WeakPolarHBondContact O-CE2 3.43Å; I149-Y151 PolarHBondContact O-N 2.98Å; I149-A162 HydrophobicContact CB-CB 4.49Å; I149-A162 HydrophobicContact CG1-CB 3.81Å
150V87.9Confident87.2Confident28 Ų2873.1 Ų73.117%0.1736%0.355CS..EExtended strand (participates in β ladder)trans-89.8103.6176.4-169.20000109.9R159 F161 F163V150-R159 VanDerWaalsContact O-CB 3.22Å; V150-R159 WeakPolarHBondContact O-CB 3.32Å; V150-R159 VanDerWaalsContact O-CG 3.24Å; V150-R159 WeakPolarHBondContact O-CG 3.36Å; V150-R159 PolarHBondContact O-N 3.34Å; V150-F161 HydrophobicContact CB-CD2 4.18Å; V150-F161 HydrophobicContact CB-CE1 4.48Å; V150-F161 HydrophobicContact CB-CE2 3.68Å; V150-F161 HydrophobicContact CB-CZ 3.84Å; V150-F161 HydrophobicContact CG1-CE2 4.13Å; V150-F161 HydrophobicContact CG1-CZ 3.91Å; V150-F161 HydrophobicContact CG2-CD2 3.95Å; V150-F161 HydrophobicContact CG2-CE2 3.47Å; V150-F161 VanDerWaalsContact CG2-CE2 3.47Å; V150-F161 HydrophobicContact CG2-CZ 4.11Å; V150-F161 PolarHBondContact N-O 3.11Å; V150-F163 HydrophobicContact CG2-CD2 3.98Å; V150-F163 HydrophobicContact CG2-CE2 3.73Å
151Y87.4Confident87.2Confident112 Ų11269.5 Ų69.544%0.43934%0.339SS..EExtended strand (participates in β ladder)trans-82.1151.4172.8-57-88.2000111.9I149 R157I149-Y151 HydrophobicContact CB-CD2 4.42Å; I149-Y151 HydrophobicContact CB-CE2 3.67Å; I149-Y151 HydrophobicContact CG2-CD1 4.28Å; I149-Y151 HydrophobicContact CG2-CD2 4.12Å; I149-Y151 HydrophobicContact CG2-CE1 3.83Å; I149-Y151 HydrophobicContact CG2-CE2 3.66Å; I149-Y151 HydrophobicContact CG2-CG 4.4Å; I149-Y151 VanDerWaalsContact CG2-CZ 3.49Å; I149-Y151 VanDerWaalsContact O-CD2 3.23Å; I149-Y151 WeakPolarHBondContact O-CD2 3.44Å; I149-Y151 WeakPolarHBondContact O-CE2 3.43Å; I149-Y151 PolarHBondContact O-N 2.98Å; Y151-R157 WeakPolarHBondContact CA-O 3.15Å
152D84.4Confident87.2Confident52 Ų5268.2 Ų68.228%0.27833%0.334SS..  trans-84.7126.6167.6167.643.8000110.3Q154 S155 R156 R157 R159D152-Q154 VanDerWaalsContact C-N 3.26Å; D152-Q154 PolarHBondContact O-N 3.05Å; D152-Q154 PolarHBondContact OD1-N 3.12Å; D152-S155 VanDerWaalsContact OD2-CB 3.24Å; D152-S155 WeakPolarHBondContact OD2-CB 3.49Å; D152-S155 PolarHBondContact OD2-N 3.16Å; D152-S155 PolarHBondContact OD2-OG 2.83Å; D152-R156 VanDerWaalsContact O-CA 3.3Å; D152-R156 WeakPolarHBondContact O-CA 3.25Å; D152-R156 PolarHBondContact O-N 2.87Å; D152-R157 PolarHBondContact N-O 3.36Å; D152-R159 HydrophobicContact CB-CG 3.91Å
153Q76.6Confident87.3Confident141 Ų14168.4 Ų68.466%0.65933%0.331SS*.THydrogen-bonded Turntrans-68.8-23.6-177.3-169.7172.55.200112.7
154Q77.8Confident87.2Confident183 Ų18365.8 Ų65.886%0.85531%0.314SS*.THydrogen-bonded Turntrans-81.8-50.4179.8-64.3-169.9-10.300112.5D152D152-Q154 VanDerWaalsContact C-N 3.26Å; D152-Q154 PolarHBondContact O-N 3.05Å; D152-Q154 PolarHBondContact OD1-N 3.12Å
155S80Confident87.2Confident59 Ų5966.2 Ų66.241%0.41332%0.315SS..THydrogen-bonded Turntrans-91.1-9.4-17664.20000115D152 R157D152-S155 VanDerWaalsContact OD2-CB 3.24Å; D152-S155 WeakPolarHBondContact OD2-CB 3.49Å; D152-S155 PolarHBondContact OD2-N 3.16Å; D152-S155 PolarHBondContact OD2-OG 2.83Å; S155-R157 PolarHBondContact O-N 2.82Å; S155-R157 VanDerWaalsContact O-N 3.12Å; S155-R157 PolarHBondContact OG-N 3.14Å
156R79Confident87.2Confident217 Ų21763.7 Ų63.782%0.81929%0.293SS*.  trans59.76.3-169.8-66-71.5-159.6169.36.4115.1D152D152-R156 VanDerWaalsContact O-CA 3.3Å; D152-R156 WeakPolarHBondContact O-CA 3.25Å; D152-R156 PolarHBondContact O-N 2.87Å
157R83.5Confident87.3Confident160 Ų16066 Ų6660%0.60430%0.301SS*.SBendtrans-87.1154.5-179.6-63.6176.3-177-161.7-3.6111.1Y151 D152 S155Y151-R157 WeakPolarHBondContact CA-O 3.15Å; D152-R157 PolarHBondContact N-O 3.36Å; S155-R157 PolarHBondContact O-N 2.82Å; S155-R157 VanDerWaalsContact O-N 3.12Å; S155-R157 PolarHBondContact OG-N 3.14Å
158S85.3Confident87.3Confident11 Ų1169.5 Ų69.58%0.07732%0.32CS..EExtended strand (participates in β ladder)trans-62.5147.8168.977.30000109.7S126 L127 G160S126-S158 PolarHBondContact O-OG 2.95Å; S126-S158 VanDerWaalsContact O-OG 3.12Å; L127-S158 WeakPolarHBondContact CD2-O 3.46Å; S158-G160 PolarHBondContact O-N 2.83Å
159R86Confident87.3Confident136 Ų13670 Ų7051%0.51332%0.321SS..EExtended strand (participates in β ladder)trans-8511.2178.3-63.5179.268.3-165.5-3.6113.3V150 D152 F161V150-R159 VanDerWaalsContact O-CB 3.22Å; V150-R159 WeakPolarHBondContact O-CB 3.32Å; V150-R159 VanDerWaalsContact O-CG 3.24Å; V150-R159 WeakPolarHBondContact O-CG 3.36Å; V150-R159 PolarHBondContact O-N 3.34Å; D152-R159 HydrophobicContact CB-CG 3.91Å; R159-F161 VanDerWaalsContact C-N 3.27Å; R159-F161 HydrophobicContact CB-CD1 3.74Å; R159-F161 HydrophobicContact CB-CE1 3.5Å; R159-F161 VanDerWaalsContact CB-CE1 3.5Å; R159-F161 HydrophobicContact CB-CZ 4.42Å; R159-F161 HydrophobicContact CG-CE1 4.43Å; R159-F161 WeakPolarHBondContact O-CD1 3.39Å; R159-F161 PolarHBondContact O-N 2.86Å
160G88.9Confident87.4Confident14 Ų1475.4 Ų75.414%0.14435%0.35CS..EExtended strand (participates in β ladder)trans70.418.3-174.400000114.3G124 L125 S158G124-G160 PolarHBondContact N-O 2.89Å; L125-G160 PolarHBondContact N-O 3.47Å; S158-G160 PolarHBondContact O-N 2.83Å
161F90.7Very high87.6Confident42 Ų4275.7 Ų75.718%0.18435%0.35CS..EExtended strand (participates in β ladder)trans-147.4153.2173.171.6-88.5000113.3V122 F123 V150 R159 F163V122-F161 CarbonylContact O-C 3.6Å; V122-F161 WeakPolarHBondContact O-CA 3.36Å; V122-F161 VanDerWaalsContact O-CB 3.27Å; V122-F161 WeakPolarHBondContact O-CB 3.44Å; F123-F161 HydrophobicContact CD1-CB 3.66Å; F123-F161 HydrophobicContact CD1-CG 4.28Å; F123-F161 HydrophobicContact CE1-CB 4.16Å; F123-F161 HydrophobicContact CE1-CD2 4.45Å; F123-F161 HydrophobicContact CE1-CG 4.4Å; F123-F161 HydrophobicContact CG-CB 4.42Å; V150-F161 HydrophobicContact CB-CD2 4.18Å; V150-F161 HydrophobicContact CB-CE1 4.48Å; V150-F161 HydrophobicContact CB-CE2 3.68Å; V150-F161 HydrophobicContact CB-CZ 3.84Å; V150-F161 HydrophobicContact CG1-CE2 4.13Å; V150-F161 HydrophobicContact CG1-CZ 3.91Å; V150-F161 HydrophobicContact CG2-CD2 3.95Å; V150-F161 HydrophobicContact CG2-CE2 3.47Å; V150-F161 VanDerWaalsContact CG2-CE2 3.47Å; V150-F161 HydrophobicContact CG2-CZ 4.11Å; V150-F161 PolarHBondContact N-O 3.11Å; R159-F161 VanDerWaalsContact C-N 3.27Å; R159-F161 HydrophobicContact CB-CD1 3.74Å; R159-F161 HydrophobicContact CB-CE1 3.5Å; R159-F161 VanDerWaalsContact CB-CE1 3.5Å; R159-F161 HydrophobicContact CB-CZ 4.42Å; R159-F161 HydrophobicContact CG-CE1 4.43Å; R159-F161 WeakPolarHBondContact O-CD1 3.39Å; R159-F161 PolarHBondContact O-N 2.86Å; F161-F163 HydrophobicContact CD2-CE2 4.03Å; F161-F163 HydrophobicContact CD2-CZ 4.17Å; F161-F163 AromaticContact CE2-CE2 3.87Å; F161-F163 HydrophobicContact CE2-CE2 3.87Å; F161-F163 HydrophobicContact CE2-CZ 4.1Å
162A91.6Very high87.8Confident0 Ų070.3 Ų70.30%033%0.329CS..EExtended strand (participates in β ladder)trans-143.1167.1-177.200000111.2V122 L125 L134 S148 I149V122-A162 PolarHBondContact N-O 3.04Å; V122-A162 PolarHBondContact O-N 2.86Å; L125-A162 HydrophobicContact CD1-CB 3.58Å; L134-A162 HydrophobicContact CD1-CB 3.51Å; S148-A162 CarbonylContact O-C 3.55Å; S148-A162 WeakPolarHBondContact O-CA 3.37Å; I149-A162 HydrophobicContact CB-CB 4.49Å; I149-A162 HydrophobicContact CG1-CB 3.81Å
163F91.9Very high88.1Confident18 Ų1872.6 Ų72.68%0.07934%0.337CS..EExtended strand (participates in β ladder)trans-121.2128170.7-61.3-77.3000110.2L120 V147 S148 V150 F161 Y165 H200L120-F163 WeakPolarHBondContact O-CA 3.22Å; V147-F163 WeakPolarHBondContact CA-O 3.23Å; S148-F163 PolarHBondContact N-O 2.57Å; S148-F163 PolarHBondContact O-N 2.83Å; V150-F163 HydrophobicContact CG2-CD2 3.98Å; V150-F163 HydrophobicContact CG2-CE2 3.73Å; F161-F163 HydrophobicContact CD2-CE2 4.03Å; F161-F163 HydrophobicContact CD2-CZ 4.17Å; F161-F163 AromaticContact CE2-CE2 3.87Å; F161-F163 HydrophobicContact CE2-CE2 3.87Å; F161-F163 HydrophobicContact CE2-CZ 4.1Å; F163-Y165 HydrophobicContact CB-CE2 3.79Å; F163-H200 AromaticContact CD1-CD2 3.85Å; F163-H200 AromaticContact CD1-NE2 3.91Å; F163-H200 AromaticContact CD2-CD2 3.51Å; F163-H200 AromaticContact CE1-CD2 3.71Å; F163-H200 AromaticContact CE1-NE2 3.39Å; F163-H200 WeakPolarHBondContact CE1-NE2 3.38Å; F163-H200 AromaticContact CE2-CD2 3.34Å; F163-H200 WeakPolarHBondContact CE2-CD2 3.45Å; F163-H200 AromaticContact CE2-NE2 3.7Å; F163-H200 AromaticContact CG-CD2 3.75Å; F163-H200 AromaticContact CZ-CD2 3.46Å; F163-H200 VanDerWaalsContact CZ-CD2 3.46Å; F163-H200 WeakPolarHBondContact CZ-CD2 3.1Å; F163-H200 AromaticContact CZ-NE2 3.27Å; F163-H200 VanDerWaalsContact CZ-NE2 3.27Å; F163-H200 WeakPolarHBondContact CZ-NE2 3.23Å
164V92.3Very high88.8Confident0 Ų069.1 Ų69.10%032%0.321CS..EExtended strand (participates in β ladder)trans-108.8129174.9-177.90000107.7C119 L120 V122 F138 I144 V147 F166C119-V164 CarbonylContact C-O 3.57Å; C119-V164 WeakPolarHBondContact CA-O 3.24Å; L120-V164 PolarHBondContact N-O 3.13Å; L120-V164 PolarHBondContact O-N 2.85Å; V122-V164 HydrophobicContact CG2-CG2 4.02Å; F138-V164 HydrophobicContact CB-CG1 4.36Å; F138-V164 HydrophobicContact CD2-CG2 4Å; F138-V164 HydrophobicContact CE2-CG2 4.27Å; F138-V164 HydrophobicContact CG-CG1 4.48Å; F138-V164 HydrophobicContact CG-CG2 4.41Å; I144-V164 HydrophobicContact CD1-CG1 4.24Å; I144-V164 HydrophobicContact CG1-CG1 4.3Å; I144-V164 HydrophobicContact CG2-CG1 3.98Å; V147-V164 HydrophobicContact CG1-CG2 4.45Å; V164-F166 HydrophobicContact CB-CE2 4.37Å; V164-F166 HydrophobicContact CG1-CD2 4.05Å; V164-F166 HydrophobicContact CG1-CE2 3.62Å; V164-F166 HydrophobicContact CG1-CZ 4.16Å
165Y92Very high89.5Confident24 Ų2460.4 Ų60.49%0.09428%0.28CS..EExtended strand (participates in β ladder)trans-111.2108.2178.2-54.6-93.8000108.2C118 C119 I144 A145 D146 F163 P199 H200C118-Y165 CarbonylContact O-C 3.53Å; C118-Y165 WeakPolarHBondContact O-CA 3.24Å; C119-Y165 HydrophobicContact CB-CD1 3.89Å; C119-Y165 HydrophobicContact CB-CE1 4.03Å; C119-Y165 WeakPolarHBondContact SG-CE1 3.46Å; I144-Y165 CarbonylContact C-O 3.57Å; A145-Y165 PolarHBondContact N-O 3.04Å; D146-Y165 HydrophobicContact CB-CD2 3.83Å; D146-Y165 HydrophobicContact CB-CG 4.35Å; D146-Y165 PolarHBondContact N-O 2.81Å; D146-Y165 PolarHBondContact O-N 3.47Å; F163-Y165 HydrophobicContact CB-CE2 3.79Å; Y165-P199 HydrophobicContact CE1-CB 4.3Å; Y165-P199 WeakPolarHBondContact OH-CA 3.4Å; Y165-H200 PolarHBondContact OH-N 3.07Å
166F93.1Very high90Very high7 Ų759.4 Ų59.43%0.03127%0.268CS..EExtended strand (participates in β ladder)trans-79.5162.4168.9-71.3-92.8000110.4C118 L120 F138 P143 I144 V164 N168 D171 A172 A175C118-F166 HydrophobicContact CB-CB 4.23Å; C118-F166 WeakPolarHBondContact CB-O 3.47Å; C118-F166 PolarHBondContact O-N 3.47Å; L120-F166 HydrophobicContact CD1-CD2 4.32Å; L120-F166 HydrophobicContact CD1-CE2 3.71Å; L120-F166 HydrophobicContact CG-CD2 4.37Å; L120-F166 HydrophobicContact CG-CE2 4.18Å; F138-F166 HydrophobicContact CB-CZ 4.05Å; F138-F166 HydrophobicContact CD1-CE2 4.42Å; F138-F166 HydrophobicContact CD1-CZ 4.03Å; F138-F166 HydrophobicContact CG-CZ 4.44Å; P143-F166 WeakPolarHBondContact O-CA 3.09Å; P143-F166 WeakPolarHBondContact O-CD1 3.36Å; I144-F166 HydrophobicContact CG1-CD1 4.3Å; I144-F166 HydrophobicContact CG1-CE1 4.06Å; I144-F166 HydrophobicContact CG1-CZ 4.47Å; V164-F166 HydrophobicContact CB-CE2 4.37Å; V164-F166 HydrophobicContact CG1-CD2 4.05Å; V164-F166 HydrophobicContact CG1-CE2 3.62Å; V164-F166 HydrophobicContact CG1-CZ 4.16Å; F166-N168 WeakPolarHBondContact CB-O 3.33Å; F166-D171 HydrophobicContact CD1-CB 3.93Å; F166-D171 HydrophobicContact CE1-CB 4.47Å; F166-A172 HydrophobicContact CB-CB 4.15Å; F166-A172 HydrophobicContact CD2-CB 3.77Å; F166-A172 HydrophobicContact CE2-CB 4.48Å; F166-A172 HydrophobicContact CG-CB 4.07Å; F166-A175 HydrophobicContact CE1-CB 4.32Å; F166-A175 HydrophobicContact CE2-CB 3.97Å; F166-A175 HydrophobicContact CZ-CB 3.57Å
167E91.6Very high90.5Very high123 Ų12355.4 Ų55.458%0.57526%0.258SS*.SBendtrans-75.2-49.2168.9-60.4-176158.600110.3C118 P143 A145C118-E167 PolarHBondContact SG-O 2.98Å; P143-E167 HydrophobicContact CB-CG 4.15Å; P143-E167 WeakPolarHBondContact CB-OE2 3.32Å; P143-E167 HydrophobicContact CG-CB 4.18Å; P143-E167 HydrophobicContact CG-CG 4.33Å; P143-E167 WeakPolarHBondContact CG-OE2 3.24Å; P143-E167 PolarHBondContact O-N 2.81Å; P143-E167 VanDerWaalsContact O-N 3.15Å; A145-E167 HydrophobicContact CB-CG 4.16Å
168N92.1Very high90.9Very high80 Ų8055.1 Ų55.143%0.42826%0.257SS..SBendtrans-93.6158.7-178.4-51.5-57.9000113.3C118 F166 D171C118-N168 WeakPolarHBondContact CB-O 3.47Å; F166-N168 WeakPolarHBondContact CB-O 3.33Å; N168-D171 HydrophobicContact CB-CB 4.36Å; N168-D171 WeakPolarHBondContact CB-OD2 3.41Å; N168-D171 PolarHBondContact ND2-OD2 3.28Å
169V91.1Very high91Very high56 Ų5654.6 Ų54.634%0.33925%0.254SS..Hα-helixtrans-80.6-36.7174.9-178.90000111.4P116 C118 A172 K173P116-V169 HydrophobicContact CB-CG1 4.06Å; C118-V169 VanDerWaalsContact SG-CG2 3.53Å; V169-A172 WeakPolarHBondContact O-CB 3.38Å; V169-A172 PolarHBondContact O-N 2.9Å; V169-K173 PolarHBondContact O-N 3.15Å
170D92Very high91.2Very high120 Ų12052.1 Ų52.164%0.64225%0.251SS*.Hα-helixtrans-70.9-42.3-175.3-59.7-84.6000112.1A172 K173 E174D170-A172 VanDerWaalsContact C-N 3.28Å; D170-A172 PolarHBondContact O-N 2.93Å; D170-K173 WeakPolarHBondContact O-CA 3.37Å; D170-K173 WeakPolarHBondContact O-CB 3.49Å; D170-K173 PolarHBondContact O-N 2.95Å; D170-E174 PolarHBondContact O-N 3.36Å
171D92.3Very high91.1Very high34 Ų3452.6 Ų52.618%0.18226%0.256CS..Hα-helixtrans-56.3-43.1170.7-53-6.9000111.2P143 F166 N168 K173 E174 A175P143-D171 WeakPolarHBondContact CD-OD2 3.26Å; F166-D171 HydrophobicContact CD1-CB 3.93Å; F166-D171 HydrophobicContact CE1-CB 4.47Å; N168-D171 HydrophobicContact CB-CB 4.36Å; N168-D171 WeakPolarHBondContact CB-OD2 3.41Å; N168-D171 PolarHBondContact ND2-OD2 3.28Å; D171-K173 VanDerWaalsContact C-N 3.31Å; D171-K173 PolarHBondContact O-N 3.38Å; D171-E174 PolarHBondContact O-N 2.81Å; D171-A175 WeakPolarHBondContact O-CB 3.27Å; D171-A175 PolarHBondContact O-N 3.15Å
172A91Very high91Very high0 Ų052.8 Ų52.80%026%0.258CS..Hα-helixtrans-66.6-32.1176.300000112.3L120 F166 V169 D170 K176L120-A172 HydrophobicContact CD1-CB 4.41Å; L120-A172 WeakPolarHBondContact CD1-O 3.37Å; L120-A172 HydrophobicContact CD2-CB 4.11Å; L120-A172 HydrophobicContact CG-CB 4.16Å; F166-A172 HydrophobicContact CB-CB 4.15Å; F166-A172 HydrophobicContact CD2-CB 3.77Å; F166-A172 HydrophobicContact CE2-CB 4.48Å; F166-A172 HydrophobicContact CG-CB 4.07Å; V169-A172 WeakPolarHBondContact O-CB 3.38Å; V169-A172 PolarHBondContact O-N 2.9Å; D170-A172 VanDerWaalsContact C-N 3.28Å; D170-A172 PolarHBondContact O-N 2.93Å; A172-K176 WeakPolarHBondContact O-CB 3.45Å; A172-K176 PolarHBondContact O-N 2.98Å
173K91.6Very high90.9Very high100 Ų10059.4 Ų59.444%0.43529%0.288SS..Hα-helixtrans-69.1-47.6173.2-176.6-164.3166.2-157.90111.1V169 D170 D171 K176 E177 F193V169-K173 PolarHBondContact O-N 3.15Å; D170-K173 WeakPolarHBondContact O-CA 3.37Å; D170-K173 WeakPolarHBondContact O-CB 3.49Å; D170-K173 PolarHBondContact O-N 2.95Å; D171-K173 VanDerWaalsContact C-N 3.31Å; D171-K173 PolarHBondContact O-N 3.38Å; K173-K176 WeakPolarHBondContact O-CB 3.25Å; K173-K176 PolarHBondContact O-N 2.87Å; K173-E177 WeakPolarHBondContact CE-OE1 3.04Å; K173-E177 PolarHBondContact O-N 3.36Å; K173-F193 HydrophobicContact CB-CZ 4.06Å; K173-F193 HydrophobicContact CG-CZ 4.23Å
174E91.9Very high90.6Very high68 Ų6859.3 Ų59.332%0.31829%0.289SS..Hα-helixtrans-62.1-46.1176.4-173.3-178.310600111.1D170 D171 K176 E177 R178D170-E174 PolarHBondContact O-N 3.36Å; D171-E174 PolarHBondContact O-N 2.81Å; E174-K176 VanDerWaalsContact C-N 3.29Å; E174-K176 PolarHBondContact O-N 3.29Å; E174-E177 PolarHBondContact O-N 3.27Å; E174-E177 VanDerWaalsContact O-N 3.13Å; E174-R178 VanDerWaalsContact CD-NH2 3.28Å; E174-R178 HydrophobicContact CG-CG 4.08Å; E174-R178 WeakPolarHBondContact O-CB 3.04Å; E174-R178 PolarHBondContact O-N 3.11Å; E174-R178 IonicContact OE1-CZ 2.72Å; E174-R178 IonicContact OE1-NE 3.02Å; E174-R178 IonicContact OE1-NH1 3.7Å; E174-R178 PolarHBondContact OE1-NH1 3.13Å; E174-R178 IonicContact OE1-NH2 3.28Å; E174-R178 IonicContact OE2-CZ 2.71Å; E174-R178 IonicContact OE2-NE 3.06Å; E174-R178 IonicContact OE2-NH1 3.44Å; E174-R178 PolarHBondContact OE2-NH1 3.01Å; E174-R178 IonicContact OE2-NH2 3.68Å; E174-R178 PolarHBondContact OE2-NH2 3.17Å
175A91.6Very high90.2Very high0 Ų063.5 Ų63.50%031%0.311CS..Hα-helixtrans-57.7-40.8175.800000112L120 F138 Y141 F166 D171 A179L120-A175 HydrophobicContact CD1-CB 3.82Å; F138-A175 HydrophobicContact CD1-CB 4.17Å; F138-A175 HydrophobicContact CE1-CB 4.48Å; Y141-A175 HydrophobicContact CD2-CB 3.63Å; Y141-A175 HydrophobicContact CE2-CB 4.37Å; Y141-A175 HydrophobicContact CG-CB 3.79Å; F166-A175 HydrophobicContact CE1-CB 4.32Å; F166-A175 HydrophobicContact CE2-CB 3.97Å; F166-A175 HydrophobicContact CZ-CB 3.57Å; D171-A175 WeakPolarHBondContact O-CB 3.27Å; D171-A175 PolarHBondContact O-N 3.15Å; A175-A179 WeakPolarHBondContact O-CB 3.34Å; A175-A179 PolarHBondContact O-N 3.17Å
176K91.1Very high89.8Confident37 Ų3766 Ų6616%0.16134%0.344CS..Hα-helixtrans-60.8-50.6172.9-175.8-162.8172.1-168.10111.2L120 A172 K173 E174 N180 V191 F193L120-K176 HydrophobicContact CD1-CB 4.42Å; L120-K176 HydrophobicContact CD2-CB 4.28Å; A172-K176 WeakPolarHBondContact O-CB 3.45Å; A172-K176 PolarHBondContact O-N 2.98Å; K173-K176 WeakPolarHBondContact O-CB 3.25Å; K173-K176 PolarHBondContact O-N 2.87Å; E174-K176 VanDerWaalsContact C-N 3.29Å; E174-K176 PolarHBondContact O-N 3.29Å; K176-N180 WeakPolarHBondContact O-CB 3.35Å; K176-N180 PolarHBondContact O-N 3.02Å; K176-N180 VanDerWaalsContact O-N 3.17Å; K176-V191 HydrophobicContact CB-CG1 4.31Å; K176-V191 HydrophobicContact CG-CG1 4.32Å; K176-F193 HydrophobicContact CD-CD2 3.84Å; K176-F193 HydrophobicContact CD-CE1 4.37Å; K176-F193 HydrophobicContact CD-CE2 3.62Å; K176-F193 HydrophobicContact CD-CG 4.29Å; K176-F193 HydrophobicContact CD-CZ 3.89Å
177E89.9Confident89.6Confident133 Ų13370.4 Ų70.462%0.62136%0.36SS*.Hα-helixtrans-67.1-36.7-175.4-72.1174.4-16400112.4K173 E174K173-E177 WeakPolarHBondContact CE-OE1 3.04Å; K173-E177 PolarHBondContact O-N 3.36Å; E174-E177 PolarHBondContact O-N 3.27Å; E174-E177 VanDerWaalsContact O-N 3.13Å
178R90.5Very high89.6Confident154 Ų15472.6 Ų72.658%0.58136%0.363SS*.Hα-helixtrans-89.9-25.2-178.5-65.5-173.7-178.8171.44.9115.3Y141 E174Y141-R178 HydrophobicContact CD1-CB 4.38Å; Y141-R178 HydrophobicContact CE1-CB 3.48Å; Y141-R178 VanDerWaalsContact CE1-CB 3.48Å; Y141-R178 HydrophobicContact CE1-CG 4.19Å; E174-R178 VanDerWaalsContact CD-NH2 3.28Å; E174-R178 HydrophobicContact CG-CG 4.08Å; E174-R178 WeakPolarHBondContact O-CB 3.04Å; E174-R178 PolarHBondContact O-N 3.11Å; E174-R178 IonicContact OE1-CZ 2.72Å; E174-R178 IonicContact OE1-NE 3.02Å; E174-R178 IonicContact OE1-NH1 3.7Å; E174-R178 PolarHBondContact OE1-NH1 3.13Å; E174-R178 IonicContact OE1-NH2 3.28Å; E174-R178 IonicContact OE2-CZ 2.71Å; E174-R178 IonicContact OE2-NE 3.06Å; E174-R178 IonicContact OE2-NH1 3.44Å; E174-R178 PolarHBondContact OE2-NH1 3.01Å; E174-R178 IonicContact OE2-NH2 3.68Å; E174-R178 PolarHBondContact OE2-NH2 3.17Å
179A88.5Confident89.6Confident0 Ų068.9 Ų68.90%034%0.344CS..Hα-helixtrans-99.8-15.3-179.100000114.3F138 Y141 A175 G181 M182 I189 V191F138-A179 HydrophobicContact CE1-CB 3.69Å; F138-A179 HydrophobicContact CZ-CB 4.08Å; Y141-A179 HydrophobicContact CE2-CB 4.03Å; A175-A179 WeakPolarHBondContact O-CB 3.34Å; A175-A179 PolarHBondContact O-N 3.17Å; A179-G181 PolarHBondContact O-N 3.27Å; A179-G181 VanDerWaalsContact O-N 3.14Å; A179-M182 HydrophobicContact CB-CE 4.2Å; A179-M182 VanDerWaalsContact O-CB 3.23Å; A179-M182 WeakPolarHBondContact O-CB 3.44Å; A179-M182 PolarHBondContact O-N 3.12Å; A179-M182 VanDerWaalsContact O-N 3.17Å; A179-I189 WeakPolarHBondContact O-CG1 3.45Å; A179-V191 HydrophobicContact CB-CG2 4.05Å
180N89.5Confident89.6Confident84 Ų8472.8 Ų72.845%0.44935%0.352SS..THydrogen-bonded Turntrans-67.3112.2176.4-179.249.4000111.6K176 R190 V191K176-N180 WeakPolarHBondContact O-CB 3.35Å; K176-N180 PolarHBondContact O-N 3.02Å; K176-N180 VanDerWaalsContact O-N 3.17Å; N180-R190 WeakPolarHBondContact OD1-CA 3.17Å; N180-V191 HydrophobicContact CB-CB 4.22Å; N180-V191 PolarHBondContact OD1-N 2.9Å; N180-V191 VanDerWaalsContact OD1-N 3.16Å
181G86.5Confident89.6Confident24 Ų2467 Ų6725%0.24732%0.322CS..THydrogen-bonded Turntrans97.4-0.4-177.200000115A179 R188 I189A179-G181 PolarHBondContact O-N 3.27Å; A179-G181 VanDerWaalsContact O-N 3.14Å; G181-R188 PolarHBondContact O-NE 2.98Å; G181-R188 VanDerWaalsContact O-NE 3.12Å; G181-R188 PolarHBondContact O-NH2 3.27Å; G181-I189 VanDerWaalsContact CA-O 3.29Å; G181-I189 WeakPolarHBondContact CA-O 3.04Å; G181-I189 PolarHBondContact N-O 2.72Å
182M89Confident89.5Confident47 Ų4766.8 Ų66.823%0.23232%0.32CS..  trans-60.5154.4171.8176.8-178.5-70.400111.6V137 Y141 A179 R188 I189V137-M182 HydrophobicContact CG1-SD 3.7Å; Y141-M182 VanDerWaalsContact OH-CE 3.25Å; Y141-M182 WeakPolarHBondContact OH-CE 3.33Å; A179-M182 HydrophobicContact CB-CE 4.2Å; A179-M182 VanDerWaalsContact O-CB 3.23Å; A179-M182 WeakPolarHBondContact O-CB 3.44Å; A179-M182 PolarHBondContact O-N 3.12Å; A179-M182 VanDerWaalsContact O-N 3.17Å; M182-R188 CarbonylContact O-C 3.6Å; M182-R188 WeakPolarHBondContact O-CA 3.48Å; M182-I189 HydrophobicContact CB-CD1 4.22Å; M182-I189 HydrophobicContact CB-CG1 4Å; M182-I189 PolarHBondContact O-N 3.29Å; M182-I189 HydrophobicContact SD-CD1 4.41Å
183E88.7Confident89.4Confident138 Ų13867.8 Ų67.865%0.64533%0.325SS*.EExtended strand (participates in β ladder)trans-100.3130.7172.3-76.4177.7178.600111.9R187 R188E183-R187 WeakPolarHBondContact CA-O 3.48Å; E183-R188 HydrophobicContact CG-CB 4.5Å; E183-R188 HydrophobicContact CG-CG 3.6Å; E183-R188 WeakPolarHBondContact OE1-CD 3.49Å; E183-R188 VanDerWaalsContact OE1-CG 3.26Å; E183-R188 WeakPolarHBondContact OE1-CG 3.45Å
184L85.4Confident88.9Confident17 Ų1763.5 Ų63.59%0.08931%0.307CS..EExtended strand (participates in β ladder)trans-136.3127.8178.6-167.674.9000107.8L125 T129 L134 V137 G186 R187 I189L125-L184 HydrophobicContact CD2-CD2 3.88Å; T129-L184 HydrophobicContact CG2-CD2 3.55Å; T129-L184 HydrophobicContact CG2-CG 4.45Å; L134-L184 HydrophobicContact CD2-CD2 4.06Å; V137-L184 HydrophobicContact CG2-CD1 3.84Å; L184-G186 PolarHBondContact O-N 2.97Å; L184-G186 VanDerWaalsContact O-N 3.11Å; L184-R187 PolarHBondContact N-O 3.37Å; L184-R187 PolarHBondContact O-N 3.26Å; L184-I189 HydrophobicContact CB-CG2 3.75Å; L184-I189 HydrophobicContact CD2-CG2 4.34Å
185D84.4Confident87.9Confident87 Ų8763 Ų6347%0.46531%0.306SS..THydrogen-bonded Turntrans49.636.7-177.8-57.8-32.3000114.1S126 T129 R187S126-D185 WeakPolarHBondContact CB-OD2 3.44Å; T129-D185 WeakPolarHBondContact CA-OD2 3.46Å; T129-D185 WeakPolarHBondContact CB-OD2 3.29Å; T129-D185 PolarHBondContact N-OD2 3.47Å; T129-D185 PolarHBondContact OG1-OD2 2.87Å; D185-R187 VanDerWaalsContact C-N 3.34Å; D185-R187 PolarHBondContact O-N 3.28Å
186G85Confident86.7Confident76 Ų7665 Ų6578%0.78432%0.319SS*.THydrogen-bonded Turntrans71.420.6-176.400000115L184L184-G186 PolarHBondContact O-N 2.97Å; L184-G186 VanDerWaalsContact O-N 3.11Å
187R88.5Confident85.6Confident100 Ų10069.6 Ų69.638%0.37734%0.338SS..EExtended strand (participates in β ladder)trans-129138.6176.7-60.8-174.5-176-176.6-1.4112G124 L125 E183 L184 D185 I189G124-R187 WeakPolarHBondContact O-CB 3.26Å; L125-R187 PolarHBondContact O-NH1 3.46Å; E183-R187 WeakPolarHBondContact CA-O 3.48Å; L184-R187 PolarHBondContact N-O 3.37Å; L184-R187 PolarHBondContact O-N 3.26Å; D185-R187 VanDerWaalsContact C-N 3.34Å; D185-R187 PolarHBondContact O-N 3.28Å; R187-I189 PolarHBondContact O-N 3.12Å
188R91Very high84.3Confident169 Ų16972.4 Ų72.464%0.63834%0.343SS*.EExtended strand (participates in β ladder)trans-75.5113.4174.1-61.6-161.269.2-168.11.9110.6G181 M182 E183G181-R188 PolarHBondContact O-NE 2.98Å; G181-R188 VanDerWaalsContact O-NE 3.12Å; G181-R188 PolarHBondContact O-NH2 3.27Å; M182-R188 CarbonylContact O-C 3.6Å; M182-R188 WeakPolarHBondContact O-CA 3.48Å; E183-R188 HydrophobicContact CG-CB 4.5Å; E183-R188 HydrophobicContact CG-CG 3.6Å; E183-R188 WeakPolarHBondContact OE1-CD 3.49Å; E183-R188 VanDerWaalsContact OE1-CG 3.26Å; E183-R188 WeakPolarHBondContact OE1-CG 3.45Å
189I92.8Very high82.9Confident3 Ų369.5 Ų69.52%0.01535%0.345CS..  trans-82.2147.1177.272.5172.4000110.6V122 F123 L125 F138 A179 G181 M182 L184 R187 V191V122-I189 HydrophobicContact CG1-CB 4.27Å; V122-I189 HydrophobicContact CG1-CD1 4.14Å; F123-I189 CarbonylContact O-C 3.58Å; F123-I189 WeakPolarHBondContact O-CA 3.4Å; L125-I189 HydrophobicContact CD2-CG2 3.81Å; F138-I189 HydrophobicContact CZ-CD1 4.26Å; A179-I189 WeakPolarHBondContact O-CG1 3.45Å; G181-I189 VanDerWaalsContact CA-O 3.29Å; G181-I189 WeakPolarHBondContact CA-O 3.04Å; G181-I189 PolarHBondContact N-O 2.72Å; M182-I189 HydrophobicContact CB-CD1 4.22Å; M182-I189 HydrophobicContact CB-CG1 4Å; M182-I189 PolarHBondContact O-N 3.29Å; M182-I189 HydrophobicContact SD-CD1 4.41Å; L184-I189 HydrophobicContact CB-CG2 3.75Å; L184-I189 HydrophobicContact CD2-CG2 4.34Å; R187-I189 PolarHBondContact O-N 3.12Å; I189-V191 HydrophobicContact CD1-CG2 4.27Å; I189-V191 HydrophobicContact CG1-CG2 4.47Å
190R91.2Very high81.7Confident137 Ų13773.1 Ų73.152%0.51736%0.361SS..EExtended strand (participates in β ladder)trans-116.6133.2173.5168.3-178.7165.7144.48.2108.5F123 N180 D192F123-R190 HydrophobicContact CB-CB 4.41Å; F123-R190 PolarHBondContact N-O 2.81Å; F123-R190 PolarHBondContact O-N 2.63Å; N180-R190 WeakPolarHBondContact OD1-CA 3.17Å; R190-D192 IonicContact CZ-OD2 3.53Å; R190-D192 IonicContact NE-OD2 2.65Å; R190-D192 PolarHBondContact NE-OD2 2.84Å; R190-D192 IonicContact NH2-OD1 3.14Å; R190-D192 IonicContact NH2-OD2 3.41Å; R190-D192 PolarHBondContact NH2-OD2 3.35Å
191V92.1Very high80.3Confident0 Ų075 Ų750%038%0.376CS..EExtended strand (participates in β ladder)trans-122123-177.3-172.30000109.9L120 V122 F138 K176 A179 N180 I189L120-V191 HydrophobicContact CB-CG1 4Å; L120-V191 HydrophobicContact CD1-CG1 3.71Å; L120-V191 HydrophobicContact CG-CG1 4.3Å; V122-V191 HydrophobicContact CG1-CG2 4.33Å; V122-V191 HydrophobicContact CG2-CG2 4.46Å; F138-V191 HydrophobicContact CE1-CG2 4.41Å; F138-V191 HydrophobicContact CZ-CG2 4.05Å; K176-V191 HydrophobicContact CB-CG1 4.31Å; K176-V191 HydrophobicContact CG-CG1 4.32Å; A179-V191 HydrophobicContact CB-CG2 4.05Å; N180-V191 HydrophobicContact CB-CB 4.22Å; N180-V191 PolarHBondContact OD1-N 2.9Å; N180-V191 VanDerWaalsContact OD1-N 3.16Å; I189-V191 HydrophobicContact CD1-CG2 4.27Å; I189-V191 HydrophobicContact CG1-CG2 4.47Å
192D90.2Very high79.1Confident28 Ų2879.1 Ų79.115%0.1540%0.399CS..EExtended strand (participates in β ladder)trans-128.9153.9176.6-77.7-58.9000110.7L120 G121 F123 R190L120-D192 CarbonylContact C-O 3.06Å; L120-D192 WeakPolarHBondContact CA-O 3.4Å; G121-D192 PolarHBondContact N-O 2.88Å; G121-D192 PolarHBondContact O-N 2.84Å; F123-D192 HydrophobicContact CE2-CB 4.36Å; R190-D192 IonicContact CZ-OD2 3.53Å; R190-D192 IonicContact NE-OD2 2.65Å; R190-D192 PolarHBondContact NE-OD2 2.84Å; R190-D192 IonicContact NH2-OD1 3.14Å; R190-D192 IonicContact NH2-OD2 3.41Å; R190-D192 PolarHBondContact NH2-OD2 3.35Å
193F88Confident77.6Confident21 Ų2181.9 Ų81.99%0.09242%0.418CS..EExtended strand (participates in β ladder)trans-62138.1165.8-69.2-56.6000110.3P114 P116 N117 L120 K173 K176P114-F193 HydrophobicContact CG-CB 3.91Å; P114-F193 WeakPolarHBondContact CG-O 3.44Å; P116-F193 HydrophobicContact CB-CD2 4.41Å; P116-F193 HydrophobicContact CB-CE1 4.13Å; P116-F193 HydrophobicContact CB-CE2 3.89Å; P116-F193 HydrophobicContact CB-CZ 3.74Å; N117-F193 WeakPolarHBondContact OD1-CB 3.46Å; L120-F193 HydrophobicContact CD2-CD1 3.52Å; L120-F193 HydrophobicContact CD2-CE1 3.82Å; L120-F193 HydrophobicContact CD2-CG 4.47Å; K173-F193 HydrophobicContact CB-CZ 4.06Å; K173-F193 HydrophobicContact CG-CZ 4.23Å; K176-F193 HydrophobicContact CD-CD2 3.84Å; K176-F193 HydrophobicContact CD-CE1 4.37Å; K176-F193 HydrophobicContact CD-CE2 3.62Å; K176-F193 HydrophobicContact CD-CG 4.29Å; K176-F193 HydrophobicContact CD-CZ 3.89Å
194S80.9Confident76Confident10 Ų1078.5 Ų78.57%0.0741%0.408CS..  trans-75138.3179-175.40000111.2N117 C119 T196N117-S194 PolarHBondContact ND2-O 3.36Å; C119-S194 VanDerWaalsContact O-CB 3.24Å; C119-S194 WeakPolarHBondContact O-CB 3.3Å; C119-S194 PolarHBondContact O-N 3.09Å; C119-S194 WeakPolarHBondContact SG-CB 3.11Å; S194-T196 PolarHBondContact O-N 2.88Å; S194-T196 VanDerWaalsContact O-N 3.15Å; S194-T196 PolarHBondContact OG-N 3.01Å; S194-T196 PolarHBondContact OG-OG1 3.37Å
195I70.7Confident74.7Confident58 Ų5880 Ų8030%0.29743%0.427SS..SBendtrans-65.4-16.5176.3-63.3178.5000111.6H107 R111 P114H107-I195 HydrophobicContact CB-CG2 3.99Å; H107-I195 VanDerWaalsContact CE1-CG2 3.5Å; H107-I195 WeakPolarHBondContact CE1-CG2 3.29Å; H107-I195 PolarHBondContact CE1-O 2.9Å; H107-I195 VanDerWaalsContact CG-CG2 3.42Å; H107-I195 WeakPolarHBondContact ND1-CG2 3.4Å; R111-I195 HydrophobicContact CG-CD1 4.36Å; P114-I195 HydrophobicContact CB-CG1 4.18Å; P114-I195 HydrophobicContact CG-CG1 4.08Å
196T67.9Low73.6Confident42 Ų4281.9 Ų81.926%0.25844%0.436SS..  trans-113.3117179.847.40000112.6S194 R198 H200S194-T196 PolarHBondContact O-N 2.88Å; S194-T196 VanDerWaalsContact O-N 3.15Å; S194-T196 PolarHBondContact OG-N 3.01Å; S194-T196 PolarHBondContact OG-OG1 3.37Å; T196-R198 PolarHBondContact O-N 2.82Å; T196-H200 PolarHBondContact OG1-CE1 3.49Å; T196-H200 PolarHBondContact OG1-NE2 3.44Å; T196-H200 VanDerWaalsContact OG1-NE2 3.15Å
197K66.6Low72.3Confident133 Ų13387.1 Ų87.158%0.57843%0.434SS*.SBendtrans-7531.1172.5-51.7-171.1-176.6-172.20113.9D115 N117D115-K197 IonicContact OD2-NZ 3.64Å; D115-K197 PolarHBondContact OD2-NZ 2.83Å; N117-K197 HydrophobicContact CB-CG 4.39Å
198R62.9Low71Confident192 Ų19288.1 Ų88.173%0.72544%0.444SS*.SBendtrans-142.5151.1179-74.987.4159.5-150.3-4.6109.4T196 H200T196-R198 PolarHBondContact O-N 2.82Å; R198-H200 PolarHBondContact O-N 2.98Å
199P61.4Low69.5Low94 Ų9481.2 Ų81.261%0.6143%0.425SS*.  trans-54.2132.9165.924.6-33.8000110.2Y165 T201Y165-P199 HydrophobicContact CE1-CB 4.3Å; Y165-P199 WeakPolarHBondContact OH-CA 3.4Å; P199-T201 PolarHBondContact O-N 3.03Å; P199-T201 VanDerWaalsContact O-N 3.11Å
200H63.1Low67.5Low75 Ų7590.1 Ų90.135%0.34746%0.459SS..  trans-65.6112.7178.7-80.3-69.9000110.1F163 Y165 T196 R198 P202F163-H200 AromaticContact CD1-CD2 3.85Å; F163-H200 AromaticContact CD1-NE2 3.91Å; F163-H200 AromaticContact CD2-CD2 3.51Å; F163-H200 AromaticContact CE1-CD2 3.71Å; F163-H200 AromaticContact CE1-NE2 3.39Å; F163-H200 WeakPolarHBondContact CE1-NE2 3.38Å; F163-H200 AromaticContact CE2-CD2 3.34Å; F163-H200 WeakPolarHBondContact CE2-CD2 3.45Å; F163-H200 AromaticContact CE2-NE2 3.7Å; F163-H200 AromaticContact CG-CD2 3.75Å; F163-H200 AromaticContact CZ-CD2 3.46Å; F163-H200 VanDerWaalsContact CZ-CD2 3.46Å; F163-H200 WeakPolarHBondContact CZ-CD2 3.1Å; F163-H200 AromaticContact CZ-NE2 3.27Å; F163-H200 VanDerWaalsContact CZ-NE2 3.27Å; F163-H200 WeakPolarHBondContact CZ-NE2 3.23Å; Y165-H200 PolarHBondContact OH-N 3.07Å; T196-H200 PolarHBondContact OG1-CE1 3.49Å; T196-H200 PolarHBondContact OG1-NE2 3.44Å; T196-H200 VanDerWaalsContact OG1-NE2 3.15Å; R198-H200 PolarHBondContact O-N 2.98Å; H200-P202 VanDerWaalsContact O-N 3.12Å
201T60.3Low65.8Low123 Ų12387.3 Ų87.376%0.75546%0.458SS*.  trans-50.4122.4161.6-46.50000107.5P199 T203P199-T201 PolarHBondContact O-N 3.03Å; P199-T201 VanDerWaalsContact O-N 3.11Å; T201-T203 PolarHBondContact O-N 2.92Å
202P60Low63.9Low112 Ų11293.8 Ų93.873%0.72750%0.498SS*.  trans-57120.8-173.521.5-33000108.2H200 P204H200-P202 VanDerWaalsContact O-N 3.12Å; P202-P204 VanDerWaalsContact O-CD 3.22Å; P202-P204 WeakPolarHBondContact O-CD 3.47Å
203T59.5Low61.8Low104 Ų104101 Ų10164%0.63853%0.525SS*.  trans-60.7115.3-178.451.10000107.4T201 G205T201-T203 PolarHBondContact O-N 2.92Å; T203-G205 PolarHBondContact O-N 3.37Å; T203-G205 VanDerWaalsContact O-N 3.14Å
204P53.1Low59.8Low67 Ų67102.9 Ų102.944%0.43555%0.55SS..  trans-58.7126.8178.223.8-31.9000106.9P202 I206 M208P202-P204 VanDerWaalsContact O-CD 3.22Å; P202-P204 WeakPolarHBondContact O-CD 3.47Å; P204-I206 CarbonylContact O-C 3.53Å; P204-I206 PolarHBondContact O-N 3.33Å; P204-I206 VanDerWaalsContact O-O 3.07Å; P204-M208 HydrophobicContact CG-CE 3.63Å; P204-M208 HydrophobicContact CG-SD 4.1Å
205G58.7Low58.2Low48 Ų48106.8 Ų106.850%0.49558%0.577SS.*SBendtrans-65.82-174.100000114.4T203 Y207T203-G205 PolarHBondContact O-N 3.37Å; T203-G205 VanDerWaalsContact O-N 3.14Å; G205-Y207 PolarHBondContact O-N 2.95Å
206I60.9Low56.9Low127 Ų127109.2 Ų109.265%0.65160%0.599SS**SBendtrans-72.6115163.5-54.3172.2000108.3P204 M208P204-I206 CarbonylContact O-C 3.53Å; P204-I206 PolarHBondContact O-N 3.33Å; P204-I206 VanDerWaalsContact O-O 3.07Å; I206-M208 PolarHBondContact O-N 2.85Å
207Y59.5Low55.8Low187 Ų187118.4 Ų118.473%0.73363%0.629SS**  trans-61.597172.7175.7-102.3000111G205 G209G205-Y207 PolarHBondContact O-N 2.95Å; Y207-G209 VanDerWaalsContact CE1-CA 3.43Å; Y207-G209 PolarHBondContact O-N 2.96Å
208M59.8Low54.6Low120 Ų120123.9 Ų123.959%0.59165%0.646SS**  trans-67.413.8178.1-66.7178.614900114.7M101 P204 I206M101-M208 HydrophobicContact CE-CB 3.83Å; M101-M208 HydrophobicContact CE-SD 4.42Å; P204-M208 HydrophobicContact CG-CE 3.63Å; P204-M208 HydrophobicContact CG-SD 4.1Å; I206-M208 PolarHBondContact O-N 2.85Å
209G60.6Low53.6Low24 Ų24124.8 Ų124.825%0.24765%0.649CS.*SBendtrans-76.3-173.9171.300000112.1Y207 P211Y207-G209 VanDerWaalsContact CE1-CA 3.43Å; Y207-G209 PolarHBondContact O-N 2.96Å; G209-P211 WeakPolarHBondContact O-CD 3.39Å
210R50.3Low52.5Low191 Ų191126.7 Ų126.772%0.72165%0.654SS**SBendtrans-61.9120.4-178.4-163.7178.4-162-86.20.8109.7T212R210-T212 PolarHBondContact O-N 3.48Å; R210-T212 VanDerWaalsContact O-N 3.11Å
211P54.9Low51.4Low77 Ų77133.1 Ų133.150%0.568%0.677SS.*  trans-57.9117.7-175.2-28.536.3000112.4G209 Y213G209-P211 WeakPolarHBondContact O-CD 3.39Å; P211-Y213 HydrophobicContact CB-CE1 4.31Å; P211-Y213 PolarHBondContact O-N 2.81Å
212T52.8Low50.4Low136 Ų136138.1 Ų138.183%0.83468%0.684SS**SBendtrans-84.123.4177.544.90000112.7R210R210-T212 PolarHBondContact O-N 3.48Å; R210-T212 VanDerWaalsContact O-N 3.11Å
213Y46.5Very low49.6Very low181 Ų181140.5 Ų140.571%0.7169%0.69SS**SBendtrans-139.1139.1172.154.8-84000109.2P211P211-Y213 HydrophobicContact CB-CE1 4.31Å; P211-Y213 PolarHBondContact O-N 2.81Å
214G46.5Very low48.9Very low60 Ų60147.5 Ų147.562%0.61971%0.705SS**SBendtrans95.4-24.7176.100000117.1S216 R217G214-S216 PolarHBondContact O-N 3.44Å; G214-R217 PolarHBondContact O-N 3.15Å
215S46.5Very low48.2Very low92 Ų92146.4 Ų146.464%0.64371%0.706SS**THydrogen-bonded Turntrans-67.318.1-178.3-169.90000115.7
216S44Very low47Very low109 Ų109155.7 Ų155.776%0.76273%0.728SS**THydrogen-bonded Turntrans-133.712.4-179.4-167.10000113.9G214G214-S216 PolarHBondContact O-N 3.44Å
217R43.7Very low46Very low234 Ų234157.1 Ų157.188%0.88374%0.737SS**SBendtrans-137.221.8174.5-67.1-168.7-179-178.11.1114.4G214G214-R217 PolarHBondContact O-N 3.15Å
218R42.1Very low45.1Very low248 Ų248160.2 Ų160.294%0.93675%0.747SS**SBendtrans-131.425.2170.2-86.5-73.3-170.9149.72.2111.7
219R41.7Very low44Very low212 Ų212157.3 Ų157.380%0.875%0.749SS**SBendtrans-104.5157.1155-162.8175.8-165.3168.73.9105.9
220D38.6Very low42.7Very low133 Ų133167 Ų16771%0.71178%0.779SS**SBendtrans73.7137.3-174.8-44.6-49.7000113.6
221Y40.1Very low42.1Very low210 Ų210165.8 Ų165.882%0.82479%0.787SS**SBendtrans66.9133.1-166.1-61.2-92.3000115.8
222Y38.3Very low41.3Very low229 Ų229169.1 Ų169.190%0.89880%0.8SS**SBendtrans69.421.3177.7-47.2-69.4000118.9
223D42.9Very low40.6Very low161 Ų161173.9 Ų173.986%0.86180%0.803SS**  trans-135.663.3152-164.9-130.9000110.1
224R45Very low40.2Very low251 Ų251171.5 Ų171.595%0.94780%0.803SS**  trans-142.443.3176.3-156.7-178.3-167.3165.85.4111
225G38.8Very low39.7Very low45 Ų45177.4 Ų177.446%0.46481%0.808SS.*SBendtrans-122.5125.9175.500000110.8D227G225-D227 PolarHBondContact O-N 3.45Å
226Y32.9Very low39.2Very low242 Ų242184 Ų18495%0.94982%0.82SS**SBendtrans65.738152.1-42.4-69.4000119.7
227D41.6Very low38.8Very low158 Ų158183.2 Ų183.285%0.84582%0.815SS**  trans-149.674.2146.7-159.4-123.9000113.9G225G225-D227 PolarHBondContact O-N 3.45Å
228R40.3Very low38.7Very low251 Ų251182.5 Ų182.595%0.94781%0.812SS**  trans-158.842157.8-142.7168.9-172.3156.73.4114.1
229G36Very low38.4Very low60 Ų60174.7 Ų174.762%0.61980%0.795SS**  trans-89107.617200000111.2
230Y33.9Very low38.4Very low227 Ų227175.3 Ų175.389%0.8980%0.799SS**SBendtrans54.182.3158.9-46.1-78.8000118.2
231D36.9Very low38.5Very low166 Ų166176.8 Ų176.889%0.88880%0.795SS**  trans-156.677.5138.8-111.7-32.7000111.7
232D38.8Very low38.4Very low146 Ų146170.5 Ų170.578%0.78179%0.794SS**  trans-132.875.7159.5-160.5-57.2000107
233R37.4Very low38.3Very low237 Ų237163.8 Ų163.889%0.89479%0.794SS**  trans-122.559.8168-94.3-160.4177.1-161.83.7109.6
234D37.7Very low38Very low131 Ų131159.9 Ų159.970%0.70179%0.793SS**  trans-56161.5158.9-110.5-44.4000111
235Y37.1Very low37.4Very low184 Ų184152.1 Ų152.172%0.72279%0.791SS**  trans66.655.1178.4-74.8-83.1000118.3S237Y235-S237 PolarHBondContact O-N 3.18Å
236Y34.6Very low37.1Very low230 Ų230153.8 Ų153.890%0.90281%0.807SS**SBendtrans-70.960.3143.9-151.8-76000111.3
237S37.2Very low37.1Very low93 Ų93146.2 Ų146.265%0.6580%0.803SS**  trans17482159.1-84.50000113.2Y235Y235-S237 PolarHBondContact O-N 3.18Å
238R40.8Very low36.7Very low218 Ų218142.3 Ų142.382%0.82380%0.8SS**  trans-172.393.8139-105157.7-178.7163.21.4114.2
239S36.3Very low36.1Very low84 Ų84133.1 Ų133.159%0.58778%0.784SS**  43.190.6127.661.70000119.8
240Y41.2Very low36.1Very low225 Ų225141.3 Ų141.388%0.88280%0.796SS**  trans75.7118139.1-44.3-60.6000122.1
241R41.5Very low36.1Very low164 Ų164141.8 Ų141.862%0.61980%0.797SS**  81.689.1126.9-163-174.8-170.1-120.41120.7R62R62-R241 VanDerWaalsContact C-NH1 3.34Å; R62-R241 VanDerWaalsContact O-CZ 3.28Å; R62-R241 PolarHBondContact O-NH1 2.82Å; R62-R241 PolarHBondContact O-NH2 2.87Å
242G37.5Very low36Very low79 Ų79138.8 Ų138.881%0.81479%0.794SS**  101.2141.2100.800000120.1
243G36.6Very low36Very low87 Ų87136 Ų13690%0.89779%0.792SS**  trans94.1143.6174.800000114.1
244G35.1Very low36.2Very low80 Ų80133.1 Ų133.183%0.82579%0.789SS**  cis161.1133.4-8.800000112.8
245G34.3Very low36.1Very low88 Ų88132.1 Ų132.191%0.90778%0.783SS**  trans75.2165.8-179.300000114.7
246G31.7Very low36.1Very low79 Ų79132.9 Ų132.981%0.81479%0.785SS**  cis154.2127.9-5.600000112
247G33.5Very low36Very low83 Ų83127.1 Ų127.186%0.85677%0.769SS**  trans80.9154.6-172.800000113.3
248G31.5Very low36Very low76 Ų76130.5 Ų130.578%0.78478%0.775SS**  cis92.9126.87.900000112.4
249G29.3Very low35.9Very low59 Ų59127 Ų12761%0.60877%0.771SS**  cis164.544.42.300000114
250W35.1Very low35.6Very low231 Ų231131.4 Ų131.488%0.87578%0.776SS**  trans-135.2124-171.5-44.3101.3000108.7
251R33.7Very low35.4Very low238 Ų238130.7 Ų130.790%0.89877%0.772SS**  74.4112.959.1-76.6-159.4176-146.21.8115.5
252A35.9Very low35.3Very low102 Ų102134.1 Ų134.184%0.84379%0.785SS**  trans87.6155.9145.700000121.8
253A38Very low35.2Very low88 Ų88141.6 Ų141.673%0.72779%0.789SS**  trans65.8136.3177.900000116.6
254Q41.2Very low35.3Very low177 Ų177142.7 Ų142.783%0.82778%0.782SS**  cis70.1133.839.1-62.5-160.7-8200113.6
255D36.6Very low35.8Very low110 Ų110144.9 Ų144.959%0.58878%0.782SS**  cis-153.5-1741.5-139-114.8000112.7
256R36.1Very low35.9Very low200 Ų200145.1 Ų145.176%0.75577%0.77SS**  trans-15.7165152.2-76.4176.3174.9-112.212.8119.3
257D33.7Very low36.6Very low108 Ų108147.2 Ų147.258%0.57877%0.769SS**  cis-163.5-173.12.7-122.4-34.4000110.1
258Q36.4Very low36.8Very low165 Ų165152 Ų15277%0.77176%0.763SS**  trans75.4137.4168.3-38.2-176.319.200112.3
259I38.2Very low37Very low145 Ų145159 Ų15974%0.74477%0.767SS**  cis-141.5133.947.1-81.8168.5000111.7
260Y31.6Very low37.5Very low175 Ų175162 Ų16269%0.68678%0.779SS**  trans24.3137.5148.4-70.8-85.1000122.8
261R35.5Very low37.8Very low211 Ų211162.6 Ų162.680%0.79678%0.781SS**  trans61.892.8143.6-59.9163-168.1-140.44.8116.8
262R39.6Very low37.8Very low235 Ų235154.2 Ų154.289%0.88777%0.768SS**  179128.293.7-92165.4-160.3-86.94.1112.4
263R35.9Very low37.9Very low237 Ų237152.7 Ų152.789%0.89476%0.762SS**  trans29.595.9137.8-161.5176.2-159.4158.45.2115.7
264S39.3Very low37.7Very low110 Ų110158.5 Ų158.577%0.76977%0.767SS**  trans-44.6124.4171.9-50.90000111.3S266S264-S266 PolarHBondContact O-N 2.74Å
265P44.5Very low37.7Very low125 Ų125159.9 Ų159.981%0.81277%0.765SS**  trans-60.9130.7-177.4-26.735.5000112.6
266S37.3Very low37.7Very low94 Ų94160.4 Ų160.466%0.65778%0.777SS**  trans-60.6137.8169.6-57.50000110S264 Y268S264-S266 PolarHBondContact O-N 2.74Å; S266-Y268 PolarHBondContact O-N 3.41Å
267P45.2Very low37.8Very low123 Ų123160.8 Ų160.880%0.79978%0.778SS**SBendtrans-78.860.6-175.633.1-37.2000112.8
268Y38.8Very low38Very low184 Ų184160.9 Ų160.972%0.72279%0.788SS**  trans-137.4137.4171.2-64.9-76.6000109.9S266S266-Y268 PolarHBondContact O-N 3.41Å
269Y34.8Very low38.3Very low223 Ų223164.3 Ų164.388%0.87579%0.793SS**  trans72.282.9175.4-54.9-76.1000119.5
270S40.4Very low38.5Very low122 Ų122162.6 Ų162.685%0.85379%0.794SS**  trans-126.7101.7133.9-67.40000105.8
271R41Very low39.2Very low243 Ų243166.1 Ų166.192%0.91781%0.806SS**  54.1114.462.7-159.4-179.6-169.7-1693.8112.6
272G34.7Very low39.9Very low62 Ų62161.6 Ų161.664%0.63981%0.807SS**  trans108.498.6175.300000113.1
273G37.4Very low40.1Very low69 Ų69160.1 Ų160.171%0.71180%0.803SS**  trans175.134.6-175.400000115.5R275G273-R275 PolarHBondContact O-N 2.65Å
274Y34.3Very low41.1Very low210 Ų210154.2 Ų154.282%0.82480%0.798SS**  trans-63.2115.2-175.2-17.1-90.7000111.3
275R39.5Very low42.1Very low207 Ų207153.3 Ų153.378%0.78179%0.789SS**  trans-154.175.2163.5-121.9172.8-169.2-169.23.2112.6G273 R277G273-R275 PolarHBondContact O-N 2.65Å; R275-R277 PolarHBondContact O-N 3.44Å; R275-R277 VanDerWaalsContact O-N 3.07Å
276S37.1Very low42.5Very low121 Ų121159 Ų15985%0.84680%0.795SS**  trans-50.8112.9164.6-48.10000109.7
277R39.7Very low43.4Very low207 Ų207166 Ų16678%0.78181%0.806SS**  trans-126.178.6175.3-91-171.6162.7-177.1-5.2110.4R275 R279R275-R277 PolarHBondContact O-N 3.44Å; R275-R277 VanDerWaalsContact O-N 3.07Å; R277-R279 PolarHBondContact O-N 2.78Å
278S37.7Very low44.2Very low111 Ų111174.9 Ų174.978%0.77683%0.826SS**  trans-56.5113167.4-420000110.2
279R41.4Very low44.5Very low237 Ų237174.4 Ų174.489%0.89483%0.831SS**  trans179121.2166-99.5150.3-171.1-1552.6107.9R277R277-R279 PolarHBondContact O-N 2.78Å
280S43.9Very low45Very low109 Ų109171.8 Ų171.876%0.76283%0.829SS**  cis-147.8145.6-5-63.50000108.9S282S280-S282 PolarHBondContact O-N 3.31Å
281R44.4Very low45.2Very low249 Ų249174.6 Ų174.694%0.9483%0.828SS**PPolyproline II helixtrans-66.5123163.2-83.6179.5166.9167.5-6.1108.2
282S51.4Low45.5Very low115 Ų115170.6 Ų170.680%0.80482%0.823SS**PPolyproline II helixtrans-68.8132.4164.446.20000109.3S280S280-S282 PolarHBondContact O-N 3.31Å
283Y42.5Very low46.2Very low205 Ų205177.4 Ų177.480%0.80483%0.834SS**PPolyproline II helixtrans-78124.7-172.7176.6-96.9000111.3P285Y283-P285 HydrophobicContact CD1-CB 4.46Å; Y283-P285 HydrophobicContact CD1-CG 4.35Å; Y283-P285 HydrophobicContact CE1-CB 3.74Å; Y283-P285 HydrophobicContact CE1-CG 3.96Å
284S56.9Low46.7Very low112 Ų112184.6 Ų184.678%0.78384%0.842SS**  trans-113.1108.6168.2-66.50000108.8R286S284-R286 PolarHBondContact O-N 2.69Å
285P61.9Low47.6Very low91 Ų91182.8 Ų182.859%0.59184%0.843SS**PPolyproline II helixtrans-76.4123.7175.229.3-30.3000110.2Y283Y283-P285 HydrophobicContact CD1-CB 4.46Å; Y283-P285 HydrophobicContact CD1-CG 4.35Å; Y283-P285 HydrophobicContact CE1-CB 3.74Å; Y283-P285 HydrophobicContact CE1-CG 3.96Å
286R52.9Low48.3Very low246 Ų246180.9 Ų180.993%0.92885%0.848SS**PPolyproline II helixtrans-88.5139.4148.3-76.4-173.4168.7-135-2107.5S284S284-R286 PolarHBondContact O-N 2.69Å
287R55.4Low49.2Very low240 Ų240185.9 Ų185.991%0.90685%0.848SS**PPolyproline II helixtrans-77.8171163.2-78.8-172.6172.2-102.92.6109.3
288Y62.1Low50Low309 Ų309184 Ų184100%1.21286%0.855SS**  trans-45.20161.2-78.8-103.3000110.6

Retrieved 288 of 288 residues in 297.8 ms (Link to these results)