A0A060XPM7_ONCMY Loading...

cAMP-responsive element modulator

AlphaFold DB , UniProt , Accession A0A060XPM7, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene CREM, Length 322 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
1M42.2Very low42.7Very low247 Ų247154.6 Ų154.6100%1.21785%0.849SS**  0100.90-82.6167.915500107
2T37Very low42.5Very low124 Ų124157.1 Ų157.176%0.76185%0.85SS**  trans-69.8139.2171.134.60000109.7
3M52.2Low41.9Very low187 Ų187159.5 Ų159.592%0.92185%0.852SS**  trans-140.7114157.3-77.9-65.7-175.800107.6
4D40Very low41.3Very low143 Ų143153.8 Ų153.877%0.76585%0.85SS**  trans-69146.6170.1-58-75.4000111.2
5T54.9Low40.9Very low145 Ų145158.3 Ų158.389%0.8985%0.849SS**  trans-144.6114.1153.143.80000109.4
6E47.1Very low40.9Very low175 Ų175160 Ų16082%0.81885%0.847SS**  trans-78.7146.1170.8-56.6-163.6157.700112.1
7V45.3Very low40.7Very low143 Ų143158.9 Ų158.987%0.86784%0.841SS**  trans-144.796151.4178.70000110.2
8V37.5Very low40.6Very low117 Ų117156.7 Ų156.771%0.70983%0.83SS**  20.3118.1127.71760000121
9S33.5Very low40.5Very low104 Ų104154.7 Ų154.773%0.72783%0.83SS**  63133.4122.6-1590000124.8
10S39.1Very low40.7Very low110 Ų110154.3 Ų154.377%0.76983%0.827SS**  trans140.9107.8132-58.40000109.6
11K41Very low40.5Very low206 Ų206152.8 Ų152.890%0.89683%0.828SS**  66.210856.2-146.5178-173.1-174.80114.8
12Q39.8Very low40.4Very low184 Ų184148.4 Ų148.486%0.8681%0.81SS**  trans-157.8105.1161.6-158.7166.714.500106.3
13E35.2Very low40.5Very low188 Ų188152 Ų15288%0.87982%0.818SS**  50.6128.388.3-63.8-158.115300112.6
14G32.9Very low39.7Very low80 Ų80150.4 Ų150.483%0.82581%0.814SS**  cis-168.8-175.220.300000106.1
15R35.3Very low40.2Very low221 Ų221148.9 Ų148.983%0.83481%0.812SS**  cis-172.7148.326.5177.3176.4178.4-110.5-1.9106.6D17R15-D17 IonicContact NH1-OD2 3.8Å
16F41.8Very low39.1Very low186 Ų186147.8 Ų147.882%0.81681%0.809SS**  trans-57.9152.2170.7-85.8-111.3000113.4
17D37.8Very low38.6Very low141 Ų141148.5 Ų148.575%0.75481%0.813SS**  -153134128.1-97.4-39.9000111.7R15R15-D17 IonicContact NH1-OD2 3.8Å
18D38.9Very low37.9Very low119 Ų119147.7 Ų147.764%0.63681%0.814SS**  trans-98.6143.2179169.838.4000108
19S38.6Very low37.7Very low119 Ų119150.8 Ų150.883%0.83282%0.82SS**  trans-160.7105.3164-81.60000111.4
20L43.8Very low37.7Very low147 Ų147150.7 Ų150.777%0.7782%0.82SS**  trans-67.8146160.7-69.3160.1000111.4
21S36.8Very low37.3Very low122 Ų122152.5 Ų152.585%0.85382%0.821SS**  trans-154.6102153.1-52.70000108.9
22D40.5Very low37.3Very low156 Ų156148 Ų14883%0.83482%0.816SS**  trans-61.3145.6154-89.1-55.7000109.4
23E38.1Very low37.4Very low198 Ų198145.2 Ų145.293%0.92581%0.813SS**  trans-172.7114.3131.5-72.2-138.4118.500109.5
24D36.3Very low37.6Very low155 Ų155142.2 Ų142.283%0.82981%0.808SS**  trans-100.4165.3152.4-119.9-21.8000106.2
25P50.6Low37.8Very low111 Ų111142.9 Ų142.972%0.72181%0.805SS**  cis-144.9171.226.238.3-17.2000115.9
26S31.1Very low37.8Very low121 Ų121138.1 Ų138.185%0.84680%0.801SS**  trans-177.8145.8133.234.80000114.4
27Q35.9Very low37.7Very low191 Ų191136.5 Ų136.589%0.89380%0.799SS**  trans-70.6150.2-173.1-60.1166.7-22.700113.4
28S32.3Very low37.6Very low126 Ų126135.3 Ų135.388%0.88180%0.797SS**  trans-166.1148.6138.430.50000112
29E32.2Very low37.5Very low181 Ų181138.2 Ų138.285%0.84681%0.806SS**  trans-87.9159-157.7-58.5165.491.400114.5
30S33.9Very low37.5Very low102 Ų102138.9 Ų138.971%0.71381%0.805SS**  trans80.3140.613780.80000121.4
31N30.1Very low37.1Very low149 Ų149137.8 Ų137.880%0.79781%0.81SS**  trans82.894.6152.4-69.1-8.7000119.4
32S42.4Very low37Very low112 Ų112135.2 Ų135.278%0.78380%0.803SS**  trans-48.5157.7148.138.20000113.3
33P41.3Very low37Very low124 Ų124136.2 Ų136.281%0.80581%0.808SS**  -137.2136.7121.234.1-20.7000114.1A35P33-A35 PolarHBondContact O-N 2.8Å
34T39.8Very low37Very low126 Ų126131.8 Ų131.877%0.77380%0.799SS**  trans-51.8121.6161-550000110.6V36T34-V36 PolarHBondContact O-N 3.39Å
35A36Very low37.4Very low93 Ų93128.5 Ų128.577%0.76979%0.793SS**  trans-77.5114.7171.500000110P33P33-A35 PolarHBondContact O-N 2.8Å
36V34.7Very low37.2Very low122 Ų122127.5 Ų127.574%0.73980%0.803SS**  trans-83.5122.2170.1176.30000108.2T34 T38T34-V36 PolarHBondContact O-N 3.39Å; V36-T38 PolarHBondContact O-N 2.93Å
37I40.4Very low37.7Very low152 Ų152129.3 Ų129.378%0.77980%0.8SS**  trans-86.7106.2173.9-58.5173.9000108Q39I37-Q39 HydrophobicContact CG2-CG 4.3Å
38T36.9Very low38.2Very low115 Ų115126.8 Ų126.871%0.70680%0.798SS**  trans-99.2108.5167.7-54.10000108.5V36V36-T38 PolarHBondContact O-N 2.93Å
39Q36.3Very low39Very low180 Ų180125.5 Ų125.584%0.84179%0.785SS**  trans-79.9116.4171.5-73.8-174.6-45.100109.6I37I37-Q39 HydrophobicContact CG2-CG 4.3Å
40V37.4Very low39.8Very low133 Ų133121.6 Ų121.681%0.80677%0.773SS**  trans-108.5114164.334.50000107.6G42V40-G42 PolarHBondContact O-N 3.29Å
41S36.9Very low40.1Very low125 Ų125122.4 Ų122.487%0.87477%0.765SS**  trans-71.9117.4174.6-630000109.9
42G33Very low41.1Very low68 Ų68119.5 Ų119.570%0.70175%0.75SS**  trans-137.3118.8170.500000109.2V40 S44V40-G42 PolarHBondContact O-N 3.29Å; G42-S44 PolarHBondContact O-N 3.06Å
43D40.8Very low41.3Very low176 Ų176121 Ų12194%0.94176%0.757SS**  trans-70.1107.3-174.6-159.814.8000110.6
44S39.4Very low41.9Very low106 Ų106119.7 Ų119.774%0.74175%0.75SS**SBendtrans168.2124.1147.4-170.40000111.4G42G42-S44 PolarHBondContact O-N 3.06Å
45A44.8Very low42.6Very low85 Ų85116.5 Ų116.570%0.70274%0.742SS**SBendtrans39.282.6158.100000119M47A45-M47 VanDerWaalsContact C-N 3.32Å; A45-M47 PolarHBondContact O-N 3.24Å
46G45.6Very low43Very low90 Ų90118.8 Ų118.893%0.92874%0.737SS**SBendtrans52.920.6132.100000121.4
47M42.5Very low43.5Very low159 Ų159116.9 Ų116.978%0.78373%0.726SS**  trans-115.9117.5173.3-77.1-153.7162.200111.6A45A45-M47 VanDerWaalsContact C-N 3.32Å; A45-M47 PolarHBondContact O-N 3.24Å
48T46.2Very low43.7Very low138 Ų138115.5 Ų115.585%0.84772%0.719SS**  trans-99.1110.6169.8-38.80000108.5
49V48.1Very low44.2Very low100 Ų100118 Ų11861%0.60672%0.723SS**  trans-91.5119.7173.2-179.30000108
50V49.2Very low44.6Very low98 Ų98115.6 Ų115.659%0.59472%0.72SS**  trans-97.9112.6172.7-179.30000108.1
51Q40.3Very low44.8Very low119 Ų119117.1 Ų117.156%0.55672%0.718SS**BIsolated β-bridgetrans-91.9115177.8-168.874.830.900109.7
52L51.7Low45.1Very low89 Ų89113.4 Ų113.447%0.46670%0.7SS.*  trans-86155.5172-71.9151.1000110.5S54 G55L52-S54 PolarHBondContact O-N 3.11Å; L52-G55 PolarHBondContact O-N 2.89Å
53P46.9Very low45.6Very low143 Ų143116.8 Ų116.893%0.92971%0.707SS**THydrogen-bonded Turntrans-68.12.6-170.9-16.229.9000116
54S53.8Low45.7Very low97 Ų97116 Ų11668%0.67870%0.701SS**THydrogen-bonded Turntrans-113.413.4-179.258.40000114.4L52 Q56L52-S54 PolarHBondContact O-N 3.11Å; S54-Q56 VanDerWaalsContact C-N 3.33Å; S54-Q56 PolarHBondContact O-N 2.95Å
55G53.8Low45.8Very low58 Ų58119.5 Ų119.560%0.59871%0.705SS**SBendtrans75.410.5168.900000116.2L52L52-G55 PolarHBondContact O-N 2.89Å
56Q44.1Very low45.8Very low142 Ų142118.5 Ų118.566%0.66470%0.697SS**PPolyproline II helixtrans-95.6128.5170.1-82.8178.537.100111.5S54S54-Q56 VanDerWaalsContact C-N 3.33Å; S54-Q56 PolarHBondContact O-N 2.95Å
57T45.8Very low45.8Very low82 Ų82120.6 Ų120.650%0.50369%0.694SS.*BIsolated β-bridgetrans-93.5121.2173.947.40000110.1
58L43.5Very low46.2Very low123 Ų123121.3 Ų121.364%0.64470%0.696SS**PPolyproline II helixtrans-103.3117.9170.8-76.5171.1000109.2V60L58-V60 PolarHBondContact O-N 2.99Å
59H48Very low46.1Very low167 Ų167119.4 Ų119.477%0.77370%0.695SS**  trans-82.8107.1172.8-72.5-163.3000108.9
60V45.8Very low45.9Very low130 Ų130120.1 Ų120.179%0.78870%0.704SS**  trans-106.9109.4175.3-172.70000108.9L58 G62L58-V60 PolarHBondContact O-N 2.99Å; V60-G62 PolarHBondContact O-N 2.97Å; V60-G62 VanDerWaalsContact O-N 3.09Å
61Q39.9Very low45.8Very low164 Ų164121.4 Ų121.477%0.76671%0.712SS**  trans-72.297.5176-177.465.965.700109.6V63Q61-V63 PolarHBondContact O-N 3.3Å
62G44Very low45.7Very low48 Ų48123.2 Ų123.250%0.49572%0.724SS.*  trans-66.4125.8168.400000110.6V60 I64V60-G62 PolarHBondContact O-N 2.97Å; V60-G62 VanDerWaalsContact O-N 3.09Å; G62-I64 PolarHBondContact O-N 3.45Å
63V44.3Very low45.1Very low138 Ų138126.1 Ų126.184%0.83674%0.735SS**  trans-81.487.8169.5179.90000107.7Q61Q61-V63 PolarHBondContact O-N 3.3Å
64I42.4Very low44.8Very low159 Ų159123.9 Ų123.982%0.81572%0.722SS**  trans-103.7105.4161.8-59.1-177.7000106.8G62 A66G62-I64 PolarHBondContact O-N 3.45Å; I64-A66 PolarHBondContact O-N 3.38Å
65Q41.3Very low44.1Very low180 Ų180125 Ų12584%0.84173%0.728SS**  trans-75.9103.8172.7-170.5169.574.100108.5
66A44.2Very low43.3Very low65 Ų65129.5 Ų129.554%0.53773%0.733SS.*  trans-65.3152.2168.800000110.8I64 Q68I64-A66 PolarHBondContact O-N 3.38Å; A66-Q68 PolarHBondContact O-N 3.15Å
67P46.1Very low43Very low133 Ų133131.2 Ų131.286%0.86474%0.743SS**  trans-68.9106177.228.2-31.2000109.6A69P67-A69 PolarHBondContact O-N 3.31Å
68Q50.9Low42.8Very low174 Ų174135.4 Ų135.481%0.81376%0.757SS**  trans-68.2117.7170.3-66.8-93.7-26.900108.5A66 S70A66-Q68 PolarHBondContact O-N 3.15Å; Q68-S70 PolarHBondContact O-N 2.92Å
69A44.8Very low42.5Very low99 Ų99137 Ų13782%0.81877%0.766SS**  trans-62107.8169.300000108.7P67 V71P67-A69 PolarHBondContact O-N 3.31Å; A69-V71 PolarHBondContact O-N 3.08Å
70S42.3Very low42Very low115 Ų115135 Ų13580%0.80477%0.765SS**  trans-69.7129.1-179.8-76.20000111.6Q68 I72Q68-S70 PolarHBondContact O-N 2.92Å; S70-I72 PolarHBondContact O-N 3.25Å
71V48Very low41.4Very low125 Ų125137.2 Ų137.276%0.75877%0.767SS**  trans-56.6119170176.20000110.6A69 Q73A69-V71 PolarHBondContact O-N 3.08Å; V71-Q73 HydrophobicContact CG1-CB 4.46Å
72I38.7Very low41.1Very low157 Ų157136.8 Ų136.881%0.80577%0.769SS**  trans-12595.4151-60-178.5000107.7S70 S74S70-I72 PolarHBondContact O-N 3.25Å; I72-S74 PolarHBondContact O-N 3.27Å
73Q38.3Very low40.7Very low149 Ų149139.4 Ų139.470%0.69678%0.775SS**PPolyproline II helixtrans-60.1117.7167.4-170.5174.311.300109.2V71V71-Q73 HydrophobicContact CG1-CB 4.46Å
74S40.2Very low40.3Very low96 Ų96138.5 Ų138.567%0.67178%0.775SS**PPolyproline II helixtrans-77.6149.2170.9-68.60000110.3I72 Q76I72-S74 PolarHBondContact O-N 3.27Å; S74-Q76 PolarHBondContact O-N 2.9Å
75P40.9Very low40Very low122 Ų122138 Ų13879%0.79277%0.772SS**PPolyproline II helixtrans-68.1135-17729-32.1000110M77P75-M77 PolarHBondContact O-N 2.88Å
76Q36.1Very low39.8Very low152 Ų152134.4 Ų134.471%0.7177%0.773SS**  trans-64.8114.9-177.5-50.5175.311.800108.9S74S74-Q76 PolarHBondContact O-N 2.9Å
77M38.2Very low39.3Very low177 Ų177134.9 Ų134.987%0.87279%0.785SS**  trans-89.6109.9157.2-77.4-77.9-68.100106P75 N79P75-M77 PolarHBondContact O-N 2.88Å; M77-N79 PolarHBondContact O-N 3.29Å
78Q41.7Very low39.6Very low171 Ų171137 Ų13780%0.79979%0.788SS**  trans-53.9109.7166.4-93.1110.2-9.600108.5
79N35.9Very low39.1Very low157 Ų157137.8 Ų137.884%0.8479%0.791SS**  trans-103.3114.3160.2-13927.5000106.9M77 Q81M77-N79 PolarHBondContact O-N 3.29Å; N79-Q81 PolarHBondContact O-N 3.36Å
80V37.5Very low39.2Very low124 Ų124140.8 Ų140.875%0.75279%0.794SS**  trans-52.8123.7172.9172.20000108.2I82V80-I82 PolarHBondContact O-N 3.13Å
81Q33Very low39.5Very low176 Ų176138.2 Ų138.282%0.82279%0.786SS**  trans-60.6118.6174.9-75.1174-18.600109.5N79N79-Q81 PolarHBondContact O-N 3.36Å
82I33.9Very low39.6Very low156 Ų156139 Ų13980%0.878%0.781SS**  trans-108.899.4152.5-59.4176.7000106.1V80 S84V80-I82 PolarHBondContact O-N 3.13Å; I82-S84 PolarHBondContact O-N 3.37Å
83T36.8Very low40.4Very low102 Ų102136 Ų13663%0.62677%0.774SS**  trans-55.8121165.2-63.40000109.5I85T83-I85 HydrophobicContact CG2-CD1 4.05Å; T83-I85 HydrophobicContact CG2-CG1 3.76Å
84S34.3Very low41.2Very low120 Ų120133.4 Ų133.484%0.83977%0.768SS**  trans-147137.7147.8-780000109.2I82I82-S84 PolarHBondContact O-N 3.37Å
85I37.8Very low42.2Very low148 Ų148131.6 Ų131.676%0.75976%0.76SS**  trans-109.7149.5-150.7-50.8168.2000107.2T83T83-I85 HydrophobicContact CG2-CD1 4.05Å; T83-I85 HydrophobicContact CG2-CG1 3.76Å
86A37Very low43.8Very low104 Ų104128.6 Ų128.686%0.8674%0.739SS**  trans77.9134.616200000118.2
87G32.1Very low45.9Very low76 Ų76126 Ų12678%0.78473%0.73SS**  trans149.473.1167.800000112.9E89G87-E89 PolarHBondContact O-N 2.92Å
88L52.5Low48.2Very low177 Ų177121.2 Ų121.293%0.92771%0.711SS**  trans-70.697.9165-78.3162.4000108.6
89E40.8Very low50.3Low190 Ų190118.4 Ų118.489%0.88870%0.698SS**  trans-145.6146.7161.5-65.1-167146.800112.1G87G87-E89 PolarHBondContact O-N 2.92Å
90D46.8Very low53Low162 Ų162117 Ų11787%0.86668%0.684SS**SBendtrans-78.6148.9-159.1-154.44.4000112.6E92D90-E92 PolarHBondContact O-N 3.11Å
91G49.6Very low55.5Low62 Ų62118.8 Ų118.864%0.63968%0.677SS**SBendtrans71-10.9162.700000121.3
92E50.3Low58.3Low142 Ų142118.1 Ų118.166%0.66467%0.667SS**  trans-92.91.1-170.9-169.4164.2171.400115.7D90 T96D90-E92 PolarHBondContact O-N 3.11Å; E92-T96 HydrophobicContact CG-CG2 4.23Å; E92-T96 PolarHBondContact O-OG1 2.9Å
93S54.4Low61Low94 Ų94115.7 Ų115.766%0.65765%0.653SS**Hα-helixtrans-75.5-30-178.559.20000113.7T96 D97S93-T96 PolarHBondContact O-OG1 2.92Å; S93-D97 WeakPolarHBondContact O-CB 3.36Å; S93-D97 PolarHBondContact O-N 2.87Å
94T56.4Low63.7Low93 Ų93116.2 Ų116.257%0.57165%0.65SS**Hα-helixtrans-84.8-33.8-176.759.40000113D97 T98T94-D97 PolarHBondContact O-N 3Å; T94-T98 WeakPolarHBondContact O-CB 3.36Å; T94-T98 VanDerWaalsContact O-CG2 3.23Å; T94-T98 WeakPolarHBondContact O-CG2 3.11Å; T94-T98 PolarHBondContact O-N 3.37Å; T94-T98 PolarHBondContact O-OG1 2.89Å
95A60.3Low66.4Low59 Ų59112 Ų11249%0.48862%0.618SS.*Hα-helixtrans-65.7-40.3176.800000111.6T98 Q99A95-T98 WeakPolarHBondContact CA-OG1 3.47Å; A95-T98 PolarHBondContact O-OG1 3.47Å; A95-Q99 WeakPolarHBondContact O-CB 3.41Å; A95-Q99 PolarHBondContact O-N 3.49Å; A95-Q99 VanDerWaalsContact O-N 3.11Å
96T75.4Confident68.9Low59 Ų59107.1 Ų107.136%0.36260%0.597SS.*Hα-helixtrans-74.1-3617759.30000112.3E92 S93 Q99 K100E92-T96 HydrophobicContact CG-CG2 4.23Å; E92-T96 PolarHBondContact O-OG1 2.9Å; S93-T96 PolarHBondContact O-OG1 2.92Å; T96-Q99 PolarHBondContact O-N 3.07Å; T96-K100 WeakPolarHBondContact O-CB 3.42Å; T96-K100 VanDerWaalsContact O-CG 3.24Å; T96-K100 WeakPolarHBondContact O-CG 3.32Å; T96-K100 PolarHBondContact O-N 3.23Å
97D79.6Confident71.5Confident97 Ų97110.7 Ų110.752%0.51959%0.588SS.*Hα-helixtrans-67.2-43.6174.7-17661.4000112.5S93 T94 Q99 K100 R101S93-D97 WeakPolarHBondContact O-CB 3.36Å; S93-D97 PolarHBondContact O-N 2.87Å; T94-D97 PolarHBondContact O-N 3Å; D97-Q99 VanDerWaalsContact C-N 3.31Å; D97-Q99 PolarHBondContact O-N 3.27Å; D97-K100 PolarHBondContact O-N 2.92Å; D97-R101 WeakPolarHBondContact O-CB 3.35Å; D97-R101 PolarHBondContact O-N 3.29Å
98T85.6Confident74.5Confident76 Ų76113.6 Ų113.647%0.46658%0.576SS.*Hα-helixtrans-64-36.4175.352.30000112.2T94 A95 R101 R102T94-T98 WeakPolarHBondContact O-CB 3.36Å; T94-T98 VanDerWaalsContact O-CG2 3.23Å; T94-T98 WeakPolarHBondContact O-CG2 3.11Å; T94-T98 PolarHBondContact O-N 3.37Å; T94-T98 PolarHBondContact O-OG1 2.89Å; A95-T98 WeakPolarHBondContact CA-OG1 3.47Å; A95-T98 PolarHBondContact O-OG1 3.47Å; T98-R101 PolarHBondContact O-N 2.92Å; T98-R102 VanDerWaalsContact O-CB 3.3Å; T98-R102 WeakPolarHBondContact O-CB 3.46Å; T98-R102 PolarHBondContact O-N 3.01Å
99Q87.1Confident76.2Confident113 Ų113110.4 Ų110.453%0.52857%0.566SS.*Hα-helixtrans-66.3-44.5174.1-175.764.5-1.900111.7A95 T96 D97 R101 R102 E103A95-Q99 WeakPolarHBondContact O-CB 3.41Å; A95-Q99 PolarHBondContact O-N 3.49Å; A95-Q99 VanDerWaalsContact O-N 3.11Å; T96-Q99 PolarHBondContact O-N 3.07Å; D97-Q99 VanDerWaalsContact C-N 3.31Å; D97-Q99 PolarHBondContact O-N 3.27Å; Q99-R101 PolarHBondContact O-N 2.85Å; Q99-R102 WeakPolarHBondContact O-CB 3.42Å; Q99-R102 PolarHBondContact O-N 2.96Å; Q99-E103 PolarHBondContact O-N 2.89Å
100K91.1Very high78.7Confident126 Ų126104.4 Ų104.455%0.54855%0.545SS..Hα-helixtrans-61.8-43.1174.4-72.6169-176.5174.30111.6T96 D97 R102 E103 I104T96-K100 WeakPolarHBondContact O-CB 3.42Å; T96-K100 VanDerWaalsContact O-CG 3.24Å; T96-K100 WeakPolarHBondContact O-CG 3.32Å; T96-K100 PolarHBondContact O-N 3.23Å; D97-K100 PolarHBondContact O-N 2.92Å; K100-R102 VanDerWaalsContact C-N 3.34Å; K100-R102 PolarHBondContact O-N 2.94Å; K100-E103 PolarHBondContact O-N 3.21Å; K100-I104 WeakPolarHBondContact O-CD1 3.43Å; K100-I104 VanDerWaalsContact O-CG1 3.23Å; K100-I104 WeakPolarHBondContact O-CG1 3.36Å; K100-I104 PolarHBondContact O-N 2.71Å
101R91.9Very high81Confident163 Ų163100.8 Ų100.862%0.61552%0.52SS*.Hα-helixtrans-61.5-42.2175.2-173.9177.3-178.2-87.22.1111.5D97 T98 Q99 I104 L105D97-R101 WeakPolarHBondContact O-CB 3.35Å; D97-R101 PolarHBondContact O-N 3.29Å; T98-R101 PolarHBondContact O-N 2.92Å; Q99-R101 PolarHBondContact O-N 2.85Å; R101-I104 PolarHBondContact O-N 3.27Å; R101-L105 HydrophobicContact CG-CD1 4.18Å; R101-L105 WeakPolarHBondContact O-CB 3.2Å; R101-L105 VanDerWaalsContact O-CG 3.23Å; R101-L105 WeakPolarHBondContact O-CG 3.49Å; R101-L105 PolarHBondContact O-N 3.37Å
102R90.4Very high83Confident162 Ų162105.3 Ų105.361%0.61152%0.517SS*.Hα-helixtrans-63.3-42.8176.7-172.1-174.3-60.4-136.71.8111.7T98 Q99 K100 L105 S106T98-R102 VanDerWaalsContact O-CB 3.3Å; T98-R102 WeakPolarHBondContact O-CB 3.46Å; T98-R102 PolarHBondContact O-N 3.01Å; Q99-R102 WeakPolarHBondContact O-CB 3.42Å; Q99-R102 PolarHBondContact O-N 2.96Å; K100-R102 VanDerWaalsContact C-N 3.34Å; K100-R102 PolarHBondContact O-N 2.94Å; R102-L105 PolarHBondContact O-N 3.44Å; R102-S106 WeakPolarHBondContact O-CB 3.33Å; R102-S106 PolarHBondContact O-N 2.96Å; R102-S106 PolarHBondContact O-OG 2.96Å
103E90.9Very high85.1Confident105 Ų105105 Ų10549%0.49151%0.514SS..Hα-helixtrans-66.1-43.1177.7-168.7-173.7163.600112.2Q99 K100 L105 S106 R107Q99-E103 PolarHBondContact O-N 2.89Å; K100-E103 PolarHBondContact O-N 3.21Å; E103-L105 VanDerWaalsContact C-N 3.29Å; E103-L105 PolarHBondContact O-N 3.11Å; E103-S106 WeakPolarHBondContact CA-OG 3.5Å; E103-S106 PolarHBondContact O-N 3.24Å; E103-S106 PolarHBondContact O-OG 3.37Å; E103-R107 VanDerWaalsContact O-CG 3.29Å; E103-R107 WeakPolarHBondContact O-CG 3.29Å; E103-R107 PolarHBondContact O-N 3.46Å; E103-R107 VanDerWaalsContact O-N 3.15Å
104I92.6Very high86.9Confident113 Ų113104.8 Ų104.858%0.57951%0.505SS*.Hα-helixtrans-62.6-39.6176.5-68.2164.1000110.6K100 R101 R108K100-I104 WeakPolarHBondContact O-CD1 3.43Å; K100-I104 VanDerWaalsContact O-CG1 3.23Å; K100-I104 WeakPolarHBondContact O-CG1 3.36Å; K100-I104 PolarHBondContact O-N 2.71Å; R101-I104 PolarHBondContact O-N 3.27Å; I104-R108 WeakPolarHBondContact O-CG 3.4Å
105L92.2Very high88.3Confident31 Ų31104.7 Ų104.716%0.16250%0.5CS..Hα-helixtrans-70.1-44177.4-70172.5000111.8R101 R102 E103 R107 R108 Y111R101-L105 HydrophobicContact CG-CD1 4.18Å; R101-L105 WeakPolarHBondContact O-CB 3.2Å; R101-L105 VanDerWaalsContact O-CG 3.23Å; R101-L105 WeakPolarHBondContact O-CG 3.49Å; R101-L105 PolarHBondContact O-N 3.37Å; R102-L105 PolarHBondContact O-N 3.44Å; E103-L105 VanDerWaalsContact C-N 3.29Å; E103-L105 PolarHBondContact O-N 3.11Å; L105-R107 PolarHBondContact O-N 2.88Å; L105-R108 WeakPolarHBondContact O-CB 3.48Å; L105-R108 PolarHBondContact O-N 3.48Å; L105-Y111 HydrophobicContact CB-CD1 4.24Å; L105-Y111 HydrophobicContact CB-CD2 3.98Å; L105-Y111 HydrophobicContact CB-CE1 4.32Å; L105-Y111 HydrophobicContact CB-CE2 4.06Å; L105-Y111 HydrophobicContact CB-CG 4.07Å; L105-Y111 HydrophobicContact CD1-CE2 4.31Å; L105-Y111 WeakPolarHBondContact O-CB 3.25Å; L105-Y111 WeakPolarHBondContact O-CD1 3.48Å
106S89.1Confident89.6Confident46 Ų46107.3 Ų107.332%0.32251%0.506SS..Hα-helixtrans-67.1-20-179.668.60000114.2R102 E103 R112R102-S106 WeakPolarHBondContact O-CB 3.33Å; R102-S106 PolarHBondContact O-N 2.96Å; R102-S106 PolarHBondContact O-OG 2.96Å; E103-S106 WeakPolarHBondContact CA-OG 3.5Å; E103-S106 PolarHBondContact O-N 3.24Å; E103-S106 PolarHBondContact O-OG 3.37Å; S106-R112 VanDerWaalsContact O-CG 3.24Å; S106-R112 WeakPolarHBondContact O-CG 3.39Å; S106-R112 PolarHBondContact O-NE 3.21Å
107R92.6Very high90.3Very high178 Ų178108.6 Ų108.667%0.67251%0.508SS*.THydrogen-bonded Turntrans-77.2-18.1170.9-68.8176.276.4-178.94.2113.5E103 L105E103-R107 VanDerWaalsContact O-CG 3.29Å; E103-R107 WeakPolarHBondContact O-CG 3.29Å; E103-R107 PolarHBondContact O-N 3.46Å; E103-R107 VanDerWaalsContact O-N 3.15Å; L105-R107 PolarHBondContact O-N 2.88Å
108R94.1Very high90.5Very high137 Ų137109.8 Ų109.852%0.51751%0.513SS..SBendtrans-78.2132.2-179.4-66.5171.469.4171.60.7111I104 L105 S110 Y111 R112I104-R108 WeakPolarHBondContact O-CG 3.4Å; L105-R108 WeakPolarHBondContact O-CB 3.48Å; L105-R108 PolarHBondContact O-N 3.48Å; R108-S110 VanDerWaalsContact C-N 3.31Å; R108-S110 PolarHBondContact O-N 2.96Å; R108-Y111 PolarHBondContact O-N 3Å; R108-R112 PolarHBondContact O-N 3.39Å; R108-R112 VanDerWaalsContact O-N 3.14Å
109P89.8Confident90.1Very high111 Ų111110.3 Ų110.372%0.72152%0.52SS*.Hα-helixtrans-57.6-39.9-179.6-25.733.4000113.8Y111 R112 K113P109-Y111 PolarHBondContact O-N 3.01Å; P109-R112 PolarHBondContact O-N 3.43Å; P109-K113 WeakPolarHBondContact O-CB 3.48Å; P109-K113 PolarHBondContact O-N 2.92Å
110S93.5Very high88.9Confident64 Ų64109.1 Ų109.145%0.44852%0.524SS..Hα-helixtrans-65-39.8179.960.30000112.8R108 K113 I114R108-S110 VanDerWaalsContact C-N 3.31Å; R108-S110 PolarHBondContact O-N 2.96Å; S110-K113 PolarHBondContact O-N 3.48Å; S110-I114 WeakPolarHBondContact O-CD1 3.33Å; S110-I114 VanDerWaalsContact O-CG1 3.31Å; S110-I114 WeakPolarHBondContact O-CG1 3.43Å; S110-I114 PolarHBondContact O-N 3.3Å; S110-I114 VanDerWaalsContact O-N 3.11Å
111Y94.3Very high87.2Confident86 Ų86108.2 Ų108.234%0.33753%0.525SS..Hα-helixtrans-71.4-39.3179.8-171.7-89.3000111L105 R108 P109 K113 I114 L115L105-Y111 HydrophobicContact CB-CD1 4.24Å; L105-Y111 HydrophobicContact CB-CD2 3.98Å; L105-Y111 HydrophobicContact CB-CE1 4.32Å; L105-Y111 HydrophobicContact CB-CE2 4.06Å; L105-Y111 HydrophobicContact CB-CG 4.07Å; L105-Y111 HydrophobicContact CD1-CE2 4.31Å; L105-Y111 WeakPolarHBondContact O-CB 3.25Å; L105-Y111 WeakPolarHBondContact O-CD1 3.48Å; R108-Y111 PolarHBondContact O-N 3Å; P109-Y111 PolarHBondContact O-N 3.01Å; Y111-K113 VanDerWaalsContact C-N 3.31Å; Y111-K113 PolarHBondContact O-N 3.14Å; Y111-I114 PolarHBondContact O-N 3.36Å; Y111-L115 VanDerWaalsContact O-CB 3.31Å; Y111-L115 WeakPolarHBondContact O-CB 3.49Å; Y111-L115 PolarHBondContact O-N 2.84Å
112R92.5Very high85.2Confident156 Ų156105.8 Ų105.859%0.58953%0.533SS*.Hα-helixtrans-60.6-41171.3-73.1-166.7-164.8162-0.1112.4S106 R108 P109 L115 N116S106-R112 VanDerWaalsContact O-CG 3.24Å; S106-R112 WeakPolarHBondContact O-CG 3.39Å; S106-R112 PolarHBondContact O-NE 3.21Å; R108-R112 PolarHBondContact O-N 3.39Å; R108-R112 VanDerWaalsContact O-N 3.14Å; P109-R112 PolarHBondContact O-N 3.43Å; R112-L115 PolarHBondContact O-N 3.49Å; R112-N116 WeakPolarHBondContact O-CB 3.2Å; R112-N116 PolarHBondContact O-N 2.94Å
113K93Very high83.3Confident137 Ų137103.6 Ų103.660%0.59654%0.543SS*.Hα-helixtrans-60.9-50.6179.7-161.2-171.2-178.3-155.80110.9P109 S110 Y111 L115 N116 E117P109-K113 WeakPolarHBondContact O-CB 3.48Å; P109-K113 PolarHBondContact O-N 2.92Å; S110-K113 PolarHBondContact O-N 3.48Å; Y111-K113 VanDerWaalsContact C-N 3.31Å; Y111-K113 PolarHBondContact O-N 3.14Å; K113-L115 PolarHBondContact O-N 3.04Å; K113-N116 PolarHBondContact O-N 3.08Å; K113-E117 WeakPolarHBondContact CE-OE1 3.38Å; K113-E117 WeakPolarHBondContact CG-OE1 3.44Å; K113-E117 IonicContact NZ-OE1 2.65Å; K113-E117 WeakPolarHBondContact O-CB 3.48Å; K113-E117 VanDerWaalsContact O-CG 3.27Å; K113-E117 WeakPolarHBondContact O-CG 3.37Å; K113-E117 PolarHBondContact O-N 3.06Å
114I92.5Very high81Confident89 Ų89102.2 Ų102.246%0.45655%0.545SS..Hα-helixtrans-62.6-42.9177.3-63.5162.8000110.9S110 Y111 N116 E117 L118S110-I114 WeakPolarHBondContact O-CD1 3.33Å; S110-I114 VanDerWaalsContact O-CG1 3.31Å; S110-I114 WeakPolarHBondContact O-CG1 3.43Å; S110-I114 PolarHBondContact O-N 3.3Å; S110-I114 VanDerWaalsContact O-N 3.11Å; Y111-I114 PolarHBondContact O-N 3.36Å; I114-N116 VanDerWaalsContact C-N 3.3Å; I114-N116 PolarHBondContact O-N 3.38Å; I114-E117 PolarHBondContact O-N 2.85Å; I114-L118 HydrophobicContact CG2-CD1 3.74Å; I114-L118 HydrophobicContact CG2-CG 4.13Å; I114-L118 WeakPolarHBondContact O-CB 3.29Å; I114-L118 WeakPolarHBondContact O-CG 3.32Å; I114-L118 PolarHBondContact O-N 3.26Å
115L86.7Confident78.6Confident90 Ų90104.9 Ų104.947%0.47156%0.559SS.*Hα-helixtrans-63-39178.9-171.968.4000111.9Y111 R112 K113 S119Y111-L115 VanDerWaalsContact O-CB 3.31Å; Y111-L115 WeakPolarHBondContact O-CB 3.49Å; Y111-L115 PolarHBondContact O-N 2.84Å; R112-L115 PolarHBondContact O-N 3.49Å; K113-L115 PolarHBondContact O-N 3.04Å; L115-S119 WeakPolarHBondContact O-CB 3.36Å; L115-S119 PolarHBondContact O-N 2.95Å; L115-S119 PolarHBondContact O-OG 3.33Å
116N87.4Confident76.1Confident115 Ų115109 Ų10962%0.61559%0.588SS**Hα-helixtrans-68.4-47.4176.4-163.966.3000110.7R112 K113 I114 L118 S119 S120R112-N116 WeakPolarHBondContact O-CB 3.2Å; R112-N116 PolarHBondContact O-N 2.94Å; K113-N116 PolarHBondContact O-N 3.08Å; I114-N116 VanDerWaalsContact C-N 3.3Å; I114-N116 PolarHBondContact O-N 3.38Å; N116-L118 PolarHBondContact O-N 3.02Å; N116-S119 WeakPolarHBondContact O-CB 3.44Å; N116-S119 PolarHBondContact O-N 2.95Å; N116-S119 VanDerWaalsContact O-N 3.12Å; N116-S120 PolarHBondContact O-N 3.42Å; N116-S120 PolarHBondContact O-OG 3.04Å
117E89.4Confident73.5Confident86 Ų86117.3 Ų117.340%0.40261%0.612SS.*Hα-helixtrans-54.9-50.9175.6-75169.9-17300110.9K113 I114 S119 S120 D121K113-E117 WeakPolarHBondContact CE-OE1 3.38Å; K113-E117 WeakPolarHBondContact CG-OE1 3.44Å; K113-E117 IonicContact NZ-OE1 2.65Å; K113-E117 WeakPolarHBondContact O-CB 3.48Å; K113-E117 VanDerWaalsContact O-CG 3.27Å; K113-E117 WeakPolarHBondContact O-CG 3.37Å; K113-E117 PolarHBondContact O-N 3.06Å; I114-E117 PolarHBondContact O-N 2.85Å; E117-S119 VanDerWaalsContact C-N 3.31Å; E117-S119 PolarHBondContact O-N 3.37Å; E117-S120 WeakPolarHBondContact CA-OG 3.46Å; E117-S120 CarbonylContact O-C 3.52Å; E117-S120 PolarHBondContact O-N 3.24Å; E117-S120 PolarHBondContact O-OG 3.28Å; E117-D121 WeakPolarHBondContact O-CB 3.48Å; E117-D121 PolarHBondContact O-N 2.93Å
118L84.3Confident70.9Confident121 Ų121115 Ų11563%0.63461%0.612SS**Hα-helixtrans-64.4-31.9177-67.7173.8000113.5I114 N116 S120I114-L118 HydrophobicContact CG2-CD1 3.74Å; I114-L118 HydrophobicContact CG2-CG 4.13Å; I114-L118 WeakPolarHBondContact O-CB 3.29Å; I114-L118 WeakPolarHBondContact O-CG 3.32Å; I114-L118 PolarHBondContact O-N 3.26Å; N116-L118 PolarHBondContact O-N 3.02Å; L118-S120 VanDerWaalsContact C-N 3.29Å
119S75.7Confident68Low88 Ų88117.4 Ų117.462%0.61563%0.628SS**Hα-helixtrans-72-27.8174.8-58.40000111.8L115 N116 E117L115-S119 WeakPolarHBondContact O-CB 3.36Å; L115-S119 PolarHBondContact O-N 2.95Å; L115-S119 PolarHBondContact O-OG 3.33Å; N116-S119 WeakPolarHBondContact O-CB 3.44Å; N116-S119 PolarHBondContact O-N 2.95Å; N116-S119 VanDerWaalsContact O-N 3.12Å; E117-S119 VanDerWaalsContact C-N 3.31Å; E117-S119 PolarHBondContact O-N 3.37Å
120S63.1Low65.4Low87 Ų87120.6 Ų120.661%0.60863%0.634SS**Hα-helixtrans-92.1-15.5178.145.80000114.7N116 E117 L118N116-S120 PolarHBondContact O-N 3.42Å; N116-S120 PolarHBondContact O-OG 3.04Å; E117-S120 WeakPolarHBondContact CA-OG 3.46Å; E117-S120 CarbonylContact O-C 3.52Å; E117-S120 PolarHBondContact O-N 3.24Å; E117-S120 PolarHBondContact O-OG 3.28Å; L118-S120 VanDerWaalsContact C-N 3.29Å
121D55.1Low62.4Low107 Ų107125.5 Ų125.557%0.57265%0.649SS**  trans-112.727.3-167.7-15218.5000114.1E117 S123E117-D121 WeakPolarHBondContact O-CB 3.48Å; E117-D121 PolarHBondContact O-N 2.93Å; D121-S123 PolarHBondContact O-N 3.17Å
122S50.7Low59.5Low112 Ų112129.7 Ų129.778%0.78367%0.669SS**THydrogen-bonded Turntrans-77.67176.758.70000114.5
123S49.8Very low57.6Low116 Ų116127.4 Ų127.481%0.81168%0.675SS**THydrogen-bonded Turntrans-108.1-4.4-171.9-167.40000116.1D121D121-S123 PolarHBondContact O-N 3.17Å
124S43.5Very low54.7Low77 Ų77129.8 Ų129.854%0.53869%0.688SS.*  trans-143.881.1-174.245.40000113.6
125I42Very low51.7Low169 Ų169133.2 Ų133.287%0.86771%0.708SS**  trans-115.597.6154.9-55.4179.6000108.3
126P40Very low49.2Very low118 Ų118138 Ų13877%0.76673%0.728SS**  trans-80.5132.3161.2-11.629.2000111.3
127R34.6Very low46.9Very low220 Ų220138.7 Ų138.783%0.8374%0.736SS**  trans-60.4142.7172.2-97.2175.8149.9159.3-7.3114.1
128I36.7Very low44.8Very low130 Ų130140.2 Ų140.267%0.66775%0.753SS**  trans63.5133.2133.2-54167.6000115.2
129E33.2Very low42Very low186 Ų186140 Ų14087%0.86976%0.761SS**  -173.715773.2-151.6147.2-146.900113.6
130E36.5Very low39.7Very low179 Ų179140.6 Ų140.684%0.83677%0.766SS**  trans-105.3171.6-175.1-167.3-178172.600110.5
131E29.7Very low38.1Very low166 Ų166142.1 Ų142.178%0.77678%0.776SS**  trans94.7146.9172.8-66.4-154.4123.600117.7
132K32.5Very low37.1Very low174 Ų174143.5 Ų143.576%0.75779%0.789SS**  cis-166.8169.2-20.9-117.8-179.794.7167.10107.1
133P54.2Low36.5Very low109 Ų109143.6 Ų143.671%0.70879%0.786SS**  trans-105.9159.7-166.540.4-33.4000114.8
134E31.1Very low35.6Very low186 Ų186141.8 Ų141.887%0.86978%0.778SS**  trans-165.5110.8158.540-155.815100107.9
135D30.4Very low35.5Very low162 Ų162145.3 Ų145.387%0.86680%0.796SS**  77.6117.386.7-102.6-19000113.7
136E34Very low35.4Very low190 Ų190144.7 Ų144.789%0.88879%0.79SS**  160.6123.3127.2-85.5-163.616200111.9
137V38.4Very low35.8Very low130 Ų130144.3 Ų144.379%0.78879%0.785SS**  trans-95.9155.8164.6-151.30000106.5
138P45.2Very low36.3Very low117 Ų117139.3 Ų139.376%0.7678%0.781SS**  -155.3168.989.535.9-15.4000116.7
139S26.1Very low37.3Very low116 Ų116136.4 Ų136.481%0.81177%0.77SS**  trans81.5141.9148.8-152.20000117.3
140S27.4Very low38.7Very low102 Ų102130.5 Ų130.571%0.71375%0.749SS**  cis170.1127.6-13.4170.70000104.4
141S29.7Very low40.2Very low118 Ų118127.1 Ų127.183%0.82574%0.735SS**  trans169.6142.8141.847.80000112.4
142V33Very low42.1Very low137 Ų137125.6 Ų125.683%0.8372%0.723SS**  trans-99.3173.4-164.3-140.10000111.6
143P38.8Very low43.9Very low113 Ų113123.1 Ų123.173%0.73472%0.715SS**  -108.1136.7-107.935.9-18.2000113.6
144A31.2Very low44.6Very low78 Ų78120 Ų12065%0.64569%0.693SS**  trans-89.3125.4158.900000108.2Q146A144-Q146 VanDerWaalsContact C-N 3.27Å; A144-Q146 HydrophobicContact CB-CG 4.45Å; A144-Q146 PolarHBondContact O-N 2.86Å
145V41.2Very low45.5Very low151 Ų151117.9 Ų117.992%0.91570%0.699SS**  trans-65.390174.6179.30000108.2
146Q40.3Very low47.3Very low156 Ų156114 Ų11473%0.72969%0.685SS**  trans-100.3125.2172.6-72.2-177.5-6.900108.4A144A144-Q146 VanDerWaalsContact C-N 3.27Å; A144-Q146 HydrophobicContact CB-CG 4.45Å; A144-Q146 PolarHBondContact O-N 2.86Å
147V48.6Very low48.8Very low110 Ų110106 Ų10667%0.66765%0.653SS**  trans-53.6131.5166.1-175.30000107.3T149V147-T149 PolarHBondContact O-N 2.99Å
148P44.5Very low50.5Low116 Ų116103.1 Ų103.175%0.75363%0.631SS**  trans-60.7112.2-172.621.2-31.4000110.6S150P148-S150 PolarHBondContact O-N 3.14Å
149T58.1Low51.6Low69 Ų69102.5 Ų102.542%0.42361%0.614SS.*  trans-62.1121.9163.944.50000107.3V147 I151V147-T149 PolarHBondContact O-N 2.99Å; T149-I151 PolarHBondContact O-N 2.84Å; T149-I151 VanDerWaalsContact O-N 3.15Å
150S61.5Low53.9Low62 Ų6299 Ų9943%0.43459%0.586SS.*EExtended strand (participates in β ladder)trans-69.8113.6176.9-63.10000108.5P148 Y152P148-S150 PolarHBondContact O-N 3.14Å; S150-Y152 WeakPolarHBondContact CB-OH 3.36Å
151I69.3Low55.9Low107 Ų10795.2 Ų95.255%0.54956%0.561SS.*EExtended strand (participates in β ladder)trans-101.5123.3177.8-59.4172000107.6T149 Y159 I160 A161T149-I151 PolarHBondContact O-N 2.84Å; T149-I151 VanDerWaalsContact O-N 3.15Å; I151-Y159 HydrophobicContact CG2-CD1 4.08Å; I151-I160 CarbonylContact C-O 3.6Å; I151-I160 WeakPolarHBondContact CA-O 3.42Å; I151-A161 HydrophobicContact CG1-CB 4.37Å
152Y68.6Low57.9Low135 Ų13593.2 Ų93.253%0.52954%0.54SS..EExtended strand (participates in β ladder)trans-112.3131.1178.3-56.9-85000109.3S150 I160 I162S150-Y152 WeakPolarHBondContact CB-OH 3.36Å; Y152-I160 PolarHBondContact N-O 3.03Å; Y152-I160 PolarHBondContact O-N 3.39Å; Y152-I162 HydrophobicContact CE2-CD1 4.18Å
153Q69.8Low59.5Low122 Ų12288.7 Ų88.757%0.5751%0.512SS*.EExtended strand (participates in β ladder)trans-101.4128.3174.8-163.917722.100109.6Q158 Y159Q153-Q158 WeakPolarHBondContact CA-O 3.43Å; Q153-Y159 HydrophobicContact CB-CD1 4.38Å; Q153-Y159 HydrophobicContact CB-CE1 4.34Å; Q153-Y159 HydrophobicContact CG-CD1 4.2Å; Q153-Y159 HydrophobicContact CG-CE1 3.93Å; Q153-Y159 PolarHBondContact NE2-OH 3.47Å; Q153-Y159 VanDerWaalsContact NE2-OH 3.11Å
154T68.9Low60.1Low43 Ų4392.4 Ų92.426%0.26452%0.52SS..  trans-80160.2172.666.90000110.2S156 G157 Q158 I160T154-S156 PolarHBondContact O-N 3.42Å; T154-S156 PolarHBondContact OG1-N 2.9Å; T154-S156 PolarHBondContact OG1-OG 3.26Å; T154-G157 PolarHBondContact O-N 3.38Å; T154-Q158 HydrophobicContact CG2-CB 4.49Å; T154-Q158 PolarHBondContact N-O 2.98Å; T154-Q158 WeakPolarHBondContact OG1-CB 3.5Å; T154-Q158 PolarHBondContact OG1-N 3.19Å; T154-I160 HydrophobicContact CG2-CD1 3.78Å; T154-I160 HydrophobicContact CG2-CG1 4.46Å
155S51Low61.3Low142 Ų14292 Ų9299%0.99352%0.523SS*.THydrogen-bonded Turntrans-61.4-13.4174.357.80000113.8
156S68.5Low62.2Low81 Ų8186.2 Ų86.257%0.56649%0.494SS*.THydrogen-bonded Turntrans-92.46.1173.957.40000113.8T154T154-S156 PolarHBondContact O-N 3.42Å; T154-S156 PolarHBondContact OG1-N 2.9Å; T154-S156 PolarHBondContact OG1-OG 3.26Å
157G65.1Low62.9Low20 Ų2079.4 Ų79.421%0.20647%0.465CS..SBendtrans81.96.9176.400000115.3T154 P173T154-G157 PolarHBondContact O-N 3.38Å; G157-P173 VanDerWaalsContact O-CD 3.29Å; G157-P173 WeakPolarHBondContact O-CD 3.33Å; G157-P173 VanDerWaalsContact O-CG 3.32Å; G157-P173 WeakPolarHBondContact O-CG 3.31Å
158Q74.6Confident63.6Low71 Ų7177 Ų7733%0.33245%0.448SS..  trans-79.3142.2176.3-60.6174.411.800110.6Q153 T154Q153-Q158 WeakPolarHBondContact CA-O 3.43Å; T154-Q158 HydrophobicContact CG2-CB 4.49Å; T154-Q158 PolarHBondContact N-O 2.98Å; T154-Q158 WeakPolarHBondContact OG1-CB 3.5Å; T154-Q158 PolarHBondContact OG1-N 3.19Å
159Y67.6Low64.5Low104 Ų10474.7 Ų74.741%0.40843%0.427SS..EExtended strand (participates in β ladder)trans-103125.9177.1-64-82000110.4I151 Q153 T171I151-Y159 HydrophobicContact CG2-CD1 4.08Å; Q153-Y159 HydrophobicContact CB-CD1 4.38Å; Q153-Y159 HydrophobicContact CB-CE1 4.34Å; Q153-Y159 HydrophobicContact CG-CD1 4.2Å; Q153-Y159 HydrophobicContact CG-CE1 3.93Å; Q153-Y159 PolarHBondContact NE2-OH 3.47Å; Q153-Y159 VanDerWaalsContact NE2-OH 3.11Å; Y159-T171 PolarHBondContact N-O 3.41Å; Y159-T171 PolarHBondContact O-N 3.43Å
160I74.6Confident65.1Low43 Ų4373 Ų7322%0.22142%0.415CS..EExtended strand (participates in β ladder)trans-113120.8177.7-55.8171.3000108.2I151 Y152 T154 I168 Q169I151-I160 CarbonylContact C-O 3.6Å; I151-I160 WeakPolarHBondContact CA-O 3.42Å; Y152-I160 PolarHBondContact N-O 3.03Å; Y152-I160 PolarHBondContact O-N 3.39Å; T154-I160 HydrophobicContact CG2-CD1 3.78Å; T154-I160 HydrophobicContact CG2-CG1 4.46Å; I160-I168 HydrophobicContact CG2-CG2 3.82Å; I160-Q169 WeakPolarHBondContact CA-O 3.38Å
161A69.8Low65.1Low22 Ų2273 Ų7318%0.18241%0.413CS..EExtended strand (participates in β ladder)trans-115.2132.417400000110.5I151 Q169I151-A161 HydrophobicContact CG1-CB 4.37Å; A161-Q169 PolarHBondContact N-O 2.97Å; A161-Q169 PolarHBondContact O-N 3.47Å
162I71.1Confident64.7Low76 Ų7671.3 Ų71.339%0.3941%0.41SS..EExtended strand (participates in β ladder)trans-109118.3176.2-53.5175000108.4Y152Y152-I162 HydrophobicContact CE2-CD1 4.18Å
163T66.5Low63.6Low41 Ų4169.3 Ų69.325%0.25241%0.413SS..  trans-82.9160.5178.462.60000111.5G165 G166 A167T163-G165 PolarHBondContact O-N 2.91Å; T163-G166 PolarHBondContact O-N 3.09Å; T163-A167 PolarHBondContact N-O 3.21Å; T163-A167 WeakPolarHBondContact OG1-CB 3.26Å; T163-A167 PolarHBondContact OG1-N 3.46Å; T163-A167 PolarHBondContact OG1-O 3.13Å; T163-A167 VanDerWaalsContact OG1-O 3.11Å
164Q52Low62.5Low191 Ų19166.6 Ų66.689%0.89342%0.419SS*.THydrogen-bonded Turntrans-58.6-21.4179.4-166.9177.550.700113.5G166Q164-G166 VanDerWaalsContact C-N 3.31Å
165G56.5Low61.3Low69 Ų6969.6 Ų69.671%0.71144%0.441SS*.THydrogen-bonded Turntrans-86.39.8173.500000115T163 A167T163-G165 PolarHBondContact O-N 2.91Å; G165-A167 PolarHBondContact O-N 3.34Å
166G59.2Low61Low30 Ų3073.1 Ų73.131%0.30944%0.442SS..SBendtrans73.38.3-178.800000114.4T163 Q164T163-G166 PolarHBondContact O-N 3.09Å; Q164-G166 VanDerWaalsContact C-N 3.31Å
167A55.3Low59.5Low14 Ų1471.6 Ų71.612%0.11644%0.439CS..  trans-78.2132.6176.100000110.4T163 G165 T183 L184T163-A167 PolarHBondContact N-O 3.21Å; T163-A167 WeakPolarHBondContact OG1-CB 3.26Å; T163-A167 PolarHBondContact OG1-N 3.46Å; T163-A167 PolarHBondContact OG1-O 3.13Å; T163-A167 VanDerWaalsContact OG1-O 3.11Å; G165-A167 PolarHBondContact O-N 3.34Å; A167-T183 HydrophobicContact CB-CG2 4.5Å; A167-L184 CarbonylContact C-O 3.53Å; A167-L184 WeakPolarHBondContact CA-O 3.35Å; A167-L184 WeakPolarHBondContact CB-O 3.46Å
168I63.2Low58.5Low60 Ų6078.7 Ų78.731%0.30847%0.471SS..EExtended strand (participates in β ladder)trans-100.7120.8-179.5-54.4175.6000107.8I160 I170 L184I160-I168 HydrophobicContact CG2-CG2 3.82Å; I168-I170 HydrophobicContact CG2-CG1 4.15Å; I168-L184 PolarHBondContact N-O 2.94Å; I168-L184 PolarHBondContact O-N 3.16Å
169Q63.5Low57.2Low67 Ų6784.6 Ų84.631%0.31350%0.499SS..EExtended strand (participates in β ladder)trans-106.5126.3173.2-64.118036.100108.8I160 A161 T183I160-Q169 WeakPolarHBondContact CA-O 3.38Å; A161-Q169 PolarHBondContact N-O 2.97Å; A161-Q169 PolarHBondContact O-N 3.47Å; Q169-T183 HydrophobicContact CG-CG2 4.28Å
170I70.4Confident56.1Low34 Ų3482 Ų8217%0.17450%0.504CS..EExtended strand (participates in β ladder)trans-115.2121.4177.1-53.3175.2000107.9I168 Q182I168-I170 HydrophobicContact CG2-CG1 4.15Å; I170-Q182 PolarHBondContact N-O 3.44Å
171T61.8Low54.7Low62 Ų6284.3 Ų84.338%0.3852%0.52SS..EExtended strand (participates in β ladder)trans-117.6120.5177.6-54.70000109.1Y159Y159-T171 PolarHBondContact N-O 3.41Å; Y159-T171 PolarHBondContact O-N 3.43Å
172S61.8Low53.9Low71 Ų7188.2 Ų88.250%0.49753%0.534SS..  trans-97.6135.6175.8-63.60000110.6G174S172-G174 PolarHBondContact O-N 3.48Å
173P44.6Very low52.5Low92 Ų9288.7 Ų88.760%0.59754%0.541SS*.SBendtrans-80.5110.7172.631-30.6000109.7G157G157-P173 VanDerWaalsContact O-CD 3.29Å; G157-P173 WeakPolarHBondContact O-CD 3.33Å; G157-P173 VanDerWaalsContact O-CG 3.32Å; G157-P173 WeakPolarHBondContact O-CG 3.31Å
174G47.1Very low51.8Low66 Ų6689.1 Ų89.168%0.6854%0.541SS*.  trans135.783.6168.600000114.9S172S172-G174 PolarHBondContact O-N 3.48Å
175S42.5Very low51.3Low105 Ų10583.6 Ų83.673%0.73453%0.528SS*.  168.5121.6129.542.70000108.8G177S175-G177 VanDerWaalsContact C-N 3.27Å; S175-G177 PolarHBondContact O-N 2.86Å
176E45.4Very low50.6Low216 Ų21687.3 Ų87.3100%1.00953%0.529SS*.SBendtrans-62.193.4161.3-75.5177130.200108
177G37.5Very low49.6Very low49 Ų4990.4 Ų90.451%0.50555%0.545SS..SBendtrans177.3131.5179.800000108.7S175 Q179S175-G177 VanDerWaalsContact C-N 3.27Å; S175-G177 PolarHBondContact O-N 2.86Å; G177-Q179 PolarHBondContact O-N 3.22Å
178L43.8Very low48.8Very low170 Ų17098.1 Ų98.189%0.8959%0.585SS**SBendtrans-34.5129.7-179.7-89.263.7000113.9
179Q47.4Very low47.5Very low195 Ų19598.4 Ų98.491%0.91159%0.592SS**  trans88.4112.9172.5-53.6-1744100116.7G177G177-Q179 PolarHBondContact O-N 3.22Å
180G45.2Very low46.6Very low49 Ų4999.6 Ų99.651%0.50562%0.623SS.*  trans-166.26.6168.400000117.2
181V44Very low45.1Very low92 Ų92102.1 Ų102.156%0.55864%0.64SS**EExtended strand (participates in β ladder)trans-103.396.2172.7-176.80000108T183V181-T183 PolarHBondContact O-N 3.35Å
182Q54.2Low44Very low104 Ų104104 Ų10449%0.48665%0.653SS.*EExtended strand (participates in β ladder)trans-85.5108.2171.6-73.6-177.474.300108.6I170 L184I170-Q182 PolarHBondContact N-O 3.44Å; Q182-L184 HydrophobicContact CB-CD1 4.29Å
183T40.5Very low42.9Very low86 Ų86108 Ų10853%0.52866%0.664SS.*EExtended strand (participates in β ladder)trans-96.7107.3175.1-57.60000108.8A167 Q169 V181A167-T183 HydrophobicContact CB-CG2 4.5Å; Q169-T183 HydrophobicContact CG-CG2 4.28Å; V181-T183 PolarHBondContact O-N 3.35Å
184L51.6Low42.8Very low50 Ų50109.9 Ų109.926%0.26267%0.668SS.*EExtended strand (participates in β ladder)trans-93.3111.6173.7-79.480.6000109.5A167 I168 Q182 L195A167-L184 CarbonylContact C-O 3.53Å; A167-L184 WeakPolarHBondContact CA-O 3.35Å; A167-L184 WeakPolarHBondContact CB-O 3.46Å; I168-L184 PolarHBondContact N-O 2.94Å; I168-L184 PolarHBondContact O-N 3.16Å; Q182-L184 HydrophobicContact CB-CD1 4.29Å; L184-L195 HydrophobicContact CD2-CD1 3.74Å; L184-L195 HydrophobicContact CD2-CD2 3.99Å
185A42.7Very low42.6Very low75 Ų75109.6 Ų109.662%0.6265%0.65SS**  trans-91118.917100000110.2S187A185-S187 PolarHBondContact O-N 2.88Å; A185-S187 VanDerWaalsContact O-N 3.11Å
186M40.2Very low42.4Very low147 Ų147111.3 Ų111.372%0.72465%0.647SS**  trans-75100.2175.9-61.4-155.678.200110.1
187S38.1Very low42Very low94 Ų94104.7 Ų104.766%0.65761%0.613SS**  trans-91.7120.1172.6-64.70000110A185 S189A185-S187 PolarHBondContact O-N 2.88Å; A185-S187 VanDerWaalsContact O-N 3.11Å; S187-S189 PolarHBondContact O-N 3.11Å
188N39.7Very low41.8Very low176 Ų176106.5 Ų106.594%0.94162%0.623SS**  trans-78.149.9-179.4-164.432.1000112.4
189S36.5Very low41.5Very low66 Ų66103.3 Ų103.346%0.46261%0.611SS.*  trans-104124.1170.761.10000108.5S187 T191S187-S189 PolarHBondContact O-N 3.11Å; S189-T191 PolarHBondContact O-N 3.18Å
190G43.2Very low40.9Very low93 Ų93103.3 Ų103.396%0.95961%0.611SS**SBendtrans-65.241.5-173.900000116.7
191T38.5Very low40.6Very low86 Ų86105.7 Ų105.753%0.52863%0.626SS.*SBendtrans-110.1132.2172.853.10000109.4S189 Q193S189-T191 PolarHBondContact O-N 3.18Å; T191-Q193 PolarHBondContact O-N 3.15Å
192P38.9Very low40.3Very low103 Ų103105.1 Ų105.167%0.66964%0.639SS**  trans-65.612217827.5-32.7000109.9
193Q39.5Very low39.3Very low154 Ų154107.1 Ų107.172%0.7265%0.653SS**  trans-107.6131.8169.3-63.5-142.111.400109.9T191T191-Q193 PolarHBondContact O-N 3.15Å
194I41.9Very low39.2Very low131 Ų131108.6 Ų108.667%0.67267%0.666SS**EExtended strand (participates in β ladder)trans-92.8125.6-178.1-63.1169.7000107.5F208I194-F208 HydrophobicContact CG2-CD1 4.5Å
195L42.7Very low38.6Very low61 Ų61107.9 Ų107.932%0.31967%0.671SS.*EExtended strand (participates in β ladder)trans-92.4110.9175.9-161.964.5000109.2L184 Y197L184-L195 HydrophobicContact CD2-CD1 3.74Å; L184-L195 HydrophobicContact CD2-CD2 3.99Å; L195-Y197 HydrophobicContact CD2-CD2 4.32Å; L195-Y197 HydrophobicContact CD2-CE2 3.49Å; L195-Y197 VanDerWaalsContact CD2-CE2 3.49Å; L195-Y197 HydrophobicContact CG-CD2 4.21Å; L195-Y197 HydrophobicContact CG-CE2 3.76Å
196Q38.4Very low38.8Very low141 Ų141108.4 Ų108.466%0.65966%0.661SS**  trans-100.5105.9-179.6-171.1163.72800110.2
197Y37.1Very low38.8Very low77 Ų77105.4 Ų105.430%0.30265%0.645SS.*  trans-93121.4168-79.6-83.7000109.3L195 Q206L195-Y197 HydrophobicContact CD2-CD2 4.32Å; L195-Y197 HydrophobicContact CD2-CE2 3.49Å; L195-Y197 VanDerWaalsContact CD2-CE2 3.49Å; L195-Y197 HydrophobicContact CG-CD2 4.21Å; L195-Y197 HydrophobicContact CG-CE2 3.76Å; Y197-Q206 PolarHBondContact O-OE1 3.43Å
198A34.4Very low39.2Very low87 Ų87104.3 Ų104.372%0.71963%0.628SS**  trans-93.4112.5162.100000107.8
199T36.6Very low39.6Very low102 Ų10299.2 Ų99.263%0.62660%0.598SS**  trans-80.7128.3167.563.20000107.8A201T199-A201 PolarHBondContact O-N 2.92Å
200Q34.6Very low39.9Very low196 Ų19698.4 Ų98.492%0.91659%0.592SS**  trans-72.7118.4-179.8-161.1168.745.200109.3
201A38.7Very low40Very low99 Ų9998 Ų9882%0.81857%0.571SS**SBendtrans39.9102.6159.800000117.7T199T199-A201 PolarHBondContact O-N 2.92Å
202G37.9Very low40.2Very low80 Ų80100.7 Ų100.783%0.82558%0.577SS**SBendtrans146.712.9148.700000119.5
203D33.2Very low40.5Very low146 Ų146100 Ų10078%0.78159%0.589SS**SBendtrans-167.7143.8150.5-146.1-13.4000110.1G205D203-G205 PolarHBondContact O-N 2.98Å
204S39.7Very low41Very low116 Ų11696 Ų9681%0.81159%0.59SS**  trans-70.9107.7-168.649.80000113.2
205G39.2Very low41Very low35 Ų3594.3 Ų94.336%0.36158%0.579SS.*  trans-174.687.2167.500000113.6D203 Q207D203-G205 PolarHBondContact O-N 2.98Å; G205-Q207 PolarHBondContact O-N 3.38Å
206Q45.7Very low41.2Very low87 Ų8796 Ų9641%0.40759%0.591SS.*  trans-70.5119.9166.9-63.3-81.955.400108.4Y197 A221Y197-Q206 PolarHBondContact O-OE1 3.43Å; Q206-A221 HydrophobicContact CB-CB 4.32Å; Q206-A221 PolarHBondContact O-N 2.86Å
207Q41.6Very low41.7Very low84 Ų8492.4 Ų92.439%0.39358%0.579SS.*EExtended strand (participates in β ladder)trans-107.3113.1177.6-64-69.9-0.800109.3G205 F209G205-Q207 PolarHBondContact O-N 3.38Å; Q207-F209 HydrophobicContact CB-CE2 3.86Å; Q207-F209 HydrophobicContact CB-CZ 4.42Å
208F46.1Very low42.3Very low71 Ų7193.7 Ų93.731%0.31159%0.59SS.*EExtended strand (participates in β ladder)trans-90.9126.6176.6-61.4-78.3000109.9I194 Q219 A221I194-F208 HydrophobicContact CG2-CD1 4.5Å; F208-Q219 HydrophobicContact CB-CB 4.16Å; F208-Q219 WeakPolarHBondContact CB-O 3.47Å; F208-Q219 WeakPolarHBondContact CD2-O 3.44Å; F208-Q219 PolarHBondContact N-O 3.29Å; F208-Q219 PolarHBondContact O-N 3.14Å; F208-A221 HydrophobicContact CD2-CB 4.26Å; F208-A221 HydrophobicContact CE2-CB 3.68Å
209F46.9Very low42.7Very low69 Ų6994.4 Ų94.430%0.30358%0.578SS.*EExtended strand (participates in β ladder)trans-108.7116.6171.4-64.7-91.6000108.4Q207 V216 V217 I218Q207-F209 HydrophobicContact CB-CE2 3.86Å; Q207-F209 HydrophobicContact CB-CZ 4.42Å; F209-V216 HydrophobicContact CD1-CG1 3.96Å; F209-V217 WeakPolarHBondContact CA-O 3.41Å; F209-I218 HydrophobicContact CD1-CG1 3.9Å; F209-I218 HydrophobicContact CE1-CB 4.33Å; F209-I218 HydrophobicContact CE1-CD1 3.79Å; F209-I218 HydrophobicContact CE1-CG1 3.59Å; F209-I218 HydrophobicContact CE1-CG2 4.07Å; F209-I218 HydrophobicContact CZ-CG2 4.28Å
210S43.2Very low42.9Very low48 Ų4891.3 Ų91.334%0.33656%0.563SS.*EExtended strand (participates in β ladder)trans-113.8128.7170.155.90000108.9V217S210-V217 PolarHBondContact N-O 3.47Å; S210-V217 PolarHBondContact O-N 2.99Å
211V46Very low43.4Very low84 Ų8485 Ų8551%0.50954%0.544SS..EExtended strand (participates in β ladder)trans-110.4105.1178.4-176.60000108.1Q215 V216V211-Q215 WeakPolarHBondContact CA-O 3.47Å; V211-V216 HydrophobicContact CG2-CG2 4.3Å
212Q42.3Very low43.5Very low143 Ų14385 Ų8567%0.66853%0.534SS*.EExtended strand (participates in β ladder)trans-105.9124.4166.8-88.5-167.518.600108.9G214 Q215Q212-G214 VanDerWaalsContact C-N 3.28Å; Q212-G214 PolarHBondContact O-N 3.16Å; Q212-G214 VanDerWaalsContact O-N 3.08Å; Q212-Q215 PolarHBondContact N-O 2.93Å; Q212-Q215 PolarHBondContact O-N 3.38Å
213G45.2Very low43.9Very low89 Ų8985.3 Ų85.392%0.91854%0.538SS*.THydrogen-bonded Turntrans52.538.4164.900000115.7
214G50.3Low44.5Very low71 Ų7185.9 Ų85.973%0.73254%0.541SS*.THydrogen-bonded Turntrans83.49.1179.100000115.9Q212Q212-G214 VanDerWaalsContact C-N 3.28Å; Q212-G214 PolarHBondContact O-N 3.16Å; Q212-G214 VanDerWaalsContact O-N 3.08Å
215Q41.3Very low44.6Very low94 Ų9486.3 Ų86.344%0.43953%0.531SS..EExtended strand (participates in β ladder)trans-105.8130.8170.4-64.9-75.8-13.800109.8V211 Q212V211-Q215 WeakPolarHBondContact CA-O 3.47Å; Q212-Q215 PolarHBondContact N-O 2.93Å; Q212-Q215 PolarHBondContact O-N 3.38Å
216V47.1Very low44.8Very low97 Ų9789.1 Ų89.159%0.58854%0.544SS*.EExtended strand (participates in β ladder)trans-92.7112.6172.3-1800000108.1F209 V211 I218F209-V216 HydrophobicContact CD1-CG1 3.96Å; V211-V216 HydrophobicContact CG2-CG2 4.3Å; V216-I218 HydrophobicContact CG1-CG1 4.47Å
217V49.6Very low44.8Very low65 Ų6588.7 Ų88.739%0.39456%0.555SS.*EExtended strand (participates in β ladder)trans-101.9119.9174.9-1760000108.5F209 S210F209-V217 WeakPolarHBondContact CA-O 3.41Å; S210-V217 PolarHBondContact N-O 3.47Å; S210-V217 PolarHBondContact O-N 2.99Å
218I48.1Very low44.6Very low104 Ų10494 Ų9453%0.53357%0.573SS.*EExtended strand (participates in β ladder)trans-96112.9174.6-47.4-178000107.5F209 V216F209-I218 HydrophobicContact CD1-CG1 3.9Å; F209-I218 HydrophobicContact CE1-CB 4.33Å; F209-I218 HydrophobicContact CE1-CD1 3.79Å; F209-I218 HydrophobicContact CE1-CG1 3.59Å; F209-I218 HydrophobicContact CE1-CG2 4.07Å; F209-I218 HydrophobicContact CZ-CG2 4.28Å; V216-I218 HydrophobicContact CG1-CG1 4.47Å
219Q43.1Very low44.3Very low102 Ų10299 Ų9948%0.47760%0.597SS.*EExtended strand (participates in β ladder)trans-109.9103.7175.1-170.386.248.400107.8F208F208-Q219 HydrophobicContact CB-CB 4.16Å; F208-Q219 WeakPolarHBondContact CB-O 3.47Å; F208-Q219 WeakPolarHBondContact CD2-O 3.44Å; F208-Q219 PolarHBondContact N-O 3.29Å; F208-Q219 PolarHBondContact O-N 3.14Å
220A42.2Very low43.8Very low37 Ų37103 Ų10331%0.30662%0.621SS.*EExtended strand (participates in β ladder)trans-79.4133.5170.700000109.2T222A220-T222 PolarHBondContact O-N 3.43Å; A220-T222 VanDerWaalsContact O-N 3.16Å
221A43.7Very low43.6Very low63 Ų63109.1 Ų109.152%0.52164%0.636SS.*  trans-82.223.8-174.600000114.8Q206 F208Q206-A221 HydrophobicContact CB-CB 4.32Å; Q206-A221 PolarHBondContact O-N 2.86Å; F208-A221 HydrophobicContact CD2-CB 4.26Å; F208-A221 HydrophobicContact CE2-CB 3.68Å
222T40.7Very low43Very low99 Ų99108.6 Ų108.661%0.60764%0.636SS**SBendtrans-101.1112.5179.1-7.30000108.7A220 D224A220-T222 PolarHBondContact O-N 3.43Å; A220-T222 VanDerWaalsContact O-N 3.16Å; T222-D224 PolarHBondContact O-N 2.78Å
223G46.6Very low42.7Very low87 Ų87107.8 Ų107.890%0.89764%0.643SS**THydrogen-bonded Turntrans-68.240.6-162.400000118.3
224D46.4Very low42.3Very low158 Ų158108.1 Ų108.185%0.84563%0.628SS**THydrogen-bonded Turntrans-156.932.3170.1-140.11.8000115.2T222T222-D224 PolarHBondContact O-N 2.78Å
225M40.9Very low42Very low125 Ų125110 Ų11062%0.61663%0.63SS**  trans-115116178.8-90.9-10257.900111.4A227 Y228M225-A227 PolarHBondContact O-N 3.41Å; M225-Y228 HydrophobicContact CE-CE2 4.03Å
226P44.7Very low42.1Very low95 Ų95111.1 Ų111.162%0.61765%0.648SS**  trans-63.3128.2172.325.1-33.8000109.8Y228P226-Y228 PolarHBondContact O-N 3.46Å; P226-Y228 VanDerWaalsContact O-N 3.07Å
227A44.1Very low41.5Very low77 Ų77110.3 Ų110.364%0.63666%0.659SS**  trans-57.6111176.700000110.3M225 Q229M225-A227 PolarHBondContact O-N 3.41Å; A227-Q229 PolarHBondContact O-N 3.26Å
228Y39Very low40.9Very low197 Ų197114.7 Ų114.777%0.77368%0.679SS**  trans-74.791.5170.9-77.6-83.8000109.1M225 P226 L230M225-Y228 HydrophobicContact CE-CE2 4.03Å; P226-Y228 PolarHBondContact O-N 3.46Å; P226-Y228 VanDerWaalsContact O-N 3.07Å; Y228-L230 PolarHBondContact O-N 3.39Å
229Q38.6Very low40.7Very low176 Ų176115 Ų11582%0.82269%0.688SS**  trans-74.1102.1172.8-166.81788200109.2A227 R231A227-Q229 PolarHBondContact O-N 3.26Å; Q229-R231 VanDerWaalsContact C-N 3.32Å; Q229-R231 PolarHBondContact O-N 2.98Å
230L37Very low40.8Very low153 Ų153118.5 Ų118.580%0.80170%0.704SS**  trans-71.485173.6-82.1158.6000110.2Y228 S232Y228-L230 PolarHBondContact O-N 3.39Å; L230-S232 PolarHBondContact O-N 3.13Å; L230-S232 VanDerWaalsContact O-N 3.11Å
231R38.6Very low40.4Very low176 Ų176120.1 Ų120.166%0.66473%0.725SS**  trans-70.9101.5169.5-171.583.1-175.5112.81.9109Q229Q229-R231 VanDerWaalsContact C-N 3.32Å; Q229-R231 PolarHBondContact O-N 2.98Å
232S33.8Very low40.3Very low73 Ų73124.9 Ų124.951%0.5174%0.741SS.*  trans-72.1135.5162.6-63.70000109.3L230 T234L230-S232 PolarHBondContact O-N 3.13Å; L230-S232 VanDerWaalsContact O-N 3.11Å; S232-T234 PolarHBondContact O-N 3.15Å
233P34.9Very low40.5Very low125 Ų125126.9 Ų126.981%0.81275%0.753SS**  trans-74.593.617430.5-30.4000108.2S235P233-S235 PolarHBondContact O-N 3.3Å; P233-S235 VanDerWaalsContact O-N 3.15Å
234T38.7Very low40.5Very low96 Ų96131.4 Ų131.459%0.58975%0.753SS**  trans-71.5105.3168.349.80000108.2S232 S236S232-T234 PolarHBondContact O-N 3.15Å; T234-S236 PolarHBondContact O-N 2.91Å; T234-S236 VanDerWaalsContact O-N 3.13Å
235S42.8Very low40.2Very low112 Ų112128.7 Ų128.778%0.78375%0.752SS**  trans-62.1104.1162.954.10000109.4P233P233-S235 PolarHBondContact O-N 3.3Å; P233-S235 VanDerWaalsContact O-N 3.15Å
236S43.9Very low40.2Very low117 Ų117127.8 Ų127.882%0.81876%0.764SS**SBendtrans155.5124.7145.249.30000110.7T234T234-S236 PolarHBondContact O-N 2.91Å; T234-S236 VanDerWaalsContact O-N 3.13Å
237G34.5Very low39.8Very low79 Ų79128.8 Ų128.881%0.81477%0.774SS**  trans94.487.3161.500000116.8
238L36.9Very low40Very low158 Ų158131.3 Ų131.383%0.82778%0.784SS**  trans-64.2144.9148.2-89.1151000108.4
239P42.9Very low40Very low111 Ų111125.4 Ų125.472%0.72178%0.783SS**  -139.7167.980.331.6-11.8000116.1
240Q45.3Very low40.4Very low174 Ų174122.4 Ų122.481%0.81378%0.781SS**  trans-24.8136.3178-76.473.916.800118.4
241G34.8Very low40.6Very low72 Ų72123.3 Ų123.374%0.74279%0.786SS**  trans-168.480.3164.500000111.6V243G241-V243 PolarHBondContact O-N 2.99Å
242L41.2Very low41.2Very low163 Ų163119.3 Ų119.385%0.85379%0.785SS**  trans-69.3112.4172.8-165.286.6000109.2
243V45.3Very low41.8Very low141 Ų141124.4 Ų124.486%0.85580%0.803SS**  trans-134.5106.1156.8-76.80000109.7G241G241-V243 PolarHBondContact O-N 2.99Å
244M46.2Very low42.5Very low181 Ų181126.6 Ų126.689%0.89280%0.802SS**  trans-65.1124.8168.3-74.3-88.4-103.600109.5
245A39.7Very low42.8Very low102 Ų102127.8 Ų127.884%0.84381%0.805SS**  trans-136.9116.9154.200000107.8
246A41.6Very low43.1Very low105 Ų105125.9 Ų125.987%0.86879%0.79SS**  trans-66.5137.9-176.400000112.2
247S35.4Very low43.8Very low117 Ų117124.6 Ų124.682%0.81878%0.779SS**  -162.5131.5126.4-150.20000111.3
248P49.7Very low44.7Very low129 Ų129124.9 Ų124.984%0.83876%0.764SS**  trans-89.5130.7-174.734.9-30000111.3
249G39.2Very low45.7Very low73 Ų73122.3 Ų122.375%0.75375%0.748SS**  trans-162.531.5176.500000113.5L251G249-L251 PolarHBondContact O-N 3.07Å
250S45.2Very low46.8Very low113 Ų113121.4 Ų121.479%0.7974%0.74SS**  trans-84.778.4171175.40000109.7S252S250-S252 PolarHBondContact O-N 3.45Å
251L42Very low48.2Very low173 Ų173119.2 Ų119.291%0.90673%0.73SS**  trans-92.285.2158.4-67.1-176.9000108.5G249 M253G249-L251 PolarHBondContact O-N 3.07Å; L251-M253 PolarHBondContact O-N 3.4Å
252S51.2Low50.3Low91 Ų91120.7 Ų120.764%0.63672%0.718SS**  trans-61.1122.7161.8158.20000109.2S250S250-S252 PolarHBondContact O-N 3.45Å
253M45.8Very low52.5Low181 Ų181117.3 Ų117.389%0.89270%0.703SS**  trans-144.1109.3145.4-87-54.3150.300111.9L251L251-M253 PolarHBondContact O-N 3.4Å
254H51.3Low54.7Low171 Ų171114.8 Ų114.879%0.79269%0.689SS**SBendtrans106.274.8147.2-149.578.5000119.7
255N44.2Very low57Low120 Ų120114.7 Ų114.764%0.64268%0.678SS**  -167.4141.3129-137.46.2000109.8
256P49.3Very low59.7Low72 Ų72116.7 Ų116.747%0.46867%0.668SS.*  trans-74148.5-177.931.6-30.1000110.7V258 H259P256-V258 HydrophobicContact CB-CG2 4.27Å; P256-V258 PolarHBondContact O-N 2.88Å; P256-H259 PolarHBondContact O-N 2.92Å
257P57.6Low62.3Low91 Ų91119.4 Ų119.459%0.59166%0.656SS**THydrogen-bonded Turntrans-58.3-18.7-175.919.8-31000114.5H259 T260 E261P257-H259 VanDerWaalsContact C-N 3.31Å; P257-H259 PolarHBondContact O-N 3.2Å; P257-T260 PolarHBondContact O-N 3.01Å; P257-T260 VanDerWaalsContact O-N 3.14Å; P257-T260 PolarHBondContact O-OG1 3.45Å; P257-E261 PolarHBondContact O-N 3.24Å
258V55.1Low65.2Low84 Ų84119.7 Ų119.751%0.50964%0.644SS.*Hα-helixtrans-57-39.9-178.7-159.30000112.6P256 T260 E261 E262P256-V258 HydrophobicContact CB-CG2 4.27Å; P256-V258 PolarHBondContact O-N 2.88Å; V258-T260 VanDerWaalsContact C-N 3.34Å; V258-T260 PolarHBondContact O-N 2.85Å; V258-E261 PolarHBondContact O-N 2.88Å; V258-E262 WeakPolarHBondContact O-CB 3.5Å; V258-E262 WeakPolarHBondContact O-CG 3.38Å; V258-E262 PolarHBondContact O-N 2.82Å
259H57.6Low67.5Low105 Ų105117 Ų11749%0.48663%0.625SS.*Hα-helixtrans-72.6-27.5-178.5-104.4-36.1000113.2P256 P257 E262 V263P256-H259 PolarHBondContact O-N 2.92Å; P257-H259 VanDerWaalsContact C-N 3.31Å; P257-H259 PolarHBondContact O-N 3.2Å; H259-E262 IonicContact CE1-OE2 3.75Å; H259-E262 IonicContact ND1-OE2 3.3Å; H259-E262 PolarHBondContact ND1-OE2 2.84Å; H259-V263 WeakPolarHBondContact O-CB 3.24Å; H259-V263 WeakPolarHBondContact O-CG2 3.48Å; H259-V263 PolarHBondContact O-N 2.96Å; H259-V263 VanDerWaalsContact O-N 3.11Å
260T64.8Low70.3Confident92 Ų92121 Ų12156%0.56462%0.618SS**Hα-helixtrans-74.7-38.6177.363.10000111.7P257 V258 V263 T264P257-T260 PolarHBondContact O-N 3.01Å; P257-T260 VanDerWaalsContact O-N 3.14Å; P257-T260 PolarHBondContact O-OG1 3.45Å; V258-T260 VanDerWaalsContact C-N 3.34Å; V258-T260 PolarHBondContact O-N 2.85Å; T260-V263 PolarHBondContact O-N 2.96Å; T260-T264 WeakPolarHBondContact O-CG2 3.46Å; T260-T264 PolarHBondContact O-N 3.47Å; T260-T264 PolarHBondContact O-OG1 2.98Å
261E75.1Confident72.8Confident127 Ų127120.7 Ų120.759%0.59361%0.606SS**Hα-helixtrans-70.3-35.4175.4-66.9-174.9170.800112.7P257 V258 T264 R265P257-E261 PolarHBondContact O-N 3.24Å; V258-E261 PolarHBondContact O-N 2.88Å; E261-T264 WeakPolarHBondContact CA-OG1 3.49Å; E261-T264 PolarHBondContact O-OG1 3.13Å; E261-R265 VanDerWaalsContact O-CB 3.28Å; E261-R265 WeakPolarHBondContact O-CB 3.47Å; E261-R265 PolarHBondContact O-N 3.21Å
262E79.5Confident75.5Confident104 Ų104117.8 Ų117.849%0.48659%0.589SS.*Hα-helixtrans-66.2-38.8172-76.9-179.2167.500112.2V258 H259 K266V258-E262 WeakPolarHBondContact O-CB 3.5Å; V258-E262 WeakPolarHBondContact O-CG 3.38Å; V258-E262 PolarHBondContact O-N 2.82Å; H259-E262 IonicContact CE1-OE2 3.75Å; H259-E262 IonicContact ND1-OE2 3.3Å; H259-E262 PolarHBondContact ND1-OE2 2.84Å; E262-K266 VanDerWaalsContact O-CB 3.22Å; E262-K266 WeakPolarHBondContact O-CB 3.14Å; E262-K266 PolarHBondContact O-N 2.87Å
263V87.4Confident77.8Confident91 Ų91120.6 Ų120.655%0.55259%0.59SS**Hα-helixtrans-67.5-41.2177.11690000111.1H259 T260 K266 R267H259-V263 WeakPolarHBondContact O-CB 3.24Å; H259-V263 WeakPolarHBondContact O-CG2 3.48Å; H259-V263 PolarHBondContact O-N 2.96Å; H259-V263 VanDerWaalsContact O-N 3.11Å; T260-V263 PolarHBondContact O-N 2.96Å; V263-K266 PolarHBondContact O-N 3.07Å; V263-R267 WeakPolarHBondContact O-CB 3.46Å; V263-R267 PolarHBondContact O-N 3.38Å
264T91.8Very high80.3Confident89 Ų89117.3 Ų117.355%0.54658%0.577SS.*Hα-helixtrans-67.1-45.417656.30000111.3T260 E261 K266 R267 E268T260-T264 WeakPolarHBondContact O-CG2 3.46Å; T260-T264 PolarHBondContact O-N 3.47Å; T260-T264 PolarHBondContact O-OG1 2.98Å; E261-T264 WeakPolarHBondContact CA-OG1 3.49Å; E261-T264 PolarHBondContact O-OG1 3.13Å; T264-K266 VanDerWaalsContact C-N 3.33Å; T264-K266 PolarHBondContact O-N 3.36Å; T264-R267 WeakPolarHBondContact O-CB 3.41Å; T264-R267 PolarHBondContact O-N 3.38Å; T264-R267 VanDerWaalsContact O-N 3.1Å; T264-E268 PolarHBondContact O-N 2.65Å
265R94.5Very high82.5Confident178 Ų178116.2 Ų116.267%0.67257%0.565SS**Hα-helixtrans-59.6-41.9175-168.4-176.1-67.8-152.10.9111.8E261 R267 E268 V269E261-R265 VanDerWaalsContact O-CB 3.28Å; E261-R265 WeakPolarHBondContact O-CB 3.47Å; E261-R265 PolarHBondContact O-N 3.21Å; R265-R267 VanDerWaalsContact C-N 3.35Å; R265-R267 PolarHBondContact O-N 3.31Å; R265-E268 WeakPolarHBondContact O-CB 3.47Å; R265-E268 PolarHBondContact O-N 2.94Å; R265-V269 WeakPolarHBondContact O-CG2 3.32Å; R265-V269 PolarHBondContact O-N 3.03Å
266K96.1Very high85.1Confident144 Ų144115.3 Ų115.363%0.62656%0.557SS**Hα-helixtrans-65.5-35.7175.3-175.3175.4-179.5177.30112.5E262 V263 T264 R270E262-K266 VanDerWaalsContact O-CB 3.22Å; E262-K266 WeakPolarHBondContact O-CB 3.14Å; E262-K266 PolarHBondContact O-N 2.87Å; V263-K266 PolarHBondContact O-N 3.07Å; T264-K266 VanDerWaalsContact C-N 3.33Å; T264-K266 PolarHBondContact O-N 3.36Å; K266-R270 WeakPolarHBondContact O-CG 3.42Å; K266-R270 PolarHBondContact O-N 3.43Å
267R96.3Very high87.4Confident163 Ų163114.5 Ų114.562%0.61556%0.556SS**Hα-helixtrans-65.4-44.3172.7-175-177.7-175.3-1681.8110.9V263 T264 R265 R270 L271V263-R267 WeakPolarHBondContact O-CB 3.46Å; V263-R267 PolarHBondContact O-N 3.38Å; T264-R267 WeakPolarHBondContact O-CB 3.41Å; T264-R267 PolarHBondContact O-N 3.38Å; T264-R267 VanDerWaalsContact O-N 3.1Å; R265-R267 VanDerWaalsContact C-N 3.35Å; R265-R267 PolarHBondContact O-N 3.31Å; R267-R270 WeakPolarHBondContact O-CB 3.38Å; R267-R270 PolarHBondContact O-N 2.91Å; R267-L271 HydrophobicContact CG-CD1 4.27Å; R267-L271 WeakPolarHBondContact O-CG 3.27Å; R267-L271 PolarHBondContact O-N 2.86Å
268E96.5Very high89.4Confident122 Ų122112 Ų11257%0.5754%0.543SS*.Hα-helixtrans-60.7-47.3178.5-174.5176.9-168.700111.9T264 R265 R270 L271 M272T264-E268 PolarHBondContact O-N 2.65Å; R265-E268 WeakPolarHBondContact O-CB 3.47Å; R265-E268 PolarHBondContact O-N 2.94Å; E268-R270 VanDerWaalsContact C-N 3.28Å; E268-R270 PolarHBondContact O-N 3.45Å; E268-L271 PolarHBondContact O-N 2.91Å; E268-L271 VanDerWaalsContact O-N 3.13Å; E268-M272 WeakPolarHBondContact O-CG 3.41Å; E268-M272 PolarHBondContact O-N 3.28Å
269V97.4Very high91.5Very high73 Ų73113.5 Ų113.544%0.44254%0.54SS..Hα-helixtrans-58.4-41175.5172.10000111.5R265 M272 K273R265-V269 WeakPolarHBondContact O-CG2 3.32Å; R265-V269 PolarHBondContact O-N 3.03Å; V269-M272 PolarHBondContact O-N 3.18Å; V269-K273 HydrophobicContact CG1-CD 4.31Å; V269-K273 WeakPolarHBondContact O-CB 3.2Å; V269-K273 WeakPolarHBondContact O-CG 3.12Å; V269-K273 PolarHBondContact O-N 3Å
270R98.1Very high93.4Very high158 Ų158114.8 Ų114.860%0.59655%0.546SS*.Hα-helixtrans-63.6-43.4176.4-77-172.3-68.2163-2112K266 R267 E268 K273 N274K266-R270 WeakPolarHBondContact O-CG 3.42Å; K266-R270 PolarHBondContact O-N 3.43Å; R267-R270 WeakPolarHBondContact O-CB 3.38Å; R267-R270 PolarHBondContact O-N 2.91Å; E268-R270 VanDerWaalsContact C-N 3.28Å; E268-R270 PolarHBondContact O-N 3.45Å; R270-K273 PolarHBondContact O-N 3.47Å; R270-N274 WeakPolarHBondContact O-CB 3.41Å; R270-N274 PolarHBondContact O-N 3.37Å
271L98.3Very high95.1Very high105 Ų105114.6 Ų114.655%0.5555%0.547SS..Hα-helixtrans-65.7-40.8177.6-68.8174.9000111.5R267 E268 N274 R275R267-L271 HydrophobicContact CG-CD1 4.27Å; R267-L271 WeakPolarHBondContact O-CG 3.27Å; R267-L271 PolarHBondContact O-N 2.86Å; E268-L271 PolarHBondContact O-N 2.91Å; E268-L271 VanDerWaalsContact O-N 3.13Å; L271-N274 PolarHBondContact O-N 3.21Å; L271-R275 WeakPolarHBondContact O-CB 3.41Å; L271-R275 PolarHBondContact O-N 2.91Å
272M97.8Very high96.2Very high112 Ų112117.7 Ų117.755%0.55255%0.554SS**Hα-helixtrans-62.7-45.3175.3-72.8-69.1-115.700112E268 V269 R275 E276E268-M272 WeakPolarHBondContact O-CG 3.41Å; E268-M272 PolarHBondContact O-N 3.28Å; V269-M272 PolarHBondContact O-N 3.18Å; M272-R275 WeakPolarHBondContact O-CB 3.33Å; M272-R275 PolarHBondContact O-N 3.34Å; M272-E276 PolarHBondContact O-N 3.44Å
273K98.6Very high97.1Very high150 Ų150119.9 Ų119.965%0.65256%0.562SS**Hα-helixtrans-63.6-41.6175.1-74.1-175.4175.8-1710112.5V269 R270 R275 E276 A277V269-K273 HydrophobicContact CG1-CD 4.31Å; V269-K273 WeakPolarHBondContact O-CB 3.2Å; V269-K273 WeakPolarHBondContact O-CG 3.12Å; V269-K273 PolarHBondContact O-N 3Å; R270-K273 PolarHBondContact O-N 3.47Å; K273-R275 VanDerWaalsContact C-N 3.33Å; K273-E276 PolarHBondContact O-N 2.87Å; K273-A277 WeakPolarHBondContact O-CB 3.33Å; K273-A277 PolarHBondContact O-N 3.4Å
274N98.4Very high97.6Very high113 Ų113123 Ų12360%0.60457%0.568SS**Hα-helixtrans-65.1-38.8176.5-175-96.4000111.6R270 L271 E276 A277 A278R270-N274 WeakPolarHBondContact O-CB 3.41Å; R270-N274 PolarHBondContact O-N 3.37Å; L271-N274 PolarHBondContact O-N 3.21Å; N274-E276 VanDerWaalsContact C-N 3.31Å; N274-E276 PolarHBondContact O-N 3.5Å; N274-A277 PolarHBondContact O-N 3.11Å; N274-A278 WeakPolarHBondContact O-CB 3.48Å; N274-A278 PolarHBondContact O-N 3.34Å
275R98.5Very high98Very high148 Ų148126 Ų12656%0.55857%0.573SS**Hα-helixtrans-59.3-43.8173.8-171.7178.6-173.3-174.5-0.6111.3L271 M272 K273 R279L271-R275 WeakPolarHBondContact O-CB 3.41Å; L271-R275 PolarHBondContact O-N 2.91Å; M272-R275 WeakPolarHBondContact O-CB 3.33Å; M272-R275 PolarHBondContact O-N 3.34Å; K273-R275 VanDerWaalsContact C-N 3.33Å; R275-R279 WeakPolarHBondContact O-CG 3.48Å; R275-R279 PolarHBondContact O-N 2.9Å
276E98.6Very high98.2Very high101 Ų101125.5 Ų125.547%0.47258%0.576SS.*Hα-helixtrans-67.9-46.9177.8-164.558.9-159.400112.2M272 K273 N274 A278 R279 E280M272-E276 PolarHBondContact O-N 3.44Å; K273-E276 PolarHBondContact O-N 2.87Å; N274-E276 VanDerWaalsContact C-N 3.31Å; N274-E276 PolarHBondContact O-N 3.5Å; E276-A278 PolarHBondContact O-N 3.26Å; E276-R279 WeakPolarHBondContact O-CB 3.35Å; E276-R279 PolarHBondContact O-N 3.46Å; E276-R279 IonicContact OE2-CZ 3.56Å; E276-R279 IonicContact OE2-NH1 3.73Å; E276-R279 PolarHBondContact OE2-NH1 3.37Å; E276-E280 PolarHBondContact O-N 2.91Å
277A98.5Very high98.3Very high54 Ų54124.7 Ų124.745%0.44658%0.575SS.*Hα-helixtrans-57.4-38.3176.200000112.3K273 N274 E280 C281K273-A277 WeakPolarHBondContact O-CB 3.33Å; K273-A277 PolarHBondContact O-N 3.4Å; N274-A277 PolarHBondContact O-N 3.11Å; A277-E280 PolarHBondContact O-N 2.85Å; A277-C281 WeakPolarHBondContact O-CB 3.44Å; A277-C281 PolarHBondContact O-N 3.12Å
278A98.8Very high98.4Very high38 Ų38124 Ų12431%0.31457%0.573SS.*Hα-helixtrans-66.2-38.3175.800000112.5N274 E276 R282N274-A278 WeakPolarHBondContact O-CB 3.48Å; N274-A278 PolarHBondContact O-N 3.34Å; E276-A278 PolarHBondContact O-N 3.26Å; A278-R282 WeakPolarHBondContact O-CD 3.31Å; A278-R282 VanDerWaalsContact O-CG 3.24Å; A278-R282 WeakPolarHBondContact O-CG 3.33Å; A278-R282 PolarHBondContact O-N 3.42Å; A278-R282 VanDerWaalsContact O-N 3.14Å
279R98.7Very high98.6Very high116 Ų116121.1 Ų121.144%0.43856%0.564SS.*Hα-helixtrans-64.2-47.7174.4-70.1-179.2-171.6120.5-8.1111R275 E276 R282 K283R275-R279 WeakPolarHBondContact O-CG 3.48Å; R275-R279 PolarHBondContact O-N 2.9Å; E276-R279 WeakPolarHBondContact O-CB 3.35Å; E276-R279 PolarHBondContact O-N 3.46Å; E276-R279 IonicContact OE2-CZ 3.56Å; E276-R279 IonicContact OE2-NH1 3.73Å; E276-R279 PolarHBondContact OE2-NH1 3.37Å; R279-R282 PolarHBondContact O-N 3.21Å; R279-K283 PolarHBondContact O-N 2.89Å
280E98.7Very high98.6Very high132 Ų132124.9 Ų124.962%0.61757%0.574SS**Hα-helixtrans-64.7-43.3-178.8-167.8176.9-179.400111.7E276 A277 R282 K283 K284E276-E280 PolarHBondContact O-N 2.91Å; A277-E280 PolarHBondContact O-N 2.85Å; E280-R282 VanDerWaalsContact C-N 3.33Å; E280-R282 PolarHBondContact O-N 3Å; E280-K283 PolarHBondContact O-N 2.97Å; E280-K283 VanDerWaalsContact O-N 3.15Å; E280-K284 WeakPolarHBondContact O-CB 3.48Å; E280-K284 PolarHBondContact O-N 3.48Å
281C98.8Very high98.6Very high88 Ų88121 Ų12160%0.59557%0.57SS**Hα-helixtrans-55.9-46.6174178.90000111.7A277 K284 K285A277-C281 WeakPolarHBondContact O-CB 3.44Å; A277-C281 PolarHBondContact O-N 3.12Å; C281-K284 PolarHBondContact O-N 2.7Å; C281-K285 WeakPolarHBondContact O-CB 3.31Å; C281-K285 PolarHBondContact O-N 3.02Å
282R98.8Very high98.7Very high192 Ų192119.3 Ų119.373%0.72556%0.562SS**Hα-helixtrans-63.9-41.5176.3-70.2170-173.7-175.21.7112.2A278 R279 E280 K285 K286A278-R282 WeakPolarHBondContact O-CD 3.31Å; A278-R282 VanDerWaalsContact O-CG 3.24Å; A278-R282 WeakPolarHBondContact O-CG 3.33Å; A278-R282 PolarHBondContact O-N 3.42Å; A278-R282 VanDerWaalsContact O-N 3.14Å; R279-R282 PolarHBondContact O-N 3.21Å; E280-R282 VanDerWaalsContact C-N 3.33Å; E280-R282 PolarHBondContact O-N 3Å; R282-K285 PolarHBondContact O-N 3.39Å; R282-K286 PolarHBondContact O-N 3.1Å
283K98.9Very high98.7Very high150 Ų150119.9 Ų119.965%0.65256%0.563SS**Hα-helixtrans-61.9-48.9177.7-174.7-178.1176.4-173.10111R279 E280 K285 K286 E287R279-K283 PolarHBondContact O-N 2.89Å; E280-K283 PolarHBondContact O-N 2.97Å; E280-K283 VanDerWaalsContact O-N 3.15Å; K283-K285 VanDerWaalsContact C-N 3.34Å; K283-K285 PolarHBondContact O-N 3.32Å; K283-K286 WeakPolarHBondContact O-CB 3.21Å; K283-K286 PolarHBondContact O-N 3.48Å; K283-K286 VanDerWaalsContact O-N 3.16Å; K283-E287 PolarHBondContact O-N 3.2Å
284K98.9Very high98.7Very high156 Ų156117.8 Ų117.868%0.67856%0.559SS**Hα-helixtrans-62.3-40.3178.7-169.5171.6-175.7174.40111.8E280 C281 E287 Y288E280-K284 WeakPolarHBondContact O-CB 3.48Å; E280-K284 PolarHBondContact O-N 3.48Å; C281-K284 PolarHBondContact O-N 2.7Å; K284-E287 PolarHBondContact O-N 3.05Å; K284-Y288 WeakPolarHBondContact O-CB 3.37Å; K284-Y288 PolarHBondContact O-N 3.33Å
285K98.8Very high98.7Very high152 Ų152120.2 Ų120.266%0.66156%0.559SS**Hα-helixtrans-61.8-44.9173.8-173.5175.7-179-1800111.7C281 R282 K283 E287 Y288 V289C281-K285 WeakPolarHBondContact O-CB 3.31Å; C281-K285 PolarHBondContact O-N 3.02Å; R282-K285 PolarHBondContact O-N 3.39Å; K283-K285 VanDerWaalsContact C-N 3.34Å; K283-K285 PolarHBondContact O-N 3.32Å; K285-E287 VanDerWaalsContact C-N 3.33Å; K285-E287 PolarHBondContact O-N 3.27Å; K285-Y288 PolarHBondContact O-N 3.47Å; K285-V289 WeakPolarHBondContact O-CG2 3.4Å; K285-V289 PolarHBondContact O-N 2.96Å
286K98.8Very high98.8Very high168 Ų168116.7 Ų116.773%0.7355%0.554SS**Hα-helixtrans-60.9-42.7177.3-174.4176.5-178.8178.10111.8R282 K283 K290R282-K286 PolarHBondContact O-N 3.1Å; K283-K286 WeakPolarHBondContact O-CB 3.21Å; K283-K286 PolarHBondContact O-N 3.48Å; K283-K286 VanDerWaalsContact O-N 3.16Å; K286-K290 PolarHBondContact O-N 3.14Å; K286-K290 VanDerWaalsContact O-N 3.09Å
287E98.8Very high98.8Very high128 Ų128114.3 Ų114.360%0.59855%0.552SS**Hα-helixtrans-69.1-40.3178.3-173.3172.1-178.600112.6K283 K284 K285 V289 K290 C291K283-E287 PolarHBondContact O-N 3.2Å; K284-E287 PolarHBondContact O-N 3.05Å; K285-E287 VanDerWaalsContact C-N 3.33Å; K285-E287 PolarHBondContact O-N 3.27Å; E287-V289 VanDerWaalsContact C-N 3.35Å; E287-V289 PolarHBondContact O-N 3.25Å; E287-K290 WeakPolarHBondContact O-CB 3.37Å; E287-K290 PolarHBondContact O-N 3.28Å; E287-C291 WeakPolarHBondContact O-CB 3.49Å; E287-C291 PolarHBondContact O-N 3.23Å
288Y98.8Very high98.8Very high148 Ų148115 Ų11558%0.5855%0.55SS*.Hα-helixtrans-60-45.3174.7177.7-110.7000111.7K284 K285 K290 C291 L292K284-Y288 WeakPolarHBondContact O-CB 3.37Å; K284-Y288 PolarHBondContact O-N 3.33Å; K285-Y288 PolarHBondContact O-N 3.47Å; Y288-K290 VanDerWaalsContact C-N 3.34Å; Y288-K290 PolarHBondContact O-N 2.98Å; Y288-C291 PolarHBondContact O-N 2.82Å; Y288-L292 HydrophobicContact CD1-CD1 4.04Å; Y288-L292 HydrophobicContact CE1-CD1 3.44Å; Y288-L292 VanDerWaalsContact CE1-CD1 3.44Å; Y288-L292 HydrophobicContact CE1-CG 4.14Å; Y288-L292 HydrophobicContact CE2-CD1 4.36Å; Y288-L292 HydrophobicContact CE2-CD2 4.33Å; Y288-L292 HydrophobicContact CE2-CG 4.21Å; Y288-L292 WeakPolarHBondContact O-CG 3.38Å; Y288-L292 PolarHBondContact O-N 3.02Å
289V98.9Very high98.8Very high62 Ų62116.9 Ų116.938%0.37655%0.554SS.*Hα-helixtrans-58.9-47.1174.5171.90000110.5K285 E287 C291 L292 E293K285-V289 WeakPolarHBondContact O-CG2 3.4Å; K285-V289 PolarHBondContact O-N 2.96Å; E287-V289 VanDerWaalsContact C-N 3.35Å; E287-V289 PolarHBondContact O-N 3.25Å; V289-C291 VanDerWaalsContact C-N 3.3Å; V289-C291 PolarHBondContact O-N 3.09Å; V289-L292 WeakPolarHBondContact O-CB 3.36Å; V289-L292 PolarHBondContact O-N 3.43Å; V289-L292 VanDerWaalsContact O-N 3.13Å; V289-E293 HydrophobicContact CG1-CG 4.41Å; V289-E293 WeakPolarHBondContact O-CG 3.49Å; V289-E293 PolarHBondContact O-N 3.44Å
290K98.8Very high98.8Very high151 Ų151117.2 Ų117.266%0.65756%0.561SS**Hα-helixtrans-59.9-39.2177.1-172.4-179.6180-175.80112.8K286 E287 Y288 E293 N294K286-K290 PolarHBondContact O-N 3.14Å; K286-K290 VanDerWaalsContact O-N 3.09Å; E287-K290 WeakPolarHBondContact O-CB 3.37Å; E287-K290 PolarHBondContact O-N 3.28Å; Y288-K290 VanDerWaalsContact C-N 3.34Å; Y288-K290 PolarHBondContact O-N 2.98Å; K290-E293 PolarHBondContact O-N 2.79Å; K290-N294 WeakPolarHBondContact O-CB 3.5Å; K290-N294 PolarHBondContact O-N 3.32Å
291C98.8Very high98.8Very high77 Ų77115.7 Ų115.752%0.5256%0.557SS.*Hα-helixtrans-66.7-39.3176.6-179.20000111.6E287 Y288 V289 N294 R295E287-C291 WeakPolarHBondContact O-CB 3.49Å; E287-C291 PolarHBondContact O-N 3.23Å; Y288-C291 PolarHBondContact O-N 2.82Å; V289-C291 VanDerWaalsContact C-N 3.3Å; V289-C291 PolarHBondContact O-N 3.09Å; C291-N294 PolarHBondContact O-N 3.32Å; C291-R295 WeakPolarHBondContact O-CB 3.4Å; C291-R295 PolarHBondContact O-N 3.31Å
292L98.9Very high98.8Very high70 Ų70116.5 Ų116.537%0.36655%0.552SS.*Hα-helixtrans-64.2-45.9173.6-71.8179.9000111.8Y288 V289 N294 R295 V296Y288-L292 HydrophobicContact CD1-CD1 4.04Å; Y288-L292 HydrophobicContact CE1-CD1 3.44Å; Y288-L292 VanDerWaalsContact CE1-CD1 3.44Å; Y288-L292 HydrophobicContact CE1-CG 4.14Å; Y288-L292 HydrophobicContact CE2-CD1 4.36Å; Y288-L292 HydrophobicContact CE2-CD2 4.33Å; Y288-L292 HydrophobicContact CE2-CG 4.21Å; Y288-L292 WeakPolarHBondContact O-CG 3.38Å; Y288-L292 PolarHBondContact O-N 3.02Å; V289-L292 WeakPolarHBondContact O-CB 3.36Å; V289-L292 PolarHBondContact O-N 3.43Å; V289-L292 VanDerWaalsContact O-N 3.13Å; L292-N294 VanDerWaalsContact C-N 3.31Å; L292-N294 PolarHBondContact O-N 2.92Å; L292-R295 PolarHBondContact O-N 3.31Å; L292-V296 WeakPolarHBondContact O-CG2 3.49Å; L292-V296 PolarHBondContact O-N 3.47Å
293E98.6Very high98.8Very high123 Ų123111.9 Ų111.958%0.57554%0.542SS*.Hα-helixtrans-57.8-44.6175.8-70167.6169.600111.2V289 K290 V296 A297V289-E293 HydrophobicContact CG1-CG 4.41Å; V289-E293 WeakPolarHBondContact O-CG 3.49Å; V289-E293 PolarHBondContact O-N 3.44Å; K290-E293 PolarHBondContact O-N 2.79Å; E293-V296 PolarHBondContact O-N 3.29Å; E293-A297 PolarHBondContact O-N 3.14Å
294N98.8Very high98.8Very high106 Ų106110.5 Ų110.557%0.56754%0.536SS*.Hα-helixtrans-63.7-43.2175.6-179.9-99.2000112.2K290 C291 L292 V296 A297 V298K290-N294 WeakPolarHBondContact O-CB 3.5Å; K290-N294 PolarHBondContact O-N 3.32Å; C291-N294 PolarHBondContact O-N 3.32Å; L292-N294 VanDerWaalsContact C-N 3.31Å; L292-N294 PolarHBondContact O-N 2.92Å; N294-V296 VanDerWaalsContact C-N 3.31Å; N294-V296 PolarHBondContact O-N 3.04Å; N294-A297 PolarHBondContact O-N 3.36Å; N294-V298 WeakPolarHBondContact O-CG2 3.4Å; N294-V298 PolarHBondContact O-N 2.94Å
295R98.8Very high98.8Very high164 Ų164105.8 Ų105.862%0.61952%0.52SS*.Hα-helixtrans-62-40.4177.1-176.7175.8177.2169-0.4111.5C291 L292 V298 L299C291-R295 WeakPolarHBondContact O-CB 3.4Å; C291-R295 PolarHBondContact O-N 3.31Å; L292-R295 PolarHBondContact O-N 3.31Å; R295-V298 PolarHBondContact O-N 3.44Å; R295-L299 HydrophobicContact CG-CD1 4.04Å; R295-L299 HydrophobicContact CG-CG 4.48Å; R295-L299 WeakPolarHBondContact O-CB 3.11Å; R295-L299 VanDerWaalsContact O-CG 3.26Å; R295-L299 WeakPolarHBondContact O-CG 3.41Å; R295-L299 PolarHBondContact O-N 3.44Å
296V98.9Very high98.8Very high74 Ų74102.9 Ų102.945%0.44851%0.511SS..Hα-helixtrans-60.2-49.5174.2169.70000110L292 E293 N294 V298 L299 E300L292-V296 WeakPolarHBondContact O-CG2 3.49Å; L292-V296 PolarHBondContact O-N 3.47Å; E293-V296 PolarHBondContact O-N 3.29Å; N294-V296 VanDerWaalsContact C-N 3.31Å; N294-V296 PolarHBondContact O-N 3.04Å; V296-V298 VanDerWaalsContact C-N 3.32Å; V296-V298 PolarHBondContact O-N 3.11Å; V296-L299 PolarHBondContact O-N 2.9Å; V296-L299 VanDerWaalsContact O-N 3.14Å; V296-E300 HydrophobicContact CG1-CG 4.24Å; V296-E300 WeakPolarHBondContact CG1-OE1 3.14Å; V296-E300 WeakPolarHBondContact O-CB 3.22Å; V296-E300 WeakPolarHBondContact O-CG 3.39Å; V296-E300 PolarHBondContact O-N 3.48Å
297A98.8Very high98.7Very high51 Ų51100.2 Ų100.242%0.42150%0.504SS..Hα-helixtrans-59.6-40.4178.700000113E293 N294 N301E293-A297 PolarHBondContact O-N 3.14Å; N294-A297 PolarHBondContact O-N 3.36Å; A297-N301 WeakPolarHBondContact O-CB 3.49Å; A297-N301 PolarHBondContact O-N 3.46Å
298V98.8Very high98.7Very high68 Ų6899.3 Ų99.341%0.41250%0.5SS..Hα-helixtrans-63.6-46175.4170.80000111N294 R295 V296 N301 Q302N294-V298 WeakPolarHBondContact O-CG2 3.4Å; N294-V298 PolarHBondContact O-N 2.94Å; R295-V298 PolarHBondContact O-N 3.44Å; V296-V298 VanDerWaalsContact C-N 3.32Å; V296-V298 PolarHBondContact O-N 3.11Å; V298-N301 PolarHBondContact O-N 3.44Å; V298-Q302 HydrophobicContact CG1-CG 4.46Å; V298-Q302 WeakPolarHBondContact O-CG 3.48Å; V298-Q302 PolarHBondContact O-N 3.01Å
299L98.8Very high98.6Very high78 Ų7897.2 Ų97.241%0.40850%0.495SS..Hα-helixtrans-65.7-38.1179.5-71.9170.9000112.1R295 V296 N301 Q302 N303R295-L299 HydrophobicContact CG-CD1 4.04Å; R295-L299 HydrophobicContact CG-CG 4.48Å; R295-L299 WeakPolarHBondContact O-CB 3.11Å; R295-L299 VanDerWaalsContact O-CG 3.26Å; R295-L299 WeakPolarHBondContact O-CG 3.41Å; R295-L299 PolarHBondContact O-N 3.44Å; V296-L299 PolarHBondContact O-N 2.9Å; V296-L299 VanDerWaalsContact O-N 3.14Å; L299-N301 VanDerWaalsContact C-N 3.35Å; L299-Q302 PolarHBondContact O-N 3.15Å; L299-N303 WeakPolarHBondContact O-CB 3.24Å; L299-N303 PolarHBondContact O-N 3.03Å; L299-N303 PolarHBondContact O-ND2 2.9Å
300E98.6Very high98.6Very high123 Ų12399.9 Ų99.958%0.57551%0.507SS*.Hα-helixtrans-62-43.6173.8-74.2174.4169.500111.3V296 N303 K304V296-E300 HydrophobicContact CG1-CG 4.24Å; V296-E300 WeakPolarHBondContact CG1-OE1 3.14Å; V296-E300 WeakPolarHBondContact O-CB 3.22Å; V296-E300 WeakPolarHBondContact O-CG 3.39Å; V296-E300 PolarHBondContact O-N 3.48Å; E300-N303 PolarHBondContact O-N 3.29Å; E300-K304 WeakPolarHBondContact O-CB 3.23Å; E300-K304 PolarHBondContact O-N 3.41Å
301N98.8Very high98.4Very high101 Ų101100.1 Ų100.154%0.5451%0.508SS..Hα-helixtrans-65.8-43.9176.6-168.346.4000112A297 V298 L299 N303 K304 T305A297-N301 WeakPolarHBondContact O-CB 3.49Å; A297-N301 PolarHBondContact O-N 3.46Å; V298-N301 PolarHBondContact O-N 3.44Å; L299-N301 VanDerWaalsContact C-N 3.35Å; N301-N303 PolarHBondContact O-N 3.37Å; N301-K304 WeakPolarHBondContact O-CB 3.46Å; N301-K304 PolarHBondContact O-N 3.4Å; N301-T305 PolarHBondContact O-N 3.49Å; N301-T305 PolarHBondContact O-OG1 3.32Å
302Q98.7Very high98.3Very high105 Ų10598.9 Ų98.949%0.49150%0.503SS..Hα-helixtrans-59.3-46.5175-75178.7-31.100111.7V298 L299 K304 T305 L306V298-Q302 HydrophobicContact CG1-CG 4.46Å; V298-Q302 WeakPolarHBondContact O-CG 3.48Å; V298-Q302 PolarHBondContact O-N 3.01Å; L299-Q302 PolarHBondContact O-N 3.15Å; Q302-K304 VanDerWaalsContact C-N 3.29Å; Q302-K304 PolarHBondContact O-N 3.39Å; Q302-T305 PolarHBondContact O-N 2.95Å; Q302-L306 VanDerWaalsContact O-CG 3.31Å; Q302-L306 WeakPolarHBondContact O-CG 3.38Å; Q302-L306 PolarHBondContact O-N 2.93Å
303N98.6Very high98.2Very high95 Ų95101 Ų10151%0.50851%0.514SS..Hα-helixtrans-60-40.6176.2-81.6-28.7000111.8L299 E300 N301 L306 I307L299-N303 WeakPolarHBondContact O-CB 3.24Å; L299-N303 PolarHBondContact O-N 3.03Å; L299-N303 PolarHBondContact O-ND2 2.9Å; E300-N303 PolarHBondContact O-N 3.29Å; N301-N303 PolarHBondContact O-N 3.37Å; N303-L306 PolarHBondContact O-N 3.47Å; N303-I307 WeakPolarHBondContact O-CB 3.28Å; N303-I307 WeakPolarHBondContact O-CD1 3.29Å; N303-I307 WeakPolarHBondContact O-CG1 3.49Å; N303-I307 PolarHBondContact O-N 2.89Å
304K98.7Very high98Very high121 Ų121102.1 Ų102.153%0.52652%0.517SS..Hα-helixtrans-61-49.3176.7-172.9-176.2175.6-169.30111.6E300 N301 Q302 L306 I307 E308E300-K304 WeakPolarHBondContact O-CB 3.23Å; E300-K304 PolarHBondContact O-N 3.41Å; N301-K304 WeakPolarHBondContact O-CB 3.46Å; N301-K304 PolarHBondContact O-N 3.4Å; Q302-K304 VanDerWaalsContact C-N 3.29Å; Q302-K304 PolarHBondContact O-N 3.39Å; K304-L306 PolarHBondContact O-N 3.25Å; K304-I307 PolarHBondContact O-N 2.82Å; K304-E308 WeakPolarHBondContact CE-OE1 3.39Å; K304-E308 WeakPolarHBondContact O-CG 3.23Å; K304-E308 PolarHBondContact O-N 3.04Å
305T98.6Very high97.8Very high56 Ų56101.3 Ų101.334%0.34451%0.513SS..Hα-helixtrans-59.6-45.5177.4-58.50000111.6N301 Q302 I307 E308 E309N301-T305 PolarHBondContact O-N 3.49Å; N301-T305 PolarHBondContact O-OG1 3.32Å; Q302-T305 PolarHBondContact O-N 2.95Å; T305-I307 VanDerWaalsContact C-N 3.31Å; T305-I307 PolarHBondContact O-N 3.47Å; T305-E308 PolarHBondContact O-N 3.26Å; T305-E308 VanDerWaalsContact O-N 3.14Å; T305-E309 HydrophobicContact CG2-CG 4.5Å; T305-E309 WeakPolarHBondContact O-CG 3.49Å; T305-E309 PolarHBondContact O-N 3.47Å
306L98.6Very high97.6Very high91 Ų9197.9 Ų97.948%0.47651%0.506SS..Hα-helixtrans-61.6-38.8177.8-70172.4000112.3Q302 N303 K304 E309 L310Q302-L306 VanDerWaalsContact O-CG 3.31Å; Q302-L306 WeakPolarHBondContact O-CG 3.38Å; Q302-L306 PolarHBondContact O-N 2.93Å; N303-L306 PolarHBondContact O-N 3.47Å; K304-L306 PolarHBondContact O-N 3.25Å; L306-E309 PolarHBondContact O-N 3.11Å; L306-L310 WeakPolarHBondContact O-CB 3.43Å; L306-L310 VanDerWaalsContact O-CG 3.25Å; L306-L310 WeakPolarHBondContact O-CG 3.36Å; L306-L310 PolarHBondContact O-N 2.96Å
307I98.2Very high97.2Very high113 Ų113102 Ų10258%0.57951%0.514SS*.Hα-helixtrans-64.3-42.3175.2-71.3164.7000110.9N303 K304 T305 L310 K311N303-I307 WeakPolarHBondContact O-CB 3.28Å; N303-I307 WeakPolarHBondContact O-CD1 3.29Å; N303-I307 WeakPolarHBondContact O-CG1 3.49Å; N303-I307 PolarHBondContact O-N 2.89Å; K304-I307 PolarHBondContact O-N 2.82Å; T305-I307 VanDerWaalsContact C-N 3.31Å; T305-I307 PolarHBondContact O-N 3.47Å; I307-L310 PolarHBondContact O-N 3.49Å; I307-K311 WeakPolarHBondContact O-CB 3.47Å; I307-K311 PolarHBondContact O-N 2.89Å
308E97.9Very high96.2Very high109 Ų109103 Ų10351%0.50952%0.518SS..Hα-helixtrans-64.2-43.3177.7-72.8173.9-175.100111.6K304 T305 K311 A312K304-E308 WeakPolarHBondContact CE-OE1 3.39Å; K304-E308 WeakPolarHBondContact O-CG 3.23Å; K304-E308 PolarHBondContact O-N 3.04Å; T305-E308 PolarHBondContact O-N 3.26Å; T305-E308 VanDerWaalsContact O-N 3.14Å; E308-K311 WeakPolarHBondContact O-CB 3.3Å; E308-K311 PolarHBondContact O-N 3.46Å; E308-A312 PolarHBondContact O-N 3.41Å
309E97.4Very high94.8Very high104 Ų104105.8 Ų105.849%0.48653%0.526SS..Hα-helixtrans-62.1-46.9174.9-72.3176.6-178.300112T305 L306 K311 A312 L313T305-E309 HydrophobicContact CG2-CG 4.5Å; T305-E309 WeakPolarHBondContact O-CG 3.49Å; T305-E309 PolarHBondContact O-N 3.47Å; L306-E309 PolarHBondContact O-N 3.11Å; E309-K311 VanDerWaalsContact C-N 3.26Å; E309-K311 PolarHBondContact O-N 2.97Å; E309-A312 PolarHBondContact O-N 3.3Å; E309-L313 WeakPolarHBondContact O-CB 3.37Å; E309-L313 WeakPolarHBondContact O-CG 3.34Å; E309-L313 PolarHBondContact O-N 2.98Å
310L97.5Very high93Very high117 Ų117109.6 Ų109.661%0.61354%0.539SS*.Hα-helixtrans-60.9-38.3176.1-74.5176.3000111.7L306 I307 K314L306-L310 WeakPolarHBondContact O-CB 3.43Å; L306-L310 VanDerWaalsContact O-CG 3.25Å; L306-L310 WeakPolarHBondContact O-CG 3.36Å; L306-L310 PolarHBondContact O-N 2.96Å; I307-L310 PolarHBondContact O-N 3.49Å; L310-K314 WeakPolarHBondContact O-CB 3.46Å; L310-K314 PolarHBondContact O-N 2.83Å
311K96.6Very high91.1Very high157 Ų157109.2 Ų109.268%0.68354%0.541SS*.Hα-helixtrans-65.3-46175.8-174-179.1177.9-175.20111.1I307 E308 E309 K314 D315I307-K311 WeakPolarHBondContact O-CB 3.47Å; I307-K311 PolarHBondContact O-N 2.89Å; E308-K311 WeakPolarHBondContact O-CB 3.3Å; E308-K311 PolarHBondContact O-N 3.46Å; E309-K311 VanDerWaalsContact C-N 3.26Å; E309-K311 PolarHBondContact O-N 2.97Å; K311-K314 PolarHBondContact O-N 3.39Å; K311-D315 WeakPolarHBondContact O-CB 3.5Å; K311-D315 PolarHBondContact O-N 3.17Å
312A96Very high88.7Confident51 Ų51115.4 Ų115.442%0.42157%0.567SS.*Hα-helixtrans-61.4-43.6177.500000111.8E308 E309 K314 D315 I316E308-A312 PolarHBondContact O-N 3.41Å; E309-A312 PolarHBondContact O-N 3.3Å; A312-K314 PolarHBondContact O-N 3.27Å; A312-D315 WeakPolarHBondContact O-CB 3.37Å; A312-D315 PolarHBondContact O-N 3.02Å; A312-I316 WeakPolarHBondContact O-CD1 3.23Å; A312-I316 VanDerWaalsContact O-CG1 3.29Å; A312-I316 WeakPolarHBondContact O-CG1 3.47Å; A312-I316 PolarHBondContact O-N 3.45Å
313L96.4Very high88.2Confident113 Ų113115.9 Ų115.959%0.59257%0.57SS**Hα-helixtrans-63.1-42175.9-74.1168.8000112.2E309 D315 Y317E309-L313 WeakPolarHBondContact O-CB 3.37Å; E309-L313 WeakPolarHBondContact O-CG 3.34Å; E309-L313 PolarHBondContact O-N 2.98Å; L313-D315 VanDerWaalsContact C-N 3.34Å; L313-Y317 PolarHBondContact O-N 3.25Å; L313-Y317 VanDerWaalsContact O-N 3.13Å
314K95.2Very high87.6Confident148 Ų148117 Ų11764%0.64357%0.574SS**Hα-helixtrans-63.8-40.6176.3-173.5178.2179.3-178.30111.7L310 K311 A312 Y317 C318L310-K314 WeakPolarHBondContact O-CB 3.46Å; L310-K314 PolarHBondContact O-N 2.83Å; K311-K314 PolarHBondContact O-N 3.39Å; A312-K314 PolarHBondContact O-N 3.27Å; K314-Y317 PolarHBondContact O-N 3.3Å; K314-C318 WeakPolarHBondContact O-CB 3.24Å; K314-C318 PolarHBondContact O-N 3.28Å
315D94Very high87Confident88 Ų88116.8 Ų116.847%0.47158%0.576SS.*Hα-helixtrans-61.1-49178.3-163.156.5000111.3K311 A312 L313 Y317 C318 H319K311-D315 WeakPolarHBondContact O-CB 3.5Å; K311-D315 PolarHBondContact O-N 3.17Å; A312-D315 WeakPolarHBondContact O-CB 3.37Å; A312-D315 PolarHBondContact O-N 3.02Å; L313-D315 VanDerWaalsContact C-N 3.34Å; D315-Y317 VanDerWaalsContact C-N 3.26Å; D315-Y317 PolarHBondContact O-N 3Å; D315-C318 PolarHBondContact O-N 3.28Å; D315-H319 PolarHBondContact O-N 3.28Å; D315-H319 VanDerWaalsContact O-N 3.08Å; D315-H319 IonicContact OD1-CE1 3.95Å; D315-H319 IonicContact OD1-NE2 3.68Å
316I94.1Very high86.3Confident93 Ų93120.4 Ų120.448%0.47759%0.59SS.*Hα-helixtrans-59.6-36.9176.6-64.2163.3000111.7A312 K320A312-I316 WeakPolarHBondContact O-CD1 3.23Å; A312-I316 VanDerWaalsContact O-CG1 3.29Å; A312-I316 WeakPolarHBondContact O-CG1 3.47Å; A312-I316 PolarHBondContact O-N 3.45Å; I316-K320 HydrophobicContact CG2-CD 4.46Å; I316-K320 WeakPolarHBondContact O-CG 3.36Å
317Y90.4Very high85.6Confident160 Ų160122.2 Ų122.263%0.62760%0.597SS**Hα-helixtrans-79.2-34.1-179.9-167.1-100000113.1L313 K314 D315 N321L313-Y317 PolarHBondContact O-N 3.25Å; L313-Y317 VanDerWaalsContact O-N 3.13Å; K314-Y317 PolarHBondContact O-N 3.3Å; D315-Y317 VanDerWaalsContact C-N 3.26Å; D315-Y317 PolarHBondContact O-N 3Å; Y317-N321 PolarHBondContact O-ND2 3.38Å
318C78.4Confident84.7Confident72 Ų72122.8 Ų122.849%0.48660%0.598SS.*Hα-helixtrans-70.3-32.3176.6-900000112.8K314 D315K314-C318 WeakPolarHBondContact O-CB 3.24Å; K314-C318 PolarHBondContact O-N 3.28Å; D315-C318 PolarHBondContact O-N 3.28Å
319H68.4Low83.8Confident126 Ų126123.8 Ų123.858%0.58361%0.605SS**THydrogen-bonded Turntrans-86.2-7.1179.6-67.7-3.5000114.6D315D315-H319 PolarHBondContact O-N 3.28Å; D315-H319 VanDerWaalsContact O-N 3.08Å; D315-H319 IonicContact OD1-CE1 3.95Å; D315-H319 IonicContact OD1-NE2 3.68Å
320K61.8Low82.7Confident159 Ų159125.3 Ų125.369%0.69161%0.614SS**THydrogen-bonded Turntrans-87.7-9.5174.9-81.7-178.4178.6-177.90114.2I316I316-K320 HydrophobicContact CG2-CD 4.46Å; I316-K320 WeakPolarHBondContact O-CG 3.36Å
321N58Low81.5Confident115 Ų115126 Ų12662%0.61561%0.614SS**  trans-111.214.9-174.4-65.2-27.6000113Y317Y317-N321 PolarHBondContact O-ND2 3.38Å
322E48.6Very low80.1Confident230 Ų230123.2 Ų123.2100%1.07561%0.607SS**  trans-118.20172.1-163.9172.6-164.800109

Retrieved 322 of 322 residues in 583.8 ms (Link to these results)