A0A087YF45_POEFO Loading...

Iroquois homeobox 4a

AlphaFold DB , UniProt , Accession A0A087YF45, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 461 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
1M36.7Very low37.3Very low233 Ų233137.5 Ų137.5100%1.14879%0.792SS**  0132.50-72.6167166.700107.4
2T36Very low37.5Very low127 Ų127134.4 Ų134.478%0.77978%0.784SS**  trans43.9112.9163.155.10000119.4
3T43.5Very low37.2Very low116 Ų116134.8 Ų134.871%0.71279%0.79SS**  cis93.4124.232.768.90000117.4
4N35.9Very low37Very low143 Ų143129.4 Ų129.477%0.76578%0.777SS**  trans70.9127.2152-59.8-29.2000119.7
5S39.8Very low37Very low100 Ų100137.3 Ų137.370%0.69979%0.788SS**  cis86.5141.143.8-60.40000115.9
6L37.5Very low36.8Very low155 Ų155134.3 Ų134.381%0.81278%0.777SS**  trans80.6127.9169.8-48173.6000116.3
7T40Very low36.7Very low115 Ų115135.8 Ų135.871%0.70678%0.78SS**  cis93.9139.724690000117.5
8T40.3Very low36.6Very low130 Ų130133.2 Ų133.280%0.79878%0.777SS**  trans71.4156.3164.320.20000116.9
9C34.7Very low36.4Very low105 Ų105134 Ų13471%0.70978%0.778SS**  cis-163.5155.17.928.40000113.8
10C37.7Very low36.4Very low114 Ų114132.7 Ų132.777%0.7778%0.777SS**  trans55.8136.8138.6-60.20000123.9
11E28.7Very low36.2Very low175 Ų175130.2 Ų130.282%0.81878%0.779SS**  -162.5160.399.3-159.861.6-172.500110.6
12S38.8Very low36.2Very low100 Ų100126.3 Ų126.370%0.69977%0.768SS**  trans-135.4178.9179.1-73.50000111.2
13T34.2Very low36.2Very low139 Ų139124.4 Ų124.485%0.85377%0.766SS**  trans90.6136172.8-40.50000114.7
14G33.7Very low36Very low59 Ų59124 Ų12461%0.60877%0.774SS**  cis150.9151-9.700000113.1
15R37.9Very low35.9Very low249 Ų249123 Ų12394%0.9478%0.778SS**  trans68.1162.1170.6-54.1173.2-176.9-99.3-0.1115.6
16S33.4Very low35.8Very low89 Ų89121.9 Ų121.962%0.62278%0.783SS**  cis179.7137.5-31.3176.40000108.8
17I35.4Very low35.9Very low160 Ų160123.4 Ų123.482%0.82179%0.785SS**  trans57.9122.9155.3-70.8167.9000118.7
18A35.1Very low35.9Very low89 Ų89123.4 Ų123.474%0.73679%0.786SS**  174.4124.1115.800000114.5
19D33Very low36.4Very low148 Ų148123.1 Ų123.179%0.79179%0.786SS**  trans71.6118.1133.1-144.436.3000124.5
20S35.4Very low36.5Very low108 Ų108124.3 Ų124.376%0.75579%0.79SS**  trans31131.8135.5-52.20000123.2
21G32.8Very low36.3Very low80 Ų80128.4 Ų128.483%0.82579%0.79SS**  trans178.8103.6161.400000114.4
22V37.2Very low36.6Very low151 Ų151124.8 Ų124.892%0.91578%0.783SS**  trans-74.2134.4176.8173.10000111.3
23A35.3Very low37.1Very low88 Ų88125.3 Ų125.373%0.72778%0.784SS**  168.3144.8126.900000115.9
24A38.3Very low36.9Very low106 Ų106124.9 Ų124.988%0.87678%0.781SS**  trans72.6146.414600000121.5
25S34.5Very low36.8Very low122 Ų122131.5 Ų131.585%0.85379%0.789SS**  trans-91.1140.9-169.754.10000114.4
26G38.3Very low36.6Very low78 Ų78126.8 Ų126.880%0.80478%0.778SS**  trans-131.5143.4159.800000109.9
27Q39.9Very low36.6Very low186 Ų186126.1 Ų126.187%0.86977%0.773SS**  trans-87.2155.1-163.1-69.4-160.1-15.600116.2
28T39.5Very low36.8Very low116 Ų116128.9 Ų128.971%0.71277%0.773SS**  trans-32.315814943.60000115.4
29P50.5Low36.9Very low123 Ų123132.3 Ų132.380%0.79978%0.779SS**  cis-139.9157.837.737.7-17.9000119.7
30V37.3Very low37.3Very low130 Ų130133.8 Ų133.879%0.78879%0.786SS**  trans-74.6138.7166.9173.80000110
31Y33.5Very low37.1Very low201 Ų201132.8 Ų132.879%0.78878%0.783SS**  trans-84.5121.3179.7177.4-94.4000111.6
32C34.7Very low37.2Very low98 Ų98135.7 Ų135.766%0.66279%0.785SS**  trans-120.8124.7170.2-72.50000109.8V34C32-V34 PolarHBondContact O-N 3.28Å
33P48.2Very low36.9Very low112 Ų112133.2 Ų133.273%0.72778%0.781SS**  trans-76.5120.7170.429.6-31.6000110.8
34V31Very low36.8Very low129 Ų129140.9 Ų140.978%0.78279%0.791SS**  trans-105.7116.5175.9173.60000110.2C32C32-V34 PolarHBondContact O-N 3.28Å
35Y32.4Very low36.7Very low198 Ų198144.9 Ų144.978%0.77679%0.791SS**  trans30.9107.3137.8-145.9-108.8000118.9S37Y35-S37 WeakPolarHBondContact CE1-OG 2.94Å; Y35-S37 VanDerWaalsContact CZ-OG 3.3Å; Y35-S37 PolarHBondContact OH-OG 3.46Å
36E33.6Very low36.7Very low150 Ų150147.3 Ų147.370%0.70179%0.789SS**  trans-100.8112.1154.5-167.6179.9-173.600109.6R38E36-R38 HydrophobicContact CG-CG 4.35Å; E36-R38 IonicContact OE1-CZ 3.62Å; E36-R38 IonicContact OE1-NE 2.78Å; E36-R38 PolarHBondContact OE1-NE 2.78Å; E36-R38 IonicContact OE1-NH2 3.55Å
37S32.8Very low36.9Very low76 Ų76151.4 Ų151.453%0.53179%0.792SS.*  trans-116.5103.4164.4-86.60000109.3Y35 L39Y35-S37 WeakPolarHBondContact CE1-OG 2.94Å; Y35-S37 VanDerWaalsContact CZ-OG 3.3Å; Y35-S37 PolarHBondContact OH-OG 3.46Å; S37-L39 PolarHBondContact O-N 3.4Å
38R40.1Very low36.6Very low217 Ų217147.7 Ų147.782%0.81979%0.786SS**  trans-82.7101.1167.8-75.6-172-178.4-132.2-2.3110.5E36E36-R38 HydrophobicContact CG-CG 4.35Å; E36-R38 IonicContact OE1-CZ 3.62Å; E36-R38 IonicContact OE1-NE 2.78Å; E36-R38 PolarHBondContact OE1-NE 2.78Å; E36-R38 IonicContact OE1-NH2 3.55Å
39L37.2Very low36.5Very low162 Ų162147.9 Ų147.985%0.84879%0.793SS**  trans-93.3124.8153.1-80.8165.6000108.6S37S37-L39 PolarHBondContact O-N 3.4Å
40L40.5Very low35.8Very low179 Ų179146.4 Ų146.494%0.93779%0.79SS**  trans-117.9141.9147.7-118.187.4000107.9
41A32.4Very low35.9Very low86 Ų86144.9 Ų144.971%0.71179%0.791SS**  trans-102.1-178.7-171.400000112.8
42T33.3Very low36Very low141 Ų141139.8 Ų139.887%0.86579%0.791SS**  trans100.190.8155.179.10000118.7
43A31.6Very low36.3Very low100 Ų100143.2 Ų143.283%0.82680%0.802SS**  trans-15196.3137.700000108.7
44R33Very low35.7Very low248 Ų248141.5 Ų141.594%0.93681%0.805SS**PPolyproline II helixtrans-87.7123.8163.2-76.1-176.2174.7168.5-0.9107.1
45H35.7Very low36.3Very low190 Ų190140.9 Ų140.988%0.8880%0.801SS**PPolyproline II helixtrans-94.8120.1161.8-115.4-74.7000108.2
46E35.3Very low36.7Very low173 Ų173142.5 Ų142.581%0.80881%0.807SS**PPolyproline II helixtrans-75.1154.6178.5-65.8-165.8133.700112.4S48E46-S48 PolarHBondContact O-N 3.33Å
47L42.5Very low36.7Very low165 Ų165138.4 Ų138.486%0.86481%0.806SS**  trans-74.1114.5156.1-72.682.8000108
48S32.9Very low36.8Very low108 Ų108140.5 Ų140.576%0.75582%0.82SS**  trans-10092.9168.7-171.40000110.5E46 A50E46-S48 PolarHBondContact O-N 3.33Å; S48-A50 PolarHBondContact O-N 3.22Å
49S38.6Very low37.4Very low120 Ų120134.2 Ų134.284%0.83981%0.807SS**  trans-75.9100.6163.3-66.30000108.9
50A35.6Very low37.4Very low91 Ų91136.5 Ų136.575%0.75281%0.806SS**  trans-116.991173.900000110.5S48S48-A50 PolarHBondContact O-N 3.22Å
51A39.7Very low37.5Very low98 Ų98134.1 Ų134.181%0.8180%0.799SS**  trans-86.5159.8159.800000109.8
52A35.8Very low37.6Very low95 Ų95133.8 Ų133.879%0.78580%0.804SS**  trans68.5110177.300000116.8
53L39.9Very low37.7Very low169 Ų169130.4 Ų130.489%0.88580%0.797SS**  -166.8117.996.4-93169000108.9
54G36.8Very low38Very low77 Ų77135.1 Ų135.179%0.79480%0.802SS**  trans-95.1135.2173.700000110.9
55V42.3Very low38.1Very low115 Ų115126.5 Ų126.570%0.69779%0.791SS**  trans-144.1131.2170-161.60000108.6
56Y41.6Very low38.1Very low233 Ų233129.4 Ų129.491%0.91480%0.796SS**  trans65.7133-174.1-60.9-82.1000116.8
57G32.7Very low38.1Very low64 Ų64124.7 Ų124.766%0.6679%0.794SS**  cis164.540-2.400000120.2
58S35.8Very low38Very low120 Ų120124.3 Ų124.384%0.83979%0.792SS**  trans64-176.7161.6-121.70000115.8
59P52.5Low38.4Very low85 Ų85130.1 Ų130.155%0.55280%0.799SS**  cis-135178.5-1.527.7-2.8000117.4
60Y37.4Very low38.5Very low210 Ų210131.2 Ų131.282%0.82480%0.801SS**  trans73.1135.6164.4-57.2-61.8000117.4
61T42.5Very low38.6Very low129 Ų129131.3 Ų131.379%0.79180%0.801SS**  cis-147.6159.9-6.5200000109.1
62G35Very low38.7Very low79 Ų79137.4 Ų137.481%0.81481%0.805SS**  trans-72179.2167.500000112.9
63G34.1Very low38.7Very low70 Ų70136.4 Ų136.472%0.72280%0.804SS**  cis173.7167.6-3.300000111
64Q39Very low38.6Very low199 Ų199134.8 Ų134.893%0.9380%0.801SS**  trans53.6125.8168.4-56.1-65.36.200119.7
65G34.8Very low38.9Very low67 Ų67138.9 Ų138.969%0.69181%0.805SS**  trans128.1121.3145.100000117
66Y35.4Very low38.6Very low251 Ų251137.4 Ų137.498%0.98481%0.805SS**  trans36.3124.8143.9-81.8-96.5000120.7
67G34.8Very low38.8Very low74 Ų74132.2 Ų132.276%0.76380%0.802SS**  trans154.4108.8149.900000115.8
68N41.7Very low39Very low157 Ų157132.5 Ų132.584%0.8480%0.799SS**  trans-60.6132.5151.2-106.4-49.4000108.9
69Y40.9Very low39Very low229 Ų229136 Ų13690%0.89880%0.799SS**  trans-175.6123.6137.5-93.6-62.8000109.5
70V40.9Very low38.4Very low144 Ų144141.7 Ų141.787%0.87381%0.811SS**  trans-99111163.7175.70000107.2
71A36.4Very low38.4Very low92 Ų92138 Ų13876%0.7682%0.816SS**  trans-93.6136.3176.200000110.6
72Y41.5Very low38.2Very low227 Ų227139.8 Ų139.889%0.8982%0.82SS**  trans-68.9133169.1-98.1-102.6000110.2
73G36.1Very low38.3Very low74 Ų74139.2 Ų139.276%0.76381%0.814SS**  trans-115.3115.8171.200000110.4
74T38.7Very low38.3Very low135 Ų135143 Ų14383%0.82882%0.823SS**  trans-102.9129.2174.248.70000110.5
75D43Very low38.3Very low162 Ų162142.1 Ų142.187%0.86682%0.817SS**  trans-129.3150154.768.1-80.4000109.9
76A35.6Very low38.4Very low85 Ų85146.5 Ų146.570%0.70282%0.824SS**  trans-143.2143.9-16400000112.2
77S45.4Very low38.6Very low123 Ų123138.7 Ų138.786%0.8680%0.802SS**  trans67.4142.9164740000116
78A38.3Very low38.8Very low70 Ų70143.4 Ų143.458%0.57980%0.802SS**  cis-164178.446.800000115.4
79F35.8Very low38.7Very low195 Ų195142.8 Ų142.886%0.85580%0.799SS**  trans98.1132.1161-62.7-72.3000119.8
80Y38.3Very low38.4Very low204 Ų204136.5 Ų136.580%0.879%0.794SS**  trans-90.1158.4-160.7-58.3-101.5000112.5
81S37.8Very low38.2Very low132 Ų132134.6 Ų134.692%0.92379%0.794SS**  trans-146.4130.5139.9-800000108.9
82L39.8Very low38.3Very low167 Ų167135 Ų13587%0.87480%0.796SS**  trans-117.1123.1-165.5-168.2110.9000110.6
83G37Very low38.2Very low67 Ų67129.6 Ų129.669%0.69179%0.792SS**  trans73.5130.7146.400000119.8
84T32.5Very low38.3Very low149 Ų149130.1 Ų130.191%0.91479%0.789SS**  -147.8142.2123.2-71.70000108.3
85F40.5Very low38.5Very low181 Ų181132.5 Ų132.579%0.79479%0.791SS**  trans-79.4150.5-174.5-117-122.1000112.2T87F85-T87 WeakPolarHBondContact CD1-OG1 2.91Å; F85-T87 WeakPolarHBondContact CE1-OG1 3.32Å
86D35.2Very low38.4Very low159 Ų159129.4 Ų129.485%0.8579%0.788SS**  -148.8157.9117.5-163.7-149.4000110.8
87T40.6Very low38.5Very low86 Ų86128.8 Ų128.853%0.52879%0.79SS.*  trans-122.5165.2-165.8-45.90000111.1F85F85-T87 WeakPolarHBondContact CD1-OG1 2.91Å; F85-T87 WeakPolarHBondContact CE1-OG1 3.32Å
88K39.4Very low38.3Very low174 Ų174130.5 Ų130.576%0.75779%0.787SS**  trans84.3137152.4-160.6171.4176.1178.70114.7
89D39.4Very low38.4Very low144 Ų144133.7 Ų133.777%0.7780%0.8SS**  cis-123.2164.79.5-107.2-46.7000113.2
90A34.7Very low38.8Very low96 Ų96132.8 Ų132.879%0.79380%0.798SS**  trans-104.8150.1-179.500000113.2
91A36.2Very low39.1Very low105 Ų105127.7 Ų127.787%0.86880%0.799SS**  trans-150.4102149.800000109.4
92A39Very low39Very low99 Ų99127.6 Ų127.682%0.81879%0.793SS**  trans-82.4151.9175.800000111.2
93S38.8Very low39.1Very low115 Ų115123.5 Ų123.580%0.80478%0.783SS**  trans-131.5102.1150.6-169.90000108.1
94A37.6Very low39Very low85 Ų85130.2 Ų130.270%0.70279%0.789SS**  trans-99.7125.1177.600000109.2
95H44.6Very low39.6Very low185 Ų185133.4 Ų133.486%0.85679%0.786SS**  trans-109102.1155.8-84.8-72.6000108.6
96A40Very low39.8Very low97 Ų97129.3 Ų129.380%0.80278%0.777SS**  trans-80.5150.7171.100000110.7
97G37.4Very low40.4Very low72 Ų72132 Ų13274%0.74278%0.777SS**  trans78.3106.2153.100000117.4
98I42.6Very low40.6Very low158 Ų158132.6 Ų132.681%0.8178%0.777SS**  -151.3124.9113.5-104.3158.2000108.9Q100I98-Q100 HydrophobicContact CG2-CG 4.47Å
99T40.2Very low41.1Very low137 Ų137130 Ų13084%0.8478%0.778SS**  trans-83.8131.6169.347.70000109.3
100Q44.1Very low41.8Very low176 Ų176128 Ų12882%0.82277%0.771SS**  trans-129.2119.4152.5-73.9-164.262.300109I98I98-Q100 HydrophobicContact CG2-CG 4.47Å
101A43.5Very low42.7Very low98 Ų98129.8 Ų129.881%0.8177%0.767SS**  trans-97.9127.1171.900000108.6
102T37.1Very low43.1Very low130 Ų130128.1 Ų128.180%0.79876%0.759SS**  trans-159.7134.6161-11.70000112.1
103A40.5Very low43.4Very low81 Ų81132 Ų13267%0.66976%0.761SS**  trans56.678.1163.100000118.6Y105A103-Y105 PolarHBondContact O-N 3.3Å
104Y35.8Very low43.6Very low207 Ų207136 Ų13681%0.81276%0.759SS**  trans-70107.2156.9179.5-96.1000110.1P106Y104-P106 HydrophobicContact CD1-CG 4.31Å; Y104-P106 HydrophobicContact CE1-CB 4.16Å; Y104-P106 HydrophobicContact CE1-CG 3.77Å
105Y44.1Very low44.1Very low217 Ų217139.1 Ų139.185%0.85176%0.759SS**  trans-115.7106.5164.3-94.2-76.8000109.2A103 Y107A103-Y105 PolarHBondContact O-N 3.3Å; Y105-Y107 PolarHBondContact O-N 3.37Å
106P46.2Very low44Very low95 Ų95141 Ų14162%0.61776%0.76SS**  trans-77.5103.5174.330.5-30.9000109.2Y104Y104-P106 HydrophobicContact CD1-CG 4.31Å; Y104-P106 HydrophobicContact CE1-CB 4.16Å; Y104-P106 HydrophobicContact CE1-CG 3.77Å
107Y46.4Very low44.3Very low214 Ų214144.5 Ų144.584%0.83977%0.766SS**  trans-84.3126.1173.1-163.4-91.6000110.1Y105 P109Y105-Y107 PolarHBondContact O-N 3.37Å; Y107-P109 WeakPolarHBondContact O-CD 3.47Å
108D44.4Very low44.8Very low99 Ų99150.7 Ų150.753%0.52977%0.767SS.*  trans-67.6120.2-179.8-176.8-18.8000111T110D108-T110 VanDerWaalsContact C-N 3.29Å; D108-T110 VanDerWaalsContact CG-OG1 3.31Å; D108-T110 PolarHBondContact O-N 2.68Å; D108-T110 VanDerWaalsContact OD1-CB 3.31Å; D108-T110 WeakPolarHBondContact OD1-CB 3.31Å; D108-T110 VanDerWaalsContact OD1-CG2 3.31Å; D108-T110 WeakPolarHBondContact OD1-CG2 3.45Å; D108-T110 PolarHBondContact OD1-N 3.37Å; D108-T110 PolarHBondContact OD1-OG1 3.38Å; D108-T110 PolarHBondContact OD2-OG1 3.3Å
109P50.5Low44.9Very low120 Ų120154.3 Ų154.378%0.77977%0.772SS**G310 helixtrans-82.54.3-17734.2-35.7000114.4Y107Y107-P109 WeakPolarHBondContact O-CD 3.47Å
110T54.9Low45.3Very low101 Ų101151.5 Ų151.562%0.6277%0.77SS**G310 helixtrans-83.8-15.5-171.461.50000115.5D108 G112D108-T110 VanDerWaalsContact C-N 3.29Å; D108-T110 VanDerWaalsContact CG-OG1 3.31Å; D108-T110 PolarHBondContact O-N 2.68Å; D108-T110 VanDerWaalsContact OD1-CB 3.31Å; D108-T110 WeakPolarHBondContact OD1-CB 3.31Å; D108-T110 VanDerWaalsContact OD1-CG2 3.31Å; D108-T110 WeakPolarHBondContact OD1-CG2 3.45Å; D108-T110 PolarHBondContact OD1-N 3.37Å; D108-T110 PolarHBondContact OD1-OG1 3.38Å; D108-T110 PolarHBondContact OD2-OG1 3.3Å; T110-G112 PolarHBondContact O-N 3.46Å
111L53.2Low45.5Very low135 Ų135148.1 Ų148.171%0.70777%0.766SS**G310 helixtrans-94.820.8-174.9-149.171.3000114.9Y114L111-Y114 HydrophobicContact CD1-CE2 4.32Å
112G45.1Very low45.7Very low69 Ų69151.7 Ų151.771%0.71177%0.768SS**G310 helixtrans-94.5-9-179.100000116.2T110 Y114T110-G112 PolarHBondContact O-N 3.46Å; G112-Y114 PolarHBondContact O-N 3.29Å
113Q44.3Very low46.3Very low182 Ų182152 Ų15285%0.8576%0.764SS**  trans-101.241.7-169.3-66.6-174.4-76.600114.5Q115Q113-Q115 PolarHBondContact O-N 3.14Å
114Y42.4Very low46.6Very low199 Ų199152.7 Ų152.778%0.7878%0.78SS**  trans-79.5110.2169.5-89.7-80.9000111.5L111 G112 Y116L111-Y114 HydrophobicContact CD1-CE2 4.32Å; G112-Y114 PolarHBondContact O-N 3.29Å; Y114-Y116 PolarHBondContact O-N 3Å
115Q48.4Very low47.1Very low149 Ų149145.3 Ų145.370%0.69677%0.767SS**  trans-58.6125175-61.8173.1-103.700111.5Q113Q113-Q115 PolarHBondContact O-N 3.14Å
116Y43Very low47.5Very low224 Ų224141 Ų14188%0.87876%0.763SS**  trans-127.610.5163.5-122.2-82.4000114.4Y114Y114-Y116 PolarHBondContact O-N 3Å
117D47.1Very low47.9Very low171 Ų171147.2 Ų147.291%0.91477%0.774SS**  trans-106.954178.4-71.2-68.3000112.6
118R47.7Very low48.5Very low202 Ų202147.9 Ų147.976%0.76278%0.775SS**  trans-141.859171.8-163.7-176.5-86.3-164.7-4.3113.7
119Y44.4Very low49.6Very low235 Ų235152.8 Ų152.892%0.92279%0.792SS**SBendtrans-164.373.7133.7-129.2-94.7000111.4
120G48.5Very low50.5Low78 Ų78154.1 Ų154.180%0.80479%0.792SS**  trans-136.367176.300000109.9
121S47.2Very low51.4Low104 Ų104151.6 Ų151.673%0.72778%0.782SS**  trans-69.9138.2-172.6-163.80000112.2
122M48.6Very low52.8Low173 Ų173148.6 Ų148.685%0.85277%0.769SS**SBendtrans80.335154.2-133.968.915500120.9
123D49.2Very low54.7Low136 Ų136155 Ų15573%0.72777%0.772SS**  trans-151.538.8152.8-118.5-34.3000115G125D123-G125 PolarHBondContact O-N 3.34Å
124G47.6Very low56.7Low96 Ų96151.9 Ų151.999%0.9976%0.758SS**THydrogen-bonded Turntrans-71.467176.700000113.6
125G45.8Very low58.9Low53 Ų53144 Ų14455%0.54673%0.73SS.*THydrogen-bonded Turntrans-165.8-0.9-17300000118.7D123 R127D123-G125 PolarHBondContact O-N 3.34Å; G125-R127 PolarHBondContact O-N 3.04Å
126T52.8Low61Low126 Ų126137.7 Ų137.777%0.77370%0.702SS**  trans-77.247.6-179.145.80000114.2R128T126-R128 PolarHBondContact O-N 3.29Å; T126-R128 VanDerWaalsContact O-N 3.12Å
127R54.2Low63.6Low225 Ų225130.4 Ų130.485%0.84968%0.683SS**  trans-52.1124153-74-169.1-168.1-127.42.6106.6G125 K129G125-R127 PolarHBondContact O-N 3.04Å; R127-K129 PolarHBondContact O-N 2.94Å
128R58.4Low65.9Low229 Ų229124.5 Ų124.586%0.86465%0.654SS**  trans-53.3105.4177-64.2178.1-174.4166.62.6107.7T126 N130T126-R128 PolarHBondContact O-N 3.29Å; T126-R128 VanDerWaalsContact O-N 3.12Å; R128-N130 PolarHBondContact O-N 3.08Å; R128-N130 PolarHBondContact O-OD1 3.07Å; R128-N130 VanDerWaalsContact O-OD1 3.11Å
129K68.2Low68.3Low202 Ų202114.9 Ų114.988%0.87862%0.618SS**  trans-65.3100.7180-66.2-178.8-177.3176.30107.2R127 A131R127-K129 PolarHBondContact O-N 2.94Å; K129-A131 PolarHBondContact O-N 3.16Å
130N68.6Low70.7Confident147 Ų147108.5 Ų108.579%0.78660%0.595SS**PPolyproline II helixtrans-55.2127.9175.4-60.473.5000107.9R128 T132R128-N130 PolarHBondContact O-N 3.08Å; R128-N130 PolarHBondContact O-OD1 3.07Å; R128-N130 VanDerWaalsContact O-OD1 3.11Å; N130-T132 PolarHBondContact O-N 2.88Å
131A74.8Confident73Confident48 Ų48107.6 Ų107.640%0.39758%0.579SS.*PPolyproline II helixtrans-53.8128.9175.700000109.1K129 T136 M166K129-A131 PolarHBondContact O-N 3.16Å; A131-T136 HydrophobicContact CB-CG2 3.91Å; A131-M166 HydrophobicContact CB-SD 4.26Å
132T83.3Confident75.4Confident73 Ų73103.3 Ų103.345%0.44855%0.547SS..PPolyproline II helixtrans-64.9160.4-17484.60000110.7N130 E134 T135 T136N130-T132 PolarHBondContact O-N 2.88Å; T132-E134 WeakPolarHBondContact CB-OE2 3.37Å; T132-E134 PolarHBondContact O-N 3.45Å; T132-E134 PolarHBondContact OG1-OE2 3.25Å; T132-T135 PolarHBondContact N-OG1 2.92Å; T132-T135 PolarHBondContact O-N 3.37Å; T132-T135 PolarHBondContact O-OG1 2.63Å; T132-T135 VanDerWaalsContact O-OG1 3.06Å; T132-T135 PolarHBondContact OG1-N 3.2Å; T132-T136 PolarHBondContact O-N 2.96Å; T132-T136 VanDerWaalsContact O-N 3.11Å
133R84.6Confident77.6Confident202 Ų20295.9 Ų95.976%0.76251%0.511SS*.Hα-helixtrans-59-36.1-176.9-179.9174.4174.3-86.12.9110.8T136 S137R133-T136 PolarHBondContact O-N 2.98Å; R133-T136 PolarHBondContact O-OG1 3.26Å; R133-S137 PolarHBondContact O-N 2.76Å; R133-S137 VanDerWaalsContact O-N 3.09Å
134E85.3Confident79.7Confident118 Ų11894.6 Ų94.655%0.55150%0.501SS*.Hα-helixtrans-65.2-51.1178.6-53.964.4-129.700110.8T132 T136 S137T132-E134 WeakPolarHBondContact CB-OE2 3.37Å; T132-E134 PolarHBondContact O-N 3.45Å; T132-E134 PolarHBondContact OG1-OE2 3.25Å; E134-T136 VanDerWaalsContact C-N 3.29Å; E134-T136 PolarHBondContact O-N 3.07Å; E134-S137 WeakPolarHBondContact O-CB 3.3Å; E134-S137 PolarHBondContact O-N 3.28Å
135T90.1Very high82.1Confident32 Ų3297.2 Ų97.220%0.19649%0.487CS..Hα-helixtrans-62.9-36.3178.664.50000111.9T132 S137 T164T132-T135 PolarHBondContact N-OG1 2.92Å; T132-T135 PolarHBondContact O-N 3.37Å; T132-T135 PolarHBondContact O-OG1 2.63Å; T132-T135 VanDerWaalsContact O-OG1 3.06Å; T132-T135 PolarHBondContact OG1-N 3.2Å; T135-S137 VanDerWaalsContact C-N 3.26Å; T135-S137 PolarHBondContact O-N 3.09Å; T135-T164 VanDerWaalsContact CG2-O 3.29Å; T135-T164 WeakPolarHBondContact CG2-O 3.3Å; T135-T164 VanDerWaalsContact O-CG2 3.25Å; T135-T164 WeakPolarHBondContact O-CG2 3.49Å
136T92.6Very high84.4Confident18 Ų1897.4 Ų97.411%0.1147%0.474CS..Hα-helixtrans-73.1-15.9173.672.70000114A131 T132 R133 E134 K140A131-T136 HydrophobicContact CB-CG2 3.91Å; T132-T136 PolarHBondContact O-N 2.96Å; T132-T136 VanDerWaalsContact O-N 3.11Å; R133-T136 PolarHBondContact O-N 2.98Å; R133-T136 PolarHBondContact O-OG1 3.26Å; E134-T136 VanDerWaalsContact C-N 3.29Å; E134-T136 PolarHBondContact O-N 3.07Å; T136-K140 WeakPolarHBondContact O-CB 3.27Å; T136-K140 WeakPolarHBondContact O-CD 3.35Å; T136-K140 WeakPolarHBondContact O-CG 3.22Å; T136-K140 PolarHBondContact O-N 2.67Å; T136-K140 PolarHBondContact OG1-NZ 2.81Å
137S96Very high86.3Confident70 Ų7095.7 Ų95.749%0.4945%0.453SS..Hα-helixtrans-67-47.2-179.6-160.60000110.9R133 E134 T135 L139 K140 A141R133-S137 PolarHBondContact O-N 2.76Å; R133-S137 VanDerWaalsContact O-N 3.09Å; E134-S137 WeakPolarHBondContact O-CB 3.3Å; E134-S137 PolarHBondContact O-N 3.28Å; T135-S137 VanDerWaalsContact C-N 3.26Å; T135-S137 PolarHBondContact O-N 3.09Å; S137-L139 PolarHBondContact O-N 3.42Å; S137-K140 WeakPolarHBondContact O-CB 3.28Å; S137-K140 PolarHBondContact O-N 3.45Å; S137-K140 VanDerWaalsContact O-N 3.15Å; S137-A141 PolarHBondContact O-N 2.76Å
138T96.4Very high87.9Confident48 Ų4894 Ų9429%0.29445%0.452SS..Hα-helixtrans-60.3-44.1176.2-490000112K140 A141 W142 L160 I163T138-K140 VanDerWaalsContact C-N 3.29Å; T138-K140 PolarHBondContact O-N 3.39Å; T138-A141 PolarHBondContact O-N 3.28Å; T138-W142 PolarHBondContact O-N 3.5Å; T138-L160 HydrophobicContact CG2-CD2 3.95Å; T138-I163 HydrophobicContact CG2-CG2 3.91Å
139L96.9Very high89.5Confident0 Ų087.6 Ų87.60%044%0.435CS..Hα-helixtrans-63.2-35.9177.1-57.3179000112.2S137 L143 L160 T164 M166 V171 W174 F175S137-L139 PolarHBondContact O-N 3.42Å; L139-L143 VanDerWaalsContact O-CB 3.28Å; L139-L143 WeakPolarHBondContact O-CB 3.34Å; L139-L143 PolarHBondContact O-N 3.11Å; L139-L160 HydrophobicContact CD2-CB 4.11Å; L139-L160 HydrophobicContact CD2-CD1 4.43Å; L139-L160 HydrophobicContact CD2-CD2 4.35Å; L139-T164 HydrophobicContact CD2-CG2 3.86Å; L139-T164 HydrophobicContact CG-CG2 3.94Å; L139-M166 HydrophobicContact CD1-CE 4.24Å; L139-M166 HydrophobicContact CD1-SD 3.95Å; L139-V171 HydrophobicContact CD2-CG1 4.33Å; L139-W174 HydrophobicContact CB-CD2 4.08Å; L139-W174 HydrophobicContact CB-CE3 3.84Å; L139-W174 HydrophobicContact CB-CH2 3.65Å; L139-W174 HydrophobicContact CB-CZ2 3.87Å; L139-W174 HydrophobicContact CB-CZ3 3.63Å; L139-W174 HydrophobicContact CD1-CB 4.33Å; L139-W174 HydrophobicContact CD1-CD2 3.64Å; L139-W174 HydrophobicContact CD1-CE3 4.06Å; L139-W174 HydrophobicContact CD1-CG 3.74Å; L139-W174 HydrophobicContact CG-CD2 4.48Å; L139-W174 HydrophobicContact CG-CE3 4.49Å; L139-F175 HydrophobicContact CD2-CE2 4Å; L139-F175 HydrophobicContact CD2-CZ 4.43Å
140K95.4Very high90.8Very high101 Ų10178 Ų7844%0.43939%0.393SS..Hα-helixtrans-69.9-43.3174.1-73.4162.4-176.5156.60111.6T136 S137 T138 L143 Q144 W174T136-K140 WeakPolarHBondContact O-CB 3.27Å; T136-K140 WeakPolarHBondContact O-CD 3.35Å; T136-K140 WeakPolarHBondContact O-CG 3.22Å; T136-K140 PolarHBondContact O-N 2.67Å; T136-K140 PolarHBondContact OG1-NZ 2.81Å; S137-K140 WeakPolarHBondContact O-CB 3.28Å; S137-K140 PolarHBondContact O-N 3.45Å; S137-K140 VanDerWaalsContact O-N 3.15Å; T138-K140 VanDerWaalsContact C-N 3.29Å; T138-K140 PolarHBondContact O-N 3.39Å; K140-L143 WeakPolarHBondContact O-CB 3.31Å; K140-L143 PolarHBondContact O-N 3.38Å; K140-Q144 WeakPolarHBondContact O-CG 3.35Å; K140-Q144 PolarHBondContact O-N 2.98Å; K140-W174 HydrophobicContact CG-CH2 4.05Å; K140-W174 HydrophobicContact CG-CZ2 4.08Å
141A96.6Very high92.2Very high59 Ų5977 Ų7749%0.48838%0.379SS..Hα-helixtrans-58.7-52.3178.800000111S137 T138 L143 Q144 E145S137-A141 PolarHBondContact O-N 2.76Å; T138-A141 PolarHBondContact O-N 3.28Å; A141-L143 VanDerWaalsContact C-N 3.27Å; A141-L143 PolarHBondContact O-N 3.39Å; A141-Q144 WeakPolarHBondContact O-CB 3.34Å; A141-Q144 PolarHBondContact O-N 2.82Å; A141-E145 PolarHBondContact O-N 3.33Å; A141-E145 VanDerWaalsContact O-N 3.1Å
142W97.3Very high93.2Very high13 Ų1375.8 Ų75.85%0.04937%0.367CS..Hα-helixtrans-57.5-40.1175.7-173.693.9000111.9T138 Q144 E145 H146 P152 E156 L160 F175T138-W142 PolarHBondContact O-N 3.5Å; W142-Q144 VanDerWaalsContact C-N 3.33Å; W142-Q144 PolarHBondContact O-N 3.14Å; W142-E145 PolarHBondContact O-N 3.22Å; W142-H146 AromaticContact CD1-CE1 3.86Å; W142-H146 AromaticContact CD1-ND1 3.69Å; W142-H146 HydrophobicContact CD2-CB 4.21Å; W142-H146 AromaticContact CD2-CG 3.96Å; W142-H146 AromaticContact CD2-ND1 3.61Å; W142-H146 AromaticContact CE2-CE1 3.71Å; W142-H146 AromaticContact CE2-CG 3.5Å; W142-H146 VanDerWaalsContact CE2-CG 3.5Å; W142-H146 AromaticContact CE2-ND1 3.28Å; W142-H146 VanDerWaalsContact CE2-ND1 3.28Å; W142-H146 HydrophobicContact CE3-CB 3.95Å; W142-H146 AromaticContact CG-ND1 3.86Å; W142-H146 HydrophobicContact CH2-CB 3.45Å; W142-H146 VanDerWaalsContact CH2-CB 3.45Å; W142-H146 AromaticContact CH2-CG 3.6Å; W142-H146 HydrophobicContact CZ2-CB 3.75Å; W142-H146 AromaticContact CZ2-CD2 3.57Å; W142-H146 AromaticContact CZ2-CG 3.31Å; W142-H146 AromaticContact CZ2-ND1 3.63Å; W142-H146 HydrophobicContact CZ3-CB 3.59Å; W142-H146 AromaticContact NE1-CE1 3.39Å; W142-H146 PolarHBondContact NE1-CE1 2.64Å; W142-H146 AromaticContact NE1-ND1 3.37Å; W142-H146 PolarHBondContact NE1-ND1 3.1Å; W142-H146 WeakPolarHBondContact O-CB 3.42Å; W142-H146 PolarHBondContact O-N 3.39Å; W142-H146 PolarHBondContact O-ND1 2.95Å; W142-H146 VanDerWaalsContact O-ND1 3.13Å; W142-P152 VanDerWaalsContact CH2-CA 3.45Å; W142-P152 HydrophobicContact CH2-CB 3.64Å; W142-P152 HydrophobicContact CH2-CG 4.17Å; W142-P152 VanDerWaalsContact CH2-N 3.33Å; W142-P152 HydrophobicContact CZ2-CB 3.61Å; W142-P152 HydrophobicContact CZ3-CB 4.17Å; W142-P152 HydrophobicContact CZ3-CG 4.32Å; W142-E156 VanDerWaalsContact CE2-OE1 3.29Å; W142-E156 VanDerWaalsContact CZ2-OE1 3.28Å; W142-E156 WeakPolarHBondContact CZ2-OE1 3.33Å; W142-E156 PolarHBondContact NE1-OE1 3.09Å; W142-L160 HydrophobicContact CB-CD1 4.36Å; W142-L160 HydrophobicContact CB-CD2 4.17Å; W142-L160 HydrophobicContact CD2-CD1 4.12Å; W142-L160 HydrophobicContact CG-CD1 3.93Å; W142-L160 HydrophobicContact CG-CD2 4.36Å; W142-F175 HydrophobicContact CD2-CE1 4.44Å; W142-F175 HydrophobicContact CD2-CZ 4.15Å; W142-F175 HydrophobicContact CE3-CD1 4.39Å; W142-F175 AromaticContact CE3-CE1 3.33Å; W142-F175 HydrophobicContact CE3-CE1 3.33Å; W142-F175 AromaticContact CE3-CZ 3.43Å; W142-F175 HydrophobicContact CE3-CZ 3.43Å; W142-F175 VanDerWaalsContact CE3-CZ 3.43Å; W142-F175 HydrophobicContact CZ3-CD1 4.23Å; W142-F175 AromaticContact CZ3-CE1 3.57Å; W142-F175 HydrophobicContact CZ3-CE1 3.57Å; W142-F175 AromaticContact CZ3-CZ 4Å; W142-F175 HydrophobicContact CZ3-CZ 4Å
143L95.9Very high93.9Very high18 Ų1876.3 Ų76.39%0.09437%0.37CS..Hα-helixtrans-66.7-28.7177.2-177.365.9000113.7L139 K140 A141 R147 P150 W174 F175 A178L139-L143 VanDerWaalsContact O-CB 3.28Å; L139-L143 WeakPolarHBondContact O-CB 3.34Å; L139-L143 PolarHBondContact O-N 3.11Å; K140-L143 WeakPolarHBondContact O-CB 3.31Å; K140-L143 PolarHBondContact O-N 3.38Å; A141-L143 VanDerWaalsContact C-N 3.27Å; A141-L143 PolarHBondContact O-N 3.39Å; L143-R147 PolarHBondContact O-N 3.35Å; L143-P150 HydrophobicContact CD1-CB 3.43Å; L143-P150 VanDerWaalsContact CD1-CB 3.43Å; L143-W174 HydrophobicContact CD2-CH2 4.1Å; L143-W174 HydrophobicContact CD2-CZ3 4.13Å; L143-F175 HydrophobicContact CB-CE1 4.2Å; L143-F175 HydrophobicContact CD1-CD1 4.37Å; L143-F175 HydrophobicContact CD1-CE1 4.22Å; L143-A178 HydrophobicContact CD2-CB 3.84Å
144Q94Very high94.6Very high109 Ų10975.4 Ų75.451%0.50937%0.372SS..Hα-helixtrans-75.4-40.6176.5-65.4-83.3-22.200111.1K140 A141 W142 R147K140-Q144 WeakPolarHBondContact O-CG 3.35Å; K140-Q144 PolarHBondContact O-N 2.98Å; A141-Q144 WeakPolarHBondContact O-CB 3.34Å; A141-Q144 PolarHBondContact O-N 2.82Å; W142-Q144 VanDerWaalsContact C-N 3.33Å; W142-Q144 PolarHBondContact O-N 3.14Å; Q144-R147 VanDerWaalsContact CD-NH2 3.26Å; Q144-R147 WeakPolarHBondContact O-CG 3.45Å
145E96.5Very high95.2Very high151 Ų15172 Ų7271%0.70637%0.369SS*.Hα-helixtrans-64.8-50.7174-175.4173.3-149.600110.7A141 W142 R147A141-E145 PolarHBondContact O-N 3.33Å; A141-E145 VanDerWaalsContact O-N 3.1Å; W142-E145 PolarHBondContact O-N 3.22Å; E145-R147 PolarHBondContact O-N 2.98Å; E145-R147 VanDerWaalsContact O-N 3.09Å
146H94.4Very high95.6Very high57 Ų5772.4 Ų72.426%0.26437%0.368SS..THydrogen-bonded Turntrans-87.332.4-179-64.178.3000113.1W142 K148 N149 P150 E156W142-H146 AromaticContact CD1-CE1 3.86Å; W142-H146 AromaticContact CD1-ND1 3.69Å; W142-H146 HydrophobicContact CD2-CB 4.21Å; W142-H146 AromaticContact CD2-CG 3.96Å; W142-H146 AromaticContact CD2-ND1 3.61Å; W142-H146 AromaticContact CE2-CE1 3.71Å; W142-H146 AromaticContact CE2-CG 3.5Å; W142-H146 VanDerWaalsContact CE2-CG 3.5Å; W142-H146 AromaticContact CE2-ND1 3.28Å; W142-H146 VanDerWaalsContact CE2-ND1 3.28Å; W142-H146 HydrophobicContact CE3-CB 3.95Å; W142-H146 AromaticContact CG-ND1 3.86Å; W142-H146 HydrophobicContact CH2-CB 3.45Å; W142-H146 VanDerWaalsContact CH2-CB 3.45Å; W142-H146 AromaticContact CH2-CG 3.6Å; W142-H146 HydrophobicContact CZ2-CB 3.75Å; W142-H146 AromaticContact CZ2-CD2 3.57Å; W142-H146 AromaticContact CZ2-CG 3.31Å; W142-H146 AromaticContact CZ2-ND1 3.63Å; W142-H146 HydrophobicContact CZ3-CB 3.59Å; W142-H146 AromaticContact NE1-CE1 3.39Å; W142-H146 PolarHBondContact NE1-CE1 2.64Å; W142-H146 AromaticContact NE1-ND1 3.37Å; W142-H146 PolarHBondContact NE1-ND1 3.1Å; W142-H146 WeakPolarHBondContact O-CB 3.42Å; W142-H146 PolarHBondContact O-N 3.39Å; W142-H146 PolarHBondContact O-ND1 2.95Å; W142-H146 VanDerWaalsContact O-ND1 3.13Å; H146-K148 VanDerWaalsContact C-N 3.3Å; H146-K148 PolarHBondContact O-N 3Å; H146-N149 CarbonylContact O-C 3.6Å; H146-N149 PolarHBondContact O-N 2.96Å; H146-N149 VanDerWaalsContact O-N 3.12Å; H146-P150 VanDerWaalsContact O-CA 3.32Å; H146-P150 WeakPolarHBondContact O-CA 3.29Å; H146-E156 IonicContact CE1-OE1 3.59Å; H146-E156 IonicContact NE2-OE1 2.68Å
147R91.9Very high95.8Very high90 Ų9074 Ų7434%0.3437%0.374SS..THydrogen-bonded Turntrans-50-48.7178-89.3-91.3177.459.8-7.8112.5L143 Q144 E145 N149 M188L143-R147 PolarHBondContact O-N 3.35Å; Q144-R147 VanDerWaalsContact CD-NH2 3.26Å; Q144-R147 WeakPolarHBondContact O-CG 3.45Å; E145-R147 PolarHBondContact O-N 2.98Å; E145-R147 VanDerWaalsContact O-N 3.09Å; R147-N149 VanDerWaalsContact C-N 3.31Å; R147-N149 PolarHBondContact O-N 3.47Å; R147-M188 WeakPolarHBondContact O-CE 3.26Å
148K89.5Confident95.9Very high189 Ų18974.6 Ų74.682%0.82237%0.371SS*.THydrogen-bonded Turntrans-65.3-29.8-177.7-66.5-178.3-179.4177.60113.5H146 W190H146-K148 VanDerWaalsContact C-N 3.3Å; H146-K148 PolarHBondContact O-N 3Å; K148-W190 WeakPolarHBondContact O-CH2 3.48Å; K148-W190 WeakPolarHBondContact O-CZ3 3.46Å
149N91.6Very high96Very high94 Ų9476.9 Ų76.950%0.50338%0.379SS..  trans-146.379.7178.5-171.524.7000111.4H146 R147 Y151H146-N149 CarbonylContact O-C 3.6Å; H146-N149 PolarHBondContact O-N 2.96Å; H146-N149 VanDerWaalsContact O-N 3.12Å; R147-N149 VanDerWaalsContact C-N 3.31Å; R147-N149 PolarHBondContact O-N 3.47Å; N149-Y151 PolarHBondContact O-N 3.39Å; N149-Y151 WeakPolarHBondContact OD1-CD2 3.37Å
150P95.3Very high96Very high1 Ų177 Ų771%0.00638%0.38CS..  trans-79.743.6-17232-34.2000112.9L143 H146 R179 W190L143-P150 HydrophobicContact CD1-CB 3.43Å; L143-P150 VanDerWaalsContact CD1-CB 3.43Å; H146-P150 VanDerWaalsContact O-CA 3.32Å; H146-P150 WeakPolarHBondContact O-CA 3.29Å; P150-R179 HydrophobicContact CB-CG 4.06Å; P150-R179 HydrophobicContact CG-CG 3.8Å; P150-R179 WeakPolarHBondContact O-CD 3.31Å; P150-R179 PolarHBondContact O-NH1 3.31Å; P150-W190 VanDerWaalsContact CD-CZ2 3.48Å; P150-W190 HydrophobicContact CG-CH2 4.45Å; P150-W190 HydrophobicContact CG-CZ2 3.92Å
151Y97.3Very high96.1Very high127 Ų12772.9 Ų72.950%0.49837%0.365SS..  trans-118.390.7-179.9-72.6-100.4000108.7N149 T153 R179 W190N149-Y151 PolarHBondContact O-N 3.39Å; N149-Y151 WeakPolarHBondContact OD1-CD2 3.37Å; Y151-T153 PolarHBondContact O-N 3.37Å; Y151-R179 VanDerWaalsContact CE2-CD 3.47Å; Y151-W190 HydrophobicContact CE2-CH2 4.17Å; Y151-W190 HydrophobicContact CE2-CZ2 4.03Å
152P97.1Very high96.2Very high22 Ų2276 Ų7614%0.14337%0.372CS..  trans-63.7136.7-17824.5-33.2000110.8W142 E156 F175W142-P152 VanDerWaalsContact CH2-CA 3.45Å; W142-P152 HydrophobicContact CH2-CB 3.64Å; W142-P152 HydrophobicContact CH2-CG 4.17Å; W142-P152 VanDerWaalsContact CH2-N 3.33Å; W142-P152 HydrophobicContact CZ2-CB 3.61Å; W142-P152 HydrophobicContact CZ3-CB 4.17Å; W142-P152 HydrophobicContact CZ3-CG 4.32Å; P152-E156 HydrophobicContact CB-CB 4.08Å; P152-F175 HydrophobicContact CG-CD2 3.9Å; P152-F175 HydrophobicContact CG-CE2 4.09Å; P152-F175 HydrophobicContact CG-CG 4.13Å; P152-F175 HydrophobicContact CG-CZ 4.49Å
153T98.1Very high96.1Very high83 Ų8379.9 Ų79.951%0.50939%0.393SS..  trans-62.4168.5173.862.30000111.6Y151 G155 E156 K157Y151-T153 PolarHBondContact O-N 3.37Å; T153-G155 VanDerWaalsContact C-N 3.27Å; T153-G155 PolarHBondContact O-N 3.1Å; T153-E156 VanDerWaalsContact CB-OE2 3.3Å; T153-E156 WeakPolarHBondContact CB-OE2 3.29Å; T153-E156 VanDerWaalsContact CG2-OE2 3.3Å; T153-E156 WeakPolarHBondContact CG2-OE2 3.47Å; T153-E156 PolarHBondContact N-OE2 3.4Å; T153-E156 PolarHBondContact O-N 2.85Å; T153-E156 VanDerWaalsContact OG1-CG 3.27Å; T153-E156 WeakPolarHBondContact OG1-CG 3.25Å; T153-E156 PolarHBondContact OG1-N 3.31Å; T153-E156 PolarHBondContact OG1-OE2 3.33Å; T153-K157 VanDerWaalsContact O-CB 3.31Å; T153-K157 WeakPolarHBondContact O-CB 3.41Å; T153-K157 PolarHBondContact O-N 2.63Å
154K97.8Very high96.2Very high183 Ų18379.2 Ų79.280%0.79639%0.389SS*.Hα-helixtrans-55.1-42.8177.7-170.8179.3178.8-175.50111.8I158K154-I158 WeakPolarHBondContact O-CD1 3.46Å; K154-I158 WeakPolarHBondContact O-CG1 3.45Å; K154-I158 PolarHBondContact O-N 3.41Å
155G98.2Very high96.3Very high48 Ų4883.2 Ų83.250%0.49541%0.405SS..Hα-helixtrans-67.6-50.5178.800000113.1T153 K157 I158 M159T153-G155 VanDerWaalsContact C-N 3.27Å; T153-G155 PolarHBondContact O-N 3.1Å; G155-K157 VanDerWaalsContact C-N 3.26Å; G155-K157 PolarHBondContact O-N 3.03Å; G155-I158 WeakPolarHBondContact O-CB 3.15Å; G155-I158 PolarHBondContact O-N 3.27Å; G155-I158 VanDerWaalsContact O-N 3.08Å; G155-M159 PolarHBondContact O-N 3.25Å
156E98.1Very high96.2Very high39 Ų3977.3 Ų77.318%0.18238%0.378CS..Hα-helixtrans-60.6-37.3179-67.1168.3109.400112.2W142 H146 P152 T153 I158 M159 L160W142-E156 VanDerWaalsContact CE2-OE1 3.29Å; W142-E156 VanDerWaalsContact CZ2-OE1 3.28Å; W142-E156 WeakPolarHBondContact CZ2-OE1 3.33Å; W142-E156 PolarHBondContact NE1-OE1 3.09Å; H146-E156 IonicContact CE1-OE1 3.59Å; H146-E156 IonicContact NE2-OE1 2.68Å; P152-E156 HydrophobicContact CB-CB 4.08Å; T153-E156 VanDerWaalsContact CB-OE2 3.3Å; T153-E156 WeakPolarHBondContact CB-OE2 3.29Å; T153-E156 VanDerWaalsContact CG2-OE2 3.3Å; T153-E156 WeakPolarHBondContact CG2-OE2 3.47Å; T153-E156 PolarHBondContact N-OE2 3.4Å; T153-E156 PolarHBondContact O-N 2.85Å; T153-E156 VanDerWaalsContact OG1-CG 3.27Å; T153-E156 WeakPolarHBondContact OG1-CG 3.25Å; T153-E156 PolarHBondContact OG1-N 3.31Å; T153-E156 PolarHBondContact OG1-OE2 3.33Å; E156-I158 VanDerWaalsContact C-N 3.28Å; E156-I158 PolarHBondContact O-N 3.15Å; E156-M159 PolarHBondContact O-N 3.43Å; E156-L160 WeakPolarHBondContact O-CB 3.06Å; E156-L160 VanDerWaalsContact O-CG 3.22Å; E156-L160 WeakPolarHBondContact O-CG 3.34Å; E156-L160 PolarHBondContact O-N 2.93Å
157K97.8Very high96.3Very high53 Ų5378.3 Ų78.323%0.2339%0.388CS..Hα-helixtrans-63.7-34.7177.7-154.2-176.1-164.7176.60112.2T153 G155 A161 L168 V171 S172T153-K157 VanDerWaalsContact O-CB 3.31Å; T153-K157 WeakPolarHBondContact O-CB 3.41Å; T153-K157 PolarHBondContact O-N 2.63Å; G155-K157 VanDerWaalsContact C-N 3.26Å; G155-K157 PolarHBondContact O-N 3.03Å; K157-A161 VanDerWaalsContact O-CB 3.29Å; K157-A161 WeakPolarHBondContact O-CB 3.48Å; K157-A161 PolarHBondContact O-N 3.22Å; K157-A161 VanDerWaalsContact O-N 3.11Å; K157-L168 HydrophobicContact CB-CD1 3.93Å; K157-L168 HydrophobicContact CD-CD1 3.89Å; K157-L168 HydrophobicContact CD-CG 4.18Å; K157-L168 HydrophobicContact CG-CD1 3.65Å; K157-L168 HydrophobicContact CG-CG 4.37Å; K157-V171 HydrophobicContact CG-CG1 4.07Å; K157-S172 WeakPolarHBondContact CE-OG 3.3Å; K157-S172 PolarHBondContact NZ-OG 3.19Å
158I97.8Very high96.5Very high82 Ų8277.9 Ų77.942%0.42139%0.392SS..Hα-helixtrans-71.5-48.2173.3-66.2164000110K154 G155 E156 L160 A161 I162 L168K154-I158 WeakPolarHBondContact O-CD1 3.46Å; K154-I158 WeakPolarHBondContact O-CG1 3.45Å; K154-I158 PolarHBondContact O-N 3.41Å; G155-I158 WeakPolarHBondContact O-CB 3.15Å; G155-I158 PolarHBondContact O-N 3.27Å; G155-I158 VanDerWaalsContact O-N 3.08Å; E156-I158 VanDerWaalsContact C-N 3.28Å; E156-I158 PolarHBondContact O-N 3.15Å; I158-L160 VanDerWaalsContact C-N 3.34Å; I158-L160 PolarHBondContact O-N 2.86Å; I158-A161 WeakPolarHBondContact O-CB 3.4Å; I158-A161 PolarHBondContact O-N 3.17Å; I158-A161 VanDerWaalsContact O-N 3.14Å; I158-I162 HydrophobicContact CG2-CD1 3.86Å; I158-I162 WeakPolarHBondContact O-CG1 2.98Å; I158-I162 PolarHBondContact O-N 3.38Å; I158-L168 HydrophobicContact CG1-CD1 4.04Å
159M98.2Very high96.9Very high95 Ų9573.8 Ų73.847%0.46838%0.383SS..Hα-helixtrans-55.7-47.7176.8-179.317868.200111.8G155 E156 A161 I162 I163G155-M159 PolarHBondContact O-N 3.25Å; E156-M159 PolarHBondContact O-N 3.43Å; M159-A161 PolarHBondContact O-N 3.42Å; M159-I162 PolarHBondContact O-N 3.37Å; M159-I163 HydrophobicContact CG-CD1 3.75Å; M159-I163 VanDerWaalsContact O-CG1 3.31Å; M159-I163 WeakPolarHBondContact O-CG1 3.32Å; M159-I163 PolarHBondContact O-N 3.13Å
160L97.9Very high97.1Very high4 Ų473.9 Ų73.92%0.02138%0.38CS..Hα-helixtrans-64.8-39177.1-68.4172000112.1T138 L139 W142 E156 I158 T164 V171 F175T138-L160 HydrophobicContact CG2-CD2 3.95Å; L139-L160 HydrophobicContact CD2-CB 4.11Å; L139-L160 HydrophobicContact CD2-CD1 4.43Å; L139-L160 HydrophobicContact CD2-CD2 4.35Å; W142-L160 HydrophobicContact CB-CD1 4.36Å; W142-L160 HydrophobicContact CB-CD2 4.17Å; W142-L160 HydrophobicContact CD2-CD1 4.12Å; W142-L160 HydrophobicContact CG-CD1 3.93Å; W142-L160 HydrophobicContact CG-CD2 4.36Å; E156-L160 WeakPolarHBondContact O-CB 3.06Å; E156-L160 VanDerWaalsContact O-CG 3.22Å; E156-L160 WeakPolarHBondContact O-CG 3.34Å; E156-L160 PolarHBondContact O-N 2.93Å; I158-L160 VanDerWaalsContact C-N 3.34Å; I158-L160 PolarHBondContact O-N 2.86Å; L160-T164 WeakPolarHBondContact O-CB 3.02Å; L160-T164 WeakPolarHBondContact O-CG2 3.28Å; L160-T164 PolarHBondContact O-N 3.24Å; L160-T164 PolarHBondContact O-OG1 3.09Å; L160-V171 HydrophobicContact CB-CG1 4.24Å; L160-F175 HydrophobicContact CD1-CE2 3.7Å; L160-F175 HydrophobicContact CD1-CZ 3.86Å
161A97.3Very high97.2Very high14 Ų1473.9 Ų73.912%0.11638%0.38CS..Hα-helixtrans-60.5-44.2174.800000111.9K157 I158 M159 K165 M166 V171K157-A161 VanDerWaalsContact O-CB 3.29Å; K157-A161 WeakPolarHBondContact O-CB 3.48Å; K157-A161 PolarHBondContact O-N 3.22Å; K157-A161 VanDerWaalsContact O-N 3.11Å; I158-A161 WeakPolarHBondContact O-CB 3.4Å; I158-A161 PolarHBondContact O-N 3.17Å; I158-A161 VanDerWaalsContact O-N 3.14Å; M159-A161 PolarHBondContact O-N 3.42Å; A161-K165 WeakPolarHBondContact O-CA 3.46Å; A161-K165 PolarHBondContact O-N 3.06Å; A161-M166 CarbonylContact C-O 3.1Å; A161-M166 WeakPolarHBondContact CA-O 3.18Å; A161-M166 VanDerWaalsContact CB-O 3.26Å; A161-M166 WeakPolarHBondContact CB-O 3.35Å; A161-M166 PolarHBondContact O-N 3.04Å; A161-M166 VanDerWaalsContact O-N 3.1Å; A161-V171 HydrophobicContact CB-CG2 4.06Å
162I97.4Very high97.2Very high123 Ų12370 Ų7063%0.63137%0.371SS*.Hα-helixtrans-62.5-54.2176.3-66.2165.4000110.7I158 M159 T164 K165I158-I162 HydrophobicContact CG2-CD1 3.86Å; I158-I162 WeakPolarHBondContact O-CG1 2.98Å; I158-I162 PolarHBondContact O-N 3.38Å; M159-I162 PolarHBondContact O-N 3.37Å; I162-T164 PolarHBondContact O-N 3.41Å; I162-K165 PolarHBondContact O-N 3.19Å
163I96.7Very high97.2Very high96 Ų9672.9 Ų72.949%0.49239%0.389SS..Hα-helixtrans-62.4-42.6-175.8-64.5164.5000111.4T138 M159 K165T138-I163 HydrophobicContact CG2-CG2 3.91Å; M159-I163 HydrophobicContact CG-CD1 3.75Å; M159-I163 VanDerWaalsContact O-CG1 3.31Å; M159-I163 WeakPolarHBondContact O-CG1 3.32Å; M159-I163 PolarHBondContact O-N 3.13Å; I163-K165 VanDerWaalsContact C-N 3.32Å
164T96.5Very high97.2Very high3 Ų371.6 Ų71.62%0.01838%0.375CS..Hα-helixtrans-85-5.8-177.863.40000113.8T135 L139 L160 I162 M166T135-T164 VanDerWaalsContact CG2-O 3.29Å; T135-T164 WeakPolarHBondContact CG2-O 3.3Å; T135-T164 VanDerWaalsContact O-CG2 3.25Å; T135-T164 WeakPolarHBondContact O-CG2 3.49Å; L139-T164 HydrophobicContact CD2-CG2 3.86Å; L139-T164 HydrophobicContact CG-CG2 3.94Å; L160-T164 WeakPolarHBondContact O-CB 3.02Å; L160-T164 WeakPolarHBondContact O-CG2 3.28Å; L160-T164 PolarHBondContact O-N 3.24Å; L160-T164 PolarHBondContact O-OG1 3.09Å; I162-T164 PolarHBondContact O-N 3.41Å; T164-M166 PolarHBondContact O-N 2.82Å; T164-M166 WeakPolarHBondContact OG1-CB 3.21Å
165K96.1Very high97.2Very high194 Ų19463 Ų6384%0.84334%0.337SS*.THydrogen-bonded Turntrans52.935.1-173.5-54.2-178.7-177.6-179.60112.4A161 I162 I163A161-K165 WeakPolarHBondContact O-CA 3.46Å; A161-K165 PolarHBondContact O-N 3.06Å; I162-K165 PolarHBondContact O-N 3.19Å; I163-K165 VanDerWaalsContact C-N 3.32Å
166M94.6Very high97.1Very high27 Ų2761.9 Ų61.913%0.13332%0.324CS..  trans-107.8149.8178.1-69.5174.860.300109.7A131 L139 A161 T164 Q170 V171A131-M166 HydrophobicContact CB-SD 4.26Å; L139-M166 HydrophobicContact CD1-CE 4.24Å; L139-M166 HydrophobicContact CD1-SD 3.95Å; A161-M166 CarbonylContact C-O 3.1Å; A161-M166 WeakPolarHBondContact CA-O 3.18Å; A161-M166 VanDerWaalsContact CB-O 3.26Å; A161-M166 WeakPolarHBondContact CB-O 3.35Å; A161-M166 PolarHBondContact O-N 3.04Å; A161-M166 VanDerWaalsContact O-N 3.1Å; T164-M166 PolarHBondContact O-N 2.82Å; T164-M166 WeakPolarHBondContact OG1-CB 3.21Å; M166-Q170 HydrophobicContact CB-CB 4.17Å; M166-Q170 HydrophobicContact CE-CB 3.73Å; M166-V171 HydrophobicContact CB-CG2 3.93Å
167T97.1Very high97Very high78 Ų7863.3 Ų63.348%0.47933%0.332SS..  trans-67.815317573.30000110.9T169 Q170 V171T167-T169 PolarHBondContact O-N 3.26Å; T167-T169 VanDerWaalsContact O-N 3.1Å; T167-Q170 WeakPolarHBondContact O-CA 3.09Å; T167-Q170 WeakPolarHBondContact O-CB 3.33Å; T167-Q170 PolarHBondContact O-N 2.99Å; T167-Q170 WeakPolarHBondContact OG1-CG 3.36Å; T167-Q170 PolarHBondContact OG1-N 2.91Å; T167-V171 PolarHBondContact O-N 3.1Å
168L97Very high96.8Very high81 Ų8161.4 Ų61.442%0.42433%0.327SS..Hα-helixtrans-52.4-36.4177.2-165.174.4000112.1K157 I158 S172K157-L168 HydrophobicContact CB-CD1 3.93Å; K157-L168 HydrophobicContact CD-CD1 3.89Å; K157-L168 HydrophobicContact CD-CG 4.18Å; K157-L168 HydrophobicContact CG-CD1 3.65Å; K157-L168 HydrophobicContact CG-CG 4.37Å; I158-L168 HydrophobicContact CG1-CD1 4.04Å; L168-S172 VanDerWaalsContact O-CB 3.3Å; L168-S172 WeakPolarHBondContact O-CB 3.33Å; L168-S172 PolarHBondContact O-N 2.87Å
169T97Very high96.7Very high102 Ų10260.2 Ų60.263%0.62632%0.317SS*.Hα-helixtrans-66.8-41.6175.4-50.80000112.5T167 S172 T173T167-T169 PolarHBondContact O-N 3.26Å; T167-T169 VanDerWaalsContact O-N 3.1Å; T169-S172 WeakPolarHBondContact O-CB 3.35Å; T169-S172 PolarHBondContact O-N 3.04Å; T169-T173 WeakPolarHBondContact O-CB 3.34Å; T169-T173 PolarHBondContact O-N 3.49Å; T169-T173 PolarHBondContact O-OG1 3.37Å
170Q96.9Very high96.5Very high97 Ų9763.9 Ų63.945%0.45333%0.325SS..Hα-helixtrans-65-44.9175.4-72.5169.8-21.200111.3M166 T167 T173 W174M166-Q170 HydrophobicContact CB-CB 4.17Å; M166-Q170 HydrophobicContact CE-CB 3.73Å; T167-Q170 WeakPolarHBondContact O-CA 3.09Å; T167-Q170 WeakPolarHBondContact O-CB 3.33Å; T167-Q170 PolarHBondContact O-N 2.99Å; T167-Q170 WeakPolarHBondContact OG1-CG 3.36Å; T167-Q170 PolarHBondContact OG1-N 2.91Å; Q170-T173 PolarHBondContact O-N 3.28Å; Q170-W174 WeakPolarHBondContact O-CB 3.45Å; Q170-W174 PolarHBondContact O-N 3.12Å
171V97.3Very high96.2Very high0 Ų071.4 Ų71.40%035%0.354CS..Hα-helixtrans-60.1-46.9174.1177.70000110.6L139 K157 L160 A161 M166 T167 T173 W174 F175L139-V171 HydrophobicContact CD2-CG1 4.33Å; K157-V171 HydrophobicContact CG-CG1 4.07Å; L160-V171 HydrophobicContact CB-CG1 4.24Å; A161-V171 HydrophobicContact CB-CG2 4.06Å; M166-V171 HydrophobicContact CB-CG2 3.93Å; T167-V171 PolarHBondContact O-N 3.1Å; V171-T173 VanDerWaalsContact C-N 3.34Å; V171-T173 PolarHBondContact O-N 3.39Å; V171-W174 PolarHBondContact O-N 2.96Å; V171-F175 HydrophobicContact CG1-CD2 3.82Å; V171-F175 HydrophobicContact CG1-CE2 3.83Å; V171-F175 WeakPolarHBondContact O-CD2 3.35Å; V171-F175 PolarHBondContact O-N 3.24Å
172S97.4Very high95.8Very high45 Ų4571.4 Ų71.432%0.31535%0.351SS..Hα-helixtrans-54.6-48.3175.4-160.90000112.5K157 L168 T169 F175 A176K157-S172 WeakPolarHBondContact CE-OG 3.3Å; K157-S172 PolarHBondContact NZ-OG 3.19Å; L168-S172 VanDerWaalsContact O-CB 3.3Å; L168-S172 WeakPolarHBondContact O-CB 3.33Å; L168-S172 PolarHBondContact O-N 2.87Å; T169-S172 WeakPolarHBondContact O-CB 3.35Å; T169-S172 PolarHBondContact O-N 3.04Å; S172-F175 PolarHBondContact O-N 2.77Å; S172-A176 WeakPolarHBondContact O-CB 3.33Å; S172-A176 PolarHBondContact O-N 2.94Å
173T97.2Very high95.1Very high84 Ų8473.1 Ų73.152%0.51535%0.354SS..Hα-helixtrans-67.8-39.1-178.4-56.80000111.3T169 Q170 V171 A176 N177T169-T173 WeakPolarHBondContact O-CB 3.34Å; T169-T173 PolarHBondContact O-N 3.49Å; T169-T173 PolarHBondContact O-OG1 3.37Å; Q170-T173 PolarHBondContact O-N 3.28Å; V171-T173 VanDerWaalsContact C-N 3.34Å; V171-T173 PolarHBondContact O-N 3.39Å; T173-A176 PolarHBondContact O-N 3.5Å; T173-N177 WeakPolarHBondContact O-CB 3.34Å; T173-N177 PolarHBondContact O-N 3.27Å
174W96.9Very high94.3Very high56 Ų5677.9 Ų77.921%0.21237%0.371CS..Hα-helixtrans-61-50.5176.3-169.599.5000111.1L139 K140 L143 Q170 V171 A176 N177 A178L139-W174 HydrophobicContact CB-CD2 4.08Å; L139-W174 HydrophobicContact CB-CE3 3.84Å; L139-W174 HydrophobicContact CB-CH2 3.65Å; L139-W174 HydrophobicContact CB-CZ2 3.87Å; L139-W174 HydrophobicContact CB-CZ3 3.63Å; L139-W174 HydrophobicContact CD1-CB 4.33Å; L139-W174 HydrophobicContact CD1-CD2 3.64Å; L139-W174 HydrophobicContact CD1-CE3 4.06Å; L139-W174 HydrophobicContact CD1-CG 3.74Å; L139-W174 HydrophobicContact CG-CD2 4.48Å; L139-W174 HydrophobicContact CG-CE3 4.49Å; K140-W174 HydrophobicContact CG-CH2 4.05Å; K140-W174 HydrophobicContact CG-CZ2 4.08Å; L143-W174 HydrophobicContact CD2-CH2 4.1Å; L143-W174 HydrophobicContact CD2-CZ3 4.13Å; Q170-W174 WeakPolarHBondContact O-CB 3.45Å; Q170-W174 PolarHBondContact O-N 3.12Å; V171-W174 PolarHBondContact O-N 2.96Å; W174-A176 PolarHBondContact O-N 3.03Å; W174-N177 PolarHBondContact O-N 3.11Å; W174-N177 VanDerWaalsContact O-N 3.1Å; W174-A178 HydrophobicContact CE3-CB 4.02Å; W174-A178 HydrophobicContact CH2-CB 4.19Å; W174-A178 HydrophobicContact CZ3-CB 3.79Å; W174-A178 WeakPolarHBondContact O-CB 3.44Å; W174-A178 PolarHBondContact O-N 3.38Å
175F97.2Very high93.3Very high2 Ų282.2 Ų82.21%0.00939%0.391CS..Hα-helixtrans-63.6-38.7177.4-84.7-71.6000113L139 W142 L143 P152 L160 V171 S172 N177 A178 R179L139-F175 HydrophobicContact CD2-CE2 4Å; L139-F175 HydrophobicContact CD2-CZ 4.43Å; W142-F175 HydrophobicContact CD2-CE1 4.44Å; W142-F175 HydrophobicContact CD2-CZ 4.15Å; W142-F175 HydrophobicContact CE3-CD1 4.39Å; W142-F175 AromaticContact CE3-CE1 3.33Å; W142-F175 HydrophobicContact CE3-CE1 3.33Å; W142-F175 AromaticContact CE3-CZ 3.43Å; W142-F175 HydrophobicContact CE3-CZ 3.43Å; W142-F175 VanDerWaalsContact CE3-CZ 3.43Å; W142-F175 HydrophobicContact CZ3-CD1 4.23Å; W142-F175 AromaticContact CZ3-CE1 3.57Å; W142-F175 HydrophobicContact CZ3-CE1 3.57Å; W142-F175 AromaticContact CZ3-CZ 4Å; W142-F175 HydrophobicContact CZ3-CZ 4Å; L143-F175 HydrophobicContact CB-CE1 4.2Å; L143-F175 HydrophobicContact CD1-CD1 4.37Å; L143-F175 HydrophobicContact CD1-CE1 4.22Å; P152-F175 HydrophobicContact CG-CD2 3.9Å; P152-F175 HydrophobicContact CG-CE2 4.09Å; P152-F175 HydrophobicContact CG-CG 4.13Å; P152-F175 HydrophobicContact CG-CZ 4.49Å; L160-F175 HydrophobicContact CD1-CE2 3.7Å; L160-F175 HydrophobicContact CD1-CZ 3.86Å; V171-F175 HydrophobicContact CG1-CD2 3.82Å; V171-F175 HydrophobicContact CG1-CE2 3.83Å; V171-F175 WeakPolarHBondContact O-CD2 3.35Å; V171-F175 PolarHBondContact O-N 3.24Å; S172-F175 PolarHBondContact O-N 2.77Å; F175-N177 VanDerWaalsContact C-N 3.29Å; F175-N177 PolarHBondContact O-N 3.27Å; F175-A178 PolarHBondContact O-N 2.91Å; F175-R179 WeakPolarHBondContact O-CB 3.48Å; F175-R179 WeakPolarHBondContact O-CG 3.42Å; F175-R179 PolarHBondContact O-N 2.89Å
176A96.3Very high92Very high25 Ų2579.2 Ų79.221%0.20739%0.385CS..Hα-helixtrans-63.1-34.8173.700000112.3S172 T173 W174 R180S172-A176 WeakPolarHBondContact O-CB 3.33Å; S172-A176 PolarHBondContact O-N 2.94Å; T173-A176 PolarHBondContact O-N 3.5Å; W174-A176 PolarHBondContact O-N 3.03Å; A176-R180 VanDerWaalsContact C-NH1 3.27Å; A176-R180 VanDerWaalsContact O-CG 3.28Å; A176-R180 WeakPolarHBondContact O-CG 3.44Å; A176-R180 PolarHBondContact O-NH1 3.02Å
177N96.1Very high90.6Very high69 Ų6984 Ų8437%0.36941%0.405SS..Hα-helixtrans-73.1-46.4174.6-157.8-58.3000111.1T173 W174 F175 R179 R180 R181T173-N177 WeakPolarHBondContact O-CB 3.34Å; T173-N177 PolarHBondContact O-N 3.27Å; W174-N177 PolarHBondContact O-N 3.11Å; W174-N177 VanDerWaalsContact O-N 3.1Å; F175-N177 VanDerWaalsContact C-N 3.29Å; F175-N177 PolarHBondContact O-N 3.27Å; N177-R179 PolarHBondContact O-N 3.42Å; N177-R180 PolarHBondContact O-N 2.76Å; N177-R181 WeakPolarHBondContact O-CG 3.5Å; N177-R181 PolarHBondContact O-N 2.86Å; N177-R181 PolarHBondContact OD1-NE 3.19Å; N177-R181 PolarHBondContact OD1-NH2 3.47Å
178A94.9Very high89.1Confident13 Ų1381.5 Ų81.511%0.10739%0.388CS..Hα-helixtrans-59.2-47.1179.800000112.4L143 W174 F175 R180 R181 L182L143-A178 HydrophobicContact CD2-CB 3.84Å; W174-A178 HydrophobicContact CE3-CB 4.02Å; W174-A178 HydrophobicContact CH2-CB 4.19Å; W174-A178 HydrophobicContact CZ3-CB 3.79Å; W174-A178 WeakPolarHBondContact O-CB 3.44Å; W174-A178 PolarHBondContact O-N 3.38Å; F175-A178 PolarHBondContact O-N 2.91Å; A178-R180 VanDerWaalsContact C-N 3.33Å; A178-R180 PolarHBondContact O-N 2.89Å; A178-R181 PolarHBondContact O-N 3.32Å; A178-L182 WeakPolarHBondContact O-CB 3.49Å; A178-L182 PolarHBondContact O-N 3.02Å
179R95.1Very high87.2Confident57 Ų5783.1 Ų83.122%0.21540%0.401CS..Hα-helixtrans-59.2-39.5175.4-73.7-164.4-64.4-89.82.9113.1P150 Y151 F175 N177 L182 K183P150-R179 HydrophobicContact CB-CG 4.06Å; P150-R179 HydrophobicContact CG-CG 3.8Å; P150-R179 WeakPolarHBondContact O-CD 3.31Å; P150-R179 PolarHBondContact O-NH1 3.31Å; Y151-R179 VanDerWaalsContact CE2-CD 3.47Å; F175-R179 WeakPolarHBondContact O-CB 3.48Å; F175-R179 WeakPolarHBondContact O-CG 3.42Å; F175-R179 PolarHBondContact O-N 2.89Å; N177-R179 PolarHBondContact O-N 3.42Å; R179-L182 PolarHBondContact O-N 3.26Å; R179-K183 PolarHBondContact O-N 2.83Å
180R93.9Very high85.4Confident171 Ų17183 Ų8365%0.64539%0.389SS*.Hα-helixtrans-65-40.7176.7-71.6177.4-165.5113-13.4111.8A176 N177 A178 K184A176-R180 VanDerWaalsContact C-NH1 3.27Å; A176-R180 VanDerWaalsContact O-CG 3.28Å; A176-R180 WeakPolarHBondContact O-CG 3.44Å; A176-R180 PolarHBondContact O-NH1 3.02Å; N177-R180 PolarHBondContact O-N 2.76Å; A178-R180 VanDerWaalsContact C-N 3.33Å; A178-R180 PolarHBondContact O-N 2.89Å; R180-K184 PolarHBondContact O-N 2.92Å; R180-K184 VanDerWaalsContact O-N 3.09Å
181R92.1Very high83.2Confident163 Ų16383.1 Ų83.162%0.61540%0.399SS*.Hα-helixtrans-61.6-51.2174.3-66.4177.7-168-157.3-2110.6N177 A178 K183 K184 E185N177-R181 WeakPolarHBondContact O-CG 3.5Å; N177-R181 PolarHBondContact O-N 2.86Å; N177-R181 PolarHBondContact OD1-NE 3.19Å; N177-R181 PolarHBondContact OD1-NH2 3.47Å; A178-R181 PolarHBondContact O-N 3.32Å; R181-K183 VanDerWaalsContact C-N 3.28Å; R181-K183 PolarHBondContact O-N 3.02Å; R181-K184 WeakPolarHBondContact O-CA 3.5Å; R181-K184 PolarHBondContact O-N 3.45Å; R181-E185 VanDerWaalsContact O-CG 3.3Å; R181-E185 WeakPolarHBondContact O-CG 3.44Å; R181-E185 PolarHBondContact O-N 3.37Å
182L87.3Confident81Confident13 Ų1389.3 Ų89.37%0.06844%0.439CS..Hα-helixtrans-58.2-37.7-178.7-149.676.8000112.6A178 R179 E185 K187 M188A178-L182 WeakPolarHBondContact O-CB 3.49Å; A178-L182 PolarHBondContact O-N 3.02Å; R179-L182 PolarHBondContact O-N 3.26Å; L182-E185 WeakPolarHBondContact CA-OE1 3.28Å; L182-K187 HydrophobicContact CD1-CB 3.84Å; L182-K187 HydrophobicContact CG-CB 4.23Å; L182-K187 PolarHBondContact O-N 2.95Å; L182-M188 HydrophobicContact CB-CB 4.26Å; L182-M188 HydrophobicContact CD2-CB 3.79Å; L182-M188 HydrophobicContact CD2-CG 4.01Å; L182-M188 HydrophobicContact CD2-SD 3.8Å; L182-M188 HydrophobicContact CG-CB 3.82Å; L182-M188 PolarHBondContact O-N 3.38Å
183K82.8Confident79Confident160 Ų16099 Ų9970%0.69647%0.469SS*.Hα-helixtrans-67.9-40.3172.2-175175-179176.80112.7R179 R181R179-K183 PolarHBondContact O-N 2.83Å; R181-K183 VanDerWaalsContact C-N 3.28Å; R181-K183 PolarHBondContact O-N 3.02Å
184K81.4Confident76.5Confident195 Ų195102 Ų10285%0.84848%0.482SS*.Hα-helixtrans-69.8-35-179.4-176.9174.6178.3178.50112.6R180 R181R180-K184 PolarHBondContact O-N 2.92Å; R180-K184 VanDerWaalsContact O-N 3.09Å; R181-K184 WeakPolarHBondContact O-CA 3.5Å; R181-K184 PolarHBondContact O-N 3.45Å
185E74.9Confident73.8Confident94 Ų94109.1 Ų109.144%0.43951%0.514SS..THydrogen-bonded Turntrans-92.913.7-174.270.1-171.1144.500114.4R181 L182 K187R181-E185 VanDerWaalsContact O-CG 3.3Å; R181-E185 WeakPolarHBondContact O-CG 3.44Å; R181-E185 PolarHBondContact O-N 3.37Å; L182-E185 WeakPolarHBondContact CA-OE1 3.28Å; E185-K187 HydrophobicContact CG-CB 3.84Å; E185-K187 HydrophobicContact CG-CD 3.83Å; E185-K187 HydrophobicContact CG-CG 3.75Å; E185-K187 PolarHBondContact O-N 3.19Å; E185-K187 WeakPolarHBondContact OE2-CD 2.96Å; E185-K187 WeakPolarHBondContact OE2-CE 3.3Å
186N68Low70.9Confident132 Ų132112 Ų11271%0.70654%0.544SS*.SBendtrans55.33.4-175.6-149.5-85000115.7M188N186-M188 PolarHBondContact O-N 2.83Å
187K65.8Low68.5Low126 Ų126116.5 Ų116.555%0.54857%0.574SS.*  trans-70.110.3173.1-64.5179.2-153.2-56.90113.7L182 E185L182-K187 HydrophobicContact CD1-CB 3.84Å; L182-K187 HydrophobicContact CG-CB 4.23Å; L182-K187 PolarHBondContact O-N 2.95Å; E185-K187 HydrophobicContact CG-CB 3.84Å; E185-K187 HydrophobicContact CG-CD 3.83Å; E185-K187 HydrophobicContact CG-CG 3.75Å; E185-K187 PolarHBondContact O-N 3.19Å; E185-K187 WeakPolarHBondContact OE2-CD 2.96Å; E185-K187 WeakPolarHBondContact OE2-CE 3.3Å
188M65.9Low66.1Low26 Ų26121.8 Ų121.813%0.12860%0.596CS.*  trans-136.387.1173-162.358.4-154.500111R147 L182 N186 W190R147-M188 WeakPolarHBondContact O-CE 3.26Å; L182-M188 HydrophobicContact CB-CB 4.26Å; L182-M188 HydrophobicContact CD2-CB 3.79Å; L182-M188 HydrophobicContact CD2-CG 4.01Å; L182-M188 HydrophobicContact CD2-SD 3.8Å; L182-M188 HydrophobicContact CG-CB 3.82Å; L182-M188 PolarHBondContact O-N 3.38Å; N186-M188 PolarHBondContact O-N 2.83Å; M188-W190 HydrophobicContact CE-CD2 3.59Å; M188-W190 HydrophobicContact CE-CE3 3.8Å; M188-W190 HydrophobicContact CE-CG 4.17Å; M188-W190 HydrophobicContact CE-CH2 4.12Å; M188-W190 HydrophobicContact CE-CZ2 3.87Å; M188-W190 HydrophobicContact CE-CZ3 4.06Å; M188-W190 HydrophobicContact CG-CD2 4.1Å; M188-W190 HydrophobicContact CG-CG 3.93Å; M188-W190 HydrophobicContact CG-CZ2 4.46Å; M188-W190 PolarHBondContact O-N 3.06Å
189T58Low64.1Low115 Ų115129.6 Ų129.671%0.70663%0.631SS**  trans-70.875164.1-40.80000109P191T189-P191 WeakPolarHBondContact O-CD 3.45Å
190W57.8Low61.6Low99 Ų99133.7 Ų133.738%0.37565%0.65SS.*  trans-63.5120.1155.5-69.1112000107.1K148 P150 Y151 M188 P192K148-W190 WeakPolarHBondContact O-CH2 3.48Å; K148-W190 WeakPolarHBondContact O-CZ3 3.46Å; P150-W190 VanDerWaalsContact CD-CZ2 3.48Å; P150-W190 HydrophobicContact CG-CH2 4.45Å; P150-W190 HydrophobicContact CG-CZ2 3.92Å; Y151-W190 HydrophobicContact CE2-CH2 4.17Å; Y151-W190 HydrophobicContact CE2-CZ2 4.03Å; M188-W190 HydrophobicContact CE-CD2 3.59Å; M188-W190 HydrophobicContact CE-CE3 3.8Å; M188-W190 HydrophobicContact CE-CG 4.17Å; M188-W190 HydrophobicContact CE-CH2 4.12Å; M188-W190 HydrophobicContact CE-CZ2 3.87Å; M188-W190 HydrophobicContact CE-CZ3 4.06Å; M188-W190 HydrophobicContact CG-CD2 4.1Å; M188-W190 HydrophobicContact CG-CG 3.93Å; M188-W190 HydrophobicContact CG-CZ2 4.46Å; M188-W190 PolarHBondContact O-N 3.06Å; W190-P192 WeakPolarHBondContact O-CD 3.31Å
191P51.9Low59.1Low101 Ų101136.4 Ų136.466%0.65666%0.661SS**  trans-56.9129.3171.5-21.333000108.4T189 R193T189-P191 WeakPolarHBondContact O-CD 3.45Å; P191-R193 PolarHBondContact O-N 3.1Å
192P49.9Very low56.5Low130 Ų130137.5 Ų137.584%0.84467%0.666SS**  trans-61103166.4-17.330.8000107W190 N194W190-P192 WeakPolarHBondContact O-CD 3.31Å; P192-N194 PolarHBondContact O-N 3.43Å
193R56.7Low54.5Low248 Ų248143.7 Ų143.794%0.93670%0.699SS**  trans-72.598.1-175.8-175.3166.5158.6155.1-6.9109P191P191-R193 PolarHBondContact O-N 3.1Å
194N42.9Very low52.7Low148 Ų148145.5 Ų145.579%0.79171%0.71SS**  trans100101.6153.8-142.345.9000119.1P192P192-N194 PolarHBondContact O-N 3.43Å
195K40.3Very low50.8Low205 Ų205143.6 Ų143.689%0.89171%0.709SS**SBendtrans-163112.4137.2-165.281176.2-174.10110.1
196G36.7Very low49.4Very low61 Ų61148.5 Ų148.563%0.62973%0.732SS**  trans77.6118.2177.500000113.4
197S46.4Very low48.1Very low121 Ų121151.5 Ų151.585%0.84674%0.742SS**  cis63.557.212.988.70000116.2
198E45.7Very low46.6Very low179 Ų179148.9 Ų148.984%0.83675%0.75SS**  trans-14767.1149.9-164.6158.1-145.400111.1
199E52.5Low45.2Very low178 Ų178153.4 Ų153.483%0.83278%0.784SS**  trans-90.388.8152.7-176.4160.9-142.700107.4
200K43.3Very low44.3Very low142 Ų142156.8 Ų156.862%0.61779%0.792SS**  trans-13279.2161.6-85.4-162.8169.6-167.70108.8Y202K200-Y202 HydrophobicContact CB-CE2 4.22Å; K200-Y202 HydrophobicContact CD-CE2 4.14Å; K200-Y202 PolarHBondContact O-N 3.11Å
201R40Very low43.3Very low229 Ų229161.3 Ų161.386%0.86482%0.818SS**  trans-66.3116.4151.9-64.6-175-172.6-160.52.5106.4
202Y39.3Very low42.7Very low185 Ų185160.2 Ų160.273%0.72583%0.825SS**  trans-89.1107.1158.5-72.2-89.2000106K200K200-Y202 HydrophobicContact CB-CE2 4.22Å; K200-Y202 HydrophobicContact CD-CE2 4.14Å; K200-Y202 PolarHBondContact O-N 3.11Å
203D45.1Very low42.3Very low143 Ų143163 Ų16377%0.76583%0.826SS**  trans-169.497.6160.2-127.4-47.5000108.3
204E43.9Very low41.7Very low198 Ų198159.6 Ų159.693%0.92583%0.825SS**  trans-173.297148.8-111.3169.8-166.100108.3
205D40.9Very low41.6Very low156 Ų156160 Ų16083%0.83482%0.819SS**  trans-76.6125.1160.9-63.7-59.4000108.9
206E46.8Very low41.3Very low197 Ų197155.5 Ų155.592%0.92181%0.814SS**  trans-156.7128.4139.8-152.8161.7-162.300111.2
207E39.3Very low41.4Very low195 Ų195158.5 Ų158.591%0.91181%0.812SS**  trans-85.9143177.9-70.8-16716200112.4
208G35.6Very low40.7Very low70 Ų70158.7 Ų158.772%0.72280%0.803SS**  trans84.3112.9142.400000118.1
209S35.6Very low40.2Very low121 Ų121156.4 Ų156.485%0.84680%0.802SS**  -166.3108.4128.6-86.10000113.2
210Q39Very low39.6Very low187 Ų187155.3 Ų155.387%0.87480%0.802SS**  trans60.8102.5134.3-154.4162.615.600120.1
211E37.6Very low39.3Very low193 Ų193156.2 Ų156.290%0.90281%0.813SS**  trans-57.1142.6155.561-150137.600113.4
212G38.8Very low39.5Very low78 Ų78150.8 Ų150.880%0.80480%0.801SS**  trans-157.163.3-169.500000114.5
213Q41.8Very low39.7Very low189 Ų189148.9 Ų148.988%0.88381%0.809SS**  trans-47.7127.4169.4169.3-165.121.700114.4
214I44.1Very low39.6Very low176 Ų176152.6 Ų152.690%0.90381%0.813SS**  -150.9153.1129.9-24.4168.4000111.8
215K40.9Very low39.1Very low156 Ų156148.7 Ų148.768%0.67881%0.807SS**  trans-117.9142.6-169.5163.8-155.5175.9-153.40110.9E217K215-E217 WeakPolarHBondContact CE-OE2 3.31Å; K215-E217 IonicContact NZ-OE2 3.82Å; K215-E217 PolarHBondContact NZ-OE2 2.88Å
216S33Very low38.9Very low111 Ų111153 Ų15378%0.77681%0.811SS**  trans173.9129.1137.849.30000110.5
217E38.9Very low38.6Very low124 Ų124147 Ų14758%0.57980%0.796SS**  cis96.7126.148.9-110.5-172.987.500114.3K215K215-E217 WeakPolarHBondContact CE-OE2 3.31Å; K215-E217 IonicContact NZ-OE2 3.82Å; K215-E217 PolarHBondContact NZ-OE2 2.88Å
218N32.1Very low38.5Very low126 Ų126144.9 Ų144.967%0.67479%0.791SS**  trans69.3141.5158.7-47.4-35.4000116.9
219T35.6Very low39.2Very low130 Ų130151.7 Ų151.780%0.79880%0.801SS**  cis-162.5144.835.2-40.90000110.6
220D40.1Very low39.6Very low156 Ų156154.5 Ų154.583%0.83480%0.8SS**  trans-73.1152.8165.6-47.6-94.9000112.1
221D37Very low40.1Very low160 Ų160153.3 Ų153.386%0.85680%0.799SS**  trans-163150.8130.1-160.145.2000112.8
222D44.5Very low40.5Very low115 Ų115152.3 Ų152.362%0.61579%0.794SS**  trans-67.7159.3178.2-105-95000113.8
223T43.4Very low40.7Very low146 Ų146157.1 Ų157.190%0.89680%0.801SS**  trans-157.8112.6134.30.60000112.6
224R42.3Very low40.7Very low221 Ų221153.1 Ų153.183%0.83479%0.794SS**  trans-70.9140.1173.1-64.4176.9167.3-157.4-5.5111.6
225S33.8Very low41Very low116 Ų116151.4 Ų151.481%0.81179%0.786SS**  166.7132.2115.951.90000112.8
226R37.2Very low41.5Very low245 Ų245151.3 Ų151.393%0.92579%0.793SS**  167130.8101.4-172.9167.9-175.3165.62.2109.5
227A39.4Very low42.2Very low71 Ų71154.3 Ų154.359%0.58780%0.8SS**  trans-85.4175.8-175.800000113.2
228D37.8Very low42.7Very low151 Ų151155.6 Ų155.681%0.80781%0.81SS**  trans75.599.8154.9-46.9-39000118.5
229K51.5Low43.1Very low214 Ų214159.2 Ų159.293%0.9382%0.821SS**  trans-152.680.6135.7-107.6164.7-167.91780110.4L231K229-L231 PolarHBondContact O-N 2.84Å
230E43.9Very low43.9Very low179 Ų179160.4 Ų160.484%0.83682%0.822SS**  trans-54115.5155.5174.2-174.7-149.600109.3
231L49.1Very low44.4Very low162 Ų162158.4 Ų158.485%0.84882%0.816SS**  trans-150.2121.5147.3-86-167.5000109.9K229 L233K229-L231 PolarHBondContact O-N 2.84Å; L231-L233 PolarHBondContact O-N 2.97Å
232Q45Very low44.8Very low173 Ų173158 Ų15881%0.80881%0.813SS**  trans-43.9122.3172.5-58.6160.6-40.800113
233L43.8Very low44.4Very low178 Ų178159.7 Ų159.793%0.93282%0.817SS**  -136.5125128.1-78.7-174.7000108L231L231-L233 PolarHBondContact O-N 2.97Å
234S41.5Very low44.4Very low106 Ų106159.3 Ų159.374%0.74182%0.82SS**  trans-87.8148.3-17050.90000112.4
235D51.3Low43.8Very low139 Ų139155.7 Ų155.774%0.74381%0.813SS**  trans64.5110131.2-167.225.9000118.4
236L50.2Low43.9Very low155 Ų155156.1 Ų156.181%0.81282%0.816SS**  167.778.5124.1-87-178000109.9
237D47.1Very low43.6Very low173 Ų173149 Ų14993%0.92580%0.804SS**SBendtrans-153.630.3173.6-111.4-33.7000113.5
238D51.1Low43.4Very low151 Ų151153.8 Ų153.881%0.80781%0.814SS**  trans-145.989169.6-167.322.5000112
239F40.2Very low43.1Very low203 Ų203152.6 Ų152.689%0.8982%0.816SS**  trans-161.669.5157-129.6-74.2000111.9
240D51.6Low42.2Very low154 Ų154149.5 Ų149.582%0.82481%0.805SS**  trans-146.573.4163.7-158-6.9000111.7
241T51.9Low41.6Very low114 Ų114146.9 Ų146.970%0.69979%0.794SS**  trans-173146.4151.4-77.30000108.8
242L43.8Very low40.8Very low152 Ų152147.4 Ų147.480%0.79679%0.789SS**  trans74.1124-165.7-42.8-178.5000111.2
243E37.5Very low40.5Very low151 Ų151148.6 Ų148.671%0.70680%0.795SS**  cis-146.9123.428.7-170.1168.2-99.600111.5E245E243-E245 HydrophobicContact CG-CB 4.41Å; E243-E245 HydrophobicContact CG-CG 3.98Å
244S43.2Very low39.8Very low137 Ų137149.6 Ų149.696%0.95879%0.786SS**  trans-114.684.5155.7-83.90000107.6
245E30Very low39.4Very low146 Ų146153.8 Ų153.868%0.68279%0.787SS**  trans-100.1113.6157.168.3174.366.300110.2E243E243-E245 HydrophobicContact CG-CB 4.41Å; E243-E245 HydrophobicContact CG-CG 3.98Å
246S34.5Very low38.6Very low125 Ų125153.2 Ų153.287%0.87478%0.779SS**  trans-142.569.9159.3-1650000107.3
247S32.2Very low37.9Very low96 Ų96154.1 Ų154.167%0.67178%0.782SS**  trans-79.1152.2158.857.40000109.3
248E35.3Very low37.2Very low170 Ų170150.5 Ų150.579%0.79476%0.762SS**  cis-172.1137.6-18.9177.5174.5150.600104.7
249C30.4Very low36.5Very low126 Ų126149.9 Ų149.985%0.85176%0.764SS**  trans-147.7115.7156.955.10000111.7
250E33.7Very low36.2Very low150 Ų150146.7 Ų146.770%0.70175%0.752SS**  trans-40151.7162.4-80-174.1110.100112.3
251M31.3Very low35.3Very low124 Ų124146 Ų14661%0.61175%0.745SS**  -172.3138.166.4-166.748.114200115.5
252K31.9Very low34.5Very low173 Ų173146.5 Ų146.575%0.75275%0.753SS**  trans64108.2155.6-84.4165-179.9153.30121.6
253H38.3Very low34Very low198 Ų198144.9 Ų144.992%0.91775%0.75SS**  trans-63.9132.7147.8-102.7-113.2000113.4
254R29.8Very low33.7Very low198 Ų198144 Ų14475%0.74776%0.755SS**  trans-161.4123.7151.1-151.7-172.5-85.5-164.6-5.9104.5
255Y33.2Very low33.2Very low195 Ų195141.8 Ų141.877%0.76574%0.74SS**  cis-143.9148.846.1-75.9-95.6000114.4
256H34.1Very low33.2Very low126 Ų126142.5 Ų142.558%0.58375%0.748SS**  trans-56.7143.9155.2169.151.7000112.3N258H256-N258 PolarHBondContact CE1-OD1 3.41Å
257M34.1Very low33Very low175 Ų175142.1 Ų142.186%0.86274%0.744SS**  trans-141148149.3-95.4-58105.200111
258N33Very low32.7Very low96 Ų96143.6 Ų143.651%0.51375%0.754SS.*  trans-107.2142.9-149-137.3-4.4000113.7H256 H260H256-N258 PolarHBondContact CE1-OD1 3.41Å; N258-H260 PolarHBondContact O-N 3.41Å; N258-H260 VanDerWaalsContact O-N 3.17Å; N258-H260 PolarHBondContact O-ND1 2.96Å
259T36.5Very low32.5Very low138 Ų138139.5 Ų139.585%0.84775%0.75SS**  trans-63.1109165.127.70000111.8
260H34.2Very low32.7Very low136 Ų136142.6 Ų142.663%0.6375%0.752SS**  trans-159.9136.6151.355.2-33.3000104.6N258N258-H260 PolarHBondContact O-N 3.41Å; N258-H260 VanDerWaalsContact O-N 3.17Å; N258-H260 PolarHBondContact O-ND1 2.96Å
261M32.6Very low32.6Very low139 Ų139144 Ų14469%0.68576%0.758SS**  -137.5148.951.9-42.5-61.4157.200112.3T263M261-T263 HydrophobicContact CB-CG2 4.42Å
262S35.5Very low32.8Very low125 Ų125145 Ų14587%0.87477%0.765SS**  trans-95.3130.5147.5-66.10000107.9
263T33Very low32.8Very low118 Ų118143.3 Ų143.372%0.72476%0.763SS**  trans-136101.3165.251.50000109.5M261M261-T263 HydrophobicContact CB-CG2 4.42Å
264T31.6Very low32.5Very low132 Ų132143 Ų14381%0.8176%0.759SS**  trans45118.2133.856.80000118.9
265S33.1Very low32.5Very low91 Ų91141.8 Ų141.864%0.63677%0.767SS**  trans-27.4134142.2169.10000112.9
266D29.6Very low32.4Very low162 Ų162137.1 Ų137.187%0.86677%0.769SS**  -146.1143.1116-100.2-27.6000112.3
267C29.3Very low32.1Very low116 Ų116136.3 Ų136.378%0.78478%0.777SS**  trans-88.1147.3-175.5-64.80000110.7
268S27.3Very low32.1Very low127 Ų127135.9 Ų135.989%0.88878%0.778SS**  trans-139100.7148.5-153.10000108.3
269A31.2Very low32.2Very low85 Ų85140.6 Ų140.670%0.70279%0.794SS**  trans-77.8144.7166.700000108.5
270E33.2Very low32Very low190 Ų190142.5 Ų142.589%0.88880%0.797SS**  trans154.696.8153.5-83-95.7121.600108.6
271H32.8Very low31.7Very low181 Ų181141.5 Ų141.584%0.83881%0.805SS**  -176.5115.9115.4-161.2-79.7000109.7
272L33.9Very low31.9Very low143 Ų143140.6 Ų140.675%0.74981%0.807SS**  trans-82.1150.7-176.4-170.263.1000112.6
273I33.6Very low32.4Very low138 Ų138140.6 Ų140.671%0.70880%0.804SS**  trans-50.7139.5171.9-56.8153.9000112.6
274K31.7Very low32.4Very low191 Ų191140.9 Ų140.983%0.8381%0.805SS**  178.3123.2125.8-97.4158.2-172.8177.50113.7
275N28.3Very low33.1Very low173 Ų173139.6 Ų139.693%0.92580%0.799SS**  trans-145.986.3159.3-96.3-21.6000108.8
276A31.9Very low33Very low97 Ų97143.5 Ų143.580%0.80281%0.812SS**  trans-163.2110.9164.400000111.7
277S28.6Very low33Very low109 Ų109139.4 Ų139.476%0.76281%0.808SS**  trans34.4114.4142.2-140.40000120.1
278L33.4Very low33Very low166 Ų166137.5 Ų137.587%0.86981%0.808SS**  -179.8157.790.5-91.4172.9000111.8
279K35.6Very low33.1Very low196 Ų196140.2 Ų140.285%0.85281%0.807SS**  trans-88.7142.2-179.3-54.2167.5-178.3175.70110.3
280I32.3Very low33.3Very low178 Ų178145.1 Ų145.191%0.91382%0.815SS**  trans-169.1158.3146.9-101.8148.9000110
281S28.2Very low33.2Very low114 Ų114142.6 Ų142.680%0.79781%0.808SS**  trans-89164.6-152-51.70000117.4
282V35Very low33.4Very low121 Ų121141 Ų14173%0.73381%0.805SS**  trans-64.6159.9172.6-141.90000112.3V284V282-V284 HydrophobicContact CG1-CG2 4.09Å
283P46.2Very low33.2Very low125 Ų125137.1 Ų137.181%0.81280%0.799SS**  -137.8163.289.722.9-1.5000116.4
284V34.3Very low33.3Very low123 Ų123139.7 Ų139.775%0.74581%0.805SS**  trans-89.2151-179.7169.40000110.9V282V282-V284 HydrophobicContact CG1-CG2 4.09Å
285P45.9Very low33.3Very low105 Ų105137.1 Ų137.168%0.68281%0.806SS**  -146.7144.3119.825.1-4.2000116.5
286L31.4Very low33.2Very low174 Ų174135.1 Ų135.191%0.91180%0.804SS**  trans49.8145.9150.3-72.580.4000120.2
287G28.6Very low33.1Very low76 Ų76137.7 Ų137.778%0.78480%0.802SS**  cis160.4159.3-0.300000111.1
288G29.6Very low33.1Very low76 Ų76141.2 Ų141.278%0.78480%0.804SS**  trans88.8121.1177.700000114.1
289E28.8Very low32.8Very low184 Ų184139.4 Ų139.486%0.8680%0.8SS**  cis110.5142.227.7-79.8-135.8118.400112.9
290Q36.2Very low32.3Very low187 Ų187135.5 Ų135.587%0.87480%0.797SS**  trans78.5154.1171.7-55.2175.788.600119.4
291D31.4Very low33Very low138 Ų138131.5 Ų131.574%0.73878%0.783SS**  cis-166.6172.5-48.5-155.2-9.6000108.5
292L35.7Very low33.2Very low148 Ų148134.1 Ų134.178%0.77578%0.783SS**  trans59.8105151.6-72.3154.4000120.2
293G30Very low33Very low61 Ų61134.6 Ų134.663%0.62978%0.781SS**  97.5103.583.500000120.7
294K35.4Very low32.2Very low192 Ų192138.2 Ų138.284%0.83578%0.784SS**  65.4109.2127-63.6171.4-175.8172.40121
295T31.6Very low32.1Very low137 Ų137140.5 Ų140.584%0.8479%0.787SS**  45.3127.2126.8630000121.6
296C27Very low32.4Very low130 Ų130140.1 Ų140.188%0.87879%0.785SS**  -154.1166128-151.90000112.4
297I30.7Very low32.5Very low151 Ų151138.3 Ų138.377%0.77478%0.776SS**  trans-120.9153.5-175.9-55.6175.7000108.7
298K27.6Very low32.8Very low183 Ų183139.4 Ų139.480%0.79677%0.771SS**  trans112.5152.1137.2-129.7178.9177.4177.10120.1
299T27Very low32.9Very low129 Ų129142.7 Ų142.779%0.79177%0.768SS**  trans81.4113.2154.341.70000122.6
300S26.1Very low33.4Very low113 Ų113141.1 Ų141.179%0.7976%0.761SS**  trans-50.3-178.7145.4-121.20000113.9
301P47.3Very low33.5Very low94 Ų94139.2 Ų139.261%0.6175%0.752SS**  cis-148.2-167.725.944.1-22.4000118.6
302E31.6Very low33.8Very low170 Ų170139.2 Ų139.279%0.79475%0.747SS**  trans70.1149.3149.1-80.3163.4-169.800120.1
303D31.7Very low33.9Very low130 Ų130138.8 Ų138.870%0.69574%0.741SS**  cis-164.4170.4-20.7-150.8-38.9000108.9
304F27.9Very low34.4Very low202 Ų202143.4 Ų143.489%0.88675%0.747SS**  trans158.3130.8142.4-96.4-74.6000114.6
305Q32.4Very low34.6Very low170 Ų170142.2 Ų142.279%0.79474%0.744SS**  trans-114.5-166174.8-124.2-163.6-58.900109.7
306P53.1Low34.7Very low98 Ų98144.7 Ų144.764%0.63675%0.746SS**  cis-143.3-173.715.941.9-19.7000118.9
307D33Very low34.9Very low135 Ų135142.8 Ų142.872%0.72274%0.74SS**  trans71.9144149.4-85.2-36.6000122.9
308S34.1Very low35.2Very low99 Ų99145.4 Ų145.469%0.69275%0.745SS**  cis-165.7-179-12.2-137.30000113.2
309M33.2Very low35.2Very low145 Ų145142.2 Ų142.271%0.71475%0.746SS**  trans104.489.5161.7-63.6-68.1-73.100122.9
310Q39.4Very low35.3Very low151 Ų151141.2 Ų141.271%0.70674%0.743SS**  74.9100.2107.9-155.2155.780.300123.9
311Q37.8Very low35.5Very low147 Ų147145.9 Ų145.969%0.68775%0.745SS**  95.7136.9122.5-123.4166.92.100126.5
312Q37.7Very low34.9Very low139 Ų139147.4 Ų147.465%0.6575%0.753SS**  trans85.1104.1141.4-122.8142.511.100119.1
313Q38.2Very low35.1Very low138 Ų138147 Ų14765%0.64575%0.751SS**  91140.870.1-178.6169.135.700111.7
314Q38.8Very low35.2Very low159 Ų159148.6 Ų148.674%0.74375%0.754SS**  cis-148.1173.9-0.3-143.7153.7-1.300112.3
315Q39.6Very low35.5Very low166 Ų166146.4 Ų146.478%0.77675%0.747SS**  trans-77.9155.3167.6-52.7153.919.600111.9
316Q33.8Very low35.5Very low190 Ų190146.1 Ų146.189%0.88875%0.745SS**  172.5175.8117.8-92.4-176.426.700112.6
317A32Very low34.4Very low90 Ų90145 Ų14574%0.74475%0.752SS**  trans-136.7166.3-157.700000115
318K37.3Very low34.6Very low206 Ų206147 Ų14790%0.89676%0.756SS**  trans123150.5148.5-66.7176.1-178.5178.90117.5
319S27.5Very low34.6Very low115 Ų115150.7 Ų150.780%0.80476%0.763SS**  trans75.9122.5175.3-75.10000117.9
320C28.7Very low34.8Very low109 Ų109151.9 Ų151.974%0.73677%0.771SS**  80.3122.654.9-177.20000110.6
321Y31.6Very low34.8Very low210 Ų210151.8 Ų151.882%0.82477%0.774SS**  cis-165.3142.79.8-141.8-118.5000109.6
322T34.2Very low34.7Very low127 Ų127151.7 Ų151.778%0.77978%0.779SS**  trans-178119.7138.6130000115.2
323Q34.2Very low34.8Very low161 Ų161147.5 Ų147.575%0.75277%0.773SS**  46.6103.6124.8-168.7165.819.900121.6
324Q34.9Very low34.8Very low163 Ų163149.3 Ų149.376%0.76278%0.778SS**  166.5115.791.1-165.2151.6-6.900115.1
325Q34.3Very low35.1Very low157 Ų157147.5 Ų147.573%0.73478%0.781SS**  trans22.3124.9154.9-67.1-17910.500124.7
326Q31.2Very low35.9Very low164 Ų164150.9 Ų150.977%0.76679%0.786SS**  trans69.6100.8130-63.2-178.615.600120.9
327G31.2Very low37Very low74 Ų74149 Ų14976%0.76378%0.78SS**  trans-138.2118.2149.200000109.5
328H37.3Very low38Very low177 Ų177156.4 Ų156.482%0.81979%0.789SS**  trans-77.9125.7-178.7-80.9-98.1000111.2L330H328-L330 PolarHBondContact O-N 3.12Å
329Q34.5Very low38.8Very low177 Ų177151.3 Ų151.383%0.82778%0.78SS**  trans-71.2119.4174.8-65.7-117.688.700110.5
330L36Very low40.2Very low170 Ų170154.6 Ų154.689%0.8979%0.787SS**  trans-107.898.1169.4-171.4135.6000109H328H328-L330 PolarHBondContact O-N 3.12Å
331L40.2Very low41.7Very low149 Ų149153.2 Ų153.278%0.7878%0.784SS**  trans-105.7118.8173.4-87.2170.9000111.1
332D36.3Very low42.8Very low145 Ų145152.1 Ų152.178%0.77579%0.786SS**  trans66153.6151-160.219.4000119.4
333G39.2Very low43.6Very low51 Ų51153 Ų15353%0.52679%0.792SS.*  trans139.915151.200000122.7
334K37.9Very low44.1Very low175 Ų175149.8 Ų149.876%0.76179%0.793SS**  trans70.5136.2173.9-60.678.5170.7170.30117.3R336K334-R336 PolarHBondContact O-N 3.34Å
335P44.3Very low44.9Very low122 Ų122149 Ų14979%0.79280%0.799SS**  trans-78.1115.4171.631.4-32.5000111.7I337P335-I337 PolarHBondContact O-N 2.83Å
336R56.9Low45Very low236 Ų236147 Ų14789%0.89180%0.803SS**  trans-76.7109.1163.7-69.4-169.8-167.8178.16109.3K334 W338K334-R336 PolarHBondContact O-N 3.34Å; R336-W338 PolarHBondContact O-N 2.86Å
337I58.2Low45.7Very low150 Ų150147.4 Ų147.477%0.76981%0.809SS**SBendtrans-62.6128.4173-45.7177000107.5P335P335-I337 PolarHBondContact O-N 2.83Å
338W51.2Low46.1Very low246 Ų246150.6 Ų150.693%0.93281%0.809SS**  trans90.561.8-172.8-52.1-1.1000116.7R336R336-W338 PolarHBondContact O-N 2.86Å
339S55.1Low46.5Very low99 Ų99150.8 Ų150.869%0.69281%0.81SS**  trans-124.985.3151.7-159.90000110.4A341S339-A341 VanDerWaalsContact C-N 3.29Å; S339-A341 PolarHBondContact O-N 2.93Å
340L56.7Low46.9Very low184 Ų184148.8 Ų148.896%0.96381%0.81SS**  trans-8764.1175.1-175.771.2000109.9
341A60.8Low47.1Very low80 Ų80149.5 Ų149.566%0.66181%0.809SS**  trans-172.767.3171.400000113.6S339S339-A341 VanDerWaalsContact C-N 3.29Å; S339-A341 PolarHBondContact O-N 2.93Å
342Q54Low46.9Very low187 Ų187153 Ų15387%0.87481%0.813SS**SBendtrans-142.739.6163.9-77.5-154.5-13.700114.3
343T52.3Low47.3Very low147 Ų147151.4 Ų151.490%0.90281%0.811SS**SBendtrans-145.556.916856.20000111.3
344A43.8Very low47.8Very low93 Ų93155 Ų15577%0.76983%0.828SS**SBendtrans-144.714-176.200000116.1
345T50.6Low48.2Very low145 Ų145152.4 Ų152.489%0.8983%0.83SS**  trans-14876.6171.953.10000112
346S36.7Very low48.1Very low116 Ų116154.7 Ų154.781%0.81183%0.833SS**  trans-157.480.7156-169.50000109.8
347L47.4Very low47.6Very low172 Ų172152 Ų15290%0.90184%0.835SS**  trans-8994.2161.4178.567.1000107.3
348N38.8Very low46.6Very low141 Ų141155.3 Ų155.375%0.75484%0.837SS**  trans-146.8148.6154.4-105.2-60.2000109.8
349Q45.5Very low45.7Very low181 Ų181150.3 Ų150.385%0.84684%0.838SS**  trans-74.9129.5-159.2-58.8162.331.400111.8
350T43.6Very low44.9Very low135 Ų135153.5 Ų153.583%0.82884%0.842SS**  trans-170.5130.5143.39.50000111.7
351E39.3Very low44.2Very low185 Ų185149.3 Ų149.386%0.86483%0.834SS**  trans53.297.6146.7-154157.5-16100120.3
352Y36.8Very low43.7Very low223 Ų223151.2 Ų151.288%0.87584%0.84SS**  trans-81.3134.2161.1-109.7-94000110.7S354Y352-S354 PolarHBondContact O-N 3.38Å
353P44.1Very low43.5Very low111 Ų111148.1 Ų148.172%0.72184%0.836SS**  trans-71.1126.7173.828.2-32.9000111.4C355P353-C355 PolarHBondContact O-N 2.88Å
354S50.6Low42.7Very low128 Ų128147.2 Ų147.290%0.89584%0.836SS**  trans-75.9111.7-175.9-70.10000112.8Y352Y352-S354 PolarHBondContact O-N 3.38Å
355C44.8Very low42.2Very low119 Ų119148.4 Ų148.480%0.80484%0.839SS**  trans-147.5-4.1166.960.70000116.5P353P353-C355 PolarHBondContact O-N 2.88Å
356M42.8Very low41.6Very low171 Ų171149.2 Ų149.284%0.84284%0.837SS**SBendtrans-120.49.4-170-81.1-81.6-72.900115.4
357L45.8Very low41.4Very low179 Ų179149.1 Ų149.194%0.93783%0.831SS**  trans-132.575.4-177.2-76.5171.1000112.9
358R38.4Very low40.8Very low219 Ų219149.8 Ų149.883%0.82683%0.83SS**  trans-157.497154.3-157.5173.3-170.1165.22.2113.4
359C32.1Very low40.6Very low141 Ų141148.2 Ų148.295%0.95383%0.83SS**  trans-150.6131.1134.2-106.50000108.2
360Q37Very low41.1Very low166 Ų166145.4 Ų145.478%0.77683%0.827SS**  trans-122.7123.3-159.1-169.9169.316.100107.9
361A42.2Very low40.5Very low96 Ų96143.4 Ų143.479%0.79382%0.824SS**PPolyproline II helixtrans-80.5135.9176.100000110.5
362P50.6Low40.2Very low120 Ų120138.8 Ų138.878%0.77982%0.818SS**PPolyproline II helixtrans-81.6164.2167.833.8-32.6000111.6
363P50.1Low40.1Very low123 Ų123134.3 Ų134.380%0.79981%0.814SS**PPolyproline II helixtrans-94163-157.936.8-36.8000114.6
364S34.6Very low39.8Very low128 Ų128134 Ų13490%0.89582%0.815SS**  trans-147.5142.4160.5-72.40000110.3
365S34Very low39.3Very low118 Ų118134.1 Ų134.183%0.82581%0.813SS**  trans-82.4160.4-164.546.10000114.9
366L38.6Very low38.9Very low161 Ų161134.4 Ų134.484%0.84381%0.81SS**  trans-49.6149.4166.3-64.9155.6000112.5
367T33Very low38.9Very low114 Ų114133 Ų13370%0.69981%0.812SS**  171.4123.1120.9-70.60000112.9
368Q34.8Very low38.3Very low186 Ų186130.4 Ų130.487%0.86980%0.803SS**  trans53.4141.3151.3-63.2165.724.600123.6
369S33.3Very low38.7Very low109 Ų109128.4 Ų128.476%0.76281%0.808SS**  trans-85.8178.2156.9-43.80000110
370P56.3Low38.8Very low121 Ų121127.6 Ų127.679%0.78679%0.794SS**  cis-144.4-171.613.542.9-22.1000117.4
371A31.6Very low39.3Very low93 Ų93126.9 Ų126.977%0.76980%0.795SS**  trans89.1120.8147.900000122.5
372A33.1Very low39.2Very low89 Ų89132.1 Ų132.174%0.73679%0.794SS**  trans80.8148.4133.700000123.7
373T34Very low39Very low128 Ų128134.9 Ų134.979%0.78580%0.797SS**  trans75110.215939.90000122.4
374S37.5Very low38.4Very low105 Ų105134.7 Ų134.773%0.73479%0.789SS**  trans72.3135.7131.7-53.70000120.9
375P41.6Very low38.9Very low131 Ų131131.8 Ų131.885%0.85177%0.769SS**  trans-84.6134.2176.634.1-32.4000111.8
376V35.5Very low39.8Very low125 Ų125131.1 Ų131.176%0.75876%0.762SS**  trans-112.3123.9163176.80000108.1V378V376-V378 HydrophobicContact CG1-CG2 4.27Å; V376-V378 PolarHBondContact O-N 3.43Å
377T43.5Very low40.5Very low142 Ų142127.8 Ų127.887%0.87175%0.748SS**  trans-66.5115.217246.50000110.1
378V31.6Very low41.6Very low123 Ų123125.2 Ų125.275%0.74573%0.732SS**  trans-124.2122.7165.1-179.70000108.4V376 D380V376-V378 HydrophobicContact CG1-CG2 4.27Å; V376-V378 PolarHBondContact O-N 3.43Å; V378-D380 PolarHBondContact O-N 2.97Å
379L47.9Very low42.8Very low178 Ų178120.4 Ų120.493%0.93272%0.715SS**  trans-72.3110.1173-177.275000108.2
380D34.5Very low44.1Very low124 Ų124120.8 Ų120.866%0.66371%0.708SS**  trans-122.3131.1171.4-171.5-120.8000111.6V378 R382V378-D380 PolarHBondContact O-N 2.97Å; D380-R382 PolarHBondContact O-N 2.93Å
381N47Very low44.3Very low150 Ų150123.2 Ų123.280%0.80270%0.702SS**  trans-82.978.2-169.2-177.231000110.8Q383N381-Q383 PolarHBondContact O-N 3.26Å
382R39.5Very low45.5Very low206 Ų206124.8 Ų124.878%0.77770%0.697SS**  trans-84.9111.8-179.6-64.5-168.672.6142.22.9111.5D380 D384D380-R382 PolarHBondContact O-N 2.93Å; R382-D384 PolarHBondContact O-N 2.89Å; R382-D384 VanDerWaalsContact O-N 3.09Å
383Q47.5Very low46.8Very low179 Ų179129.3 Ų129.384%0.83670%0.695SS**  trans-50.3109.3164.5-66.4-785.200110.2N381 S385N381-Q383 PolarHBondContact O-N 3.26Å; Q383-S385 PolarHBondContact O-N 3.09Å
384D37Very low48.3Very low119 Ų119126.8 Ų126.864%0.63668%0.68SS**  trans-74.8113.1178.3-107.6-52.1000110.4R382 T388R382-D384 PolarHBondContact O-N 2.89Å; R382-D384 VanDerWaalsContact O-N 3.09Å; D384-T388 PolarHBondContact OD1-OG1 3.4Å
385S45.8Very low49.2Very low67 Ų67126.6 Ų126.647%0.46967%0.671SS.*  trans-66.9134.2171.3175.30000109.1Q383 V387 T388Q383-S385 PolarHBondContact O-N 3.09Å; S385-V387 PolarHBondContact O-N 3.19Å; S385-T388 PolarHBondContact O-N 2.78Å; S385-T388 PolarHBondContact O-OG1 3.35Å
386P51.9Low49.8Very low103 Ų103122.6 Ų122.667%0.66965%0.653SS**Hα-helixtrans-60-8-169.622.6-34.6000115.6
387V52.6Low50.7Low91 Ų91120.9 Ų120.955%0.55264%0.643SS**Hα-helixtrans-79.8-23.5176-170.80000112.9S385S385-V387 PolarHBondContact O-N 3.19Å
388T57.3Low50.8Low61 Ų61122.5 Ų122.537%0.37464%0.638SS.*Hα-helixtrans-74.4-48.1177.757.40000110.9D384 S385 L390 R391 N392D384-T388 PolarHBondContact OD1-OG1 3.4Å; S385-T388 PolarHBondContact O-N 2.78Å; S385-T388 PolarHBondContact O-OG1 3.35Å; T388-L390 PolarHBondContact O-N 3.16Å; T388-R391 PolarHBondContact O-N 3.43Å; T388-R391 VanDerWaalsContact O-N 3.07Å; T388-N392 PolarHBondContact O-N 3.45Å
389T60.2Low51.2Low84 Ų84123.8 Ų123.852%0.51564%0.635SS.*Hα-helixtrans-55.6-37.7175.5-53.90000112R391 N392 W393T389-R391 PolarHBondContact O-N 3.48Å; T389-N392 PolarHBondContact O-N 3.33Å; T389-W393 PolarHBondContact O-N 3.41Å
390L60.5Low50.7Low118 Ų118120.6 Ų120.662%0.61862%0.619SS**Hα-helixtrans-65.2-36.1178.6-133.895.9000112.9T388 V394T388-L390 PolarHBondContact O-N 3.16Å; L390-V394 VanDerWaalsContact O-CG2 3.31Å; L390-V394 WeakPolarHBondContact O-CG2 3.47Å; L390-V394 PolarHBondContact O-N 3.17Å
391R61Low51.2Low172 Ų172120.2 Ų120.265%0.64962%0.623SS**Hα-helixtrans-68.5-46.6174.4-89.9-173.7170.5102-0.5111.5T388 T389 W393 V394 D395T388-R391 PolarHBondContact O-N 3.43Å; T388-R391 VanDerWaalsContact O-N 3.07Å; T389-R391 PolarHBondContact O-N 3.48Å; R391-W393 PolarHBondContact O-N 3.37Å; R391-V394 PolarHBondContact O-N 2.9Å; R391-V394 VanDerWaalsContact O-N 3.16Å; R391-D395 PolarHBondContact O-N 3.38Å
392N56.4Low50.9Low125 Ų125119.7 Ų119.767%0.66862%0.62SS**Hα-helixtrans-61.6-31.5177.9-70.6-2.3000112.5T388 T389 G396T388-N392 PolarHBondContact O-N 3.45Å; T389-N392 PolarHBondContact O-N 3.33Å; N392-G396 WeakPolarHBondContact O-CA 3.15Å; N392-G396 PolarHBondContact O-N 2.66Å
393W60.8Low51.2Low184 Ų184119.2 Ų119.270%0.69762%0.624SS**Hα-helixtrans-72.3-45.3173.1-17180.5000112.5T389 R391 G396 V397T389-W393 PolarHBondContact O-N 3.41Å; R391-W393 PolarHBondContact O-N 3.37Å; W393-G396 PolarHBondContact O-N 3.38Å; W393-V397 HydrophobicContact CD2-CG2 4.38Å; W393-V397 HydrophobicContact CZ2-CG2 4.39Å; W393-V397 VanDerWaalsContact O-CG2 3.32Å; W393-V397 WeakPolarHBondContact O-CG2 3.19Å; W393-V397 PolarHBondContact O-N 3.29Å; W393-V397 VanDerWaalsContact O-N 3.14Å
394V64.8Low51.1Low76 Ų76120.9 Ų120.946%0.46162%0.623SS.*Hα-helixtrans-63.1-43.4178.1167.60000112.1L390 R391L390-V394 VanDerWaalsContact O-CG2 3.31Å; L390-V394 WeakPolarHBondContact O-CG2 3.47Å; L390-V394 PolarHBondContact O-N 3.17Å; R391-V394 PolarHBondContact O-N 2.9Å; R391-V394 VanDerWaalsContact O-N 3.16Å
395D56.5Low51.1Low101 Ų101124.7 Ų124.754%0.5464%0.636SS.*Hα-helixtrans-76.8-26.1178.6-66.9-33000112.1R391R391-D395 PolarHBondContact O-N 3.38Å
396G54.3Low50.9Low46 Ų46127.2 Ų127.247%0.47465%0.654SS.*Hα-helixtrans-74.4-29177.100000114.7N392 W393 F398 H399N392-G396 WeakPolarHBondContact O-CA 3.15Å; N392-G396 PolarHBondContact O-N 2.66Å; W393-G396 PolarHBondContact O-N 3.38Å; G396-F398 PolarHBondContact O-N 3.4Å; G396-H399 PolarHBondContact O-N 3.22Å
397V53.4Low50.3Low90 Ų90128.7 Ų128.755%0.54566%0.661SS.*THydrogen-bonded Turntrans-70.3-16.5-179.8167.40000113.1W393W393-V397 HydrophobicContact CD2-CG2 4.38Å; W393-V397 HydrophobicContact CZ2-CG2 4.39Å; W393-V397 VanDerWaalsContact O-CG2 3.32Å; W393-V397 WeakPolarHBondContact O-CG2 3.19Å; W393-V397 PolarHBondContact O-N 3.29Å; W393-V397 VanDerWaalsContact O-N 3.14Å
398F45.5Very low49.4Very low176 Ų176132 Ų13277%0.77268%0.675SS**THydrogen-bonded Turntrans-111.46.1179.2-74.2-80.6000114.9G396G396-F398 PolarHBondContact O-N 3.4Å
399H41.6Very low48.3Very low150 Ų150133.8 Ų133.869%0.69469%0.69SS**  trans-124.787.6177.2-80.3-49.3000113G396G396-H399 PolarHBondContact O-N 3.22Å
400D36.7Very low47.2Very low110 Ų110138.2 Ų138.259%0.58871%0.705SS**  trans-62.4123.3166.2-176.7-3.5000110.6L402D400-L402 PolarHBondContact O-N 3.4Å; D400-L402 PolarHBondContact OD1-N 3.32Å
401P45.3Very low46Very low116 Ų116137.1 Ų137.175%0.75371%0.712SS**G310 helixtrans-74.1-1.8-174.929.1-35.5000115F403P401-F403 PolarHBondContact O-N 3.21Å
402L40.8Very low45Very low139 Ų139137.6 Ų137.673%0.72873%0.727SS**G310 helixtrans-79.4-3.9-172.7-66.2177.6000116.3D400D400-L402 PolarHBondContact O-N 3.4Å; D400-L402 PolarHBondContact OD1-N 3.32Å
403F45.1Very low44.4Very low196 Ų196137.3 Ų137.386%0.8673%0.73SS**G310 helixtrans-127.244.4-176.8-83.8-79.2000115.3P401P401-F403 PolarHBondContact O-N 3.21Å
404R45.1Very low43.3Very low215 Ų215135.7 Ų135.781%0.81174%0.735SS**  trans-123.930.1177.7-87.6-68.1-173-169.1-0.4117.5
405H36.6Very low41.9Very low199 Ų199138.8 Ų138.892%0.92175%0.754SS**  trans-137.886.4161.8-71.7-66000113.5
406S41.6Very low41Very low120 Ų120139.9 Ų139.984%0.83976%0.764SS**  trans-159.154.5156.4-1640000113.9
407T40.7Very low40.1Very low133 Ų133144 Ų14482%0.81678%0.78SS**  trans-141.766.3160.255.40000109.9
408L33.4Very low39.2Very low161 Ų161144.5 Ų144.584%0.84379%0.788SS**  trans-94.996.3166.3-163161.4000108.2
409S34.6Very low38.8Very low99 Ų99147.7 Ų147.769%0.69280%0.795SS**  trans-98.2130.7169.1-50.40000108.9
410Q35.8Very low38.5Very low177 Ų177146.2 Ų146.283%0.82780%0.796SS**SBendtrans87.2147.9168.5-52.4-17937.500118.5
411A36.8Very low38.6Very low94 Ų94147.2 Ų147.278%0.77781%0.806SS**  trans69.978.9172.200000118
412L39.8Very low37.8Very low182 Ų182148.8 Ų148.895%0.95381%0.809SS**  -155.6132.3125.8-101.2144.5000109.8
413T42.4Very low37.5Very low119 Ų119148 Ų14873%0.7381%0.81SS**  trans-89.2153.6-178.539.80000111.4
414N38.3Very low37.1Very low151 Ų151148.1 Ų148.181%0.80781%0.81SS**  trans60.4110.9166.1-56.1-23.8000117.6
415T35.4Very low36.5Very low140 Ų140141.4 Ų141.486%0.85981%0.808SS**  -171.1123.9120.9-78.20000110.7
416T38.2Very low36.4Very low124 Ų124138.9 Ų138.976%0.76181%0.807SS**  trans-71.6136166.7-74.20000110.9
417V35.1Very low36Very low132 Ų132139.1 Ų139.180%0.880%0.802SS**  -157.2131.7129.2172.50000109
418S34.8Very low35.8Very low101 Ų101141.3 Ų141.371%0.70681%0.808SS**  trans-91.6155.4172.6-48.70000112.1
419W37.1Very low35.7Very low244 Ų244142 Ų14292%0.92481%0.808SS**  trans-143.9152.3143.946.8-83.9000111.1
420T36.1Very low35.6Very low119 Ų119141 Ų14173%0.7381%0.805SS**  trans-108160.9-151.447.70000113.8
421T36.9Very low35.3Very low130 Ų130139.6 Ų139.680%0.79880%0.798SS**  trans-48.3141.4162.747.20000112
422N29.5Very low35Very low149 Ų149145.2 Ų145.280%0.79780%0.8SS**  trans-119.4104.6168.8-169.67.3000109.6
423T34.9Very low34.6Very low124 Ų124142.6 Ų142.676%0.76180%0.796SS**  trans-97.6132.4169.642.10000109.2
424K35.4Very low34.2Very low198 Ų198142 Ų14286%0.86180%0.803SS**  trans-149.6108.7161.6-112.6176.7-176.4-179.90110.5
425G32.5Very low33.9Very low74 Ų74139.5 Ų139.576%0.76380%0.804SS**  trans-88.8159159.600000110.1
426T34.6Very low33.7Very low146 Ų146136.9 Ų136.990%0.89680%0.796SS**  trans-136.4128.2161.339.40000108.7
427V33Very low33.3Very low124 Ų124138.5 Ų138.575%0.75280%0.799SS**  trans-89.2139.8174.31690000108.1
428L37.4Very low33.2Very low180 Ų180138.7 Ų138.794%0.94279%0.792SS**  trans-144.4160.5147.3-80.7-171.8000109.8
429E30.2Very low33Very low176 Ų176140.9 Ų140.982%0.82279%0.791SS**  trans-132.9170.2-148.4-162.8-174.5120.800111.9
430A32.7Very low32.7Very low77 Ų77136.3 Ų136.364%0.63678%0.779SS**  trans88119.9148.300000121.8
431E30.3Very low32.5Very low148 Ų148138.8 Ų138.869%0.69278%0.783SS**  trans78.1100.1133.6-71.1-147.5115.700124.1
432R30.2Very low32.2Very low212 Ų212139.8 Ų139.880%0.878%0.783SS**  63.5120.996.6-169.4-173.2-169.7-171.31.6119.4
433S31.3Very low33.8Very low126 Ų126138.4 Ų138.488%0.88178%0.782SS**  trans-169.3151.2135-85.50000111.5
434A33.6Very low34.7Very low106 Ų106137.2 Ų137.288%0.87678%0.776SS**  trans-137140.4-176.800000112.1
435A32.1Very low34.9Very low100 Ų100136.3 Ų136.383%0.82677%0.772SS**  trans-169146.9159.900000107.7
436A31Very low34.9Very low84 Ų84139.8 Ų139.869%0.69477%0.774SS**  cis134135.2-6.800000109.3
437L31Very low35Very low158 Ų158138.5 Ų138.583%0.82777%0.771SS**  trans67.6153.1175.8-74.966.5000115
438Q33.5Very low35.2Very low137 Ų137136.7 Ų136.764%0.6477%0.768SS**  cis-145.4157.413.4-172.648.429.900112.6
439Q30.4Very low35.2Very low146 Ų146137 Ų13768%0.68277%0.768SS**  trans-70.9163.6171.8-56.5156.1-61.300112.7
440H30.9Very low35.4Very low149 Ų149134.2 Ų134.269%0.6977%0.768SS**  161.2152.595.8-135.5-76.8000115
441Q31.3Very low35.7Very low171 Ų171140.1 Ų140.180%0.79978%0.779SS**  trans92.6106.5145.8-117.5160.469.400121.9
442D30.4Very low36.8Very low151 Ų151138 Ų13881%0.80778%0.778SS**  trans-90.4-171.4160.4-60.9-73.2000112.4
443P62.8Low37.3Very low119 Ų119136.3 Ų136.377%0.77378%0.777SS**  -115.4-87.4-51.126.7-8.1000111.4
444P55.3Low37.7Very low99 Ų99135.9 Ų135.964%0.64377%0.769SS**  cis-124.1-179.9-2732-10.5000116.1
445K37.8Very low38Very low179 Ų179137.4 Ų137.478%0.77876%0.761SS**  trans99.194.4155.9-56.1-167.8-179.1-179.40121.7
446D33.5Very low38.3Very low147 Ų147137.9 Ų137.979%0.78675%0.75SS**  48.7115.7112.4-47.5-40.1000121.4
447S36.9Very low38.9Very low120 Ų120141.7 Ų141.784%0.83975%0.751SS**  -166118.3109.5-126.70000115.4
448A36.9Very low39.4Very low85 Ų85140.8 Ų140.870%0.70275%0.746SS**  trans36112.2137.100000122.3
449M37.5Very low39.7Very low188 Ų188143.1 Ų143.193%0.92675%0.754SS**  37.1121.3110-59-85.1-15800119.2
450S34.9Very low40Very low117 Ų117141.3 Ų141.382%0.81876%0.756SS**  161.9117.1109.8-168.70000113.7
451F37.4Very low40.9Very low201 Ų201143.2 Ų143.288%0.88279%0.786SS**  trans-86.4153.9148.4-87.4-79.4000107.3
452P55.3Low41.4Very low104 Ų104141.8 Ų141.868%0.67579%0.786SS**  -162.2176.964.743.4-21.2000120.3
453K39.9Very low42Very low175 Ų175141.3 Ų141.376%0.76178%0.784SS**  trans70.1109.6139.7-88.6172.2178.8174.20122.5
454T39.7Very low40.8Very low117 Ų117142.6 Ų142.672%0.71879%0.785SS**  59.6140.3125.761.80000118.6
455I40.3Very low40Very low138 Ų138145.1 Ų145.171%0.70879%0.793SS**  169.7157.259.7-144.2160.6000110.2
456N37.2Very low40.1Very low111 Ų111143 Ų14359%0.59479%0.794SS**  trans72.1106.2154.8-73.9-20.1000124.6
457K43.9Very low40.6Very low164 Ų164142.7 Ų142.771%0.71380%0.795SS**  91135103.5-81177.4-175.2179.40123.4
458L41.6Very low40.8Very low138 Ų138144.4 Ų144.472%0.72379%0.792SS**  trans88.5105.1132.1-75.7167.4000122.1
459F39.4Very low41.1Very low187 Ų187148.9 Ų148.982%0.8280%0.799SS**  87.6152109.4-125.7-112.8000122.9
460C36.5Very low41.4Very low108 Ų108145.7 Ų145.773%0.7379%0.788SS**  trans67.1141.9175.8-76.40000118
461S50.8Low42Very low188 Ų188148.3 Ų148.3100%1.31579%0.785SS**  cis-130.404.6-94.90000112.5

Retrieved 461 of 461 residues in 166.2 ms (Link to these results)