A0A060D1M6_MAIZE Loading...

TCP transcription factor

AlphaFold DB , UniProt , Accession A0A060D1M6, Species MAIZE (Zea mays, Maize), Gene TCP16, Length 220 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
1M52.3Low57.3Low249 Ų249147 Ų147100%1.22786%0.859SS**  097.70-76.6172.2166.900107.3
2A52Low56.7Low99 Ų99143.3 Ų143.382%0.81886%0.858SS**  trans-106.7123-174.200000109.3
3T66.5Low56.2Low144 Ų144140 Ų14088%0.88386%0.856SS**  trans-107.2109173.143.20000108.8
4T70.6Confident56.4Low139 Ų139141.9 Ų141.985%0.85385%0.854SS**PPolyproline II helixtrans-87.2133.3172.540.50000110
5R67.6Low56Low244 Ų244145.5 Ų145.592%0.92185%0.854SS**PPolyproline II helixtrans-89.6120.3172.2-75.2174.789.6165.64.5109.2
6E58.3Low56.1Low187 Ų187148.1 Ų148.187%0.87486%0.855SS**PPolyproline II helixtrans-72.4128.3166.4-107.8-97.1107.500109.8
7V59.9Low56.1Low133 Ų133146.8 Ų146.881%0.80685%0.849SS**  trans-96.8104.61741770000108.5
8S51.2Low56Low100 Ų100151.8 Ų151.870%0.69985%0.853SS**  trans-25.9123.2164.9178.40000117.3
9S51.1Low56.1Low107 Ų107152.3 Ų152.375%0.74885%0.848SS**  4898.1124.4-1550000118.8
10S51.3Low56.6Low123 Ų123151.2 Ų151.286%0.8685%0.846SS**  trans-150.256.9143.5-174.70000109.6
11A49.1Very low57.2Low92 Ų92151.1 Ų151.176%0.7684%0.842SS**  trans-89.2142.9161.200000108.1
12A50.3Low58Low102 Ų102144.9 Ų144.984%0.84382%0.82SS**  trans87.455.7176.600000117.5
13A50.8Low58.9Low101 Ų101148.7 Ų148.784%0.83582%0.823SS**  trans-138.643.5147.300000110.7
14M58.4Low59.4Low167 Ų167147.7 Ų147.782%0.82382%0.819SS**SBendtrans-112.7143.2159.5-62.6-143.579.900105.8
15F50.5Low59.6Low196 Ų196147.1 Ų147.186%0.8682%0.815SS**SBendtrans77.660.9179.2-84.1-95.4000118
16H57.5Low59.5Low187 Ų187141.1 Ų141.187%0.86681%0.808SS**  trans-142.1139.9148.6-82.584.4000109.2
17V56.2Low59.3Low125 Ų125137.6 Ų137.676%0.75880%0.804SS**  trans8948.8169.3-151.30000116.9Q19V17-Q19 VanDerWaalsContact C-N 3.26Å; V17-Q19 HydrophobicContact CG1-CB 4.07Å; V17-Q19 PolarHBondContact O-N 3.46Å
18Y55.1Low59.2Low237 Ų237137.7 Ų137.793%0.92981%0.805SS**  trans-82.383.2132.4-82.8-84.8000106.7
19Q57.5Low59.1Low162 Ų162136.9 Ų136.976%0.75781%0.805SS**  trans-93.9111.2170.5-153.4-173.475.700107.8V17 I21V17-Q19 VanDerWaalsContact C-N 3.26Å; V17-Q19 HydrophobicContact CG1-CB 4.07Å; V17-Q19 PolarHBondContact O-N 3.46Å; Q19-I21 PolarHBondContact O-N 3.39Å
20T65.8Low58.9Low130 Ų130136.6 Ų136.680%0.79881%0.809SS**PPolyproline II helixtrans-70118.9173.646.40000108.9P22T20-P22 WeakPolarHBondContact O-CD 3.4Å
21I68.2Low58.7Low150 Ų150135.6 Ų135.677%0.76981%0.808SS**PPolyproline II helixtrans-83.2121.3174.1-54.9172.5000107.9Q19Q19-I21 PolarHBondContact O-N 3.39Å
22P69.8Low58.3Low117 Ų117135.2 Ų135.276%0.7681%0.813SS**PPolyproline II helixtrans-71.9133.7174.427.6-31.7000111.3T20T20-P22 WeakPolarHBondContact O-CD 3.4Å
23M71.3Confident57.9Low179 Ų179134.1 Ų134.188%0.88281%0.812SS**PPolyproline II helixtrans-74.5138.8-179.9-61.5-156.1-69.500112.3
24P76.2Confident57.5Low124 Ų124133.4 Ų133.481%0.80581%0.814SS**PPolyproline II helixtrans-79.1130.5169.729.8-31.2000111.7
25T74.6Confident56.6Low126 Ų126129.3 Ų129.377%0.77382%0.815SS**PPolyproline II helixtrans-72.4137.1173.345.50000111.1S27T25-S27 PolarHBondContact O-N 2.91Å; T25-S27 VanDerWaalsContact O-N 3.15Å
26P66.8Low56.2Low119 Ų119124.1 Ų124.177%0.77381%0.808SS**  trans-78.199.7168.230-30.6000109.5
27S54.2Low55.7Low112 Ų112123.2 Ų123.278%0.78381%0.807SS**  trans-80.9109.8157.8-173.70000107.7T25T25-S27 PolarHBondContact O-N 2.91Å; T25-S27 VanDerWaalsContact O-N 3.15Å
28T57.7Low55.5Low135 Ų135123.4 Ų123.483%0.82881%0.807SS**  trans-139.5114.1161.4-44.70000107.6
29A49.3Very low55Low83 Ų83118 Ų11869%0.68680%0.804SS**  trans-75.4153.4-175.500000112.5
30A45.7Very low54.6Low101 Ų101116.5 Ų116.584%0.83581%0.806SS**  trans61.8103.6135.200000120.5
31A46.8Very low53.8Low102 Ų102116 Ų11684%0.84381%0.808SS**  177.3105.2127.900000106.6
32G42.3Very low53.2Low85 Ų85113.4 Ų113.488%0.87681%0.809SS**  62115.768.100000109.6
33G41.9Very low52.2Low79 Ų79114.2 Ų114.281%0.81481%0.814SS**  cis139.6130.118.600000107.2
34G42.6Very low51.4Low85 Ų85110.3 Ų110.388%0.87681%0.81SS**  trans79.2133.7171.600000115.5
35G38.3Very low50.5Low82 Ų82113.9 Ų113.985%0.84581%0.813SS**  cis89.88722.700000110.9
36A41.4Very low49.8Very low87 Ų87114.1 Ų114.172%0.71982%0.817SS**  trans165.4112.1147.900000113.4
37M48.9Very low49.2Very low168 Ų168111.5 Ų111.583%0.82881%0.811SS**  trans55.9124.1130.579-156.6-129.300123.7
38V51.2Low49.3Very low128 Ų128115.9 Ų115.978%0.77682%0.816SS**  trans67.8114.3139.9-570000121
39S43.7Very low49.2Very low123 Ų123119 Ų11986%0.8682%0.819SS**  -150.9117.9128.8-163.50000109.9
40V49.6Very low49.3Very low131 Ų131124.4 Ų124.479%0.79483%0.829SS**  trans-84.4127.6176166.10000108.1
41S49.8Very low49.5Very low121 Ų121123.2 Ų123.285%0.84683%0.827SS**  trans-156.5138.3154.1-83.20000110.9
42A55.6Low49.7Very low95 Ų95121.7 Ų121.779%0.78582%0.821SS**  trans-76.6173.1-154.500000115.4
43P47.3Very low50.6Low134 Ų134122 Ų12287%0.8782%0.824SS**  trans-93.4129.6-151.935.6-31.8000113.5
44A55.5Low51.7Low97 Ų97127.1 Ų127.180%0.80282%0.824SS**  trans-124.3113.5168.400000110.1
45K57.4Low52.9Low198 Ų198128.8 Ų128.886%0.86181%0.813SS**  trans18121.4159.4-62.5176.5-179.5176.30116.8G47K45-G47 VanDerWaalsContact C-N 3.3Å; K45-G47 PolarHBondContact O-N 2.76Å
46P59.4Low54.3Low131 Ų131136.3 Ų136.385%0.85182%0.816SS**  trans-69.890.9168.230.4-31.4000109K48P46-K48 PolarHBondContact O-N 2.78Å; P46-K48 VanDerWaalsContact O-N 3.14Å
47G54.4Low55.9Low64 Ų64135.6 Ų135.666%0.6680%0.798SS**  trans-61.3111.8162.800000107.9K45 K49K45-G47 VanDerWaalsContact C-N 3.3Å; K45-G47 PolarHBondContact O-N 2.76Å; G47-K49 VanDerWaalsContact C-N 3.33Å; G47-K49 PolarHBondContact O-N 2.88Å
48K55.5Low56.9Low205 Ų205130.9 Ų130.989%0.89178%0.781SS**  trans-56.696.6171.6-78.3176.1174.8177.10108.2P46 E50P46-K48 PolarHBondContact O-N 2.78Å; P46-K48 VanDerWaalsContact O-N 3.14Å; K48-E50 VanDerWaalsContact C-N 3.28Å; K48-E50 PolarHBondContact O-N 3.2Å
49K55.8Low58.3Low201 Ų201132 Ų13287%0.87478%0.775SS**  trans-70.391.5165.9-74.7-175.8179.2177.30107.5G47 G51G47-K49 VanDerWaalsContact C-N 3.33Å; G47-K49 PolarHBondContact O-N 2.88Å; K49-G51 PolarHBondContact O-N 2.72Å; K49-G51 VanDerWaalsContact O-N 3.14Å
50E52.9Low59.6Low195 Ų195128.8 Ų128.891%0.91175%0.75SS**  trans-53.7109.5149.2-75.7178.1151.500107.1K48K48-E50 VanDerWaalsContact C-N 3.28Å; K48-E50 PolarHBondContact O-N 3.2Å
51G49.1Very low60.3Low76 Ų76129.6 Ų129.678%0.78475%0.75SS**  trans178.491.3-174.800000113.5K49K49-G51 PolarHBondContact O-N 2.72Å; K49-G51 VanDerWaalsContact O-N 3.14Å
52G51.5Low61.6Low70 Ų70126.5 Ų126.572%0.72274%0.738SS**  trans107.242.4151.900000117.2K54G52-K54 PolarHBondContact O-N 2.66Å
53G59.8Low62.6Low91 Ų91129.4 Ų129.494%0.93873%0.729SS**  trans-71.139.2165.600000114
54K66.7Low64.2Low187 Ų187124.9 Ų124.981%0.81371%0.706SS**  trans-96.3106.7171.8-102.7166.6177.6170.50108.4G52 R56G52-K54 PolarHBondContact O-N 2.66Å; K54-R56 PolarHBondContact O-N 3.16Å; K54-R56 VanDerWaalsContact O-N 3.07Å
55D67.1Low65.5Low120 Ų120128.2 Ų128.264%0.64270%0.698SS**  trans-32.9108.5167.4-168.655.3000111.7H57D55-H57 PolarHBondContact O-N 2.64Å; D55-H57 VanDerWaalsContact O-N 3.15Å; D55-H57 IonicContact OD1-CE1 3.7Å; D55-H57 PolarHBondContact OD1-CE1 3.37Å; D55-H57 IonicContact OD1-CG 2.65Å; D55-H57 IonicContact OD1-ND1 3.01Å; D55-H57 PolarHBondContact OD1-ND1 2.99Å; D55-H57 IonicContact OD2-CE1 3.27Å; D55-H57 IonicContact OD2-CG 2.81Å; D55-H57 IonicContact OD2-ND1 3.91Å; D55-H57 PolarHBondContact OD2-ND1 3.38Å
56R66.9Low67Low240 Ų240127.3 Ų127.391%0.90669%0.689SS**  trans-78.813.8-175.5-64.2-174.7-180-177.4-0.2113.2K54 S58K54-R56 PolarHBondContact O-N 3.16Å; K54-R56 VanDerWaalsContact O-N 3.07Å; R56-S58 PolarHBondContact O-N 3.34Å
57H75.2Confident68.4Low73 Ų73126.9 Ų126.934%0.33868%0.684SS.*  trans-71.9103.9174.4-57.7100.2000107.8D55 K59 R66D55-H57 PolarHBondContact O-N 2.64Å; D55-H57 VanDerWaalsContact O-N 3.15Å; D55-H57 IonicContact OD1-CE1 3.7Å; D55-H57 PolarHBondContact OD1-CE1 3.37Å; D55-H57 IonicContact OD1-CG 2.65Å; D55-H57 IonicContact OD1-ND1 3.01Å; D55-H57 PolarHBondContact OD1-ND1 2.99Å; D55-H57 IonicContact OD2-CE1 3.27Å; D55-H57 IonicContact OD2-CG 2.81Å; D55-H57 IonicContact OD2-ND1 3.91Å; D55-H57 PolarHBondContact OD2-ND1 3.38Å; H57-K59 PolarHBondContact O-N 3.35Å; H57-R66 WeakPolarHBondContact CD2-CD 3.31Å; H57-R66 PolarHBondContact CE1-NH1 2.88Å; H57-R66 PolarHBondContact NE2-NH1 3.03Å
58S70.6Confident70.2Confident68 Ų68135.3 Ų135.348%0.47670%0.696SS.*PPolyproline II helixtrans-56.5116.7174.662.30000108R56 V60 R65R56-S58 PolarHBondContact O-N 3.34Å; S58-V60 PolarHBondContact O-N 3.48Å; S58-R65 PolarHBondContact O-NE 2.89Å; S58-R65 PolarHBondContact OG-NE 3.2Å
59K81.1Confident71.9Confident151 Ų151130.1 Ų130.166%0.65768%0.676SS**EExtended strand (participates in β ladder)trans-75.3117.4178.7-160.4161.9-177.6156.60106.4H57 G62 R63H57-K59 PolarHBondContact O-N 3.35Å; K59-G62 WeakPolarHBondContact CE-O 3.05Å; K59-G62 VanDerWaalsContact CG-C 3.44Å; K59-R63 CarbonylContact C-O 3.51Å; K59-R63 WeakPolarHBondContact CA-O 3.33Å
60V70Confident73.9Confident56 Ų56124.5 Ų124.534%0.33966%0.66SS.*EExtended strand (participates in β ladder)trans-94.2124.8173.662.20000107.5S58 G62 R63 R65S58-V60 PolarHBondContact O-N 3.48Å; V60-G62 PolarHBondContact O-N 3.06Å; V60-R63 PolarHBondContact N-O 2.8Å; V60-R63 WeakPolarHBondContact O-CA 3.1Å; V60-R63 PolarHBondContact O-N 3.39Å; V60-R65 HydrophobicContact CB-CG 4.15Å; V60-R65 HydrophobicContact CG1-CG 3.61Å
61N64.1Low75.9Confident148 Ų148122.4 Ų122.479%0.79165%0.653SS**THydrogen-bonded Turntrans47.737.3-178-64.3-20.7000114.9R63N61-R63 VanDerWaalsContact C-N 3.29Å; N61-R63 PolarHBondContact O-N 3.2Å
62G77Confident78.2Confident57 Ų57124.4 Ų124.459%0.58865%0.65SS**THydrogen-bonded Turntrans74.315.2-177.500000114.5K59 V60K59-G62 WeakPolarHBondContact CE-O 3.05Å; K59-G62 VanDerWaalsContact CG-C 3.44Å; V60-G62 PolarHBondContact O-N 3.06Å
63R77.2Confident80.3Confident156 Ų156123.9 Ų123.959%0.58964%0.635SS**EExtended strand (participates in β ladder)trans-130.6147.4174.7-172.8177173.1106.3-3.5111.8K59 V60 N61 F117K59-R63 CarbonylContact C-O 3.51Å; K59-R63 WeakPolarHBondContact CA-O 3.33Å; V60-R63 PolarHBondContact N-O 2.8Å; V60-R63 WeakPolarHBondContact O-CA 3.1Å; V60-R63 PolarHBondContact O-N 3.39Å; N61-R63 VanDerWaalsContact C-N 3.29Å; N61-R63 PolarHBondContact O-N 3.2Å; R63-F117 HydrophobicContact CB-CZ 4.48Å
64G80.3Confident82.1Confident39 Ų39120.5 Ų120.540%0.40260%0.598SS.*EExtended strand (participates in β ladder)trans-68.8146.8173.700000111.7R66G64-R66 PolarHBondContact O-N 3.32Å
65R84.3Confident83.5Confident166 Ų166114.2 Ų114.263%0.62658%0.58SS**SBendtrans-77.1-3.4175.6-62174.2-174.6-110.90.2114.1S58 V60S58-R65 PolarHBondContact O-NE 2.89Å; S58-R65 PolarHBondContact OG-NE 3.2Å; V60-R65 HydrophobicContact CB-CG 4.15Å; V60-R65 HydrophobicContact CG1-CG 3.61Å
66R88.4Confident84.9Confident180 Ų180117 Ų11768%0.67958%0.582SS**  trans-95133.6-174.5-54.9174.291.1176.5-2110.3H57 G64H57-R66 WeakPolarHBondContact CD2-CD 3.31Å; H57-R66 PolarHBondContact CE1-NH1 2.88Å; H57-R66 PolarHBondContact NE2-NH1 3.03Å; G64-R66 PolarHBondContact O-N 3.32Å
67V88.4Confident86.3Confident121 Ų121106.4 Ų106.473%0.73354%0.544SS*.  trans-108.8134.3172.4-179.50000108.2
68R93.5Very high87.2Confident242 Ų242107.6 Ų107.691%0.91355%0.549SS*.  trans-89.4120172.8-69.4-179.8175.5-101.42.5108.2
69M90.8Very high88.5Confident96 Ų96109.8 Ų109.847%0.47355%0.551SS.*  trans-105.3134.9-175-168.762.172.800110.6C73 A74M69-C73 HydrophobicContact CG-CB 3.59Å; M69-C73 HydrophobicContact SD-CB 3.4Å; M69-C73 WeakPolarHBondContact SD-CB 3.38Å; M69-A74 HydrophobicContact CB-CB 4.47Å; M69-A74 HydrophobicContact CG-CB 4.16Å
70P96.5Very high89.2Confident82 Ų82104.6 Ų104.653%0.53253%0.53SS..  trans-57.4150.3168.8-23.534.3000111.6V72 C73 A74P70-V72 VanDerWaalsContact C-N 3.3Å; P70-V72 PolarHBondContact O-N 3.41Å; P70-C73 PolarHBondContact O-N 2.82Å; P70-C73 VanDerWaalsContact O-N 3.14Å; P70-A74 PolarHBondContact O-N 3.03Å
71I96.5Very high90.5Very high151 Ų151102.6 Ų102.677%0.77452%0.518SS*.Hα-helixtrans-56.4-44.5-174.1-58.4171.2000111.3C73 A74 A75I71-C73 PolarHBondContact O-N 3.04Å; I71-A74 PolarHBondContact O-N 2.66Å; I71-A75 PolarHBondContact O-N 2.99Å
72V96.8Very high92Very high119 Ų119105.7 Ų105.772%0.72152%0.519SS*.Hα-helixtrans-61.5-43.3-179.1-178.70000111.7P70 A75 R76P70-V72 VanDerWaalsContact C-N 3.3Å; P70-V72 PolarHBondContact O-N 3.41Å; V72-A75 PolarHBondContact O-N 3.34Å; V72-R76 PolarHBondContact O-N 2.82Å
73C96.2Very high92.9Very high59 Ų59109 Ų10940%0.39952%0.519SS..Hα-helixtrans-68.2-42.7178.7-60.60000111.1M69 P70 I71 A75 R76 V77M69-C73 HydrophobicContact CG-CB 3.59Å; M69-C73 HydrophobicContact SD-CB 3.4Å; M69-C73 WeakPolarHBondContact SD-CB 3.38Å; P70-C73 PolarHBondContact O-N 2.82Å; P70-C73 VanDerWaalsContact O-N 3.14Å; I71-C73 PolarHBondContact O-N 3.04Å; C73-A75 VanDerWaalsContact C-N 3.32Å; C73-A75 PolarHBondContact O-N 2.99Å; C73-R76 PolarHBondContact O-N 3.42Å; C73-V77 WeakPolarHBondContact O-CG2 3.33Å; C73-V77 PolarHBondContact O-N 3.33Å
74A95.8Very high93.7Very high20 Ų20104.5 Ų104.517%0.16551%0.506CS..Hα-helixtrans-61-41.4176.700000111.6M69 P70 I71 R76 V77 F78M69-A74 HydrophobicContact CB-CB 4.47Å; M69-A74 HydrophobicContact CG-CB 4.16Å; P70-A74 PolarHBondContact O-N 3.03Å; I71-A74 PolarHBondContact O-N 2.66Å; A74-R76 VanDerWaalsContact C-N 3.32Å; A74-R76 PolarHBondContact O-N 3.42Å; A74-V77 PolarHBondContact O-N 3.01Å; A74-V77 VanDerWaalsContact O-N 3.14Å; A74-F78 HydrophobicContact CB-CD2 4.47Å; A74-F78 HydrophobicContact CB-CE2 3.93Å; A74-F78 HydrophobicContact CB-CZ 4.34Å; A74-F78 WeakPolarHBondContact O-CD2 3.47Å; A74-F78 VanDerWaalsContact O-CG 3.25Å; A74-F78 WeakPolarHBondContact O-CG 3.49Å; A74-F78 PolarHBondContact O-N 3.39Å
75A96.5Very high94.4Very high54 Ų54105.6 Ų105.645%0.44652%0.517SS..Hα-helixtrans-57-45.2176.100000112.1I71 V72 C73 V77 F78 Q79I71-A75 PolarHBondContact O-N 2.99Å; V72-A75 PolarHBondContact O-N 3.34Å; C73-A75 VanDerWaalsContact C-N 3.32Å; C73-A75 PolarHBondContact O-N 2.99Å; A75-V77 PolarHBondContact O-N 3.25Å; A75-F78 PolarHBondContact O-N 2.91Å; A75-Q79 WeakPolarHBondContact O-CB 3.47Å; A75-Q79 PolarHBondContact O-N 3.22Å
76R96.4Very high94.8Very high179 Ų179100 Ų10068%0.67550%0.5SS*.Hα-helixtrans-64.6-39.3176.4-171.8175.6-76.4176.6-3.9112.1V72 C73 A74 Q79 L80V72-R76 PolarHBondContact O-N 2.82Å; C73-R76 PolarHBondContact O-N 3.42Å; A74-R76 VanDerWaalsContact C-N 3.32Å; A74-R76 PolarHBondContact O-N 3.42Å; R76-Q79 PolarHBondContact O-N 2.9Å; R76-L80 HydrophobicContact CG-CD1 4.3Å; R76-L80 WeakPolarHBondContact O-CG 3.31Å; R76-L80 PolarHBondContact O-N 3.42Å
77V96.4Very high95.1Very high18 Ų18100 Ų10011%0.10951%0.505CS..Hα-helixtrans-65.6-42.9175.91750000111.3C73 A74 A75 Q79 L80 T81 D89 T92 I93C73-V77 WeakPolarHBondContact O-CG2 3.33Å; C73-V77 PolarHBondContact O-N 3.33Å; A74-V77 PolarHBondContact O-N 3.01Å; A74-V77 VanDerWaalsContact O-N 3.14Å; A75-V77 PolarHBondContact O-N 3.25Å; V77-Q79 VanDerWaalsContact C-N 3.28Å; V77-Q79 PolarHBondContact O-N 2.97Å; V77-L80 PolarHBondContact O-N 3.4Å; V77-T81 WeakPolarHBondContact O-CB 3.41Å; V77-T81 PolarHBondContact O-N 2.85Å; V77-T81 PolarHBondContact O-OG1 3.19Å; V77-D89 HydrophobicContact CG1-CB 4.18Å; V77-T92 HydrophobicContact CG1-CG2 4.17Å; V77-I93 HydrophobicContact CG1-CD1 4.03Å; V77-I93 HydrophobicContact CG1-CG1 4.49Å; V77-I93 HydrophobicContact CG2-CD1 3.85Å
78F95.6Very high95.3Very high98 Ų9896.7 Ų96.743%0.4349%0.487SS..Hα-helixtrans-63.8-36.3176.8-63.8-41000112.2A74 A75 R82 D89A74-F78 HydrophobicContact CB-CD2 4.47Å; A74-F78 HydrophobicContact CB-CE2 3.93Å; A74-F78 HydrophobicContact CB-CZ 4.34Å; A74-F78 WeakPolarHBondContact O-CD2 3.47Å; A74-F78 VanDerWaalsContact O-CG 3.25Å; A74-F78 WeakPolarHBondContact O-CG 3.49Å; A74-F78 PolarHBondContact O-N 3.39Å; A75-F78 PolarHBondContact O-N 2.91Å; F78-R82 WeakPolarHBondContact O-CG 3.37Å; F78-R82 PolarHBondContact O-N 2.79Å; F78-D89 VanDerWaalsContact CD1-OD1 3.3Å; F78-D89 WeakPolarHBondContact CD1-OD1 3.42Å; F78-D89 WeakPolarHBondContact CE1-OD1 3.47Å; F78-D89 WeakPolarHBondContact CE1-OD2 3.41Å
79Q96.8Very high95.3Very high114 Ų11488.5 Ų88.553%0.53346%0.461SS..Hα-helixtrans-63.8-53.9173.2179.2173.51.900111.1A75 R76 V77 T81 R82 E83A75-Q79 WeakPolarHBondContact O-CB 3.47Å; A75-Q79 PolarHBondContact O-N 3.22Å; R76-Q79 PolarHBondContact O-N 2.9Å; V77-Q79 VanDerWaalsContact C-N 3.28Å; V77-Q79 PolarHBondContact O-N 2.97Å; Q79-T81 PolarHBondContact O-N 3.35Å; Q79-R82 WeakPolarHBondContact O-CB 3.5Å; Q79-R82 PolarHBondContact O-N 2.88Å; Q79-E83 WeakPolarHBondContact CG-OE1 3.31Å; Q79-E83 PolarHBondContact NE2-OE1 3.15Å; Q79-E83 PolarHBondContact O-N 3.47Å
80L96.6Very high95.5Very high41 Ų4186.4 Ų86.422%0.21546%0.464CS..Hα-helixtrans-57.9-36.7178.2-74.9168.7000112.5R76 V77 R82 E83 L84 T92 L96R76-L80 HydrophobicContact CG-CD1 4.3Å; R76-L80 WeakPolarHBondContact O-CG 3.31Å; R76-L80 PolarHBondContact O-N 3.42Å; V77-L80 PolarHBondContact O-N 3.4Å; L80-R82 VanDerWaalsContact C-N 3.26Å; L80-R82 PolarHBondContact O-N 3.11Å; L80-E83 PolarHBondContact O-N 2.8Å; L80-L84 WeakPolarHBondContact O-CB 3.3Å; L80-L84 VanDerWaalsContact O-CG 3.32Å; L80-L84 WeakPolarHBondContact O-CG 3.3Å; L80-L84 PolarHBondContact O-N 3.22Å; L80-T92 HydrophobicContact CB-CG2 3.99Å; L80-L96 HydrophobicContact CD1-CD1 4.35Å; L80-L96 HydrophobicContact CD1-CD2 4.33Å
81T96Very high95.4Very high14 Ų1485.8 Ų85.89%0.08645%0.454CS..Hα-helixtrans-59.1-40.4177.1-57.30000111.3V77 Q79 G85 L86 T92V77-T81 WeakPolarHBondContact O-CB 3.41Å; V77-T81 PolarHBondContact O-N 2.85Å; V77-T81 PolarHBondContact O-OG1 3.19Å; Q79-T81 PolarHBondContact O-N 3.35Å; T81-G85 PolarHBondContact O-N 2.98Å; T81-L86 HydrophobicContact CG2-CB 4.46Å; T81-L86 VanDerWaalsContact CG2-O 3.23Å; T81-L86 WeakPolarHBondContact CG2-O 3.43Å; T81-L86 PolarHBondContact O-N 3.38Å; T81-T92 WeakPolarHBondContact CA-OG1 3.34Å; T81-T92 WeakPolarHBondContact CB-OG1 3.47Å; T81-T92 WeakPolarHBondContact CG2-OG1 3.39Å; T81-T92 WeakPolarHBondContact OG1-CB 3.25Å; T81-T92 PolarHBondContact OG1-OG1 2.84Å
82R95.5Very high95.4Very high214 Ų21478.6 Ų78.681%0.80842%0.417SS*.Hα-helixtrans-71.4-39.4176.2-64.1172-174.4-173.61.3111.9F78 Q79 L80 G85F78-R82 WeakPolarHBondContact O-CG 3.37Å; F78-R82 PolarHBondContact O-N 2.79Å; Q79-R82 WeakPolarHBondContact O-CB 3.5Å; Q79-R82 PolarHBondContact O-N 2.88Å; L80-R82 VanDerWaalsContact C-N 3.26Å; L80-R82 PolarHBondContact O-N 3.11Å; R82-G85 PolarHBondContact O-N 3.46Å
83E95.8Very high95.3Very high125 Ų12575.9 Ų75.958%0.58440%0.398SS*.Hα-helixtrans-69-37.2-179.3-68.5174.2-172.300112.6Q79 L80Q79-E83 WeakPolarHBondContact CG-OE1 3.31Å; Q79-E83 PolarHBondContact NE2-OE1 3.15Å; Q79-E83 PolarHBondContact O-N 3.47Å; L80-E83 PolarHBondContact O-N 2.8Å
84L94.4Very high95.2Very high62 Ų6277.5 Ų77.533%0.32540%0.4SS..Hα-helixtrans-82.5-12.7178.7-64.2170.8000113.7L80 L86 T92 W95L80-L84 WeakPolarHBondContact O-CB 3.3Å; L80-L84 VanDerWaalsContact O-CG 3.32Å; L80-L84 WeakPolarHBondContact O-CG 3.3Å; L80-L84 PolarHBondContact O-N 3.22Å; L84-L86 VanDerWaalsContact C-N 3.27Å; L84-L86 HydrophobicContact CB-CD1 3.98Å; L84-L86 HydrophobicContact CB-CG 3.86Å; L84-L86 HydrophobicContact CD1-CD1 3.84Å; L84-L86 PolarHBondContact O-N 3.05Å; L84-T92 HydrophobicContact CD1-CG2 4.25Å; L84-W95 HydrophobicContact CD1-CD2 3.61Å; L84-W95 HydrophobicContact CD1-CE3 3.43Å; L84-W95 VanDerWaalsContact CD1-CE3 3.43Å; L84-W95 HydrophobicContact CD1-CG 4.18Å; L84-W95 HydrophobicContact CD1-CH2 4.2Å; L84-W95 HydrophobicContact CD1-CZ2 4.34Å; L84-W95 HydrophobicContact CD1-CZ3 3.75Å; L84-W95 HydrophobicContact CD2-CD2 4.33Å; L84-W95 HydrophobicContact CD2-CH2 3.91Å; L84-W95 HydrophobicContact CD2-CZ2 3.68Å; L84-W95 HydrophobicContact CD2-CZ3 4.31Å
85G94.4Very high95.2Very high62 Ų6281 Ų8164%0.63941%0.409SS*.THydrogen-bonded Turntrans69.422.2-174.100000114.1T81 R82T81-G85 PolarHBondContact O-N 2.98Å; R82-G85 PolarHBondContact O-N 3.46Å
86L94.4Very high95.2Very high50 Ų5081.3 Ų81.326%0.26240%0.403SS..  trans-81.2146.4177.6-63.3174000110.3T81 L84 Q91 W95T81-L86 HydrophobicContact CG2-CB 4.46Å; T81-L86 VanDerWaalsContact CG2-O 3.23Å; T81-L86 WeakPolarHBondContact CG2-O 3.43Å; T81-L86 PolarHBondContact O-N 3.38Å; L84-L86 VanDerWaalsContact C-N 3.27Å; L84-L86 HydrophobicContact CB-CD1 3.98Å; L84-L86 HydrophobicContact CB-CG 3.86Å; L84-L86 HydrophobicContact CD1-CD1 3.84Å; L84-L86 PolarHBondContact O-N 3.05Å; L86-Q91 HydrophobicContact CB-CB 4.27Å; L86-Q91 HydrophobicContact CD1-CB 4.35Å; L86-Q91 HydrophobicContact CD2-CB 4.43Å; L86-W95 HydrophobicContact CD1-CB 3.98Å; L86-W95 HydrophobicContact CD1-CG 4.38Å
87K93.9Very high95Very high180 Ų18077.6 Ų77.678%0.78340%0.396SS*.SBendtrans-84.1-16.6-171.9-67.6119.566.2173.30113.9
88S93.5Very high94.8Very high51 Ų5183.4 Ų83.436%0.35742%0.416SS..SBendtrans-150150.3-174.868.30000111.6G90 Q91 T92S88-G90 PolarHBondContact O-N 3.15Å; S88-Q91 WeakPolarHBondContact O-CB 2.7Å; S88-Q91 PolarHBondContact O-N 3.3Å; S88-Q91 WeakPolarHBondContact OG-CG 3.23Å; S88-Q91 PolarHBondContact OG-N 2.98Å; S88-T92 PolarHBondContact O-N 2.9Å; S88-T92 PolarHBondContact O-OG1 3.28Å
89D93.7Very high94.6Very high69 Ų6984.5 Ų84.537%0.36942%0.422SS..Hα-helixtrans-60.6-33.5178.8-40.6-42.8000111.7V77 F78 Q91 T92 I93V77-D89 HydrophobicContact CG1-CB 4.18Å; F78-D89 VanDerWaalsContact CD1-OD1 3.3Å; F78-D89 WeakPolarHBondContact CD1-OD1 3.42Å; F78-D89 WeakPolarHBondContact CE1-OD1 3.47Å; F78-D89 WeakPolarHBondContact CE1-OD2 3.41Å; D89-Q91 VanDerWaalsContact C-N 3.29Å; D89-Q91 PolarHBondContact O-N 3.5Å; D89-T92 WeakPolarHBondContact O-CB 3.11Å; D89-T92 PolarHBondContact O-N 3.41Å; D89-T92 VanDerWaalsContact O-N 3.13Å; D89-I93 WeakPolarHBondContact O-CG1 3.4Å; D89-I93 PolarHBondContact O-N 3.46Å
90G93.3Very high94.4Very high52 Ų5280.7 Ų80.754%0.53641%0.41SS..Hα-helixtrans-59.1-40.1175.600000112.7S88 I93 E94S88-G90 PolarHBondContact O-N 3.15Å; G90-I93 PolarHBondContact O-N 2.68Å; G90-E94 WeakPolarHBondContact O-CB 3.04Å; G90-E94 PolarHBondContact O-N 3.07Å
91Q95.1Very high94.1Very high69 Ų6983.6 Ų83.632%0.32242%0.422SS..Hα-helixtrans-68.6-38.8174.3-72178.3-16.300111.7L86 S88 D89 E94 W95L86-Q91 HydrophobicContact CB-CB 4.27Å; L86-Q91 HydrophobicContact CD1-CB 4.35Å; L86-Q91 HydrophobicContact CD2-CB 4.43Å; S88-Q91 WeakPolarHBondContact O-CB 2.7Å; S88-Q91 PolarHBondContact O-N 3.3Å; S88-Q91 WeakPolarHBondContact OG-CG 3.23Å; S88-Q91 PolarHBondContact OG-N 2.98Å; D89-Q91 VanDerWaalsContact C-N 3.29Å; D89-Q91 PolarHBondContact O-N 3.5Å; Q91-E94 PolarHBondContact O-N 2.91Å; Q91-W95 WeakPolarHBondContact O-CB 3.33Å; Q91-W95 PolarHBondContact O-N 2.87Å
92T96.7Very high93.7Very high0 Ų087.3 Ų87.30%045%0.447CS..Hα-helixtrans-63.4-41.7176.3-54.30000111.6V77 L80 T81 L84 S88 D89 W95 L96V77-T92 HydrophobicContact CG1-CG2 4.17Å; L80-T92 HydrophobicContact CB-CG2 3.99Å; T81-T92 WeakPolarHBondContact CA-OG1 3.34Å; T81-T92 WeakPolarHBondContact CB-OG1 3.47Å; T81-T92 WeakPolarHBondContact CG2-OG1 3.39Å; T81-T92 WeakPolarHBondContact OG1-CB 3.25Å; T81-T92 PolarHBondContact OG1-OG1 2.84Å; L84-T92 HydrophobicContact CD1-CG2 4.25Å; S88-T92 PolarHBondContact O-N 2.9Å; S88-T92 PolarHBondContact O-OG1 3.28Å; D89-T92 WeakPolarHBondContact O-CB 3.11Å; D89-T92 PolarHBondContact O-N 3.41Å; D89-T92 VanDerWaalsContact O-N 3.13Å; T92-W95 PolarHBondContact O-N 3.13Å; T92-L96 HydrophobicContact CG2-CD1 4.48Å; T92-L96 WeakPolarHBondContact O-CB 3.42Å; T92-L96 WeakPolarHBondContact O-CG 3.42Å; T92-L96 PolarHBondContact O-N 3.2Å
93I94.4Very high93.4Very high63 Ų6381 Ų8132%0.32344%0.436SS..Hα-helixtrans-66.2-42.3174.5-62.5-57.5000111V77 D89 G90 W95 L96 L97V77-I93 HydrophobicContact CG1-CD1 4.03Å; V77-I93 HydrophobicContact CG1-CG1 4.49Å; V77-I93 HydrophobicContact CG2-CD1 3.85Å; D89-I93 WeakPolarHBondContact O-CG1 3.4Å; D89-I93 PolarHBondContact O-N 3.46Å; G90-I93 PolarHBondContact O-N 2.68Å; I93-W95 VanDerWaalsContact C-N 3.32Å; I93-W95 PolarHBondContact O-N 3.47Å; I93-L96 HydrophobicContact CD1-CD1 4.19Å; I93-L96 PolarHBondContact O-N 2.98Å; I93-L97 HydrophobicContact CG2-CD1 4.15Å; I93-L97 HydrophobicContact CG2-CG 4.4Å; I93-L97 WeakPolarHBondContact O-CG 3.36Å; I93-L97 PolarHBondContact O-N 2.81Å
94E93.7Very high92.9Very high92 Ų9277.6 Ų77.643%0.4342%0.421SS..Hα-helixtrans-59.5-44.2174.9-175.2-178.3168.700111.6G90 Q91 L97 R98G90-E94 WeakPolarHBondContact O-CB 3.04Å; G90-E94 PolarHBondContact O-N 3.07Å; Q91-E94 PolarHBondContact O-N 2.91Å; E94-L97 PolarHBondContact O-N 3.2Å; E94-R98 WeakPolarHBondContact O-CG 3.4Å; E94-R98 PolarHBondContact O-N 3.44Å; E94-R98 IonicContact OE1-CZ 3.54Å; E94-R98 VanDerWaalsContact OE1-CZ 3.27Å; E94-R98 IonicContact OE1-NE 3.91Å; E94-R98 IonicContact OE1-NH2 2.66Å; E94-R98 PolarHBondContact OE1-NH2 3.24Å
95W96Very high92.5Very high95 Ų9578 Ų7836%0.3643%0.426SS..Hα-helixtrans-61.1-46.2175.117991.4000111.8L84 L86 Q91 T92 I93 L97 R98 Q99L84-W95 HydrophobicContact CD1-CD2 3.61Å; L84-W95 HydrophobicContact CD1-CE3 3.43Å; L84-W95 VanDerWaalsContact CD1-CE3 3.43Å; L84-W95 HydrophobicContact CD1-CG 4.18Å; L84-W95 HydrophobicContact CD1-CH2 4.2Å; L84-W95 HydrophobicContact CD1-CZ2 4.34Å; L84-W95 HydrophobicContact CD1-CZ3 3.75Å; L84-W95 HydrophobicContact CD2-CD2 4.33Å; L84-W95 HydrophobicContact CD2-CH2 3.91Å; L84-W95 HydrophobicContact CD2-CZ2 3.68Å; L84-W95 HydrophobicContact CD2-CZ3 4.31Å; L86-W95 HydrophobicContact CD1-CB 3.98Å; L86-W95 HydrophobicContact CD1-CG 4.38Å; Q91-W95 WeakPolarHBondContact O-CB 3.33Å; Q91-W95 PolarHBondContact O-N 2.87Å; T92-W95 PolarHBondContact O-N 3.13Å; I93-W95 VanDerWaalsContact C-N 3.32Å; I93-W95 PolarHBondContact O-N 3.47Å; W95-L97 VanDerWaalsContact C-N 3.31Å; W95-L97 PolarHBondContact O-N 3.3Å; W95-R98 PolarHBondContact O-N 2.65Å; W95-Q99 HydrophobicContact CD2-CG 4.01Å; W95-Q99 HydrophobicContact CE3-CG 4.3Å; W95-Q99 HydrophobicContact CH2-CG 4.03Å; W95-Q99 HydrophobicContact CZ2-CG 3.71Å; W95-Q99 HydrophobicContact CZ3-CG 4.31Å; W95-Q99 WeakPolarHBondContact O-CG 3.47Å; W95-Q99 PolarHBondContact O-N 3.01Å
96L95.6Very high92.2Very high59 Ų5979.2 Ų79.231%0.30943%0.43SS..Hα-helixtrans-59.5-42.4176.7-78.7170.1000111.8L80 T92 I93 Q99 A100L80-L96 HydrophobicContact CD1-CD1 4.35Å; L80-L96 HydrophobicContact CD1-CD2 4.33Å; T92-L96 HydrophobicContact CG2-CD1 4.48Å; T92-L96 WeakPolarHBondContact O-CB 3.42Å; T92-L96 WeakPolarHBondContact O-CG 3.42Å; T92-L96 PolarHBondContact O-N 3.2Å; I93-L96 HydrophobicContact CD1-CD1 4.19Å; I93-L96 PolarHBondContact O-N 2.98Å; L96-Q99 PolarHBondContact O-N 3.41Å; L96-A100 VanDerWaalsContact O-CB 3.23Å; L96-A100 WeakPolarHBondContact O-CB 3.44Å; L96-A100 PolarHBondContact O-N 2.7Å
97L92.8Very high91.8Very high101 Ų10181.1 Ų81.153%0.52945%0.452SS..Hα-helixtrans-65.5-41.4178.8-71.5175000111.5I93 E94 W95 A100 E101I93-L97 HydrophobicContact CG2-CD1 4.15Å; I93-L97 HydrophobicContact CG2-CG 4.4Å; I93-L97 WeakPolarHBondContact O-CG 3.36Å; I93-L97 PolarHBondContact O-N 2.81Å; E94-L97 PolarHBondContact O-N 3.2Å; W95-L97 VanDerWaalsContact C-N 3.31Å; W95-L97 PolarHBondContact O-N 3.3Å; L97-A100 CarbonylContact O-C 3.53Å; L97-A100 PolarHBondContact O-N 2.69Å; L97-E101 WeakPolarHBondContact O-CG 3.37Å; L97-E101 PolarHBondContact O-N 3.24Å
98R92.4Very high91.4Very high141 Ų14176.5 Ų76.553%0.53244%0.44SS..Hα-helixtrans-61.2-45.8174.7-73.6178.7-179.5178.73.8112.4E94 W95 A100 E101E94-R98 WeakPolarHBondContact O-CG 3.4Å; E94-R98 PolarHBondContact O-N 3.44Å; E94-R98 IonicContact OE1-CZ 3.54Å; E94-R98 VanDerWaalsContact OE1-CZ 3.27Å; E94-R98 IonicContact OE1-NE 3.91Å; E94-R98 IonicContact OE1-NH2 2.66Å; E94-R98 PolarHBondContact OE1-NH2 3.24Å; W95-R98 PolarHBondContact O-N 2.65Å; R98-A100 VanDerWaalsContact C-N 3.26Å; R98-A100 PolarHBondContact O-N 3.08Å; R98-E101 VanDerWaalsContact O-CB 3.31Å; R98-E101 WeakPolarHBondContact O-CB 3.45Å; R98-E101 WeakPolarHBondContact O-CG 3.33Å; R98-E101 PolarHBondContact O-N 2.86Å
99Q92.1Very high90.6Very high121 Ų12177.4 Ų77.457%0.56546%0.457SS*.Hα-helixtrans-67.2-29.2176.9-65.7-55.9-38.600112.5W95 L96 E101 P102W95-Q99 HydrophobicContact CD2-CG 4.01Å; W95-Q99 HydrophobicContact CE3-CG 4.3Å; W95-Q99 HydrophobicContact CH2-CG 4.03Å; W95-Q99 HydrophobicContact CZ2-CG 3.71Å; W95-Q99 HydrophobicContact CZ3-CG 4.31Å; W95-Q99 WeakPolarHBondContact O-CG 3.47Å; W95-Q99 PolarHBondContact O-N 3.01Å; L96-Q99 PolarHBondContact O-N 3.41Å; Q99-E101 VanDerWaalsContact C-N 3.34Å; Q99-P102 VanDerWaalsContact O-CD 3.3Å; Q99-P102 WeakPolarHBondContact O-CD 3.32Å
100A92.1Very high89.6Confident33 Ų3378.2 Ų78.227%0.27347%0.468SS..Hα-helixtrans-81.3-9.1175.600000113.5L96 L97 R98 P102 S103 I104L96-A100 VanDerWaalsContact O-CB 3.23Å; L96-A100 WeakPolarHBondContact O-CB 3.44Å; L96-A100 PolarHBondContact O-N 2.7Å; L97-A100 CarbonylContact O-C 3.53Å; L97-A100 PolarHBondContact O-N 2.69Å; R98-A100 VanDerWaalsContact C-N 3.26Å; R98-A100 PolarHBondContact O-N 3.08Å; A100-P102 VanDerWaalsContact C-CD 3.47Å; A100-S103 CarbonylContact O-C 3.59Å; A100-S103 WeakPolarHBondContact O-CA 3.42Å; A100-S103 WeakPolarHBondContact O-CB 3.41Å; A100-S103 PolarHBondContact O-N 3.26Å; A100-I104 HydrophobicContact CB-CD1 4.09Å; A100-I104 HydrophobicContact CB-CG1 4.44Å; A100-I104 VanDerWaalsContact O-CG1 3.3Å; A100-I104 WeakPolarHBondContact O-CG1 3.4Å; A100-I104 PolarHBondContact O-N 3.29Å
101E89.7Confident88.2Confident103 Ų10376.5 Ų76.548%0.48145%0.45SS..Hα-helixtrans-50.9-48.1179.3-75.5171.4-164.300113L97 R98 Q99 S103 I104 V105L97-E101 WeakPolarHBondContact O-CG 3.37Å; L97-E101 PolarHBondContact O-N 3.24Å; R98-E101 VanDerWaalsContact O-CB 3.31Å; R98-E101 WeakPolarHBondContact O-CB 3.45Å; R98-E101 WeakPolarHBondContact O-CG 3.33Å; R98-E101 PolarHBondContact O-N 2.86Å; Q99-E101 VanDerWaalsContact C-N 3.34Å; E101-S103 VanDerWaalsContact C-N 3.28Å; E101-S103 PolarHBondContact O-N 3.35Å; E101-I104 PolarHBondContact O-N 3.19Å; E101-V105 VanDerWaalsContact O-CG2 3.31Å; E101-V105 WeakPolarHBondContact O-CG2 3.48Å; E101-V105 PolarHBondContact O-N 2.89Å
102P87.6Confident86.9Confident92 Ų9278.3 Ų78.360%0.59747%0.466SS*.Hα-helixtrans-59.8-40178.2-21.834.1000112.2Q99 A100 A106Q99-P102 VanDerWaalsContact O-CD 3.3Å; Q99-P102 WeakPolarHBondContact O-CD 3.32Å; A100-P102 VanDerWaalsContact C-CD 3.47Å; P102-A106 WeakPolarHBondContact O-CB 3.23Å; P102-A106 PolarHBondContact O-N 3.36Å
103S89.4Confident85.1Confident82 Ų8283 Ų8357%0.57350%0.495SS*.Hα-helixtrans-69.6-39.4178.6-56.40000112A100 E101 A107A100-S103 CarbonylContact O-C 3.59Å; A100-S103 WeakPolarHBondContact O-CA 3.42Å; A100-S103 WeakPolarHBondContact O-CB 3.41Å; A100-S103 PolarHBondContact O-N 3.26Å; E101-S103 VanDerWaalsContact C-N 3.28Å; E101-S103 PolarHBondContact O-N 3.35Å; S103-A107 VanDerWaalsContact O-CB 3.31Å; S103-A107 WeakPolarHBondContact O-CB 3.38Å; S103-A107 PolarHBondContact O-N 3.44Å
104I86.5Confident83.5Confident52 Ų5284.9 Ų84.927%0.26751%0.511SS..Hα-helixtrans-65.9-45.4176.8-67.5164.2000109.8A100 E101 A107 T108 T112A100-I104 HydrophobicContact CB-CD1 4.09Å; A100-I104 HydrophobicContact CB-CG1 4.44Å; A100-I104 VanDerWaalsContact O-CG1 3.3Å; A100-I104 WeakPolarHBondContact O-CG1 3.4Å; A100-I104 PolarHBondContact O-N 3.29Å; E101-I104 PolarHBondContact O-N 3.19Å; I104-A107 PolarHBondContact O-N 2.91Å; I104-T108 HydrophobicContact CG2-CG2 4.31Å; I104-T108 WeakPolarHBondContact O-CB 3.37Å; I104-T108 WeakPolarHBondContact O-CG2 3.3Å; I104-T108 PolarHBondContact O-N 2.95Å; I104-T108 PolarHBondContact O-OG1 3.02Å; I104-T112 HydrophobicContact CG2-CG2 4.29Å
105V85.7Confident81.7Confident71 Ų7185 Ų8543%0.4353%0.528SS..Hα-helixtrans-63.6-45.4178.9174.10000110.6E101 A107 T108 G109E101-V105 VanDerWaalsContact O-CG2 3.31Å; E101-V105 WeakPolarHBondContact O-CG2 3.48Å; E101-V105 PolarHBondContact O-N 2.89Å; V105-A107 VanDerWaalsContact C-N 3.3Å; V105-A107 PolarHBondContact O-N 3.14Å; V105-T108 PolarHBondContact O-N 3.14Å; V105-G109 WeakPolarHBondContact O-CA 3.46Å; V105-G109 PolarHBondContact O-N 3.06Å
106A87.2Confident79.6Confident88 Ų8886.2 Ų86.273%0.72755%0.546SS*.Hα-helixtrans-61.1-38.3177.200000112.7P102P102-A106 WeakPolarHBondContact O-CB 3.23Å; P102-A106 PolarHBondContact O-N 3.36Å
107A86.7Confident77.4Confident89 Ų8989.7 Ų89.774%0.73656%0.559SS**Hα-helixtrans-78.3-30.9-179.800000113.9S103 I104 V105S103-A107 VanDerWaalsContact O-CB 3.31Å; S103-A107 WeakPolarHBondContact O-CB 3.38Å; S103-A107 PolarHBondContact O-N 3.44Å; I104-A107 PolarHBondContact O-N 2.91Å; V105-A107 VanDerWaalsContact C-N 3.3Å; V105-A107 PolarHBondContact O-N 3.14Å
108T85.4Confident75.1Confident84 Ų8490.8 Ų90.852%0.51557%0.569SS.*Hα-helixtrans-105.7-12.6-173.761.80000113.8I104 V105 S110 G111I104-T108 HydrophobicContact CG2-CG2 4.31Å; I104-T108 WeakPolarHBondContact O-CB 3.37Å; I104-T108 WeakPolarHBondContact O-CG2 3.3Å; I104-T108 PolarHBondContact O-N 2.95Å; I104-T108 PolarHBondContact O-OG1 3.02Å; V105-T108 PolarHBondContact O-N 3.14Å; T108-S110 PolarHBondContact O-N 2.85Å; T108-G111 PolarHBondContact OG1-N 3.36Å
109G75.7Confident72.7Confident69 Ų6989.8 Ų89.871%0.71158%0.584SS**SBendtrans68.8-19.1-179.700000115.7V105V105-G109 WeakPolarHBondContact O-CA 3.46Å; V105-G109 PolarHBondContact O-N 3.06Å
110S72.7Confident70.6Confident87 Ų8787.6 Ų87.661%0.60858%0.582SS**SBendtrans-123.9-12-173.8-174.30000114.8T108 T113T108-S110 PolarHBondContact O-N 2.85Å; S110-T113 PolarHBondContact OG-OG1 3.41Å
111G64.4Low68.3Low16 Ų1691.3 Ų91.317%0.16561%0.606CS.*SBendtrans69.2112.9-178.200000112.8T108 T113T108-G111 PolarHBondContact OG1-N 3.36Å; G111-T113 PolarHBondContact O-N 3.33Å
112T67.7Low66.5Low107 Ų10789.9 Ų89.966%0.65661%0.611SS**  trans49.316.6160.675.10000119.2I104 P114I104-T112 HydrophobicContact CG2-CG2 4.29Å; T112-P114 WeakPolarHBondContact O-CD 3.44Å
113T59Low64.4Low99 Ų9990.9 Ų90.961%0.60762%0.618SS**  trans-56.5107169.7-37.90000106.9S110 G111 A115S110-T113 PolarHBondContact OG-OG1 3.41Å; G111-T113 PolarHBondContact O-N 3.33Å; T113-A115 PolarHBondContact O-N 3.14Å; T113-A115 VanDerWaalsContact O-N 3.16Å
114P60.3Low62.6Low101 Ų10191.7 Ų91.766%0.65662%0.624SS**  trans-60.7131.3-175.924.5-30.6000105.6T112 V116T112-P114 WeakPolarHBondContact O-CD 3.44Å; P114-V116 WeakPolarHBondContact O-CG2 3.4Å; P114-V116 PolarHBondContact O-N 3.04Å
115A57.8Low60.9Low96 Ų9694.9 Ų94.979%0.79365%0.646SS**  trans-56.994.6167.100000106.2T113 F117T113-A115 PolarHBondContact O-N 3.14Å; T113-A115 VanDerWaalsContact O-N 3.16Å; A115-F117 PolarHBondContact O-N 3.38Å
116V51.3Low58.9Low120 Ų12096.2 Ų96.273%0.72766%0.658SS**  trans-55.5126.1176.8-155.20000104.2P114 V118P114-V116 WeakPolarHBondContact O-CG2 3.4Å; P114-V116 PolarHBondContact O-N 3.04Å; V116-V118 VanDerWaalsContact C-N 3.33Å; V116-V118 PolarHBondContact O-N 3.5Å
117F48.3Very low56.9Low132 Ų13297.3 Ų97.358%0.57966%0.66SS**  trans-52.894.4-173.3-75.7-99.4000110.5R63 A115 S119R63-F117 HydrophobicContact CB-CZ 4.48Å; A115-F117 PolarHBondContact O-N 3.38Å; F117-S119 PolarHBondContact O-N 2.96Å
118V45Very low54.9Low123 Ų12398.4 Ų98.475%0.74566%0.663SS**  trans-7675.8162.7-174.20000105.9V116 S120V116-V118 VanDerWaalsContact C-N 3.33Å; V116-V118 PolarHBondContact O-N 3.5Å; V118-S120 WeakPolarHBondContact CG1-OG 3.42Å; V118-S120 PolarHBondContact O-N 3.39Å
119S41.8Very low53Low120 Ų12099.3 Ų99.384%0.83967%0.672SS**  trans-82.175.6150.5-85.80000107F117F117-S119 PolarHBondContact O-N 2.96Å
120S47.9Very low51.4Low75 Ų75100.5 Ų100.552%0.52467%0.67SS.*  trans-135.3108.3162.761.30000108.1V118V118-S120 WeakPolarHBondContact CG1-OG 3.42Å; V118-S120 PolarHBondContact O-N 3.39Å
121S45.4Very low50.1Low112 Ų112104.9 Ų104.978%0.78368%0.68SS**  trans25.9103.1140.352.10000117.2
122A50.8Low48.8Very low72 Ų72115.1 Ų115.160%0.59572%0.716SS**  trans7.6166143.900000121.1F157A122-F157 HydrophobicContact CB-CE2 4.49Å
123P44.7Very low47.7Very low114 Ų114118 Ų11874%0.7472%0.721SS**  cis-137.8-169.4-42.937.7-19.4000112.1
124S49.9Very low47.1Very low99 Ų99119.5 Ų119.569%0.69272%0.721SS**  trans97.6126.7150.574.10000120.6
125T52.1Low46.2Very low118 Ų118120.5 Ų120.572%0.72472%0.717SS**  trans62.899.5139.4460000118.4
126S43.3Very low45.5Very low100 Ų100122.8 Ų122.870%0.69971%0.712SS**  77.8137.988.967.30000115.6
127S45.2Very low45.1Very low110 Ų110125.6 Ų125.677%0.76972%0.717SS**  trans77.7107.4172.165.90000115.7
128S45Very low44.6Very low113 Ų113123.4 Ų123.479%0.7972%0.723SS**  68.312879.5-80.50000114.2
129S44.7Very low44.9Very low102 Ų102123.7 Ų123.771%0.71373%0.725SS**  trans69.9108.1155.465.90000119.6
130S41.6Very low45.4Very low95 Ų95124 Ų12466%0.66472%0.722SS**  71.8144119.3-50.60000120.1
131H45.7Very low45.4Very low178 Ų178126.6 Ų126.682%0.82473%0.734SS**  trans108.2121.5156.6-52-68.3000116.9
132Y38.4Very low45.3Very low231 Ų231129 Ų12991%0.90674%0.738SS**  trans-57.8176.9173-65.2-93.4000112.9
133H44.7Very low45Very low168 Ų168128.8 Ų128.878%0.77874%0.742SS**  trans106.595160.1-148-94.6000113.3
134H45.6Very low45.4Very low131 Ų131131.1 Ų131.161%0.60674%0.74SS**  77.6114.684.7-170.980.5000113.6
135Q40.8Very low45.4Very low122 Ų122136.2 Ų136.257%0.5775%0.745SS**  trans68.2110.4139.2-157.6174.654.500119.7
136Q44.5Very low44.8Very low144 Ų144136.4 Ų136.467%0.67375%0.748SS**  trans47.2129.7135.9-51.9167.810.500119.2
137Q41.2Very low44.8Very low178 Ų178142.3 Ų142.383%0.83276%0.755SS**  trans137.8147.8130.1-73.4151.8105.200113
138A38.7Very low45Very low86 Ų86146.4 Ų146.471%0.71176%0.762SS**  trans-83.7176.4-161.100000114.5
139T50.3Low44.9Very low129 Ų129149.7 Ų149.779%0.79176%0.764SS**  trans100150.8155.681.60000117.8
140V52.4Low44.8Very low128 Ų128148.2 Ų148.278%0.77677%0.765SS**  trans99.489.6173.9-51.40000115.5
141V48.2Very low44.9Very low128 Ų128151.4 Ų151.478%0.77678%0.775SS**  71.1122.266.7-178.60000112.7
142L42.8Very low44.8Very low164 Ų164147.3 Ų147.386%0.85977%0.772SS**  trans106.2114.1142.8-136.664.6000119.7
143G45.4Very low45.2Very low67 Ų67141.6 Ų141.669%0.69177%0.772SS**  trans144.48415700000112.1
144K53.6Low45.6Very low162 Ų162136.4 Ų136.470%0.70477%0.765SS**  46.2122.380.3-63.5-124.5178.7179.20110.9
145R49.9Very low45.9Very low207 Ų207135.9 Ų135.978%0.78178%0.776SS**  cis176.8-174.231.2-103.1169.8170.4147.6-5105.8
146P40Very low47Very low121 Ų121134.8 Ų134.879%0.78678%0.777SS**  -125.6174.9-58.936.3-17.4000112
147R41.7Very low48.1Very low224 Ų224133.8 Ų133.885%0.84577%0.771SS**  trans-67.1135176.9169.5175.1171.694.4-2.7113.3
148E50.8Low48.7Very low197 Ų197134.7 Ų134.792%0.92177%0.767SS**  trans-129.6144.9153.6-70.5-163.5151.600110.1
149E41.3Very low49.6Very low181 Ų181134.3 Ų134.385%0.84676%0.764SS**  trans-90.7135.2-169.1174.7-175155.400109.7
150G44.5Very low49.9Very low71 Ų71132.2 Ų132.273%0.73276%0.759SS**  trans-174.7111.4177.900000110.9
151D42Very low49.9Very low162 Ų162131.5 Ų131.587%0.86675%0.751SS**  trans-46.8164.9-179.3-80-76.6000117.1
152A44.8Very low50.3Low93 Ų93130.6 Ų130.677%0.76975%0.747SS**  trans90.181.7165.500000117.3
153A47Very low50.3Low110 Ų110128 Ų12891%0.90975%0.749SS**  19.1111.2122.600000117.4
154G52.8Low50.5Low60 Ų60127.8 Ų127.862%0.61974%0.741SS**  trans145.479.4162.100000112.3V156G154-V156 VanDerWaalsContact O-CG2 3.25Å; G154-V156 WeakPolarHBondContact O-CG2 3.13Å; G154-V156 PolarHBondContact O-N 2.99Å
155S52.1Low50.2Low120 Ų120126.5 Ų126.584%0.83975%0.749SS**  trans-62.986.1166.2157.60000109.3F157S155-F157 VanDerWaalsContact C-N 3.25Å; S155-F157 PolarHBondContact O-N 3.27Å; S155-F157 VanDerWaalsContact O-N 3.11Å
156V63.6Low50Low98 Ų98127.6 Ų127.659%0.59475%0.753SS**  trans-85.866.9175.8-155.10000109.7G154 W158 A159G154-V156 VanDerWaalsContact O-CG2 3.25Å; G154-V156 WeakPolarHBondContact O-CG2 3.13Å; G154-V156 PolarHBondContact O-N 2.99Å; V156-W158 PolarHBondContact O-N 3Å; V156-A159 HydrophobicContact CB-CB 4.11Å; V156-A159 HydrophobicContact CG1-CB 3.21Å; V156-A159 PolarHBondContact O-N 2.89Å
157F67.8Low50.2Low123 Ų123125 Ų12554%0.53974%0.742SS.*THydrogen-bonded Turntrans-60.4-26.8179.9169.2-106.1000113.2A122 S155A122-F157 HydrophobicContact CB-CE2 4.49Å; S155-F157 VanDerWaalsContact C-N 3.25Å; S155-F157 PolarHBondContact O-N 3.27Å; S155-F157 VanDerWaalsContact O-N 3.11Å
158W53.6Low50.5Low198 Ų198121.2 Ų121.275%0.7574%0.744SS**THydrogen-bonded Turntrans-93.3-7.6-177.8-68.5108.4000115.4V156 L161V156-W158 PolarHBondContact O-N 3Å; W158-L161 HydrophobicContact CE3-CD1 4.27Å
159A57.3Low49.9Very low78 Ų78119.9 Ų119.965%0.64574%0.738SS**THydrogen-bonded Turntrans-93.8-5.7-176.200000114.8V156V156-A159 HydrophobicContact CB-CB 4.11Å; V156-A159 HydrophobicContact CG1-CB 3.21Å; V156-A159 PolarHBondContact O-N 2.89Å
160A55.9Low49.9Very low84 Ų84115.4 Ų115.469%0.69473%0.732SS**THydrogen-bonded Turntrans-104.312.4178.800000113.4P162A160-P162 WeakPolarHBondContact O-CD 3.25Å
161L53.8Low49.9Very low114 Ų114122.7 Ų122.760%0.59774%0.737SS**  trans-71.5112.9167.3-95.479000108.1W158 A163W158-L161 HydrophobicContact CE3-CD1 4.27Å; L161-A163 PolarHBondContact O-N 3.14Å
162P55.3Low50Low109 Ų109119.2 Ų119.271%0.70874%0.74SS**  trans-60.9125.3172.125.5-32.2000108.5A160 A164A160-P162 WeakPolarHBondContact O-CD 3.25Å; P162-A164 PolarHBondContact O-N 3.28Å
163A44.1Very low50.1Low109 Ų109122 Ų12290%0.90174%0.735SS**  trans-60.685.2164.400000108.5L161L161-A163 PolarHBondContact O-N 3.14Å
164A49.5Very low50.4Low62 Ų62120.7 Ų120.751%0.51272%0.719SS.*  trans-106.8121.5178.100000109.1P162 R166P162-A164 PolarHBondContact O-N 3.28Å; A164-R166 VanDerWaalsContact C-N 3.28Å; A164-R166 PolarHBondContact O-N 3.45Å
165P46Very low50.7Low136 Ų136123 Ų12388%0.88372%0.723SS**  trans-72.686.5174.130.7-32000108.2A167P165-A167 PolarHBondContact O-N 2.93Å
166R45.5Very low50.9Low230 Ų230123.9 Ų123.987%0.86872%0.717SS**  trans-91.8103.1178.2-92.2-93.7162.3106.4-7.9109.6A164A164-R166 VanDerWaalsContact C-N 3.28Å; A164-R166 PolarHBondContact O-N 3.45Å
167A44.3Very low50.6Low66 Ų66125 Ų12555%0.54572%0.716SS.*  trans50101.5144.400000116.7P165 E169P165-A167 PolarHBondContact O-N 2.93Å; A167-E169 HydrophobicContact CB-CG 4.41Å; A167-E169 PolarHBondContact O-N 3.3Å
168T48.5Very low50Low145 Ų145121.3 Ų121.389%0.8971%0.708SS**  trans-61.576.1153.952.80000109.7
169E39.1Very low50Low168 Ų168118.6 Ų118.679%0.78570%0.704SS**  trans-134.2116.2170.3-70.6-169.9144.400107.2A167A167-E169 HydrophobicContact CB-CG 4.41Å; A167-E169 PolarHBondContact O-N 3.3Å
170A41.4Very low50Low87 Ų87117.7 Ų117.772%0.71970%0.696SS**SBendtrans156.3-5.7145.200000114.8
171W43.3Very low50Low224 Ų224116.5 Ų116.585%0.84869%0.687SS**SBendtrans-135.378.6177.4-61.183.7000111.2F173W171-F173 WeakPolarHBondContact O-CD2 3.2Å; W171-F173 PolarHBondContact O-N 3.44Å
172G45.1Very low50Low89 Ų89114.1 Ų114.192%0.91868%0.683SS**  trans49.78.6146.900000121.5
173F45.3Very low50Low153 Ų153111.6 Ų111.667%0.67167%0.672SS**  trans-91.7115175.3-70.3-72.9000108.7W171W171-F173 WeakPolarHBondContact O-CD2 3.2Å; W171-F173 PolarHBondContact O-N 3.44Å
174S53.6Low50.5Low81 Ų81109.2 Ų109.257%0.56665%0.652SS**  trans-52138.6173.1-73.60000110.2L176 E177 A178S174-L176 PolarHBondContact O-N 2.84Å; S174-E177 PolarHBondContact O-N 3.35Å; S174-A178 PolarHBondContact O-N 3.48Å
175P59.3Low50.6Low109 Ų109109.3 Ų109.371%0.70865%0.652SS**Hα-helixtrans-53.8-25.6-178.1-25.732.9000113.9Q179P175-Q179 WeakPolarHBondContact O-CB 3.48Å; P175-Q179 PolarHBondContact O-N 3.42Å; P175-Q179 VanDerWaalsContact O-N 3.14Å
176L57.3Low50.9Low138 Ų138106.2 Ų106.272%0.72364%0.638SS**Hα-helixtrans-72.8-33.4178.2-159.272.5000113S174 A180S174-L176 PolarHBondContact O-N 2.84Å; L176-A180 PolarHBondContact O-N 3.06Å
177E56.8Low51.1Low123 Ų12398.7 Ų98.758%0.57563%0.625SS**Hα-helixtrans-81.1-31.7179-165.4161.8117.300111.4S174 Q179 A180 A181S174-E177 PolarHBondContact O-N 3.35Å; E177-Q179 VanDerWaalsContact C-N 3.34Å; E177-A180 PolarHBondContact O-N 2.83Å; E177-A181 VanDerWaalsContact O-CB 3.32Å; E177-A181 WeakPolarHBondContact O-CB 3.32Å; E177-A181 PolarHBondContact O-N 2.87Å
178A55.5Low51.6Low44 Ų4499.5 Ų99.536%0.36463%0.632SS.*Hα-helixtrans-64.4-39.1169.500000111.6S174 A181 A182S174-A178 PolarHBondContact O-N 3.48Å; A178-A181 PolarHBondContact O-N 2.84Å; A178-A182 VanDerWaalsContact O-CB 3.22Å; A178-A182 WeakPolarHBondContact O-CB 3.19Å; A178-A182 PolarHBondContact O-N 3.49Å
179Q53.8Low51.4Low142 Ų142101.7 Ų101.766%0.66463%0.626SS**Hα-helixtrans-70-35.1175.4-166.1164.90.200112P175 E177 A183P175-Q179 WeakPolarHBondContact O-CB 3.48Å; P175-Q179 PolarHBondContact O-N 3.42Å; P175-Q179 VanDerWaalsContact O-N 3.14Å; E177-Q179 VanDerWaalsContact C-N 3.34Å; Q179-A183 WeakPolarHBondContact O-CB 3.27Å; Q179-A183 PolarHBondContact O-N 2.89Å
180A57Low52.1Low59 Ų5998.7 Ų98.749%0.48862%0.618SS.*Hα-helixtrans-69.7-39.317300000112.8L176 E177 A183 A184L176-A180 PolarHBondContact O-N 3.06Å; E177-A180 PolarHBondContact O-N 2.83Å; A180-A183 PolarHBondContact O-N 3.05Å; A180-A184 VanDerWaalsContact O-CB 3.25Å; A180-A184 WeakPolarHBondContact O-CB 3.24Å; A180-A184 PolarHBondContact O-N 2.86Å
181A55.7Low52.7Low59 Ų5997.8 Ų97.849%0.48861%0.605SS.*Hα-helixtrans-70.9-37.1175.800000112.2E177 A178 A184 A185E177-A181 VanDerWaalsContact O-CB 3.32Å; E177-A181 WeakPolarHBondContact O-CB 3.32Å; E177-A181 PolarHBondContact O-N 2.87Å; A178-A181 PolarHBondContact O-N 2.84Å; A181-A184 PolarHBondContact O-N 2.98Å; A181-A185 VanDerWaalsContact O-CB 3.27Å; A181-A185 WeakPolarHBondContact O-CB 3.22Å; A181-A185 PolarHBondContact O-N 2.9Å
182A54.6Low52.9Low63 Ų6395.6 Ų95.652%0.52161%0.607SS.*Hα-helixtrans-67.7-38.317200000111.7A178 A186A178-A182 VanDerWaalsContact O-CB 3.22Å; A178-A182 WeakPolarHBondContact O-CB 3.19Å; A178-A182 PolarHBondContact O-N 3.49Å; A182-A186 VanDerWaalsContact O-CB 3.24Å; A182-A186 WeakPolarHBondContact O-CB 3.21Å; A182-A186 PolarHBondContact O-N 2.8Å
183A53.6Low53.2Low57 Ų5795.3 Ų95.347%0.47160%0.596SS.*Hα-helixtrans-68.5-36.8172.700000112.4Q179 A180 A186 A187Q179-A183 WeakPolarHBondContact O-CB 3.27Å; Q179-A183 PolarHBondContact O-N 2.89Å; A180-A183 PolarHBondContact O-N 3.05Å; A183-A186 PolarHBondContact O-N 3.14Å; A183-A187 WeakPolarHBondContact O-CB 3.25Å; A183-A187 PolarHBondContact O-N 3.48Å
184A54.6Low53.4Low58 Ų5895.1 Ų95.148%0.47960%0.597SS.*Hα-helixtrans-71.7-36175.300000112.4A180 A181 A187 A188A180-A184 VanDerWaalsContact O-CB 3.25Å; A180-A184 WeakPolarHBondContact O-CB 3.24Å; A180-A184 PolarHBondContact O-N 2.86Å; A181-A184 PolarHBondContact O-N 2.98Å; A184-A187 PolarHBondContact O-N 3.39Å; A184-A188 VanDerWaalsContact O-CB 3.24Å; A184-A188 WeakPolarHBondContact O-CB 3.24Å; A184-A188 PolarHBondContact O-N 2.8Å
185A52.5Low53.2Low64 Ų6493.9 Ų93.953%0.52959%0.591SS.*Hα-helixtrans-70.4-36.6172.800000111.9A181 A188 Y189A181-A185 VanDerWaalsContact O-CB 3.27Å; A181-A185 WeakPolarHBondContact O-CB 3.22Å; A181-A185 PolarHBondContact O-N 2.9Å; A185-A188 PolarHBondContact O-N 2.83Å; A185-Y189 PolarHBondContact O-N 3.43Å
186A51.4Low52.9Low71 Ų7195.8 Ų95.859%0.58759%0.591SS**Hα-helixtrans-69.1-32.9171.300000112.3A182 A183A182-A186 VanDerWaalsContact O-CB 3.24Å; A182-A186 WeakPolarHBondContact O-CB 3.21Å; A182-A186 PolarHBondContact O-N 2.8Å; A183-A186 PolarHBondContact O-N 3.14Å
187A51.4Low52.5Low72 Ų7292.6 Ų92.660%0.59558%0.584SS**Hα-helixtrans-76.7-28.5174.800000113.1A183 A184A183-A187 WeakPolarHBondContact O-CB 3.25Å; A183-A187 PolarHBondContact O-N 3.48Å; A184-A187 PolarHBondContact O-N 3.39Å
188A52.9Low52.2Low84 Ų8493.1 Ų93.169%0.69459%0.587SS**Hα-helixtrans-82.9-20.317600000113A184 A185 V190A184-A188 VanDerWaalsContact O-CB 3.24Å; A184-A188 WeakPolarHBondContact O-CB 3.24Å; A184-A188 PolarHBondContact O-N 2.8Å; A185-A188 PolarHBondContact O-N 2.83Å; A188-V190 PolarHBondContact O-N 3.13Å; A188-V190 VanDerWaalsContact O-N 3.13Å
189Y44.4Very low52Low191 Ų19196.5 Ų96.575%0.74960%0.595SS**  trans-84.566.3163.5-165.3-98.2000109.4A185 P191A185-Y189 PolarHBondContact O-N 3.43Å; Y189-P191 WeakPolarHBondContact O-CD 3.48Å
190V54.7Low52Low104 Ų10496.1 Ų96.163%0.6359%0.593SS**  trans-60.2124.8163.1178.10000106.5A188 M192A188-V190 PolarHBondContact O-N 3.13Å; A188-V190 VanDerWaalsContact O-N 3.13Å; V190-M192 VanDerWaalsContact C-N 3.27Å; V190-M192 PolarHBondContact O-N 2.8Å
191P53.3Low52Low69 Ų6999.2 Ų99.245%0.44860%0.597SS.*  trans-6795.4172.229.1-31.5000107.1Y189 A193 Q194Y189-P191 WeakPolarHBondContact O-CD 3.48Å; P191-A193 PolarHBondContact O-N 2.78Å; P191-Q194 PolarHBondContact O-N 3.15Å; P191-Q194 VanDerWaalsContact O-N 3.15Å
192M47.8Very low52.2Low177 Ų177101.5 Ų101.587%0.87260%0.6SS**THydrogen-bonded Turntrans-5911.6165.9-169.173.8178.500112V190V190-M192 VanDerWaalsContact C-N 3.27Å; V190-M192 PolarHBondContact O-N 2.8Å
193A51.4Low52.6Low84 Ų84103.9 Ų103.969%0.69460%0.604SS**THydrogen-bonded Turntrans-106.9-10.9177.800000113.5P191P191-A193 PolarHBondContact O-N 2.78Å
194Q50.3Low53Low149 Ų149107.3 Ų107.370%0.69661%0.614SS**SBendtrans-97.2-7.4177.9-146.7169-48.800113.6P191 Q196P191-Q194 PolarHBondContact O-N 3.15Å; P191-Q194 VanDerWaalsContact O-N 3.15Å; Q194-Q196 VanDerWaalsContact C-N 3.28Å; Q194-Q196 PolarHBondContact O-N 2.79Å
195A48.5Very low53.3Low54 Ų54109 Ų10945%0.44662%0.615SS.*THydrogen-bonded Turntrans-86.223.6175.300000113.8H199A195-H199 PolarHBondContact O-CD2 3.34Å; A195-H199 PolarHBondContact O-NE2 3.12Å; A195-H199 VanDerWaalsContact O-NE2 3.12Å
196Q52.6Low53.9Low150 Ų150108.8 Ų108.870%0.70161%0.613SS**THydrogen-bonded Turntrans-113.9-24.2167.5-71.6-170.2-70.900112.8Q194 H200Q194-Q196 VanDerWaalsContact C-N 3.28Å; Q194-Q196 PolarHBondContact O-N 2.79Å; Q196-H200 PolarHBondContact O-CD2 3.3Å; Q196-H200 VanDerWaalsContact O-CD2 3.32Å; Q196-H200 PolarHBondContact O-NE2 3.32Å
197A50.4Low54.6Low70 Ų70108.3 Ų108.358%0.57961%0.609SS**THydrogen-bonded Turntrans-76.8-26.9-179.800000114
198Q49.4Very low55.3Low135 Ų135111.1 Ų111.163%0.63161%0.613SS**SBendtrans-83.6-15177.8-67.7-73.3-62.600113.2H200 L202Q198-H200 VanDerWaalsContact C-N 3.32Å; Q198-H200 PolarHBondContact O-N 2.97Å; Q198-L202 PolarHBondContact O-N 3.47Å
199H50.9Low55.8Low115 Ų115111 Ų11153%0.53261%0.607SS.*Hα-helixtrans-74.5-21.9179.4-75-96.4000112.6A195 N203A195-H199 PolarHBondContact O-CD2 3.34Å; A195-H199 PolarHBondContact O-NE2 3.12Å; A195-H199 VanDerWaalsContact O-NE2 3.12Å; H199-N203 WeakPolarHBondContact O-CB 3Å; H199-N203 PolarHBondContact O-N 3.45Å
200H55.2Low56.5Low133 Ų133103.9 Ų103.962%0.61659%0.592SS**Hα-helixtrans-71.6-34.3178.4-57.1-64.3000112.6Q196 Q198 L204Q196-H200 PolarHBondContact O-CD2 3.3Å; Q196-H200 VanDerWaalsContact O-CD2 3.32Å; Q196-H200 PolarHBondContact O-NE2 3.32Å; Q198-H200 VanDerWaalsContact C-N 3.32Å; Q198-H200 PolarHBondContact O-N 2.97Å; H200-L204 WeakPolarHBondContact O-CG 3.47Å; H200-L204 PolarHBondContact O-N 3.13Å
201H55.5Low56.5Low124 Ų124102.1 Ų102.157%0.57459%0.588SS**Hα-helixtrans-78.5-40.1178.5-170-94.2000112.3L204 L205H201-L204 PolarHBondContact O-N 3.47Å; H201-L205 PolarHBondContact O-N 3.24Å; H201-L205 VanDerWaalsContact O-N 3.13Å
202L60.4Low56.5Low107 Ų107102.5 Ų102.556%0.5660%0.597SS**Hα-helixtrans-69.8-32.4175.4-65.1176.1000112.2Q198 L205 A206Q198-L202 PolarHBondContact O-N 3.47Å; L202-L205 PolarHBondContact O-N 2.94Å; L202-A206 VanDerWaalsContact O-CB 3.29Å; L202-A206 WeakPolarHBondContact O-CB 3.34Å; L202-A206 PolarHBondContact O-N 3.49Å
203N63.2Low56.8Low113 Ų113104.5 Ų104.560%0.60460%0.595SS**Hα-helixtrans-73.2-32.3176.6-160.225.1000112.4H199 A207H199-N203 WeakPolarHBondContact O-CB 3Å; H199-N203 PolarHBondContact O-N 3.45Å; N203-A207 WeakPolarHBondContact O-CB 3.27Å; N203-A207 PolarHBondContact O-N 2.97Å
204L62.8Low56.9Low130 Ų130111.3 Ų111.368%0.68160%0.603SS**Hα-helixtrans-69.9-39.4170.8-76.3-176.8000112.7H200 H201 A207 L208H200-L204 WeakPolarHBondContact O-CG 3.47Å; H200-L204 PolarHBondContact O-N 3.13Å; H201-L204 PolarHBondContact O-N 3.47Å; L204-A207 PolarHBondContact O-N 3.48Å; L204-L208 PolarHBondContact O-N 3.4Å
205L59.8Low57.1Low94 Ų94108.3 Ų108.349%0.49260%0.603SS.*Hα-helixtrans-66.8-36.4173.4-77.1167.9000112.3H201 L202 L208 S209H201-L205 PolarHBondContact O-N 3.24Å; H201-L205 VanDerWaalsContact O-N 3.13Å; L202-L205 PolarHBondContact O-N 2.94Å; L205-L208 PolarHBondContact O-N 2.91Å; L205-S209 VanDerWaalsContact O-CB 3.27Å; L205-S209 WeakPolarHBondContact O-CB 3.29Å; L205-S209 PolarHBondContact O-N 2.94Å
206A65Low57.5Low59 Ų59114.3 Ų114.349%0.48862%0.622SS.*Hα-helixtrans-68.6-37.917400000112.5L202 S209 G210L202-A206 VanDerWaalsContact O-CB 3.29Å; L202-A206 WeakPolarHBondContact O-CB 3.34Å; L202-A206 PolarHBondContact O-N 3.49Å; A206-S209 PolarHBondContact O-N 3.49Å; A206-G210 PolarHBondContact O-N 3.01Å
207A66.5Low57.6Low60 Ų60116 Ų11650%0.49663%0.63SS.*Hα-helixtrans-66.4-37.7174.300000112.4N203 L204 A211N203-A207 WeakPolarHBondContact O-CB 3.27Å; N203-A207 PolarHBondContact O-N 2.97Å; L204-A207 PolarHBondContact O-N 3.48Å; A207-A211 PolarHBondContact O-N 3.21Å
208L65.9Low57.7Low132 Ų132121.5 Ų121.569%0.69164%0.643SS**Hα-helixtrans-72.1-38.2175.9-145.183.4000112.1L204 L205 A211 A212L204-L208 PolarHBondContact O-N 3.4Å; L205-L208 PolarHBondContact O-N 2.91Å; L208-A211 PolarHBondContact O-N 3.39Å; L208-A212 PolarHBondContact O-N 3.19Å
209S64.3Low57.9Low81 Ų81121.5 Ų121.557%0.56665%0.653SS**Hα-helixtrans-68.5-34.2176.6-175.30000112.6L205 A206L205-S209 VanDerWaalsContact O-CB 3.27Å; L205-S209 WeakPolarHBondContact O-CB 3.29Å; L205-S209 PolarHBondContact O-N 2.94Å; A206-S209 PolarHBondContact O-N 3.49Å
210G57.8Low57.8Low42 Ų42131.3 Ų131.343%0.43369%0.685SS.*Hα-helixtrans-72.1-32.1173.400000113.9A206 R213A206-G210 PolarHBondContact O-N 3.01Å; G210-R213 PolarHBondContact O-N 3.48Å
211A55.5Low58Low66 Ų66131.2 Ų131.255%0.54569%0.689SS.*Hα-helixtrans-71.5-35.5176.600000112.5A207 L208 R213 R214A207-A211 PolarHBondContact O-N 3.21Å; L208-A211 PolarHBondContact O-N 3.39Å; A211-R213 PolarHBondContact O-N 3.26Å; A211-R214 PolarHBondContact O-N 3.29Å
212A53.8Low58.1Low77 Ų77131.6 Ų131.664%0.63670%0.695SS**Hα-helixtrans-67.6-19.8176.600000113.7L208L208-A212 PolarHBondContact O-N 3.19Å
213R54.5Low58Low219 Ų219132.9 Ų132.983%0.82670%0.702SS**THydrogen-bonded Turntrans-87.2-7.2177.3-80.4-96-178.5174.9-2.6113.9G210 A211G210-R213 PolarHBondContact O-N 3.48Å; A211-R213 PolarHBondContact O-N 3.26Å
214R52.5Low57.7Low228 Ų228134.1 Ų134.186%0.8671%0.708SS**SBendtrans-99.95.8-179.6-94.6-164.5175.7131-0.1115.2A211A211-R214 PolarHBondContact O-N 3.29Å
215A53.9Low57.4Low85 Ų85134.4 Ų134.470%0.70271%0.709SS**SBendtrans-100.44.7-178.500000114.9
216E57.6Low57.2Low180 Ų180137.1 Ų137.184%0.84172%0.724SS**SBendtrans-116.19-175.8-82.7-92143.300113.7
217E55.3Low56.6Low186 Ų186142.6 Ų142.687%0.86974%0.741SS**SBendtrans-127.348.8-178.6-157.9170.2167.500111.4
218E52.4Low55.9Low185 Ų185149 Ų14986%0.86476%0.76SS**SBendtrans-141.847.8170.3-163.1163.5134.500110.7
219T53.6Low55Low135 Ų135150.4 Ų150.483%0.82877%0.765SS**  trans-15368.1169.352.60000110.8
220R49.3Very low54.2Low321 Ų321156.7 Ų156.7100%1.21178%0.783SS**  trans-162.90154.2-150.7172.1175.1-162.2-2.9113

Retrieved 220 of 220 residues in 229.3 ms (Link to these results)