A0A087XMQ1_POEFO Loading...

Lysosomal membrane ascorbate-dependent ferrireductase CYB561A3

Transmembrane reductase that uses ascorbate as an electron donor in the cytoplasm and transfers electrons across membranes to reduce iron cations Fe(3+) into Fe(2+) in the lumen of the late endosome and lysosome. Reduced iron can then be extruded from the late endosome and lysosome to the cytoplasm by divalent metal-specific transporters. It is therefore most probably involved in endosomal and lysosomal cellular iron homeostasis.

AlphaFold DB , UniProt , Accession A0A087XMQ1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 290 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	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
1	M	38.4	Very low	33.5	Very low	235 Å²	235	159.4 Å²	159.4	100%	1.158	88%	0.875	S	S	*	*				0	116.6	0	-106	160.9	161.7	0	0	107.6
2	E	37.2	Very low	33.6	Very low	193 Å²	193	155.5 Å²	155.5	90%	0.902	86%	0.864	S	S	*	*			trans	61.2	136.3	155.6	-70.8	170.4	133.5	0	0	123.3
3	R	29.9	Very low	33.3	Very low	227 Å²	227	149.8 Å²	149.8	86%	0.857	86%	0.862	S	S	*	*			trans	-97.9	166.9	-178.8	-82.6	-176.8	-176.5	176.1	1.1	110.5
4	N	31.9	Very low	33.1	Very low	159 Å²	159	147.5 Å²	147.5	85%	0.85	86%	0.859	S	S	*	*			trans	85.6	133.4	144.3	-81.2	4.1	0	0	0	119.1
5	G	31.6	Very low	33	Very low	71 Å²	71	149.9 Å²	149.9	73%	0.732	86%	0.856	S	S	*	*			trans	152.5	61.7	154	0	0	0	0	0	115.4	Q7	G5-Q7 PolarHBondContact O-N 2.85Å
6	T	31.8	Very low	32.9	Very low	150 Å²	150	148.2 Å²	148.2	92%	0.92	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-63.4	118.6	163.7	9.8	0	0	0	0	109.8
7	Q	33.6	Very low	32.9	Very low	191 Å²	191	152.2 Å²	152.2	89%	0.893	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-102	117	169.2	-83.4	177.4	-4.2	0	0	109.6	G5	G5-Q7 PolarHBondContact O-N 2.85Å
8	S	33	Very low	33.1	Very low	110 Å²	110	151.4 Å²	151.4	77%	0.769	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-84.6	141.5	163.7	-63.8	0	0	0	0	109.4
9	P	38	Very low	33	Very low	127 Å²	127	153.3 Å²	153.3	83%	0.825	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-83.4	142.8	171.7	31.2	-30.7	0	0	0	112
10	D	31.4	Very low	33.1	Very low	167 Å²	167	154.7 Å²	154.7	89%	0.893	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-60.3	147.1	-176.4	-72.7	-54.3	0	0	0	115.4
11	C	31.4	Very low	33.1	Very low	123 Å²	123	159.1 Å²	159.1	83%	0.831	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-69.2	155	175.1	-83.7	0	0	0	0	114
12	P	35.5	Very low	32.6	Very low	113 Å²	113	157.6 Å²	157.6	73%	0.734	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-79	154.4	173.2	27.5	-22.2	0	0	0	113.2	S14	P12-S14 PolarHBondContact O-N 3.34Å
13	G	29.5	Very low	32.6	Very low	82 Å²	82	153.7 Å²	153.7	85%	0.845	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-52	127.6	-174.9	0	0	0	0	0	114.8
14	S	30.6	Very low	32.6	Very low	117 Å²	117	151.4 Å²	151.4	82%	0.818	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-94.3	134.9	177	-64.2	0	0	0	0	111.3	P12	P12-S14 PolarHBondContact O-N 3.34Å
15	F	31	Very low	32.6	Very low	184 Å²	184	150.4 Å²	150.4	81%	0.807	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-53.4	144.5	166.6	-77.6	-103.2	0	0	0	111.7	Y17	F15-Y17 PolarHBondContact O-N 3.43Å; F15-Y17 VanDerWaalsContact O-N 3.1Å
16	P	31.8	Very low	32.6	Very low	122 Å²	122	151.8 Å²	151.8	79%	0.792	83%	0.834	S	S	*	*			trans	-76	104.8	175.4	28.6	-30.3	0	0	0	110.7	V18	P16-V18 PolarHBondContact O-N 2.99Å
17	Y	32.9	Very low	32.4	Very low	216 Å²	216	152.7 Å²	152.7	85%	0.847	83%	0.832	S	S	*	*			trans	-65.1	113.1	161.6	-82.3	-95.6	0	0	0	109.6	F15 F19	F15-Y17 PolarHBondContact O-N 3.43Å; F15-Y17 VanDerWaalsContact O-N 3.1Å; Y17-F19 VanDerWaalsContact C-N 3.35Å; Y17-F19 PolarHBondContact O-N 2.84Å
18	V	35.6	Very low	32.1	Very low	139 Å²	139	148.8 Å²	148.8	84%	0.842	83%	0.826	S	S	*	*			trans	-88.2	76.9	166.6	179.2	0	0	0	0	107.5	P16	P16-V18 PolarHBondContact O-N 2.99Å
19	F	32.6	Very low	32.1	Very low	186 Å²	186	149.1 Å²	149.1	82%	0.816	82%	0.823	S	S	*	*			trans	-163.1	96.3	164.9	-137.4	-95	0	0	0	108.9	Y17	Y17-F19 VanDerWaalsContact C-N 3.35Å; Y17-F19 PolarHBondContact O-N 2.84Å
20	E	35.3	Very low	31.8	Very low	182 Å²	182	150.6 Å²	150.6	85%	0.85	82%	0.824	S	S	*	*			trans	169.2	117.7	139.9	-96.4	-165.5	-178.7	0	0	110.2
21	R	32.2	Very low	31.8	Very low	247 Å²	247	146 Å²	146	93%	0.932	82%	0.816	S	S	*	*			trans	-170.6	94.3	143.8	-107.5	172.9	-155.4	-126.3	3.4	109.3
22	F	28.6	Very low	31.8	Very low	203 Å²	203	149.8 Å²	149.8	89%	0.89	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-89.1	132.2	151.5	-83.9	-87.9	0	0	0	107.7
23	P	36.6	Very low	31.8	Very low	112 Å²	112	152.4 Å²	152.4	73%	0.727	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-94.5	117.3	160.6	22	-8.9	0	0	0	110
24	L	30.7	Very low	31.9	Very low	178 Å²	178	157.5 Å²	157.5	93%	0.932	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-66.6	124.4	155.2	-85	162.4	0	0	0	107.7
25	V	31.4	Very low	32.3	Very low	138 Å²	138	159.2 Å²	159.2	84%	0.836	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-96.7	118.7	173.4	171.1	0	0	0	0	108.5
26	S	30.3	Very low	32.3	Very low	101 Å²	101	155.7 Å²	155.7	71%	0.706	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-70.6	138	167	49.3	0	0	0	0	110.7
27	L	27.6	Very low	32.7	Very low	169 Å²	169	155.3 Å²	155.3	89%	0.885	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-71.9	128.4	173	-157.2	77.5	0	0	0	109.6
28	S	28.7	Very low	32.9	Very low	109 Å²	109	154.3 Å²	154.3	76%	0.762	84%	0.836	S	S	*	*			trans	-145.9	124.6	163.7	-54	0	0	0	0	109
29	T	32.6	Very low	33	Very low	117 Å²	117	157 Å²	157	72%	0.718	84%	0.836	S	S	*	*			trans	-78.1	138	171.2	43	0	0	0	0	109.9
30	D	31.7	Very low	33.4	Very low	158 Å²	158	155.1 Å²	155.1	85%	0.845	83%	0.834	S	S	*	*				168.3	140.8	121.5	-79.4	-18.6	0	0	0	109.6
31	G	31.3	Very low	33.9	Very low	70 Å²	70	155.9 Å²	155.9	72%	0.722	84%	0.835	S	S	*	*			trans	-87.4	166.1	-173.1	0	0	0	0	0	113.7
32	E	30.5	Very low	34.5	Very low	203 Å²	203	150.2 Å²	150.2	95%	0.949	83%	0.828	S	S	*	*			trans	-169.8	143	135.8	-106.4	174.3	159.9	0	0	110
33	N	36.3	Very low	35.8	Very low	168 Å²	168	145.7 Å²	145.7	90%	0.898	81%	0.812	S	S	*	*			trans	-73.3	122.9	178	-92.2	-26.7	0	0	0	110.5
34	E	30.9	Very low	36.7	Very low	189 Å²	189	144.7 Å²	144.7	88%	0.883	81%	0.805	S	S	*	*			trans	-138.4	126.2	153.4	-79.1	-163.7	146.8	0	0	111	S36	E34-S36 PolarHBondContact O-N 3.06Å
35	T	39.4	Very low	38.2	Very low	153 Å²	153	141.7 Å²	141.7	94%	0.939	80%	0.795	S	S	*	*			trans	-76.3	105.3	174.3	29.9	0	0	0	0	109.3
36	S	31.3	Very low	39.8	Very low	110 Å²	110	137.6 Å²	137.6	77%	0.769	78%	0.781	S	S	*	*			trans	-93.7	136.5	176	-168.4	0	0	0	0	111.3	E34	E34-S36 PolarHBondContact O-N 3.06Å
37	P	39.3	Very low	41.5	Very low	114 Å²	114	136.3 Å²	136.3	74%	0.74	77%	0.771	S	S	*	*			trans	-70.3	145.3	-177.9	27.5	-30.9	0	0	0	111.5	K39	P37-K39 PolarHBondContact O-N 3.38Å
38	Q	39	Very low	43.6	Very low	194 Å²	194	133.3 Å²	133.3	91%	0.907	75%	0.754	S	S	*	*			trans	-47.2	96	-178.3	-161.1	173.2	4.8	0	0	111.8	N40	Q38-N40 PolarHBondContact O-N 2.94Å
39	K	37.8	Very low	46.2	Very low	196 Å²	196	137.5 Å²	137.5	85%	0.852	75%	0.753	S	S	*	*			trans	-66.6	108.1	177.4	-155.8	174.5	-168.6	173.6	0	108	P37 K41	P37-K39 PolarHBondContact O-N 3.38Å; K39-K41 PolarHBondContact O-N 3.02Å
40	N	40.1	Very low	48.8	Very low	146 Å²	146	132.9 Å²	132.9	78%	0.781	73%	0.725	S	S	*	*			trans	-44	114.8	169.5	-93.3	-19.1	0	0	0	108.6	Q38 T42	Q38-N40 PolarHBondContact O-N 2.94Å; N40-T42 PolarHBondContact O-N 3.14Å; N40-T42 PolarHBondContact O-OG1 2.87Å
41	K	45.9	Very low	51.4	Low	199 Å²	199	127.5 Å²	127.5	87%	0.865	70%	0.698	S	S	*	*			trans	-77.1	78.2	-173.4	-152.5	178.2	-166.1	175.1	0	107.7	K39 I43	K39-K41 PolarHBondContact O-N 3.02Å; K41-I43 PolarHBondContact O-N 3.43Å
42	T	45.2	Very low	54.3	Low	128 Å²	128	128.3 Å²	128.3	79%	0.785	69%	0.688	S	S	*	*			trans	-58.7	106.5	170.8	-33.3	0	0	0	0	106.8	N40 P44	N40-T42 PolarHBondContact O-N 3.14Å; N40-T42 PolarHBondContact O-OG1 2.87Å; T42-P44 WeakPolarHBondContact O-CD 3.46Å
43	I	54.4	Low	57.3	Low	107 Å²	107	121.5 Å²	121.5	55%	0.549	66%	0.661	S	S	.	*			trans	-59.7	124.3	178.4	-61.2	-179.1	0	0	0	106.6	K41 T45 M48	K41-I43 PolarHBondContact O-N 3.43Å; I43-T45 PolarHBondContact O-N 3.02Å; I43-T45 VanDerWaalsContact O-N 3.14Å; I43-M48 HydrophobicContact CG2-CG 4.03Å
44	P	56.8	Low	60.1	Low	91 Å²	91	113.5 Å²	113.5	59%	0.591	62%	0.618	S	S	*	*			trans	-58.6	123.8	-178.2	-19.8	29.3	0	0	0	109.4	T42 G46 C47	T42-P44 WeakPolarHBondContact O-CD 3.46Å; P44-G46 PolarHBondContact O-N 3.41Å; P44-C47 WeakPolarHBondContact O-CB 3.32Å; P44-C47 PolarHBondContact O-N 3.27Å
45	T	61.5	Low	63.2	Low	116 Å²	116	108.1 Å²	108.1	71%	0.712	59%	0.59	S	S	*	*	H	α-helix	trans	-52.5	-28.5	179.7	45	0	0	0	0	112.9	I43 R49	I43-T45 PolarHBondContact O-N 3.02Å; I43-T45 VanDerWaalsContact O-N 3.14Å; T45-R49 PolarHBondContact O-N 3.37Å
46	G	64.8	Low	65.9	Low	52 Å²	52	106.1 Å²	106.1	54%	0.536	57%	0.573	S	S	.	*	H	α-helix	trans	-65.5	-32.3	173.6	0	0	0	0	0	115	P44 S50	P44-G46 PolarHBondContact O-N 3.41Å; G46-S50 PolarHBondContact O-N 3.17Å
47	C	66.2	Low	69	Low	74 Å²	74	102.1 Å²	102.1	50%	0.5	55%	0.545	S	S	.	.	H	α-helix	trans	-68	-46.9	177.7	-175.5	0	0	0	0	110.7	P44 R49 S50 T51	P44-C47 WeakPolarHBondContact O-CB 3.32Å; P44-C47 PolarHBondContact O-N 3.27Å; C47-R49 PolarHBondContact O-N 3.09Å; C47-S50 PolarHBondContact O-N 3.35Å; C47-T51 PolarHBondContact O-N 3.22Å; C47-T51 VanDerWaalsContact O-N 3.15Å; C47-T51 PolarHBondContact O-OG1 3.15Å
48	M	72.2	Confident	71.8	Confident	106 Å²	106	99.6 Å²	99.6	52%	0.522	52%	0.521	S	S	.	.	H	α-helix	trans	-62.9	-41.9	179.3	-58.9	-165.1	-41.9	0	0	112.2	I43 S50 T51 V52	I43-M48 HydrophobicContact CG2-CG 4.03Å; M48-S50 VanDerWaalsContact C-N 3.32Å; M48-S50 PolarHBondContact O-N 3.28Å; M48-T51 PolarHBondContact O-N 2.72Å; M48-V52 WeakPolarHBondContact O-CG2 3.37Å; M48-V52 PolarHBondContact O-N 3.5Å
49	R	82.9	Confident	74.6	Confident	197 Å²	197	95.6 Å²	95.6	74%	0.743	51%	0.506	S	S	*	.	H	α-helix	trans	-62.3	-38.2	178.6	-170.6	176	177.5	-179.5	-0.3	112.2	T45 C47 T53	T45-R49 PolarHBondContact O-N 3.37Å; C47-R49 PolarHBondContact O-N 3.09Å; R49-T53 WeakPolarHBondContact O-CB 3.45Å; R49-T53 PolarHBondContact O-N 3.15Å; R49-T53 VanDerWaalsContact O-N 3.09Å; R49-T53 PolarHBondContact O-OG1 3.47Å
50	S	86.6	Confident	77.5	Confident	19 Å²	19	90.3 Å²	90.3	13%	0.133	49%	0.486	C	S	.	.	H	α-helix	trans	-69	-41.6	178.2	-169.1	0	0	0	0	112.2	G46 C47 M48 T53 F54 Q269 W270	G46-S50 PolarHBondContact O-N 3.17Å; C47-S50 PolarHBondContact O-N 3.35Å; M48-S50 VanDerWaalsContact C-N 3.32Å; M48-S50 PolarHBondContact O-N 3.28Å; S50-T53 PolarHBondContact O-N 3.32Å; S50-F54 PolarHBondContact O-N 3.37Å; S50-Q269 PolarHBondContact OG-OE1 2.95Å; S50-W270 PolarHBondContact O-NE1 3.12Å; S50-W270 PolarHBondContact OG-NE1 3.3Å; S50-W270 VanDerWaalsContact OG-NE1 3.15Å
51	T	87.9	Confident	80.3	Confident	46 Å²	46	83.3 Å²	83.3	28%	0.282	45%	0.449	S	S	.	.	H	α-helix	trans	-64.6	-43.5	176.5	-59	0	0	0	0	112.6	C47 M48 T53 F54 Y55	C47-T51 PolarHBondContact O-N 3.22Å; C47-T51 VanDerWaalsContact O-N 3.15Å; C47-T51 PolarHBondContact O-OG1 3.15Å; M48-T51 PolarHBondContact O-N 2.72Å; T51-T53 VanDerWaalsContact C-N 3.35Å; T51-T53 PolarHBondContact O-N 3.31Å; T51-F54 WeakPolarHBondContact O-CB 3.42Å; T51-F54 PolarHBondContact O-N 2.95Å; T51-Y55 HydrophobicContact CG2-CD2 3.89Å; T51-Y55 HydrophobicContact CG2-CE2 3.39Å; T51-Y55 WeakPolarHBondContact O-CD2 2.88Å; T51-Y55 PolarHBondContact O-N 3.27Å; T51-Y55 VanDerWaalsContact O-N 3.12Å
52	V	91.4	Very high	82.8	Confident	86 Å²	86	76.8 Å²	76.8	52%	0.521	42%	0.423	S	S	.	.	H	α-helix	trans	-61.6	-45.3	175.2	172.6	0	0	0	0	110.7	M48 F54 Y55 L56	M48-V52 WeakPolarHBondContact O-CG2 3.37Å; M48-V52 PolarHBondContact O-N 3.5Å; V52-F54 VanDerWaalsContact C-N 3.3Å; V52-F54 PolarHBondContact O-N 3.28Å; V52-Y55 PolarHBondContact O-N 2.8Å; V52-Y55 VanDerWaalsContact O-N 3.17Å; V52-L56 HydrophobicContact CG1-CD1 4.18Å; V52-L56 HydrophobicContact CG1-CG 4.45Å; V52-L56 WeakPolarHBondContact O-CG 3.37Å; V52-L56 PolarHBondContact O-N 2.81Å
53	T	93.9	Very high	85.3	Confident	60 Å²	60	73.3 Å²	73.3	37%	0.368	41%	0.407	S	S	.	.	H	α-helix	trans	-60	-41.1	177.9	-53.3	0	0	0	0	111.4	R49 S50 T51 L56 C57 W270	R49-T53 WeakPolarHBondContact O-CB 3.45Å; R49-T53 PolarHBondContact O-N 3.15Å; R49-T53 VanDerWaalsContact O-N 3.09Å; R49-T53 PolarHBondContact O-OG1 3.47Å; S50-T53 PolarHBondContact O-N 3.32Å; T51-T53 VanDerWaalsContact C-N 3.35Å; T51-T53 PolarHBondContact O-N 3.31Å; T53-L56 PolarHBondContact O-N 3.39Å; T53-C57 PolarHBondContact O-N 3.44Å; T53-C57 PolarHBondContact O-SG 3.1Å; T53-W270 HydrophobicContact CG2-CH2 4.29Å; T53-W270 HydrophobicContact CG2-CZ2 3.9Å
54	F	94.9	Very high	87.4	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-57.2	-50.9	173.9	172.3	-91.8	0	0	0	111.6	S50 T51 V52 L56 C57 Y58 R115 V116 P117 I264 W270	S50-F54 PolarHBondContact O-N 3.37Å; T51-F54 WeakPolarHBondContact O-CB 3.42Å; T51-F54 PolarHBondContact O-N 2.95Å; V52-F54 VanDerWaalsContact C-N 3.3Å; V52-F54 PolarHBondContact O-N 3.28Å; F54-L56 VanDerWaalsContact C-N 3.32Å; F54-L56 PolarHBondContact O-N 3.24Å; F54-C57 PolarHBondContact O-N 3.01Å; F54-Y58 HydrophobicContact CE1-CG 4.27Å; F54-Y58 HydrophobicContact CZ-CD2 4.29Å; F54-Y58 HydrophobicContact CZ-CG 4.33Å; F54-Y58 WeakPolarHBondContact O-CB 3.44Å; F54-Y58 PolarHBondContact O-N 3.39Å; F54-R115 HydrophobicContact CE2-CB 3.6Å; F54-R115 WeakPolarHBondContact CE2-O 3.29Å; F54-R115 HydrophobicContact CZ-CB 4.1Å; F54-R115 WeakPolarHBondContact CZ-O 3.48Å; F54-V116 HydrophobicContact CE1-CB 4.4Å; F54-V116 HydrophobicContact CE1-CG2 4.28Å; F54-V116 HydrophobicContact CZ-CB 4.35Å; F54-V116 HydrophobicContact CZ-CG2 3.99Å; F54-P117 HydrophobicContact CD1-CG 3.96Å; F54-P117 HydrophobicContact CE1-CG 4.37Å; F54-P117 HydrophobicContact CG-CG 4.31Å; F54-I264 HydrophobicContact CE2-CG2 3.88Å; F54-W270 HydrophobicContact CB-CD2 4.03Å; F54-W270 HydrophobicContact CB-CG 4.19Å; F54-W270 HydrophobicContact CB-CZ2 4.24Å; F54-W270 HydrophobicContact CD2-CB 3.94Å; F54-W270 AromaticContact CD2-CD2 3.66Å; F54-W270 HydrophobicContact CD2-CD2 3.66Å; F54-W270 AromaticContact CD2-CE3 3.8Å; F54-W270 HydrophobicContact CD2-CE3 3.8Å; F54-W270 AromaticContact CD2-CG 3.72Å; F54-W270 HydrophobicContact CD2-CG 3.72Å; F54-W270 HydrophobicContact CE2-CB 4.45Å; F54-W270 HydrophobicContact CG-CD2 4.33Å; F54-W270 HydrophobicContact CG-CG 4.35Å
55	Y	95.6	Very high	89.4	Confident	77 Å²	77	65 Å²	65	30%	0.302	36%	0.358	S	S	.	.	H	α-helix	trans	-66.4	-33	-177.7	-71.3	-61.8	0	0	0	112.9	T51 V52 Y58 L59 V116 L118	T51-Y55 HydrophobicContact CG2-CD2 3.89Å; T51-Y55 HydrophobicContact CG2-CE2 3.39Å; T51-Y55 WeakPolarHBondContact O-CD2 2.88Å; T51-Y55 PolarHBondContact O-N 3.27Å; T51-Y55 VanDerWaalsContact O-N 3.12Å; V52-Y55 PolarHBondContact O-N 2.8Å; V52-Y55 VanDerWaalsContact O-N 3.17Å; Y55-Y58 PolarHBondContact O-N 3.41Å; Y55-L59 VanDerWaalsContact O-CB 3.29Å; Y55-L59 WeakPolarHBondContact O-CB 3.13Å; Y55-L59 PolarHBondContact O-N 2.99Å; Y55-V116 HydrophobicContact CE1-CG1 4.48Å; Y55-L118 HydrophobicContact CE1-CD1 3.63Å; Y55-L118 WeakPolarHBondContact OH-CD1 3.49Å; Y55-L118 VanDerWaalsContact OH-CG 3.31Å; Y55-L118 WeakPolarHBondContact OH-CG 3.28Å
56	L	96.6	Very high	91.2	Very high	110 Å²	110	64.8 Å²	64.8	58%	0.576	35%	0.352	S	S	*	.	H	α-helix	trans	-63.5	-46.8	171.7	-68.4	175.3	0	0	0	111.4	V52 T53 F54 Y58 L59 L60	V52-L56 HydrophobicContact CG1-CD1 4.18Å; V52-L56 HydrophobicContact CG1-CG 4.45Å; V52-L56 WeakPolarHBondContact O-CG 3.37Å; V52-L56 PolarHBondContact O-N 2.81Å; T53-L56 PolarHBondContact O-N 3.39Å; F54-L56 VanDerWaalsContact C-N 3.32Å; F54-L56 PolarHBondContact O-N 3.24Å; L56-Y58 VanDerWaalsContact C-N 3.32Å; L56-Y58 PolarHBondContact O-N 2.99Å; L56-L59 PolarHBondContact O-N 2.95Å; L56-L60 WeakPolarHBondContact O-CB 3.31Å; L56-L60 PolarHBondContact O-N 3.14Å
57	C	96.9	Very high	92.8	Very high	27 Å²	27	63.9 Å²	63.9	18%	0.182	34%	0.34	C	S	.	.	H	α-helix	trans	-63.3	-38.2	174.9	-71.2	0	0	0	0	112.1	T53 F54 L60 C61 V260 I264 W270	T53-C57 PolarHBondContact O-N 3.44Å; T53-C57 PolarHBondContact O-SG 3.1Å; F54-C57 PolarHBondContact O-N 3.01Å; C57-L60 PolarHBondContact O-N 3.18Å; C57-C61 WeakPolarHBondContact O-CB 3.34Å; C57-C61 PolarHBondContact O-N 3.1Å; C57-V260 WeakPolarHBondContact O-CG1 3.18Å; C57-I264 HydrophobicContact CB-CD1 4.25Å; C57-I264 HydrophobicContact CB-CG1 4.06Å; C57-W270 HydrophobicContact CB-CH2 4.34Å; C57-W270 HydrophobicContact CB-CZ3 4.46Å
58	Y	97.4	Very high	94.4	Very high	60 Å²	60	60.3 Å²	60.3	24%	0.235	32%	0.316	C	S	.	.	H	α-helix	trans	-68.3	-43.4	178.4	-174.3	-111.2	0	0	0	111.6	F54 Y55 L56 L60 C61 L62 V112 V116	F54-Y58 HydrophobicContact CE1-CG 4.27Å; F54-Y58 HydrophobicContact CZ-CD2 4.29Å; F54-Y58 HydrophobicContact CZ-CG 4.33Å; F54-Y58 WeakPolarHBondContact O-CB 3.44Å; F54-Y58 PolarHBondContact O-N 3.39Å; Y55-Y58 PolarHBondContact O-N 3.41Å; L56-Y58 VanDerWaalsContact C-N 3.32Å; L56-Y58 PolarHBondContact O-N 2.99Å; Y58-L60 VanDerWaalsContact C-N 3.34Å; Y58-L60 PolarHBondContact O-N 3.43Å; Y58-C61 VanDerWaalsContact O-CB 3.27Å; Y58-C61 WeakPolarHBondContact O-CB 3.38Å; Y58-C61 PolarHBondContact O-N 3.38Å; Y58-L62 HydrophobicContact CD1-CD1 4.1Å; Y58-L62 HydrophobicContact CE1-CD1 3.7Å; Y58-L62 HydrophobicContact CE1-CG 4.27Å; Y58-L62 WeakPolarHBondContact O-CG 3.44Å; Y58-L62 PolarHBondContact O-N 3.21Å; Y58-V112 HydrophobicContact CD2-CG2 4.24Å; Y58-V112 HydrophobicContact CE2-CG2 3.93Å; Y58-V116 HydrophobicContact CE2-CG2 4.29Å
59	L	98	Very high	95.7	Very high	111 Å²	111	56.9 Å²	56.9	58%	0.581	30%	0.301	S	S	*	.	H	α-helix	trans	-61.7	-43.3	173.8	-179.8	63.1	0	0	0	111.3	Y55 L56 C61 L62 A63	Y55-L59 VanDerWaalsContact O-CB 3.29Å; Y55-L59 WeakPolarHBondContact O-CB 3.13Å; Y55-L59 PolarHBondContact O-N 2.99Å; L56-L59 PolarHBondContact O-N 2.95Å; L59-C61 VanDerWaalsContact C-N 3.32Å; L59-C61 PolarHBondContact O-N 3.46Å; L59-L62 PolarHBondContact O-N 3.46Å; L59-A63 WeakPolarHBondContact O-CB 3.02Å; L59-A63 PolarHBondContact O-N 2.79Å
60	L	98.4	Very high	96.4	Very high	84 Å²	84	50.8 Å²	50.8	44%	0.44	29%	0.285	S	S	.	.	H	α-helix	trans	-60.4	-42.3	174	179.3	62.4	0	0	0	111.5	L56 C57 Y58 L62 A63 L64 V260	L56-L60 WeakPolarHBondContact O-CB 3.31Å; L56-L60 PolarHBondContact O-N 3.14Å; C57-L60 PolarHBondContact O-N 3.18Å; Y58-L60 VanDerWaalsContact C-N 3.34Å; Y58-L60 PolarHBondContact O-N 3.43Å; L60-L62 PolarHBondContact O-N 3.01Å; L60-A63 PolarHBondContact O-N 3.25Å; L60-L64 HydrophobicContact CD1-CD1 3.93Å; L60-L64 HydrophobicContact CD1-CG 3.98Å; L60-L64 HydrophobicContact CG-CD1 3.85Å; L60-L64 HydrophobicContact CG-CG 4.32Å; L60-L64 WeakPolarHBondContact O-CB 3.4Å; L60-L64 VanDerWaalsContact O-CG 3.27Å; L60-L64 WeakPolarHBondContact O-CG 3.49Å; L60-L64 PolarHBondContact O-N 3.09Å; L60-V260 HydrophobicContact CD2-CG2 3.79Å; L60-V260 HydrophobicContact CG-CG2 4.21Å
61	C	98.4	Very high	97	Very high	0 Å²	0	51 Å²	51	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-57.2	-48.1	174.8	-174.8	0	0	0	0	111.3	C57 Y58 L59 G65 V260 I264	C57-C61 WeakPolarHBondContact O-CB 3.34Å; C57-C61 PolarHBondContact O-N 3.1Å; Y58-C61 VanDerWaalsContact O-CB 3.27Å; Y58-C61 WeakPolarHBondContact O-CB 3.38Å; Y58-C61 PolarHBondContact O-N 3.38Å; L59-C61 VanDerWaalsContact C-N 3.32Å; L59-C61 PolarHBondContact O-N 3.46Å; C61-G65 PolarHBondContact O-N 3.34Å; C61-V260 HydrophobicContact CB-CG1 3.79Å; C61-I264 HydrophobicContact CB-CD1 4.14Å
62	L	98.4	Very high	97.5	Very high	62 Å²	62	48.9 Å²	48.9	33%	0.325	27%	0.273	S	S	.	.	H	α-helix	trans	-63.4	-43.8	178.2	-66.7	177.3	0	0	0	112.4	Y58 L59 L60 G65 L66 Y109	Y58-L62 HydrophobicContact CD1-CD1 4.1Å; Y58-L62 HydrophobicContact CE1-CD1 3.7Å; Y58-L62 HydrophobicContact CE1-CG 4.27Å; Y58-L62 WeakPolarHBondContact O-CG 3.44Å; Y58-L62 PolarHBondContact O-N 3.21Å; L59-L62 PolarHBondContact O-N 3.46Å; L60-L62 PolarHBondContact O-N 3.01Å; L62-G65 PolarHBondContact O-N 3.01Å; L62-L66 WeakPolarHBondContact O-CB 3.27Å; L62-L66 PolarHBondContact O-N 2.72Å; L62-Y109 WeakPolarHBondContact CA-OH 3.37Å; L62-Y109 HydrophobicContact CD2-CD1 4.11Å; L62-Y109 HydrophobicContact CD2-CE1 3.73Å; L62-Y109 HydrophobicContact CD2-CE2 4.26Å; L62-Y109 PolarHBondContact O-OH 3.25Å
63	A	98.7	Very high	97.8	Very high	54 Å²	54	46.8 Å²	46.8	45%	0.446	26%	0.262	S	S	.	.	H	α-helix	trans	-64.9	-44.6	179.2	0	0	0	0	0	111.9	L59 L60 L66 A67	L59-A63 WeakPolarHBondContact O-CB 3.02Å; L59-A63 PolarHBondContact O-N 2.79Å; L60-A63 PolarHBondContact O-N 3.25Å; A63-L66 PolarHBondContact O-N 3.29Å; A63-A67 WeakPolarHBondContact O-CB 3.42Å; A63-A67 PolarHBondContact O-N 3.47Å
64	L	98.7	Very high	98	Very high	23 Å²	23	48.5 Å²	48.5	12%	0.12	27%	0.269	C	S	.	.	H	α-helix	trans	-65	-43.2	177.1	-72.5	172.1	0	0	0	111.8	L60 A67 C68 L253 A256 F257 V260	L60-L64 HydrophobicContact CD1-CD1 3.93Å; L60-L64 HydrophobicContact CD1-CG 3.98Å; L60-L64 HydrophobicContact CG-CD1 3.85Å; L60-L64 HydrophobicContact CG-CG 4.32Å; L60-L64 WeakPolarHBondContact O-CB 3.4Å; L60-L64 VanDerWaalsContact O-CG 3.27Å; L60-L64 WeakPolarHBondContact O-CG 3.49Å; L60-L64 PolarHBondContact O-N 3.09Å; L64-A67 PolarHBondContact O-N 2.91Å; L64-C68 PolarHBondContact O-N 2.9Å; L64-C68 PolarHBondContact O-SG 3.19Å; L64-C68 VanDerWaalsContact O-SG 3.33Å; L64-L253 HydrophobicContact CD2-CD2 3.78Å; L64-A256 HydrophobicContact CD1-CB 4.12Å; L64-A256 HydrophobicContact CD2-CB 4.3Å; L64-F257 HydrophobicContact CB-CB 4.14Å; L64-F257 HydrophobicContact CB-CD2 4.13Å; L64-V260 HydrophobicContact CD1-CG2 3.91Å
65	G	98.8	Very high	98.2	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-64.9	-40.4	177.9	0	0	0	0	0	112.2	C61 L62 C68 V69 Y109	C61-G65 PolarHBondContact O-N 3.34Å; L62-G65 PolarHBondContact O-N 3.01Å; G65-C68 PolarHBondContact O-N 3.48Å; G65-V69 WeakPolarHBondContact O-CG2 3.36Å; G65-V69 PolarHBondContact O-N 3.25Å; G65-V69 VanDerWaalsContact O-N 3.14Å; G65-Y109 VanDerWaalsContact CA-OH 3.3Å; G65-Y109 WeakPolarHBondContact CA-OH 3.5Å
66	L	98.7	Very high	98.3	Very high	112 Å²	112	45 Å²	45	59%	0.586	26%	0.255	S	S	*	.	H	α-helix	trans	-60.6	-45.9	171.6	179.2	63	0	0	0	111.5	L62 A63 C68 V69 V70 Y109	L62-L66 WeakPolarHBondContact O-CB 3.27Å; L62-L66 PolarHBondContact O-N 2.72Å; A63-L66 PolarHBondContact O-N 3.29Å; L66-C68 VanDerWaalsContact C-N 3.35Å; L66-C68 PolarHBondContact O-N 3.16Å; L66-V69 PolarHBondContact O-N 3.26Å; L66-V70 HydrophobicContact CD1-CG2 4.1Å; L66-V70 HydrophobicContact CG-CG2 4.38Å; L66-V70 WeakPolarHBondContact O-CG2 3.27Å; L66-V70 PolarHBondContact O-N 3.46Å; L66-Y109 PolarHBondContact N-OH 3.02Å
67	A	98.8	Very high	98.3	Very high	33 Å²	33	43.1 Å²	43.1	27%	0.273	25%	0.251	S	S	.	.	H	α-helix	trans	-60	-43.2	177.7	0	0	0	0	0	111.9	A63 L64 V69 V70 C71 L253	A63-A67 WeakPolarHBondContact O-CB 3.42Å; A63-A67 PolarHBondContact O-N 3.47Å; L64-A67 PolarHBondContact O-N 2.91Å; A67-V69 PolarHBondContact O-N 3.44Å; A67-V70 PolarHBondContact O-N 3.04Å; A67-C71 VanDerWaalsContact O-CB 3.24Å; A67-C71 WeakPolarHBondContact O-CB 3.39Å; A67-C71 PolarHBondContact O-N 3.26Å; A67-C71 PolarHBondContact O-SG 3.22Å; A67-C71 VanDerWaalsContact O-SG 3.33Å; A67-L253 HydrophobicContact CB-CD1 4.05Å; A67-L253 HydrophobicContact CB-CD2 4.28Å
68	C	98.8	Very high	98.3	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-55.9	-50.1	174.5	-73.8	0	0	0	0	112	L64 G65 L66 C71 V72 V100 V105 L250	L64-C68 PolarHBondContact O-N 2.9Å; L64-C68 PolarHBondContact O-SG 3.19Å; L64-C68 VanDerWaalsContact O-SG 3.33Å; G65-C68 PolarHBondContact O-N 3.48Å; L66-C68 VanDerWaalsContact C-N 3.35Å; L66-C68 PolarHBondContact O-N 3.16Å; C68-C71 PolarHBondContact O-N 3.47Å; C68-V72 WeakPolarHBondContact O-CG1 3.44Å; C68-V72 PolarHBondContact O-N 2.96Å; C68-V100 HydrophobicContact CB-CG1 3.87Å; C68-V105 HydrophobicContact CB-CG2 4.04Å; C68-L250 HydrophobicContact CB-CD1 4.34Å; C68-L250 WeakPolarHBondContact O-CD1 3.39Å
69	V	98.8	Very high	98.2	Very high	34 Å²	34	52 Å²	52	21%	0.206	28%	0.281	C	S	.	.	H	α-helix	trans	-64	-45.7	-179.3	176	0	0	0	0	111	G65 L66 A67 V72 C73 T101 V105	G65-V69 WeakPolarHBondContact O-CG2 3.36Å; G65-V69 PolarHBondContact O-N 3.25Å; G65-V69 VanDerWaalsContact O-N 3.14Å; L66-V69 PolarHBondContact O-N 3.26Å; A67-V69 PolarHBondContact O-N 3.44Å; V69-V72 VanDerWaalsContact O-CG1 3.32Å; V69-V72 WeakPolarHBondContact O-CG1 3.18Å; V69-C73 WeakPolarHBondContact O-CB 3.27Å; V69-C73 PolarHBondContact O-N 3.35Å; V69-C73 PolarHBondContact O-SG 2.87Å; V69-T101 HydrophobicContact CG2-CG2 4.07Å; V69-V105 HydrophobicContact CG2-CB 4.33Å; V69-V105 HydrophobicContact CG2-CG1 4.31Å; V69-V105 HydrophobicContact CG2-CG2 4.13Å
70	V	98.6	Very high	98.1	Very high	68 Å²	68	48.5 Å²	48.5	41%	0.412	26%	0.26	S	S	.	.	H	α-helix	trans	-62.4	-48.1	177.9	171.4	0	0	0	0	110.7	L66 A67 V72 C73 L74	L66-V70 HydrophobicContact CD1-CG2 4.1Å; L66-V70 HydrophobicContact CG-CG2 4.38Å; L66-V70 WeakPolarHBondContact O-CG2 3.27Å; L66-V70 PolarHBondContact O-N 3.46Å; A67-V70 PolarHBondContact O-N 3.04Å; V70-V72 PolarHBondContact O-N 3.49Å; V70-C73 PolarHBondContact O-N 2.83Å; V70-L74 HydrophobicContact CG1-CD1 3.64Å; V70-L74 HydrophobicContact CG1-CG 4.13Å; V70-L74 WeakPolarHBondContact O-CB 3.37Å; V70-L74 VanDerWaalsContact O-CG 3.24Å; V70-L74 WeakPolarHBondContact O-CG 3.39Å; V70-L74 PolarHBondContact O-N 3.37Å
71	C	98.4	Very high	97.9	Very high	24 Å²	24	49.9 Å²	49.9	16%	0.162	27%	0.268	C	S	.	.	H	α-helix	trans	-61.4	-44.7	-179.9	-76.7	0	0	0	0	112.5	A67 C68 L74 W75 L250 L253	A67-C71 VanDerWaalsContact O-CB 3.24Å; A67-C71 WeakPolarHBondContact O-CB 3.39Å; A67-C71 PolarHBondContact O-N 3.26Å; A67-C71 PolarHBondContact O-SG 3.22Å; A67-C71 VanDerWaalsContact O-SG 3.33Å; C68-C71 PolarHBondContact O-N 3.47Å; C71-L74 PolarHBondContact O-N 2.68Å; C71-W75 VanDerWaalsContact O-CB 3.32Å; C71-W75 WeakPolarHBondContact O-CB 3.35Å; C71-W75 PolarHBondContact O-N 3.18Å; C71-L250 HydrophobicContact CB-CB 4.32Å; C71-L250 HydrophobicContact CB-CD1 3.96Å; C71-L253 HydrophobicContact CB-CD1 4.44Å
72	V	98.7	Very high	97.7	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.006	27%	0.274	C	S	.	.	H	α-helix	trans	-67.9	-37.8	179.5	72.5	0	0	0	0	111.9	C68 V69 V70 N76 P96 V97 V100 L250	C68-V72 WeakPolarHBondContact O-CG1 3.44Å; C68-V72 PolarHBondContact O-N 2.96Å; V69-V72 VanDerWaalsContact O-CG1 3.32Å; V69-V72 WeakPolarHBondContact O-CG1 3.18Å; V70-V72 PolarHBondContact O-N 3.49Å; V72-N76 PolarHBondContact O-N 3.42Å; V72-N76 VanDerWaalsContact O-N 3.17Å; V72-N76 PolarHBondContact O-ND2 3.26Å; V72-P96 HydrophobicContact CG2-CB 3.95Å; V72-V97 HydrophobicContact CG1-CG2 4.24Å; V72-V97 HydrophobicContact CG2-CG2 4.12Å; V72-V100 HydrophobicContact CB-CB 4.5Å; V72-V100 HydrophobicContact CB-CG1 4.47Å; V72-V100 HydrophobicContact CG1-CB 4.08Å; V72-V100 HydrophobicContact CG1-CG1 4.01Å; V72-V100 HydrophobicContact CG2-CG2 4.27Å; V72-L250 HydrophobicContact CB-CD1 4.25Å; V72-L250 HydrophobicContact CB-CD2 3.72Å; V72-L250 HydrophobicContact CG2-CD2 3.9Å
73	C	98.4	Very high	97.7	Very high	43 Å²	43	51 Å²	51	29%	0.291	27%	0.273	S	S	.	.	H	α-helix	trans	-66.3	-45.9	175.2	-72.4	0	0	0	0	111.5	V69 V70 N76 S77	V69-C73 WeakPolarHBondContact O-CB 3.27Å; V69-C73 PolarHBondContact O-N 3.35Å; V69-C73 PolarHBondContact O-SG 2.87Å; V70-C73 PolarHBondContact O-N 2.83Å; C73-N76 PolarHBondContact O-N 3.41Å; C73-S77 WeakPolarHBondContact O-CB 3.47Å; C73-S77 PolarHBondContact O-N 2.98Å
74	L	98.1	Very high	97.7	Very high	95 Å²	95	49.6 Å²	49.6	50%	0.497	26%	0.262	S	S	.	.	H	α-helix	trans	-63.1	-42.7	177.4	-73.7	177.3	0	0	0	111.8	V70 C71 N76 S77 R78	V70-L74 HydrophobicContact CG1-CD1 3.64Å; V70-L74 HydrophobicContact CG1-CG 4.13Å; V70-L74 WeakPolarHBondContact O-CB 3.37Å; V70-L74 VanDerWaalsContact O-CG 3.24Å; V70-L74 WeakPolarHBondContact O-CG 3.39Å; V70-L74 PolarHBondContact O-N 3.37Å; C71-L74 PolarHBondContact O-N 2.68Å; L74-N76 PolarHBondContact O-N 2.7Å; L74-S77 PolarHBondContact O-N 3.21Å; L74-R78 WeakPolarHBondContact O-CB 3.37Å; L74-R78 PolarHBondContact O-N 3Å
75	W	98.3	Very high	97.6	Very high	2 Å²	2	54.7 Å²	54.7	1%	0.008	28%	0.28	C	S	.	.	H	α-helix	trans	-57.1	-51.1	177.2	177	30	0	0	0	111.1	C71 W79 I223 K226 L227 E243 L246 L250	C71-W75 VanDerWaalsContact O-CB 3.32Å; C71-W75 WeakPolarHBondContact O-CB 3.35Å; C71-W75 PolarHBondContact O-N 3.18Å; W75-W79 WeakPolarHBondContact O-CB 3.33Å; W75-W79 PolarHBondContact O-N 3.12Å; W75-I223 HydrophobicContact CH2-CG2 4.28Å; W75-I223 HydrophobicContact CZ3-CG1 4.23Å; W75-I223 HydrophobicContact CZ3-CG2 4.36Å; W75-K226 HydrophobicContact CH2-CB 4.06Å; W75-K226 HydrophobicContact CH2-CG 3.93Å; W75-K226 HydrophobicContact CZ2-CG 4.06Å; W75-L227 HydrophobicContact CH2-CD2 4.37Å; W75-L227 HydrophobicContact CH2-CG 4.24Å; W75-L227 HydrophobicContact CZ2-CD2 3.61Å; W75-L227 HydrophobicContact CZ2-CG 3.94Å; W75-E243 PolarHBondContact NE1-OE1 3.1Å; W75-L246 HydrophobicContact CB-CD2 3.83Å; W75-L246 HydrophobicContact CB-CG 4.46Å; W75-L246 HydrophobicContact CG-CD2 4.49Å; W75-L250 HydrophobicContact CE3-CD2 3.97Å; W75-L250 HydrophobicContact CZ3-CD2 4.3Å
76	N	98.1	Very high	97.5	Very high	1 Å²	1	59.6 Å²	59.6	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-71.1	-37.4	-178.4	-74.5	-80.1	0	0	0	112.8	V72 C73 L74 R80 G82 F83 N93 V97	V72-N76 PolarHBondContact O-N 3.42Å; V72-N76 VanDerWaalsContact O-N 3.17Å; V72-N76 PolarHBondContact O-ND2 3.26Å; C73-N76 PolarHBondContact O-N 3.41Å; L74-N76 PolarHBondContact O-N 2.7Å; N76-R80 CarbonylContact O-C 3.4Å; N76-R80 WeakPolarHBondContact O-CA 3.41Å; N76-R80 VanDerWaalsContact O-CB 3.26Å; N76-R80 WeakPolarHBondContact O-CB 3.34Å; N76-R80 PolarHBondContact O-N 2.97Å; N76-R80 VanDerWaalsContact O-N 3.1Å; N76-G82 PolarHBondContact O-N 3.49Å; N76-F83 HydrophobicContact CB-CE1 3.9Å; N76-F83 HydrophobicContact CB-CZ 3.69Å; N76-N93 HydrophobicContact CB-CB 4.06Å; N76-N93 WeakPolarHBondContact OD1-CB 3.29Å; N76-N93 PolarHBondContact OD1-OD1 3.35Å; N76-V97 HydrophobicContact CB-CG2 4.44Å
77	S	96.5	Very high	97.3	Very high	72 Å²	72	54.8 Å²	54.8	50%	0.503	28%	0.284	S	S	.	.	H	α-helix	trans	-68.2	-44.2	177.9	178.6	0	0	0	0	112.5	C73 L74	C73-S77 WeakPolarHBondContact O-CB 3.47Å; C73-S77 PolarHBondContact O-N 2.98Å; L74-S77 PolarHBondContact O-N 3.21Å
78	R	96.4	Very high	97.3	Very high	186 Å²	186	54.4 Å²	54.4	70%	0.702	28%	0.279	S	S	*	.	H	α-helix	trans	-84.2	-34.7	-172.1	179	64.6	178.8	118.7	-6.1	113.6	L74	L74-R78 WeakPolarHBondContact O-CB 3.37Å; L74-R78 PolarHBondContact O-N 3Å
79	W	96	Very high	97.1	Very high	88 Å²	88	57 Å²	57	33%	0.333	30%	0.298	S	S	.	.	H	α-helix	trans	-111.2	-17.4	-174.5	-77.4	-90.6	0	0	0	114.6	W75 A242 E243 L246	W75-W79 WeakPolarHBondContact O-CB 3.33Å; W75-W79 PolarHBondContact O-N 3.12Å; W79-A242 HydrophobicContact CZ2-CB 4.38Å; W79-E243 HydrophobicContact CB-CG 3.95Å; W79-E243 HydrophobicContact CD2-CB 4.22Å; W79-E243 HydrophobicContact CD2-CG 3.86Å; W79-E243 HydrophobicContact CG-CB 4.05Å; W79-E243 HydrophobicContact CG-CG 3.52Å; W79-L246 HydrophobicContact CE3-CD2 3.94Å; W79-L246 HydrophobicContact CH2-CD2 3.9Å; W79-L246 HydrophobicContact CZ3-CD2 3.28Å
80	R	95.3	Very high	97.1	Very high	36 Å²	36	61 Å²	61	14%	0.136	31%	0.309	C	S	.	.	S	Bend	trans	-115.2	20.4	-173.2	-51.1	-71	81.3	126.4	9.7	114.1	N76 G82 N93 E243	N76-R80 CarbonylContact O-C 3.4Å; N76-R80 WeakPolarHBondContact O-CA 3.41Å; N76-R80 VanDerWaalsContact O-CB 3.26Å; N76-R80 WeakPolarHBondContact O-CB 3.34Å; N76-R80 PolarHBondContact O-N 2.97Å; N76-R80 VanDerWaalsContact O-N 3.1Å; R80-G82 PolarHBondContact O-N 2.93Å; R80-N93 VanDerWaalsContact CB-CG 3.5Å; R80-N93 WeakPolarHBondContact CB-ND2 3.25Å; R80-N93 WeakPolarHBondContact CB-OD1 3.49Å; R80-N93 PolarHBondContact O-ND2 2.96Å; R80-E243 IonicContact CZ-OE1 2.55Å; R80-E243 IonicContact CZ-OE2 3.52Å; R80-E243 IonicContact NH1-OE1 3.62Å; R80-E243 PolarHBondContact NH1-OE1 2.76Å; R80-E243 IonicContact NH1-OE2 3.17Å; R80-E243 IonicContact NH2-OE1 3.39Å; R80-E243 PolarHBondContact NH2-OE1 3.25Å; R80-E243 VanDerWaalsContact NH2-OE1 3.17Å; R80-E243 IonicContact NH2-OE2 3.04Å; R80-E243 PolarHBondContact NH2-OE2 3.33Å
81	D	94.4	Very high	97.1	Very high	114 Å²	114	57.9 Å²	57.9	61%	0.61	29%	0.29	S	S	*	.			trans	63.4	22.3	176.6	-50.2	-50.9	0	0	0	114.8	R90	D81-R90 HydrophobicContact CB-CG 4.42Å; D81-R90 WeakPolarHBondContact O-CD 3.41Å; D81-R90 PolarHBondContact O-NE 2.82Å
82	G	95.4	Very high	97.1	Very high	13 Å²	13	58 Å²	58	13%	0.134	29%	0.288	C	S	.	.			trans	81.2	-145.1	173.9	0	0	0	0	0	114.4	N76 R80 N93	N76-G82 PolarHBondContact O-N 3.49Å; R80-G82 PolarHBondContact O-N 2.93Å; G82-N93 PolarHBondContact O-ND2 3.37Å
83	F	98	Very high	97.1	Very high	71 Å²	71	58 Å²	58	31%	0.311	29%	0.288	S	S	.	.			trans	-133.2	142.2	-166	-57.7	-81.2	0	0	0	111.8	N76 N93 W94 V97	N76-F83 HydrophobicContact CB-CE1 3.9Å; N76-F83 HydrophobicContact CB-CZ 3.69Å; F83-N93 HydrophobicContact CD1-CB 3.94Å; F83-N93 HydrophobicContact CE1-CB 3.93Å; F83-W94 HydrophobicContact CB-CZ2 3.81Å; F83-W94 AromaticContact CD1-CD2 3.94Å; F83-W94 HydrophobicContact CD1-CD2 3.94Å; F83-W94 AromaticContact CD1-CE2 3.97Å; F83-W94 HydrophobicContact CD1-CE3 4.3Å; F83-W94 HydrophobicContact CD1-CG 4.26Å; F83-W94 HydrophobicContact CD1-CZ2 4.35Å; F83-W94 HydrophobicContact CG-CZ2 4.17Å; F83-V97 HydrophobicContact CE1-CB 4.45Å; F83-V97 HydrophobicContact CE1-CG2 3.67Å; F83-V97 HydrophobicContact CZ-CG2 3.84Å
84	A	97.8	Very high	97.1	Very high	26 Å²	26	60 Å²	60	22%	0.215	29%	0.289	C	S	.	.			trans	-154.5	172.6	173	0	0	0	0	0	109.5	R90 Q91 W94	A84-R90 HydrophobicContact CB-CB 3.7Å; A84-R90 PolarHBondContact N-O 2.85Å; A84-Q91 WeakPolarHBondContact O-CA 3.35Å; A84-W94 PolarHBondContact O-NE1 3.37Å
85	W	97.9	Very high	97.1	Very high	129 Å²	129	56.4 Å²	56.4	49%	0.489	27%	0.27	S	S	.	.	S	Bend	trans	-132.1	70	174	-160.2	-76.8	0	0	0	109.7	Q91 W94 L144 C147 A148	W85-Q91 VanDerWaalsContact C-OE1 3.27Å; W85-Q91 HydrophobicContact CD2-CG 4.36Å; W85-Q91 HydrophobicContact CE3-CG 4.46Å; W85-W94 AromaticContact CE3-CD1 3.87Å; W85-W94 HydrophobicContact CE3-CG 4.37Å; W85-W94 HydrophobicContact CZ3-CB 4.41Å; W85-W94 HydrophobicContact CZ3-CG 4.33Å; W85-L144 WeakPolarHBondContact CH2-O 3.36Å; W85-C147 HydrophobicContact CH2-CB 4.26Å; W85-C147 HydrophobicContact CZ2-CB 4.05Å; W85-A148 HydrophobicContact CH2-CB 4.07Å; W85-A148 HydrophobicContact CZ3-CB 4.09Å
86	D	96.9	Very high	97.1	Very high	104 Å²	104	57.2 Å²	57.2	56%	0.556	28%	0.275	S	S	*	.	S	Bend	trans	-142.6	12.2	-165.1	65.1	-7.5	0	0	0	115	S88	D86-S88 PolarHBondContact O-N 3.4Å; D86-S88 WeakPolarHBondContact OD1-CB 3.48Å; D86-S88 PolarHBondContact OD1-N 3.21Å; D86-S88 PolarHBondContact OD1-OG 2.72Å; D86-S88 PolarHBondContact OD2-OG 2.84Å
87	G	94.7	Very high	97.1	Very high	11 Å²	11	57.7 Å²	57.7	11%	0.113	28%	0.278	C	S	.	.	S	Bend	trans	76.8	1.7	-175.3	0	0	0	0	0	114.4
88	S	96.9	Very high	97.3	Very high	24 Å²	24	55.1 Å²	55.1	17%	0.168	26%	0.258	C	S	.	.	S	Bend	trans	-80.7	175.6	178.1	77.8	0	0	0	0	112.7	D86 R90 Q91 F92 F152	D86-S88 PolarHBondContact O-N 3.4Å; D86-S88 WeakPolarHBondContact OD1-CB 3.48Å; D86-S88 PolarHBondContact OD1-N 3.21Å; D86-S88 PolarHBondContact OD1-OG 2.72Å; D86-S88 PolarHBondContact OD2-OG 2.84Å; S88-R90 PolarHBondContact O-N 2.87Å; S88-R90 VanDerWaalsContact O-N 3.16Å; S88-R90 WeakPolarHBondContact OG-CB 3.41Å; S88-R90 PolarHBondContact OG-N 3.32Å; S88-R90 VanDerWaalsContact OG-N 3.16Å; S88-Q91 WeakPolarHBondContact O-CB 3.41Å; S88-Q91 PolarHBondContact O-N 3.48Å; S88-F92 PolarHBondContact O-N 2.92Å; S88-F152 VanDerWaalsContact O-CD2 3.25Å; S88-F152 WeakPolarHBondContact O-CD2 3.28Å
89	S	96.4	Very high	97.4	Very high	56 Å²	56	47.1 Å²	47.1	39%	0.392	23%	0.23	S	C	.	.	H	α-helix	trans	-57.5	-25.5	171.2	49.8	0	0	0	0	112.9	Q91 F92 N93	S89-Q91 VanDerWaalsContact C-N 3.31Å; S89-F92 WeakPolarHBondContact O-CB 3.38Å; S89-F92 PolarHBondContact O-N 3.45Å; S89-N93 VanDerWaalsContact O-CG 3.32Å; S89-N93 PolarHBondContact O-N 3.36Å; S89-N93 PolarHBondContact O-ND2 3.37Å; S89-N93 PolarHBondContact O-OD1 3.2Å
90	R	97.9	Very high	97.5	Very high	116 Å²	116	43.2 Å²	43.2	44%	0.438	22%	0.215	S	C	.	.	H	α-helix	trans	-71	-27.5	175.4	-62	-180	-178.4	171.9	-0.5	112.5	D81 A84 S88 N93	D81-R90 HydrophobicContact CB-CG 4.42Å; D81-R90 WeakPolarHBondContact O-CD 3.41Å; D81-R90 PolarHBondContact O-NE 2.82Å; A84-R90 HydrophobicContact CB-CB 3.7Å; A84-R90 PolarHBondContact N-O 2.85Å; S88-R90 PolarHBondContact O-N 2.87Å; S88-R90 VanDerWaalsContact O-N 3.16Å; S88-R90 WeakPolarHBondContact OG-CB 3.41Å; S88-R90 PolarHBondContact OG-N 3.32Å; S88-R90 VanDerWaalsContact OG-N 3.16Å; R90-N93 PolarHBondContact O-N 3Å
91	Q	98.4	Very high	97.7	Very high	4 Å²	4	43 Å²	43	2%	0.019	22%	0.218	C	C	.	.	H	α-helix	trans	-69.7	-41.9	169.7	-175.7	168.1	-16.3	0	0	111.3	A84 W85 S88 S89 N93 W94 A148 D151	A84-Q91 WeakPolarHBondContact O-CA 3.35Å; W85-Q91 VanDerWaalsContact C-OE1 3.27Å; W85-Q91 HydrophobicContact CD2-CG 4.36Å; W85-Q91 HydrophobicContact CE3-CG 4.46Å; S88-Q91 WeakPolarHBondContact O-CB 3.41Å; S88-Q91 PolarHBondContact O-N 3.48Å; S89-Q91 VanDerWaalsContact C-N 3.31Å; Q91-N93 PolarHBondContact O-N 2.98Å; Q91-N93 VanDerWaalsContact O-N 3.15Å; Q91-W94 WeakPolarHBondContact O-CB 3.44Å; Q91-W94 PolarHBondContact O-N 3.11Å; Q91-W94 VanDerWaalsContact O-N 3.07Å; Q91-A148 HydrophobicContact CG-CB 4.22Å; Q91-D151 PolarHBondContact NE2-OD2 3.33Å
92	F	98.3	Very high	97.9	Very high	26 Å²	26	37.5 Å²	37.5	11%	0.114	19%	0.189	C	C	.	.	H	α-helix	trans	-54.4	-36.6	174.6	178.1	-85.9	0	0	0	112.2	S88 S89 W94 H95 P96 V149 F152 K226	S88-F92 PolarHBondContact O-N 2.92Å; S89-F92 WeakPolarHBondContact O-CB 3.38Å; S89-F92 PolarHBondContact O-N 3.45Å; F92-W94 PolarHBondContact O-N 3.12Å; F92-W94 VanDerWaalsContact O-N 3.1Å; F92-H95 WeakPolarHBondContact O-CB 3.44Å; F92-H95 PolarHBondContact O-N 3.22Å; F92-P96 VanDerWaalsContact O-CD 3.23Å; F92-P96 WeakPolarHBondContact O-CD 3.35Å; F92-V149 HydrophobicContact CD2-CB 4.44Å; F92-V149 HydrophobicContact CD2-CG2 3.96Å; F92-V149 HydrophobicContact CE2-CG2 3.77Å; F92-F152 HydrophobicContact CB-CB 4.22Å; F92-F152 HydrophobicContact CB-CD1 3.84Å; F92-F152 HydrophobicContact CB-CD2 4.04Å; F92-F152 HydrophobicContact CB-CE1 4.19Å; F92-F152 HydrophobicContact CB-CE2 4.36Å; F92-F152 HydrophobicContact CB-CG 3.75Å; F92-F152 HydrophobicContact CB-CZ 4.44Å; F92-F152 AromaticContact CD2-CD1 3.54Å; F92-F152 HydrophobicContact CD2-CD1 3.54Å; F92-F152 AromaticContact CD2-CE1 3.84Å; F92-F152 HydrophobicContact CD2-CE1 3.84Å; F92-F152 HydrophobicContact CD2-CG 4.26Å; F92-F152 HydrophobicContact CG-CD1 4.07Å; F92-F152 HydrophobicContact CG-CE1 4.23Å; F92-F152 HydrophobicContact CG-CG 4.47Å; F92-K226 HydrophobicContact CD1-CD 4.39Å; F92-K226 VanDerWaalsContact CD1-NZ 3.27Å; F92-K226 HydrophobicContact CE1-CD 3.57Å; F92-K226 VanDerWaalsContact CE1-CE 3.46Å; F92-K226 HydrophobicContact CE1-CG 4.28Å; F92-K226 VanDerWaalsContact CE1-NZ 3.31Å; F92-K226 HydrophobicContact CZ-CD 4.06Å
93	N	98.4	Very high	98	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-20.7	-178	-62.9	-21.2	0	0	0	113.9	N76 R80 G82 F83 S89 R90 Q91 H95 P96	N76-N93 HydrophobicContact CB-CB 4.06Å; N76-N93 WeakPolarHBondContact OD1-CB 3.29Å; N76-N93 PolarHBondContact OD1-OD1 3.35Å; R80-N93 VanDerWaalsContact CB-CG 3.5Å; R80-N93 WeakPolarHBondContact CB-ND2 3.25Å; R80-N93 WeakPolarHBondContact CB-OD1 3.49Å; R80-N93 PolarHBondContact O-ND2 2.96Å; G82-N93 PolarHBondContact O-ND2 3.37Å; F83-N93 HydrophobicContact CD1-CB 3.94Å; F83-N93 HydrophobicContact CE1-CB 3.93Å; S89-N93 VanDerWaalsContact O-CG 3.32Å; S89-N93 PolarHBondContact O-N 3.36Å; S89-N93 PolarHBondContact O-ND2 3.37Å; S89-N93 PolarHBondContact O-OD1 3.2Å; R90-N93 PolarHBondContact O-N 3Å; Q91-N93 PolarHBondContact O-N 2.98Å; Q91-N93 VanDerWaalsContact O-N 3.15Å; N93-H95 VanDerWaalsContact C-N 3.28Å; N93-H95 PolarHBondContact O-N 3.5Å; N93-P96 WeakPolarHBondContact O-CD 3.23Å; N93-P96 WeakPolarHBondContact O-CG 3.45Å
94	W	98.7	Very high	98	Very high	84 Å²	84	33.8 Å²	33.8	32%	0.318	17%	0.169	S	C	.	.	H	α-helix	trans	-65.8	-31.1	169.8	-77.6	114.5	0	0	0	112.7	F83 A84 W85 Q91 F92 V97 L98 A148	F83-W94 HydrophobicContact CB-CZ2 3.81Å; F83-W94 AromaticContact CD1-CD2 3.94Å; F83-W94 HydrophobicContact CD1-CD2 3.94Å; F83-W94 AromaticContact CD1-CE2 3.97Å; F83-W94 HydrophobicContact CD1-CE3 4.3Å; F83-W94 HydrophobicContact CD1-CG 4.26Å; F83-W94 HydrophobicContact CD1-CZ2 4.35Å; F83-W94 HydrophobicContact CG-CZ2 4.17Å; A84-W94 PolarHBondContact O-NE1 3.37Å; W85-W94 AromaticContact CE3-CD1 3.87Å; W85-W94 HydrophobicContact CE3-CG 4.37Å; W85-W94 HydrophobicContact CZ3-CB 4.41Å; W85-W94 HydrophobicContact CZ3-CG 4.33Å; Q91-W94 WeakPolarHBondContact O-CB 3.44Å; Q91-W94 PolarHBondContact O-N 3.11Å; Q91-W94 VanDerWaalsContact O-N 3.07Å; F92-W94 PolarHBondContact O-N 3.12Å; F92-W94 VanDerWaalsContact O-N 3.1Å; W94-V97 PolarHBondContact O-N 3.33Å; W94-L98 HydrophobicContact CB-CD1 3.99Å; W94-L98 HydrophobicContact CB-CG 4.49Å; W94-L98 HydrophobicContact CE3-CD1 4.33Å; W94-L98 HydrophobicContact CE3-CD2 4.33Å; W94-L98 HydrophobicContact CE3-CG 4.12Å; W94-L98 VanDerWaalsContact O-CB 3.23Å; W94-L98 WeakPolarHBondContact O-CB 3.27Å; W94-L98 WeakPolarHBondContact O-CG 3.42Å; W94-L98 PolarHBondContact O-N 3.02Å; W94-A148 HydrophobicContact CB-CB 3.91Å
95	H	98.6	Very high	98	Very high	21 Å²	21	32.9 Å²	32.9	10%	0.097	16%	0.161	C	C	.	.	H	α-helix	trans	-56	-60.9	-179.7	178	76.6	0	0	0	112.8	F92 N93 V97 L98 M99 G145 V149 H165	F92-H95 WeakPolarHBondContact O-CB 3.44Å; F92-H95 PolarHBondContact O-N 3.22Å; N93-H95 VanDerWaalsContact C-N 3.28Å; N93-H95 PolarHBondContact O-N 3.5Å; H95-V97 VanDerWaalsContact C-N 3.31Å; H95-V97 PolarHBondContact O-N 2.93Å; H95-L98 PolarHBondContact O-N 3.25Å; H95-M99 VanDerWaalsContact O-CB 3.31Å; H95-M99 WeakPolarHBondContact O-CB 3.29Å; H95-M99 WeakPolarHBondContact O-CG 3.49Å; H95-M99 PolarHBondContact O-N 2.84Å; H95-G145 PolarHBondContact ND1-O 2.72Å; H95-V149 HydrophobicContact CB-CB 4.13Å; H95-H165 AromaticContact NE2-NE2 3.81Å
96	P	98.6	Very high	98.1	Very high	19 Å²	19	28.7 Å²	28.7	12%	0.123	15%	0.148	C	C	.	.	H	α-helix	trans	-62.5	-36.6	-179.8	25.2	-34.8	0	0	0	112.6	V72 F92 N93 V100	V72-P96 HydrophobicContact CG2-CB 3.95Å; F92-P96 VanDerWaalsContact O-CD 3.23Å; F92-P96 WeakPolarHBondContact O-CD 3.35Å; N93-P96 WeakPolarHBondContact O-CD 3.23Å; N93-P96 WeakPolarHBondContact O-CG 3.45Å; P96-V100 WeakPolarHBondContact O-CB 3.34Å; P96-V100 VanDerWaalsContact O-CG2 3.28Å; P96-V100 WeakPolarHBondContact O-CG2 3.4Å; P96-V100 PolarHBondContact O-N 2.91Å
97	V	98.7	Very high	98.2	Very high	10 Å²	10	24 Å²	24	6%	0.061	12%	0.122	C	C	.	.	H	α-helix	trans	-65.4	-48.4	179.3	172.7	0	0	0	0	111.4	V72 N76 F83 W94 H95 T101	V72-V97 HydrophobicContact CG1-CG2 4.24Å; V72-V97 HydrophobicContact CG2-CG2 4.12Å; N76-V97 HydrophobicContact CB-CG2 4.44Å; F83-V97 HydrophobicContact CE1-CB 4.45Å; F83-V97 HydrophobicContact CE1-CG2 3.67Å; F83-V97 HydrophobicContact CZ-CG2 3.84Å; W94-V97 PolarHBondContact O-N 3.33Å; H95-V97 VanDerWaalsContact C-N 3.31Å; H95-V97 PolarHBondContact O-N 2.93Å; V97-T101 WeakPolarHBondContact O-CB 3.2Å; V97-T101 PolarHBondContact O-N 3.39Å; V97-T101 PolarHBondContact O-OG1 3.31Å
98	L	98.8	Very high	98.4	Very high	18 Å²	18	23.5 Å²	23.5	9%	0.094	12%	0.117	C	C	.	.	H	α-helix	trans	-70.3	-35.9	-179	-67.6	173.1	0	0	0	111.9	W94 H95 G102 M141 L144	W94-L98 HydrophobicContact CB-CD1 3.99Å; W94-L98 HydrophobicContact CB-CG 4.49Å; W94-L98 HydrophobicContact CE3-CD1 4.33Å; W94-L98 HydrophobicContact CE3-CD2 4.33Å; W94-L98 HydrophobicContact CE3-CG 4.12Å; W94-L98 VanDerWaalsContact O-CB 3.23Å; W94-L98 WeakPolarHBondContact O-CB 3.27Å; W94-L98 WeakPolarHBondContact O-CG 3.42Å; W94-L98 PolarHBondContact O-N 3.02Å; H95-L98 PolarHBondContact O-N 3.25Å; L98-G102 WeakPolarHBondContact O-CA 3.35Å; L98-G102 PolarHBondContact O-N 3.48Å; L98-M141 HydrophobicContact CD2-CE 3.68Å; L98-L144 HydrophobicContact CD1-CB 3.78Å
99	M	98.7	Very high	98.4	Very high	19 Å²	19	24.7 Å²	24.7	9%	0.094	12%	0.118	C	C	.	.	I	π-helix	trans	-68.2	-46.8	176.7	-69.2	-61.5	168.7	0	0	112.2	H95 L103 L104 S142 L146 I173	H95-M99 VanDerWaalsContact O-CB 3.31Å; H95-M99 WeakPolarHBondContact O-CB 3.29Å; H95-M99 WeakPolarHBondContact O-CG 3.49Å; H95-M99 PolarHBondContact O-N 2.84Å; M99-L103 PolarHBondContact O-N 3.38Å; M99-L103 HydrophobicContact SD-CD2 4.4Å; M99-L104 PolarHBondContact O-N 3.27Å; M99-L104 VanDerWaalsContact O-N 3.16Å; M99-S142 WeakPolarHBondContact CE-O 3.32Å; M99-L146 HydrophobicContact CE-CD2 3.74Å; M99-L146 HydrophobicContact CE-CG 3.77Å; M99-I173 HydrophobicContact CE-CD1 3.83Å; M99-I173 HydrophobicContact SD-CD1 4.18Å
100	V	98.8	Very high	98.5	Very high	5 Å²	5	22 Å²	22	3%	0.03	10%	0.099	C	C	.	.	I	π-helix	trans	-66.3	-42.3	177	170.1	0	0	0	0	110.8	C68 V72 P96 L104 V105	C68-V100 HydrophobicContact CB-CG1 3.87Å; V72-V100 HydrophobicContact CB-CB 4.5Å; V72-V100 HydrophobicContact CB-CG1 4.47Å; V72-V100 HydrophobicContact CG1-CB 4.08Å; V72-V100 HydrophobicContact CG1-CG1 4.01Å; V72-V100 HydrophobicContact CG2-CG2 4.27Å; P96-V100 WeakPolarHBondContact O-CB 3.34Å; P96-V100 VanDerWaalsContact O-CG2 3.28Å; P96-V100 WeakPolarHBondContact O-CG2 3.4Å; P96-V100 PolarHBondContact O-N 2.91Å; V100-L104 HydrophobicContact CG1-CD2 4.44Å; V100-L104 WeakPolarHBondContact O-CB 3.41Å; V100-V105 HydrophobicContact CG1-CG2 4.49Å; V100-V105 WeakPolarHBondContact O-CB 3.24Å; V100-V105 WeakPolarHBondContact O-CG2 3.3Å; V100-V105 PolarHBondContact O-N 3.41Å
101	T	98.8	Very high	98.5	Very high	31 Å²	31	17.4 Å²	17.4	19%	0.19	9%	0.086	C	C	.	.	I	π-helix	trans	-72.8	-47.8	-177.6	-52.3	0	0	0	0	111.8	V69 V97 L106 M141	V69-T101 HydrophobicContact CG2-CG2 4.07Å; V97-T101 WeakPolarHBondContact O-CB 3.2Å; V97-T101 PolarHBondContact O-N 3.39Å; V97-T101 PolarHBondContact O-OG1 3.31Å; T101-L106 VanDerWaalsContact O-CB 3.25Å; T101-L106 WeakPolarHBondContact O-CB 3.34Å; T101-L106 PolarHBondContact O-N 3.48Å; T101-M141 HydrophobicContact CG2-CE 3.55Å; T101-M141 HydrophobicContact CG2-SD 4.25Å
102	G	98.6	Very high	98.4	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.085	C	C	.	.	I	π-helix	trans	-79.7	-73.8	-177.1	0	0	0	0	0	112	L98 L104 L106 Y107 S138	L98-G102 WeakPolarHBondContact O-CA 3.35Å; L98-G102 PolarHBondContact O-N 3.48Å; G102-L104 VanDerWaalsContact C-N 3.27Å; G102-L104 PolarHBondContact O-N 3.22Å; G102-L106 WeakPolarHBondContact O-CB 3.36Å; G102-L106 PolarHBondContact O-N 3.14Å; G102-Y107 PolarHBondContact O-N 2.98Å; G102-S138 PolarHBondContact O-OG 3.38Å
103	L	97.8	Very high	98.3	Very high	6 Å²	6	16.4 Å²	16.4	3%	0.031	8%	0.082	C	C	.	.	I	π-helix	trans	-69.7	-22.3	-168.3	-156.7	58.3	0	0	0	113.3	M99 Y107 S142 I173 F176 T215	M99-L103 PolarHBondContact O-N 3.38Å; M99-L103 HydrophobicContact SD-CD2 4.4Å; L103-Y107 WeakPolarHBondContact O-CB 3.39Å; L103-Y107 WeakPolarHBondContact O-CD1 3.48Å; L103-S142 WeakPolarHBondContact CB-OG 3.46Å; L103-S142 WeakPolarHBondContact CD1-OG 3.32Å; L103-I173 HydrophobicContact CD2-CD1 4.22Å; L103-I173 HydrophobicContact CD2-CG1 3.6Å; L103-F176 HydrophobicContact CD1-CB 4.32Å; L103-F176 HydrophobicContact CD1-CD1 4.12Å; L103-F176 HydrophobicContact CD1-CD2 3.92Å; L103-F176 HydrophobicContact CD1-CE1 4.44Å; L103-F176 HydrophobicContact CD1-CE2 4.24Å; L103-F176 HydrophobicContact CD1-CG 3.85Å; L103-F176 HydrophobicContact CD1-CZ 4.5Å; L103-T215 HydrophobicContact CB-CG2 3.99Å; L103-T215 HydrophobicContact CD2-CG2 4.05Å; L103-T215 HydrophobicContact CG-CG2 3.71Å; L103-T215 WeakPolarHBondContact O-CG2 3.36Å
104	L	98.4	Very high	97.9	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.093	C	C	.	.	I	π-helix	trans	-100.1	-66.2	175.7	-176.4	75.1	0	0	0	112.3	M99 V100 G102 G108 L212 T215 V254 F257	M99-L104 PolarHBondContact O-N 3.27Å; M99-L104 VanDerWaalsContact O-N 3.16Å; V100-L104 HydrophobicContact CG1-CD2 4.44Å; V100-L104 WeakPolarHBondContact O-CB 3.41Å; G102-L104 VanDerWaalsContact C-N 3.27Å; G102-L104 PolarHBondContact O-N 3.22Å; L104-G108 PolarHBondContact O-N 2.94Å; L104-L212 HydrophobicContact CD1-CD1 4.47Å; L104-T215 HydrophobicContact CB-CG2 4.27Å; L104-T215 HydrophobicContact CD1-CG2 4.39Å; L104-V254 HydrophobicContact CD1-CG1 4.41Å; L104-V254 HydrophobicContact CD2-CB 4.02Å; L104-V254 HydrophobicContact CD2-CG1 3.69Å; L104-V254 HydrophobicContact CD2-CG2 3.62Å; L104-F257 HydrophobicContact CD1-CD1 4.09Å; L104-F257 HydrophobicContact CD1-CE1 4.33Å; L104-F257 HydrophobicContact CD2-CD1 4.3Å; L104-F257 HydrophobicContact CG-CD1 3.87Å; L104-F257 HydrophobicContact CG-CE1 4Å; L104-F257 WeakPolarHBondContact O-CE1 3.45Å
105	V	98.8	Very high	97.6	Very high	7 Å²	7	16.4 Å²	16.4	4%	0.042	8%	0.083	C	C	.	.	I	π-helix	trans	-73	-55.1	-168.7	172.8	0	0	0	0	112.3	C68 V69 V100 Y107 G108 Y109 F257	C68-V105 HydrophobicContact CB-CG2 4.04Å; V69-V105 HydrophobicContact CG2-CB 4.33Å; V69-V105 HydrophobicContact CG2-CG1 4.31Å; V69-V105 HydrophobicContact CG2-CG2 4.13Å; V100-V105 HydrophobicContact CG1-CG2 4.49Å; V100-V105 WeakPolarHBondContact O-CB 3.24Å; V100-V105 WeakPolarHBondContact O-CG2 3.3Å; V100-V105 PolarHBondContact O-N 3.41Å; V105-Y107 VanDerWaalsContact C-N 3.3Å; V105-Y107 PolarHBondContact O-N 2.94Å; V105-G108 PolarHBondContact O-N 3.38Å; V105-Y109 HydrophobicContact CG1-CD2 4.02Å; V105-Y109 HydrophobicContact CG1-CE1 4.28Å; V105-Y109 HydrophobicContact CG1-CE2 3.41Å; V105-Y109 VanDerWaalsContact CG1-CE2 3.41Å; V105-Y109 PolarHBondContact O-N 2.96Å; V105-F257 HydrophobicContact CB-CZ 4.48Å; V105-F257 HydrophobicContact CG2-CZ 4.44Å
106	L	98.7	Very high	97.3	Very high	41 Å²	41	16.1 Å²	16.1	22%	0.215	8%	0.083	C	C	.	.	I	π-helix	trans	-63.1	-39.8	179.7	-171.9	64.8	0	0	0	111	T101 G102 Y109 G110 L134 M141	T101-L106 VanDerWaalsContact O-CB 3.25Å; T101-L106 WeakPolarHBondContact O-CB 3.34Å; T101-L106 PolarHBondContact O-N 3.48Å; G102-L106 WeakPolarHBondContact O-CB 3.36Å; G102-L106 PolarHBondContact O-N 3.14Å; L106-Y109 PolarHBondContact O-N 3.49Å; L106-G110 PolarHBondContact O-N 3.36Å; L106-L134 HydrophobicContact CD1-CD2 3.54Å; L106-L134 HydrophobicContact CG-CD2 4.44Å; L106-M141 HydrophobicContact CD2-SD 4.28Å
107	Y	98.7	Very high	96.7	Very high	6 Å²	6	16.4 Å²	16.4	2%	0.024	8%	0.084	C	C	.	.	H	α-helix	trans	-56.6	-53.7	170.5	178.1	-158.3	0	0	0	112	G102 L103 V105 Y109 G110 A111 M135 F176 G208 I211 L212	G102-Y107 PolarHBondContact O-N 2.98Å; L103-Y107 WeakPolarHBondContact O-CB 3.39Å; L103-Y107 WeakPolarHBondContact O-CD1 3.48Å; V105-Y107 VanDerWaalsContact C-N 3.3Å; V105-Y107 PolarHBondContact O-N 2.94Å; Y107-Y109 VanDerWaalsContact C-N 3.31Å; Y107-Y109 PolarHBondContact O-N 3.06Å; Y107-G110 CarbonylContact O-C 3.59Å; Y107-G110 PolarHBondContact O-N 3.08Å; Y107-G110 VanDerWaalsContact O-N 3.11Å; Y107-A111 HydrophobicContact CE2-CB 4.39Å; Y107-A111 WeakPolarHBondContact O-CB 3.24Å; Y107-A111 PolarHBondContact O-N 3.39Å; Y107-M135 HydrophobicContact CD2-CE 3.61Å; Y107-M135 HydrophobicContact CD2-SD 3.41Å; Y107-M135 WeakPolarHBondContact CD2-SD 3.3Å; Y107-M135 HydrophobicContact CE2-CE 3.76Å; Y107-M135 HydrophobicContact CE2-SD 3.75Å; Y107-F176 HydrophobicContact CD1-CD2 4.34Å; Y107-F176 AromaticContact CD1-CE2 3.93Å; Y107-F176 HydrophobicContact CD1-CE2 3.93Å; Y107-F176 AromaticContact CD2-CE2 3.55Å; Y107-F176 HydrophobicContact CD2-CE2 3.55Å; Y107-F176 HydrophobicContact CD2-CZ 4.26Å; Y107-F176 HydrophobicContact CE1-CD2 4.08Å; Y107-F176 AromaticContact CE1-CE2 3.96Å; Y107-F176 HydrophobicContact CE1-CE2 3.96Å; Y107-F176 HydrophobicContact CE2-CD2 4.33Å; Y107-F176 AromaticContact CE2-CE2 3.61Å; Y107-F176 HydrophobicContact CE2-CE2 3.61Å; Y107-F176 AromaticContact CG-CE2 3.7Å; Y107-F176 HydrophobicContact CG-CE2 3.7Å; Y107-F176 HydrophobicContact CG-CZ 4.44Å; Y107-F176 AromaticContact CZ-CE2 3.77Å; Y107-G208 WeakPolarHBondContact OH-CA 3.36Å; Y107-G208 PolarHBondContact OH-O 3.17Å; Y107-I211 HydrophobicContact CE1-CB 4.41Å; Y107-I211 HydrophobicContact CE1-CG2 4.01Å; Y107-L212 HydrophobicContact CD1-CB 4.43Å; Y107-L212 HydrophobicContact CD1-CD1 3.73Å; Y107-L212 HydrophobicContact CE1-CB 3.79Å; Y107-L212 HydrophobicContact CE1-CD1 3.97Å; Y107-L212 HydrophobicContact CG-CD1 4.47Å
108	G	98.5	Very high	96	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-57.2	-43.1	-179	0	0	0	0	0	112.6	L104 V105 A111 V112	L104-G108 PolarHBondContact O-N 2.94Å; V105-G108 PolarHBondContact O-N 3.38Å; G108-A111 PolarHBondContact O-N 2.98Å; G108-V112 PolarHBondContact O-N 3.4Å
109	Y	98.5	Very high	95.3	Very high	48 Å²	48	21.4 Å²	21.4	19%	0.188	11%	0.11	C	C	.	.	H	α-helix	trans	-63	-45.4	174.5	-64.3	-17.8	0	0	0	112.5	L62 G65 L66 V105 L106 Y107 A111 V112 V113 F257	L62-Y109 WeakPolarHBondContact CA-OH 3.37Å; L62-Y109 HydrophobicContact CD2-CD1 4.11Å; L62-Y109 HydrophobicContact CD2-CE1 3.73Å; L62-Y109 HydrophobicContact CD2-CE2 4.26Å; L62-Y109 PolarHBondContact O-OH 3.25Å; G65-Y109 VanDerWaalsContact CA-OH 3.3Å; G65-Y109 WeakPolarHBondContact CA-OH 3.5Å; L66-Y109 PolarHBondContact N-OH 3.02Å; V105-Y109 HydrophobicContact CG1-CD2 4.02Å; V105-Y109 HydrophobicContact CG1-CE1 4.28Å; V105-Y109 HydrophobicContact CG1-CE2 3.41Å; V105-Y109 VanDerWaalsContact CG1-CE2 3.41Å; V105-Y109 PolarHBondContact O-N 2.96Å; L106-Y109 PolarHBondContact O-N 3.49Å; Y107-Y109 VanDerWaalsContact C-N 3.31Å; Y107-Y109 PolarHBondContact O-N 3.06Å; Y109-A111 VanDerWaalsContact C-N 3.27Å; Y109-A111 PolarHBondContact O-N 3.07Å; Y109-V112 WeakPolarHBondContact O-CG2 3.36Å; Y109-V112 PolarHBondContact O-N 3.36Å; Y109-V113 PolarHBondContact O-N 3.16Å; Y109-F257 HydrophobicContact CD1-CE2 4.26Å; Y109-F257 HydrophobicContact CD1-CZ 4.33Å; Y109-F257 AromaticContact CE1-CE2 3.73Å; Y109-F257 HydrophobicContact CE1-CE2 3.73Å; Y109-F257 HydrophobicContact CE1-CZ 4.2Å
110	G	97.8	Very high	94.6	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-60.2	-36.4	174.8	0	0	0	0	0	112.7	L106 Y107 V113 H131	L106-G110 PolarHBondContact O-N 3.36Å; Y107-G110 CarbonylContact O-C 3.59Å; Y107-G110 PolarHBondContact O-N 3.08Å; Y107-G110 VanDerWaalsContact O-N 3.11Å; G110-V113 VanDerWaalsContact O-CG1 3.23Å; G110-V113 WeakPolarHBondContact O-CG1 3.39Å; G110-H131 PolarHBondContact O-ND1 3.33Å
111	A	97.6	Very high	93.6	Very high	19 Å²	19	27.3 Å²	27.3	16%	0.157	15%	0.154	C	C	.	.	H	α-helix	trans	-68.1	-38.3	-179	0	0	0	0	0	112	Y107 G108 Y109 M135 L265	Y107-A111 HydrophobicContact CE2-CB 4.39Å; Y107-A111 WeakPolarHBondContact O-CB 3.24Å; Y107-A111 PolarHBondContact O-N 3.39Å; G108-A111 PolarHBondContact O-N 2.98Å; Y109-A111 VanDerWaalsContact C-N 3.27Å; Y109-A111 PolarHBondContact O-N 3.07Å; A111-M135 HydrophobicContact CB-CE 4.29Å; A111-M135 VanDerWaalsContact N-CE 3.34Å; A111-L265 HydrophobicContact CB-CD1 4.18Å; A111-L265 HydrophobicContact CB-CD2 4.41Å; A111-L265 WeakPolarHBondContact O-CD2 3.43Å
112	V	97.2	Very high	92.9	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-88.2	-6.2	-178.2	-57.2	0	0	0	0	114.1	Y58 G108 Y109 Y114 R115 V261 I264 L265	Y58-V112 HydrophobicContact CD2-CG2 4.24Å; Y58-V112 HydrophobicContact CE2-CG2 3.93Å; G108-V112 PolarHBondContact O-N 3.4Å; Y109-V112 WeakPolarHBondContact O-CG2 3.36Å; Y109-V112 PolarHBondContact O-N 3.36Å; V112-Y114 PolarHBondContact O-N 2.84Å; V112-Y114 VanDerWaalsContact O-N 3.11Å; V112-R115 WeakPolarHBondContact O-CA 3.27Å; V112-R115 VanDerWaalsContact O-CB 3.25Å; V112-R115 WeakPolarHBondContact O-CB 3.47Å; V112-R115 PolarHBondContact O-N 3.4Å; V112-V261 HydrophobicContact CG1-CG1 3.91Å; V112-I264 HydrophobicContact CB-CG2 3.91Å; V112-I264 HydrophobicContact CG1-CB 3.97Å; V112-I264 HydrophobicContact CG1-CD1 4.31Å; V112-I264 HydrophobicContact CG1-CG2 3.67Å; V112-L265 HydrophobicContact CG1-CD2 4.14Å; V112-L265 HydrophobicContact CG1-CG 4.3Å
113	V	94.8	Very high	92.3	Very high	10 Å²	10	38 Å²	38	6%	0.061	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-55.7	-35.3	-172.5	77.4	0	0	0	0	113.7	Y109 G110 R115 W127 L130 H131	Y109-V113 PolarHBondContact O-N 3.16Å; G110-V113 VanDerWaalsContact O-CG1 3.23Å; G110-V113 WeakPolarHBondContact O-CG1 3.39Å; V113-R115 PolarHBondContact O-N 3.33Å; V113-W127 HydrophobicContact CG2-CE3 4.03Å; V113-W127 HydrophobicContact CG2-CZ3 4.31Å; V113-L130 HydrophobicContact CG2-CD2 3.65Å; V113-L130 HydrophobicContact CG2-CG 4.19Å; V113-H131 HydrophobicContact CG1-CB 3.85Å
114	Y	91.3	Very high	91.8	Very high	60 Å²	60	40.6 Å²	40.6	24%	0.235	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-73.7	-14.1	177.2	-74	-79	0	0	0	114.2	V112 V116 W120 W127 K128 H131 R272	V112-Y114 PolarHBondContact O-N 2.84Å; V112-Y114 VanDerWaalsContact O-N 3.11Å; Y114-V116 VanDerWaalsContact C-N 3.31Å; Y114-W120 PolarHBondContact O-NE1 3.49Å; Y114-W127 HydrophobicContact CD1-CB 4.25Å; Y114-W127 HydrophobicContact CE1-CB 3.9Å; Y114-K128 HydrophobicContact CE1-CG 4.42Å; Y114-K128 WeakPolarHBondContact OH-CA 3.37Å; Y114-K128 WeakPolarHBondContact OH-CG 3.07Å; Y114-K128 PolarHBondContact OH-N 3.37Å; Y114-H131 HydrophobicContact CD2-CB 4.42Å; Y114-H131 HydrophobicContact CE2-CB 3.57Å; Y114-H131 AromaticContact CE2-CG 3.62Å; Y114-H131 AromaticContact CE2-ND1 3.84Å; Y114-R272 WeakPolarHBondContact O-CB 3.49Å
115	R	92.2	Very high	91.4	Very high	24 Å²	24	45.6 Å²	45.6	9%	0.091	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-82.5	-13	-176.2	-55.6	-68.1	-178.7	150.1	1.8	112.3	F54 V112 V113 P117 I264 L265 T267 W270 Q271	F54-R115 HydrophobicContact CE2-CB 3.6Å; F54-R115 WeakPolarHBondContact CE2-O 3.29Å; F54-R115 HydrophobicContact CZ-CB 4.1Å; F54-R115 WeakPolarHBondContact CZ-O 3.48Å; V112-R115 WeakPolarHBondContact O-CA 3.27Å; V112-R115 VanDerWaalsContact O-CB 3.25Å; V112-R115 WeakPolarHBondContact O-CB 3.47Å; V112-R115 PolarHBondContact O-N 3.4Å; V113-R115 PolarHBondContact O-N 3.33Å; R115-P117 WeakPolarHBondContact O-CD 3.31Å; R115-I264 HydrophobicContact CB-CG2 3.9Å; R115-I264 HydrophobicContact CG-CG2 3.93Å; R115-L265 VanDerWaalsContact CZ-O 3.3Å; R115-L265 PolarHBondContact NH1-O 2.92Å; R115-L265 PolarHBondContact NH2-O 2.93Å; R115-T267 PolarHBondContact NH1-O 3.36Å; R115-W270 WeakPolarHBondContact CA-O 3.34Å; R115-W270 WeakPolarHBondContact CD-O 3.41Å; R115-Q271 VanDerWaalsContact NH1-CA 3.29Å; R115-Q271 VanDerWaalsContact NH1-CB 3.32Å
116	V	91.8	Very high	91.1	Very high	16 Å²	16	48.6 Å²	48.6	10%	0.097	26%	0.263	C	S	.	.			trans	-67.8	113.5	-177.7	-177.8	0	0	0	0	111	F54 Y55 Y58 Y114 L118 T119 W120	F54-V116 HydrophobicContact CE1-CB 4.4Å; F54-V116 HydrophobicContact CE1-CG2 4.28Å; F54-V116 HydrophobicContact CZ-CB 4.35Å; F54-V116 HydrophobicContact CZ-CG2 3.99Å; Y55-V116 HydrophobicContact CE1-CG1 4.48Å; Y58-V116 HydrophobicContact CE2-CG2 4.29Å; Y114-V116 VanDerWaalsContact C-N 3.31Å; V116-L118 VanDerWaalsContact C-N 3.3Å; V116-L118 HydrophobicContact CG1-CB 4.3Å; V116-L118 HydrophobicContact CG1-CD1 4.03Å; V116-L118 PolarHBondContact O-N 3.27Å; V116-T119 HydrophobicContact CB-CG2 3.82Å; V116-T119 HydrophobicContact CG1-CG2 3.94Å; V116-T119 WeakPolarHBondContact O-CB 3.45Å; V116-T119 WeakPolarHBondContact O-CG2 3.32Å; V116-T119 PolarHBondContact O-N 3.45Å; V116-T119 PolarHBondContact O-OG1 2.93Å; V116-W120 PolarHBondContact O-NE1 2.84Å
117	P	87	Confident	90.8	Very high	24 Å²	24	49.8 Å²	49.8	16%	0.156	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-60.9	-31.9	-173.5	-27.6	36.6	0	0	0	114.9	F54 R115 T119 W120	F54-P117 HydrophobicContact CD1-CG 3.96Å; F54-P117 HydrophobicContact CE1-CG 4.37Å; F54-P117 HydrophobicContact CG-CG 4.31Å; R115-P117 WeakPolarHBondContact O-CD 3.31Å; P117-T119 PolarHBondContact O-N 3.46Å; P117-W120 HydrophobicContact CB-CD2 4.37Å; P117-W120 HydrophobicContact CB-CE3 4.43Å; P117-W120 HydrophobicContact CB-CH2 4.43Å; P117-W120 HydrophobicContact CB-CZ2 4.35Å; P117-W120 HydrophobicContact CB-CZ3 4.47Å; P117-W120 HydrophobicContact CG-CH2 4.28Å; P117-W120 HydrophobicContact CG-CZ2 4.12Å; P117-W120 PolarHBondContact O-N 3.24Å; P117-W120 VanDerWaalsContact O-N 3.14Å
118	L	83.9	Confident	90.5	Very high	130 Å²	130	52.6 Å²	52.6	68%	0.681	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-55.1	-23	175.4	-70	122.1	0	0	0	112.9	Y55 V116	Y55-L118 HydrophobicContact CE1-CD1 3.63Å; Y55-L118 WeakPolarHBondContact OH-CD1 3.49Å; Y55-L118 VanDerWaalsContact OH-CG 3.31Å; Y55-L118 WeakPolarHBondContact OH-CG 3.28Å; V116-L118 VanDerWaalsContact C-N 3.3Å; V116-L118 HydrophobicContact CG1-CB 4.3Å; V116-L118 HydrophobicContact CG1-CD1 4.03Å; V116-L118 PolarHBondContact O-N 3.27Å
119	T	83.1	Confident	90.4	Very high	3 Å²	3	57.2 Å²	57.2	2%	0.018	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-90.1	-9.8	-173.7	74.8	0	0	0	0	113.6	V116 P117 G121 Q122 W127 R272	V116-T119 HydrophobicContact CB-CG2 3.82Å; V116-T119 HydrophobicContact CG1-CG2 3.94Å; V116-T119 WeakPolarHBondContact O-CB 3.45Å; V116-T119 WeakPolarHBondContact O-CG2 3.32Å; V116-T119 PolarHBondContact O-N 3.45Å; V116-T119 PolarHBondContact O-OG1 2.93Å; P117-T119 PolarHBondContact O-N 3.46Å; T119-G121 PolarHBondContact O-N 3.32Å; T119-Q122 PolarHBondContact O-N 3.25Å; T119-W127 VanDerWaalsContact CB-CE2 3.42Å; T119-W127 HydrophobicContact CG2-CD2 3.8Å; T119-W127 VanDerWaalsContact CG2-CE2 3.47Å; T119-W127 HydrophobicContact CG2-CE3 3.84Å; T119-W127 HydrophobicContact CG2-CH2 3.27Å; T119-W127 HydrophobicContact CG2-CZ2 3.21Å; T119-W127 HydrophobicContact CG2-CZ3 3.58Å; T119-R272 PolarHBondContact O-NH2 3.43Å
120	W	84.1	Confident	90.2	Very high	73 Å²	73	58.2 Å²	58.2	28%	0.277	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-31.9	-165.4	-68	-1.5	0	0	0	113.8	Y114 V116 P117 Q269 W270 R272 P273	Y114-W120 PolarHBondContact O-NE1 3.49Å; V116-W120 PolarHBondContact O-NE1 2.84Å; P117-W120 HydrophobicContact CB-CD2 4.37Å; P117-W120 HydrophobicContact CB-CE3 4.43Å; P117-W120 HydrophobicContact CB-CH2 4.43Å; P117-W120 HydrophobicContact CB-CZ2 4.35Å; P117-W120 HydrophobicContact CB-CZ3 4.47Å; P117-W120 HydrophobicContact CG-CH2 4.28Å; P117-W120 HydrophobicContact CG-CZ2 4.12Å; P117-W120 PolarHBondContact O-N 3.24Å; P117-W120 VanDerWaalsContact O-N 3.14Å; W120-Q269 WeakPolarHBondContact CH2-O 3.08Å; W120-W270 WeakPolarHBondContact CZ2-O 3.5Å; W120-R272 HydrophobicContact CG-CG 4.09Å; W120-P273 HydrophobicContact CD2-CG 4.26Å; W120-P273 HydrophobicContact CE3-CG 3.9Å; W120-P273 HydrophobicContact CZ3-CG 4.4Å
121	G	78.8	Confident	90.2	Very high	75 Å²	75	59.8 Å²	59.8	77%	0.773	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	0.4	175.9	0	0	0	0	0	115.1	T119	T119-G121 PolarHBondContact O-N 3.32Å
122	Q	83.3	Confident	90.2	Very high	123 Å²	123	59.6 Å²	59.6	58%	0.575	32%	0.315	S	S	*	.	S	Bend	trans	-96.9	164.9	-176.1	-60	-60.9	-57	0	0	111.6	T119 K124 R272	T119-Q122 PolarHBondContact O-N 3.25Å; Q122-K124 PolarHBondContact O-N 3.07Å; Q122-R272 PolarHBondContact O-NH2 2.88Å
123	N	86.3	Confident	90.3	Very high	132 Å²	132	62.5 Å²	62.5	71%	0.706	34%	0.339	S	S	*	.			trans	-51.5	137.6	172.4	-78.8	-30	0	0	0	111.6	P126 W127	N123-P126 WeakPolarHBondContact O-CD 3.02Å; N123-W127 VanDerWaalsContact O-CD1 3.23Å
124	K	87.4	Confident	90.4	Very high	62 Å²	62	63.9 Å²	63.9	27%	0.27	35%	0.346	S	S	.	.	H	α-helix	trans	-73.3	-27.4	-177.4	-77.6	176.5	175.6	175.5	0	113.3	Q122 W127 K128 R272 S275	Q122-K124 PolarHBondContact O-N 3.07Å; K124-W127 PolarHBondContact O-N 2.71Å; K124-K128 PolarHBondContact O-N 2.88Å; K124-K128 VanDerWaalsContact O-N 3.12Å; K124-R272 VanDerWaalsContact CG-CZ 3.48Å; K124-R272 VanDerWaalsContact CG-NH2 3.27Å; K124-S275 WeakPolarHBondContact CE-OG 3.41Å; K124-S275 PolarHBondContact NZ-OG 3.16Å
125	L	89.5	Confident	90.8	Very high	104 Å²	104	61.6 Å²	61.6	55%	0.545	34%	0.338	S	S	.	.	H	α-helix	trans	-62.6	-47.1	-171.9	-178.6	64.9	0	0	0	113.9	W127 K128 L129	L125-W127 VanDerWaalsContact C-N 3.27Å; L125-W127 PolarHBondContact O-N 3.33Å; L125-K128 WeakPolarHBondContact O-CA 3.29Å; L125-K128 WeakPolarHBondContact O-CB 3.47Å; L125-K128 PolarHBondContact O-N 2.87Å; L125-L129 HydrophobicContact CD1-CD1 4.43Å; L125-L129 HydrophobicContact CD1-CG 4.28Å; L125-L129 HydrophobicContact CG-CD1 4.18Å; L125-L129 HydrophobicContact CG-CG 4.46Å; L125-L129 WeakPolarHBondContact O-CG 3.24Å; L125-L129 PolarHBondContact O-N 3.42Å
126	P	92.3	Very high	91.1	Very high	71 Å²	71	63.6 Å²	63.6	46%	0.461	35%	0.35	S	S	.	.	H	α-helix	trans	-56.6	-40	177.5	-27	35.5	0	0	0	113.2	N123 L129 L130	N123-P126 WeakPolarHBondContact O-CD 3.02Å; P126-L129 PolarHBondContact O-N 3.29Å; P126-L130 WeakPolarHBondContact O-CB 3.49Å; P126-L130 PolarHBondContact O-N 3.5Å
127	W	92.4	Very high	91.4	Very high	66 Å²	66	63.9 Å²	63.9	25%	0.25	36%	0.356	C	S	.	.	H	α-helix	trans	-71.9	-29.6	178.7	-56	100.4	0	0	0	112.8	V113 Y114 T119 N123 K124 L125 L130 H131	V113-W127 HydrophobicContact CG2-CE3 4.03Å; V113-W127 HydrophobicContact CG2-CZ3 4.31Å; Y114-W127 HydrophobicContact CD1-CB 4.25Å; Y114-W127 HydrophobicContact CE1-CB 3.9Å; T119-W127 VanDerWaalsContact CB-CE2 3.42Å; T119-W127 HydrophobicContact CG2-CD2 3.8Å; T119-W127 VanDerWaalsContact CG2-CE2 3.47Å; T119-W127 HydrophobicContact CG2-CE3 3.84Å; T119-W127 HydrophobicContact CG2-CH2 3.27Å; T119-W127 HydrophobicContact CG2-CZ2 3.21Å; T119-W127 HydrophobicContact CG2-CZ3 3.58Å; N123-W127 VanDerWaalsContact O-CD1 3.23Å; K124-W127 PolarHBondContact O-N 2.71Å; L125-W127 VanDerWaalsContact C-N 3.27Å; L125-W127 PolarHBondContact O-N 3.33Å; W127-L130 HydrophobicContact CE3-CD2 3.93Å; W127-L130 HydrophobicContact CZ3-CD2 3.87Å; W127-H131 VanDerWaalsContact O-CB 3.27Å; W127-H131 WeakPolarHBondContact O-CB 3.48Å; W127-H131 PolarHBondContact O-N 3.11Å
128	K	92.9	Very high	91.9	Very high	64 Å²	64	62.8 Å²	62.8	28%	0.278	35%	0.349	S	S	.	.	H	α-helix	trans	-65.6	-46.3	168.8	-73.4	177.6	167.9	-162.1	0	112.4	Y114 K124 L125 A132 F187 L188	Y114-K128 HydrophobicContact CE1-CG 4.42Å; Y114-K128 WeakPolarHBondContact OH-CA 3.37Å; Y114-K128 WeakPolarHBondContact OH-CG 3.07Å; Y114-K128 PolarHBondContact OH-N 3.37Å; K124-K128 PolarHBondContact O-N 2.88Å; K124-K128 VanDerWaalsContact O-N 3.12Å; L125-K128 WeakPolarHBondContact O-CA 3.29Å; L125-K128 WeakPolarHBondContact O-CB 3.47Å; L125-K128 PolarHBondContact O-N 2.87Å; K128-A132 WeakPolarHBondContact O-CB 3.45Å; K128-A132 PolarHBondContact O-N 3.14Å; K128-F187 PolarHBondContact NZ-O 2.86Å; K128-L188 HydrophobicContact CB-CD2 3.72Å
129	L	95.5	Very high	92.6	Very high	97 Å²	97	57.2 Å²	57.2	51%	0.508	32%	0.32	S	S	.	.	H	α-helix	trans	-64	-45	177.1	-66.7	173.4	0	0	0	110.8	L125 P126 A132 A133 L188	L125-L129 HydrophobicContact CD1-CD1 4.43Å; L125-L129 HydrophobicContact CD1-CG 4.28Å; L125-L129 HydrophobicContact CG-CD1 4.18Å; L125-L129 HydrophobicContact CG-CG 4.46Å; L125-L129 WeakPolarHBondContact O-CG 3.24Å; L125-L129 PolarHBondContact O-N 3.42Å; P126-L129 PolarHBondContact O-N 3.29Å; L129-A132 PolarHBondContact O-N 2.94Å; L129-A133 VanDerWaalsContact O-CB 3.23Å; L129-A133 WeakPolarHBondContact O-CB 3.27Å; L129-A133 PolarHBondContact O-N 2.92Å; L129-L188 HydrophobicContact CD2-CD2 3.97Å
130	L	95.9	Very high	93.4	Very high	70 Å²	70	61.3 Å²	61.3	37%	0.366	34%	0.341	S	S	.	.	H	α-helix	trans	-60.5	-49.1	176.7	180	59.6	0	0	0	111.7	V113 P126 W127 A132 A133 L134	V113-L130 HydrophobicContact CG2-CD2 3.65Å; V113-L130 HydrophobicContact CG2-CG 4.19Å; P126-L130 WeakPolarHBondContact O-CB 3.49Å; P126-L130 PolarHBondContact O-N 3.5Å; W127-L130 HydrophobicContact CE3-CD2 3.93Å; W127-L130 HydrophobicContact CZ3-CD2 3.87Å; L130-A132 PolarHBondContact O-N 3.18Å; L130-A133 PolarHBondContact O-N 2.97Å; L130-L134 HydrophobicContact CD1-CD1 3.97Å; L130-L134 HydrophobicContact CD1-CG 4.04Å; L130-L134 HydrophobicContact CG-CD1 3.95Å; L130-L134 HydrophobicContact CG-CG 4.44Å; L130-L134 WeakPolarHBondContact O-CB 3.34Å; L130-L134 VanDerWaalsContact O-CG 3.24Å; L130-L134 WeakPolarHBondContact O-CG 3.45Å; L130-L134 PolarHBondContact O-N 2.95Å
131	H	97	Very high	94.1	Very high	32 Å²	32	60 Å²	60	15%	0.148	34%	0.338	C	S	.	.	H	α-helix	trans	-55.5	-51.9	175.3	175.9	85	0	0	0	111.4	G110 V113 Y114 W127 A133 L134 M135	G110-H131 PolarHBondContact O-ND1 3.33Å; V113-H131 HydrophobicContact CG1-CB 3.85Å; Y114-H131 HydrophobicContact CD2-CB 4.42Å; Y114-H131 HydrophobicContact CE2-CB 3.57Å; Y114-H131 AromaticContact CE2-CG 3.62Å; Y114-H131 AromaticContact CE2-ND1 3.84Å; W127-H131 VanDerWaalsContact O-CB 3.27Å; W127-H131 WeakPolarHBondContact O-CB 3.48Å; W127-H131 PolarHBondContact O-N 3.11Å; H131-A133 VanDerWaalsContact C-N 3.33Å; H131-A133 PolarHBondContact O-N 3.48Å; H131-L134 PolarHBondContact O-N 3.06Å; H131-M135 WeakPolarHBondContact CE1-CE 3.24Å; H131-M135 VanDerWaalsContact O-CG 3.24Å; H131-M135 WeakPolarHBondContact O-CG 3.4Å; H131-M135 PolarHBondContact O-N 2.88Å
132	A	97.7	Very high	95	Very high	15 Å²	15	56.4 Å²	56.4	12%	0.124	30%	0.302	C	S	.	.	H	α-helix	trans	-64.6	-36.4	-178	0	0	0	0	0	113.3	K128 L129 L130 M135 L136 W180 L188	K128-A132 WeakPolarHBondContact O-CB 3.45Å; K128-A132 PolarHBondContact O-N 3.14Å; L129-A132 PolarHBondContact O-N 2.94Å; L130-A132 PolarHBondContact O-N 3.18Å; A132-M135 PolarHBondContact O-N 3.45Å; A132-L136 WeakPolarHBondContact O-CB 3.26Å; A132-L136 PolarHBondContact O-N 3.35Å; A132-W180 PolarHBondContact O-NE1 3.45Å; A132-L188 HydrophobicContact CB-CD1 3.33Å; A132-L188 HydrophobicContact CB-CG 4.42Å
133	A	98	Very high	95.7	Very high	61 Å²	61	54.4 Å²	54.4	50%	0.504	29%	0.294	S	S	.	.	H	α-helix	trans	-67	-44.3	175.7	0	0	0	0	0	111.8	L129 L130 H131 M135 L136 G137	L129-A133 VanDerWaalsContact O-CB 3.23Å; L129-A133 WeakPolarHBondContact O-CB 3.27Å; L129-A133 PolarHBondContact O-N 2.92Å; L130-A133 PolarHBondContact O-N 2.97Å; H131-A133 VanDerWaalsContact C-N 3.33Å; H131-A133 PolarHBondContact O-N 3.48Å; A133-M135 VanDerWaalsContact C-N 3.33Å; A133-M135 PolarHBondContact O-N 3.31Å; A133-L136 PolarHBondContact O-N 2.97Å; A133-G137 PolarHBondContact O-N 2.94Å
134	L	98.4	Very high	96.3	Very high	40 Å²	40	51.9 Å²	51.9	21%	0.209	28%	0.28	C	S	.	.	H	α-helix	trans	-61.6	-42.1	174.7	-68	169.8	0	0	0	111.2	L106 L130 H131 G137 S138	L106-L134 HydrophobicContact CD1-CD2 3.54Å; L106-L134 HydrophobicContact CG-CD2 4.44Å; L130-L134 HydrophobicContact CD1-CD1 3.97Å; L130-L134 HydrophobicContact CD1-CG 4.04Å; L130-L134 HydrophobicContact CG-CD1 3.95Å; L130-L134 HydrophobicContact CG-CG 4.44Å; L130-L134 WeakPolarHBondContact O-CB 3.34Å; L130-L134 VanDerWaalsContact O-CG 3.24Å; L130-L134 WeakPolarHBondContact O-CG 3.45Å; L130-L134 PolarHBondContact O-N 2.95Å; H131-L134 PolarHBondContact O-N 3.06Å; L134-G137 PolarHBondContact O-N 3.46Å; L134-S138 WeakPolarHBondContact O-CB 3.47Å; L134-S138 PolarHBondContact O-N 3.26Å
135	M	98.4	Very high	96.9	Very high	12 Å²	12	48.9 Å²	48.9	6%	0.059	27%	0.267	C	S	.	.	H	α-helix	trans	-66.7	-39.3	176.4	-63.9	-55.4	167	0	0	112.5	Y107 A111 H131 A132 A133 S138 L139 F176	Y107-M135 HydrophobicContact CD2-CE 3.61Å; Y107-M135 HydrophobicContact CD2-SD 3.41Å; Y107-M135 WeakPolarHBondContact CD2-SD 3.3Å; Y107-M135 HydrophobicContact CE2-CE 3.76Å; Y107-M135 HydrophobicContact CE2-SD 3.75Å; A111-M135 HydrophobicContact CB-CE 4.29Å; A111-M135 VanDerWaalsContact N-CE 3.34Å; H131-M135 WeakPolarHBondContact CE1-CE 3.24Å; H131-M135 VanDerWaalsContact O-CG 3.24Å; H131-M135 WeakPolarHBondContact O-CG 3.4Å; H131-M135 PolarHBondContact O-N 2.88Å; A132-M135 PolarHBondContact O-N 3.45Å; A133-M135 VanDerWaalsContact C-N 3.33Å; A133-M135 PolarHBondContact O-N 3.31Å; M135-S138 WeakPolarHBondContact O-CB 3.35Å; M135-S138 PolarHBondContact O-N 2.88Å; M135-L139 PolarHBondContact O-N 3.38Å; M135-F176 HydrophobicContact CB-CZ 4.25Å; M135-F176 WeakPolarHBondContact O-CE1 3.37Å; M135-F176 HydrophobicContact SD-CE2 4.03Å; M135-F176 HydrophobicContact SD-CZ 3.79Å
136	L	98.5	Very high	97.3	Very high	65 Å²	65	45.4 Å²	45.4	34%	0.34	25%	0.249	S	C	.	.	H	α-helix	trans	-65.3	-43.4	175.2	179.9	59	0	0	0	111.2	A132 A133 S138 L139 I140 W180	A132-L136 WeakPolarHBondContact O-CB 3.26Å; A132-L136 PolarHBondContact O-N 3.35Å; A133-L136 PolarHBondContact O-N 2.97Å; L136-S138 VanDerWaalsContact C-N 3.31Å; L136-S138 PolarHBondContact O-N 3.12Å; L136-L139 WeakPolarHBondContact O-CB 3.19Å; L136-L139 PolarHBondContact O-N 3.28Å; L136-L139 VanDerWaalsContact O-N 3.15Å; L136-I140 HydrophobicContact CD1-CD1 4.26Å; L136-I140 HydrophobicContact CD1-CG1 4.35Å; L136-I140 HydrophobicContact CG-CD1 4.03Å; L136-I140 WeakPolarHBondContact O-CG1 3.28Å; L136-I140 PolarHBondContact O-N 3.49Å; L136-W180 HydrophobicContact CB-CZ2 3.98Å; L136-W180 HydrophobicContact CD1-CH2 4.1Å; L136-W180 HydrophobicContact CD1-CZ2 3.74Å; L136-W180 HydrophobicContact CD2-CZ2 4.08Å; L136-W180 HydrophobicContact CG-CZ2 4.14Å
137	G	98.8	Very high	97.6	Very high	23 Å²	23	44.5 Å²	44.5	24%	0.237	24%	0.243	C	C	.	.	H	α-helix	trans	-58	-44	173.7	0	0	0	0	0	111.9	A133 L134 L139 I140 M141	A133-G137 PolarHBondContact O-N 2.94Å; L134-G137 PolarHBondContact O-N 3.46Å; G137-L139 PolarHBondContact O-N 2.9Å; G137-I140 PolarHBondContact O-N 3.2Å; G137-M141 WeakPolarHBondContact O-CG 3.49Å; G137-M141 PolarHBondContact O-N 2.89Å
138	S	98.6	Very high	97.9	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-58.2	-45.6	173.5	171.8	0	0	0	0	111.9	G102 L134 M135 L136 M141 S142 F176	G102-S138 PolarHBondContact O-OG 3.38Å; L134-S138 WeakPolarHBondContact O-CB 3.47Å; L134-S138 PolarHBondContact O-N 3.26Å; M135-S138 WeakPolarHBondContact O-CB 3.35Å; M135-S138 PolarHBondContact O-N 2.88Å; L136-S138 VanDerWaalsContact C-N 3.31Å; L136-S138 PolarHBondContact O-N 3.12Å; S138-M141 PolarHBondContact O-N 2.85Å; S138-S142 WeakPolarHBondContact O-CB 3.24Å; S138-S142 PolarHBondContact O-N 2.79Å; S138-S142 PolarHBondContact O-OG 2.93Å; S138-F176 WeakPolarHBondContact OG-CZ 3.48Å
139	L	98.6	Very high	98.2	Very high	14 Å²	14	39 Å²	39	7%	0.073	22%	0.222	C	C	.	.	H	α-helix	trans	-61.7	-47.1	177.7	179.7	58.2	0	0	0	111.7	M135 L136 G137 M141 S142 I143 F176 T177	M135-L139 PolarHBondContact O-N 3.38Å; L136-L139 WeakPolarHBondContact O-CB 3.19Å; L136-L139 PolarHBondContact O-N 3.28Å; L136-L139 VanDerWaalsContact O-N 3.15Å; G137-L139 PolarHBondContact O-N 2.9Å; L139-M141 PolarHBondContact O-N 2.82Å; L139-S142 WeakPolarHBondContact O-CB 3.34Å; L139-S142 PolarHBondContact O-N 3.43Å; L139-I143 HydrophobicContact CD1-CD1 3.94Å; L139-I143 HydrophobicContact CD1-CG1 4.19Å; L139-I143 HydrophobicContact CG-CD1 3.89Å; L139-I143 WeakPolarHBondContact O-CG1 3.38Å; L139-I143 PolarHBondContact O-N 3.17Å; L139-F176 HydrophobicContact CB-CD1 4.3Å; L139-F176 HydrophobicContact CB-CE1 3.96Å; L139-F176 HydrophobicContact CD1-CD1 4.26Å; L139-T177 VanDerWaalsContact CD1-OG1 3.29Å; L139-T177 WeakPolarHBondContact CD1-OG1 3.4Å; L139-T177 HydrophobicContact CD2-CG2 4.33Å
140	I	98.8	Very high	98.3	Very high	89 Å²	89	37.1 Å²	37.1	46%	0.456	21%	0.21	S	C	.	.	H	α-helix	trans	-59.2	-48.9	178.9	-68.5	166.9	0	0	0	110.5	L136 G137 S142 I143 L144	L136-I140 HydrophobicContact CD1-CD1 4.26Å; L136-I140 HydrophobicContact CD1-CG1 4.35Å; L136-I140 HydrophobicContact CG-CD1 4.03Å; L136-I140 WeakPolarHBondContact O-CG1 3.28Å; L136-I140 PolarHBondContact O-N 3.49Å; G137-I140 PolarHBondContact O-N 3.2Å; I140-S142 VanDerWaalsContact C-N 3.29Å; I140-S142 PolarHBondContact O-N 2.89Å; I140-I143 PolarHBondContact O-N 3.42Å; I140-L144 HydrophobicContact CG2-CD1 4.22Å; I140-L144 WeakPolarHBondContact O-CG 3.44Å; I140-L144 PolarHBondContact O-N 2.95Å
141	M	98.8	Very high	98.4	Very high	45 Å²	45	37 Å²	37	22%	0.222	21%	0.21	C	C	.	.	H	α-helix	trans	-60.5	-40.1	177.6	-68.6	-174	77	0	0	112	L98 T101 L106 G137 S138 L139 L144 G145	L98-M141 HydrophobicContact CD2-CE 3.68Å; T101-M141 HydrophobicContact CG2-CE 3.55Å; T101-M141 HydrophobicContact CG2-SD 4.25Å; L106-M141 HydrophobicContact CD2-SD 4.28Å; G137-M141 WeakPolarHBondContact O-CG 3.49Å; G137-M141 PolarHBondContact O-N 2.89Å; S138-M141 PolarHBondContact O-N 2.85Å; L139-M141 PolarHBondContact O-N 2.82Å; M141-L144 PolarHBondContact O-N 2.86Å; M141-G145 PolarHBondContact O-N 2.96Å
142	S	98.3	Very high	98.5	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-65.2	-42	178.4	-54.1	0	0	0	0	111.9	M99 L103 S138 L139 I140 G145 L146	M99-S142 WeakPolarHBondContact CE-O 3.32Å; L103-S142 WeakPolarHBondContact CB-OG 3.46Å; L103-S142 WeakPolarHBondContact CD1-OG 3.32Å; S138-S142 WeakPolarHBondContact O-CB 3.24Å; S138-S142 PolarHBondContact O-N 2.79Å; S138-S142 PolarHBondContact O-OG 2.93Å; L139-S142 WeakPolarHBondContact O-CB 3.34Å; L139-S142 PolarHBondContact O-N 3.43Å; I140-S142 VanDerWaalsContact C-N 3.29Å; I140-S142 PolarHBondContact O-N 2.89Å; S142-G145 PolarHBondContact O-N 3.32Å; S142-L146 PolarHBondContact O-N 3.45Å
143	I	98.7	Very high	98.5	Very high	81 Å²	81	37.9 Å²	37.9	42%	0.415	21%	0.211	S	C	.	.	H	α-helix	trans	-61.9	-47.1	175.3	-69.2	165.7	0	0	0	110.2	L139 I140 G145 L146 C147	L139-I143 HydrophobicContact CD1-CD1 3.94Å; L139-I143 HydrophobicContact CD1-CG1 4.19Å; L139-I143 HydrophobicContact CG-CD1 3.89Å; L139-I143 WeakPolarHBondContact O-CG1 3.38Å; L139-I143 PolarHBondContact O-N 3.17Å; I140-I143 PolarHBondContact O-N 3.42Å; I143-G145 VanDerWaalsContact C-N 3.3Å; I143-G145 PolarHBondContact O-N 3.48Å; I143-L146 WeakPolarHBondContact O-CB 3.44Å; I143-L146 PolarHBondContact O-N 2.7Å; I143-L146 VanDerWaalsContact O-N 3.09Å; I143-C147 PolarHBondContact O-N 3.47Å; I143-C147 PolarHBondContact O-SG 2.94Å
144	L	98.8	Very high	98.5	Very high	78 Å²	78	39.4 Å²	39.4	41%	0.408	21%	0.211	S	C	.	.	H	α-helix	trans	-60.2	-40.5	176	-67.6	175.2	0	0	0	111.9	W85 L98 I140 M141 L146 C147 A148	W85-L144 WeakPolarHBondContact CH2-O 3.36Å; L98-L144 HydrophobicContact CD1-CB 3.78Å; I140-L144 HydrophobicContact CG2-CD1 4.22Å; I140-L144 WeakPolarHBondContact O-CG 3.44Å; I140-L144 PolarHBondContact O-N 2.95Å; M141-L144 PolarHBondContact O-N 2.86Å; L144-L146 VanDerWaalsContact C-N 3.32Å; L144-L146 PolarHBondContact O-N 3.29Å; L144-C147 PolarHBondContact O-N 3.02Å; L144-A148 WeakPolarHBondContact O-CB 3.41Å; L144-A148 PolarHBondContact O-N 3.41Å
145	G	98.7	Very high	98.4	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-65.1	-33.1	175.1	0	0	0	0	0	113.2	H95 M141 S142 I143 V149	H95-G145 PolarHBondContact ND1-O 2.72Å; M141-G145 PolarHBondContact O-N 2.96Å; S142-G145 PolarHBondContact O-N 3.32Å; I143-G145 VanDerWaalsContact C-N 3.3Å; I143-G145 PolarHBondContact O-N 3.48Å; G145-V149 PolarHBondContact O-N 3.44Å
146	L	98.6	Very high	98.3	Very high	31 Å²	31	45.1 Å²	45.1	16%	0.162	24%	0.244	C	C	.	.	H	α-helix	trans	-68.8	-48.4	170.7	-73.5	-174	0	0	0	111.2	M99 S142 I143 L144 A148 V149 F150 I170 I173	M99-L146 HydrophobicContact CE-CD2 3.74Å; M99-L146 HydrophobicContact CE-CG 3.77Å; S142-L146 PolarHBondContact O-N 3.45Å; I143-L146 WeakPolarHBondContact O-CB 3.44Å; I143-L146 PolarHBondContact O-N 2.7Å; I143-L146 VanDerWaalsContact O-N 3.09Å; L144-L146 VanDerWaalsContact C-N 3.32Å; L144-L146 PolarHBondContact O-N 3.29Å; L146-A148 PolarHBondContact O-N 3.37Å; L146-V149 HydrophobicContact CD2-CG1 4.45Å; L146-V149 VanDerWaalsContact O-CG1 3.22Å; L146-V149 WeakPolarHBondContact O-CG1 3.4Å; L146-V149 PolarHBondContact O-N 2.94Å; L146-V149 VanDerWaalsContact O-N 3.11Å; L146-F150 HydrophobicContact CB-CD2 4.26Å; L146-F150 HydrophobicContact CB-CE2 4.48Å; L146-F150 HydrophobicContact CD2-CE2 4.32Å; L146-F150 VanDerWaalsContact O-CD2 3.31Å; L146-F150 WeakPolarHBondContact O-CD2 3.32Å; L146-F150 PolarHBondContact O-N 3.03Å; L146-I170 HydrophobicContact CD1-CD1 3.89Å; L146-I173 HydrophobicContact CD1-CD1 3.55Å; L146-I173 HydrophobicContact CD1-CG2 4.14Å; L146-I173 HydrophobicContact CD2-CD1 3.81Å; L146-I173 HydrophobicContact CG-CD1 3.63Å
147	C	98.6	Very high	98.3	Very high	51 Å²	51	49.2 Å²	49.2	35%	0.345	27%	0.266	S	S	.	.	H	α-helix	trans	-52.1	-45.5	175.7	-65.7	0	0	0	0	110.9	W85 I143 L144 V149 F150 D151	W85-C147 HydrophobicContact CH2-CB 4.26Å; W85-C147 HydrophobicContact CZ2-CB 4.05Å; I143-C147 PolarHBondContact O-N 3.47Å; I143-C147 PolarHBondContact O-SG 2.94Å; L144-C147 PolarHBondContact O-N 3.02Å; C147-V149 PolarHBondContact O-N 3.02Å; C147-F150 PolarHBondContact O-N 3.25Å; C147-D151 VanDerWaalsContact O-CB 3.23Å; C147-D151 WeakPolarHBondContact O-CB 3.34Å; C147-D151 PolarHBondContact O-N 3.42Å
148	A	98.6	Very high	98.1	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-56.8	-44.4	177.9	0	0	0	0	0	114.1	W85 Q91 W94 L144 L146 F152	W85-A148 HydrophobicContact CH2-CB 4.07Å; W85-A148 HydrophobicContact CZ3-CB 4.09Å; Q91-A148 HydrophobicContact CG-CB 4.22Å; W94-A148 HydrophobicContact CB-CB 3.91Å; L144-A148 WeakPolarHBondContact O-CB 3.41Å; L144-A148 PolarHBondContact O-N 3.41Å; L146-A148 PolarHBondContact O-N 3.37Å; A148-F152 VanDerWaalsContact O-CB 3.28Å; A148-F152 WeakPolarHBondContact O-CB 3.38Å; A148-F152 PolarHBondContact O-N 3.3Å
149	V	98.4	Very high	98	Very high	15 Å²	15	54.5 Å²	54.5	9%	0.091	30%	0.296	C	S	.	.	H	α-helix	trans	-77.6	-39.1	-179.8	63.8	0	0	0	0	112.6	F92 H95 G145 L146 C147 F152 H153	F92-V149 HydrophobicContact CD2-CB 4.44Å; F92-V149 HydrophobicContact CD2-CG2 3.96Å; F92-V149 HydrophobicContact CE2-CG2 3.77Å; H95-V149 HydrophobicContact CB-CB 4.13Å; G145-V149 PolarHBondContact O-N 3.44Å; L146-V149 HydrophobicContact CD2-CG1 4.45Å; L146-V149 VanDerWaalsContact O-CG1 3.22Å; L146-V149 WeakPolarHBondContact O-CG1 3.4Å; L146-V149 PolarHBondContact O-N 2.94Å; L146-V149 VanDerWaalsContact O-N 3.11Å; C147-V149 PolarHBondContact O-N 3.02Å; V149-F152 PolarHBondContact O-N 3.26Å; V149-H153 WeakPolarHBondContact O-CB 3.25Å; V149-H153 PolarHBondContact O-N 3.28Å
150	F	98.4	Very high	98	Very high	57 Å²	57	56.3 Å²	56.3	25%	0.25	31%	0.305	C	S	.	.	H	α-helix	trans	-65.7	-45.5	177.7	-86.4	-82.6	0	0	0	111.4	L146 C147 F152 H153 N154 N160 L161	L146-F150 HydrophobicContact CB-CD2 4.26Å; L146-F150 HydrophobicContact CB-CE2 4.48Å; L146-F150 HydrophobicContact CD2-CE2 4.32Å; L146-F150 VanDerWaalsContact O-CD2 3.31Å; L146-F150 WeakPolarHBondContact O-CD2 3.32Å; L146-F150 PolarHBondContact O-N 3.03Å; C147-F150 PolarHBondContact O-N 3.25Å; F150-F152 VanDerWaalsContact C-N 3.34Å; F150-F152 PolarHBondContact O-N 2.99Å; F150-H153 PolarHBondContact O-N 2.83Å; F150-N154 WeakPolarHBondContact O-CB 3.48Å; F150-N154 PolarHBondContact O-N 2.8Å; F150-N154 PolarHBondContact O-ND2 3.23Å; F150-N154 PolarHBondContact O-OD1 2.87Å; F150-N160 HydrophobicContact CD1-CB 4.2Å; F150-N160 HydrophobicContact CE1-CB 3.82Å; F150-L161 HydrophobicContact CE1-CG 4.45Å; F150-L161 HydrophobicContact CZ-CD1 4.28Å; F150-L161 HydrophobicContact CZ-CD2 4.06Å; F150-L161 HydrophobicContact CZ-CG 4.09Å
151	D	98.3	Very high	97.9	Very high	69 Å²	69	55.6 Å²	55.6	37%	0.369	30%	0.302	S	S	.	.	H	α-helix	trans	-61.2	-44.1	176.2	-71.2	-11.7	0	0	0	111.1	Q91 C147 N154 A155	Q91-D151 PolarHBondContact NE2-OD2 3.33Å; C147-D151 VanDerWaalsContact O-CB 3.23Å; C147-D151 WeakPolarHBondContact O-CB 3.34Å; C147-D151 PolarHBondContact O-N 3.42Å; D151-N154 PolarHBondContact O-N 3.18Å; D151-A155 VanDerWaalsContact O-CB 3.25Å; D151-A155 WeakPolarHBondContact O-CB 3.21Å; D151-A155 PolarHBondContact O-N 2.89Å
152	F	98	Very high	97.7	Very high	31 Å²	31	59.7 Å²	59.7	14%	0.136	32%	0.316	C	S	.	.	H	α-helix	trans	-60.3	-49.5	175.7	166.6	-104.2	0	0	0	112.1	S88 F92 A148 V149 F150 N154 A155 K156	S88-F152 VanDerWaalsContact O-CD2 3.25Å; S88-F152 WeakPolarHBondContact O-CD2 3.28Å; F92-F152 HydrophobicContact CB-CB 4.22Å; F92-F152 HydrophobicContact CB-CD1 3.84Å; F92-F152 HydrophobicContact CB-CD2 4.04Å; F92-F152 HydrophobicContact CB-CE1 4.19Å; F92-F152 HydrophobicContact CB-CE2 4.36Å; F92-F152 HydrophobicContact CB-CG 3.75Å; F92-F152 HydrophobicContact CB-CZ 4.44Å; F92-F152 AromaticContact CD2-CD1 3.54Å; F92-F152 HydrophobicContact CD2-CD1 3.54Å; F92-F152 AromaticContact CD2-CE1 3.84Å; F92-F152 HydrophobicContact CD2-CE1 3.84Å; F92-F152 HydrophobicContact CD2-CG 4.26Å; F92-F152 HydrophobicContact CG-CD1 4.07Å; F92-F152 HydrophobicContact CG-CE1 4.23Å; F92-F152 HydrophobicContact CG-CG 4.47Å; A148-F152 VanDerWaalsContact O-CB 3.28Å; A148-F152 WeakPolarHBondContact O-CB 3.38Å; A148-F152 PolarHBondContact O-N 3.3Å; V149-F152 PolarHBondContact O-N 3.26Å; F150-F152 VanDerWaalsContact C-N 3.34Å; F150-F152 PolarHBondContact O-N 2.99Å; F152-N154 VanDerWaalsContact C-N 3.35Å; F152-N154 PolarHBondContact O-N 3.1Å; F152-A155 PolarHBondContact O-N 3.36Å; F152-K156 HydrophobicContact CD2-CG 3.92Å; F152-K156 HydrophobicContact CE2-CD 4.45Å; F152-K156 HydrophobicContact CE2-CG 3.56Å; F152-K156 HydrophobicContact CZ-CG 3.99Å; F152-K156 WeakPolarHBondContact O-CB 3.47Å; F152-K156 WeakPolarHBondContact O-CG 3.24Å; F152-K156 PolarHBondContact O-N 2.95Å
153	H	97.9	Very high	97.7	Very high	34 Å²	34	60.4 Å²	60.4	16%	0.157	32%	0.321	C	S	.	.	H	α-helix	trans	-61.3	-44	178.6	-76	172.8	0	0	0	111.8	V149 F150 K156 N157 T158 N160	V149-H153 WeakPolarHBondContact O-CB 3.25Å; V149-H153 PolarHBondContact O-N 3.28Å; F150-H153 PolarHBondContact O-N 2.83Å; H153-K156 CarbonylContact O-C 3.48Å; H153-K156 PolarHBondContact O-N 3.43Å; H153-N157 PolarHBondContact O-N 3.21Å; H153-T158 PolarHBondContact O-N 2.86Å; H153-N160 WeakPolarHBondContact CB-OD1 3.23Å; H153-N160 PolarHBondContact ND1-OD1 3.46Å
154	N	98.1	Very high	97.7	Very high	92 Å²	92	62.5 Å²	62.5	49%	0.492	33%	0.333	S	S	.	.	H	α-helix	trans	-62.7	-45.3	177.8	-66.3	-14.6	0	0	0	111.1	F150 D151 F152 K156 N157 N160	F150-N154 WeakPolarHBondContact O-CB 3.48Å; F150-N154 PolarHBondContact O-N 2.8Å; F150-N154 PolarHBondContact O-ND2 3.23Å; F150-N154 PolarHBondContact O-OD1 2.87Å; D151-N154 PolarHBondContact O-N 3.18Å; F152-N154 VanDerWaalsContact C-N 3.35Å; F152-N154 PolarHBondContact O-N 3.1Å; N154-K156 PolarHBondContact O-N 3.22Å; N154-N157 PolarHBondContact O-N 3.31Å; N154-N160 PolarHBondContact OD1-ND2 3.1Å
155	A	97.6	Very high	97.7	Very high	57 Å²	57	60.5 Å²	60.5	47%	0.471	32%	0.321	S	S	.	.	H	α-helix	trans	-64.4	-27.8	176.8	0	0	0	0	0	113.3	D151 F152	D151-A155 VanDerWaalsContact O-CB 3.25Å; D151-A155 WeakPolarHBondContact O-CB 3.21Å; D151-A155 PolarHBondContact O-N 2.89Å; F152-A155 PolarHBondContact O-N 3.36Å
156	K	96.4	Very high	97.7	Very high	115 Å²	115	61.5 Å²	61.5	50%	0.5	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	6.8	177	-61.4	-55.2	-179.8	-171.3	0	114.1	F152 H153 N154 T158	F152-K156 HydrophobicContact CD2-CG 3.92Å; F152-K156 HydrophobicContact CE2-CD 4.45Å; F152-K156 HydrophobicContact CE2-CG 3.56Å; F152-K156 HydrophobicContact CZ-CG 3.99Å; F152-K156 WeakPolarHBondContact O-CB 3.47Å; F152-K156 WeakPolarHBondContact O-CG 3.24Å; F152-K156 PolarHBondContact O-N 2.95Å; H153-K156 CarbonylContact O-C 3.48Å; H153-K156 PolarHBondContact O-N 3.43Å; N154-K156 PolarHBondContact O-N 3.22Å; K156-T158 PolarHBondContact O-N 3.17Å; K156-T158 VanDerWaalsContact O-N 3.16Å; K156-T158 PolarHBondContact O-OG1 3.45Å
157	N	96.7	Very high	97.7	Very high	151 Å²	151	67.5 Å²	67.5	81%	0.807	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	36.5	-174.5	-61.3	-67.1	0	0	0	113.2	H153 N154	H153-N157 PolarHBondContact O-N 3.21Å; N154-N157 PolarHBondContact O-N 3.31Å
158	T	95.3	Very high	97.7	Very high	46 Å²	46	67.1 Å²	67.1	28%	0.282	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-91.1	132.6	176.5	-41.2	0	0	0	0	108.6	H153 K156	H153-T158 PolarHBondContact O-N 2.86Å; K156-T158 PolarHBondContact O-N 3.17Å; K156-T158 VanDerWaalsContact O-N 3.16Å; K156-T158 PolarHBondContact O-OG1 3.45Å
159	P	96.8	Very high	97.7	Very high	88 Å²	88	67.8 Å²	67.8	57%	0.571	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-58.1	141.5	177.1	-25.1	34.4	0	0	0	111.9	Y162	P159-Y162 HydrophobicContact CB-CD1 4.04Å; P159-Y162 WeakPolarHBondContact O-CD1 3.35Å; P159-Y162 VanDerWaalsContact O-CE1 3.27Å; P159-Y162 WeakPolarHBondContact O-CE1 3.36Å
160	N	97.6	Very high	97.7	Very high	52 Å²	52	69.1 Å²	69.1	28%	0.278	36%	0.356	S	S	.	.	S	Bend	trans	-90.5	154.8	175	-72.3	-59.4	0	0	0	111.3	F150 H153 N154 Y162	F150-N160 HydrophobicContact CD1-CB 4.2Å; F150-N160 HydrophobicContact CE1-CB 3.82Å; H153-N160 WeakPolarHBondContact CB-OD1 3.23Å; H153-N160 PolarHBondContact ND1-OD1 3.46Å; N154-N160 PolarHBondContact OD1-ND2 3.1Å; N160-Y162 VanDerWaalsContact C-N 3.31Å; N160-Y162 PolarHBondContact O-N 3.36Å
161	L	96.4	Very high	97.7	Very high	75 Å²	75	69.5 Å²	69.5	39%	0.393	36%	0.363	S	S	.	.	S	Bend	trans	56.1	31.7	168.6	-58.4	179.3	0	0	0	116.3	F150 S166 W167 I170	F150-L161 HydrophobicContact CE1-CG 4.45Å; F150-L161 HydrophobicContact CZ-CD1 4.28Å; F150-L161 HydrophobicContact CZ-CD2 4.06Å; F150-L161 HydrophobicContact CZ-CG 4.09Å; L161-S166 VanDerWaalsContact C-OG 3.3Å; L161-S166 VanDerWaalsContact CA-OG 3.24Å; L161-S166 WeakPolarHBondContact CA-OG 3.36Å; L161-W167 PolarHBondContact O-NE1 2.82Å; L161-I170 HydrophobicContact CD2-CB 4.34Å; L161-I170 HydrophobicContact CD2-CG2 4.49Å
162	Y	96.6	Very high	97.7	Very high	130 Å²	130	66.2 Å²	66.2	51%	0.51	35%	0.345	S	S	.	.			trans	-95.9	-16.1	178	72.1	-91.5	0	0	0	114	P159 N160	P159-Y162 HydrophobicContact CB-CD1 4.04Å; P159-Y162 WeakPolarHBondContact O-CD1 3.35Å; P159-Y162 VanDerWaalsContact O-CE1 3.27Å; P159-Y162 WeakPolarHBondContact O-CE1 3.36Å; N160-Y162 VanDerWaalsContact C-N 3.31Å; N160-Y162 PolarHBondContact O-N 3.36Å
163	S	98.1	Very high	97.7	Very high	16 Å²	16	65.2 Å²	65.2	11%	0.112	34%	0.341	C	S	.	.	S	Bend	trans	-93.6	152.3	-177	80.9	0	0	0	0	112.2	H165 S166 W167 E225	S163-H165 PolarHBondContact O-N 3.48Å; S163-S166 PolarHBondContact N-OG 2.7Å; S163-S166 PolarHBondContact O-N 3.45Å; S163-S166 PolarHBondContact O-OG 2.87Å; S163-S166 PolarHBondContact OG-N 3.05Å; S163-W167 PolarHBondContact O-N 3.5Å; S163-W167 VanDerWaalsContact O-N 3.16Å; S163-E225 WeakPolarHBondContact CB-OE1 3.44Å; S163-E225 PolarHBondContact OG-OE1 3.33Å; S163-E225 PolarHBondContact OG-OE2 2.84Å; S163-E225 VanDerWaalsContact OG-OE2 3.05Å
164	L	98.2	Very high	97.7	Very high	125 Å²	125	68 Å²	68	65%	0.654	36%	0.356	S	S	*	.	H	α-helix	trans	-61.3	-35.8	175.7	-173.2	65.6	0	0	0	111.9	S166 W167 I168	L164-S166 VanDerWaalsContact C-N 3.29Å; L164-S166 PolarHBondContact O-N 2.97Å; L164-W167 PolarHBondContact O-N 3.45Å; L164-I168 HydrophobicContact CG-CD1 4.04Å; L164-I168 HydrophobicContact CG-CG1 4.47Å; L164-I168 WeakPolarHBondContact O-CG1 3.19Å; L164-I168 PolarHBondContact O-N 2.94Å
165	H	98.4	Very high	97.7	Very high	35 Å²	35	66.2 Å²	66.2	16%	0.162	35%	0.346	C	S	.	.	H	α-helix	trans	-53.8	-48.3	172	163.6	65	0	0	0	111.1	H95 S163 W167 I168 G169 A218 S221 G222 E225	H95-H165 AromaticContact NE2-NE2 3.81Å; S163-H165 PolarHBondContact O-N 3.48Å; H165-W167 VanDerWaalsContact C-N 3.34Å; H165-W167 PolarHBondContact O-N 3.23Å; H165-I168 PolarHBondContact O-N 3.5Å; H165-G169 PolarHBondContact O-N 2.94Å; H165-A218 PolarHBondContact CE1-O 3.08Å; H165-A218 PolarHBondContact ND1-O 2.94Å; H165-S221 PolarHBondContact ND1-OG 3.04Å; H165-G222 VanDerWaalsContact CE1-CA 3.48Å; H165-G222 WeakPolarHBondContact CE1-CA 3.35Å; H165-G222 WeakPolarHBondContact ND1-CA 3.39Å; H165-G222 PolarHBondContact ND1-N 3.5Å; H165-E225 WeakPolarHBondContact CB-OE2 3.45Å; H165-E225 IonicContact CD2-OE2 3.85Å; H165-E225 PolarHBondContact CD2-OE2 2.9Å; H165-E225 IonicContact CG-OE2 3.33Å
166	S	98.3	Very high	97.8	Very high	21 Å²	21	63.7 Å²	63.7	15%	0.147	33%	0.325	C	S	.	.	H	α-helix	trans	-65.9	-34.3	-179	73	0	0	0	0	113.3	L161 S163 L164 I170	L161-S166 VanDerWaalsContact C-OG 3.3Å; L161-S166 VanDerWaalsContact CA-OG 3.24Å; L161-S166 WeakPolarHBondContact CA-OG 3.36Å; S163-S166 PolarHBondContact N-OG 2.7Å; S163-S166 PolarHBondContact O-N 3.45Å; S163-S166 PolarHBondContact O-OG 2.87Å; S163-S166 PolarHBondContact OG-N 3.05Å; L164-S166 VanDerWaalsContact C-N 3.29Å; L164-S166 PolarHBondContact O-N 2.97Å; S166-I170 WeakPolarHBondContact O-CB 3.47Å; S166-I170 WeakPolarHBondContact O-CG2 3.23Å; S166-I170 PolarHBondContact O-N 3.47Å
167	W	98.6	Very high	97.9	Very high	158 Å²	158	61 Å²	61	60%	0.598	32%	0.318	S	S	*	.	H	α-helix	trans	-68.5	-48.7	175.5	-72.3	22.5	0	0	0	111.3	L161 S163 L164 H165 G169 I170 T171	L161-W167 PolarHBondContact O-NE1 2.82Å; S163-W167 PolarHBondContact O-N 3.5Å; S163-W167 VanDerWaalsContact O-N 3.16Å; L164-W167 PolarHBondContact O-N 3.45Å; H165-W167 VanDerWaalsContact C-N 3.34Å; H165-W167 PolarHBondContact O-N 3.23Å; W167-G169 VanDerWaalsContact C-N 3.31Å; W167-G169 PolarHBondContact O-N 3.47Å; W167-I170 WeakPolarHBondContact O-CG2 3.37Å; W167-T171 WeakPolarHBondContact O-CB 3.45Å; W167-T171 PolarHBondContact O-N 3.42Å; W167-T171 VanDerWaalsContact O-N 3.08Å; W167-T171 PolarHBondContact O-OG1 2.87Å
168	I	98.6	Very high	98	Very high	43 Å²	43	58.8 Å²	58.8	22%	0.221	31%	0.306	C	S	.	.	H	α-helix	trans	-61.4	-43.5	176.6	-63.1	172.2	0	0	0	110.2	L164 H165 T171 A172 L214 A217 A218	L164-I168 HydrophobicContact CG-CD1 4.04Å; L164-I168 HydrophobicContact CG-CG1 4.47Å; L164-I168 WeakPolarHBondContact O-CG1 3.19Å; L164-I168 PolarHBondContact O-N 2.94Å; H165-I168 PolarHBondContact O-N 3.5Å; I168-T171 PolarHBondContact O-N 2.94Å; I168-A172 WeakPolarHBondContact O-CB 3.41Å; I168-A172 PolarHBondContact O-N 3.3Å; I168-L214 HydrophobicContact CG2-CG 4.26Å; I168-L214 WeakPolarHBondContact CG2-O 3.11Å; I168-A217 HydrophobicContact CG2-CB 4.46Å; I168-A218 HydrophobicContact CG2-CB 4.04Å
169	G	98.3	Very high	98.1	Very high	13 Å²	13	57.4 Å²	57.4	13%	0.134	30%	0.296	C	S	.	.	H	α-helix	trans	-63.1	-48.6	-179.4	0	0	0	0	0	113.4	H165 W167 T171 A172 I173	H165-G169 PolarHBondContact O-N 2.94Å; W167-G169 VanDerWaalsContact C-N 3.31Å; W167-G169 PolarHBondContact O-N 3.47Å; G169-T171 PolarHBondContact O-N 3.32Å; G169-A172 WeakPolarHBondContact O-CB 3.38Å; G169-A172 PolarHBondContact O-N 3.4Å; G169-I173 PolarHBondContact O-N 2.96Å
170	I	98.1	Very high	98.2	Very high	44 Å²	44	56.5 Å²	56.5	23%	0.226	28%	0.281	C	S	.	.	H	α-helix	trans	-67.3	-38.2	179.5	-157.9	60.6	0	0	0	111.3	L146 L161 S166 W167 A172 I173 I174	L146-I170 HydrophobicContact CD1-CD1 3.89Å; L161-I170 HydrophobicContact CD2-CB 4.34Å; L161-I170 HydrophobicContact CD2-CG2 4.49Å; S166-I170 WeakPolarHBondContact O-CB 3.47Å; S166-I170 WeakPolarHBondContact O-CG2 3.23Å; S166-I170 PolarHBondContact O-N 3.47Å; W167-I170 WeakPolarHBondContact O-CG2 3.37Å; I170-A172 PolarHBondContact O-N 2.84Å; I170-I173 PolarHBondContact O-N 3.25Å; I170-I174 HydrophobicContact CG1-CD1 4.16Å; I170-I174 VanDerWaalsContact O-CG1 3.28Å; I170-I174 WeakPolarHBondContact O-CG1 3.42Å; I170-I174 PolarHBondContact O-N 2.8Å
171	T	98.6	Very high	98.2	Very high	64 Å²	64	55.5 Å²	55.5	39%	0.393	28%	0.283	S	S	.	.	H	α-helix	trans	-60.7	-44.8	172.7	-61.9	0	0	0	0	111.4	W167 I168 G169 I173 I174 L175 L214	W167-T171 WeakPolarHBondContact O-CB 3.45Å; W167-T171 PolarHBondContact O-N 3.42Å; W167-T171 VanDerWaalsContact O-N 3.08Å; W167-T171 PolarHBondContact O-OG1 2.87Å; I168-T171 PolarHBondContact O-N 2.94Å; G169-T171 PolarHBondContact O-N 3.32Å; T171-I173 PolarHBondContact O-N 2.88Å; T171-I174 PolarHBondContact O-N 2.93Å; T171-L175 HydrophobicContact CG2-CD1 3.84Å; T171-L175 HydrophobicContact CG2-CG 4.31Å; T171-L175 WeakPolarHBondContact O-CB 3.48Å; T171-L175 VanDerWaalsContact O-CG 3.28Å; T171-L175 WeakPolarHBondContact O-CG 3.08Å; T171-L175 PolarHBondContact O-N 3.42Å; T171-L214 HydrophobicContact CG2-CD2 3.96Å
172	A	98.6	Very high	98.2	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-58.7	-45.9	177.9	0	0	0	0	0	111.8	I168 G169 I170 L175 F176 L214	I168-A172 WeakPolarHBondContact O-CB 3.41Å; I168-A172 PolarHBondContact O-N 3.3Å; G169-A172 WeakPolarHBondContact O-CB 3.38Å; G169-A172 PolarHBondContact O-N 3.4Å; I170-A172 PolarHBondContact O-N 2.84Å; A172-L175 PolarHBondContact O-N 3.42Å; A172-F176 VanDerWaalsContact O-CB 3.22Å; A172-F176 WeakPolarHBondContact O-CB 3.43Å; A172-F176 PolarHBondContact O-N 3.42Å; A172-L214 HydrophobicContact CB-CB 4.06Å; A172-L214 HydrophobicContact CB-CD2 4.47Å
173	I	98.4	Very high	98.2	Very high	11 Å²	11	49.6 Å²	49.6	6%	0.056	27%	0.266	C	S	.	.	H	α-helix	trans	-69.6	-40.2	-178.4	-69	170.2	0	0	0	111.9	M99 L103 L146 G169 I170 T171 F176 T177	M99-I173 HydrophobicContact CE-CD1 3.83Å; M99-I173 HydrophobicContact SD-CD1 4.18Å; L103-I173 HydrophobicContact CD2-CD1 4.22Å; L103-I173 HydrophobicContact CD2-CG1 3.6Å; L146-I173 HydrophobicContact CD1-CD1 3.55Å; L146-I173 HydrophobicContact CD1-CG2 4.14Å; L146-I173 HydrophobicContact CD2-CD1 3.81Å; L146-I173 HydrophobicContact CG-CD1 3.63Å; G169-I173 PolarHBondContact O-N 2.96Å; I170-I173 PolarHBondContact O-N 3.25Å; T171-I173 PolarHBondContact O-N 2.88Å; I173-F176 PolarHBondContact O-N 3.33Å; I173-T177 WeakPolarHBondContact O-CB 3.4Å; I173-T177 PolarHBondContact O-N 2.66Å; I173-T177 PolarHBondContact O-OG1 2.94Å
174	I	98.6	Very high	98	Very high	92 Å²	92	52.9 Å²	52.9	47%	0.472	28%	0.278	S	S	.	.	H	α-helix	trans	-61	-50.2	174.6	-70.1	167.1	0	0	0	110	I170 T171 F176 T177 L178	I170-I174 HydrophobicContact CG1-CD1 4.16Å; I170-I174 VanDerWaalsContact O-CG1 3.28Å; I170-I174 WeakPolarHBondContact O-CG1 3.42Å; I170-I174 PolarHBondContact O-N 2.8Å; T171-I174 PolarHBondContact O-N 2.93Å; I174-F176 VanDerWaalsContact C-N 3.32Å; I174-F176 PolarHBondContact O-N 3.26Å; I174-T177 PolarHBondContact O-N 3.03Å; I174-L178 HydrophobicContact CG2-CD1 4.09Å; I174-L178 WeakPolarHBondContact O-CG 3.41Å; I174-L178 PolarHBondContact O-N 3.43Å
175	L	98.6	Very high	97.9	Very high	54 Å²	54	49.3 Å²	49.3	28%	0.283	27%	0.267	S	S	.	.	H	α-helix	trans	-61.4	-41.3	177.9	-69.8	174.9	0	0	0	111.6	T171 A172 T177 L178 Q179 I211 L214	T171-L175 HydrophobicContact CG2-CD1 3.84Å; T171-L175 HydrophobicContact CG2-CG 4.31Å; T171-L175 WeakPolarHBondContact O-CB 3.48Å; T171-L175 VanDerWaalsContact O-CG 3.28Å; T171-L175 WeakPolarHBondContact O-CG 3.08Å; T171-L175 PolarHBondContact O-N 3.42Å; A172-L175 PolarHBondContact O-N 3.42Å; L175-T177 PolarHBondContact O-N 3.02Å; L175-L178 PolarHBondContact O-N 3.21Å; L175-Q179 WeakPolarHBondContact O-CB 3.45Å; L175-Q179 PolarHBondContact O-N 2.8Å; L175-I211 HydrophobicContact CB-CD1 3.9Å; L175-I211 HydrophobicContact CB-CG1 3.8Å; L175-L214 HydrophobicContact CD1-CD2 4.1Å
176	F	98.6	Very high	97.6	Very high	5 Å²	5	47.8 Å²	47.8	2%	0.022	26%	0.261	C	S	.	.	H	α-helix	trans	-62.1	-41.9	176.4	-169.6	-91.4	0	0	0	112.3	L103 Y107 M135 S138 L139 A172 I173 I174 Q179 W180 I211	L103-F176 HydrophobicContact CD1-CB 4.32Å; L103-F176 HydrophobicContact CD1-CD1 4.12Å; L103-F176 HydrophobicContact CD1-CD2 3.92Å; L103-F176 HydrophobicContact CD1-CE1 4.44Å; L103-F176 HydrophobicContact CD1-CE2 4.24Å; L103-F176 HydrophobicContact CD1-CG 3.85Å; L103-F176 HydrophobicContact CD1-CZ 4.5Å; Y107-F176 HydrophobicContact CD1-CD2 4.34Å; Y107-F176 AromaticContact CD1-CE2 3.93Å; Y107-F176 HydrophobicContact CD1-CE2 3.93Å; Y107-F176 AromaticContact CD2-CE2 3.55Å; Y107-F176 HydrophobicContact CD2-CE2 3.55Å; Y107-F176 HydrophobicContact CD2-CZ 4.26Å; Y107-F176 HydrophobicContact CE1-CD2 4.08Å; Y107-F176 AromaticContact CE1-CE2 3.96Å; Y107-F176 HydrophobicContact CE1-CE2 3.96Å; Y107-F176 HydrophobicContact CE2-CD2 4.33Å; Y107-F176 AromaticContact CE2-CE2 3.61Å; Y107-F176 HydrophobicContact CE2-CE2 3.61Å; Y107-F176 AromaticContact CG-CE2 3.7Å; Y107-F176 HydrophobicContact CG-CE2 3.7Å; Y107-F176 HydrophobicContact CG-CZ 4.44Å; Y107-F176 AromaticContact CZ-CE2 3.77Å; M135-F176 HydrophobicContact CB-CZ 4.25Å; M135-F176 WeakPolarHBondContact O-CE1 3.37Å; M135-F176 HydrophobicContact SD-CE2 4.03Å; M135-F176 HydrophobicContact SD-CZ 3.79Å; S138-F176 WeakPolarHBondContact OG-CZ 3.48Å; L139-F176 HydrophobicContact CB-CD1 4.3Å; L139-F176 HydrophobicContact CB-CE1 3.96Å; L139-F176 HydrophobicContact CD1-CD1 4.26Å; A172-F176 VanDerWaalsContact O-CB 3.22Å; A172-F176 WeakPolarHBondContact O-CB 3.43Å; A172-F176 PolarHBondContact O-N 3.42Å; I173-F176 PolarHBondContact O-N 3.33Å; I174-F176 VanDerWaalsContact C-N 3.32Å; I174-F176 PolarHBondContact O-N 3.26Å; F176-Q179 WeakPolarHBondContact O-CB 3.2Å; F176-Q179 PolarHBondContact O-N 3.16Å; F176-W180 WeakPolarHBondContact O-CB 3.22Å; F176-W180 PolarHBondContact O-N 3.24Å; F176-I211 HydrophobicContact CB-CG2 4.06Å; F176-I211 HydrophobicContact CD2-CG2 3.94Å
177	T	98.6	Very high	97.3	Very high	57 Å²	57	48.8 Å²	48.8	35%	0.35	26%	0.263	S	S	.	.	H	α-helix	trans	-64.6	-47.2	178.2	-55.8	0	0	0	0	111.2	L139 I173 I174 L175 Q179 W180 G181	L139-T177 VanDerWaalsContact CD1-OG1 3.29Å; L139-T177 WeakPolarHBondContact CD1-OG1 3.4Å; L139-T177 HydrophobicContact CD2-CG2 4.33Å; I173-T177 WeakPolarHBondContact O-CB 3.4Å; I173-T177 PolarHBondContact O-N 2.66Å; I173-T177 PolarHBondContact O-OG1 2.94Å; I174-T177 PolarHBondContact O-N 3.03Å; L175-T177 PolarHBondContact O-N 3.02Å; T177-Q179 VanDerWaalsContact C-N 3.35Å; T177-Q179 PolarHBondContact O-N 3.04Å; T177-W180 PolarHBondContact O-N 3.24Å; T177-G181 PolarHBondContact O-N 3.17Å
178	L	98.4	Very high	96.9	Very high	106 Å²	106	43.2 Å²	43.2	56%	0.555	25%	0.245	S	C	*	.	H	α-helix	trans	-61.5	-44.5	175.5	-68.7	172.4	0	0	0	111.3	I174 L175 W180 G181 V182	I174-L178 HydrophobicContact CG2-CD1 4.09Å; I174-L178 WeakPolarHBondContact O-CG 3.41Å; I174-L178 PolarHBondContact O-N 3.43Å; L175-L178 PolarHBondContact O-N 3.21Å; L178-W180 VanDerWaalsContact C-N 3.32Å; L178-W180 PolarHBondContact O-N 2.76Å; L178-G181 PolarHBondContact O-N 3.42Å; L178-V182 WeakPolarHBondContact O-CB 3.45Å; L178-V182 WeakPolarHBondContact O-CG2 3.28Å; L178-V182 PolarHBondContact O-N 3.06Å
179	Q	98.1	Very high	96.5	Very high	17 Å²	17	44.6 Å²	44.6	8%	0.079	25%	0.252	C	S	.	.	H	α-helix	trans	-59.4	-41.3	177.2	176.1	73.5	-14.3	0	0	111.9	L175 F176 T177 G183 H204 I211	L175-Q179 WeakPolarHBondContact O-CB 3.45Å; L175-Q179 PolarHBondContact O-N 2.8Å; F176-Q179 WeakPolarHBondContact O-CB 3.2Å; F176-Q179 PolarHBondContact O-N 3.16Å; T177-Q179 VanDerWaalsContact C-N 3.35Å; T177-Q179 PolarHBondContact O-N 3.04Å; Q179-G183 PolarHBondContact O-N 2.99Å; Q179-H204 VanDerWaalsContact CD-ND1 3.31Å; Q179-H204 PolarHBondContact NE2-CE1 3.21Å; Q179-H204 VanDerWaalsContact NE2-CE1 3.29Å; Q179-H204 PolarHBondContact NE2-ND1 3.11Å; Q179-H204 PolarHBondContact NE2-O 3.3Å; Q179-H204 PolarHBondContact OE1-ND1 3.43Å; Q179-I211 HydrophobicContact CB-CD1 3.82Å; Q179-I211 HydrophobicContact CG-CD1 4.01Å
180	W	98.1	Very high	95.8	Very high	68 Å²	68	49.3 Å²	49.3	26%	0.258	28%	0.28	S	S	.	.	H	α-helix	trans	-66.2	-47.6	175.4	-175.5	85	0	0	0	111.6	A132 L136 F176 T177 L178 G183 F184	A132-W180 PolarHBondContact O-NE1 3.45Å; L136-W180 HydrophobicContact CB-CZ2 3.98Å; L136-W180 HydrophobicContact CD1-CH2 4.1Å; L136-W180 HydrophobicContact CD1-CZ2 3.74Å; L136-W180 HydrophobicContact CD2-CZ2 4.08Å; L136-W180 HydrophobicContact CG-CZ2 4.14Å; F176-W180 WeakPolarHBondContact O-CB 3.22Å; F176-W180 PolarHBondContact O-N 3.24Å; T177-W180 PolarHBondContact O-N 3.24Å; L178-W180 VanDerWaalsContact C-N 3.32Å; L178-W180 PolarHBondContact O-N 2.76Å; W180-G183 PolarHBondContact O-N 3.42Å; W180-F184 HydrophobicContact CH2-CD2 4.37Å; W180-F184 HydrophobicContact CZ2-CD2 4.3Å; W180-F184 WeakPolarHBondContact O-CB 3.34Å; W180-F184 PolarHBondContact O-N 3.48Å
181	G	97.6	Very high	95.3	Very high	32 Å²	32	52.7 Å²	52.7	33%	0.33	31%	0.307	S	S	.	.	H	α-helix	trans	-60.9	-47.6	179.2	0	0	0	0	0	112.9	T177 L178 F184 A185	T177-G181 PolarHBondContact O-N 3.17Å; L178-G181 PolarHBondContact O-N 3.42Å; G181-F184 PolarHBondContact O-N 3.5Å; G181-A185 WeakPolarHBondContact O-CB 3.36Å; G181-A185 PolarHBondContact O-N 2.93Å
182	V	96.3	Very high	94.8	Very high	70 Å²	70	50.3 Å²	50.3	42%	0.424	29%	0.293	S	S	.	.	H	α-helix	trans	-64.5	-40.8	175.5	173.4	0	0	0	0	111	L178 G186 L200	L178-V182 WeakPolarHBondContact O-CB 3.45Å; L178-V182 WeakPolarHBondContact O-CG2 3.28Å; L178-V182 PolarHBondContact O-N 3.06Å; V182-G186 PolarHBondContact O-N 3.36Å; V182-L200 HydrophobicContact CG1-CD1 4.31Å; V182-L200 HydrophobicContact CG1-CD2 4.38Å
183	G	96.4	Very high	94.4	Very high	11 Å²	11	54.1 Å²	54.1	11%	0.113	32%	0.317	C	S	.	.	H	α-helix	trans	-63.1	-42.7	177.4	0	0	0	0	0	112.7	Q179 W180 F187	Q179-G183 PolarHBondContact O-N 2.99Å; W180-G183 PolarHBondContact O-N 3.42Å; G183-F187 WeakPolarHBondContact O-CB 3.3Å; G183-F187 WeakPolarHBondContact O-CD2 3.31Å; G183-F187 PolarHBondContact O-N 3.33Å
184	F	95.4	Very high	94	Very high	84 Å²	84	58.1 Å²	58.1	37%	0.368	34%	0.342	S	S	.	.	I	π-helix	trans	-62.5	-53.6	175.6	-177.9	-92.2	0	0	0	111.1	W180 G181 G186 L188 L189	W180-F184 HydrophobicContact CH2-CD2 4.37Å; W180-F184 HydrophobicContact CZ2-CD2 4.3Å; W180-F184 WeakPolarHBondContact O-CB 3.34Å; W180-F184 PolarHBondContact O-N 3.48Å; G181-F184 PolarHBondContact O-N 3.5Å; F184-G186 PolarHBondContact O-N 3.5Å; F184-L188 HydrophobicContact CD2-CB 4.38Å; F184-L188 HydrophobicContact CD2-CD1 3.58Å; F184-L188 HydrophobicContact CE2-CD1 4.01Å; F184-L188 HydrophobicContact CG-CD1 4.48Å; F184-L188 WeakPolarHBondContact O-CB 3.35Å; F184-L188 PolarHBondContact O-N 3.12Å; F184-L189 HydrophobicContact CD1-CD1 4.41Å; F184-L189 HydrophobicContact CD1-CG 4.28Å; F184-L189 HydrophobicContact CE1-CD1 4.17Å; F184-L189 HydrophobicContact CE1-CD2 3.81Å; F184-L189 HydrophobicContact CE1-CG 3.98Å; F184-L189 HydrophobicContact CZ-CD2 4.1Å; F184-L189 PolarHBondContact O-N 3.07Å
185	A	94.6	Very high	93.7	Very high	50 Å²	50	59.6 Å²	59.6	41%	0.413	35%	0.35	S	S	.	.	I	π-helix	trans	-64	-39.6	-179.2	0	0	0	0	0	112.9	G181	G181-A185 WeakPolarHBondContact O-CB 3.36Å; G181-A185 PolarHBondContact O-N 2.93Å
186	G	92.9	Very high	93.3	Very high	4 Å²	4	60.8 Å²	60.8	4%	0.041	36%	0.356	C	S	.	.	I	π-helix	trans	-79.2	-44.3	-176.5	0	0	0	0	0	114.2	V182 F184 S192 R197	V182-G186 PolarHBondContact O-N 3.36Å; F184-G186 PolarHBondContact O-N 3.5Å; G186-S192 VanDerWaalsContact O-CB 3.27Å; G186-S192 WeakPolarHBondContact O-CB 3.47Å; G186-S192 PolarHBondContact O-OG 3.22Å; G186-R197 VanDerWaalsContact O-CG 3.26Å; G186-R197 WeakPolarHBondContact O-CG 3.31Å; G186-R197 PolarHBondContact O-NE 3.31Å
187	F	92.2	Very high	93	Very high	42 Å²	42	63.7 Å²	63.7	18%	0.184	37%	0.367	C	S	.	.	I	π-helix	trans	-110.5	-19.8	-166.3	-55.7	-62.7	0	0	0	115.4	K128 G183 R197 L200 K201 H204	K128-F187 PolarHBondContact NZ-O 2.86Å; G183-F187 WeakPolarHBondContact O-CB 3.3Å; G183-F187 WeakPolarHBondContact O-CD2 3.31Å; G183-F187 PolarHBondContact O-N 3.33Å; F187-R197 HydrophobicContact CD1-CB 4.46Å; F187-R197 HydrophobicContact CD1-CG 4.33Å; F187-R197 HydrophobicContact CE1-CB 4.26Å; F187-L200 HydrophobicContact CE1-CB 4.47Å; F187-L200 HydrophobicContact CZ-CB 3.84Å; F187-K201 HydrophobicContact CE1-CB 4.27Å; F187-K201 HydrophobicContact CZ-CB 4.31Å; F187-H204 HydrophobicContact CE2-CB 3.88Å; F187-H204 AromaticContact CE2-CG 3.69Å; F187-H204 AromaticContact CE2-ND1 3.95Å; F187-H204 HydrophobicContact CZ-CB 4.21Å
188	L	90.6	Very high	92.7	Very high	41 Å²	41	68 Å²	68	22%	0.215	38%	0.381	C	S	.	.	I	π-helix	trans	-99.4	-46.2	177.5	-82.7	175.6	0	0	0	112.9	K128 L129 A132 F184	K128-L188 HydrophobicContact CB-CD2 3.72Å; L129-L188 HydrophobicContact CD2-CD2 3.97Å; A132-L188 HydrophobicContact CB-CD1 3.33Å; A132-L188 HydrophobicContact CB-CG 4.42Å; F184-L188 HydrophobicContact CD2-CB 4.38Å; F184-L188 HydrophobicContact CD2-CD1 3.58Å; F184-L188 HydrophobicContact CE2-CD1 4.01Å; F184-L188 HydrophobicContact CG-CD1 4.48Å; F184-L188 WeakPolarHBondContact O-CB 3.35Å; F184-L188 PolarHBondContact O-N 3.12Å
189	L	89.6	Confident	92.5	Very high	72 Å²	72	68 Å²	68	38%	0.377	38%	0.381	S	S	.	.	S	Bend	trans	-66.8	137.2	179.9	-63.2	-177.7	0	0	0	111.2	F184 C191 R197	F184-L189 HydrophobicContact CD1-CD1 4.41Å; F184-L189 HydrophobicContact CD1-CG 4.28Å; F184-L189 HydrophobicContact CE1-CD1 4.17Å; F184-L189 HydrophobicContact CE1-CD2 3.81Å; F184-L189 HydrophobicContact CE1-CG 3.98Å; F184-L189 HydrophobicContact CZ-CD2 4.1Å; F184-L189 PolarHBondContact O-N 3.07Å; L189-C191 PolarHBondContact O-N 2.79Å; L189-R197 PolarHBondContact O-NH2 2.9Å
190	P	84.3	Confident	92.3	Very high	111 Å²	111	69 Å²	69	72%	0.721	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-28	-177.3	25.5	-32.6	0	0	0	112.3	S192 R197	P190-S192 VanDerWaalsContact C-N 3.27Å; P190-S192 PolarHBondContact O-N 3.01Å; P190-R197 PolarHBondContact O-NH2 2.89Å
191	C	85.9	Confident	92.1	Very high	116 Å²	116	70 Å²	70	78%	0.784	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-7.3	-169.9	-46.3	0	0	0	0	115.7	L189	L189-C191 PolarHBondContact O-N 2.79Å
192	S	87.9	Confident	92	Very high	14 Å²	14	72.2 Å²	72.2	10%	0.098	40%	0.402	C	S	.	.	S	Bend	trans	-78.3	126.9	-176.9	-174.2	0	0	0	0	112.2	G186 P190 R197	G186-S192 VanDerWaalsContact O-CB 3.27Å; G186-S192 WeakPolarHBondContact O-CB 3.47Å; G186-S192 PolarHBondContact O-OG 3.22Å; P190-S192 VanDerWaalsContact C-N 3.27Å; P190-S192 PolarHBondContact O-N 3.01Å; S192-R197 PolarHBondContact O-NE 3.47Å; S192-R197 PolarHBondContact O-NH1 3.3Å; S192-R197 PolarHBondContact O-NH2 3.42Å
193	P	91.4	Very high	92	Very high	80 Å²	80	73.8 Å²	73.8	52%	0.519	41%	0.406	S	S	.	.			trans	-58.1	144.6	178.2	-24.8	33.5	0	0	0	113.3	L195 L196 R197	P193-L195 VanDerWaalsContact C-N 3.3Å; P193-L195 PolarHBondContact O-N 3.48Å; P193-L196 HydrophobicContact CB-CB 4.28Å; P193-L196 WeakPolarHBondContact O-CB 3.14Å; P193-L196 PolarHBondContact O-N 3.27Å; P193-L196 VanDerWaalsContact O-N 3.17Å; P193-R197 PolarHBondContact O-N 2.82Å; P193-R197 VanDerWaalsContact O-N 3.1Å
194	V	89.8	Confident	92.1	Very high	95 Å²	95	75 Å²	75	58%	0.576	41%	0.409	S	S	*	.	H	α-helix	trans	-60.2	-38.9	-179.4	177.8	0	0	0	0	112.1	R197 K198	V194-R197 PolarHBondContact O-N 3.22Å; V194-K198 WeakPolarHBondContact O-CG 3.45Å; V194-K198 PolarHBondContact O-N 2.92Å; V194-K198 VanDerWaalsContact O-N 3.07Å
195	L	91.5	Very high	92.1	Very high	123 Å²	123	75 Å²	75	64%	0.644	42%	0.416	S	S	*	.	H	α-helix	trans	-61.3	-46	177	179.5	60.8	0	0	0	111.5	P193 R197 K198 L199	P193-L195 VanDerWaalsContact C-N 3.3Å; P193-L195 PolarHBondContact O-N 3.48Å; L195-R197 VanDerWaalsContact C-N 3.34Å; L195-R197 PolarHBondContact O-N 2.85Å; L195-K198 PolarHBondContact O-N 3.25Å; L195-K198 VanDerWaalsContact O-N 3.16Å; L195-L199 HydrophobicContact CD1-CD1 4.42Å; L195-L199 HydrophobicContact CG-CD1 4.29Å; L195-L199 WeakPolarHBondContact O-CG 3.41Å; L195-L199 PolarHBondContact O-N 2.83Å; L195-L199 VanDerWaalsContact O-N 3.08Å
196	L	91.3	Very high	92.2	Very high	79 Å²	79	81.2 Å²	81.2	41%	0.414	43%	0.429	S	S	.	.	H	α-helix	trans	-60	-44.8	177.9	-179.8	61.9	0	0	0	111.1	P193 K198 L199 L200	P193-L196 HydrophobicContact CB-CB 4.28Å; P193-L196 WeakPolarHBondContact O-CB 3.14Å; P193-L196 PolarHBondContact O-N 3.27Å; P193-L196 VanDerWaalsContact O-N 3.17Å; L196-K198 VanDerWaalsContact C-N 3.31Å; L196-K198 PolarHBondContact O-N 2.92Å; L196-L199 PolarHBondContact O-N 3.49Å; L196-L200 HydrophobicContact CD1-CD1 3.84Å; L196-L200 HydrophobicContact CD1-CD2 4.49Å; L196-L200 HydrophobicContact CD1-CG 3.89Å; L196-L200 HydrophobicContact CD2-CD1 4.32Å; L196-L200 HydrophobicContact CG-CD1 3.73Å; L196-L200 HydrophobicContact CG-CG 4.18Å; L196-L200 WeakPolarHBondContact O-CB 3.49Å; L196-L200 WeakPolarHBondContact O-CG 3.42Å; L196-L200 PolarHBondContact O-N 2.98Å
197	R	92.5	Very high	92.4	Very high	65 Å²	65	82.9 Å²	82.9	25%	0.245	44%	0.437	C	S	.	.	H	α-helix	trans	-59.7	-39	176.1	-69.2	178.5	179.6	145.8	6.6	112.7	G186 F187 L189 P190 S192 P193 V194 L195 K201	G186-R197 VanDerWaalsContact O-CG 3.26Å; G186-R197 WeakPolarHBondContact O-CG 3.31Å; G186-R197 PolarHBondContact O-NE 3.31Å; F187-R197 HydrophobicContact CD1-CB 4.46Å; F187-R197 HydrophobicContact CD1-CG 4.33Å; F187-R197 HydrophobicContact CE1-CB 4.26Å; L189-R197 PolarHBondContact O-NH2 2.9Å; P190-R197 PolarHBondContact O-NH2 2.89Å; S192-R197 PolarHBondContact O-NE 3.47Å; S192-R197 PolarHBondContact O-NH1 3.3Å; S192-R197 PolarHBondContact O-NH2 3.42Å; P193-R197 PolarHBondContact O-N 2.82Å; P193-R197 VanDerWaalsContact O-N 3.1Å; V194-R197 PolarHBondContact O-N 3.22Å; L195-R197 VanDerWaalsContact C-N 3.34Å; L195-R197 PolarHBondContact O-N 2.85Å; R197-K201 WeakPolarHBondContact O-CB 3.29Å; R197-K201 PolarHBondContact O-N 3.43Å
198	K	91.8	Very high	92.7	Very high	149 Å²	149	81.5 Å²	81.5	65%	0.648	43%	0.434	S	S	*	.	H	α-helix	trans	-65.7	-39.9	177.4	-74.4	-179.3	177.8	-177.3	0	112	V194 L195 L196 P202	V194-K198 WeakPolarHBondContact O-CG 3.45Å; V194-K198 PolarHBondContact O-N 2.92Å; V194-K198 VanDerWaalsContact O-N 3.07Å; L195-K198 PolarHBondContact O-N 3.25Å; L195-K198 VanDerWaalsContact O-N 3.16Å; L196-K198 VanDerWaalsContact C-N 3.31Å; L196-K198 PolarHBondContact O-N 2.92Å; K198-P202 WeakPolarHBondContact O-CD 3.34Å
199	L	93.9	Very high	93	Very high	106 Å²	106	80.2 Å²	80.2	56%	0.555	43%	0.431	S	S	*	.	H	α-helix	trans	-73.2	-39.4	177.6	-65.6	172.7	0	0	0	112.6	L195 L196 P202	L195-L199 HydrophobicContact CD1-CD1 4.42Å; L195-L199 HydrophobicContact CG-CD1 4.29Å; L195-L199 WeakPolarHBondContact O-CG 3.41Å; L195-L199 PolarHBondContact O-N 2.83Å; L195-L199 VanDerWaalsContact O-N 3.08Å; L196-L199 PolarHBondContact O-N 3.49Å; L199-P202 WeakPolarHBondContact O-CD 3.49Å; L199-P202 WeakPolarHBondContact O-CG 3.37Å
200	L	95	Very high	93.4	Very high	38 Å²	38	78.2 Å²	78.2	20%	0.199	42%	0.423	C	S	.	.	H	α-helix	trans	-73.5	-33.1	-179.1	-72.5	178.4	0	0	0	113.2	V182 F187 L196 I203 H204	V182-L200 HydrophobicContact CG1-CD1 4.31Å; V182-L200 HydrophobicContact CG1-CD2 4.38Å; F187-L200 HydrophobicContact CE1-CB 4.47Å; F187-L200 HydrophobicContact CZ-CB 3.84Å; L196-L200 HydrophobicContact CD1-CD1 3.84Å; L196-L200 HydrophobicContact CD1-CD2 4.49Å; L196-L200 HydrophobicContact CD1-CG 3.89Å; L196-L200 HydrophobicContact CD2-CD1 4.32Å; L196-L200 HydrophobicContact CG-CD1 3.73Å; L196-L200 HydrophobicContact CG-CG 4.18Å; L196-L200 WeakPolarHBondContact O-CB 3.49Å; L196-L200 WeakPolarHBondContact O-CG 3.42Å; L196-L200 PolarHBondContact O-N 2.98Å; L200-I203 PolarHBondContact O-N 3.41Å; L200-H204 VanDerWaalsContact O-CB 3.28Å; L200-H204 WeakPolarHBondContact O-CB 3.35Å; L200-H204 PolarHBondContact O-N 2.88Å
201	K	93.8	Very high	94.1	Very high	87 Å²	87	73 Å²	73	38%	0.378	39%	0.389	S	S	.	.	H	α-helix	trans	-52.1	-52.6	-176.5	-177	-179.3	179.5	-174.8	0	113.6	F187 R197 I203 H204 V205 D274	F187-K201 HydrophobicContact CE1-CB 4.27Å; F187-K201 HydrophobicContact CZ-CB 4.31Å; R197-K201 WeakPolarHBondContact O-CB 3.29Å; R197-K201 PolarHBondContact O-N 3.43Å; K201-I203 PolarHBondContact O-N 2.83Å; K201-H204 PolarHBondContact O-N 3.17Å; K201-V205 WeakPolarHBondContact O-CG2 3.18Å; K201-V205 PolarHBondContact O-N 2.76Å; K201-D274 IonicContact NZ-OD1 2.7Å; K201-D274 PolarHBondContact NZ-OD1 3.49Å; K201-D274 IonicContact NZ-OD2 3.45Å
202	P	94.5	Very high	94.7	Very high	80 Å²	80	67.5 Å²	67.5	52%	0.519	35%	0.352	S	S	.	.	H	α-helix	trans	-64	-40.3	179.7	24.2	-34.3	0	0	0	112.5	K198 L199 V205 W206	K198-P202 WeakPolarHBondContact O-CD 3.34Å; L199-P202 WeakPolarHBondContact O-CD 3.49Å; L199-P202 WeakPolarHBondContact O-CG 3.37Å; P202-V205 PolarHBondContact O-N 2.83Å; P202-W206 WeakPolarHBondContact O-CB 3.34Å; P202-W206 PolarHBondContact O-N 3.46Å
203	I	96.9	Very high	95.2	Very high	102 Å²	102	71.3 Å²	71.3	52%	0.523	37%	0.37	S	S	.	.	H	α-helix	trans	-62.8	-46.9	177.5	-59.6	172.3	0	0	0	110	L200 K201 V205 W206 L207	L200-I203 PolarHBondContact O-N 3.41Å; K201-I203 PolarHBondContact O-N 2.83Å; I203-V205 PolarHBondContact O-N 3.05Å; I203-W206 PolarHBondContact O-N 3.42Å; I203-L207 WeakPolarHBondContact O-CB 3.2Å; I203-L207 PolarHBondContact O-N 3.17Å
204	H	97.2	Very high	95.5	Very high	37 Å²	37	70.2 Å²	70.2	17%	0.171	36%	0.36	C	S	.	.	H	α-helix	trans	-59.9	-45.8	178	-178.4	83.5	0	0	0	111.4	Q179 F187 L200 K201 G208	Q179-H204 VanDerWaalsContact CD-ND1 3.31Å; Q179-H204 PolarHBondContact NE2-CE1 3.21Å; Q179-H204 VanDerWaalsContact NE2-CE1 3.29Å; Q179-H204 PolarHBondContact NE2-ND1 3.11Å; Q179-H204 PolarHBondContact NE2-O 3.3Å; Q179-H204 PolarHBondContact OE1-ND1 3.43Å; F187-H204 HydrophobicContact CE2-CB 3.88Å; F187-H204 AromaticContact CE2-CG 3.69Å; F187-H204 AromaticContact CE2-ND1 3.95Å; F187-H204 HydrophobicContact CZ-CB 4.21Å; L200-H204 VanDerWaalsContact O-CB 3.28Å; L200-H204 WeakPolarHBondContact O-CB 3.35Å; L200-H204 PolarHBondContact O-N 2.88Å; K201-H204 PolarHBondContact O-N 3.17Å; H204-G208 PolarHBondContact O-N 2.55Å
205	V	96.1	Very high	95.9	Very high	84 Å²	84	65.8 Å²	65.8	51%	0.509	33%	0.333	S	S	.	.	H	α-helix	trans	-64.9	-45.9	178.9	172.8	0	0	0	0	111.5	K201 P202 I203 G208 G209	K201-V205 WeakPolarHBondContact O-CG2 3.18Å; K201-V205 PolarHBondContact O-N 2.76Å; P202-V205 PolarHBondContact O-N 2.83Å; I203-V205 PolarHBondContact O-N 3.05Å; V205-G208 PolarHBondContact O-N 2.85Å; V205-G209 PolarHBondContact O-N 2.88Å; V205-G209 VanDerWaalsContact O-N 3.14Å
206	W	96.6	Very high	96.3	Very high	181 Å²	181	60.7 Å²	60.7	69%	0.686	31%	0.307	S	S	*	.	H	α-helix	trans	-63.8	-49.6	179.2	179.2	86.8	0	0	0	111.7	P202 I203 G208 G209 S210	P202-W206 WeakPolarHBondContact O-CB 3.34Å; P202-W206 PolarHBondContact O-N 3.46Å; I203-W206 PolarHBondContact O-N 3.42Å; W206-G208 VanDerWaalsContact C-N 3.28Å; W206-G208 PolarHBondContact O-N 2.88Å; W206-G209 PolarHBondContact O-N 3.39Å; W206-G209 VanDerWaalsContact O-N 3.1Å; W206-S210 PolarHBondContact O-N 3.39Å; W206-S210 PolarHBondContact O-OG 2.7Å
207	L	97.9	Very high	96.6	Very high	39 Å²	39	59 Å²	59	20%	0.204	31%	0.305	C	S	.	.	H	α-helix	trans	-63	-37	-179.6	-174.9	59	0	0	0	111.3	I203 S210 I211	I203-L207 WeakPolarHBondContact O-CB 3.2Å; I203-L207 PolarHBondContact O-N 3.17Å; L207-S210 PolarHBondContact O-N 3.33Å; L207-I211 HydrophobicContact CD1-CD1 4.31Å; L207-I211 HydrophobicContact CD1-CG1 4.33Å; L207-I211 HydrophobicContact CG-CD1 3.87Å; L207-I211 HydrophobicContact CG-CG1 4.39Å; L207-I211 WeakPolarHBondContact O-CD1 3.48Å; L207-I211 VanDerWaalsContact O-CG1 3.24Å; L207-I211 WeakPolarHBondContact O-CG1 3.25Å; L207-I211 PolarHBondContact O-N 2.99Å
208	G	97.9	Very high	96.9	Very high	12 Å²	12	56.3 Å²	56.3	12%	0.124	30%	0.296	C	S	.	.	H	α-helix	trans	-60.2	-45	172.4	0	0	0	0	0	112.7	Y107 H204 V205 W206 S210 I211 L212	Y107-G208 WeakPolarHBondContact OH-CA 3.36Å; Y107-G208 PolarHBondContact OH-O 3.17Å; H204-G208 PolarHBondContact O-N 2.55Å; V205-G208 PolarHBondContact O-N 2.85Å; W206-G208 VanDerWaalsContact C-N 3.28Å; W206-G208 PolarHBondContact O-N 2.88Å; G208-S210 VanDerWaalsContact C-N 3.34Å; G208-S210 PolarHBondContact O-N 2.82Å; G208-I211 PolarHBondContact O-N 2.84Å; G208-L212 PolarHBondContact O-N 3.46Å; G208-L212 VanDerWaalsContact O-N 3.17Å
209	G	97.6	Very high	97.3	Very high	15 Å²	15	50 Å²	50	16%	0.155	27%	0.27	C	S	.	.	H	α-helix	trans	-60	-43.4	173.4	0	0	0	0	0	112.8	V205 W206 L212 L213	V205-G209 PolarHBondContact O-N 2.88Å; V205-G209 VanDerWaalsContact O-N 3.14Å; W206-G209 PolarHBondContact O-N 3.39Å; W206-G209 VanDerWaalsContact O-N 3.1Å; G209-L212 WeakPolarHBondContact O-CB 3.36Å; G209-L212 PolarHBondContact O-N 3.34Å; G209-L213 PolarHBondContact O-N 2.91Å
210	S	98.3	Very high	97.5	Very high	30 Å²	30	47.3 Å²	47.3	21%	0.21	26%	0.256	C	S	.	.	H	α-helix	trans	-64.7	-40.4	179	-59.9	0	0	0	0	113.1	W206 L207 G208 L212 L213 L214	W206-S210 PolarHBondContact O-N 3.39Å; W206-S210 PolarHBondContact O-OG 2.7Å; L207-S210 PolarHBondContact O-N 3.33Å; G208-S210 VanDerWaalsContact C-N 3.34Å; G208-S210 PolarHBondContact O-N 2.82Å; S210-L212 VanDerWaalsContact C-N 3.32Å; S210-L212 PolarHBondContact O-N 3.43Å; S210-L213 WeakPolarHBondContact O-CB 3.22Å; S210-L213 PolarHBondContact O-N 3.15Å; S210-L214 PolarHBondContact O-N 3.23Å
211	I	98.6	Very high	97.7	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-65.5	-37.1	176.6	-66.1	159.8	0	0	0	111	Y107 L175 F176 Q179 L207 G208 L213 L214 T215	Y107-I211 HydrophobicContact CE1-CB 4.41Å; Y107-I211 HydrophobicContact CE1-CG2 4.01Å; L175-I211 HydrophobicContact CB-CD1 3.9Å; L175-I211 HydrophobicContact CB-CG1 3.8Å; F176-I211 HydrophobicContact CB-CG2 4.06Å; F176-I211 HydrophobicContact CD2-CG2 3.94Å; Q179-I211 HydrophobicContact CB-CD1 3.82Å; Q179-I211 HydrophobicContact CG-CD1 4.01Å; L207-I211 HydrophobicContact CD1-CD1 4.31Å; L207-I211 HydrophobicContact CD1-CG1 4.33Å; L207-I211 HydrophobicContact CG-CD1 3.87Å; L207-I211 HydrophobicContact CG-CG1 4.39Å; L207-I211 WeakPolarHBondContact O-CD1 3.48Å; L207-I211 VanDerWaalsContact O-CG1 3.24Å; L207-I211 WeakPolarHBondContact O-CG1 3.25Å; L207-I211 PolarHBondContact O-N 2.99Å; G208-I211 PolarHBondContact O-N 2.84Å; I211-L213 VanDerWaalsContact C-N 3.33Å; I211-L213 PolarHBondContact O-N 3Å; I211-L214 PolarHBondContact O-N 3.47Å; I211-T215 WeakPolarHBondContact O-CB 3.4Å; I211-T215 PolarHBondContact O-N 2.93Å; I211-T215 PolarHBondContact O-OG1 2.94Å
212	L	98.2	Very high	97.9	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-63.2	-39.5	175.5	-176.5	67.9	0	0	0	111.8	L104 Y107 G208 G209 S210 T215 T216 V261 L262	L104-L212 HydrophobicContact CD1-CD1 4.47Å; Y107-L212 HydrophobicContact CD1-CB 4.43Å; Y107-L212 HydrophobicContact CD1-CD1 3.73Å; Y107-L212 HydrophobicContact CE1-CB 3.79Å; Y107-L212 HydrophobicContact CE1-CD1 3.97Å; Y107-L212 HydrophobicContact CG-CD1 4.47Å; G208-L212 PolarHBondContact O-N 3.46Å; G208-L212 VanDerWaalsContact O-N 3.17Å; G209-L212 WeakPolarHBondContact O-CB 3.36Å; G209-L212 PolarHBondContact O-N 3.34Å; S210-L212 VanDerWaalsContact C-N 3.32Å; S210-L212 PolarHBondContact O-N 3.43Å; L212-T215 PolarHBondContact O-N 3.34Å; L212-T216 WeakPolarHBondContact O-CB 3.47Å; L212-T216 PolarHBondContact O-N 3.46Å; L212-T216 PolarHBondContact O-OG1 2.89Å; L212-V261 HydrophobicContact CD2-CB 3.92Å; L212-V261 HydrophobicContact CD2-CG1 3.34Å; L212-L262 HydrophobicContact CD2-CD2 4.21Å; L212-L262 HydrophobicContact CD2-CG 4.27Å
213	L	98.4	Very high	98.1	Very high	94 Å²	94	40.3 Å²	40.3	49%	0.492	23%	0.225	S	C	.	.	H	α-helix	trans	-63.5	-46.5	173.4	-75.2	170.6	0	0	0	111.9	G209 S210 I211 T215 T216 A217 L262	G209-L213 PolarHBondContact O-N 2.91Å; S210-L213 WeakPolarHBondContact O-CB 3.22Å; S210-L213 PolarHBondContact O-N 3.15Å; I211-L213 VanDerWaalsContact C-N 3.33Å; I211-L213 PolarHBondContact O-N 3Å; L213-T215 VanDerWaalsContact C-N 3.31Å; L213-T215 PolarHBondContact O-N 2.68Å; L213-T216 WeakPolarHBondContact O-CB 3.44Å; L213-T216 PolarHBondContact O-N 2.84Å; L213-A217 PolarHBondContact O-N 3.45Å; L213-L262 HydrophobicContact CD2-CD1 3.5Å; L213-L262 VanDerWaalsContact CD2-CD1 3.5Å; L213-L262 HydrophobicContact CG-CD1 4.04Å
214	L	98.4	Very high	98.1	Very high	57 Å²	57	38 Å²	38	30%	0.298	21%	0.214	S	C	.	.	H	α-helix	trans	-58.3	-44.2	175.3	-105.3	66.9	0	0	0	111.6	I168 T171 A172 L175 S210 I211 T216 A217 A218	I168-L214 HydrophobicContact CG2-CG 4.26Å; I168-L214 WeakPolarHBondContact CG2-O 3.11Å; T171-L214 HydrophobicContact CG2-CD2 3.96Å; A172-L214 HydrophobicContact CB-CB 4.06Å; A172-L214 HydrophobicContact CB-CD2 4.47Å; L175-L214 HydrophobicContact CD1-CD2 4.1Å; S210-L214 PolarHBondContact O-N 3.23Å; I211-L214 PolarHBondContact O-N 3.47Å; L214-T216 VanDerWaalsContact C-N 3.34Å; L214-T216 PolarHBondContact O-N 3.43Å; L214-A217 PolarHBondContact O-N 3.42Å; L214-A218 WeakPolarHBondContact O-CB 3.3Å; L214-A218 PolarHBondContact O-N 3.2Å
215	T	98.5	Very high	98.1	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.012	21%	0.214	C	C	.	.	H	α-helix	trans	-62	-43.6	177.1	-57.9	0	0	0	0	111.4	L103 L104 I211 L212 L213 A217 A218 C219	L103-T215 HydrophobicContact CB-CG2 3.99Å; L103-T215 HydrophobicContact CD2-CG2 4.05Å; L103-T215 HydrophobicContact CG-CG2 3.71Å; L103-T215 WeakPolarHBondContact O-CG2 3.36Å; L104-T215 HydrophobicContact CB-CG2 4.27Å; L104-T215 HydrophobicContact CD1-CG2 4.39Å; I211-T215 WeakPolarHBondContact O-CB 3.4Å; I211-T215 PolarHBondContact O-N 2.93Å; I211-T215 PolarHBondContact O-OG1 2.94Å; L212-T215 PolarHBondContact O-N 3.34Å; L213-T215 VanDerWaalsContact C-N 3.31Å; L213-T215 PolarHBondContact O-N 2.68Å; T215-A217 VanDerWaalsContact C-N 3.35Å; T215-A217 PolarHBondContact O-N 2.96Å; T215-A218 PolarHBondContact O-N 3.2Å; T215-C219 PolarHBondContact O-N 3.35Å; T215-C219 PolarHBondContact O-SG 3.24Å
216	T	98.7	Very high	98.2	Very high	16 Å²	16	35.5 Å²	35.5	10%	0.098	20%	0.196	C	C	.	.	H	α-helix	trans	-60.3	-46.4	176.9	-57.6	0	0	0	0	110.4	L212 L213 L214 C219 I220 V254	L212-T216 WeakPolarHBondContact O-CB 3.47Å; L212-T216 PolarHBondContact O-N 3.46Å; L212-T216 PolarHBondContact O-OG1 2.89Å; L213-T216 WeakPolarHBondContact O-CB 3.44Å; L213-T216 PolarHBondContact O-N 2.84Å; L214-T216 VanDerWaalsContact C-N 3.34Å; L214-T216 PolarHBondContact O-N 3.43Å; T216-C219 PolarHBondContact O-N 2.95Å; T216-I220 HydrophobicContact CG2-CD1 3.89Å; T216-I220 WeakPolarHBondContact O-CD1 3.48Å; T216-I220 VanDerWaalsContact O-CG1 3.29Å; T216-I220 WeakPolarHBondContact O-CG1 3.33Å; T216-I220 PolarHBondContact O-N 3.39Å; T216-I220 VanDerWaalsContact O-N 3.07Å; T216-V254 HydrophobicContact CG2-CG1 4.06Å
217	A	98.7	Very high	98.2	Very high	44 Å²	44	26.9 Å²	26.9	36%	0.364	16%	0.163	S	C	.	.	H	α-helix	trans	-63	-41.2	175.9	0	0	0	0	0	112.5	I168 L213 L214 T215 I220 S221	I168-A217 HydrophobicContact CG2-CB 4.46Å; L213-A217 PolarHBondContact O-N 3.45Å; L214-A217 PolarHBondContact O-N 3.42Å; T215-A217 VanDerWaalsContact C-N 3.35Å; T215-A217 PolarHBondContact O-N 2.96Å; A217-I220 PolarHBondContact O-N 3.37Å; A217-S221 WeakPolarHBondContact O-CB 3.39Å; A217-S221 PolarHBondContact O-N 3.5Å; A217-S221 PolarHBondContact O-OG 2.98Å
218	A	98.8	Very high	98.1	Very high	9 Å²	9	30.2 Å²	30.2	7%	0.074	18%	0.176	C	C	.	.	H	α-helix	trans	-62.1	-45.1	175.3	0	0	0	0	0	111.3	H165 I168 L214 T215 I220 S221 G222	H165-A218 PolarHBondContact CE1-O 3.08Å; H165-A218 PolarHBondContact ND1-O 2.94Å; I168-A218 HydrophobicContact CG2-CB 4.04Å; L214-A218 WeakPolarHBondContact O-CB 3.3Å; L214-A218 PolarHBondContact O-N 3.2Å; T215-A218 PolarHBondContact O-N 3.2Å; A218-I220 PolarHBondContact O-N 3.37Å; A218-S221 WeakPolarHBondContact CA-OG 3.28Å; A218-S221 PolarHBondContact O-OG 3.27Å; A218-G222 PolarHBondContact O-N 3.36Å
219	C	98.7	Very high	98	Very high	15 Å²	15	34.3 Å²	34.3	10%	0.101	19%	0.191	C	C	.	.	H	α-helix	trans	-61.5	-47.8	178.4	-68.7	0	0	0	0	111.8	T215 T216 G222 I223 V254	T215-C219 PolarHBondContact O-N 3.35Å; T215-C219 PolarHBondContact O-SG 3.24Å; T216-C219 PolarHBondContact O-N 2.95Å; C219-G222 PolarHBondContact O-N 3.05Å; C219-I223 WeakPolarHBondContact O-CD1 3.4Å; C219-I223 VanDerWaalsContact O-CG1 3.23Å; C219-I223 WeakPolarHBondContact O-CG1 3.38Å; C219-I223 PolarHBondContact O-N 2.86Å; C219-V254 HydrophobicContact CB-CG1 3.85Å
220	I	98.4	Very high	97.8	Very high	50 Å²	50	36 Å²	36	26%	0.256	20%	0.198	S	C	.	.	H	α-helix	trans	-65.1	-45.5	-178.5	-62.8	158.1	0	0	0	111	T216 A217 A218 G222 I223 N224 V254 V255	T216-I220 HydrophobicContact CG2-CD1 3.89Å; T216-I220 WeakPolarHBondContact O-CD1 3.48Å; T216-I220 VanDerWaalsContact O-CG1 3.29Å; T216-I220 WeakPolarHBondContact O-CG1 3.33Å; T216-I220 PolarHBondContact O-N 3.39Å; T216-I220 VanDerWaalsContact O-N 3.07Å; A217-I220 PolarHBondContact O-N 3.37Å; A218-I220 PolarHBondContact O-N 3.37Å; I220-G222 VanDerWaalsContact C-N 3.34Å; I220-G222 PolarHBondContact O-N 2.74Å; I220-I223 PolarHBondContact O-N 2.88Å; I220-N224 PolarHBondContact O-N 3.24Å; I220-V254 HydrophobicContact CG1-CG1 4.11Å; I220-V255 HydrophobicContact CD1-CG2 3.28Å; I220-V255 HydrophobicContact CG1-CG2 4.1Å
221	S	98.6	Very high	97.7	Very high	35 Å²	35	35.3 Å²	35.3	25%	0.245	19%	0.192	C	C	.	.	H	α-helix	trans	-63.7	-38.9	177.2	54.7	0	0	0	0	112.2	H165 A217 A218 N224 E225	H165-S221 PolarHBondContact ND1-OG 3.04Å; A217-S221 WeakPolarHBondContact O-CB 3.39Å; A217-S221 PolarHBondContact O-N 3.5Å; A217-S221 PolarHBondContact O-OG 2.98Å; A218-S221 WeakPolarHBondContact CA-OG 3.28Å; A218-S221 PolarHBondContact O-OG 3.27Å; S221-N224 PolarHBondContact O-N 3.4Å; S221-E225 VanDerWaalsContact O-CB 3.3Å; S221-E225 WeakPolarHBondContact O-CB 3.34Å; S221-E225 PolarHBondContact O-N 2.89Å
222	G	98.6	Very high	97.3	Very high	14 Å²	14	42.9 Å²	42.9	14%	0.144	23%	0.225	C	C	.	.	H	α-helix	trans	-68.7	-38.4	177.1	0	0	0	0	0	113.4	H165 A218 C219 I220 K226	H165-G222 VanDerWaalsContact CE1-CA 3.48Å; H165-G222 WeakPolarHBondContact CE1-CA 3.35Å; H165-G222 WeakPolarHBondContact ND1-CA 3.39Å; H165-G222 PolarHBondContact ND1-N 3.5Å; A218-G222 PolarHBondContact O-N 3.36Å; C219-G222 PolarHBondContact O-N 3.05Å; I220-G222 VanDerWaalsContact C-N 3.34Å; I220-G222 PolarHBondContact O-N 2.74Å; G222-K226 WeakPolarHBondContact O-CB 3.43Å; G222-K226 PolarHBondContact O-N 3.43Å
223	I	98.6	Very high	96.6	Very high	9 Å²	9	45.1 Å²	45.1	5%	0.046	25%	0.248	C	C	.	.	H	α-helix	trans	-60.3	-50.2	172.4	-69.9	162.6	0	0	0	109.9	W75 C219 I220 K226 L227 G247 L250 V254	W75-I223 HydrophobicContact CH2-CG2 4.28Å; W75-I223 HydrophobicContact CZ3-CG1 4.23Å; W75-I223 HydrophobicContact CZ3-CG2 4.36Å; C219-I223 WeakPolarHBondContact O-CD1 3.4Å; C219-I223 VanDerWaalsContact O-CG1 3.23Å; C219-I223 WeakPolarHBondContact O-CG1 3.38Å; C219-I223 PolarHBondContact O-N 2.86Å; I220-I223 PolarHBondContact O-N 2.88Å; I223-K226 PolarHBondContact O-N 3.43Å; I223-L227 HydrophobicContact CG2-CD1 3.77Å; I223-L227 HydrophobicContact CG2-CG 4.43Å; I223-L227 WeakPolarHBondContact O-CB 3.19Å; I223-L227 VanDerWaalsContact O-CG 3.31Å; I223-L227 WeakPolarHBondContact O-CG 3.23Å; I223-L227 PolarHBondContact O-N 3.5Å; I223-G247 WeakPolarHBondContact CG2-O 3.23Å; I223-L250 HydrophobicContact CD1-CD2 3.94Å; I223-L250 HydrophobicContact CD1-CG 3.85Å; I223-L250 HydrophobicContact CG1-CD2 4.34Å; I223-V254 HydrophobicContact CD1-CG2 4.45Å
224	N	97.9	Very high	95.8	Very high	54 Å²	54	49 Å²	49	29%	0.289	27%	0.27	S	S	.	.	H	α-helix	trans	-60.2	-49.2	178	-87.3	-11.4	0	0	0	112.1	I220 S221 K226 L227 F228	I220-N224 PolarHBondContact O-N 3.24Å; S221-N224 PolarHBondContact O-N 3.4Å; N224-K226 VanDerWaalsContact C-N 3.29Å; N224-K226 PolarHBondContact O-N 3.4Å; N224-L227 PolarHBondContact O-N 3.5Å; N224-F228 HydrophobicContact CB-CD2 4.48Å; N224-F228 HydrophobicContact CB-CE2 4.04Å; N224-F228 WeakPolarHBondContact O-CD2 3.37Å; N224-F228 VanDerWaalsContact O-CG 3.25Å; N224-F228 WeakPolarHBondContact O-CG 3.26Å; N224-F228 PolarHBondContact O-N 2.95Å
225	E	97.5	Very high	95.3	Very high	39 Å²	39	50.2 Å²	50.2	18%	0.182	28%	0.279	C	S	.	.	H	α-helix	trans	-55.6	-46.7	178.4	-179.8	167.7	-145.4	0	0	110.8	S163 H165 S221 F228 F229	S163-E225 WeakPolarHBondContact CB-OE1 3.44Å; S163-E225 PolarHBondContact OG-OE1 3.33Å; S163-E225 PolarHBondContact OG-OE2 2.84Å; S163-E225 VanDerWaalsContact OG-OE2 3.05Å; H165-E225 WeakPolarHBondContact CB-OE2 3.45Å; H165-E225 IonicContact CD2-OE2 3.85Å; H165-E225 PolarHBondContact CD2-OE2 2.9Å; H165-E225 IonicContact CG-OE2 3.33Å; S221-E225 VanDerWaalsContact O-CB 3.3Å; S221-E225 WeakPolarHBondContact O-CB 3.34Å; S221-E225 PolarHBondContact O-N 2.89Å; E225-F228 PolarHBondContact O-N 3.07Å; E225-F229 HydrophobicContact CG-CD2 3.89Å; E225-F229 HydrophobicContact CG-CE1 4.27Å; E225-F229 HydrophobicContact CG-CE2 3.21Å; E225-F229 HydrophobicContact CG-CZ 3.43Å; E225-F229 VanDerWaalsContact CG-CZ 3.43Å; E225-F229 WeakPolarHBondContact O-CD2 3.36Å; E225-F229 WeakPolarHBondContact O-CG 3.17Å; E225-F229 PolarHBondContact O-N 3.28Å; E225-F229 WeakPolarHBondContact OE1-CZ 3.38Å
226	K	97.2	Very high	95.1	Very high	30 Å²	30	52.8 Å²	52.8	13%	0.13	30%	0.295	C	S	.	.	H	α-helix	trans	-63.6	-44.9	177.8	-174.7	59	171.1	-168.9	0	112.4	W75 F92 G222 I223 N224 F229 V230	W75-K226 HydrophobicContact CH2-CB 4.06Å; W75-K226 HydrophobicContact CH2-CG 3.93Å; W75-K226 HydrophobicContact CZ2-CG 4.06Å; F92-K226 HydrophobicContact CD1-CD 4.39Å; F92-K226 VanDerWaalsContact CD1-NZ 3.27Å; F92-K226 HydrophobicContact CE1-CD 3.57Å; F92-K226 VanDerWaalsContact CE1-CE 3.46Å; F92-K226 HydrophobicContact CE1-CG 4.28Å; F92-K226 VanDerWaalsContact CE1-NZ 3.31Å; F92-K226 HydrophobicContact CZ-CD 4.06Å; G222-K226 WeakPolarHBondContact O-CB 3.43Å; G222-K226 PolarHBondContact O-N 3.43Å; I223-K226 PolarHBondContact O-N 3.43Å; N224-K226 VanDerWaalsContact C-N 3.29Å; N224-K226 PolarHBondContact O-N 3.4Å; K226-F229 PolarHBondContact O-N 3.26Å; K226-V230 HydrophobicContact CD-CG1 3.98Å; K226-V230 WeakPolarHBondContact O-CG1 3.06Å; K226-V230 WeakPolarHBondContact O-CG2 3.46Å; K226-V230 PolarHBondContact O-N 2.92Å; K226-V230 VanDerWaalsContact O-N 3.08Å
227	L	97.3	Very high	95	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-62.6	-42.8	178.8	-72.8	169.4	0	0	0	111.8	W75 I223 N224 F229 V230 L231 Y237	W75-L227 HydrophobicContact CH2-CD2 4.37Å; W75-L227 HydrophobicContact CH2-CG 4.24Å; W75-L227 HydrophobicContact CZ2-CD2 3.61Å; W75-L227 HydrophobicContact CZ2-CG 3.94Å; I223-L227 HydrophobicContact CG2-CD1 3.77Å; I223-L227 HydrophobicContact CG2-CG 4.43Å; I223-L227 WeakPolarHBondContact O-CB 3.19Å; I223-L227 VanDerWaalsContact O-CG 3.31Å; I223-L227 WeakPolarHBondContact O-CG 3.23Å; I223-L227 PolarHBondContact O-N 3.5Å; N224-L227 PolarHBondContact O-N 3.5Å; L227-F229 VanDerWaalsContact C-N 3.31Å; L227-F229 PolarHBondContact O-N 3.5Å; L227-V230 PolarHBondContact O-N 3.08Å; L227-L231 HydrophobicContact CD2-CD1 3.94Å; L227-L231 VanDerWaalsContact O-CB 3.3Å; L227-L231 WeakPolarHBondContact O-CB 3.23Å; L227-L231 PolarHBondContact O-N 2.83Å; L227-Y237 HydrophobicContact CB-CD2 4.04Å; L227-Y237 HydrophobicContact CB-CE2 4.03Å; L227-Y237 HydrophobicContact CD1-CE2 3.87Å; L227-Y237 HydrophobicContact CG-CE2 4.44Å
228	F	96.2	Very high	94.8	Very high	109 Å²	109	57 Å²	57	48%	0.478	32%	0.316	S	S	.	.	H	α-helix	trans	-63.9	-36.1	175.9	-64.3	-36.2	0	0	0	112.5	N224 E225 Y237	N224-F228 HydrophobicContact CB-CD2 4.48Å; N224-F228 HydrophobicContact CB-CE2 4.04Å; N224-F228 WeakPolarHBondContact O-CD2 3.37Å; N224-F228 VanDerWaalsContact O-CG 3.25Å; N224-F228 WeakPolarHBondContact O-CG 3.26Å; N224-F228 PolarHBondContact O-N 2.95Å; E225-F228 PolarHBondContact O-N 3.07Å; F228-Y237 AromaticContact CD1-CD1 3.62Å; F228-Y237 HydrophobicContact CD1-CD1 3.62Å; F228-Y237 HydrophobicContact CD1-CE1 4.04Å; F228-Y237 HydrophobicContact CD1-CG 4.08Å; F228-Y237 AromaticContact CE1-CD1 3.3Å; F228-Y237 HydrophobicContact CE1-CD1 3.3Å; F228-Y237 AromaticContact CE1-CE1 3.35Å; F228-Y237 HydrophobicContact CE1-CE1 3.35Å; F228-Y237 HydrophobicContact CE1-CG 4.19Å; F228-Y237 HydrophobicContact CZ-CD1 4.49Å; F228-Y237 HydrophobicContact CZ-CE1 4.2Å
229	F	94.2	Very high	94.6	Very high	97 Å²	97	60.1 Å²	60.1	43%	0.425	34%	0.337	S	S	.	.	H	α-helix	trans	-72.1	-36.7	179.6	-67.8	-18.6	0	0	0	113.7	E225 K226 L227 K232	E225-F229 HydrophobicContact CG-CD2 3.89Å; E225-F229 HydrophobicContact CG-CE1 4.27Å; E225-F229 HydrophobicContact CG-CE2 3.21Å; E225-F229 HydrophobicContact CG-CZ 3.43Å; E225-F229 VanDerWaalsContact CG-CZ 3.43Å; E225-F229 WeakPolarHBondContact O-CD2 3.36Å; E225-F229 WeakPolarHBondContact O-CG 3.17Å; E225-F229 PolarHBondContact O-N 3.28Å; E225-F229 WeakPolarHBondContact OE1-CZ 3.38Å; K226-F229 PolarHBondContact O-N 3.26Å; L227-F229 VanDerWaalsContact C-N 3.31Å; L227-F229 PolarHBondContact O-N 3.5Å; F229-K232 WeakPolarHBondContact O-CD 3.14Å; F229-K232 VanDerWaalsContact O-CE 3.23Å; F229-K232 WeakPolarHBondContact O-CE 3.41Å; F229-K232 WeakPolarHBondContact O-CG 3.17Å
230	V	94.4	Very high	94.4	Very high	52 Å²	52	64.3 Å²	64.3	32%	0.315	36%	0.357	S	S	.	.	H	α-helix	trans	-90.8	-27.3	-175.1	-61.5	0	0	0	0	113.4	K226 L227	K226-V230 HydrophobicContact CD-CG1 3.98Å; K226-V230 WeakPolarHBondContact O-CG1 3.06Å; K226-V230 WeakPolarHBondContact O-CG2 3.46Å; K226-V230 PolarHBondContact O-N 2.92Å; K226-V230 VanDerWaalsContact O-N 3.08Å; L227-V230 PolarHBondContact O-N 3.08Å
231	L	94.9	Very high	94.3	Very high	15 Å²	15	63.1 Å²	63.1	8%	0.079	35%	0.352	C	S	.	.	S	Bend	trans	-107.7	54.8	-178.1	-59.2	171.8	0	0	0	111.6	L227 V235 T236 Y237 P241	L227-L231 HydrophobicContact CD2-CD1 3.94Å; L227-L231 VanDerWaalsContact O-CB 3.3Å; L227-L231 WeakPolarHBondContact O-CB 3.23Å; L227-L231 PolarHBondContact O-N 2.83Å; L231-V235 CarbonylContact C-O 3.52Å; L231-T236 CarbonylContact O-C 3.47Å; L231-T236 WeakPolarHBondContact O-CA 3.35Å; L231-Y237 HydrophobicContact CD1-CD2 3.9Å; L231-Y237 PolarHBondContact O-N 3.46Å; L231-P241 HydrophobicContact CD1-CG 3.78Å; L231-P241 HydrophobicContact CD2-CG 4.08Å; L231-P241 HydrophobicContact CG-CG 4.48Å
232	K	90.5	Very high	94.3	Very high	159 Å²	159	64.9 Å²	64.9	69%	0.691	37%	0.369	S	S	*	.	B	Isolated β-bridge	trans	-118.1	3.5	179.4	66.1	-178.6	179.6	-179.5	0	114.7	F229	F229-K232 WeakPolarHBondContact O-CD 3.14Å; F229-K232 VanDerWaalsContact O-CE 3.23Å; F229-K232 WeakPolarHBondContact O-CE 3.41Å; F229-K232 WeakPolarHBondContact O-CG 3.17Å
233	G	83.7	Confident	94.2	Very high	47 Å²	47	64.7 Å²	64.7	49%	0.485	37%	0.365	S	S	.	.	S	Bend	trans	-99	-138.6	-178.2	0	0	0	0	0	112.4	V235 T236	G233-V235 PolarHBondContact O-N 3.42Å; G233-T236 WeakPolarHBondContact O-CG2 3.38Å
234	N	82.8	Confident	94.1	Very high	177 Å²	177	64.3 Å²	64.3	95%	0.947	36%	0.362	S	S	*	.	S	Bend	trans	-59.1	-32.5	-179.3	-65.7	-1.7	0	0	0	113.3
235	V	87.6	Confident	94.1	Very high	81 Å²	81	65 Å²	65	49%	0.491	37%	0.369	S	S	.	.	S	Bend	trans	-106.5	109.9	170.1	-178.2	0	0	0	0	107.6	L231 G233 P241	L231-V235 CarbonylContact C-O 3.52Å; G233-V235 PolarHBondContact O-N 3.42Å; V235-P241 HydrophobicContact CG1-CB 3.54Å; V235-P241 HydrophobicContact CG1-CG 3.8Å
236	T	94.3	Very high	94.1	Very high	57 Å²	57	64.8 Å²	64.8	35%	0.35	37%	0.368	S	S	.	.	B	Isolated β-bridge	trans	-92.5	149.6	-177.5	59.9	0	0	0	0	111.2	L231 G233 S238 S239	L231-T236 CarbonylContact O-C 3.47Å; L231-T236 WeakPolarHBondContact O-CA 3.35Å; G233-T236 WeakPolarHBondContact O-CG2 3.38Å; T236-S238 PolarHBondContact O-N 2.97Å; T236-S238 PolarHBondContact OG1-OG 3.43Å; T236-S239 PolarHBondContact O-N 2.98Å; T236-S239 VanDerWaalsContact O-N 3.11Å; T236-S239 PolarHBondContact O-OG 3.38Å
237	Y	95.5	Very high	94.2	Very high	45 Å²	45	63.3 Å²	63.3	18%	0.176	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-57.5	-35.4	177.5	178.4	-111.4	0	0	0	113.2	L227 F228 L231 S239 I240 N248	L227-Y237 HydrophobicContact CB-CD2 4.04Å; L227-Y237 HydrophobicContact CB-CE2 4.03Å; L227-Y237 HydrophobicContact CD1-CE2 3.87Å; L227-Y237 HydrophobicContact CG-CE2 4.44Å; F228-Y237 AromaticContact CD1-CD1 3.62Å; F228-Y237 HydrophobicContact CD1-CD1 3.62Å; F228-Y237 HydrophobicContact CD1-CE1 4.04Å; F228-Y237 HydrophobicContact CD1-CG 4.08Å; F228-Y237 AromaticContact CE1-CD1 3.3Å; F228-Y237 HydrophobicContact CE1-CD1 3.3Å; F228-Y237 AromaticContact CE1-CE1 3.35Å; F228-Y237 HydrophobicContact CE1-CE1 3.35Å; F228-Y237 HydrophobicContact CE1-CG 4.19Å; F228-Y237 HydrophobicContact CZ-CD1 4.49Å; F228-Y237 HydrophobicContact CZ-CE1 4.2Å; L231-Y237 HydrophobicContact CD1-CD2 3.9Å; L231-Y237 PolarHBondContact O-N 3.46Å; Y237-S239 PolarHBondContact O-N 3.44Å; Y237-I240 PolarHBondContact O-N 2.85Å; Y237-N248 VanDerWaalsContact OH-CG 3.27Å; Y237-N248 PolarHBondContact OH-ND2 3.37Å; Y237-N248 PolarHBondContact OH-OD1 3Å
238	S	95.3	Very high	94.2	Very high	103 Å²	103	66 Å²	66	72%	0.72	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-64.6	-20.5	179.5	54.5	0	0	0	0	114	T236 I240	T236-S238 PolarHBondContact O-N 2.97Å; T236-S238 PolarHBondContact OG1-OG 3.43Å; S238-I240 PolarHBondContact O-N 3.45Å
239	S	95.4	Very high	94.3	Very high	74 Å²	74	63.5 Å²	63.5	52%	0.517	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-77.7	-3.8	172.2	70.5	0	0	0	0	113.7	T236 Y237	T236-S239 PolarHBondContact O-N 2.98Å; T236-S239 VanDerWaalsContact O-N 3.11Å; T236-S239 PolarHBondContact O-OG 3.38Å; Y237-S239 PolarHBondContact O-N 3.44Å
240	I	93.8	Very high	94.5	Very high	104 Å²	104	58.9 Å²	58.9	53%	0.533	35%	0.352	S	S	.	.			trans	51.2	59.7	-179.3	-53.7	172.6	0	0	0	110.8	Y237 S238 V245	Y237-I240 PolarHBondContact O-N 2.85Å; S238-I240 PolarHBondContact O-N 3.45Å; I240-V245 HydrophobicContact CG2-CG2 3.44Å; I240-V245 VanDerWaalsContact CG2-CG2 3.44Å
241	P	96.6	Very high	94.7	Very high	24 Å²	24	56.9 Å²	56.9	16%	0.156	34%	0.342	C	S	.	.			trans	-64	163.6	176.6	30.6	-36.6	0	0	0	110.6	L231 V235 E243 G244 V245	L231-P241 HydrophobicContact CD1-CG 3.78Å; L231-P241 HydrophobicContact CD2-CG 4.08Å; L231-P241 HydrophobicContact CG-CG 4.48Å; V235-P241 HydrophobicContact CG1-CB 3.54Å; V235-P241 HydrophobicContact CG1-CG 3.8Å; P241-E243 PolarHBondContact O-N 2.99Å; P241-G244 CarbonylContact O-C 3.6Å; P241-G244 WeakPolarHBondContact O-CA 3.49Å; P241-G244 PolarHBondContact O-N 3Å; P241-V245 PolarHBondContact O-N 3Å
242	A	97.3	Very high	94.9	Very high	72 Å²	72	59.1 Å²	59.1	60%	0.595	36%	0.363	S	S	*	.	H	α-helix	trans	-51.6	-35.9	-178.9	0	0	0	0	0	113.4	W79 V245 L246	W79-A242 HydrophobicContact CZ2-CB 4.38Å; A242-V245 PolarHBondContact O-N 3.26Å; A242-L246 PolarHBondContact O-N 3.49Å
243	E	97.1	Very high	95.3	Very high	11 Å²	11	53.4 Å²	53.4	5%	0.051	34%	0.34	C	S	.	.	H	α-helix	trans	-63.4	-45.3	173.2	-163.9	-168.8	148.4	0	0	112.9	W75 W79 R80 P241 V245 L246 G247	W75-E243 PolarHBondContact NE1-OE1 3.1Å; W79-E243 HydrophobicContact CB-CG 3.95Å; W79-E243 HydrophobicContact CD2-CB 4.22Å; W79-E243 HydrophobicContact CD2-CG 3.86Å; W79-E243 HydrophobicContact CG-CB 4.05Å; W79-E243 HydrophobicContact CG-CG 3.52Å; R80-E243 IonicContact CZ-OE1 2.55Å; R80-E243 IonicContact CZ-OE2 3.52Å; R80-E243 IonicContact NH1-OE1 3.62Å; R80-E243 PolarHBondContact NH1-OE1 2.76Å; R80-E243 IonicContact NH1-OE2 3.17Å; R80-E243 IonicContact NH2-OE1 3.39Å; R80-E243 PolarHBondContact NH2-OE1 3.25Å; R80-E243 VanDerWaalsContact NH2-OE1 3.17Å; R80-E243 IonicContact NH2-OE2 3.04Å; R80-E243 PolarHBondContact NH2-OE2 3.33Å; P241-E243 PolarHBondContact O-N 2.99Å; E243-V245 VanDerWaalsContact C-N 3.33Å; E243-V245 PolarHBondContact O-N 3.35Å; E243-L246 PolarHBondContact O-N 3.5Å; E243-G247 PolarHBondContact O-N 3.25Å
244	G	97.1	Very high	96	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-63.4	-38.9	176.8	0	0	0	0	0	111.9	P241 G247 N248	P241-G244 CarbonylContact O-C 3.6Å; P241-G244 WeakPolarHBondContact O-CA 3.49Å; P241-G244 PolarHBondContact O-N 3Å; G244-G247 PolarHBondContact O-N 2.74Å; G244-N248 VanDerWaalsContact O-CB 3.31Å; G244-N248 WeakPolarHBondContact O-CB 3.39Å; G244-N248 PolarHBondContact O-N 2.88Å; G244-N248 PolarHBondContact O-ND2 3.49Å
245	V	98	Very high	96.8	Very high	70 Å²	70	45.5 Å²	45.5	42%	0.424	29%	0.288	S	S	.	.	H	α-helix	trans	-59.4	-47.5	172.9	178	0	0	0	0	110.8	I240 P241 A242 E243 N248 S249	I240-V245 HydrophobicContact CG2-CG2 3.44Å; I240-V245 VanDerWaalsContact CG2-CG2 3.44Å; P241-V245 PolarHBondContact O-N 3Å; A242-V245 PolarHBondContact O-N 3.26Å; E243-V245 VanDerWaalsContact C-N 3.33Å; E243-V245 PolarHBondContact O-N 3.35Å; V245-N248 PolarHBondContact O-N 3.1Å; V245-S249 VanDerWaalsContact O-CB 3.3Å; V245-S249 WeakPolarHBondContact O-CB 3.05Å; V245-S249 PolarHBondContact O-N 3.07Å; V245-S249 PolarHBondContact O-OG 3.38Å
246	L	97.9	Very high	97.3	Very high	33 Å²	33	43.4 Å²	43.4	17%	0.173	28%	0.279	C	S	.	.	H	α-helix	trans	-64.3	-45	179.1	-177.4	66.5	0	0	0	111.7	W75 W79 A242 E243 N248 S249 L250	W75-L246 HydrophobicContact CB-CD2 3.83Å; W75-L246 HydrophobicContact CB-CG 4.46Å; W75-L246 HydrophobicContact CG-CD2 4.49Å; W79-L246 HydrophobicContact CE3-CD2 3.94Å; W79-L246 HydrophobicContact CH2-CD2 3.9Å; W79-L246 HydrophobicContact CZ3-CD2 3.28Å; A242-L246 PolarHBondContact O-N 3.49Å; E243-L246 PolarHBondContact O-N 3.5Å; L246-N248 PolarHBondContact O-N 3.3Å; L246-S249 PolarHBondContact O-N 3.15Å; L246-L250 PolarHBondContact O-N 2.85Å
247	G	98	Very high	97.6	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.1	-43.2	177.1	0	0	0	0	0	112.6	I223 E243 G244 L250 G251	I223-G247 WeakPolarHBondContact CG2-O 3.23Å; E243-G247 PolarHBondContact O-N 3.25Å; G244-G247 PolarHBondContact O-N 2.74Å; G247-L250 WeakPolarHBondContact O-CB 3.24Å; G247-L250 PolarHBondContact O-N 2.91Å; G247-G251 PolarHBondContact O-N 3.46Å
248	N	98.3	Very high	97.7	Very high	56 Å²	56	38.6 Å²	38.6	30%	0.299	26%	0.255	S	S	.	.	H	α-helix	trans	-67	-38.4	175.7	-71.4	-12.4	0	0	0	112.5	Y237 G244 V245 L246 L250 G251 A252	Y237-N248 VanDerWaalsContact OH-CG 3.27Å; Y237-N248 PolarHBondContact OH-ND2 3.37Å; Y237-N248 PolarHBondContact OH-OD1 3Å; G244-N248 VanDerWaalsContact O-CB 3.31Å; G244-N248 WeakPolarHBondContact O-CB 3.39Å; G244-N248 PolarHBondContact O-N 2.88Å; G244-N248 PolarHBondContact O-ND2 3.49Å; V245-N248 PolarHBondContact O-N 3.1Å; L246-N248 PolarHBondContact O-N 3.3Å; N248-L250 VanDerWaalsContact C-N 3.34Å; N248-G251 PolarHBondContact O-N 3.37Å; N248-A252 PolarHBondContact O-N 3.27Å
249	S	98.5	Very high	97.9	Very high	56 Å²	56	38.9 Å²	38.9	39%	0.392	25%	0.248	S	C	.	.	H	α-helix	trans	-62.8	-42.5	174.3	-58.5	0	0	0	0	111	V245 L246 G251 A252 L253	V245-S249 VanDerWaalsContact O-CB 3.3Å; V245-S249 WeakPolarHBondContact O-CB 3.05Å; V245-S249 PolarHBondContact O-N 3.07Å; V245-S249 PolarHBondContact O-OG 3.38Å; L246-S249 PolarHBondContact O-N 3.15Å; S249-G251 PolarHBondContact O-N 2.94Å; S249-A252 PolarHBondContact O-N 2.87Å; S249-L253 VanDerWaalsContact O-CG 3.29Å; S249-L253 WeakPolarHBondContact O-CG 3.48Å; S249-L253 PolarHBondContact O-N 2.91Å
250	L	98.7	Very high	98	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-59.2	-45.3	171.6	174.5	63.5	0	0	0	111.2	C68 C71 V72 W75 I223 L246 G247 N248 A252 L253 V254	C68-L250 HydrophobicContact CB-CD1 4.34Å; C68-L250 WeakPolarHBondContact O-CD1 3.39Å; C71-L250 HydrophobicContact CB-CB 4.32Å; C71-L250 HydrophobicContact CB-CD1 3.96Å; V72-L250 HydrophobicContact CB-CD1 4.25Å; V72-L250 HydrophobicContact CB-CD2 3.72Å; V72-L250 HydrophobicContact CG2-CD2 3.9Å; W75-L250 HydrophobicContact CE3-CD2 3.97Å; W75-L250 HydrophobicContact CZ3-CD2 4.3Å; I223-L250 HydrophobicContact CD1-CD2 3.94Å; I223-L250 HydrophobicContact CD1-CG 3.85Å; I223-L250 HydrophobicContact CG1-CD2 4.34Å; L246-L250 PolarHBondContact O-N 2.85Å; G247-L250 WeakPolarHBondContact O-CB 3.24Å; G247-L250 PolarHBondContact O-N 2.91Å; N248-L250 VanDerWaalsContact C-N 3.34Å; L250-A252 VanDerWaalsContact C-N 3.34Å; L250-A252 PolarHBondContact O-N 3.09Å; L250-L253 PolarHBondContact O-N 3.05Å; L250-V254 HydrophobicContact CD1-CG2 4.27Å; L250-V254 VanDerWaalsContact O-CG2 3.28Å; L250-V254 WeakPolarHBondContact O-CG2 3.36Å; L250-V254 PolarHBondContact O-N 3.2Å
251	G	98.6	Very high	98.2	Very high	10 Å²	10	31.5 Å²	31.5	10%	0.103	20%	0.204	C	C	.	.	H	α-helix	trans	-57.9	-43.4	175.5	0	0	0	0	0	113	G247 N248 S249 V254 V255	G247-G251 PolarHBondContact O-N 3.46Å; N248-G251 PolarHBondContact O-N 3.37Å; S249-G251 PolarHBondContact O-N 2.94Å; G251-V254 WeakPolarHBondContact O-CB 3.28Å; G251-V254 PolarHBondContact O-N 2.61Å; G251-V255 WeakPolarHBondContact O-CG2 3.44Å; G251-V255 PolarHBondContact O-N 3.25Å; G251-V255 VanDerWaalsContact O-N 3.12Å
252	A	98.8	Very high	98.3	Very high	62 Å²	62	32.3 Å²	32.3	51%	0.512	21%	0.207	S	C	.	.	H	α-helix	trans	-65.4	-40.8	175.5	0	0	0	0	0	112.5	N248 S249 L250 V255 A256	N248-A252 PolarHBondContact O-N 3.27Å; S249-A252 PolarHBondContact O-N 2.87Å; L250-A252 VanDerWaalsContact C-N 3.34Å; L250-A252 PolarHBondContact O-N 3.09Å; A252-V255 PolarHBondContact O-N 3.27Å; A252-A256 WeakPolarHBondContact O-CB 3.47Å; A252-A256 PolarHBondContact O-N 3.38Å
253	L	98.8	Very high	98.2	Very high	39 Å²	39	34.3 Å²	34.3	20%	0.204	20%	0.203	C	C	.	.	H	α-helix	trans	-62.1	-42	174.6	-71.9	170.7	0	0	0	111.7	L64 A67 C71 S249 L250 V255 A256 F257	L64-L253 HydrophobicContact CD2-CD2 3.78Å; A67-L253 HydrophobicContact CB-CD1 4.05Å; A67-L253 HydrophobicContact CB-CD2 4.28Å; C71-L253 HydrophobicContact CB-CD1 4.44Å; S249-L253 VanDerWaalsContact O-CG 3.29Å; S249-L253 WeakPolarHBondContact O-CG 3.48Å; S249-L253 PolarHBondContact O-N 2.91Å; L250-L253 PolarHBondContact O-N 3.05Å; L253-V255 PolarHBondContact O-N 3.26Å; L253-A256 PolarHBondContact O-N 3.07Å; L253-F257 VanDerWaalsContact O-CB 3.27Å; L253-F257 WeakPolarHBondContact O-CB 3.15Å; L253-F257 PolarHBondContact O-N 2.79Å
254	V	98.8	Very high	98.3	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-58.4	-46.4	175.4	164	0	0	0	0	111.1	L104 T216 C219 I220 I223 L250 G251 G258	L104-V254 HydrophobicContact CD1-CG1 4.41Å; L104-V254 HydrophobicContact CD2-CB 4.02Å; L104-V254 HydrophobicContact CD2-CG1 3.69Å; L104-V254 HydrophobicContact CD2-CG2 3.62Å; T216-V254 HydrophobicContact CG2-CG1 4.06Å; C219-V254 HydrophobicContact CB-CG1 3.85Å; I220-V254 HydrophobicContact CG1-CG1 4.11Å; I223-V254 HydrophobicContact CD1-CG2 4.45Å; L250-V254 HydrophobicContact CD1-CG2 4.27Å; L250-V254 VanDerWaalsContact O-CG2 3.28Å; L250-V254 WeakPolarHBondContact O-CG2 3.36Å; L250-V254 PolarHBondContact O-N 3.2Å; G251-V254 WeakPolarHBondContact O-CB 3.28Å; G251-V254 PolarHBondContact O-N 2.61Å; V254-G258 PolarHBondContact O-N 3.37Å
255	V	98.8	Very high	98.2	Very high	58 Å²	58	35.7 Å²	35.7	35%	0.352	21%	0.21	S	C	.	.	H	α-helix	trans	-61.8	-50.5	175.6	174.2	0	0	0	0	110.9	I220 G251 A252 L253 F257 G258 L259	I220-V255 HydrophobicContact CD1-CG2 3.28Å; I220-V255 HydrophobicContact CG1-CG2 4.1Å; G251-V255 WeakPolarHBondContact O-CG2 3.44Å; G251-V255 PolarHBondContact O-N 3.25Å; G251-V255 VanDerWaalsContact O-N 3.12Å; A252-V255 PolarHBondContact O-N 3.27Å; L253-V255 PolarHBondContact O-N 3.26Å; V255-F257 VanDerWaalsContact C-N 3.33Å; V255-F257 PolarHBondContact O-N 3.16Å; V255-G258 PolarHBondContact O-N 3.27Å; V255-L259 HydrophobicContact CG1-CD1 3.88Å; V255-L259 HydrophobicContact CG1-CG 4.3Å; V255-L259 WeakPolarHBondContact O-CG 3.4Å; V255-L259 PolarHBondContact O-N 3.3Å
256	A	98.8	Very high	98	Very high	36 Å²	36	36.2 Å²	36.2	30%	0.298	22%	0.217	S	C	.	.	H	α-helix	trans	-59.4	-44.8	-178.5	0	0	0	0	0	111.6	L64 A252 L253 L259 V260	L64-A256 HydrophobicContact CD1-CB 4.12Å; L64-A256 HydrophobicContact CD2-CB 4.3Å; A252-A256 WeakPolarHBondContact O-CB 3.47Å; A252-A256 PolarHBondContact O-N 3.38Å; L253-A256 PolarHBondContact O-N 3.07Å; A256-L259 PolarHBondContact O-N 3.41Å; A256-V260 WeakPolarHBondContact O-CG2 3.28Å; A256-V260 PolarHBondContact O-N 2.98Å
257	F	98.8	Very high	97.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-58.4	-51.2	175.4	174.9	-97.8	0	0	0	111.5	L64 L104 V105 Y109 L253 V255 L259 V260 V261	L64-F257 HydrophobicContact CB-CB 4.14Å; L64-F257 HydrophobicContact CB-CD2 4.13Å; L104-F257 HydrophobicContact CD1-CD1 4.09Å; L104-F257 HydrophobicContact CD1-CE1 4.33Å; L104-F257 HydrophobicContact CD2-CD1 4.3Å; L104-F257 HydrophobicContact CG-CD1 3.87Å; L104-F257 HydrophobicContact CG-CE1 4Å; L104-F257 WeakPolarHBondContact O-CE1 3.45Å; V105-F257 HydrophobicContact CB-CZ 4.48Å; V105-F257 HydrophobicContact CG2-CZ 4.44Å; Y109-F257 HydrophobicContact CD1-CE2 4.26Å; Y109-F257 HydrophobicContact CD1-CZ 4.33Å; Y109-F257 AromaticContact CE1-CE2 3.73Å; Y109-F257 HydrophobicContact CE1-CE2 3.73Å; Y109-F257 HydrophobicContact CE1-CZ 4.2Å; L253-F257 VanDerWaalsContact O-CB 3.27Å; L253-F257 WeakPolarHBondContact O-CB 3.15Å; L253-F257 PolarHBondContact O-N 2.79Å; V255-F257 VanDerWaalsContact C-N 3.33Å; V255-F257 PolarHBondContact O-N 3.16Å; F257-L259 VanDerWaalsContact C-N 3.33Å; F257-L259 PolarHBondContact O-N 2.96Å; F257-V260 PolarHBondContact O-N 3.16Å; F257-V261 HydrophobicContact CD1-CG2 4.37Å; F257-V261 HydrophobicContact CE1-CG2 3.9Å; F257-V261 HydrophobicContact CE2-CG2 4.07Å; F257-V261 HydrophobicContact CZ-CG2 3.74Å; F257-V261 WeakPolarHBondContact O-CG2 3.23Å; F257-V261 PolarHBondContact O-N 3.11Å
258	G	98.4	Very high	97.4	Very high	2 Å²	2	42.3 Å²	42.3	2%	0.021	25%	0.249	C	C	.	.	H	α-helix	trans	-57.8	-44.1	178.6	0	0	0	0	0	112.6	V254 V255 V261 L262	V254-G258 PolarHBondContact O-N 3.37Å; V255-G258 PolarHBondContact O-N 3.27Å; G258-V261 PolarHBondContact O-N 3.23Å; G258-L262 WeakPolarHBondContact O-CB 3.31Å; G258-L262 VanDerWaalsContact O-CG 3.29Å; G258-L262 WeakPolarHBondContact O-CG 3.22Å; G258-L262 PolarHBondContact O-N 2.88Å
259	L	98.5	Very high	97	Very high	108 Å²	108	46.3 Å²	46.3	57%	0.565	27%	0.266	S	S	*	.	H	α-helix	trans	-64	-41	177.3	-69.9	176	0	0	0	112.7	V255 A256 F257 L262 K263	V255-L259 HydrophobicContact CG1-CD1 3.88Å; V255-L259 HydrophobicContact CG1-CG 4.3Å; V255-L259 WeakPolarHBondContact O-CG 3.4Å; V255-L259 PolarHBondContact O-N 3.3Å; A256-L259 PolarHBondContact O-N 3.41Å; F257-L259 VanDerWaalsContact C-N 3.33Å; F257-L259 PolarHBondContact O-N 2.96Å; L259-L262 PolarHBondContact O-N 3.4Å; L259-K263 WeakPolarHBondContact O-CB 3.18Å; L259-K263 PolarHBondContact O-N 3.41Å
260	V	98.5	Very high	96.7	Very high	23 Å²	23	44.1 Å²	44.1	14%	0.139	25%	0.249	C	C	.	.	H	α-helix	trans	-64.6	-43.9	176.5	170.6	0	0	0	0	110.9	C57 L60 C61 L64 A256 F257 K263 I264	C57-V260 WeakPolarHBondContact O-CG1 3.18Å; L60-V260 HydrophobicContact CD2-CG2 3.79Å; L60-V260 HydrophobicContact CG-CG2 4.21Å; C61-V260 HydrophobicContact CB-CG1 3.79Å; L64-V260 HydrophobicContact CD1-CG2 3.91Å; A256-V260 WeakPolarHBondContact O-CG2 3.28Å; A256-V260 PolarHBondContact O-N 2.98Å; F257-V260 PolarHBondContact O-N 3.16Å; V260-K263 WeakPolarHBondContact O-CB 3.25Å; V260-K263 PolarHBondContact O-N 3.16Å; V260-I264 HydrophobicContact CG1-CD1 4.12Å; V260-I264 WeakPolarHBondContact O-CG1 3.43Å; V260-I264 PolarHBondContact O-N 3.36Å
261	V	98.4	Very high	96.2	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-59.8	-48.6	175.2	172.6	0	0	0	0	110.5	V112 L212 F257 G258 K263 I264 L265	V112-V261 HydrophobicContact CG1-CG1 3.91Å; L212-V261 HydrophobicContact CD2-CB 3.92Å; L212-V261 HydrophobicContact CD2-CG1 3.34Å; F257-V261 HydrophobicContact CD1-CG2 4.37Å; F257-V261 HydrophobicContact CE1-CG2 3.9Å; F257-V261 HydrophobicContact CE2-CG2 4.07Å; F257-V261 HydrophobicContact CZ-CG2 3.74Å; F257-V261 WeakPolarHBondContact O-CG2 3.23Å; F257-V261 PolarHBondContact O-N 3.11Å; G258-V261 PolarHBondContact O-N 3.23Å; V261-K263 VanDerWaalsContact C-N 3.3Å; V261-K263 PolarHBondContact O-N 3.24Å; V261-I264 PolarHBondContact O-N 3.31Å; V261-I264 VanDerWaalsContact O-N 3.12Å; V261-L265 HydrophobicContact CG1-CD1 3.93Å; V261-L265 HydrophobicContact CG1-CG 4.32Å; V261-L265 WeakPolarHBondContact O-CG 3.49Å; V261-L265 PolarHBondContact O-N 2.94Å
262	L	97.3	Very high	95.7	Very high	41 Å²	41	49 Å²	49	22%	0.215	27%	0.268	C	S	.	.	H	α-helix	trans	-61.7	-37.3	177.5	-70.8	170.5	0	0	0	112.4	L212 L213 G258 L259 I264 L265 S266	L212-L262 HydrophobicContact CD2-CD2 4.21Å; L212-L262 HydrophobicContact CD2-CG 4.27Å; L213-L262 HydrophobicContact CD2-CD1 3.5Å; L213-L262 VanDerWaalsContact CD2-CD1 3.5Å; L213-L262 HydrophobicContact CG-CD1 4.04Å; G258-L262 WeakPolarHBondContact O-CB 3.31Å; G258-L262 VanDerWaalsContact O-CG 3.29Å; G258-L262 WeakPolarHBondContact O-CG 3.22Å; G258-L262 PolarHBondContact O-N 2.88Å; L259-L262 PolarHBondContact O-N 3.4Å; L262-I264 VanDerWaalsContact C-N 3.34Å; L262-I264 PolarHBondContact O-N 3.31Å; L262-L265 PolarHBondContact O-N 2.87Å; L262-S266 VanDerWaalsContact O-CB 3.28Å; L262-S266 WeakPolarHBondContact O-CB 3.27Å; L262-S266 PolarHBondContact O-N 2.9Å; L262-S266 PolarHBondContact O-OG 3.34Å
263	K	97.2	Very high	95	Very high	115 Å²	115	49.3 Å²	49.3	50%	0.5	27%	0.265	S	S	.	.	H	α-helix	trans	-61.5	-43	174	178.8	58.3	-178.5	173.7	0	111.5	L259 V260 V261 S266 T267	L259-K263 WeakPolarHBondContact O-CB 3.18Å; L259-K263 PolarHBondContact O-N 3.41Å; V260-K263 WeakPolarHBondContact O-CB 3.25Å; V260-K263 PolarHBondContact O-N 3.16Å; V261-K263 VanDerWaalsContact C-N 3.3Å; V261-K263 PolarHBondContact O-N 3.24Å; K263-S266 WeakPolarHBondContact CA-OG 3.47Å; K263-S266 PolarHBondContact O-OG 2.57Å; K263-T267 PolarHBondContact O-N 2.93Å; K263-T267 PolarHBondContact O-OG1 3.06Å
264	I	97.2	Very high	94	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-63.7	-44.4	176.2	-66.8	166.5	0	0	0	111	F54 C57 C61 V112 R115 V260 V261 L262 W270	F54-I264 HydrophobicContact CE2-CG2 3.88Å; C57-I264 HydrophobicContact CB-CD1 4.25Å; C57-I264 HydrophobicContact CB-CG1 4.06Å; C61-I264 HydrophobicContact CB-CD1 4.14Å; V112-I264 HydrophobicContact CB-CG2 3.91Å; V112-I264 HydrophobicContact CG1-CB 3.97Å; V112-I264 HydrophobicContact CG1-CD1 4.31Å; V112-I264 HydrophobicContact CG1-CG2 3.67Å; R115-I264 HydrophobicContact CB-CG2 3.9Å; R115-I264 HydrophobicContact CG-CG2 3.93Å; V260-I264 HydrophobicContact CG1-CD1 4.12Å; V260-I264 WeakPolarHBondContact O-CG1 3.43Å; V260-I264 PolarHBondContact O-N 3.36Å; V261-I264 PolarHBondContact O-N 3.31Å; V261-I264 VanDerWaalsContact O-N 3.12Å; L262-I264 VanDerWaalsContact C-N 3.34Å; L262-I264 PolarHBondContact O-N 3.31Å; I264-W270 HydrophobicContact CB-CE3 4.37Å; I264-W270 HydrophobicContact CB-CZ3 4.38Å; I264-W270 HydrophobicContact CG1-CE3 4.4Å; I264-W270 HydrophobicContact CG1-CZ3 4.04Å; I264-W270 HydrophobicContact CG2-CE3 4.3Å
265	L	95.7	Very high	92.2	Very high	39 Å²	39	56.2 Å²	56.2	20%	0.204	31%	0.308	C	S	.	.	H	α-helix	trans	-69.6	-34.3	-178.8	-65.5	177.9	0	0	0	113.6	A111 V112 R115 V261 L262	A111-L265 HydrophobicContact CB-CD1 4.18Å; A111-L265 HydrophobicContact CB-CD2 4.41Å; A111-L265 WeakPolarHBondContact O-CD2 3.43Å; V112-L265 HydrophobicContact CG1-CD2 4.14Å; V112-L265 HydrophobicContact CG1-CG 4.3Å; R115-L265 VanDerWaalsContact CZ-O 3.3Å; R115-L265 PolarHBondContact NH1-O 2.92Å; R115-L265 PolarHBondContact NH2-O 2.93Å; V261-L265 HydrophobicContact CG1-CD1 3.93Å; V261-L265 HydrophobicContact CG1-CG 4.32Å; V261-L265 WeakPolarHBondContact O-CG 3.49Å; V261-L265 PolarHBondContact O-N 2.94Å; L262-L265 PolarHBondContact O-N 2.87Å
266	S	94.4	Very high	89.7	Confident	82 Å²	82	63 Å²	63	57%	0.573	33%	0.327	S	S	*	.	H	α-helix	trans	-81.9	-12.8	-179.5	56	0	0	0	0	113.9	L262 K263 I268	L262-S266 VanDerWaalsContact O-CB 3.28Å; L262-S266 WeakPolarHBondContact O-CB 3.27Å; L262-S266 PolarHBondContact O-N 2.9Å; L262-S266 PolarHBondContact O-OG 3.34Å; K263-S266 WeakPolarHBondContact CA-OG 3.47Å; K263-S266 PolarHBondContact O-OG 2.57Å; S266-I268 PolarHBondContact O-N 3.2Å
267	T	93.8	Very high	87.1	Confident	20 Å²	20	67 Å²	67	12%	0.123	35%	0.35	C	S	.	.			trans	-82.7	105.5	-179.8	-58.8	0	0	0	0	110.8	R115 K263 Q269 W270	R115-T267 PolarHBondContact NH1-O 3.36Å; K263-T267 PolarHBondContact O-N 2.93Å; K263-T267 PolarHBondContact O-OG1 3.06Å; T267-Q269 VanDerWaalsContact C-N 3.27Å; T267-Q269 HydrophobicContact CG2-CB 4.28Å; T267-Q269 PolarHBondContact O-N 3.35Å; T267-W270 HydrophobicContact CG2-CD2 3.41Å; T267-W270 VanDerWaalsContact CG2-CD2 3.41Å; T267-W270 HydrophobicContact CG2-CE3 3.68Å; T267-W270 HydrophobicContact CG2-CG 3.82Å; T267-W270 HydrophobicContact CG2-CH2 4.24Å; T267-W270 HydrophobicContact CG2-CZ2 4.01Å; T267-W270 HydrophobicContact CG2-CZ3 4.09Å; T267-W270 PolarHBondContact O-N 3.47Å; T267-W270 VanDerWaalsContact O-N 3.1Å
268	I	89.4	Confident	84.3	Confident	140 Å²	140	69.8 Å²	69.8	72%	0.718	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-58	-38.8	-176.9	-62	173	0	0	0	111.8	S266 W270 Q271	S266-I268 PolarHBondContact O-N 3.2Å; I268-W270 PolarHBondContact O-N 3.47Å; I268-W270 VanDerWaalsContact O-N 3.09Å; I268-Q271 VanDerWaalsContact O-CB 3.27Å; I268-Q271 WeakPolarHBondContact O-CB 3.19Å; I268-Q271 PolarHBondContact O-N 3.44Å
269	Q	89.8	Confident	81.6	Confident	141 Å²	141	76 Å²	76	66%	0.659	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-61.1	-20.8	-179.9	-63.6	180	3.1	0	0	113.7	S50 W120 T267	S50-Q269 PolarHBondContact OG-OE1 2.95Å; W120-Q269 WeakPolarHBondContact CH2-O 3.08Å; T267-Q269 VanDerWaalsContact C-N 3.27Å; T267-Q269 HydrophobicContact CG2-CB 4.28Å; T267-Q269 PolarHBondContact O-N 3.35Å
270	W	91.4	Very high	78.9	Confident	10 Å²	10	77.2 Å²	77.2	4%	0.038	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-100.8	7.2	179.8	-51.8	-25.8	0	0	0	112.3	S50 T53 F54 C57 R115 W120 I264 T267 I268	S50-W270 PolarHBondContact O-NE1 3.12Å; S50-W270 PolarHBondContact OG-NE1 3.3Å; S50-W270 VanDerWaalsContact OG-NE1 3.15Å; T53-W270 HydrophobicContact CG2-CH2 4.29Å; T53-W270 HydrophobicContact CG2-CZ2 3.9Å; F54-W270 HydrophobicContact CB-CD2 4.03Å; F54-W270 HydrophobicContact CB-CG 4.19Å; F54-W270 HydrophobicContact CB-CZ2 4.24Å; F54-W270 HydrophobicContact CD2-CB 3.94Å; F54-W270 AromaticContact CD2-CD2 3.66Å; F54-W270 HydrophobicContact CD2-CD2 3.66Å; F54-W270 AromaticContact CD2-CE3 3.8Å; F54-W270 HydrophobicContact CD2-CE3 3.8Å; F54-W270 AromaticContact CD2-CG 3.72Å; F54-W270 HydrophobicContact CD2-CG 3.72Å; F54-W270 HydrophobicContact CE2-CB 4.45Å; F54-W270 HydrophobicContact CG-CD2 4.33Å; F54-W270 HydrophobicContact CG-CG 4.35Å; C57-W270 HydrophobicContact CB-CH2 4.34Å; C57-W270 HydrophobicContact CB-CZ3 4.46Å; R115-W270 WeakPolarHBondContact CA-O 3.34Å; R115-W270 WeakPolarHBondContact CD-O 3.41Å; W120-W270 WeakPolarHBondContact CZ2-O 3.5Å; I264-W270 HydrophobicContact CB-CE3 4.37Å; I264-W270 HydrophobicContact CB-CZ3 4.38Å; I264-W270 HydrophobicContact CG1-CE3 4.4Å; I264-W270 HydrophobicContact CG1-CZ3 4.04Å; I264-W270 HydrophobicContact CG2-CE3 4.3Å; T267-W270 HydrophobicContact CG2-CD2 3.41Å; T267-W270 VanDerWaalsContact CG2-CD2 3.41Å; T267-W270 HydrophobicContact CG2-CE3 3.68Å; T267-W270 HydrophobicContact CG2-CG 3.82Å; T267-W270 HydrophobicContact CG2-CH2 4.24Å; T267-W270 HydrophobicContact CG2-CZ2 4.01Å; T267-W270 HydrophobicContact CG2-CZ3 4.09Å; T267-W270 PolarHBondContact O-N 3.47Å; T267-W270 VanDerWaalsContact O-N 3.1Å; I268-W270 PolarHBondContact O-N 3.47Å; I268-W270 VanDerWaalsContact O-N 3.09Å
271	Q	89.3	Confident	75.9	Confident	90 Å²	90	80 Å²	80	42%	0.421	44%	0.442	S	S	.	.	S	Bend	trans	-72.2	130.4	173.2	-167	167.7	-22.8	0	0	110	R115 I268 P273	R115-Q271 VanDerWaalsContact NH1-CA 3.29Å; R115-Q271 VanDerWaalsContact NH1-CB 3.32Å; I268-Q271 VanDerWaalsContact O-CB 3.27Å; I268-Q271 WeakPolarHBondContact O-CB 3.19Å; I268-Q271 PolarHBondContact O-N 3.44Å; Q271-P273 WeakPolarHBondContact O-CD 3.25Å
272	R	87.6	Confident	73.1	Confident	22 Å²	22	90.2 Å²	90.2	8%	0.083	48%	0.483	C	S	.	.	P	Polyproline II helix	trans	-55.1	125.2	173.6	-177.7	167.3	-177.4	173.3	4.5	110.2	Y114 T119 W120 Q122 K124	Y114-R272 WeakPolarHBondContact O-CB 3.49Å; T119-R272 PolarHBondContact O-NH2 3.43Å; W120-R272 HydrophobicContact CG-CG 4.09Å; Q122-R272 PolarHBondContact O-NH2 2.88Å; K124-R272 VanDerWaalsContact CG-CZ 3.48Å; K124-R272 VanDerWaalsContact CG-NH2 3.27Å
273	P	84.9	Confident	70.1	Confident	70 Å²	70	94.6 Å²	94.6	46%	0.455	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-57.6	143.2	175.1	-25.3	34.2	0	0	0	111.9	W120 Q271	W120-P273 HydrophobicContact CD2-CG 4.26Å; W120-P273 HydrophobicContact CE3-CG 3.9Å; W120-P273 HydrophobicContact CZ3-CG 4.4Å; Q271-P273 WeakPolarHBondContact O-CD 3.25Å
274	D	77.8	Confident	67.2	Low	112 Å²	112	94 Å²	94	60%	0.599	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-65.3	150.5	165.6	-72.4	-39.2	0	0	0	109.2	K201 R276	K201-D274 IonicContact NZ-OD1 2.7Å; K201-D274 PolarHBondContact NZ-OD1 3.49Å; K201-D274 IonicContact NZ-OD2 3.45Å; D274-R276 PolarHBondContact O-N 2.84Å
275	S	60.4	Low	64.6	Low	71 Å²	71	101.9 Å²	101.9	50%	0.497	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-62.7	134.7	-177.5	-48.3	0	0	0	0	107.8	K124	K124-S275 WeakPolarHBondContact CE-OG 3.41Å; K124-S275 PolarHBondContact NZ-OG 3.16Å
276	R	46.2	Very low	61.9	Low	200 Å²	200	109.1 Å²	109.1	76%	0.755	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-66	146	176.5	-68.4	-178	-174.8	-174.6	1.2	108.7	D274 G278 D279	D274-R276 PolarHBondContact O-N 2.84Å; R276-G278 PolarHBondContact O-N 3.2Å; R276-D279 PolarHBondContact O-N 2.91Å
277	P	43.5	Very low	59.3	Low	122 Å²	122	112.1 Å²	112.1	79%	0.792	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-56.3	-20.3	177.6	-24.8	33.1	0	0	0	114.7
278	G	40.2	Very low	57	Low	58 Å²	58	120.5 Å²	120.5	60%	0.598	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-76.7	-13.7	179.8	0	0	0	0	0	115.9	R276 I280	R276-G278 PolarHBondContact O-N 3.2Å; G278-I280 VanDerWaalsContact C-N 3.27Å; G278-I280 PolarHBondContact O-N 3.31Å
279	D	41.4	Very low	54.8	Low	132 Å²	132	120.5 Å²	120.5	71%	0.706	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-87.8	7.3	-179.5	-64.2	-28.7	0	0	0	112.8	R276	R276-D279 PolarHBondContact O-N 2.91Å
280	I	42.8	Very low	52.6	Low	133 Å²	133	125.6 Å²	125.6	68%	0.682	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-103.9	9.6	174.7	-48.3	174.8	0	0	0	110.6	G278 Y282	G278-I280 VanDerWaalsContact C-N 3.27Å; G278-I280 PolarHBondContact O-N 3.31Å; I280-Y282 PolarHBondContact O-N 3.35Å
281	A	36.2	Very low	50.7	Low	81 Å²	81	131.4 Å²	131.4	67%	0.669	71%	0.705	S	S	*	*			trans	-68.4	102.9	166.4	0	0	0	0	0	107.8	T283	A281-T283 PolarHBondContact O-N 3.42Å
282	Y	38.2	Very low	48.6	Very low	216 Å²	216	133.6 Å²	133.6	85%	0.847	72%	0.72	S	S	*	*			trans	-30.7	121.6	163.1	-91.8	-105.4	0	0	0	110.3	I280 P284	I280-Y282 PolarHBondContact O-N 3.35Å; Y282-P284 WeakPolarHBondContact O-CD 3.33Å
283	T	34.3	Very low	46.5	Very low	133 Å²	133	139.8 Å²	139.8	82%	0.816	76%	0.756	S	S	*	*			trans	-76.1	106	155.2	-39.2	0	0	0	0	105.3	A281	A281-T283 PolarHBondContact O-N 3.42Å
284	P	36.8	Very low	44.2	Very low	102 Å²	102	143.9 Å²	143.9	66%	0.662	77%	0.774	S	S	*	*			trans	-67.2	137.5	167.8	-5	24.9	0	0	0	106.3	Y282 Q286	Y282-P284 WeakPolarHBondContact O-CD 3.33Å; P284-Q286 PolarHBondContact O-N 2.91Å
285	L	42.8	Very low	42.1	Very low	166 Å²	166	145.9 Å²	145.9	87%	0.869	79%	0.785	S	S	*	*			trans	-55.7	113.3	162.9	-68.7	167.3	0	0	0	106.2	D287	L285-D287 PolarHBondContact O-N 3.25Å; L285-D287 VanDerWaalsContact O-N 3.16Å
286	Q	39	Very low	40.9	Very low	191 Å²	191	150.9 Å²	150.9	89%	0.893	80%	0.804	S	S	*	*			trans	-65.5	112	164	-105.4	171.3	-33	0	0	105.9	P284 E288	P284-Q286 PolarHBondContact O-N 2.91Å; Q286-E288 PolarHBondContact O-N 3.2Å
287	D	39.6	Very low	40.5	Very low	145 Å²	145	147.4 Å²	147.4	78%	0.775	81%	0.807	S	S	*	*			trans	-48.5	124	167.3	-74.7	-44.4	0	0	0	109.5	L285 N289	L285-D287 PolarHBondContact O-N 3.25Å; L285-D287 VanDerWaalsContact O-N 3.16Å; D287-N289 PolarHBondContact O-N 2.9Å
288	E	46.3	Very low	40.3	Very low	195 Å²	195	149.3 Å²	149.3	91%	0.911	81%	0.808	S	S	*	*			trans	-70.7	104	157	-79	-174.4	144.7	0	0	107.5	Q286	Q286-E288 PolarHBondContact O-N 3.2Å
289	N	43.3	Very low	40.3	Very low	141 Å²	141	156.9 Å²	156.9	75%	0.754	83%	0.826	S	S	*	*			trans	-133.3	100.1	155.1	-85.8	-35.6	0	0	0	106.9	D287	D287-N289 PolarHBondContact O-N 2.9Å
290	D	43	Very low	40.2	Very low	248 Å²	248	159.2 Å²	159.2	100%	1.326	84%	0.837	S	S	*	*			trans	-153.1	0	142.9	-89	-24.6	0	0	0	108.2

Retrieved 290 of 290 residues in 188.6 ms (Link to these results)

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