A0A087YBD5_POEFO Loading...

Tyrosine-protein kinase

AlphaFold DB , UniProt , Accession A0A087YBD5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 521 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	32.5	Very low	29.8	Very low	247 Å²	247	163.6 Å²	163.6	100%	1.217	88%	0.877	S	S	*	*				0	113.6	0	-91.5	175.2	166.2	0	0	107.7
2	G	31.1	Very low	30	Very low	71 Å²	71	163.7 Å²	163.7	73%	0.732	88%	0.877	S	S	*	*			trans	60.6	138.8	165.1	0	0	0	0	0	116.9
3	T	29.8	Very low	30.1	Very low	146 Å²	146	170.2 Å²	170.2	90%	0.896	88%	0.882	S	S	*	*			cis	-174	121.2	7.2	11.4	0	0	0	0	102.6
4	Q	27.1	Very low	30.3	Very low	207 Å²	207	167.1 Å²	167.1	97%	0.967	87%	0.874	S	S	*	*			trans	-111.7	106.1	176.3	-143.2	173.2	7.5	0	0	107.1
5	E	30.7	Very low	30.2	Very low	174 Å²	174	162.7 Å²	162.7	81%	0.813	87%	0.871	S	S	*	*			trans	-113.3	145.6	170.1	-105.4	-171.3	174.7	0	0	108.9
6	K	30.7	Very low	30	Very low	190 Å²	190	160.3 Å²	160.3	83%	0.826	87%	0.871	S	S	*	*			trans	91.1	85.6	169.3	-55.9	-179.9	-177.3	178.7	0	116.9
7	T	29.4	Very low	29.7	Very low	152 Å²	152	158.2 Å²	158.2	93%	0.933	87%	0.87	S	S	*	*				-159.5	111.2	115.2	45.2	0	0	0	0	108.8
8	S	27.4	Very low	29.6	Very low	118 Å²	118	157.1 Å²	157.1	83%	0.825	87%	0.873	S	S	*	*			trans	-120.8	148.3	178.2	169.2	0	0	0	0	108.9
9	S	31.1	Very low	29.6	Very low	104 Å²	104	155.4 Å²	155.4	73%	0.727	87%	0.872	S	S	*	*	S	Bend	trans	98.1	127.6	173.1	77.5	0	0	0	0	117.1
10	L	29.4	Very low	29.5	Very low	161 Å²	161	153.9 Å²	153.9	84%	0.843	87%	0.87	S	S	*	*	S	Bend	trans	97	25.5	172.9	-69.6	140	0	0	0	119.4
11	W	29.1	Very low	29.5	Very low	230 Å²	230	152.1 Å²	152.1	87%	0.871	87%	0.866	S	S	*	*	S	Bend	trans	-127	-1.9	163.3	-85.8	90.1	0	0	0	116.6
12	D	31.8	Very low	29.3	Very low	164 Å²	164	145.5 Å²	145.5	88%	0.877	84%	0.843	S	S	*	*	S	Bend	trans	-105.4	50.6	178.1	-70.3	-37.4	0	0	0	113.9
13	R	31.4	Very low	29.5	Very low	248 Å²	248	149.3 Å²	149.3	94%	0.936	85%	0.847	S	S	*	*			trans	-134.4	34.9	167.1	-86.2	-168.8	170	-174.4	-2.5	112.9
14	V	32.4	Very low	29.9	Very low	128 Å²	128	146.2 Å²	146.2	78%	0.776	84%	0.836	S	S	*	*	S	Bend	trans	-128	130	168.8	179.9	0	0	0	0	107.7
15	A	29.2	Very low	30.3	Very low	100 Å²	100	140.4 Å²	140.4	83%	0.826	82%	0.817	S	S	*	*	S	Bend	trans	75.2	97.1	175.2	0	0	0	0	0	117.4
16	S	27.2	Very low	30.5	Very low	124 Å²	124	139.1 Å²	139.1	87%	0.867	81%	0.809	S	S	*	*			trans	142.3	85.4	139.4	180	0	0	0	0	111.7
17	C	24.9	Very low	30.6	Very low	126 Å²	126	138.3 Å²	138.3	85%	0.851	81%	0.805	S	S	*	*			trans	-171.8	80	142.2	-144.2	0	0	0	0	110.5
18	C	27.2	Very low	30.7	Very low	138 Å²	138	138.5 Å²	138.5	93%	0.932	80%	0.796	S	S	*	*			trans	-146.3	58.5	164.5	-111.2	0	0	0	0	111.3
19	C	29.5	Very low	31	Very low	125 Å²	125	140.1 Å²	140.1	85%	0.845	79%	0.79	S	S	*	*			trans	-140.1	94.6	158.1	-88.8	0	0	0	0	108.5
20	C	27.2	Very low	31.1	Very low	124 Å²	124	142.9 Å²	142.9	84%	0.838	79%	0.791	S	S	*	*			trans	179.3	114.4	133.2	-102.2	0	0	0	0	111.1
21	C	29.8	Very low	31.2	Very low	118 Å²	118	143.7 Å²	143.7	80%	0.797	79%	0.791	S	S	*	*			trans	58.5	102.7	139.9	-59.8	0	0	0	0	120.3
22	C	29.1	Very low	31.4	Very low	107 Å²	107	142 Å²	142	72%	0.723	79%	0.79	S	S	*	*				-149.7	107.8	122.9	-106.2	0	0	0	0	110.2	A24 C25	C22-A24 PolarHBondContact O-N 3.5Å; C22-C25 PolarHBondContact O-N 3.49Å
23	N	36	Very low	31.4	Very low	152 Å²	152	145.5 Å²	145.5	81%	0.813	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	10	175.6	-97.2	-10.7	0	0	0	114.2
24	A	37.4	Very low	31.5	Very low	80 Å²	80	137 Å²	137	66%	0.661	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-22	177.1	0	0	0	0	0	113.5	C22	C22-A24 PolarHBondContact O-N 3.5Å
25	C	34.6	Very low	31.3	Very low	85 Å²	85	139.8 Å²	139.8	57%	0.574	78%	0.784	S	S	*	*	S	Bend	trans	-84.5	-11.2	179.1	-109.6	0	0	0	0	114.4	C22	C22-C25 PolarHBondContact O-N 3.49Å
26	K	35.6	Very low	31.4	Very low	147 Å²	147	144.4 Å²	144.4	64%	0.639	79%	0.786	S	S	*	*	S	Bend	trans	-83.5	-19.7	179.7	-76	-173.5	174.1	-177	0	113.9
27	K	32.6	Very low	31.7	Very low	173 Å²	173	148.4 Å²	148.4	75%	0.752	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-21.3	178.5	-83.7	-171.4	172	-174.2	0	114.5
28	E	32.3	Very low	31.9	Very low	157 Å²	157	147.7 Å²	147.7	73%	0.734	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-12.4	173	-82.9	-176.4	148.5	0	0	113.8
29	Q	33.6	Very low	32.4	Very low	151 Å²	151	145.7 Å²	145.7	71%	0.706	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-11.2	178.3	-76	-171.6	-15.4	0	0	114.2
30	E	31.8	Very low	32.4	Very low	162 Å²	162	144.3 Å²	144.3	76%	0.757	75%	0.746	S	S	*	*	S	Bend	trans	-89	-16.1	173.1	-78.5	-179.5	159.2	0	0	113.6
31	E	32.7	Very low	32.8	Very low	178 Å²	178	142 Å²	142	83%	0.832	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	1.8	177.6	-87.1	-175.9	163	0	0	115.2
32	K	32.4	Very low	33	Very low	195 Å²	195	140.7 Å²	140.7	85%	0.848	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.5	22.8	173.4	-73.7	-172	179.4	175.8	0	114.3
33	R	31.8	Very low	33.3	Very low	238 Å²	238	142.8 Å²	142.8	90%	0.898	72%	0.717	S	S	*	*			trans	-103.5	55	173.2	-157.5	174.8	-177.7	-177.8	-0.9	111.2
34	G	33.2	Very low	33.1	Very low	69 Å²	69	141.2 Å²	141.2	71%	0.711	71%	0.709	S	S	*	*			trans	-157	31.2	-172.1	0	0	0	0	0	115.3
35	Q	29.9	Very low	32.7	Very low	186 Å²	186	143.1 Å²	143.1	87%	0.869	72%	0.715	S	S	*	*			trans	-130.8	91.3	164.6	-83.5	-178.5	-8.1	0	0	109.7	K37	Q35-K37 PolarHBondContact O-N 2.92Å
36	K	30.7	Very low	32.7	Very low	197 Å²	197	146.9 Å²	146.9	86%	0.857	73%	0.726	S	S	*	*			trans	-55.1	115.8	158.1	-86.1	-179.2	169.9	-175.5	0	107.1	T38	K36-T38 PolarHBondContact O-N 2.98Å; K36-T38 VanDerWaalsContact O-N 3.09Å
37	K	32.5	Very low	32.6	Very low	208 Å²	208	146.5 Å²	146.5	90%	0.904	74%	0.736	S	S	*	*			trans	-74.6	96	166.1	-80.9	-173.1	177	-178.1	0	107.7	Q35	Q35-K37 PolarHBondContact O-N 2.92Å
38	T	29.7	Very low	32.5	Very low	112 Å²	112	141.9 Å²	141.9	69%	0.687	74%	0.737	S	S	*	*			trans	-66.9	136.3	175.6	-43.5	0	0	0	0	110.1	K36 T40	K36-T38 PolarHBondContact O-N 2.98Å; K36-T38 VanDerWaalsContact O-N 3.09Å; T38-T40 PolarHBondContact O-N 2.78Å; T38-T40 PolarHBondContact O-OG1 2.47Å
39	I	37.1	Very low	32.5	Very low	96 Å²	96	138.2 Å²	138.2	49%	0.492	74%	0.742	S	S	.	*			trans	-60.6	110.1	166.7	-62.1	172.2	0	0	0	107.3	V41	I39-V41 HydrophobicContact CG2-CG2 4.31Å; I39-V41 PolarHBondContact O-N 2.92Å
40	T	30.1	Very low	32.5	Very low	95 Å²	95	139.3 Å²	139.3	58%	0.583	75%	0.752	S	S	*	*			trans	-89.9	98.2	176.8	-50.4	0	0	0	0	109.3	T38 V42	T38-T40 PolarHBondContact O-N 2.78Å; T38-T40 PolarHBondContact O-OG1 2.47Å; T40-V42 HydrophobicContact CG2-CG2 4.11Å; T40-V42 PolarHBondContact O-N 3.35Å
41	V	36.8	Very low	32.6	Very low	75 Å²	75	140.6 Å²	140.6	46%	0.455	76%	0.758	S	S	.	*			trans	-77.6	110	163.1	-179.3	0	0	0	0	106.8	I39 M43 I368	I39-V41 HydrophobicContact CG2-CG2 4.31Å; I39-V41 PolarHBondContact O-N 2.92Å; V41-M43 PolarHBondContact O-N 3.32Å; V41-I368 HydrophobicContact CG1-CD1 4.41Å
42	V	34.1	Very low	32.5	Very low	91 Å²	91	139.7 Å²	139.7	55%	0.552	76%	0.759	S	S	*	*			trans	-81.1	108.4	175.7	-178.4	0	0	0	0	107.8	T40	T40-V42 HydrophobicContact CG2-CG2 4.11Å; T40-V42 PolarHBondContact O-N 3.35Å
43	M	33.5	Very low	32.5	Very low	151 Å²	151	135.8 Å²	135.8	74%	0.744	75%	0.753	S	S	*	*			trans	-75	147.3	171	-64.3	-177.7	86.5	0	0	110.3	V41	V41-M43 PolarHBondContact O-N 3.32Å
44	N	33	Very low	32.6	Very low	120 Å²	120	130.7 Å²	130.7	64%	0.642	75%	0.751	S	S	*	*			trans	-71.8	125.8	-178.1	-159.8	6.1	0	0	0	110.9	M46	N44-M46 VanDerWaalsContact C-N 3.28Å; N44-M46 PolarHBondContact O-N 3.22Å
45	P	28.6	Very low	32.7	Very low	120 Å²	120	136.2 Å²	136.2	78%	0.779	76%	0.758	S	S	*	*	S	Bend	trans	-76.7	21.2	-172	-16.9	31.2	0	0	0	117.8
46	M	33.7	Very low	33	Very low	163 Å²	163	134.5 Å²	134.5	80%	0.803	76%	0.755	S	S	*	*			trans	-133.2	75.7	-169.3	-73.6	-86.7	-144.2	0	0	113.1	N44	N44-M46 VanDerWaalsContact C-N 3.28Å; N44-M46 PolarHBondContact O-N 3.22Å
47	T	34.4	Very low	33.1	Very low	140 Å²	140	136.7 Å²	136.7	86%	0.859	76%	0.758	S	S	*	*			trans	-159.1	99.2	152	48.3	0	0	0	0	109.6
48	G	30.8	Very low	33.2	Very low	75 Å²	75	132.5 Å²	132.5	77%	0.773	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-65.7	148.5	164.2	0	0	0	0	0	110.6
49	G	32.1	Very low	33.7	Very low	81 Å²	81	134 Å²	134	84%	0.835	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-56.2	144	-170	0	0	0	0	0	115.1
50	L	32.8	Very low	33.3	Very low	173 Å²	173	135.7 Å²	135.7	91%	0.906	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-98.4	117.3	166.6	-70.1	164.2	0	0	0	107.1
51	E	34.7	Very low	33.5	Very low	190 Å²	190	135.4 Å²	135.4	89%	0.888	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-73.1	143.6	167.5	-69.5	-179.4	154.3	0	0	109.9
52	D	29.7	Very low	33.8	Very low	158 Å²	158	137.2 Å²	137.2	85%	0.845	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-66.3	135.5	176.8	-70.2	-47.4	0	0	0	111.6
53	P	33.7	Very low	34.1	Very low	113 Å²	113	138.5 Å²	138.5	73%	0.734	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-77.6	151.2	172.3	30.2	-31.4	0	0	0	112
54	P	33.3	Very low	35.3	Very low	131 Å²	131	137.9 Å²	137.9	85%	0.851	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-75.6	143.8	-167.6	28.6	-33.6	0	0	0	114.5
55	E	36.2	Very low	36.5	Very low	185 Å²	185	134 Å²	134	86%	0.864	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-65.7	153.4	170.3	-76.3	-179.8	142.8	0	0	113.2
56	N	35.5	Very low	38.7	Very low	150 Å²	150	134.6 Å²	134.6	80%	0.802	77%	0.765	S	S	*	*			trans	88.5	100	167.7	-77.9	-34.6	0	0	0	120.5
57	R	32.1	Very low	41.4	Very low	244 Å²	244	133.5 Å²	133.5	92%	0.921	75%	0.752	S	S	*	*			trans	-139.4	127.1	132.1	-101.3	-175.5	-164.9	-176.4	5.7	110.9
58	P	35.1	Very low	44.3	Very low	120 Å²	120	128 Å²	128	78%	0.779	72%	0.716	S	S	*	*			trans	-83.3	166.3	170.2	-7.6	25.9	0	0	0	113.8
59	L	41	Very low	47.2	Very low	143 Å²	143	126.3 Å²	126.3	75%	0.749	69%	0.689	S	S	*	*			trans	-69.4	170.5	-144.5	-67	152.6	0	0	0	119.6
60	P	29.2	Very low	50.2	Low	132 Å²	132	122.5 Å²	122.5	86%	0.857	65%	0.65	S	S	*	*				-121.7	154.8	94.2	36	-31.6	0	0	0	113.7
61	S	32.6	Very low	52.9	Low	88 Å²	88	115.8 Å²	115.8	62%	0.615	61%	0.614	S	S	*	*			trans	-143.2	152.6	169.6	50	0	0	0	0	108.9
62	P	43.6	Very low	55.5	Low	114 Å²	114	108.2 Å²	108.2	74%	0.74	58%	0.578	S	S	*	*			cis	-129	-159.9	-3.7	46.5	-27.7	0	0	0	110.5
63	P	41.6	Very low	58.5	Low	118 Å²	118	105.3 Å²	105.3	77%	0.766	56%	0.563	S	S	*	*			cis	-112.6	120.8	41.6	25	-6.8	0	0	0	112.7	S65	P63-S65 PolarHBondContact O-N 2.86Å
64	K	58.5	Low	61.3	Low	138 Å²	138	100.1 Å²	100.1	60%	0.6	53%	0.529	S	S	*	.			trans	-59.6	128.5	141.1	-74.5	179.3	175.3	-176.9	0	103.8	E66 T95	K64-E66 PolarHBondContact O-N 3.14Å; K64-T95 PolarHBondContact NZ-OG1 3Å
65	S	58.3	Low	64.1	Low	38 Å²	38	98.2 Å²	98.2	27%	0.266	52%	0.519	S	S	.	.			trans	-48.4	119.3	172.5	-178.7	0	0	0	0	107.3	P63 R67 Y68	P63-S65 PolarHBondContact O-N 2.86Å; S65-R67 PolarHBondContact O-N 2.86Å; S65-R67 PolarHBondContact OG-O 2.64Å; S65-Y68 WeakPolarHBondContact O-CE2 3.1Å
66	E	74.1	Confident	66.8	Low	133 Å²	133	90.8 Å²	90.8	62%	0.621	49%	0.489	S	S	*	.	S	Bend	trans	-67.6	-24.7	179.9	-72.3	-180	168	0	0	109.7	K64 E91 V92	K64-E66 PolarHBondContact O-N 3.14Å; E66-E91 CarbonylContact O-C 3.59Å; E66-E91 WeakPolarHBondContact O-CA 3.4Å; E66-V92 PolarHBondContact O-N 2.79Å
67	R	91.1	Very high	69.4	Low	139 Å²	139	85.5 Å²	85.5	53%	0.525	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	131.4	-172.4	-63	-175.5	-176.1	-173.4	0.3	111.8	S65 I89 L90 V125	S65-R67 PolarHBondContact O-N 2.86Å; S65-R67 PolarHBondContact OG-O 2.64Å; R67-I89 HydrophobicContact CB-CG2 3.99Å; R67-I89 HydrophobicContact CG-CG2 4.24Å; R67-L90 CarbonylContact C-O 3.53Å; R67-L90 WeakPolarHBondContact CA-O 3.38Å; R67-V125 HydrophobicContact CB-CG2 4.06Å; R67-V125 WeakPolarHBondContact O-CG2 3.39Å; R67-V125 PolarHBondContact O-N 3.45Å
68	Y	93.9	Very high	72.1	Confident	26 Å²	26	75.2 Å²	75.2	10%	0.102	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	150.4	175.6	-69.4	-107.7	0	0	0	109.1	S65 I89 L90 V92 W101 V122 A123 P124	S65-Y68 WeakPolarHBondContact O-CE2 3.1Å; Y68-I89 CarbonylContact O-C 3.5Å; Y68-I89 VanDerWaalsContact O-CA 3.31Å; Y68-I89 WeakPolarHBondContact O-CA 3.34Å; Y68-L90 PolarHBondContact N-O 3.29Å; Y68-L90 PolarHBondContact O-N 3.44Å; Y68-V92 HydrophobicContact CD2-CB 3.91Å; Y68-V92 HydrophobicContact CD2-CG2 3.26Å; Y68-V92 HydrophobicContact CE2-CB 3.81Å; Y68-V92 HydrophobicContact CE2-CG2 3.57Å; Y68-V92 HydrophobicContact CG-CG2 3.88Å; Y68-W101 HydrophobicContact CD1-CZ3 4.15Å; Y68-W101 HydrophobicContact CE1-CH2 4.26Å; Y68-W101 AromaticContact CE1-CZ3 3.71Å; Y68-W101 HydrophobicContact CE1-CZ3 3.71Å; Y68-V122 HydrophobicContact CD1-CB 4.28Å; Y68-V122 HydrophobicContact CD1-CG2 3.98Å; Y68-V122 HydrophobicContact CG-CG2 4.4Å; Y68-A123 CarbonylContact C-O 3.58Å; Y68-A123 WeakPolarHBondContact CA-O 3.5Å; Y68-A123 WeakPolarHBondContact CB-O 3.41Å; Y68-A123 VanDerWaalsContact CD1-C 3.41Å; Y68-P124 HydrophobicContact CD1-CG 4.22Å; Y68-P124 HydrophobicContact CE1-CB 4.35Å; Y68-P124 HydrophobicContact CE1-CG 3.71Å
69	I	93.3	Very high	74.6	Confident	38 Å²	38	78.9 Å²	78.9	20%	0.195	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	137.6	170.5	-169.3	164.9	0	0	0	109.2	L71 D88 I89 V122 A123 V125 A130	I69-L71 HydrophobicContact CG2-CD2 4.25Å; I69-L71 PolarHBondContact O-N 3.24Å; I69-D88 CarbonylContact C-O 3.56Å; I69-D88 WeakPolarHBondContact CA-O 3.42Å; I69-I89 HydrophobicContact CB-CD1 3.94Å; I69-I89 HydrophobicContact CD1-CD1 4.21Å; I69-I89 HydrophobicContact CG1-CD1 3.97Å; I69-V122 VanDerWaalsContact O-CA 3.28Å; I69-V122 WeakPolarHBondContact O-CA 3.47Å; I69-A123 PolarHBondContact N-O 3.47Å; I69-A123 PolarHBondContact O-N 3.23Å; I69-V125 HydrophobicContact CB-CG2 4.25Å; I69-A130 HydrophobicContact CG2-CB 3.54Å
70	A	93.1	Very high	77	Confident	2 Å²	2	76.1 Å²	76.1	2%	0.017	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	122	170.7	0	0	0	0	0	110.1	F84 N85 T86 G87 D88	A70-F84 HydrophobicContact CB-CD2 3.41Å; A70-F84 VanDerWaalsContact CB-CD2 3.41Å; A70-F84 HydrophobicContact CB-CE2 3.73Å; A70-F84 HydrophobicContact CB-CG 4.41Å; A70-N85 VanDerWaalsContact CB-O 3.24Å; A70-N85 WeakPolarHBondContact CB-O 3.47Å; A70-T86 WeakPolarHBondContact O-CA 3.45Å; A70-G87 PolarHBondContact O-N 2.83Å; A70-D88 HydrophobicContact CB-CB 4.38Å; A70-D88 PolarHBondContact N-O 2.98Å
71	L	89.5	Confident	80	Confident	32 Å²	32	70.4 Å²	70.4	17%	0.168	38%	0.377	C	S	.	.	S	Bend	trans	-84.2	-25.4	177.1	-59.6	-178.8	0	0	0	112	I69 T86 Y121 A123 D129	I69-L71 HydrophobicContact CG2-CD2 4.25Å; I69-L71 PolarHBondContact O-N 3.24Å; L71-T86 WeakPolarHBondContact O-CG2 3.26Å; L71-T86 PolarHBondContact O-OG1 3.12Å; L71-Y121 WeakPolarHBondContact CB-O 3.37Å; L71-Y121 PolarHBondContact N-O 3.49Å; L71-A123 HydrophobicContact CD1-CB 3.95Å; L71-A123 HydrophobicContact CD2-CB 4.02Å; L71-A123 HydrophobicContact CG-CB 4.15Å; L71-D129 VanDerWaalsContact CD2-O 3.31Å; L71-D129 WeakPolarHBondContact CD2-O 3.44Å
72	F	90.3	Very high	83	Confident	30 Å²	30	66.4 Å²	66.4	13%	0.132	35%	0.349	C	S	.	.	S	Bend	trans	-139.1	151.1	-175.3	-53.1	-82.7	0	0	0	110.3	F84 T86 Y121 K227 A230 P231	F72-F84 VanDerWaalsContact O-CE2 3.3Å; F72-F84 WeakPolarHBondContact O-CE2 3.49Å; F72-T86 WeakPolarHBondContact CA-OG1 3.42Å; F72-T86 PolarHBondContact N-OG1 3.47Å; F72-Y121 HydrophobicContact CB-CD1 3.73Å; F72-Y121 HydrophobicContact CB-CE1 3.94Å; F72-Y121 HydrophobicContact CB-CG 4.42Å; F72-Y121 HydrophobicContact CD2-CG 4.46Å; F72-K227 HydrophobicContact CE1-CB 4.09Å; F72-K227 HydrophobicContact CE1-CD 3.89Å; F72-K227 HydrophobicContact CZ-CD 4.06Å; F72-A230 HydrophobicContact CB-CB 3.78Å; F72-A230 HydrophobicContact CD1-CB 3.85Å; F72-A230 HydrophobicContact CG-CB 3.88Å; F72-P231 VanDerWaalsContact CD2-CD 3.41Å; F72-P231 HydrophobicContact CD2-CG 4.02Å; F72-P231 HydrophobicContact CE2-CG 3.74Å; F72-P231 VanDerWaalsContact CZ-CD 3.43Å; F72-P231 HydrophobicContact CZ-CG 4.24Å
73	D	91.6	Very high	85.5	Confident	97 Å²	97	63 Å²	63	52%	0.519	33%	0.325	S	S	.	.			trans	-63.3	138.1	168.4	-63.6	-21.5	0	0	0	110.3	N85 T86 Y121	D73-N85 VanDerWaalsContact OD1-CA 3.23Å; D73-N85 WeakPolarHBondContact OD1-CA 3.35Å; D73-T86 PolarHBondContact N-OG1 3.2Å; D73-T86 PolarHBondContact OD1-N 3.16Å; D73-T86 PolarHBondContact OD1-OG1 3.26Å; D73-Y121 WeakPolarHBondContact O-CE1 3.42Å
74	Y	93	Very high	88	Confident	5 Å²	5	57.3 Å²	57.3	2%	0.02	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-133.7	121.5	173.5	-177.9	-101.4	0	0	0	110.5	D81 L82 T83 F84 W100 P118 Y121 T233	Y74-D81 HydrophobicContact CE1-CB 4.09Å; Y74-D81 PolarHBondContact OH-OD2 3.37Å; Y74-L82 VanDerWaalsContact CD1-O 3.31Å; Y74-L82 WeakPolarHBondContact CD1-O 3.43Å; Y74-T83 CarbonylContact O-C 3.56Å; Y74-T83 VanDerWaalsContact O-CA 3.28Å; Y74-T83 WeakPolarHBondContact O-CA 3.47Å; Y74-T83 WeakPolarHBondContact O-CG2 3.28Å; Y74-F84 HydrophobicContact CD1-CD1 4.27Å; Y74-F84 AromaticContact CD1-CE1 3.72Å; Y74-F84 HydrophobicContact CD1-CE1 3.72Å; Y74-F84 HydrophobicContact CD1-CZ 4.25Å; Y74-F84 AromaticContact CG-CE1 3.9Å; Y74-F84 HydrophobicContact CG-CE1 3.9Å; Y74-F84 AromaticContact CG-CZ 3.94Å; Y74-F84 HydrophobicContact CG-CZ 3.94Å; Y74-F84 PolarHBondContact N-O 2.64Å; Y74-F84 PolarHBondContact O-N 3.22Å; Y74-W100 HydrophobicContact CE2-CH2 4.29Å; Y74-W100 HydrophobicContact CE2-CZ3 4.48Å; Y74-W100 AromaticContact CZ-CZ3 3.91Å; Y74-W100 VanDerWaalsContact OH-CH2 3.27Å; Y74-W100 WeakPolarHBondContact OH-CH2 3.28Å; Y74-W100 WeakPolarHBondContact OH-CZ3 3.3Å; Y74-P118 HydrophobicContact CD2-CG 3.66Å; Y74-P118 HydrophobicContact CE2-CG 3.55Å; Y74-P118 HydrophobicContact CG-CG 4.23Å; Y74-Y121 HydrophobicContact CD2-CD1 4.22Å; Y74-Y121 AromaticContact CD2-CE1 3.96Å; Y74-Y121 HydrophobicContact CD2-CE1 3.96Å; Y74-Y121 HydrophobicContact CG-CD1 4.46Å; Y74-T233 HydrophobicContact CE2-CG2 4.24Å
75	S	92.6	Very high	89.8	Confident	91 Å²	91	53.7 Å²	53.7	64%	0.636	28%	0.276	S	S	*	.			trans	-95.4	125.9	171.3	-66.4	0	0	0	0	110.3	R77	S75-R77 PolarHBondContact O-N 3.18Å
76	A	92.3	Very high	91.3	Very high	29 Å²	29	55.7 Å²	55.7	24%	0.24	29%	0.287	C	S	.	.			trans	-51.4	128.9	176	0	0	0	0	0	111.6	D81 T83	A76-D81 HydrophobicContact CB-CB 3.64Å; A76-T83 WeakPolarHBondContact CB-OG1 3.27Å; A76-T83 PolarHBondContact N-OG1 2.99Å; A76-T83 VanDerWaalsContact N-OG1 3.1Å
77	R	90.4	Very high	92.1	Very high	39 Å²	39	51 Å²	51	15%	0.147	27%	0.274	C	S	.	.	S	Bend	trans	-102.1	-15.7	179.3	-57	170.5	-176.5	168.7	1.8	112.4	S75 D81 T233 L236 W270 T274	S75-R77 PolarHBondContact O-N 3.18Å; R77-D81 PolarHBondContact N-OD2 3.32Å; R77-T233 PolarHBondContact NH1-OG1 2.95Å; R77-T233 PolarHBondContact NH2-OG1 2.92Å; R77-L236 WeakPolarHBondContact CD-O 3.44Å; R77-L236 PolarHBondContact NH1-O 2.84Å; R77-W270 HydrophobicContact CB-CH2 4.39Å; R77-W270 HydrophobicContact CB-CZ3 3.72Å; R77-T274 VanDerWaalsContact CD-OG1 3.32Å; R77-T274 WeakPolarHBondContact CD-OG1 3.19Å
78	T	87.9	Confident	92.3	Very high	27 Å²	27	45 Å²	45	17%	0.166	25%	0.252	C	S	.	.	S	Bend	trans	-133.6	165	173.7	85.1	0	0	0	0	109.8	N80 D81 W270	T78-N80 PolarHBondContact O-N 2.87Å; T78-N80 PolarHBondContact OG1-N 3.07Å; T78-D81 PolarHBondContact N-OD2 3.3Å; T78-D81 WeakPolarHBondContact O-CB 3.31Å; T78-D81 PolarHBondContact O-N 2.83Å; T78-D81 PolarHBondContact OG1-OD1 2.99Å; T78-W270 HydrophobicContact CG2-CH2 3.78Å; T78-W270 HydrophobicContact CG2-CZ2 4.44Å
79	E	88.8	Confident	92.3	Very high	197 Å²	197	45.3 Å²	45.3	92%	0.921	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-19.1	176.3	-60.7	-179.4	174.1	0	0	113.4
80	N	91.3	Very high	92.5	Very high	85 Å²	85	43.5 Å²	43.5	46%	0.455	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-9.1	-179.6	-60.5	-47.5	0	0	0	113	T78 G115 Y116	T78-N80 PolarHBondContact O-N 2.87Å; T78-N80 PolarHBondContact OG1-N 3.07Å; N80-G115 CarbonylContact O-C 3.55Å; N80-G115 WeakPolarHBondContact O-CA 3.29Å; N80-Y116 HydrophobicContact CB-CD2 4.07Å; N80-Y116 HydrophobicContact CB-CE2 4.48Å; N80-Y116 PolarHBondContact O-N 3.05Å
81	D	93	Very high	92.5	Very high	13 Å²	13	45.5 Å²	45.5	7%	0.07	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-81.8	151.8	-179.1	-66.4	12.2	0	0	0	110.6	Y74 A76 R77 T78 Y116	Y74-D81 HydrophobicContact CE1-CB 4.09Å; Y74-D81 PolarHBondContact OH-OD2 3.37Å; A76-D81 HydrophobicContact CB-CB 3.64Å; R77-D81 PolarHBondContact N-OD2 3.32Å; T78-D81 PolarHBondContact N-OD2 3.3Å; T78-D81 WeakPolarHBondContact O-CB 3.31Å; T78-D81 PolarHBondContact O-N 2.83Å; T78-D81 PolarHBondContact OG1-OD1 2.99Å; D81-Y116 WeakPolarHBondContact CA-O 3.34Å
82	L	94.9	Very high	92.7	Very high	4 Å²	4	45.1 Å²	45.1	2%	0.021	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-102	118.3	173.7	-178.3	67.5	0	0	0	110	Y74 F84 L90 A103 A105 K113 Y116 I117	Y74-L82 VanDerWaalsContact CD1-O 3.31Å; Y74-L82 WeakPolarHBondContact CD1-O 3.43Å; L82-F84 WeakPolarHBondContact O-CD1 3.34Å; L82-L90 HydrophobicContact CD2-CD2 4.25Å; L82-A103 HydrophobicContact CD2-CB 4.49Å; L82-A105 HydrophobicContact CD2-CB 4.22Å; L82-K113 HydrophobicContact CD1-CB 3.82Å; L82-Y116 PolarHBondContact N-O 3.37Å; L82-I117 HydrophobicContact CB-CG2 3.83Å; L82-I117 HydrophobicContact CD2-CG2 3.98Å; L82-I117 HydrophobicContact CG-CG2 4.37Å
83	T	95.8	Very high	92.8	Very high	41 Å²	41	47.2 Å²	47.2	25%	0.252	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-73.3	135.8	170.5	-56.6	0	0	0	0	110.2	Y74 A76 I109 S110	Y74-T83 CarbonylContact O-C 3.56Å; Y74-T83 VanDerWaalsContact O-CA 3.28Å; Y74-T83 WeakPolarHBondContact O-CA 3.47Å; Y74-T83 WeakPolarHBondContact O-CG2 3.28Å; A76-T83 WeakPolarHBondContact CB-OG1 3.27Å; A76-T83 PolarHBondContact N-OG1 2.99Å; A76-T83 VanDerWaalsContact N-OG1 3.1Å; T83-I109 HydrophobicContact CG2-CD1 3.49Å; T83-I109 VanDerWaalsContact CG2-CD1 3.49Å; T83-S110 WeakPolarHBondContact O-CB 3.36Å; T83-S110 PolarHBondContact O-OG 3.18Å
84	F	95	Very high	92.7	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-151	160.1	174.7	55.4	-95.1	0	0	0	111.1	A70 F72 Y74 L82 D88 L90 I117 Y121	A70-F84 HydrophobicContact CB-CD2 3.41Å; A70-F84 VanDerWaalsContact CB-CD2 3.41Å; A70-F84 HydrophobicContact CB-CE2 3.73Å; A70-F84 HydrophobicContact CB-CG 4.41Å; F72-F84 VanDerWaalsContact O-CE2 3.3Å; F72-F84 WeakPolarHBondContact O-CE2 3.49Å; Y74-F84 HydrophobicContact CD1-CD1 4.27Å; Y74-F84 AromaticContact CD1-CE1 3.72Å; Y74-F84 HydrophobicContact CD1-CE1 3.72Å; Y74-F84 HydrophobicContact CD1-CZ 4.25Å; Y74-F84 AromaticContact CG-CE1 3.9Å; Y74-F84 HydrophobicContact CG-CE1 3.9Å; Y74-F84 AromaticContact CG-CZ 3.94Å; Y74-F84 HydrophobicContact CG-CZ 3.94Å; Y74-F84 PolarHBondContact N-O 2.64Å; Y74-F84 PolarHBondContact O-N 3.22Å; L82-F84 WeakPolarHBondContact O-CD1 3.34Å; F84-D88 HydrophobicContact CB-CB 4.28Å; F84-L90 HydrophobicContact CB-CD2 4.27Å; F84-L90 HydrophobicContact CD1-CD1 3.93Å; F84-L90 HydrophobicContact CD2-CD1 4.32Å; F84-L90 HydrophobicContact CE1-CD1 4.2Å; F84-L90 HydrophobicContact CG-CD1 4Å; F84-L90 HydrophobicContact CZ-CD1 4.46Å; F84-I117 HydrophobicContact CD1-CG2 3.88Å; F84-I117 HydrophobicContact CE1-CB 3.75Å; F84-I117 HydrophobicContact CE1-CG2 3.48Å; F84-I117 VanDerWaalsContact CE1-CG2 3.48Å; F84-I117 HydrophobicContact CZ-CB 4.38Å; F84-Y121 HydrophobicContact CE2-CD1 4.32Å; F84-Y121 HydrophobicContact CZ-CD1 4.27Å; F84-Y121 HydrophobicContact CZ-CG 4.48Å
85	N	94.5	Very high	92.5	Very high	61 Å²	61	47.2 Å²	47.2	33%	0.326	27%	0.268	S	S	.	.			trans	-108.6	159.2	176	-61.7	-29.9	0	0	0	111.2	A70 D73 G87 D88	A70-N85 VanDerWaalsContact CB-O 3.24Å; A70-N85 WeakPolarHBondContact CB-O 3.47Å; D73-N85 VanDerWaalsContact OD1-CA 3.23Å; D73-N85 WeakPolarHBondContact OD1-CA 3.35Å; N85-G87 PolarHBondContact O-N 3.31Å; N85-D88 PolarHBondContact N-OD2 3.23Å; N85-D88 VanDerWaalsContact O-CB 3.25Å; N85-D88 WeakPolarHBondContact O-CB 3.25Å; N85-D88 PolarHBondContact O-N 2.99Å
86	T	90.9	Very high	92.1	Very high	81 Å²	81	47.4 Å²	47.4	50%	0.497	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	130.1	171	-65.7	0	0	0	0	110.3	A70 L71 F72 D73	A70-T86 WeakPolarHBondContact O-CA 3.45Å; L71-T86 WeakPolarHBondContact O-CG2 3.26Å; L71-T86 PolarHBondContact O-OG1 3.12Å; F72-T86 WeakPolarHBondContact CA-OG1 3.42Å; F72-T86 PolarHBondContact N-OG1 3.47Å; D73-T86 PolarHBondContact N-OG1 3.2Å; D73-T86 PolarHBondContact OD1-N 3.16Å; D73-T86 PolarHBondContact OD1-OG1 3.26Å
87	G	90.6	Very high	91.3	Very high	33 Å²	33	47.1 Å²	47.1	34%	0.34	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.4	-11.7	-177.6	0	0	0	0	0	114.9	A70 N85	A70-G87 PolarHBondContact O-N 2.83Å; N85-G87 PolarHBondContact O-N 3.31Å
88	D	94.8	Very high	90.9	Very high	15 Å²	15	47.2 Å²	47.2	8%	0.08	28%	0.28	C	S	.	.			trans	-63.3	142.2	172.9	-72.8	-12.6	0	0	0	110.3	I69 A70 F84 N85 N107 G108	I69-D88 CarbonylContact C-O 3.56Å; I69-D88 WeakPolarHBondContact CA-O 3.42Å; A70-D88 HydrophobicContact CB-CB 4.38Å; A70-D88 PolarHBondContact N-O 2.98Å; F84-D88 HydrophobicContact CB-CB 4.28Å; N85-D88 PolarHBondContact N-OD2 3.23Å; N85-D88 VanDerWaalsContact O-CB 3.25Å; N85-D88 WeakPolarHBondContact O-CB 3.25Å; N85-D88 PolarHBondContact O-N 2.99Å; D88-N107 WeakPolarHBondContact CA-OD1 3.48Å; D88-G108 VanDerWaalsContact OD1-CA 3.31Å; D88-G108 WeakPolarHBondContact OD1-CA 3.19Å
89	I	95.6	Very high	90.8	Very high	31 Å²	31	49.4 Å²	49.4	16%	0.159	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	125.8	177.9	-56.5	-61	0	0	0	108.7	R67 Y68 I69 V106 N107 V125	R67-I89 HydrophobicContact CB-CG2 3.99Å; R67-I89 HydrophobicContact CG-CG2 4.24Å; Y68-I89 CarbonylContact O-C 3.5Å; Y68-I89 VanDerWaalsContact O-CA 3.31Å; Y68-I89 WeakPolarHBondContact O-CA 3.34Å; I69-I89 HydrophobicContact CB-CD1 3.94Å; I69-I89 HydrophobicContact CD1-CD1 4.21Å; I69-I89 HydrophobicContact CG1-CD1 3.97Å; I89-V106 HydrophobicContact CB-CB 4.3Å; I89-V106 HydrophobicContact CG2-CB 4.19Å; I89-V106 HydrophobicContact CG2-CG2 4.24Å; I89-V106 VanDerWaalsContact O-CB 3.32Å; I89-V106 WeakPolarHBondContact O-CB 3.32Å; I89-V106 PolarHBondContact O-N 3.06Å; I89-N107 PolarHBondContact N-OD1 3.15Å; I89-V125 HydrophobicContact CD1-CG2 3.85Å
90	L	95.6	Very high	90.9	Very high	0 Å²	0	40 Å²	40	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	134.7	-175.6	-53.7	-179.3	0	0	0	109.6	R67 Y68 L82 F84 A103 A105 I117 V122	R67-L90 CarbonylContact C-O 3.53Å; R67-L90 WeakPolarHBondContact CA-O 3.38Å; Y68-L90 PolarHBondContact N-O 3.29Å; Y68-L90 PolarHBondContact O-N 3.44Å; L82-L90 HydrophobicContact CD2-CD2 4.25Å; F84-L90 HydrophobicContact CB-CD2 4.27Å; F84-L90 HydrophobicContact CD1-CD1 3.93Å; F84-L90 HydrophobicContact CD2-CD1 4.32Å; F84-L90 HydrophobicContact CE1-CD1 4.2Å; F84-L90 HydrophobicContact CG-CD1 4Å; F84-L90 HydrophobicContact CZ-CD1 4.46Å; L90-A103 HydrophobicContact CB-CB 4.29Å; L90-A105 HydrophobicContact CD2-CB 3.8Å; L90-I117 HydrophobicContact CD1-CD1 3.85Å; L90-I117 HydrophobicContact CD1-CG2 4.31Å; L90-V122 HydrophobicContact CD1-CG1 3.86Å
91	E	95.1	Very high	90.9	Very high	44 Å²	44	38.2 Å²	38.2	21%	0.206	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	113.2	171.6	-173.7	-175.4	166.8	0	0	109.4	E66 L93 A103 R104 V106	E66-E91 CarbonylContact O-C 3.59Å; E66-E91 WeakPolarHBondContact O-CA 3.4Å; E91-L93 HydrophobicContact CG-CD2 4.16Å; E91-L93 PolarHBondContact O-N 3.41Å; E91-A103 CarbonylContact O-C 3.56Å; E91-A103 WeakPolarHBondContact O-CA 3.48Å; E91-A103 WeakPolarHBondContact O-CB 3.46Å; E91-R104 PolarHBondContact N-O 2.94Å; E91-R104 PolarHBondContact O-N 2.73Å; E91-R104 IonicContact OE1-NH2 2.58Å; E91-R104 PolarHBondContact OE1-NH2 3.12Å; E91-R104 VanDerWaalsContact OE1-NH2 3.08Å; E91-R104 IonicContact OE2-CZ 3.44Å; E91-R104 VanDerWaalsContact OE2-CZ 3.28Å; E91-R104 IonicContact OE2-NE 3.23Å; E91-R104 PolarHBondContact OE2-NE 3.31Å; E91-R104 VanDerWaalsContact OE2-NE 3.16Å; E91-R104 IonicContact OE2-NH2 3.5Å; E91-R104 PolarHBondContact OE2-NH2 3.34Å; E91-V106 HydrophobicContact CB-CG2 3.95Å
92	V	93.3	Very high	91	Very high	24 Å²	24	38.8 Å²	38.8	15%	0.145	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	117.8	-177.4	174.2	0	0	0	0	109.6	E66 Y68 T95 W101 A103 I117	E66-V92 PolarHBondContact O-N 2.79Å; Y68-V92 HydrophobicContact CD2-CB 3.91Å; Y68-V92 HydrophobicContact CD2-CG2 3.26Å; Y68-V92 HydrophobicContact CE2-CB 3.81Å; Y68-V92 HydrophobicContact CE2-CG2 3.57Å; Y68-V92 HydrophobicContact CG-CG2 3.88Å; V92-T95 HydrophobicContact CG1-CG2 3.49Å; V92-T95 VanDerWaalsContact CG1-CG2 3.49Å; V92-W101 HydrophobicContact CG1-CB 4.26Å; V92-W101 HydrophobicContact CG1-CD2 4.33Å; V92-W101 HydrophobicContact CG1-CE3 3.95Å; V92-W101 HydrophobicContact CG1-CG 4.49Å; V92-W101 HydrophobicContact CG2-CE3 3.91Å; V92-W101 HydrophobicContact CG2-CZ3 4.44Å; V92-A103 HydrophobicContact CG2-CB 4.44Å; V92-I117 HydrophobicContact CG2-CD1 4.46Å
93	L	92.4	Very high	90.9	Very high	74 Å²	74	38.6 Å²	38.6	39%	0.387	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	-35.5	-173.9	-56.3	178	0	0	0	112.5	E91 I102 R104 K114	E91-L93 HydrophobicContact CG-CD2 4.16Å; E91-L93 PolarHBondContact O-N 3.41Å; L93-I102 HydrophobicContact CB-CG2 4.38Å; L93-I102 HydrophobicContact CD1-CG2 4.43Å; L93-I102 PolarHBondContact N-O 3.08Å; L93-R104 HydrophobicContact CD1-CB 4.06Å; L93-R104 HydrophobicContact CG-CB 4.5Å; L93-K114 HydrophobicContact CD1-CD 3.85Å; L93-K114 HydrophobicContact CD1-CG 4.06Å
94	D	88.9	Confident	91	Very high	62 Å²	62	41.1 Å²	41.1	33%	0.332	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	130.5	-179.6	-170	1.2	0	0	0	111.4	S96 W101 I102	D94-S96 WeakPolarHBondContact OD1-CB 3Å; D94-S96 PolarHBondContact OD1-N 2.94Å; D94-S96 PolarHBondContact OD1-OG 2.79Å; D94-S96 PolarHBondContact OD2-OG 3.3Å; D94-W101 CarbonylContact O-C 3.54Å; D94-W101 WeakPolarHBondContact O-CA 3.28Å; D94-W101 WeakPolarHBondContact O-CB 3.32Å; D94-I102 HydrophobicContact CB-CB 3.99Å; D94-I102 HydrophobicContact CB-CD1 4.17Å; D94-I102 HydrophobicContact CB-CG1 4.26Å; D94-I102 PolarHBondContact N-O 3.4Å; D94-I102 PolarHBondContact O-N 3.21Å
95	T	88.8	Confident	91	Very high	41 Å²	41	41.1 Å²	41.1	25%	0.252	24%	0.238	S	C	.	.			trans	-115.6	8.8	177.4	68.8	0	0	0	0	112.6	K64 V92 A97 G98 W101	K64-T95 PolarHBondContact NZ-OG1 3Å; V92-T95 HydrophobicContact CG1-CG2 3.49Å; V92-T95 VanDerWaalsContact CG1-CG2 3.49Å; T95-A97 PolarHBondContact O-N 2.81Å; T95-G98 PolarHBondContact O-N 2.85Å; T95-W101 HydrophobicContact CG2-CD2 3.83Å; T95-W101 HydrophobicContact CG2-CE3 4.32Å; T95-W101 HydrophobicContact CG2-CG 3.99Å; T95-W101 HydrophobicContact CG2-CZ2 4.45Å
96	S	84.2	Confident	91	Very high	94 Å²	94	40.4 Å²	40.4	66%	0.657	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	-25.4	-175.5	64.4	0	0	0	0	113.3	D94 G98	D94-S96 WeakPolarHBondContact OD1-CB 3Å; D94-S96 PolarHBondContact OD1-N 2.94Å; D94-S96 PolarHBondContact OD1-OG 2.79Å; D94-S96 PolarHBondContact OD2-OG 3.3Å; S96-G98 PolarHBondContact O-N 3.16Å
97	A	75.4	Confident	91.1	Very high	23 Å²	23	39.5 Å²	39.5	19%	0.19	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	16.6	-178.9	0	0	0	0	0	114.7	T95 E99 W100 Y116 Y238	T95-A97 PolarHBondContact O-N 2.81Å; A97-E99 PolarHBondContact O-N 3.22Å; A97-E99 VanDerWaalsContact O-N 3.12Å; A97-W100 WeakPolarHBondContact CB-O 3.41Å; A97-Y116 HydrophobicContact CB-CE1 4.49Å; A97-Y238 HydrophobicContact CB-CD2 3.72Å; A97-Y238 HydrophobicContact CB-CE2 3.28Å
98	G	82.5	Confident	91.1	Very high	41 Å²	41	39.7 Å²	39.7	42%	0.423	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	-105.4	175.1	0	0	0	0	0	112.5	T95 S96 W101	T95-G98 PolarHBondContact O-N 2.85Å; S96-G98 PolarHBondContact O-N 3.16Å; G98-W101 VanDerWaalsContact O-CD1 3.26Å; G98-W101 PolarHBondContact O-NE1 2.9Å
99	E	86.5	Confident	90.7	Very high	73 Å²	73	43.5 Å²	43.5	34%	0.341	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-9	-172.7	-56.1	-55.2	147.8	0	0	114.4	A97 A119 Y234	A97-E99 PolarHBondContact O-N 3.22Å; A97-E99 VanDerWaalsContact O-N 3.12Å; E99-A119 WeakPolarHBondContact O-CB 3.26Å; E99-A119 PolarHBondContact O-N 2.82Å; E99-Y234 HydrophobicContact CB-CD2 3.59Å; E99-Y234 HydrophobicContact CB-CE2 4.44Å; E99-Y234 HydrophobicContact CB-CG 3.75Å; E99-Y234 HydrophobicContact CG-CD1 4.14Å; E99-Y234 HydrophobicContact CG-CD2 3.64Å; E99-Y234 HydrophobicContact CG-CE2 4.19Å; E99-Y234 HydrophobicContact CG-CG 3.58Å; E99-Y234 VanDerWaalsContact OE2-CD2 3.23Å; E99-Y234 WeakPolarHBondContact OE2-CD2 3.46Å; E99-Y234 WeakPolarHBondContact OE2-CE2 3.45Å
100	W	89	Confident	90.5	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	122.1	174.8	-70.7	82.5	0	0	0	108.9	Y74 A97 Y116 I117 P118 T233 Y234 Y238	Y74-W100 HydrophobicContact CE2-CH2 4.29Å; Y74-W100 HydrophobicContact CE2-CZ3 4.48Å; Y74-W100 AromaticContact CZ-CZ3 3.91Å; Y74-W100 VanDerWaalsContact OH-CH2 3.27Å; Y74-W100 WeakPolarHBondContact OH-CH2 3.28Å; Y74-W100 WeakPolarHBondContact OH-CZ3 3.3Å; A97-W100 WeakPolarHBondContact CB-O 3.41Å; W100-Y116 HydrophobicContact CB-CD1 4.28Å; W100-I117 CarbonylContact C-O 3.48Å; W100-I117 WeakPolarHBondContact CA-O 3.45Å; W100-P118 HydrophobicContact CE3-CG 4.36Å; W100-P118 HydrophobicContact CH2-CG 3.99Å; W100-P118 HydrophobicContact CZ3-CG 3.81Å; W100-T233 HydrophobicContact CH2-CG2 4.32Å; W100-T233 HydrophobicContact CZ2-CG2 4.37Å; W100-Y234 PolarHBondContact NE1-O 2.98Å; W100-Y238 HydrophobicContact CB-CD2 4.14Å
101	W	93	Very high	90.4	Very high	47 Å²	47	46.8 Å²	46.8	18%	0.178	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	151.4	-178	-62.7	-11.2	0	0	0	110.6	Y68 V92 D94 T95 G98 Y116 I117 A119 V122	Y68-W101 HydrophobicContact CD1-CZ3 4.15Å; Y68-W101 HydrophobicContact CE1-CH2 4.26Å; Y68-W101 AromaticContact CE1-CZ3 3.71Å; Y68-W101 HydrophobicContact CE1-CZ3 3.71Å; V92-W101 HydrophobicContact CG1-CB 4.26Å; V92-W101 HydrophobicContact CG1-CD2 4.33Å; V92-W101 HydrophobicContact CG1-CE3 3.95Å; V92-W101 HydrophobicContact CG1-CG 4.49Å; V92-W101 HydrophobicContact CG2-CE3 3.91Å; V92-W101 HydrophobicContact CG2-CZ3 4.44Å; D94-W101 CarbonylContact O-C 3.54Å; D94-W101 WeakPolarHBondContact O-CA 3.28Å; D94-W101 WeakPolarHBondContact O-CB 3.32Å; T95-W101 HydrophobicContact CG2-CD2 3.83Å; T95-W101 HydrophobicContact CG2-CE3 4.32Å; T95-W101 HydrophobicContact CG2-CG 3.99Å; T95-W101 HydrophobicContact CG2-CZ2 4.45Å; G98-W101 VanDerWaalsContact O-CD1 3.26Å; G98-W101 PolarHBondContact O-NE1 2.9Å; W101-Y116 CarbonylContact O-C 3.59Å; W101-Y116 VanDerWaalsContact O-CA 3.28Å; W101-Y116 WeakPolarHBondContact O-CA 3.24Å; W101-I117 HydrophobicContact CB-CG1 4.06Å; W101-I117 PolarHBondContact N-O 2.76Å; W101-I117 WeakPolarHBondContact O-CG1 3.32Å; W101-I117 PolarHBondContact O-N 3.21Å; W101-A119 HydrophobicContact CD2-CB 3.74Å; W101-A119 HydrophobicContact CE3-CB 4.25Å; W101-A119 HydrophobicContact CG-CB 4.18Å; W101-A119 HydrophobicContact CH2-CB 4.15Å; W101-A119 HydrophobicContact CZ2-CB 3.63Å; W101-A119 HydrophobicContact CZ3-CB 4.43Å; W101-V122 HydrophobicContact CE3-CG2 4.14Å; W101-V122 HydrophobicContact CZ3-CG2 3.9Å
102	I	93.4	Very high	90.2	Very high	25 Å²	25	50.7 Å²	50.7	13%	0.128	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	124.8	169.7	-59.6	179.2	0	0	0	107.5	L93 D94 K114 Y116	L93-I102 HydrophobicContact CB-CG2 4.38Å; L93-I102 HydrophobicContact CD1-CG2 4.43Å; L93-I102 PolarHBondContact N-O 3.08Å; D94-I102 HydrophobicContact CB-CB 3.99Å; D94-I102 HydrophobicContact CB-CD1 4.17Å; D94-I102 HydrophobicContact CB-CG1 4.26Å; D94-I102 PolarHBondContact N-O 3.4Å; D94-I102 PolarHBondContact O-N 3.21Å; I102-K114 HydrophobicContact CG2-CD 4.15Å; I102-K114 HydrophobicContact CG2-CG 3.92Å; I102-Y116 HydrophobicContact CD1-CE1 3.93Å; I102-Y116 HydrophobicContact CG1-CD1 3.78Å; I102-Y116 HydrophobicContact CG1-CE1 3.41Å; I102-Y116 VanDerWaalsContact CG1-CE1 3.41Å; I102-Y116 HydrophobicContact CG1-CG 4.49Å
103	A	94.8	Very high	90.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	161.5	178	0	0	0	0	0	111.9	L82 L90 E91 V92 K114 G115 I117	L82-A103 HydrophobicContact CD2-CB 4.49Å; L90-A103 HydrophobicContact CB-CB 4.29Å; E91-A103 CarbonylContact O-C 3.56Å; E91-A103 WeakPolarHBondContact O-CA 3.48Å; E91-A103 WeakPolarHBondContact O-CB 3.46Å; V92-A103 HydrophobicContact CG2-CB 4.44Å; A103-K114 VanDerWaalsContact O-CA 3.29Å; A103-K114 WeakPolarHBondContact O-CA 3.2Å; A103-G115 PolarHBondContact N-O 3.46Å; A103-G115 PolarHBondContact O-N 2.94Å; A103-I117 HydrophobicContact CB-CD1 3.53Å; A103-I117 HydrophobicContact CB-CG1 3.89Å; A103-I117 HydrophobicContact CB-CG2 4.13Å
104	R	95.9	Very high	90.4	Very high	95 Å²	95	58.8 Å²	58.8	36%	0.358	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	131.4	168.4	172.6	174.8	62.3	-161.3	1.7	109.1	E91 L93 K113	E91-R104 PolarHBondContact N-O 2.94Å; E91-R104 PolarHBondContact O-N 2.73Å; E91-R104 IonicContact OE1-NH2 2.58Å; E91-R104 PolarHBondContact OE1-NH2 3.12Å; E91-R104 VanDerWaalsContact OE1-NH2 3.08Å; E91-R104 IonicContact OE2-CZ 3.44Å; E91-R104 VanDerWaalsContact OE2-CZ 3.28Å; E91-R104 IonicContact OE2-NE 3.23Å; E91-R104 PolarHBondContact OE2-NE 3.31Å; E91-R104 VanDerWaalsContact OE2-NE 3.16Å; E91-R104 IonicContact OE2-NH2 3.5Å; E91-R104 PolarHBondContact OE2-NH2 3.34Å; L93-R104 HydrophobicContact CD1-CB 4.06Å; L93-R104 HydrophobicContact CG-CB 4.5Å; R104-K113 VanDerWaalsContact CA-O 3.3Å; R104-K113 WeakPolarHBondContact CA-O 3.45Å
105	A	95.3	Very high	90.7	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	129.9	175.9	0	0	0	0	0	110.8	L82 L90 S110 D112 K113	L82-A105 HydrophobicContact CD2-CB 4.22Å; L90-A105 HydrophobicContact CD2-CB 3.8Å; A105-S110 WeakPolarHBondContact CB-O 3.5Å; A105-D112 PolarHBondContact O-N 2.88Å; A105-K113 PolarHBondContact N-O 3.35Å
106	V	94.8	Very high	91	Very high	46 Å²	46	56.2 Å²	56.2	28%	0.279	30%	0.303	S	S	.	.	S	Bend	trans	-88.8	-28.8	179.2	-177.5	0	0	0	0	111	I89 E91	I89-V106 HydrophobicContact CB-CB 4.3Å; I89-V106 HydrophobicContact CG2-CB 4.19Å; I89-V106 HydrophobicContact CG2-CG2 4.24Å; I89-V106 VanDerWaalsContact O-CB 3.32Å; I89-V106 WeakPolarHBondContact O-CB 3.32Å; I89-V106 PolarHBondContact O-N 3.06Å; E91-V106 HydrophobicContact CB-CG2 3.95Å
107	N	93	Very high	91.4	Very high	61 Å²	61	51.8 Å²	51.8	33%	0.326	27%	0.272	S	S	.	.	S	Bend	trans	-142.5	-168.8	175.4	68.1	-8.4	0	0	0	109.9	D88 I89	D88-N107 WeakPolarHBondContact CA-OD1 3.48Å; I89-N107 PolarHBondContact N-OD1 3.15Å
108	G	90.8	Very high	92.3	Very high	37 Å²	37	50.7 Å²	50.7	38%	0.381	26%	0.263	S	S	.	.	S	Bend	trans	79.3	-165.1	174.2	0	0	0	0	0	114.2	D88 S110 I111	D88-G108 VanDerWaalsContact OD1-CA 3.31Å; D88-G108 WeakPolarHBondContact OD1-CA 3.19Å; G108-S110 PolarHBondContact O-N 3Å; G108-I111 PolarHBondContact O-N 3.16Å
109	I	86.9	Confident	92.7	Very high	95 Å²	95	49.2 Å²	49.2	49%	0.487	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-20.3	-172.3	54.2	171	0	0	0	114	T83	T83-I109 HydrophobicContact CG2-CD1 3.49Å; T83-I109 VanDerWaalsContact CG2-CD1 3.49Å
110	S	91.1	Very high	92.8	Very high	8 Å²	8	47.9 Å²	47.9	6%	0.056	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.8	22.1	-176.8	-65.6	0	0	0	0	112.8	T83 A105 G108 D112 K113	T83-S110 WeakPolarHBondContact O-CB 3.36Å; T83-S110 PolarHBondContact O-OG 3.18Å; A105-S110 WeakPolarHBondContact CB-O 3.5Å; G108-S110 PolarHBondContact O-N 3Å; S110-D112 PolarHBondContact O-N 2.79Å; S110-K113 WeakPolarHBondContact O-CA 3.25Å; S110-K113 WeakPolarHBondContact O-CB 3.37Å; S110-K113 WeakPolarHBondContact O-CG 3.43Å; S110-K113 PolarHBondContact O-N 2.94Å
111	I	93.6	Very high	92.9	Very high	92 Å²	92	48.5 Å²	48.5	47%	0.472	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-43.3	133.7	-178.1	-166.8	166.9	0	0	0	112.6	G108 K113	G108-I111 PolarHBondContact O-N 3.16Å; I111-K113 PolarHBondContact O-N 2.78Å
112	D	91.1	Very high	92.9	Very high	127 Å²	127	46.9 Å²	46.9	68%	0.679	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.2	-2.5	-176.4	-60.4	-45.2	0	0	0	116.4	A105 S110	A105-D112 PolarHBondContact O-N 2.88Å; S110-D112 PolarHBondContact O-N 2.79Å
113	K	95.3	Very high	92.8	Very high	129 Å²	129	45.8 Å²	45.8	56%	0.561	24%	0.235	S	C	*	.			trans	-79.7	151.1	172.1	-57.7	-178.1	-178.4	173.7	0	110.9	L82 R104 A105 S110 I111	L82-K113 HydrophobicContact CD1-CB 3.82Å; R104-K113 VanDerWaalsContact CA-O 3.3Å; R104-K113 WeakPolarHBondContact CA-O 3.45Å; A105-K113 PolarHBondContact N-O 3.35Å; S110-K113 WeakPolarHBondContact O-CA 3.25Å; S110-K113 WeakPolarHBondContact O-CB 3.37Å; S110-K113 WeakPolarHBondContact O-CG 3.43Å; S110-K113 PolarHBondContact O-N 2.94Å; I111-K113 PolarHBondContact O-N 2.78Å
114	K	95.2	Very high	92.6	Very high	138 Å²	138	47.8 Å²	47.8	60%	0.6	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-118.9	141.7	178.4	178.7	-176.1	175.8	-175.9	0	109.7	L93 I102 A103	L93-K114 HydrophobicContact CD1-CD 3.85Å; L93-K114 HydrophobicContact CD1-CG 4.06Å; I102-K114 HydrophobicContact CG2-CD 4.15Å; I102-K114 HydrophobicContact CG2-CG 3.92Å; A103-K114 VanDerWaalsContact O-CA 3.29Å; A103-K114 WeakPolarHBondContact O-CA 3.2Å
115	G	94.6	Very high	92.3	Very high	8 Å²	8	46.2 Å²	46.2	8%	0.082	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.7	-178.4	173.5	0	0	0	0	0	112.2	N80 A103	N80-G115 CarbonylContact O-C 3.55Å; N80-G115 WeakPolarHBondContact O-CA 3.29Å; A103-G115 PolarHBondContact N-O 3.46Å; A103-G115 PolarHBondContact O-N 2.94Å
116	Y	94	Very high	91.9	Very high	42 Å²	42	55.1 Å²	55.1	17%	0.165	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	140.2	174.8	-73.2	-81.8	0	0	0	111.5	N80 D81 L82 A97 W100 W101 I102 Y238	N80-Y116 HydrophobicContact CB-CD2 4.07Å; N80-Y116 HydrophobicContact CB-CE2 4.48Å; N80-Y116 PolarHBondContact O-N 3.05Å; D81-Y116 WeakPolarHBondContact CA-O 3.34Å; L82-Y116 PolarHBondContact N-O 3.37Å; A97-Y116 HydrophobicContact CB-CE1 4.49Å; W100-Y116 HydrophobicContact CB-CD1 4.28Å; W101-Y116 CarbonylContact O-C 3.59Å; W101-Y116 VanDerWaalsContact O-CA 3.28Å; W101-Y116 WeakPolarHBondContact O-CA 3.24Å; I102-Y116 HydrophobicContact CD1-CE1 3.93Å; I102-Y116 HydrophobicContact CG1-CD1 3.78Å; I102-Y116 HydrophobicContact CG1-CE1 3.41Å; I102-Y116 VanDerWaalsContact CG1-CE1 3.41Å; I102-Y116 HydrophobicContact CG1-CG 4.49Å; Y116-Y238 HydrophobicContact CD1-CD1 4.31Å; Y116-Y238 HydrophobicContact CD1-CD2 4.15Å; Y116-Y238 AromaticContact CD1-CG 3.81Å; Y116-Y238 HydrophobicContact CD1-CG 3.81Å; Y116-Y238 HydrophobicContact CD2-CD1 4.29Å; Y116-Y238 HydrophobicContact CD2-CG 4.41Å; Y116-Y238 AromaticContact CE1-CD1 3.69Å; Y116-Y238 HydrophobicContact CE1-CD1 3.69Å; Y116-Y238 AromaticContact CE1-CD2 3.7Å; Y116-Y238 HydrophobicContact CE1-CD2 3.7Å; Y116-Y238 HydrophobicContact CE1-CE1 4.03Å; Y116-Y238 HydrophobicContact CE1-CE2 4.06Å; Y116-Y238 AromaticContact CE1-CG 3.5Å; Y116-Y238 HydrophobicContact CE1-CG 3.5Å; Y116-Y238 VanDerWaalsContact CE1-CG 3.5Å; Y116-Y238 AromaticContact CE2-CD1 3.69Å; Y116-Y238 HydrophobicContact CE2-CD1 3.69Å; Y116-Y238 HydrophobicContact CE2-CE1 4.2Å; Y116-Y238 HydrophobicContact CE2-CG 4.16Å; Y116-Y238 HydrophobicContact CG-CG 4.26Å; Y116-Y238 AromaticContact CZ-CD1 3.35Å; Y116-Y238 AromaticContact CZ-CE1 3.55Å; Y116-Y238 AromaticContact CZ-CG 3.7Å; Y116-Y238 WeakPolarHBondContact OH-CE1 3.33Å
117	I	94.2	Very high	91.6	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	148.9	175.9	63.8	164.3	0	0	0	110.1	L82 F84 L90 V92 W100 W101 A103 V122	L82-I117 HydrophobicContact CB-CG2 3.83Å; L82-I117 HydrophobicContact CD2-CG2 3.98Å; L82-I117 HydrophobicContact CG-CG2 4.37Å; F84-I117 HydrophobicContact CD1-CG2 3.88Å; F84-I117 HydrophobicContact CE1-CB 3.75Å; F84-I117 HydrophobicContact CE1-CG2 3.48Å; F84-I117 VanDerWaalsContact CE1-CG2 3.48Å; F84-I117 HydrophobicContact CZ-CB 4.38Å; L90-I117 HydrophobicContact CD1-CD1 3.85Å; L90-I117 HydrophobicContact CD1-CG2 4.31Å; V92-I117 HydrophobicContact CG2-CD1 4.46Å; W100-I117 CarbonylContact C-O 3.48Å; W100-I117 WeakPolarHBondContact CA-O 3.45Å; W101-I117 HydrophobicContact CB-CG1 4.06Å; W101-I117 PolarHBondContact N-O 2.76Å; W101-I117 WeakPolarHBondContact O-CG1 3.32Å; W101-I117 PolarHBondContact O-N 3.21Å; A103-I117 HydrophobicContact CB-CD1 3.53Å; A103-I117 HydrophobicContact CB-CG1 3.89Å; A103-I117 HydrophobicContact CB-CG2 4.13Å; I117-V122 HydrophobicContact CD1-CG1 3.95Å; I117-V122 HydrophobicContact CD1-CG2 4.25Å
118	P	92.4	Very high	91.4	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	128.4	169.7	-13.6	27.8	0	0	0	111	Y74 W100 N120 Y121 T233	Y74-P118 HydrophobicContact CD2-CG 3.66Å; Y74-P118 HydrophobicContact CE2-CG 3.55Å; Y74-P118 HydrophobicContact CG-CG 4.23Å; W100-P118 HydrophobicContact CE3-CG 4.36Å; W100-P118 HydrophobicContact CH2-CG 3.99Å; W100-P118 HydrophobicContact CZ3-CG 3.81Å; P118-N120 VanDerWaalsContact C-N 3.26Å; P118-N120 WeakPolarHBondContact CB-OD1 3.47Å; P118-N120 PolarHBondContact O-N 2.97Å; P118-Y121 HydrophobicContact CB-CD2 3.61Å; P118-Y121 HydrophobicContact CB-CE2 4.19Å; P118-Y121 HydrophobicContact CB-CG 4.03Å; P118-Y121 HydrophobicContact CG-CD2 4Å; P118-Y121 HydrophobicContact CG-CE2 4.36Å; P118-Y121 HydrophobicContact CG-CG 4.1Å; P118-Y121 PolarHBondContact O-N 3.19Å; P118-Y121 VanDerWaalsContact O-N 3.15Å; P118-T233 HydrophobicContact CB-CG2 3.81Å; P118-T233 HydrophobicContact CG-CG2 3.57Å
119	A	91.1	Very high	91.2	Very high	11 Å²	11	54.8 Å²	54.8	9%	0.091	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-61.7	-33.6	-179.1	0	0	0	0	0	112.8	E99 W101 Y121 V122	E99-A119 WeakPolarHBondContact O-CB 3.26Å; E99-A119 PolarHBondContact O-N 2.82Å; W101-A119 HydrophobicContact CD2-CB 3.74Å; W101-A119 HydrophobicContact CE3-CB 4.25Å; W101-A119 HydrophobicContact CG-CB 4.18Å; W101-A119 HydrophobicContact CH2-CB 4.15Å; W101-A119 HydrophobicContact CZ2-CB 3.63Å; W101-A119 HydrophobicContact CZ3-CB 4.43Å; A119-Y121 PolarHBondContact O-N 2.97Å; A119-V122 WeakPolarHBondContact O-CG2 3.25Å
120	N	89.1	Confident	91.3	Very high	44 Å²	44	51 Å²	51	24%	0.235	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-78.4	1.7	179.8	67.2	-33.7	0	0	0	114.5	P118 Q232 Y234	P118-N120 VanDerWaalsContact C-N 3.26Å; P118-N120 WeakPolarHBondContact CB-OD1 3.47Å; P118-N120 PolarHBondContact O-N 2.97Å; N120-Q232 PolarHBondContact ND2-O 3.25Å; N120-Y234 HydrophobicContact CB-CE2 4.29Å
121	Y	91.8	Very high	91.4	Very high	13 Å²	13	52 Å²	52	5%	0.051	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-96.1	-3.6	177.1	-84.2	-128.5	0	0	0	112.5	L71 F72 D73 Y74 F84 P118 A119 A230 P231 T233	L71-Y121 WeakPolarHBondContact CB-O 3.37Å; L71-Y121 PolarHBondContact N-O 3.49Å; F72-Y121 HydrophobicContact CB-CD1 3.73Å; F72-Y121 HydrophobicContact CB-CE1 3.94Å; F72-Y121 HydrophobicContact CB-CG 4.42Å; F72-Y121 HydrophobicContact CD2-CG 4.46Å; D73-Y121 WeakPolarHBondContact O-CE1 3.42Å; Y74-Y121 HydrophobicContact CD2-CD1 4.22Å; Y74-Y121 AromaticContact CD2-CE1 3.96Å; Y74-Y121 HydrophobicContact CD2-CE1 3.96Å; Y74-Y121 HydrophobicContact CG-CD1 4.46Å; F84-Y121 HydrophobicContact CE2-CD1 4.32Å; F84-Y121 HydrophobicContact CZ-CD1 4.27Å; F84-Y121 HydrophobicContact CZ-CG 4.48Å; P118-Y121 HydrophobicContact CB-CD2 3.61Å; P118-Y121 HydrophobicContact CB-CE2 4.19Å; P118-Y121 HydrophobicContact CB-CG 4.03Å; P118-Y121 HydrophobicContact CG-CD2 4Å; P118-Y121 HydrophobicContact CG-CE2 4.36Å; P118-Y121 HydrophobicContact CG-CG 4.1Å; P118-Y121 PolarHBondContact O-N 3.19Å; P118-Y121 VanDerWaalsContact O-N 3.15Å; A119-Y121 PolarHBondContact O-N 2.97Å; Y121-A230 HydrophobicContact CE1-CB 3.94Å; Y121-A230 WeakPolarHBondContact OH-CB 3.3Å; Y121-P231 HydrophobicContact CD2-CG 4.13Å; Y121-P231 HydrophobicContact CE2-CG 3.89Å; Y121-P231 WeakPolarHBondContact CE2-O 3.3Å; Y121-P231 VanDerWaalsContact CZ-O 3.25Å; Y121-P231 PolarHBondContact OH-O 2.77Å; Y121-T233 HydrophobicContact CD2-CG2 4.47Å; Y121-T233 HydrophobicContact CE2-CG2 3.72Å
122	V	92.2	Very high	91.2	Very high	14 Å²	14	51 Å²	51	9%	0.085	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	150.3	-170.8	-63.1	0	0	0	0	111.7	Y68 I69 L90 W101 I117 A119	Y68-V122 HydrophobicContact CD1-CB 4.28Å; Y68-V122 HydrophobicContact CD1-CG2 3.98Å; Y68-V122 HydrophobicContact CG-CG2 4.4Å; I69-V122 VanDerWaalsContact O-CA 3.28Å; I69-V122 WeakPolarHBondContact O-CA 3.47Å; L90-V122 HydrophobicContact CD1-CG1 3.86Å; W101-V122 HydrophobicContact CE3-CG2 4.14Å; W101-V122 HydrophobicContact CZ3-CG2 3.9Å; I117-V122 HydrophobicContact CD1-CG1 3.95Å; I117-V122 HydrophobicContact CD1-CG2 4.25Å; A119-V122 WeakPolarHBondContact O-CG2 3.25Å
123	A	91.1	Very high	91.3	Very high	2 Å²	2	45.5 Å²	45.5	2%	0.017	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	150.4	172.2	0	0	0	0	0	111	Y68 I69 L71 V125 D129 A130	Y68-A123 CarbonylContact C-O 3.58Å; Y68-A123 WeakPolarHBondContact CA-O 3.5Å; Y68-A123 WeakPolarHBondContact CB-O 3.41Å; Y68-A123 VanDerWaalsContact CD1-C 3.41Å; I69-A123 PolarHBondContact N-O 3.47Å; I69-A123 PolarHBondContact O-N 3.23Å; L71-A123 HydrophobicContact CD1-CB 3.95Å; L71-A123 HydrophobicContact CD2-CB 4.02Å; L71-A123 HydrophobicContact CG-CB 4.15Å; A123-V125 PolarHBondContact O-N 3.22Å; A123-D129 VanDerWaalsContact CB-C 3.46Å; A123-D129 HydrophobicContact CB-CB 3.65Å; A123-A130 HydrophobicContact CB-CB 4.44Å
124	P	92.1	Very high	91.2	Very high	42 Å²	42	40 Å²	40	27%	0.273	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	132.5	172.3	-20.5	30.4	0	0	0	110.5	Y68 E126 S127 A130	Y68-P124 HydrophobicContact CD1-CG 4.22Å; Y68-P124 HydrophobicContact CE1-CB 4.35Å; Y68-P124 HydrophobicContact CE1-CG 3.71Å; P124-E126 PolarHBondContact O-N 2.93Å; P124-E126 VanDerWaalsContact O-N 3.08Å; P124-S127 WeakPolarHBondContact O-CB 3.48Å; P124-S127 PolarHBondContact O-N 3.35Å; P124-S127 PolarHBondContact O-OG 3.16Å; P124-A130 WeakPolarHBondContact O-CB 3.38Å
125	V	89.4	Confident	91	Very high	62 Å²	62	34.3 Å²	34.3	38%	0.376	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-32.9	-174.3	172.6	0	0	0	0	113.5	R67 I69 I89 A123	R67-V125 HydrophobicContact CB-CG2 4.06Å; R67-V125 WeakPolarHBondContact O-CG2 3.39Å; R67-V125 PolarHBondContact O-N 3.45Å; I69-V125 HydrophobicContact CB-CG2 4.25Å; I89-V125 HydrophobicContact CD1-CG2 3.85Å; A123-V125 PolarHBondContact O-N 3.22Å
126	E	86.1	Confident	90.7	Very high	187 Å²	187	35.7 Å²	35.7	87%	0.874	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-1.4	-178.5	-60.1	-176	168.7	0	0	113.8	P124	P124-E126 PolarHBondContact O-N 2.93Å; P124-E126 VanDerWaalsContact O-N 3.08Å
127	S	88.4	Confident	90.2	Very high	27 Å²	27	40.6 Å²	40.6	19%	0.189	22%	0.223	C	C	.	.	S	Bend	trans	-85.3	157.7	-178.8	71.6	0	0	0	0	112.1	P124 D129 A130	P124-S127 WeakPolarHBondContact O-CB 3.48Å; P124-S127 PolarHBondContact O-N 3.35Å; P124-S127 PolarHBondContact O-OG 3.16Å; S127-D129 PolarHBondContact O-N 2.88Å; S127-D129 PolarHBondContact OG-N 2.89Å; S127-A130 VanDerWaalsContact O-CB 3.32Å; S127-A130 WeakPolarHBondContact O-CB 3.18Å; S127-A130 PolarHBondContact O-N 3.01Å; S127-A130 PolarHBondContact OG-N 2.82Å
128	I	88.3	Confident	89.9	Confident	43 Å²	43	41.7 Å²	41.7	22%	0.221	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-62.6	-25.9	168.3	-169.4	172.1	0	0	0	112.1	A130 E131 W133 Y134 L203	I128-A130 PolarHBondContact O-N 3.27Å; I128-E131 VanDerWaalsContact O-CB 3.3Å; I128-E131 WeakPolarHBondContact O-CB 3.34Å; I128-E131 PolarHBondContact O-N 2.83Å; I128-W133 HydrophobicContact CD1-CH2 4.27Å; I128-W133 HydrophobicContact CD1-CZ3 4.33Å; I128-W133 HydrophobicContact CG1-CH2 4.2Å; I128-W133 HydrophobicContact CG1-CZ3 4.44Å; I128-Y134 HydrophobicContact CB-CD1 4.4Å; I128-Y134 HydrophobicContact CD1-CD1 4.42Å; I128-Y134 HydrophobicContact CD1-CD2 3.73Å; I128-Y134 HydrophobicContact CD1-CE1 4.47Å; I128-Y134 HydrophobicContact CD1-CE2 3.8Å; I128-Y134 HydrophobicContact CD1-CG 4.05Å; I128-Y134 HydrophobicContact CG1-CD1 3.89Å; I128-Y134 HydrophobicContact CG1-CD2 3.94Å; I128-Y134 HydrophobicContact CG1-CE1 4.25Å; I128-Y134 HydrophobicContact CG1-CE2 4.31Å; I128-Y134 HydrophobicContact CG1-CG 3.71Å; I128-Y134 HydrophobicContact CG2-CD1 4.03Å; I128-Y134 HydrophobicContact CG2-CE1 3.7Å; I128-Y134 WeakPolarHBondContact O-CB 3.19Å; I128-L203 HydrophobicContact CD1-CB 4.34Å; I128-L203 HydrophobicContact CD1-CD1 3.38Å; I128-L203 HydrophobicContact CD1-CG 4.47Å
129	D	87.5	Confident	89.6	Confident	67 Å²	67	45.7 Å²	45.7	36%	0.358	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-64.6	-20.4	176.8	-57.3	-64.9	0	0	0	112.8	L71 A123 S127 E131 Y134	L71-D129 VanDerWaalsContact CD2-O 3.31Å; L71-D129 WeakPolarHBondContact CD2-O 3.44Å; A123-D129 VanDerWaalsContact CB-C 3.46Å; A123-D129 HydrophobicContact CB-CB 3.65Å; S127-D129 PolarHBondContact O-N 2.88Å; S127-D129 PolarHBondContact OG-N 2.89Å; D129-E131 VanDerWaalsContact C-N 3.27Å; D129-Y134 VanDerWaalsContact OD1-CE1 3.29Å; D129-Y134 WeakPolarHBondContact OD1-CE1 3.42Å
130	A	89.5	Confident	89.3	Confident	15 Å²	15	46 Å²	46	12%	0.124	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-73.2	-17.7	171.8	0	0	0	0	0	113.4	I69 A123 P124 S127 I128	I69-A130 HydrophobicContact CG2-CB 3.54Å; A123-A130 HydrophobicContact CB-CB 4.44Å; P124-A130 WeakPolarHBondContact O-CB 3.38Å; S127-A130 VanDerWaalsContact O-CB 3.32Å; S127-A130 WeakPolarHBondContact O-CB 3.18Å; S127-A130 PolarHBondContact O-N 3.01Å; S127-A130 PolarHBondContact OG-N 2.82Å; I128-A130 PolarHBondContact O-N 3.27Å
131	E	91.7	Very high	88.8	Confident	30 Å²	30	46 Å²	46	14%	0.14	25%	0.246	C	C	.	.	S	Bend	trans	-78.3	130.3	-174.8	-65.5	-69.3	157.9	0	0	111	I128 D129 W133 Y134 K204	I128-E131 VanDerWaalsContact O-CB 3.3Å; I128-E131 WeakPolarHBondContact O-CB 3.34Å; I128-E131 PolarHBondContact O-N 2.83Å; D129-E131 VanDerWaalsContact C-N 3.27Å; E131-W133 HydrophobicContact CB-CD2 4.05Å; E131-W133 HydrophobicContact CB-CH2 4.25Å; E131-W133 HydrophobicContact CB-CZ2 3.68Å; E131-W133 HydrophobicContact CG-CH2 4.24Å; E131-W133 HydrophobicContact CG-CZ2 3.57Å; E131-W133 PolarHBondContact O-N 3.4Å; E131-W133 PolarHBondContact OE2-NE1 3.44Å; E131-Y134 PolarHBondContact O-N 2.98Å; E131-Y134 VanDerWaalsContact O-N 3.11Å; E131-K204 WeakPolarHBondContact OE1-CD 3.36Å; E131-K204 IonicContact OE1-NZ 2.64Å; E131-K204 PolarHBondContact OE1-NZ 3.05Å
132	P	89.8	Confident	88.4	Confident	71 Å²	71	48 Å²	48	46%	0.461	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-24.5	-174	25.7	-34.3	0	0	0	113.1	F135 P224 K227	P132-F135 WeakPolarHBondContact O-CE2 3.22Å; P132-P224 HydrophobicContact CB-CB 4.43Å; P132-P224 HydrophobicContact CB-CG 4.36Å; P132-P224 HydrophobicContact CG-CG 4.14Å; P132-K227 WeakPolarHBondContact O-CE 3.26Å
133	W	93.4	Very high	88.2	Confident	11 Å²	11	47.4 Å²	47.4	4%	0.042	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-1.2	179.2	49.2	-96.3	0	0	0	113.7	I128 E131 F135 F157 L158 V159 L203 K204 V207 P224	I128-W133 HydrophobicContact CD1-CH2 4.27Å; I128-W133 HydrophobicContact CD1-CZ3 4.33Å; I128-W133 HydrophobicContact CG1-CH2 4.2Å; I128-W133 HydrophobicContact CG1-CZ3 4.44Å; E131-W133 HydrophobicContact CB-CD2 4.05Å; E131-W133 HydrophobicContact CB-CH2 4.25Å; E131-W133 HydrophobicContact CB-CZ2 3.68Å; E131-W133 HydrophobicContact CG-CH2 4.24Å; E131-W133 HydrophobicContact CG-CZ2 3.57Å; E131-W133 PolarHBondContact O-N 3.4Å; E131-W133 PolarHBondContact OE2-NE1 3.44Å; W133-F135 WeakPolarHBondContact O-CD2 3.35Å; W133-F157 HydrophobicContact CB-CD2 4.28Å; W133-F157 HydrophobicContact CB-CE2 3.5Å; W133-F157 HydrophobicContact CB-CZ 3.73Å; W133-F157 HydrophobicContact CD2-CE2 4.36Å; W133-F157 AromaticContact CG-CE2 3.82Å; W133-F157 HydrophobicContact CG-CE2 3.82Å; W133-F157 HydrophobicContact CG-CZ 4Å; W133-L158 CarbonylContact O-C 3.59Å; W133-L158 WeakPolarHBondContact O-CA 3.26Å; W133-V159 HydrophobicContact CE3-CB 3.59Å; W133-V159 HydrophobicContact CE3-CG2 3.43Å; W133-V159 VanDerWaalsContact CE3-CG2 3.43Å; W133-V159 HydrophobicContact CZ3-CB 3.62Å; W133-V159 HydrophobicContact CZ3-CG1 4.13Å; W133-V159 HydrophobicContact CZ3-CG2 3.56Å; W133-V159 PolarHBondContact O-N 3.32Å; W133-L203 HydrophobicContact CH2-CB 3.77Å; W133-L203 HydrophobicContact CZ3-CB 4.35Å; W133-K204 HydrophobicContact CZ2-CB 4.42Å; W133-V207 HydrophobicContact CD2-CG2 4.01Å; W133-V207 HydrophobicContact CE3-CG2 4.11Å; W133-V207 HydrophobicContact CG-CG1 4.49Å; W133-V207 HydrophobicContact CH2-CG2 4.19Å; W133-V207 HydrophobicContact CZ2-CB 4.47Å; W133-V207 HydrophobicContact CZ2-CG2 4.07Å; W133-V207 HydrophobicContact CZ3-CG2 4.2Å; W133-P224 HydrophobicContact CB-CB 3.9Å; W133-P224 HydrophobicContact CB-CG 4.11Å
134	Y	93.3	Very high	88.1	Confident	14 Å²	14	49.8 Å²	49.8	6%	0.055	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-96.3	129.9	-179.3	-173.7	-118.5	0	0	0	112.6	I128 D129 E131 P136 V159 N161 Y169	I128-Y134 HydrophobicContact CB-CD1 4.4Å; I128-Y134 HydrophobicContact CD1-CD1 4.42Å; I128-Y134 HydrophobicContact CD1-CD2 3.73Å; I128-Y134 HydrophobicContact CD1-CE1 4.47Å; I128-Y134 HydrophobicContact CD1-CE2 3.8Å; I128-Y134 HydrophobicContact CD1-CG 4.05Å; I128-Y134 HydrophobicContact CG1-CD1 3.89Å; I128-Y134 HydrophobicContact CG1-CD2 3.94Å; I128-Y134 HydrophobicContact CG1-CE1 4.25Å; I128-Y134 HydrophobicContact CG1-CE2 4.31Å; I128-Y134 HydrophobicContact CG1-CG 3.71Å; I128-Y134 HydrophobicContact CG2-CD1 4.03Å; I128-Y134 HydrophobicContact CG2-CE1 3.7Å; I128-Y134 WeakPolarHBondContact O-CB 3.19Å; D129-Y134 VanDerWaalsContact OD1-CE1 3.29Å; D129-Y134 WeakPolarHBondContact OD1-CE1 3.42Å; E131-Y134 PolarHBondContact O-N 2.98Å; E131-Y134 VanDerWaalsContact O-N 3.11Å; Y134-P136 HydrophobicContact CD1-CB 4.49Å; Y134-P136 HydrophobicContact CD1-CG 4.33Å; Y134-P136 HydrophobicContact CE1-CB 3.66Å; Y134-P136 HydrophobicContact CE1-CG 3.89Å; Y134-V159 WeakPolarHBondContact CA-O 3.29Å; Y134-V159 HydrophobicContact CD2-CB 4.31Å; Y134-V159 HydrophobicContact CD2-CG1 4.24Å; Y134-V159 WeakPolarHBondContact CD2-O 3.29Å; Y134-N161 PolarHBondContact OH-OD1 2.9Å; Y134-Y169 HydrophobicContact CE2-CD1 4Å; Y134-Y169 AromaticContact CE2-CE1 3.84Å; Y134-Y169 HydrophobicContact CE2-CE1 3.84Å
135	F	91.4	Very high	87.8	Confident	18 Å²	18	51.1 Å²	51.1	8%	0.079	27%	0.266	C	S	.	.			trans	-136.6	74.8	-171	-75.2	-107.1	0	0	0	109.1	P132 W133 D137 T138 L146 L158 V159 R160 C225 K227	P132-F135 WeakPolarHBondContact O-CE2 3.22Å; W133-F135 WeakPolarHBondContact O-CD2 3.35Å; F135-D137 PolarHBondContact O-N 3.04Å; F135-T138 WeakPolarHBondContact CB-OG1 3.23Å; F135-T138 PolarHBondContact O-N 3.41Å; F135-L146 HydrophobicContact CD1-CD1 4.3Å; F135-L146 HydrophobicContact CE1-CD1 4.36Å; F135-L158 HydrophobicContact CB-CD1 4.35Å; F135-L158 HydrophobicContact CD1-CD2 4.47Å; F135-L158 HydrophobicContact CD2-CB 3.55Å; F135-L158 HydrophobicContact CD2-CD2 4.41Å; F135-L158 HydrophobicContact CD2-CG 4.47Å; F135-L158 HydrophobicContact CE2-CB 3.91Å; F135-L158 HydrophobicContact CG-CB 4.15Å; F135-L158 HydrophobicContact CG-CD2 4.31Å; F135-V159 PolarHBondContact N-O 2.75Å; F135-R160 WeakPolarHBondContact O-CA 3.2Å; F135-R160 WeakPolarHBondContact O-CB 3.34Å; F135-C225 HydrophobicContact CE2-CB 4.16Å; F135-C225 HydrophobicContact CZ-CB 4Å; F135-C225 WeakPolarHBondContact CZ-O 3.32Å; F135-K227 HydrophobicContact CE1-CG 3.74Å; F135-K227 HydrophobicContact CE2-CG 4.32Å; F135-K227 HydrophobicContact CZ-CD 4.28Å; F135-K227 HydrophobicContact CZ-CG 3.42Å; F135-K227 VanDerWaalsContact CZ-CG 3.42Å
136	P	88.3	Confident	87.7	Confident	37 Å²	37	49.9 Å²	49.9	24%	0.24	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-42.2	-166.4	18.8	-30.2	0	0	0	113.7	Y134 N161	Y134-P136 HydrophobicContact CD1-CB 4.49Å; Y134-P136 HydrophobicContact CD1-CG 4.33Å; Y134-P136 HydrophobicContact CE1-CB 3.66Å; Y134-P136 HydrophobicContact CE1-CG 3.89Å; P136-N161 WeakPolarHBondContact O-CB 3.31Å; P136-N161 PolarHBondContact O-ND2 2.86Å
137	D	83.7	Confident	88	Confident	145 Å²	145	41 Å²	41	78%	0.775	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.7	5	-172.4	-56.6	-46.9	0	0	0	113.6	F135 K139	F135-D137 PolarHBondContact O-N 3.04Å; D137-K139 PolarHBondContact O-N 3.49Å
138	T	86.5	Confident	88.1	Confident	23 Å²	23	44.7 Å²	44.7	14%	0.141	23%	0.23	C	C	.	.			trans	-79.8	122.5	-177.7	-64.1	0	0	0	0	110.3	F135 D142 A143 L146 R160	F135-T138 WeakPolarHBondContact CB-OG1 3.23Å; F135-T138 PolarHBondContact O-N 3.41Å; T138-D142 HydrophobicContact CG2-CB 3.83Å; T138-A143 HydrophobicContact CG2-CB 3.81Å; T138-L146 HydrophobicContact CG2-CD1 3.85Å; T138-R160 VanDerWaalsContact O-CD 3.29Å; T138-R160 WeakPolarHBondContact O-CD 3.36Å
139	K	86	Confident	87.9	Confident	84 Å²	84	43.5 Å²	43.5	37%	0.365	23%	0.228	S	C	.	.			trans	-77.4	168.7	173.1	-61.3	-170.1	-179.4	-174.4	0	111.2	D137 L141 D142 A143 E505	D137-K139 PolarHBondContact O-N 3.49Å; K139-L141 PolarHBondContact O-N 3.18Å; K139-D142 PolarHBondContact O-N 2.72Å; K139-A143 WeakPolarHBondContact O-CB 3.13Å; K139-A143 PolarHBondContact O-N 2.83Å; K139-E505 IonicContact NZ-OE1 2.81Å; K139-E505 PolarHBondContact NZ-OE1 3.4Å
140	R	84.8	Confident	87.5	Confident	16 Å²	16	49.1 Å²	49.1	6%	0.06	25%	0.252	C	S	.	.	H	α-helix	trans	-55	-51	-178.8	178.5	154.9	170.2	166	4.4	111.9	A143 E144 R160 E163 H181 L512 S514	R140-A143 WeakPolarHBondContact O-CB 3.47Å; R140-A143 PolarHBondContact O-N 3.44Å; R140-E144 IonicContact NE-OE1 3.55Å; R140-E144 WeakPolarHBondContact O-CG 3.42Å; R140-E144 PolarHBondContact O-N 3.17Å; R140-R160 VanDerWaalsContact CB-NH2 3.31Å; R140-E163 WeakPolarHBondContact CA-OE1 3.25Å; R140-E163 VanDerWaalsContact CB-OE1 3.26Å; R140-E163 WeakPolarHBondContact CB-OE1 3.24Å; R140-E163 PolarHBondContact N-OE1 3.26Å; R140-H181 PolarHBondContact NE-CD2 3.29Å; R140-H181 PolarHBondContact NE-NE2 3.13Å; R140-H181 PolarHBondContact NH2-CD2 2.85Å; R140-L512 HydrophobicContact CB-CD2 4.31Å; R140-L512 HydrophobicContact CG-CD2 3.89Å; R140-L512 PolarHBondContact NH1-O 2.87Å; R140-L512 VanDerWaalsContact NH1-O 3.16Å; R140-S514 PolarHBondContact NH1-O 3.17Å; R140-S514 PolarHBondContact NH2-O 3.4Å
141	L	79.1	Confident	87.3	Confident	46 Å²	46	50 Å²	50	24%	0.241	26%	0.262	C	S	.	.	H	α-helix	trans	-67.4	-38.2	-179.4	-65.5	173.7	0	0	0	112.3	K139 A143 E144 K145 F508 L512	K139-L141 PolarHBondContact O-N 3.18Å; L141-A143 VanDerWaalsContact C-N 3.28Å; L141-A143 PolarHBondContact O-N 3.02Å; L141-E144 WeakPolarHBondContact O-CB 3.49Å; L141-E144 PolarHBondContact O-N 2.86Å; L141-K145 WeakPolarHBondContact O-CG 3.38Å; L141-K145 PolarHBondContact O-N 3.32Å; L141-F508 HydrophobicContact CD1-CB 4.11Å; L141-F508 HydrophobicContact CD1-CD1 3.46Å; L141-F508 VanDerWaalsContact CD1-CD1 3.46Å; L141-F508 HydrophobicContact CD1-CE1 3.94Å; L141-F508 HydrophobicContact CD1-CG 3.8Å; L141-L512 HydrophobicContact CD2-CD2 4.47Å
142	D	83.1	Confident	87.3	Confident	55 Å²	55	49.7 Å²	49.7	29%	0.294	26%	0.262	S	S	.	.	H	α-helix	trans	-62.1	-41.3	174	-63	-34	0	0	0	110.4	T138 K139 E144 K145 L146	T138-D142 HydrophobicContact CG2-CB 3.83Å; K139-D142 PolarHBondContact O-N 2.72Å; D142-E144 VanDerWaalsContact C-N 3.33Å; D142-E144 PolarHBondContact O-N 3.01Å; D142-K145 PolarHBondContact O-N 2.78Å; D142-L146 WeakPolarHBondContact O-CB 3.31Å; D142-L146 WeakPolarHBondContact O-CG 3.48Å; D142-L146 PolarHBondContact O-N 3.25Å
143	A	89.3	Confident	87.4	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.2	-40.2	174.2	0	0	0	0	0	112.1	T138 K139 R140 L141 L147 L158	T138-A143 HydrophobicContact CG2-CB 3.81Å; K139-A143 WeakPolarHBondContact O-CB 3.13Å; K139-A143 PolarHBondContact O-N 2.83Å; R140-A143 WeakPolarHBondContact O-CB 3.47Å; R140-A143 PolarHBondContact O-N 3.44Å; L141-A143 VanDerWaalsContact C-N 3.28Å; L141-A143 PolarHBondContact O-N 3.02Å; A143-L147 VanDerWaalsContact O-CB 3.25Å; A143-L147 WeakPolarHBondContact O-CB 3.47Å; A143-L147 WeakPolarHBondContact O-CG 3.19Å; A143-L147 PolarHBondContact O-N 2.88Å; A143-L158 HydrophobicContact CB-CD1 3.83Å; A143-L158 HydrophobicContact CB-CD2 3.99Å; A143-L158 HydrophobicContact CB-CG 4.33Å
144	E	89.6	Confident	87.5	Confident	52 Å²	52	57.4 Å²	57.4	24%	0.243	29%	0.292	C	S	.	.	H	α-helix	trans	-59.7	-50.4	175.3	-66.9	-178.4	-172.6	0	0	111.1	R140 L141 D142 L147 Q148 V179 H181	R140-E144 IonicContact NE-OE1 3.55Å; R140-E144 WeakPolarHBondContact O-CG 3.42Å; R140-E144 PolarHBondContact O-N 3.17Å; L141-E144 WeakPolarHBondContact O-CB 3.49Å; L141-E144 PolarHBondContact O-N 2.86Å; D142-E144 VanDerWaalsContact C-N 3.33Å; D142-E144 PolarHBondContact O-N 3.01Å; E144-L147 PolarHBondContact O-N 3.13Å; E144-Q148 VanDerWaalsContact O-CB 3.25Å; E144-Q148 WeakPolarHBondContact O-CB 3.32Å; E144-Q148 VanDerWaalsContact O-CG 3.24Å; E144-Q148 WeakPolarHBondContact O-CG 3.31Å; E144-Q148 PolarHBondContact O-N 3.47Å; E144-V179 HydrophobicContact CB-CG2 4.48Å; E144-V179 HydrophobicContact CG-CB 4.03Å; E144-V179 HydrophobicContact CG-CG1 4.32Å; E144-H181 IonicContact OE1-NE2 3.52Å; E144-H181 PolarHBondContact OE1-NE2 2.67Å
145	K	84.9	Confident	87.6	Confident	71 Å²	71	56.8 Å²	56.8	31%	0.309	29%	0.29	S	S	.	.	H	α-helix	trans	-62.3	-45.4	178.1	-68.6	178.2	-175.2	-179.7	0	112.6	L141 D142 G149 D347 E350	L141-K145 WeakPolarHBondContact O-CG 3.38Å; L141-K145 PolarHBondContact O-N 3.32Å; D142-K145 PolarHBondContact O-N 2.78Å; K145-G149 PolarHBondContact O-N 3.26Å; K145-D347 IonicContact NZ-OD1 2.9Å; K145-E350 WeakPolarHBondContact CE-OE2 3.32Å; K145-E350 IonicContact NZ-OE1 3.96Å; K145-E350 PolarHBondContact NZ-OE1 3.14Å; K145-E350 IonicContact NZ-OE2 3.79Å; K145-E350 PolarHBondContact NZ-OE2 3.48Å
146	L	88	Confident	87.9	Confident	36 Å²	36	56 Å²	56	19%	0.188	29%	0.287	C	S	.	.	H	α-helix	trans	-61.3	-48.9	179.5	-74.2	171.4	0	0	0	110.6	F135 T138 D142 G149 N152	F135-L146 HydrophobicContact CD1-CD1 4.3Å; F135-L146 HydrophobicContact CE1-CD1 4.36Å; T138-L146 HydrophobicContact CG2-CD1 3.85Å; D142-L146 WeakPolarHBondContact O-CB 3.31Å; D142-L146 WeakPolarHBondContact O-CG 3.48Å; D142-L146 PolarHBondContact O-N 3.25Å; L146-G149 PolarHBondContact O-N 2.8Å; L146-G149 VanDerWaalsContact O-N 3.16Å; L146-N152 PolarHBondContact O-ND2 2.73Å
147	L	91.4	Very high	88.4	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-69.2	-37.1	-179.1	-76	168.4	0	0	0	112.6	A143 E144 G149 N152 A156 L158 L174 V179 C225	A143-L147 VanDerWaalsContact O-CB 3.25Å; A143-L147 WeakPolarHBondContact O-CB 3.47Å; A143-L147 WeakPolarHBondContact O-CG 3.19Å; A143-L147 PolarHBondContact O-N 2.88Å; E144-L147 PolarHBondContact O-N 3.13Å; L147-G149 PolarHBondContact O-N 3.39Å; L147-N152 VanDerWaalsContact O-CB 3.26Å; L147-N152 WeakPolarHBondContact O-CB 3.48Å; L147-N152 PolarHBondContact O-ND2 2.98Å; L147-A156 HydrophobicContact CD2-CB 4.07Å; L147-A156 WeakPolarHBondContact CD2-O 3.48Å; L147-L158 HydrophobicContact CD1-CD2 4.25Å; L147-L158 HydrophobicContact CD1-CG 4.23Å; L147-L158 HydrophobicContact CG-CD2 4.05Å; L147-L158 HydrophobicContact CG-CG 4.46Å; L147-L174 HydrophobicContact CB-CB 4.41Å; L147-L174 WeakPolarHBondContact O-CD2 3.03Å; L147-V179 HydrophobicContact CB-CG2 3.74Å; L147-V179 HydrophobicContact CD1-CG1 3.6Å; L147-V179 HydrophobicContact CD1-CG2 4.09Å; L147-C225 HydrophobicContact CD2-CB 3.67Å; L147-C225 HydrophobicContact CG-CB 4.42Å
148	Q	89.9	Confident	89	Confident	105 Å²	105	47.5 Å²	47.5	49%	0.491	24%	0.239	S	C	.	.	H	α-helix	trans	-77	-6.6	174	-67.9	176.8	-38.1	0	0	113.2	E144 L174 G177 V179	E144-Q148 VanDerWaalsContact O-CB 3.25Å; E144-Q148 WeakPolarHBondContact O-CB 3.32Å; E144-Q148 VanDerWaalsContact O-CG 3.24Å; E144-Q148 WeakPolarHBondContact O-CG 3.31Å; E144-Q148 PolarHBondContact O-N 3.47Å; Q148-L174 HydrophobicContact CG-CD1 4.08Å; Q148-G177 PolarHBondContact NE2-O 3.23Å; Q148-V179 HydrophobicContact CG-CG2 4.01Å
149	G	84.1	Confident	89.4	Confident	17 Å²	17	46.4 Å²	46.4	18%	0.175	23%	0.232	C	C	.	.	S	Bend	trans	-61.6	156.5	176	0	0	0	0	0	112.9	K145 L146 L147 G151	K145-G149 PolarHBondContact O-N 3.26Å; L146-G149 PolarHBondContact O-N 2.8Å; L146-G149 VanDerWaalsContact O-N 3.16Å; L147-G149 PolarHBondContact O-N 3.39Å; G149-G151 PolarHBondContact O-N 3.45Å
150	E	79.6	Confident	89.8	Confident	186 Å²	186	42.4 Å²	42.4	87%	0.869	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	134.7	-177.5	-67.4	-170.7	164.7	0	0	112
151	G	84.9	Confident	90.2	Very high	32 Å²	32	44.4 Å²	44.4	33%	0.33	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	97.9	-13.6	175.7	0	0	0	0	0	115.5	G149 R226	G149-G151 PolarHBondContact O-N 3.45Å; G151-R226 PolarHBondContact O-NE 2.83Å; G151-R226 PolarHBondContact O-NH2 2.82Å
152	N	91.5	Very high	90.6	Very high	25 Å²	25	42.7 Å²	42.7	13%	0.134	22%	0.218	C	C	.	.			trans	-73.9	146.9	166.9	-67.7	-54.8	0	0	0	110.6	L146 L147 A156 L174 R226	L146-N152 PolarHBondContact O-ND2 2.73Å; L147-N152 VanDerWaalsContact O-CB 3.26Å; L147-N152 WeakPolarHBondContact O-CB 3.48Å; L147-N152 PolarHBondContact O-ND2 2.98Å; N152-A156 HydrophobicContact CB-CB 3.86Å; N152-L174 HydrophobicContact CB-CD2 4.28Å; N152-R226 PolarHBondContact OD1-N 2.84Å; N152-R226 VanDerWaalsContact OD1-N 3.08Å
153	Q	93.9	Very high	90.4	Very high	149 Å²	149	44.2 Å²	44.2	70%	0.696	22%	0.224	S	C	*	.			trans	-114	170	179.9	-64	-171.5	1.3	0	0	111	G155 A156	Q153-G155 PolarHBondContact O-N 2.86Å; Q153-A156 WeakPolarHBondContact O-CB 3.46Å; Q153-A156 PolarHBondContact O-N 3.38Å
154	E	95.3	Very high	89.7	Confident	94 Å²	94	47.6 Å²	47.6	44%	0.439	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.6	130.9	172.7	-172.4	69.9	-167.8	0	0	111	A156 H175 Q176 V219	E154-A156 VanDerWaalsContact C-N 3.31Å; E154-H175 WeakPolarHBondContact OE1-CA 3.35Å; E154-H175 IonicContact OE1-CE1 2.83Å; E154-H175 PolarHBondContact OE1-CE1 2.99Å; E154-H175 IonicContact OE1-CG 2.62Å; E154-H175 IonicContact OE1-ND1 2.79Å; E154-H175 PolarHBondContact OE1-ND1 2.85Å; E154-Q176 PolarHBondContact OE1-N 2.7Å; E154-Q176 VanDerWaalsContact OE1-N 3.14Å; E154-Q176 PolarHBondContact OE2-N 2.95Å; E154-V219 HydrophobicContact CG-CG2 4.29Å
155	G	95.6	Very high	89	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.01	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	-0.5	-175.4	0	0	0	0	0	114.9	Q153 F157 L174 L220 G222	Q153-G155 PolarHBondContact O-N 2.86Å; G155-F157 PolarHBondContact O-N 3.35Å; G155-L174 WeakPolarHBondContact CA-O 3.47Å; G155-L174 PolarHBondContact N-O 3.08Å; G155-L220 WeakPolarHBondContact CA-O 3.49Å; G155-G222 PolarHBondContact O-N 2.96Å
156	A	97.4	Very high	88.7	Confident	2 Å²	2	55.8 Å²	55.8	2%	0.017	29%	0.286	C	S	.	.			trans	-56.7	140.2	173.1	0	0	0	0	0	110.9	L147 N152 Q153 E154 V173 L174 E223	L147-A156 HydrophobicContact CD2-CB 4.07Å; L147-A156 WeakPolarHBondContact CD2-O 3.48Å; N152-A156 HydrophobicContact CB-CB 3.86Å; Q153-A156 WeakPolarHBondContact O-CB 3.46Å; Q153-A156 PolarHBondContact O-N 3.38Å; E154-A156 VanDerWaalsContact C-N 3.31Å; A156-V173 CarbonylContact O-C 3.58Å; A156-V173 WeakPolarHBondContact O-CA 3.48Å; A156-L174 HydrophobicContact CB-CB 4.32Å; A156-L174 PolarHBondContact O-N 3.31Å; A156-E223 VanDerWaalsContact CA-O 3.25Å; A156-E223 WeakPolarHBondContact CA-O 3.36Å
157	F	97.7	Very high	88.3	Confident	4 Å²	4	56.4 Å²	56.4	2%	0.018	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	161.2	-170	76.5	-77.2	0	0	0	114	W133 G155 L171 S172 V173 V207 L221 G222 E223 P224 C225	W133-F157 HydrophobicContact CB-CD2 4.28Å; W133-F157 HydrophobicContact CB-CE2 3.5Å; W133-F157 HydrophobicContact CB-CZ 3.73Å; W133-F157 HydrophobicContact CD2-CE2 4.36Å; W133-F157 AromaticContact CG-CE2 3.82Å; W133-F157 HydrophobicContact CG-CE2 3.82Å; W133-F157 HydrophobicContact CG-CZ 4Å; G155-F157 PolarHBondContact O-N 3.35Å; F157-L171 HydrophobicContact CB-CD1 4.25Å; F157-L171 HydrophobicContact CD2-CD1 3.76Å; F157-L171 HydrophobicContact CG-CD1 4.42Å; F157-S172 CarbonylContact C-O 3.54Å; F157-S172 WeakPolarHBondContact CA-O 3.32Å; F157-S172 WeakPolarHBondContact CB-O 3.49Å; F157-V173 HydrophobicContact CB-CG1 4.45Å; F157-V173 HydrophobicContact CB-CG2 4.18Å; F157-V207 HydrophobicContact CE2-CB 4.45Å; F157-V207 HydrophobicContact CE2-CG1 3.6Å; F157-V207 HydrophobicContact CE2-CG2 3.96Å; F157-V207 HydrophobicContact CZ-CG1 3.42Å; F157-V207 VanDerWaalsContact CZ-CG1 3.42Å; F157-L221 HydrophobicContact CB-CD2 3.83Å; F157-L221 HydrophobicContact CD1-CB 3.83Å; F157-L221 HydrophobicContact CD1-CD2 4.3Å; F157-L221 HydrophobicContact CD1-CG 4.47Å; F157-L221 HydrophobicContact CD2-CD1 4.06Å; F157-L221 HydrophobicContact CD2-CD2 4.27Å; F157-L221 HydrophobicContact CE1-CB 3.98Å; F157-L221 HydrophobicContact CE2-CD1 4.12Å; F157-L221 HydrophobicContact CG-CB 4.21Å; F157-L221 HydrophobicContact CG-CD1 4.34Å; F157-L221 HydrophobicContact CG-CD2 3.87Å; F157-L221 HydrophobicContact CG-CG 4.35Å; F157-L221 HydrophobicContact CZ-CB 4.45Å; F157-L221 HydrophobicContact CZ-CD1 4.46Å; F157-G222 VanDerWaalsContact CE1-O 3.28Å; F157-G222 WeakPolarHBondContact CE1-O 3.29Å; F157-E223 PolarHBondContact N-O 3.32Å; F157-P224 HydrophobicContact CE1-CG 4.42Å; F157-P224 HydrophobicContact CZ-CG 4.48Å; F157-P224 CarbonylContact O-C 3.49Å; F157-C225 WeakPolarHBondContact O-CB 3.28Å; F157-C225 PolarHBondContact O-N 2.67Å
158	L	96.6	Very high	88.1	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	155	168.2	61	85.1	0	0	0	111.2	W133 F135 A143 L147 R160 S172 C225	W133-L158 CarbonylContact O-C 3.59Å; W133-L158 WeakPolarHBondContact O-CA 3.26Å; F135-L158 HydrophobicContact CB-CD1 4.35Å; F135-L158 HydrophobicContact CD1-CD2 4.47Å; F135-L158 HydrophobicContact CD2-CB 3.55Å; F135-L158 HydrophobicContact CD2-CD2 4.41Å; F135-L158 HydrophobicContact CD2-CG 4.47Å; F135-L158 HydrophobicContact CE2-CB 3.91Å; F135-L158 HydrophobicContact CG-CB 4.15Å; F135-L158 HydrophobicContact CG-CD2 4.31Å; A143-L158 HydrophobicContact CB-CD1 3.83Å; A143-L158 HydrophobicContact CB-CD2 3.99Å; A143-L158 HydrophobicContact CB-CG 4.33Å; L147-L158 HydrophobicContact CD1-CD2 4.25Å; L147-L158 HydrophobicContact CD1-CG 4.23Å; L147-L158 HydrophobicContact CG-CD2 4.05Å; L147-L158 HydrophobicContact CG-CG 4.46Å; L158-R160 HydrophobicContact CD1-CB 4.04Å; L158-R160 HydrophobicContact CD1-CG 4.1Å; L158-S172 PolarHBondContact N-O 3.17Å; L158-S172 PolarHBondContact O-N 3.18Å; L158-C225 HydrophobicContact CB-CB 3.99Å; L158-C225 HydrophobicContact CD2-CB 3.87Å; L158-C225 HydrophobicContact CG-CB 4.43Å
159	V	96.1	Very high	88.2	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	134	169.6	-179.3	0	0	0	0	108.7	W133 Y134 F135 Y169 S170 L171 L184 V207	W133-V159 HydrophobicContact CE3-CB 3.59Å; W133-V159 HydrophobicContact CE3-CG2 3.43Å; W133-V159 VanDerWaalsContact CE3-CG2 3.43Å; W133-V159 HydrophobicContact CZ3-CB 3.62Å; W133-V159 HydrophobicContact CZ3-CG1 4.13Å; W133-V159 HydrophobicContact CZ3-CG2 3.56Å; W133-V159 PolarHBondContact O-N 3.32Å; Y134-V159 WeakPolarHBondContact CA-O 3.29Å; Y134-V159 HydrophobicContact CD2-CB 4.31Å; Y134-V159 HydrophobicContact CD2-CG1 4.24Å; Y134-V159 WeakPolarHBondContact CD2-O 3.29Å; F135-V159 PolarHBondContact N-O 2.75Å; V159-Y169 HydrophobicContact CG1-CD1 4.46Å; V159-S170 WeakPolarHBondContact CA-O 3.49Å; V159-L171 HydrophobicContact CG2-CD1 4Å; V159-L184 HydrophobicContact CG1-CD1 3.9Å; V159-L184 HydrophobicContact CG2-CD1 4.4Å; V159-V207 HydrophobicContact CG2-CG2 4.35Å
160	R	94.4	Very high	88.7	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	163.7	-176	60.9	-172.9	-177.9	83.9	-2.4	111	F135 T138 R140 L158 E163 Y169 S170 S172	F135-R160 WeakPolarHBondContact O-CA 3.2Å; F135-R160 WeakPolarHBondContact O-CB 3.34Å; T138-R160 VanDerWaalsContact O-CD 3.29Å; T138-R160 WeakPolarHBondContact O-CD 3.36Å; R140-R160 VanDerWaalsContact CB-NH2 3.31Å; L158-R160 HydrophobicContact CD1-CB 4.04Å; L158-R160 HydrophobicContact CD1-CG 4.1Å; R160-E163 IonicContact CZ-OE1 3.45Å; R160-E163 IonicContact NH1-OE1 3.57Å; R160-E163 PolarHBondContact NH1-OE1 3.46Å; R160-E163 IonicContact NH2-OE1 3.65Å; R160-Y169 CarbonylContact O-C 3.52Å; R160-Y169 WeakPolarHBondContact O-CA 3.33Å; R160-S170 PolarHBondContact N-O 2.98Å; R160-S170 PolarHBondContact O-N 3.39Å; R160-S172 PolarHBondContact NE-OG 3.35Å; R160-S172 VanDerWaalsContact NE-OG 3.16Å
161	N	91.8	Very high	89.5	Confident	57 Å²	57	45.5 Å²	45.5	31%	0.305	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	143.5	170.4	-70	-41.5	0	0	0	110.5	Y134 P136 E163 Y169	Y134-N161 PolarHBondContact OH-OD1 2.9Å; P136-N161 WeakPolarHBondContact O-CB 3.31Å; P136-N161 PolarHBondContact O-ND2 2.86Å; N161-E163 PolarHBondContact O-N 3.28Å; N161-Y169 WeakPolarHBondContact OD1-CE1 3.09Å
162	S	86.8	Confident	90	Very high	10 Å²	10	44 Å²	44	7%	0.07	23%	0.228	C	C	.	.			trans	-73.7	124.4	174.9	176.5	0	0	0	0	110.3	S164 L165 E168	S162-S164 VanDerWaalsContact C-N 3.31Å; S162-S164 PolarHBondContact OG-N 3.45Å; S162-S164 PolarHBondContact OG-OG 2.86Å; S162-S164 VanDerWaalsContact OG-OG 3.04Å; S162-L165 WeakPolarHBondContact CB-O 3.25Å; S162-L165 PolarHBondContact OG-N 3.23Å; S162-E168 VanDerWaalsContact CB-O 3.24Å; S162-E168 WeakPolarHBondContact CB-O 3.33Å; S162-E168 PolarHBondContact N-O 2.96Å
163	E	79.9	Confident	90.3	Very high	88 Å²	88	42.8 Å²	42.8	41%	0.411	22%	0.221	S	C	.	.	S	Bend	trans	-67.3	-35.3	174	-72.1	159.1	-93.7	0	0	111.7	R140 R160 N161	R140-E163 WeakPolarHBondContact CA-OE1 3.25Å; R140-E163 VanDerWaalsContact CB-OE1 3.26Å; R140-E163 WeakPolarHBondContact CB-OE1 3.24Å; R140-E163 PolarHBondContact N-OE1 3.26Å; R160-E163 IonicContact CZ-OE1 3.45Å; R160-E163 IonicContact NH1-OE1 3.57Å; R160-E163 PolarHBondContact NH1-OE1 3.46Å; R160-E163 IonicContact NH2-OE1 3.65Å; N161-E163 PolarHBondContact O-N 3.28Å
164	S	74.4	Confident	90.4	Very high	70 Å²	70	36.3 Å²	36.3	49%	0.49	19%	0.192	S	C	.	.	S	Bend	trans	-77.2	-26.5	-175.7	63.3	0	0	0	0	114	S162	S162-S164 VanDerWaalsContact C-N 3.31Å; S162-S164 PolarHBondContact OG-N 3.45Å; S162-S164 PolarHBondContact OG-OG 2.86Å; S162-S164 VanDerWaalsContact OG-OG 3.04Å
165	L	75.5	Confident	90.3	Very high	79 Å²	79	33.6 Å²	33.6	41%	0.414	18%	0.179	S	C	.	.	S	Bend	trans	-145.3	111.7	-171.8	-88.9	142.5	0	0	0	110.8	S162 G167 E168	S162-L165 WeakPolarHBondContact CB-O 3.25Å; S162-L165 PolarHBondContact OG-N 3.23Å; L165-G167 PolarHBondContact O-N 2.81Å; L165-E168 HydrophobicContact CB-CB 4.07Å; L165-E168 HydrophobicContact CB-CG 3.9Å; L165-E168 PolarHBondContact O-N 3.11Å
166	K	77.2	Confident	90.1	Very high	217 Å²	217	40.9 Å²	40.9	94%	0.943	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	126.4	178.1	-171	175	-177.2	176	0	111.1
167	G	79.8	Confident	89.5	Confident	48 Å²	48	43.1 Å²	43.1	50%	0.495	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.7	-2	178.3	0	0	0	0	0	115.3	L165	L165-G167 PolarHBondContact O-N 2.81Å
168	E	87.3	Confident	89.1	Confident	43 Å²	43	51.8 Å²	51.8	20%	0.201	27%	0.269	C	S	.	.			trans	-98.2	164.4	169.2	-63.8	-69.7	-178.7	0	0	110.6	S162 L165 L184	S162-E168 VanDerWaalsContact CB-O 3.24Å; S162-E168 WeakPolarHBondContact CB-O 3.33Å; S162-E168 PolarHBondContact N-O 2.96Å; L165-E168 HydrophobicContact CB-CB 4.07Å; L165-E168 HydrophobicContact CB-CG 3.9Å; L165-E168 PolarHBondContact O-N 3.11Å; E168-L184 VanDerWaalsContact OE2-O 3.11Å
169	Y	93.3	Very high	88.9	Confident	36 Å²	36	52.7 Å²	52.7	14%	0.141	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	162.4	-178.2	-57.5	-83.4	0	0	0	111.9	Y134 V159 R160 N161 L184 Y192 L203	Y134-Y169 HydrophobicContact CE2-CD1 4Å; Y134-Y169 AromaticContact CE2-CE1 3.84Å; Y134-Y169 HydrophobicContact CE2-CE1 3.84Å; V159-Y169 HydrophobicContact CG1-CD1 4.46Å; R160-Y169 CarbonylContact O-C 3.52Å; R160-Y169 WeakPolarHBondContact O-CA 3.33Å; N161-Y169 WeakPolarHBondContact OD1-CE1 3.09Å; Y169-L184 PolarHBondContact O-N 3.22Å; Y169-Y192 HydrophobicContact CD2-CD1 4.45Å; Y169-Y192 AromaticContact CD2-CE1 3.74Å; Y169-Y192 HydrophobicContact CD2-CE1 3.74Å; Y169-Y192 AromaticContact CE2-CE1 3.74Å; Y169-Y192 HydrophobicContact CE2-CE1 3.74Å; Y169-L203 HydrophobicContact CD1-CD1 4.31Å; Y169-L203 HydrophobicContact CD2-CD1 3.73Å; Y169-L203 HydrophobicContact CE1-CD1 4.4Å; Y169-L203 HydrophobicContact CE2-CD1 3.81Å; Y169-L203 HydrophobicContact CG-CD1 3.97Å
170	S	94.4	Very high	88.7	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	135.6	172.7	-65.9	0	0	0	0	110.2	V159 R160 Y182	V159-S170 WeakPolarHBondContact CA-O 3.49Å; R160-S170 PolarHBondContact N-O 2.98Å; R160-S170 PolarHBondContact O-N 3.39Å; S170-Y182 CarbonylContact C-O 3.56Å; S170-Y182 WeakPolarHBondContact CA-O 3.16Å
171	L	95.5	Very high	88.6	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	124.8	171.4	170.2	66	0	0	0	108.4	F157 V159 V173 H181 Y182 L184 L217 L221	F157-L171 HydrophobicContact CB-CD1 4.25Å; F157-L171 HydrophobicContact CD2-CD1 3.76Å; F157-L171 HydrophobicContact CG-CD1 4.42Å; V159-L171 HydrophobicContact CG2-CD1 4Å; L171-V173 HydrophobicContact CD1-CG2 4.06Å; L171-V173 HydrophobicContact CD2-CG2 4.17Å; L171-V173 HydrophobicContact CG-CG2 3.78Å; L171-H181 WeakPolarHBondContact O-CA 3.31Å; L171-Y182 HydrophobicContact CD2-CD2 4.44Å; L171-Y182 PolarHBondContact N-O 2.63Å; L171-Y182 PolarHBondContact O-N 2.73Å; L171-L184 HydrophobicContact CB-CD1 4.19Å; L171-L184 HydrophobicContact CB-CD2 3.9Å; L171-L184 HydrophobicContact CB-CG 4.12Å; L171-L217 HydrophobicContact CD2-CD1 4.14Å; L171-L217 HydrophobicContact CD2-CD2 4.32Å; L171-L221 HydrophobicContact CD1-CD1 4.35Å; L171-L221 HydrophobicContact CD1-CD2 4.22Å; L171-L221 HydrophobicContact CD2-CD1 4.4Å; L171-L221 HydrophobicContact CD2-CD2 4.29Å
172	S	96.4	Very high	88.5	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	128.6	177.2	-49.7	0	0	0	0	109.1	F157 L158 R160 K180 H181	F157-S172 CarbonylContact C-O 3.54Å; F157-S172 WeakPolarHBondContact CA-O 3.32Å; F157-S172 WeakPolarHBondContact CB-O 3.49Å; L158-S172 PolarHBondContact N-O 3.17Å; L158-S172 PolarHBondContact O-N 3.18Å; R160-S172 PolarHBondContact NE-OG 3.35Å; R160-S172 VanDerWaalsContact NE-OG 3.16Å; S172-K180 CarbonylContact C-O 3.57Å; S172-K180 WeakPolarHBondContact CA-O 3.45Å; S172-H181 WeakPolarHBondContact CB-ND1 3.35Å; S172-H181 PolarHBondContact OG-ND1 3.44Å
173	V	96.5	Very high	88.7	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	130.9	-171.1	-169.7	0	0	0	0	110.5	A156 F157 L171 V179 K180 Y182 V219 L221	A156-V173 CarbonylContact O-C 3.58Å; A156-V173 WeakPolarHBondContact O-CA 3.48Å; F157-V173 HydrophobicContact CB-CG1 4.45Å; F157-V173 HydrophobicContact CB-CG2 4.18Å; L171-V173 HydrophobicContact CD1-CG2 4.06Å; L171-V173 HydrophobicContact CD2-CG2 4.17Å; L171-V173 HydrophobicContact CG-CG2 3.78Å; V173-V179 CarbonylContact O-C 3.5Å; V173-V179 WeakPolarHBondContact O-CA 3.42Å; V173-K180 PolarHBondContact N-O 2.84Å; V173-K180 PolarHBondContact O-N 3.12Å; V173-Y182 HydrophobicContact CG2-CD2 4.24Å; V173-Y182 HydrophobicContact CG2-CE2 4.2Å; V173-V219 HydrophobicContact CG1-CG1 3.62Å; V173-L221 HydrophobicContact CG1-CD2 4.05Å; V173-L221 HydrophobicContact CG2-CD2 3.61Å
174	L	96.3	Very high	89.2	Confident	14 Å²	14	50.5 Å²	50.5	7%	0.073	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	120.6	174	-174.9	69	0	0	0	110.4	L147 Q148 N152 G155 A156 V179	L147-L174 HydrophobicContact CB-CB 4.41Å; L147-L174 WeakPolarHBondContact O-CD2 3.03Å; Q148-L174 HydrophobicContact CG-CD1 4.08Å; N152-L174 HydrophobicContact CB-CD2 4.28Å; G155-L174 WeakPolarHBondContact CA-O 3.47Å; G155-L174 PolarHBondContact N-O 3.08Å; A156-L174 HydrophobicContact CB-CB 4.32Å; A156-L174 PolarHBondContact O-N 3.31Å; L174-V179 HydrophobicContact CD1-CG2 3.96Å
175	H	94.3	Very high	89.7	Confident	37 Å²	37	50.4 Å²	50.4	17%	0.171	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	119.8	176.5	-176.7	57.4	0	0	0	110.4	E154 G177 R178 K180 C218 V219	E154-H175 WeakPolarHBondContact OE1-CA 3.35Å; E154-H175 IonicContact OE1-CE1 2.83Å; E154-H175 PolarHBondContact OE1-CE1 2.99Å; E154-H175 IonicContact OE1-CG 2.62Å; E154-H175 IonicContact OE1-ND1 2.79Å; E154-H175 PolarHBondContact OE1-ND1 2.85Å; H175-G177 VanDerWaalsContact C-N 3.27Å; H175-G177 PolarHBondContact O-N 3.16Å; H175-R178 CarbonylContact C-O 3.57Å; H175-R178 PolarHBondContact N-O 3.41Å; H175-R178 PolarHBondContact O-N 3.16Å; H175-K180 HydrophobicContact CB-CG 4.46Å; H175-C218 HydrophobicContact CB-CB 4.37Å; H175-C218 PolarHBondContact CE1-O 2.74Å; H175-V219 HydrophobicContact CB-CG1 4.14Å
176	Q	90.7	Very high	90.3	Very high	153 Å²	153	50.5 Å²	50.5	72%	0.715	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.6	41.7	176.9	-58.9	-180	-3.8	0	0	113.6	E154 R178	E154-Q176 PolarHBondContact OE1-N 2.7Å; E154-Q176 VanDerWaalsContact OE1-N 3.14Å; E154-Q176 PolarHBondContact OE2-N 2.95Å; Q176-R178 PolarHBondContact O-N 3.26Å
177	G	85.6	Confident	90.9	Very high	49 Å²	49	43 Å²	43	51%	0.505	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	5.5	179.5	0	0	0	0	0	115	Q148 H175	Q148-G177 PolarHBondContact NE2-O 3.23Å; H175-G177 VanDerWaalsContact C-N 3.27Å; H175-G177 PolarHBondContact O-N 3.16Å
178	R	89.2	Confident	91.2	Very high	187 Å²	187	49.2 Å²	49.2	71%	0.706	24%	0.24	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-119.2	153.9	173.2	-64.1	-175.4	179.8	-171.6	-0.1	110	H175 Q176	H175-R178 CarbonylContact C-O 3.57Å; H175-R178 PolarHBondContact N-O 3.41Å; H175-R178 PolarHBondContact O-N 3.16Å; Q176-R178 PolarHBondContact O-N 3.26Å
179	V	92	Very high	91.3	Very high	18 Å²	18	51.8 Å²	51.8	11%	0.109	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	133.2	176.1	179.7	0	0	0	0	109.5	E144 L147 Q148 V173 L174 H181	E144-V179 HydrophobicContact CB-CG2 4.48Å; E144-V179 HydrophobicContact CG-CB 4.03Å; E144-V179 HydrophobicContact CG-CG1 4.32Å; L147-V179 HydrophobicContact CB-CG2 3.74Å; L147-V179 HydrophobicContact CD1-CG1 3.6Å; L147-V179 HydrophobicContact CD1-CG2 4.09Å; Q148-V179 HydrophobicContact CG-CG2 4.01Å; V173-V179 CarbonylContact O-C 3.5Å; V173-V179 WeakPolarHBondContact O-CA 3.42Å; L174-V179 HydrophobicContact CD1-CG2 3.96Å; V179-H181 VanDerWaalsContact CG1-CE1 3.5Å; V179-H181 WeakPolarHBondContact CG1-CE1 3.28Å
180	K	91.8	Very high	91.1	Very high	48 Å²	48	51.8 Å²	51.8	21%	0.209	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	137.3	178.6	-68.5	-69.3	-174.2	-179.1	0	109	S172 V173 H175 Y182 C218 D516	S172-K180 CarbonylContact C-O 3.57Å; S172-K180 WeakPolarHBondContact CA-O 3.45Å; V173-K180 PolarHBondContact N-O 2.84Å; V173-K180 PolarHBondContact O-N 3.12Å; H175-K180 HydrophobicContact CB-CG 4.46Å; K180-Y182 HydrophobicContact CB-CE2 3.95Å; K180-C218 HydrophobicContact CG-CB 4.31Å; K180-D516 VanDerWaalsContact CD-CG 3.46Å; K180-D516 WeakPolarHBondContact CD-OD2 3.44Å; K180-D516 IonicContact NZ-OD1 3.84Å; K180-D516 PolarHBondContact NZ-OD1 3.05Å; K180-D516 IonicContact NZ-OD2 2.7Å
181	H	91.6	Very high	91	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	122.6	-175.2	-56.7	-85.9	0	0	0	111.1	R140 E144 L171 S172 V179 Y515 D516	R140-H181 PolarHBondContact NE-CD2 3.29Å; R140-H181 PolarHBondContact NE-NE2 3.13Å; R140-H181 PolarHBondContact NH2-CD2 2.85Å; E144-H181 IonicContact OE1-NE2 3.52Å; E144-H181 PolarHBondContact OE1-NE2 2.67Å; L171-H181 WeakPolarHBondContact O-CA 3.31Å; S172-H181 WeakPolarHBondContact CB-ND1 3.35Å; S172-H181 PolarHBondContact OG-ND1 3.44Å; V179-H181 VanDerWaalsContact CG1-CE1 3.5Å; V179-H181 WeakPolarHBondContact CG1-CE1 3.28Å; H181-Y515 HydrophobicContact CB-CD1 4.32Å; H181-Y515 HydrophobicContact CB-CE1 4.47Å; H181-D516 PolarHBondContact O-N 2.91Å
182	Y	91.2	Very high	90.9	Very high	2 Å²	2	56.1 Å²	56.1	1%	0.008	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	132.7	178.7	-59.2	-85.7	0	0	0	109.7	S170 L171 V173 K180 V194 L217 C218 D516	S170-Y182 CarbonylContact C-O 3.56Å; S170-Y182 WeakPolarHBondContact CA-O 3.16Å; L171-Y182 HydrophobicContact CD2-CD2 4.44Å; L171-Y182 PolarHBondContact N-O 2.63Å; L171-Y182 PolarHBondContact O-N 2.73Å; V173-Y182 HydrophobicContact CG2-CD2 4.24Å; V173-Y182 HydrophobicContact CG2-CE2 4.2Å; K180-Y182 HydrophobicContact CB-CE2 3.95Å; Y182-V194 HydrophobicContact CD1-CG1 3.92Å; Y182-V194 HydrophobicContact CG-CG1 4.24Å; Y182-L217 HydrophobicContact CD1-CD2 3.82Å; Y182-L217 HydrophobicContact CD2-CD2 3.78Å; Y182-L217 HydrophobicContact CE1-CD2 3.78Å; Y182-L217 HydrophobicContact CE2-CD2 3.76Å; Y182-L217 HydrophobicContact CG-CD2 3.82Å; Y182-C218 VanDerWaalsContact OH-CB 3.3Å; Y182-C218 WeakPolarHBondContact OH-CB 3.37Å; Y182-C218 PolarHBondContact OH-N 3.05Å; Y182-C218 PolarHBondContact OH-SG 3.35Å; Y182-D516 HydrophobicContact CE1-CB 4.35Å
183	K	89.7	Confident	90.6	Very high	59 Å²	59	56.8 Å²	56.8	26%	0.257	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	127.7	174.1	-168.9	174.8	-177.3	176.7	0	109.4	Q185 Y515	K183-Q185 HydrophobicContact CD-CG 4.24Å; K183-Q185 HydrophobicContact CG-CG 4.06Å; K183-Y515 HydrophobicContact CB-CD1 4.37Å
184	L	90.5	Very high	90.2	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	115.7	172.8	-55	-174.9	0	0	0	107.6	V159 E168 Y169 L171 V194 L203 L206	V159-L184 HydrophobicContact CG1-CD1 3.9Å; V159-L184 HydrophobicContact CG2-CD1 4.4Å; E168-L184 VanDerWaalsContact OE2-O 3.11Å; Y169-L184 PolarHBondContact O-N 3.22Å; L171-L184 HydrophobicContact CB-CD1 4.19Å; L171-L184 HydrophobicContact CB-CD2 3.9Å; L171-L184 HydrophobicContact CB-CG 4.12Å; L184-V194 HydrophobicContact CD2-CG2 3.46Å; L184-V194 VanDerWaalsContact CD2-CG2 3.46Å; L184-L203 HydrophobicContact CD1-CD2 3.51Å; L184-L206 HydrophobicContact CD2-CD1 4.12Å; L184-L206 HydrophobicContact CD2-CD2 4.34Å
185	Q	85.8	Confident	89.5	Confident	69 Å²	69	58.1 Å²	58.1	32%	0.322	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	154.1	-177.8	-60.2	-168.6	-87	0	0	110.7	K183 Y192 Y193	K183-Q185 HydrophobicContact CD-CG 4.24Å; K183-Q185 HydrophobicContact CG-CG 4.06Å; Q185-Y192 CarbonylContact O-C 3.53Å; Q185-Y192 WeakPolarHBondContact O-CA 3.16Å; Q185-Y193 HydrophobicContact CB-CD1 4.25Å; Q185-Y193 HydrophobicContact CB-CD2 4.49Å; Q185-Y193 HydrophobicContact CB-CE1 3.66Å; Q185-Y193 HydrophobicContact CB-CE2 3.93Å; Q185-Y193 VanDerWaalsContact CB-CZ 3.5Å; Q185-Y193 PolarHBondContact N-O 3.15Å; Q185-Y193 WeakPolarHBondContact O-CD1 3.16Å; Q185-Y193 PolarHBondContact O-N 3.4Å
186	K	88.5	Confident	88.7	Confident	80 Å²	80	64.1 Å²	64.1	35%	0.348	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	139.8	171.3	-70.8	175.5	179.4	171.6	0	111.7	H191 Y192	K186-H191 CarbonylContact C-O 3.49Å; K186-H191 WeakPolarHBondContact CA-O 3.13Å; K186-Y192 HydrophobicContact CD-CE1 4.12Å; K186-Y192 WeakPolarHBondContact CE-OH 3.32Å; K186-Y192 HydrophobicContact CG-CD1 3.95Å; K186-Y192 HydrophobicContact CG-CE1 3.85Å; K186-Y192 PolarHBondContact NZ-OH 2.97Å
187	L	87.9	Confident	88.2	Confident	59 Å²	59	62.8 Å²	62.8	31%	0.309	33%	0.325	S	S	.	.			trans	-80.7	166.7	163.2	-68.7	176.3	0	0	0	110.1	N189 G190 H191 Y193 S199	L187-N189 WeakPolarHBondContact CB-OD1 3.37Å; L187-N189 PolarHBondContact O-N 2.98Å; L187-N189 VanDerWaalsContact O-N 3.13Å; L187-G190 WeakPolarHBondContact O-CA 3.42Å; L187-G190 PolarHBondContact O-N 2.61Å; L187-H191 HydrophobicContact CD1-CB 4.43Å; L187-H191 PolarHBondContact N-O 3.1Å; L187-Y193 HydrophobicContact CB-CE1 4.5Å; L187-Y193 HydrophobicContact CD1-CD1 4.41Å; L187-Y193 HydrophobicContact CD2-CD1 3.88Å; L187-Y193 HydrophobicContact CD2-CE1 3.44Å; L187-Y193 VanDerWaalsContact CD2-CE1 3.44Å; L187-Y193 HydrophobicContact CG-CD1 3.61Å; L187-Y193 HydrophobicContact CG-CE1 3.61Å; L187-S199 WeakPolarHBondContact CD1-OG 3.13Å
188	D	88.1	Confident	88.3	Confident	180 Å²	180	63.9 Å²	63.9	96%	0.963	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-26	177.9	-60.3	-26.6	0	0	0	113	G190	D188-G190 PolarHBondContact O-N 3.38Å
189	N	88.9	Confident	88.5	Confident	96 Å²	96	57 Å²	57	51%	0.513	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	3.7	175.1	71.4	-7.9	0	0	0	113.7	L187 H191	L187-N189 WeakPolarHBondContact CB-OD1 3.37Å; L187-N189 PolarHBondContact O-N 2.98Å; L187-N189 VanDerWaalsContact O-N 3.13Å; N189-H191 VanDerWaalsContact C-N 3.34Å; N189-H191 PolarHBondContact O-N 2.89Å; N189-H191 VanDerWaalsContact OD1-CB 3.29Å; N189-H191 WeakPolarHBondContact OD1-CB 3.48Å; N189-H191 PolarHBondContact OD1-N 3.03Å
190	G	88.4	Confident	88.6	Confident	37 Å²	37	56.9 Å²	56.9	38%	0.381	30%	0.295	S	S	.	.	S	Bend	trans	84.2	-3.4	-179.9	0	0	0	0	0	115.4	L187 D188	L187-G190 WeakPolarHBondContact O-CA 3.42Å; L187-G190 PolarHBondContact O-N 2.61Å; D188-G190 PolarHBondContact O-N 3.38Å
191	H	93.3	Very high	88.8	Confident	57 Å²	57	57.6 Å²	57.6	26%	0.264	30%	0.304	S	S	.	.			trans	-72.9	142	179.9	-68.4	-160.6	0	0	0	111.7	K186 L187 N189 F200	K186-H191 CarbonylContact C-O 3.49Å; K186-H191 WeakPolarHBondContact CA-O 3.13Å; L187-H191 HydrophobicContact CD1-CB 4.43Å; L187-H191 PolarHBondContact N-O 3.1Å; N189-H191 VanDerWaalsContact C-N 3.34Å; N189-H191 PolarHBondContact O-N 2.89Å; N189-H191 VanDerWaalsContact OD1-CB 3.29Å; N189-H191 WeakPolarHBondContact OD1-CB 3.48Å; N189-H191 PolarHBondContact OD1-N 3.03Å; H191-F200 CarbonylContact C-O 3.54Å; H191-F200 WeakPolarHBondContact CA-O 3.49Å; H191-F200 WeakPolarHBondContact CB-O 3.3Å
192	Y	92.3	Very high	88.8	Confident	33 Å²	33	60.3 Å²	60.3	13%	0.129	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	144	176.8	-62.2	-87.1	0	0	0	111.8	Y169 Q185 K186 S199 F200 L203	Y169-Y192 HydrophobicContact CD2-CD1 4.45Å; Y169-Y192 AromaticContact CD2-CE1 3.74Å; Y169-Y192 HydrophobicContact CD2-CE1 3.74Å; Y169-Y192 AromaticContact CE2-CE1 3.74Å; Y169-Y192 HydrophobicContact CE2-CE1 3.74Å; Q185-Y192 CarbonylContact O-C 3.53Å; Q185-Y192 WeakPolarHBondContact O-CA 3.16Å; K186-Y192 HydrophobicContact CD-CE1 4.12Å; K186-Y192 WeakPolarHBondContact CE-OH 3.32Å; K186-Y192 HydrophobicContact CG-CD1 3.95Å; K186-Y192 HydrophobicContact CG-CE1 3.85Å; K186-Y192 PolarHBondContact NZ-OH 2.97Å; Y192-S199 CarbonylContact O-C 3.59Å; Y192-S199 VanDerWaalsContact O-CA 3.26Å; Y192-S199 WeakPolarHBondContact O-CA 3.01Å; Y192-F200 PolarHBondContact N-O 3.03Å; Y192-F200 PolarHBondContact O-N 3.1Å; Y192-L203 HydrophobicContact CD1-CD1 4.44Å; Y192-L203 HydrophobicContact CD1-CD2 3.55Å; Y192-L203 HydrophobicContact CD1-CG 3.86Å; Y192-L203 HydrophobicContact CD2-CD2 4.29Å; Y192-L203 HydrophobicContact CD2-CG 4.04Å; Y192-L203 HydrophobicContact CE1-CD1 4.04Å; Y192-L203 HydrophobicContact CE1-CD2 4Å; Y192-L203 HydrophobicContact CE1-CG 3.85Å; Y192-L203 HydrophobicContact CE2-CG 4.07Å; Y192-L203 HydrophobicContact CG-CD2 3.7Å; Y192-L203 HydrophobicContact CG-CG 3.94Å
193	Y	90.4	Very high	88.9	Confident	14 Å²	14	60.6 Å²	60.6	6%	0.055	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	155.6	172.8	67.1	-83.9	0	0	0	112.2	Q185 L187 S195 K196 K198	Q185-Y193 HydrophobicContact CB-CD1 4.25Å; Q185-Y193 HydrophobicContact CB-CD2 4.49Å; Q185-Y193 HydrophobicContact CB-CE1 3.66Å; Q185-Y193 HydrophobicContact CB-CE2 3.93Å; Q185-Y193 VanDerWaalsContact CB-CZ 3.5Å; Q185-Y193 PolarHBondContact N-O 3.15Å; Q185-Y193 WeakPolarHBondContact O-CD1 3.16Å; Q185-Y193 PolarHBondContact O-N 3.4Å; L187-Y193 HydrophobicContact CB-CE1 4.5Å; L187-Y193 HydrophobicContact CD1-CD1 4.41Å; L187-Y193 HydrophobicContact CD2-CD1 3.88Å; L187-Y193 HydrophobicContact CD2-CE1 3.44Å; L187-Y193 VanDerWaalsContact CD2-CE1 3.44Å; L187-Y193 HydrophobicContact CG-CD1 3.61Å; L187-Y193 HydrophobicContact CG-CE1 3.61Å; Y193-S195 VanDerWaalsContact CD2-C 3.48Å; Y193-K196 HydrophobicContact CD2-CG 4.05Å; Y193-K196 HydrophobicContact CE2-CB 4.4Å; Y193-K196 HydrophobicContact CE2-CG 3.42Å; Y193-K196 VanDerWaalsContact CE2-CG 3.42Å; Y193-K198 WeakPolarHBondContact CB-O 3.35Å
194	V	87.1	Confident	89.1	Confident	15 Å²	15	62.3 Å²	62.3	9%	0.091	33%	0.33	C	S	.	.	S	Bend	trans	-95.8	-49.7	165.1	178.2	0	0	0	0	109.1	Y182 L184 L206 Y210 L217	Y182-V194 HydrophobicContact CD1-CG1 3.92Å; Y182-V194 HydrophobicContact CG-CG1 4.24Å; L184-V194 HydrophobicContact CD2-CG2 3.46Å; L184-V194 VanDerWaalsContact CD2-CG2 3.46Å; V194-L206 HydrophobicContact CG2-CD1 4.49Å; V194-Y210 HydrophobicContact CB-CE2 4.35Å; V194-Y210 HydrophobicContact CG2-CE2 3.8Å; V194-L217 HydrophobicContact CG1-CD2 4.08Å; V194-L217 HydrophobicContact CG2-CD2 4.48Å
195	S	81.9	Confident	89.3	Confident	27 Å²	27	66.2 Å²	66.2	19%	0.189	35%	0.348	C	S	.	.	S	Bend	trans	-113.8	141.2	172.4	-179.2	0	0	0	0	110.3	Y193 T197 K198 S518	Y193-S195 VanDerWaalsContact CD2-C 3.48Å; S195-T197 PolarHBondContact O-N 2.87Å; S195-T197 PolarHBondContact OG-OG1 3.47Å; S195-K198 PolarHBondContact O-N 3.27Å; S195-K198 VanDerWaalsContact O-N 3.12Å; S195-S518 WeakPolarHBondContact CB-OG 3.29Å
196	K	77	Confident	89.8	Confident	163 Å²	163	62.9 Å²	62.9	71%	0.709	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-12.2	-179.1	-70.1	-175.7	179	-178.9	0	113.8	Y193 K198	Y193-K196 HydrophobicContact CD2-CG 4.05Å; Y193-K196 HydrophobicContact CE2-CB 4.4Å; Y193-K196 HydrophobicContact CE2-CG 3.42Å; Y193-K196 VanDerWaalsContact CE2-CG 3.42Å; K196-K198 VanDerWaalsContact C-N 3.26Å; K196-K198 PolarHBondContact O-N 3.42Å
197	T	81.8	Confident	90.1	Very high	125 Å²	125	59.5 Å²	59.5	77%	0.767	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-24.8	176.4	55	0	0	0	0	112.8	S195	S195-T197 PolarHBondContact O-N 2.87Å; S195-T197 PolarHBondContact OG-OG1 3.47Å
198	K	87.9	Confident	90.5	Very high	73 Å²	73	60.5 Å²	60.5	32%	0.317	32%	0.322	S	S	.	.			trans	-146.8	127.5	-176.1	-161.6	164.2	-172	143.4	0	112.4	Y193 S195 K196 F200 Y209	Y193-K198 WeakPolarHBondContact CB-O 3.35Å; S195-K198 PolarHBondContact O-N 3.27Å; S195-K198 VanDerWaalsContact O-N 3.12Å; K196-K198 VanDerWaalsContact C-N 3.26Å; K196-K198 PolarHBondContact O-N 3.42Å; K198-F200 HydrophobicContact CB-CZ 4.49Å; K198-F200 HydrophobicContact CD-CE1 4.43Å; K198-F200 HydrophobicContact CD-CZ 3.86Å; K198-F200 HydrophobicContact CG-CE1 4.27Å; K198-F200 HydrophobicContact CG-CE2 4.15Å; K198-F200 HydrophobicContact CG-CZ 3.68Å; K198-Y209 HydrophobicContact CD-CD1 4.28Å; K198-Y209 HydrophobicContact CD-CE1 3.65Å; K198-Y209 HydrophobicContact CD-CE2 4.11Å; K198-Y209 PolarHBondContact NZ-OH 3.08Å
199	S	93	Very high	90.8	Very high	43 Å²	43	54 Å²	54	30%	0.301	28%	0.284	S	S	.	.			trans	-129.1	154.9	-179.2	69.1	0	0	0	0	112.5	L187 Y192	L187-S199 WeakPolarHBondContact CD1-OG 3.13Å; Y192-S199 CarbonylContact O-C 3.59Å; Y192-S199 VanDerWaalsContact O-CA 3.26Å; Y192-S199 WeakPolarHBondContact O-CA 3.01Å
200	F	94.8	Very high	91.1	Very high	15 Å²	15	49.6 Å²	49.6	7%	0.066	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-132.3	135	-170.1	-54.7	-84.1	0	0	0	110.6	H191 Y192 K198 T202 E205 L206 Y209 Y210	H191-F200 CarbonylContact C-O 3.54Å; H191-F200 WeakPolarHBondContact CA-O 3.49Å; H191-F200 WeakPolarHBondContact CB-O 3.3Å; Y192-F200 PolarHBondContact N-O 3.03Å; Y192-F200 PolarHBondContact O-N 3.1Å; K198-F200 HydrophobicContact CB-CZ 4.49Å; K198-F200 HydrophobicContact CD-CE1 4.43Å; K198-F200 HydrophobicContact CD-CZ 3.86Å; K198-F200 HydrophobicContact CG-CE1 4.27Å; K198-F200 HydrophobicContact CG-CE2 4.15Å; K198-F200 HydrophobicContact CG-CZ 3.68Å; F200-T202 VanDerWaalsContact C-N 3.26Å; F200-T202 PolarHBondContact O-N 2.92Å; F200-E205 HydrophobicContact CB-CB 4.31Å; F200-E205 HydrophobicContact CD1-CB 4.45Å; F200-L206 HydrophobicContact CB-CB 3.96Å; F200-L206 HydrophobicContact CD2-CB 3.65Å; F200-L206 HydrophobicContact CD2-CD1 3.84Å; F200-L206 HydrophobicContact CD2-CG 3.68Å; F200-L206 HydrophobicContact CE2-CB 4.32Å; F200-L206 HydrophobicContact CE2-CD1 4.4Å; F200-L206 HydrophobicContact CE2-CG 4.02Å; F200-L206 HydrophobicContact CG-CB 3.81Å; F200-L206 HydrophobicContact CG-CG 4.36Å; F200-Y209 VanDerWaalsContact CE1-CB 3.4Å; F200-Y209 AromaticContact CE1-CD1 3.93Å; F200-Y209 HydrophobicContact CE1-CD1 3.93Å; F200-Y209 HydrophobicContact CE1-CD2 4Å; F200-Y209 AromaticContact CE1-CG 3.47Å; F200-Y209 HydrophobicContact CE1-CG 3.47Å; F200-Y209 VanDerWaalsContact CE1-CG 3.47Å; F200-Y209 HydrophobicContact CE2-CD1 4.44Å; F200-Y209 AromaticContact CZ-CD1 3.41Å; F200-Y209 HydrophobicContact CZ-CD1 3.41Å; F200-Y209 VanDerWaalsContact CZ-CD1 3.41Å; F200-Y209 HydrophobicContact CZ-CD2 4.28Å; F200-Y209 HydrophobicContact CZ-CE1 4.16Å; F200-Y209 AromaticContact CZ-CG 3.48Å; F200-Y209 HydrophobicContact CZ-CG 3.48Å; F200-Y209 VanDerWaalsContact CZ-CG 3.48Å; F200-Y210 AromaticContact CE2-CE2 3.87Å; F200-Y210 HydrophobicContact CE2-CE2 3.87Å; F200-Y210 HydrophobicContact CZ-CE2 4.33Å
201	P	94.1	Very high	91.5	Very high	62 Å²	62	50 Å²	50	40%	0.403	26%	0.257	S	S	.	.	S	Bend	trans	-56.9	-37.2	175.7	-24.7	32.4	0	0	0	113.7	E205	P201-E205 VanDerWaalsContact CD-OE2 3.28Å; P201-E205 WeakPolarHBondContact CD-OE2 3.23Å
202	T	93.1	Very high	91.6	Very high	57 Å²	57	55.6 Å²	55.6	35%	0.35	28%	0.276	S	S	.	.	S	Bend	trans	-129.8	154.8	-177.2	66.1	0	0	0	0	111.8	F200 K204 E205 L206	F200-T202 VanDerWaalsContact C-N 3.26Å; F200-T202 PolarHBondContact O-N 2.92Å; T202-K204 PolarHBondContact O-N 2.9Å; T202-E205 PolarHBondContact O-N 2.8Å; T202-E205 WeakPolarHBondContact OG1-CB 3.21Å; T202-E205 VanDerWaalsContact OG1-CG 3.32Å; T202-E205 WeakPolarHBondContact OG1-CG 3.3Å; T202-E205 PolarHBondContact OG1-N 2.8Å; T202-E205 VanDerWaalsContact OG1-N 3.15Å; T202-E205 PolarHBondContact OG1-OE1 3.16Å; T202-L206 PolarHBondContact O-N 2.64Å; T202-L206 VanDerWaalsContact O-N 3.12Å
203	L	93.4	Very high	91.5	Very high	9 Å²	9	58.8 Å²	58.8	5%	0.047	29%	0.292	C	S	.	.	H	α-helix	trans	-63.6	-30.9	172.5	-75	172.4	0	0	0	112	I128 W133 Y169 L184 Y192 L206 V207	I128-L203 HydrophobicContact CD1-CB 4.34Å; I128-L203 HydrophobicContact CD1-CD1 3.38Å; I128-L203 HydrophobicContact CD1-CG 4.47Å; W133-L203 HydrophobicContact CH2-CB 3.77Å; W133-L203 HydrophobicContact CZ3-CB 4.35Å; Y169-L203 HydrophobicContact CD1-CD1 4.31Å; Y169-L203 HydrophobicContact CD2-CD1 3.73Å; Y169-L203 HydrophobicContact CE1-CD1 4.4Å; Y169-L203 HydrophobicContact CE2-CD1 3.81Å; Y169-L203 HydrophobicContact CG-CD1 3.97Å; L184-L203 HydrophobicContact CD1-CD2 3.51Å; Y192-L203 HydrophobicContact CD1-CD1 4.44Å; Y192-L203 HydrophobicContact CD1-CD2 3.55Å; Y192-L203 HydrophobicContact CD1-CG 3.86Å; Y192-L203 HydrophobicContact CD2-CD2 4.29Å; Y192-L203 HydrophobicContact CD2-CG 4.04Å; Y192-L203 HydrophobicContact CE1-CD1 4.04Å; Y192-L203 HydrophobicContact CE1-CD2 4Å; Y192-L203 HydrophobicContact CE1-CG 3.85Å; Y192-L203 HydrophobicContact CE2-CG 4.07Å; Y192-L203 HydrophobicContact CG-CD2 3.7Å; Y192-L203 HydrophobicContact CG-CG 3.94Å; L203-L206 WeakPolarHBondContact O-CB 3.36Å; L203-L206 PolarHBondContact O-N 3.18Å; L203-V207 WeakPolarHBondContact O-CG2 3.35Å; L203-V207 PolarHBondContact O-N 3.08Å
204	K	93.8	Very high	91.3	Very high	94 Å²	94	60.5 Å²	60.5	41%	0.409	31%	0.306	S	S	.	.	H	α-helix	trans	-60.6	-49.7	173.9	-173.1	178.6	-169.4	131.4	0	111.8	E131 W133 T202 L206 V207 E208	E131-K204 WeakPolarHBondContact OE1-CD 3.36Å; E131-K204 IonicContact OE1-NZ 2.64Å; E131-K204 PolarHBondContact OE1-NZ 3.05Å; W133-K204 HydrophobicContact CZ2-CB 4.42Å; T202-K204 PolarHBondContact O-N 2.9Å; K204-L206 VanDerWaalsContact C-N 3.29Å; K204-L206 PolarHBondContact O-N 2.6Å; K204-V207 PolarHBondContact O-N 3.11Å; K204-E208 WeakPolarHBondContact O-CG 3.32Å; K204-E208 PolarHBondContact O-N 3.48Å
205	E	94.6	Very high	91.2	Very high	82 Å²	82	63.5 Å²	63.5	38%	0.383	32%	0.322	S	S	.	.	H	α-helix	trans	-63.1	-36	176.2	-75.1	169	-113.4	0	0	112.5	F200 P201 T202 Y209	F200-E205 HydrophobicContact CB-CB 4.31Å; F200-E205 HydrophobicContact CD1-CB 4.45Å; P201-E205 VanDerWaalsContact CD-OE2 3.28Å; P201-E205 WeakPolarHBondContact CD-OE2 3.23Å; T202-E205 PolarHBondContact O-N 2.8Å; T202-E205 WeakPolarHBondContact OG1-CB 3.21Å; T202-E205 VanDerWaalsContact OG1-CG 3.32Å; T202-E205 WeakPolarHBondContact OG1-CG 3.3Å; T202-E205 PolarHBondContact OG1-N 2.8Å; T202-E205 VanDerWaalsContact OG1-N 3.15Å; T202-E205 PolarHBondContact OG1-OE1 3.16Å; E205-Y209 WeakPolarHBondContact O-CB 3.47Å; E205-Y209 PolarHBondContact O-N 2.93Å
206	L	95.4	Very high	91	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-60	-48.9	173.3	-176.5	154.5	0	0	0	110.9	L184 V194 F200 T202 L203 K204 Y209 Y210	L184-L206 HydrophobicContact CD2-CD1 4.12Å; L184-L206 HydrophobicContact CD2-CD2 4.34Å; V194-L206 HydrophobicContact CG2-CD1 4.49Å; F200-L206 HydrophobicContact CB-CB 3.96Å; F200-L206 HydrophobicContact CD2-CB 3.65Å; F200-L206 HydrophobicContact CD2-CD1 3.84Å; F200-L206 HydrophobicContact CD2-CG 3.68Å; F200-L206 HydrophobicContact CE2-CB 4.32Å; F200-L206 HydrophobicContact CE2-CD1 4.4Å; F200-L206 HydrophobicContact CE2-CG 4.02Å; F200-L206 HydrophobicContact CG-CB 3.81Å; F200-L206 HydrophobicContact CG-CG 4.36Å; T202-L206 PolarHBondContact O-N 2.64Å; T202-L206 VanDerWaalsContact O-N 3.12Å; L203-L206 WeakPolarHBondContact O-CB 3.36Å; L203-L206 PolarHBondContact O-N 3.18Å; K204-L206 VanDerWaalsContact C-N 3.29Å; K204-L206 PolarHBondContact O-N 2.6Å; L206-Y209 WeakPolarHBondContact O-CB 3.49Å; L206-Y209 PolarHBondContact O-N 3.31Å; L206-Y210 HydrophobicContact CD2-CD2 3.67Å; L206-Y210 HydrophobicContact CD2-CE2 4.03Å; L206-Y210 HydrophobicContact CG-CD2 3.89Å; L206-Y210 HydrophobicContact CG-CE2 3.91Å; L206-Y210 VanDerWaalsContact O-CD2 3.26Å; L206-Y210 WeakPolarHBondContact O-CD2 3.21Å; L206-Y210 PolarHBondContact O-N 3.25Å
207	V	95.8	Very high	91.5	Very high	8 Å²	8	55.2 Å²	55.2	5%	0.048	29%	0.286	C	S	.	.	H	α-helix	trans	-63.2	-49.2	179.1	168.4	0	0	0	0	110.8	W133 F157 V159 L203 K204 Y209 Y210 S211 L221	W133-V207 HydrophobicContact CD2-CG2 4.01Å; W133-V207 HydrophobicContact CE3-CG2 4.11Å; W133-V207 HydrophobicContact CG-CG1 4.49Å; W133-V207 HydrophobicContact CH2-CG2 4.19Å; W133-V207 HydrophobicContact CZ2-CB 4.47Å; W133-V207 HydrophobicContact CZ2-CG2 4.07Å; W133-V207 HydrophobicContact CZ3-CG2 4.2Å; F157-V207 HydrophobicContact CE2-CB 4.45Å; F157-V207 HydrophobicContact CE2-CG1 3.6Å; F157-V207 HydrophobicContact CE2-CG2 3.96Å; F157-V207 HydrophobicContact CZ-CG1 3.42Å; F157-V207 VanDerWaalsContact CZ-CG1 3.42Å; V159-V207 HydrophobicContact CG2-CG2 4.35Å; L203-V207 WeakPolarHBondContact O-CG2 3.35Å; L203-V207 PolarHBondContact O-N 3.08Å; K204-V207 PolarHBondContact O-N 3.11Å; V207-Y209 PolarHBondContact O-N 3.4Å; V207-Y210 PolarHBondContact O-N 3.24Å; V207-Y210 VanDerWaalsContact O-N 3.16Å; V207-S211 PolarHBondContact O-N 2.58Å; V207-S211 PolarHBondContact O-OG 2.83Å; V207-L221 HydrophobicContact CG1-CD1 4.4Å
208	E	95.1	Very high	91.9	Very high	80 Å²	80	50.2 Å²	50.2	37%	0.374	26%	0.256	S	S	.	.	H	α-helix	trans	-57.9	-35.5	178.2	-73.8	179.7	-166.9	0	0	112.8	K204	K204-E208 WeakPolarHBondContact O-CG 3.32Å; K204-E208 PolarHBondContact O-N 3.48Å
209	Y	95.4	Very high	92.2	Very high	44 Å²	44	48.1 Å²	48.1	17%	0.173	25%	0.249	C	C	.	.	H	α-helix	trans	-66.4	-53.4	174.8	-178	-96.8	0	0	0	111.8	K198 F200 E205 L206 V207 S211 R212 Q213 D215	K198-Y209 HydrophobicContact CD-CD1 4.28Å; K198-Y209 HydrophobicContact CD-CE1 3.65Å; K198-Y209 HydrophobicContact CD-CE2 4.11Å; K198-Y209 PolarHBondContact NZ-OH 3.08Å; F200-Y209 VanDerWaalsContact CE1-CB 3.4Å; F200-Y209 AromaticContact CE1-CD1 3.93Å; F200-Y209 HydrophobicContact CE1-CD1 3.93Å; F200-Y209 HydrophobicContact CE1-CD2 4Å; F200-Y209 AromaticContact CE1-CG 3.47Å; F200-Y209 HydrophobicContact CE1-CG 3.47Å; F200-Y209 VanDerWaalsContact CE1-CG 3.47Å; F200-Y209 HydrophobicContact CE2-CD1 4.44Å; F200-Y209 AromaticContact CZ-CD1 3.41Å; F200-Y209 HydrophobicContact CZ-CD1 3.41Å; F200-Y209 VanDerWaalsContact CZ-CD1 3.41Å; F200-Y209 HydrophobicContact CZ-CD2 4.28Å; F200-Y209 HydrophobicContact CZ-CE1 4.16Å; F200-Y209 AromaticContact CZ-CG 3.48Å; F200-Y209 HydrophobicContact CZ-CG 3.48Å; F200-Y209 VanDerWaalsContact CZ-CG 3.48Å; E205-Y209 WeakPolarHBondContact O-CB 3.47Å; E205-Y209 PolarHBondContact O-N 2.93Å; L206-Y209 WeakPolarHBondContact O-CB 3.49Å; L206-Y209 PolarHBondContact O-N 3.31Å; V207-Y209 PolarHBondContact O-N 3.4Å; Y209-S211 PolarHBondContact O-N 2.76Å; Y209-R212 PolarHBondContact O-N 3.36Å; Y209-Q213 HydrophobicContact CE1-CB 3.93Å; Y209-Q213 HydrophobicContact CE2-CB 4.25Å; Y209-Q213 HydrophobicContact CE2-CG 4.16Å; Y209-Q213 PolarHBondContact O-N 2.83Å; Y209-D215 HydrophobicContact CE1-CB 4.11Å; Y209-D215 PolarHBondContact OH-OD2 2.78Å
210	Y	95.7	Very high	92.3	Very high	3 Å²	3	49.8 Å²	49.8	1%	0.012	25%	0.254	C	S	.	.	H	α-helix	trans	-72.5	-14.7	-175.5	-76.5	-65.6	0	0	0	114	V194 F200 L206 V207 R212 Q213 S214 D215 L217 L221	V194-Y210 HydrophobicContact CB-CE2 4.35Å; V194-Y210 HydrophobicContact CG2-CE2 3.8Å; F200-Y210 AromaticContact CE2-CE2 3.87Å; F200-Y210 HydrophobicContact CE2-CE2 3.87Å; F200-Y210 HydrophobicContact CZ-CE2 4.33Å; L206-Y210 HydrophobicContact CD2-CD2 3.67Å; L206-Y210 HydrophobicContact CD2-CE2 4.03Å; L206-Y210 HydrophobicContact CG-CD2 3.89Å; L206-Y210 HydrophobicContact CG-CE2 3.91Å; L206-Y210 VanDerWaalsContact O-CD2 3.26Å; L206-Y210 WeakPolarHBondContact O-CD2 3.21Å; L206-Y210 PolarHBondContact O-N 3.25Å; V207-Y210 PolarHBondContact O-N 3.24Å; V207-Y210 VanDerWaalsContact O-N 3.16Å; Y210-R212 PolarHBondContact O-N 3.03Å; Y210-Q213 VanDerWaalsContact CA-O 3.27Å; Y210-Q213 WeakPolarHBondContact CA-O 3.49Å; Y210-Q213 WeakPolarHBondContact CD1-O 3.25Å; Y210-S214 WeakPolarHBondContact CD1-O 3.47Å; Y210-S214 VanDerWaalsContact CE1-O 3.29Å; Y210-S214 WeakPolarHBondContact CE1-O 3.28Å; Y210-D215 HydrophobicContact CE1-CB 4.13Å; Y210-L217 HydrophobicContact CD1-CD1 3.35Å; Y210-L217 HydrophobicContact CD1-CG 3.6Å; Y210-L217 HydrophobicContact CD2-CD1 4.22Å; Y210-L217 HydrophobicContact CE1-CD1 4.03Å; Y210-L217 HydrophobicContact CE1-CG 3.79Å; Y210-L217 HydrophobicContact CG-CD1 3.47Å; Y210-L217 VanDerWaalsContact CG-CD1 3.47Å; Y210-L217 HydrophobicContact CG-CG 4.19Å; Y210-L221 PolarHBondContact O-N 3.26Å
211	S	95.6	Very high	92.4	Very high	46 Å²	46	49.3 Å²	49.3	32%	0.322	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-17.1	165.4	-67.1	0	0	0	0	113.7	V207 Y209 L221	V207-S211 PolarHBondContact O-N 2.58Å; V207-S211 PolarHBondContact O-OG 2.83Å; Y209-S211 PolarHBondContact O-N 2.76Å; S211-L221 VanDerWaalsContact CA-O 3.28Å; S211-L221 WeakPolarHBondContact CA-O 3.46Å; S211-L221 WeakPolarHBondContact CB-O 3.24Å; S211-L221 PolarHBondContact OG-O 2.97Å
212	R	95.3	Very high	92.5	Very high	174 Å²	174	48 Å²	48	66%	0.657	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111.5	-27.6	-178.8	-61.9	176.6	-171.2	145.1	7.7	113.3	Y209 Y210	Y209-R212 PolarHBondContact O-N 3.36Å; Y210-R212 PolarHBondContact O-N 3.03Å
213	Q	91.2	Very high	92.6	Very high	100 Å²	100	52.4 Å²	52.4	47%	0.467	27%	0.267	S	S	.	.			trans	-140.9	131	-176.4	-60.5	-62.6	-44.6	0	0	109.7	Y209 Y210 L220	Y209-Q213 HydrophobicContact CE1-CB 3.93Å; Y209-Q213 HydrophobicContact CE2-CB 4.25Å; Y209-Q213 HydrophobicContact CE2-CG 4.16Å; Y209-Q213 PolarHBondContact O-N 2.83Å; Y210-Q213 VanDerWaalsContact CA-O 3.27Å; Y210-Q213 WeakPolarHBondContact CA-O 3.49Å; Y210-Q213 WeakPolarHBondContact CD1-O 3.25Å; Q213-L220 VanDerWaalsContact N-CD2 3.34Å
214	S	84.9	Confident	92.7	Very high	50 Å²	50	53.5 Å²	53.5	35%	0.35	27%	0.274	S	S	.	.			trans	-79.2	-39	-177	56.2	0	0	0	0	112.3	Y210 G216 L217	Y210-S214 WeakPolarHBondContact CD1-O 3.47Å; Y210-S214 VanDerWaalsContact CE1-O 3.29Å; Y210-S214 WeakPolarHBondContact CE1-O 3.28Å; S214-G216 VanDerWaalsContact C-N 3.28Å; S214-G216 PolarHBondContact O-N 3.29Å; S214-G216 VanDerWaalsContact O-N 3.07Å; S214-L217 VanDerWaalsContact O-CB 3.31Å; S214-L217 WeakPolarHBondContact O-CB 3.45Å; S214-L217 WeakPolarHBondContact O-CG 3.19Å; S214-L217 PolarHBondContact O-N 3.33Å
215	D	84.8	Confident	92.6	Very high	78 Å²	78	49.1 Å²	49.1	42%	0.417	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	38.6	50.8	173.5	-81.8	15.1	0	0	0	114.8	Y209 Y210	Y209-D215 HydrophobicContact CE1-CB 4.11Å; Y209-D215 PolarHBondContact OH-OD2 2.78Å; Y210-D215 HydrophobicContact CE1-CB 4.13Å
216	G	78.6	Confident	92.2	Very high	11 Å²	11	52 Å²	52	11%	0.113	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	97	-3.4	179.9	0	0	0	0	0	115.3	S214	S214-G216 VanDerWaalsContact C-N 3.28Å; S214-G216 PolarHBondContact O-N 3.29Å; S214-G216 VanDerWaalsContact O-N 3.07Å
217	L	87.9	Confident	91.2	Very high	6 Å²	6	55.1 Å²	55.1	3%	0.031	28%	0.276	C	S	.	.	S	Bend	trans	-76.3	149.8	162.1	-61.9	-171.9	0	0	0	110.9	L171 Y182 V194 Y210 S214 V219 L221	L171-L217 HydrophobicContact CD2-CD1 4.14Å; L171-L217 HydrophobicContact CD2-CD2 4.32Å; Y182-L217 HydrophobicContact CD1-CD2 3.82Å; Y182-L217 HydrophobicContact CD2-CD2 3.78Å; Y182-L217 HydrophobicContact CE1-CD2 3.78Å; Y182-L217 HydrophobicContact CE2-CD2 3.76Å; Y182-L217 HydrophobicContact CG-CD2 3.82Å; V194-L217 HydrophobicContact CG1-CD2 4.08Å; V194-L217 HydrophobicContact CG2-CD2 4.48Å; Y210-L217 HydrophobicContact CD1-CD1 3.35Å; Y210-L217 HydrophobicContact CD1-CG 3.6Å; Y210-L217 HydrophobicContact CD2-CD1 4.22Å; Y210-L217 HydrophobicContact CE1-CD1 4.03Å; Y210-L217 HydrophobicContact CE1-CG 3.79Å; Y210-L217 HydrophobicContact CG-CD1 3.47Å; Y210-L217 VanDerWaalsContact CG-CD1 3.47Å; Y210-L217 HydrophobicContact CG-CG 4.19Å; S214-L217 VanDerWaalsContact O-CB 3.31Å; S214-L217 WeakPolarHBondContact O-CB 3.45Å; S214-L217 WeakPolarHBondContact O-CG 3.19Å; S214-L217 PolarHBondContact O-N 3.33Å; L217-V219 PolarHBondContact O-N 3.48Å; L217-L221 HydrophobicContact CD1-CD2 4.04Å; L217-L221 HydrophobicContact CD1-CG 4.18Å
218	C	88.9	Confident	89.5	Confident	19 Å²	19	58.7 Å²	58.7	13%	0.128	29%	0.293	C	S	.	.	S	Bend	trans	-61.7	-28.7	178.4	55.1	0	0	0	0	113.3	H175 K180 Y182	H175-C218 HydrophobicContact CB-CB 4.37Å; H175-C218 PolarHBondContact CE1-O 2.74Å; K180-C218 HydrophobicContact CG-CB 4.31Å; Y182-C218 VanDerWaalsContact OH-CB 3.3Å; Y182-C218 WeakPolarHBondContact OH-CB 3.37Å; Y182-C218 PolarHBondContact OH-N 3.05Å; Y182-C218 PolarHBondContact OH-SG 3.35Å
219	V	94.2	Very high	88.2	Confident	30 Å²	30	58.7 Å²	58.7	18%	0.182	29%	0.294	C	S	.	.	S	Bend	trans	-155.9	159.5	177.7	65.4	0	0	0	0	109.6	E154 V173 H175 L217	E154-V219 HydrophobicContact CG-CG2 4.29Å; V173-V219 HydrophobicContact CG1-CG1 3.62Å; H175-V219 HydrophobicContact CB-CG1 4.14Å; L217-V219 PolarHBondContact O-N 3.48Å
220	L	96.3	Very high	87.2	Confident	78 Å²	78	58.8 Å²	58.8	41%	0.408	30%	0.303	S	S	.	.			trans	-60.6	144.8	169.2	-68.2	172.2	0	0	0	110.5	G155 Q213 G222	G155-L220 WeakPolarHBondContact CA-O 3.49Å; Q213-L220 VanDerWaalsContact N-CD2 3.34Å; L220-G222 PolarHBondContact O-N 3.49Å
221	L	97.3	Very high	86.4	Confident	5 Å²	5	60.8 Å²	60.8	3%	0.026	32%	0.317	C	S	.	.			trans	-70.8	116.2	172.9	-58.4	-175.9	0	0	0	109.7	F157 L171 V173 V207 Y210 S211 L217	F157-L221 HydrophobicContact CB-CD2 3.83Å; F157-L221 HydrophobicContact CD1-CB 3.83Å; F157-L221 HydrophobicContact CD1-CD2 4.3Å; F157-L221 HydrophobicContact CD1-CG 4.47Å; F157-L221 HydrophobicContact CD2-CD1 4.06Å; F157-L221 HydrophobicContact CD2-CD2 4.27Å; F157-L221 HydrophobicContact CE1-CB 3.98Å; F157-L221 HydrophobicContact CE2-CD1 4.12Å; F157-L221 HydrophobicContact CG-CB 4.21Å; F157-L221 HydrophobicContact CG-CD1 4.34Å; F157-L221 HydrophobicContact CG-CD2 3.87Å; F157-L221 HydrophobicContact CG-CG 4.35Å; F157-L221 HydrophobicContact CZ-CB 4.45Å; F157-L221 HydrophobicContact CZ-CD1 4.46Å; L171-L221 HydrophobicContact CD1-CD1 4.35Å; L171-L221 HydrophobicContact CD1-CD2 4.22Å; L171-L221 HydrophobicContact CD2-CD1 4.4Å; L171-L221 HydrophobicContact CD2-CD2 4.29Å; V173-L221 HydrophobicContact CG1-CD2 4.05Å; V173-L221 HydrophobicContact CG2-CD2 3.61Å; V207-L221 HydrophobicContact CG1-CD1 4.4Å; Y210-L221 PolarHBondContact O-N 3.26Å; S211-L221 VanDerWaalsContact CA-O 3.28Å; S211-L221 WeakPolarHBondContact CA-O 3.46Å; S211-L221 WeakPolarHBondContact CB-O 3.24Å; S211-L221 PolarHBondContact OG-O 2.97Å; L217-L221 HydrophobicContact CD1-CD2 4.04Å; L217-L221 HydrophobicContact CD1-CG 4.18Å
222	G	95.8	Very high	85.5	Confident	34 Å²	34	61.9 Å²	61.9	35%	0.351	32%	0.317	S	S	.	.			trans	-86.3	-131.2	176.4	0	0	0	0	0	111.6	G155 F157 L220	G155-G222 PolarHBondContact O-N 2.96Å; F157-G222 VanDerWaalsContact CE1-O 3.28Å; F157-G222 WeakPolarHBondContact CE1-O 3.29Å; L220-G222 PolarHBondContact O-N 3.49Å
223	E	95.1	Very high	84.9	Confident	150 Å²	150	53.8 Å²	53.8	70%	0.701	29%	0.286	S	S	*	.	S	Bend	trans	-77.2	147.4	177.4	-67.5	-61.4	144.2	0	0	111.9	A156 F157	A156-E223 VanDerWaalsContact CA-O 3.25Å; A156-E223 WeakPolarHBondContact CA-O 3.36Å; F157-E223 PolarHBondContact N-O 3.32Å
224	P	94.8	Very high	84.2	Confident	31 Å²	31	53.5 Å²	53.5	20%	0.201	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-52.7	147	167.9	-26.7	36	0	0	0	112.2	P132 W133 F157 R226	P132-P224 HydrophobicContact CB-CB 4.43Å; P132-P224 HydrophobicContact CB-CG 4.36Å; P132-P224 HydrophobicContact CG-CG 4.14Å; W133-P224 HydrophobicContact CB-CB 3.9Å; W133-P224 HydrophobicContact CB-CG 4.11Å; F157-P224 HydrophobicContact CE1-CG 4.42Å; F157-P224 HydrophobicContact CZ-CG 4.48Å; F157-P224 CarbonylContact O-C 3.49Å; P224-R226 PolarHBondContact O-N 3.3Å
225	C	93.1	Very high	83.9	Confident	3 Å²	3	51.5 Å²	51.5	2%	0.02	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-53.6	132.2	172.9	-172.8	0	0	0	0	110	F135 L147 F157 L158 K227	F135-C225 HydrophobicContact CE2-CB 4.16Å; F135-C225 HydrophobicContact CZ-CB 4Å; F135-C225 WeakPolarHBondContact CZ-O 3.32Å; L147-C225 HydrophobicContact CD2-CB 3.67Å; L147-C225 HydrophobicContact CG-CB 4.42Å; F157-C225 WeakPolarHBondContact O-CB 3.28Å; F157-C225 PolarHBondContact O-N 2.67Å; L158-C225 HydrophobicContact CB-CB 3.99Å; L158-C225 HydrophobicContact CD2-CB 3.87Å; L158-C225 HydrophobicContact CG-CB 4.43Å; C225-K227 PolarHBondContact O-N 2.93Å
226	R	84.7	Confident	83.6	Confident	141 Å²	141	47.8 Å²	47.8	53%	0.532	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-65.7	119.4	179.3	-67.9	-177	175.9	-169.8	0.7	110.5	G151 N152 P224 M228	G151-R226 PolarHBondContact O-NE 2.83Å; G151-R226 PolarHBondContact O-NH2 2.82Å; N152-R226 PolarHBondContact OD1-N 2.84Å; N152-R226 VanDerWaalsContact OD1-N 3.08Å; P224-R226 PolarHBondContact O-N 3.3Å; R226-M228 PolarHBondContact O-N 2.93Å
227	K	73.9	Confident	83.5	Confident	67 Å²	67	47.4 Å²	47.4	29%	0.291	25%	0.245	S	C	.	.			trans	-69.7	94	167.3	-67.4	-176.8	-179.4	-179	0	107.8	F72 P132 F135 C225 E229	F72-K227 HydrophobicContact CE1-CB 4.09Å; F72-K227 HydrophobicContact CE1-CD 3.89Å; F72-K227 HydrophobicContact CZ-CD 4.06Å; P132-K227 WeakPolarHBondContact O-CE 3.26Å; F135-K227 HydrophobicContact CE1-CG 3.74Å; F135-K227 HydrophobicContact CE2-CG 4.32Å; F135-K227 HydrophobicContact CZ-CD 4.28Å; F135-K227 HydrophobicContact CZ-CG 3.42Å; F135-K227 VanDerWaalsContact CZ-CG 3.42Å; C225-K227 PolarHBondContact O-N 2.93Å; K227-E229 VanDerWaalsContact C-N 3.3Å; K227-E229 PolarHBondContact O-N 2.87Å
228	M	61.7	Low	82.8	Confident	82 Å²	82	50.2 Å²	50.2	40%	0.404	26%	0.256	S	S	.	.			trans	-68.3	-26.9	-171	-67.7	-154.7	-67.9	0	0	113.4	R226	R226-M228 PolarHBondContact O-N 2.93Å
229	E	66.2	Low	81.7	Confident	81 Å²	81	52.8 Å²	52.8	38%	0.379	27%	0.268	S	S	.	.	S	Bend	trans	-141.1	137.7	-176.8	-74.8	163.1	-137.3	0	0	111.7	K227 E381 N382	K227-E229 VanDerWaalsContact C-N 3.3Å; K227-E229 PolarHBondContact O-N 2.87Å; E229-E381 WeakPolarHBondContact OE1-CB 3.4Å; E229-E381 VanDerWaalsContact OE1-CD 3.26Å; E229-E381 VanDerWaalsContact OE1-OE2 3.09Å; E229-N382 PolarHBondContact OE1-ND2 3.07Å; E229-N382 VanDerWaalsContact OE1-ND2 3.13Å
230	A	75.3	Confident	80.3	Confident	45 Å²	45	51.8 Å²	51.8	37%	0.372	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-68.9	142.1	169.2	0	0	0	0	0	109.7	F72 Y121	F72-A230 HydrophobicContact CB-CB 3.78Å; F72-A230 HydrophobicContact CD1-CB 3.85Å; F72-A230 HydrophobicContact CG-CB 3.88Å; Y121-A230 HydrophobicContact CE1-CB 3.94Å; Y121-A230 WeakPolarHBondContact OH-CB 3.3Å
231	P	78.3	Confident	78.5	Confident	46 Å²	46	49.2 Å²	49.2	30%	0.299	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-61.5	151.5	177.9	27.9	-34.4	0	0	0	109.7	F72 Y121 T233	F72-P231 VanDerWaalsContact CD2-CD 3.41Å; F72-P231 HydrophobicContact CD2-CG 4.02Å; F72-P231 HydrophobicContact CE2-CG 3.74Å; F72-P231 VanDerWaalsContact CZ-CD 3.43Å; F72-P231 HydrophobicContact CZ-CG 4.24Å; Y121-P231 HydrophobicContact CD2-CG 4.13Å; Y121-P231 HydrophobicContact CE2-CG 3.89Å; Y121-P231 WeakPolarHBondContact CE2-O 3.3Å; Y121-P231 VanDerWaalsContact CZ-O 3.25Å; Y121-P231 PolarHBondContact OH-O 2.77Å; P231-T233 PolarHBondContact O-N 3.2Å
232	Q	77.8	Confident	76.6	Confident	69 Å²	69	54.2 Å²	54.2	32%	0.322	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-64.5	138.2	174	-169.3	168.6	26.9	0	0	110	N120 Y310 E324	N120-Q232 PolarHBondContact ND2-O 3.25Å; Q232-Y310 PolarHBondContact NE2-OH 3.41Å; Q232-E324 PolarHBondContact NE2-OE2 3.11Å; Q232-E324 PolarHBondContact OE1-OE2 2.95Å
233	T	82.3	Confident	75	Confident	3 Å²	3	59.7 Å²	59.7	2%	0.018	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-73.9	152.8	173.4	56.7	0	0	0	0	110.4	Y74 R77 W100 P118 Y121 P231 G235	Y74-T233 HydrophobicContact CE2-CG2 4.24Å; R77-T233 PolarHBondContact NH1-OG1 2.95Å; R77-T233 PolarHBondContact NH2-OG1 2.92Å; W100-T233 HydrophobicContact CH2-CG2 4.32Å; W100-T233 HydrophobicContact CZ2-CG2 4.37Å; P118-T233 HydrophobicContact CB-CG2 3.81Å; P118-T233 HydrophobicContact CG-CG2 3.57Å; Y121-T233 HydrophobicContact CD2-CG2 4.47Å; Y121-T233 HydrophobicContact CE2-CG2 3.72Å; P231-T233 PolarHBondContact O-N 3.2Å; T233-G235 PolarHBondContact O-N 3.13Å; T233-G235 PolarHBondContact OG1-O 3.48Å
234	Y	75.8	Confident	74	Confident	95 Å²	95	54.5 Å²	54.5	37%	0.373	27%	0.266	S	S	.	.	S	Bend	trans	-73.7	96	172	-66.6	-82.9	0	0	0	110.6	E99 W100 N120	E99-Y234 HydrophobicContact CB-CD2 3.59Å; E99-Y234 HydrophobicContact CB-CE2 4.44Å; E99-Y234 HydrophobicContact CB-CG 3.75Å; E99-Y234 HydrophobicContact CG-CD1 4.14Å; E99-Y234 HydrophobicContact CG-CD2 3.64Å; E99-Y234 HydrophobicContact CG-CE2 4.19Å; E99-Y234 HydrophobicContact CG-CG 3.58Å; E99-Y234 VanDerWaalsContact OE2-CD2 3.23Å; E99-Y234 WeakPolarHBondContact OE2-CD2 3.46Å; E99-Y234 WeakPolarHBondContact OE2-CE2 3.45Å; W100-Y234 PolarHBondContact NE1-O 2.98Å; N120-Y234 HydrophobicContact CB-CE2 4.29Å
235	G	79	Confident	73.4	Confident	8 Å²	8	55.4 Å²	55.4	8%	0.082	27%	0.268	C	S	.	.	S	Bend	trans	79.3	-174	-173.8	0	0	0	0	0	113.1	T233	T233-G235 PolarHBondContact O-N 3.13Å; T233-G235 PolarHBondContact OG1-O 3.48Å
236	L	78.4	Confident	73.1	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.269	C	S	.	.	S	Bend	trans	-81.4	-43.3	-175.7	-73.3	168.6	0	0	0	112.5	R77 T240 W270 T274 V276 Y310 A311	R77-L236 WeakPolarHBondContact CD-O 3.44Å; R77-L236 PolarHBondContact NH1-O 2.84Å; L236-T240 HydrophobicContact CB-CG2 4.17Å; L236-T240 PolarHBondContact N-OG1 2.82Å; L236-W270 HydrophobicContact CB-CD2 4.2Å; L236-W270 HydrophobicContact CB-CE3 3.85Å; L236-W270 HydrophobicContact CB-CH2 3.72Å; L236-W270 HydrophobicContact CB-CZ2 4.08Å; L236-W270 HydrophobicContact CB-CZ3 3.59Å; L236-W270 HydrophobicContact CD1-CD2 3.83Å; L236-W270 HydrophobicContact CD1-CE3 4.22Å; L236-W270 HydrophobicContact CD1-CG 4.02Å; L236-W270 HydrophobicContact CD2-CD2 4.08Å; L236-W270 HydrophobicContact CD2-CE3 3.7Å; L236-W270 HydrophobicContact CD2-CG 4.47Å; L236-W270 HydrophobicContact CD2-CZ3 4.23Å; L236-W270 HydrophobicContact CG-CD2 4.25Å; L236-W270 HydrophobicContact CG-CE3 4.12Å; L236-W270 HydrophobicContact CG-CZ3 4.36Å; L236-T274 HydrophobicContact CD2-CG2 3.89Å; L236-V276 HydrophobicContact CD2-CG1 4.03Å; L236-Y310 HydrophobicContact CD1-CD2 4.44Å; L236-Y310 HydrophobicContact CD1-CG 4.39Å; L236-Y310 HydrophobicContact CD2-CD2 3.6Å; L236-Y310 HydrophobicContact CD2-CE2 3.92Å; L236-Y310 HydrophobicContact CD2-CG 4.05Å; L236-Y310 HydrophobicContact CG-CD2 3.93Å; L236-Y310 HydrophobicContact CG-CG 3.86Å; L236-A311 HydrophobicContact CD1-CB 4.16Å
237	S	76.9	Confident	73.3	Confident	3 Å²	3	52.6 Å²	52.6	2%	0.021	27%	0.268	C	S	.	.	S	Bend	trans	-157.9	169.8	176	66.6	0	0	0	0	111.3	N239 T240 V241	S237-N239 VanDerWaalsContact C-N 3.28Å; S237-N239 PolarHBondContact O-N 3.04Å; S237-T240 PolarHBondContact N-OG1 3.31Å; S237-T240 PolarHBondContact O-N 3.33Å; S237-T240 PolarHBondContact O-OG1 3.02Å; S237-V241 PolarHBondContact O-N 3.48Å
238	Y	73.9	Confident	74.1	Confident	65 Å²	65	51.7 Å²	51.7	26%	0.255	26%	0.262	S	S	.	.	H	α-helix	trans	-47.4	-48.4	173.8	169.7	-107.6	0	0	0	112.9	A97 W100 Y116 T240 V241	A97-Y238 HydrophobicContact CB-CD2 3.72Å; A97-Y238 HydrophobicContact CB-CE2 3.28Å; W100-Y238 HydrophobicContact CB-CD2 4.14Å; Y116-Y238 HydrophobicContact CD1-CD1 4.31Å; Y116-Y238 HydrophobicContact CD1-CD2 4.15Å; Y116-Y238 AromaticContact CD1-CG 3.81Å; Y116-Y238 HydrophobicContact CD1-CG 3.81Å; Y116-Y238 HydrophobicContact CD2-CD1 4.29Å; Y116-Y238 HydrophobicContact CD2-CG 4.41Å; Y116-Y238 AromaticContact CE1-CD1 3.69Å; Y116-Y238 HydrophobicContact CE1-CD1 3.69Å; Y116-Y238 AromaticContact CE1-CD2 3.7Å; Y116-Y238 HydrophobicContact CE1-CD2 3.7Å; Y116-Y238 HydrophobicContact CE1-CE1 4.03Å; Y116-Y238 HydrophobicContact CE1-CE2 4.06Å; Y116-Y238 AromaticContact CE1-CG 3.5Å; Y116-Y238 HydrophobicContact CE1-CG 3.5Å; Y116-Y238 VanDerWaalsContact CE1-CG 3.5Å; Y116-Y238 AromaticContact CE2-CD1 3.69Å; Y116-Y238 HydrophobicContact CE2-CD1 3.69Å; Y116-Y238 HydrophobicContact CE2-CE1 4.2Å; Y116-Y238 HydrophobicContact CE2-CG 4.16Å; Y116-Y238 HydrophobicContact CG-CG 4.26Å; Y116-Y238 AromaticContact CZ-CD1 3.35Å; Y116-Y238 AromaticContact CZ-CE1 3.55Å; Y116-Y238 AromaticContact CZ-CG 3.7Å; Y116-Y238 WeakPolarHBondContact OH-CE1 3.33Å; Y238-T240 PolarHBondContact O-N 2.69Å; Y238-V241 WeakPolarHBondContact O-CB 3.36Å; Y238-V241 WeakPolarHBondContact O-CG2 3.44Å; Y238-V241 PolarHBondContact O-N 2.99Å; Y238-V241 VanDerWaalsContact O-N 3.09Å
239	N	65.5	Low	75.6	Confident	72 Å²	72	54.6 Å²	54.6	39%	0.385	28%	0.279	S	S	.	.	H	α-helix	trans	-61.5	-33.9	-178.2	-68.6	-16.8	0	0	0	112.3	S237 V241 Q243	S237-N239 VanDerWaalsContact C-N 3.28Å; S237-N239 PolarHBondContact O-N 3.04Å; N239-V241 VanDerWaalsContact C-N 3.32Å; N239-V241 PolarHBondContact O-N 3.47Å; N239-Q243 WeakPolarHBondContact O-CA 3.4Å; N239-Q243 VanDerWaalsContact O-CB 3.3Å; N239-Q243 WeakPolarHBondContact O-CB 3.39Å; N239-Q243 PolarHBondContact O-N 3.21Å
240	T	64.3	Low	76.9	Confident	10 Å²	10	51.4 Å²	51.4	6%	0.061	27%	0.266	C	S	.	.	H	α-helix	trans	-78.1	-13.7	179.7	62.4	0	0	0	0	114.3	L236 S237 Y238 D242 Q243 I246 W270	L236-T240 HydrophobicContact CB-CG2 4.17Å; L236-T240 PolarHBondContact N-OG1 2.82Å; S237-T240 PolarHBondContact N-OG1 3.31Å; S237-T240 PolarHBondContact O-N 3.33Å; S237-T240 PolarHBondContact O-OG1 3.02Å; Y238-T240 PolarHBondContact O-N 2.69Å; T240-D242 PolarHBondContact O-N 3.04Å; T240-Q243 WeakPolarHBondContact CA-O 3.39Å; T240-I246 HydrophobicContact CG2-CG2 3.93Å; T240-W270 HydrophobicContact CG2-CZ2 4.31Å
241	V	58.8	Low	77.8	Confident	23 Å²	23	49.9 Å²	49.9	14%	0.139	25%	0.252	C	S	.	.	H	α-helix	trans	-61.9	-39.1	176.6	-179.1	0	0	0	0	110.3	S237 Y238 N239 K299	S237-V241 PolarHBondContact O-N 3.48Å; Y238-V241 WeakPolarHBondContact O-CB 3.36Å; Y238-V241 WeakPolarHBondContact O-CG2 3.44Å; Y238-V241 PolarHBondContact O-N 2.99Å; Y238-V241 VanDerWaalsContact O-N 3.09Å; N239-V241 VanDerWaalsContact C-N 3.32Å; N239-V241 PolarHBondContact O-N 3.47Å; V241-K299 WeakPolarHBondContact O-CE 3.24Å; V241-K299 PolarHBondContact O-NZ 3.31Å
242	D	56.5	Low	78.7	Confident	111 Å²	111	53.2 Å²	53.2	59%	0.594	26%	0.258	S	S	*	.	H	α-helix	trans	-108.5	-34	179.2	-67.2	-35.4	0	0	0	113.5	T240	T240-D242 PolarHBondContact O-N 3.04Å
243	Q	63.2	Low	79.6	Confident	148 Å²	148	52.8 Å²	52.8	69%	0.692	26%	0.258	S	S	*	.			trans	-108.4	78.7	178.5	-56	-179.1	-0.4	0	0	110.6	N239 T240	N239-Q243 WeakPolarHBondContact O-CA 3.4Å; N239-Q243 VanDerWaalsContact O-CB 3.3Å; N239-Q243 WeakPolarHBondContact O-CB 3.39Å; N239-Q243 PolarHBondContact O-N 3.21Å; T240-Q243 WeakPolarHBondContact CA-O 3.39Å
244	W	73.1	Confident	80.2	Confident	41 Å²	41	56 Å²	56	16%	0.155	27%	0.273	C	S	.	.			trans	-79.8	-15.3	-174.8	64.6	-72.8	0	0	0	114.3	I246 L292 A295 A311 V312	W244-I246 PolarHBondContact O-N 3.24Å; W244-L292 HydrophobicContact CH2-CB 4.45Å; W244-L292 HydrophobicContact CH2-CD2 3.3Å; W244-L292 HydrophobicContact CH2-CG 4.41Å; W244-L292 HydrophobicContact CZ2-CD2 3.43Å; W244-L292 VanDerWaalsContact CZ2-CD2 3.43Å; W244-L292 HydrophobicContact CZ3-CD2 4.45Å; W244-A295 HydrophobicContact CH2-CB 3.55Å; W244-A295 HydrophobicContact CZ3-CB 3.43Å; W244-A295 VanDerWaalsContact CZ3-CB 3.43Å; W244-A311 CarbonylContact O-C 3.53Å; W244-A311 WeakPolarHBondContact O-CA 3.24Å; W244-A311 WeakPolarHBondContact O-CB 3.37Å; W244-V312 HydrophobicContact CD2-CG2 4.2Å; W244-V312 HydrophobicContact CE3-CB 3.96Å; W244-V312 HydrophobicContact CE3-CG1 3.73Å; W244-V312 HydrophobicContact CE3-CG2 3.27Å; W244-V312 HydrophobicContact CH2-CG1 4.48Å; W244-V312 HydrophobicContact CH2-CG2 3.62Å; W244-V312 HydrophobicContact CZ2-CG2 4.45Å; W244-V312 HydrophobicContact CZ3-CB 3.68Å; W244-V312 HydrophobicContact CZ3-CG1 3.34Å; W244-V312 HydrophobicContact CZ3-CG2 2.95Å; W244-V312 PolarHBondContact O-N 2.77Å
245	E	82.5	Confident	81.1	Confident	51 Å²	51	56.4 Å²	56.4	24%	0.238	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-75	115.8	166.8	-178.5	68.3	-154.1	0	0	107.7	V312 C313 T314 L315	E245-V312 WeakPolarHBondContact CA-O 3.4Å; E245-V312 VanDerWaalsContact OE2-CG2 3.25Å; E245-V312 WeakPolarHBondContact OE2-CG2 3.45Å; E245-C313 WeakPolarHBondContact OE1-CA 3.39Å; E245-T314 VanDerWaalsContact CD-OG1 3.31Å; E245-T314 PolarHBondContact OE1-N 2.89Å; E245-T314 PolarHBondContact OE1-OG1 2.79Å; E245-T314 PolarHBondContact OE2-N 3.35Å; E245-T314 PolarHBondContact OE2-OG1 2.78Å; E245-L315 HydrophobicContact CG-CD1 4.29Å; E245-L315 HydrophobicContact CG-CG 4.14Å; E245-L315 WeakPolarHBondContact OE1-CG 3.26Å; E245-L315 PolarHBondContact OE1-N 3Å; E245-L315 VanDerWaalsContact OE1-N 3.15Å
246	I	87.6	Confident	81.9	Confident	8 Å²	8	61 Å²	61	4%	0.041	30%	0.3	C	S	.	.			trans	-111.9	149.9	178.5	62.4	174	0	0	0	110	T240 W244 R248 I251 A311 V312 C313 I322	T240-I246 HydrophobicContact CG2-CG2 3.93Å; W244-I246 PolarHBondContact O-N 3.24Å; I246-R248 PolarHBondContact O-N 3.45Å; I246-I251 HydrophobicContact CD1-CD1 3.81Å; I246-I251 HydrophobicContact CD1-CG1 3.83Å; I246-A311 HydrophobicContact CB-CB 4.47Å; I246-A311 HydrophobicContact CD1-CB 3.67Å; I246-A311 HydrophobicContact CG1-CB 3.86Å; I246-A311 HydrophobicContact CG2-CB 3.86Å; I246-V312 PolarHBondContact N-O 2.66Å; I246-C313 PolarHBondContact O-SG 3.19Å; I246-I322 HydrophobicContact CD1-CD1 4.13Å; I246-I322 HydrophobicContact CD1-CG1 4.28Å; I246-I322 HydrophobicContact CG1-CD1 4.42Å
247	P	88.8	Confident	82.5	Confident	77 Å²	77	65.5 Å²	65.5	50%	0.5	32%	0.323	S	S	.	.			trans	-68	134.9	177.8	30.9	-36	0	0	0	109.5	N249 S250	P247-N249 VanDerWaalsContact CB-OD1 3.31Å; P247-N249 WeakPolarHBondContact CB-OD1 3.47Å; P247-N249 PolarHBondContact O-N 3Å; P247-N249 VanDerWaalsContact O-N 3.1Å; P247-S250 WeakPolarHBondContact O-CB 3.48Å; P247-S250 PolarHBondContact O-N 3.2Å; P247-S250 PolarHBondContact O-OG 2.84Å
248	R	91.3	Very high	82.9	Confident	47 Å²	47	66.7 Å²	66.7	18%	0.177	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-53.9	-34	-177.6	-179.4	-179.2	-62.7	-75.4	-9.7	113.4	I246 S250 I251 C313 E316 P318 Y320	I246-R248 PolarHBondContact O-N 3.45Å; R248-S250 PolarHBondContact O-N 3.07Å; R248-I251 PolarHBondContact O-N 3.1Å; R248-C313 HydrophobicContact CB-CB 4.46Å; R248-E316 IonicContact NE-OE2 2.67Å; R248-E316 PolarHBondContact NE-OE2 2.75Å; R248-E316 PolarHBondContact NH2-O 3.26Å; R248-P318 VanDerWaalsContact CZ-O 3.29Å; R248-P318 PolarHBondContact NH1-O 3.37Å; R248-P318 PolarHBondContact NH2-O 2.67Å; R248-Y320 HydrophobicContact CG-CE2 4.14Å; R248-Y320 PolarHBondContact NH1-OH 2.95Å
249	N	92.5	Very high	83.4	Confident	143 Å²	143	67 Å²	67	77%	0.765	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-66.9	-15.1	178.4	67.2	-1	0	0	0	114.2	P247 I251	P247-N249 VanDerWaalsContact CB-OD1 3.31Å; P247-N249 WeakPolarHBondContact CB-OD1 3.47Å; P247-N249 PolarHBondContact O-N 3Å; P247-N249 VanDerWaalsContact O-N 3.1Å; N249-I251 PolarHBondContact O-N 3.1Å
250	S	92.4	Very high	83.6	Confident	14 Å²	14	65.7 Å²	65.7	10%	0.098	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-74.7	-9.8	171.4	68.7	0	0	0	0	112.9	P247 R248 W270 N271	P247-S250 WeakPolarHBondContact O-CB 3.48Å; P247-S250 PolarHBondContact O-N 3.2Å; P247-S250 PolarHBondContact O-OG 2.84Å; R248-S250 PolarHBondContact O-N 3.07Å; S250-W270 WeakPolarHBondContact O-CA 3.37Å; S250-N271 WeakPolarHBondContact CB-OD1 3.32Å; S250-N271 PolarHBondContact O-N 3.2Å
251	I	95.8	Very high	83.7	Confident	14 Å²	14	70 Å²	70	7%	0.072	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	119.2	180	-61.4	-67.1	0	0	0	109.8	I246 R248 N249 L253 W270 V276 V278 Y320 I322	I246-I251 HydrophobicContact CD1-CD1 3.81Å; I246-I251 HydrophobicContact CD1-CG1 3.83Å; R248-I251 PolarHBondContact O-N 3.1Å; N249-I251 PolarHBondContact O-N 3.1Å; I251-L253 HydrophobicContact CG2-CD2 4.18Å; I251-W270 HydrophobicContact CD1-CB 3.7Å; I251-W270 HydrophobicContact CD1-CG 4.05Å; I251-V276 HydrophobicContact CD1-CG2 4.27Å; I251-V278 HydrophobicContact CG2-CG2 3.84Å; I251-Y320 HydrophobicContact CG2-CD2 4.46Å; I251-Y320 HydrophobicContact CG2-CE2 4.47Å; I251-I322 HydrophobicContact CD1-CG1 4.15Å; I251-I322 HydrophobicContact CD1-CG2 4.48Å; I251-I322 HydrophobicContact CG1-CG1 4.39Å
252	R	96.4	Very high	84.1	Confident	116 Å²	116	71.1 Å²	71.1	44%	0.438	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	114.9	164.9	-173.6	175.7	70.8	-151.5	-10.6	109.7	G268 M269 E272	R252-G268 CarbonylContact O-C 3.54Å; R252-G268 VanDerWaalsContact O-CA 3.23Å; R252-G268 WeakPolarHBondContact O-CA 3.33Å; R252-M269 HydrophobicContact CB-CB 4.48Å; R252-M269 PolarHBondContact N-O 3.06Å; R252-M269 PolarHBondContact O-N 2.93Å; R252-E272 IonicContact CZ-OE1 2.74Å; R252-E272 IonicContact CZ-OE2 3.61Å; R252-E272 IonicContact NE-OE1 3.16Å; R252-E272 IonicContact NE-OE2 2.63Å; R252-E272 IonicContact NH1-OE1 2.73Å; R252-E272 PolarHBondContact NH1-OE1 2.67Å; R252-E272 IonicContact NH1-OE2 2.67Å; R252-E272 PolarHBondContact NH1-OE2 3.34Å; R252-E272 IonicContact NH2-OE1 2.64Å; R252-E272 IonicContact NH2-OE2 3.28Å; R252-E272 PolarHBondContact NH2-OE2 2.89Å
253	L	96	Very high	85.2	Confident	60 Å²	60	66 Å²	66	31%	0.314	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	137.6	169.3	-65.8	-171.3	0	0	0	110.5	I251 Y266 V278 Y320	I251-L253 HydrophobicContact CG2-CD2 4.18Å; L253-Y266 HydrophobicContact CD1-CD2 4.3Å; L253-Y266 HydrophobicContact CD1-CG 4.34Å; L253-Y266 HydrophobicContact CD2-CG 4.35Å; L253-V278 HydrophobicContact CD2-CB 3.7Å; L253-V278 HydrophobicContact CD2-CG1 3.71Å; L253-V278 HydrophobicContact CD2-CG2 3.92Å; L253-Y320 HydrophobicContact CD1-CE2 4.33Å; L253-Y320 VanDerWaalsContact CD1-OH 3.23Å; L253-Y320 WeakPolarHBondContact CD1-OH 3.27Å; L253-Y320 HydrophobicContact CD2-CE2 4.11Å; L253-Y320 HydrophobicContact CG-CE2 4.24Å
254	M	96	Very high	86.5	Confident	69 Å²	69	62 Å²	62	34%	0.34	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	-132.1	178.2	-57.5	179.3	64.7	0	0	109	K267 M269	M254-K267 WeakPolarHBondContact CA-O 3.45Å; M254-K267 HydrophobicContact CB-CB 4.36Å; M254-K267 HydrophobicContact CB-CG 4.46Å; M254-K267 WeakPolarHBondContact CB-O 3.44Å; M254-K267 PolarHBondContact N-O 2.78Å; M254-M269 HydrophobicContact SD-CB 4.14Å
255	D	94.4	Very high	87.5	Confident	105 Å²	105	62.1 Å²	62.1	56%	0.561	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.4	138.6	-175.5	-56.5	-55.2	0	0	0	112.6	L257 Y266 K267	D255-L257 PolarHBondContact O-N 3.19Å; D255-Y266 CarbonylContact O-C 3.57Å; D255-Y266 WeakPolarHBondContact O-CA 3.23Å; D255-K267 PolarHBondContact O-N 3.31Å
256	K	95.1	Very high	88.1	Confident	105 Å²	105	61.8 Å²	61.8	46%	0.457	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	119.9	169.4	-174.9	173.3	173.1	176.6	0	109.4	E264 Y266	K256-E264 WeakPolarHBondContact CE-OE1 3.39Å; K256-E264 IonicContact NZ-OE1 3.58Å; K256-E264 PolarHBondContact NZ-OE1 2.81Å; K256-Y266 HydrophobicContact CB-CD1 3.89Å; K256-Y266 HydrophobicContact CB-CE1 3.71Å; K256-Y266 HydrophobicContact CD-CE1 4.31Å; K256-Y266 HydrophobicContact CG-CD1 4.34Å; K256-Y266 HydrophobicContact CG-CE1 4.01Å
257	L	91	Very high	88.5	Confident	93 Å²	93	63.5 Å²	63.5	49%	0.487	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	-34.8	179.3	-61.9	175.8	0	0	0	111.8	D255 V265 K267 L325	D255-L257 PolarHBondContact O-N 3.19Å; L257-V265 HydrophobicContact CB-CG1 4.34Å; L257-V265 HydrophobicContact CD1-CG1 4.33Å; L257-V265 PolarHBondContact N-O 2.91Å; L257-K267 HydrophobicContact CD1-CB 4.13Å; L257-K267 HydrophobicContact CD2-CB 4.13Å; L257-K267 HydrophobicContact CG-CB 4.13Å; L257-L325 HydrophobicContact CD1-CD1 3.66Å
258	G	86.8	Confident	88.9	Confident	28 Å²	28	59.8 Å²	59.8	29%	0.289	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.3	172.5	-178.1	0	0	0	0	0	113.7	V265	G258-V265 PolarHBondContact N-O 3.37Å; G258-V265 VanDerWaalsContact N-O 3.09Å; G258-V265 PolarHBondContact O-N 2.69Å
259	A	83.3	Confident	89.1	Confident	73 Å²	73	58.7 Å²	58.7	60%	0.603	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.2	132.7	170.9	0	0	0	0	0	109.2	E264	A259-E264 HydrophobicContact CB-CG 4.26Å
260	G	70.3	Confident	89.2	Confident	44 Å²	44	52.3 Å²	52.3	45%	0.454	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	-174.3	177.3	0	0	0	0	0	111.8	F262 G263	G260-F262 PolarHBondContact O-N 3.49Å; G260-G263 PolarHBondContact N-O 2.94Å; G260-G263 PolarHBondContact O-N 3.11Å
261	Q	65.7	Low	89.1	Confident	99 Å²	99	54.8 Å²	54.8	46%	0.463	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-41.2	175.4	179	169.7	-33.1	0	0	111.7	K282	Q261-K282 PolarHBondContact O-NZ 3.18Å
262	F	68.3	Low	89	Confident	47 Å²	47	59.2 Å²	59.2	21%	0.206	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-7.1	-170	-48.2	-64.8	0	0	0	114.3	G260 L281 K282 F396	G260-F262 PolarHBondContact O-N 3.49Å; F262-L281 HydrophobicContact CB-CD2 4.45Å; F262-K282 PolarHBondContact O-N 3.33Å; F262-F396 HydrophobicContact CB-CE2 3.97Å; F262-F396 HydrophobicContact CB-CZ 4.09Å; F262-F396 HydrophobicContact CD1-CB 4.45Å; F262-F396 HydrophobicContact CD1-CD1 4.13Å; F262-F396 AromaticContact CD1-CD2 3.28Å; F262-F396 HydrophobicContact CD1-CD2 3.28Å; F262-F396 HydrophobicContact CD1-CE1 4.22Å; F262-F396 AromaticContact CD1-CE2 3.38Å; F262-F396 HydrophobicContact CD1-CE2 3.38Å; F262-F396 AromaticContact CD1-CG 3.69Å; F262-F396 HydrophobicContact CD1-CG 3.69Å; F262-F396 AromaticContact CD1-CZ 3.87Å; F262-F396 HydrophobicContact CD1-CZ 3.87Å; F262-F396 HydrophobicContact CD2-CE2 4.42Å; F262-F396 HydrophobicContact CE1-CB 3.94Å; F262-F396 HydrophobicContact CE1-CD1 4.45Å; F262-F396 AromaticContact CE1-CD2 3.36Å; F262-F396 HydrophobicContact CE1-CD2 3.36Å; F262-F396 AromaticContact CE1-CE2 3.96Å; F262-F396 HydrophobicContact CE1-CE2 3.96Å; F262-F396 AromaticContact CE1-CG 3.66Å; F262-F396 HydrophobicContact CE1-CG 3.66Å; F262-F396 AromaticContact CG-CD2 3.95Å; F262-F396 HydrophobicContact CG-CD2 3.95Å; F262-F396 AromaticContact CG-CE2 3.65Å; F262-F396 HydrophobicContact CG-CE2 3.65Å; F262-F396 HydrophobicContact CG-CZ 4.2Å; F262-F396 HydrophobicContact CZ-CD2 4.08Å
263	G	79.8	Confident	88.6	Confident	3 Å²	3	57 Å²	57	3%	0.031	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	141.7	-158.6	179.8	0	0	0	0	0	112.1	G260 T280	G260-G263 PolarHBondContact N-O 2.94Å; G260-G263 PolarHBondContact O-N 3.11Å; G263-T280 VanDerWaalsContact CA-O 3.3Å; G263-T280 WeakPolarHBondContact CA-O 3.4Å
264	E	90.6	Very high	88.3	Confident	65 Å²	65	55 Å²	55	30%	0.304	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	145.9	-171.7	-59.5	177.7	133.6	0	0	110.5	K256 A259 Y266 T280	K256-E264 WeakPolarHBondContact CE-OE1 3.39Å; K256-E264 IonicContact NZ-OE1 3.58Å; K256-E264 PolarHBondContact NZ-OE1 2.81Å; A259-E264 HydrophobicContact CB-CG 4.26Å; E264-Y266 HydrophobicContact CB-CD2 4.23Å; E264-Y266 HydrophobicContact CB-CE2 3.47Å; E264-Y266 VanDerWaalsContact CB-CE2 3.47Å; E264-Y266 PolarHBondContact OE2-OH 2.95Å; E264-T280 PolarHBondContact N-O 3.23Å; E264-T280 PolarHBondContact N-OG1 3.04Å; E264-T280 VanDerWaalsContact N-OG1 3.13Å; E264-T280 PolarHBondContact O-N 2.84Å; E264-T280 PolarHBondContact O-OG1 3.19Å
265	V	92.6	Very high	88.2	Confident	43 Å²	43	55.7 Å²	55.7	26%	0.261	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	129.5	177	-174.1	0	0	0	0	108.2	L257 G258 V278 K279	L257-V265 HydrophobicContact CB-CG1 4.34Å; L257-V265 HydrophobicContact CD1-CG1 4.33Å; L257-V265 PolarHBondContact N-O 2.91Å; G258-V265 PolarHBondContact N-O 3.37Å; G258-V265 VanDerWaalsContact N-O 3.09Å; G258-V265 PolarHBondContact O-N 2.69Å; V265-V278 WeakPolarHBondContact CA-O 3.45Å; V265-K279 HydrophobicContact CG2-CB 4.32Å; V265-K279 HydrophobicContact CG2-CG 4.07Å
266	Y	95.6	Very high	88.3	Confident	44 Å²	44	50.7 Å²	50.7	17%	0.173	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	150.3	-180	-66.4	-93.8	0	0	0	110.3	L253 D255 K256 E264 V278 T280	L253-Y266 HydrophobicContact CD1-CD2 4.3Å; L253-Y266 HydrophobicContact CD1-CG 4.34Å; L253-Y266 HydrophobicContact CD2-CG 4.35Å; D255-Y266 CarbonylContact O-C 3.57Å; D255-Y266 WeakPolarHBondContact O-CA 3.23Å; K256-Y266 HydrophobicContact CB-CD1 3.89Å; K256-Y266 HydrophobicContact CB-CE1 3.71Å; K256-Y266 HydrophobicContact CD-CE1 4.31Å; K256-Y266 HydrophobicContact CG-CD1 4.34Å; K256-Y266 HydrophobicContact CG-CE1 4.01Å; E264-Y266 HydrophobicContact CB-CD2 4.23Å; E264-Y266 HydrophobicContact CB-CE2 3.47Å; E264-Y266 VanDerWaalsContact CB-CE2 3.47Å; E264-Y266 PolarHBondContact OE2-OH 2.95Å; Y266-V278 PolarHBondContact N-O 2.85Å; Y266-V278 PolarHBondContact O-N 3.41Å; Y266-T280 HydrophobicContact CD2-CG2 3.92Å; Y266-T280 HydrophobicContact CE2-CG2 3.93Å
267	K	96.6	Very high	88.3	Confident	44 Å²	44	46.1 Å²	46.1	19%	0.191	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	137.7	156.3	-177.4	171.9	179.9	175.8	0	106.9	M254 D255 L257 E275 L325	M254-K267 WeakPolarHBondContact CA-O 3.45Å; M254-K267 HydrophobicContact CB-CB 4.36Å; M254-K267 HydrophobicContact CB-CG 4.46Å; M254-K267 WeakPolarHBondContact CB-O 3.44Å; M254-K267 PolarHBondContact N-O 2.78Å; D255-K267 PolarHBondContact O-N 3.31Å; L257-K267 HydrophobicContact CD1-CB 4.13Å; L257-K267 HydrophobicContact CD2-CB 4.13Å; L257-K267 HydrophobicContact CG-CB 4.13Å; K267-E275 WeakPolarHBondContact CE-OE1 3.37Å; K267-E275 WeakPolarHBondContact CE-OE2 3.3Å; K267-E275 IonicContact NZ-OE1 2.57Å; K267-E275 PolarHBondContact NZ-OE1 3.28Å; K267-E275 IonicContact NZ-OE2 3.44Å; K267-E275 PolarHBondContact NZ-OE2 2.9Å; K267-L325 HydrophobicContact CD-CD2 4.09Å; K267-L325 HydrophobicContact CG-CD2 3.99Å
268	G	96.4	Very high	88.5	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	165.8	176.8	0	0	0	0	0	111.7	R252 E275 V276	R252-G268 CarbonylContact O-C 3.54Å; R252-G268 VanDerWaalsContact O-CA 3.23Å; R252-G268 WeakPolarHBondContact O-CA 3.33Å; G268-E275 WeakPolarHBondContact O-CA 3.33Å; G268-V276 PolarHBondContact N-O 3.29Å; G268-V276 PolarHBondContact O-N 2.97Å
269	M	96	Very high	88.7	Confident	24 Å²	24	41.5 Å²	41.5	12%	0.118	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	119.1	172	-172.2	66.8	72.3	0	0	108.6	R252 M254 E272 T274 E275	R252-M269 HydrophobicContact CB-CB 4.48Å; R252-M269 PolarHBondContact N-O 3.06Å; R252-M269 PolarHBondContact O-N 2.93Å; M254-M269 HydrophobicContact SD-CB 4.14Å; M269-E272 VanDerWaalsContact CG-CA 3.47Å; M269-T274 PolarHBondContact SD-N 2.77Å; M269-T274 VanDerWaalsContact SD-N 3.45Å; M269-E275 HydrophobicContact CE-CG 3.71Å; M269-E275 HydrophobicContact SD-CG 4.24Å
270	W	94.1	Very high	89	Confident	8 Å²	8	38.6 Å²	38.6	3%	0.03	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	129.2	172.6	177.3	66.5	0	0	0	110.4	R77 T78 L236 T240 S250 I251 E272 T273 T274 V276	R77-W270 HydrophobicContact CB-CH2 4.39Å; R77-W270 HydrophobicContact CB-CZ3 3.72Å; T78-W270 HydrophobicContact CG2-CH2 3.78Å; T78-W270 HydrophobicContact CG2-CZ2 4.44Å; L236-W270 HydrophobicContact CB-CD2 4.2Å; L236-W270 HydrophobicContact CB-CE3 3.85Å; L236-W270 HydrophobicContact CB-CH2 3.72Å; L236-W270 HydrophobicContact CB-CZ2 4.08Å; L236-W270 HydrophobicContact CB-CZ3 3.59Å; L236-W270 HydrophobicContact CD1-CD2 3.83Å; L236-W270 HydrophobicContact CD1-CE3 4.22Å; L236-W270 HydrophobicContact CD1-CG 4.02Å; L236-W270 HydrophobicContact CD2-CD2 4.08Å; L236-W270 HydrophobicContact CD2-CE3 3.7Å; L236-W270 HydrophobicContact CD2-CG 4.47Å; L236-W270 HydrophobicContact CD2-CZ3 4.23Å; L236-W270 HydrophobicContact CG-CD2 4.25Å; L236-W270 HydrophobicContact CG-CE3 4.12Å; L236-W270 HydrophobicContact CG-CZ3 4.36Å; T240-W270 HydrophobicContact CG2-CZ2 4.31Å; S250-W270 WeakPolarHBondContact O-CA 3.37Å; I251-W270 HydrophobicContact CD1-CB 3.7Å; I251-W270 HydrophobicContact CD1-CG 4.05Å; W270-E272 PolarHBondContact O-N 3.22Å; W270-T273 PolarHBondContact O-N 3.24Å; W270-T273 PolarHBondContact O-OG1 3.48Å; W270-T274 PolarHBondContact N-O 3.15Å; W270-T274 PolarHBondContact O-N 2.86Å; W270-T274 VanDerWaalsContact O-N 3.07Å; W270-V276 HydrophobicContact CB-CG1 4.26Å
271	N	91.6	Very high	89.6	Confident	66 Å²	66	36.7 Å²	36.7	35%	0.353	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.3	31.6	-179.5	-78.3	-3.3	0	0	0	114	S250 T273	S250-N271 WeakPolarHBondContact CB-OD1 3.32Å; S250-N271 PolarHBondContact O-N 3.2Å; N271-T273 WeakPolarHBondContact O-CG2 3.49Å; N271-T273 PolarHBondContact O-N 3.13Å; N271-T273 PolarHBondContact O-OG1 3.21Å
272	E	91.8	Very high	90.2	Very high	107 Å²	107	37.3 Å²	37.3	50%	0.5	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	13.8	-176.2	-60.8	-62.7	139.8	0	0	115.3	R252 M269 W270	R252-E272 IonicContact CZ-OE1 2.74Å; R252-E272 IonicContact CZ-OE2 3.61Å; R252-E272 IonicContact NE-OE1 3.16Å; R252-E272 IonicContact NE-OE2 2.63Å; R252-E272 IonicContact NH1-OE1 2.73Å; R252-E272 PolarHBondContact NH1-OE1 2.67Å; R252-E272 IonicContact NH1-OE2 2.67Å; R252-E272 PolarHBondContact NH1-OE2 3.34Å; R252-E272 IonicContact NH2-OE1 2.64Å; R252-E272 IonicContact NH2-OE2 3.28Å; R252-E272 PolarHBondContact NH2-OE2 2.89Å; M269-E272 VanDerWaalsContact CG-CA 3.47Å; W270-E272 PolarHBondContact O-N 3.22Å
273	T	88.3	Confident	90.7	Very high	71 Å²	71	39.1 Å²	39.1	44%	0.436	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.7	-33	-172.2	52.8	0	0	0	0	113.8	W270 N271	W270-T273 PolarHBondContact O-N 3.24Å; W270-T273 PolarHBondContact O-OG1 3.48Å; N271-T273 WeakPolarHBondContact O-CG2 3.49Å; N271-T273 PolarHBondContact O-N 3.13Å; N271-T273 PolarHBondContact O-OG1 3.21Å
274	T	91	Very high	90.2	Very high	16 Å²	16	42 Å²	42	10%	0.098	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	119.4	-169.7	-50.2	0	0	0	0	111.3	R77 L236 M269 W270 V276	R77-T274 VanDerWaalsContact CD-OG1 3.32Å; R77-T274 WeakPolarHBondContact CD-OG1 3.19Å; L236-T274 HydrophobicContact CD2-CG2 3.89Å; M269-T274 PolarHBondContact SD-N 2.77Å; M269-T274 VanDerWaalsContact SD-N 3.45Å; W270-T274 PolarHBondContact N-O 3.15Å; W270-T274 PolarHBondContact O-N 2.86Å; W270-T274 VanDerWaalsContact O-N 3.07Å; T274-V276 HydrophobicContact CG2-CG1 4.44Å
275	E	94.1	Very high	89	Confident	85 Å²	85	40.3 Å²	40.3	40%	0.397	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	134.8	173.2	-62.7	-163.4	147.6	0	0	111.1	K267 G268 M269 L325	K267-E275 WeakPolarHBondContact CE-OE1 3.37Å; K267-E275 WeakPolarHBondContact CE-OE2 3.3Å; K267-E275 IonicContact NZ-OE1 2.57Å; K267-E275 PolarHBondContact NZ-OE1 3.28Å; K267-E275 IonicContact NZ-OE2 3.44Å; K267-E275 PolarHBondContact NZ-OE2 2.9Å; G268-E275 WeakPolarHBondContact O-CA 3.33Å; M269-E275 HydrophobicContact CE-CG 3.71Å; M269-E275 HydrophobicContact SD-CG 4.24Å; E275-L325 HydrophobicContact CB-CD2 3.98Å
276	V	95.4	Very high	87.9	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	159.9	-177.2	-65.3	0	0	0	0	110.9	L236 I251 G268 W270 T274 V278 Y310 I322	L236-V276 HydrophobicContact CD2-CG1 4.03Å; I251-V276 HydrophobicContact CD1-CG2 4.27Å; G268-V276 PolarHBondContact N-O 3.29Å; G268-V276 PolarHBondContact O-N 2.97Å; W270-V276 HydrophobicContact CB-CG1 4.26Å; T274-V276 HydrophobicContact CG2-CG1 4.44Å; V276-V278 HydrophobicContact CG2-CG2 3.88Å; V276-Y310 HydrophobicContact CG1-CD2 3.96Å; V276-Y310 HydrophobicContact CG1-CE2 4.14Å; V276-I322 HydrophobicContact CB-CG2 3.69Å; V276-I322 HydrophobicContact CG1-CG2 3.81Å; V276-I322 HydrophobicContact CG2-CG2 3.89Å
277	A	95.6	Very high	86.7	Confident	8 Å²	8	41.1 Å²	41.1	7%	0.066	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	132.9	163.5	0	0	0	0	0	109	I322 T323 L325	A277-I322 WeakPolarHBondContact O-CA 3.44Å; A277-T323 PolarHBondContact N-O 3.47Å; A277-T323 PolarHBondContact O-N 2.89Å; A277-L325 HydrophobicContact CB-CD1 4.13Å
278	V	95	Very high	85.5	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	107.6	-178.8	-171.1	0	0	0	0	109	I251 L253 V265 Y266 V276 Y320 I321	I251-V278 HydrophobicContact CG2-CG2 3.84Å; L253-V278 HydrophobicContact CD2-CB 3.7Å; L253-V278 HydrophobicContact CD2-CG1 3.71Å; L253-V278 HydrophobicContact CD2-CG2 3.92Å; V265-V278 WeakPolarHBondContact CA-O 3.45Å; Y266-V278 PolarHBondContact N-O 2.85Å; Y266-V278 PolarHBondContact O-N 3.41Å; V276-V278 HydrophobicContact CG2-CG2 3.88Å; V278-Y320 HydrophobicContact CG1-CD1 4.1Å; V278-Y320 HydrophobicContact CG1-CD2 3.59Å; V278-Y320 HydrophobicContact CG1-CE2 4.12Å; V278-Y320 HydrophobicContact CG1-CG 3.59Å; V278-I321 WeakPolarHBondContact CA-O 3.41Å
279	K	91.6	Very high	84.4	Confident	24 Å²	24	49.2 Å²	49.2	10%	0.104	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	122	172.5	-173	174.5	-165.5	173	0	109	V265 Y320 I321 D389 L392	V265-K279 HydrophobicContact CG2-CB 4.32Å; V265-K279 HydrophobicContact CG2-CG 4.07Å; K279-Y320 CarbonylContact O-C 3.52Å; K279-Y320 WeakPolarHBondContact O-CA 3.23Å; K279-I321 HydrophobicContact CB-CB 4.2Å; K279-I321 HydrophobicContact CD-CD1 4.5Å; K279-I321 PolarHBondContact N-O 3.45Å; K279-I321 PolarHBondContact O-N 2.79Å; K279-D389 IonicContact NZ-OD1 2.98Å; K279-D389 PolarHBondContact NZ-OD1 2.8Å; K279-D389 IonicContact NZ-OD2 3.83Å; K279-D389 PolarHBondContact NZ-OD2 3.08Å; K279-L392 HydrophobicContact CD-CD1 4.05Å
280	T	89.8	Confident	83.2	Confident	12 Å²	12	51.1 Å²	51.1	7%	0.074	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	136.7	174.6	64.4	0	0	0	0	109.1	G263 E264 Y266 I319 Y320	G263-T280 VanDerWaalsContact CA-O 3.3Å; G263-T280 WeakPolarHBondContact CA-O 3.4Å; E264-T280 PolarHBondContact N-O 3.23Å; E264-T280 PolarHBondContact N-OG1 3.04Å; E264-T280 VanDerWaalsContact N-OG1 3.13Å; E264-T280 PolarHBondContact O-N 2.84Å; E264-T280 PolarHBondContact O-OG1 3.19Å; Y266-T280 HydrophobicContact CD2-CG2 3.92Å; Y266-T280 HydrophobicContact CE2-CG2 3.93Å; T280-I319 WeakPolarHBondContact CA-O 3.31Å; T280-Y320 HydrophobicContact CG2-CD1 3.71Å; T280-Y320 HydrophobicContact CG2-CE1 3.37Å
281	L	82.6	Confident	82.4	Confident	5 Å²	5	50.9 Å²	50.9	3%	0.026	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-97.3	136.5	169.1	-62.5	-177	0	0	0	109.6	F262 F291 P318 I319 I321 F396	F262-L281 HydrophobicContact CB-CD2 4.45Å; L281-F291 HydrophobicContact CD1-CD2 3.79Å; L281-F291 HydrophobicContact CD1-CE2 3.8Å; L281-P318 WeakPolarHBondContact O-CB 3.37Å; L281-I319 HydrophobicContact CB-CB 4.29Å; L281-I319 HydrophobicContact CD1-CB 4.33Å; L281-I319 HydrophobicContact CD1-CG2 4.3Å; L281-I319 PolarHBondContact N-O 3.4Å; L281-I321 HydrophobicContact CD1-CD1 4.34Å; L281-I321 HydrophobicContact CD2-CD1 4.38Å; L281-I321 HydrophobicContact CG-CD1 4.37Å; L281-F396 HydrophobicContact CD2-CZ 4.01Å
282	K	78.1	Confident	81.6	Confident	111 Å²	111	50.2 Å²	50.2	48%	0.483	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-63.4	142.6	176	-66.9	172.3	-178.1	162.6	0	109.6	Q261 F262 G284 T285	Q261-K282 PolarHBondContact O-NZ 3.18Å; F262-K282 PolarHBondContact O-N 3.33Å; K282-G284 PolarHBondContact O-N 2.94Å; K282-T285 WeakPolarHBondContact CB-OG1 3.29Å; K282-T285 WeakPolarHBondContact O-CB 3.41Å; K282-T285 PolarHBondContact O-N 2.77Å; K282-T285 PolarHBondContact O-OG1 3.13Å
283	P	77.8	Confident	80.7	Confident	86 Å²	86	47.7 Å²	47.7	56%	0.558	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48	136.6	171.1	-33.3	39.6	0	0	0	112.4	T285 E317	P283-T285 VanDerWaalsContact C-N 3.25Å; P283-T285 PolarHBondContact O-N 3.4Å; P283-E317 VanDerWaalsContact CB-OE2 3.3Å; P283-E317 WeakPolarHBondContact CB-OE2 3.36Å
284	G	69.9	Low	80	Confident	62 Å²	62	45.2 Å²	45.2	64%	0.639	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	14.8	178.5	0	0	0	0	0	115.9	K282 M286	K282-G284 PolarHBondContact O-N 2.94Å; G284-M286 VanDerWaalsContact C-N 3.3Å
285	T	66	Low	79.3	Confident	31 Å²	31	44.6 Å²	44.6	19%	0.19	26%	0.256	C	S	.	.	S	Bend	trans	-79.6	-15.5	172.5	-38.4	0	0	0	0	112.4	K282 P283 F396	K282-T285 WeakPolarHBondContact CB-OG1 3.29Å; K282-T285 WeakPolarHBondContact O-CB 3.41Å; K282-T285 PolarHBondContact O-N 2.77Å; K282-T285 PolarHBondContact O-OG1 3.13Å; P283-T285 VanDerWaalsContact C-N 3.25Å; P283-T285 PolarHBondContact O-N 3.4Å; T285-F396 HydrophobicContact CG2-CD1 3.66Å; T285-F396 HydrophobicContact CG2-CE1 3.23Å; T285-F396 HydrophobicContact CG2-CZ 4.13Å; T285-F396 WeakPolarHBondContact O-CE1 3.44Å
286	M	68.3	Low	78.5	Confident	19 Å²	19	45.5 Å²	45.5	9%	0.094	26%	0.26	C	S	.	.	S	Bend	trans	-165.5	147.4	-175.1	-164.2	177.2	-62.7	0	0	111.8	G284 F291 V395 F396	G284-M286 VanDerWaalsContact C-N 3.3Å; M286-F291 HydrophobicContact CE-CD2 4.45Å; M286-F291 HydrophobicContact CG-CB 4.26Å; M286-F291 WeakPolarHBondContact SD-CA 3.44Å; M286-F291 HydrophobicContact SD-CB 3.39Å; M286-F291 WeakPolarHBondContact SD-CB 3.07Å; M286-F291 HydrophobicContact SD-CD2 3.69Å; M286-F291 HydrophobicContact SD-CG 4.02Å; M286-V395 HydrophobicContact CE-CB 3.34Å; M286-V395 HydrophobicContact CE-CG1 3.27Å; M286-V395 HydrophobicContact CE-CG2 4.11Å; M286-V395 HydrophobicContact CG-CG1 3.56Å; M286-V395 HydrophobicContact SD-CB 3.88Å; M286-V395 HydrophobicContact SD-CG1 3.2Å; M286-V395 WeakPolarHBondContact SD-CG1 3.44Å; M286-V395 HydrophobicContact SD-CG2 4.36Å; M286-F396 HydrophobicContact CE-CD1 3.94Å; M286-F396 HydrophobicContact CE-CE1 3.32Å; M286-F396 HydrophobicContact CE-CE2 4.12Å; M286-F396 HydrophobicContact CE-CZ 3.44Å; M286-F396 VanDerWaalsContact CE-CZ 3.44Å
287	D	70.8	Confident	77.6	Confident	84 Å²	84	48 Å²	48	45%	0.449	27%	0.273	S	S	.	.			trans	-69.7	130.7	164.7	-173.4	-81.9	0	0	0	110.9	E289 D290 F291	D287-E289 PolarHBondContact O-N 3.2Å; D287-E289 VanDerWaalsContact OD1-CB 3.29Å; D287-E289 WeakPolarHBondContact OD1-CB 3.45Å; D287-E289 PolarHBondContact OD1-N 2.92Å; D287-D290 HydrophobicContact CB-CB 4.48Å; D287-D290 PolarHBondContact O-N 3.13Å; D287-F291 PolarHBondContact O-N 3.46Å
288	P	71.7	Confident	76.7	Confident	59 Å²	59	48.3 Å²	48.3	38%	0.383	27%	0.274	S	S	.	.	H	α-helix	trans	-54.9	-32.8	180	-27.8	35.6	0	0	0	114.7	F291 L292	P288-F291 WeakPolarHBondContact O-CB 3.46Å; P288-F291 PolarHBondContact O-N 3.21Å; P288-L292 WeakPolarHBondContact O-CG 3.4Å; P288-L292 PolarHBondContact O-N 2.76Å
289	E	73	Confident	75.8	Confident	156 Å²	156	51.3 Å²	51.3	73%	0.729	29%	0.286	S	S	*	.	H	α-helix	trans	-69.7	-43.4	179.5	-61.7	-175	173.8	0	0	111.8	D287 F291 L292 A293	D287-E289 PolarHBondContact O-N 3.2Å; D287-E289 VanDerWaalsContact OD1-CB 3.29Å; D287-E289 WeakPolarHBondContact OD1-CB 3.45Å; D287-E289 PolarHBondContact OD1-N 2.92Å; E289-F291 VanDerWaalsContact C-N 3.28Å; E289-F291 PolarHBondContact O-N 3.07Å; E289-L292 PolarHBondContact O-N 3.47Å; E289-A293 PolarHBondContact O-N 3.2Å
290	D	71.8	Confident	75.2	Confident	63 Å²	63	59.7 Å²	59.7	34%	0.337	32%	0.317	S	S	.	.	H	α-helix	trans	-64	-36	174.6	-97	-19.9	0	0	0	110.7	D287 E294 V395 K398	D287-D290 HydrophobicContact CB-CB 4.48Å; D287-D290 PolarHBondContact O-N 3.13Å; D290-E294 PolarHBondContact O-N 3.3Å; D290-V395 HydrophobicContact CB-CG1 4.18Å; D290-K398 IonicContact OD1-NZ 2.66Å; D290-K398 PolarHBondContact OD1-NZ 3.36Å; D290-K398 IonicContact OD2-NZ 2.92Å; D290-K398 PolarHBondContact OD2-NZ 2.86Å
291	F	76.1	Confident	75	Confident	4 Å²	4	59.4 Å²	59.4	2%	0.018	32%	0.316	C	S	.	.	H	α-helix	trans	-62.6	-50.2	172.8	-179.9	-102.8	0	0	0	111.9	L281 M286 D287 P288 E289 A293 E294 A295 V312 T314 I319 I321	L281-F291 HydrophobicContact CD1-CD2 3.79Å; L281-F291 HydrophobicContact CD1-CE2 3.8Å; M286-F291 HydrophobicContact CE-CD2 4.45Å; M286-F291 HydrophobicContact CG-CB 4.26Å; M286-F291 WeakPolarHBondContact SD-CA 3.44Å; M286-F291 HydrophobicContact SD-CB 3.39Å; M286-F291 WeakPolarHBondContact SD-CB 3.07Å; M286-F291 HydrophobicContact SD-CD2 3.69Å; M286-F291 HydrophobicContact SD-CG 4.02Å; D287-F291 PolarHBondContact O-N 3.46Å; P288-F291 WeakPolarHBondContact O-CB 3.46Å; P288-F291 PolarHBondContact O-N 3.21Å; E289-F291 VanDerWaalsContact C-N 3.28Å; E289-F291 PolarHBondContact O-N 3.07Å; F291-A293 VanDerWaalsContact C-N 3.28Å; F291-A293 PolarHBondContact O-N 3.35Å; F291-E294 PolarHBondContact O-N 2.91Å; F291-A295 HydrophobicContact CE1-CB 4.35Å; F291-A295 HydrophobicContact CZ-CB 4.44Å; F291-A295 WeakPolarHBondContact O-CB 3.19Å; F291-A295 PolarHBondContact O-N 3.29Å; F291-V312 HydrophobicContact CE1-CB 4.07Å; F291-V312 HydrophobicContact CE1-CG1 3.8Å; F291-V312 HydrophobicContact CE1-CG2 4.32Å; F291-V312 HydrophobicContact CZ-CB 4.5Å; F291-V312 HydrophobicContact CZ-CG1 3.86Å; F291-T314 HydrophobicContact CD1-CG2 3.53Å; F291-T314 HydrophobicContact CE1-CG2 3.52Å; F291-I319 HydrophobicContact CB-CD1 4.49Å; F291-I319 HydrophobicContact CD1-CD1 4.31Å; F291-I319 HydrophobicContact CD1-CG2 3.97Å; F291-I319 HydrophobicContact CE1-CG2 3.61Å; F291-I319 HydrophobicContact CE2-CG2 4.38Å; F291-I319 HydrophobicContact CG-CD1 4.32Å; F291-I319 HydrophobicContact CG-CG2 4.5Å; F291-I319 HydrophobicContact CZ-CG2 3.86Å; F291-I321 HydrophobicContact CE2-CD1 3.55Å; F291-I321 HydrophobicContact CE2-CG1 3.92Å; F291-I321 HydrophobicContact CZ-CD1 3.85Å; F291-I321 HydrophobicContact CZ-CG1 3.71Å
292	L	74.8	Confident	75.2	Confident	52 Å²	52	63.2 Å²	63.2	27%	0.272	33%	0.329	S	S	.	.	H	α-helix	trans	-60.1	-39.7	-179.7	-69.8	167.3	0	0	0	111	W244 P288 E289 A295 Q296 T314	W244-L292 HydrophobicContact CH2-CB 4.45Å; W244-L292 HydrophobicContact CH2-CD2 3.3Å; W244-L292 HydrophobicContact CH2-CG 4.41Å; W244-L292 HydrophobicContact CZ2-CD2 3.43Å; W244-L292 VanDerWaalsContact CZ2-CD2 3.43Å; W244-L292 HydrophobicContact CZ3-CD2 4.45Å; P288-L292 WeakPolarHBondContact O-CG 3.4Å; P288-L292 PolarHBondContact O-N 2.76Å; E289-L292 PolarHBondContact O-N 3.47Å; L292-A295 PolarHBondContact O-N 2.78Å; L292-Q296 VanDerWaalsContact O-CG 3.29Å; L292-Q296 WeakPolarHBondContact O-CG 3.48Å; L292-Q296 PolarHBondContact O-N 3.09Å; L292-T314 HydrophobicContact CD2-CG2 3.95Å
293	A	74	Confident	75.7	Confident	54 Å²	54	60.3 Å²	60.3	45%	0.446	32%	0.317	S	S	.	.	H	α-helix	trans	-63.1	-42.8	177.3	0	0	0	0	0	112.6	E289 F291 Q296 L297	E289-A293 PolarHBondContact O-N 3.2Å; F291-A293 VanDerWaalsContact C-N 3.28Å; F291-A293 PolarHBondContact O-N 3.35Å; A293-Q296 PolarHBondContact O-N 2.79Å; A293-L297 PolarHBondContact O-N 3.22Å
294	E	73.7	Confident	76.3	Confident	19 Å²	19	60.6 Å²	60.6	9%	0.089	32%	0.32	C	S	.	.	H	α-helix	trans	-70.9	-39	176.7	-165.8	71.2	-153.8	0	0	111.5	D290 F291 Q296 L297 M298 Y367 G391 V395	D290-E294 PolarHBondContact O-N 3.3Å; F291-E294 PolarHBondContact O-N 2.91Å; E294-Q296 VanDerWaalsContact C-N 3.3Å; E294-Q296 PolarHBondContact O-N 2.82Å; E294-L297 WeakPolarHBondContact O-CA 3.32Å; E294-L297 WeakPolarHBondContact O-CB 3.44Å; E294-L297 PolarHBondContact O-N 2.77Å; E294-M298 WeakPolarHBondContact O-CG 3.45Å; E294-M298 PolarHBondContact O-N 3.33Å; E294-Y367 PolarHBondContact OE1-OH 3.24Å; E294-G391 VanDerWaalsContact CD-O 3.23Å; E294-G391 WeakPolarHBondContact CG-O 3.4Å; E294-G391 VanDerWaalsContact OE1-CA 3.29Å; E294-G391 WeakPolarHBondContact OE1-CA 3.49Å; E294-G391 VanDerWaalsContact OE1-O 3.13Å; E294-V395 HydrophobicContact CB-CG2 3.61Å; E294-V395 HydrophobicContact CG-CG2 3.58Å
295	A	76.3	Confident	77.5	Confident	2 Å²	2	59.9 Å²	59.9	2%	0.017	30%	0.299	C	S	.	.	H	α-helix	trans	-63.1	-35.5	175.7	0	0	0	0	0	112.2	W244 F291 L292 L297 M298 K299 L309	W244-A295 HydrophobicContact CH2-CB 3.55Å; W244-A295 HydrophobicContact CZ3-CB 3.43Å; W244-A295 VanDerWaalsContact CZ3-CB 3.43Å; F291-A295 HydrophobicContact CE1-CB 4.35Å; F291-A295 HydrophobicContact CZ-CB 4.44Å; F291-A295 WeakPolarHBondContact O-CB 3.19Å; F291-A295 PolarHBondContact O-N 3.29Å; L292-A295 PolarHBondContact O-N 2.78Å; A295-L297 VanDerWaalsContact C-N 3.27Å; A295-L297 PolarHBondContact O-N 2.93Å; A295-M298 PolarHBondContact O-N 2.89Å; A295-K299 PolarHBondContact O-N 2.9Å; A295-L309 HydrophobicContact CB-CD2 4.26Å
296	Q	77	Confident	78.8	Confident	105 Å²	105	58.5 Å²	58.5	49%	0.491	29%	0.29	S	S	.	.	H	α-helix	trans	-62.7	-33.6	171.3	-77.4	177.7	11.2	0	0	112.7	L292 A293 E294 K299	L292-Q296 VanDerWaalsContact O-CG 3.29Å; L292-Q296 WeakPolarHBondContact O-CG 3.48Å; L292-Q296 PolarHBondContact O-N 3.09Å; A293-Q296 PolarHBondContact O-N 2.79Å; E294-Q296 VanDerWaalsContact C-N 3.3Å; E294-Q296 PolarHBondContact O-N 2.82Å; Q296-K299 WeakPolarHBondContact O-CB 3.33Å
297	L	76.6	Confident	79.9	Confident	53 Å²	53	58 Å²	58	28%	0.277	29%	0.288	S	S	.	.	H	α-helix	trans	-72	-48.5	175.3	-158.1	162	0	0	0	109.9	A293 E294 A295 K299 R300 L301 Y367	A293-L297 PolarHBondContact O-N 3.22Å; E294-L297 WeakPolarHBondContact O-CA 3.32Å; E294-L297 WeakPolarHBondContact O-CB 3.44Å; E294-L297 PolarHBondContact O-N 2.77Å; A295-L297 VanDerWaalsContact C-N 3.27Å; A295-L297 PolarHBondContact O-N 2.93Å; L297-K299 PolarHBondContact O-N 2.91Å; L297-R300 PolarHBondContact O-N 3.38Å; L297-L301 HydrophobicContact CD2-CD1 3.5Å; L297-L301 HydrophobicContact CD2-CD2 4.45Å; L297-L301 HydrophobicContact CD2-CG 3.91Å; L297-L301 PolarHBondContact O-N 2.8Å; L297-Y367 HydrophobicContact CD1-CD2 4.15Å; L297-Y367 HydrophobicContact CD1-CE2 3.91Å; L297-Y367 HydrophobicContact CD2-CD2 3.28Å; L297-Y367 HydrophobicContact CD2-CE2 3.3Å; L297-Y367 HydrophobicContact CD2-CG 4.31Å; L297-Y367 HydrophobicContact CG-CD2 4.36Å; L297-Y367 HydrophobicContact CG-CE2 4.21Å
298	M	77	Confident	80.7	Confident	14 Å²	14	55.1 Å²	55.1	7%	0.069	27%	0.272	C	S	.	.	H	α-helix	trans	-54.8	-35.9	174	-67.6	178	68.2	0	0	112.3	E294 A295 R300 L301 L309 F390	E294-M298 WeakPolarHBondContact O-CG 3.45Å; E294-M298 PolarHBondContact O-N 3.33Å; A295-M298 PolarHBondContact O-N 2.89Å; M298-R300 VanDerWaalsContact C-N 3.28Å; M298-R300 PolarHBondContact O-N 2.94Å; M298-L301 PolarHBondContact O-N 2.81Å; M298-L309 HydrophobicContact CB-CD2 3.97Å; M298-F390 WeakPolarHBondContact CE-O 3.3Å; M298-F390 HydrophobicContact CG-CE2 4.5Å
299	K	74.4	Confident	81.5	Confident	62 Å²	62	53 Å²	53	27%	0.27	26%	0.257	S	S	.	.	H	α-helix	trans	-56.9	-38.4	175.5	178.9	179.6	179.7	175.6	0	113	V241 A295 Q296 L297 R302	V241-K299 WeakPolarHBondContact O-CE 3.24Å; V241-K299 PolarHBondContact O-NZ 3.31Å; A295-K299 PolarHBondContact O-N 2.9Å; Q296-K299 WeakPolarHBondContact O-CB 3.33Å; L297-K299 PolarHBondContact O-N 2.91Å; K299-R302 PolarHBondContact O-NE 2.7Å
300	R	80.3	Confident	82.1	Confident	200 Å²	200	46.6 Å²	46.6	76%	0.755	23%	0.227	S	C	*	.	H	α-helix	trans	-80	-24.9	-176.8	-65	179.8	-175.5	-178.1	1.5	112.4	L297 M298 R302 Y361	L297-R300 PolarHBondContact O-N 3.38Å; M298-R300 VanDerWaalsContact C-N 3.28Å; M298-R300 PolarHBondContact O-N 2.94Å; R300-R302 PolarHBondContact O-N 3.04Å; R300-R302 VanDerWaalsContact O-N 3.12Å; R300-Y361 PolarHBondContact O-OH 3.37Å
301	L	85.3	Confident	82.9	Confident	7 Å²	7	43.6 Å²	43.6	4%	0.037	21%	0.211	C	C	.	.			trans	-81	89.8	179.7	-61.9	176.2	0	0	0	109.9	L297 M298 L306 Y361 L362 Q365 Y367 F390	L297-L301 HydrophobicContact CD2-CD1 3.5Å; L297-L301 HydrophobicContact CD2-CD2 4.45Å; L297-L301 HydrophobicContact CD2-CG 3.91Å; L297-L301 PolarHBondContact O-N 2.8Å; M298-L301 PolarHBondContact O-N 2.81Å; L301-L306 HydrophobicContact CB-CD1 4.42Å; L301-Y361 HydrophobicContact CB-CE1 4.18Å; L301-Y361 HydrophobicContact CD2-CE1 4.07Å; L301-L362 HydrophobicContact CD1-CD2 3.76Å; L301-L362 HydrophobicContact CD2-CD2 4.15Å; L301-L362 HydrophobicContact CG-CD2 4.37Å; L301-Q365 HydrophobicContact CD2-CB 3.57Å; L301-Q365 HydrophobicContact CD2-CG 3.71Å; L301-Y367 HydrophobicContact CD1-CD1 4.09Å; L301-Y367 HydrophobicContact CD1-CD2 3.95Å; L301-Y367 HydrophobicContact CD1-CE1 4.48Å; L301-Y367 HydrophobicContact CD1-CE2 4.31Å; L301-Y367 HydrophobicContact CD1-CG 3.81Å; L301-F390 HydrophobicContact CB-CE2 3.88Å; L301-F390 HydrophobicContact CD1-CD2 3.78Å; L301-F390 HydrophobicContact CD1-CE2 3.8Å
302	R	85.6	Confident	83.5	Confident	84 Å²	84	43.4 Å²	43.4	32%	0.317	21%	0.21	S	C	.	.			trans	-114.8	116.3	-179.6	-66	-173.9	179.1	-171.8	-4.3	110.4	K299 R300 Y361	K299-R302 PolarHBondContact O-NE 2.7Å; R300-R302 PolarHBondContact O-N 3.04Å; R300-R302 VanDerWaalsContact O-N 3.12Å; R302-Y361 PolarHBondContact N-OH 3.06Å; R302-Y361 VanDerWaalsContact O-CZ 3.29Å; R302-Y361 PolarHBondContact O-OH 2.96Å
303	H	89.9	Confident	84.2	Confident	50 Å²	50	41 Å²	41	23%	0.231	20%	0.197	C	C	.	.			trans	-155.5	142.6	177.8	-177.2	-96.5	0	0	0	110.5	K305 L306 Y361	H303-K305 PolarHBondContact ND1-N 3.23Å; H303-K305 PolarHBondContact O-N 2.83Å; H303-L306 HydrophobicContact CB-CB 4.32Å; H303-L306 HydrophobicContact CB-CD1 4.02Å; H303-L306 HydrophobicContact CB-CG 3.94Å; H303-L306 PolarHBondContact O-N 2.91Å; H303-Y361 HydrophobicContact CB-CD1 3.66Å; H303-Y361 HydrophobicContact CB-CD2 4.17Å; H303-Y361 HydrophobicContact CB-CE1 4Å; H303-Y361 HydrophobicContact CB-CE2 4.49Å; H303-Y361 HydrophobicContact CB-CG 3.73Å; H303-Y361 AromaticContact CD2-CD2 3.93Å; H303-Y361 AromaticContact CD2-CG 3.84Å; H303-Y361 AromaticContact CG-CG 3.87Å
304	P	89.4	Confident	84.7	Confident	93 Å²	93	39.6 Å²	39.6	60%	0.604	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-18.4	-177.7	-26.7	35.3	0	0	0	115.5	K386	P304-K386 WeakPolarHBondContact O-CE 3.22Å
305	K	95	Very high	85.1	Confident	47 Å²	47	45.5 Å²	45.5	20%	0.204	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.5	15.6	178.4	-51	-58.4	178.3	-176.7	0	113.7	H303 Q354 A357 C385 K386 V387	H303-K305 PolarHBondContact ND1-N 3.23Å; H303-K305 PolarHBondContact O-N 2.83Å; K305-Q354 VanDerWaalsContact CB-O 3.23Å; K305-Q354 WeakPolarHBondContact CB-O 3.22Å; K305-Q354 HydrophobicContact CD-CB 3.98Å; K305-Q354 HydrophobicContact CD-CG 4.15Å; K305-Q354 HydrophobicContact CG-CB 4.46Å; K305-Q354 WeakPolarHBondContact CG-O 3.39Å; K305-A357 HydrophobicContact CG-CB 4.37Å; K305-C385 WeakPolarHBondContact CD-O 3.16Å; K305-K386 WeakPolarHBondContact O-CA 3.33Å; K305-V387 PolarHBondContact O-N 3.24Å
306	L	93.7	Very high	85.4	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.01	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-116.4	145.5	169.1	-64.3	-174.3	0	0	0	109.3	L301 H303 Q308 Y361 L362 V387 F390	L301-L306 HydrophobicContact CB-CD1 4.42Å; H303-L306 HydrophobicContact CB-CB 4.32Å; H303-L306 HydrophobicContact CB-CD1 4.02Å; H303-L306 HydrophobicContact CB-CG 3.94Å; H303-L306 PolarHBondContact O-N 2.91Å; L306-Q308 PolarHBondContact O-N 2.89Å; L306-Y361 HydrophobicContact CD1-CD1 3.58Å; L306-Y361 HydrophobicContact CD1-CE1 3.89Å; L306-L362 HydrophobicContact CD1-CD2 3.59Å; L306-L362 HydrophobicContact CD1-CG 4.01Å; L306-L362 HydrophobicContact CD2-CD1 4.12Å; L306-L362 HydrophobicContact CD2-CD2 4.47Å; L306-L362 HydrophobicContact CD2-CG 4.13Å; L306-V387 HydrophobicContact CD2-CB 3.71Å; L306-V387 HydrophobicContact CD2-CG1 4.42Å; L306-V387 HydrophobicContact CD2-CG2 4.28Å; L306-F390 HydrophobicContact CB-CE1 3.82Å; L306-F390 HydrophobicContact CB-CZ 3.89Å; L306-F390 HydrophobicContact CD1-CE1 4.45Å; L306-F390 HydrophobicContact CD1-CE2 4.29Å; L306-F390 HydrophobicContact CD1-CZ 4.11Å; L306-F390 HydrophobicContact CD2-CD1 4.32Å; L306-F390 HydrophobicContact CD2-CE1 4.23Å; L306-F390 HydrophobicContact CG-CE1 4.39Å; L306-F390 HydrophobicContact CG-CZ 4.46Å
307	I	92.3	Very high	85.7	Confident	9 Å²	9	51.9 Å²	51.9	5%	0.046	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-65.9	124.7	173.7	-71.7	-61.9	0	0	0	110.3	L309 T323 E324 M326 L378 K386 V387 A388 F390	I307-L309 PolarHBondContact O-N 3.47Å; I307-T323 HydrophobicContact CG2-CG2 3.89Å; I307-E324 HydrophobicContact CD1-CG 3.87Å; I307-E324 HydrophobicContact CG2-CG 4.23Å; I307-M326 HydrophobicContact CD1-CE 4.38Å; I307-M326 HydrophobicContact CD1-CG 3.56Å; I307-M326 HydrophobicContact CD1-SD 4Å; I307-L378 HydrophobicContact CD1-CB 4.15Å; I307-L378 HydrophobicContact CD1-CD1 3.8Å; I307-L378 HydrophobicContact CD1-CG 4.39Å; I307-L378 HydrophobicContact CG1-CD1 3.98Å; I307-L378 HydrophobicContact CG1-CG 4.45Å; I307-K386 HydrophobicContact CD1-CB 3.55Å; I307-K386 HydrophobicContact CD1-CD 3.92Å; I307-K386 HydrophobicContact CD1-CG 4.34Å; I307-K386 HydrophobicContact CG1-CB 3.9Å; I307-V387 PolarHBondContact N-O 3.48Å; I307-A388 HydrophobicContact CB-CB 4.25Å; I307-A388 HydrophobicContact CG1-CB 3.6Å; I307-F390 WeakPolarHBondContact O-CZ 3.04Å
308	Q	87.9	Confident	86.2	Confident	23 Å²	23	51.6 Å²	51.6	11%	0.107	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-76.5	120.1	178.9	-172.9	59	62.6	0	0	110.6	L306 Y310 T323 E324	L306-Q308 PolarHBondContact O-N 2.89Å; Q308-Y310 HydrophobicContact CB-CD1 4.45Å; Q308-Y310 HydrophobicContact CB-CE1 4.24Å; Q308-Y310 HydrophobicContact CG-CD1 3.84Å; Q308-Y310 HydrophobicContact CG-CE1 3.86Å; Q308-Y310 PolarHBondContact O-N 3.07Å; Q308-T323 WeakPolarHBondContact O-CA 3.41Å; Q308-T323 WeakPolarHBondContact O-CB 3.46Å; Q308-E324 PolarHBondContact N-OE1 2.87Å; Q308-E324 PolarHBondContact O-N 3.39Å
309	L	87.1	Confident	86.7	Confident	15 Å²	15	51.4 Å²	51.4	8%	0.079	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	122.7	162.3	-179.9	67.5	0	0	0	108.6	A295 M298 I307 V312 I321 T323	A295-L309 HydrophobicContact CB-CD2 4.26Å; M298-L309 HydrophobicContact CB-CD2 3.97Å; I307-L309 PolarHBondContact O-N 3.47Å; L309-V312 HydrophobicContact CD1-CG1 4.23Å; L309-I321 HydrophobicContact CD1-CG2 3.38Å; L309-T323 HydrophobicContact CD1-CG2 4.39Å
310	Y	86.8	Confident	87.4	Confident	21 Å²	21	49.8 Å²	49.8	8%	0.082	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	-50.7	177.7	-75.1	-22.7	0	0	0	112.3	Q232 L236 V276 Q308 I322 E324	Q232-Y310 PolarHBondContact NE2-OH 3.41Å; L236-Y310 HydrophobicContact CD1-CD2 4.44Å; L236-Y310 HydrophobicContact CD1-CG 4.39Å; L236-Y310 HydrophobicContact CD2-CD2 3.6Å; L236-Y310 HydrophobicContact CD2-CE2 3.92Å; L236-Y310 HydrophobicContact CD2-CG 4.05Å; L236-Y310 HydrophobicContact CG-CD2 3.93Å; L236-Y310 HydrophobicContact CG-CG 3.86Å; V276-Y310 HydrophobicContact CG1-CD2 3.96Å; V276-Y310 HydrophobicContact CG1-CE2 4.14Å; Q308-Y310 HydrophobicContact CB-CD1 4.45Å; Q308-Y310 HydrophobicContact CB-CE1 4.24Å; Q308-Y310 HydrophobicContact CG-CD1 3.84Å; Q308-Y310 HydrophobicContact CG-CE1 3.86Å; Q308-Y310 PolarHBondContact O-N 3.07Å; Y310-I322 WeakPolarHBondContact CB-O 3.47Å; Y310-I322 HydrophobicContact CD2-CG2 4.43Å; Y310-I322 PolarHBondContact N-O 2.86Å; Y310-E324 HydrophobicContact CE2-CB 4.05Å
311	A	88.6	Confident	87.9	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	170.7	-172.3	0	0	0	0	0	110.6	L236 W244 I246 I322	L236-A311 HydrophobicContact CD1-CB 4.16Å; W244-A311 CarbonylContact O-C 3.53Å; W244-A311 WeakPolarHBondContact O-CA 3.24Å; W244-A311 WeakPolarHBondContact O-CB 3.37Å; I246-A311 HydrophobicContact CB-CB 4.47Å; I246-A311 HydrophobicContact CD1-CB 3.67Å; I246-A311 HydrophobicContact CG1-CB 3.86Å; I246-A311 HydrophobicContact CG2-CB 3.86Å; A311-I322 HydrophobicContact CB-CB 4.22Å; A311-I322 HydrophobicContact CB-CD1 4.3Å; A311-I322 PolarHBondContact N-O 3.17Å; A311-I322 WeakPolarHBondContact O-CA 3.37Å; A311-I322 WeakPolarHBondContact O-CB 3.28Å; A311-I322 WeakPolarHBondContact O-CD1 3.49Å; A311-I322 PolarHBondContact O-N 2.89Å
312	V	88.7	Confident	88.2	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	162.9	165.8	-57	0	0	0	0	111.3	W244 E245 I246 F291 L309 T314 Y320	W244-V312 HydrophobicContact CD2-CG2 4.2Å; W244-V312 HydrophobicContact CE3-CB 3.96Å; W244-V312 HydrophobicContact CE3-CG1 3.73Å; W244-V312 HydrophobicContact CE3-CG2 3.27Å; W244-V312 HydrophobicContact CH2-CG1 4.48Å; W244-V312 HydrophobicContact CH2-CG2 3.62Å; W244-V312 HydrophobicContact CZ2-CG2 4.45Å; W244-V312 HydrophobicContact CZ3-CB 3.68Å; W244-V312 HydrophobicContact CZ3-CG1 3.34Å; W244-V312 HydrophobicContact CZ3-CG2 2.95Å; W244-V312 PolarHBondContact O-N 2.77Å; E245-V312 WeakPolarHBondContact CA-O 3.4Å; E245-V312 VanDerWaalsContact OE2-CG2 3.25Å; E245-V312 WeakPolarHBondContact OE2-CG2 3.45Å; I246-V312 PolarHBondContact N-O 2.66Å; F291-V312 HydrophobicContact CE1-CB 4.07Å; F291-V312 HydrophobicContact CE1-CG1 3.8Å; F291-V312 HydrophobicContact CE1-CG2 4.32Å; F291-V312 HydrophobicContact CZ-CB 4.5Å; F291-V312 HydrophobicContact CZ-CG1 3.86Å; L309-V312 HydrophobicContact CD1-CG1 4.23Å; V312-T314 HydrophobicContact CB-CG2 4.14Å; V312-T314 HydrophobicContact CG2-CG2 3.55Å; V312-Y320 CarbonylContact C-O 3.55Å; V312-Y320 WeakPolarHBondContact CA-O 3.4Å; V312-Y320 VanDerWaalsContact CB-O 3.25Å; V312-Y320 WeakPolarHBondContact CB-O 3.41Å
313	C	89.1	Confident	88.6	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.014	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	104.3	162.9	-44.3	0	0	0	0	108.3	E245 I246 R248 I319 Y320	E245-C313 WeakPolarHBondContact OE1-CA 3.39Å; I246-C313 PolarHBondContact O-SG 3.19Å; R248-C313 HydrophobicContact CB-CB 4.46Å; C313-I319 WeakPolarHBondContact O-CA 3.4Å; C313-Y320 HydrophobicContact CB-CG 4.46Å; C313-Y320 PolarHBondContact N-O 2.86Å; C313-Y320 PolarHBondContact O-N 3.31Å
314	T	84.5	Confident	88.6	Confident	24 Å²	24	35.4 Å²	35.4	15%	0.147	18%	0.183	C	C	.	.			trans	-113.3	-14.7	-178.1	62.8	0	0	0	0	113.6	E245 F291 L292 V312 E316 I319	E245-T314 VanDerWaalsContact CD-OG1 3.31Å; E245-T314 PolarHBondContact OE1-N 2.89Å; E245-T314 PolarHBondContact OE1-OG1 2.79Å; E245-T314 PolarHBondContact OE2-N 3.35Å; E245-T314 PolarHBondContact OE2-OG1 2.78Å; F291-T314 HydrophobicContact CD1-CG2 3.53Å; F291-T314 HydrophobicContact CE1-CG2 3.52Å; L292-T314 HydrophobicContact CD2-CG2 3.95Å; V312-T314 HydrophobicContact CB-CG2 4.14Å; V312-T314 HydrophobicContact CG2-CG2 3.55Å; T314-E316 PolarHBondContact O-N 2.85Å; T314-E316 VanDerWaalsContact O-N 3.16Å; T314-I319 HydrophobicContact CG2-CG2 3.89Å
315	L	81.5	Confident	88.8	Confident	143 Å²	143	32.7 Å²	32.7	75%	0.749	16%	0.164	S	C	*	.	S	Bend	trans	-62.2	-22.2	-179.8	-66.1	177.2	0	0	0	114.3	E245	E245-L315 HydrophobicContact CG-CD1 4.29Å; E245-L315 HydrophobicContact CG-CG 4.14Å; E245-L315 WeakPolarHBondContact OE1-CG 3.26Å; E245-L315 PolarHBondContact OE1-N 3Å; E245-L315 VanDerWaalsContact OE1-N 3.15Å
316	E	82.9	Confident	88.7	Confident	121 Å²	121	31.3 Å²	31.3	57%	0.565	16%	0.158	S	C	*	.	S	Bend	trans	-137.9	150.4	-179.8	-62.3	174.8	175.9	0	0	109.8	R248 T314	R248-E316 IonicContact NE-OE2 2.67Å; R248-E316 PolarHBondContact NE-OE2 2.75Å; R248-E316 PolarHBondContact NH2-O 3.26Å; T314-E316 PolarHBondContact O-N 2.85Å; T314-E316 VanDerWaalsContact O-N 3.16Å
317	E	83	Confident	88.6	Confident	120 Å²	120	37 Å²	37	56%	0.561	18%	0.183	S	C	*	.	S	Bend	trans	-82.7	151.4	168.2	-73.4	-162.8	150.1	0	0	112.1	P283	P283-E317 VanDerWaalsContact CB-OE2 3.3Å; P283-E317 WeakPolarHBondContact CB-OE2 3.36Å
318	P	87.3	Confident	88.6	Confident	47 Å²	47	40.6 Å²	40.6	31%	0.305	20%	0.199	S	C	.	.	S	Bend	cis	-77	139.8	-6.9	29.6	-32.6	0	0	0	111.9	R248 L281 Y320	R248-P318 VanDerWaalsContact CZ-O 3.29Å; R248-P318 PolarHBondContact NH1-O 3.37Å; R248-P318 PolarHBondContact NH2-O 2.67Å; L281-P318 WeakPolarHBondContact O-CB 3.37Å; P318-Y320 HydrophobicContact CG-CE1 4.05Å; P318-Y320 VanDerWaalsContact O-CD1 3.25Å; P318-Y320 WeakPolarHBondContact O-CD1 3.21Å; P318-Y320 PolarHBondContact O-N 3.25Å
319	I	86.6	Confident	88.9	Confident	10 Å²	10	40.7 Å²	40.7	5%	0.051	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-55.1	134.4	179.5	-62.2	177	0	0	0	110.4	T280 L281 F291 C313 T314	T280-I319 WeakPolarHBondContact CA-O 3.31Å; L281-I319 HydrophobicContact CB-CB 4.29Å; L281-I319 HydrophobicContact CD1-CB 4.33Å; L281-I319 HydrophobicContact CD1-CG2 4.3Å; L281-I319 PolarHBondContact N-O 3.4Å; F291-I319 HydrophobicContact CB-CD1 4.49Å; F291-I319 HydrophobicContact CD1-CD1 4.31Å; F291-I319 HydrophobicContact CD1-CG2 3.97Å; F291-I319 HydrophobicContact CE1-CG2 3.61Å; F291-I319 HydrophobicContact CE2-CG2 4.38Å; F291-I319 HydrophobicContact CG-CD1 4.32Å; F291-I319 HydrophobicContact CG-CG2 4.5Å; F291-I319 HydrophobicContact CZ-CG2 3.86Å; C313-I319 WeakPolarHBondContact O-CA 3.4Å; T314-I319 HydrophobicContact CG2-CG2 3.89Å
320	Y	91	Very high	89.3	Confident	27 Å²	27	40.8 Å²	40.8	11%	0.106	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	135.1	173.1	-71.8	-1.5	0	0	0	111.2	R248 I251 L253 V278 K279 T280 V312 C313 P318	R248-Y320 HydrophobicContact CG-CE2 4.14Å; R248-Y320 PolarHBondContact NH1-OH 2.95Å; I251-Y320 HydrophobicContact CG2-CD2 4.46Å; I251-Y320 HydrophobicContact CG2-CE2 4.47Å; L253-Y320 HydrophobicContact CD1-CE2 4.33Å; L253-Y320 VanDerWaalsContact CD1-OH 3.23Å; L253-Y320 WeakPolarHBondContact CD1-OH 3.27Å; L253-Y320 HydrophobicContact CD2-CE2 4.11Å; L253-Y320 HydrophobicContact CG-CE2 4.24Å; V278-Y320 HydrophobicContact CG1-CD1 4.1Å; V278-Y320 HydrophobicContact CG1-CD2 3.59Å; V278-Y320 HydrophobicContact CG1-CE2 4.12Å; V278-Y320 HydrophobicContact CG1-CG 3.59Å; K279-Y320 CarbonylContact O-C 3.52Å; K279-Y320 WeakPolarHBondContact O-CA 3.23Å; T280-Y320 HydrophobicContact CG2-CD1 3.71Å; T280-Y320 HydrophobicContact CG2-CE1 3.37Å; V312-Y320 CarbonylContact C-O 3.55Å; V312-Y320 WeakPolarHBondContact CA-O 3.4Å; V312-Y320 VanDerWaalsContact CB-O 3.25Å; V312-Y320 WeakPolarHBondContact CB-O 3.41Å; C313-Y320 HydrophobicContact CB-CG 4.46Å; C313-Y320 PolarHBondContact N-O 2.86Å; C313-Y320 PolarHBondContact O-N 3.31Å; P318-Y320 HydrophobicContact CG-CE1 4.05Å; P318-Y320 VanDerWaalsContact O-CD1 3.25Å; P318-Y320 WeakPolarHBondContact O-CD1 3.21Å; P318-Y320 PolarHBondContact O-N 3.25Å
321	I	89.8	Confident	89.9	Confident	5 Å²	5	39.8 Å²	39.8	3%	0.026	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	119	167.7	-40.6	-172.3	0	0	0	107.1	V278 K279 L281 F291 L309 T323 L392	V278-I321 WeakPolarHBondContact CA-O 3.41Å; K279-I321 HydrophobicContact CB-CB 4.2Å; K279-I321 HydrophobicContact CD-CD1 4.5Å; K279-I321 PolarHBondContact N-O 3.45Å; K279-I321 PolarHBondContact O-N 2.79Å; L281-I321 HydrophobicContact CD1-CD1 4.34Å; L281-I321 HydrophobicContact CD2-CD1 4.38Å; L281-I321 HydrophobicContact CG-CD1 4.37Å; F291-I321 HydrophobicContact CE2-CD1 3.55Å; F291-I321 HydrophobicContact CE2-CG1 3.92Å; F291-I321 HydrophobicContact CZ-CD1 3.85Å; F291-I321 HydrophobicContact CZ-CG1 3.71Å; L309-I321 HydrophobicContact CD1-CG2 3.38Å; I321-T323 HydrophobicContact CG2-CG2 4.31Å; I321-L392 HydrophobicContact CD1-CD1 4.22Å; I321-L392 HydrophobicContact CD1-CD2 3.75Å
322	I	92.4	Very high	90.3	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	118.7	-176.5	-57.9	85.2	0	0	0	107.9	I246 I251 V276 A277 Y310 A311	I246-I322 HydrophobicContact CD1-CD1 4.13Å; I246-I322 HydrophobicContact CD1-CG1 4.28Å; I246-I322 HydrophobicContact CG1-CD1 4.42Å; I251-I322 HydrophobicContact CD1-CG1 4.15Å; I251-I322 HydrophobicContact CD1-CG2 4.48Å; I251-I322 HydrophobicContact CG1-CG1 4.39Å; V276-I322 HydrophobicContact CB-CG2 3.69Å; V276-I322 HydrophobicContact CG1-CG2 3.81Å; V276-I322 HydrophobicContact CG2-CG2 3.89Å; A277-I322 WeakPolarHBondContact O-CA 3.44Å; Y310-I322 WeakPolarHBondContact CB-O 3.47Å; Y310-I322 HydrophobicContact CD2-CG2 4.43Å; Y310-I322 PolarHBondContact N-O 2.86Å; A311-I322 HydrophobicContact CB-CB 4.22Å; A311-I322 HydrophobicContact CB-CD1 4.3Å; A311-I322 PolarHBondContact N-O 3.17Å; A311-I322 WeakPolarHBondContact O-CA 3.37Å; A311-I322 WeakPolarHBondContact O-CB 3.28Å; A311-I322 WeakPolarHBondContact O-CD1 3.49Å; A311-I322 PolarHBondContact O-N 2.89Å
323	T	92.3	Very high	90.6	Very high	24 Å²	24	46.8 Å²	46.8	15%	0.147	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	173.3	177.2	67.3	0	0	0	0	110.3	A277 I307 Q308 L309 I321	A277-T323 PolarHBondContact N-O 3.47Å; A277-T323 PolarHBondContact O-N 2.89Å; I307-T323 HydrophobicContact CG2-CG2 3.89Å; Q308-T323 WeakPolarHBondContact O-CA 3.41Å; Q308-T323 WeakPolarHBondContact O-CB 3.46Å; L309-T323 HydrophobicContact CD1-CG2 4.39Å; I321-T323 HydrophobicContact CG2-CG2 4.31Å
324	E	90.4	Very high	91	Very high	10 Å²	10	48.8 Å²	48.8	5%	0.047	25%	0.245	C	C	.	.			trans	-57.1	148.9	165.4	65.5	-178.5	121.9	0	0	112.8	Q232 I307 Q308 Y310 M326 K386	Q232-E324 PolarHBondContact NE2-OE2 3.11Å; Q232-E324 PolarHBondContact OE1-OE2 2.95Å; I307-E324 HydrophobicContact CD1-CG 3.87Å; I307-E324 HydrophobicContact CG2-CG 4.23Å; Q308-E324 PolarHBondContact N-OE1 2.87Å; Q308-E324 PolarHBondContact O-N 3.39Å; Y310-E324 HydrophobicContact CE2-CB 4.05Å; E324-M326 HydrophobicContact CG-SD 4.42Å; E324-K386 VanDerWaalsContact OE1-CD 3.3Å; E324-K386 WeakPolarHBondContact OE1-CD 3.39Å; E324-K386 IonicContact OE1-NZ 2.76Å; E324-K386 PolarHBondContact OE1-NZ 3.48Å; E324-K386 IonicContact OE2-NZ 2.7Å; E324-K386 PolarHBondContact OE2-NZ 3.38Å
325	L	93.2	Very high	91.6	Very high	37 Å²	37	47.6 Å²	47.6	19%	0.194	24%	0.238	C	C	.	.			trans	-93.6	119.4	176.6	-178.9	64.6	0	0	0	110.3	L257 K267 E275 A277	L257-L325 HydrophobicContact CD1-CD1 3.66Å; K267-L325 HydrophobicContact CD-CD2 4.09Å; K267-L325 HydrophobicContact CG-CD2 3.99Å; E275-L325 HydrophobicContact CB-CD2 3.98Å; A277-L325 HydrophobicContact CB-CD1 4.13Å
326	M	93.6	Very high	92.3	Very high	17 Å²	17	46 Å²	46	8%	0.084	22%	0.222	C	C	.	.			trans	-98	110.3	177.8	-63.2	-66.5	-79.9	0	0	110.2	I307 E324 H328 G329 L378 V379 K386	I307-M326 HydrophobicContact CD1-CE 4.38Å; I307-M326 HydrophobicContact CD1-CG 3.56Å; I307-M326 HydrophobicContact CD1-SD 4Å; E324-M326 HydrophobicContact CG-SD 4.42Å; M326-H328 PolarHBondContact O-N 3.16Å; M326-H328 VanDerWaalsContact O-N 3.1Å; M326-G329 PolarHBondContact O-N 3.09Å; M326-G329 VanDerWaalsContact O-N 3.1Å; M326-L378 HydrophobicContact CB-CB 3.7Å; M326-L378 HydrophobicContact CB-CD1 4.19Å; M326-L378 HydrophobicContact CE-CB 4.29Å; M326-L378 WeakPolarHBondContact CE-O 3.38Å; M326-L378 HydrophobicContact CG-CB 3.59Å; M326-L378 HydrophobicContact CG-CD1 3.9Å; M326-L378 HydrophobicContact CG-CG 4.4Å; M326-V379 CarbonylContact C-O 3.57Å; M326-K386 HydrophobicContact CE-CB 4.01Å; M326-K386 HydrophobicContact CE-CD 3.94Å; M326-K386 HydrophobicContact CE-CG 3.81Å; M326-K386 HydrophobicContact SD-CD 4.07Å
327	K	91	Very high	92.9	Very high	123 Å²	123	49.1 Å²	49.1	54%	0.535	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-24.8	-166.6	-66.3	-170.6	-173.7	168.8	0	115.1	E381	K327-E381 HydrophobicContact CD-CG 3.73Å; K327-E381 VanDerWaalsContact CD-OE1 3.31Å; K327-E381 WeakPolarHBondContact CD-OE1 3.18Å; K327-E381 WeakPolarHBondContact CE-OE1 3.3Å; K327-E381 WeakPolarHBondContact CE-OE2 3.23Å; K327-E381 HydrophobicContact CG-CG 4.47Å; K327-E381 IonicContact NZ-OE1 2.77Å; K327-E381 PolarHBondContact NZ-OE1 3.18Å; K327-E381 IonicContact NZ-OE2 2.73Å; K327-E381 PolarHBondContact NZ-OE2 3.41Å
328	H	93.3	Very high	93.4	Very high	83 Å²	83	44.8 Å²	44.8	38%	0.384	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	8.4	-177.8	-61.5	-32.6	0	0	0	113.8	M326 Y334 V379 G380	M326-H328 PolarHBondContact O-N 3.16Å; M326-H328 VanDerWaalsContact O-N 3.1Å; H328-Y334 HydrophobicContact CB-CD2 3.68Å; H328-Y334 HydrophobicContact CB-CE2 3.91Å; H328-Y334 AromaticContact CD2-CE2 3.84Å; H328-Y334 AromaticContact CG-CE2 3.89Å; H328-V379 WeakPolarHBondContact CA-O 3.33Å; H328-V379 HydrophobicContact CB-CB 3.96Å; H328-V379 HydrophobicContact CB-CG1 4.03Å; H328-V379 WeakPolarHBondContact CB-O 3.35Å; H328-V379 PolarHBondContact N-O 3.25Å; H328-G380 PolarHBondContact CD2-O 2.84Å
329	G	94.3	Very high	93.5	Very high	26 Å²	26	50.6 Å²	50.6	27%	0.268	24%	0.235	S	C	.	.			trans	67.7	-146.7	175.2	0	0	0	0	0	112.4	M326 L378 V379	M326-G329 PolarHBondContact O-N 3.09Å; M326-G329 VanDerWaalsContact O-N 3.1Å; G329-L378 CarbonylContact O-C 3.42Å; G329-L378 VanDerWaalsContact O-CA 3.3Å; G329-L378 WeakPolarHBondContact O-CA 3.43Å; G329-V379 PolarHBondContact O-N 3.48Å
330	S	95.9	Very high	93.4	Very high	16 Å²	16	51.8 Å²	51.8	11%	0.112	25%	0.25	C	C	.	.	B	Isolated β-bridge	trans	-75.1	145.8	-178.8	70.3	0	0	0	0	112.4	L332 E333 Y334 V377	S330-L332 PolarHBondContact O-N 3.43Å; S330-E333 PolarHBondContact O-N 3.3Å; S330-E333 VanDerWaalsContact O-N 3.11Å; S330-E333 WeakPolarHBondContact OG-CG 3.45Å; S330-E333 PolarHBondContact OG-N 3.42Å; S330-E333 PolarHBondContact OG-OE2 3.42Å; S330-Y334 WeakPolarHBondContact O-CB 3.32Å; S330-Y334 PolarHBondContact O-N 3.09Å; S330-V377 CarbonylContact C-O 3.59Å; S330-V377 WeakPolarHBondContact CA-O 3.21Å
331	L	97.9	Very high	93.3	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-57.2	-35.3	174.7	176.7	63.6	0	0	0	111.2	E333 Y334 L335 M351 I355 A374 V377 V379 L439 I443	L331-E333 PolarHBondContact O-N 3.17Å; L331-Y334 PolarHBondContact O-N 2.99Å; L331-L335 HydrophobicContact CD1-CD1 3.95Å; L331-L335 HydrophobicContact CD1-CD2 4.33Å; L331-L335 HydrophobicContact CD1-CG 3.82Å; L331-L335 HydrophobicContact CD2-CD1 4.49Å; L331-L335 HydrophobicContact CG-CD1 3.79Å; L331-L335 HydrophobicContact CG-CG 4.16Å; L331-L335 WeakPolarHBondContact O-CB 3.34Å; L331-L335 WeakPolarHBondContact O-CD1 3.31Å; L331-L335 WeakPolarHBondContact O-CG 3.1Å; L331-L335 PolarHBondContact O-N 3.19Å; L331-M351 HydrophobicContact CD1-SD 3.67Å; L331-I355 HydrophobicContact CD2-CD1 3.77Å; L331-A374 WeakPolarHBondContact CB-O 3.42Å; L331-A374 PolarHBondContact N-O 3.29Å; L331-V377 HydrophobicContact CB-CB 3.91Å; L331-V377 HydrophobicContact CB-CG1 4.02Å; L331-V377 HydrophobicContact CD2-CB 4.04Å; L331-V377 HydrophobicContact CD2-CG1 3.91Å; L331-V377 PolarHBondContact N-O 3.38Å; L331-V379 HydrophobicContact CB-CG2 3.81Å; L331-V379 HydrophobicContact CD1-CG2 3.76Å; L331-V379 HydrophobicContact CG-CG2 4.4Å; L331-L439 HydrophobicContact CD2-CD1 4.3Å; L331-I443 HydrophobicContact CD2-CD1 4.18Å; L331-I443 HydrophobicContact CD2-CG1 4.02Å
332	L	97	Very high	93.2	Very high	24 Å²	24	58.2 Å²	58.2	13%	0.126	31%	0.305	C	S	.	.	H	α-helix	trans	-57.7	-49.1	175.2	-178.9	62.8	0	0	0	112.5	S330 R336 A374 R375	S330-L332 PolarHBondContact O-N 3.43Å; L332-R336 WeakPolarHBondContact O-CB 3.37Å; L332-R336 VanDerWaalsContact O-CG 3.23Å; L332-R336 WeakPolarHBondContact O-CG 3.21Å; L332-R336 PolarHBondContact O-N 3.21Å; L332-A374 HydrophobicContact CB-CB 3.98Å; L332-A374 HydrophobicContact CD1-CB 4.35Å; L332-A374 PolarHBondContact N-O 3.21Å; L332-A374 VanDerWaalsContact N-O 3.07Å; L332-R375 HydrophobicContact CB-CB 4.42Å; L332-R375 HydrophobicContact CD2-CB 4.05Å
333	E	96.1	Very high	93.2	Very high	124 Å²	124	58.7 Å²	58.7	58%	0.579	31%	0.308	S	S	*	.	H	α-helix	trans	-70.5	-39.3	179.1	-72.2	171.5	159.7	0	0	111.2	S330 L331 R336 K337	S330-E333 PolarHBondContact O-N 3.3Å; S330-E333 VanDerWaalsContact O-N 3.11Å; S330-E333 WeakPolarHBondContact OG-CG 3.45Å; S330-E333 PolarHBondContact OG-N 3.42Å; S330-E333 PolarHBondContact OG-OE2 3.42Å; L331-E333 PolarHBondContact O-N 3.17Å; E333-R336 PolarHBondContact O-N 3.28Å; E333-K337 VanDerWaalsContact O-CB 3.32Å; E333-K337 WeakPolarHBondContact O-CB 3.47Å; E333-K337 PolarHBondContact O-N 2.88Å
334	Y	97.1	Very high	93	Very high	43 Å²	43	66.2 Å²	66.2	17%	0.169	33%	0.333	C	S	.	.	H	α-helix	trans	-57.4	-52.6	177.2	-170.5	-110.4	0	0	0	112	H328 S330 L331 R336 K337 D338 L343 M351 V379 N383	H328-Y334 HydrophobicContact CB-CD2 3.68Å; H328-Y334 HydrophobicContact CB-CE2 3.91Å; H328-Y334 AromaticContact CD2-CE2 3.84Å; H328-Y334 AromaticContact CG-CE2 3.89Å; S330-Y334 WeakPolarHBondContact O-CB 3.32Å; S330-Y334 PolarHBondContact O-N 3.09Å; L331-Y334 PolarHBondContact O-N 2.99Å; Y334-R336 PolarHBondContact O-N 2.78Å; Y334-K337 PolarHBondContact O-N 2.92Å; Y334-D338 PolarHBondContact O-N 3.28Å; Y334-D338 VanDerWaalsContact O-N 3.15Å; Y334-L343 HydrophobicContact CD1-CD1 4.13Å; Y334-L343 HydrophobicContact CE1-CD1 3.82Å; Y334-L343 HydrophobicContact CE1-CD2 4.1Å; Y334-L343 HydrophobicContact CE1-CG 4.46Å; Y334-M351 HydrophobicContact CD1-CE 4.22Å; Y334-M351 HydrophobicContact CE1-CE 3.74Å; Y334-V379 HydrophobicContact CD1-CB 4.48Å; Y334-V379 HydrophobicContact CD1-CG1 4.01Å; Y334-V379 HydrophobicContact CD1-CG2 4.17Å; Y334-V379 HydrophobicContact CD2-CG1 4.32Å; Y334-V379 HydrophobicContact CE1-CG1 4.05Å; Y334-V379 HydrophobicContact CE2-CG1 4.38Å; Y334-V379 HydrophobicContact CG-CB 4.29Å; Y334-V379 HydrophobicContact CG-CG1 4.14Å; Y334-V379 HydrophobicContact CG-CG2 4.18Å; Y334-N383 WeakPolarHBondContact CE1-OD1 3.47Å; Y334-N383 VanDerWaalsContact CZ-OD1 3.29Å; Y334-N383 PolarHBondContact OH-OD1 2.93Å
335	L	97.3	Very high	93	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-59.8	-43.8	176.9	-72.6	169.6	0	0	0	112.3	L331 K337 D338 K339 L343 I443 F446	L331-L335 HydrophobicContact CD1-CD1 3.95Å; L331-L335 HydrophobicContact CD1-CD2 4.33Å; L331-L335 HydrophobicContact CD1-CG 3.82Å; L331-L335 HydrophobicContact CD2-CD1 4.49Å; L331-L335 HydrophobicContact CG-CD1 3.79Å; L331-L335 HydrophobicContact CG-CG 4.16Å; L331-L335 WeakPolarHBondContact O-CB 3.34Å; L331-L335 WeakPolarHBondContact O-CD1 3.31Å; L331-L335 WeakPolarHBondContact O-CG 3.1Å; L331-L335 PolarHBondContact O-N 3.19Å; L335-K337 VanDerWaalsContact C-N 3.32Å; L335-K337 PolarHBondContact O-N 2.98Å; L335-D338 PolarHBondContact O-N 3.03Å; L335-K339 PolarHBondContact O-N 3.27Å; L335-L343 HydrophobicContact CD2-CD1 4.1Å; L335-I443 HydrophobicContact CD1-CG1 4.25Å; L335-F446 HydrophobicContact CD2-CD1 4.24Å
336	R	96.8	Very high	92.6	Very high	109 Å²	109	71 Å²	71	41%	0.411	36%	0.358	S	S	.	.	H	α-helix	trans	-70.3	-27.5	-179.5	-77.1	176.5	174.8	177.2	2.7	113.6	L332 E333 Y334 K339 F446 G447	L332-R336 WeakPolarHBondContact O-CB 3.37Å; L332-R336 VanDerWaalsContact O-CG 3.23Å; L332-R336 WeakPolarHBondContact O-CG 3.21Å; L332-R336 PolarHBondContact O-N 3.21Å; E333-R336 PolarHBondContact O-N 3.28Å; Y334-R336 PolarHBondContact O-N 2.78Å; R336-K339 WeakPolarHBondContact O-CE 3.04Å; R336-K339 WeakPolarHBondContact O-CG 3.23Å; R336-F446 WeakPolarHBondContact CG-O 3.21Å; R336-G447 PolarHBondContact NE-O 2.59Å; R336-G447 PolarHBondContact NH2-O 3.16Å
337	K	95.8	Very high	92.4	Very high	186 Å²	186	71.7 Å²	71.7	81%	0.809	36%	0.362	S	S	*	.	H	α-helix	trans	-72.3	-43.3	175.1	-175.4	-179.9	176.9	-175	0	110.3	E333 Y334 L335	E333-K337 VanDerWaalsContact O-CB 3.32Å; E333-K337 WeakPolarHBondContact O-CB 3.47Å; E333-K337 PolarHBondContact O-N 2.88Å; Y334-K337 PolarHBondContact O-N 2.92Å; L335-K337 VanDerWaalsContact C-N 3.32Å; L335-K337 PolarHBondContact O-N 2.98Å
338	D	93.3	Very high	92.6	Very high	29 Å²	29	66.2 Å²	66.2	16%	0.155	34%	0.338	C	S	.	.	H	α-helix	trans	-71.2	-44.7	180	179.2	63.9	0	0	0	113.4	Y334 L335 G340 G341 T342 L343	Y334-D338 PolarHBondContact O-N 3.28Å; Y334-D338 VanDerWaalsContact O-N 3.15Å; L335-D338 PolarHBondContact O-N 3.03Å; D338-G340 PolarHBondContact O-N 3.26Å; D338-G340 VanDerWaalsContact OD2-CA 3.23Å; D338-G340 WeakPolarHBondContact OD2-CA 3.29Å; D338-G340 PolarHBondContact OD2-N 2.98Å; D338-G341 PolarHBondContact O-N 3.2Å; D338-G341 PolarHBondContact OD1-N 3.04Å; D338-G341 PolarHBondContact OD2-N 3.17Å; D338-G341 VanDerWaalsContact OD2-N 3.14Å; D338-T342 PolarHBondContact OD1-N 3.01Å; D338-T342 PolarHBondContact OD1-OG1 3.38Å; D338-L343 HydrophobicContact CB-CD1 3.93Å; D338-L343 HydrophobicContact CB-CG 4.21Å; D338-L343 WeakPolarHBondContact OD2-CB 3.4Å; D338-L343 PolarHBondContact OD2-N 3.02Å
339	K	88.3	Confident	92.5	Very high	169 Å²	169	62.2 Å²	62.2	74%	0.735	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	27.9	-178.2	-53.2	-176.1	180	172.6	0	114.6	L335 R336	L335-K339 PolarHBondContact O-N 3.27Å; R336-K339 WeakPolarHBondContact O-CE 3.04Å; R336-K339 WeakPolarHBondContact O-CG 3.23Å
340	G	85.5	Confident	92.3	Very high	35 Å²	35	62.2 Å²	62.2	36%	0.361	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.2	27.1	-177.1	0	0	0	0	0	113.2	D338 F446	D338-G340 PolarHBondContact O-N 3.26Å; D338-G340 VanDerWaalsContact OD2-CA 3.23Å; D338-G340 WeakPolarHBondContact OD2-CA 3.29Å; D338-G340 PolarHBondContact OD2-N 2.98Å; G340-F446 VanDerWaalsContact N-CD1 3.32Å
341	G	88.6	Confident	92.3	Very high	64 Å²	64	61.4 Å²	61.4	66%	0.66	31%	0.307	S	S	*	.	S	Bend	trans	-78.2	-51.4	176.3	0	0	0	0	0	111.8	D338	D338-G341 PolarHBondContact O-N 3.2Å; D338-G341 PolarHBondContact OD1-N 3.04Å; D338-G341 PolarHBondContact OD2-N 3.17Å; D338-G341 VanDerWaalsContact OD2-N 3.14Å
342	T	88.3	Confident	92.3	Very high	104 Å²	104	61.4 Å²	61.4	64%	0.638	31%	0.307	S	S	*	.	S	Bend	trans	-114.3	-36.1	-179.5	70	0	0	0	0	112.6	D338 R344	D338-T342 PolarHBondContact OD1-N 3.01Å; D338-T342 PolarHBondContact OD1-OG1 3.38Å; T342-R344 PolarHBondContact O-N 3.33Å
343	L	90.7	Very high	92.2	Very high	10 Å²	10	60.8 Å²	60.8	5%	0.052	31%	0.305	C	S	.	.			trans	-71.5	124.3	-177.4	-64.9	174.4	0	0	0	110.9	Y334 L335 D338 D347 M351 F446	Y334-L343 HydrophobicContact CD1-CD1 4.13Å; Y334-L343 HydrophobicContact CE1-CD1 3.82Å; Y334-L343 HydrophobicContact CE1-CD2 4.1Å; Y334-L343 HydrophobicContact CE1-CG 4.46Å; L335-L343 HydrophobicContact CD2-CD1 4.1Å; D338-L343 HydrophobicContact CB-CD1 3.93Å; D338-L343 HydrophobicContact CB-CG 4.21Å; D338-L343 WeakPolarHBondContact OD2-CB 3.4Å; D338-L343 PolarHBondContact OD2-N 3.02Å; L343-D347 HydrophobicContact CD2-CB 4Å; L343-M351 HydrophobicContact CD1-CE 4.04Å; L343-M351 HydrophobicContact CD2-CE 3.64Å; L343-M351 HydrophobicContact CG-CE 4.48Å; L343-F446 HydrophobicContact CB-CE1 4.1Å
344	R	89.6	Confident	92.2	Very high	181 Å²	181	55.7 Å²	55.7	68%	0.683	28%	0.281	S	S	*	.			trans	-95.3	169.4	176.1	-57.3	-179.1	-174.2	173.3	4.2	110.2	T342 Q346 D347 Q348	T342-R344 PolarHBondContact O-N 3.33Å; R344-Q346 PolarHBondContact O-N 3.41Å; R344-D347 PolarHBondContact N-OD2 3.25Å; R344-D347 WeakPolarHBondContact O-CB 3.38Å; R344-D347 PolarHBondContact O-N 3.41Å; R344-D347 VanDerWaalsContact O-N 3.08Å; R344-Q348 WeakPolarHBondContact O-CG 3.43Å; R344-Q348 PolarHBondContact O-N 2.92Å; R344-Q348 VanDerWaalsContact O-N 3.08Å
345	V	89.2	Confident	92.3	Very high	42 Å²	42	53.7 Å²	53.7	26%	0.255	27%	0.273	S	S	.	.	H	α-helix	trans	-56.6	-37.8	176.2	173.9	0	0	0	0	111.1	D347 Q348 I349 P476	V345-D347 PolarHBondContact O-N 2.58Å; V345-Q348 WeakPolarHBondContact O-CB 3.46Å; V345-Q348 PolarHBondContact O-N 3.1Å; V345-I349 HydrophobicContact CG1-CD1 3.79Å; V345-I349 HydrophobicContact CG1-CG1 4.24Å; V345-I349 VanDerWaalsContact O-CG1 3.24Å; V345-I349 WeakPolarHBondContact O-CG1 3.37Å; V345-I349 PolarHBondContact O-N 2.83Å; V345-P476 HydrophobicContact CG1-CG 3.52Å
346	Q	85.9	Confident	92.3	Very high	107 Å²	107	53.7 Å²	53.7	50%	0.5	27%	0.273	S	S	.	.	H	α-helix	trans	-58.8	-47.2	175.9	-68.3	81.1	1.1	0	0	111.8	R344 Q348 I349 E350 F508	R344-Q346 PolarHBondContact O-N 3.41Å; Q346-Q348 VanDerWaalsContact C-N 3.31Å; Q346-Q348 PolarHBondContact O-N 2.62Å; Q346-I349 PolarHBondContact O-N 3.45Å; Q346-E350 WeakPolarHBondContact O-CB 3.41Å; Q346-E350 PolarHBondContact O-N 2.93Å; Q346-F508 HydrophobicContact CB-CE1 4.23Å; Q346-F508 HydrophobicContact CG-CE1 4.44Å
347	D	89.2	Confident	92.3	Very high	30 Å²	30	49 Å²	49	16%	0.16	26%	0.258	C	S	.	.	H	α-helix	trans	-60.9	-42.1	177.1	-56.1	-64.7	0	0	0	111.1	K145 L343 R344 V345 I349 E350 M351	K145-D347 IonicContact NZ-OD1 2.9Å; L343-D347 HydrophobicContact CD2-CB 4Å; R344-D347 PolarHBondContact N-OD2 3.25Å; R344-D347 WeakPolarHBondContact O-CB 3.38Å; R344-D347 PolarHBondContact O-N 3.41Å; R344-D347 VanDerWaalsContact O-N 3.08Å; V345-D347 PolarHBondContact O-N 2.58Å; D347-I349 PolarHBondContact O-N 2.62Å; D347-E350 PolarHBondContact O-N 3.05Å; D347-M351 VanDerWaalsContact O-CG 3.25Å; D347-M351 WeakPolarHBondContact O-CG 3.43Å; D347-M351 PolarHBondContact O-N 3.43Å
348	Q	94.1	Very high	92.4	Very high	8 Å²	8	40.1 Å²	40.1	4%	0.037	22%	0.22	C	C	.	.	H	α-helix	trans	-62.1	-41.7	178.1	-69.5	174.5	-76.2	0	0	112.4	R344 V345 Q346 A352 I443 M444	R344-Q348 WeakPolarHBondContact O-CG 3.43Å; R344-Q348 PolarHBondContact O-N 2.92Å; R344-Q348 VanDerWaalsContact O-N 3.08Å; V345-Q348 WeakPolarHBondContact O-CB 3.46Å; V345-Q348 PolarHBondContact O-N 3.1Å; Q346-Q348 VanDerWaalsContact C-N 3.31Å; Q346-Q348 PolarHBondContact O-N 2.62Å; Q348-A352 PolarHBondContact O-N 2.82Å; Q348-A352 VanDerWaalsContact O-N 3.13Å; Q348-I443 HydrophobicContact CB-CG2 3.64Å; Q348-I443 HydrophobicContact CG-CG2 4.07Å; Q348-I443 PolarHBondContact NE2-O 3.14Å; Q348-I443 WeakPolarHBondContact O-CG2 3.47Å; Q348-M444 HydrophobicContact CB-CE 4Å; Q348-M444 HydrophobicContact CB-SD 4.34Å
349	I	92.1	Very high	92.6	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-68.3	-39.5	177.7	-64.5	177.4	0	0	0	110.5	V345 Q346 D347 A352 A353 M444 M479 L504 Y507 F508	V345-I349 HydrophobicContact CG1-CD1 3.79Å; V345-I349 HydrophobicContact CG1-CG1 4.24Å; V345-I349 VanDerWaalsContact O-CG1 3.24Å; V345-I349 WeakPolarHBondContact O-CG1 3.37Å; V345-I349 PolarHBondContact O-N 2.83Å; Q346-I349 PolarHBondContact O-N 3.45Å; D347-I349 PolarHBondContact O-N 2.62Å; I349-A352 WeakPolarHBondContact O-CB 3.33Å; I349-A352 PolarHBondContact O-N 2.95Å; I349-A353 PolarHBondContact O-N 2.89Å; I349-M444 HydrophobicContact CG1-CE 3.77Å; I349-M479 HydrophobicContact CB-CE 4.39Å; I349-M479 HydrophobicContact CD1-CE 4.14Å; I349-M479 HydrophobicContact CG1-CE 3.65Å; I349-M479 HydrophobicContact CG2-CE 4.2Å; I349-L504 HydrophobicContact CG2-CD2 4.14Å; I349-Y507 HydrophobicContact CD1-CD1 3.4Å; I349-Y507 HydrophobicContact CD1-CD2 4.48Å; I349-Y507 HydrophobicContact CD1-CE1 3.18Å; I349-Y507 HydrophobicContact CD1-CE2 4.3Å; I349-Y507 HydrophobicContact CD1-CG 4.07Å; I349-Y507 HydrophobicContact CG2-CD1 4.26Å; I349-Y507 HydrophobicContact CG2-CG 4.43Å; I349-F508 HydrophobicContact CB-CE2 4.3Å; I349-F508 HydrophobicContact CB-CZ 3.78Å; I349-F508 HydrophobicContact CG2-CE2 3.56Å; I349-F508 HydrophobicContact CG2-CZ 3.56Å
350	E	90.4	Very high	93	Very high	25 Å²	25	30.8 Å²	30.8	12%	0.117	18%	0.178	C	C	.	.	H	α-helix	trans	-67.1	-41	178	-170.3	-178.9	142.5	0	0	112.2	K145 Q346 D347 A352 A353 Q354 F508	K145-E350 WeakPolarHBondContact CE-OE2 3.32Å; K145-E350 IonicContact NZ-OE1 3.96Å; K145-E350 PolarHBondContact NZ-OE1 3.14Å; K145-E350 IonicContact NZ-OE2 3.79Å; K145-E350 PolarHBondContact NZ-OE2 3.48Å; Q346-E350 WeakPolarHBondContact O-CB 3.41Å; Q346-E350 PolarHBondContact O-N 2.93Å; D347-E350 PolarHBondContact O-N 3.05Å; E350-A352 VanDerWaalsContact C-N 3.28Å; E350-A352 PolarHBondContact O-N 2.87Å; E350-A353 PolarHBondContact O-N 2.89Å; E350-Q354 VanDerWaalsContact O-CG 3.3Å; E350-Q354 WeakPolarHBondContact O-CG 3.38Å; E350-Q354 PolarHBondContact O-N 2.84Å; E350-F508 HydrophobicContact CB-CZ 4.14Å
351	M	96.1	Very high	93.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-57	-44.3	170.8	-68.3	175.8	-170.6	0	0	110.9	L331 Y334 L343 D347 Q354 I355 N383 C385	L331-M351 HydrophobicContact CD1-SD 3.67Å; Y334-M351 HydrophobicContact CD1-CE 4.22Å; Y334-M351 HydrophobicContact CE1-CE 3.74Å; L343-M351 HydrophobicContact CD1-CE 4.04Å; L343-M351 HydrophobicContact CD2-CE 3.64Å; L343-M351 HydrophobicContact CG-CE 4.48Å; D347-M351 VanDerWaalsContact O-CG 3.25Å; D347-M351 WeakPolarHBondContact O-CG 3.43Å; D347-M351 PolarHBondContact O-N 3.43Å; M351-Q354 PolarHBondContact O-N 2.79Å; M351-I355 WeakPolarHBondContact O-CD1 3.49Å; M351-I355 WeakPolarHBondContact O-CG1 3.3Å; M351-I355 PolarHBondContact O-N 2.71Å; M351-I355 VanDerWaalsContact O-N 3.09Å; M351-N383 HydrophobicContact CE-CB 3.84Å; M351-C385 VanDerWaalsContact CG-SG 3.55Å
352	A	97.7	Very high	93.8	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62	-43	175.9	0	0	0	0	0	112.5	Q348 I349 E350 I355 A356 L440 I443 L504	Q348-A352 PolarHBondContact O-N 2.82Å; Q348-A352 VanDerWaalsContact O-N 3.13Å; I349-A352 WeakPolarHBondContact O-CB 3.33Å; I349-A352 PolarHBondContact O-N 2.95Å; E350-A352 VanDerWaalsContact C-N 3.28Å; E350-A352 PolarHBondContact O-N 2.87Å; A352-I355 PolarHBondContact O-N 3.24Å; A352-A356 WeakPolarHBondContact O-CB 3.45Å; A352-A356 PolarHBondContact O-N 3.41Å; A352-L440 HydrophobicContact CB-CD2 3.43Å; A352-L440 VanDerWaalsContact CB-CD2 3.43Å; A352-I443 HydrophobicContact CB-CD1 4.17Å; A352-L504 HydrophobicContact CB-CD1 4.08Å; A352-L504 HydrophobicContact CB-CD2 4.16Å
353	A	95.1	Very high	94	Very high	10 Å²	10	24.6 Å²	24.6	8%	0.083	11%	0.114	C	C	.	.	H	α-helix	trans	-62	-44.1	177.6	0	0	0	0	0	111.7	I349 E350 I355 A356 A357 L504 E505	I349-A353 PolarHBondContact O-N 2.89Å; E350-A353 PolarHBondContact O-N 2.89Å; A353-I355 VanDerWaalsContact C-N 3.34Å; A353-I355 PolarHBondContact O-N 3.01Å; A353-A356 PolarHBondContact O-N 3.49Å; A353-A357 PolarHBondContact O-N 3.28Å; A353-L504 HydrophobicContact CB-CB 3.84Å; A353-E505 HydrophobicContact CB-CG 4.46Å
354	Q	95.8	Very high	94.1	Very high	18 Å²	18	29.9 Å²	29.9	8%	0.084	14%	0.138	C	C	.	.	H	α-helix	trans	-59.1	-43.9	175.5	-72.5	-175.9	67.6	0	0	111.9	K305 E350 M351 A357 G358 N383 C385	K305-Q354 VanDerWaalsContact CB-O 3.23Å; K305-Q354 WeakPolarHBondContact CB-O 3.22Å; K305-Q354 HydrophobicContact CD-CB 3.98Å; K305-Q354 HydrophobicContact CD-CG 4.15Å; K305-Q354 HydrophobicContact CG-CB 4.46Å; K305-Q354 WeakPolarHBondContact CG-O 3.39Å; E350-Q354 VanDerWaalsContact O-CG 3.3Å; E350-Q354 WeakPolarHBondContact O-CG 3.38Å; E350-Q354 PolarHBondContact O-N 2.84Å; M351-Q354 PolarHBondContact O-N 2.79Å; Q354-A357 PolarHBondContact O-N 2.84Å; Q354-G358 PolarHBondContact O-N 3.3Å; Q354-G358 VanDerWaalsContact O-N 3.17Å; Q354-N383 PolarHBondContact NE2-O 3.3Å; Q354-C385 HydrophobicContact CB-CB 4.15Å
355	I	98.5	Very high	94.2	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-67.8	-42.1	178	-63.2	155.1	0	0	0	110.9	L331 M351 A352 A353 A357 G358 M359 L372 V377 C385 V387 F436 L439 I443	L331-I355 HydrophobicContact CD2-CD1 3.77Å; M351-I355 WeakPolarHBondContact O-CD1 3.49Å; M351-I355 WeakPolarHBondContact O-CG1 3.3Å; M351-I355 PolarHBondContact O-N 2.71Å; M351-I355 VanDerWaalsContact O-N 3.09Å; A352-I355 PolarHBondContact O-N 3.24Å; A353-I355 VanDerWaalsContact C-N 3.34Å; A353-I355 PolarHBondContact O-N 3.01Å; I355-A357 VanDerWaalsContact C-N 3.31Å; I355-A357 PolarHBondContact O-N 3.25Å; I355-G358 PolarHBondContact O-N 2.9Å; I355-M359 HydrophobicContact CG2-CG 4.44Å; I355-M359 WeakPolarHBondContact O-CG 3.23Å; I355-M359 PolarHBondContact O-N 3.09Å; I355-L372 HydrophobicContact CG2-CD1 4.28Å; I355-V377 HydrophobicContact CD1-CB 4.5Å; I355-V377 HydrophobicContact CD1-CG1 3.88Å; I355-V377 HydrophobicContact CD1-CG2 4.09Å; I355-V377 HydrophobicContact CG1-CG1 3.85Å; I355-V377 HydrophobicContact CG1-CG2 4.14Å; I355-V377 HydrophobicContact CG2-CG2 4.41Å; I355-C385 HydrophobicContact CG1-CB 4.12Å; I355-V387 HydrophobicContact CG2-CG2 3.89Å; I355-F436 HydrophobicContact CB-CE2 4.2Å; I355-F436 HydrophobicContact CG2-CD2 4.16Å; I355-F436 HydrophobicContact CG2-CE2 3.89Å; I355-L439 HydrophobicContact CD1-CD2 4.11Å; I355-L439 HydrophobicContact CG2-CD2 3.72Å; I355-I443 HydrophobicContact CD1-CD1 3.97Å
356	A	98.3	Very high	94.1	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-59	-42.1	175.5	0	0	0	0	0	111.5	A352 A353 G358 M359 A360 F436 Q501 L504	A352-A356 WeakPolarHBondContact O-CB 3.45Å; A352-A356 PolarHBondContact O-N 3.41Å; A353-A356 PolarHBondContact O-N 3.49Å; A356-G358 PolarHBondContact O-N 3.09Å; A356-M359 CarbonylContact O-C 3.6Å; A356-M359 PolarHBondContact O-N 3.18Å; A356-A360 WeakPolarHBondContact O-CB 3.33Å; A356-A360 PolarHBondContact O-N 2.91Å; A356-F436 HydrophobicContact CB-CE2 4.19Å; A356-F436 HydrophobicContact CB-CZ 3.82Å; A356-Q501 HydrophobicContact CB-CB 4.09Å; A356-L504 HydrophobicContact CB-CD1 3.93Å
357	A	96.8	Very high	94.2	Very high	11 Å²	11	24 Å²	24	9%	0.091	12%	0.119	C	C	.	.	H	α-helix	trans	-61.2	-43.6	175.5	0	0	0	0	0	112.4	K305 A353 Q354 I355 M359 A360 Y361 Q501	K305-A357 HydrophobicContact CG-CB 4.37Å; A353-A357 PolarHBondContact O-N 3.28Å; Q354-A357 PolarHBondContact O-N 2.84Å; I355-A357 VanDerWaalsContact C-N 3.31Å; I355-A357 PolarHBondContact O-N 3.25Å; A357-M359 PolarHBondContact O-N 3.36Å; A357-A360 PolarHBondContact O-N 2.78Å; A357-Y361 PolarHBondContact O-N 3.01Å; A357-Y361 VanDerWaalsContact O-N 3.12Å; A357-Q501 HydrophobicContact CB-CG 4.22Å
358	G	96.8	Very high	94.1	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-60.9	-42.5	174.2	0	0	0	0	0	112.9	Q354 I355 A356 Y361 L362	Q354-G358 PolarHBondContact O-N 3.3Å; Q354-G358 VanDerWaalsContact O-N 3.17Å; I355-G358 PolarHBondContact O-N 2.9Å; A356-G358 PolarHBondContact O-N 3.09Å; G358-Y361 PolarHBondContact O-N 3.34Å; G358-L362 PolarHBondContact O-N 3.07Å
359	M	97.9	Very high	94	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.005	11%	0.114	C	C	.	.	H	α-helix	trans	-73.3	-30.9	178	-69	-60	-54.6	0	0	113.4	I355 A356 A357 Y361 L362 E363 H369 L372 V387 D432 F497	I355-M359 HydrophobicContact CG2-CG 4.44Å; I355-M359 WeakPolarHBondContact O-CG 3.23Å; I355-M359 PolarHBondContact O-N 3.09Å; A356-M359 CarbonylContact O-C 3.6Å; A356-M359 PolarHBondContact O-N 3.18Å; A357-M359 PolarHBondContact O-N 3.36Å; M359-Y361 VanDerWaalsContact C-N 3.33Å; M359-L362 HydrophobicContact CE-CD1 4.37Å; M359-L362 PolarHBondContact O-N 2.92Å; M359-L362 HydrophobicContact SD-CD1 3.87Å; M359-E363 WeakPolarHBondContact O-CB 3.43Å; M359-E363 PolarHBondContact O-N 2.89Å; M359-H369 HydrophobicContact CE-CB 3.81Å; M359-H369 HydrophobicContact SD-CB 4.2Å; M359-L372 HydrophobicContact CE-CD2 4.05Å; M359-L372 HydrophobicContact CG-CD1 4.32Å; M359-L372 HydrophobicContact CG-CD2 3.86Å; M359-L372 HydrophobicContact SD-CD1 3.96Å; M359-L372 HydrophobicContact SD-CD2 3.92Å; M359-L372 HydrophobicContact SD-CG 4.46Å; M359-V387 HydrophobicContact CG-CG2 4.48Å; M359-V387 HydrophobicContact SD-CG1 4.22Å; M359-D432 HydrophobicContact CE-CB 3.8Å; M359-F497 HydrophobicContact CB-CB 4.31Å; M359-F497 HydrophobicContact CB-CD1 3.36Å; M359-F497 HydrophobicContact CB-CD2 3.81Å; M359-F497 HydrophobicContact CB-CE1 3.4Å; M359-F497 VanDerWaalsContact CB-CE1 3.4Å; M359-F497 HydrophobicContact CB-CE2 3.86Å; M359-F497 HydrophobicContact CB-CG 3.57Å; M359-F497 HydrophobicContact CB-CZ 3.66Å; M359-F497 HydrophobicContact CE-CD2 4.46Å; M359-F497 HydrophobicContact CE-CE2 3.65Å; M359-F497 HydrophobicContact CE-CZ 3.69Å; M359-F497 HydrophobicContact CG-CD1 4.26Å; M359-F497 HydrophobicContact CG-CE1 3.81Å; M359-F497 HydrophobicContact CG-CE2 4.47Å; M359-F497 HydrophobicContact CG-CZ 3.93Å
360	A	97.4	Very high	93.8	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.008	12%	0.118	C	C	.	.	H	α-helix	trans	-64	-40.8	173	0	0	0	0	0	110.8	A356 A357 E363 Q364 F497	A356-A360 WeakPolarHBondContact O-CB 3.33Å; A356-A360 PolarHBondContact O-N 2.91Å; A357-A360 PolarHBondContact O-N 2.78Å; A360-E363 WeakPolarHBondContact O-CB 3.45Å; A360-E363 PolarHBondContact O-N 3.35Å; A360-Q364 WeakPolarHBondContact O-CG 3.42Å; A360-Q364 PolarHBondContact O-N 2.93Å; A360-F497 VanDerWaalsContact CA-CB 3.49Å; A360-F497 HydrophobicContact CB-CB 3.84Å
361	Y	96	Very high	93.7	Very high	37 Å²	37	24.3 Å²	24.3	15%	0.145	12%	0.119	C	C	.	.	H	α-helix	trans	-61.4	-46.1	171.2	175.1	-94.7	0	0	0	111.8	R300 L301 R302 H303 L306 A357 G358 M359 E363 Q364 Q365	R300-Y361 PolarHBondContact O-OH 3.37Å; L301-Y361 HydrophobicContact CB-CE1 4.18Å; L301-Y361 HydrophobicContact CD2-CE1 4.07Å; R302-Y361 PolarHBondContact N-OH 3.06Å; R302-Y361 VanDerWaalsContact O-CZ 3.29Å; R302-Y361 PolarHBondContact O-OH 2.96Å; H303-Y361 HydrophobicContact CB-CD1 3.66Å; H303-Y361 HydrophobicContact CB-CD2 4.17Å; H303-Y361 HydrophobicContact CB-CE1 4Å; H303-Y361 HydrophobicContact CB-CE2 4.49Å; H303-Y361 HydrophobicContact CB-CG 3.73Å; H303-Y361 AromaticContact CD2-CD2 3.93Å; H303-Y361 AromaticContact CD2-CG 3.84Å; H303-Y361 AromaticContact CG-CG 3.87Å; L306-Y361 HydrophobicContact CD1-CD1 3.58Å; L306-Y361 HydrophobicContact CD1-CE1 3.89Å; A357-Y361 PolarHBondContact O-N 3.01Å; A357-Y361 VanDerWaalsContact O-N 3.12Å; G358-Y361 PolarHBondContact O-N 3.34Å; M359-Y361 VanDerWaalsContact C-N 3.33Å; Y361-E363 VanDerWaalsContact C-N 3.31Å; Y361-E363 PolarHBondContact O-N 3.45Å; Y361-Q364 WeakPolarHBondContact O-CB 3.31Å; Y361-Q364 PolarHBondContact O-N 2.84Å; Y361-Q365 HydrophobicContact CD1-CG 4.23Å; Y361-Q365 HydrophobicContact CD2-CG 4.46Å; Y361-Q365 HydrophobicContact CE1-CG 3.79Å; Y361-Q365 HydrophobicContact CE2-CG 4.03Å; Y361-Q365 WeakPolarHBondContact O-CG 3.36Å; Y361-Q365 PolarHBondContact O-N 3.44Å
362	L	93.3	Very high	93.7	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-60.5	-39.4	175.6	-67.5	-177.7	0	0	0	112.4	L301 L306 G358 M359 Q365 N366 Y367 F390	L301-L362 HydrophobicContact CD1-CD2 3.76Å; L301-L362 HydrophobicContact CD2-CD2 4.15Å; L301-L362 HydrophobicContact CG-CD2 4.37Å; L306-L362 HydrophobicContact CD1-CD2 3.59Å; L306-L362 HydrophobicContact CD1-CG 4.01Å; L306-L362 HydrophobicContact CD2-CD1 4.12Å; L306-L362 HydrophobicContact CD2-CD2 4.47Å; L306-L362 HydrophobicContact CD2-CG 4.13Å; G358-L362 PolarHBondContact O-N 3.07Å; M359-L362 HydrophobicContact CE-CD1 4.37Å; M359-L362 PolarHBondContact O-N 2.92Å; M359-L362 HydrophobicContact SD-CD1 3.87Å; L362-Q365 CarbonylContact O-C 3.57Å; L362-Q365 PolarHBondContact O-N 2.83Å; L362-N366 PolarHBondContact O-N 2.85Å; L362-N366 VanDerWaalsContact O-N 3.16Å; L362-Y367 HydrophobicContact CD1-CD1 4.35Å; L362-Y367 HydrophobicContact CD2-CD1 3.97Å; L362-Y367 HydrophobicContact CD2-CG 4.32Å; L362-Y367 PolarHBondContact O-N 3.08Å; L362-F390 HydrophobicContact CD1-CB 4.14Å; L362-F390 HydrophobicContact CD1-CG 4.42Å; L362-F390 HydrophobicContact CD2-CD2 4.24Å
363	E	93.9	Very high	93.6	Very high	35 Å²	35	24.3 Å²	24.3	16%	0.164	12%	0.119	C	C	.	.	H	α-helix	trans	-58	-47.5	173.4	174.6	171.2	-122.4	0	0	111.5	M359 A360 Y361 Q365 N366 I429 T496 F497	M359-E363 WeakPolarHBondContact O-CB 3.43Å; M359-E363 PolarHBondContact O-N 2.89Å; A360-E363 WeakPolarHBondContact O-CB 3.45Å; A360-E363 PolarHBondContact O-N 3.35Å; Y361-E363 VanDerWaalsContact C-N 3.31Å; Y361-E363 PolarHBondContact O-N 3.45Å; E363-Q365 VanDerWaalsContact C-N 3.28Å; E363-Q365 PolarHBondContact O-N 3.12Å; E363-N366 PolarHBondContact O-N 3.33Å; E363-I429 HydrophobicContact CB-CG2 3.89Å; E363-I429 HydrophobicContact CG-CG2 3.82Å; E363-I429 WeakPolarHBondContact OE1-CG2 3.18Å; E363-T496 WeakPolarHBondContact OE2-CB 3.41Å; E363-F497 HydrophobicContact CB-CD2 4.49Å; E363-F497 PolarHBondContact OE2-N 3.42Å
364	Q	93.3	Very high	93.7	Very high	121 Å²	121	23.8 Å²	23.8	57%	0.565	12%	0.115	S	C	*	.	H	α-helix	trans	-62.1	-35.5	176.4	-69.6	172.4	16.6	0	0	112.6	A360 Y361 N366	A360-Q364 WeakPolarHBondContact O-CG 3.42Å; A360-Q364 PolarHBondContact O-N 2.93Å; Y361-Q364 WeakPolarHBondContact O-CB 3.31Å; Y361-Q364 PolarHBondContact O-N 2.84Å; Q364-N366 PolarHBondContact O-N 2.79Å
365	Q	90.2	Very high	93.7	Very high	94 Å²	94	26.7 Å²	26.7	44%	0.439	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	6.6	175.7	-58.8	-52.9	-54.9	0	0	113.2	L301 Y361 L362 E363 Y367	L301-Q365 HydrophobicContact CD2-CB 3.57Å; L301-Q365 HydrophobicContact CD2-CG 3.71Å; Y361-Q365 HydrophobicContact CD1-CG 4.23Å; Y361-Q365 HydrophobicContact CD2-CG 4.46Å; Y361-Q365 HydrophobicContact CE1-CG 3.79Å; Y361-Q365 HydrophobicContact CE2-CG 4.03Å; Y361-Q365 WeakPolarHBondContact O-CG 3.36Å; Y361-Q365 PolarHBondContact O-N 3.44Å; L362-Q365 CarbonylContact O-C 3.57Å; L362-Q365 PolarHBondContact O-N 2.83Å; E363-Q365 VanDerWaalsContact C-N 3.28Å; E363-Q365 PolarHBondContact O-N 3.12Å; Q365-Y367 PolarHBondContact O-N 2.9Å
366	N	87.4	Confident	93.5	Very high	105 Å²	105	27.3 Å²	27.3	56%	0.561	13%	0.129	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.5	35.9	-175.4	-64.7	-76.1	0	0	0	113.3	L362 E363 Q364	L362-N366 PolarHBondContact O-N 2.85Å; L362-N366 VanDerWaalsContact O-N 3.16Å; E363-N366 PolarHBondContact O-N 3.33Å; Q364-N366 PolarHBondContact O-N 2.79Å
367	Y	87.4	Confident	93.4	Very high	9 Å²	9	27.3 Å²	27.3	4%	0.035	13%	0.129	C	C	.	.			trans	-107.3	126.9	-177.2	-166.5	-88.7	0	0	0	112.2	E294 L297 L301 L362 Q365 F390 G391 I429	E294-Y367 PolarHBondContact OE1-OH 3.24Å; L297-Y367 HydrophobicContact CD1-CD2 4.15Å; L297-Y367 HydrophobicContact CD1-CE2 3.91Å; L297-Y367 HydrophobicContact CD2-CD2 3.28Å; L297-Y367 HydrophobicContact CD2-CE2 3.3Å; L297-Y367 HydrophobicContact CD2-CG 4.31Å; L297-Y367 HydrophobicContact CG-CD2 4.36Å; L297-Y367 HydrophobicContact CG-CE2 4.21Å; L301-Y367 HydrophobicContact CD1-CD1 4.09Å; L301-Y367 HydrophobicContact CD1-CD2 3.95Å; L301-Y367 HydrophobicContact CD1-CE1 4.48Å; L301-Y367 HydrophobicContact CD1-CE2 4.31Å; L301-Y367 HydrophobicContact CD1-CG 3.81Å; L362-Y367 HydrophobicContact CD1-CD1 4.35Å; L362-Y367 HydrophobicContact CD2-CD1 3.97Å; L362-Y367 HydrophobicContact CD2-CG 4.32Å; L362-Y367 PolarHBondContact O-N 3.08Å; Q365-Y367 PolarHBondContact O-N 2.9Å; Y367-F390 HydrophobicContact CE1-CB 4.14Å; Y367-G391 WeakPolarHBondContact OH-CA 3.34Å; Y367-G391 PolarHBondContact OH-N 3.34Å; Y367-I429 WeakPolarHBondContact O-CD1 3.39Å
368	I	88.4	Confident	93.4	Very high	18 Å²	18	28.6 Å²	28.6	9%	0.092	13%	0.134	C	C	.	.			trans	-100.9	122.9	-178.2	-51.8	164.2	0	0	0	109.3	V41 R370 F427 I429 D432	V41-I368 HydrophobicContact CG1-CD1 4.41Å; I368-R370 HydrophobicContact CB-CG 4.38Å; I368-R370 HydrophobicContact CG2-CG 3.7Å; I368-F427 HydrophobicContact CG2-CB 4.46Å; I368-I429 HydrophobicContact CG1-CD1 3.95Å; I368-D432 VanDerWaalsContact CG2-OD2 3.31Å; I368-D432 WeakPolarHBondContact CG2-OD2 3.49Å
369	H	90.9	Very high	93.4	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.009	13%	0.134	C	C	.	.			trans	-73	-43.8	-178.1	-171	-62.6	0	0	0	112.9	M359 D371 L372 V387 A388 D432	M359-H369 HydrophobicContact CE-CB 3.81Å; M359-H369 HydrophobicContact SD-CB 4.2Å; H369-D371 PolarHBondContact CE1-O 3.22Å; H369-D371 PolarHBondContact ND1-N 3.49Å; H369-D371 PolarHBondContact ND1-O 2.97Å; H369-D371 PolarHBondContact O-N 3.15Å; H369-L372 PolarHBondContact ND1-N 3.18Å; H369-V387 WeakPolarHBondContact CD2-CG1 3.37Å; H369-V387 WeakPolarHBondContact NE2-CG1 3.48Å; H369-A388 PolarHBondContact NE2-O 2.88Å; H369-D432 PolarHBondContact N-OD2 3.25Å
370	R	88.2	Confident	93.1	Very high	22 Å²	22	28.9 Å²	28.9	8%	0.083	14%	0.137	C	C	.	.	S	Bend	trans	68.9	-23.3	178.3	-51.2	-179.3	176	-166.2	-2.2	117.2	I368 A393 F427 D432	I368-R370 HydrophobicContact CB-CG 4.38Å; I368-R370 HydrophobicContact CG2-CG 3.7Å; R370-A393 HydrophobicContact CB-CB 4.09Å; R370-F427 HydrophobicContact CB-CD1 4.12Å; R370-F427 HydrophobicContact CB-CE1 4.31Å; R370-F427 HydrophobicContact CG-CB 4.44Å; R370-F427 HydrophobicContact CG-CD1 3.98Å; R370-F427 HydrophobicContact CG-CG 4.35Å; R370-D432 WeakPolarHBondContact CA-OD1 3.34Å; R370-D432 PolarHBondContact N-OD1 3.33Å
371	D	88.4	Confident	92.4	Very high	26 Å²	26	31.7 Å²	31.7	14%	0.139	15%	0.15	C	C	.	.			trans	-130.4	51.3	174.9	-167.6	11.3	0	0	0	114	H369 A373 R375 N376 A393 P413	H369-D371 PolarHBondContact CE1-O 3.22Å; H369-D371 PolarHBondContact ND1-N 3.49Å; H369-D371 PolarHBondContact ND1-O 2.97Å; H369-D371 PolarHBondContact O-N 3.15Å; D371-A373 PolarHBondContact O-N 3.46Å; D371-R375 IonicContact OD1-CZ 2.69Å; D371-R375 IonicContact OD1-NH2 4Å; D371-R375 PolarHBondContact OD1-NH2 3.32Å; D371-R375 IonicContact OD2-CZ 3.22Å; D371-R375 IonicContact OD2-NH2 3.04Å; D371-R375 PolarHBondContact OD2-NH2 3.1Å; D371-N376 PolarHBondContact O-ND2 3.12Å; D371-N376 PolarHBondContact OD2-ND2 3.43Å; D371-A393 HydrophobicContact CB-CB 4.49Å; D371-P413 VanDerWaalsContact OD1-CG 3.29Å; D371-P413 WeakPolarHBondContact OD1-CG 3.44Å
372	L	95.3	Very high	91.7	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.165	C	C	.	.			trans	-76.9	117.3	177.6	-178.1	64.3	0	0	0	110.5	I355 M359 H369 V387 S435 F436 L439 F497	I355-L372 HydrophobicContact CG2-CD1 4.28Å; M359-L372 HydrophobicContact CE-CD2 4.05Å; M359-L372 HydrophobicContact CG-CD1 4.32Å; M359-L372 HydrophobicContact CG-CD2 3.86Å; M359-L372 HydrophobicContact SD-CD1 3.96Å; M359-L372 HydrophobicContact SD-CD2 3.92Å; M359-L372 HydrophobicContact SD-CG 4.46Å; H369-L372 PolarHBondContact ND1-N 3.18Å; L372-V387 HydrophobicContact CD1-CG1 4.14Å; L372-S435 WeakPolarHBondContact O-CB 3.5Å; L372-F436 HydrophobicContact CD2-CB 3.81Å; L372-F436 HydrophobicContact CD2-CD2 4.09Å; L372-F436 HydrophobicContact CD2-CG 4.46Å; L372-L439 HydrophobicContact CD1-CD2 4.01Å; L372-L439 HydrophobicContact CD2-CD2 4.46Å; L372-L439 HydrophobicContact CG-CD2 4.04Å; L372-F497 HydrophobicContact CD2-CE1 4.46Å; L372-F497 HydrophobicContact CD2-CZ 4.16Å
373	A	96	Very high	91.4	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.171	C	C	.	.	S	Bend	trans	-162.1	164.9	-179.5	0	0	0	0	0	110.9	D371 R375 N376 V377 W416	D371-A373 PolarHBondContact O-N 3.46Å; A373-R375 HydrophobicContact CB-CG 4.19Å; A373-R375 PolarHBondContact O-N 3Å; A373-R375 VanDerWaalsContact O-N 3.09Å; A373-N376 PolarHBondContact O-N 3.11Å; A373-V377 PolarHBondContact O-N 2.97Å; A373-W416 HydrophobicContact CB-CD2 4.4Å; A373-W416 HydrophobicContact CB-CG 4.13Å
374	A	97.8	Very high	91.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-62.7	-25.1	-175.4	0	0	0	0	0	113.2	L331 L332 N376 L439 E442	L331-A374 WeakPolarHBondContact CB-O 3.42Å; L331-A374 PolarHBondContact N-O 3.29Å; L332-A374 HydrophobicContact CB-CB 3.98Å; L332-A374 HydrophobicContact CD1-CB 4.35Å; L332-A374 PolarHBondContact N-O 3.21Å; L332-A374 VanDerWaalsContact N-O 3.07Å; A374-N376 VanDerWaalsContact C-N 3.28Å; A374-N376 PolarHBondContact O-N 3.49Å; A374-L439 VanDerWaalsContact CA-CD1 3.5Å; A374-L439 HydrophobicContact CB-CD1 3.7Å; A374-E442 HydrophobicContact CB-CB 4.04Å; A374-E442 HydrophobicContact CB-CG 4.46Å; A374-E442 PolarHBondContact N-OE2 3.25Å
375	R	94.6	Very high	91.4	Very high	78 Å²	78	30.3 Å²	30.3	29%	0.294	15%	0.149	S	C	.	.	G	3₁₀ helix	trans	-71	-21.4	174.7	67.7	-179.1	-175.9	-76.6	-7	114	L332 D371 A373	L332-R375 HydrophobicContact CB-CB 4.42Å; L332-R375 HydrophobicContact CD2-CB 4.05Å; D371-R375 IonicContact OD1-CZ 2.69Å; D371-R375 IonicContact OD1-NH2 4Å; D371-R375 PolarHBondContact OD1-NH2 3.32Å; D371-R375 IonicContact OD2-CZ 3.22Å; D371-R375 IonicContact OD2-NH2 3.04Å; D371-R375 PolarHBondContact OD2-NH2 3.1Å; A373-R375 HydrophobicContact CB-CG 4.19Å; A373-R375 PolarHBondContact O-N 3Å; A373-R375 VanDerWaalsContact O-N 3.09Å
376	N	94.4	Very high	91.7	Very high	14 Å²	14	26.6 Å²	26.6	8%	0.075	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-106.9	16.9	-179.9	-65.2	-16.9	0	0	0	111.6	D371 A373 A374 A388	D371-N376 PolarHBondContact O-ND2 3.12Å; D371-N376 PolarHBondContact OD2-ND2 3.43Å; A373-N376 PolarHBondContact O-N 3.11Å; A374-N376 VanDerWaalsContact C-N 3.28Å; A374-N376 PolarHBondContact O-N 3.49Å; N376-A388 WeakPolarHBondContact O-CA 3.45Å; N376-A388 WeakPolarHBondContact O-CB 3.14Å; N376-A388 PolarHBondContact O-N 3.38Å
377	V	97.8	Very high	92.2	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	132.9	165.8	178.1	0	0	0	0	106.5	S330 L331 I355 A373 C385 K386 L439	S330-V377 CarbonylContact C-O 3.59Å; S330-V377 WeakPolarHBondContact CA-O 3.21Å; L331-V377 HydrophobicContact CB-CB 3.91Å; L331-V377 HydrophobicContact CB-CG1 4.02Å; L331-V377 HydrophobicContact CD2-CB 4.04Å; L331-V377 HydrophobicContact CD2-CG1 3.91Å; L331-V377 PolarHBondContact N-O 3.38Å; I355-V377 HydrophobicContact CD1-CB 4.5Å; I355-V377 HydrophobicContact CD1-CG1 3.88Å; I355-V377 HydrophobicContact CD1-CG2 4.09Å; I355-V377 HydrophobicContact CG1-CG1 3.85Å; I355-V377 HydrophobicContact CG1-CG2 4.14Å; I355-V377 HydrophobicContact CG2-CG2 4.41Å; A373-V377 PolarHBondContact O-N 2.97Å; V377-C385 HydrophobicContact CG1-CB 4.01Å; V377-K386 WeakPolarHBondContact CA-O 3.4Å; V377-L439 HydrophobicContact CG2-CD2 4.25Å
378	L	97.1	Very high	92.4	Very high	38 Å²	38	21.4 Å²	21.4	20%	0.199	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	147.5	178.4	-60	-177.6	0	0	0	110.7	I307 M326 G329 C385 K386 A388	I307-L378 HydrophobicContact CD1-CB 4.15Å; I307-L378 HydrophobicContact CD1-CD1 3.8Å; I307-L378 HydrophobicContact CD1-CG 4.39Å; I307-L378 HydrophobicContact CG1-CD1 3.98Å; I307-L378 HydrophobicContact CG1-CG 4.45Å; M326-L378 HydrophobicContact CB-CB 3.7Å; M326-L378 HydrophobicContact CB-CD1 4.19Å; M326-L378 HydrophobicContact CE-CB 4.29Å; M326-L378 WeakPolarHBondContact CE-O 3.38Å; M326-L378 HydrophobicContact CG-CB 3.59Å; M326-L378 HydrophobicContact CG-CD1 3.9Å; M326-L378 HydrophobicContact CG-CG 4.4Å; G329-L378 CarbonylContact O-C 3.42Å; G329-L378 VanDerWaalsContact O-CA 3.3Å; G329-L378 WeakPolarHBondContact O-CA 3.43Å; L378-C385 WeakPolarHBondContact O-CA 3.34Å; L378-K386 PolarHBondContact N-O 2.77Å; L378-K386 PolarHBondContact O-N 3.02Å; L378-A388 HydrophobicContact CD1-CB 4.04Å; L378-A388 HydrophobicContact CG-CB 3.89Å
379	V	96.5	Very high	92.2	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	124	-176.7	-173.3	0	0	0	0	109.9	M326 H328 G329 L331 Y334 I384	M326-V379 CarbonylContact C-O 3.57Å; H328-V379 WeakPolarHBondContact CA-O 3.33Å; H328-V379 HydrophobicContact CB-CB 3.96Å; H328-V379 HydrophobicContact CB-CG1 4.03Å; H328-V379 WeakPolarHBondContact CB-O 3.35Å; H328-V379 PolarHBondContact N-O 3.25Å; G329-V379 PolarHBondContact O-N 3.48Å; L331-V379 HydrophobicContact CB-CG2 3.81Å; L331-V379 HydrophobicContact CD1-CG2 3.76Å; L331-V379 HydrophobicContact CG-CG2 4.4Å; Y334-V379 HydrophobicContact CD1-CB 4.48Å; Y334-V379 HydrophobicContact CD1-CG1 4.01Å; Y334-V379 HydrophobicContact CD1-CG2 4.17Å; Y334-V379 HydrophobicContact CD2-CG1 4.32Å; Y334-V379 HydrophobicContact CE1-CG1 4.05Å; Y334-V379 HydrophobicContact CE2-CG1 4.38Å; Y334-V379 HydrophobicContact CG-CB 4.29Å; Y334-V379 HydrophobicContact CG-CG1 4.14Å; Y334-V379 HydrophobicContact CG-CG2 4.18Å; V379-I384 CarbonylContact C-O 3.55Å; V379-I384 WeakPolarHBondContact CA-O 3.39Å
380	G	90.8	Very high	91.4	Very high	6 Å²	6	23 Å²	23	6%	0.062	11%	0.114	C	C	.	.			trans	-97.9	-165.5	175.5	0	0	0	0	0	111	H328 I384	H328-G380 PolarHBondContact CD2-O 2.84Å; G380-I384 PolarHBondContact N-O 3.49Å
381	E	83.3	Confident	90.2	Very high	61 Å²	61	22 Å²	22	29%	0.285	11%	0.111	S	C	.	.	G	3₁₀ helix	trans	-63.4	156.3	173.5	-64.6	-175.3	133.4	0	0	111	E229 K327 N383 I384	E229-E381 WeakPolarHBondContact OE1-CB 3.4Å; E229-E381 VanDerWaalsContact OE1-CD 3.26Å; E229-E381 VanDerWaalsContact OE1-OE2 3.09Å; K327-E381 HydrophobicContact CD-CG 3.73Å; K327-E381 VanDerWaalsContact CD-OE1 3.31Å; K327-E381 WeakPolarHBondContact CD-OE1 3.18Å; K327-E381 WeakPolarHBondContact CE-OE1 3.3Å; K327-E381 WeakPolarHBondContact CE-OE2 3.23Å; K327-E381 HydrophobicContact CG-CG 4.47Å; K327-E381 IonicContact NZ-OE1 2.77Å; K327-E381 PolarHBondContact NZ-OE1 3.18Å; K327-E381 IonicContact NZ-OE2 2.73Å; K327-E381 PolarHBondContact NZ-OE2 3.41Å; E381-N383 PolarHBondContact O-N 3Å; E381-N383 VanDerWaalsContact O-N 3.11Å; E381-I384 WeakPolarHBondContact O-CB 3.47Å; E381-I384 WeakPolarHBondContact O-CG1 3.48Å; E381-I384 PolarHBondContact O-N 3.45Å
382	N	80.1	Confident	89	Confident	85 Å²	85	21.1 Å²	21.1	46%	0.455	11%	0.106	S	C	.	.	G	3₁₀ helix	trans	54.4	33.7	177.5	-52.3	-52.7	0	0	0	114	E229 I384	E229-N382 PolarHBondContact OE1-ND2 3.07Å; E229-N382 VanDerWaalsContact OE1-ND2 3.13Å; N382-I384 PolarHBondContact O-N 3.38Å
383	N	88.8	Confident	87.1	Confident	23 Å²	23	21.8 Å²	21.8	12%	0.123	11%	0.112	C	C	.	.	G	3₁₀ helix	trans	59.8	23.8	-178.3	-65.1	-29.2	0	0	0	114.7	Y334 M351 Q354 E381 C385	Y334-N383 WeakPolarHBondContact CE1-OD1 3.47Å; Y334-N383 VanDerWaalsContact CZ-OD1 3.29Å; Y334-N383 PolarHBondContact OH-OD1 2.93Å; M351-N383 HydrophobicContact CE-CB 3.84Å; Q354-N383 PolarHBondContact NE2-O 3.3Å; E381-N383 PolarHBondContact O-N 3Å; E381-N383 VanDerWaalsContact O-N 3.11Å; N383-C385 PolarHBondContact O-N 3.29Å
384	I	89.9	Confident	85.2	Confident	56 Å²	56	26.2 Å²	26.2	29%	0.287	13%	0.128	S	C	.	.			trans	-64.4	121.4	174.7	-67.8	170.7	0	0	0	109.4	V379 G380 E381 N382 K386	V379-I384 CarbonylContact C-O 3.55Å; V379-I384 WeakPolarHBondContact CA-O 3.39Å; G380-I384 PolarHBondContact N-O 3.49Å; E381-I384 WeakPolarHBondContact O-CB 3.47Å; E381-I384 WeakPolarHBondContact O-CG1 3.48Å; E381-I384 PolarHBondContact O-N 3.45Å; N382-I384 PolarHBondContact O-N 3.38Å; I384-K386 HydrophobicContact CG2-CG 4.32Å
385	C	96.4	Very high	83.1	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	132.4	177.5	-69.4	0	0	0	0	110.9	K305 M351 Q354 I355 V377 L378 N383	K305-C385 WeakPolarHBondContact CD-O 3.16Å; M351-C385 VanDerWaalsContact CG-SG 3.55Å; Q354-C385 HydrophobicContact CB-CB 4.15Å; I355-C385 HydrophobicContact CG1-CB 4.12Å; V377-C385 HydrophobicContact CG1-CB 4.01Å; L378-C385 WeakPolarHBondContact O-CA 3.34Å; N383-C385 PolarHBondContact O-N 3.29Å
386	K	97.1	Very high	81	Confident	16 Å²	16	24.5 Å²	24.5	7%	0.07	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	134.2	174	-62.8	-173.7	173.5	-169.7	0	110.9	P304 K305 I307 E324 M326 V377 L378 I384	P304-K386 WeakPolarHBondContact O-CE 3.22Å; K305-K386 WeakPolarHBondContact O-CA 3.33Å; I307-K386 HydrophobicContact CD1-CB 3.55Å; I307-K386 HydrophobicContact CD1-CD 3.92Å; I307-K386 HydrophobicContact CD1-CG 4.34Å; I307-K386 HydrophobicContact CG1-CB 3.9Å; E324-K386 VanDerWaalsContact OE1-CD 3.3Å; E324-K386 WeakPolarHBondContact OE1-CD 3.39Å; E324-K386 IonicContact OE1-NZ 2.76Å; E324-K386 PolarHBondContact OE1-NZ 3.48Å; E324-K386 IonicContact OE2-NZ 2.7Å; E324-K386 PolarHBondContact OE2-NZ 3.38Å; M326-K386 HydrophobicContact CE-CB 4.01Å; M326-K386 HydrophobicContact CE-CD 3.94Å; M326-K386 HydrophobicContact CE-CG 3.81Å; M326-K386 HydrophobicContact SD-CD 4.07Å; V377-K386 WeakPolarHBondContact CA-O 3.4Å; L378-K386 PolarHBondContact N-O 2.77Å; L378-K386 PolarHBondContact O-N 3.02Å; I384-K386 HydrophobicContact CG2-CG 4.32Å
387	V	96.6	Very high	78.8	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	130.1	175.5	-175.3	0	0	0	0	109.2	K305 L306 I307 I355 M359 H369 L372 F390	K305-V387 PolarHBondContact O-N 3.24Å; L306-V387 HydrophobicContact CD2-CB 3.71Å; L306-V387 HydrophobicContact CD2-CG1 4.42Å; L306-V387 HydrophobicContact CD2-CG2 4.28Å; I307-V387 PolarHBondContact N-O 3.48Å; I355-V387 HydrophobicContact CG2-CG2 3.89Å; M359-V387 HydrophobicContact CG-CG2 4.48Å; M359-V387 HydrophobicContact SD-CG1 4.22Å; H369-V387 WeakPolarHBondContact CD2-CG1 3.37Å; H369-V387 WeakPolarHBondContact NE2-CG1 3.48Å; L372-V387 HydrophobicContact CD1-CG1 4.14Å; V387-F390 WeakPolarHBondContact O-CD1 3.37Å; V387-F390 WeakPolarHBondContact O-CE1 3.47Å
388	A	92.2	Very high	76.3	Confident	5 Å²	5	31.7 Å²	31.7	4%	0.041	16%	0.156	C	C	.	.			trans	-119.6	170.8	-176.3	0	0	0	0	0	111	I307 H369 N376 L378 F390	I307-A388 HydrophobicContact CB-CB 4.25Å; I307-A388 HydrophobicContact CG1-CB 3.6Å; H369-A388 PolarHBondContact NE2-O 2.88Å; N376-A388 WeakPolarHBondContact O-CA 3.45Å; N376-A388 WeakPolarHBondContact O-CB 3.14Å; N376-A388 PolarHBondContact O-N 3.38Å; L378-A388 HydrophobicContact CD1-CB 4.04Å; L378-A388 HydrophobicContact CG-CB 3.89Å; A388-F390 PolarHBondContact O-N 3.15Å
389	D	83.8	Confident	73.8	Confident	51 Å²	51	36 Å²	36	27%	0.273	18%	0.175	S	C	.	.			trans	57.8	9.9	175.4	-75	-5.7	0	0	0	115.9	K279 G391 L392	K279-D389 IonicContact NZ-OD1 2.98Å; K279-D389 PolarHBondContact NZ-OD1 2.8Å; K279-D389 IonicContact NZ-OD2 3.83Å; K279-D389 PolarHBondContact NZ-OD2 3.08Å; D389-G391 PolarHBondContact O-N 2.94Å; D389-L392 PolarHBondContact O-N 3.13Å
390	F	73.9	Confident	71.1	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.009	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	129.9	159.8	68.7	-85.6	0	0	0	108	M298 L301 L306 I307 L362 Y367 V387 A388	M298-F390 WeakPolarHBondContact CE-O 3.3Å; M298-F390 HydrophobicContact CG-CE2 4.5Å; L301-F390 HydrophobicContact CB-CE2 3.88Å; L301-F390 HydrophobicContact CD1-CD2 3.78Å; L301-F390 HydrophobicContact CD1-CE2 3.8Å; L306-F390 HydrophobicContact CB-CE1 3.82Å; L306-F390 HydrophobicContact CB-CZ 3.89Å; L306-F390 HydrophobicContact CD1-CE1 4.45Å; L306-F390 HydrophobicContact CD1-CE2 4.29Å; L306-F390 HydrophobicContact CD1-CZ 4.11Å; L306-F390 HydrophobicContact CD2-CD1 4.32Å; L306-F390 HydrophobicContact CD2-CE1 4.23Å; L306-F390 HydrophobicContact CG-CE1 4.39Å; L306-F390 HydrophobicContact CG-CZ 4.46Å; I307-F390 WeakPolarHBondContact O-CZ 3.04Å; L362-F390 HydrophobicContact CD1-CB 4.14Å; L362-F390 HydrophobicContact CD1-CG 4.42Å; L362-F390 HydrophobicContact CD2-CD2 4.24Å; Y367-F390 HydrophobicContact CE1-CB 4.14Å; V387-F390 WeakPolarHBondContact O-CD1 3.37Å; V387-F390 WeakPolarHBondContact O-CE1 3.47Å; A388-F390 PolarHBondContact O-N 3.15Å
391	G	62.7	Low	68.4	Low	1 Å²	1	47.3 Å²	47.3	1%	0.01	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	116.7	-59.6	-167.7	0	0	0	0	0	112.2	E294 Y367 D389 A393	E294-G391 VanDerWaalsContact CD-O 3.23Å; E294-G391 WeakPolarHBondContact CG-O 3.4Å; E294-G391 VanDerWaalsContact OE1-CA 3.29Å; E294-G391 WeakPolarHBondContact OE1-CA 3.49Å; E294-G391 VanDerWaalsContact OE1-O 3.13Å; Y367-G391 WeakPolarHBondContact OH-CA 3.34Å; Y367-G391 PolarHBondContact OH-N 3.34Å; D389-G391 PolarHBondContact O-N 2.94Å; G391-A393 PolarHBondContact O-N 2.69Å
392	L	63.5	Low	66.1	Low	7 Å²	7	49.1 Å²	49.1	4%	0.037	25%	0.251	C	S	.	.	H	α-helix	trans	-75.4	-29.7	-161.3	-63.9	177.2	0	0	0	113.4	K279 I321 D389 R394 V395 F396	K279-L392 HydrophobicContact CD-CD1 4.05Å; I321-L392 HydrophobicContact CD1-CD1 4.22Å; I321-L392 HydrophobicContact CD1-CD2 3.75Å; D389-L392 PolarHBondContact O-N 3.13Å; L392-R394 VanDerWaalsContact C-N 3.33Å; L392-R394 PolarHBondContact O-N 3.04Å; L392-V395 PolarHBondContact O-N 3.38Å; L392-F396 HydrophobicContact CB-CD2 4.45Å; L392-F396 HydrophobicContact CB-CE2 4Å; L392-F396 WeakPolarHBondContact O-CD2 3.17Å; L392-F396 PolarHBondContact O-N 2.7Å
393	A	56.4	Low	63.9	Low	15 Å²	15	47.9 Å²	47.9	12%	0.124	25%	0.247	C	C	.	.	H	α-helix	trans	-65.6	-30.8	-177.8	0	0	0	0	0	113.8	R370 D371 G391 M397	R370-A393 HydrophobicContact CB-CB 4.09Å; D371-A393 HydrophobicContact CB-CB 4.49Å; G391-A393 PolarHBondContact O-N 2.69Å; A393-M397 WeakPolarHBondContact O-CG 3.4Å
394	R	56.6	Low	61.4	Low	93 Å²	93	53.3 Å²	53.3	35%	0.351	27%	0.267	S	S	.	.	H	α-helix	trans	-68.1	-38.2	179.2	-73.6	-176.7	65	-167.5	-3.1	112.2	L392	L392-R394 VanDerWaalsContact C-N 3.33Å; L392-R394 PolarHBondContact O-N 3.04Å
395	V	52.5	Low	58.6	Low	11 Å²	11	57.2 Å²	57.2	7%	0.067	28%	0.284	C	S	.	.	H	α-helix	trans	-78.5	-37	-170.1	-160.2	0	0	0	0	111.2	M286 D290 E294 L392 M397 K398	M286-V395 HydrophobicContact CE-CB 3.34Å; M286-V395 HydrophobicContact CE-CG1 3.27Å; M286-V395 HydrophobicContact CE-CG2 4.11Å; M286-V395 HydrophobicContact CG-CG1 3.56Å; M286-V395 HydrophobicContact SD-CB 3.88Å; M286-V395 HydrophobicContact SD-CG1 3.2Å; M286-V395 WeakPolarHBondContact SD-CG1 3.44Å; M286-V395 HydrophobicContact SD-CG2 4.36Å; D290-V395 HydrophobicContact CB-CG1 4.18Å; E294-V395 HydrophobicContact CB-CG2 3.61Å; E294-V395 HydrophobicContact CG-CG2 3.58Å; L392-V395 PolarHBondContact O-N 3.38Å; V395-M397 VanDerWaalsContact C-N 3.29Å; V395-M397 PolarHBondContact O-N 3.41Å; V395-K398 PolarHBondContact O-N 3.5Å
396	F	50.2	Low	55.9	Low	31 Å²	31	60.7 Å²	60.7	14%	0.136	31%	0.312	C	S	.	.	H	α-helix	trans	-76.1	-11.4	175.7	-58.9	-56.3	0	0	0	114.6	F262 L281 T285 M286 L392	F262-F396 HydrophobicContact CB-CE2 3.97Å; F262-F396 HydrophobicContact CB-CZ 4.09Å; F262-F396 HydrophobicContact CD1-CB 4.45Å; F262-F396 HydrophobicContact CD1-CD1 4.13Å; F262-F396 AromaticContact CD1-CD2 3.28Å; F262-F396 HydrophobicContact CD1-CD2 3.28Å; F262-F396 HydrophobicContact CD1-CE1 4.22Å; F262-F396 AromaticContact CD1-CE2 3.38Å; F262-F396 HydrophobicContact CD1-CE2 3.38Å; F262-F396 AromaticContact CD1-CG 3.69Å; F262-F396 HydrophobicContact CD1-CG 3.69Å; F262-F396 AromaticContact CD1-CZ 3.87Å; F262-F396 HydrophobicContact CD1-CZ 3.87Å; F262-F396 HydrophobicContact CD2-CE2 4.42Å; F262-F396 HydrophobicContact CE1-CB 3.94Å; F262-F396 HydrophobicContact CE1-CD1 4.45Å; F262-F396 AromaticContact CE1-CD2 3.36Å; F262-F396 HydrophobicContact CE1-CD2 3.36Å; F262-F396 AromaticContact CE1-CE2 3.96Å; F262-F396 HydrophobicContact CE1-CE2 3.96Å; F262-F396 AromaticContact CE1-CG 3.66Å; F262-F396 HydrophobicContact CE1-CG 3.66Å; F262-F396 AromaticContact CG-CD2 3.95Å; F262-F396 HydrophobicContact CG-CD2 3.95Å; F262-F396 AromaticContact CG-CE2 3.65Å; F262-F396 HydrophobicContact CG-CE2 3.65Å; F262-F396 HydrophobicContact CG-CZ 4.2Å; F262-F396 HydrophobicContact CZ-CD2 4.08Å; L281-F396 HydrophobicContact CD2-CZ 4.01Å; T285-F396 HydrophobicContact CG2-CD1 3.66Å; T285-F396 HydrophobicContact CG2-CE1 3.23Å; T285-F396 HydrophobicContact CG2-CZ 4.13Å; T285-F396 WeakPolarHBondContact O-CE1 3.44Å; M286-F396 HydrophobicContact CE-CD1 3.94Å; M286-F396 HydrophobicContact CE-CE1 3.32Å; M286-F396 HydrophobicContact CE-CE2 4.12Å; M286-F396 HydrophobicContact CE-CZ 3.44Å; M286-F396 VanDerWaalsContact CE-CZ 3.44Å; L392-F396 HydrophobicContact CB-CD2 4.45Å; L392-F396 HydrophobicContact CB-CE2 4Å; L392-F396 WeakPolarHBondContact O-CD2 3.17Å; L392-F396 PolarHBondContact O-N 2.7Å
397	M	49.3	Very low	53.1	Low	49 Å²	49	70.6 Å²	70.6	24%	0.241	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-14.1	175.8	-72.7	178.1	178.3	0	0	113.3	A393 V395 S400 F412 F427	A393-M397 WeakPolarHBondContact O-CG 3.4Å; V395-M397 VanDerWaalsContact C-N 3.29Å; V395-M397 PolarHBondContact O-N 3.41Å; M397-S400 PolarHBondContact O-OG 2.93Å; M397-F412 HydrophobicContact CE-CB 4.42Å; M397-F427 HydrophobicContact CE-CZ 4.34Å
398	K	44.2	Very low	50.4	Low	116 Å²	116	78.1 Å²	78.1	50%	0.504	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-36.7	178	-112.7	-177.8	172.6	-172.3	0	112.1	D290 V395 S400	D290-K398 IonicContact OD1-NZ 2.66Å; D290-K398 PolarHBondContact OD1-NZ 3.36Å; D290-K398 IonicContact OD2-NZ 2.92Å; D290-K398 PolarHBondContact OD2-NZ 2.86Å; V395-K398 PolarHBondContact O-N 3.5Å; K398-S400 VanDerWaalsContact C-N 3.26Å; K398-S400 PolarHBondContact O-N 2.94Å
399	E	44.3	Very low	47.8	Very low	128 Å²	128	81.1 Å²	81.1	60%	0.598	42%	0.421	S	S	*	.	S	Bend	trans	-74.8	-14.6	179.7	-70	-173.2	167.1	0	0	113.6	E401	E399-E401 VanDerWaalsContact C-N 3.29Å; E399-E401 PolarHBondContact O-N 3.43Å
400	S	39.8	Very low	45.6	Very low	55 Å²	55	80.6 Å²	80.6	39%	0.385	43%	0.428	S	S	.	.			trans	-89.2	59.2	169.3	56.4	0	0	0	0	111.4	M397 K398 S402	M397-S400 PolarHBondContact O-OG 2.93Å; K398-S400 VanDerWaalsContact C-N 3.26Å; K398-S400 PolarHBondContact O-N 2.94Å; S400-S402 PolarHBondContact O-N 2.83Å
401	E	35.4	Very low	44.8	Very low	188 Å²	188	87.9 Å²	87.9	88%	0.879	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	8.1	169.6	-91.2	-161.7	159.2	0	0	113.4	E399	E399-E401 VanDerWaalsContact C-N 3.29Å; E399-E401 PolarHBondContact O-N 3.43Å
402	S	33.5	Very low	45	Very low	99 Å²	99	90.7 Å²	90.7	69%	0.692	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-156.5	53.2	179.3	55.6	0	0	0	0	114.7	S400	S400-S402 PolarHBondContact O-N 2.83Å
403	V	34.7	Very low	46	Very low	60 Å²	60	91.5 Å²	91.5	36%	0.364	48%	0.477	S	S	.	.			trans	-139.6	86.1	170.6	-163.2	0	0	0	0	113.9	E405	V403-E405 HydrophobicContact CG1-CB 4.35Å
404	Y	36	Very low	47.6	Very low	137 Å²	137	91.9 Å²	91.9	54%	0.537	48%	0.478	S	S	.	.				-107.4	69.2	122.5	-149.2	-85.2	0	0	0	107.5	A406 F412 I422	Y404-A406 HydrophobicContact CE1-CB 4.41Å; Y404-F412 HydrophobicContact CE2-CZ 4.27Å; Y404-I422 HydrophobicContact CE2-CG2 4.22Å; Y404-I422 WeakPolarHBondContact CE2-O 3.41Å; Y404-I422 WeakPolarHBondContact OH-CG2 3.17Å
405	E	32.4	Very low	49.4	Very low	137 Å²	137	88.3 Å²	88.3	64%	0.64	47%	0.465	S	S	*	.			trans	-107.4	92.3	157	-74.5	-162.3	166	0	0	107.4	V403 R407	V403-E405 HydrophobicContact CG1-CB 4.35Å; E405-R407 PolarHBondContact O-N 2.95Å
406	A	39.5	Very low	51.4	Low	73 Å²	73	88.9 Å²	88.9	60%	0.603	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	38.9	163.2	0	0	0	0	0	111.6	Y404	Y404-A406 HydrophobicContact CE1-CB 4.41Å
407	R	37.3	Very low	53.4	Low	224 Å²	224	87.7 Å²	87.7	85%	0.845	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130	-15.7	-179.8	-75.6	-167.7	173.6	178.7	-1.4	115.9	E405	E405-R407 PolarHBondContact O-N 2.95Å
408	D	40.1	Very low	55.6	Low	159 Å²	159	85.4 Å²	85.4	85%	0.85	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-176.9	116.2	154.2	-96.1	-34.1	0	0	0	110.2
409	G	36.8	Very low	57.9	Low	67 Å²	67	81.1 Å²	81.1	69%	0.691	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	112.5	-13.9	149.9	0	0	0	0	0	121.4	K411	G409-K411 PolarHBondContact O-N 3Å
410	G	39.2	Very low	60	Low	41 Å²	41	75.9 Å²	75.9	42%	0.423	41%	0.41	S	S	.	.			trans	-81.1	104.2	176.1	0	0	0	0	0	113.5	F412	G410-F412 PolarHBondContact O-N 3.49Å
411	K	57.2	Low	62.3	Low	155 Å²	155	73.4 Å²	73.4	67%	0.674	39%	0.393	S	S	*	.			trans	-96.6	79.4	-170.7	-64.4	174.9	-176.1	175	0	113.3	G409	G409-K411 PolarHBondContact O-N 3Å
412	F	66.7	Low	64.7	Low	60 Å²	60	64.9 Å²	64.9	26%	0.263	35%	0.353	S	S	.	.			trans	-103.1	153.3	162.1	61.7	-93.4	0	0	0	110.4	M397 Y404 G410 V414 I422	M397-F412 HydrophobicContact CE-CB 4.42Å; Y404-F412 HydrophobicContact CE2-CZ 4.27Å; G410-F412 PolarHBondContact O-N 3.49Å; F412-V414 VanDerWaalsContact C-N 3.28Å; F412-V414 HydrophobicContact CD2-CG2 4.14Å; F412-V414 HydrophobicContact CE2-CG2 3.9Å; F412-V414 WeakPolarHBondContact O-CG2 3.37Å; F412-V414 PolarHBondContact O-N 3.43Å; F412-I422 HydrophobicContact CE2-CG1 4.37Å
413	P	84.4	Confident	67	Low	24 Å²	24	64.7 Å²	64.7	16%	0.156	34%	0.341	C	S	.	.			trans	-78.5	71.2	-168.3	35.3	-41.1	0	0	0	112.3	D371 K415 W416 T417	D371-P413 VanDerWaalsContact OD1-CG 3.29Å; D371-P413 WeakPolarHBondContact OD1-CG 3.44Å; P413-K415 PolarHBondContact O-N 2.9Å; P413-W416 HydrophobicContact CB-CE3 4.02Å; P413-W416 PolarHBondContact O-N 2.95Å; P413-T417 PolarHBondContact O-N 2.83Å; P413-T417 PolarHBondContact O-OG1 2.7Å; P413-T417 VanDerWaalsContact O-OG1 3.09Å
414	V	89.1	Confident	69.2	Low	23 Å²	23	67.7 Å²	67.7	14%	0.139	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-43.5	-40.2	-170.2	-178.6	0	0	0	0	114.5	F412 W416 T417 I422 N456 V460	F412-V414 VanDerWaalsContact C-N 3.28Å; F412-V414 HydrophobicContact CD2-CG2 4.14Å; F412-V414 HydrophobicContact CE2-CG2 3.9Å; F412-V414 WeakPolarHBondContact O-CG2 3.37Å; F412-V414 PolarHBondContact O-N 3.43Å; V414-W416 VanDerWaalsContact C-N 3.27Å; V414-W416 PolarHBondContact O-N 2.87Å; V414-T417 PolarHBondContact O-N 2.92Å; V414-I422 HydrophobicContact CG1-CD1 4.13Å; V414-N456 HydrophobicContact CB-CB 3.98Å; V414-N456 HydrophobicContact CG1-CB 3.92Å; V414-N456 HydrophobicContact CG2-CB 4.18Å; V414-V460 HydrophobicContact CG1-CG2 3.47Å; V414-V460 VanDerWaalsContact CG1-CG2 3.47Å
415	K	94.3	Very high	71.3	Confident	18 Å²	18	65.7 Å²	65.7	8%	0.078	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-15.5	-176.1	-66.8	178.4	165.5	-157.9	0	114.6	P413 M449 P450 Y451 M454 N456	P413-K415 PolarHBondContact O-N 2.9Å; K415-M449 HydrophobicContact CD-SD 4.15Å; K415-P450 HydrophobicContact CB-CG 4.05Å; K415-P450 WeakPolarHBondContact CD-O 3.5Å; K415-P450 PolarHBondContact NZ-O 3.48Å; K415-P450 VanDerWaalsContact NZ-O 3.14Å; K415-Y451 HydrophobicContact CB-CD2 4.1Å; K415-Y451 HydrophobicContact CG-CD2 4.2Å; K415-Y451 PolarHBondContact NZ-O 3.27Å; K415-M454 WeakPolarHBondContact CE-O 3.35Å; K415-M454 PolarHBondContact NZ-O 2.71Å; K415-N456 WeakPolarHBondContact CE-OD1 3.44Å
416	W	95.5	Very high	73.7	Confident	22 Å²	22	62.2 Å²	62.2	8%	0.083	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-19.5	175.1	-69.6	-102.8	0	0	0	112.2	A373 P413 V414 W434 S435 I438 E442 M449 P450	A373-W416 HydrophobicContact CB-CD2 4.4Å; A373-W416 HydrophobicContact CB-CG 4.13Å; P413-W416 HydrophobicContact CB-CE3 4.02Å; P413-W416 PolarHBondContact O-N 2.95Å; V414-W416 VanDerWaalsContact C-N 3.27Å; V414-W416 PolarHBondContact O-N 2.87Å; W416-W434 VanDerWaalsContact O-CD1 3.29Å; W416-S435 WeakPolarHBondContact O-CA 3.43Å; W416-S435 PolarHBondContact O-OG 3.14Å; W416-S435 VanDerWaalsContact O-OG 3.07Å; W416-I438 HydrophobicContact CD2-CG2 4.35Å; W416-I438 HydrophobicContact CG-CB 4.47Å; W416-I438 HydrophobicContact CG-CG2 3.91Å; W416-E442 WeakPolarHBondContact CZ2-OE1 3.21Å; W416-E442 VanDerWaalsContact NE1-CD 3.3Å; W416-E442 PolarHBondContact NE1-OE2 2.99Å; W416-M449 HydrophobicContact CH2-CE 4.24Å; W416-M449 HydrophobicContact CH2-SD 3.64Å; W416-M449 HydrophobicContact CZ3-SD 4.28Å; W416-P450 HydrophobicContact CD2-CG 4.34Å; W416-P450 HydrophobicContact CH2-CG 3.88Å; W416-P450 HydrophobicContact CZ2-CG 3.64Å; W416-P450 HydrophobicContact CZ3-CG 4.33Å
417	T	92.6	Very high	75.9	Confident	6 Å²	6	59.7 Å²	59.7	4%	0.037	31%	0.312	C	S	.	.	S	Bend	trans	-78.1	136.2	-172.6	-48.6	0	0	0	0	112.2	P413 V414 A421 I422 F427	P413-T417 PolarHBondContact O-N 2.83Å; P413-T417 PolarHBondContact O-OG1 2.7Å; P413-T417 VanDerWaalsContact O-OG1 3.09Å; V414-T417 PolarHBondContact O-N 2.92Å; T417-A421 HydrophobicContact CG2-CB 3.61Å; T417-I422 HydrophobicContact CG2-CD1 4.45Å; T417-I422 HydrophobicContact CG2-CG1 3.62Å; T417-I422 WeakPolarHBondContact O-CD1 3.44Å; T417-F427 HydrophobicContact CG2-CE1 4.19Å; T417-F427 HydrophobicContact CG2-CZ 4.4Å
418	A	94.3	Very high	78.4	Confident	1 Å²	1	50 Å²	50	1%	0.008	28%	0.278	C	S	.	.			trans	-64.4	150	177.5	0	0	0	0	0	112.6	E420 A421 I422 W434	A418-E420 VanDerWaalsContact C-N 3.32Å; A418-E420 WeakPolarHBondContact CB-OE1 3.32Å; A418-E420 WeakPolarHBondContact CB-OE2 3.45Å; A418-E420 PolarHBondContact O-N 2.9Å; A418-A421 HydrophobicContact CB-CB 4.41Å; A418-A421 PolarHBondContact O-N 2.57Å; A418-I422 WeakPolarHBondContact O-CG1 3.25Å; A418-I422 PolarHBondContact O-N 2.93Å; A418-W434 HydrophobicContact CB-CB 3.67Å; A418-W434 HydrophobicContact CB-CD2 4.09Å; A418-W434 HydrophobicContact CB-CG 3.66Å
419	P	92.3	Very high	81	Confident	27 Å²	27	43.7 Å²	43.7	18%	0.175	24%	0.244	C	C	.	.	H	α-helix	trans	-55.7	-42.8	-177.8	-26.2	35	0	0	0	113.5	A421 I422 H423 W434 I463	P419-A421 VanDerWaalsContact C-N 3.32Å; P419-A421 PolarHBondContact O-N 2.76Å; P419-I422 PolarHBondContact O-N 3.39Å; P419-H423 PolarHBondContact O-N 2.91Å; P419-H423 PolarHBondContact O-ND1 3.18Å; P419-W434 HydrophobicContact CG-CE3 4.49Å; P419-W434 HydrophobicContact CG-CH2 3.68Å; P419-W434 HydrophobicContact CG-CZ2 4.02Å; P419-W434 HydrophobicContact CG-CZ3 3.93Å; P419-I463 HydrophobicContact CG-CG2 3.78Å
420	E	89.8	Confident	83.8	Confident	17 Å²	17	42.6 Å²	42.6	8%	0.079	22%	0.22	C	C	.	.	H	α-helix	trans	-67.1	-32.7	179.1	70.9	-73.9	175.9	0	0	112.9	A418 N424 K426 R494	A418-E420 VanDerWaalsContact C-N 3.32Å; A418-E420 WeakPolarHBondContact CB-OE1 3.32Å; A418-E420 WeakPolarHBondContact CB-OE2 3.45Å; A418-E420 PolarHBondContact O-N 2.9Å; E420-N424 WeakPolarHBondContact O-CA 3.37Å; E420-N424 WeakPolarHBondContact O-CB 3.25Å; E420-N424 PolarHBondContact O-N 3.48Å; E420-K426 PolarHBondContact O-N 2.82Å; E420-R494 IonicContact OE1-CZ 3.57Å; E420-R494 IonicContact OE1-NH1 3.08Å; E420-R494 PolarHBondContact OE1-NH1 3.2Å; E420-R494 IonicContact OE1-NH2 3.71Å; E420-R494 PolarHBondContact OE1-NH2 3Å; E420-R494 IonicContact OE2-CZ 2.82Å; E420-R494 IonicContact OE2-NH1 2.76Å; E420-R494 IonicContact OE2-NH2 3.24Å; E420-R494 PolarHBondContact OE2-NH2 3.33Å
421	A	87.8	Confident	86.5	Confident	4 Å²	4	40.7 Å²	40.7	3%	0.033	20%	0.201	C	C	.	.	H	α-helix	trans	-71.2	-37.7	175	0	0	0	0	0	111.2	T417 A418 P419 N425 F427	T417-A421 HydrophobicContact CG2-CB 3.61Å; A418-A421 HydrophobicContact CB-CB 4.41Å; A418-A421 PolarHBondContact O-N 2.57Å; P419-A421 VanDerWaalsContact C-N 3.32Å; P419-A421 PolarHBondContact O-N 2.76Å; A421-N425 VanDerWaalsContact O-CA 3.23Å; A421-N425 WeakPolarHBondContact O-CA 3.3Å; A421-N425 PolarHBondContact O-N 3.4Å; A421-F427 HydrophobicContact CB-CD1 3.96Å; A421-F427 HydrophobicContact CB-CE1 3.86Å; A421-F427 HydrophobicContact CB-CE2 4.41Å; A421-F427 HydrophobicContact CB-CG 4.3Å; A421-F427 HydrophobicContact CB-CZ 4.09Å
422	I	85	Confident	88.3	Confident	9 Å²	9	33.3 Å²	33.3	5%	0.046	17%	0.169	C	C	.	.	H	α-helix	trans	-67.2	-53.6	174.7	-62.2	175.3	0	0	0	111.3	Y404 F412 V414 T417 A418 P419 V460	Y404-I422 HydrophobicContact CE2-CG2 4.22Å; Y404-I422 WeakPolarHBondContact CE2-O 3.41Å; Y404-I422 WeakPolarHBondContact OH-CG2 3.17Å; F412-I422 HydrophobicContact CE2-CG1 4.37Å; V414-I422 HydrophobicContact CG1-CD1 4.13Å; T417-I422 HydrophobicContact CG2-CD1 4.45Å; T417-I422 HydrophobicContact CG2-CG1 3.62Å; T417-I422 WeakPolarHBondContact O-CD1 3.44Å; A418-I422 WeakPolarHBondContact O-CG1 3.25Å; A418-I422 PolarHBondContact O-N 2.93Å; P419-I422 PolarHBondContact O-N 3.39Å; I422-V460 HydrophobicContact CD1-CG2 3.88Å; I422-V460 HydrophobicContact CG2-CG1 4.46Å; I422-V460 HydrophobicContact CG2-CG2 4.39Å
423	H	82.7	Confident	89.9	Confident	95 Å²	95	30.5 Å²	30.5	44%	0.44	16%	0.156	S	C	.	.	H	α-helix	trans	-79.5	-36.5	-169.5	-64.4	90.3	0	0	0	112.9	P419 S464	P419-H423 PolarHBondContact O-N 2.91Å; P419-H423 PolarHBondContact O-ND1 3.18Å; H423-S464 PolarHBondContact CE1-OG 3.38Å
424	N	81	Confident	90.5	Very high	123 Å²	123	29.4 Å²	29.4	66%	0.658	15%	0.149	S	C	*	.	H	α-helix	trans	-117.1	3.4	-169.4	-57.4	-16.9	0	0	0	113	E420 K426	E420-N424 WeakPolarHBondContact O-CA 3.37Å; E420-N424 WeakPolarHBondContact O-CB 3.25Å; E420-N424 PolarHBondContact O-N 3.48Å; N424-K426 HydrophobicContact CB-CB 4.34Å; N424-K426 PolarHBondContact O-N 2.91Å
425	N	78.7	Confident	91	Very high	94 Å²	94	28.5 Å²	28.5	50%	0.503	14%	0.144	S	C	.	.			trans	54.3	30.2	-173.8	-160.2	24.3	0	0	0	112.8	A421 F427	A421-N425 VanDerWaalsContact O-CA 3.23Å; A421-N425 WeakPolarHBondContact O-CA 3.3Å; A421-N425 PolarHBondContact O-N 3.4Å; N425-F427 PolarHBondContact O-N 2.87Å; N425-F427 VanDerWaalsContact OD1-CE2 3.29Å; N425-F427 WeakPolarHBondContact OD1-CE2 3.44Å
426	K	82.8	Confident	91.2	Very high	64 Å²	64	27.7 Å²	27.7	28%	0.278	14%	0.14	S	C	.	.			trans	-96.1	88.8	-176.7	-170.5	-173.2	179	-167.2	0	110.5	E420 N424 E491	E420-K426 PolarHBondContact O-N 2.82Å; N424-K426 HydrophobicContact CB-CB 4.34Å; N424-K426 PolarHBondContact O-N 2.91Å; K426-E491 WeakPolarHBondContact CE-OE2 3.38Å; K426-E491 IonicContact NZ-OE1 2.85Å; K426-E491 PolarHBondContact NZ-OE1 3.22Å; K426-E491 IonicContact NZ-OE2 3.27Å; K426-E491 PolarHBondContact NZ-OE2 3.34Å
427	F	86.1	Confident	91.3	Very high	21 Å²	21	26.6 Å²	26.6	9%	0.092	14%	0.136	C	C	.	.			trans	-86.6	135.3	173.7	-69.9	-89	0	0	0	111.2	I368 R370 M397 T417 A421 N425	I368-F427 HydrophobicContact CG2-CB 4.46Å; R370-F427 HydrophobicContact CB-CD1 4.12Å; R370-F427 HydrophobicContact CB-CE1 4.31Å; R370-F427 HydrophobicContact CG-CB 4.44Å; R370-F427 HydrophobicContact CG-CD1 3.98Å; R370-F427 HydrophobicContact CG-CG 4.35Å; M397-F427 HydrophobicContact CE-CZ 4.34Å; T417-F427 HydrophobicContact CG2-CE1 4.19Å; T417-F427 HydrophobicContact CG2-CZ 4.4Å; A421-F427 HydrophobicContact CB-CD1 3.96Å; A421-F427 HydrophobicContact CB-CE1 3.86Å; A421-F427 HydrophobicContact CB-CE2 4.41Å; A421-F427 HydrophobicContact CB-CG 4.3Å; A421-F427 HydrophobicContact CB-CZ 4.09Å; N425-F427 PolarHBondContact O-N 2.87Å; N425-F427 VanDerWaalsContact OD1-CE2 3.29Å; N425-F427 WeakPolarHBondContact OD1-CE2 3.44Å
428	S	89.9	Confident	91.6	Very high	19 Å²	19	26.3 Å²	26.3	13%	0.133	14%	0.135	C	C	.	.			trans	-152.8	171.2	178.4	68.4	0	0	0	0	110.6	K430 S431 D432	S428-K430 PolarHBondContact O-N 3.35Å; S428-K430 PolarHBondContact OG-N 3.09Å; S428-S431 PolarHBondContact N-OG 2.96Å; S428-S431 WeakPolarHBondContact O-CB 3.41Å; S428-S431 PolarHBondContact O-N 3.32Å; S428-S431 PolarHBondContact O-OG 3.27Å; S428-S431 PolarHBondContact OG-N 3.25Å; S428-D432 PolarHBondContact O-N 3.31Å
429	I	93.9	Very high	91.8	Very high	27 Å²	27	26.3 Å²	26.3	14%	0.138	13%	0.134	C	C	.	.	H	α-helix	trans	-54.8	-35.9	169.2	-56	-58.7	0	0	0	111	E363 Y367 I368 S431 D432 V433 F497	E363-I429 HydrophobicContact CB-CG2 3.89Å; E363-I429 HydrophobicContact CG-CG2 3.82Å; E363-I429 WeakPolarHBondContact OE1-CG2 3.18Å; Y367-I429 WeakPolarHBondContact O-CD1 3.39Å; I368-I429 HydrophobicContact CG1-CD1 3.95Å; I429-S431 VanDerWaalsContact C-N 3.28Å; I429-S431 PolarHBondContact O-N 3.12Å; I429-D432 CarbonylContact O-C 3.39Å; I429-D432 WeakPolarHBondContact O-CA 3.47Å; I429-D432 WeakPolarHBondContact O-CB 3.36Å; I429-D432 PolarHBondContact O-N 3Å; I429-V433 WeakPolarHBondContact O-CG2 3.22Å; I429-V433 PolarHBondContact O-N 3.07Å; I429-F497 HydrophobicContact CG2-CD2 3.84Å; I429-F497 HydrophobicContact CG2-CE2 4.02Å
430	K	97.1	Very high	92.1	Very high	44 Å²	44	25 Å²	25	19%	0.191	13%	0.126	C	C	.	.	H	α-helix	trans	-66.9	-27	177	-61.5	-62.4	-177.9	175.9	0	113.2	S428 V433 W434 E491 R494 P495	S428-K430 PolarHBondContact O-N 3.35Å; S428-K430 PolarHBondContact OG-N 3.09Å; K430-V433 PolarHBondContact O-N 2.78Å; K430-W434 PolarHBondContact O-N 3.35Å; K430-E491 HydrophobicContact CB-CB 4.18Å; K430-E491 WeakPolarHBondContact CD-O 3.41Å; K430-E491 WeakPolarHBondContact CG-O 3.41Å; K430-R494 HydrophobicContact CD-CB 4.27Å; K430-R494 PolarHBondContact NZ-O 3.41Å; K430-R494 WeakPolarHBondContact O-CD 3.3Å; K430-R494 PolarHBondContact O-NH1 3.44Å; K430-P495 VanDerWaalsContact NZ-C 3.31Å; K430-P495 PolarHBondContact NZ-O 3.29Å
431	S	94.9	Very high	92.5	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.014	13%	0.126	C	C	.	.	H	α-helix	trans	-74.7	-28.7	170.4	69.4	0	0	0	0	112.6	S428 I429 W434 S435	S428-S431 PolarHBondContact N-OG 2.96Å; S428-S431 WeakPolarHBondContact O-CB 3.41Å; S428-S431 PolarHBondContact O-N 3.32Å; S428-S431 PolarHBondContact O-OG 3.27Å; S428-S431 PolarHBondContact OG-N 3.25Å; I429-S431 VanDerWaalsContact C-N 3.28Å; I429-S431 PolarHBondContact O-N 3.12Å; S431-W434 WeakPolarHBondContact O-CB 3.4Å; S431-W434 PolarHBondContact O-N 3.39Å; S431-S435 PolarHBondContact O-N 3.39Å; S431-S435 PolarHBondContact O-OG 3.22Å
432	D	96.3	Very high	93	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-71.9	-34.7	169.9	-70.1	-27.3	0	0	0	111.4	M359 I368 H369 R370 S428 I429 W434 S435 F436 F497	M359-D432 HydrophobicContact CE-CB 3.8Å; I368-D432 VanDerWaalsContact CG2-OD2 3.31Å; I368-D432 WeakPolarHBondContact CG2-OD2 3.49Å; H369-D432 PolarHBondContact N-OD2 3.25Å; R370-D432 WeakPolarHBondContact CA-OD1 3.34Å; R370-D432 PolarHBondContact N-OD1 3.33Å; S428-D432 PolarHBondContact O-N 3.31Å; I429-D432 CarbonylContact O-C 3.39Å; I429-D432 WeakPolarHBondContact O-CA 3.47Å; I429-D432 WeakPolarHBondContact O-CB 3.36Å; I429-D432 PolarHBondContact O-N 3Å; D432-W434 VanDerWaalsContact C-N 3.28Å; D432-W434 PolarHBondContact O-N 3.2Å; D432-S435 CarbonylContact O-C 3.58Å; D432-S435 WeakPolarHBondContact O-CA 3.29Å; D432-S435 WeakPolarHBondContact O-CB 3.48Å; D432-S435 PolarHBondContact O-N 2.99Å; D432-S435 VanDerWaalsContact O-N 3.08Å; D432-F436 PolarHBondContact O-N 3.39Å; D432-F497 HydrophobicContact CB-CE2 3.95Å; D432-F497 HydrophobicContact CB-CZ 4.12Å
433	V	98.6	Very high	93.7	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-59.8	-38.8	172.5	172.3	0	0	0	0	111.5	I429 K430 F436 G437 C486 R494 P495 F497 L500	I429-V433 WeakPolarHBondContact O-CG2 3.22Å; I429-V433 PolarHBondContact O-N 3.07Å; K430-V433 PolarHBondContact O-N 2.78Å; V433-F436 WeakPolarHBondContact O-CB 3.23Å; V433-F436 PolarHBondContact O-N 3.04Å; V433-G437 PolarHBondContact O-N 3.12Å; V433-G437 VanDerWaalsContact O-N 3.11Å; V433-C486 HydrophobicContact CG1-CB 4.2Å; V433-C486 WeakPolarHBondContact O-CB 3.15Å; V433-R494 HydrophobicContact CG1-CB 3.87Å; V433-P495 HydrophobicContact CG1-CG 4.29Å; V433-F497 HydrophobicContact CG2-CD2 3.88Å; V433-F497 HydrophobicContact CG2-CE2 3.61Å; V433-F497 HydrophobicContact CG2-CG 4.44Å; V433-F497 HydrophobicContact CG2-CZ 3.97Å; V433-L500 HydrophobicContact CG1-CD1 4.11Å
434	W	98.5	Very high	94.4	Very high	1 Å²	1	20.7 Å²	20.7	0%	0.004	11%	0.105	C	C	.	.	H	α-helix	trans	-61.4	-46.6	171.8	177.2	-74.9	0	0	0	111.7	W416 A418 P419 K430 S431 D432 F436 G437 I438 I463 W487	W416-W434 VanDerWaalsContact O-CD1 3.29Å; A418-W434 HydrophobicContact CB-CB 3.67Å; A418-W434 HydrophobicContact CB-CD2 4.09Å; A418-W434 HydrophobicContact CB-CG 3.66Å; P419-W434 HydrophobicContact CG-CE3 4.49Å; P419-W434 HydrophobicContact CG-CH2 3.68Å; P419-W434 HydrophobicContact CG-CZ2 4.02Å; P419-W434 HydrophobicContact CG-CZ3 3.93Å; K430-W434 PolarHBondContact O-N 3.35Å; S431-W434 WeakPolarHBondContact O-CB 3.4Å; S431-W434 PolarHBondContact O-N 3.39Å; D432-W434 VanDerWaalsContact C-N 3.28Å; D432-W434 PolarHBondContact O-N 3.2Å; W434-F436 VanDerWaalsContact C-N 3.26Å; W434-F436 PolarHBondContact O-N 3.35Å; W434-G437 PolarHBondContact O-N 2.92Å; W434-G437 VanDerWaalsContact O-N 3.1Å; W434-I438 PolarHBondContact O-N 3.26Å; W434-I463 HydrophobicContact CH2-CG2 3.61Å; W434-I463 HydrophobicContact CZ2-CD1 4.42Å; W434-I463 HydrophobicContact CZ2-CG2 3.7Å; W434-W487 AromaticContact CD2-CD1 3.78Å; W434-W487 AromaticContact CE2-CD1 3.89Å; W434-W487 HydrophobicContact CE3-CB 4.11Å; W434-W487 HydrophobicContact CH2-CB 4.11Å; W434-W487 HydrophobicContact CZ3-CB 3.86Å; W434-W487 VanDerWaalsContact CZ3-O 3.32Å; W434-W487 WeakPolarHBondContact CZ3-O 3.47Å; W434-W487 PolarHBondContact O-NE1 2.96Å
435	S	98.3	Very high	95.1	Very high	5 Å²	5	15.3 Å²	15.3	4%	0.035	8%	0.076	C	C	.	.	H	α-helix	trans	-60.6	-38	178.2	-52.1	0	0	0	0	111.1	L372 W416 S431 D432 G437 I438 L439	L372-S435 WeakPolarHBondContact O-CB 3.5Å; W416-S435 WeakPolarHBondContact O-CA 3.43Å; W416-S435 PolarHBondContact O-OG 3.14Å; W416-S435 VanDerWaalsContact O-OG 3.07Å; S431-S435 PolarHBondContact O-N 3.39Å; S431-S435 PolarHBondContact O-OG 3.22Å; D432-S435 CarbonylContact O-C 3.58Å; D432-S435 WeakPolarHBondContact O-CA 3.29Å; D432-S435 WeakPolarHBondContact O-CB 3.48Å; D432-S435 PolarHBondContact O-N 2.99Å; D432-S435 VanDerWaalsContact O-N 3.08Å; S435-G437 PolarHBondContact O-N 3.08Å; S435-I438 WeakPolarHBondContact O-CB 3.45Å; S435-I438 PolarHBondContact O-N 3.44Å; S435-I438 VanDerWaalsContact O-N 3.15Å; S435-L439 PolarHBondContact O-N 3.33Å
436	F	98.8	Very high	96	Very high	0 Å²	0	13 Å²	13	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-61.1	-41.9	173.1	-175.4	-104.7	0	0	0	112.1	I355 A356 L372 D432 V433 W434 I438 L439 L440 F497 L500 L504	I355-F436 HydrophobicContact CB-CE2 4.2Å; I355-F436 HydrophobicContact CG2-CD2 4.16Å; I355-F436 HydrophobicContact CG2-CE2 3.89Å; A356-F436 HydrophobicContact CB-CE2 4.19Å; A356-F436 HydrophobicContact CB-CZ 3.82Å; L372-F436 HydrophobicContact CD2-CB 3.81Å; L372-F436 HydrophobicContact CD2-CD2 4.09Å; L372-F436 HydrophobicContact CD2-CG 4.46Å; D432-F436 PolarHBondContact O-N 3.39Å; V433-F436 WeakPolarHBondContact O-CB 3.23Å; V433-F436 PolarHBondContact O-N 3.04Å; W434-F436 VanDerWaalsContact C-N 3.26Å; W434-F436 PolarHBondContact O-N 3.35Å; F436-I438 VanDerWaalsContact C-N 3.28Å; F436-I438 PolarHBondContact O-N 2.79Å; F436-L439 HydrophobicContact CD2-CD2 4.14Å; F436-L439 CarbonylContact O-C 3.59Å; F436-L439 WeakPolarHBondContact O-CA 3.5Å; F436-L439 WeakPolarHBondContact O-CB 3.34Å; F436-L439 PolarHBondContact O-N 3.49Å; F436-L439 VanDerWaalsContact O-N 3.08Å; F436-L440 HydrophobicContact CD1-CD1 4.05Å; F436-L440 HydrophobicContact CD1-CG 4.08Å; F436-L440 HydrophobicContact CE1-CD1 3.74Å; F436-L440 HydrophobicContact CE1-CD2 3.81Å; F436-L440 HydrophobicContact CE1-CG 3.81Å; F436-L440 HydrophobicContact CE2-CD2 4.36Å; F436-L440 HydrophobicContact CZ-CD1 4.49Å; F436-L440 HydrophobicContact CZ-CD2 3.71Å; F436-L440 HydrophobicContact CZ-CG 4.16Å; F436-L440 WeakPolarHBondContact O-CG 3.14Å; F436-L440 PolarHBondContact O-N 3.28Å; F436-F497 HydrophobicContact CB-CE1 3.69Å; F436-F497 HydrophobicContact CB-CZ 3.98Å; F436-F497 HydrophobicContact CD1-CE1 4.26Å; F436-F497 AromaticContact CD2-CE1 3.92Å; F436-F497 HydrophobicContact CD2-CE1 3.92Å; F436-F497 AromaticContact CG-CE1 3.7Å; F436-F497 HydrophobicContact CG-CE1 3.7Å; F436-F497 HydrophobicContact CG-CZ 4.47Å; F436-L500 HydrophobicContact CD1-CD1 3.71Å; F436-L500 HydrophobicContact CE1-CB 4.38Å; F436-L500 HydrophobicContact CE1-CD1 3.98Å; F436-L500 HydrophobicContact CE1-CD2 4.48Å; F436-L504 HydrophobicContact CE1-CD1 4.16Å; F436-L504 HydrophobicContact CZ-CD1 3.81Å
437	G	98.6	Very high	96.6	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-58	-39.8	173.1	0	0	0	0	0	112.8	V433 W434 S435 L440 Y441 W487	V433-G437 PolarHBondContact O-N 3.12Å; V433-G437 VanDerWaalsContact O-N 3.11Å; W434-G437 PolarHBondContact O-N 2.92Å; W434-G437 VanDerWaalsContact O-N 3.1Å; S435-G437 PolarHBondContact O-N 3.08Å; G437-L440 PolarHBondContact O-N 3.5Å; G437-Y441 PolarHBondContact O-N 2.9Å; G437-W487 VanDerWaalsContact C-CZ2 3.41Å; G437-W487 WeakPolarHBondContact O-CZ2 3.03Å
438	I	98.6	Very high	97.1	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-67.7	-39	174.5	-56.9	-68.4	0	0	0	111	W416 W434 S435 F436 Y441 E442 P450 Y451 L469 W487	W416-I438 HydrophobicContact CD2-CG2 4.35Å; W416-I438 HydrophobicContact CG-CB 4.47Å; W416-I438 HydrophobicContact CG-CG2 3.91Å; W434-I438 PolarHBondContact O-N 3.26Å; S435-I438 WeakPolarHBondContact O-CB 3.45Å; S435-I438 PolarHBondContact O-N 3.44Å; S435-I438 VanDerWaalsContact O-N 3.15Å; F436-I438 VanDerWaalsContact C-N 3.28Å; F436-I438 PolarHBondContact O-N 2.79Å; I438-Y441 VanDerWaalsContact O-CB 3.31Å; I438-Y441 WeakPolarHBondContact O-CB 3.45Å; I438-Y441 PolarHBondContact O-N 2.99Å; I438-Y441 VanDerWaalsContact O-N 3.16Å; I438-E442 PolarHBondContact O-N 3.31Å; I438-P450 HydrophobicContact CG2-CB 3.91Å; I438-P450 HydrophobicContact CG2-CG 3.83Å; I438-Y451 HydrophobicContact CD1-CE2 4.06Å; I438-L469 HydrophobicContact CD1-CD1 4.14Å; I438-W487 HydrophobicContact CD1-CZ2 3.68Å; I438-W487 HydrophobicContact CG1-CZ2 4.38Å
439	L	98.7	Very high	97.4	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-62	-41.1	174	171.2	61.4	0	0	0	112.3	L331 I355 L372 A374 V377 S435 F436 Y441 E442 I443	L331-L439 HydrophobicContact CD2-CD1 4.3Å; I355-L439 HydrophobicContact CD1-CD2 4.11Å; I355-L439 HydrophobicContact CG2-CD2 3.72Å; L372-L439 HydrophobicContact CD1-CD2 4.01Å; L372-L439 HydrophobicContact CD2-CD2 4.46Å; L372-L439 HydrophobicContact CG-CD2 4.04Å; A374-L439 VanDerWaalsContact CA-CD1 3.5Å; A374-L439 HydrophobicContact CB-CD1 3.7Å; V377-L439 HydrophobicContact CG2-CD2 4.25Å; S435-L439 PolarHBondContact O-N 3.33Å; F436-L439 HydrophobicContact CD2-CD2 4.14Å; F436-L439 CarbonylContact O-C 3.59Å; F436-L439 WeakPolarHBondContact O-CA 3.5Å; F436-L439 WeakPolarHBondContact O-CB 3.34Å; F436-L439 PolarHBondContact O-N 3.49Å; F436-L439 VanDerWaalsContact O-N 3.08Å; L439-Y441 VanDerWaalsContact C-N 3.26Å; L439-Y441 PolarHBondContact O-N 3.19Å; L439-E442 WeakPolarHBondContact O-CB 3.43Å; L439-E442 PolarHBondContact O-N 2.86Å; L439-E442 VanDerWaalsContact O-N 3.11Å; L439-I443 HydrophobicContact CD1-CD1 4.19Å; L439-I443 HydrophobicContact CD1-CG1 4.26Å; L439-I443 HydrophobicContact CG-CD1 4.11Å; L439-I443 WeakPolarHBondContact O-CG1 3.46Å; L439-I443 PolarHBondContact O-N 3.38Å
440	L	98.6	Very high	97.4	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-59.5	-39.6	173	-66.2	-179.8	0	0	0	111.3	A352 F436 G437 I443 M444 M479 L482 M483	A352-L440 HydrophobicContact CB-CD2 3.43Å; A352-L440 VanDerWaalsContact CB-CD2 3.43Å; F436-L440 HydrophobicContact CD1-CD1 4.05Å; F436-L440 HydrophobicContact CD1-CG 4.08Å; F436-L440 HydrophobicContact CE1-CD1 3.74Å; F436-L440 HydrophobicContact CE1-CD2 3.81Å; F436-L440 HydrophobicContact CE1-CG 3.81Å; F436-L440 HydrophobicContact CE2-CD2 4.36Å; F436-L440 HydrophobicContact CZ-CD1 4.49Å; F436-L440 HydrophobicContact CZ-CD2 3.71Å; F436-L440 HydrophobicContact CZ-CG 4.16Å; F436-L440 WeakPolarHBondContact O-CG 3.14Å; F436-L440 PolarHBondContact O-N 3.28Å; G437-L440 PolarHBondContact O-N 3.5Å; L440-I443 PolarHBondContact O-N 2.92Å; L440-M444 WeakPolarHBondContact O-CB 3.45Å; L440-M444 VanDerWaalsContact O-CG 3.32Å; L440-M444 WeakPolarHBondContact O-CG 3.46Å; L440-M444 PolarHBondContact O-N 3.34Å; L440-M479 HydrophobicContact CD1-SD 4.07Å; L440-M479 HydrophobicContact CD2-SD 4.05Å; L440-M479 HydrophobicContact CG-SD 4.46Å; L440-L482 HydrophobicContact CD1-CD2 3.91Å; L440-L482 HydrophobicContact CD1-CG 4.24Å; L440-M483 HydrophobicContact CB-CE 3.91Å; L440-M483 HydrophobicContact CB-CG 3.84Å; L440-M483 HydrophobicContact CB-SD 4.47Å; L440-M483 HydrophobicContact CD1-CG 4.13Å; L440-M483 WeakPolarHBondContact O-CE 3.39Å
441	Y	98.4	Very high	97.3	Very high	22 Å²	22	14 Å²	14	9%	0.086	7%	0.066	C	C	.	.	H	α-helix	trans	-62.1	-45.1	172.8	177	-82.6	0	0	0	111.5	G437 I438 L439 I443 M444 T445 L469 P472	G437-Y441 PolarHBondContact O-N 2.9Å; I438-Y441 VanDerWaalsContact O-CB 3.31Å; I438-Y441 WeakPolarHBondContact O-CB 3.45Å; I438-Y441 PolarHBondContact O-N 2.99Å; I438-Y441 VanDerWaalsContact O-N 3.16Å; L439-Y441 VanDerWaalsContact C-N 3.26Å; L439-Y441 PolarHBondContact O-N 3.19Å; Y441-I443 VanDerWaalsContact C-N 3.34Å; Y441-I443 PolarHBondContact O-N 3.24Å; Y441-M444 PolarHBondContact O-N 3.38Å; Y441-T445 HydrophobicContact CD1-CG2 4.24Å; Y441-T445 HydrophobicContact CD2-CG2 4.4Å; Y441-T445 HydrophobicContact CE1-CG2 3.86Å; Y441-T445 HydrophobicContact CE2-CG2 4.06Å; Y441-T445 HydrophobicContact CG-CG2 4.47Å; Y441-T445 WeakPolarHBondContact O-CB 3.45Å; Y441-T445 VanDerWaalsContact O-CG2 3.32Å; Y441-T445 WeakPolarHBondContact O-CG2 3.5Å; Y441-T445 PolarHBondContact O-N 2.87Å; Y441-T445 PolarHBondContact O-OG1 2.9Å; Y441-L469 HydrophobicContact CD1-CD1 4.11Å; Y441-L469 HydrophobicContact CD2-CB 4.06Å; Y441-L469 HydrophobicContact CD2-CD1 3.81Å; Y441-L469 HydrophobicContact CD2-CG 4.45Å; Y441-L469 HydrophobicContact CE1-CD1 4.33Å; Y441-L469 HydrophobicContact CE2-CB 4.05Å; Y441-L469 HydrophobicContact CE2-CD1 4.02Å; Y441-L469 HydrophobicContact CE2-CD2 4.33Å; Y441-L469 HydrophobicContact CE2-CG 4.35Å; Y441-L469 HydrophobicContact CG-CD1 3.86Å; Y441-P472 HydrophobicContact CD2-CG 3.75Å; Y441-P472 HydrophobicContact CE2-CG 3.9Å
442	E	98.5	Very high	97.2	Very high	3 Å²	3	17.8 Å²	17.8	1%	0.014	9%	0.093	C	C	.	.	H	α-helix	trans	-58.2	-46.5	175.1	-67.5	-177.8	101.7	0	0	111.2	A374 W416 I438 L439 T445 F446 G447	A374-E442 HydrophobicContact CB-CB 4.04Å; A374-E442 HydrophobicContact CB-CG 4.46Å; A374-E442 PolarHBondContact N-OE2 3.25Å; W416-E442 WeakPolarHBondContact CZ2-OE1 3.21Å; W416-E442 VanDerWaalsContact NE1-CD 3.3Å; W416-E442 PolarHBondContact NE1-OE2 2.99Å; I438-E442 PolarHBondContact O-N 3.31Å; L439-E442 WeakPolarHBondContact O-CB 3.43Å; L439-E442 PolarHBondContact O-N 2.86Å; L439-E442 VanDerWaalsContact O-N 3.11Å; E442-T445 PolarHBondContact O-N 3.38Å; E442-T445 PolarHBondContact O-OG1 3.44Å; E442-F446 PolarHBondContact O-N 3.27Å; E442-F446 VanDerWaalsContact O-N 3.13Å; E442-G447 PolarHBondContact O-N 3.18Å
443	I	98.1	Very high	97.1	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-57.9	-53.6	177.8	-70.4	168.2	0	0	0	110.5	L331 L335 Q348 A352 I355 L439 L440 Y441 T445 F446	L331-I443 HydrophobicContact CD2-CD1 4.18Å; L331-I443 HydrophobicContact CD2-CG1 4.02Å; L335-I443 HydrophobicContact CD1-CG1 4.25Å; Q348-I443 HydrophobicContact CB-CG2 3.64Å; Q348-I443 HydrophobicContact CG-CG2 4.07Å; Q348-I443 PolarHBondContact NE2-O 3.14Å; Q348-I443 WeakPolarHBondContact O-CG2 3.47Å; A352-I443 HydrophobicContact CB-CD1 4.17Å; I355-I443 HydrophobicContact CD1-CD1 3.97Å; L439-I443 HydrophobicContact CD1-CD1 4.19Å; L439-I443 HydrophobicContact CD1-CG1 4.26Å; L439-I443 HydrophobicContact CG-CD1 4.11Å; L439-I443 WeakPolarHBondContact O-CG1 3.46Å; L439-I443 PolarHBondContact O-N 3.38Å; L440-I443 PolarHBondContact O-N 2.92Å; Y441-I443 VanDerWaalsContact C-N 3.34Å; Y441-I443 PolarHBondContact O-N 3.24Å; I443-T445 PolarHBondContact O-N 2.72Å; I443-F446 PolarHBondContact O-N 3.43Å
444	M	97.2	Very high	96.8	Very high	10 Å²	10	25.9 Å²	25.9	5%	0.049	14%	0.14	C	C	.	.	H	α-helix	trans	-69.1	-15.2	-176	-67.8	-62.8	161.7	0	0	113.9	Q348 I349 L440 Y441 P472 C475 M479 M483	Q348-M444 HydrophobicContact CB-CE 4Å; Q348-M444 HydrophobicContact CB-SD 4.34Å; I349-M444 HydrophobicContact CG1-CE 3.77Å; L440-M444 WeakPolarHBondContact O-CB 3.45Å; L440-M444 VanDerWaalsContact O-CG 3.32Å; L440-M444 WeakPolarHBondContact O-CG 3.46Å; L440-M444 PolarHBondContact O-N 3.34Å; Y441-M444 PolarHBondContact O-N 3.38Å; M444-P472 HydrophobicContact CB-CB 4.5Å; M444-P472 HydrophobicContact CB-CG 4.29Å; M444-C475 HydrophobicContact CB-CB 4.39Å; M444-M479 HydrophobicContact CE-CB 4.4Å; M444-M479 HydrophobicContact CE-CE 3.78Å; M444-M479 HydrophobicContact CE-CG 3.55Å; M444-M479 HydrophobicContact CE-SD 3.9Å; M444-M479 HydrophobicContact CG-CG 3.91Å; M444-M479 HydrophobicContact SD-CG 4.19Å; M444-M483 HydrophobicContact CB-CE 4.01Å; M444-M483 HydrophobicContact CG-CE 3.68Å
445	T	96.8	Very high	96.5	Very high	9 Å²	9	29.7 Å²	29.7	6%	0.055	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	6.9	178.4	58	0	0	0	0	113.8	Y441 E442 I443 G447 Q448 P472	Y441-T445 HydrophobicContact CD1-CG2 4.24Å; Y441-T445 HydrophobicContact CD2-CG2 4.4Å; Y441-T445 HydrophobicContact CE1-CG2 3.86Å; Y441-T445 HydrophobicContact CE2-CG2 4.06Å; Y441-T445 HydrophobicContact CG-CG2 4.47Å; Y441-T445 WeakPolarHBondContact O-CB 3.45Å; Y441-T445 VanDerWaalsContact O-CG2 3.32Å; Y441-T445 WeakPolarHBondContact O-CG2 3.5Å; Y441-T445 PolarHBondContact O-N 2.87Å; Y441-T445 PolarHBondContact O-OG1 2.9Å; E442-T445 PolarHBondContact O-N 3.38Å; E442-T445 PolarHBondContact O-OG1 3.44Å; I443-T445 PolarHBondContact O-N 2.72Å; T445-G447 VanDerWaalsContact C-N 3.35Å; T445-Q448 WeakPolarHBondContact O-CG 3.5Å; T445-Q448 WeakPolarHBondContact OG1-CB 3.37Å; T445-Q448 PolarHBondContact OG1-N 3.42Å; T445-P472 HydrophobicContact CG2-CB 3.64Å; T445-P472 HydrophobicContact CG2-CG 3.85Å
446	F	97.3	Very high	96	Very high	46 Å²	46	33 Å²	33	20%	0.202	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	43.8	-175.6	-61.7	-86.8	0	0	0	113.3	L335 R336 G340 L343 E442 I443	L335-F446 HydrophobicContact CD2-CD1 4.24Å; R336-F446 WeakPolarHBondContact CG-O 3.21Å; G340-F446 VanDerWaalsContact N-CD1 3.32Å; L343-F446 HydrophobicContact CB-CE1 4.1Å; E442-F446 PolarHBondContact O-N 3.27Å; E442-F446 VanDerWaalsContact O-N 3.13Å; I443-F446 PolarHBondContact O-N 3.43Å
447	G	96.6	Very high	95.5	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.01	20%	0.203	C	C	.	.	S	Bend	trans	80.4	27	173.7	0	0	0	0	0	114.7	R336 E442 T445	R336-G447 PolarHBondContact NE-O 2.59Å; R336-G447 PolarHBondContact NH2-O 3.16Å; E442-G447 PolarHBondContact O-N 3.18Å; T445-G447 VanDerWaalsContact C-N 3.35Å
448	Q	96.1	Very high	95.2	Very high	105 Å²	105	42.2 Å²	42.2	49%	0.491	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-65.6	141.7	172.6	-72.1	178.7	14.7	0	0	110.8	T445 P450	T445-Q448 WeakPolarHBondContact O-CG 3.5Å; T445-Q448 WeakPolarHBondContact OG1-CB 3.37Å; T445-Q448 PolarHBondContact OG1-N 3.42Å; Q448-P450 WeakPolarHBondContact O-CD 3.35Å
449	M	95.3	Very high	94.9	Very high	81 Å²	81	42.3 Å²	42.3	40%	0.399	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-62.4	123.2	175.2	178.4	62	62.5	0	0	109.9	K415 W416 S452	K415-M449 HydrophobicContact CD-SD 4.15Å; W416-M449 HydrophobicContact CH2-CE 4.24Å; W416-M449 HydrophobicContact CH2-SD 3.64Å; W416-M449 HydrophobicContact CZ3-SD 4.28Å; M449-S452 WeakPolarHBondContact O-CB 3.48Å; M449-S452 PolarHBondContact O-N 2.63Å
450	P	95.1	Very high	94.5	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	143.4	174.5	25.5	-34.8	0	0	0	110.3	K415 W416 I438 Q448 S452 L469	K415-P450 HydrophobicContact CB-CG 4.05Å; K415-P450 WeakPolarHBondContact CD-O 3.5Å; K415-P450 PolarHBondContact NZ-O 3.48Å; K415-P450 VanDerWaalsContact NZ-O 3.14Å; W416-P450 HydrophobicContact CD2-CG 4.34Å; W416-P450 HydrophobicContact CH2-CG 3.88Å; W416-P450 HydrophobicContact CZ2-CG 3.64Å; W416-P450 HydrophobicContact CZ3-CG 4.33Å; I438-P450 HydrophobicContact CG2-CB 3.91Å; I438-P450 HydrophobicContact CG2-CG 3.83Å; Q448-P450 WeakPolarHBondContact O-CD 3.35Å; P450-S452 PolarHBondContact O-N 3.5Å; P450-L469 HydrophobicContact CB-CD1 4.17Å
451	Y	94.7	Very high	94.2	Very high	8 Å²	8	47.9 Å²	47.9	3%	0.031	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	43.7	-178	-41.4	-82.9	0	0	0	112.3	K415 I438 T453 M454 A459 W462 I463 L469	K415-Y451 HydrophobicContact CB-CD2 4.1Å; K415-Y451 HydrophobicContact CG-CD2 4.2Å; K415-Y451 PolarHBondContact NZ-O 3.27Å; I438-Y451 HydrophobicContact CD1-CE2 4.06Å; Y451-T453 PolarHBondContact O-N 3.22Å; Y451-T453 VanDerWaalsContact O-N 3.07Å; Y451-M454 HydrophobicContact CD1-SD 4.39Å; Y451-M454 PolarHBondContact O-N 3.15Å; Y451-A459 HydrophobicContact CD1-CB 4.45Å; Y451-A459 HydrophobicContact CD2-CB 4.2Å; Y451-A459 HydrophobicContact CG-CB 3.98Å; Y451-W462 HydrophobicContact CD1-CE3 4.21Å; Y451-W462 HydrophobicContact CD1-CZ3 4.2Å; Y451-W462 AromaticContact CE1-CE3 3.92Å; Y451-W462 HydrophobicContact CE1-CE3 3.92Å; Y451-W462 AromaticContact CE1-CZ3 3.73Å; Y451-W462 HydrophobicContact CE1-CZ3 3.73Å; Y451-I463 HydrophobicContact CE1-CD1 4.16Å; Y451-I463 HydrophobicContact CE1-CG1 4.12Å; Y451-I463 HydrophobicContact CE2-CD1 4.15Å; Y451-L469 HydrophobicContact CD1-CD2 3.66Å; Y451-L469 HydrophobicContact CD1-CG 4.11Å; Y451-L469 HydrophobicContact CE1-CD1 4.14Å; Y451-L469 HydrophobicContact CE1-CD2 3.67Å; Y451-L469 HydrophobicContact CE1-CG 3.58Å; Y451-L469 HydrophobicContact CE2-CD1 4.18Å; Y451-L469 HydrophobicContact CG-CD2 4.23Å
452	S	92.6	Very high	94.1	Very high	82 Å²	82	49.9 Å²	49.9	57%	0.573	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-27.8	-170.4	55.5	0	0	0	0	114	M449 P450 M454	M449-S452 WeakPolarHBondContact O-CB 3.48Å; M449-S452 PolarHBondContact O-N 2.63Å; P450-S452 PolarHBondContact O-N 3.5Å; S452-M454 VanDerWaalsContact C-N 3.34Å
453	T	94.1	Very high	93.9	Very high	125 Å²	125	50.3 Å²	50.3	77%	0.767	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	0.3	178.6	61.7	0	0	0	0	114.1	Y451	Y451-T453 PolarHBondContact O-N 3.22Å; Y451-T453 VanDerWaalsContact O-N 3.07Å
454	M	92.7	Very high	93.6	Very high	45 Å²	45	53.4 Å²	53.4	22%	0.222	28%	0.284	C	S	.	.	S	Bend	trans	-122.1	142.2	-174.1	-58.4	-179.4	-175.6	0	0	111.5	K415 Y451 S452 Q458 A459 W462	K415-M454 WeakPolarHBondContact CE-O 3.35Å; K415-M454 PolarHBondContact NZ-O 2.71Å; Y451-M454 HydrophobicContact CD1-SD 4.39Å; Y451-M454 PolarHBondContact O-N 3.15Å; S452-M454 VanDerWaalsContact C-N 3.34Å; M454-Q458 HydrophobicContact CB-CB 3.94Å; M454-Q458 HydrophobicContact CG-CB 4.45Å; M454-A459 HydrophobicContact CB-CB 4.4Å; M454-W462 HydrophobicContact CE-CB 4.41Å; M454-W462 HydrophobicContact CE-CD2 3.91Å; M454-W462 HydrophobicContact CE-CG 3.82Å; M454-W462 HydrophobicContact SD-CB 4.07Å; M454-W462 HydrophobicContact SD-CD2 4.32Å; M454-W462 HydrophobicContact SD-CG 4.08Å
455	T	91.9	Very high	93.5	Very high	81 Å²	81	62.1 Å²	62.1	50%	0.497	32%	0.316	S	S	.	.			trans	-67.8	165.3	163.5	69.4	0	0	0	0	110.6	M457 Q458 A459	T455-M457 VanDerWaalsContact C-N 3.32Å; T455-M457 PolarHBondContact O-N 3.33Å; T455-Q458 PolarHBondContact O-N 3.24Å; T455-Q458 WeakPolarHBondContact OG1-CG 3.18Å; T455-Q458 PolarHBondContact OG1-N 3.37Å; T455-Q458 PolarHBondContact OG1-OE1 3.35Å; T455-A459 PolarHBondContact O-N 2.89Å
456	N	88.1	Confident	93.4	Very high	76 Å²	76	63.8 Å²	63.8	41%	0.406	34%	0.335	S	S	.	.	H	α-helix	trans	-55.3	-45.9	177.7	-73.5	-4.4	0	0	0	112.2	V414 K415 Q458 A459 V460	V414-N456 HydrophobicContact CB-CB 3.98Å; V414-N456 HydrophobicContact CG1-CB 3.92Å; V414-N456 HydrophobicContact CG2-CB 4.18Å; K415-N456 WeakPolarHBondContact CE-OD1 3.44Å; N456-Q458 PolarHBondContact O-N 2.83Å; N456-A459 PolarHBondContact O-N 3.36Å; N456-V460 WeakPolarHBondContact O-CG2 3.4Å; N456-V460 PolarHBondContact O-N 3.4Å
457	M	88.1	Confident	93.3	Very high	95 Å²	95	64.5 Å²	64.5	47%	0.468	34%	0.341	S	S	.	.	H	α-helix	trans	-65.5	-38.6	178.6	-72.7	-57.8	-59.3	0	0	112.8	T455 V460 Q461	T455-M457 VanDerWaalsContact C-N 3.32Å; T455-M457 PolarHBondContact O-N 3.33Å; M457-V460 PolarHBondContact O-N 2.91Å; M457-Q461 WeakPolarHBondContact O-CG 3.43Å; M457-Q461 PolarHBondContact O-N 3.34Å
458	Q	92.9	Very high	93.4	Very high	98 Å²	98	66.7 Å²	66.7	46%	0.458	35%	0.349	S	S	.	.	H	α-helix	trans	-65.3	-42.1	175.8	-74.8	171.1	-33.1	0	0	111.4	M454 T455 N456 Q461 W462	M454-Q458 HydrophobicContact CB-CB 3.94Å; M454-Q458 HydrophobicContact CG-CB 4.45Å; T455-Q458 PolarHBondContact O-N 3.24Å; T455-Q458 WeakPolarHBondContact OG1-CG 3.18Å; T455-Q458 PolarHBondContact OG1-N 3.37Å; T455-Q458 PolarHBondContact OG1-OE1 3.35Å; N456-Q458 PolarHBondContact O-N 2.83Å; Q458-Q461 PolarHBondContact O-N 3.39Å; Q458-W462 VanDerWaalsContact O-CB 3.25Å; Q458-W462 WeakPolarHBondContact O-CB 3.33Å; Q458-W462 PolarHBondContact O-N 3.47Å
459	A	92	Very high	93.4	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.008	33%	0.329	C	S	.	.	H	α-helix	trans	-60.7	-47	176.4	0	0	0	0	0	111.2	Y451 M454 T455 N456 Q461 W462 I463	Y451-A459 HydrophobicContact CD1-CB 4.45Å; Y451-A459 HydrophobicContact CD2-CB 4.2Å; Y451-A459 HydrophobicContact CG-CB 3.98Å; M454-A459 HydrophobicContact CB-CB 4.4Å; T455-A459 PolarHBondContact O-N 2.89Å; N456-A459 PolarHBondContact O-N 3.36Å; A459-Q461 PolarHBondContact O-N 3.48Å; A459-W462 PolarHBondContact O-N 3.42Å; A459-I463 WeakPolarHBondContact O-CB 3.36Å; A459-I463 WeakPolarHBondContact O-CD1 3.19Å; A459-I463 VanDerWaalsContact O-CG1 3.23Å; A459-I463 WeakPolarHBondContact O-CG1 3.49Å; A459-I463 PolarHBondContact O-N 3.35Å
460	V	89.9	Confident	93.5	Very high	12 Å²	12	62.7 Å²	62.7	7%	0.073	34%	0.337	C	S	.	.	H	α-helix	trans	-56.9	-50.8	176.1	173.2	0	0	0	0	111.2	V414 I422 N456 M457 W462 I463 S464	V414-V460 HydrophobicContact CG1-CG2 3.47Å; V414-V460 VanDerWaalsContact CG1-CG2 3.47Å; I422-V460 HydrophobicContact CD1-CG2 3.88Å; I422-V460 HydrophobicContact CG2-CG1 4.46Å; I422-V460 HydrophobicContact CG2-CG2 4.39Å; N456-V460 WeakPolarHBondContact O-CG2 3.4Å; N456-V460 PolarHBondContact O-N 3.4Å; M457-V460 PolarHBondContact O-N 2.91Å; V460-W462 VanDerWaalsContact C-N 3.28Å; V460-W462 PolarHBondContact O-N 2.88Å; V460-I463 PolarHBondContact O-N 2.9Å; V460-S464 WeakPolarHBondContact O-CB 3.25Å; V460-S464 PolarHBondContact O-N 3.03Å; V460-S464 PolarHBondContact O-OG 3.4Å
461	Q	92.6	Very high	93.6	Very high	105 Å²	105	65.4 Å²	65.4	49%	0.491	36%	0.356	S	S	.	.	H	α-helix	trans	-61.9	-36.9	179.2	-72.1	177.1	-3.3	0	0	112.7	M457 Q458 A459 R465	M457-Q461 WeakPolarHBondContact O-CG 3.43Å; M457-Q461 PolarHBondContact O-N 3.34Å; Q458-Q461 PolarHBondContact O-N 3.39Å; A459-Q461 PolarHBondContact O-N 3.48Å; Q461-R465 WeakPolarHBondContact O-CG 2.98Å; Q461-R465 PolarHBondContact O-N 2.91Å
462	W	95.5	Very high	93.5	Very high	65 Å²	65	65.4 Å²	65.4	25%	0.246	36%	0.357	C	S	.	.	H	α-helix	trans	-69.7	-43.6	-179.7	-172	82.2	0	0	0	111.9	Y451 M454 Q458 A459 V460 R465 N467 R468	Y451-W462 HydrophobicContact CD1-CE3 4.21Å; Y451-W462 HydrophobicContact CD1-CZ3 4.2Å; Y451-W462 AromaticContact CE1-CE3 3.92Å; Y451-W462 HydrophobicContact CE1-CE3 3.92Å; Y451-W462 AromaticContact CE1-CZ3 3.73Å; Y451-W462 HydrophobicContact CE1-CZ3 3.73Å; M454-W462 HydrophobicContact CE-CB 4.41Å; M454-W462 HydrophobicContact CE-CD2 3.91Å; M454-W462 HydrophobicContact CE-CG 3.82Å; M454-W462 HydrophobicContact SD-CB 4.07Å; M454-W462 HydrophobicContact SD-CD2 4.32Å; M454-W462 HydrophobicContact SD-CG 4.08Å; Q458-W462 VanDerWaalsContact O-CB 3.25Å; Q458-W462 WeakPolarHBondContact O-CB 3.33Å; Q458-W462 PolarHBondContact O-N 3.47Å; A459-W462 PolarHBondContact O-N 3.42Å; V460-W462 VanDerWaalsContact C-N 3.28Å; V460-W462 PolarHBondContact O-N 2.88Å; W462-R465 PolarHBondContact O-N 3.47Å; W462-N467 HydrophobicContact CD2-CB 3.4Å; W462-N467 VanDerWaalsContact CD2-CB 3.4Å; W462-N467 HydrophobicContact CE3-CB 3.54Å; W462-N467 HydrophobicContact CG-CB 4.14Å; W462-N467 HydrophobicContact CH2-CB 3.61Å; W462-N467 HydrophobicContact CZ2-CB 3.42Å; W462-N467 VanDerWaalsContact CZ2-CB 3.42Å; W462-N467 HydrophobicContact CZ3-CB 3.62Å; W462-N467 WeakPolarHBondContact O-CB 2.97Å; W462-N467 PolarHBondContact O-ND2 3.48Å; W462-R468 VanDerWaalsContact CH2-C 3.41Å; W462-R468 WeakPolarHBondContact CH2-O 3.38Å
463	I	94.3	Very high	93.4	Very high	11 Å²	11	66.8 Å²	66.8	6%	0.056	36%	0.364	C	S	.	.	H	α-helix	trans	-63.3	-42.5	175.7	-66.5	163	0	0	0	110.9	P419 W434 Y451 A459 V460 R465 G466 R468	P419-I463 HydrophobicContact CG-CG2 3.78Å; W434-I463 HydrophobicContact CH2-CG2 3.61Å; W434-I463 HydrophobicContact CZ2-CD1 4.42Å; W434-I463 HydrophobicContact CZ2-CG2 3.7Å; Y451-I463 HydrophobicContact CE1-CD1 4.16Å; Y451-I463 HydrophobicContact CE1-CG1 4.12Å; Y451-I463 HydrophobicContact CE2-CD1 4.15Å; A459-I463 WeakPolarHBondContact O-CB 3.36Å; A459-I463 WeakPolarHBondContact O-CD1 3.19Å; A459-I463 VanDerWaalsContact O-CG1 3.23Å; A459-I463 WeakPolarHBondContact O-CG1 3.49Å; A459-I463 PolarHBondContact O-N 3.35Å; V460-I463 PolarHBondContact O-N 2.9Å; I463-R465 PolarHBondContact O-N 3.04Å; I463-R465 VanDerWaalsContact O-N 3.13Å; I463-G466 PolarHBondContact O-N 3.32Å; I463-R468 PolarHBondContact O-NH1 3.36Å
464	S	91.3	Very high	92.9	Very high	66 Å²	66	72.2 Å²	72.2	46%	0.462	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-15.1	178.1	-61.8	0	0	0	0	113.9	H423 V460 G466	H423-S464 PolarHBondContact CE1-OG 3.38Å; V460-S464 WeakPolarHBondContact O-CB 3.25Å; V460-S464 PolarHBondContact O-N 3.03Å; V460-S464 PolarHBondContact O-OG 3.4Å; S464-G466 VanDerWaalsContact C-N 3.26Å
465	R	95.4	Very high	92.9	Very high	193 Å²	193	70.8 Å²	70.8	73%	0.728	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	8.5	171.4	-67.2	172.2	-172.5	179.5	3.1	113.2	Q461 W462 I463 N467	Q461-R465 WeakPolarHBondContact O-CG 2.98Å; Q461-R465 PolarHBondContact O-N 2.91Å; W462-R465 PolarHBondContact O-N 3.47Å; I463-R465 PolarHBondContact O-N 3.04Å; I463-R465 VanDerWaalsContact O-N 3.13Å; R465-N467 VanDerWaalsContact C-N 3.34Å; R465-N467 WeakPolarHBondContact CB-ND2 3.29Å
466	G	94.2	Very high	92.9	Very high	44 Å²	44	68 Å²	68	45%	0.454	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.2	1.1	-178.7	0	0	0	0	0	114.5	I463 S464 R468	I463-G466 PolarHBondContact O-N 3.32Å; S464-G466 VanDerWaalsContact C-N 3.26Å; G466-R468 PolarHBondContact O-NH1 2.83Å
467	N	96.8	Very high	93.1	Very high	61 Å²	61	72.6 Å²	72.6	33%	0.326	36%	0.364	S	S	.	.			trans	-74.8	151.2	-179.8	-56.7	-71.6	0	0	0	111.9	W462 R465	W462-N467 HydrophobicContact CD2-CB 3.4Å; W462-N467 VanDerWaalsContact CD2-CB 3.4Å; W462-N467 HydrophobicContact CE3-CB 3.54Å; W462-N467 HydrophobicContact CG-CB 4.14Å; W462-N467 HydrophobicContact CH2-CB 3.61Å; W462-N467 HydrophobicContact CZ2-CB 3.42Å; W462-N467 VanDerWaalsContact CZ2-CB 3.42Å; W462-N467 HydrophobicContact CZ3-CB 3.62Å; W462-N467 WeakPolarHBondContact O-CB 2.97Å; W462-N467 PolarHBondContact O-ND2 3.48Å; R465-N467 VanDerWaalsContact C-N 3.34Å; R465-N467 WeakPolarHBondContact CB-ND2 3.29Å
468	R	97.3	Very high	93.2	Very high	47 Å²	47	71.5 Å²	71.5	18%	0.177	36%	0.364	C	S	.	.			trans	-137.3	151.4	178.6	-61.4	-60.6	-178.8	-91.2	-1.5	110.3	W462 I463 G466 L484 W487	W462-R468 VanDerWaalsContact CH2-C 3.41Å; W462-R468 WeakPolarHBondContact CH2-O 3.38Å; I463-R468 PolarHBondContact O-NH1 3.36Å; G466-R468 PolarHBondContact O-NH1 2.83Å; R468-L484 HydrophobicContact CB-CD2 3.9Å; R468-L484 HydrophobicContact CG-CD2 4.2Å; R468-W487 HydrophobicContact CB-CE3 4.06Å; R468-W487 HydrophobicContact CG-CB 4.42Å; R468-W487 HydrophobicContact CG-CE3 4.46Å; R468-W487 VanDerWaalsContact CZ-O 3.3Å; R468-W487 PolarHBondContact NE-O 3.05Å; R468-W487 PolarHBondContact NH2-O 3.26Å
469	L	96.9	Very high	93.3	Very high	11 Å²	11	67 Å²	67	6%	0.058	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-53.4	139.4	178.8	-73.9	166.3	0	0	0	110.2	I438 Y441 P450 Y451 W487	I438-L469 HydrophobicContact CD1-CD1 4.14Å; Y441-L469 HydrophobicContact CD1-CD1 4.11Å; Y441-L469 HydrophobicContact CD2-CB 4.06Å; Y441-L469 HydrophobicContact CD2-CD1 3.81Å; Y441-L469 HydrophobicContact CD2-CG 4.45Å; Y441-L469 HydrophobicContact CE1-CD1 4.33Å; Y441-L469 HydrophobicContact CE2-CB 4.05Å; Y441-L469 HydrophobicContact CE2-CD1 4.02Å; Y441-L469 HydrophobicContact CE2-CD2 4.33Å; Y441-L469 HydrophobicContact CE2-CG 4.35Å; Y441-L469 HydrophobicContact CG-CD1 3.86Å; P450-L469 HydrophobicContact CB-CD1 4.17Å; Y451-L469 HydrophobicContact CD1-CD2 3.66Å; Y451-L469 HydrophobicContact CD1-CG 4.11Å; Y451-L469 HydrophobicContact CE1-CD1 4.14Å; Y451-L469 HydrophobicContact CE1-CD2 3.67Å; Y451-L469 HydrophobicContact CE1-CG 3.58Å; Y451-L469 HydrophobicContact CE2-CD1 4.18Å; Y451-L469 HydrophobicContact CG-CD2 4.23Å; L469-W487 HydrophobicContact CB-CH2 3.87Å; L469-W487 HydrophobicContact CB-CZ3 4Å; L469-W487 HydrophobicContact CD1-CH2 4.12Å; L469-W487 HydrophobicContact CD1-CZ2 4.32Å
470	P	96.4	Very high	93.5	Very high	90 Å²	90	68.5 Å²	68.5	58%	0.584	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-71.3	162.5	177.9	31.7	-35.8	0	0	0	111.2	P472	P470-P472 WeakPolarHBondContact O-CD 3.37Å
471	C	97.1	Very high	93.9	Very high	58 Å²	58	72.8 Å²	72.8	39%	0.392	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-57.4	122.4	174.5	-173.2	0	0	0	0	111	H480	C471-H480 WeakPolarHBondContact CA-CD2 3.48Å; C471-H480 HydrophobicContact CB-CB 4.18Å; C471-H480 PolarHBondContact N-NE2 2.93Å
472	P	94.4	Very high	94.1	Very high	7 Å²	7	68.4 Å²	68.4	5%	0.045	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-61.1	151.5	177.7	-23.7	32.9	0	0	0	112.9	Y441 M444 T445 P470 R474 C475	Y441-P472 HydrophobicContact CD2-CG 3.75Å; Y441-P472 HydrophobicContact CE2-CG 3.9Å; M444-P472 HydrophobicContact CB-CB 4.5Å; M444-P472 HydrophobicContact CB-CG 4.29Å; T445-P472 HydrophobicContact CG2-CB 3.64Å; T445-P472 HydrophobicContact CG2-CG 3.85Å; P470-P472 WeakPolarHBondContact O-CD 3.37Å; P472-R474 PolarHBondContact O-N 3.34Å; P472-C475 HydrophobicContact CB-CB 3.87Å; P472-C475 HydrophobicContact CG-CB 4.12Å; P472-C475 VanDerWaalsContact O-CB 3.24Å; P472-C475 WeakPolarHBondContact O-CB 3.25Å; P472-C475 PolarHBondContact O-N 2.58Å; P472-C475 VanDerWaalsContact O-N 3.13Å
473	P	89.1	Confident	94.2	Very high	111 Å²	111	65.3 Å²	65.3	72%	0.721	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	133.5	171.8	-22.5	33.2	0	0	0	111.1	C475	P473-C475 PolarHBondContact O-N 3.35Å
474	R	84.8	Confident	94.4	Very high	240 Å²	240	67.7 Å²	67.7	91%	0.906	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	65	6.9	-179	-50.8	177.8	-179.9	173.2	-0.8	115.4	P472	P472-R474 PolarHBondContact O-N 3.34Å
475	C	92.6	Very high	94.8	Very high	14 Å²	14	68.1 Å²	68.1	10%	0.095	35%	0.35	C	S	.	.			trans	-73.1	128.9	171.2	-178.2	0	0	0	0	110.5	M444 P472 P473	M444-C475 HydrophobicContact CB-CB 4.39Å; P472-C475 HydrophobicContact CB-CB 3.87Å; P472-C475 HydrophobicContact CG-CB 4.12Å; P472-C475 VanDerWaalsContact O-CB 3.24Å; P472-C475 WeakPolarHBondContact O-CB 3.25Å; P472-C475 PolarHBondContact O-N 2.58Å; P472-C475 VanDerWaalsContact O-N 3.13Å; P473-C475 PolarHBondContact O-N 3.35Å
476	P	91.6	Very high	94.9	Very high	23 Å²	23	59 Å²	59	15%	0.149	32%	0.315	C	S	.	.			trans	-59	139.6	171.9	-23.4	33.6	0	0	0	111.8	V345 P478 M479 H480 Y507	V345-P476 HydrophobicContact CG1-CG 3.52Å; P476-P478 VanDerWaalsContact C-CD 3.44Å; P476-P478 VanDerWaalsContact C-N 3.34Å; P476-M479 HydrophobicContact CB-CB 4.47Å; P476-M479 WeakPolarHBondContact O-CB 3.35Å; P476-M479 PolarHBondContact O-N 3.2Å; P476-H480 PolarHBondContact O-N 3.45Å; P476-Y507 VanDerWaalsContact CB-OH 3.28Å; P476-Y507 WeakPolarHBondContact CB-OH 3.19Å
477	K	91.4	Very high	95.1	Very high	173 Å²	173	57 Å²	57	75%	0.752	29%	0.294	S	S	*	.	H	α-helix	trans	-53.7	-42.8	178.6	-65.8	-177.9	-179.8	176.6	0	113.4	M479 H480 L481	K477-M479 VanDerWaalsContact C-N 3.28Å; K477-M479 PolarHBondContact O-N 3.38Å; K477-H480 PolarHBondContact O-N 3.45Å; K477-L481 WeakPolarHBondContact O-CG 3.37Å; K477-L481 PolarHBondContact O-N 3.01Å
478	P	91.7	Very high	95.2	Very high	72 Å²	72	56.6 Å²	56.6	47%	0.468	29%	0.292	S	S	.	.	H	α-helix	trans	-60.9	-36.8	178.6	-23.5	35.1	0	0	0	112.9	P476 L481 L482 Y507	P476-P478 VanDerWaalsContact C-CD 3.44Å; P476-P478 VanDerWaalsContact C-N 3.34Å; P478-L481 PolarHBondContact O-N 3.06Å; P478-L482 PolarHBondContact O-N 3.26Å; P478-Y507 HydrophobicContact CB-CD2 4.3Å; P478-Y507 HydrophobicContact CB-CE2 3.9Å; P478-Y507 HydrophobicContact CG-CE2 4Å
479	M	94.6	Very high	95	Very high	3 Å²	3	61.5 Å²	61.5	2%	0.015	32%	0.317	C	S	.	.	H	α-helix	trans	-65.2	-42	176.4	-174.7	62.4	50.6	0	0	111.9	I349 L440 M444 P476 K477 L481 L482 M483 L504	I349-M479 HydrophobicContact CB-CE 4.39Å; I349-M479 HydrophobicContact CD1-CE 4.14Å; I349-M479 HydrophobicContact CG1-CE 3.65Å; I349-M479 HydrophobicContact CG2-CE 4.2Å; L440-M479 HydrophobicContact CD1-SD 4.07Å; L440-M479 HydrophobicContact CD2-SD 4.05Å; L440-M479 HydrophobicContact CG-SD 4.46Å; M444-M479 HydrophobicContact CE-CB 4.4Å; M444-M479 HydrophobicContact CE-CE 3.78Å; M444-M479 HydrophobicContact CE-CG 3.55Å; M444-M479 HydrophobicContact CE-SD 3.9Å; M444-M479 HydrophobicContact CG-CG 3.91Å; M444-M479 HydrophobicContact SD-CG 4.19Å; P476-M479 HydrophobicContact CB-CB 4.47Å; P476-M479 WeakPolarHBondContact O-CB 3.35Å; P476-M479 PolarHBondContact O-N 3.2Å; K477-M479 VanDerWaalsContact C-N 3.28Å; K477-M479 PolarHBondContact O-N 3.38Å; M479-L481 VanDerWaalsContact C-N 3.34Å; M479-L482 WeakPolarHBondContact O-CB 3.42Å; M479-L482 PolarHBondContact O-N 3.02Å; M479-L482 HydrophobicContact SD-CD2 4.26Å; M479-M483 HydrophobicContact CG-CE 3.88Å; M479-M483 WeakPolarHBondContact O-CG 3.49Å; M479-M483 PolarHBondContact O-N 2.92Å; M479-L504 HydrophobicContact CE-CD2 3.44Å; M479-L504 VanDerWaalsContact CE-CD2 3.44Å; M479-L504 HydrophobicContact SD-CD2 4.15Å
480	H	96.5	Very high	94.9	Very high	32 Å²	32	66.9 Å²	66.9	15%	0.148	34%	0.34	C	S	.	.	H	α-helix	trans	-66.3	-36.1	175.3	178.4	-103.1	0	0	0	112.5	C471 P476 K477 L482 M483 L484	C471-H480 WeakPolarHBondContact CA-CD2 3.48Å; C471-H480 HydrophobicContact CB-CB 4.18Å; C471-H480 PolarHBondContact N-NE2 2.93Å; P476-H480 PolarHBondContact O-N 3.45Å; K477-H480 PolarHBondContact O-N 3.45Å; H480-L482 VanDerWaalsContact C-N 3.31Å; H480-M483 WeakPolarHBondContact O-CB 3.43Å; H480-M483 PolarHBondContact O-N 3.02Å; H480-L484 WeakPolarHBondContact O-CG 3.45Å; H480-L484 PolarHBondContact O-N 2.99Å
481	L	96.6	Very high	94.8	Very high	103 Å²	103	65.2 Å²	65.2	54%	0.539	32%	0.324	S	S	.	.	H	α-helix	trans	-61.5	-42.5	172.9	-69.2	173.1	0	0	0	111	K477 P478 M479 M483 L484 D485	K477-L481 WeakPolarHBondContact O-CG 3.37Å; K477-L481 PolarHBondContact O-N 3.01Å; P478-L481 PolarHBondContact O-N 3.06Å; M479-L481 VanDerWaalsContact C-N 3.34Å; L481-M483 VanDerWaalsContact C-N 3.32Å; L481-M483 PolarHBondContact O-N 3.2Å; L481-L484 HydrophobicContact CD2-CD1 4.48Å; L481-L484 WeakPolarHBondContact O-CB 3.49Å; L481-L484 PolarHBondContact O-N 3.45Å; L481-D485 PolarHBondContact O-N 3.24Å
482	L	97.3	Very high	94.6	Very high	12 Å²	12	69.9 Å²	69.9	6%	0.063	34%	0.338	C	S	.	.	H	α-helix	trans	-57.9	-43	173.9	-161.4	69.8	0	0	0	112	L440 P478 M479 H480 L484 D485 C486 L500 Q503 L504	L440-L482 HydrophobicContact CD1-CD2 3.91Å; L440-L482 HydrophobicContact CD1-CG 4.24Å; P478-L482 PolarHBondContact O-N 3.26Å; M479-L482 WeakPolarHBondContact O-CB 3.42Å; M479-L482 PolarHBondContact O-N 3.02Å; M479-L482 HydrophobicContact SD-CD2 4.26Å; H480-L482 VanDerWaalsContact C-N 3.31Å; L482-L484 VanDerWaalsContact C-N 3.34Å; L482-L484 PolarHBondContact O-N 2.73Å; L482-D485 PolarHBondContact O-N 3.44Å; L482-C486 PolarHBondContact O-N 2.81Å; L482-C486 PolarHBondContact O-SG 2.7Å; L482-C486 VanDerWaalsContact O-SG 3.38Å; L482-L500 HydrophobicContact CD1-CD2 3.45Å; L482-L500 VanDerWaalsContact CD1-CD2 3.45Å; L482-L500 HydrophobicContact CD2-CD2 4.16Å; L482-L500 HydrophobicContact CG-CD2 3.72Å; L482-Q503 HydrophobicContact CD1-CB 4.32Å; L482-L504 HydrophobicContact CD2-CD1 4.25Å; L482-L504 HydrophobicContact CD2-CD2 3.66Å; L482-L504 HydrophobicContact CD2-CG 3.83Å
483	M	98.5	Very high	94.7	Very high	0 Å²	0	72.1 Å²	72.1	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-60	-42.7	174.1	-63	177.7	-162.7	0	0	111.9	L440 M444 M479 H480 L481 C486 W487	L440-M483 HydrophobicContact CB-CE 3.91Å; L440-M483 HydrophobicContact CB-CG 3.84Å; L440-M483 HydrophobicContact CB-SD 4.47Å; L440-M483 HydrophobicContact CD1-CG 4.13Å; L440-M483 WeakPolarHBondContact O-CE 3.39Å; M444-M483 HydrophobicContact CB-CE 4.01Å; M444-M483 HydrophobicContact CG-CE 3.68Å; M479-M483 HydrophobicContact CG-CE 3.88Å; M479-M483 WeakPolarHBondContact O-CG 3.49Å; M479-M483 PolarHBondContact O-N 2.92Å; H480-M483 WeakPolarHBondContact O-CB 3.43Å; H480-M483 PolarHBondContact O-N 3.02Å; L481-M483 VanDerWaalsContact C-N 3.32Å; L481-M483 PolarHBondContact O-N 3.2Å; M483-C486 WeakPolarHBondContact O-CB 3.46Å; M483-C486 PolarHBondContact O-N 2.92Å; M483-W487 HydrophobicContact CB-CE3 4.14Å; M483-W487 HydrophobicContact CB-CH2 3.75Å; M483-W487 HydrophobicContact CB-CZ2 4.14Å; M483-W487 HydrophobicContact CB-CZ3 3.75Å; M483-W487 HydrophobicContact CG-CH2 4.28Å; M483-W487 VanDerWaalsContact O-CG 3.25Å; M483-W487 PolarHBondContact O-N 2.64Å; M483-W487 HydrophobicContact SD-CH2 3.99Å
484	L	98.4	Very high	95.2	Very high	62 Å²	62	67 Å²	67	33%	0.325	32%	0.32	S	S	.	.	H	α-helix	trans	-65.4	-38	177.9	-69	176.9	0	0	0	112.2	R468 H480 L481 L482 W487 N488	R468-L484 HydrophobicContact CB-CD2 3.9Å; R468-L484 HydrophobicContact CG-CD2 4.2Å; H480-L484 WeakPolarHBondContact O-CG 3.45Å; H480-L484 PolarHBondContact O-N 2.99Å; L481-L484 HydrophobicContact CD2-CD1 4.48Å; L481-L484 WeakPolarHBondContact O-CB 3.49Å; L481-L484 PolarHBondContact O-N 3.45Å; L482-L484 VanDerWaalsContact C-N 3.34Å; L482-L484 PolarHBondContact O-N 2.73Å; L484-W487 HydrophobicContact CD2-CE3 4.27Å; L484-W487 CarbonylContact O-C 3.48Å; L484-W487 PolarHBondContact O-N 2.91Å; L484-W487 VanDerWaalsContact O-N 3.14Å; L484-N488 PolarHBondContact O-N 3.13Å
485	D	98.3	Very high	95.8	Very high	75 Å²	75	56.5 Å²	56.5	40%	0.401	28%	0.283	S	S	.	.	H	α-helix	trans	-63.6	-42.1	174.6	-69.3	-25.9	0	0	0	111.1	L481 L482 W487 N488 P495	L481-D485 PolarHBondContact O-N 3.24Å; L482-D485 PolarHBondContact O-N 3.44Å; D485-W487 VanDerWaalsContact C-N 3.27Å; D485-W487 PolarHBondContact O-N 2.8Å; D485-N488 PolarHBondContact O-N 3.22Å; D485-P495 HydrophobicContact CB-CG 4.43Å; D485-P495 WeakPolarHBondContact O-CD 3.46Å
486	C	98.7	Very high	96.1	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-60.4	-35	171.4	-71.2	0	0	0	0	112.8	V433 L482 M483 N488 R494	V433-C486 HydrophobicContact CG1-CB 4.2Å; V433-C486 WeakPolarHBondContact O-CB 3.15Å; L482-C486 PolarHBondContact O-N 2.81Å; L482-C486 PolarHBondContact O-SG 2.7Å; L482-C486 VanDerWaalsContact O-SG 3.38Å; M483-C486 WeakPolarHBondContact O-CB 3.46Å; M483-C486 PolarHBondContact O-N 2.92Å; C486-N488 VanDerWaalsContact C-N 3.34Å; C486-N488 PolarHBondContact O-N 3.28Å; C486-R494 WeakPolarHBondContact O-CD 3.31Å; C486-R494 WeakPolarHBondContact O-CG 3.49Å
487	W	98.4	Very high	96.4	Very high	2 Å²	2	56.8 Å²	56.8	1%	0.008	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	22.6	-178.9	-55	-36.8	0	0	0	114.3	W434 G437 I438 R468 L469 M483 L484 D485 E489	W434-W487 AromaticContact CD2-CD1 3.78Å; W434-W487 AromaticContact CE2-CD1 3.89Å; W434-W487 HydrophobicContact CE3-CB 4.11Å; W434-W487 HydrophobicContact CH2-CB 4.11Å; W434-W487 HydrophobicContact CZ3-CB 3.86Å; W434-W487 VanDerWaalsContact CZ3-O 3.32Å; W434-W487 WeakPolarHBondContact CZ3-O 3.47Å; W434-W487 PolarHBondContact O-NE1 2.96Å; G437-W487 VanDerWaalsContact C-CZ2 3.41Å; G437-W487 WeakPolarHBondContact O-CZ2 3.03Å; I438-W487 HydrophobicContact CD1-CZ2 3.68Å; I438-W487 HydrophobicContact CG1-CZ2 4.38Å; R468-W487 HydrophobicContact CB-CE3 4.06Å; R468-W487 HydrophobicContact CG-CB 4.42Å; R468-W487 HydrophobicContact CG-CE3 4.46Å; R468-W487 VanDerWaalsContact CZ-O 3.3Å; R468-W487 PolarHBondContact NE-O 3.05Å; R468-W487 PolarHBondContact NH2-O 3.26Å; L469-W487 HydrophobicContact CB-CH2 3.87Å; L469-W487 HydrophobicContact CB-CZ3 4Å; L469-W487 HydrophobicContact CD1-CH2 4.12Å; L469-W487 HydrophobicContact CD1-CZ2 4.32Å; M483-W487 HydrophobicContact CB-CE3 4.14Å; M483-W487 HydrophobicContact CB-CH2 3.75Å; M483-W487 HydrophobicContact CB-CZ2 4.14Å; M483-W487 HydrophobicContact CB-CZ3 3.75Å; M483-W487 HydrophobicContact CG-CH2 4.28Å; M483-W487 VanDerWaalsContact O-CG 3.25Å; M483-W487 PolarHBondContact O-N 2.64Å; M483-W487 HydrophobicContact SD-CH2 3.99Å; L484-W487 HydrophobicContact CD2-CE3 4.27Å; L484-W487 CarbonylContact O-C 3.48Å; L484-W487 PolarHBondContact O-N 2.91Å; L484-W487 VanDerWaalsContact O-N 3.14Å; D485-W487 VanDerWaalsContact C-N 3.27Å; D485-W487 PolarHBondContact O-N 2.8Å; W487-E489 PolarHBondContact O-N 3.33Å
488	N	98	Very high	96.5	Very high	54 Å²	54	54.4 Å²	54.4	29%	0.289	28%	0.276	S	S	.	.			trans	-58.1	136.5	173.1	-158.9	-60.4	0	0	0	110.5	L484 D485 C486 K490 R494	L484-N488 PolarHBondContact O-N 3.13Å; D485-N488 PolarHBondContact O-N 3.22Å; C486-N488 VanDerWaalsContact C-N 3.34Å; C486-N488 PolarHBondContact O-N 3.28Å; N488-K490 VanDerWaalsContact C-N 3.28Å; N488-K490 PolarHBondContact O-N 3.21Å; N488-K490 PolarHBondContact OD1-N 2.84Å; N488-R494 HydrophobicContact CB-CG 3.89Å; N488-R494 PolarHBondContact O-NE 2.92Å; N488-R494 PolarHBondContact O-NH2 3.38Å
489	E	94.6	Very high	96.7	Very high	149 Å²	149	53.8 Å²	53.8	70%	0.696	27%	0.27	S	S	*	.	S	Bend	trans	-61	-40	177.8	-176.4	176.6	-173.7	0	0	111.3	W487 E491	W487-E489 PolarHBondContact O-N 3.33Å; E489-E491 PolarHBondContact O-N 3.38Å
490	K	94.8	Very high	96.8	Very high	125 Å²	125	53.6 Å²	53.6	54%	0.543	27%	0.27	S	S	.	.	S	Bend	trans	-82.6	113.1	176.4	-66.5	177.1	179.9	179.8	0	109.2	N488 F492 S493	N488-K490 VanDerWaalsContact C-N 3.28Å; N488-K490 PolarHBondContact O-N 3.21Å; N488-K490 PolarHBondContact OD1-N 2.84Å; K490-F492 VanDerWaalsContact C-N 3.26Å; K490-F492 HydrophobicContact CB-CD1 4.21Å; K490-F492 HydrophobicContact CB-CE1 3.84Å; K490-F492 HydrophobicContact CB-CZ 4.08Å; K490-F492 HydrophobicContact CD-CE1 4.08Å; K490-F492 HydrophobicContact CD-CE2 4.49Å; K490-F492 HydrophobicContact CD-CZ 3.71Å; K490-F492 HydrophobicContact CG-CE1 4.18Å; K490-F492 HydrophobicContact CG-CZ 4.29Å; K490-F492 PolarHBondContact O-N 3.26Å; K490-S493 WeakPolarHBondContact O-CB 3.32Å; K490-S493 PolarHBondContact O-N 3Å
491	E	92.9	Very high	96.6	Very high	54 Å²	54	54.4 Å²	54.4	25%	0.252	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-50.4	-42.3	-179.9	19.7	173.1	-178.6	0	0	113.2	K426 K430 E489 S493 R494	K426-E491 WeakPolarHBondContact CE-OE2 3.38Å; K426-E491 IonicContact NZ-OE1 2.85Å; K426-E491 PolarHBondContact NZ-OE1 3.22Å; K426-E491 IonicContact NZ-OE2 3.27Å; K426-E491 PolarHBondContact NZ-OE2 3.34Å; K430-E491 HydrophobicContact CB-CB 4.18Å; K430-E491 WeakPolarHBondContact CD-O 3.41Å; K430-E491 WeakPolarHBondContact CG-O 3.41Å; E489-E491 PolarHBondContact O-N 3.38Å; E491-S493 VanDerWaalsContact C-N 3.28Å; E491-S493 PolarHBondContact O-N 3.16Å; E491-R494 PolarHBondContact O-N 2.91Å
492	F	93.3	Very high	96.2	Very high	157 Å²	157	57.1 Å²	57.1	69%	0.689	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-73	-16.7	179.4	65.3	-93.7	0	0	0	114.2	K490	K490-F492 VanDerWaalsContact C-N 3.26Å; K490-F492 HydrophobicContact CB-CD1 4.21Å; K490-F492 HydrophobicContact CB-CE1 3.84Å; K490-F492 HydrophobicContact CB-CZ 4.08Å; K490-F492 HydrophobicContact CD-CE1 4.08Å; K490-F492 HydrophobicContact CD-CE2 4.49Å; K490-F492 HydrophobicContact CD-CZ 3.71Å; K490-F492 HydrophobicContact CG-CE1 4.18Å; K490-F492 HydrophobicContact CG-CZ 4.29Å; K490-F492 PolarHBondContact O-N 3.26Å
493	S	97.5	Very high	95.8	Very high	53 Å²	53	59.8 Å²	59.8	37%	0.371	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-86.3	-8.8	176.6	-59.9	0	0	0	0	112.9	K490 E491	K490-S493 WeakPolarHBondContact O-CB 3.32Å; K490-S493 PolarHBondContact O-N 3Å; E491-S493 VanDerWaalsContact C-N 3.28Å; E491-S493 PolarHBondContact O-N 3.16Å
494	R	98.4	Very high	95.4	Very high	4 Å²	4	59.9 Å²	59.9	2%	0.015	29%	0.289	C	S	.	.	S	Bend	trans	-72.4	146.4	172.2	-56.9	174.8	-169	155.8	9.4	109.3	E420 K430 V433 C486 N488 E491	E420-R494 IonicContact OE1-CZ 3.57Å; E420-R494 IonicContact OE1-NH1 3.08Å; E420-R494 PolarHBondContact OE1-NH1 3.2Å; E420-R494 IonicContact OE1-NH2 3.71Å; E420-R494 PolarHBondContact OE1-NH2 3Å; E420-R494 IonicContact OE2-CZ 2.82Å; E420-R494 IonicContact OE2-NH1 2.76Å; E420-R494 IonicContact OE2-NH2 3.24Å; E420-R494 PolarHBondContact OE2-NH2 3.33Å; K430-R494 HydrophobicContact CD-CB 4.27Å; K430-R494 PolarHBondContact NZ-O 3.41Å; K430-R494 WeakPolarHBondContact O-CD 3.3Å; K430-R494 PolarHBondContact O-NH1 3.44Å; V433-R494 HydrophobicContact CG1-CB 3.87Å; C486-R494 WeakPolarHBondContact O-CD 3.31Å; C486-R494 WeakPolarHBondContact O-CG 3.49Å; N488-R494 HydrophobicContact CB-CG 3.89Å; N488-R494 PolarHBondContact O-NE 2.92Å; N488-R494 PolarHBondContact O-NH2 3.38Å; E491-R494 PolarHBondContact O-N 2.91Å
495	P	98	Very high	94.7	Very high	20 Å²	20	59.8 Å²	59.8	13%	0.13	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-64.3	167.7	179.2	26.8	-34.7	0	0	0	112.6	K430 V433 D485 T499 L500	K430-P495 VanDerWaalsContact NZ-C 3.31Å; K430-P495 PolarHBondContact NZ-O 3.29Å; V433-P495 HydrophobicContact CG1-CG 4.29Å; D485-P495 HydrophobicContact CB-CG 4.43Å; D485-P495 WeakPolarHBondContact O-CD 3.46Å; P495-T499 HydrophobicContact CB-CG2 4.22Å; P495-L500 HydrophobicContact CB-CD2 4.18Å; P495-L500 HydrophobicContact CB-CG 4.1Å; P495-L500 HydrophobicContact CG-CD1 4.15Å; P495-L500 HydrophobicContact CG-CD2 3.52Å; P495-L500 HydrophobicContact CG-CG 3.76Å
496	T	98	Very high	93.7	Very high	42 Å²	42	58.6 Å²	58.6	26%	0.258	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-82.1	161.3	165.5	60.4	0	0	0	0	109.7	E363 E498 T499 L500	E363-T496 WeakPolarHBondContact OE2-CB 3.41Å; T496-E498 VanDerWaalsContact C-N 3.27Å; T496-E498 PolarHBondContact O-N 3.34Å; T496-T499 PolarHBondContact O-N 3.45Å; T496-T499 PolarHBondContact OG1-N 2.93Å; T496-T499 VanDerWaalsContact OG1-N 3.15Å; T496-T499 PolarHBondContact OG1-OG1 3.3Å; T496-L500 WeakPolarHBondContact O-CG 3.41Å; T496-L500 PolarHBondContact O-N 3.39Å
497	F	98.2	Very high	92.4	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-67.7	-32	175.2	-84.3	-70.6	0	0	0	112	M359 A360 E363 L372 I429 D432 V433 F436 T499 L500 Q501	M359-F497 HydrophobicContact CB-CB 4.31Å; M359-F497 HydrophobicContact CB-CD1 3.36Å; M359-F497 HydrophobicContact CB-CD2 3.81Å; M359-F497 HydrophobicContact CB-CE1 3.4Å; M359-F497 VanDerWaalsContact CB-CE1 3.4Å; M359-F497 HydrophobicContact CB-CE2 3.86Å; M359-F497 HydrophobicContact CB-CG 3.57Å; M359-F497 HydrophobicContact CB-CZ 3.66Å; M359-F497 HydrophobicContact CE-CD2 4.46Å; M359-F497 HydrophobicContact CE-CE2 3.65Å; M359-F497 HydrophobicContact CE-CZ 3.69Å; M359-F497 HydrophobicContact CG-CD1 4.26Å; M359-F497 HydrophobicContact CG-CE1 3.81Å; M359-F497 HydrophobicContact CG-CE2 4.47Å; M359-F497 HydrophobicContact CG-CZ 3.93Å; A360-F497 VanDerWaalsContact CA-CB 3.49Å; A360-F497 HydrophobicContact CB-CB 3.84Å; E363-F497 HydrophobicContact CB-CD2 4.49Å; E363-F497 PolarHBondContact OE2-N 3.42Å; L372-F497 HydrophobicContact CD2-CE1 4.46Å; L372-F497 HydrophobicContact CD2-CZ 4.16Å; I429-F497 HydrophobicContact CG2-CD2 3.84Å; I429-F497 HydrophobicContact CG2-CE2 4.02Å; D432-F497 HydrophobicContact CB-CE2 3.95Å; D432-F497 HydrophobicContact CB-CZ 4.12Å; V433-F497 HydrophobicContact CG2-CD2 3.88Å; V433-F497 HydrophobicContact CG2-CE2 3.61Å; V433-F497 HydrophobicContact CG2-CG 4.44Å; V433-F497 HydrophobicContact CG2-CZ 3.97Å; F436-F497 HydrophobicContact CB-CE1 3.69Å; F436-F497 HydrophobicContact CB-CZ 3.98Å; F436-F497 HydrophobicContact CD1-CE1 4.26Å; F436-F497 AromaticContact CD2-CE1 3.92Å; F436-F497 HydrophobicContact CD2-CE1 3.92Å; F436-F497 AromaticContact CG-CE1 3.7Å; F436-F497 HydrophobicContact CG-CE1 3.7Å; F436-F497 HydrophobicContact CG-CZ 4.47Å; F497-T499 VanDerWaalsContact C-N 3.34Å; F497-T499 PolarHBondContact O-N 3.36Å; F497-L500 HydrophobicContact CD1-CD1 3.93Å; F497-L500 HydrophobicContact CE1-CD1 4.23Å; F497-L500 PolarHBondContact O-N 3.06Å; F497-Q501 WeakPolarHBondContact O-CB 3.42Å; F497-Q501 PolarHBondContact O-N 3.22Å
498	E	94.3	Very high	90.5	Very high	124 Å²	124	63.6 Å²	63.6	58%	0.579	30%	0.301	S	S	*	.	H	α-helix	trans	-57.6	-45.2	169.9	-178.2	-179.7	-148.9	0	0	111.9	T496 Q501 W502	T496-E498 VanDerWaalsContact C-N 3.27Å; T496-E498 PolarHBondContact O-N 3.34Å; E498-Q501 PolarHBondContact O-N 3.19Å; E498-W502 PolarHBondContact O-N 3.21Å
499	T	95.3	Very high	88.5	Confident	58 Å²	58	64.8 Å²	64.8	36%	0.356	31%	0.307	S	S	.	.	H	α-helix	trans	-64.2	-44.3	176.8	-59	0	0	0	0	111	P495 T496 F497 W502 Q503	P495-T499 HydrophobicContact CB-CG2 4.22Å; T496-T499 PolarHBondContact O-N 3.45Å; T496-T499 PolarHBondContact OG1-N 2.93Å; T496-T499 VanDerWaalsContact OG1-N 3.15Å; T496-T499 PolarHBondContact OG1-OG1 3.3Å; F497-T499 VanDerWaalsContact C-N 3.34Å; F497-T499 PolarHBondContact O-N 3.36Å; T499-W502 PolarHBondContact O-N 3.32Å; T499-Q503 HydrophobicContact CG2-CG 4.35Å; T499-Q503 WeakPolarHBondContact O-CB 3.3Å; T499-Q503 VanDerWaalsContact O-CG 3.3Å; T499-Q503 WeakPolarHBondContact O-CG 3.46Å; T499-Q503 PolarHBondContact O-N 3.47Å
500	L	96.6	Very high	86.4	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-61.8	-43.4	178.1	-70.8	170.8	0	0	0	111.9	V433 F436 L482 P495 T496 F497 Q503 L504	V433-L500 HydrophobicContact CG1-CD1 4.11Å; F436-L500 HydrophobicContact CD1-CD1 3.71Å; F436-L500 HydrophobicContact CE1-CB 4.38Å; F436-L500 HydrophobicContact CE1-CD1 3.98Å; F436-L500 HydrophobicContact CE1-CD2 4.48Å; L482-L500 HydrophobicContact CD1-CD2 3.45Å; L482-L500 VanDerWaalsContact CD1-CD2 3.45Å; L482-L500 HydrophobicContact CD2-CD2 4.16Å; L482-L500 HydrophobicContact CG-CD2 3.72Å; P495-L500 HydrophobicContact CB-CD2 4.18Å; P495-L500 HydrophobicContact CB-CG 4.1Å; P495-L500 HydrophobicContact CG-CD1 4.15Å; P495-L500 HydrophobicContact CG-CD2 3.52Å; P495-L500 HydrophobicContact CG-CG 3.76Å; T496-L500 WeakPolarHBondContact O-CG 3.41Å; T496-L500 PolarHBondContact O-N 3.39Å; F497-L500 HydrophobicContact CD1-CD1 3.93Å; F497-L500 HydrophobicContact CE1-CD1 4.23Å; F497-L500 PolarHBondContact O-N 3.06Å; L500-Q503 PolarHBondContact O-N 3.45Å; L500-L504 WeakPolarHBondContact O-CB 3.2Å; L500-L504 WeakPolarHBondContact O-CD1 3.44Å; L500-L504 WeakPolarHBondContact O-CG 3.39Å; L500-L504 PolarHBondContact O-N 2.92Å
501	Q	92.4	Very high	84.1	Confident	49 Å²	49	65.7 Å²	65.7	23%	0.229	32%	0.32	C	S	.	.	H	α-helix	trans	-57.5	-52.9	175.2	178.4	-170.9	-8.8	0	0	110	A356 A357 F497 E498 Q503 L504 E505	A356-Q501 HydrophobicContact CB-CB 4.09Å; A357-Q501 HydrophobicContact CB-CG 4.22Å; F497-Q501 WeakPolarHBondContact O-CB 3.42Å; F497-Q501 PolarHBondContact O-N 3.22Å; E498-Q501 PolarHBondContact O-N 3.19Å; Q501-Q503 PolarHBondContact O-N 3Å; Q501-L504 PolarHBondContact O-N 3.29Å; Q501-E505 HydrophobicContact CG-CG 4.43Å; Q501-E505 PolarHBondContact NE2-OE1 3.46Å; Q501-E505 WeakPolarHBondContact O-CG 3.45Å; Q501-E505 PolarHBondContact O-N 3.18Å
502	W	87.8	Confident	81.8	Confident	159 Å²	159	64.2 Å²	64.2	60%	0.602	31%	0.314	S	S	*	.	H	α-helix	trans	-59.4	-44.6	-179.5	-178.9	76.7	0	0	0	112.2	E498 T499 L504 E505 D506	E498-W502 PolarHBondContact O-N 3.21Å; T499-W502 PolarHBondContact O-N 3.32Å; W502-L504 VanDerWaalsContact C-N 3.31Å; W502-L504 PolarHBondContact O-N 3.45Å; W502-E505 PolarHBondContact O-N 2.97Å; W502-D506 HydrophobicContact CZ2-CB 4.45Å; W502-D506 VanDerWaalsContact O-CB 3.26Å; W502-D506 WeakPolarHBondContact O-CB 3.18Å; W502-D506 PolarHBondContact O-N 2.67Å
503	Q	90.4	Very high	79.6	Confident	69 Å²	69	63.9 Å²	63.9	32%	0.322	32%	0.319	S	S	.	.	H	α-helix	trans	-63.8	-34.6	177.7	-72.1	179	-55.6	0	0	113.2	L482 T499 L500 Q501 Y507	L482-Q503 HydrophobicContact CD1-CB 4.32Å; T499-Q503 HydrophobicContact CG2-CG 4.35Å; T499-Q503 WeakPolarHBondContact O-CB 3.3Å; T499-Q503 VanDerWaalsContact O-CG 3.3Å; T499-Q503 WeakPolarHBondContact O-CG 3.46Å; T499-Q503 PolarHBondContact O-N 3.47Å; L500-Q503 PolarHBondContact O-N 3.45Å; Q501-Q503 PolarHBondContact O-N 3Å; Q503-Y507 PolarHBondContact O-N 2.73Å
504	L	90.1	Very high	77.4	Confident	2 Å²	2	65 Å²	65	1%	0.01	33%	0.327	C	S	.	.	H	α-helix	trans	-75.8	-33.7	177.6	-72.3	164.6	0	0	0	112	I349 A352 A353 A356 F436 M479 L482 L500 Q501 W502 F508	I349-L504 HydrophobicContact CG2-CD2 4.14Å; A352-L504 HydrophobicContact CB-CD1 4.08Å; A352-L504 HydrophobicContact CB-CD2 4.16Å; A353-L504 HydrophobicContact CB-CB 3.84Å; A356-L504 HydrophobicContact CB-CD1 3.93Å; F436-L504 HydrophobicContact CE1-CD1 4.16Å; F436-L504 HydrophobicContact CZ-CD1 3.81Å; M479-L504 HydrophobicContact CE-CD2 3.44Å; M479-L504 VanDerWaalsContact CE-CD2 3.44Å; M479-L504 HydrophobicContact SD-CD2 4.15Å; L482-L504 HydrophobicContact CD2-CD1 4.25Å; L482-L504 HydrophobicContact CD2-CD2 3.66Å; L482-L504 HydrophobicContact CD2-CG 3.83Å; L500-L504 WeakPolarHBondContact O-CB 3.2Å; L500-L504 WeakPolarHBondContact O-CD1 3.44Å; L500-L504 WeakPolarHBondContact O-CG 3.39Å; L500-L504 PolarHBondContact O-N 2.92Å; Q501-L504 PolarHBondContact O-N 3.29Å; W502-L504 VanDerWaalsContact C-N 3.31Å; W502-L504 PolarHBondContact O-N 3.45Å; L504-F508 VanDerWaalsContact O-CD2 3.3Å; L504-F508 WeakPolarHBondContact O-CD2 3.45Å; L504-F508 VanDerWaalsContact O-CE2 3.32Å; L504-F508 WeakPolarHBondContact O-CE2 3.29Å
505	E	82.3	Confident	75.6	Confident	60 Å²	60	68.2 Å²	68.2	28%	0.28	34%	0.339	S	S	.	.	H	α-helix	trans	-72	-43.9	173.3	-70	179.9	148.4	0	0	111.4	K139 A353 Q501 W502 Y507 F508	K139-E505 IonicContact NZ-OE1 2.81Å; K139-E505 PolarHBondContact NZ-OE1 3.4Å; A353-E505 HydrophobicContact CB-CG 4.46Å; Q501-E505 HydrophobicContact CG-CG 4.43Å; Q501-E505 PolarHBondContact NE2-OE1 3.46Å; Q501-E505 WeakPolarHBondContact O-CG 3.45Å; Q501-E505 PolarHBondContact O-N 3.18Å; W502-E505 PolarHBondContact O-N 2.97Å; E505-Y507 VanDerWaalsContact C-N 3.25Å; E505-Y507 PolarHBondContact O-N 2.85Å; E505-F508 WeakPolarHBondContact O-CB 3.29Å; E505-F508 WeakPolarHBondContact O-CD2 3.2Å; E505-F508 PolarHBondContact O-N 3.06Å; E505-F508 VanDerWaalsContact O-N 3.13Å
506	D	78.9	Confident	73.9	Confident	49 Å²	49	69.3 Å²	69.3	26%	0.262	34%	0.344	S	S	.	.	H	α-helix	trans	-65.8	-25.1	178.4	-176.1	67.3	0	0	0	113	W502 F508 D509	W502-D506 HydrophobicContact CZ2-CB 4.45Å; W502-D506 VanDerWaalsContact O-CB 3.26Å; W502-D506 WeakPolarHBondContact O-CB 3.18Å; W502-D506 PolarHBondContact O-N 2.67Å; D506-F508 PolarHBondContact O-N 2.79Å; D506-D509 PolarHBondContact O-N 3.39Å
507	Y	70.6	Confident	72	Confident	78 Å²	78	71.5 Å²	71.5	31%	0.306	35%	0.354	S	S	.	.	H	α-helix	trans	-52.9	-26.9	172.5	-168.5	-83.9	0	0	0	112.1	I349 P476 P478 Q503 E505	I349-Y507 HydrophobicContact CD1-CD1 3.4Å; I349-Y507 HydrophobicContact CD1-CD2 4.48Å; I349-Y507 HydrophobicContact CD1-CE1 3.18Å; I349-Y507 HydrophobicContact CD1-CE2 4.3Å; I349-Y507 HydrophobicContact CD1-CG 4.07Å; I349-Y507 HydrophobicContact CG2-CD1 4.26Å; I349-Y507 HydrophobicContact CG2-CG 4.43Å; P476-Y507 VanDerWaalsContact CB-OH 3.28Å; P476-Y507 WeakPolarHBondContact CB-OH 3.19Å; P478-Y507 HydrophobicContact CB-CD2 4.3Å; P478-Y507 HydrophobicContact CB-CE2 3.9Å; P478-Y507 HydrophobicContact CG-CE2 4Å; Q503-Y507 PolarHBondContact O-N 2.73Å; E505-Y507 VanDerWaalsContact C-N 3.25Å; E505-Y507 PolarHBondContact O-N 2.85Å
508	F	58.8	Low	69.9	Low	29 Å²	29	72.2 Å²	72.2	13%	0.127	36%	0.359	C	S	.	.	H	α-helix	trans	-86.1	-29.3	177.1	-61.8	-78.2	0	0	0	113.6	L141 Q346 I349 E350 L504 E505 D506 M510 D511 L512	L141-F508 HydrophobicContact CD1-CB 4.11Å; L141-F508 HydrophobicContact CD1-CD1 3.46Å; L141-F508 VanDerWaalsContact CD1-CD1 3.46Å; L141-F508 HydrophobicContact CD1-CE1 3.94Å; L141-F508 HydrophobicContact CD1-CG 3.8Å; Q346-F508 HydrophobicContact CB-CE1 4.23Å; Q346-F508 HydrophobicContact CG-CE1 4.44Å; I349-F508 HydrophobicContact CB-CE2 4.3Å; I349-F508 HydrophobicContact CB-CZ 3.78Å; I349-F508 HydrophobicContact CG2-CE2 3.56Å; I349-F508 HydrophobicContact CG2-CZ 3.56Å; E350-F508 HydrophobicContact CB-CZ 4.14Å; L504-F508 VanDerWaalsContact O-CD2 3.3Å; L504-F508 WeakPolarHBondContact O-CD2 3.45Å; L504-F508 VanDerWaalsContact O-CE2 3.32Å; L504-F508 WeakPolarHBondContact O-CE2 3.29Å; E505-F508 WeakPolarHBondContact O-CB 3.29Å; E505-F508 WeakPolarHBondContact O-CD2 3.2Å; E505-F508 PolarHBondContact O-N 3.06Å; E505-F508 VanDerWaalsContact O-N 3.13Å; D506-F508 PolarHBondContact O-N 2.79Å; F508-M510 PolarHBondContact O-N 3.23Å; F508-D511 PolarHBondContact O-N 3.27Å; F508-D511 VanDerWaalsContact O-N 3.16Å; F508-L512 HydrophobicContact CB-CD1 4.01Å; F508-L512 WeakPolarHBondContact O-CD1 3.47Å; F508-L512 VanDerWaalsContact O-CG 3.25Å; F508-L512 WeakPolarHBondContact O-CG 3.23Å
509	D	55.2	Low	67.9	Low	79 Å²	79	70.2 Å²	70.2	42%	0.422	36%	0.359	S	S	.	.	H	α-helix	trans	-66.8	-21.5	-175.6	-83	-24.2	0	0	0	113.7	D506 D511 L512	D506-D509 PolarHBondContact O-N 3.39Å; D509-D511 PolarHBondContact O-N 2.83Å; D509-L512 PolarHBondContact O-N 3.01Å; D509-L512 WeakPolarHBondContact OD1-CD1 3.34Å
510	M	50.4	Low	65.5	Low	151 Å²	151	74.7 Å²	74.7	74%	0.744	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-18.2	174.7	-77.2	-175.6	-114.5	0	0	114.1	F508	F508-M510 PolarHBondContact O-N 3.23Å
511	D	46.8	Very low	63.1	Low	142 Å²	142	82.9 Å²	82.9	76%	0.759	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	-13.2	173.8	-104.9	-19.2	0	0	0	113.5	F508 D509	F508-D511 PolarHBondContact O-N 3.27Å; F508-D511 VanDerWaalsContact O-N 3.16Å; D509-D511 PolarHBondContact O-N 2.83Å
512	L	44.9	Very low	61.6	Low	24 Å²	24	84.6 Å²	84.6	13%	0.126	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-3.2	-165.4	-68.9	167.1	0	0	0	116.1	R140 L141 F508 D509 S514	R140-L512 HydrophobicContact CB-CD2 4.31Å; R140-L512 HydrophobicContact CG-CD2 3.89Å; R140-L512 PolarHBondContact NH1-O 2.87Å; R140-L512 VanDerWaalsContact NH1-O 3.16Å; L141-L512 HydrophobicContact CD2-CD2 4.47Å; F508-L512 HydrophobicContact CB-CD1 4.01Å; F508-L512 WeakPolarHBondContact O-CD1 3.47Å; F508-L512 VanDerWaalsContact O-CG 3.25Å; F508-L512 WeakPolarHBondContact O-CG 3.23Å; D509-L512 PolarHBondContact O-N 3.01Å; D509-L512 WeakPolarHBondContact OD1-CD1 3.34Å; L512-S514 PolarHBondContact O-N 2.92Å; L512-S514 VanDerWaalsContact O-N 3.12Å
513	N	46.6	Very low	60.2	Low	150 Å²	150	80.7 Å²	80.7	80%	0.802	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	6.9	-178.2	-79	-42.1	0	0	0	115.4	Y515	N513-Y515 PolarHBondContact O-N 3.43Å
514	S	52.4	Low	58.5	Low	76 Å²	76	81.3 Å²	81.3	53%	0.531	41%	0.412	S	S	.	.			trans	-91.3	91.2	170.7	60.1	0	0	0	0	110.6	R140 L512	R140-S514 PolarHBondContact NH1-O 3.17Å; R140-S514 PolarHBondContact NH2-O 3.4Å; L512-S514 PolarHBondContact O-N 2.92Å; L512-S514 VanDerWaalsContact O-N 3.12Å
515	Y	59.3	Low	56.7	Low	71 Å²	71	86 Å²	86	28%	0.278	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-86.6	139.1	159.1	-76.4	-89.6	0	0	0	108.3	H181 K183 N513	H181-Y515 HydrophobicContact CB-CD1 4.32Å; H181-Y515 HydrophobicContact CB-CE1 4.47Å; K183-Y515 HydrophobicContact CB-CD1 4.37Å; N513-Y515 PolarHBondContact O-N 3.43Å
516	D	63.8	Low	55.1	Low	43 Å²	43	87.6 Å²	87.6	23%	0.23	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-75.6	127.2	177	-68.8	-82.6	0	0	0	109.4	K180 H181 Y182	K180-D516 VanDerWaalsContact CD-CG 3.46Å; K180-D516 WeakPolarHBondContact CD-OD2 3.44Å; K180-D516 IonicContact NZ-OD1 3.84Å; K180-D516 PolarHBondContact NZ-OD1 3.05Å; K180-D516 IonicContact NZ-OD2 2.7Å; H181-D516 PolarHBondContact O-N 2.91Å; Y182-D516 HydrophobicContact CE1-CB 4.35Å
517	D	56.8	Low	53.5	Low	88 Å²	88	90.2 Å²	90.2	47%	0.471	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-80	125	174.7	-168.6	-4.9	0	0	0	109.9	S519 H520	D517-S519 PolarHBondContact O-N 3.34Å; D517-S519 WeakPolarHBondContact OD1-CB 3.38Å; D517-S519 PolarHBondContact OD1-N 3.19Å; D517-S519 PolarHBondContact OD1-OG 3Å; D517-S519 PolarHBondContact OD2-OG 3.47Å; D517-H520 PolarHBondContact O-N 3.48Å
518	S	55.4	Low	52.3	Low	15 Å²	15	91.1 Å²	91.1	11%	0.105	47%	0.468	C	S	.	.	G	3₁₀ helix	trans	-63.7	-13.5	173.5	62.7	0	0	0	0	113.4	S195 H520	S195-S518 WeakPolarHBondContact CB-OG 3.29Å; S518-H520 PolarHBondContact O-N 3.09Å
519	S	51.2	Low	51.8	Low	82 Å²	82	95.8 Å²	95.8	57%	0.573	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-70.8	-12.1	177.7	76	0	0	0	0	114.5	D517	D517-S519 PolarHBondContact O-N 3.34Å; D517-S519 WeakPolarHBondContact OD1-CB 3.38Å; D517-S519 PolarHBondContact OD1-N 3.19Å; D517-S519 PolarHBondContact OD1-OG 3Å; D517-S519 PolarHBondContact OD2-OG 3.47Å
520	H	46.1	Very low	51.5	Low	153 Å²	153	97.3 Å²	97.3	71%	0.708	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-93.6	-6.4	-175.1	-80.8	-52.2	0	0	0	115.6	D517 S518	D517-H520 PolarHBondContact O-N 3.48Å; S518-H520 PolarHBondContact O-N 3.09Å
521	Y	44.3	Very low	51.6	Low	172 Å²	172	92.4 Å²	92.4	68%	0.675	48%	0.478	S	S	*	.			trans	-120.1	0	-174.5	-68	-80	0	0	0	113.2

Retrieved 521 of 521 residues in 140.3 ms (Link to these results)

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