A0A087YBD3_POEFO Loading...

Reticulon 4 receptor-like 2 a

AlphaFold DB , UniProt , Accession A0A087YBD3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 504 aa.

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(Predicted Aligned Error values between residue pairs)

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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	33.1	Very low	28.8	Very low	242 Å²	242	166.5 Å²	166.5	100%	1.192	88%	0.884	S	S	*	*				0	93.9	0	-175.6	-174.1	-68.5	0	0	107.4
2	L	27.9	Very low	28.5	Very low	171 Å²	171	167.3 Å²	167.3	90%	0.895	88%	0.879	S	S	*	*			trans	179.4	94.1	169.5	-104.5	166.2	0	0	0	104.8
3	E	24.1	Very low	29.2	Very low	193 Å²	193	162.6 Å²	162.6	90%	0.902	87%	0.865	S	S	*	*			trans	-85.5	150.2	175.6	-77	177.7	127.1	0	0	110.7
4	Y	30.8	Very low	29	Very low	205 Å²	205	157.5 Å²	157.5	80%	0.804	86%	0.857	S	S	*	*			trans	-86.1	142.2	170.4	-90	-107.9	0	0	0	110.2
5	I	28.3	Very low	28.9	Very low	149 Å²	149	159.8 Å²	159.8	76%	0.764	86%	0.859	S	S	*	*			trans	-133.7	120.6	148.1	-57.9	-179	0	0	0	108	D7	I5-D7 HydrophobicContact CG2-CB 4.35Å
6	W	32.4	Very low	28.7	Very low	246 Å²	246	156.1 Å²	156.1	93%	0.932	85%	0.849	S	S	*	*			trans	-123.2	124	153.8	-95.9	60.8	0	0	0	105.5
7	D	28.4	Very low	28.6	Very low	150 Å²	150	158.6 Å²	158.6	80%	0.802	85%	0.854	S	S	*	*			trans	-113.7	161	-174.6	-158.8	3.4	0	0	0	111.3	I5	I5-D7 HydrophobicContact CG2-CB 4.35Å
8	S	31	Very low	28.4	Very low	111 Å²	111	155.7 Å²	155.7	78%	0.776	85%	0.848	S	S	*	*			trans	-115.7	126	-159.4	-56	0	0	0	0	114.2
9	G	26.9	Very low	28.2	Very low	88 Å²	88	156.3 Å²	156.3	91%	0.907	85%	0.849	S	S	*	*			trans	100.5	149.5	149.9	0	0	0	0	0	118.3
10	G	25	Very low	28.1	Very low	83 Å²	83	159.5 Å²	159.5	86%	0.856	85%	0.848	S	S	*	*			trans	143.3	120.1	168.9	0	0	0	0	0	114.7
11	H	28.8	Very low	28.1	Very low	193 Å²	193	159.9 Å²	159.9	89%	0.894	85%	0.85	S	S	*	*			trans	-84.6	137.6	175.1	-86.2	-28.7	0	0	0	113
12	Q	25	Very low	27.7	Very low	177 Å²	177	152.4 Å²	152.4	83%	0.827	83%	0.834	S	S	*	*			trans	41.4	163	137.4	-80.1	-164.7	-3	0	0	122.9
13	P	38.3	Very low	27.5	Very low	106 Å²	106	151.5 Å²	151.5	69%	0.688	83%	0.83	S	S	*	*			cis	-137.2	174.2	-26.5	35.8	-17.6	0	0	0	115.2
14	A	26.3	Very low	27.6	Very low	91 Å²	91	151.2 Å²	151.2	75%	0.752	83%	0.829	S	S	*	*			trans	60.1	122.1	150.9	0	0	0	0	0	121.6
15	H	26.9	Very low	27.3	Very low	192 Å²	192	145.6 Å²	145.6	89%	0.889	82%	0.819	S	S	*	*				-157.8	147.2	126.1	-117.8	-78	0	0	0	112.4
16	S	25.7	Very low	27.3	Very low	100 Å²	100	146.3 Å²	146.3	70%	0.699	82%	0.823	S	S	*	*			trans	-90.1	148.9	179	51.5	0	0	0	0	112.6
17	Q	26.9	Very low	26.9	Very low	200 Å²	200	140.3 Å²	140.3	94%	0.935	82%	0.819	S	S	*	*			trans	-158	154.2	150.5	-115.3	167.6	39.3	0	0	113.1
18	S	25.5	Very low	26.8	Very low	106 Å²	106	136.5 Å²	136.5	74%	0.741	82%	0.815	S	S	*	*			trans	-133	138.4	-171	170.9	0	0	0	0	110
19	L	25.2	Very low	26.6	Very low	166 Å²	166	139.2 Å²	139.2	87%	0.869	82%	0.821	S	S	*	*			trans	-161.1	98.2	169.2	-96.5	150.9	0	0	0	107.2
20	R	24.8	Very low	26.6	Very low	220 Å²	220	139.8 Å²	139.8	83%	0.83	81%	0.811	S	S	*	*				56.3	102.3	87.9	-82.5	-166	179.2	-173.9	2.4	117
21	L	28.1	Very low	26.6	Very low	169 Å²	169	146.1 Å²	146.1	89%	0.885	82%	0.815	S	S	*	*				43	117.2	128.1	-75.8	160	0	0	0	119.9
22	G	24.8	Very low	26.5	Very low	84 Å²	84	141.1 Å²	141.1	87%	0.866	81%	0.807	S	S	*	*			trans	-141.1	127.2	154.7	0	0	0	0	0	109.8
23	N	24.9	Very low	26.6	Very low	152 Å²	152	140.5 Å²	140.5	81%	0.813	81%	0.808	S	S	*	*			trans	-126.7	123.5	-170.3	-161.1	17.2	0	0	0	108.8
24	Q	25.9	Very low	26	Very low	188 Å²	188	143.7 Å²	143.7	88%	0.879	82%	0.819	S	S	*	*			trans	-166.7	90.1	161.2	-113.4	168.4	21.3	0	0	115.1
25	S	24.6	Very low	26	Very low	86 Å²	86	149 Å²	149	60%	0.601	82%	0.819	S	S	*	*				24	130.9	126.9	61.9	0	0	0	0	124
26	I	27	Very low	26.1	Very low	165 Å²	165	146 Å²	146	85%	0.846	82%	0.817	S	S	*	*			trans	79.6	108.5	139	-57.7	156.5	0	0	0	119.4
27	S	24.6	Very low	26	Very low	120 Å²	120	146.9 Å²	146.9	84%	0.839	81%	0.813	S	S	*	*				-155.3	149	103	72.8	0	0	0	0	109.4
28	G	26.8	Very low	26.1	Very low	70 Å²	70	147 Å²	147	72%	0.722	81%	0.805	S	S	*	*			trans	-117.9	154.5	177.6	0	0	0	0	0	110.8
29	D	25.7	Very low	26.1	Very low	168 Å²	168	148.5 Å²	148.5	90%	0.898	80%	0.804	S	S	*	*			trans	-152.7	161.4	149.6	-135.5	-27.5	0	0	0	112.4
30	S	26.9	Very low	26.2	Very low	100 Å²	100	146 Å²	146	70%	0.699	80%	0.796	S	S	*	*			trans	-101.7	142.5	-160.9	-56.4	0	0	0	0	114.2
31	K	26.8	Very low	26.4	Very low	216 Å²	216	147.2 Å²	147.2	94%	0.939	80%	0.8	S	S	*	*			trans	-171.3	145.4	130.1	-103.2	152.3	-168.6	172.6	0	115.2
32	A	26.7	Very low	26.3	Very low	88 Å²	88	148.6 Å²	148.6	73%	0.727	80%	0.799	S	S	*	*			trans	-65.6	153.8	-175.5	0	0	0	0	0	115.7
33	L	26	Very low	26.5	Very low	164 Å²	164	147.8 Å²	147.8	86%	0.859	79%	0.791	S	S	*	*				177.6	118.4	109.1	-97.4	163.6	0	0	0	111.6
34	L	26.3	Very low	26.7	Very low	172 Å²	172	148.1 Å²	148.1	90%	0.901	79%	0.792	S	S	*	*			trans	-161.8	118.7	152.6	-108.6	164.1	0	0	0	109.4
35	R	25.7	Very low	26.7	Very low	204 Å²	204	149.4 Å²	149.4	77%	0.77	79%	0.789	S	S	*	*			trans	-97.8	155.2	161.6	-80.4	-175.8	172.6	-178.7	-0.7	108.1
36	P	28.4	Very low	26.7	Very low	128 Å²	128	155.3 Å²	155.3	83%	0.831	80%	0.804	S	S	*	*				-133.7	153.8	112.1	32.7	-21.6	0	0	0	114.8
37	L	25	Very low	26.6	Very low	119 Å²	119	155.4 Å²	155.4	62%	0.623	79%	0.794	S	S	*	*			trans	-140.4	145.5	169.3	-74.8	169.3	0	0	0	103.8
38	R	27.3	Very low	26.7	Very low	202 Å²	202	158.8 Å²	158.8	76%	0.762	80%	0.799	S	S	*	*			cis	-172.3	175.7	9	-137.8	177.5	-173.2	-170.6	3.8	110.7
39	L	26.8	Very low	26.7	Very low	138 Å²	138	161.2 Å²	161.2	72%	0.723	80%	0.795	S	S	*	*			trans	72.9	148.3	152.6	-65.6	154.4	0	0	0	116.4
40	T	27.5	Very low	26.9	Very low	113 Å²	113	161 Å²	161	69%	0.693	79%	0.794	S	S	*	*			cis	-139.2	147.2	13.8	-27.5	0	0	0	0	112	F42	T40-F42 HydrophobicContact CG2-CD2 4.05Å; T40-F42 HydrophobicContact CG2-CE2 4.42Å
41	R	27.7	Very low	27	Very low	245 Å²	245	161.1 Å²	161.1	93%	0.925	80%	0.795	S	S	*	*			trans	-125.2	123.9	167.7	-165.8	-175.8	-164.9	-173.5	6	107
42	F	26.9	Very low	27	Very low	199 Å²	199	155.3 Å²	155.3	87%	0.873	78%	0.781	S	S	*	*			trans	-121.9	142.3	174.9	-112.6	-85.9	0	0	0	109.6	T40	T40-F42 HydrophobicContact CG2-CD2 4.05Å; T40-F42 HydrophobicContact CG2-CE2 4.42Å
43	G	30	Very low	27.1	Very low	67 Å²	67	158.5 Å²	158.5	69%	0.691	79%	0.785	S	S	*	*			trans	-168.4	135.7	172.8	0	0	0	0	0	110.7
44	L	27.8	Very low	27.2	Very low	158 Å²	158	156.1 Å²	156.1	83%	0.827	78%	0.782	S	S	*	*			trans	-170.5	106.5	165.9	-94.7	151.6	0	0	0	104
45	W	26.5	Very low	27.4	Very low	216 Å²	216	159.6 Å²	159.6	82%	0.818	78%	0.783	S	S	*	*				85.5	116.6	84.7	-110.9	70	0	0	0	114.8
46	F	24.6	Very low	27.6	Very low	210 Å²	210	154.8 Å²	154.8	92%	0.921	78%	0.78	S	S	*	*			trans	-143.1	96.4	149.6	-108.7	-78.6	0	0	0	110.9
47	R	25.1	Very low	27.7	Very low	166 Å²	166	159.5 Å²	159.5	63%	0.626	78%	0.781	S	S	*	*			trans	13.7	127.6	142.1	-169.7	174	-179	166.5	-2	119.2	D49	R47-D49 IonicContact CZ-OD1 3.34Å; R47-D49 IonicContact CZ-OD2 3.69Å; R47-D49 IonicContact NE-OD1 2.79Å; R47-D49 PolarHBondContact NE-OD1 3.1Å; R47-D49 IonicContact NE-OD2 3.47Å; R47-D49 PolarHBondContact NE-OD2 3.32Å; R47-D49 IonicContact NH2-OD1 3Å; R47-D49 PolarHBondContact NH2-OD1 3.27Å; R47-D49 IonicContact NH2-OD2 3.14Å; R47-D49 PolarHBondContact NH2-OD2 3.28Å; R47-D49 VanDerWaalsContact NH2-OD2 3.14Å
48	M	26.1	Very low	28.1	Very low	192 Å²	192	164.9 Å²	164.9	95%	0.946	79%	0.793	S	S	*	*			trans	-117.7	129	147.3	-90.9	-174.1	164.7	0	0	108.9
49	D	26.3	Very low	28.4	Very low	120 Å²	120	160.3 Å²	160.3	64%	0.642	79%	0.792	S	S	*	*			trans	-79.9	157.5	173.4	-77.7	-22.9	0	0	0	111	R47	R47-D49 IonicContact CZ-OD1 3.34Å; R47-D49 IonicContact CZ-OD2 3.69Å; R47-D49 IonicContact NE-OD1 2.79Å; R47-D49 PolarHBondContact NE-OD1 3.1Å; R47-D49 IonicContact NE-OD2 3.47Å; R47-D49 PolarHBondContact NE-OD2 3.32Å; R47-D49 IonicContact NH2-OD1 3Å; R47-D49 PolarHBondContact NH2-OD1 3.27Å; R47-D49 IonicContact NH2-OD2 3.14Å; R47-D49 PolarHBondContact NH2-OD2 3.28Å; R47-D49 VanDerWaalsContact NH2-OD2 3.14Å
50	N	30.8	Very low	29	Very low	163 Å²	163	158.5 Å²	158.5	87%	0.872	79%	0.792	S	S	*	*			trans	-142.1	119.3	178.1	-168.5	8.9	0	0	0	110.3
51	S	27.8	Very low	29.6	Very low	103 Å²	103	160.8 Å²	160.8	72%	0.72	80%	0.798	S	S	*	*			trans	-149	87.9	175.3	45.2	0	0	0	0	112.5
52	S	28.7	Very low	30.4	Very low	94 Å²	94	157.9 Å²	157.9	66%	0.657	80%	0.797	S	S	*	*			trans	34.2	126.4	135.5	65.4	0	0	0	0	120.7
53	I	28.9	Very low	31.4	Very low	156 Å²	156	159.1 Å²	159.1	80%	0.8	80%	0.796	S	S	*	*				179.6	149.8	104.9	-95.1	163.5	0	0	0	113.5
54	S	26.2	Very low	32.2	Very low	114 Å²	114	161.7 Å²	161.7	80%	0.797	79%	0.794	S	S	*	*			trans	94.1	132.1	159.5	78.2	0	0	0	0	120.2
55	R	32.2	Very low	33.1	Very low	245 Å²	245	160.4 Å²	160.4	93%	0.925	80%	0.796	S	S	*	*			trans	-77.7	149.4	171.2	-61.8	161.3	164.5	161.7	-7.2	109.5
56	S	29.3	Very low	34.1	Very low	102 Å²	102	160 Å²	160	71%	0.713	80%	0.795	S	S	*	*				171.4	151.2	121.9	-170.3	0	0	0	0	113.7
57	R	31.3	Very low	35.3	Very low	227 Å²	227	154.6 Å²	154.6	86%	0.857	78%	0.775	S	S	*	*			trans	65.6	95.1	159.1	-78.7	166.2	-172	-152.1	1.2	120.7
58	R	32.4	Very low	36.7	Very low	232 Å²	232	148.9 Å²	148.9	88%	0.875	77%	0.768	S	S	*	*				44.1	115.9	114.2	-76.3	-173	176.6	174.9	-0.4	119.4
59	S	33.4	Very low	38.1	Very low	106 Å²	106	145.8 Å²	145.8	74%	0.741	75%	0.754	S	S	*	*				91.9	144.8	119.6	72.8	0	0	0	0	120.4
60	S	40.8	Very low	39.7	Very low	101 Å²	101	143 Å²	143	71%	0.706	74%	0.744	S	S	*	*			trans	54.4	101.1	169	56.8	0	0	0	0	117.7
61	I	39.7	Very low	41	Very low	160 Å²	160	140.6 Å²	140.6	82%	0.821	73%	0.731	S	S	*	*				-154.5	69.5	117.3	-81.3	132.3	0	0	0	107.3
62	M	44.8	Very low	42.5	Very low	184 Å²	184	144.8 Å²	144.8	91%	0.906	73%	0.731	S	S	*	*			trans	-97.2	81.8	158.1	-85.3	-167.2	77.9	0	0	108.2
63	R	46.5	Very low	44.1	Very low	226 Å²	226	145.1 Å²	145.1	85%	0.853	73%	0.725	S	S	*	*	S	Bend	trans	173.4	88	163.3	-103.1	171.4	-76.2	-171.9	-0.8	108.6
64	N	47.1	Very low	46	Very low	121 Å²	121	141.2 Å²	141.2	65%	0.647	71%	0.708	S	S	*	*			trans	-172.6	-9.5	153.2	-102.6	-10.9	0	0	0	115.5	R66 N67	N64-R66 PolarHBondContact O-N 2.93Å; N64-N67 PolarHBondContact O-N 2.88Å
65	C	46.5	Very low	47.9	Very low	130 Å²	130	138.9 Å²	138.9	88%	0.878	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	32.5	177.5	-55.3	0	0	0	0	115.3
66	R	47	Very low	49.5	Very low	209 Å²	209	135 Å²	135	79%	0.789	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.6	-28	169.8	-161	164.1	75	179.6	5.5	112.8	N64	N64-R66 PolarHBondContact O-N 2.93Å
67	N	50.3	Low	51.1	Low	96 Å²	96	135.9 Å²	135.9	51%	0.513	67%	0.67	S	S	.	*	H	α-helix	trans	-84.6	-23.9	-178.4	-61.8	5.1	0	0	0	112.4	N64 S70 L71	N64-N67 PolarHBondContact O-N 2.88Å; N67-S70 WeakPolarHBondContact CA-OG 3.34Å; N67-S70 PolarHBondContact O-OG 3.01Å; N67-L71 WeakPolarHBondContact O-CB 3.4Å; N67-L71 PolarHBondContact O-N 3.29Å; N67-L71 VanDerWaalsContact O-N 3.08Å
68	G	54.5	Low	52.5	Low	45 Å²	45	131 Å²	131	46%	0.464	66%	0.66	S	S	.	*	H	α-helix	trans	-68.1	-39.9	176.4	0	0	0	0	0	113.3	L71 W72	G68-L71 PolarHBondContact O-N 2.78Å; G68-W72 WeakPolarHBondContact O-CB 3.31Å; G68-W72 PolarHBondContact O-N 3.26Å
69	L	56.3	Low	53.7	Low	127 Å²	127	126.5 Å²	126.5	67%	0.665	65%	0.653	S	S	*	*	H	α-helix	trans	-67.4	-39.1	177.3	-85.9	155.8	0	0	0	112.4	W72 L73	L69-W72 PolarHBondContact O-N 2.8Å; L69-L73 WeakPolarHBondContact O-CB 3.28Å; L69-L73 PolarHBondContact O-N 3.01Å
70	S	59.1	Low	54.4	Low	61 Å²	61	123.2 Å²	123.2	43%	0.427	64%	0.635	S	S	.	*	H	α-helix	trans	-67.5	-39	173.6	49.1	0	0	0	0	112.2	N67 L73 V74	N67-S70 WeakPolarHBondContact CA-OG 3.34Å; N67-S70 PolarHBondContact O-OG 3.01Å; S70-L73 PolarHBondContact O-N 2.78Å; S70-V74 WeakPolarHBondContact O-CB 3.46Å; S70-V74 VanDerWaalsContact O-CG2 3.28Å; S70-V74 WeakPolarHBondContact O-CG2 3.4Å; S70-V74 PolarHBondContact O-N 2.02Å
71	L	58.9	Low	54.5	Low	113 Å²	113	126.6 Å²	126.6	59%	0.592	64%	0.637	S	S	*	*	H	α-helix	trans	-66	-39.8	173.6	-100.3	153.6	0	0	0	111.8	N67 G68 V74 V75	N67-L71 WeakPolarHBondContact O-CB 3.4Å; N67-L71 PolarHBondContact O-N 3.29Å; N67-L71 VanDerWaalsContact O-N 3.08Å; G68-L71 PolarHBondContact O-N 2.78Å; L71-V74 PolarHBondContact O-N 3.26Å; L71-V75 VanDerWaalsContact O-CB 3.26Å; L71-V75 WeakPolarHBondContact O-CB 3.28Å; L71-V75 WeakPolarHBondContact O-CG2 3.49Å; L71-V75 PolarHBondContact O-N 2.97Å
72	W	59.3	Low	55	Low	192 Å²	192	124.2 Å²	124.2	73%	0.727	63%	0.632	S	S	*	*	H	α-helix	trans	-65.9	-38.1	175.7	-130.1	88.1	0	0	0	112.3	G68 L69 W76	G68-W72 WeakPolarHBondContact O-CB 3.31Å; G68-W72 PolarHBondContact O-N 3.26Å; L69-W72 PolarHBondContact O-N 2.8Å; W72-W76 WeakPolarHBondContact O-CB 3.49Å; W72-W76 PolarHBondContact O-N 2.83Å
73	L	61.6	Low	55.1	Low	101 Å²	101	122.5 Å²	122.5	53%	0.529	63%	0.627	S	S	.	*	H	α-helix	trans	-64.9	-44.2	172.3	-90.8	161	0	0	0	112.5	L69 S70 W76 L77	L69-L73 WeakPolarHBondContact O-CB 3.28Å; L69-L73 PolarHBondContact O-N 3.01Å; S70-L73 PolarHBondContact O-N 2.78Å; L73-W76 PolarHBondContact O-N 3.44Å; L73-L77 WeakPolarHBondContact O-CB 3.26Å; L73-L77 WeakPolarHBondContact O-CD1 3.48Å; L73-L77 VanDerWaalsContact O-CG 3.27Å; L73-L77 WeakPolarHBondContact O-CG 3.34Å; L73-L77 PolarHBondContact O-N 2.82Å
74	V	68.6	Low	55.2	Low	74 Å²	74	117.3 Å²	117.3	45%	0.448	62%	0.622	S	S	.	*	H	α-helix	trans	-66.7	-41.4	177.3	168.7	0	0	0	0	111.1	S70 L71 L77 I78	S70-V74 WeakPolarHBondContact O-CB 3.46Å; S70-V74 VanDerWaalsContact O-CG2 3.28Å; S70-V74 WeakPolarHBondContact O-CG2 3.4Å; S70-V74 PolarHBondContact O-N 2.02Å; L71-V74 PolarHBondContact O-N 3.26Å; V74-L77 PolarHBondContact O-N 2.7Å; V74-I78 HydrophobicContact CG1-CD1 3.58Å; V74-I78 HydrophobicContact CG1-CG1 4.44Å; V74-I78 WeakPolarHBondContact O-CB 2.97Å; V74-I78 WeakPolarHBondContact O-CG1 2.99Å; V74-I78 PolarHBondContact O-N 3.28Å
75	V	66.9	Low	55.4	Low	64 Å²	64	115.8 Å²	115.8	39%	0.388	63%	0.626	S	S	.	*	H	α-helix	trans	-66.7	-36.8	174	170.1	0	0	0	0	111.1	L71 I78 L79	L71-V75 VanDerWaalsContact O-CB 3.26Å; L71-V75 WeakPolarHBondContact O-CB 3.28Å; L71-V75 WeakPolarHBondContact O-CG2 3.49Å; L71-V75 PolarHBondContact O-N 2.97Å; V75-I78 PolarHBondContact O-N 2.94Å; V75-L79 HydrophobicContact CG1-CD1 3.61Å; V75-L79 HydrophobicContact CG1-CG 4.16Å; V75-L79 VanDerWaalsContact O-CB 3.27Å; V75-L79 WeakPolarHBondContact O-CB 3.38Å; V75-L79 PolarHBondContact O-N 3.27Å
76	W	65.3	Low	56.1	Low	164 Å²	164	113.1 Å²	113.1	62%	0.621	61%	0.609	S	S	*	*	H	α-helix	trans	-69.6	-30.2	173.4	-171.5	80.4	0	0	0	112.6	W72 L73 G80	W72-W76 WeakPolarHBondContact O-CB 3.49Å; W72-W76 PolarHBondContact O-N 2.83Å; L73-W76 PolarHBondContact O-N 3.44Å; W76-G80 WeakPolarHBondContact O-CA 3.48Å; W76-G80 PolarHBondContact O-N 3.21Å
77	L	62.3	Low	57.1	Low	120 Å²	120	106.2 Å²	106.2	63%	0.628	60%	0.597	S	S	*	*	H	α-helix	trans	-78.8	-20.6	172.7	-74.4	163.5	0	0	0	113.9	L73 V74	L73-L77 WeakPolarHBondContact O-CB 3.26Å; L73-L77 WeakPolarHBondContact O-CD1 3.48Å; L73-L77 VanDerWaalsContact O-CG 3.27Å; L73-L77 WeakPolarHBondContact O-CG 3.34Å; L73-L77 PolarHBondContact O-N 2.82Å; V74-L77 PolarHBondContact O-N 2.7Å
78	I	60.7	Low	58.8	Low	126 Å²	126	103.7 Å²	103.7	65%	0.646	59%	0.586	S	S	*	*	H	α-helix	trans	-99.3	-39.4	-179.7	-67.6	170.5	0	0	0	112.1	V74 V75	V74-I78 HydrophobicContact CG1-CD1 3.58Å; V74-I78 HydrophobicContact CG1-CG1 4.44Å; V74-I78 WeakPolarHBondContact O-CB 2.97Å; V74-I78 WeakPolarHBondContact O-CG1 2.99Å; V74-I78 PolarHBondContact O-N 3.28Å; V75-I78 PolarHBondContact O-N 2.94Å
79	L	57.7	Low	60.5	Low	137 Å²	137	102 Å²	102	72%	0.717	57%	0.567	S	S	*	*	H	α-helix	trans	-90.6	-25.1	174.9	-67.5	179.4	0	0	0	112.9	V75 K81	V75-L79 HydrophobicContact CG1-CD1 3.61Å; V75-L79 HydrophobicContact CG1-CG 4.16Å; V75-L79 VanDerWaalsContact O-CB 3.27Å; V75-L79 WeakPolarHBondContact O-CB 3.38Å; V75-L79 PolarHBondContact O-N 3.27Å; L79-K81 PolarHBondContact O-N 3.36Å
80	G	49.3	Very low	61.9	Low	36 Å²	36	103.8 Å²	103.8	37%	0.371	57%	0.572	S	S	.	*	S	Bend	trans	-67.8	76.2	154.9	0	0	0	0	0	108.2	W76	W76-G80 WeakPolarHBondContact O-CA 3.48Å; W76-G80 PolarHBondContact O-N 3.21Å
81	K	42.8	Very low	63.4	Low	173 Å²	173	107.6 Å²	107.6	75%	0.752	58%	0.583	S	S	*	*			trans	-43.3	130.8	151.9	-72.1	-179.3	176.8	178.5	0	105.4	L79 N83	L79-K81 PolarHBondContact O-N 3.36Å; K81-N83 PolarHBondContact O-N 3.07Å
82	P	48.6	Very low	65	Low	110 Å²	110	103.1 Å²	103.1	71%	0.714	56%	0.56	S	S	*	*			trans	-52.7	121	157.8	24.8	-31	0	0	0	105
83	N	48.3	Very low	66.6	Low	148 Å²	148	97.5 Å²	97.5	79%	0.791	55%	0.547	S	S	*	.			trans	-45.4	120.8	151.6	-84.5	-0.2	0	0	0	103.4	K81 A85	K81-N83 PolarHBondContact O-N 3.07Å; N83-A85 VanDerWaalsContact C-N 3.32Å; N83-A85 WeakPolarHBondContact O-CA 3.23Å; N83-A85 PolarHBondContact O-N 3.08Å
84	P	48.3	Very low	68.1	Low	117 Å²	117	94 Å²	94	76%	0.76	53%	0.53	S	S	*	.			trans	-53.9	106.8	-174.2	21	-32	0	0	0	105.6	S86	P84-S86 WeakPolarHBondContact O-CA 3.47Å; P84-S86 PolarHBondContact O-N 3.13Å
85	A	51.3	Low	69.2	Low	88 Å²	88	96.4 Å²	96.4	73%	0.727	53%	0.532	S	S	*	.			trans	-62.5	109.2	-164.3	0	0	0	0	0	104.5	N83 A87	N83-A85 VanDerWaalsContact C-N 3.32Å; N83-A85 WeakPolarHBondContact O-CA 3.23Å; N83-A85 PolarHBondContact O-N 3.08Å; A85-A87 VanDerWaalsContact O-CA 3.23Å; A85-A87 WeakPolarHBondContact O-CA 3.24Å; A85-A87 PolarHBondContact O-N 2.87Å
86	S	60.3	Low	70.2	Confident	74 Å²	74	98.1 Å²	98.1	52%	0.517	55%	0.545	S	S	.	.			trans	-39.7	108.1	-155.4	50.3	0	0	0	0	108.4	P84 C88	P84-S86 WeakPolarHBondContact O-CA 3.47Å; P84-S86 PolarHBondContact O-N 3.13Å; S86-C88 PolarHBondContact O-N 2.92Å
87	A	68.9	Low	71.3	Confident	65 Å²	65	96.2 Å²	96.2	54%	0.537	55%	0.552	S	S	.	*			trans	-72.7	70.8	-153.3	0	0	0	0	0	110.9	A85	A85-A87 VanDerWaalsContact O-CA 3.23Å; A85-A87 WeakPolarHBondContact O-CA 3.24Å; A85-A87 PolarHBondContact O-N 2.87Å
88	C	86.1	Confident	72.6	Confident	43 Å²	43	92.8 Å²	92.8	29%	0.291	54%	0.537	S	S	.	.	P	Polyproline II helix	trans	-71.2	128.8	-174.1	-158.1	0	0	0	0	107.8	S86 V93 C94	S86-C88 PolarHBondContact O-N 2.92Å; C88-V93 VanDerWaalsContact SG-C 3.53Å; C88-C94 WeakPolarHBondContact CA-SG 3.26Å; C88-C94 HydrophobicContact CB-CB 3.77Å; C88-C94 WeakPolarHBondContact CB-SG 3.46Å; C88-C94 WeakPolarHBondContact SG-CB 3.15Å; C88-C94 PolarHBondContact SG-N 3.19Å; C88-C94 CovalentContact SG-SG 2.04Å; C88-C94 PolarHBondContact SG-SG 2.91Å
89	P	88.9	Confident	74.1	Confident	9 Å²	9	87.5 Å²	87.5	6%	0.058	51%	0.509	C	S	.	.	P	Polyproline II helix	trans	-57.5	147.6	179.4	-21.8	30.3	0	0	0	111.2	H91 C92 P112 V115	P89-H91 PolarHBondContact O-N 3.35Å; P89-C92 HydrophobicContact CB-CB 4.32Å; P89-C92 WeakPolarHBondContact O-CB 3.29Å; P89-C92 PolarHBondContact O-N 3.4Å; P89-P112 HydrophobicContact CB-CB 3.84Å; P89-P112 HydrophobicContact CB-CG 4.18Å; P89-P112 HydrophobicContact CG-CB 4.41Å; P89-P112 HydrophobicContact CG-CG 4.36Å; P89-V115 HydrophobicContact CG-CG2 4.02Å
90	H	86.8	Confident	75.8	Confident	164 Å²	164	81.6 Å²	81.6	76%	0.759	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	136	175.9	-78.6	-81.2	0	0	0	110.4	C92 F108	H90-C92 VanDerWaalsContact C-N 3.25Å; H90-C92 PolarHBondContact O-N 3.23Å; H90-F108 WeakPolarHBondContact O-CZ 3.19Å
91	H	89.6	Confident	78	Confident	142 Å²	142	79.9 Å²	79.9	66%	0.657	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.8	7.4	-173.7	-48.9	-83.3	0	0	0	116.1	P89 Q106 F108	P89-H91 PolarHBondContact O-N 3.35Å; H91-Q106 HydrophobicContact CB-CG 4.16Å; H91-Q106 WeakPolarHBondContact O-CG 3.47Å; H91-F108 HydrophobicContact CB-CZ 4.08Å
92	C	93.6	Very high	80.5	Confident	18 Å²	18	72.5 Å²	72.5	12%	0.122	43%	0.431	C	S	.	.			trans	-104.4	162.8	169.6	-57.2	0	0	0	0	112.6	P89 H90 S102 C103	P89-C92 HydrophobicContact CB-CB 4.32Å; P89-C92 WeakPolarHBondContact O-CB 3.29Å; P89-C92 PolarHBondContact O-N 3.4Å; H90-C92 VanDerWaalsContact C-N 3.25Å; H90-C92 PolarHBondContact O-N 3.23Å; C92-S102 CarbonylContact C-O 3.48Å; C92-S102 VanDerWaalsContact CA-O 3.23Å; C92-S102 WeakPolarHBondContact CA-O 3.41Å; C92-S102 WeakPolarHBondContact CB-O 3.17Å; C92-C103 HydrophobicContact CB-CB 4.14Å; C92-C103 WeakPolarHBondContact CB-SG 3.46Å; C92-C103 WeakPolarHBondContact SG-CB 3.11Å; C92-C103 CovalentContact SG-SG 2.03Å; C92-C103 PolarHBondContact SG-SG 2.83Å
93	V	93.4	Very high	82.7	Confident	75 Å²	75	67.2 Å²	67.2	46%	0.455	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	128.7	173.8	-176	0	0	0	0	109	C88 Y95 S102	C88-V93 VanDerWaalsContact SG-C 3.53Å; V93-Y95 HydrophobicContact CB-CE2 4.47Å; V93-Y95 HydrophobicContact CG1-CE1 4.18Å; V93-Y95 HydrophobicContact CG1-CE2 3.83Å; V93-S102 PolarHBondContact N-O 3.27Å; V93-S102 WeakPolarHBondContact O-CB 3.32Å; V93-S102 PolarHBondContact O-N 2.71Å
94	C	92.9	Very high	84.9	Confident	26 Å²	26	63.5 Å²	63.5	18%	0.176	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	132.9	-177.3	-60.6	0	0	0	0	111.2	C88 T100	C88-C94 WeakPolarHBondContact CA-SG 3.26Å; C88-C94 HydrophobicContact CB-CB 3.77Å; C88-C94 WeakPolarHBondContact CB-SG 3.46Å; C88-C94 WeakPolarHBondContact SG-CB 3.15Å; C88-C94 PolarHBondContact SG-N 3.19Å; C88-C94 CovalentContact SG-SG 2.04Å; C88-C94 PolarHBondContact SG-SG 2.91Å; C94-T100 CarbonylContact C-O 3.53Å; C94-T100 VanDerWaalsContact CA-O 3.29Å; C94-T100 WeakPolarHBondContact CA-O 3.37Å
95	Y	91.6	Very high	87.1	Confident	125 Å²	125	60.8 Å²	60.8	49%	0.49	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	133.4	176.8	-53.5	-86.1	0	0	0	108.9	V93 P98 M99 T100	V93-Y95 HydrophobicContact CB-CE2 4.47Å; V93-Y95 HydrophobicContact CG1-CE1 4.18Å; V93-Y95 HydrophobicContact CG1-CE2 3.83Å; Y95-P98 VanDerWaalsContact O-O 3.11Å; Y95-M99 CarbonylContact O-C 3.02Å; Y95-M99 VanDerWaalsContact O-CA 3.24Å; Y95-M99 WeakPolarHBondContact O-CA 2.99Å; Y95-T100 HydrophobicContact CD2-CG2 4.35Å; Y95-T100 PolarHBondContact N-O 2.04Å; Y95-T100 PolarHBondContact O-N 2.88Å
96	P	88.1	Confident	89.1	Confident	100 Å²	100	60.8 Å²	60.8	65%	0.649	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.8	-13.7	-172.5	31.3	-36	0	0	0	115.2	M99	P96-M99 PolarHBondContact O-N 2.58Å
97	T	88.8	Confident	90.8	Very high	125 Å²	125	61.5 Å²	61.5	77%	0.767	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.7	99.4	-169.9	54.5	0	0	0	0	112.8
98	P	89	Confident	92	Very high	48 Å²	48	60.1 Å²	60.1	31%	0.312	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	cis	-64.6	159.1	-17.2	29.9	-34.6	0	0	0	111.3	Y95 T100	Y95-P98 VanDerWaalsContact O-O 3.11Å; P98-T100 PolarHBondContact O-N 3.34Å; P98-T100 PolarHBondContact O-OG1 3.23Å
99	M	91.2	Very high	92.4	Very high	14 Å²	14	62.5 Å²	62.5	7%	0.069	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	106.4	-178	-171.4	59.3	170.2	0	0	111.1	Y95 P96 P116 E118 Q120 R121	Y95-M99 CarbonylContact O-C 3.02Å; Y95-M99 VanDerWaalsContact O-CA 3.24Å; Y95-M99 WeakPolarHBondContact O-CA 2.99Å; P96-M99 PolarHBondContact O-N 2.58Å; M99-P116 HydrophobicContact CE-CB 3.61Å; M99-P116 HydrophobicContact CE-CG 3.56Å; M99-E118 WeakPolarHBondContact CB-O 2.99Å; M99-E118 HydrophobicContact CG-CG 4.24Å; M99-Q120 PolarHBondContact O-N 2.97Å; M99-R121 PolarHBondContact O-N 2.87Å
100	T	94.6	Very high	92.6	Very high	14 Å²	14	64 Å²	64	9%	0.086	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	127.3	-168.4	-58.2	0	0	0	0	109.6	C94 Y95 P98 R121 F123	C94-T100 CarbonylContact C-O 3.53Å; C94-T100 VanDerWaalsContact CA-O 3.29Å; C94-T100 WeakPolarHBondContact CA-O 3.37Å; Y95-T100 HydrophobicContact CD2-CG2 4.35Å; Y95-T100 PolarHBondContact N-O 2.04Å; Y95-T100 PolarHBondContact O-N 2.88Å; P98-T100 PolarHBondContact O-N 3.34Å; P98-T100 PolarHBondContact O-OG1 3.23Å; T100-R121 CarbonylContact C-O 3.15Å; T100-R121 WeakPolarHBondContact CA-O 3.06Å; T100-R121 HydrophobicContact CG2-CB 3.94Å; T100-F123 HydrophobicContact CG2-CD2 3.9Å; T100-F123 HydrophobicContact CG2-CE2 3.52Å; T100-F123 HydrophobicContact CG2-CZ 4.44Å
101	V	94.8	Very high	92.9	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	113.3	-178.3	-176.4	0	0	0	0	108.9	V115 R121 F123	V101-V115 HydrophobicContact CG1-CG2 4.49Å; V101-V115 HydrophobicContact CG2-CG1 4.37Å; V101-R121 PolarHBondContact N-O 3.27Å; V101-F123 PolarHBondContact O-N 3.29Å
102	S	95.6	Very high	93	Very high	17 Å²	17	51.2 Å²	51.2	12%	0.119	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	106.4	-174.8	-130	0	0	0	0	109.7	C92 V93 Q104	C92-S102 CarbonylContact C-O 3.48Å; C92-S102 VanDerWaalsContact CA-O 3.23Å; C92-S102 WeakPolarHBondContact CA-O 3.41Å; C92-S102 WeakPolarHBondContact CB-O 3.17Å; V93-S102 PolarHBondContact N-O 3.27Å; V93-S102 WeakPolarHBondContact O-CB 3.32Å; V93-S102 PolarHBondContact O-N 2.71Å; S102-Q104 PolarHBondContact OG-NE2 3.41Å; S102-Q104 PolarHBondContact OG-OE1 3.39Å
103	C	95.1	Very high	92.5	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	33%	0.334	C	S	.	.			trans	-126.5	18.4	-172.7	-69.1	0	0	0	0	112.5	C92 F108 F123 L124 N127	C92-C103 HydrophobicContact CB-CB 4.14Å; C92-C103 WeakPolarHBondContact CB-SG 3.46Å; C92-C103 WeakPolarHBondContact SG-CB 3.11Å; C92-C103 CovalentContact SG-SG 2.03Å; C92-C103 PolarHBondContact SG-SG 2.83Å; C103-F108 HydrophobicContact CB-CD2 4.34Å; C103-F108 HydrophobicContact CB-CE2 3.84Å; C103-F108 WeakPolarHBondContact O-CE2 3.5Å; C103-F123 CarbonylContact C-O 3.09Å; C103-F123 WeakPolarHBondContact CA-O 3.37Å; C103-F123 WeakPolarHBondContact CB-O 3.37Å; C103-F123 PolarHBondContact N-O 3.27Å; C103-L124 HydrophobicContact CB-CD2 3.43Å; C103-L124 VanDerWaalsContact CB-CD2 3.43Å; C103-L124 HydrophobicContact CB-CG 4.22Å; C103-N127 PolarHBondContact O-ND2 3.24Å
104	Q	94.8	Very high	91.9	Very high	70 Å²	70	55.7 Å²	55.7	33%	0.327	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	149.9	-173.5	70.4	-80.5	18.4	0	0	113.7	S102 Q106 F123 Q125	S102-Q104 PolarHBondContact OG-NE2 3.41Å; S102-Q104 PolarHBondContact OG-OE1 3.39Å; Q104-Q106 VanDerWaalsContact C-N 3.32Å; Q104-Q106 PolarHBondContact O-N 3.03Å; Q104-Q106 PolarHBondContact O-NE2 3.24Å; Q104-F123 PolarHBondContact N-O 3.24Å; Q104-Q125 VanDerWaalsContact CA-O 3.29Å; Q104-Q125 WeakPolarHBondContact CA-O 3.26Å; Q104-Q125 HydrophobicContact CB-CG 4.02Å; Q104-Q125 WeakPolarHBondContact CB-O 3.12Å
105	A	94.4	Very high	91.5	Very high	60 Å²	60	55.1 Å²	55.1	50%	0.496	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	29.3	172	0	0	0	0	0	116.2	Q125 N126	A105-Q125 PolarHBondContact N-O 3.18Å; A105-N126 VanDerWaalsContact CA-O 3.3Å; A105-N126 WeakPolarHBondContact CA-O 3.27Å; A105-N126 HydrophobicContact CB-CB 4.38Å; A105-N126 PolarHBondContact N-O 2.9Å
106	Q	93.6	Very high	91	Very high	87 Å²	87	50 Å²	50	41%	0.407	31%	0.31	S	S	.	.	S	Bend	trans	-101.1	1.4	179.8	-55.4	-52	-52.5	0	0	114.1	H91 Q104 F108 N127	H91-Q106 HydrophobicContact CB-CG 4.16Å; H91-Q106 WeakPolarHBondContact O-CG 3.47Å; Q104-Q106 VanDerWaalsContact C-N 3.32Å; Q104-Q106 PolarHBondContact O-N 3.03Å; Q104-Q106 PolarHBondContact O-NE2 3.24Å; Q106-F108 VanDerWaalsContact C-N 3.28Å; Q106-F108 HydrophobicContact CB-CD2 3.71Å; Q106-F108 HydrophobicContact CB-CE1 4.48Å; Q106-F108 HydrophobicContact CB-CE2 3.45Å; Q106-F108 VanDerWaalsContact CB-CE2 3.45Å; Q106-F108 HydrophobicContact CB-CG 4.32Å; Q106-F108 HydrophobicContact CB-CZ 3.89Å; Q106-F108 HydrophobicContact CG-CD2 4.33Å; Q106-F108 HydrophobicContact CG-CE2 3.69Å; Q106-F108 HydrophobicContact CG-CZ 4.18Å; Q106-F108 PolarHBondContact O-N 3.1Å; Q106-N127 WeakPolarHBondContact CA-OD1 3.2Å; Q106-N127 PolarHBondContact N-OD1 2.9Å
107	N	94.8	Very high	90.7	Very high	90 Å²	90	53.3 Å²	53.3	48%	0.481	31%	0.311	S	S	.	.			trans	59.7	28.7	-173	-59.2	-84.4	0	0	0	114.7	T109 N127 R128	N107-T109 PolarHBondContact O-N 3.41Å; N107-N127 PolarHBondContact N-OD1 3.19Å; N107-R128 HydrophobicContact CB-CG 4.47Å; N107-R128 PolarHBondContact OD1-NE 3.16Å; N107-R128 PolarHBondContact OD1-NH2 2.91Å
108	F	94.4	Very high	90.5	Very high	35 Å²	35	53.8 Å²	53.8	15%	0.154	30%	0.304	C	S	.	.			trans	-57.3	131.8	174.6	-69.7	-59	0	0	0	111.5	H90 H91 C103 Q106 P112 N127 R128 I129	H90-F108 WeakPolarHBondContact O-CZ 3.19Å; H91-F108 HydrophobicContact CB-CZ 4.08Å; C103-F108 HydrophobicContact CB-CD2 4.34Å; C103-F108 HydrophobicContact CB-CE2 3.84Å; C103-F108 WeakPolarHBondContact O-CE2 3.5Å; Q106-F108 VanDerWaalsContact C-N 3.28Å; Q106-F108 HydrophobicContact CB-CD2 3.71Å; Q106-F108 HydrophobicContact CB-CE1 4.48Å; Q106-F108 HydrophobicContact CB-CE2 3.45Å; Q106-F108 VanDerWaalsContact CB-CE2 3.45Å; Q106-F108 HydrophobicContact CB-CG 4.32Å; Q106-F108 HydrophobicContact CB-CZ 3.89Å; Q106-F108 HydrophobicContact CG-CD2 4.33Å; Q106-F108 HydrophobicContact CG-CE2 3.69Å; Q106-F108 HydrophobicContact CG-CZ 4.18Å; Q106-F108 PolarHBondContact O-N 3.1Å; F108-P112 HydrophobicContact CD1-CB 4.35Å; F108-P112 HydrophobicContact CD2-CG 4.48Å; F108-P112 HydrophobicContact CE1-CB 4.07Å; F108-P112 HydrophobicContact CE2-CG 4.3Å; F108-P112 HydrophobicContact CZ-CB 4.2Å; F108-P112 HydrophobicContact CZ-CG 4.36Å; F108-N127 HydrophobicContact CB-CB 4.23Å; F108-N127 PolarHBondContact N-OD1 2.97Å; F108-N127 VanDerWaalsContact N-OD1 3.07Å; F108-R128 CarbonylContact O-C 3.16Å; F108-R128 VanDerWaalsContact O-CA 3.28Å; F108-R128 WeakPolarHBondContact O-CA 3.2Å; F108-R128 PolarHBondContact O-N 2.98Å; F108-I129 HydrophobicContact CB-CG1 4.39Å; F108-I129 PolarHBondContact O-N 3.37Å
109	T	94.5	Very high	90.5	Very high	94 Å²	94	51.5 Å²	51.5	58%	0.577	29%	0.289	S	S	*	.	S	Bend	trans	-92.7	-14.7	177	53.1	0	0	0	0	113.6	N107 I129 T130	N107-T109 PolarHBondContact O-N 3.41Å; T109-I129 WeakPolarHBondContact O-CA 3.3Å; T109-T130 PolarHBondContact O-N 3.07Å; T109-T130 VanDerWaalsContact O-N 3.17Å; T109-T130 PolarHBondContact O-OG1 3.23Å
110	A	93.8	Very high	90.7	Very high	39 Å²	39	54.3 Å²	54.3	32%	0.322	30%	0.302	S	S	.	.	S	Bend	trans	-143.5	164.2	174.4	0	0	0	0	0	109
111	V	93	Very high	90.7	Very high	22 Å²	22	58.6 Å²	58.6	13%	0.133	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-59.5	127.3	173.3	-177.3	0	0	0	0	109	L124 I129 L132 F137	V111-L124 HydrophobicContact CG1-CD1 4.04Å; V111-L124 HydrophobicContact CG2-CD1 4.5Å; V111-I129 HydrophobicContact CG2-CD1 4.48Å; V111-I129 HydrophobicContact CG2-CG2 4.48Å; V111-L132 HydrophobicContact CG2-CD2 4.04Å; V111-F137 HydrophobicContact CG1-CD1 4.4Å; V111-F137 HydrophobicContact CG1-CE1 3.79Å; V111-F137 HydrophobicContact CG1-CZ 4.29Å; V111-F137 HydrophobicContact CG2-CE1 4.02Å; V111-F137 HydrophobicContact CG2-CZ 3.68Å
112	P	90.1	Very high	90.8	Very high	17 Å²	17	58.6 Å²	58.6	11%	0.11	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-70.5	134.6	-173.3	28.4	-35.2	0	0	0	111.4	P89 F108 V115 L124	P89-P112 HydrophobicContact CB-CB 3.84Å; P89-P112 HydrophobicContact CB-CG 4.18Å; P89-P112 HydrophobicContact CG-CB 4.41Å; P89-P112 HydrophobicContact CG-CG 4.36Å; F108-P112 HydrophobicContact CD1-CB 4.35Å; F108-P112 HydrophobicContact CD2-CG 4.48Å; F108-P112 HydrophobicContact CE1-CB 4.07Å; F108-P112 HydrophobicContact CE2-CG 4.3Å; F108-P112 HydrophobicContact CZ-CB 4.2Å; F108-P112 HydrophobicContact CZ-CG 4.36Å; P112-V115 HydrophobicContact CG-CG2 4.39Å; P112-V115 WeakPolarHBondContact O-CG2 3.36Å; P112-L124 HydrophobicContact CG-CD2 4.02Å
113	V	84.9	Confident	90.8	Very high	146 Å²	146	59.2 Å²	59.2	89%	0.885	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	137.4	-179.8	-176.6	0	0	0	0	110.2
114	G	80.3	Confident	90.9	Very high	40 Å²	40	59.2 Å²	59.2	41%	0.412	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.5	4.4	176.4	0	0	0	0	0	115.4	P116	G114-P116 WeakPolarHBondContact O-CD 3.48Å; G114-P116 VanDerWaalsContact O-N 3.09Å
115	V	83.5	Confident	91	Very high	15 Å²	15	56.8 Å²	56.8	9%	0.091	31%	0.306	C	S	.	.			trans	-50.2	118.8	169.6	174.8	0	0	0	0	109.1	P89 V101 P112 Y117 V122	P89-V115 HydrophobicContact CG-CG2 4.02Å; V101-V115 HydrophobicContact CG1-CG2 4.49Å; V101-V115 HydrophobicContact CG2-CG1 4.37Å; P112-V115 HydrophobicContact CG-CG2 4.39Å; P112-V115 WeakPolarHBondContact O-CG2 3.36Å; V115-Y117 PolarHBondContact O-N 2.89Å; V115-V122 HydrophobicContact CG1-CG2 4.14Å
116	P	81.7	Confident	91.2	Very high	17 Å²	17	57.8 Å²	57.8	11%	0.11	30%	0.303	C	S	.	.			trans	-62	134.3	-175.4	-30	39.8	0	0	0	112.3	M99 G114 E118 S119	M99-P116 HydrophobicContact CE-CB 3.61Å; M99-P116 HydrophobicContact CE-CG 3.56Å; G114-P116 WeakPolarHBondContact O-CD 3.48Å; G114-P116 VanDerWaalsContact O-N 3.09Å; P116-E118 HydrophobicContact CB-CG 4.27Å; P116-E118 PolarHBondContact O-N 3.14Å; P116-E118 VanDerWaalsContact O-N 3.1Å; P116-S119 WeakPolarHBondContact O-CB 3.31Å; P116-S119 PolarHBondContact O-N 2.83Å; P116-S119 PolarHBondContact O-OG 2.69Å
117	Y	82.1	Confident	91.3	Very high	169 Å²	169	54.1 Å²	54.1	66%	0.663	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-22.8	-176	-61	-72.9	0	0	0	114.4	V115 S119 G138	V115-Y117 PolarHBondContact O-N 2.89Å; Y117-S119 VanDerWaalsContact C-N 3.31Å; Y117-G138 WeakPolarHBondContact O-CA 3.4Å
118	E	84.3	Confident	91.4	Very high	136 Å²	136	57 Å²	57	64%	0.636	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	5.6	175.2	57.3	177	-172.5	0	0	113.9	M99 P116 Q120	M99-E118 WeakPolarHBondContact CB-O 2.99Å; M99-E118 HydrophobicContact CG-CG 4.24Å; P116-E118 HydrophobicContact CB-CG 4.27Å; P116-E118 PolarHBondContact O-N 3.14Å; P116-E118 VanDerWaalsContact O-N 3.1Å; E118-Q120 PolarHBondContact O-N 3Å
119	S	89.5	Confident	91.5	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.283	C	S	.	.			trans	-63.8	122.6	176.2	53.4	0	0	0	0	111.8	P116 Y117 V122 G140 T141	P116-S119 WeakPolarHBondContact O-CB 3.31Å; P116-S119 PolarHBondContact O-N 2.83Å; P116-S119 PolarHBondContact O-OG 2.69Å; Y117-S119 VanDerWaalsContact C-N 3.31Å; S119-V122 WeakPolarHBondContact OG-CG2 3.28Å; S119-G140 CarbonylContact O-C 3.34Å; S119-T141 VanDerWaalsContact O-CA 3.25Å; S119-T141 WeakPolarHBondContact O-CA 3.17Å; S119-T141 PolarHBondContact O-N 3.06Å; S119-T141 PolarHBondContact O-OG1 3.15Å
120	Q	94.4	Very high	91.6	Very high	72 Å²	72	53.1 Å²	53.1	34%	0.336	27%	0.27	S	S	.	.	S	Bend	trans	-89	-29.1	175.1	-67.8	177.4	-6.8	0	0	111.5	M99 E118 G140 Q142 V143	M99-Q120 PolarHBondContact O-N 2.97Å; E118-Q120 PolarHBondContact O-N 3Å; Q120-G140 WeakPolarHBondContact CA-O 3.48Å; Q120-Q142 WeakPolarHBondContact O-CA 3.2Å; Q120-Q142 WeakPolarHBondContact O-CB 3.49Å; Q120-Q142 PolarHBondContact O-N 3.28Å; Q120-V143 PolarHBondContact O-N 3.35Å
121	R	95.9	Very high	91.6	Very high	104 Å²	104	53.9 Å²	53.9	39%	0.392	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	124.3	-178	-58.6	-177.6	179.5	171.4	-2.6	109.9	M99 T100 V101 F123 V143	M99-R121 PolarHBondContact O-N 2.87Å; T100-R121 CarbonylContact C-O 3.15Å; T100-R121 WeakPolarHBondContact CA-O 3.06Å; T100-R121 HydrophobicContact CG2-CB 3.94Å; V101-R121 PolarHBondContact N-O 3.27Å; R121-F123 HydrophobicContact CB-CE1 4.44Å; R121-F123 HydrophobicContact CB-CE2 4.37Å; R121-F123 HydrophobicContact CB-CZ 4.05Å; R121-V143 WeakPolarHBondContact CA-O 3.39Å; R121-V143 HydrophobicContact CG-CB 4.17Å; R121-V143 HydrophobicContact CG-CG2 4.33Å
122	V	95.6	Very high	91.6	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	115.8	-178.4	-178.8	0	0	0	0	109	V115 S119 L124 F137 T141 V143 L144 W145	V115-V122 HydrophobicContact CG1-CG2 4.14Å; S119-V122 WeakPolarHBondContact OG-CG2 3.28Å; V122-L124 HydrophobicContact CG1-CD1 3.63Å; V122-L124 HydrophobicContact CG1-CG 4.04Å; V122-F137 HydrophobicContact CG1-CD1 4.46Å; V122-F137 HydrophobicContact CG1-CE1 4.48Å; V122-T141 HydrophobicContact CB-CG2 4.46Å; V122-T141 HydrophobicContact CG2-CG2 4.08Å; V122-V143 PolarHBondContact N-O 3.02Å; V122-L144 HydrophobicContact CB-CD1 3.92Å; V122-L144 HydrophobicContact CG1-CD1 3.95Å; V122-W145 PolarHBondContact O-N 3.17Å
123	F	97.1	Very high	91.6	Very high	31 Å²	31	57.4 Å²	57.4	14%	0.136	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	101.9	-174.9	-59.6	-42.2	0	0	0	110.1	T100 V101 C103 Q104 R121 Q125 V143 W145	T100-F123 HydrophobicContact CG2-CD2 3.9Å; T100-F123 HydrophobicContact CG2-CE2 3.52Å; T100-F123 HydrophobicContact CG2-CZ 4.44Å; V101-F123 PolarHBondContact O-N 3.29Å; C103-F123 CarbonylContact C-O 3.09Å; C103-F123 WeakPolarHBondContact CA-O 3.37Å; C103-F123 WeakPolarHBondContact CB-O 3.37Å; C103-F123 PolarHBondContact N-O 3.27Å; Q104-F123 PolarHBondContact N-O 3.24Å; R121-F123 HydrophobicContact CB-CE1 4.44Å; R121-F123 HydrophobicContact CB-CE2 4.37Å; R121-F123 HydrophobicContact CB-CZ 4.05Å; F123-Q125 VanDerWaalsContact C-OE1 3.24Å; F123-Q125 VanDerWaalsContact CA-OE1 3.31Å; F123-Q125 VanDerWaalsContact CB-OE1 3.3Å; F123-V143 HydrophobicContact CE1-CG1 4.1Å; F123-W145 HydrophobicContact CD1-CB 4.11Å; F123-W145 AromaticContact CD1-CD2 3.52Å; F123-W145 HydrophobicContact CD1-CD2 3.52Å; F123-W145 AromaticContact CD1-CE3 3.24Å; F123-W145 HydrophobicContact CD1-CE3 3.24Å; F123-W145 AromaticContact CD1-CG 3.92Å; F123-W145 HydrophobicContact CD1-CG 3.92Å; F123-W145 AromaticContact CD1-CZ3 3.85Å; F123-W145 HydrophobicContact CD1-CZ3 3.85Å; F123-W145 AromaticContact CE1-CD2 3.59Å; F123-W145 HydrophobicContact CE1-CD2 3.59Å; F123-W145 AromaticContact CE1-CE2 3.94Å; F123-W145 AromaticContact CE1-CE3 3.45Å; F123-W145 HydrophobicContact CE1-CE3 3.45Å; F123-W145 VanDerWaalsContact CE1-CE3 3.45Å; F123-W145 HydrophobicContact CE1-CG 4.23Å; F123-W145 HydrophobicContact CE1-CH2 4.04Å; F123-W145 HydrophobicContact CE1-CZ2 4.16Å; F123-W145 AromaticContact CE1-CZ3 3.68Å; F123-W145 HydrophobicContact CE1-CZ3 3.68Å; F123-W145 HydrophobicContact CG-CE3 4.05Å; F123-W145 HydrophobicContact CZ-CE3 4.39Å; F123-W145 HydrophobicContact CZ-CH2 4.46Å; F123-W145 HydrophobicContact CZ-CZ3 4.22Å
124	L	96.4	Very high	91.8	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.255	C	S	.	.			trans	-120.4	13.2	-176.3	-76.3	161.9	0	0	0	112.6	C103 V111 P112 V122 N127 I129 F137 W145 L146 N149	C103-L124 HydrophobicContact CB-CD2 3.43Å; C103-L124 VanDerWaalsContact CB-CD2 3.43Å; C103-L124 HydrophobicContact CB-CG 4.22Å; V111-L124 HydrophobicContact CG1-CD1 4.04Å; V111-L124 HydrophobicContact CG2-CD1 4.5Å; P112-L124 HydrophobicContact CG-CD2 4.02Å; V122-L124 HydrophobicContact CG1-CD1 3.63Å; V122-L124 HydrophobicContact CG1-CG 4.04Å; L124-N127 PolarHBondContact O-ND2 3.43Å; L124-I129 HydrophobicContact CB-CD1 4.02Å; L124-I129 HydrophobicContact CD1-CD1 4.46Å; L124-I129 HydrophobicContact CD2-CD1 4.14Å; L124-I129 HydrophobicContact CG-CD1 4.45Å; L124-F137 HydrophobicContact CD1-CE1 3.72Å; L124-F137 HydrophobicContact CD1-CZ 4.43Å; L124-W145 CarbonylContact C-O 3.06Å; L124-W145 WeakPolarHBondContact CA-O 3.35Å; L124-W145 PolarHBondContact N-O 3.45Å; L124-L146 HydrophobicContact CB-CD2 3.74Å; L124-L146 HydrophobicContact CD1-CD2 4Å; L124-N149 PolarHBondContact O-ND2 3.08Å
125	Q	97.3	Very high	92	Very high	18 Å²	18	55.2 Å²	55.2	8%	0.084	27%	0.267	C	S	.	.			trans	-62	159.7	178.6	70.8	-84.6	19.2	0	0	113.7	Q104 A105 F123 N127 W145 F147	Q104-Q125 VanDerWaalsContact CA-O 3.29Å; Q104-Q125 WeakPolarHBondContact CA-O 3.26Å; Q104-Q125 HydrophobicContact CB-CG 4.02Å; Q104-Q125 WeakPolarHBondContact CB-O 3.12Å; A105-Q125 PolarHBondContact N-O 3.18Å; F123-Q125 VanDerWaalsContact C-OE1 3.24Å; F123-Q125 VanDerWaalsContact CA-OE1 3.31Å; F123-Q125 VanDerWaalsContact CB-OE1 3.3Å; Q125-N127 VanDerWaalsContact C-N 3.28Å; Q125-N127 PolarHBondContact O-N 3.31Å; Q125-N127 PolarHBondContact O-ND2 3.26Å; Q125-W145 PolarHBondContact N-O 3.34Å; Q125-F147 WeakPolarHBondContact CA-O 3.24Å; Q125-F147 HydrophobicContact CB-CD1 3.76Å; Q125-F147 HydrophobicContact CB-CD2 3.77Å; Q125-F147 HydrophobicContact CB-CE1 3.63Å; Q125-F147 HydrophobicContact CB-CE2 3.65Å; Q125-F147 HydrophobicContact CB-CG 3.83Å; Q125-F147 HydrophobicContact CB-CZ 3.59Å; Q125-F147 WeakPolarHBondContact CB-O 3.44Å; Q125-F147 HydrophobicContact CG-CD1 4.47Å; Q125-F147 HydrophobicContact CG-CD2 4.47Å; Q125-F147 HydrophobicContact CG-CE1 3.84Å; Q125-F147 HydrophobicContact CG-CE2 3.83Å; Q125-F147 HydrophobicContact CG-CZ 3.49Å; Q125-F147 VanDerWaalsContact CG-CZ 3.49Å
126	N	97.4	Very high	92.2	Very high	81 Å²	81	56.1 Å²	56.1	43%	0.433	27%	0.274	S	S	.	.	S	Bend	trans	58.5	36	178.7	-55.4	-47.9	0	0	0	113.4	A105 F147 S148	A105-N126 VanDerWaalsContact CA-O 3.3Å; A105-N126 WeakPolarHBondContact CA-O 3.27Å; A105-N126 HydrophobicContact CB-CB 4.38Å; A105-N126 PolarHBondContact N-O 2.9Å; N126-F147 PolarHBondContact N-O 3.3Å; N126-F147 VanDerWaalsContact N-O 3.1Å; N126-S148 WeakPolarHBondContact CA-O 3.4Å; N126-S148 PolarHBondContact N-O 3.19Å; N126-S148 WeakPolarHBondContact OD1-CB 3.24Å
127	N	96.9	Very high	92.6	Very high	10 Å²	10	56.1 Å²	56.1	5%	0.053	27%	0.272	C	S	.	.	S	Bend	trans	-111.4	-161.2	175	-78.8	-63.9	0	0	0	110.1	C103 Q106 N107 F108 L124 Q125 I129 S148 N149	C103-N127 PolarHBondContact O-ND2 3.24Å; Q106-N127 WeakPolarHBondContact CA-OD1 3.2Å; Q106-N127 PolarHBondContact N-OD1 2.9Å; N107-N127 PolarHBondContact N-OD1 3.19Å; F108-N127 HydrophobicContact CB-CB 4.23Å; F108-N127 PolarHBondContact N-OD1 2.97Å; F108-N127 VanDerWaalsContact N-OD1 3.07Å; L124-N127 PolarHBondContact O-ND2 3.43Å; Q125-N127 VanDerWaalsContact C-N 3.28Å; Q125-N127 PolarHBondContact O-N 3.31Å; Q125-N127 PolarHBondContact O-ND2 3.26Å; N127-I129 HydrophobicContact CB-CD1 4.4Å; N127-I129 HydrophobicContact CB-CG1 4.18Å; N127-S148 PolarHBondContact N-O 3.11Å; N127-N149 VanDerWaalsContact CA-OD1 3.31Å; N127-N149 WeakPolarHBondContact CA-OD1 3.47Å; N127-N149 WeakPolarHBondContact CB-OD1 3.13Å; N127-N149 PolarHBondContact N-OD1 2.86Å; N127-N149 PolarHBondContact O-OD1 3.09Å
128	R	96.8	Very high	92.7	Very high	152 Å²	152	48.1 Å²	48.1	57%	0.574	24%	0.241	S	C	*	.			trans	-126	28.5	179.5	-59.2	-174.4	-174.6	-141.5	-1	111.2	N107 F108 T130 N149	N107-R128 HydrophobicContact CB-CG 4.47Å; N107-R128 PolarHBondContact OD1-NE 3.16Å; N107-R128 PolarHBondContact OD1-NH2 2.91Å; F108-R128 CarbonylContact O-C 3.16Å; F108-R128 VanDerWaalsContact O-CA 3.28Å; F108-R128 WeakPolarHBondContact O-CA 3.2Å; F108-R128 PolarHBondContact O-N 2.98Å; R128-T130 PolarHBondContact O-N 3.35Å; R128-N149 PolarHBondContact N-OD1 3.32Å
129	I	96.6	Very high	92.9	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.238	C	C	.	.			trans	-62.3	126.5	-175.1	-61.8	171.4	0	0	0	108.4	F108 T109 V111 L124 N127 L132 L146 N149 N150 I151	F108-I129 HydrophobicContact CB-CG1 4.39Å; F108-I129 PolarHBondContact O-N 3.37Å; T109-I129 WeakPolarHBondContact O-CA 3.3Å; V111-I129 HydrophobicContact CG2-CD1 4.48Å; V111-I129 HydrophobicContact CG2-CG2 4.48Å; L124-I129 HydrophobicContact CB-CD1 4.02Å; L124-I129 HydrophobicContact CD1-CD1 4.46Å; L124-I129 HydrophobicContact CD2-CD1 4.14Å; L124-I129 HydrophobicContact CG-CD1 4.45Å; N127-I129 HydrophobicContact CB-CD1 4.4Å; N127-I129 HydrophobicContact CB-CG1 4.18Å; I129-L132 HydrophobicContact CG2-CD2 4.07Å; I129-L146 HydrophobicContact CD1-CD2 4.15Å; I129-N149 HydrophobicContact CB-CB 4.44Å; I129-N149 WeakPolarHBondContact CB-OD1 3.4Å; I129-N149 WeakPolarHBondContact CG1-OD1 3.45Å; I129-N149 PolarHBondContact N-OD1 3.28Å; I129-N150 CarbonylContact O-C 3.56Å; I129-N150 PolarHBondContact O-N 2.92Å; I129-N150 VanDerWaalsContact O-N 3.17Å; I129-I151 HydrophobicContact CB-CG1 4.49Å; I129-I151 HydrophobicContact CG2-CG1 4.31Å; I129-I151 WeakPolarHBondContact O-CA 3.1Å; I129-I151 WeakPolarHBondContact O-CG1 3.33Å; I129-I151 PolarHBondContact O-N 3.44Å
130	T	95.3	Very high	92.9	Very high	47 Å²	47	48.7 Å²	48.7	29%	0.288	25%	0.246	S	C	.	.			trans	-99.6	-24.8	-176.3	52.3	0	0	0	0	114.2	T109 R128 N150 T152 W153	T109-T130 PolarHBondContact O-N 3.07Å; T109-T130 VanDerWaalsContact O-N 3.17Å; T109-T130 PolarHBondContact O-OG1 3.23Å; R128-T130 PolarHBondContact O-N 3.35Å; T130-N150 WeakPolarHBondContact CA-O 3.3Å; T130-T152 PolarHBondContact O-N 3.03Å; T130-T152 PolarHBondContact O-OG1 3.35Å; T130-T152 VanDerWaalsContact O-OG1 3.11Å; T130-W153 PolarHBondContact O-N 3.17Å
131	E	94.1	Very high	92.9	Very high	55 Å²	55	45.2 Å²	45.2	26%	0.257	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	145.8	-171.1	58	-175.2	-179.9	0	0	111.4	R133 W153	E131-R133 VanDerWaalsContact CD-CZ 3.41Å; E131-R133 IonicContact OE1-CZ 2.7Å; E131-R133 IonicContact OE1-NH1 3.55Å; E131-R133 PolarHBondContact OE1-NH1 3.11Å; E131-R133 IonicContact OE1-NH2 3.64Å; E131-R133 PolarHBondContact OE1-NH2 3.09Å; E131-R133 IonicContact OE2-CZ 2.69Å; E131-R133 IonicContact OE2-NH1 3.74Å; E131-R133 IonicContact OE2-NH2 2.75Å; E131-R133 PolarHBondContact OE2-NH2 2.89Å; E131-W153 WeakPolarHBondContact CA-O 3.13Å; E131-W153 HydrophobicContact CB-CE3 4.3Å
132	L	93.9	Very high	92.9	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	126.8	173.2	-57.3	-179.9	0	0	0	109.3	V111 I129 F137 L146 I151 W153 I154 E155 A158 F159 L170	V111-L132 HydrophobicContact CG2-CD2 4.04Å; I129-L132 HydrophobicContact CG2-CD2 4.07Å; L132-F137 HydrophobicContact CD2-CE2 4.33Å; L132-F137 HydrophobicContact CD2-CZ 4.13Å; L132-L146 HydrophobicContact CD1-CD1 3.74Å; L132-L146 HydrophobicContact CD2-CD1 4.01Å; L132-L146 HydrophobicContact CD2-CD2 4.16Å; L132-I151 HydrophobicContact CD1-CD1 4.11Å; L132-I151 HydrophobicContact CD2-CD1 4.22Å; L132-I151 HydrophobicContact CG-CD1 4.2Å; L132-I151 HydrophobicContact CG-CG2 4.34Å; L132-W153 PolarHBondContact N-O 3.15Å; L132-I154 HydrophobicContact CB-CG2 4.36Å; L132-I154 HydrophobicContact CD1-CD1 4.2Å; L132-I154 HydrophobicContact CD1-CG1 4.06Å; L132-I154 HydrophobicContact CD1-CG2 4.46Å; L132-I154 HydrophobicContact CG-CG1 4.47Å; L132-E155 WeakPolarHBondContact O-CB 3.35Å; L132-E155 PolarHBondContact O-N 3.25Å; L132-A158 HydrophobicContact CB-CB 4.39Å; L132-F159 HydrophobicContact CD1-CE1 3.89Å; L132-F159 HydrophobicContact CD1-CZ 3.5Å; L132-F159 VanDerWaalsContact CD1-CZ 3.5Å; L132-L170 HydrophobicContact CD1-CD2 4.01Å
133	R	90.6	Very high	93	Very high	113 Å²	113	43.9 Å²	43.9	43%	0.426	23%	0.229	S	C	.	.			trans	-112.6	156.3	-179.7	-70.5	-169.3	178.6	85.4	8.4	113	E131 G135 S136 E155	E131-R133 VanDerWaalsContact CD-CZ 3.41Å; E131-R133 IonicContact OE1-CZ 2.7Å; E131-R133 IonicContact OE1-NH1 3.55Å; E131-R133 PolarHBondContact OE1-NH1 3.11Å; E131-R133 IonicContact OE1-NH2 3.64Å; E131-R133 PolarHBondContact OE1-NH2 3.09Å; E131-R133 IonicContact OE2-CZ 2.69Å; E131-R133 IonicContact OE2-NH1 3.74Å; E131-R133 IonicContact OE2-NH2 2.75Å; E131-R133 PolarHBondContact OE2-NH2 2.89Å; R133-G135 PolarHBondContact O-N 3.29Å; R133-S136 PolarHBondContact N-OG 2.84Å; R133-S136 VanDerWaalsContact O-CB 3.32Å; R133-S136 WeakPolarHBondContact O-CB 3.48Å; R133-S136 PolarHBondContact O-N 2.92Å; R133-S136 PolarHBondContact O-OG 2.76Å; R133-E155 WeakPolarHBondContact CA-OE2 3.36Å; R133-E155 VanDerWaalsContact CB-OE2 3.3Å; R133-E155 WeakPolarHBondContact CB-OE2 3.18Å
134	V	89	Confident	93	Very high	76 Å²	76	42.4 Å²	42.4	46%	0.461	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	136.4	170.5	-178.2	0	0	0	0	110.4	S136 E155	V134-S136 VanDerWaalsContact C-N 3.29Å; V134-S136 PolarHBondContact O-N 3.37Å; V134-E155 HydrophobicContact CG2-CG 4.1Å; V134-E155 PolarHBondContact N-OE2 3.17Å
135	G	84.6	Confident	93.1	Very high	64 Å²	64	45.9 Å²	45.9	66%	0.66	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.3	6.3	178.9	0	0	0	0	0	115.7	R133 F137	R133-G135 PolarHBondContact O-N 3.29Å; G135-F137 PolarHBondContact O-N 3.03Å
136	S	86.5	Confident	93.1	Very high	34 Å²	34	45 Å²	45	24%	0.238	23%	0.232	C	C	.	.	S	Bend	trans	-68	-15.4	175.5	-56.6	0	0	0	0	113.9	R133 V134	R133-S136 PolarHBondContact N-OG 2.84Å; R133-S136 VanDerWaalsContact O-CB 3.32Å; R133-S136 WeakPolarHBondContact O-CB 3.48Å; R133-S136 PolarHBondContact O-N 2.92Å; R133-S136 PolarHBondContact O-OG 2.76Å; V134-S136 VanDerWaalsContact C-N 3.29Å; V134-S136 PolarHBondContact O-N 3.37Å
137	F	89.8	Confident	93.1	Very high	16 Å²	16	43.6 Å²	43.6	7%	0.07	22%	0.222	C	C	.	.	S	Bend	trans	-133.4	152.4	-171.5	-56.1	-65	0	0	0	111.4	V111 V122 L124 L132 G135 L144 L146 F159 L162	V111-F137 HydrophobicContact CG1-CD1 4.4Å; V111-F137 HydrophobicContact CG1-CE1 3.79Å; V111-F137 HydrophobicContact CG1-CZ 4.29Å; V111-F137 HydrophobicContact CG2-CE1 4.02Å; V111-F137 HydrophobicContact CG2-CZ 3.68Å; V122-F137 HydrophobicContact CG1-CD1 4.46Å; V122-F137 HydrophobicContact CG1-CE1 4.48Å; L124-F137 HydrophobicContact CD1-CE1 3.72Å; L124-F137 HydrophobicContact CD1-CZ 4.43Å; L132-F137 HydrophobicContact CD2-CE2 4.33Å; L132-F137 HydrophobicContact CD2-CZ 4.13Å; G135-F137 PolarHBondContact O-N 3.03Å; F137-L144 HydrophobicContact CD1-CD1 3.97Å; F137-L144 HydrophobicContact CD1-CD2 4.27Å; F137-L144 HydrophobicContact CD2-CD2 3.92Å; F137-L144 HydrophobicContact CE1-CD1 3.65Å; F137-L144 HydrophobicContact CE1-CD2 4.22Å; F137-L144 HydrophobicContact CE2-CD2 3.86Å; F137-L144 HydrophobicContact CG-CD2 4.13Å; F137-L144 HydrophobicContact CZ-CD1 4.04Å; F137-L144 HydrophobicContact CZ-CD2 4.02Å; F137-L146 HydrophobicContact CE2-CD1 4.44Å; F137-L146 HydrophobicContact CZ-CD1 4.02Å; F137-L146 HydrophobicContact CZ-CD2 4.27Å; F137-F159 HydrophobicContact CE2-CE1 4.36Å; F137-L162 HydrophobicContact CB-CD1 4.19Å; F137-L162 HydrophobicContact CB-CD2 3.91Å; F137-L162 HydrophobicContact CD2-CD1 4.33Å
138	G	84.9	Confident	93.2	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.01	23%	0.23	C	C	.	.			trans	-76.8	141.8	178	0	0	0	0	0	112.5	Y117 G140 T141 L162	Y117-G138 WeakPolarHBondContact O-CA 3.4Å; G138-G140 PolarHBondContact O-N 2.89Å; G138-G140 VanDerWaalsContact O-N 3.12Å; G138-T141 WeakPolarHBondContact O-CB 3.33Å; G138-T141 PolarHBondContact O-N 3.08Å; G138-T141 PolarHBondContact O-OG1 2.75Å; G138-L162 WeakPolarHBondContact O-CD2 3.34Å
139	F	88.3	Confident	93.2	Very high	133 Å²	133	37.9 Å²	37.9	58%	0.583	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-25.8	179.9	55.5	-94.1	0	0	0	113.9	T141	F139-T141 VanDerWaalsContact C-N 3.28Å; F139-T141 PolarHBondContact O-N 3.43Å
140	G	89.9	Confident	93.2	Very high	15 Å²	15	41.6 Å²	41.6	16%	0.155	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	6.7	176.6	0	0	0	0	0	115.3	S119 Q120 G138 Q142	S119-G140 CarbonylContact O-C 3.34Å; Q120-G140 WeakPolarHBondContact CA-O 3.48Å; G138-G140 PolarHBondContact O-N 2.89Å; G138-G140 VanDerWaalsContact O-N 3.12Å; G140-Q142 PolarHBondContact O-N 3.22Å
141	T	94.2	Very high	93.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.211	C	C	.	.			trans	-68.5	120.9	-179.6	-52.2	0	0	0	0	110.4	S119 V122 G138 F139 L144 D164 L165	S119-T141 VanDerWaalsContact O-CA 3.25Å; S119-T141 WeakPolarHBondContact O-CA 3.17Å; S119-T141 PolarHBondContact O-N 3.06Å; S119-T141 PolarHBondContact O-OG1 3.15Å; V122-T141 HydrophobicContact CB-CG2 4.46Å; V122-T141 HydrophobicContact CG2-CG2 4.08Å; G138-T141 WeakPolarHBondContact O-CB 3.33Å; G138-T141 PolarHBondContact O-N 3.08Å; G138-T141 PolarHBondContact O-OG1 2.75Å; F139-T141 VanDerWaalsContact C-N 3.28Å; F139-T141 PolarHBondContact O-N 3.43Å; T141-L144 HydrophobicContact CG2-CB 4.11Å; T141-D164 CarbonylContact O-C 3.39Å; T141-L165 HydrophobicContact CG2-CD1 3.89Å; T141-L165 VanDerWaalsContact O-CA 3.27Å; T141-L165 WeakPolarHBondContact O-CA 3.19Å; T141-L165 WeakPolarHBondContact O-CD1 3.37Å; T141-L165 PolarHBondContact O-N 3.32Å
142	Q	96.5	Very high	93.3	Very high	56 Å²	56	40.3 Å²	40.3	26%	0.262	22%	0.221	S	C	.	.			trans	-100.1	-36.9	176.8	-66.3	171.5	-11.9	0	0	112.1	Q120 G140 D164 E166 E167	Q120-Q142 WeakPolarHBondContact O-CA 3.2Å; Q120-Q142 WeakPolarHBondContact O-CB 3.49Å; Q120-Q142 PolarHBondContact O-N 3.28Å; G140-Q142 PolarHBondContact O-N 3.22Å; Q142-D164 WeakPolarHBondContact CA-O 3.46Å; Q142-D164 WeakPolarHBondContact CG-O 3.48Å; Q142-E166 PolarHBondContact O-N 3.34Å; Q142-E167 PolarHBondContact O-N 2.97Å
143	V	97.8	Very high	93.3	Very high	19 Å²	19	45 Å²	45	12%	0.115	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	121.6	179.6	-177.1	0	0	0	0	109.6	Q120 R121 V122 F123 E167	Q120-V143 PolarHBondContact O-N 3.35Å; R121-V143 WeakPolarHBondContact CA-O 3.39Å; R121-V143 HydrophobicContact CG-CB 4.17Å; R121-V143 HydrophobicContact CG-CG2 4.33Å; V122-V143 PolarHBondContact N-O 3.02Å; F123-V143 HydrophobicContact CE1-CG1 4.1Å; V143-E167 HydrophobicContact CG1-CB 4.23Å; V143-E167 HydrophobicContact CG1-CG 4.37Å; V143-E167 HydrophobicContact CG2-CB 4.31Å
144	L	97.3	Very high	93.4	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	110.3	178.3	178.7	55.2	0	0	0	110.6	V122 F137 T141 L146 F159 L162 L165 E167 L168 D169	V122-L144 HydrophobicContact CB-CD1 3.92Å; V122-L144 HydrophobicContact CG1-CD1 3.95Å; F137-L144 HydrophobicContact CD1-CD1 3.97Å; F137-L144 HydrophobicContact CD1-CD2 4.27Å; F137-L144 HydrophobicContact CD2-CD2 3.92Å; F137-L144 HydrophobicContact CE1-CD1 3.65Å; F137-L144 HydrophobicContact CE1-CD2 4.22Å; F137-L144 HydrophobicContact CE2-CD2 3.86Å; F137-L144 HydrophobicContact CG-CD2 4.13Å; F137-L144 HydrophobicContact CZ-CD1 4.04Å; F137-L144 HydrophobicContact CZ-CD2 4.02Å; T141-L144 HydrophobicContact CG2-CB 4.11Å; L144-L146 HydrophobicContact CD1-CD1 4.04Å; L144-L146 HydrophobicContact CD1-CG 4Å; L144-L146 HydrophobicContact CD2-CD1 3.87Å; L144-L146 HydrophobicContact CG-CD1 3.8Å; L144-L146 HydrophobicContact CG-CG 4.11Å; L144-F159 HydrophobicContact CD2-CD1 4.44Å; L144-F159 HydrophobicContact CD2-CE1 4.14Å; L144-L162 HydrophobicContact CD2-CD1 4.18Å; L144-L165 HydrophobicContact CB-CD1 3.88Å; L144-E167 PolarHBondContact N-O 2.96Å; L144-L168 HydrophobicContact CB-CD1 4.13Å; L144-L168 HydrophobicContact CD2-CD1 3.93Å; L144-L168 HydrophobicContact CG-CD1 4.01Å; L144-D169 PolarHBondContact O-N 2.83Å
145	W	98.2	Very high	93.5	Very high	74 Å²	74	39.4 Å²	39.4	28%	0.28	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	117.2	175.3	-67	-12.6	0	0	0	111.3	V122 F123 L124 Q125 F147 E167	V122-W145 PolarHBondContact O-N 3.17Å; F123-W145 HydrophobicContact CD1-CB 4.11Å; F123-W145 AromaticContact CD1-CD2 3.52Å; F123-W145 HydrophobicContact CD1-CD2 3.52Å; F123-W145 AromaticContact CD1-CE3 3.24Å; F123-W145 HydrophobicContact CD1-CE3 3.24Å; F123-W145 AromaticContact CD1-CG 3.92Å; F123-W145 HydrophobicContact CD1-CG 3.92Å; F123-W145 AromaticContact CD1-CZ3 3.85Å; F123-W145 HydrophobicContact CD1-CZ3 3.85Å; F123-W145 AromaticContact CE1-CD2 3.59Å; F123-W145 HydrophobicContact CE1-CD2 3.59Å; F123-W145 AromaticContact CE1-CE2 3.94Å; F123-W145 AromaticContact CE1-CE3 3.45Å; F123-W145 HydrophobicContact CE1-CE3 3.45Å; F123-W145 VanDerWaalsContact CE1-CE3 3.45Å; F123-W145 HydrophobicContact CE1-CG 4.23Å; F123-W145 HydrophobicContact CE1-CH2 4.04Å; F123-W145 HydrophobicContact CE1-CZ2 4.16Å; F123-W145 AromaticContact CE1-CZ3 3.68Å; F123-W145 HydrophobicContact CE1-CZ3 3.68Å; F123-W145 HydrophobicContact CG-CE3 4.05Å; F123-W145 HydrophobicContact CZ-CE3 4.39Å; F123-W145 HydrophobicContact CZ-CH2 4.46Å; F123-W145 HydrophobicContact CZ-CZ3 4.22Å; L124-W145 CarbonylContact C-O 3.06Å; L124-W145 WeakPolarHBondContact CA-O 3.35Å; L124-W145 PolarHBondContact N-O 3.45Å; Q125-W145 PolarHBondContact N-O 3.34Å; W145-F147 HydrophobicContact CB-CD1 4.02Å; W145-F147 HydrophobicContact CB-CE1 4.04Å; W145-F147 HydrophobicContact CD2-CE1 4.01Å; W145-F147 HydrophobicContact CE3-CE1 4.04Å; W145-F147 HydrophobicContact CG-CD1 4.26Å; W145-F147 HydrophobicContact CG-CE1 4.05Å; W145-E167 PolarHBondContact NE1-OE1 3.29Å
146	L	97.1	Very high	93.5	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.203	C	C	.	.			trans	-125.7	12.8	178.7	-71.5	163.3	0	0	0	111.5	L124 I129 L132 F137 L144 N149 I151 D169 L170 N173	L124-L146 HydrophobicContact CB-CD2 3.74Å; L124-L146 HydrophobicContact CD1-CD2 4Å; I129-L146 HydrophobicContact CD1-CD2 4.15Å; L132-L146 HydrophobicContact CD1-CD1 3.74Å; L132-L146 HydrophobicContact CD2-CD1 4.01Å; L132-L146 HydrophobicContact CD2-CD2 4.16Å; F137-L146 HydrophobicContact CE2-CD1 4.44Å; F137-L146 HydrophobicContact CZ-CD1 4.02Å; F137-L146 HydrophobicContact CZ-CD2 4.27Å; L144-L146 HydrophobicContact CD1-CD1 4.04Å; L144-L146 HydrophobicContact CD1-CG 4Å; L144-L146 HydrophobicContact CD2-CD1 3.87Å; L144-L146 HydrophobicContact CG-CD1 3.8Å; L144-L146 HydrophobicContact CG-CG 4.11Å; L146-N149 WeakPolarHBondContact O-CB 3.46Å; L146-N149 PolarHBondContact O-ND2 2.9Å; L146-I151 HydrophobicContact CB-CD1 4.07Å; L146-D169 CarbonylContact C-O 3.47Å; L146-D169 WeakPolarHBondContact CA-O 3.46Å; L146-D169 WeakPolarHBondContact CB-O 3.33Å; L146-D169 PolarHBondContact N-O 3.14Å; L146-L170 HydrophobicContact CB-CD2 4.04Å; L146-L170 HydrophobicContact CD1-CD2 3.88Å; L146-N173 PolarHBondContact O-ND2 3.37Å
147	F	97.8	Very high	93.4	Very high	51 Å²	51	38.3 Å²	38.3	22%	0.224	20%	0.201	C	C	.	.			trans	-66.2	156.3	-177.7	69.5	-99.6	0	0	0	113.6	Q125 N126 W145 N149 D169 G171	Q125-F147 WeakPolarHBondContact CA-O 3.24Å; Q125-F147 HydrophobicContact CB-CD1 3.76Å; Q125-F147 HydrophobicContact CB-CD2 3.77Å; Q125-F147 HydrophobicContact CB-CE1 3.63Å; Q125-F147 HydrophobicContact CB-CE2 3.65Å; Q125-F147 HydrophobicContact CB-CG 3.83Å; Q125-F147 HydrophobicContact CB-CZ 3.59Å; Q125-F147 WeakPolarHBondContact CB-O 3.44Å; Q125-F147 HydrophobicContact CG-CD1 4.47Å; Q125-F147 HydrophobicContact CG-CD2 4.47Å; Q125-F147 HydrophobicContact CG-CE1 3.84Å; Q125-F147 HydrophobicContact CG-CE2 3.83Å; Q125-F147 HydrophobicContact CG-CZ 3.49Å; Q125-F147 VanDerWaalsContact CG-CZ 3.49Å; N126-F147 PolarHBondContact N-O 3.3Å; N126-F147 VanDerWaalsContact N-O 3.1Å; W145-F147 HydrophobicContact CB-CD1 4.02Å; W145-F147 HydrophobicContact CB-CE1 4.04Å; W145-F147 HydrophobicContact CD2-CE1 4.01Å; W145-F147 HydrophobicContact CE3-CE1 4.04Å; W145-F147 HydrophobicContact CG-CD1 4.26Å; W145-F147 HydrophobicContact CG-CE1 4.05Å; F147-N149 PolarHBondContact O-N 2.92Å; F147-N149 PolarHBondContact O-ND2 3.1Å; F147-D169 HydrophobicContact CD1-CB 4.18Å; F147-D169 WeakPolarHBondContact CD1-OD2 3.47Å; F147-D169 PolarHBondContact N-O 3.29Å; F147-G171 CarbonylContact C-O 3.36Å; F147-G171 WeakPolarHBondContact CA-O 3.25Å; F147-G171 WeakPolarHBondContact CB-O 3.21Å
148	S	97.8	Very high	93.4	Very high	32 Å²	32	37.9 Å²	37.9	22%	0.224	20%	0.2	C	C	.	.	S	Bend	trans	51	54.7	-176.8	-60.4	0	0	0	0	111.8	N126 N127 G171 D172	N126-S148 WeakPolarHBondContact CA-O 3.4Å; N126-S148 PolarHBondContact N-O 3.19Å; N126-S148 WeakPolarHBondContact OD1-CB 3.24Å; N127-S148 PolarHBondContact N-O 3.11Å; S148-G171 PolarHBondContact N-O 3.08Å; S148-D172 WeakPolarHBondContact CA-O 3.44Å; S148-D172 WeakPolarHBondContact CB-OD2 3.47Å; S148-D172 PolarHBondContact OG-OD2 3.06Å
149	N	97.6	Very high	93.8	Very high	10 Å²	10	37.8 Å²	37.8	5%	0.053	20%	0.2	C	C	.	.	S	Bend	trans	-118	-167.8	171.4	-90	-81.4	0	0	0	109.5	L124 N127 R128 I129 L146 F147 I151 N173	L124-N149 PolarHBondContact O-ND2 3.08Å; N127-N149 VanDerWaalsContact CA-OD1 3.31Å; N127-N149 WeakPolarHBondContact CA-OD1 3.47Å; N127-N149 WeakPolarHBondContact CB-OD1 3.13Å; N127-N149 PolarHBondContact N-OD1 2.86Å; N127-N149 PolarHBondContact O-OD1 3.09Å; R128-N149 PolarHBondContact N-OD1 3.32Å; I129-N149 HydrophobicContact CB-CB 4.44Å; I129-N149 WeakPolarHBondContact CB-OD1 3.4Å; I129-N149 WeakPolarHBondContact CG1-OD1 3.45Å; I129-N149 PolarHBondContact N-OD1 3.28Å; L146-N149 WeakPolarHBondContact O-CB 3.46Å; L146-N149 PolarHBondContact O-ND2 2.9Å; F147-N149 PolarHBondContact O-N 2.92Å; F147-N149 PolarHBondContact O-ND2 3.1Å; N149-I151 HydrophobicContact CB-CD1 4.22Å; N149-I151 HydrophobicContact CB-CG1 4.05Å; N149-N173 WeakPolarHBondContact CA-OD1 3.32Å; N149-N173 WeakPolarHBondContact CB-OD1 3.27Å; N149-N173 PolarHBondContact O-OD1 3.37Å
150	N	96.5	Very high	93.9	Very high	78 Å²	78	33.1 Å²	33.1	42%	0.417	18%	0.183	S	C	.	.			trans	-119.8	38.2	176.3	-169.1	55.3	0	0	0	111.3	I129 T130 T152 N173	I129-N150 CarbonylContact O-C 3.56Å; I129-N150 PolarHBondContact O-N 2.92Å; I129-N150 VanDerWaalsContact O-N 3.17Å; T130-N150 WeakPolarHBondContact CA-O 3.3Å; N150-T152 PolarHBondContact O-N 3.4Å; N150-N173 PolarHBondContact N-OD1 3.39Å
151	I	96.5	Very high	93.8	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	20%	0.199	C	C	.	.			trans	-66.5	119.3	-173.8	-60.8	165.4	0	0	0	108.6	I129 L132 L146 N149 I154 L170 N173 G175 L176	I129-I151 HydrophobicContact CB-CG1 4.49Å; I129-I151 HydrophobicContact CG2-CG1 4.31Å; I129-I151 WeakPolarHBondContact O-CA 3.1Å; I129-I151 WeakPolarHBondContact O-CG1 3.33Å; I129-I151 PolarHBondContact O-N 3.44Å; L132-I151 HydrophobicContact CD1-CD1 4.11Å; L132-I151 HydrophobicContact CD2-CD1 4.22Å; L132-I151 HydrophobicContact CG-CD1 4.2Å; L132-I151 HydrophobicContact CG-CG2 4.34Å; L146-I151 HydrophobicContact CB-CD1 4.07Å; N149-I151 HydrophobicContact CB-CD1 4.22Å; N149-I151 HydrophobicContact CB-CG1 4.05Å; I151-I154 HydrophobicContact CG2-CD1 4.45Å; I151-I154 HydrophobicContact CG2-CG1 3.9Å; I151-L170 HydrophobicContact CD1-CD2 4.3Å; I151-N173 HydrophobicContact CB-CB 4.27Å; I151-N173 WeakPolarHBondContact CB-OD1 3.4Å; I151-N173 VanDerWaalsContact CG1-OD1 3.3Å; I151-N173 WeakPolarHBondContact CG1-OD1 3.46Å; I151-N173 PolarHBondContact N-OD1 2.91Å; I151-G175 CarbonylContact O-C 3.08Å; I151-L176 HydrophobicContact CG2-CD1 4.39Å; I151-L176 VanDerWaalsContact O-CA 3.3Å; I151-L176 WeakPolarHBondContact O-CA 3.37Å; I151-L176 WeakPolarHBondContact O-CB 3.17Å; I151-L176 PolarHBondContact O-N 3.08Å
152	T	94.9	Very high	93.7	Very high	74 Å²	74	37.5 Å²	37.5	45%	0.454	20%	0.2	S	C	.	.			trans	-106	-21.9	177.4	50.3	0	0	0	0	112.8	T130 N150	T130-T152 PolarHBondContact O-N 3.03Å; T130-T152 PolarHBondContact O-OG1 3.35Å; T130-T152 VanDerWaalsContact O-OG1 3.11Å; N150-T152 PolarHBondContact O-N 3.4Å
153	W	93.3	Very high	93.5	Very high	98 Å²	98	42 Å²	42	37%	0.371	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	143.8	-177.6	-178.3	59.2	0	0	0	111.4	T130 E131 L132 E155 E180	T130-W153 PolarHBondContact O-N 3.17Å; E131-W153 WeakPolarHBondContact CA-O 3.13Å; E131-W153 HydrophobicContact CB-CE3 4.3Å; L132-W153 PolarHBondContact N-O 3.15Å; W153-E155 HydrophobicContact CH2-CB 3.73Å; W153-E155 HydrophobicContact CH2-CG 3.83Å; W153-E155 HydrophobicContact CZ2-CB 3.93Å; W153-E155 HydrophobicContact CZ2-CG 4.09Å; W153-E155 HydrophobicContact CZ3-CB 4.22Å; W153-E180 PolarHBondContact NE1-OE1 3.25Å
154	I	93.8	Very high	93.4	Very high	9 Å²	9	43.9 Å²	43.9	5%	0.046	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	117.2	175.7	-58.1	-179	0	0	0	105.3	L132 I151 A158 F159 L170 L176 L179	L132-I154 HydrophobicContact CB-CG2 4.36Å; L132-I154 HydrophobicContact CD1-CD1 4.2Å; L132-I154 HydrophobicContact CD1-CG1 4.06Å; L132-I154 HydrophobicContact CD1-CG2 4.46Å; L132-I154 HydrophobicContact CG-CG1 4.47Å; I151-I154 HydrophobicContact CG2-CD1 4.45Å; I151-I154 HydrophobicContact CG2-CG1 3.9Å; I154-A158 HydrophobicContact CG2-CB 3.91Å; I154-F159 HydrophobicContact CD1-CE2 4.3Å; I154-F159 HydrophobicContact CD1-CZ 4.43Å; I154-F159 HydrophobicContact CG2-CD2 4.45Å; I154-F159 HydrophobicContact CG2-CE2 3.75Å; I154-F159 HydrophobicContact CG2-CZ 4.14Å; I154-L170 HydrophobicContact CD1-CD1 4.04Å; I154-L170 HydrophobicContact CD1-CD2 4.38Å; I154-L176 HydrophobicContact CD1-CD1 3.96Å; I154-L176 HydrophobicContact CD1-CD2 4.22Å; I154-L176 HydrophobicContact CG1-CD1 3.96Å; I154-L179 HydrophobicContact CD1-CD2 4.14Å
155	E	89.8	Confident	93.4	Very high	62 Å²	62	43.9 Å²	43.9	29%	0.29	22%	0.224	S	C	.	.			trans	-61.5	140	178.8	-173.3	174.6	-154.6	0	0	110.8	L132 R133 V134 W153 G157 A158	L132-E155 WeakPolarHBondContact O-CB 3.35Å; L132-E155 PolarHBondContact O-N 3.25Å; R133-E155 WeakPolarHBondContact CA-OE2 3.36Å; R133-E155 VanDerWaalsContact CB-OE2 3.3Å; R133-E155 WeakPolarHBondContact CB-OE2 3.18Å; V134-E155 HydrophobicContact CG2-CG 4.1Å; V134-E155 PolarHBondContact N-OE2 3.17Å; W153-E155 HydrophobicContact CH2-CB 3.73Å; W153-E155 HydrophobicContact CH2-CG 3.83Å; W153-E155 HydrophobicContact CZ2-CB 3.93Å; W153-E155 HydrophobicContact CZ2-CG 4.09Å; W153-E155 HydrophobicContact CZ3-CB 4.22Å; E155-G157 PolarHBondContact O-N 2.74Å; E155-G157 VanDerWaalsContact O-N 3.14Å; E155-A158 HydrophobicContact CB-CB 4.39Å; E155-A158 WeakPolarHBondContact O-CB 3.23Å; E155-A158 PolarHBondContact O-N 2.76Å
156	A	85.7	Confident	93.4	Very high	57 Å²	57	44 Å²	44	47%	0.471	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	120.4	175.8	0	0	0	0	0	110.8
157	G	84	Confident	93.5	Very high	19 Å²	19	46.7 Å²	46.7	20%	0.196	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.3	10.5	-175.7	0	0	0	0	0	115.4	E155 F159 S160	E155-G157 PolarHBondContact O-N 2.74Å; E155-G157 VanDerWaalsContact O-N 3.14Å; G157-F159 PolarHBondContact O-N 3.47Å; G157-S160 PolarHBondContact O-N 3.11Å; G157-S160 PolarHBondContact O-OG 2.87Å; G157-S160 VanDerWaalsContact O-OG 3.13Å
158	A	89.9	Confident	93.5	Very high	6 Å²	6	44.3 Å²	44.3	5%	0.05	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-25.4	175.3	0	0	0	0	0	113.9	L132 I154 E155	L132-A158 HydrophobicContact CB-CB 4.39Å; I154-A158 HydrophobicContact CG2-CB 3.91Å; E155-A158 HydrophobicContact CB-CB 4.39Å; E155-A158 WeakPolarHBondContact O-CB 3.23Å; E155-A158 PolarHBondContact O-N 2.76Å
159	F	92.7	Very high	93.5	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	2.3	177.4	-49.8	-58.3	0	0	0	114.6	L132 F137 L144 I154 G157 E161 L162 L168 L170 A183 F184 L187	L132-F159 HydrophobicContact CD1-CE1 3.89Å; L132-F159 HydrophobicContact CD1-CZ 3.5Å; L132-F159 VanDerWaalsContact CD1-CZ 3.5Å; F137-F159 HydrophobicContact CE2-CE1 4.36Å; L144-F159 HydrophobicContact CD2-CD1 4.44Å; L144-F159 HydrophobicContact CD2-CE1 4.14Å; I154-F159 HydrophobicContact CD1-CE2 4.3Å; I154-F159 HydrophobicContact CD1-CZ 4.43Å; I154-F159 HydrophobicContact CG2-CD2 4.45Å; I154-F159 HydrophobicContact CG2-CE2 3.75Å; I154-F159 HydrophobicContact CG2-CZ 4.14Å; G157-F159 PolarHBondContact O-N 3.47Å; F159-E161 VanDerWaalsContact C-N 3.29Å; F159-E161 PolarHBondContact O-N 2.86Å; F159-E161 VanDerWaalsContact O-N 3.17Å; F159-L162 HydrophobicContact CB-CD1 4.27Å; F159-L162 HydrophobicContact CD1-CD1 3.93Å; F159-L162 WeakPolarHBondContact O-CB 3.11Å; F159-L162 PolarHBondContact O-N 2.87Å; F159-L168 HydrophobicContact CD2-CD2 4.22Å; F159-L168 HydrophobicContact CE1-CD1 4.26Å; F159-L168 HydrophobicContact CE1-CD2 4.43Å; F159-L168 HydrophobicContact CE2-CD2 4.09Å; F159-L168 HydrophobicContact CG-CD2 4.46Å; F159-L168 HydrophobicContact CZ-CD1 4.39Å; F159-L168 HydrophobicContact CZ-CD2 4.19Å; F159-L170 HydrophobicContact CE2-CD1 4.19Å; F159-L170 HydrophobicContact CZ-CD1 4.17Å; F159-L170 HydrophobicContact CZ-CD2 4.12Å; F159-A183 WeakPolarHBondContact CD2-O 3.49Å; F159-F184 AromaticContact CD2-CD1 3.98Å; F159-F184 HydrophobicContact CD2-CD1 3.98Å; F159-F184 HydrophobicContact CD2-CE1 4.13Å; F159-F184 HydrophobicContact CE2-CD1 4.24Å; F159-F184 AromaticContact CE2-CE1 3.9Å; F159-F184 HydrophobicContact CE2-CE1 3.9Å; F159-L187 HydrophobicContact CB-CD1 3.99Å; F159-L187 HydrophobicContact CB-CD2 4.05Å; F159-L187 HydrophobicContact CB-CG 4.29Å; F159-L187 WeakPolarHBondContact O-CD2 3.3Å
160	S	89.9	Confident	93.5	Very high	34 Å²	34	43.1 Å²	43.1	24%	0.238	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-25.4	-165.6	66.8	0	0	0	0	115.6	G157 R185	G157-S160 PolarHBondContact O-N 3.11Å; G157-S160 PolarHBondContact O-OG 2.87Å; G157-S160 VanDerWaalsContact O-OG 3.13Å; S160-R185 WeakPolarHBondContact CA-O 3.28Å
161	E	88.7	Confident	93.6	Very high	103 Å²	103	39.4 Å²	39.4	48%	0.481	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-2.5	176.8	-59.1	-48.5	137.7	0	0	113.7	F159 R163	F159-E161 VanDerWaalsContact C-N 3.29Å; F159-E161 PolarHBondContact O-N 2.86Å; F159-E161 VanDerWaalsContact O-N 3.17Å; E161-R163 PolarHBondContact O-N 3.04Å; E161-R163 IonicContact OE2-CZ 2.9Å; E161-R163 IonicContact OE2-NE 2.64Å; E161-R163 IonicContact OE2-NH2 3.65Å; E161-R163 PolarHBondContact OE2-NH2 3.03Å
162	L	92.7	Very high	93.6	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.021	22%	0.216	C	C	.	.			trans	-84.7	55.3	-179.3	-51.5	-176.4	0	0	0	111.5	F137 G138 L144 F159 D164 L165 L187	F137-L162 HydrophobicContact CB-CD1 4.19Å; F137-L162 HydrophobicContact CB-CD2 3.91Å; F137-L162 HydrophobicContact CD2-CD1 4.33Å; G138-L162 WeakPolarHBondContact O-CD2 3.34Å; L144-L162 HydrophobicContact CD2-CD1 4.18Å; F159-L162 HydrophobicContact CB-CD1 4.27Å; F159-L162 HydrophobicContact CD1-CD1 3.93Å; F159-L162 WeakPolarHBondContact O-CB 3.11Å; F159-L162 PolarHBondContact O-N 2.87Å; L162-D164 PolarHBondContact O-N 2.95Å; L162-L165 HydrophobicContact CB-CB 4.02Å; L162-L165 HydrophobicContact CB-CD2 4.29Å; L162-L165 HydrophobicContact CD1-CD2 4.19Å; L162-L165 WeakPolarHBondContact O-CB 3.34Å; L162-L165 PolarHBondContact O-N 3.46Å; L162-L187 HydrophobicContact CB-CD2 3.87Å; L162-L187 VanDerWaalsContact O-CD2 3.24Å; L162-L187 WeakPolarHBondContact O-CD2 3.3Å
163	R	92.8	Very high	93.7	Very high	150 Å²	150	38.6 Å²	38.6	57%	0.566	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-19	-173.1	-55.5	-177.5	-161.5	-175.6	7.5	113.8	E161 K189	E161-R163 PolarHBondContact O-N 3.04Å; E161-R163 IonicContact OE2-CZ 2.9Å; E161-R163 IonicContact OE2-NE 2.64Å; E161-R163 IonicContact OE2-NH2 3.65Å; E161-R163 PolarHBondContact OE2-NH2 3.03Å; R163-K189 WeakPolarHBondContact O-CD 3.16Å
164	D	95.3	Very high	93.8	Very high	60 Å²	60	35.6 Å²	35.6	32%	0.321	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	6.3	175.6	-71.3	-35.9	0	0	0	113.5	T141 Q142 L162 E166 K189	T141-D164 CarbonylContact O-C 3.39Å; Q142-D164 WeakPolarHBondContact CA-O 3.46Å; Q142-D164 WeakPolarHBondContact CG-O 3.48Å; L162-D164 PolarHBondContact O-N 2.95Å; D164-E166 PolarHBondContact O-N 3.01Å; D164-K189 IonicContact OD1-NZ 2.76Å; D164-K189 PolarHBondContact OD1-NZ 3.09Å
165	L	97.1	Very high	93.8	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.193	C	C	.	.			trans	-70.7	122.9	179.9	-161.3	70.2	0	0	0	111.3	T141 L144 L162 L168 L187 K189 L190	T141-L165 HydrophobicContact CG2-CD1 3.89Å; T141-L165 VanDerWaalsContact O-CA 3.27Å; T141-L165 WeakPolarHBondContact O-CA 3.19Å; T141-L165 WeakPolarHBondContact O-CD1 3.37Å; T141-L165 PolarHBondContact O-N 3.32Å; L144-L165 HydrophobicContact CB-CD1 3.88Å; L162-L165 HydrophobicContact CB-CB 4.02Å; L162-L165 HydrophobicContact CB-CD2 4.29Å; L162-L165 HydrophobicContact CD1-CD2 4.19Å; L162-L165 WeakPolarHBondContact O-CB 3.34Å; L162-L165 PolarHBondContact O-N 3.46Å; L165-L168 HydrophobicContact CD2-CB 3.94Å; L165-L168 HydrophobicContact CD2-CD1 4.42Å; L165-L168 HydrophobicContact CD2-CD2 4.26Å; L165-L168 HydrophobicContact CD2-CG 4.44Å; L165-L187 HydrophobicContact CB-CD2 4.09Å; L165-L187 HydrophobicContact CD2-CD1 4.16Å; L165-L187 HydrophobicContact CD2-CD2 3.91Å; L165-K189 CarbonylContact O-C 3.19Å; L165-L190 HydrophobicContact CD2-CD1 4.16Å; L165-L190 HydrophobicContact CG-CD1 4.09Å; L165-L190 VanDerWaalsContact O-CA 3.23Å; L165-L190 WeakPolarHBondContact O-CA 3.21Å; L165-L190 PolarHBondContact O-N 3.07Å; L165-L190 VanDerWaalsContact O-N 3.17Å
166	E	98.1	Very high	93.9	Very high	75 Å²	75	33.4 Å²	33.4	35%	0.35	18%	0.181	S	C	.	.			trans	-105	-30.8	178.3	-61.1	-175	165.7	0	0	111.4	Q142 D164 Q191 S192	Q142-E166 PolarHBondContact O-N 3.34Å; D164-E166 PolarHBondContact O-N 3.01Å; E166-Q191 HydrophobicContact CB-CG 4.31Å; E166-Q191 WeakPolarHBondContact O-CA 3.49Å; E166-Q191 WeakPolarHBondContact O-CB 3.48Å; E166-Q191 PolarHBondContact O-N 3.03Å; E166-S192 PolarHBondContact O-N 3.01Å
167	E	98.6	Very high	94.2	Very high	58 Å²	58	34.2 Å²	34.2	27%	0.271	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	124.8	-178.2	-176.2	177.5	150.1	0	0	111.8	Q142 V143 L144 W145	Q142-E167 PolarHBondContact O-N 2.97Å; V143-E167 HydrophobicContact CG1-CB 4.23Å; V143-E167 HydrophobicContact CG1-CG 4.37Å; V143-E167 HydrophobicContact CG2-CB 4.31Å; L144-E167 PolarHBondContact N-O 2.96Å; W145-E167 PolarHBondContact NE1-OE1 3.29Å
168	L	98.2	Very high	94.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	114.6	175.9	178.8	55.2	0	0	0	110.2	L144 F159 L165 L170 F184 L187 L190 S192 L193 H194	L144-L168 HydrophobicContact CB-CD1 4.13Å; L144-L168 HydrophobicContact CD2-CD1 3.93Å; L144-L168 HydrophobicContact CG-CD1 4.01Å; F159-L168 HydrophobicContact CD2-CD2 4.22Å; F159-L168 HydrophobicContact CE1-CD1 4.26Å; F159-L168 HydrophobicContact CE1-CD2 4.43Å; F159-L168 HydrophobicContact CE2-CD2 4.09Å; F159-L168 HydrophobicContact CG-CD2 4.46Å; F159-L168 HydrophobicContact CZ-CD1 4.39Å; F159-L168 HydrophobicContact CZ-CD2 4.19Å; L165-L168 HydrophobicContact CD2-CB 3.94Å; L165-L168 HydrophobicContact CD2-CD1 4.42Å; L165-L168 HydrophobicContact CD2-CD2 4.26Å; L165-L168 HydrophobicContact CD2-CG 4.44Å; L168-L170 HydrophobicContact CD1-CD2 4.35Å; L168-L170 HydrophobicContact CD1-CG 4.1Å; L168-L170 HydrophobicContact CD2-CD1 4.11Å; L168-L170 HydrophobicContact CG-CD1 4.23Å; L168-L170 HydrophobicContact CG-CG 4.12Å; L168-F184 HydrophobicContact CD2-CD1 3.96Å; L168-F184 HydrophobicContact CD2-CE1 3.84Å; L168-L187 HydrophobicContact CD2-CD1 4.08Å; L168-L190 HydrophobicContact CB-CD1 3.87Å; L168-S192 PolarHBondContact N-O 3.17Å; L168-L193 HydrophobicContact CB-CD1 4.15Å; L168-L193 HydrophobicContact CD2-CD1 4.01Å; L168-L193 HydrophobicContact CG-CD1 4.09Å; L168-H194 PolarHBondContact O-N 3.08Å
169	D	98.5	Very high	94.6	Very high	16 Å²	16	43.7 Å²	43.7	9%	0.086	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	107.9	174.3	-163.7	-13.9	0	0	0	112.3	L144 L146 F147 G171 H194 H196	L144-D169 PolarHBondContact O-N 2.83Å; L146-D169 CarbonylContact C-O 3.47Å; L146-D169 WeakPolarHBondContact CA-O 3.46Å; L146-D169 WeakPolarHBondContact CB-O 3.33Å; L146-D169 PolarHBondContact N-O 3.14Å; F147-D169 HydrophobicContact CD1-CB 4.18Å; F147-D169 WeakPolarHBondContact CD1-OD2 3.47Å; F147-D169 PolarHBondContact N-O 3.29Å; D169-G171 WeakPolarHBondContact OD1-CA 3.4Å; D169-G171 PolarHBondContact OD1-N 3.3Å; D169-H194 HydrophobicContact CB-CB 4.12Å; D169-H194 WeakPolarHBondContact OD1-CB 3.5Å; D169-H194 IonicContact OD1-CG 3.74Å; D169-H194 IonicContact OD2-CG 2.79Å; D169-H194 IonicContact OD2-ND1 3.13Å; D169-H196 IonicContact OD1-CE1 2.76Å
170	L	97.3	Very high	94.4	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.005	23%	0.225	C	C	.	.			trans	-107.7	10.3	174.3	-65.3	168.5	0	0	0	112.1	L132 L146 I151 I154 F159 L168 N173 F184 H194 C198	L132-L170 HydrophobicContact CD1-CD2 4.01Å; L146-L170 HydrophobicContact CB-CD2 4.04Å; L146-L170 HydrophobicContact CD1-CD2 3.88Å; I151-L170 HydrophobicContact CD1-CD2 4.3Å; I154-L170 HydrophobicContact CD1-CD1 4.04Å; I154-L170 HydrophobicContact CD1-CD2 4.38Å; F159-L170 HydrophobicContact CE2-CD1 4.19Å; F159-L170 HydrophobicContact CZ-CD1 4.17Å; F159-L170 HydrophobicContact CZ-CD2 4.12Å; L168-L170 HydrophobicContact CD1-CD2 4.35Å; L168-L170 HydrophobicContact CD1-CG 4.1Å; L168-L170 HydrophobicContact CD2-CD1 4.11Å; L168-L170 HydrophobicContact CG-CD1 4.23Å; L168-L170 HydrophobicContact CG-CG 4.12Å; L170-N173 PolarHBondContact O-ND2 3.28Å; L170-F184 HydrophobicContact CD1-CE1 3.79Å; L170-F184 HydrophobicContact CD1-CZ 4.03Å; L170-H194 CarbonylContact C-O 3.33Å; L170-H194 WeakPolarHBondContact CA-O 3.39Å; L170-H194 WeakPolarHBondContact CB-O 3.2Å; L170-H194 PolarHBondContact N-O 3.38Å; L170-C198 PolarHBondContact O-SG 2.83Å
171	G	97.4	Very high	94.1	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.233	C	C	.	.			trans	-60	159.7	-174.7	0	0	0	0	0	114.4	F147 S148 D169 N173 H194 H196	F147-G171 CarbonylContact C-O 3.36Å; F147-G171 WeakPolarHBondContact CA-O 3.25Å; F147-G171 WeakPolarHBondContact CB-O 3.21Å; S148-G171 PolarHBondContact N-O 3.08Å; D169-G171 WeakPolarHBondContact OD1-CA 3.4Å; D169-G171 PolarHBondContact OD1-N 3.3Å; G171-N173 PolarHBondContact O-N 2.65Å; G171-N173 VanDerWaalsContact O-N 3.17Å; G171-N173 PolarHBondContact O-ND2 3.45Å; G171-N173 VanDerWaalsContact O-ND2 3.13Å; G171-H194 PolarHBondContact N-O 2.69Å; G171-H196 CarbonylContact C-O 3.56Å; G171-H196 VanDerWaalsContact CA-O 3.31Å; G171-H196 WeakPolarHBondContact CA-O 3.49Å
172	D	97.5	Very high	93.9	Very high	58 Å²	58	44 Å²	44	31%	0.31	22%	0.218	S	C	.	.	S	Bend	trans	54.7	37	176.7	-162.8	47.2	0	0	0	113.3	S148 P174 H196	S148-D172 WeakPolarHBondContact CA-O 3.44Å; S148-D172 WeakPolarHBondContact CB-OD2 3.47Å; S148-D172 PolarHBondContact OG-OD2 3.06Å; D172-P174 VanDerWaalsContact C-CD 3.46Å; D172-P174 WeakPolarHBondContact O-CD 3.35Å; D172-H196 PolarHBondContact N-O 3.24Å
173	N	97.4	Very high	93.7	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.218	C	C	.	.			trans	-107	78.8	171	-82	-79.7	0	0	0	109.8	L146 N149 N150 I151 L170 G171 G175 L176 C198	L146-N173 PolarHBondContact O-ND2 3.37Å; N149-N173 WeakPolarHBondContact CA-OD1 3.32Å; N149-N173 WeakPolarHBondContact CB-OD1 3.27Å; N149-N173 PolarHBondContact O-OD1 3.37Å; N150-N173 PolarHBondContact N-OD1 3.39Å; I151-N173 HydrophobicContact CB-CB 4.27Å; I151-N173 WeakPolarHBondContact CB-OD1 3.4Å; I151-N173 VanDerWaalsContact CG1-OD1 3.3Å; I151-N173 WeakPolarHBondContact CG1-OD1 3.46Å; I151-N173 PolarHBondContact N-OD1 2.91Å; L170-N173 PolarHBondContact O-ND2 3.28Å; G171-N173 PolarHBondContact O-N 2.65Å; G171-N173 VanDerWaalsContact O-N 3.17Å; G171-N173 PolarHBondContact O-ND2 3.45Å; G171-N173 VanDerWaalsContact O-ND2 3.13Å; N173-G175 PolarHBondContact O-N 3.47Å; N173-G175 VanDerWaalsContact O-N 3.08Å; N173-L176 WeakPolarHBondContact O-CB 3.49Å; N173-L176 PolarHBondContact O-N 3.23Å; N173-C198 WeakPolarHBondContact O-CA 3.37Å
174	P	94.8	Very high	93.7	Very high	35 Å²	35	36.9 Å²	36.9	23%	0.227	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-11.9	-168.7	28.2	-37.4	0	0	0	114.5	D172 H177 R199	D172-P174 VanDerWaalsContact C-CD 3.46Å; D172-P174 WeakPolarHBondContact O-CD 3.35Å; P174-H177 PolarHBondContact O-CE1 2.97Å; P174-H177 PolarHBondContact O-NE2 3.19Å; P174-R199 HydrophobicContact CB-CG 4.23Å; P174-R199 WeakPolarHBondContact O-CD 3.33Å
175	G	93.6	Very high	93.5	Very high	17 Å²	17	43.4 Å²	43.4	18%	0.175	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-13.7	177.8	0	0	0	0	0	114.6	I151 N173 H177	I151-G175 CarbonylContact O-C 3.08Å; N173-G175 PolarHBondContact O-N 3.47Å; N173-G175 VanDerWaalsContact O-N 3.08Å; G175-H177 PolarHBondContact O-CD2 3.09Å; G175-H177 VanDerWaalsContact O-CD2 3.28Å
176	L	92.8	Very high	93.2	Very high	8 Å²	8	44.5 Å²	44.5	4%	0.042	22%	0.224	C	C	.	.			trans	-65.5	-51.7	-169.8	-176	55.8	0	0	0	111.6	I151 I154 N173 R178 L179 C198 L200	I151-L176 HydrophobicContact CG2-CD1 4.39Å; I151-L176 VanDerWaalsContact O-CA 3.3Å; I151-L176 WeakPolarHBondContact O-CA 3.37Å; I151-L176 WeakPolarHBondContact O-CB 3.17Å; I151-L176 PolarHBondContact O-N 3.08Å; I154-L176 HydrophobicContact CD1-CD1 3.96Å; I154-L176 HydrophobicContact CD1-CD2 4.22Å; I154-L176 HydrophobicContact CG1-CD1 3.96Å; N173-L176 WeakPolarHBondContact O-CB 3.49Å; N173-L176 PolarHBondContact O-N 3.23Å; L176-R178 PolarHBondContact O-N 3.21Å; L176-L179 HydrophobicContact CD1-CD2 4.34Å; L176-L179 HydrophobicContact CD2-CD2 4Å; L176-L179 HydrophobicContact CG-CD2 4.37Å; L176-C198 HydrophobicContact CB-CB 4.38Å; L176-C198 HydrophobicContact CD2-CB 4.29Å; L176-L200 HydrophobicContact CD2-CD2 4.49Å; L176-L200 HydrophobicContact CG-CD2 4.35Å
177	H	90.9	Very high	93	Very high	75 Å²	75	41 Å²	41	35%	0.347	21%	0.207	S	C	.	.			trans	59.1	-35.5	171.4	-70.8	-59.8	0	0	0	118.7	P174 G175 C198 R199 L200 T201	P174-H177 PolarHBondContact O-CE1 2.97Å; P174-H177 PolarHBondContact O-NE2 3.19Å; G175-H177 PolarHBondContact O-CD2 3.09Å; G175-H177 VanDerWaalsContact O-CD2 3.28Å; H177-C198 PolarHBondContact N-O 3.02Å; H177-R199 WeakPolarHBondContact ND1-CB 3.31Å; H177-R199 PolarHBondContact ND1-O 2.96Å; H177-L200 WeakPolarHBondContact O-CA 3.48Å; H177-T201 PolarHBondContact O-N 3.44Å
178	R	89.8	Confident	92.8	Very high	205 Å²	205	43.4 Å²	43.4	77%	0.774	22%	0.218	S	C	*	.			trans	-140.2	155.2	177.9	-52.1	-177.5	-156.7	156.8	7	108.4	L176	L176-R178 PolarHBondContact O-N 3.21Å
179	L	91.9	Very high	92.8	Very high	19 Å²	19	48 Å²	48	10%	0.099	24%	0.239	C	C	.	.			trans	-121	146.1	169.5	-73.5	162.6	0	0	0	108.2	I154 L176 F184 M195 L200 L203 P204 I207	I154-L179 HydrophobicContact CD1-CD2 4.14Å; L176-L179 HydrophobicContact CD1-CD2 4.34Å; L176-L179 HydrophobicContact CD2-CD2 4Å; L176-L179 HydrophobicContact CG-CD2 4.37Å; L179-F184 HydrophobicContact CD1-CE2 4.2Å; L179-F184 HydrophobicContact CD1-CZ 4.37Å; L179-F184 HydrophobicContact CD2-CZ 4.35Å; L179-M195 HydrophobicContact CD1-SD 3.57Å; L179-M195 VanDerWaalsContact CD1-SD 3.57Å; L179-L200 HydrophobicContact CD1-CD1 4.12Å; L179-L200 HydrophobicContact CD1-CD2 4.21Å; L179-L200 HydrophobicContact CG-CD2 4.15Å; L179-L203 HydrophobicContact CD1-CD2 4.49Å; L179-P204 HydrophobicContact CB-CG 4.38Å; L179-P204 VanDerWaalsContact O-CG 3.22Å; L179-P204 WeakPolarHBondContact O-CG 3.45Å; L179-I207 HydrophobicContact CB-CD1 4.12Å; L179-I207 HydrophobicContact CD1-CD1 4.38Å; L179-I207 HydrophobicContact CD1-CG1 4.37Å
180	E	88.4	Confident	92.7	Very high	86 Å²	86	47.3 Å²	47.3	40%	0.402	24%	0.235	S	C	.	.			trans	-78.5	151.4	170.1	-65.4	-177.1	-163.1	0	0	110.1	W153 A183	W153-E180 PolarHBondContact NE1-OE1 3.25Å; E180-A183 WeakPolarHBondContact O-CB 3.15Å; E180-A183 PolarHBondContact O-N 3.25Å
181	G	85.3	Confident	92.8	Very high	40 Å²	40	50.4 Å²	50.4	41%	0.412	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	140.1	176.2	0	0	0	0	0	111.1	A183 D206	G181-A183 VanDerWaalsContact C-N 3.25Å; G181-A183 PolarHBondContact O-N 3.22Å; G181-D206 VanDerWaalsContact C-OD2 3.29Å; G181-D206 VanDerWaalsContact CA-OD1 3.3Å; G181-D206 WeakPolarHBondContact CA-OD1 3.35Å; G181-D206 WeakPolarHBondContact CA-OD2 3.3Å
182	G	83.7	Confident	92.9	Very high	17 Å²	17	51 Å²	51	18%	0.175	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	16.9	-179.9	0	0	0	0	0	116.1	F184 R185 D206	G182-F184 PolarHBondContact O-N 3.24Å; G182-F184 VanDerWaalsContact O-N 3.11Å; G182-R185 WeakPolarHBondContact O-CB 3.49Å; G182-R185 PolarHBondContact O-N 3.03Å; G182-D206 PolarHBondContact N-OD2 3.05Å
183	A	88.5	Confident	92.9	Very high	3 Å²	3	48.3 Å²	48.3	3%	0.025	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-32.6	178.2	0	0	0	0	0	113.7	F159 E180 G181 I207	F159-A183 WeakPolarHBondContact CD2-O 3.49Å; E180-A183 WeakPolarHBondContact O-CB 3.15Å; E180-A183 PolarHBondContact O-N 3.25Å; G181-A183 VanDerWaalsContact C-N 3.25Å; G181-A183 PolarHBondContact O-N 3.22Å; A183-I207 HydrophobicContact CB-CD1 3.92Å
184	F	93	Very high	93	Very high	1 Å²	1	49.6 Å²	49.6	0%	0.004	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	12.6	178.5	-54	-54.8	0	0	0	114.1	F159 L168 L170 L179 G182 G186 L187 L193 M195 I207 L211	F159-F184 AromaticContact CD2-CD1 3.98Å; F159-F184 HydrophobicContact CD2-CD1 3.98Å; F159-F184 HydrophobicContact CD2-CE1 4.13Å; F159-F184 HydrophobicContact CE2-CD1 4.24Å; F159-F184 AromaticContact CE2-CE1 3.9Å; F159-F184 HydrophobicContact CE2-CE1 3.9Å; L168-F184 HydrophobicContact CD2-CD1 3.96Å; L168-F184 HydrophobicContact CD2-CE1 3.84Å; L170-F184 HydrophobicContact CD1-CE1 3.79Å; L170-F184 HydrophobicContact CD1-CZ 4.03Å; L179-F184 HydrophobicContact CD1-CE2 4.2Å; L179-F184 HydrophobicContact CD1-CZ 4.37Å; L179-F184 HydrophobicContact CD2-CZ 4.35Å; G182-F184 PolarHBondContact O-N 3.24Å; G182-F184 VanDerWaalsContact O-N 3.11Å; F184-G186 PolarHBondContact O-N 2.83Å; F184-L187 HydrophobicContact CB-CD1 3.99Å; F184-L187 HydrophobicContact CD1-CD1 3.99Å; F184-L187 HydrophobicContact CG-CD1 4.45Å; F184-L187 WeakPolarHBondContact O-CB 3.25Å; F184-L187 WeakPolarHBondContact O-CG 3.38Å; F184-L187 PolarHBondContact O-N 2.9Å; F184-L193 HydrophobicContact CD2-CD2 4.01Å; F184-L193 HydrophobicContact CE1-CD1 4.12Å; F184-L193 HydrophobicContact CE2-CD2 4.05Å; F184-L193 HydrophobicContact CG-CD2 4.35Å; F184-L193 HydrophobicContact CZ-CD1 4.22Å; F184-L193 HydrophobicContact CZ-CD2 4.41Å; F184-M195 HydrophobicContact CE2-CE 3.9Å; F184-M195 HydrophobicContact CE2-SD 3.51Å; F184-M195 VanDerWaalsContact CE2-SD 3.51Å; F184-M195 HydrophobicContact CZ-CE 4.32Å; F184-M195 HydrophobicContact CZ-CG 4.5Å; F184-M195 HydrophobicContact CZ-SD 3.4Å; F184-M195 WeakPolarHBondContact CZ-SD 3.32Å; F184-I207 HydrophobicContact CD2-CD1 3.63Å; F184-I207 HydrophobicContact CD2-CG1 3.77Å; F184-I207 WeakPolarHBondContact CD2-O 3.17Å; F184-I207 HydrophobicContact CE2-CD1 3.67Å; F184-I207 HydrophobicContact CE2-CG1 3.76Å; F184-L211 HydrophobicContact CB-CD1 4.25Å; F184-L211 HydrophobicContact CB-CD2 4.41Å
185	R	91.6	Very high	93	Very high	197 Å²	197	48 Å²	48	74%	0.743	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	131.5	-179.6	-179.6	178.3	177.7	173.1	-0.1	111	S160 G182	S160-R185 WeakPolarHBondContact CA-O 3.28Å; G182-R185 WeakPolarHBondContact O-CB 3.49Å; G182-R185 PolarHBondContact O-N 3.03Å
186	G	89.5	Confident	93.2	Very high	24 Å²	24	48.8 Å²	48.8	25%	0.247	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.4	-8.9	179.9	0	0	0	0	0	114.4	F184 E188	F184-G186 PolarHBondContact O-N 2.83Å; G186-E188 PolarHBondContact O-N 3.26Å
187	L	94.9	Very high	93.5	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	25%	0.252	C	S	.	.			trans	-81	49	177.3	-56.3	-174.8	0	0	0	112.2	F159 L162 L165 L168 F184 K189 L190 L211	F159-L187 HydrophobicContact CB-CD1 3.99Å; F159-L187 HydrophobicContact CB-CD2 4.05Å; F159-L187 HydrophobicContact CB-CG 4.29Å; F159-L187 WeakPolarHBondContact O-CD2 3.3Å; L162-L187 HydrophobicContact CB-CD2 3.87Å; L162-L187 VanDerWaalsContact O-CD2 3.24Å; L162-L187 WeakPolarHBondContact O-CD2 3.3Å; L165-L187 HydrophobicContact CB-CD2 4.09Å; L165-L187 HydrophobicContact CD2-CD1 4.16Å; L165-L187 HydrophobicContact CD2-CD2 3.91Å; L168-L187 HydrophobicContact CD2-CD1 4.08Å; F184-L187 HydrophobicContact CB-CD1 3.99Å; F184-L187 HydrophobicContact CD1-CD1 3.99Å; F184-L187 HydrophobicContact CG-CD1 4.45Å; F184-L187 WeakPolarHBondContact O-CB 3.25Å; F184-L187 WeakPolarHBondContact O-CG 3.38Å; F184-L187 PolarHBondContact O-N 2.9Å; L187-K189 PolarHBondContact O-N 3.35Å; L187-L190 HydrophobicContact CB-CB 4.03Å; L187-L190 HydrophobicContact CB-CD2 4.26Å; L187-L190 HydrophobicContact CD1-CD2 4.07Å; L187-L190 WeakPolarHBondContact O-CB 3.37Å; L187-L190 PolarHBondContact O-N 2.85Å; L187-L211 HydrophobicContact CB-CD2 3.92Å; L187-L211 WeakPolarHBondContact O-CD2 3.28Å
188	E	94.3	Very high	93.8	Very high	109 Å²	109	50.3 Å²	50.3	51%	0.509	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-26.1	-170.9	-64	-177.9	176.5	0	0	113.3	G186 S213	G186-E188 PolarHBondContact O-N 3.26Å; E188-S213 VanDerWaalsContact O-CB 3.31Å; E188-S213 WeakPolarHBondContact O-CB 3.46Å; E188-S213 PolarHBondContact O-OG 3.17Å
189	K	96.9	Very high	94.1	Very high	98 Å²	98	46.5 Å²	46.5	43%	0.426	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-1.9	176.9	-67.6	-172	-173.7	171.9	0	114.9	R163 D164 L165 L187 Q191	R163-K189 WeakPolarHBondContact O-CD 3.16Å; D164-K189 IonicContact OD1-NZ 2.76Å; D164-K189 PolarHBondContact OD1-NZ 3.09Å; L165-K189 CarbonylContact O-C 3.19Å; L187-K189 PolarHBondContact O-N 3.35Å; K189-Q191 WeakPolarHBondContact O-CG 3.5Å; K189-Q191 PolarHBondContact O-N 2.85Å
190	L	98.1	Very high	94.3	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.216	C	C	.	.			trans	-61.3	126.4	-174.6	-167.5	69.1	0	0	0	110.5	L165 L168 L187 L193 S213 L214	L165-L190 HydrophobicContact CD2-CD1 4.16Å; L165-L190 HydrophobicContact CG-CD1 4.09Å; L165-L190 VanDerWaalsContact O-CA 3.23Å; L165-L190 WeakPolarHBondContact O-CA 3.21Å; L165-L190 PolarHBondContact O-N 3.07Å; L165-L190 VanDerWaalsContact O-N 3.17Å; L168-L190 HydrophobicContact CB-CD1 3.87Å; L187-L190 HydrophobicContact CB-CB 4.03Å; L187-L190 HydrophobicContact CB-CD2 4.26Å; L187-L190 HydrophobicContact CD1-CD2 4.07Å; L187-L190 WeakPolarHBondContact O-CB 3.37Å; L187-L190 PolarHBondContact O-N 2.85Å; L190-L193 HydrophobicContact CD2-CB 3.95Å; L190-L193 HydrophobicContact CD2-CD1 4.29Å; L190-L193 HydrophobicContact CD2-CD2 4.21Å; L190-L193 HydrophobicContact CD2-CG 4.38Å; L190-S213 CarbonylContact O-C 3.54Å; L190-L214 HydrophobicContact CB-CD1 4.32Å; L190-L214 HydrophobicContact CD2-CD1 4.04Å; L190-L214 HydrophobicContact CG-CD1 3.9Å; L190-L214 WeakPolarHBondContact O-CA 3.41Å; L190-L214 PolarHBondContact O-N 3.26Å
191	Q	98.4	Very high	94.6	Very high	67 Å²	67	44.5 Å²	44.5	31%	0.313	22%	0.216	S	C	.	.			trans	-106.3	-36.5	-177.4	-53.2	-176.1	31.5	0	0	111.4	E166 K189 Q215 F216	E166-Q191 HydrophobicContact CB-CG 4.31Å; E166-Q191 WeakPolarHBondContact O-CA 3.49Å; E166-Q191 WeakPolarHBondContact O-CB 3.48Å; E166-Q191 PolarHBondContact O-N 3.03Å; K189-Q191 WeakPolarHBondContact O-CG 3.5Å; K189-Q191 PolarHBondContact O-N 2.85Å; Q191-Q215 WeakPolarHBondContact O-CA 3.43Å; Q191-Q215 PolarHBondContact O-N 3.26Å; Q191-F216 PolarHBondContact O-N 3.17Å
192	S	98.7	Very high	95.1	Very high	13 Å²	13	44.3 Å²	44.3	9%	0.091	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	127.7	177	-163.2	0	0	0	0	112	E166 L168 H194	E166-S192 PolarHBondContact O-N 3.01Å; L168-S192 PolarHBondContact N-O 3.17Å; S192-H194 PolarHBondContact OG-CD2 2.85Å; S192-H194 PolarHBondContact OG-NE2 3.48Å
193	L	98.4	Very high	95.6	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	117.4	177	178.5	54.7	0	0	0	110.3	L168 F184 L190 M195 F208 L211 L214 F216 L217 Y218	L168-L193 HydrophobicContact CB-CD1 4.15Å; L168-L193 HydrophobicContact CD2-CD1 4.01Å; L168-L193 HydrophobicContact CG-CD1 4.09Å; F184-L193 HydrophobicContact CD2-CD2 4.01Å; F184-L193 HydrophobicContact CE1-CD1 4.12Å; F184-L193 HydrophobicContact CE2-CD2 4.05Å; F184-L193 HydrophobicContact CG-CD2 4.35Å; F184-L193 HydrophobicContact CZ-CD1 4.22Å; F184-L193 HydrophobicContact CZ-CD2 4.41Å; L190-L193 HydrophobicContact CD2-CB 3.95Å; L190-L193 HydrophobicContact CD2-CD1 4.29Å; L190-L193 HydrophobicContact CD2-CD2 4.21Å; L190-L193 HydrophobicContact CD2-CG 4.38Å; L193-M195 HydrophobicContact CD1-CG 4.15Å; L193-M195 HydrophobicContact CD2-CE 3.8Å; L193-M195 HydrophobicContact CG-CE 4.04Å; L193-M195 HydrophobicContact CG-CG 4.32Å; L193-F208 HydrophobicContact CD2-CD1 4.31Å; L193-F208 HydrophobicContact CD2-CE1 3.93Å; L193-L211 HydrophobicContact CD2-CD1 4.36Å; L193-L214 HydrophobicContact CB-CD1 3.8Å; L193-L214 HydrophobicContact CB-CD2 4.46Å; L193-F216 PolarHBondContact N-O 3.09Å; L193-L217 HydrophobicContact CB-CD1 4.19Å; L193-L217 HydrophobicContact CD2-CD1 4.17Å; L193-L217 HydrophobicContact CG-CD1 4.17Å; L193-Y218 PolarHBondContact O-N 3.06Å
194	H	98.5	Very high	95.9	Very high	28 Å²	28	45.1 Å²	45.1	13%	0.13	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	120.4	-179.3	-50.4	-129.8	0	0	0	111	L168 D169 L170 G171 S192 Y218	L168-H194 PolarHBondContact O-N 3.08Å; D169-H194 HydrophobicContact CB-CB 4.12Å; D169-H194 WeakPolarHBondContact OD1-CB 3.5Å; D169-H194 IonicContact OD1-CG 3.74Å; D169-H194 IonicContact OD2-CG 2.79Å; D169-H194 IonicContact OD2-ND1 3.13Å; L170-H194 CarbonylContact C-O 3.33Å; L170-H194 WeakPolarHBondContact CA-O 3.39Å; L170-H194 WeakPolarHBondContact CB-O 3.2Å; L170-H194 PolarHBondContact N-O 3.38Å; G171-H194 PolarHBondContact N-O 2.69Å; S192-H194 PolarHBondContact OG-CD2 2.85Å; S192-H194 PolarHBondContact OG-NE2 3.48Å; H194-Y218 HydrophobicContact CB-CD2 4.3Å; H194-Y218 AromaticContact CD2-CD2 3.91Å; H194-Y218 AromaticContact CE1-CD2 3.59Å; H194-Y218 AromaticContact CE1-CE2 3.38Å; H194-Y218 WeakPolarHBondContact CE1-CE2 3.4Å; H194-Y218 AromaticContact CG-CD2 3.57Å; H194-Y218 AromaticContact ND1-CD2 3.38Å; H194-Y218 WeakPolarHBondContact ND1-CD2 3.23Å; H194-Y218 AromaticContact ND1-CE2 3.68Å; H194-Y218 AromaticContact ND1-CG 3.97Å; H194-Y218 AromaticContact NE2-CD2 3.89Å; H194-Y218 AromaticContact NE2-CE2 3.7Å
195	M	96.7	Very high	95.9	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.242	C	C	.	.			trans	-137.2	31	177.5	-64	-171.7	-73.7	0	0	111.2	L179 F184 L193 L200 F208 L217 Y218 L219 N222	L179-M195 HydrophobicContact CD1-SD 3.57Å; L179-M195 VanDerWaalsContact CD1-SD 3.57Å; F184-M195 HydrophobicContact CE2-CE 3.9Å; F184-M195 HydrophobicContact CE2-SD 3.51Å; F184-M195 VanDerWaalsContact CE2-SD 3.51Å; F184-M195 HydrophobicContact CZ-CE 4.32Å; F184-M195 HydrophobicContact CZ-CG 4.5Å; F184-M195 HydrophobicContact CZ-SD 3.4Å; F184-M195 WeakPolarHBondContact CZ-SD 3.32Å; L193-M195 HydrophobicContact CD1-CG 4.15Å; L193-M195 HydrophobicContact CD2-CE 3.8Å; L193-M195 HydrophobicContact CG-CE 4.04Å; L193-M195 HydrophobicContact CG-CG 4.32Å; M195-L200 HydrophobicContact CB-CD1 4.27Å; M195-F208 HydrophobicContact CE-CE1 3.63Å; M195-F208 HydrophobicContact CE-CZ 3.82Å; M195-L217 HydrophobicContact CE-CD1 4.23Å; M195-Y218 CarbonylContact C-O 3.58Å; M195-Y218 WeakPolarHBondContact CA-O 3.42Å; M195-Y218 PolarHBondContact N-O 2.94Å; M195-L219 HydrophobicContact CB-CD2 4.29Å; M195-L219 HydrophobicContact CE-CD2 3.83Å; M195-N222 PolarHBondContact O-ND2 2.93Å
196	H	97.8	Very high	95.9	Very high	34 Å²	34	44.7 Å²	44.7	16%	0.157	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	148.4	-179.5	64.2	-83.5	0	0	0	111	D169 G171 D172 C198 Y218 Q220	D169-H196 IonicContact OD1-CE1 2.76Å; G171-H196 CarbonylContact C-O 3.56Å; G171-H196 VanDerWaalsContact CA-O 3.31Å; G171-H196 WeakPolarHBondContact CA-O 3.49Å; D172-H196 PolarHBondContact N-O 3.24Å; H196-C198 PolarHBondContact O-N 3.37Å; H196-C198 VanDerWaalsContact O-N 3.09Å; H196-C198 PolarHBondContact O-SG 2.92Å; H196-C198 VanDerWaalsContact O-SG 3.38Å; H196-Y218 PolarHBondContact N-O 2.79Å; H196-Q220 VanDerWaalsContact CA-O 3.25Å; H196-Q220 WeakPolarHBondContact CA-O 3.41Å; H196-Q220 VanDerWaalsContact CB-CD 3.48Å; H196-Q220 HydrophobicContact CB-CG 3.92Å; H196-Q220 WeakPolarHBondContact CB-O 3.37Å
197	R	97.3	Very high	96.1	Very high	115 Å²	115	43.6 Å²	43.6	43%	0.434	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	11.1	179.3	-60.5	176.2	178.9	176.3	6	116.5	R199 Q220 E221	R197-R199 PolarHBondContact O-N 3.04Å; R197-Q220 PolarHBondContact N-O 2.98Å; R197-Q220 VanDerWaalsContact N-O 3.08Å; R197-E221 WeakPolarHBondContact CA-O 3.11Å; R197-E221 HydrophobicContact CG-CB 3.73Å; R197-E221 HydrophobicContact CG-CG 4.48Å; R197-E221 IonicContact CZ-OE1 3.64Å; R197-E221 IonicContact CZ-OE2 2.65Å; R197-E221 IonicContact NE-OE1 3.89Å; R197-E221 PolarHBondContact NE-OE1 3.11Å; R197-E221 VanDerWaalsContact NE-OE1 3.17Å; R197-E221 IonicContact NE-OE2 3.75Å; R197-E221 PolarHBondContact NE-OE2 3.32Å; R197-E221 IonicContact NH2-OE1 3.92Å; R197-E221 PolarHBondContact NH2-OE1 2.69Å; R197-E221 IonicContact NH2-OE2 3.92Å; R197-E221 PolarHBondContact NH2-OE2 3.17Å
198	C	97.1	Very high	96.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.209	C	C	.	.	S	Bend	trans	-79.4	7.4	179.7	-60.4	0	0	0	0	114.8	L170 N173 L176 H177 H196 L200 N222	L170-C198 PolarHBondContact O-SG 2.83Å; N173-C198 WeakPolarHBondContact O-CA 3.37Å; L176-C198 HydrophobicContact CB-CB 4.38Å; L176-C198 HydrophobicContact CD2-CB 4.29Å; H177-C198 PolarHBondContact N-O 3.02Å; H196-C198 PolarHBondContact O-N 3.37Å; H196-C198 VanDerWaalsContact O-N 3.09Å; H196-C198 PolarHBondContact O-SG 2.92Å; H196-C198 VanDerWaalsContact O-SG 3.38Å; C198-L200 HydrophobicContact CB-CD1 4.35Å; C198-L200 HydrophobicContact CB-CD2 4.38Å; C198-L200 HydrophobicContact CB-CG 3.95Å; C198-L200 PolarHBondContact O-N 2.64Å; C198-L200 VanDerWaalsContact O-N 3.09Å; C198-N222 PolarHBondContact N-OD1 3.03Å; C198-N222 VanDerWaalsContact N-OD1 3.17Å
199	R	96.7	Very high	96.1	Very high	126 Å²	126	43.5 Å²	43.5	48%	0.475	21%	0.207	S	C	.	.			trans	53.5	26	-179.1	-59.8	-172.5	-177.7	161.8	-4.8	114.6	P174 H177 R197 T201 N222 N223	P174-R199 HydrophobicContact CB-CG 4.23Å; P174-R199 WeakPolarHBondContact O-CD 3.33Å; H177-R199 WeakPolarHBondContact ND1-CB 3.31Å; H177-R199 PolarHBondContact ND1-O 2.96Å; R197-R199 PolarHBondContact O-N 3.04Å; R199-T201 PolarHBondContact O-N 3.17Å; R199-N222 PolarHBondContact N-OD1 3.02Å; R199-N223 PolarHBondContact O-ND2 2.91Å
200	L	96.4	Very high	96	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.206	C	C	.	.			trans	-59	130.8	-178.9	-61.1	172.8	0	0	0	110.8	L176 H177 L179 M195 C198 L203 N222 N223 L224	L176-L200 HydrophobicContact CD2-CD2 4.49Å; L176-L200 HydrophobicContact CG-CD2 4.35Å; H177-L200 WeakPolarHBondContact O-CA 3.48Å; L179-L200 HydrophobicContact CD1-CD1 4.12Å; L179-L200 HydrophobicContact CD1-CD2 4.21Å; L179-L200 HydrophobicContact CG-CD2 4.15Å; M195-L200 HydrophobicContact CB-CD1 4.27Å; C198-L200 HydrophobicContact CB-CD1 4.35Å; C198-L200 HydrophobicContact CB-CD2 4.38Å; C198-L200 HydrophobicContact CB-CG 3.95Å; C198-L200 PolarHBondContact O-N 2.64Å; C198-L200 VanDerWaalsContact O-N 3.09Å; L200-L203 HydrophobicContact CD1-CD2 4.07Å; L200-N222 HydrophobicContact CB-CB 4.26Å; L200-N222 PolarHBondContact N-OD1 3.26Å; L200-N223 CarbonylContact O-C 3.47Å; L200-N223 VanDerWaalsContact O-CA 3.24Å; L200-N223 WeakPolarHBondContact O-CA 3.31Å; L200-N223 WeakPolarHBondContact O-CB 3.46Å; L200-N223 PolarHBondContact O-N 2.57Å; L200-L224 HydrophobicContact CB-CD2 4.06Å; L200-L224 PolarHBondContact O-N 3.42Å
201	T	95.4	Very high	95.9	Very high	63 Å²	63	43.3 Å²	43.3	39%	0.387	21%	0.206	S	C	.	.			trans	-96	-29	-179.6	54.7	0	0	0	0	113.5	H177 R199 N223	H177-T201 PolarHBondContact O-N 3.44Å; R199-T201 PolarHBondContact O-N 3.17Å; T201-N223 HydrophobicContact CG2-CB 4.23Å
202	A	94.8	Very high	95.7	Very high	36 Å²	36	44.6 Å²	44.6	30%	0.298	21%	0.209	S	C	.	.			trans	-150.9	162.8	176.7	0	0	0	0	0	109.5
203	L	95.6	Very high	95.7	Very high	11 Å²	11	46.1 Å²	46.1	6%	0.058	22%	0.219	C	C	.	.			trans	-117.1	135.4	174.5	-65.3	172.4	0	0	0	108.8	L179 L200 I207 F208 L219 L224 L227 Q228 I231	L179-L203 HydrophobicContact CD1-CD2 4.49Å; L200-L203 HydrophobicContact CD1-CD2 4.07Å; L203-I207 HydrophobicContact CB-CG2 4.35Å; L203-F208 HydrophobicContact CD1-CE2 4.05Å; L203-F208 HydrophobicContact CD1-CZ 4.29Å; L203-L219 HydrophobicContact CD1-CD1 3.95Å; L203-L219 HydrophobicContact CD1-CD2 4.15Å; L203-L219 HydrophobicContact CD2-CD2 4.18Å; L203-L224 HydrophobicContact CD1-CD1 4.01Å; L203-L224 HydrophobicContact CD1-CD2 4.39Å; L203-L224 HydrophobicContact CD2-CD2 4.38Å; L203-L224 HydrophobicContact CG-CD1 4.38Å; L203-L224 HydrophobicContact CG-CD2 3.87Å; L203-L227 HydrophobicContact CD1-CD2 4.37Å; L203-Q228 PolarHBondContact O-NE2 3.04Å; L203-I231 HydrophobicContact CB-CD1 3.69Å; L203-I231 HydrophobicContact CD1-CD1 4.11Å
204	P	94.1	Very high	95.7	Very high	25 Å²	25	46.1 Å²	46.1	16%	0.162	22%	0.219	C	C	.	.			trans	-57.7	151.9	169.3	-21.2	32.1	0	0	0	111.5	L179 D206 I207	L179-P204 HydrophobicContact CB-CG 4.38Å; L179-P204 VanDerWaalsContact O-CG 3.22Å; L179-P204 WeakPolarHBondContact O-CG 3.45Å; P204-D206 VanDerWaalsContact C-N 3.29Å; P204-D206 WeakPolarHBondContact CB-OD1 3.4Å; P204-D206 PolarHBondContact O-N 3.03Å; P204-I207 HydrophobicContact CB-CB 4.14Å; P204-I207 HydrophobicContact CG-CB 4.34Å; P204-I207 HydrophobicContact CG-CD1 4.44Å; P204-I207 WeakPolarHBondContact O-CG2 3.46Å
205	H	92.1	Very high	95.7	Very high	139 Å²	139	48 Å²	48	64%	0.644	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-30.8	-176.7	68.7	-75.5	0	0	0	112.9
206	D	91.3	Very high	95.8	Very high	50 Å²	50	50.8 Å²	50.8	27%	0.267	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	2.3	-175	64.6	-37.4	0	0	0	113.6	G181 G182 P204 F208 H209	G181-D206 VanDerWaalsContact C-OD2 3.29Å; G181-D206 VanDerWaalsContact CA-OD1 3.3Å; G181-D206 WeakPolarHBondContact CA-OD1 3.35Å; G181-D206 WeakPolarHBondContact CA-OD2 3.3Å; G182-D206 PolarHBondContact N-OD2 3.05Å; P204-D206 VanDerWaalsContact C-N 3.29Å; P204-D206 WeakPolarHBondContact CB-OD1 3.4Å; P204-D206 PolarHBondContact O-N 3.03Å; D206-F208 PolarHBondContact O-N 2.87Å; D206-F208 VanDerWaalsContact O-N 3.16Å; D206-H209 VanDerWaalsContact O-CB 3.3Å; D206-H209 WeakPolarHBondContact O-CB 3.5Å; D206-H209 PolarHBondContact O-N 2.89Å; D206-H209 VanDerWaalsContact O-N 3.11Å
207	I	94.3	Very high	95.8	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.01	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-28.8	-169.5	-165.3	57.4	0	0	0	113.7	L179 A183 F184 L203 P204	L179-I207 HydrophobicContact CB-CD1 4.12Å; L179-I207 HydrophobicContact CD1-CD1 4.38Å; L179-I207 HydrophobicContact CD1-CG1 4.37Å; A183-I207 HydrophobicContact CB-CD1 3.92Å; F184-I207 HydrophobicContact CD2-CD1 3.63Å; F184-I207 HydrophobicContact CD2-CG1 3.77Å; F184-I207 WeakPolarHBondContact CD2-O 3.17Å; F184-I207 HydrophobicContact CE2-CD1 3.67Å; F184-I207 HydrophobicContact CE2-CG1 3.76Å; L203-I207 HydrophobicContact CB-CG2 4.35Å; P204-I207 HydrophobicContact CB-CB 4.14Å; P204-I207 HydrophobicContact CG-CB 4.34Å; P204-I207 HydrophobicContact CG-CD1 4.44Å; P204-I207 WeakPolarHBondContact O-CG2 3.46Å
208	F	95.4	Very high	95.9	Very high	4 Å²	4	45.9 Å²	45.9	2%	0.018	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108	10.1	-180	-57.6	-53.5	0	0	0	113.7	L193 M195 L203 D206 K210 L211 L217 L219 I231 F232 L235	L193-F208 HydrophobicContact CD2-CD1 4.31Å; L193-F208 HydrophobicContact CD2-CE1 3.93Å; M195-F208 HydrophobicContact CE-CE1 3.63Å; M195-F208 HydrophobicContact CE-CZ 3.82Å; L203-F208 HydrophobicContact CD1-CE2 4.05Å; L203-F208 HydrophobicContact CD1-CZ 4.29Å; D206-F208 PolarHBondContact O-N 2.87Å; D206-F208 VanDerWaalsContact O-N 3.16Å; F208-K210 PolarHBondContact O-N 3.2Å; F208-L211 HydrophobicContact CB-CD1 4.3Å; F208-L211 HydrophobicContact CD1-CD1 3.94Å; F208-L211 PolarHBondContact O-N 3.47Å; F208-L217 HydrophobicContact CD1-CD2 4.45Å; F208-L217 HydrophobicContact CE1-CD1 3.83Å; F208-L217 HydrophobicContact CE1-CD2 3.97Å; F208-L217 HydrophobicContact CE2-CD2 4.1Å; F208-L217 HydrophobicContact CZ-CD1 4.06Å; F208-L217 HydrophobicContact CZ-CD2 3.8Å; F208-L219 HydrophobicContact CE2-CD1 4.42Å; F208-L219 HydrophobicContact CZ-CD1 4.08Å; F208-I231 HydrophobicContact CD2-CG1 4.09Å; F208-I231 WeakPolarHBondContact CD2-O 3.3Å; F208-I231 HydrophobicContact CE2-CG1 4.37Å; F208-F232 AromaticContact CD2-CD1 3.84Å; F208-F232 HydrophobicContact CD2-CD1 3.84Å; F208-F232 AromaticContact CD2-CE1 3.91Å; F208-F232 HydrophobicContact CD2-CE1 3.91Å; F208-F232 HydrophobicContact CE2-CD1 4.04Å; F208-F232 AromaticContact CE2-CE1 3.61Å; F208-F232 HydrophobicContact CE2-CE1 3.61Å; F208-L235 HydrophobicContact CB-CD1 4.26Å; F208-L235 HydrophobicContact CB-CD2 4.13Å; F208-L235 HydrophobicContact CB-CG 4.36Å; F208-L235 HydrophobicContact CG-CD1 4.34Å
209	H	93.9	Very high	95.9	Very high	103 Å²	103	45.9 Å²	45.9	48%	0.477	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	131.2	-177	-175.1	45.7	0	0	0	111.2	D206 L211 D234	D206-H209 VanDerWaalsContact O-CB 3.3Å; D206-H209 WeakPolarHBondContact O-CB 3.5Å; D206-H209 PolarHBondContact O-N 2.89Å; D206-H209 VanDerWaalsContact O-N 3.11Å; H209-L211 VanDerWaalsContact C-N 3.29Å; H209-L211 PolarHBondContact O-N 2.96Å; H209-D234 WeakPolarHBondContact CA-OD2 3.45Å; H209-D234 IonicContact CE1-OD2 3.41Å; H209-D234 IonicContact CG-OD2 2.74Å; H209-D234 IonicContact ND1-OD2 3.25Å; H209-D234 PolarHBondContact ND1-OD2 3.09Å
210	K	94.1	Very high	96	Very high	92 Å²	92	41 Å²	41	40%	0.4	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.1	15.6	-178.1	-46.7	-164.8	175.4	-171.2	0	117.5	F208 Y212 D234	F208-K210 PolarHBondContact O-N 3.2Å; K210-Y212 HydrophobicContact CB-CD2 4.25Å; K210-Y212 HydrophobicContact CB-CE2 3.64Å; K210-Y212 HydrophobicContact CD-CE2 4.47Å; K210-Y212 HydrophobicContact CG-CE2 4.07Å; K210-Y212 WeakPolarHBondContact O-CD2 3.3Å; K210-Y212 PolarHBondContact O-N 2.96Å; K210-D234 PolarHBondContact N-OD2 2.98Å
211	L	96	Very high	96.1	Very high	2 Å²	2	45 Å²	45	1%	0.01	22%	0.222	C	C	.	.			trans	-79.5	54.3	173.5	-57.5	-175.8	0	0	0	111.6	F184 L187 L193 F208 H209 S213 L214 L235	F184-L211 HydrophobicContact CB-CD1 4.25Å; F184-L211 HydrophobicContact CB-CD2 4.41Å; L187-L211 HydrophobicContact CB-CD2 3.92Å; L187-L211 WeakPolarHBondContact O-CD2 3.28Å; L193-L211 HydrophobicContact CD2-CD1 4.36Å; F208-L211 HydrophobicContact CB-CD1 4.3Å; F208-L211 HydrophobicContact CD1-CD1 3.94Å; F208-L211 PolarHBondContact O-N 3.47Å; H209-L211 VanDerWaalsContact C-N 3.29Å; H209-L211 PolarHBondContact O-N 2.96Å; L211-S213 VanDerWaalsContact C-N 3.27Å; L211-S213 PolarHBondContact O-N 3.37Å; L211-L214 HydrophobicContact CB-CB 4.24Å; L211-L214 HydrophobicContact CD1-CD2 4.41Å; L211-L214 VanDerWaalsContact O-CB 3.29Å; L211-L214 WeakPolarHBondContact O-CB 3.11Å; L211-L214 PolarHBondContact O-N 2.93Å; L211-L214 VanDerWaalsContact O-N 3.11Å; L211-L235 HydrophobicContact CB-CD2 3.73Å; L211-L235 WeakPolarHBondContact O-CD2 3.17Å
212	Y	95.6	Very high	96.2	Very high	93 Å²	93	42.1 Å²	42.1	37%	0.365	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-27.7	-170.1	-55.7	-61.2	0	0	0	113.8	K210 D234 N237	K210-Y212 HydrophobicContact CB-CD2 4.25Å; K210-Y212 HydrophobicContact CB-CE2 3.64Å; K210-Y212 HydrophobicContact CD-CE2 4.47Å; K210-Y212 HydrophobicContact CG-CE2 4.07Å; K210-Y212 WeakPolarHBondContact O-CD2 3.3Å; K210-Y212 PolarHBondContact O-N 2.96Å; Y212-D234 HydrophobicContact CD1-CB 4.11Å; Y212-D234 WeakPolarHBondContact CD1-O 3.39Å; Y212-D234 HydrophobicContact CE1-CB 3.81Å; Y212-N237 WeakPolarHBondContact O-CB 3.39Å; Y212-N237 PolarHBondContact O-ND2 3.35Å
213	S	97.6	Very high	96.4	Very high	45 Å²	45	41.9 Å²	41.9	32%	0.315	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-3.5	178.1	-73.1	0	0	0	0	114.8	E188 L190 L211 Q215	E188-S213 VanDerWaalsContact O-CB 3.31Å; E188-S213 WeakPolarHBondContact O-CB 3.46Å; E188-S213 PolarHBondContact O-OG 3.17Å; L190-S213 CarbonylContact O-C 3.54Å; L211-S213 VanDerWaalsContact C-N 3.27Å; L211-S213 PolarHBondContact O-N 3.37Å; S213-Q215 PolarHBondContact O-N 3.35Å
214	L	98.4	Very high	96.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.196	C	C	.	.			trans	-68.9	125.7	-171.8	-161.7	72.9	0	0	0	111.2	L190 L193 L211 L217 L235 N237 L238	L190-L214 HydrophobicContact CB-CD1 4.32Å; L190-L214 HydrophobicContact CD2-CD1 4.04Å; L190-L214 HydrophobicContact CG-CD1 3.9Å; L190-L214 WeakPolarHBondContact O-CA 3.41Å; L190-L214 PolarHBondContact O-N 3.26Å; L193-L214 HydrophobicContact CB-CD1 3.8Å; L193-L214 HydrophobicContact CB-CD2 4.46Å; L211-L214 HydrophobicContact CB-CB 4.24Å; L211-L214 HydrophobicContact CD1-CD2 4.41Å; L211-L214 VanDerWaalsContact O-CB 3.29Å; L211-L214 WeakPolarHBondContact O-CB 3.11Å; L211-L214 PolarHBondContact O-N 2.93Å; L211-L214 VanDerWaalsContact O-N 3.11Å; L214-L217 HydrophobicContact CD2-CB 4.19Å; L214-L217 HydrophobicContact CD2-CD1 4.43Å; L214-L217 HydrophobicContact CD2-CD2 4.41Å; L214-L235 HydrophobicContact CB-CD2 4.12Å; L214-L235 HydrophobicContact CD2-CD1 4.21Å; L214-L235 HydrophobicContact CD2-CD2 3.95Å; L214-N237 CarbonylContact O-C 3.53Å; L214-L238 HydrophobicContact CB-CD1 4.5Å; L214-L238 HydrophobicContact CD2-CD1 4.15Å; L214-L238 HydrophobicContact CG-CD1 4.1Å; L214-L238 WeakPolarHBondContact O-CA 3.11Å; L214-L238 PolarHBondContact O-N 3.21Å
215	Q	98.5	Very high	96.5	Very high	69 Å²	69	43.5 Å²	43.5	32%	0.322	20%	0.203	S	C	.	.			trans	-110.8	-33.5	-178.2	-71.4	168	61.6	0	0	112.1	Q191 S213 S239 Q240	Q191-Q215 WeakPolarHBondContact O-CA 3.43Å; Q191-Q215 PolarHBondContact O-N 3.26Å; S213-Q215 PolarHBondContact O-N 3.35Å; Q215-S239 PolarHBondContact O-N 2.99Å; Q215-Q240 PolarHBondContact O-N 3Å
216	F	98.8	Very high	96.7	Very high	57 Å²	57	42.1 Å²	42.1	25%	0.25	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	124.5	-176.9	-51.3	-89.7	0	0	0	110.8	Q191 L193 Y218 Q240	Q191-F216 PolarHBondContact O-N 3.17Å; L193-F216 PolarHBondContact N-O 3.09Å; F216-Y218 HydrophobicContact CB-CD2 4.47Å; F216-Y218 HydrophobicContact CB-CE2 3.69Å; F216-Q240 HydrophobicContact CD1-CB 4.04Å; F216-Q240 HydrophobicContact CD1-CG 4.06Å; F216-Q240 HydrophobicContact CE1-CG 4.1Å
217	L	98.8	Very high	97	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	112.7	177.5	179.7	54.3	0	0	0	110.8	L193 M195 F208 L214 L219 F232 L235 L238 Q240 L241 F242	L193-L217 HydrophobicContact CB-CD1 4.19Å; L193-L217 HydrophobicContact CD2-CD1 4.17Å; L193-L217 HydrophobicContact CG-CD1 4.17Å; M195-L217 HydrophobicContact CE-CD1 4.23Å; F208-L217 HydrophobicContact CD1-CD2 4.45Å; F208-L217 HydrophobicContact CE1-CD1 3.83Å; F208-L217 HydrophobicContact CE1-CD2 3.97Å; F208-L217 HydrophobicContact CE2-CD2 4.1Å; F208-L217 HydrophobicContact CZ-CD1 4.06Å; F208-L217 HydrophobicContact CZ-CD2 3.8Å; L214-L217 HydrophobicContact CD2-CB 4.19Å; L214-L217 HydrophobicContact CD2-CD1 4.43Å; L214-L217 HydrophobicContact CD2-CD2 4.41Å; L217-L219 HydrophobicContact CD1-CD1 4.27Å; L217-L219 HydrophobicContact CD1-CG 4.11Å; L217-L219 HydrophobicContact CD2-CD1 3.95Å; L217-L219 HydrophobicContact CG-CD1 3.95Å; L217-L219 HydrophobicContact CG-CG 4.13Å; L217-F232 HydrophobicContact CD2-CD1 4.18Å; L217-F232 HydrophobicContact CD2-CE1 3.84Å; L217-L235 HydrophobicContact CD2-CD1 3.95Å; L217-L238 HydrophobicContact CB-CD1 3.8Å; L217-L238 HydrophobicContact CB-CD2 4.45Å; L217-Q240 PolarHBondContact N-O 3.43Å; L217-L241 HydrophobicContact CB-CD1 4.09Å; L217-L241 HydrophobicContact CD2-CD1 3.93Å; L217-L241 HydrophobicContact CG-CD1 3.99Å; L217-F242 PolarHBondContact O-N 3.3Å
218	Y	98.7	Very high	97	Very high	47 Å²	47	43.6 Å²	43.6	18%	0.184	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	102.4	-178.1	-57.3	-88.4	0	0	0	111.2	L193 H194 M195 H196 F216 Q220 F242	L193-Y218 PolarHBondContact O-N 3.06Å; H194-Y218 HydrophobicContact CB-CD2 4.3Å; H194-Y218 AromaticContact CD2-CD2 3.91Å; H194-Y218 AromaticContact CE1-CD2 3.59Å; H194-Y218 AromaticContact CE1-CE2 3.38Å; H194-Y218 WeakPolarHBondContact CE1-CE2 3.4Å; H194-Y218 AromaticContact CG-CD2 3.57Å; H194-Y218 AromaticContact ND1-CD2 3.38Å; H194-Y218 WeakPolarHBondContact ND1-CD2 3.23Å; H194-Y218 AromaticContact ND1-CE2 3.68Å; H194-Y218 AromaticContact ND1-CG 3.97Å; H194-Y218 AromaticContact NE2-CD2 3.89Å; H194-Y218 AromaticContact NE2-CE2 3.7Å; M195-Y218 CarbonylContact C-O 3.58Å; M195-Y218 WeakPolarHBondContact CA-O 3.42Å; M195-Y218 PolarHBondContact N-O 2.94Å; H196-Y218 PolarHBondContact N-O 2.79Å; F216-Y218 HydrophobicContact CB-CD2 4.47Å; F216-Y218 HydrophobicContact CB-CE2 3.69Å; Y218-Q220 VanDerWaalsContact CB-OE1 3.3Å; Y218-F242 HydrophobicContact CD1-CB 4.22Å; Y218-F242 AromaticContact CD1-CD2 3.35Å; Y218-F242 HydrophobicContact CD1-CD2 3.35Å; Y218-F242 AromaticContact CD1-CE2 3.76Å; Y218-F242 HydrophobicContact CD1-CE2 3.76Å; Y218-F242 AromaticContact CD1-CG 3.8Å; Y218-F242 HydrophobicContact CD1-CG 3.8Å; Y218-F242 HydrophobicContact CD1-CZ 4.5Å; Y218-F242 AromaticContact CE1-CD2 3.4Å; Y218-F242 HydrophobicContact CE1-CD2 3.4Å; Y218-F242 VanDerWaalsContact CE1-CD2 3.4Å; Y218-F242 HydrophobicContact CE1-CE1 4.46Å; Y218-F242 AromaticContact CE1-CE2 3.24Å; Y218-F242 HydrophobicContact CE1-CE2 3.24Å; Y218-F242 HydrophobicContact CE1-CG 4.1Å; Y218-F242 AromaticContact CE1-CZ 3.84Å; Y218-F242 HydrophobicContact CE1-CZ 3.84Å; Y218-F242 HydrophobicContact CG-CD2 4.17Å; Y218-F242 AromaticContact CZ-CE2 3.87Å
219	L	98.3	Very high	97.1	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.218	C	C	.	.			trans	-116.7	9.7	179.5	-75.8	167.5	0	0	0	112.6	M195 L203 F208 L217 N222 L224 F232 F242 L243 N246	M195-L219 HydrophobicContact CB-CD2 4.29Å; M195-L219 HydrophobicContact CE-CD2 3.83Å; L203-L219 HydrophobicContact CD1-CD1 3.95Å; L203-L219 HydrophobicContact CD1-CD2 4.15Å; L203-L219 HydrophobicContact CD2-CD2 4.18Å; F208-L219 HydrophobicContact CE2-CD1 4.42Å; F208-L219 HydrophobicContact CZ-CD1 4.08Å; L217-L219 HydrophobicContact CD1-CD1 4.27Å; L217-L219 HydrophobicContact CD1-CG 4.11Å; L217-L219 HydrophobicContact CD2-CD1 3.95Å; L217-L219 HydrophobicContact CG-CD1 3.95Å; L217-L219 HydrophobicContact CG-CG 4.13Å; L219-N222 PolarHBondContact O-ND2 3Å; L219-L224 HydrophobicContact CB-CD1 4.49Å; L219-F232 HydrophobicContact CD1-CE1 4.32Å; L219-F232 HydrophobicContact CD1-CZ 4.45Å; L219-F242 CarbonylContact C-O 3.48Å; L219-F242 WeakPolarHBondContact CA-O 3.34Å; L219-F242 WeakPolarHBondContact CB-O 3.33Å; L219-F242 PolarHBondContact N-O 2.96Å; L219-L243 HydrophobicContact CB-CD2 3.84Å; L219-L243 HydrophobicContact CD1-CD2 3.86Å; L219-N246 PolarHBondContact O-ND2 2.84Å
220	Q	98.4	Very high	97.2	Very high	22 Å²	22	45 Å²	45	10%	0.103	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	158.3	-176.2	71.6	-83.4	8.8	0	0	114	H196 R197 Y218 N222 F242 H244	H196-Q220 VanDerWaalsContact CA-O 3.25Å; H196-Q220 WeakPolarHBondContact CA-O 3.41Å; H196-Q220 VanDerWaalsContact CB-CD 3.48Å; H196-Q220 HydrophobicContact CB-CG 3.92Å; H196-Q220 WeakPolarHBondContact CB-O 3.37Å; R197-Q220 PolarHBondContact N-O 2.98Å; R197-Q220 VanDerWaalsContact N-O 3.08Å; Y218-Q220 VanDerWaalsContact CB-OE1 3.3Å; Q220-N222 PolarHBondContact O-N 3.18Å; Q220-N222 PolarHBondContact O-ND2 3.02Å; Q220-F242 HydrophobicContact CB-CB 4.48Å; Q220-F242 PolarHBondContact N-O 3.27Å; Q220-F242 VanDerWaalsContact N-O 3.17Å; Q220-F242 VanDerWaalsContact OE1-CB 3.26Å; Q220-H244 CarbonylContact C-O 3.51Å; Q220-H244 WeakPolarHBondContact CA-O 3.49Å; Q220-H244 WeakPolarHBondContact CB-CE1 3.4Å; Q220-H244 VanDerWaalsContact CB-O 3.3Å; Q220-H244 WeakPolarHBondContact CB-O 3.45Å
221	E	98	Very high	97.3	Very high	84 Å²	84	41 Å²	41	39%	0.393	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	33.3	177.2	-58.3	-178.5	-128.1	0	0	113.7	R197 H244 G245	R197-E221 WeakPolarHBondContact CA-O 3.11Å; R197-E221 HydrophobicContact CG-CB 3.73Å; R197-E221 HydrophobicContact CG-CG 4.48Å; R197-E221 IonicContact CZ-OE1 3.64Å; R197-E221 IonicContact CZ-OE2 2.65Å; R197-E221 IonicContact NE-OE1 3.89Å; R197-E221 PolarHBondContact NE-OE1 3.11Å; R197-E221 VanDerWaalsContact NE-OE1 3.17Å; R197-E221 IonicContact NE-OE2 3.75Å; R197-E221 PolarHBondContact NE-OE2 3.32Å; R197-E221 IonicContact NH2-OE1 3.92Å; R197-E221 PolarHBondContact NH2-OE1 2.69Å; R197-E221 IonicContact NH2-OE2 3.92Å; R197-E221 PolarHBondContact NH2-OE2 3.17Å; E221-H244 PolarHBondContact N-O 3.24Å; E221-G245 WeakPolarHBondContact CA-O 3.38Å
222	N	98.3	Very high	97.4	Very high	3 Å²	3	40.9 Å²	40.9	2%	0.016	20%	0.195	C	C	.	.	S	Bend	trans	-99.4	-174	170.8	-80.2	-64.8	0	0	0	111.1	M195 C198 R199 L200 L219 Q220 L224 N246	M195-N222 PolarHBondContact O-ND2 2.93Å; C198-N222 PolarHBondContact N-OD1 3.03Å; C198-N222 VanDerWaalsContact N-OD1 3.17Å; R199-N222 PolarHBondContact N-OD1 3.02Å; L200-N222 HydrophobicContact CB-CB 4.26Å; L200-N222 PolarHBondContact N-OD1 3.26Å; L219-N222 PolarHBondContact O-ND2 3Å; Q220-N222 PolarHBondContact O-N 3.18Å; Q220-N222 PolarHBondContact O-ND2 3.02Å; N222-L224 HydrophobicContact CB-CG 4.1Å; N222-N246 WeakPolarHBondContact CA-OD1 3.47Å; N222-N246 WeakPolarHBondContact CB-OD1 3.49Å; N222-N246 PolarHBondContact O-OD1 2.86Å
223	N	97.6	Very high	97.4	Very high	32 Å²	32	38.7 Å²	38.7	17%	0.171	19%	0.193	C	C	.	.			trans	-108.2	25.3	178.3	-66.1	-54.6	0	0	0	112.3	R199 L200 T201 H225 R247	R199-N223 PolarHBondContact O-ND2 2.91Å; L200-N223 CarbonylContact O-C 3.47Å; L200-N223 VanDerWaalsContact O-CA 3.24Å; L200-N223 WeakPolarHBondContact O-CA 3.31Å; L200-N223 WeakPolarHBondContact O-CB 3.46Å; L200-N223 PolarHBondContact O-N 2.57Å; T201-N223 HydrophobicContact CG2-CB 4.23Å; N223-H225 PolarHBondContact O-CD2 3.38Å; N223-H225 VanDerWaalsContact O-CD2 3.29Å; N223-H225 PolarHBondContact O-N 3.03Å; N223-R247 PolarHBondContact OD1-NE 2.94Å; N223-R247 VanDerWaalsContact OD1-NE 3.08Å; N223-R247 PolarHBondContact OD1-NH2 2.95Å
224	L	97.6	Very high	97.3	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.186	C	C	.	.			trans	-62.5	122.4	-173.8	-60	176.1	0	0	0	110.7	L200 L203 L219 N222 L227 L243 N246 R247 I248	L200-L224 HydrophobicContact CB-CD2 4.06Å; L200-L224 PolarHBondContact O-N 3.42Å; L203-L224 HydrophobicContact CD1-CD1 4.01Å; L203-L224 HydrophobicContact CD1-CD2 4.39Å; L203-L224 HydrophobicContact CD2-CD2 4.38Å; L203-L224 HydrophobicContact CG-CD1 4.38Å; L203-L224 HydrophobicContact CG-CD2 3.87Å; L219-L224 HydrophobicContact CB-CD1 4.49Å; N222-L224 HydrophobicContact CB-CG 4.1Å; L224-L227 HydrophobicContact CD1-CD2 4.32Å; L224-L243 HydrophobicContact CD1-CD2 4.41Å; L224-N246 HydrophobicContact CB-CB 4.37Å; L224-N246 VanDerWaalsContact CB-OD1 3.27Å; L224-N246 WeakPolarHBondContact CB-OD1 3.46Å; L224-N246 WeakPolarHBondContact CG-OD1 3.41Å; L224-N246 PolarHBondContact N-OD1 3.07Å; L224-R247 CarbonylContact O-C 3.22Å; L224-R247 VanDerWaalsContact O-CA 3.24Å; L224-R247 WeakPolarHBondContact O-CA 3.5Å; L224-R247 WeakPolarHBondContact O-CB 3.32Å; L224-R247 PolarHBondContact O-N 3.29Å; L224-I248 HydrophobicContact CB-CG1 4.48Å; L224-I248 PolarHBondContact O-N 3.01Å; L224-I248 VanDerWaalsContact O-N 3.11Å
225	H	95.9	Very high	97.3	Very high	69 Å²	69	38.1 Å²	38.1	32%	0.319	19%	0.186	S	C	.	.			trans	-91.9	-30	-176.5	-78.1	-65.6	0	0	0	113.9	N223	N223-H225 PolarHBondContact O-CD2 3.38Å; N223-H225 VanDerWaalsContact O-CD2 3.29Å; N223-H225 PolarHBondContact O-N 3.03Å
226	F	95.4	Very high	97.2	Very high	110 Å²	110	38.5 Å²	38.5	48%	0.482	19%	0.19	S	C	.	.			trans	-150	164.6	177.4	64.1	-84.4	0	0	0	108.6	Q228	F226-Q228 HydrophobicContact CD2-CG 4.24Å; F226-Q228 HydrophobicContact CE2-CG 3.81Å
227	L	96.8	Very high	97.1	Very high	13 Å²	13	39.6 Å²	39.6	7%	0.068	20%	0.198	C	C	.	.			trans	-118.3	144.1	167.2	-63.2	172.9	0	0	0	106.6	L203 L224 F232 L243 I248 V255	L203-L227 HydrophobicContact CD1-CD2 4.37Å; L224-L227 HydrophobicContact CD1-CD2 4.32Å; L227-F232 HydrophobicContact CD1-CE2 4.25Å; L227-F232 HydrophobicContact CD2-CZ 4.45Å; L227-L243 HydrophobicContact CD1-CD1 3.78Å; L227-L243 HydrophobicContact CD1-CD2 4.23Å; L227-L243 HydrophobicContact CD2-CD2 4.27Å; L227-I248 HydrophobicContact CD1-CD1 3.88Å; L227-I248 HydrophobicContact CG-CD1 4.09Å; L227-V255 HydrophobicContact CB-CG2 3.49Å; L227-V255 VanDerWaalsContact CB-CG2 3.49Å; L227-V255 HydrophobicContact CD1-CG2 3.95Å; L227-V255 HydrophobicContact CG-CG2 4.38Å
228	Q	95.5	Very high	97.1	Very high	70 Å²	70	39.6 Å²	39.6	33%	0.327	20%	0.198	S	C	.	.			trans	-80.6	152	177.3	-61.4	-174.9	71	0	0	109.3	L203 F226 I231	L203-Q228 PolarHBondContact O-NE2 3.04Å; F226-Q228 HydrophobicContact CD2-CG 4.24Å; F226-Q228 HydrophobicContact CE2-CG 3.81Å; Q228-I231 HydrophobicContact CB-CB 4.36Å; Q228-I231 WeakPolarHBondContact O-CG2 3.5Å
229	D	96.3	Very high	97.1	Very high	69 Å²	69	38.9 Å²	38.9	37%	0.369	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	148.4	167.5	-84.2	-19.3	0	0	0	109.6	I231 S252 N254 V255	D229-I231 PolarHBondContact O-N 3.17Å; D229-S252 WeakPolarHBondContact OD1-CB 3.2Å; D229-S252 PolarHBondContact OD1-OG 3.33Å; D229-N254 HydrophobicContact CB-CB 3.98Å; D229-N254 VanDerWaalsContact OD1-C 3.28Å; D229-N254 WeakPolarHBondContact OD1-CA 3.33Å; D229-N254 PolarHBondContact OD1-N 2.96Å; D229-V255 PolarHBondContact OD1-N 3.44Å
230	D	96.3	Very high	97.1	Very high	68 Å²	68	40.3 Å²	40.3	36%	0.364	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	4.7	177.6	-54.2	-45.6	0	0	0	116.7	F232 S233 N254 R257	D230-F232 PolarHBondContact O-N 3.28Å; D230-S233 WeakPolarHBondContact O-CB 3.24Å; D230-S233 PolarHBondContact O-N 3.44Å; D230-S233 PolarHBondContact O-OG 3.4Å; D230-N254 PolarHBondContact N-O 2.83Å; D230-N254 WeakPolarHBondContact OD1-CB 3.39Å; D230-R257 WeakPolarHBondContact OD1-CD 3.29Å
231	I	96.6	Very high	97.1	Very high	8 Å²	8	39.3 Å²	39.3	4%	0.041	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-23.5	179.9	-165.4	169.2	0	0	0	114	L203 F208 Q228 D229	L203-I231 HydrophobicContact CB-CD1 3.69Å; L203-I231 HydrophobicContact CD1-CD1 4.11Å; F208-I231 HydrophobicContact CD2-CG1 4.09Å; F208-I231 WeakPolarHBondContact CD2-O 3.3Å; F208-I231 HydrophobicContact CE2-CG1 4.37Å; Q228-I231 HydrophobicContact CB-CB 4.36Å; Q228-I231 WeakPolarHBondContact O-CG2 3.5Å; D229-I231 PolarHBondContact O-N 3.17Å
232	F	97.3	Very high	97.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.2	12.2	177.7	-52.4	-55.9	0	0	0	113.6	F208 L217 L219 L227 D230 D234 L235 L241 V255 F256 L259	F208-F232 AromaticContact CD2-CD1 3.84Å; F208-F232 HydrophobicContact CD2-CD1 3.84Å; F208-F232 AromaticContact CD2-CE1 3.91Å; F208-F232 HydrophobicContact CD2-CE1 3.91Å; F208-F232 HydrophobicContact CE2-CD1 4.04Å; F208-F232 AromaticContact CE2-CE1 3.61Å; F208-F232 HydrophobicContact CE2-CE1 3.61Å; L217-F232 HydrophobicContact CD2-CD1 4.18Å; L217-F232 HydrophobicContact CD2-CE1 3.84Å; L219-F232 HydrophobicContact CD1-CE1 4.32Å; L219-F232 HydrophobicContact CD1-CZ 4.45Å; L227-F232 HydrophobicContact CD1-CE2 4.25Å; L227-F232 HydrophobicContact CD2-CZ 4.45Å; D230-F232 PolarHBondContact O-N 3.28Å; F232-D234 VanDerWaalsContact C-N 3.31Å; F232-D234 PolarHBondContact O-N 3.44Å; F232-L235 HydrophobicContact CB-CD1 4.01Å; F232-L235 HydrophobicContact CB-CG 4.36Å; F232-L235 HydrophobicContact CD1-CD1 3.67Å; F232-L235 HydrophobicContact CG-CD1 4.26Å; F232-L235 WeakPolarHBondContact O-CB 3.3Å; F232-L235 PolarHBondContact O-N 3.5Å; F232-L241 HydrophobicContact CD2-CD2 4.2Å; F232-L241 HydrophobicContact CE1-CD1 4.47Å; F232-L241 HydrophobicContact CE2-CD2 3.91Å; F232-L241 HydrophobicContact CZ-CD1 4.34Å; F232-L241 HydrophobicContact CZ-CD2 4.15Å; F232-V255 VanDerWaalsContact CD2-O 3.24Å; F232-V255 WeakPolarHBondContact CD2-O 3.38Å; F232-F256 HydrophobicContact CD2-CD1 4.05Å; F232-F256 HydrophobicContact CD2-CE1 4.43Å; F232-F256 HydrophobicContact CE2-CD1 4.13Å; F232-F256 HydrophobicContact CE2-CE1 4.05Å; F232-L259 HydrophobicContact CB-CD1 4.06Å; F232-L259 HydrophobicContact CB-CD2 3.86Å; F232-L259 HydrophobicContact CB-CG 4Å; F232-L259 HydrophobicContact CD2-CD1 4.1Å; F232-L259 HydrophobicContact CG-CD1 4.33Å
233	S	96.3	Very high	97.2	Very high	47 Å²	47	36.5 Å²	36.5	33%	0.329	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-37	-170.6	52.4	0	0	0	0	115	D230 L235 R257	D230-S233 WeakPolarHBondContact O-CB 3.24Å; D230-S233 PolarHBondContact O-N 3.44Å; D230-S233 PolarHBondContact O-OG 3.4Å; S233-L235 VanDerWaalsContact C-N 3.34Å; S233-R257 WeakPolarHBondContact CA-O 3.43Å
234	D	96.2	Very high	97.2	Very high	32 Å²	32	36.5 Å²	36.5	17%	0.171	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-10	178.5	-73.6	-27	0	0	0	113.7	H209 K210 Y212 F232 I236	H209-D234 WeakPolarHBondContact CA-OD2 3.45Å; H209-D234 IonicContact CE1-OD2 3.41Å; H209-D234 IonicContact CG-OD2 2.74Å; H209-D234 IonicContact ND1-OD2 3.25Å; H209-D234 PolarHBondContact ND1-OD2 3.09Å; K210-D234 PolarHBondContact N-OD2 2.98Å; Y212-D234 HydrophobicContact CD1-CB 4.11Å; Y212-D234 WeakPolarHBondContact CD1-O 3.39Å; Y212-D234 HydrophobicContact CE1-CB 3.81Å; F232-D234 VanDerWaalsContact C-N 3.31Å; F232-D234 PolarHBondContact O-N 3.44Å; D234-I236 PolarHBondContact O-N 3.07Å
235	L	97.4	Very high	97.3	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.201	C	C	.	.			trans	-82.4	50	-172.2	-56.8	-171.8	0	0	0	112.5	F208 L211 L214 L217 F232 S233 N237 L238 L259	F208-L235 HydrophobicContact CB-CD1 4.26Å; F208-L235 HydrophobicContact CB-CD2 4.13Å; F208-L235 HydrophobicContact CB-CG 4.36Å; F208-L235 HydrophobicContact CG-CD1 4.34Å; L211-L235 HydrophobicContact CB-CD2 3.73Å; L211-L235 WeakPolarHBondContact O-CD2 3.17Å; L214-L235 HydrophobicContact CB-CD2 4.12Å; L214-L235 HydrophobicContact CD2-CD1 4.21Å; L214-L235 HydrophobicContact CD2-CD2 3.95Å; L217-L235 HydrophobicContact CD2-CD1 3.95Å; F232-L235 HydrophobicContact CB-CD1 4.01Å; F232-L235 HydrophobicContact CB-CG 4.36Å; F232-L235 HydrophobicContact CD1-CD1 3.67Å; F232-L235 HydrophobicContact CG-CD1 4.26Å; F232-L235 WeakPolarHBondContact O-CB 3.3Å; F232-L235 PolarHBondContact O-N 3.5Å; S233-L235 VanDerWaalsContact C-N 3.34Å; L235-N237 PolarHBondContact O-N 2.88Å; L235-L238 HydrophobicContact CB-CB 4Å; L235-L238 HydrophobicContact CB-CD2 4.4Å; L235-L238 HydrophobicContact CD1-CD2 4.08Å; L235-L238 VanDerWaalsContact O-CB 3.24Å; L235-L238 WeakPolarHBondContact O-CB 3.29Å; L235-L238 PolarHBondContact O-N 3.13Å; L235-L259 HydrophobicContact CB-CD2 3.86Å
236	I	96.1	Very high	97.4	Very high	77 Å²	77	34.8 Å²	34.8	40%	0.395	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-33.9	-171.3	-62.5	165.5	0	0	0	112	D234 V260 N261	D234-I236 PolarHBondContact O-N 3.07Å; I236-V260 HydrophobicContact CG2-CG2 4.01Å; I236-N261 WeakPolarHBondContact O-CB 3.33Å; I236-N261 PolarHBondContact O-ND2 3.12Å
237	N	97.8	Very high	97.5	Very high	80 Å²	80	34.1 Å²	34.1	43%	0.428	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	5.7	-179.5	-67.8	-45.8	0	0	0	114.3	Y212 L214 L235 S239	Y212-N237 WeakPolarHBondContact O-CB 3.39Å; Y212-N237 PolarHBondContact O-ND2 3.35Å; L214-N237 CarbonylContact O-C 3.53Å; L235-N237 PolarHBondContact O-N 2.88Å; N237-S239 PolarHBondContact O-N 3Å
238	L	98.6	Very high	97.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.178	C	C	.	.			trans	-66.5	121.6	-176.3	-165.7	74.7	0	0	0	110.7	L214 L217 L235 L241 L259 N261 L262	L214-L238 HydrophobicContact CB-CD1 4.5Å; L214-L238 HydrophobicContact CD2-CD1 4.15Å; L214-L238 HydrophobicContact CG-CD1 4.1Å; L214-L238 WeakPolarHBondContact O-CA 3.11Å; L214-L238 PolarHBondContact O-N 3.21Å; L217-L238 HydrophobicContact CB-CD1 3.8Å; L217-L238 HydrophobicContact CB-CD2 4.45Å; L235-L238 HydrophobicContact CB-CB 4Å; L235-L238 HydrophobicContact CB-CD2 4.4Å; L235-L238 HydrophobicContact CD1-CD2 4.08Å; L235-L238 VanDerWaalsContact O-CB 3.24Å; L235-L238 WeakPolarHBondContact O-CB 3.29Å; L235-L238 PolarHBondContact O-N 3.13Å; L238-L241 HydrophobicContact CD2-CB 4.05Å; L238-L241 HydrophobicContact CD2-CD1 4.4Å; L238-L241 HydrophobicContact CD2-CD2 4.38Å; L238-L259 HydrophobicContact CB-CD2 3.95Å; L238-L259 HydrophobicContact CD2-CD2 3.69Å; L238-L259 HydrophobicContact CG-CD2 4.45Å; L238-N261 CarbonylContact O-C 3.33Å; L238-L262 HydrophobicContact CD2-CD1 4.04Å; L238-L262 HydrophobicContact CG-CD1 4.1Å; L238-L262 WeakPolarHBondContact O-CA 3.47Å; L238-L262 PolarHBondContact O-N 3.19Å; L238-L262 VanDerWaalsContact O-N 3.16Å
239	S	98.4	Very high	97.6	Very high	32 Å²	32	36.9 Å²	36.9	22%	0.224	19%	0.188	C	C	.	.			trans	-97.7	-38.1	179.4	179.2	0	0	0	0	111.6	Q215 N237 D263 R264	Q215-S239 PolarHBondContact O-N 2.99Å; N237-S239 PolarHBondContact O-N 3Å; S239-D263 WeakPolarHBondContact O-CA 3.45Å; S239-D263 WeakPolarHBondContact O-CB 3.2Å; S239-D263 PolarHBondContact O-N 3.4Å; S239-R264 PolarHBondContact O-N 2.96Å
240	Q	98.8	Very high	97.7	Very high	31 Å²	31	36.9 Å²	36.9	15%	0.145	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	125	-174.3	-52.2	-170.8	19.7	0	0	112.3	Q215 F216 L217 F242 R264	Q215-Q240 PolarHBondContact O-N 3Å; F216-Q240 HydrophobicContact CD1-CB 4.04Å; F216-Q240 HydrophobicContact CD1-CG 4.06Å; F216-Q240 HydrophobicContact CE1-CG 4.1Å; L217-Q240 PolarHBondContact N-O 3.43Å; Q240-F242 HydrophobicContact CB-CD2 4.41Å; Q240-F242 HydrophobicContact CB-CE2 3.62Å; Q240-F242 HydrophobicContact CB-CZ 4.18Å; Q240-R264 HydrophobicContact CB-CB 4.43Å; Q240-R264 HydrophobicContact CG-CB 4.2Å; Q240-R264 HydrophobicContact CG-CG 4.12Å
241	L	98.8	Very high	97.8	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	113.5	179.6	-179.6	53.1	0	0	0	110.7	L217 F232 L238 L243 F256 L259 L262 R264 L265 L266	L217-L241 HydrophobicContact CB-CD1 4.09Å; L217-L241 HydrophobicContact CD2-CD1 3.93Å; L217-L241 HydrophobicContact CG-CD1 3.99Å; F232-L241 HydrophobicContact CD2-CD2 4.2Å; F232-L241 HydrophobicContact CE1-CD1 4.47Å; F232-L241 HydrophobicContact CE2-CD2 3.91Å; F232-L241 HydrophobicContact CZ-CD1 4.34Å; F232-L241 HydrophobicContact CZ-CD2 4.15Å; L238-L241 HydrophobicContact CD2-CB 4.05Å; L238-L241 HydrophobicContact CD2-CD1 4.4Å; L238-L241 HydrophobicContact CD2-CD2 4.38Å; L241-L243 HydrophobicContact CD1-CD1 4.11Å; L241-L243 HydrophobicContact CD1-CG 4Å; L241-L243 HydrophobicContact CD2-CD1 3.78Å; L241-L243 HydrophobicContact CG-CD1 3.75Å; L241-L243 HydrophobicContact CG-CG 4.01Å; L241-F256 HydrophobicContact CD2-CD1 4.17Å; L241-F256 HydrophobicContact CD2-CE1 3.96Å; L241-L259 HydrophobicContact CD2-CD1 3.89Å; L241-L262 HydrophobicContact CB-CD1 3.83Å; L241-L262 HydrophobicContact CB-CD2 4.48Å; L241-R264 PolarHBondContact N-O 2.77Å; L241-L265 HydrophobicContact CB-CD1 4.15Å; L241-L265 HydrophobicContact CD2-CD1 3.98Å; L241-L265 HydrophobicContact CG-CD1 4.06Å; L241-L266 PolarHBondContact O-N 2.97Å
242	F	98.8	Very high	97.8	Very high	29 Å²	29	35.2 Å²	35.2	13%	0.127	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	107	-179.3	-59.6	-94.9	0	0	0	110.2	L217 Y218 L219 Q220 Q240 H244 L266	L217-F242 PolarHBondContact O-N 3.3Å; Y218-F242 HydrophobicContact CD1-CB 4.22Å; Y218-F242 AromaticContact CD1-CD2 3.35Å; Y218-F242 HydrophobicContact CD1-CD2 3.35Å; Y218-F242 AromaticContact CD1-CE2 3.76Å; Y218-F242 HydrophobicContact CD1-CE2 3.76Å; Y218-F242 AromaticContact CD1-CG 3.8Å; Y218-F242 HydrophobicContact CD1-CG 3.8Å; Y218-F242 HydrophobicContact CD1-CZ 4.5Å; Y218-F242 AromaticContact CE1-CD2 3.4Å; Y218-F242 HydrophobicContact CE1-CD2 3.4Å; Y218-F242 VanDerWaalsContact CE1-CD2 3.4Å; Y218-F242 HydrophobicContact CE1-CE1 4.46Å; Y218-F242 AromaticContact CE1-CE2 3.24Å; Y218-F242 HydrophobicContact CE1-CE2 3.24Å; Y218-F242 HydrophobicContact CE1-CG 4.1Å; Y218-F242 AromaticContact CE1-CZ 3.84Å; Y218-F242 HydrophobicContact CE1-CZ 3.84Å; Y218-F242 HydrophobicContact CG-CD2 4.17Å; Y218-F242 AromaticContact CZ-CE2 3.87Å; L219-F242 CarbonylContact C-O 3.48Å; L219-F242 WeakPolarHBondContact CA-O 3.34Å; L219-F242 WeakPolarHBondContact CB-O 3.33Å; L219-F242 PolarHBondContact N-O 2.96Å; Q220-F242 HydrophobicContact CB-CB 4.48Å; Q220-F242 PolarHBondContact N-O 3.27Å; Q220-F242 VanDerWaalsContact N-O 3.17Å; Q220-F242 VanDerWaalsContact OE1-CB 3.26Å; Q240-F242 HydrophobicContact CB-CD2 4.41Å; Q240-F242 HydrophobicContact CB-CE2 3.62Å; Q240-F242 HydrophobicContact CB-CZ 4.18Å; F242-H244 AromaticContact CD1-CE1 3.91Å; F242-L266 HydrophobicContact CD1-CB 4.29Å; F242-L266 HydrophobicContact CD1-CD1 3.96Å; F242-L266 HydrophobicContact CD1-CD2 3.9Å; F242-L266 HydrophobicContact CD1-CG 4.28Å; F242-L266 HydrophobicContact CE1-CD1 3.86Å; F242-L266 HydrophobicContact CE1-CD2 3.88Å; F242-L266 HydrophobicContact CE1-CG 4.43Å
243	L	98.6	Very high	97.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.197	C	C	.	.			trans	-120.4	8.1	-178.5	-75.7	165.3	0	0	0	112.7	L219 L224 L227 L241 N246 I248 F256 L265 L266 L267 N270	L219-L243 HydrophobicContact CB-CD2 3.84Å; L219-L243 HydrophobicContact CD1-CD2 3.86Å; L224-L243 HydrophobicContact CD1-CD2 4.41Å; L227-L243 HydrophobicContact CD1-CD1 3.78Å; L227-L243 HydrophobicContact CD1-CD2 4.23Å; L227-L243 HydrophobicContact CD2-CD2 4.27Å; L241-L243 HydrophobicContact CD1-CD1 4.11Å; L241-L243 HydrophobicContact CD1-CG 4Å; L241-L243 HydrophobicContact CD2-CD1 3.78Å; L241-L243 HydrophobicContact CG-CD1 3.75Å; L241-L243 HydrophobicContact CG-CG 4.01Å; L243-N246 WeakPolarHBondContact O-CB 3.38Å; L243-N246 PolarHBondContact O-ND2 3.37Å; L243-I248 HydrophobicContact CB-CD1 4.37Å; L243-I248 HydrophobicContact CD2-CD1 4.39Å; L243-F256 HydrophobicContact CD1-CE1 3.97Å; L243-F256 HydrophobicContact CD1-CZ 4.34Å; L243-L265 HydrophobicContact CD1-CD1 4.42Å; L243-L266 CarbonylContact C-O 3.02Å; L243-L266 WeakPolarHBondContact CA-O 3.45Å; L243-L266 PolarHBondContact N-O 3Å; L243-L267 HydrophobicContact CB-CD2 3.73Å; L243-L267 HydrophobicContact CD1-CD2 3.83Å; L243-L267 HydrophobicContact CG-CD2 4.45Å; L243-N270 PolarHBondContact O-ND2 3.43Å
244	H	98.6	Very high	97.7	Very high	31 Å²	31	37.1 Å²	37.1	14%	0.144	19%	0.189	C	C	.	.			trans	-69.1	159.6	-175.5	62.6	-85.1	0	0	0	113.3	Q220 E221 F242 N246 L266 H268	Q220-H244 CarbonylContact C-O 3.51Å; Q220-H244 WeakPolarHBondContact CA-O 3.49Å; Q220-H244 WeakPolarHBondContact CB-CE1 3.4Å; Q220-H244 VanDerWaalsContact CB-O 3.3Å; Q220-H244 WeakPolarHBondContact CB-O 3.45Å; E221-H244 PolarHBondContact N-O 3.24Å; F242-H244 AromaticContact CD1-CE1 3.91Å; H244-N246 VanDerWaalsContact C-N 3.27Å; H244-N246 PolarHBondContact O-N 2.9Å; H244-N246 PolarHBondContact O-ND2 3.49Å; H244-L266 PolarHBondContact N-O 3.03Å; H244-H268 WeakPolarHBondContact CA-O 3.5Å; H244-H268 WeakPolarHBondContact CB-CE1 3.39Å; H244-H268 WeakPolarHBondContact CB-NE2 3.45Å; H244-H268 VanDerWaalsContact CB-O 3.23Å; H244-H268 WeakPolarHBondContact CB-O 3.34Å; H244-H268 AromaticContact CD2-CE1 3.79Å; H244-H268 AromaticContact CD2-NE2 3.47Å; H244-H268 PolarHBondContact CD2-NE2 3.34Å; H244-H268 AromaticContact CG-CE1 3.36Å; H244-H268 AromaticContact CG-NE2 3.46Å; H244-H268 AromaticContact ND1-CE1 3.74Å
245	G	98.3	Very high	97.8	Very high	27 Å²	27	35.7 Å²	35.7	28%	0.278	18%	0.181	S	C	.	.	S	Bend	trans	67.1	25.2	-179.3	0	0	0	0	0	114.1	E221 H268 D269	E221-G245 WeakPolarHBondContact CA-O 3.38Å; G245-H268 PolarHBondContact N-O 2.84Å; G245-D269 CarbonylContact C-O 3.41Å; G245-D269 WeakPolarHBondContact CA-O 3.43Å; G245-D269 PolarHBondContact N-O 3.28Å
246	N	98.6	Very high	97.8	Very high	7 Å²	7	35.8 Å²	35.8	4%	0.037	18%	0.182	C	C	.	.	S	Bend	trans	-104.8	-166.1	178.7	-87	-77.6	0	0	0	111.2	L219 N222 L224 L243 H244 I248 D269 N270	L219-N246 PolarHBondContact O-ND2 2.84Å; N222-N246 WeakPolarHBondContact CA-OD1 3.47Å; N222-N246 WeakPolarHBondContact CB-OD1 3.49Å; N222-N246 PolarHBondContact O-OD1 2.86Å; L224-N246 HydrophobicContact CB-CB 4.37Å; L224-N246 VanDerWaalsContact CB-OD1 3.27Å; L224-N246 WeakPolarHBondContact CB-OD1 3.46Å; L224-N246 WeakPolarHBondContact CG-OD1 3.41Å; L224-N246 PolarHBondContact N-OD1 3.07Å; L243-N246 WeakPolarHBondContact O-CB 3.38Å; L243-N246 PolarHBondContact O-ND2 3.37Å; H244-N246 VanDerWaalsContact C-N 3.27Å; H244-N246 PolarHBondContact O-N 2.9Å; H244-N246 PolarHBondContact O-ND2 3.49Å; N246-I248 HydrophobicContact CB-CD1 4.23Å; N246-I248 HydrophobicContact CB-CG1 4.19Å; N246-D269 PolarHBondContact N-O 3.18Å; N246-N270 WeakPolarHBondContact CA-OD1 3.23Å; N246-N270 WeakPolarHBondContact CB-OD1 3.39Å; N246-N270 PolarHBondContact O-OD1 2.6Å
247	R	98	Very high	97.8	Very high	96 Å²	96	37.5 Å²	37.5	36%	0.362	18%	0.183	S	C	.	.			trans	-123	22.5	-177	-56.6	177.9	-177.5	-170.4	-2.6	112.4	N223 L224 N270	N223-R247 PolarHBondContact OD1-NE 2.94Å; N223-R247 VanDerWaalsContact OD1-NE 3.08Å; N223-R247 PolarHBondContact OD1-NH2 2.95Å; L224-R247 CarbonylContact O-C 3.22Å; L224-R247 VanDerWaalsContact O-CA 3.24Å; L224-R247 WeakPolarHBondContact O-CA 3.5Å; L224-R247 WeakPolarHBondContact O-CB 3.32Å; L224-R247 PolarHBondContact O-N 3.29Å; R247-N270 PolarHBondContact N-OD1 3.35Å
248	I	98.3	Very high	97.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.17	C	C	.	.			trans	-63.9	132	-175.5	-58.7	164.4	0	0	0	109	L224 L227 L243 N246 L251 L267 N270 R271 I272	L224-I248 HydrophobicContact CB-CG1 4.48Å; L224-I248 PolarHBondContact O-N 3.01Å; L224-I248 VanDerWaalsContact O-N 3.11Å; L227-I248 HydrophobicContact CD1-CD1 3.88Å; L227-I248 HydrophobicContact CG-CD1 4.09Å; L243-I248 HydrophobicContact CB-CD1 4.37Å; L243-I248 HydrophobicContact CD2-CD1 4.39Å; N246-I248 HydrophobicContact CB-CD1 4.23Å; N246-I248 HydrophobicContact CB-CG1 4.19Å; I248-L251 HydrophobicContact CG2-CD2 4.2Å; I248-L267 HydrophobicContact CD1-CD2 4.46Å; I248-N270 WeakPolarHBondContact CB-OD1 3.19Å; I248-N270 WeakPolarHBondContact CG1-OD1 3.1Å; I248-N270 PolarHBondContact N-OD1 3.1Å; I248-R271 CarbonylContact O-C 3.54Å; I248-R271 VanDerWaalsContact O-CA 3.31Å; I248-R271 WeakPolarHBondContact O-CA 3.41Å; I248-R271 PolarHBondContact O-N 3.24Å; I248-I272 HydrophobicContact CB-CG1 4.43Å; I248-I272 HydrophobicContact CG2-CG1 4.26Å; I248-I272 PolarHBondContact O-N 2.81Å; I248-I272 VanDerWaalsContact O-N 3.08Å
249	R	96.9	Very high	97.7	Very high	140 Å²	140	34.4 Å²	34.4	53%	0.528	17%	0.171	S	C	.	.			trans	-105.3	-28.9	-175.4	-63.2	-176.8	-178.5	178.6	1.9	114.9	R271 I272 R273	R249-R271 WeakPolarHBondContact CA-O 3.37Å; R249-I272 WeakPolarHBondContact O-CA 3.06Å; R249-R273 PolarHBondContact O-N 2.69Å
250	T	96.9	Very high	97.6	Very high	69 Å²	69	36 Å²	36	42%	0.423	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	144.4	-170.2	47.7	0	0	0	0	109.6	Q274	T250-Q274 WeakPolarHBondContact CA-O 3.5Å; T250-Q274 HydrophobicContact CG2-CB 4.49Å
251	L	97.9	Very high	97.5	Very high	5 Å²	5	36.6 Å²	36.6	3%	0.026	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	114.7	170.6	-59.1	174.8	0	0	0	108.2	I248 V255 F256 L267 I272 Q274 V275 N276 A279 F280	I248-L251 HydrophobicContact CG2-CD2 4.2Å; L251-V255 HydrophobicContact CB-CG1 4.18Å; L251-V255 HydrophobicContact CD2-CG1 4.47Å; L251-F256 HydrophobicContact CD1-CE2 4.13Å; L251-F256 HydrophobicContact CD2-CE2 3.97Å; L251-F256 HydrophobicContact CD2-CZ 3.99Å; L251-L267 HydrophobicContact CD1-CD1 4.04Å; L251-I272 HydrophobicContact CD1-CD1 4.24Å; L251-I272 HydrophobicContact CD1-CG2 4.32Å; L251-I272 HydrophobicContact CG-CD1 4.43Å; L251-I272 HydrophobicContact CG-CG2 4.18Å; L251-Q274 PolarHBondContact N-O 2.93Å; L251-Q274 VanDerWaalsContact N-O 3.1Å; L251-V275 HydrophobicContact CB-CG1 4.21Å; L251-V275 HydrophobicContact CD1-CG1 4.08Å; L251-V275 HydrophobicContact CD1-CG2 4.07Å; L251-N276 WeakPolarHBondContact O-CB 3.19Å; L251-N276 PolarHBondContact O-N 3.44Å; L251-A279 HydrophobicContact CB-CB 4.38Å; L251-F280 HydrophobicContact CD1-CE1 4.21Å; L251-F280 HydrophobicContact CD1-CZ 4.38Å
252	S	96.9	Very high	97.5	Very high	37 Å²	37	36.6 Å²	36.6	26%	0.259	18%	0.183	S	C	.	.			trans	-78.4	-178.7	-179	45.6	0	0	0	0	112.3	D229 V255 A279	D229-S252 WeakPolarHBondContact OD1-CB 3.2Å; D229-S252 PolarHBondContact OD1-OG 3.33Å; S252-V255 WeakPolarHBondContact O-CG1 3.44Å; S252-A279 VanDerWaalsContact O-CB 3.3Å; S252-A279 WeakPolarHBondContact O-CB 3.22Å
253	E	96.2	Very high	97.5	Very high	56 Å²	56	37 Å²	37	26%	0.262	19%	0.187	S	C	.	.	S	Bend	trans	-68.2	-39.8	-173.1	179.2	154.3	169.8	0	0	113.3	R278	E253-R278 HydrophobicContact CG-CB 3.94Å; E253-R278 WeakPolarHBondContact OE1-CD 3.38Å; E253-R278 IonicContact OE1-CZ 2.75Å; E253-R278 IonicContact OE1-NE 3.7Å; E253-R278 IonicContact OE1-NH1 3.35Å; E253-R278 PolarHBondContact OE1-NH1 3.35Å; E253-R278 IonicContact OE2-NH1 2.81Å
254	N	96.8	Very high	97.5	Very high	31 Å²	31	41.5 Å²	41.5	17%	0.166	20%	0.204	C	C	.	.	S	Bend	trans	-113.4	15.2	-173.7	-59.3	-71.8	0	0	0	113.1	D229 D230 F256 R257	D229-N254 HydrophobicContact CB-CB 3.98Å; D229-N254 VanDerWaalsContact OD1-C 3.28Å; D229-N254 WeakPolarHBondContact OD1-CA 3.33Å; D229-N254 PolarHBondContact OD1-N 2.96Å; D230-N254 PolarHBondContact N-O 2.83Å; D230-N254 WeakPolarHBondContact OD1-CB 3.39Å; N254-F256 PolarHBondContact O-N 3.25Å; N254-R257 HydrophobicContact CB-CB 4.06Å; N254-R257 VanDerWaalsContact O-CB 3.31Å; N254-R257 WeakPolarHBondContact O-CB 3.2Å; N254-R257 PolarHBondContact O-N 3.28Å; N254-R257 VanDerWaalsContact O-N 3.1Å; N254-R257 PolarHBondContact OD1-NH1 2.8Å
255	V	97.5	Very high	97.5	Very high	1 Å²	1	40 Å²	40	1%	0.006	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-30.8	-178.6	65.8	0	0	0	0	113.6	L227 D229 F232 L251 S252	L227-V255 HydrophobicContact CB-CG2 3.49Å; L227-V255 VanDerWaalsContact CB-CG2 3.49Å; L227-V255 HydrophobicContact CD1-CG2 3.95Å; L227-V255 HydrophobicContact CG-CG2 4.38Å; D229-V255 PolarHBondContact OD1-N 3.44Å; F232-V255 VanDerWaalsContact CD2-O 3.24Å; F232-V255 WeakPolarHBondContact CD2-O 3.38Å; L251-V255 HydrophobicContact CB-CG1 4.18Å; L251-V255 HydrophobicContact CD2-CG1 4.47Å; S252-V255 WeakPolarHBondContact O-CG1 3.44Å
256	F	97.8	Very high	97.5	Very high	3 Å²	3	39.5 Å²	39.5	1%	0.013	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.5	22.7	176.7	-59	-54.6	0	0	0	112.8	F232 L241 L243 L251 N254 L259 L265 L267 F280 L283	F232-F256 HydrophobicContact CD2-CD1 4.05Å; F232-F256 HydrophobicContact CD2-CE1 4.43Å; F232-F256 HydrophobicContact CE2-CD1 4.13Å; F232-F256 HydrophobicContact CE2-CE1 4.05Å; L241-F256 HydrophobicContact CD2-CD1 4.17Å; L241-F256 HydrophobicContact CD2-CE1 3.96Å; L243-F256 HydrophobicContact CD1-CE1 3.97Å; L243-F256 HydrophobicContact CD1-CZ 4.34Å; L251-F256 HydrophobicContact CD1-CE2 4.13Å; L251-F256 HydrophobicContact CD2-CE2 3.97Å; L251-F256 HydrophobicContact CD2-CZ 3.99Å; N254-F256 PolarHBondContact O-N 3.25Å; F256-L259 HydrophobicContact CB-CD1 4.04Å; F256-L259 HydrophobicContact CD1-CD1 3.83Å; F256-L259 HydrophobicContact CG-CD1 4.37Å; F256-L259 WeakPolarHBondContact O-CB 3.48Å; F256-L259 PolarHBondContact O-N 3.03Å; F256-L265 HydrophobicContact CD2-CD2 4.25Å; F256-L265 HydrophobicContact CE1-CD1 4.1Å; F256-L265 HydrophobicContact CE1-CD2 4.47Å; F256-L265 HydrophobicContact CE2-CD2 3.99Å; F256-L265 HydrophobicContact CZ-CD1 4.17Å; F256-L265 HydrophobicContact CZ-CD2 4.12Å; F256-L267 HydrophobicContact CE2-CD1 4.12Å; F256-L267 HydrophobicContact CZ-CD1 3.91Å; F256-L267 HydrophobicContact CZ-CD2 4.24Å; F256-F280 AromaticContact CD2-CD1 4Å; F256-F280 HydrophobicContact CD2-CD1 4Å; F256-F280 HydrophobicContact CD2-CE1 4Å; F256-F280 HydrophobicContact CE2-CD1 4.41Å; F256-F280 AromaticContact CE2-CE1 3.94Å; F256-F280 HydrophobicContact CE2-CE1 3.94Å; F256-L283 HydrophobicContact CB-CD1 4.3Å; F256-L283 HydrophobicContact CB-CD2 4.17Å; F256-L283 HydrophobicContact CB-CG 4.4Å; F256-L283 HydrophobicContact CD2-CD1 4.35Å; F256-L283 HydrophobicContact CG-CD1 4.48Å
257	R	96.8	Very high	97.5	Very high	112 Å²	112	39.2 Å²	39.2	42%	0.423	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	140.7	176.9	-169.2	-166.8	179.6	96.1	2.9	110.4	D230 S233 N254 L259 D282	D230-R257 WeakPolarHBondContact OD1-CD 3.29Å; S233-R257 WeakPolarHBondContact CA-O 3.43Å; N254-R257 HydrophobicContact CB-CB 4.06Å; N254-R257 VanDerWaalsContact O-CB 3.31Å; N254-R257 WeakPolarHBondContact O-CB 3.2Å; N254-R257 PolarHBondContact O-N 3.28Å; N254-R257 VanDerWaalsContact O-N 3.1Å; N254-R257 PolarHBondContact OD1-NH1 2.8Å; R257-L259 VanDerWaalsContact C-N 3.28Å; R257-L259 PolarHBondContact O-N 2.86Å; R257-D282 WeakPolarHBondContact CA-OD2 3.2Å; R257-D282 VanDerWaalsContact CG-OD2 3.32Å; R257-D282 WeakPolarHBondContact CG-OD2 2.97Å
258	G	95.1	Very high	97.5	Very high	15 Å²	15	35.5 Å²	35.5	16%	0.155	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.1	-10	176.1	0	0	0	0	0	115.6	V260 D282	G258-V260 PolarHBondContact O-N 3Å; G258-D282 PolarHBondContact N-OD2 2.9Å
259	L	97.4	Very high	97.5	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	19%	0.189	C	C	.	.			trans	-76.9	49.4	-179.7	-66.2	-173.8	0	0	0	113.8	F232 L235 L238 L241 F256 R257 N261 L262 L283	F232-L259 HydrophobicContact CB-CD1 4.06Å; F232-L259 HydrophobicContact CB-CD2 3.86Å; F232-L259 HydrophobicContact CB-CG 4Å; F232-L259 HydrophobicContact CD2-CD1 4.1Å; F232-L259 HydrophobicContact CG-CD1 4.33Å; L235-L259 HydrophobicContact CB-CD2 3.86Å; L238-L259 HydrophobicContact CB-CD2 3.95Å; L238-L259 HydrophobicContact CD2-CD2 3.69Å; L238-L259 HydrophobicContact CG-CD2 4.45Å; L241-L259 HydrophobicContact CD2-CD1 3.89Å; F256-L259 HydrophobicContact CB-CD1 4.04Å; F256-L259 HydrophobicContact CD1-CD1 3.83Å; F256-L259 HydrophobicContact CG-CD1 4.37Å; F256-L259 WeakPolarHBondContact O-CB 3.48Å; F256-L259 PolarHBondContact O-N 3.03Å; R257-L259 VanDerWaalsContact C-N 3.28Å; R257-L259 PolarHBondContact O-N 2.86Å; L259-N261 VanDerWaalsContact C-N 3.26Å; L259-N261 PolarHBondContact O-N 2.95Å; L259-L262 HydrophobicContact CB-CB 4.2Å; L259-L262 HydrophobicContact CB-CD2 4.47Å; L259-L262 HydrophobicContact CD1-CD2 4.11Å; L259-L262 WeakPolarHBondContact O-CB 3.46Å; L259-L262 PolarHBondContact O-N 3.09Å; L259-L283 HydrophobicContact CB-CD2 3.69Å
260	V	96.3	Very high	97.6	Very high	66 Å²	66	32.4 Å²	32.4	40%	0.4	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-20.4	-171.8	-62.3	0	0	0	0	114.8	I236 G258 R285	I236-V260 HydrophobicContact CG2-CG2 4.01Å; G258-V260 PolarHBondContact O-N 3Å; V260-R285 WeakPolarHBondContact O-CD 3.47Å; V260-R285 WeakPolarHBondContact O-CG 3.4Å
261	N	97.4	Very high	97.6	Very high	42 Å²	42	35.6 Å²	35.6	23%	0.225	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.3	9.2	-179.6	-69	-50.8	0	0	0	114.3	I236 L238 L259 D263 R285	I236-N261 WeakPolarHBondContact O-CB 3.33Å; I236-N261 PolarHBondContact O-ND2 3.12Å; L238-N261 CarbonylContact O-C 3.33Å; L259-N261 VanDerWaalsContact C-N 3.26Å; L259-N261 PolarHBondContact O-N 2.95Å; N261-D263 PolarHBondContact O-N 2.91Å; N261-R285 PolarHBondContact OD1-NH1 2.8Å
262	L	98.3	Very high	97.7	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	17%	0.169	C	C	.	.			trans	-68.2	119.5	-176.4	-163.7	73.9	0	0	0	111.4	L238 L241 L259 L265 L283 R285 L286	L238-L262 HydrophobicContact CD2-CD1 4.04Å; L238-L262 HydrophobicContact CG-CD1 4.1Å; L238-L262 WeakPolarHBondContact O-CA 3.47Å; L238-L262 PolarHBondContact O-N 3.19Å; L238-L262 VanDerWaalsContact O-N 3.16Å; L241-L262 HydrophobicContact CB-CD1 3.83Å; L241-L262 HydrophobicContact CB-CD2 4.48Å; L259-L262 HydrophobicContact CB-CB 4.2Å; L259-L262 HydrophobicContact CB-CD2 4.47Å; L259-L262 HydrophobicContact CD1-CD2 4.11Å; L259-L262 WeakPolarHBondContact O-CB 3.46Å; L259-L262 PolarHBondContact O-N 3.09Å; L262-L265 HydrophobicContact CD2-CB 3.98Å; L262-L265 HydrophobicContact CD2-CD1 4.35Å; L262-L265 HydrophobicContact CD2-CD2 4.39Å; L262-L265 HydrophobicContact CD2-CG 4.47Å; L262-L283 HydrophobicContact CB-CD2 4.17Å; L262-L283 HydrophobicContact CD2-CD2 3.79Å; L262-R285 CarbonylContact O-C 3.51Å; L262-R285 VanDerWaalsContact O-C 3.22Å; L262-L286 HydrophobicContact CD2-CD1 4.07Å; L262-L286 HydrophobicContact CG-CD1 4.15Å; L262-L286 WeakPolarHBondContact O-CA 3.3Å; L262-L286 PolarHBondContact O-N 2.74Å
263	D	98.2	Very high	97.7	Very high	38 Å²	38	41.6 Å²	41.6	20%	0.203	19%	0.187	C	C	.	.			trans	-88.9	-41	175.2	178.7	54.2	0	0	0	110.9	S239 N261 L286 T287 M288	S239-D263 WeakPolarHBondContact O-CA 3.45Å; S239-D263 WeakPolarHBondContact O-CB 3.2Å; S239-D263 PolarHBondContact O-N 3.4Å; N261-D263 PolarHBondContact O-N 2.91Å; D263-L286 WeakPolarHBondContact O-CD1 3.21Å; D263-T287 PolarHBondContact O-N 2.97Å; D263-T287 PolarHBondContact O-OG1 3.45Å; D263-T287 WeakPolarHBondContact OD1-CB 3.31Å; D263-T287 WeakPolarHBondContact OD1-CG2 3.35Å; D263-T287 PolarHBondContact OD1-OG1 2.78Å; D263-M288 PolarHBondContact O-N 3Å
264	R	98.6	Very high	97.6	Very high	94 Å²	94	45.5 Å²	45.5	36%	0.355	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	126.7	-171	-45.3	-170.1	-177.8	-169.9	-6.7	113.1	S239 Q240 L241 L266 M288	S239-R264 PolarHBondContact O-N 2.96Å; Q240-R264 HydrophobicContact CB-CB 4.43Å; Q240-R264 HydrophobicContact CG-CB 4.2Å; Q240-R264 HydrophobicContact CG-CG 4.12Å; L241-R264 PolarHBondContact N-O 2.77Å; R264-L266 HydrophobicContact CB-CD1 3.86Å; R264-M288 HydrophobicContact CB-CB 4.36Å; R264-M288 HydrophobicContact CG-CB 4.17Å
265	L	98.6	Very high	97.6	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	110.1	176.1	-178.1	54.1	0	0	0	110.4	L241 L243 F256 L262 L267 F280 L283 L286 M288 L289 F290	L241-L265 HydrophobicContact CB-CD1 4.15Å; L241-L265 HydrophobicContact CD2-CD1 3.98Å; L241-L265 HydrophobicContact CG-CD1 4.06Å; L243-L265 HydrophobicContact CD1-CD1 4.42Å; F256-L265 HydrophobicContact CD2-CD2 4.25Å; F256-L265 HydrophobicContact CE1-CD1 4.1Å; F256-L265 HydrophobicContact CE1-CD2 4.47Å; F256-L265 HydrophobicContact CE2-CD2 3.99Å; F256-L265 HydrophobicContact CZ-CD1 4.17Å; F256-L265 HydrophobicContact CZ-CD2 4.12Å; L262-L265 HydrophobicContact CD2-CB 3.98Å; L262-L265 HydrophobicContact CD2-CD1 4.35Å; L262-L265 HydrophobicContact CD2-CD2 4.39Å; L262-L265 HydrophobicContact CD2-CG 4.47Å; L265-L267 HydrophobicContact CD1-CD1 3.98Å; L265-L267 HydrophobicContact CD1-CG 3.94Å; L265-L267 HydrophobicContact CD2-CD1 3.76Å; L265-L267 HydrophobicContact CG-CD1 3.69Å; L265-L267 HydrophobicContact CG-CG 4.01Å; L265-F280 HydrophobicContact CD2-CE1 4.4Å; L265-L283 HydrophobicContact CD2-CD1 3.84Å; L265-L286 HydrophobicContact CB-CD1 3.73Å; L265-L286 HydrophobicContact CB-CD2 4.41Å; L265-M288 PolarHBondContact N-O 3.04Å; L265-L289 HydrophobicContact CB-CD1 4.11Å; L265-L289 HydrophobicContact CD2-CD1 4.06Å; L265-L289 HydrophobicContact CG-CD1 4.07Å; L265-F290 PolarHBondContact O-N 2.83Å
266	L	98.7	Very high	97.6	Very high	16 Å²	16	47.2 Å²	47.2	8%	0.084	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	100.1	-176.7	-68.2	84.6	0	0	0	109.9	L241 F242 L243 H244 R264 F290	L241-L266 PolarHBondContact O-N 2.97Å; F242-L266 HydrophobicContact CD1-CB 4.29Å; F242-L266 HydrophobicContact CD1-CD1 3.96Å; F242-L266 HydrophobicContact CD1-CD2 3.9Å; F242-L266 HydrophobicContact CD1-CG 4.28Å; F242-L266 HydrophobicContact CE1-CD1 3.86Å; F242-L266 HydrophobicContact CE1-CD2 3.88Å; F242-L266 HydrophobicContact CE1-CG 4.43Å; L243-L266 CarbonylContact C-O 3.02Å; L243-L266 WeakPolarHBondContact CA-O 3.45Å; L243-L266 PolarHBondContact N-O 3Å; H244-L266 PolarHBondContact N-O 3.03Å; R264-L266 HydrophobicContact CB-CD1 3.86Å; L266-F290 HydrophobicContact CD2-CD2 3.87Å; L266-F290 HydrophobicContact CD2-CE2 4.17Å; L266-F290 HydrophobicContact CG-CD2 4.06Å
267	L	98.5	Very high	97.4	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	24%	0.241	C	C	.	.			trans	-115.8	12.9	-176.1	-76.3	165.4	0	0	0	113.1	L243 I248 L251 F256 L265 N270 I272 F290 L291 N294	L243-L267 HydrophobicContact CB-CD2 3.73Å; L243-L267 HydrophobicContact CD1-CD2 3.83Å; L243-L267 HydrophobicContact CG-CD2 4.45Å; I248-L267 HydrophobicContact CD1-CD2 4.46Å; L251-L267 HydrophobicContact CD1-CD1 4.04Å; F256-L267 HydrophobicContact CE2-CD1 4.12Å; F256-L267 HydrophobicContact CZ-CD1 3.91Å; F256-L267 HydrophobicContact CZ-CD2 4.24Å; L265-L267 HydrophobicContact CD1-CD1 3.98Å; L265-L267 HydrophobicContact CD1-CG 3.94Å; L265-L267 HydrophobicContact CD2-CD1 3.76Å; L265-L267 HydrophobicContact CG-CD1 3.69Å; L265-L267 HydrophobicContact CG-CG 4.01Å; L267-N270 PolarHBondContact O-ND2 2.96Å; L267-I272 HydrophobicContact CB-CD1 4.05Å; L267-I272 HydrophobicContact CD2-CD1 4.23Å; L267-F290 CarbonylContact C-O 3.55Å; L267-F290 WeakPolarHBondContact CA-O 3.3Å; L267-F290 PolarHBondContact N-O 2.96Å; L267-L291 HydrophobicContact CB-CD2 3.81Å; L267-L291 HydrophobicContact CD1-CD2 3.97Å; L267-N294 PolarHBondContact O-ND2 2.81Å
268	H	98.4	Very high	97.4	Very high	19 Å²	19	55.2 Å²	55.2	9%	0.088	25%	0.245	C	C	.	.			trans	-67.6	168.9	178.6	61.3	-83.9	0	0	0	112.4	H244 G245 N270 F290 F292	H244-H268 WeakPolarHBondContact CA-O 3.5Å; H244-H268 WeakPolarHBondContact CB-CE1 3.39Å; H244-H268 WeakPolarHBondContact CB-NE2 3.45Å; H244-H268 VanDerWaalsContact CB-O 3.23Å; H244-H268 WeakPolarHBondContact CB-O 3.34Å; H244-H268 AromaticContact CD2-CE1 3.79Å; H244-H268 AromaticContact CD2-NE2 3.47Å; H244-H268 PolarHBondContact CD2-NE2 3.34Å; H244-H268 AromaticContact CG-CE1 3.36Å; H244-H268 AromaticContact CG-NE2 3.46Å; H244-H268 AromaticContact ND1-CE1 3.74Å; G245-H268 PolarHBondContact N-O 2.84Å; H268-N270 VanDerWaalsContact C-N 3.28Å; H268-N270 PolarHBondContact O-N 3.13Å; H268-N270 PolarHBondContact O-ND2 3.43Å; H268-F290 HydrophobicContact CB-CB 4.29Å; H268-F290 PolarHBondContact N-O 3.46Å; H268-F290 VanDerWaalsContact N-O 3.11Å; H268-F290 AromaticContact ND1-CD2 3.87Å; H268-F292 WeakPolarHBondContact CA-O 2.89Å; H268-F292 HydrophobicContact CB-CD1 3.53Å; H268-F292 HydrophobicContact CB-CD2 3.91Å; H268-F292 HydrophobicContact CB-CE1 3.44Å; H268-F292 VanDerWaalsContact CB-CE1 3.44Å; H268-F292 HydrophobicContact CB-CE2 3.8Å; H268-F292 HydrophobicContact CB-CG 3.78Å; H268-F292 HydrophobicContact CB-CZ 3.58Å; H268-F292 WeakPolarHBondContact CB-O 3.36Å; H268-F292 AromaticContact CD2-CE1 3.74Å; H268-F292 AromaticContact CD2-CE2 3.71Å; H268-F292 AromaticContact CD2-CZ 3.18Å; H268-F292 WeakPolarHBondContact CD2-CZ 3.39Å; H268-F292 AromaticContact CG-CE1 3.41Å; H268-F292 VanDerWaalsContact CG-CE1 3.41Å; H268-F292 AromaticContact CG-CE2 3.97Å; H268-F292 AromaticContact CG-CZ 3.36Å; H268-F292 AromaticContact ND1-CE1 3.84Å; H268-F292 AromaticContact NE2-CZ 3.84Å
269	D	98.4	Very high	97.5	Very high	64 Å²	64	54.6 Å²	54.6	34%	0.342	24%	0.239	S	C	.	.	S	Bend	trans	50.9	47.2	-178.7	-58.3	-32.4	0	0	0	112.5	G245 N246 F292 N293	G245-D269 CarbonylContact C-O 3.41Å; G245-D269 WeakPolarHBondContact CA-O 3.43Å; G245-D269 PolarHBondContact N-O 3.28Å; N246-D269 PolarHBondContact N-O 3.18Å; D269-F292 PolarHBondContact N-O 2.81Å; D269-N293 WeakPolarHBondContact CA-O 3.46Å; D269-N293 PolarHBondContact N-O 2.88Å; D269-N293 VanDerWaalsContact OD1-CB 3.27Å; D269-N293 WeakPolarHBondContact OD1-CB 3.49Å; D269-N293 PolarHBondContact OD1-ND2 2.72Å
270	N	98.7	Very high	97.4	Very high	11 Å²	11	54.7 Å²	54.7	6%	0.059	24%	0.239	C	C	.	.	S	Bend	trans	-124.4	-163.7	178.3	-93.9	-87	0	0	0	109.8	L243 N246 R247 I248 L267 H268 I272 N293 N294	L243-N270 PolarHBondContact O-ND2 3.43Å; N246-N270 WeakPolarHBondContact CA-OD1 3.23Å; N246-N270 WeakPolarHBondContact CB-OD1 3.39Å; N246-N270 PolarHBondContact O-OD1 2.6Å; R247-N270 PolarHBondContact N-OD1 3.35Å; I248-N270 WeakPolarHBondContact CB-OD1 3.19Å; I248-N270 WeakPolarHBondContact CG1-OD1 3.1Å; I248-N270 PolarHBondContact N-OD1 3.1Å; L267-N270 PolarHBondContact O-ND2 2.96Å; H268-N270 VanDerWaalsContact C-N 3.28Å; H268-N270 PolarHBondContact O-N 3.13Å; H268-N270 PolarHBondContact O-ND2 3.43Å; N270-I272 HydrophobicContact CB-CD1 4.23Å; N270-I272 HydrophobicContact CB-CG1 4.08Å; N270-N293 PolarHBondContact N-O 3.21Å; N270-N294 WeakPolarHBondContact CA-OD1 3.38Å; N270-N294 WeakPolarHBondContact CB-OD1 3.22Å
271	R	97.9	Very high	97.4	Very high	135 Å²	135	56 Å²	56	51%	0.509	24%	0.237	S	C	.	.			trans	-126.8	29.1	179.9	-58	-175.8	-175.4	-172	0.2	111.6	I248 R249 R273 N294	I248-R271 CarbonylContact O-C 3.54Å; I248-R271 VanDerWaalsContact O-CA 3.31Å; I248-R271 WeakPolarHBondContact O-CA 3.41Å; I248-R271 PolarHBondContact O-N 3.24Å; R249-R271 WeakPolarHBondContact CA-O 3.37Å; R271-R273 PolarHBondContact O-N 2.93Å; R271-N294 PolarHBondContact N-OD1 3.36Å
272	I	98.4	Very high	97.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	24%	0.235	C	C	.	.			trans	-66.5	121.3	-172.9	-56.1	164.9	0	0	0	108.3	I248 R249 L251 L267 N270 V275 L291 N294 S295 L296	I248-I272 HydrophobicContact CB-CG1 4.43Å; I248-I272 HydrophobicContact CG2-CG1 4.26Å; I248-I272 PolarHBondContact O-N 2.81Å; I248-I272 VanDerWaalsContact O-N 3.08Å; R249-I272 WeakPolarHBondContact O-CA 3.06Å; L251-I272 HydrophobicContact CD1-CD1 4.24Å; L251-I272 HydrophobicContact CD1-CG2 4.32Å; L251-I272 HydrophobicContact CG-CD1 4.43Å; L251-I272 HydrophobicContact CG-CG2 4.18Å; L267-I272 HydrophobicContact CB-CD1 4.05Å; L267-I272 HydrophobicContact CD2-CD1 4.23Å; N270-I272 HydrophobicContact CB-CD1 4.23Å; N270-I272 HydrophobicContact CB-CG1 4.08Å; I272-V275 HydrophobicContact CG2-CG2 4.14Å; I272-L291 HydrophobicContact CD1-CD2 4.27Å; I272-N294 HydrophobicContact CB-CB 4.47Å; I272-N294 WeakPolarHBondContact CB-OD1 3.44Å; I272-N294 VanDerWaalsContact CG1-OD1 3.3Å; I272-N294 WeakPolarHBondContact CG1-OD1 3.29Å; I272-N294 PolarHBondContact N-OD1 2.79Å; I272-S295 CarbonylContact O-C 3.4Å; I272-S295 VanDerWaalsContact O-CA 3.26Å; I272-S295 WeakPolarHBondContact O-CA 3.24Å; I272-S295 PolarHBondContact O-N 3.23Å; I272-L296 HydrophobicContact CB-CD2 4.4Å; I272-L296 HydrophobicContact CG2-CD2 3.82Å; I272-L296 PolarHBondContact O-N 3.16Å; I272-L296 VanDerWaalsContact O-N 3.16Å
273	R	96.8	Very high	97.2	Very high	169 Å²	169	55.7 Å²	55.7	64%	0.638	24%	0.235	S	C	*	.			trans	-104.7	-32	178.7	-69.4	176	179.6	-172.4	-3.9	112.9	R249 R271	R249-R273 PolarHBondContact O-N 2.69Å; R271-R273 PolarHBondContact O-N 2.93Å
274	Q	95.2	Very high	97	Very high	137 Å²	137	56.2 Å²	56.2	64%	0.64	25%	0.25	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-140.6	140.9	-174.4	-70.3	178	-30.6	0	0	110.3	T250 L251	T250-Q274 WeakPolarHBondContact CA-O 3.5Å; T250-Q274 HydrophobicContact CG2-CB 4.49Å; L251-Q274 PolarHBondContact N-O 2.93Å; L251-Q274 VanDerWaalsContact N-O 3.1Å
275	V	97.3	Very high	96.9	Very high	12 Å²	12	59.3 Å²	59.3	7%	0.073	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	126	174.6	-172.6	0	0	0	0	107.1	L251 I272 A279 F280 L296 L299 P300 T303	L251-V275 HydrophobicContact CB-CG1 4.21Å; L251-V275 HydrophobicContact CD1-CG1 4.08Å; L251-V275 HydrophobicContact CD1-CG2 4.07Å; I272-V275 HydrophobicContact CG2-CG2 4.14Å; V275-A279 HydrophobicContact CG1-CB 3.92Å; V275-F280 HydrophobicContact CG1-CE1 4.35Å; V275-F280 HydrophobicContact CG1-CE2 4.48Å; V275-F280 HydrophobicContact CG1-CZ 4.07Å; V275-L296 HydrophobicContact CG2-CD2 3.79Å; V275-L299 HydrophobicContact CB-CD1 4.44Å; V275-L299 HydrophobicContact CG2-CD1 4.18Å; V275-P300 WeakPolarHBondContact O-CG 3.36Å; V275-T303 HydrophobicContact CG1-CG2 4.07Å
276	N	96.8	Very high	96.9	Very high	56 Å²	56	59.3 Å²	59.3	30%	0.299	26%	0.261	S	S	.	.			trans	-63.3	141.9	173.9	-176.9	-57.6	0	0	0	109.8	L251 R278 A279 T303	L251-N276 WeakPolarHBondContact O-CB 3.19Å; L251-N276 PolarHBondContact O-N 3.44Å; N276-R278 PolarHBondContact O-N 2.9Å; N276-R278 PolarHBondContact OD1-N 3.23Å; N276-A279 HydrophobicContact CB-CB 4.27Å; N276-A279 VanDerWaalsContact O-CB 3.28Å; N276-A279 WeakPolarHBondContact O-CB 3.4Å; N276-A279 PolarHBondContact O-N 3.47Å; N276-T303 WeakPolarHBondContact O-CG2 3.45Å
277	R	94.6	Very high	96.8	Very high	148 Å²	148	60 Å²	60	56%	0.558	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-27.2	-179.3	-63.4	-176.7	177	-178.7	-0.7	114.2	P300 Q302 T303 S374	R277-P300 HydrophobicContact CB-CB 4.42Å; R277-P300 HydrophobicContact CG-CB 3.81Å; R277-P300 HydrophobicContact CG-CG 4.22Å; R277-Q302 HydrophobicContact CB-CB 4.29Å; R277-Q302 VanDerWaalsContact O-CB 3.3Å; R277-Q302 WeakPolarHBondContact O-CB 3.15Å; R277-Q302 WeakPolarHBondContact O-CG 3.4Å; R277-T303 WeakPolarHBondContact O-CG2 3.37Å; R277-S374 PolarHBondContact NH1-OG 3.42Å
278	R	95.5	Very high	96.8	Very high	135 Å²	135	61.6 Å²	61.6	51%	0.509	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108	3.5	-178.6	-69.7	170.4	178.7	168	1.6	113.9	E253 N276 F280 R281	E253-R278 HydrophobicContact CG-CB 3.94Å; E253-R278 WeakPolarHBondContact OE1-CD 3.38Å; E253-R278 IonicContact OE1-CZ 2.75Å; E253-R278 IonicContact OE1-NE 3.7Å; E253-R278 IonicContact OE1-NH1 3.35Å; E253-R278 PolarHBondContact OE1-NH1 3.35Å; E253-R278 IonicContact OE2-NH1 2.81Å; N276-R278 PolarHBondContact O-N 2.9Å; N276-R278 PolarHBondContact OD1-N 3.23Å; R278-F280 PolarHBondContact O-N 2.96Å; R278-R281 VanDerWaalsContact O-CB 3.29Å; R278-R281 WeakPolarHBondContact O-CB 3.38Å; R278-R281 PolarHBondContact O-N 3.07Å
279	A	96.8	Very high	96.8	Very high	3 Å²	3	60.8 Å²	60.8	3%	0.025	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-23.7	-176	0	0	0	0	0	113.9	L251 S252 V275 N276	L251-A279 HydrophobicContact CB-CB 4.38Å; S252-A279 VanDerWaalsContact O-CB 3.3Å; S252-A279 WeakPolarHBondContact O-CB 3.22Å; V275-A279 HydrophobicContact CG1-CB 3.92Å; N276-A279 HydrophobicContact CB-CB 4.27Å; N276-A279 VanDerWaalsContact O-CB 3.28Å; N276-A279 WeakPolarHBondContact O-CB 3.4Å; N276-A279 PolarHBondContact O-N 3.47Å
280	F	96.7	Very high	96.8	Very high	2 Å²	2	59 Å²	59	1%	0.009	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	11.1	-179.6	-57.2	-20.5	0	0	0	113.8	L251 F256 L265 V275 R278 D282 L283 L289 T303 D306 T307	L251-F280 HydrophobicContact CD1-CE1 4.21Å; L251-F280 HydrophobicContact CD1-CZ 4.38Å; F256-F280 AromaticContact CD2-CD1 4Å; F256-F280 HydrophobicContact CD2-CD1 4Å; F256-F280 HydrophobicContact CD2-CE1 4Å; F256-F280 HydrophobicContact CE2-CD1 4.41Å; F256-F280 AromaticContact CE2-CE1 3.94Å; F256-F280 HydrophobicContact CE2-CE1 3.94Å; L265-F280 HydrophobicContact CD2-CE1 4.4Å; V275-F280 HydrophobicContact CG1-CE1 4.35Å; V275-F280 HydrophobicContact CG1-CE2 4.48Å; V275-F280 HydrophobicContact CG1-CZ 4.07Å; R278-F280 PolarHBondContact O-N 2.96Å; F280-D282 PolarHBondContact O-N 2.75Å; F280-D282 VanDerWaalsContact O-N 3.09Å; F280-L283 HydrophobicContact CB-CB 4.36Å; F280-L283 HydrophobicContact CB-CD1 3.92Å; F280-L283 HydrophobicContact CB-CG 4.31Å; F280-L283 HydrophobicContact CD1-CD1 3.59Å; F280-L283 HydrophobicContact CE1-CD1 4.39Å; F280-L283 HydrophobicContact CG-CD1 3.93Å; F280-L283 WeakPolarHBondContact O-CB 3.41Å; F280-L283 PolarHBondContact O-N 3.36Å; F280-L289 HydrophobicContact CD2-CD2 4.48Å; F280-L289 HydrophobicContact CE2-CD2 3.81Å; F280-L289 HydrophobicContact CZ-CD2 4.29Å; F280-T303 HydrophobicContact CD2-CG2 4.37Å; F280-D306 WeakPolarHBondContact O-CB 3.35Å; F280-T307 HydrophobicContact CB-CG2 3.68Å; F280-T307 HydrophobicContact CD2-CG2 3.94Å; F280-T307 HydrophobicContact CG-CG2 4.15Å
281	R	95.6	Very high	96.8	Very high	95 Å²	95	58.4 Å²	58.4	36%	0.358	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-39.4	-174.1	-175.6	-168	66.9	-133.8	-13.5	113.8	R278 D306	R278-R281 VanDerWaalsContact O-CB 3.29Å; R278-R281 WeakPolarHBondContact O-CB 3.38Å; R278-R281 PolarHBondContact O-N 3.07Å; R281-D306 WeakPolarHBondContact CA-OD2 3.33Å
282	D	95.9	Very high	96.8	Very high	35 Å²	35	53.6 Å²	53.6	19%	0.187	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-4.3	-175.1	-57.4	-1	0	0	0	112.3	R257 G258 F280 G284	R257-D282 WeakPolarHBondContact CA-OD2 3.2Å; R257-D282 VanDerWaalsContact CG-OD2 3.32Å; R257-D282 WeakPolarHBondContact CG-OD2 2.97Å; G258-D282 PolarHBondContact N-OD2 2.9Å; F280-D282 PolarHBondContact O-N 2.75Å; F280-D282 VanDerWaalsContact O-N 3.09Å; D282-G284 PolarHBondContact O-N 2.84Å
283	L	96.6	Very high	96.8	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	26%	0.26	C	S	.	.			trans	-85.1	39.3	-173.8	-59.1	-174.2	0	0	0	113.9	F256 L259 L262 L265 F280 R285 L286 T307	F256-L283 HydrophobicContact CB-CD1 4.3Å; F256-L283 HydrophobicContact CB-CD2 4.17Å; F256-L283 HydrophobicContact CB-CG 4.4Å; F256-L283 HydrophobicContact CD2-CD1 4.35Å; F256-L283 HydrophobicContact CG-CD1 4.48Å; L259-L283 HydrophobicContact CB-CD2 3.69Å; L262-L283 HydrophobicContact CB-CD2 4.17Å; L262-L283 HydrophobicContact CD2-CD2 3.79Å; L265-L283 HydrophobicContact CD2-CD1 3.84Å; F280-L283 HydrophobicContact CB-CB 4.36Å; F280-L283 HydrophobicContact CB-CD1 3.92Å; F280-L283 HydrophobicContact CB-CG 4.31Å; F280-L283 HydrophobicContact CD1-CD1 3.59Å; F280-L283 HydrophobicContact CE1-CD1 4.39Å; F280-L283 HydrophobicContact CG-CD1 3.93Å; F280-L283 WeakPolarHBondContact O-CB 3.41Å; F280-L283 PolarHBondContact O-N 3.36Å; L283-R285 PolarHBondContact O-N 3.1Å; L283-R285 VanDerWaalsContact O-N 3.13Å; L283-L286 HydrophobicContact CB-CB 4.26Å; L283-L286 HydrophobicContact CD1-CD2 4.26Å; L283-L286 VanDerWaalsContact O-CB 3.32Å; L283-L286 WeakPolarHBondContact O-CB 3.49Å; L283-L286 PolarHBondContact O-N 3.42Å; L283-T307 HydrophobicContact CB-CG2 4.24Å
284	G	93.9	Very high	96.9	Very high	50 Å²	50	50 Å²	50	52%	0.515	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-16.6	-173	0	0	0	0	0	115.6	D282	D282-G284 PolarHBondContact O-N 2.84Å
285	R	96.3	Very high	97	Very high	158 Å²	158	45.6 Å²	45.6	60%	0.596	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.9	4.9	179.2	-66.2	-169.9	62.1	-173.1	1	114.5	V260 N261 L262 L283 T287	V260-R285 WeakPolarHBondContact O-CD 3.47Å; V260-R285 WeakPolarHBondContact O-CG 3.4Å; N261-R285 PolarHBondContact OD1-NH1 2.8Å; L262-R285 CarbonylContact O-C 3.51Å; L262-R285 VanDerWaalsContact O-C 3.22Å; L283-R285 PolarHBondContact O-N 3.1Å; L283-R285 VanDerWaalsContact O-N 3.13Å; R285-T287 PolarHBondContact O-N 2.94Å
286	L	97.7	Very high	97	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.214	C	C	.	.			trans	-71.2	118.7	-173.7	-169.2	75.7	0	0	0	112.2	L262 D263 L265 L283 L289 T307 G309 I310	L262-L286 HydrophobicContact CD2-CD1 4.07Å; L262-L286 HydrophobicContact CG-CD1 4.15Å; L262-L286 WeakPolarHBondContact O-CA 3.3Å; L262-L286 PolarHBondContact O-N 2.74Å; D263-L286 WeakPolarHBondContact O-CD1 3.21Å; L265-L286 HydrophobicContact CB-CD1 3.73Å; L265-L286 HydrophobicContact CB-CD2 4.41Å; L283-L286 HydrophobicContact CB-CB 4.26Å; L283-L286 HydrophobicContact CD1-CD2 4.26Å; L283-L286 VanDerWaalsContact O-CB 3.32Å; L283-L286 WeakPolarHBondContact O-CB 3.49Å; L283-L286 PolarHBondContact O-N 3.42Å; L286-L289 HydrophobicContact CD2-CB 4.03Å; L286-L289 HydrophobicContact CD2-CD1 4.36Å; L286-L289 HydrophobicContact CD2-CD2 4.39Å; L286-L289 HydrophobicContact CD2-CG 4.49Å; L286-T307 HydrophobicContact CD2-CG2 4.21Å; L286-G309 CarbonylContact O-C 3.2Å; L286-I310 HydrophobicContact CD2-CD1 4.31Å; L286-I310 HydrophobicContact CD2-CG1 4.49Å; L286-I310 WeakPolarHBondContact O-CA 3.05Å; L286-I310 WeakPolarHBondContact O-CG1 3.5Å; L286-I310 PolarHBondContact O-N 3.05Å
287	T	97.4	Very high	97	Very high	31 Å²	31	44.3 Å²	44.3	19%	0.19	22%	0.216	C	C	.	.			trans	-98.7	-30.2	176.7	68.4	0	0	0	0	112.5	D263 R285 E311 F312	D263-T287 PolarHBondContact O-N 2.97Å; D263-T287 PolarHBondContact O-OG1 3.45Å; D263-T287 WeakPolarHBondContact OD1-CB 3.31Å; D263-T287 WeakPolarHBondContact OD1-CG2 3.35Å; D263-T287 PolarHBondContact OD1-OG1 2.78Å; R285-T287 PolarHBondContact O-N 2.94Å; T287-E311 PolarHBondContact O-N 3.01Å; T287-F312 PolarHBondContact O-N 3.22Å
288	M	98.4	Very high	97	Very high	34 Å²	34	42 Å²	42	17%	0.167	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	117.5	-173.9	-173.9	173.5	-67.1	0	0	112.5	D263 R264 L265 F290 F312	D263-M288 PolarHBondContact O-N 3Å; R264-M288 HydrophobicContact CB-CB 4.36Å; R264-M288 HydrophobicContact CG-CB 4.17Å; L265-M288 PolarHBondContact N-O 3.04Å; M288-F290 HydrophobicContact CG-CD1 4.06Å; M288-F290 HydrophobicContact CG-CE1 3.62Å; M288-F290 HydrophobicContact CG-CZ 4.03Å; M288-F290 HydrophobicContact SD-CE1 3.85Å; M288-F290 HydrophobicContact SD-CE2 4.25Å; M288-F290 HydrophobicContact SD-CZ 3.61Å; M288-F312 WeakPolarHBondContact CA-O 3.43Å; M288-F312 HydrophobicContact CB-CB 4.45Å; M288-F312 HydrophobicContact CE-CB 4.11Å; M288-F312 HydrophobicContact CE-CD2 4Å; M288-F312 HydrophobicContact CE-CG 4.1Å; M288-F312 HydrophobicContact CG-CB 4.15Å
289	L	98	Very high	97	Very high	2 Å²	2	36 Å²	36	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	114	178.1	179.5	56.9	0	0	0	111.2	L265 F280 L286 L291 I310 F312 L313 R314	L265-L289 HydrophobicContact CB-CD1 4.11Å; L265-L289 HydrophobicContact CD2-CD1 4.06Å; L265-L289 HydrophobicContact CG-CD1 4.07Å; F280-L289 HydrophobicContact CD2-CD2 4.48Å; F280-L289 HydrophobicContact CE2-CD2 3.81Å; F280-L289 HydrophobicContact CZ-CD2 4.29Å; L286-L289 HydrophobicContact CD2-CB 4.03Å; L286-L289 HydrophobicContact CD2-CD1 4.36Å; L286-L289 HydrophobicContact CD2-CD2 4.39Å; L286-L289 HydrophobicContact CD2-CG 4.49Å; L289-L291 HydrophobicContact CD1-CD1 4.23Å; L289-L291 HydrophobicContact CD1-CG 4.01Å; L289-L291 HydrophobicContact CD2-CD1 3.9Å; L289-L291 HydrophobicContact CG-CD1 4.03Å; L289-L291 HydrophobicContact CG-CG 4.11Å; L289-I310 HydrophobicContact CB-CD1 3.97Å; L289-I310 HydrophobicContact CD2-CD1 3.91Å; L289-F312 PolarHBondContact N-O 3.36Å; L289-L313 HydrophobicContact CB-CD1 3.95Å; L289-L313 HydrophobicContact CD2-CD1 3.94Å; L289-L313 HydrophobicContact CG-CD1 3.98Å; L289-L313 WeakPolarHBondContact O-CA 3.46Å; L289-R314 PolarHBondContact O-N 3.22Å
290	F	98.5	Very high	96.8	Very high	25 Å²	25	36.8 Å²	36.8	11%	0.11	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	112.3	174.9	-68.4	-2.9	0	0	0	110.5	L265 L266 L267 H268 M288 F292 R314	L265-F290 PolarHBondContact O-N 2.83Å; L266-F290 HydrophobicContact CD2-CD2 3.87Å; L266-F290 HydrophobicContact CD2-CE2 4.17Å; L266-F290 HydrophobicContact CG-CD2 4.06Å; L267-F290 CarbonylContact C-O 3.55Å; L267-F290 WeakPolarHBondContact CA-O 3.3Å; L267-F290 PolarHBondContact N-O 2.96Å; H268-F290 HydrophobicContact CB-CB 4.29Å; H268-F290 PolarHBondContact N-O 3.46Å; H268-F290 VanDerWaalsContact N-O 3.11Å; H268-F290 AromaticContact ND1-CD2 3.87Å; M288-F290 HydrophobicContact CG-CD1 4.06Å; M288-F290 HydrophobicContact CG-CE1 3.62Å; M288-F290 HydrophobicContact CG-CZ 4.03Å; M288-F290 HydrophobicContact SD-CE1 3.85Å; M288-F290 HydrophobicContact SD-CE2 4.25Å; M288-F290 HydrophobicContact SD-CZ 3.61Å; F290-F292 HydrophobicContact CB-CD1 4.01Å; F290-F292 HydrophobicContact CB-CE1 4Å; F290-F292 AromaticContact CD2-CE1 3.83Å; F290-F292 HydrophobicContact CD2-CE1 3.83Å; F290-F292 HydrophobicContact CG-CD1 4.28Å; F290-F292 HydrophobicContact CG-CE1 4.02Å; F290-R314 HydrophobicContact CD1-CB 3.78Å; F290-R314 HydrophobicContact CD1-CG 3.67Å; F290-R314 HydrophobicContact CE1-CB 4.35Å; F290-R314 HydrophobicContact CE1-CG 3.71Å; F290-R314 HydrophobicContact CG-CB 4.28Å; F290-R314 HydrophobicContact CG-CG 4.43Å; F290-R314 HydrophobicContact CZ-CG 4.48Å
291	L	98.2	Very high	96.5	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.208	C	C	.	.			trans	-119.3	9.6	175.8	-71.2	167.2	0	0	0	112.4	L267 I272 L289 N294 L296 L299 R314 L315 N318	L267-L291 HydrophobicContact CB-CD2 3.81Å; L267-L291 HydrophobicContact CD1-CD2 3.97Å; I272-L291 HydrophobicContact CD1-CD2 4.27Å; L289-L291 HydrophobicContact CD1-CD1 4.23Å; L289-L291 HydrophobicContact CD1-CG 4.01Å; L289-L291 HydrophobicContact CD2-CD1 3.9Å; L289-L291 HydrophobicContact CG-CD1 4.03Å; L289-L291 HydrophobicContact CG-CG 4.11Å; L291-N294 WeakPolarHBondContact O-CB 3.32Å; L291-N294 PolarHBondContact O-ND2 2.98Å; L291-N294 VanDerWaalsContact O-ND2 3.09Å; L291-L296 HydrophobicContact CB-CD1 4.1Å; L291-L296 HydrophobicContact CD1-CD1 4.32Å; L291-L296 HydrophobicContact CD2-CD1 4.5Å; L291-L299 HydrophobicContact CD1-CD1 4.42Å; L291-R314 CarbonylContact C-O 3.58Å; L291-R314 WeakPolarHBondContact CA-O 3.19Å; L291-R314 PolarHBondContact N-O 2.82Å; L291-L315 HydrophobicContact CB-CD2 4.09Å; L291-L315 HydrophobicContact CD1-CD2 4.23Å; L291-N318 PolarHBondContact O-ND2 2.04Å
292	F	98.3	Very high	96.2	Very high	34 Å²	34	37.3 Å²	37.3	15%	0.149	21%	0.206	C	C	.	.			trans	-64.1	158.1	-179.7	72.7	-94.4	0	0	0	112.7	H268 D269 F290 N294 R314 N316	H268-F292 WeakPolarHBondContact CA-O 2.89Å; H268-F292 HydrophobicContact CB-CD1 3.53Å; H268-F292 HydrophobicContact CB-CD2 3.91Å; H268-F292 HydrophobicContact CB-CE1 3.44Å; H268-F292 VanDerWaalsContact CB-CE1 3.44Å; H268-F292 HydrophobicContact CB-CE2 3.8Å; H268-F292 HydrophobicContact CB-CG 3.78Å; H268-F292 HydrophobicContact CB-CZ 3.58Å; H268-F292 WeakPolarHBondContact CB-O 3.36Å; H268-F292 AromaticContact CD2-CE1 3.74Å; H268-F292 AromaticContact CD2-CE2 3.71Å; H268-F292 AromaticContact CD2-CZ 3.18Å; H268-F292 WeakPolarHBondContact CD2-CZ 3.39Å; H268-F292 AromaticContact CG-CE1 3.41Å; H268-F292 VanDerWaalsContact CG-CE1 3.41Å; H268-F292 AromaticContact CG-CE2 3.97Å; H268-F292 AromaticContact CG-CZ 3.36Å; H268-F292 AromaticContact ND1-CE1 3.84Å; H268-F292 AromaticContact NE2-CZ 3.84Å; D269-F292 PolarHBondContact N-O 2.81Å; F290-F292 HydrophobicContact CB-CD1 4.01Å; F290-F292 HydrophobicContact CB-CE1 4Å; F290-F292 AromaticContact CD2-CE1 3.83Å; F290-F292 HydrophobicContact CD2-CE1 3.83Å; F290-F292 HydrophobicContact CG-CD1 4.28Å; F290-F292 HydrophobicContact CG-CE1 4.02Å; F292-N294 PolarHBondContact O-ND2 2.85Å; F292-R314 HydrophobicContact CB-CB 4.25Å; F292-R314 HydrophobicContact CD1-CB 3.64Å; F292-R314 HydrophobicContact CD1-CG 4.42Å; F292-R314 HydrophobicContact CE1-CB 4.49Å; F292-R314 HydrophobicContact CG-CB 4.37Å; F292-R314 PolarHBondContact N-O 2.97Å; F292-R314 VanDerWaalsContact N-O 3.11Å; F292-N316 CarbonylContact C-O 3.58Å; F292-N316 WeakPolarHBondContact CA-O 3.46Å; F292-N316 WeakPolarHBondContact CB-O 3.43Å; F292-N316 WeakPolarHBondContact CB-OD1 3.35Å
293	N	98.3	Very high	96.1	Very high	81 Å²	81	35.7 Å²	35.7	43%	0.433	20%	0.197	S	C	.	.	S	Bend	trans	51.1	62.5	-176	-163.5	25.5	0	0	0	112.6	D269 N270 N316 A317	D269-N293 WeakPolarHBondContact CA-O 3.46Å; D269-N293 PolarHBondContact N-O 2.88Å; D269-N293 VanDerWaalsContact OD1-CB 3.27Å; D269-N293 WeakPolarHBondContact OD1-CB 3.49Å; D269-N293 PolarHBondContact OD1-ND2 2.72Å; N270-N293 PolarHBondContact N-O 3.21Å; N293-N316 PolarHBondContact N-O 3.11Å; N293-A317 WeakPolarHBondContact CA-O 3.23Å; N293-A317 HydrophobicContact CB-CB 4.21Å; N293-A317 PolarHBondContact N-O 3.19Å
294	N	98.7	Very high	95.7	Very high	11 Å²	11	35.9 Å²	35.9	6%	0.059	20%	0.198	C	C	.	.	S	Bend	trans	-133.9	-163.1	177.2	-92.8	-76.4	0	0	0	109.3	L267 N270 R271 I272 L291 F292 L296 A317 N318	L267-N294 PolarHBondContact O-ND2 2.81Å; N270-N294 WeakPolarHBondContact CA-OD1 3.38Å; N270-N294 WeakPolarHBondContact CB-OD1 3.22Å; R271-N294 PolarHBondContact N-OD1 3.36Å; I272-N294 HydrophobicContact CB-CB 4.47Å; I272-N294 WeakPolarHBondContact CB-OD1 3.44Å; I272-N294 VanDerWaalsContact CG1-OD1 3.3Å; I272-N294 WeakPolarHBondContact CG1-OD1 3.29Å; I272-N294 PolarHBondContact N-OD1 2.79Å; L291-N294 WeakPolarHBondContact O-CB 3.32Å; L291-N294 PolarHBondContact O-ND2 2.98Å; L291-N294 VanDerWaalsContact O-ND2 3.09Å; F292-N294 PolarHBondContact O-ND2 2.85Å; N294-L296 HydrophobicContact CB-CG 4.38Å; N294-A317 PolarHBondContact N-O 2.97Å; N294-N318 VanDerWaalsContact CA-OD1 3.28Å; N294-N318 WeakPolarHBondContact CA-OD1 3.33Å; N294-N318 WeakPolarHBondContact CB-OD1 3.49Å; N294-N318 PolarHBondContact N-OD1 3.33Å; N294-N318 PolarHBondContact O-OD1 3.01Å
295	S	98.1	Very high	95.5	Very high	45 Å²	45	39.2 Å²	39.2	32%	0.315	20%	0.195	S	C	.	.			trans	-120.6	29.8	179.6	-59.7	0	0	0	0	112.3	I272 N318	I272-S295 CarbonylContact O-C 3.4Å; I272-S295 VanDerWaalsContact O-CA 3.26Å; I272-S295 WeakPolarHBondContact O-CA 3.24Å; I272-S295 PolarHBondContact O-N 3.23Å; S295-N318 PolarHBondContact N-OD1 3.21Å
296	L	97.6	Very high	95.3	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.174	C	C	.	.			trans	-73	125.3	-178.5	-63.2	171.5	0	0	0	111.1	I272 V275 L291 N294 N318 P319 W320	I272-L296 HydrophobicContact CB-CD2 4.4Å; I272-L296 HydrophobicContact CG2-CD2 3.82Å; I272-L296 PolarHBondContact O-N 3.16Å; I272-L296 VanDerWaalsContact O-N 3.16Å; V275-L296 HydrophobicContact CG2-CD2 3.79Å; L291-L296 HydrophobicContact CB-CD1 4.1Å; L291-L296 HydrophobicContact CD1-CD1 4.32Å; L291-L296 HydrophobicContact CD2-CD1 4.5Å; N294-L296 HydrophobicContact CB-CG 4.38Å; L296-N318 HydrophobicContact CB-CB 4.29Å; L296-N318 WeakPolarHBondContact CB-OD1 3.43Å; L296-N318 PolarHBondContact N-OD1 2.81Å; L296-P319 CarbonylContact O-C 3.07Å; L296-P319 VanDerWaalsContact O-CD 3.24Å; L296-P319 WeakPolarHBondContact O-CD 3.38Å; L296-W320 HydrophobicContact CB-CH2 3.78Å; L296-W320 HydrophobicContact CB-CZ2 4.29Å; L296-W320 HydrophobicContact CB-CZ3 4.02Å; L296-W320 HydrophobicContact CD1-CH2 3.93Å; L296-W320 HydrophobicContact CD1-CZ2 4.43Å
297	A	96.3	Very high	95	Very high	42 Å²	42	33.1 Å²	33.1	35%	0.347	17%	0.174	S	C	.	.	S	Bend	trans	-92.7	-33.2	168.5	0	0	0	0	0	112	S321	A297-S321 PolarHBondContact O-N 2.93Å
298	E	94.9	Very high	94.4	Very high	100 Å²	100	39.7 Å²	39.7	47%	0.467	20%	0.203	S	C	.	.			trans	-141.7	161.4	179.7	60.1	170.2	-154.5	0	0	110.6	E325	E298-E325 HydrophobicContact CB-CG 4.5Å
299	L	95.1	Very high	94	Very high	9 Å²	9	39.8 Å²	39.8	5%	0.047	21%	0.213	C	C	.	.			trans	-130.5	121.3	171.1	-174.5	66.1	0	0	0	107.9	V275 L291 L304 W320	V275-L299 HydrophobicContact CB-CD1 4.44Å; V275-L299 HydrophobicContact CG2-CD1 4.18Å; L291-L299 HydrophobicContact CD1-CD1 4.42Å; L299-L304 HydrophobicContact CD2-CD2 3.76Å; L299-L304 HydrophobicContact CD2-CG 4.19Å; L299-W320 HydrophobicContact CB-CH2 4.22Å; L299-W320 HydrophobicContact CB-CZ3 4.06Å
300	P	92.9	Very high	93.8	Very high	18 Å²	18	40.3 Å²	40.3	12%	0.117	22%	0.215	C	C	.	.			trans	-68.8	142.8	-169.8	-16.9	28.4	0	0	0	113.4	V275 R277 Q302 T303	V275-P300 WeakPolarHBondContact O-CG 3.36Å; R277-P300 HydrophobicContact CB-CB 4.42Å; R277-P300 HydrophobicContact CG-CB 3.81Å; R277-P300 HydrophobicContact CG-CG 4.22Å; P300-Q302 PolarHBondContact O-N 3.27Å; P300-T303 HydrophobicContact CB-CG2 4.28Å; P300-T303 HydrophobicContact CG-CG2 4.23Å; P300-T303 PolarHBondContact O-N 3.22Å; P300-T303 PolarHBondContact O-OG1 3.06Å
301	S	89.2	Confident	93.7	Very high	43 Å²	43	44.4 Å²	44.4	30%	0.301	24%	0.235	S	C	.	.	H	α-helix	trans	-57.1	-27.9	-176.9	68.4	0	0	0	0	115	R305 A328	S301-R305 PolarHBondContact O-N 2.91Å; S301-R305 PolarHBondContact OG-NH1 3.23Å; S301-R305 PolarHBondContact OG-NH2 3.38Å; S301-A328 VanDerWaalsContact CB-CB 3.44Å
302	Q	90.8	Very high	93.7	Very high	66 Å²	66	48.6 Å²	48.6	31%	0.308	25%	0.253	S	S	.	.	H	α-helix	trans	-72.6	-38	178.8	-170.4	60.4	32.5	0	0	112.3	R277 P300 L304 R305 D306	R277-Q302 HydrophobicContact CB-CB 4.29Å; R277-Q302 VanDerWaalsContact O-CB 3.3Å; R277-Q302 WeakPolarHBondContact O-CB 3.15Å; R277-Q302 WeakPolarHBondContact O-CG 3.4Å; P300-Q302 PolarHBondContact O-N 3.27Å; Q302-L304 PolarHBondContact O-N 3.11Å; Q302-R305 PolarHBondContact O-N 3.44Å; Q302-D306 PolarHBondContact NE2-OD1 3.16Å; Q302-D306 VanDerWaalsContact O-CG 3.24Å; Q302-D306 PolarHBondContact O-N 2.96Å
303	T	92.1	Very high	93.6	Very high	1 Å²	1	47 Å²	47	1%	0.006	25%	0.246	C	C	.	.	H	α-helix	trans	-62.4	-32.3	-179.2	67	0	0	0	0	111.6	V275 N276 R277 F280 P300 T307	V275-T303 HydrophobicContact CG1-CG2 4.07Å; N276-T303 WeakPolarHBondContact O-CG2 3.45Å; R277-T303 WeakPolarHBondContact O-CG2 3.37Å; F280-T303 HydrophobicContact CD2-CG2 4.37Å; P300-T303 HydrophobicContact CB-CG2 4.28Å; P300-T303 HydrophobicContact CG-CG2 4.23Å; P300-T303 PolarHBondContact O-N 3.22Å; P300-T303 PolarHBondContact O-OG1 3.06Å; T303-T307 WeakPolarHBondContact O-CG2 3Å; T303-T307 PolarHBondContact O-N 2.89Å; T303-T307 PolarHBondContact O-OG1 3.14Å; T303-T307 VanDerWaalsContact O-OG1 3.09Å
304	L	88.6	Confident	93.6	Very high	4 Å²	4	48.4 Å²	48.4	2%	0.021	25%	0.245	C	C	.	.	H	α-helix	trans	-75.7	-28.5	174.5	-65.9	172.2	0	0	0	113.7	L299 Q302 L329 W332	L299-L304 HydrophobicContact CD2-CD2 3.76Å; L299-L304 HydrophobicContact CD2-CG 4.19Å; Q302-L304 PolarHBondContact O-N 3.11Å; L304-L329 HydrophobicContact CD1-CB 4.42Å; L304-L329 HydrophobicContact CD1-CD1 3.59Å; L304-L329 HydrophobicContact CD2-CD1 4.45Å; L304-W332 HydrophobicContact CB-CD2 4.35Å; L304-W332 HydrophobicContact CB-CG 4.1Å; L304-W332 HydrophobicContact CD1-CB 3.97Å; L304-W332 HydrophobicContact CD1-CD2 4.07Å; L304-W332 HydrophobicContact CD1-CE3 4.41Å; L304-W332 HydrophobicContact CD1-CG 3.87Å; L304-W332 HydrophobicContact CD2-CD2 4.06Å; L304-W332 HydrophobicContact CD2-CE3 4.25Å; L304-W332 HydrophobicContact CD2-CH2 4.41Å; L304-W332 HydrophobicContact CD2-CZ2 4.22Å; L304-W332 HydrophobicContact CD2-CZ3 4.42Å; L304-W332 HydrophobicContact CG-CD2 4.39Å; L304-W332 HydrophobicContact CG-CG 4.41Å
305	R	90.3	Very high	93.5	Very high	120 Å²	120	47.9 Å²	47.9	45%	0.453	24%	0.242	S	C	.	.	H	α-helix	trans	-78.3	-28	176.1	-81.2	-169.4	-68.5	-86.2	-5.2	112.9	S301 Q302 Q308	S301-R305 PolarHBondContact O-N 2.91Å; S301-R305 PolarHBondContact OG-NH1 3.23Å; S301-R305 PolarHBondContact OG-NH2 3.38Å; Q302-R305 PolarHBondContact O-N 3.44Å; R305-Q308 WeakPolarHBondContact O-CG 3.02Å; R305-Q308 PolarHBondContact O-NE2 3.11Å
306	D	92.1	Very high	93.5	Very high	29 Å²	29	47.8 Å²	47.8	16%	0.155	24%	0.239	C	C	.	.	H	α-helix	trans	-74.3	-33.5	175.6	-59.7	-20.6	0	0	0	110.6	F280 R281 Q302 Q308	F280-D306 WeakPolarHBondContact O-CB 3.35Å; R281-D306 WeakPolarHBondContact CA-OD2 3.33Å; Q302-D306 PolarHBondContact NE2-OD1 3.16Å; Q302-D306 VanDerWaalsContact O-CG 3.24Å; Q302-D306 PolarHBondContact O-N 2.96Å; D306-Q308 PolarHBondContact O-N 2.96Å
307	T	91.3	Very high	93.5	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.006	26%	0.263	C	S	.	.			trans	-100.6	60.7	-177.5	64.4	0	0	0	0	113.3	F280 L283 L286 T303 G309 I310	F280-T307 HydrophobicContact CB-CG2 3.68Å; F280-T307 HydrophobicContact CD2-CG2 3.94Å; F280-T307 HydrophobicContact CG-CG2 4.15Å; L283-T307 HydrophobicContact CB-CG2 4.24Å; L286-T307 HydrophobicContact CD2-CG2 4.21Å; T303-T307 WeakPolarHBondContact O-CG2 3Å; T303-T307 PolarHBondContact O-N 2.89Å; T303-T307 PolarHBondContact O-OG1 3.14Å; T303-T307 VanDerWaalsContact O-OG1 3.09Å; T307-G309 VanDerWaalsContact C-N 3.27Å; T307-G309 PolarHBondContact O-N 2.77Å; T307-I310 VanDerWaalsContact CB-CD1 3.49Å; T307-I310 HydrophobicContact CG2-CD1 4.26Å; T307-I310 VanDerWaalsContact OG1-CD1 3.23Å; T307-I310 WeakPolarHBondContact OG1-CD1 3.37Å
308	Q	84.8	Confident	93.6	Very high	169 Å²	169	49.4 Å²	49.4	79%	0.79	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-20.3	-175.7	-54.5	-172.4	7.3	0	0	114	R305 D306	R305-Q308 WeakPolarHBondContact O-CG 3.02Å; R305-Q308 PolarHBondContact O-NE2 3.11Å; D306-Q308 PolarHBondContact O-N 2.96Å
309	G	89.6	Confident	93.7	Very high	36 Å²	36	47.4 Å²	47.4	37%	0.371	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	3.6	-178.2	0	0	0	0	0	116	L286 T307 E311	L286-G309 CarbonylContact O-C 3.2Å; T307-G309 VanDerWaalsContact C-N 3.27Å; T307-G309 PolarHBondContact O-N 2.77Å; G309-E311 PolarHBondContact O-N 3.28Å
310	I	95.1	Very high	93.8	Very high	13 Å²	13	47.2 Å²	47.2	7%	0.067	24%	0.244	C	C	.	.			trans	-68.3	122.3	-174.5	-64.8	178.6	0	0	0	111.3	L286 L289 T307 L313 V338	L286-I310 HydrophobicContact CD2-CD1 4.31Å; L286-I310 HydrophobicContact CD2-CG1 4.49Å; L286-I310 WeakPolarHBondContact O-CA 3.05Å; L286-I310 WeakPolarHBondContact O-CG1 3.5Å; L286-I310 PolarHBondContact O-N 3.05Å; L289-I310 HydrophobicContact CB-CD1 3.97Å; L289-I310 HydrophobicContact CD2-CD1 3.91Å; T307-I310 VanDerWaalsContact CB-CD1 3.49Å; T307-I310 HydrophobicContact CG2-CD1 4.26Å; T307-I310 VanDerWaalsContact OG1-CD1 3.23Å; T307-I310 WeakPolarHBondContact OG1-CD1 3.37Å; I310-L313 HydrophobicContact CG2-CB 3.97Å; I310-V338 HydrophobicContact CG2-CG2 3.86Å
311	E	95.5	Very high	94	Very high	110 Å²	110	47.5 Å²	47.5	51%	0.514	25%	0.247	S	C	.	.	S	Bend	trans	-96.3	-34.5	171.9	-60.2	-173.2	168.6	0	0	111.9	T287 G309 V338 S339	T287-E311 PolarHBondContact O-N 3.01Å; G309-E311 PolarHBondContact O-N 3.28Å; E311-V338 WeakPolarHBondContact O-CG2 3.17Å; E311-S339 WeakPolarHBondContact O-CB 3.31Å; E311-S339 PolarHBondContact O-N 3.37Å
312	F	97.2	Very high	94.3	Very high	88 Å²	88	45.5 Å²	45.5	39%	0.386	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	111.2	-174.7	-63.8	-82.2	0	0	0	112.1	T287 M288 L289 S339	T287-F312 PolarHBondContact O-N 3.22Å; M288-F312 WeakPolarHBondContact CA-O 3.43Å; M288-F312 HydrophobicContact CB-CB 4.45Å; M288-F312 HydrophobicContact CE-CB 4.11Å; M288-F312 HydrophobicContact CE-CD2 4Å; M288-F312 HydrophobicContact CE-CG 4.1Å; M288-F312 HydrophobicContact CG-CB 4.15Å; L289-F312 PolarHBondContact N-O 3.36Å; F312-S339 WeakPolarHBondContact CA-O 3.33Å
313	L	96.9	Very high	94.4	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	119.4	-177.8	-176.6	59.5	0	0	0	111.5	L289 I310 L315 W332 F333 V338 S339 S340 S341	L289-L313 HydrophobicContact CB-CD1 3.95Å; L289-L313 HydrophobicContact CD2-CD1 3.94Å; L289-L313 HydrophobicContact CG-CD1 3.98Å; L289-L313 WeakPolarHBondContact O-CA 3.46Å; I310-L313 HydrophobicContact CG2-CB 3.97Å; L313-L315 HydrophobicContact CD1-CD2 3.98Å; L313-L315 HydrophobicContact CD1-CG 4.28Å; L313-L315 HydrophobicContact CD2-CD1 4.07Å; L313-L315 HydrophobicContact CD2-CG 4.25Å; L313-L315 HydrophobicContact CG-CD1 4.34Å; L313-L315 HydrophobicContact CG-CD2 4.22Å; L313-L315 HydrophobicContact CG-CG 3.96Å; L313-W332 HydrophobicContact CD2-CH2 3.53Å; L313-W332 HydrophobicContact CD2-CZ3 3.54Å; L313-F333 HydrophobicContact CD2-CZ 4.29Å; L313-V338 HydrophobicContact CB-CG2 3.84Å; L313-S339 PolarHBondContact N-O 3.4Å; L313-S340 WeakPolarHBondContact O-CA 3.23Å; L313-S340 PolarHBondContact O-OG 2.96Å; L313-S341 PolarHBondContact O-N 2.86Å
314	R	98.1	Very high	94.4	Very high	111 Å²	111	45.6 Å²	45.6	42%	0.419	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	118.7	175.6	-67.3	-172.5	-179.4	-170.9	1.2	111.4	L289 F290 L291 F292	L289-R314 PolarHBondContact O-N 3.22Å; F290-R314 HydrophobicContact CD1-CB 3.78Å; F290-R314 HydrophobicContact CD1-CG 3.67Å; F290-R314 HydrophobicContact CE1-CB 4.35Å; F290-R314 HydrophobicContact CE1-CG 3.71Å; F290-R314 HydrophobicContact CG-CB 4.28Å; F290-R314 HydrophobicContact CG-CG 4.43Å; F290-R314 HydrophobicContact CZ-CG 4.48Å; L291-R314 CarbonylContact C-O 3.58Å; L291-R314 WeakPolarHBondContact CA-O 3.19Å; L291-R314 PolarHBondContact N-O 2.82Å; F292-R314 HydrophobicContact CB-CB 4.25Å; F292-R314 HydrophobicContact CD1-CB 3.64Å; F292-R314 HydrophobicContact CD1-CG 4.42Å; F292-R314 HydrophobicContact CE1-CB 4.49Å; F292-R314 HydrophobicContact CG-CB 4.37Å; F292-R314 PolarHBondContact N-O 2.97Å; F292-R314 VanDerWaalsContact N-O 3.11Å
315	L	97.4	Very high	94.5	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.258	C	S	.	.			trans	-124.2	-4.6	-174.7	-66.3	-171.9	0	0	0	114	L291 L313 N318 W320 L329 F333 S341 V343	L291-L315 HydrophobicContact CB-CD2 4.09Å; L291-L315 HydrophobicContact CD1-CD2 4.23Å; L313-L315 HydrophobicContact CD1-CD2 3.98Å; L313-L315 HydrophobicContact CD1-CG 4.28Å; L313-L315 HydrophobicContact CD2-CD1 4.07Å; L313-L315 HydrophobicContact CD2-CG 4.25Å; L313-L315 HydrophobicContact CG-CD1 4.34Å; L313-L315 HydrophobicContact CG-CD2 4.22Å; L313-L315 HydrophobicContact CG-CG 3.96Å; L315-N318 PolarHBondContact O-ND2 2.03Å; L315-N318 VanDerWaalsContact O-ND2 3.09Å; L315-W320 HydrophobicContact CB-CZ2 3.71Å; L315-W320 HydrophobicContact CD1-CH2 4.42Å; L315-W320 HydrophobicContact CD1-CZ2 4.13Å; L315-W320 HydrophobicContact CD2-CH2 4.21Å; L315-W320 HydrophobicContact CD2-CZ2 3.95Å; L315-W320 HydrophobicContact CG-CZ2 4.13Å; L315-W320 PolarHBondContact O-NE1 2.82Å; L315-L329 HydrophobicContact CD1-CD1 4.26Å; L315-L329 HydrophobicContact CD1-CD2 4.41Å; L315-F333 HydrophobicContact CD1-CE2 4.16Å; L315-F333 HydrophobicContact CD1-CZ 3.98Å; L315-S341 PolarHBondContact N-OG 3.42Å; L315-V343 HydrophobicContact CB-CG2 4.12Å; L315-V343 HydrophobicContact CD1-CG2 4.11Å
316	N	97.4	Very high	94.7	Very high	44 Å²	44	43.7 Å²	43.7	24%	0.235	24%	0.24	C	C	.	.			trans	-60.2	164.7	-177.3	61.6	-77.9	0	0	0	112.9	F292 N293 N318 S341 E342	F292-N316 CarbonylContact C-O 3.58Å; F292-N316 WeakPolarHBondContact CA-O 3.46Å; F292-N316 WeakPolarHBondContact CB-O 3.43Å; F292-N316 WeakPolarHBondContact CB-OD1 3.35Å; N293-N316 PolarHBondContact N-O 3.11Å; N316-N318 PolarHBondContact O-N 2.83Å; N316-N318 PolarHBondContact O-ND2 2.86Å; N316-S341 PolarHBondContact N-OG 2.67Å; N316-S341 WeakPolarHBondContact OD1-CB 3.11Å; N316-S341 PolarHBondContact OD1-OG 3.03Å; N316-E342 WeakPolarHBondContact CA-O 3.47Å; N316-E342 HydrophobicContact CB-CG 4.01Å
317	A	97.6	Very high	94.7	Very high	62 Å²	62	45 Å²	45	51%	0.512	24%	0.243	S	C	.	.	S	Bend	trans	52.1	49.9	-176.4	0	0	0	0	0	113.2	N293 N294	N293-A317 WeakPolarHBondContact CA-O 3.23Å; N293-A317 HydrophobicContact CB-CB 4.21Å; N293-A317 PolarHBondContact N-O 3.19Å; N294-A317 PolarHBondContact N-O 2.97Å
318	N	98.3	Very high	94.7	Very high	13 Å²	13	46.4 Å²	46.4	7%	0.07	26%	0.255	C	S	.	.	S	Bend	trans	-131.6	147.3	169.6	-84.7	-77.2	0	0	0	108.9	L291 N294 S295 L296 L315 N316 W320	L291-N318 PolarHBondContact O-ND2 2.04Å; N294-N318 VanDerWaalsContact CA-OD1 3.28Å; N294-N318 WeakPolarHBondContact CA-OD1 3.33Å; N294-N318 WeakPolarHBondContact CB-OD1 3.49Å; N294-N318 PolarHBondContact N-OD1 3.33Å; N294-N318 PolarHBondContact O-OD1 3.01Å; S295-N318 PolarHBondContact N-OD1 3.21Å; L296-N318 HydrophobicContact CB-CB 4.29Å; L296-N318 WeakPolarHBondContact CB-OD1 3.43Å; L296-N318 PolarHBondContact N-OD1 2.81Å; L315-N318 PolarHBondContact O-ND2 2.03Å; L315-N318 VanDerWaalsContact O-ND2 3.09Å; N316-N318 PolarHBondContact O-N 2.83Å; N316-N318 PolarHBondContact O-ND2 2.86Å; N318-W320 HydrophobicContact CB-CD2 4.23Å; N318-W320 HydrophobicContact CB-CG 4.43Å; N318-W320 HydrophobicContact CB-CZ2 3.81Å; N318-W320 PolarHBondContact O-N 2.89Å
319	P	97.6	Very high	95.1	Very high	58 Å²	58	38.6 Å²	38.6	38%	0.377	22%	0.218	S	C	.	.			trans	-78.7	59.1	-179	34.8	-38.3	0	0	0	112.5	L296 S321 A346	L296-P319 CarbonylContact O-C 3.07Å; L296-P319 VanDerWaalsContact O-CD 3.24Å; L296-P319 WeakPolarHBondContact O-CD 3.38Å; P319-S321 PolarHBondContact O-N 3.02Å; P319-A346 HydrophobicContact CB-CB 4.1Å
320	W	97.6	Very high	95.3	Very high	5 Å²	5	37.8 Å²	37.8	2%	0.019	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57	131.2	-174.4	-64.9	109.4	0	0	0	113	L296 L299 L315 N318 L329 V343 A346 S347	L296-W320 HydrophobicContact CB-CH2 3.78Å; L296-W320 HydrophobicContact CB-CZ2 4.29Å; L296-W320 HydrophobicContact CB-CZ3 4.02Å; L296-W320 HydrophobicContact CD1-CH2 3.93Å; L296-W320 HydrophobicContact CD1-CZ2 4.43Å; L299-W320 HydrophobicContact CB-CH2 4.22Å; L299-W320 HydrophobicContact CB-CZ3 4.06Å; L315-W320 HydrophobicContact CB-CZ2 3.71Å; L315-W320 HydrophobicContact CD1-CH2 4.42Å; L315-W320 HydrophobicContact CD1-CZ2 4.13Å; L315-W320 HydrophobicContact CD2-CH2 4.21Å; L315-W320 HydrophobicContact CD2-CZ2 3.95Å; L315-W320 HydrophobicContact CG-CZ2 4.13Å; L315-W320 PolarHBondContact O-NE1 2.82Å; N318-W320 HydrophobicContact CB-CD2 4.23Å; N318-W320 HydrophobicContact CB-CG 4.43Å; N318-W320 HydrophobicContact CB-CZ2 3.81Å; N318-W320 PolarHBondContact O-N 2.89Å; W320-L329 HydrophobicContact CE3-CD2 4.3Å; W320-L329 HydrophobicContact CZ3-CD2 4.17Å; W320-V343 HydrophobicContact CB-CG1 4.5Å; W320-V343 HydrophobicContact CD2-CG1 4Å; W320-V343 HydrophobicContact CG-CG1 3.78Å; W320-A346 PolarHBondContact O-N 3.19Å; W320-S347 PolarHBondContact O-N 3.26Å
321	S	96.5	Very high	95.2	Very high	25 Å²	25	40.6 Å²	40.6	18%	0.175	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	108.2	172.4	-166.6	0	0	0	0	109.6	A297 P319 G323 E325 A326 S347	A297-S321 PolarHBondContact O-N 2.93Å; P319-S321 PolarHBondContact O-N 3.02Å; S321-G323 VanDerWaalsContact C-N 3.28Å; S321-G323 PolarHBondContact O-N 2.99Å; S321-E325 VanDerWaalsContact C-OE1 3.29Å; S321-E325 WeakPolarHBondContact CB-OE1 3.35Å; S321-E325 PolarHBondContact OG-OE1 2.81Å; S321-A326 VanDerWaalsContact O-CB 3.29Å; S321-A326 WeakPolarHBondContact O-CB 3.29Å; S321-S347 WeakPolarHBondContact CA-OG 3.49Å; S321-S347 VanDerWaalsContact CB-OG 3.28Å; S321-S347 WeakPolarHBondContact CB-OG 3.4Å; S321-S347 PolarHBondContact OG-OG 3.07Å
322	C	96.2	Very high	95.1	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.199	C	C	.	.			trans	-94.1	40.5	-176.7	-62.7	0	0	0	0	112.2	C345 S347 R351 L356 L359	C322-C345 HydrophobicContact CB-CB 3.73Å; C322-C345 WeakPolarHBondContact CB-SG 3.47Å; C322-C345 VanDerWaalsContact SG-CA 3.51Å; C322-C345 WeakPolarHBondContact SG-CB 3.27Å; C322-C345 CovalentContact SG-SG 2.02Å; C322-C345 PolarHBondContact SG-SG 3.22Å; C322-S347 PolarHBondContact N-O 2.96Å; C322-R351 WeakPolarHBondContact O-CD 3.38Å; C322-R351 PolarHBondContact O-NH1 3.34Å; C322-L356 HydrophobicContact CB-CD1 4.17Å; C322-L359 HydrophobicContact CB-CD1 4.21Å
323	G	92.9	Very high	94.9	Very high	16 Å²	16	33.8 Å²	33.8	17%	0.165	18%	0.184	C	C	.	.	S	Bend	trans	-80.8	-131	170.2	0	0	0	0	0	111.7	S321 E325 F364	S321-G323 VanDerWaalsContact C-N 3.28Å; S321-G323 PolarHBondContact O-N 2.99Å; G323-E325 WeakPolarHBondContact CA-OE1 3.37Å; G323-E325 WeakPolarHBondContact CA-OE2 3.32Å; G323-E325 PolarHBondContact N-OE1 3.28Å; G323-F364 WeakPolarHBondContact O-CD1 3.3Å; G323-F364 VanDerWaalsContact O-CE1 3.26Å; G323-F364 WeakPolarHBondContact O-CE1 3.13Å
324	C	91.6	Very high	94.6	Very high	54 Å²	54	41.7 Å²	41.7	37%	0.365	21%	0.214	S	C	.	.	S	Bend	trans	-90.3	-28.8	179	-70	0	0	0	0	112.7	A326 R327 C367	C324-A326 VanDerWaalsContact C-N 3.29Å; C324-A326 PolarHBondContact O-N 3.02Å; C324-R327 WeakPolarHBondContact O-CB 3.11Å; C324-R327 PolarHBondContact O-N 3.02Å; C324-C367 WeakPolarHBondContact CA-SG 3.32Å; C324-C367 HydrophobicContact CB-CB 3.63Å; C324-C367 WeakPolarHBondContact CB-SG 3.2Å; C324-C367 WeakPolarHBondContact SG-CA 3.44Å; C324-C367 WeakPolarHBondContact SG-CB 3.41Å; C324-C367 CovalentContact SG-SG 2.04Å; C324-C367 PolarHBondContact SG-SG 2.97Å
325	E	90.6	Very high	94.3	Very high	75 Å²	75	44.3 Å²	44.3	35%	0.35	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-40.7	173	60.4	-72.3	171.6	0	0	112.9	E298 S321 G323 R327	E298-E325 HydrophobicContact CB-CG 4.5Å; S321-E325 VanDerWaalsContact C-OE1 3.29Å; S321-E325 WeakPolarHBondContact CB-OE1 3.35Å; S321-E325 PolarHBondContact OG-OE1 2.81Å; G323-E325 WeakPolarHBondContact CA-OE1 3.37Å; G323-E325 WeakPolarHBondContact CA-OE2 3.32Å; G323-E325 PolarHBondContact N-OE1 3.28Å; E325-R327 PolarHBondContact O-N 2.77Å
326	A	93.9	Very high	93.9	Very high	8 Å²	8	45.9 Å²	45.9	7%	0.066	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-5.4	178.1	0	0	0	0	0	114.8	S321 C324 A328 L329 W330 L356	S321-A326 VanDerWaalsContact O-CB 3.29Å; S321-A326 WeakPolarHBondContact O-CB 3.29Å; C324-A326 VanDerWaalsContact C-N 3.29Å; C324-A326 PolarHBondContact O-N 3.02Å; A326-A328 VanDerWaalsContact C-N 3.27Å; A326-A328 PolarHBondContact O-N 2.8Å; A326-L329 PolarHBondContact O-N 2.72Å; A326-L329 VanDerWaalsContact O-N 3.15Å; A326-W330 PolarHBondContact O-N 3.36Å; A326-L356 HydrophobicContact CB-CD1 3.63Å; A326-L356 HydrophobicContact CB-CD2 4.13Å
327	R	92.3	Very high	93.6	Very high	58 Å²	58	56 Å²	56	22%	0.219	28%	0.279	C	S	.	.	H	α-helix	trans	-53.4	-45	-178.3	179.9	179.7	172.2	113.8	16.3	111.8	C324 E325 W330 E331 F364	C324-R327 WeakPolarHBondContact O-CB 3.11Å; C324-R327 PolarHBondContact O-N 3.02Å; E325-R327 PolarHBondContact O-N 2.77Å; R327-W330 WeakPolarHBondContact O-CB 3.42Å; R327-W330 PolarHBondContact O-N 3.06Å; R327-E331 HydrophobicContact CG-CG 4.41Å; R327-E331 IonicContact CZ-OE1 3Å; R327-E331 IonicContact NE-OE1 3.19Å; R327-E331 PolarHBondContact NE-OE1 2.9Å; R327-E331 IonicContact NH2-OE1 2.69Å; R327-E331 PolarHBondContact NH2-OE1 3.13Å; R327-E331 WeakPolarHBondContact O-CG 3.37Å; R327-E331 PolarHBondContact O-N 2.78Å; R327-F364 HydrophobicContact CB-CD1 3.78Å; R327-F364 HydrophobicContact CB-CE1 4.25Å; R327-F364 HydrophobicContact CB-CG 4.26Å; R327-F364 HydrophobicContact CG-CB 4.14Å; R327-F364 HydrophobicContact CG-CD1 4.24Å; R327-F364 HydrophobicContact CG-CG 4.21Å; R327-F364 PolarHBondContact NH1-O 2.93Å
328	A	90.9	Very high	93.4	Very high	30 Å²	30	54.3 Å²	54.3	25%	0.248	26%	0.262	C	S	.	.	H	α-helix	trans	-72.5	-31.5	-177	0	0	0	0	0	113.4	S301 A326 W332	S301-A328 VanDerWaalsContact CB-CB 3.44Å; A326-A328 VanDerWaalsContact C-N 3.27Å; A326-A328 PolarHBondContact O-N 2.8Å; A328-W332 WeakPolarHBondContact O-CB 3.39Å; A328-W332 PolarHBondContact O-N 2.93Å
329	L	93.8	Very high	93.2	Very high	4 Å²	4	57.2 Å²	57.2	2%	0.021	28%	0.284	C	S	.	.	H	α-helix	trans	-69.1	-38.6	172	178	60.4	0	0	0	110.6	L304 L315 W320 A326 W332 F333 V343 L356	L304-L329 HydrophobicContact CD1-CB 4.42Å; L304-L329 HydrophobicContact CD1-CD1 3.59Å; L304-L329 HydrophobicContact CD2-CD1 4.45Å; L315-L329 HydrophobicContact CD1-CD1 4.26Å; L315-L329 HydrophobicContact CD1-CD2 4.41Å; W320-L329 HydrophobicContact CE3-CD2 4.3Å; W320-L329 HydrophobicContact CZ3-CD2 4.17Å; A326-L329 PolarHBondContact O-N 2.72Å; A326-L329 VanDerWaalsContact O-N 3.15Å; L329-W332 HydrophobicContact CD1-CE3 4.49Å; L329-F333 HydrophobicContact CD1-CD2 4Å; L329-F333 HydrophobicContact CD1-CE2 3.6Å; L329-F333 HydrophobicContact CD1-CZ 4.44Å; L329-F333 HydrophobicContact CG-CD2 4.08Å; L329-F333 HydrophobicContact CG-CE2 3.89Å; L329-F333 WeakPolarHBondContact O-CD2 3.2Å; L329-F333 PolarHBondContact O-N 2.83Å; L329-F333 VanDerWaalsContact O-N 3.08Å; L329-V343 HydrophobicContact CD2-CG1 4.5Å; L329-L356 HydrophobicContact CB-CD2 4.14Å; L329-L356 HydrophobicContact CD2-CD2 3.61Å; L329-L356 HydrophobicContact CG-CD2 3.71Å
330	W	94.4	Very high	93.1	Very high	19 Å²	19	55.8 Å²	55.8	7%	0.072	28%	0.275	C	S	.	.	H	α-helix	trans	-64.8	-47.9	173.3	171.6	82.1	0	0	0	112.5	A326 R327 W332 F333 R334 L356 L359 E361 F364	A326-W330 PolarHBondContact O-N 3.36Å; R327-W330 WeakPolarHBondContact O-CB 3.42Å; R327-W330 PolarHBondContact O-N 3.06Å; W330-W332 VanDerWaalsContact C-N 3.33Å; W330-W332 PolarHBondContact O-N 3.37Å; W330-F333 PolarHBondContact O-N 3.26Å; W330-F333 VanDerWaalsContact O-N 3.15Å; W330-R334 HydrophobicContact CZ2-CG 4.23Å; W330-R334 PolarHBondContact O-N 3.5Å; W330-L356 HydrophobicContact CB-CD1 4.27Å; W330-L356 HydrophobicContact CB-CG 4.31Å; W330-L356 VanDerWaalsContact CD1-O 3.28Å; W330-L359 PolarHBondContact NE1-O 2.67Å; W330-E361 HydrophobicContact CH2-CB 3.71Å; W330-E361 HydrophobicContact CH2-CG 3.98Å; W330-E361 HydrophobicContact CZ2-CB 4.3Å; W330-E361 HydrophobicContact CZ3-CG 4.43Å; W330-F364 HydrophobicContact CB-CE2 3.92Å; W330-F364 HydrophobicContact CB-CZ 3.81Å; W330-F364 AromaticContact CD1-CE2 3.84Å; W330-F364 AromaticContact CD2-CD2 3.87Å; W330-F364 HydrophobicContact CD2-CD2 3.87Å; W330-F364 AromaticContact CD2-CE2 3.44Å; W330-F364 HydrophobicContact CD2-CE2 3.44Å; W330-F364 VanDerWaalsContact CD2-CE2 3.44Å; W330-F364 HydrophobicContact CD2-CZ 4.26Å; W330-F364 AromaticContact CE2-CE2 3.93Å; W330-F364 AromaticContact CE3-CD2 3.8Å; W330-F364 HydrophobicContact CE3-CD2 3.8Å; W330-F364 AromaticContact CE3-CE2 3.84Å; W330-F364 HydrophobicContact CE3-CE2 3.84Å; W330-F364 HydrophobicContact CG-CD2 4.31Å; W330-F364 AromaticContact CG-CE2 3.44Å; W330-F364 HydrophobicContact CG-CE2 3.44Å; W330-F364 VanDerWaalsContact CG-CE2 3.44Å; W330-F364 AromaticContact CG-CZ 3.84Å; W330-F364 HydrophobicContact CG-CZ 3.84Å; W330-F364 HydrophobicContact CZ3-CD2 4.28Å
331	E	92.3	Very high	93.1	Very high	73 Å²	73	56.7 Å²	56.7	34%	0.341	28%	0.282	S	S	.	.	H	α-helix	trans	-56.3	-47.2	174.9	-76.3	170.5	168.1	0	0	110.6	R327 F333 R334 E335	R327-E331 HydrophobicContact CG-CG 4.41Å; R327-E331 IonicContact CZ-OE1 3Å; R327-E331 IonicContact NE-OE1 3.19Å; R327-E331 PolarHBondContact NE-OE1 2.9Å; R327-E331 IonicContact NH2-OE1 2.69Å; R327-E331 PolarHBondContact NH2-OE1 3.13Å; R327-E331 WeakPolarHBondContact O-CG 3.37Å; R327-E331 PolarHBondContact O-N 2.78Å; E331-F333 VanDerWaalsContact C-N 3.34Å; E331-F333 PolarHBondContact O-N 2.7Å; E331-R334 WeakPolarHBondContact O-CB 3.2Å; E331-R334 PolarHBondContact O-N 3.28Å; E331-E335 PolarHBondContact O-N 2.95Å
332	W	93.1	Very high	93	Very high	39 Å²	39	60.4 Å²	60.4	15%	0.148	30%	0.297	C	S	.	.	H	α-helix	trans	-58	-41.6	176	-177	87.1	0	0	0	112.7	L304 L313 A328 L329 W330 R334 E335 A336 V338	L304-W332 HydrophobicContact CB-CD2 4.35Å; L304-W332 HydrophobicContact CB-CG 4.1Å; L304-W332 HydrophobicContact CD1-CB 3.97Å; L304-W332 HydrophobicContact CD1-CD2 4.07Å; L304-W332 HydrophobicContact CD1-CE3 4.41Å; L304-W332 HydrophobicContact CD1-CG 3.87Å; L304-W332 HydrophobicContact CD2-CD2 4.06Å; L304-W332 HydrophobicContact CD2-CE3 4.25Å; L304-W332 HydrophobicContact CD2-CH2 4.41Å; L304-W332 HydrophobicContact CD2-CZ2 4.22Å; L304-W332 HydrophobicContact CD2-CZ3 4.42Å; L304-W332 HydrophobicContact CG-CD2 4.39Å; L304-W332 HydrophobicContact CG-CG 4.41Å; L313-W332 HydrophobicContact CD2-CH2 3.53Å; L313-W332 HydrophobicContact CD2-CZ3 3.54Å; A328-W332 WeakPolarHBondContact O-CB 3.39Å; A328-W332 PolarHBondContact O-N 2.93Å; L329-W332 HydrophobicContact CD1-CE3 4.49Å; W330-W332 VanDerWaalsContact C-N 3.33Å; W330-W332 PolarHBondContact O-N 3.37Å; W332-R334 PolarHBondContact O-N 3.17Å; W332-R334 VanDerWaalsContact O-N 3.17Å; W332-E335 PolarHBondContact O-N 2.95Å; W332-E335 VanDerWaalsContact O-N 3.14Å; W332-A336 HydrophobicContact CD2-CB 3.82Å; W332-A336 HydrophobicContact CE3-CB 4.04Å; W332-A336 HydrophobicContact CG-CB 4.45Å; W332-A336 HydrophobicContact CH2-CB 3.93Å; W332-A336 HydrophobicContact CZ2-CB 3.7Å; W332-A336 HydrophobicContact CZ3-CB 4.09Å; W332-A336 WeakPolarHBondContact O-CB 3.24Å; W332-A336 PolarHBondContact O-N 3.01Å; W332-V338 HydrophobicContact CH2-CB 4.14Å; W332-V338 HydrophobicContact CH2-CG1 3.73Å; W332-V338 HydrophobicContact CH2-CG2 4.29Å; W332-V338 HydrophobicContact CZ3-CG1 3.84Å
333	F	93.4	Very high	93.1	Very high	16 Å²	16	60.4 Å²	60.4	7%	0.07	30%	0.297	C	S	.	.	H	α-helix	trans	-68.3	-5.9	174.4	-84.6	-58.5	0	0	0	115.2	L313 L315 L329 W330 E331 V338 S340 V343 R357	L313-F333 HydrophobicContact CD2-CZ 4.29Å; L315-F333 HydrophobicContact CD1-CE2 4.16Å; L315-F333 HydrophobicContact CD1-CZ 3.98Å; L329-F333 HydrophobicContact CD1-CD2 4Å; L329-F333 HydrophobicContact CD1-CE2 3.6Å; L329-F333 HydrophobicContact CD1-CZ 4.44Å; L329-F333 HydrophobicContact CG-CD2 4.08Å; L329-F333 HydrophobicContact CG-CE2 3.89Å; L329-F333 WeakPolarHBondContact O-CD2 3.2Å; L329-F333 PolarHBondContact O-N 2.83Å; L329-F333 VanDerWaalsContact O-N 3.08Å; W330-F333 PolarHBondContact O-N 3.26Å; W330-F333 VanDerWaalsContact O-N 3.15Å; E331-F333 VanDerWaalsContact C-N 3.34Å; E331-F333 PolarHBondContact O-N 2.7Å; F333-V338 HydrophobicContact CD1-CG1 4.28Å; F333-V338 HydrophobicContact CE1-CG1 4.02Å; F333-S340 WeakPolarHBondContact CE1-OG 3.21Å; F333-S340 WeakPolarHBondContact CZ-OG 3.34Å; F333-V343 HydrophobicContact CE2-CG2 3.86Å; F333-V343 HydrophobicContact CZ-CG2 3.97Å; F333-R357 HydrophobicContact CB-CG 4.46Å; F333-R357 HydrophobicContact CD1-CG 4.27Å; F333-R357 HydrophobicContact CD2-CG 3.92Å; F333-R357 HydrophobicContact CE2-CG 4.17Å; F333-R357 HydrophobicContact CG-CG 3.99Å; F333-R357 HydrophobicContact CZ-CG 4.46Å
334	R	91.8	Very high	93.3	Very high	165 Å²	165	62.5 Å²	62.5	62%	0.623	30%	0.303	S	S	*	.	H	α-helix	trans	-90.7	-27.7	170.1	-58.9	-72.8	65	-159	-10.8	112.5	W330 E331 W332	W330-R334 HydrophobicContact CZ2-CG 4.23Å; W330-R334 PolarHBondContact O-N 3.5Å; E331-R334 WeakPolarHBondContact O-CB 3.2Å; E331-R334 PolarHBondContact O-N 3.28Å; W332-R334 PolarHBondContact O-N 3.17Å; W332-R334 VanDerWaalsContact O-N 3.17Å
335	E	90.6	Very high	93.6	Very high	167 Å²	167	60 Å²	60	78%	0.78	29%	0.286	S	S	*	.	H	α-helix	trans	-98.2	-37.6	-177.9	-60.8	-178	170.6	0	0	112.5	E331 W332	E331-E335 PolarHBondContact O-N 2.95Å; W332-E335 PolarHBondContact O-N 2.95Å; W332-E335 VanDerWaalsContact O-N 3.14Å
336	A	89.9	Confident	93.9	Very high	32 Å²	32	58.2 Å²	58.2	26%	0.264	29%	0.285	S	S	.	.			trans	-73.2	132.6	-174.6	0	0	0	0	0	113.1	W332 V338	W332-A336 HydrophobicContact CD2-CB 3.82Å; W332-A336 HydrophobicContact CE3-CB 4.04Å; W332-A336 HydrophobicContact CG-CB 4.45Å; W332-A336 HydrophobicContact CH2-CB 3.93Å; W332-A336 HydrophobicContact CZ2-CB 3.7Å; W332-A336 HydrophobicContact CZ3-CB 4.09Å; W332-A336 WeakPolarHBondContact O-CB 3.24Å; W332-A336 PolarHBondContact O-N 3.01Å; A336-V338 VanDerWaalsContact C-N 3.35Å; A336-V338 HydrophobicContact CB-CG1 4.35Å; A336-V338 PolarHBondContact O-N 3.29Å
337	R	90	Very high	94	Very high	257 Å²	257	59.9 Å²	59.9	97%	0.97	30%	0.296	S	S	*	.			trans	-94.7	58.7	175.4	-63	-175.9	-178.5	-177.4	1.3	111.3
338	V	93.3	Very high	94.1	Very high	27 Å²	27	59.5 Å²	59.5	16%	0.164	30%	0.301	C	S	.	.			trans	-105.7	143.9	-171.8	72.4	0	0	0	0	112.6	I310 E311 L313 W332 F333 A336 S340	I310-V338 HydrophobicContact CG2-CG2 3.86Å; E311-V338 WeakPolarHBondContact O-CG2 3.17Å; L313-V338 HydrophobicContact CB-CG2 3.84Å; W332-V338 HydrophobicContact CH2-CB 4.14Å; W332-V338 HydrophobicContact CH2-CG1 3.73Å; W332-V338 HydrophobicContact CH2-CG2 4.29Å; W332-V338 HydrophobicContact CZ3-CG1 3.84Å; F333-V338 HydrophobicContact CD1-CG1 4.28Å; F333-V338 HydrophobicContact CE1-CG1 4.02Å; A336-V338 VanDerWaalsContact C-N 3.35Å; A336-V338 HydrophobicContact CB-CG1 4.35Å; A336-V338 PolarHBondContact O-N 3.29Å; V338-S340 PolarHBondContact O-N 3.34Å
339	S	95.2	Very high	94.2	Very high	74 Å²	74	63.4 Å²	63.4	52%	0.517	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	103.7	165.2	-67.8	0	0	0	0	109.3	E311 F312 L313	E311-S339 WeakPolarHBondContact O-CB 3.31Å; E311-S339 PolarHBondContact O-N 3.37Å; F312-S339 WeakPolarHBondContact CA-O 3.33Å; L313-S339 PolarHBondContact N-O 3.4Å
340	S	95.4	Very high	94.2	Very high	28 Å²	28	70 Å²	70	20%	0.196	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	146.8	-176.9	-176.4	0	0	0	0	115.2	L313 F333 V338 R357	L313-S340 WeakPolarHBondContact O-CA 3.23Å; L313-S340 PolarHBondContact O-OG 2.96Å; F333-S340 WeakPolarHBondContact CE1-OG 3.21Å; F333-S340 WeakPolarHBondContact CZ-OG 3.34Å; V338-S340 PolarHBondContact O-N 3.34Å; S340-R357 PolarHBondContact O-NH1 2.9Å
341	S	96.1	Very high	94.1	Very high	24 Å²	24	71.1 Å²	71.1	17%	0.168	36%	0.364	C	S	.	.			trans	-63.3	169.9	166.4	71.7	0	0	0	0	112	L313 L315 N316 R357	L313-S341 PolarHBondContact O-N 2.86Å; L315-S341 PolarHBondContact N-OG 3.42Å; N316-S341 PolarHBondContact N-OG 2.67Å; N316-S341 WeakPolarHBondContact OD1-CB 3.11Å; N316-S341 PolarHBondContact OD1-OG 3.03Å; S341-R357 PolarHBondContact O-NH1 2.98Å
342	E	95.8	Very high	94.3	Very high	103 Å²	103	76.8 Å²	76.8	48%	0.481	38%	0.383	S	S	.	.			trans	-58.3	151.1	164.2	62	-175.7	-173.7	0	0	112.8	N316 I344 D355	N316-E342 WeakPolarHBondContact CA-O 3.47Å; N316-E342 HydrophobicContact CB-CG 4.01Å; E342-I344 HydrophobicContact CB-CD1 4.06Å; E342-I344 HydrophobicContact CB-CG1 4.2Å; E342-I344 HydrophobicContact CG-CD1 4.36Å; E342-I344 HydrophobicContact CG-CG1 4.02Å; E342-D355 WeakPolarHBondContact CA-OD2 3.25Å
343	V	96.8	Very high	94.4	Very high	0 Å²	0	77.4 Å²	77.4	0%	0	40%	0.401	C	S	.	.			trans	-128.2	72.1	179.7	-173.7	0	0	0	0	107.8	L315 W320 L329 F333 C345 D355 L356 R357	L315-V343 HydrophobicContact CB-CG2 4.12Å; L315-V343 HydrophobicContact CD1-CG2 4.11Å; W320-V343 HydrophobicContact CB-CG1 4.5Å; W320-V343 HydrophobicContact CD2-CG1 4Å; W320-V343 HydrophobicContact CG-CG1 3.78Å; L329-V343 HydrophobicContact CD2-CG1 4.5Å; F333-V343 HydrophobicContact CE2-CG2 3.86Å; F333-V343 HydrophobicContact CZ-CG2 3.97Å; V343-C345 PolarHBondContact O-N 3.12Å; V343-D355 PolarHBondContact N-OD1 2.94Å; V343-D355 WeakPolarHBondContact O-CA 3.28Å; V343-L356 HydrophobicContact CB-CB 3.99Å; V343-L356 HydrophobicContact CG1-CB 3.75Å; V343-L356 HydrophobicContact CG1-CD2 3.85Å; V343-L356 HydrophobicContact CG1-CG 4.46Å; V343-L356 PolarHBondContact O-N 3.47Å; V343-R357 HydrophobicContact CG2-CG 4.27Å
344	I	97.6	Very high	94.5	Very high	59 Å²	59	81 Å²	81	30%	0.303	42%	0.418	S	S	.	.	B	Isolated β-bridge	trans	-74.3	123.9	-173.3	-54.8	-58.4	0	0	0	110.9	E342 Q354 D355	E342-I344 HydrophobicContact CB-CD1 4.06Å; E342-I344 HydrophobicContact CB-CG1 4.2Å; E342-I344 HydrophobicContact CG-CD1 4.36Å; E342-I344 HydrophobicContact CG-CG1 4.02Å; I344-Q354 WeakPolarHBondContact CA-O 3.46Å; I344-D355 HydrophobicContact CD1-CB 4.04Å
345	C	97.8	Very high	94.8	Very high	1 Å²	1	74 Å²	74	1%	0.007	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	127.3	177.3	-59.1	0	0	0	0	111.5	C322 V343 R351 R352 G353 Q354	C322-C345 HydrophobicContact CB-CB 3.73Å; C322-C345 WeakPolarHBondContact CB-SG 3.47Å; C322-C345 VanDerWaalsContact SG-CA 3.51Å; C322-C345 WeakPolarHBondContact SG-CB 3.27Å; C322-C345 CovalentContact SG-SG 2.02Å; C322-C345 PolarHBondContact SG-SG 3.22Å; V343-C345 PolarHBondContact O-N 3.12Å; C345-R351 HydrophobicContact CB-CB 4.38Å; C345-R351 VanDerWaalsContact CB-O 3.28Å; C345-R351 WeakPolarHBondContact CB-O 3.24Å; C345-R352 CarbonylContact O-C 3.4Å; C345-R352 WeakPolarHBondContact O-CA 3.38Å; C345-G353 PolarHBondContact O-N 3.39Å; C345-Q354 WeakPolarHBondContact CB-O 3.49Å; C345-Q354 PolarHBondContact N-O 3.02Å; C345-Q354 PolarHBondContact SG-O 3.06Å
346	A	97.6	Very high	95	Very high	39 Å²	39	66.1 Å²	66.1	32%	0.322	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	-34.3	170	0	0	0	0	0	112.1	P319 W320	P319-A346 HydrophobicContact CB-CB 4.1Å; W320-A346 PolarHBondContact O-N 3.19Å
347	S	95.4	Very high	95.2	Very high	43 Å²	43	67.2 Å²	67.2	30%	0.301	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	163.5	175.6	51.4	0	0	0	0	111.1	W320 S321 C322	W320-S347 PolarHBondContact O-N 3.26Å; S321-S347 WeakPolarHBondContact CA-OG 3.49Å; S321-S347 VanDerWaalsContact CB-OG 3.28Å; S321-S347 WeakPolarHBondContact CB-OG 3.4Å; S321-S347 PolarHBondContact OG-OG 3.07Å; C322-S347 PolarHBondContact N-O 2.96Å
348	P	94.6	Very high	95.4	Very high	49 Å²	49	62.6 Å²	62.6	32%	0.318	34%	0.341	S	S	.	.	S	Bend	cis	-63.2	164.2	-16.9	30.4	-36.4	0	0	0	111.7	I350 R351 R352	P348-I350 HydrophobicContact CB-CG2 4.3Å; P348-I350 HydrophobicContact CG-CG2 3.99Å; P348-I350 PolarHBondContact O-N 2.91Å; P348-I350 VanDerWaalsContact O-N 3.1Å; P348-R351 PolarHBondContact O-N 2.89Å; P348-R352 PolarHBondContact O-N 2.63Å
349	S	93.6	Very high	95.4	Very high	112 Å²	112	62 Å²	62	78%	0.783	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-53.3	-35.6	-174.5	50.5	0	0	0	0	114.1	R351 R352	S349-R351 VanDerWaalsContact C-N 3.26Å; S349-R351 PolarHBondContact O-N 3.1Å; S349-R352 WeakPolarHBondContact O-CB 3.49Å; S349-R352 PolarHBondContact O-N 2.7Å
350	I	92.9	Very high	95.3	Very high	143 Å²	143	65.2 Å²	65.2	73%	0.733	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-65.4	-21	177.3	-171.7	165.3	0	0	0	114.5	P348	P348-I350 HydrophobicContact CB-CG2 4.3Å; P348-I350 HydrophobicContact CG-CG2 3.99Å; P348-I350 PolarHBondContact O-N 2.91Å; P348-I350 VanDerWaalsContact O-N 3.1Å
351	R	92.9	Very high	95.1	Very high	43 Å²	43	69.8 Å²	69.8	16%	0.162	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-108.3	0.9	176.6	-67	-179.7	-174	167.7	3.6	113.2	C322 C345 P348 S349 G353 Q354 D363	C322-R351 WeakPolarHBondContact O-CD 3.38Å; C322-R351 PolarHBondContact O-NH1 3.34Å; C345-R351 HydrophobicContact CB-CB 4.38Å; C345-R351 VanDerWaalsContact CB-O 3.28Å; C345-R351 WeakPolarHBondContact CB-O 3.24Å; P348-R351 PolarHBondContact O-N 2.89Å; S349-R351 VanDerWaalsContact C-N 3.26Å; S349-R351 PolarHBondContact O-N 3.1Å; R351-G353 PolarHBondContact O-N 3.17Å; R351-Q354 VanDerWaalsContact O-CB 3.31Å; R351-Q354 WeakPolarHBondContact O-CB 3.47Å; R351-Q354 WeakPolarHBondContact O-CG 3.48Å; R351-Q354 PolarHBondContact O-N 3.26Å; R351-D363 PolarHBondContact NH1-O 2.8Å; R351-D363 PolarHBondContact NH2-O 3.28Å
352	R	95.8	Very high	94.7	Very high	192 Å²	192	74.6 Å²	74.6	73%	0.725	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	128.4	-174.2	-174.8	173.5	177.9	177.4	0.4	111	C345 P348 S349 Q354	C345-R352 CarbonylContact O-C 3.4Å; C345-R352 WeakPolarHBondContact O-CA 3.38Å; P348-R352 PolarHBondContact O-N 2.63Å; S349-R352 WeakPolarHBondContact O-CB 3.49Å; S349-R352 PolarHBondContact O-N 2.7Å; R352-Q354 VanDerWaalsContact C-N 3.34Å
353	G	95.7	Very high	94.5	Very high	52 Å²	52	71.4 Å²	71.4	54%	0.536	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.2	-6.1	-177.1	0	0	0	0	0	115.3	C345 R351	C345-G353 PolarHBondContact O-N 3.39Å; R351-G353 PolarHBondContact O-N 3.17Å
354	Q	96.3	Very high	94.2	Very high	91 Å²	91	71.4 Å²	71.4	43%	0.425	36%	0.363	S	S	.	.			trans	-79.4	149.9	170.4	-61.1	178.9	-17.3	0	0	110.2	I344 C345 R351 R352 L359	I344-Q354 WeakPolarHBondContact CA-O 3.46Å; C345-Q354 WeakPolarHBondContact CB-O 3.49Å; C345-Q354 PolarHBondContact N-O 3.02Å; C345-Q354 PolarHBondContact SG-O 3.06Å; R351-Q354 VanDerWaalsContact O-CB 3.31Å; R351-Q354 WeakPolarHBondContact O-CB 3.47Å; R351-Q354 WeakPolarHBondContact O-CG 3.48Å; R351-Q354 PolarHBondContact O-N 3.26Å; R352-Q354 VanDerWaalsContact C-N 3.34Å; Q354-L359 HydrophobicContact CB-CD2 4.39Å
355	D	96.8	Very high	93.6	Very high	19 Å²	19	72 Å²	72	10%	0.102	38%	0.377	C	S	.	.	B	Isolated β-bridge	trans	-86.9	124.3	170.7	-174.3	-27.7	0	0	0	109.3	E342 V343 I344 R357 F358	E342-D355 WeakPolarHBondContact CA-OD2 3.25Å; V343-D355 PolarHBondContact N-OD1 2.94Å; V343-D355 WeakPolarHBondContact O-CA 3.28Å; I344-D355 HydrophobicContact CD1-CB 4.04Å; D355-R357 PolarHBondContact O-N 2.79Å; D355-R357 VanDerWaalsContact O-N 3.07Å; D355-R357 WeakPolarHBondContact OD1-CB 3.38Å; D355-R357 VanDerWaalsContact OD1-CG 3.3Å; D355-R357 WeakPolarHBondContact OD1-CG 3.22Å; D355-R357 PolarHBondContact OD1-N 3.18Å; D355-R357 IonicContact OD1-NE 3.17Å; D355-R357 PolarHBondContact OD1-NE 2.83Å; D355-R357 VanDerWaalsContact OD1-NE 3.1Å; D355-R357 IonicContact OD2-CZ 3.1Å; D355-R357 VanDerWaalsContact OD2-CZ 3.25Å; D355-R357 IonicContact OD2-NE 2.69Å; D355-R357 PolarHBondContact OD2-NE 3.43Å; D355-R357 IonicContact OD2-NH2 3.25Å; D355-R357 PolarHBondContact OD2-NH2 3.44Å; D355-F358 HydrophobicContact CB-CD2 3.87Å; D355-F358 HydrophobicContact CB-CE2 4.31Å; D355-F358 PolarHBondContact O-N 2.85Å; D355-F358 VanDerWaalsContact O-N 3.08Å
356	L	95.9	Very high	93	Very high	1 Å²	1	80.4 Å²	80.4	1%	0.005	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-47.5	-39.7	178.9	-179.4	69.6	0	0	0	112	C322 A326 L329 W330 V343 F358 L359 F364	C322-L356 HydrophobicContact CB-CD1 4.17Å; A326-L356 HydrophobicContact CB-CD1 3.63Å; A326-L356 HydrophobicContact CB-CD2 4.13Å; L329-L356 HydrophobicContact CB-CD2 4.14Å; L329-L356 HydrophobicContact CD2-CD2 3.61Å; L329-L356 HydrophobicContact CG-CD2 3.71Å; W330-L356 HydrophobicContact CB-CD1 4.27Å; W330-L356 HydrophobicContact CB-CG 4.31Å; W330-L356 VanDerWaalsContact CD1-O 3.28Å; V343-L356 HydrophobicContact CB-CB 3.99Å; V343-L356 HydrophobicContact CG1-CB 3.75Å; V343-L356 HydrophobicContact CG1-CD2 3.85Å; V343-L356 HydrophobicContact CG1-CG 4.46Å; V343-L356 PolarHBondContact O-N 3.47Å; L356-F358 PolarHBondContact O-N 3.32Å; L356-F358 VanDerWaalsContact O-N 3.14Å; L356-L359 HydrophobicContact CD1-CD1 3.97Å; L356-L359 WeakPolarHBondContact O-CB 3.38Å; L356-L359 PolarHBondContact O-N 2.9Å; L356-L359 VanDerWaalsContact O-N 3.13Å; L356-F364 HydrophobicContact CD1-CZ 4.05Å
357	R	93.8	Very high	92.5	Very high	54 Å²	54	79.4 Å²	79.4	20%	0.204	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-65	-18.4	-173.7	-58.2	175.8	-59.9	164.6	5.3	113.9	F333 S340 S341 V343 D355	F333-R357 HydrophobicContact CB-CG 4.46Å; F333-R357 HydrophobicContact CD1-CG 4.27Å; F333-R357 HydrophobicContact CD2-CG 3.92Å; F333-R357 HydrophobicContact CE2-CG 4.17Å; F333-R357 HydrophobicContact CG-CG 3.99Å; F333-R357 HydrophobicContact CZ-CG 4.46Å; S340-R357 PolarHBondContact O-NH1 2.9Å; S341-R357 PolarHBondContact O-NH1 2.98Å; V343-R357 HydrophobicContact CG2-CG 4.27Å; D355-R357 PolarHBondContact O-N 2.79Å; D355-R357 VanDerWaalsContact O-N 3.07Å; D355-R357 WeakPolarHBondContact OD1-CB 3.38Å; D355-R357 VanDerWaalsContact OD1-CG 3.3Å; D355-R357 WeakPolarHBondContact OD1-CG 3.22Å; D355-R357 PolarHBondContact OD1-N 3.18Å; D355-R357 IonicContact OD1-NE 3.17Å; D355-R357 PolarHBondContact OD1-NE 2.83Å; D355-R357 VanDerWaalsContact OD1-NE 3.1Å; D355-R357 IonicContact OD2-CZ 3.1Å; D355-R357 VanDerWaalsContact OD2-CZ 3.25Å; D355-R357 IonicContact OD2-NE 2.69Å; D355-R357 PolarHBondContact OD2-NE 3.43Å; D355-R357 IonicContact OD2-NH2 3.25Å; D355-R357 PolarHBondContact OD2-NH2 3.44Å
358	F	94.6	Very high	92	Very high	160 Å²	160	82.5 Å²	82.5	70%	0.702	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-107.5	4.7	179.1	-55.9	-55.2	0	0	0	113.8	D355 L356	D355-F358 HydrophobicContact CB-CD2 3.87Å; D355-F358 HydrophobicContact CB-CE2 4.31Å; D355-F358 PolarHBondContact O-N 2.85Å; D355-F358 VanDerWaalsContact O-N 3.08Å; L356-F358 PolarHBondContact O-N 3.32Å; L356-F358 VanDerWaalsContact O-N 3.14Å
359	L	93.6	Very high	90.9	Very high	14 Å²	14	87.1 Å²	87.1	7%	0.073	45%	0.451	C	S	.	.			trans	-65.6	157.7	168.2	-61.4	-171.9	0	0	0	111.1	C322 W330 Q354 L356 F364	C322-L359 HydrophobicContact CB-CD1 4.21Å; W330-L359 PolarHBondContact NE1-O 2.67Å; Q354-L359 HydrophobicContact CB-CD2 4.39Å; L356-L359 HydrophobicContact CD1-CD1 3.97Å; L356-L359 WeakPolarHBondContact O-CB 3.38Å; L356-L359 PolarHBondContact O-N 2.9Å; L356-L359 VanDerWaalsContact O-N 3.13Å; L359-F364 HydrophobicContact CB-CE2 3.99Å; L359-F364 HydrophobicContact CB-CZ 4.33Å; L359-F364 HydrophobicContact CD1-CE2 4.36Å; L359-F364 HydrophobicContact CD1-CZ 3.91Å
360	R	92.5	Very high	89.6	Confident	142 Å²	142	86.9 Å²	86.9	54%	0.536	45%	0.447	S	S	.	.			trans	-104.2	159.4	-176.4	-51.3	162.5	-62	172.8	6.6	110.2	M362 D363	R360-M362 HydrophobicContact CB-CE 4.15Å; R360-M362 HydrophobicContact CB-SD 4.41Å; R360-M362 PolarHBondContact O-N 2.71Å; R360-D363 WeakPolarHBondContact CA-OD2 3.07Å; R360-D363 VanDerWaalsContact CB-OD2 3.26Å; R360-D363 WeakPolarHBondContact CB-OD2 3.15Å; R360-D363 IonicContact CZ-OD1 3.64Å; R360-D363 IonicContact CZ-OD2 3.72Å; R360-D363 PolarHBondContact N-OD2 3.26Å; R360-D363 IonicContact NE-OD1 3.66Å; R360-D363 IonicContact NE-OD2 2.97Å; R360-D363 PolarHBondContact NE-OD2 2.64Å; R360-D363 IonicContact NH2-OD1 2.78Å; R360-D363 PolarHBondContact NH2-OD1 2.82Å; R360-D363 IonicContact NH2-OD2 3.56Å; R360-D363 VanDerWaalsContact O-CB 3.23Å; R360-D363 WeakPolarHBondContact O-CB 3.5Å; R360-D363 PolarHBondContact O-N 2.93Å
361	E	90.3	Very high	87.7	Confident	125 Å²	125	86.2 Å²	86.2	58%	0.584	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-57.2	-37.9	177.5	-166.6	177.8	175	0	0	112.8	W330 D363 F364 A365	W330-E361 HydrophobicContact CH2-CB 3.71Å; W330-E361 HydrophobicContact CH2-CG 3.98Å; W330-E361 HydrophobicContact CZ2-CB 4.3Å; W330-E361 HydrophobicContact CZ3-CG 4.43Å; E361-D363 PolarHBondContact O-N 3.34Å; E361-F364 CarbonylContact O-C 3.34Å; E361-F364 PolarHBondContact O-N 2.82Å; E361-A365 PolarHBondContact O-N 3.33Å
362	M	89.6	Confident	85.8	Confident	124 Å²	124	89.1 Å²	89.1	61%	0.611	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-60.5	-26.4	175.6	-59.6	83.4	76.9	0	0	113.2	R360 F364 A365	R360-M362 HydrophobicContact CB-CE 4.15Å; R360-M362 HydrophobicContact CB-SD 4.41Å; R360-M362 PolarHBondContact O-N 2.71Å; M362-F364 PolarHBondContact O-N 3.36Å; M362-A365 WeakPolarHBondContact O-CB 3.27Å; M362-A365 PolarHBondContact O-N 2.95Å
363	D	90.1	Very high	83.4	Confident	36 Å²	36	83.1 Å²	83.1	19%	0.193	47%	0.467	C	S	.	.	G	3₁₀ helix	trans	-71.6	-12.1	177.2	-56.2	-48.3	0	0	0	111.4	R351 R360 E361	R351-D363 PolarHBondContact NH1-O 2.8Å; R351-D363 PolarHBondContact NH2-O 3.28Å; R360-D363 WeakPolarHBondContact CA-OD2 3.07Å; R360-D363 VanDerWaalsContact CB-OD2 3.26Å; R360-D363 WeakPolarHBondContact CB-OD2 3.15Å; R360-D363 IonicContact CZ-OD1 3.64Å; R360-D363 IonicContact CZ-OD2 3.72Å; R360-D363 PolarHBondContact N-OD2 3.26Å; R360-D363 IonicContact NE-OD1 3.66Å; R360-D363 IonicContact NE-OD2 2.97Å; R360-D363 PolarHBondContact NE-OD2 2.64Å; R360-D363 IonicContact NH2-OD1 2.78Å; R360-D363 PolarHBondContact NH2-OD1 2.82Å; R360-D363 IonicContact NH2-OD2 3.56Å; R360-D363 VanDerWaalsContact O-CB 3.23Å; R360-D363 WeakPolarHBondContact O-CB 3.5Å; R360-D363 PolarHBondContact O-N 2.93Å; E361-D363 PolarHBondContact O-N 3.34Å
364	F	91.1	Very high	81.1	Confident	1 Å²	1	84.2 Å²	84.2	0%	0.004	47%	0.467	C	S	.	.	G	3₁₀ helix	trans	-116.2	6.9	172.9	-55.2	-81.6	0	0	0	113.8	G323 R327 W330 L356 L359 E361 M362 L366 C367	G323-F364 WeakPolarHBondContact O-CD1 3.3Å; G323-F364 VanDerWaalsContact O-CE1 3.26Å; G323-F364 WeakPolarHBondContact O-CE1 3.13Å; R327-F364 HydrophobicContact CB-CD1 3.78Å; R327-F364 HydrophobicContact CB-CE1 4.25Å; R327-F364 HydrophobicContact CB-CG 4.26Å; R327-F364 HydrophobicContact CG-CB 4.14Å; R327-F364 HydrophobicContact CG-CD1 4.24Å; R327-F364 HydrophobicContact CG-CG 4.21Å; R327-F364 PolarHBondContact NH1-O 2.93Å; W330-F364 HydrophobicContact CB-CE2 3.92Å; W330-F364 HydrophobicContact CB-CZ 3.81Å; W330-F364 AromaticContact CD1-CE2 3.84Å; W330-F364 AromaticContact CD2-CD2 3.87Å; W330-F364 HydrophobicContact CD2-CD2 3.87Å; W330-F364 AromaticContact CD2-CE2 3.44Å; W330-F364 HydrophobicContact CD2-CE2 3.44Å; W330-F364 VanDerWaalsContact CD2-CE2 3.44Å; W330-F364 HydrophobicContact CD2-CZ 4.26Å; W330-F364 AromaticContact CE2-CE2 3.93Å; W330-F364 AromaticContact CE3-CD2 3.8Å; W330-F364 HydrophobicContact CE3-CD2 3.8Å; W330-F364 AromaticContact CE3-CE2 3.84Å; W330-F364 HydrophobicContact CE3-CE2 3.84Å; W330-F364 HydrophobicContact CG-CD2 4.31Å; W330-F364 AromaticContact CG-CE2 3.44Å; W330-F364 HydrophobicContact CG-CE2 3.44Å; W330-F364 VanDerWaalsContact CG-CE2 3.44Å; W330-F364 AromaticContact CG-CZ 3.84Å; W330-F364 HydrophobicContact CG-CZ 3.84Å; W330-F364 HydrophobicContact CZ3-CD2 4.28Å; L356-F364 HydrophobicContact CD1-CZ 4.05Å; L359-F364 HydrophobicContact CB-CE2 3.99Å; L359-F364 HydrophobicContact CB-CZ 4.33Å; L359-F364 HydrophobicContact CD1-CE2 4.36Å; L359-F364 HydrophobicContact CD1-CZ 3.91Å; E361-F364 CarbonylContact O-C 3.34Å; E361-F364 PolarHBondContact O-N 2.82Å; M362-F364 PolarHBondContact O-N 3.36Å; F364-L366 VanDerWaalsContact C-N 3.31Å; F364-L366 PolarHBondContact O-N 2.85Å; F364-C367 VanDerWaalsContact O-CB 3.32Å; F364-C367 WeakPolarHBondContact O-CB 3.47Å; F364-C367 PolarHBondContact O-N 3.43Å
365	A	84.4	Confident	78.9	Confident	71 Å²	71	85 Å²	85	59%	0.587	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-21.4	-173.5	0	0	0	0	0	114.6	E361 M362	E361-A365 PolarHBondContact O-N 3.33Å; M362-A365 WeakPolarHBondContact O-CB 3.27Å; M362-A365 PolarHBondContact O-N 2.95Å
366	L	85.3	Confident	76.2	Confident	177 Å²	177	89 Å²	89	93%	0.927	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	2.1	176.1	-61.9	178.4	0	0	0	113.2	F364	F364-L366 VanDerWaalsContact C-N 3.31Å; F364-L366 PolarHBondContact O-N 2.85Å
367	C	88.2	Confident	73.7	Confident	19 Å²	19	92.9 Å²	92.9	13%	0.128	55%	0.549	C	S	.	.	S	Bend	trans	-76.8	141.7	-179.2	-65.8	0	0	0	0	111.6	C324 F364	C324-C367 WeakPolarHBondContact CA-SG 3.32Å; C324-C367 HydrophobicContact CB-CB 3.63Å; C324-C367 WeakPolarHBondContact CB-SG 3.2Å; C324-C367 WeakPolarHBondContact SG-CA 3.44Å; C324-C367 WeakPolarHBondContact SG-CB 3.41Å; C324-C367 CovalentContact SG-SG 2.04Å; C324-C367 PolarHBondContact SG-SG 2.97Å; F364-C367 VanDerWaalsContact O-CB 3.32Å; F364-C367 WeakPolarHBondContact O-CB 3.47Å; F364-C367 PolarHBondContact O-N 3.43Å
368	P	83.4	Confident	71.2	Confident	107 Å²	107	94.9 Å²	94.9	70%	0.695	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-60.5	142.1	172.3	27.5	-34.1	0	0	0	109.9
369	L	73.1	Confident	68.9	Low	146 Å²	146	93.2 Å²	93.2	76%	0.764	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-64.8	141.8	171.1	-69.9	170.5	0	0	0	109.2	D371	L369-D371 PolarHBondContact O-N 2.91Å
370	P	64.9	Low	66.5	Low	108 Å²	108	99.1 Å²	99.1	70%	0.701	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-63.7	128.1	179.8	25.3	-33.4	0	0	0	111.1
371	D	53.3	Low	64.1	Low	128 Å²	128	98.4 Å²	98.4	68%	0.684	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-61.4	127	-177.2	-77.3	-50.2	0	0	0	112.4	L369 G373 S374	L369-D371 PolarHBondContact O-N 2.91Å; D371-G373 PolarHBondContact O-N 3.47Å; D371-G373 VanDerWaalsContact O-N 3.09Å; D371-S374 PolarHBondContact O-N 2.86Å; D371-S374 VanDerWaalsContact O-N 3.17Å
372	P	53	Low	61.7	Low	104 Å²	104	99.3 Å²	99.3	68%	0.675	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-57.9	-24.8	174.1	-25	34.3	0	0	0	113.6	S374 I375	P372-S374 PolarHBondContact O-N 3.08Å; P372-I375 WeakPolarHBondContact O-CB 3.26Å; P372-I375 PolarHBondContact O-N 2.87Å
373	G	46.4	Very low	59.2	Low	66 Å²	66	102.8 Å²	102.8	68%	0.68	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-64.5	-20.2	179.2	0	0	0	0	0	114.7	D371 I375	D371-G373 PolarHBondContact O-N 3.47Å; D371-G373 VanDerWaalsContact O-N 3.09Å; G373-I375 PolarHBondContact O-N 2.77Å
374	S	45.9	Very low	56.8	Low	75 Å²	75	106.2 Å²	106.2	52%	0.524	68%	0.676	S	S	.	*	G	3₁₀ helix	trans	-79.5	2.1	172.4	-175.2	0	0	0	0	113.2	R277 D371 P372	R277-S374 PolarHBondContact NH1-OG 3.42Å; D371-S374 PolarHBondContact O-N 2.86Å; D371-S374 VanDerWaalsContact O-N 3.17Å; P372-S374 PolarHBondContact O-N 3.08Å
375	I	50.8	Low	54.4	Low	107 Å²	107	112.9 Å²	112.9	55%	0.549	72%	0.717	S	S	.	*	G	3₁₀ helix	trans	-118.7	27.8	-174.9	-39.9	177.5	0	0	0	110.5	P372 G373 G377 S378	P372-I375 WeakPolarHBondContact O-CB 3.26Å; P372-I375 PolarHBondContact O-N 2.87Å; G373-I375 PolarHBondContact O-N 2.77Å; I375-G377 PolarHBondContact O-N 3.43Å; I375-S378 PolarHBondContact O-N 2.8Å
376	A	39.1	Very low	52.3	Low	103 Å²	103	118.4 Å²	118.4	85%	0.851	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	77.7	170.7	0	0	0	0	0	110.7
377	G	43.6	Very low	50.3	Low	83 Å²	83	117 Å²	117	86%	0.856	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	172.2	-6.6	-173.8	0	0	0	0	0	115.5	I375	I375-G377 PolarHBondContact O-N 3.43Å
378	S	40.8	Very low	47.9	Very low	96 Å²	96	127 Å²	127	67%	0.671	76%	0.762	S	S	*	*			trans	-142.7	116.9	169	-170.2	0	0	0	0	111.2	I375	I375-S378 PolarHBondContact O-N 2.8Å
379	T	46.2	Very low	45.4	Very low	126 Å²	126	133.4 Å²	133.4	77%	0.773	77%	0.772	S	S	*	*			trans	-80.4	156	177.9	33	0	0	0	0	112.3
380	T	44.9	Very low	43.5	Very low	137 Å²	137	137.7 Å²	137.7	84%	0.84	78%	0.778	S	S	*	*			trans	62	92.2	165.1	43.3	0	0	0	0	118.1
381	T	41.4	Very low	42	Very low	128 Å²	128	142.5 Å²	142.5	79%	0.785	79%	0.789	S	S	*	*			trans	-110.4	120.2	142.3	51.3	0	0	0	0	109.6	F383	T381-F383 PolarHBondContact O-N 3.38Å
382	T	40.1	Very low	41	Very low	144 Å²	144	145.1 Å²	145.1	88%	0.883	80%	0.796	S	S	*	*			trans	-66.3	123.1	170.2	29.7	0	0	0	0	109.9	S384	T382-S384 PolarHBondContact O-N 2.81Å
383	F	37.6	Very low	40	Very low	196 Å²	196	149 Å²	149	86%	0.86	80%	0.803	S	S	*	*			trans	-64.3	116.7	-179.9	-84.5	-92.7	0	0	0	112.1	T381 T385	T381-F383 PolarHBondContact O-N 3.38Å; F383-T385 PolarHBondContact O-N 3.35Å
384	S	38.7	Very low	39.4	Very low	108 Å²	108	153.6 Å²	153.6	76%	0.755	81%	0.812	S	S	*	*			trans	-72.4	113.4	167.6	-176.9	0	0	0	0	110.1	T382 K386	T382-S384 PolarHBondContact O-N 2.81Å; S384-K386 VanDerWaalsContact C-N 3.34Å; S384-K386 PolarHBondContact O-N 2.81Å
385	T	41.1	Very low	38.6	Very low	141 Å²	141	160.1 Å²	160.1	87%	0.865	83%	0.83	S	S	*	*			trans	-81.3	70	-175.9	42.1	0	0	0	0	112.6	F383	F383-T385 PolarHBondContact O-N 3.35Å
386	K	39.4	Very low	37.6	Very low	188 Å²	188	161 Å²	161	82%	0.817	84%	0.843	S	S	*	*			trans	-136.5	36.8	176.3	-145.1	176.5	-178.1	178.7	0	117	S384	S384-K386 VanDerWaalsContact C-N 3.34Å; S384-K386 PolarHBondContact O-N 2.81Å
387	T	44.4	Very low	37.2	Very low	146 Å²	146	165.6 Å²	165.6	90%	0.896	85%	0.847	S	S	*	*			trans	-149.4	76.7	167	26	0	0	0	0	111.7
388	R	36.5	Very low	36.5	Very low	229 Å²	229	167 Å²	167	86%	0.864	84%	0.843	S	S	*	*			trans	-149.4	69.9	168.4	-167.2	-174.8	-74.7	-155.9	-1.6	112
389	W	31.1	Very low	35.9	Very low	242 Å²	242	167 Å²	167	92%	0.917	84%	0.844	S	S	*	*			trans	-143.1	30.2	178.3	-75.9	107.4	0	0	0	114.6
390	W	34.7	Very low	35.2	Very low	237 Å²	237	166.8 Å²	166.8	90%	0.898	84%	0.842	S	S	*	*	S	Bend	trans	-132.9	147.3	164.9	-70	92	0	0	0	109.5
391	F	33.8	Very low	34.5	Very low	209 Å²	209	169.6 Å²	169.6	92%	0.917	84%	0.843	S	S	*	*			trans	78.3	80.2	-165.3	-48.9	-62.4	0	0	0	116.3
392	H	30.4	Very low	33.9	Very low	182 Å²	182	166.4 Å²	166.4	84%	0.843	84%	0.835	S	S	*	*			trans	-126.8	141.3	151.9	-130.3	-75.4	0	0	0	109.1
393	K	33.7	Very low	33.2	Very low	187 Å²	187	166.8 Å²	166.8	81%	0.813	83%	0.83	S	S	*	*			trans	69.3	103.2	-174.5	-53.9	179.1	176.5	179.6	0	112.8
394	N	33.3	Very low	32.6	Very low	162 Å²	162	165.8 Å²	165.8	87%	0.866	83%	0.826	S	S	*	*				-147.7	146.7	62.2	-72.6	-33.6	0	0	0	112.9
395	K	28.8	Very low	32	Very low	211 Å²	211	168.3 Å²	168.3	92%	0.917	83%	0.826	S	S	*	*			trans	-114.9	137.8	168.3	-83.9	-172.8	174.8	-176.8	0	109.9
396	P	30.3	Very low	31.3	Very low	126 Å²	126	171 Å²	171	82%	0.818	83%	0.826	S	S	*	*			trans	-93.4	155.4	150.6	30.4	-21.2	0	0	0	111.6
397	Q	30	Very low	30.6	Very low	199 Å²	199	167.2 Å²	167.2	93%	0.93	82%	0.823	S	S	*	*			trans	-96.3	148.4	176	-73	171	-78.4	0	0	112.1
398	S	28.5	Very low	29.7	Very low	112 Å²	112	164.9 Å²	164.9	78%	0.783	81%	0.812	S	S	*	*			trans	176	115.4	138.9	-168.3	0	0	0	0	107.9
399	S	28.2	Very low	29.2	Very low	98 Å²	98	162.2 Å²	162.2	69%	0.685	81%	0.809	S	S	*	*				50.8	127.3	98.2	-156.6	0	0	0	0	113.8
400	T	33.4	Very low	28.9	Very low	120 Å²	120	156.7 Å²	156.7	74%	0.736	80%	0.803	S	S	*	*			cis	-159.1	168.6	42.8	-41.9	0	0	0	0	113.5
401	K	29.9	Very low	28.6	Very low	197 Å²	197	152.5 Å²	152.5	86%	0.857	80%	0.803	S	S	*	*			trans	-45.2	163.9	175.5	-54.6	164.4	-179.1	177.1	0	115.8
402	G	27.7	Very low	28.2	Very low	60 Å²	60	152 Å²	152	62%	0.619	80%	0.801	S	S	*	*			cis	-169.1	165.1	6.9	0	0	0	0	0	113
403	I	26.2	Very low	28.1	Very low	153 Å²	153	148.1 Å²	148.1	79%	0.785	80%	0.8	S	S	*	*				77	97.5	104.3	-66	172.1	0	0	0	112.7
404	F	25.1	Very low	27.7	Very low	174 Å²	174	142.7 Å²	142.7	76%	0.763	80%	0.797	S	S	*	*				77.5	145.3	101	-101.7	-124.3	0	0	0	113.6
405	E	25.2	Very low	27.4	Very low	161 Å²	161	142.3 Å²	142.3	75%	0.752	79%	0.794	S	S	*	*			cis	-157.5	-171.6	-6.1	-147.5	178.9	-175.4	0	0	109.7
406	K	26.7	Very low	27.3	Very low	199 Å²	199	143 Å²	143	87%	0.865	79%	0.792	S	S	*	*			trans	-136.8	120.7	-170.8	173	-164.3	176.5	-176	0	112.6
407	S	24.8	Very low	27.2	Very low	108 Å²	108	140.3 Å²	140.3	76%	0.755	79%	0.788	S	S	*	*			trans	-179.5	157.7	166.9	38.1	0	0	0	0	109.1
408	S	25.8	Very low	27.1	Very low	96 Å²	96	140.8 Å²	140.8	67%	0.671	79%	0.787	S	S	*	*			cis	173.6	179.3	-31	48.1	0	0	0	0	106.6
409	E	25.8	Very low	26.8	Very low	173 Å²	173	139 Å²	139	81%	0.808	79%	0.786	S	S	*	*			trans	77.3	110.8	169.4	-54.6	-170.7	163	0	0	116.2
410	T	25.2	Very low	27.1	Very low	126 Å²	126	140 Å²	140	77%	0.773	79%	0.79	S	S	*	*				81.5	112.2	55.3	61.5	0	0	0	0	116.3
411	V	27.2	Very low	26.6	Very low	150 Å²	150	139.3 Å²	139.3	91%	0.909	79%	0.79	S	S	*	*			trans	-146.6	143.3	142.3	176.9	0	0	0	0	109.5
412	K	26.1	Very low	26.2	Very low	199 Å²	199	136.2 Å²	136.2	87%	0.865	79%	0.788	S	S	*	*			trans	-106.4	152.2	170.1	-73.2	174.3	171.5	175.3	0	110.4
413	A	27.8	Very low	26	Very low	100 Å²	100	139 Å²	139	83%	0.826	79%	0.793	S	S	*	*				159.9	129.2	118.5	0	0	0	0	0	114.9
414	G	25.7	Very low	25.8	Very low	73 Å²	73	137.7 Å²	137.7	75%	0.753	79%	0.793	S	S	*	*			trans	53.8	165.9	150.8	0	0	0	0	0	121.4
415	L	27.2	Very low	25.9	Very low	153 Å²	153	134 Å²	134	80%	0.801	79%	0.788	S	S	*	*			cis	-166.7	145.9	-24.7	-120.1	171.7	0	0	0	107.9
416	Y	27.5	Very low	26	Very low	225 Å²	225	131.9 Å²	131.9	88%	0.882	79%	0.786	S	S	*	*			trans	63.6	131.8	171.1	-75.2	-75.6	0	0	0	121.5
417	G	26.9	Very low	25.9	Very low	70 Å²	70	129.3 Å²	129.3	72%	0.722	79%	0.786	S	S	*	*			trans	128.6	103.9	137.5	0	0	0	0	0	118.4
418	K	27.3	Very low	26	Very low	210 Å²	210	129.9 Å²	129.9	91%	0.913	78%	0.775	S	S	*	*			trans	13.1	131.1	153.3	-63.5	177.4	176.4	179.4	0	119.8
419	G	22.7	Very low	25.9	Very low	74 Å²	74	136.1 Å²	136.1	76%	0.763	79%	0.786	S	S	*	*			trans	-73	-164.1	162.9	0	0	0	0	0	113.8
420	P	34.1	Very low	26.1	Very low	119 Å²	119	134.8 Å²	134.8	77%	0.773	78%	0.78	S	S	*	*			cis	-137.3	-173.1	15.6	42.7	-24.6	0	0	0	116.1
421	S	23.2	Very low	26.8	Very low	106 Å²	106	136.8 Å²	136.8	74%	0.741	79%	0.785	S	S	*	*			trans	74.6	110.8	149.7	-56.6	0	0	0	0	122
422	T	23.1	Very low	26.9	Very low	132 Å²	132	133.6 Å²	133.6	81%	0.81	77%	0.774	S	S	*	*			trans	-170.5	122.5	142.1	17.4	0	0	0	0	107
423	T	21.8	Very low	27.2	Very low	118 Å²	118	131.1 Å²	131.1	72%	0.724	77%	0.77	S	S	*	*				40.3	135.2	69.8	61.2	0	0	0	0	113.2
424	T	23.3	Very low	27.5	Very low	126 Å²	126	135.4 Å²	135.4	77%	0.773	77%	0.773	S	S	*	*			cis	-171.1	162.1	0.5	15.4	0	0	0	0	105.8
425	S	27.3	Very low	27.9	Very low	96 Å²	96	141.4 Å²	141.4	67%	0.671	78%	0.782	S	S	*	*			cis	-171.9	153.1	-0.5	44.3	0	0	0	0	110.5
426	V	25.7	Very low	28.2	Very low	116 Å²	116	141.8 Å²	141.8	70%	0.703	78%	0.784	S	S	*	*			trans	48.8	119.3	135.8	179.3	0	0	0	0	119.6	K428	V426-K428 HydrophobicContact CG1-CB 3.82Å
427	V	26.3	Very low	28.7	Very low	145 Å²	145	135.4 Å²	135.4	88%	0.879	78%	0.778	S	S	*	*				-121.5	132.5	115	179.7	0	0	0	0	107.8
428	K	25.4	Very low	29	Very low	120 Å²	120	140 Å²	140	52%	0.522	79%	0.785	S	S	.	*			trans	-124.1	140.6	-171.5	178.7	-161.2	-161.7	-153.4	0	107.4	V426 E430	V426-K428 HydrophobicContact CG1-CB 3.82Å; K428-E430 HydrophobicContact CD-CG 4.28Å; K428-E430 WeakPolarHBondContact CE-OE1 3.27Å; K428-E430 VanDerWaalsContact CE-OE2 3.25Å; K428-E430 WeakPolarHBondContact CE-OE2 3.48Å; K428-E430 HydrophobicContact CG-CG 4.3Å; K428-E430 IonicContact NZ-OE1 3.46Å; K428-E430 PolarHBondContact NZ-OE1 3.5Å; K428-E430 IonicContact NZ-OE2 4Å; K428-E430 PolarHBondContact NZ-OE2 3.33Å
429	Y	24.8	Very low	29.5	Very low	228 Å²	228	135.9 Å²	135.9	89%	0.894	78%	0.779	S	S	*	*			trans	-140.2	144.5	151.5	-93.5	-76.3	0	0	0	108.9
430	E	29.7	Very low	30	Very low	144 Å²	144	141.9 Å²	141.9	67%	0.673	78%	0.784	S	S	*	*			trans	-104.9	167.2	-159.5	-89.8	167.2	127.6	0	0	115.1	K428	K428-E430 HydrophobicContact CD-CG 4.28Å; K428-E430 WeakPolarHBondContact CE-OE1 3.27Å; K428-E430 VanDerWaalsContact CE-OE2 3.25Å; K428-E430 WeakPolarHBondContact CE-OE2 3.48Å; K428-E430 HydrophobicContact CG-CG 4.3Å; K428-E430 IonicContact NZ-OE1 3.46Å; K428-E430 PolarHBondContact NZ-OE1 3.5Å; K428-E430 IonicContact NZ-OE2 4Å; K428-E430 PolarHBondContact NZ-OE2 3.33Å
431	L	39.1	Very low	30.1	Very low	169 Å²	169	144.3 Å²	144.3	89%	0.885	79%	0.79	S	S	*	*			trans	-86	162.5	-175.8	-68.5	79.9	0	0	0	113.6
432	A	30.4	Very low	30.8	Very low	83 Å²	83	146.9 Å²	146.9	69%	0.686	80%	0.795	S	S	*	*			trans	-168.6	151.4	133.1	0	0	0	0	0	107.2
433	D	32.7	Very low	31.5	Very low	147 Å²	147	146 Å²	146	79%	0.786	79%	0.792	S	S	*	*	S	Bend	cis	-157.6	177.9	-20.7	-98.1	-35	0	0	0	106.8
434	E	33	Very low	32.1	Very low	190 Å²	190	149.5 Å²	149.5	89%	0.888	80%	0.8	S	S	*	*			trans	81	23.2	178.7	-56.8	-158.1	130.5	0	0	119.4	L436	E434-L436 PolarHBondContact O-N 3.26Å
435	E	35.1	Very low	32.6	Very low	199 Å²	199	153.4 Å²	153.4	93%	0.93	81%	0.81	S	S	*	*			trans	-89.8	59.7	154.6	-157.2	175.3	-167.7	0	0	110.8
436	L	32.4	Very low	32.7	Very low	160 Å²	160	157.7 Å²	157.7	84%	0.838	81%	0.812	S	S	*	*			trans	-132	60.3	-174.3	-92.2	174.5	0	0	0	113.5	E434	E434-L436 PolarHBondContact O-N 3.26Å
437	A	38	Very low	32.8	Very low	92 Å²	92	160.9 Å²	160.9	76%	0.76	81%	0.812	S	S	*	*			trans	-164.9	94.3	156.8	0	0	0	0	0	112.6
438	L	33	Very low	33.1	Very low	167 Å²	167	159.2 Å²	159.2	87%	0.874	81%	0.813	S	S	*	*			trans	177.2	139	136.4	-95.6	160.9	0	0	0	110.3
439	P	38.2	Very low	33.2	Very low	122 Å²	122	158.8 Å²	158.8	79%	0.792	82%	0.817	S	S	*	*			trans	-76.2	146.6	-175.2	-13.5	29.6	0	0	0	113.5
440	K	34.4	Very low	33.3	Very low	200 Å²	200	158.5 Å²	158.5	87%	0.87	82%	0.815	S	S	*	*			trans	-101	138.2	169	-66	175.8	-179.1	173.2	0	109.5
441	L	35	Very low	33.2	Very low	170 Å²	170	155 Å²	155	89%	0.89	82%	0.819	S	S	*	*			trans	-108.5	131.6	171	-87.7	151	0	0	0	108
442	D	38	Very low	32.8	Very low	160 Å²	160	154.3 Å²	154.3	86%	0.856	82%	0.816	S	S	*	*			trans	-82.5	141.2	-179.3	-72.2	-40.5	0	0	0	112
443	P	37.8	Very low	32.8	Very low	113 Å²	113	159 Å²	159	73%	0.734	82%	0.824	S	S	*	*			trans	-99.7	118.2	173.5	34.7	-27.4	0	0	0	111.9
444	E	34.8	Very low	32.8	Very low	193 Å²	193	160.8 Å²	160.8	90%	0.902	83%	0.827	S	S	*	*			trans	170	94.6	137.5	-97.1	173	-164	0	0	111.5
445	E	33.9	Very low	33.3	Very low	208 Å²	208	157.4 Å²	157.4	97%	0.972	82%	0.821	S	S	*	*			trans	-156.3	85.5	139.5	-125.7	177.3	-165.3	0	0	109.2
446	Y	28.7	Very low	33.1	Very low	185 Å²	185	151.2 Å²	151.2	73%	0.725	81%	0.812	S	S	*	*			trans	-120.6	136.3	175.4	-167.5	-124.1	0	0	0	107.6
447	W	28.4	Very low	33.1	Very low	184 Å²	184	150.6 Å²	150.6	70%	0.697	81%	0.814	S	S	*	*			trans	82.5	78.1	-175.2	-45.4	112.3	0	0	0	118.4
448	A	31.8	Very low	32.8	Very low	110 Å²	110	151.1 Å²	151.1	91%	0.909	81%	0.812	S	S	*	*			trans	-121.2	132.6	132.1	0	0	0	0	0	107.6
449	N	27.7	Very low	32.9	Very low	110 Å²	110	149.5 Å²	149.5	59%	0.588	81%	0.809	S	S	*	*			trans	-133.3	144.6	-154.1	-147	5.1	0	0	0	111.1
450	Y	27.3	Very low	32.6	Very low	222 Å²	222	154.8 Å²	154.8	87%	0.871	81%	0.813	S	S	*	*			trans	62.7	132.8	171	-76.7	-94.9	0	0	0	119.8
451	G	27.6	Very low	32.5	Very low	72 Å²	72	150.7 Å²	150.7	74%	0.742	81%	0.808	S	S	*	*			trans	148.4	68.7	151.1	0	0	0	0	0	119
452	N	30.2	Very low	32.4	Very low	154 Å²	154	152.5 Å²	152.5	82%	0.824	81%	0.809	S	S	*	*			trans	52.3	151.7	139	-94.8	23.5	0	0	0	124.1
453	E	30.6	Very low	32.2	Very low	182 Å²	182	153.2 Å²	153.2	85%	0.85	81%	0.807	S	S	*	*			trans	87.9	113.1	158.5	-36.7	-150.1	156.1	0	0	119.6
454	E	32.7	Very low	32.1	Very low	184 Å²	184	155.4 Å²	155.4	86%	0.86	81%	0.812	S	S	*	*			trans	-76.1	179.8	157.5	-76.3	-167.4	173.1	0	0	111.3
455	P	43.8	Very low	32	Very low	118 Å²	118	155.2 Å²	155.2	77%	0.766	81%	0.811	S	S	*	*			cis	-129.2	143.8	-35.4	28.6	-11.8	0	0	0	111.9
456	G	31.1	Very low	31.8	Very low	70 Å²	70	151.4 Å²	151.4	72%	0.722	81%	0.806	S	S	*	*			trans	176.8	117.5	169.9	0	0	0	0	0	117.5
457	V	32.5	Very low	32.1	Very low	147 Å²	147	148.5 Å²	148.5	89%	0.891	81%	0.81	S	S	*	*			trans	43.8	101.1	146.3	-168.5	0	0	0	0	117.8
458	S	30.3	Very low	32.9	Very low	102 Å²	102	145.3 Å²	145.3	71%	0.713	81%	0.813	S	S	*	*				-175.2	117.4	111.5	39.9	0	0	0	0	112
459	V	35.3	Very low	32.8	Very low	133 Å²	133	147.9 Å²	147.9	81%	0.806	81%	0.806	S	S	*	*			trans	-75.6	128.9	165	175.7	0	0	0	0	107.9
460	R	32.8	Very low	32.9	Very low	234 Å²	234	153 Å²	153	88%	0.883	82%	0.823	S	S	*	*			trans	-102.7	104.9	165.9	-74	-174.5	177.5	176.3	-0.2	109.3
461	C	32	Very low	33	Very low	114 Å²	114	149.1 Å²	149.1	77%	0.77	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-87.5	147.3	163.2	-66.8	0	0	0	0	109.5
462	F	34	Very low	33.2	Very low	208 Å²	208	153.8 Å²	153.8	91%	0.912	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-90.9	143.1	169.3	-101	-97.5	0	0	0	110.4
463	E	32.2	Very low	33.7	Very low	175 Å²	175	151.7 Å²	151.7	82%	0.818	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-61.2	158.8	172.8	-74.1	160.6	117.5	0	0	112
464	L	35.9	Very low	33.8	Very low	159 Å²	159	149.2 Å²	149.2	83%	0.832	82%	0.819	S	S	*	*			cis	-150.5	174.8	46.5	-93.5	99.3	0	0	0	114.4
465	E	32.1	Very low	33.7	Very low	188 Å²	188	146 Å²	146	88%	0.879	82%	0.817	S	S	*	*			trans	88.5	87.6	163.8	-69.3	176	179.1	0	0	119.2
466	C	29.8	Very low	33.1	Very low	129 Å²	129	146.2 Å²	146.2	87%	0.872	82%	0.821	S	S	*	*			trans	-130.2	141.6	161.1	-75.4	0	0	0	0	111.2
467	P	37	Very low	33.2	Very low	124 Å²	124	148 Å²	148	81%	0.805	82%	0.823	S	S	*	*			trans	-89.2	167.6	161.7	11.1	7.7	0	0	0	112.4
468	P	43.6	Very low	33.5	Very low	116 Å²	116	146.3 Å²	146.3	75%	0.753	82%	0.815	S	S	*	*			trans	-94.9	150.8	-152.3	35.6	-37.4	0	0	0	117.9
469	E	29.8	Very low	33.8	Very low	165 Å²	165	147.6 Å²	147.6	77%	0.771	82%	0.821	S	S	*	*			trans	34	121.4	142.1	-65.3	174.3	164.5	0	0	121.4
470	F	29.5	Very low	33.6	Very low	217 Å²	217	153 Å²	153	95%	0.952	83%	0.827	S	S	*	*			trans	-143.5	110.4	138.2	-109.7	-80.9	0	0	0	109.8
471	D	29.5	Very low	33.8	Very low	140 Å²	140	147.4 Å²	147.4	75%	0.749	82%	0.824	S	S	*	*			trans	-77.6	136.1	178	-76.6	-51.9	0	0	0	113
472	L	33.2	Very low	34.2	Very low	170 Å²	170	147.7 Å²	147.7	89%	0.89	83%	0.827	S	S	*	*			trans	-144.7	137.5	151	-85.4	179.5	0	0	0	110.8
473	P	39.3	Very low	35	Very low	110 Å²	110	142.7 Å²	142.7	71%	0.714	82%	0.818	S	S	*	*			trans	-87.6	161.5	-168.8	34.9	-37.3	0	0	0	114.4	S475	P473-S475 PolarHBondContact O-N 3.42Å
474	P	33.2	Very low	35.7	Very low	130 Å²	130	138.6 Å²	138.6	84%	0.844	81%	0.806	S	S	*	*			trans	-80.9	117.1	179.3	31.9	-33.5	0	0	0	112.3	S476	P474-S476 PolarHBondContact O-N 3.01Å
475	S	30.7	Very low	36.8	Very low	116 Å²	116	134.4 Å²	134.4	81%	0.811	79%	0.79	S	S	*	*			trans	-84.8	110.3	169.8	62.3	0	0	0	0	111.3	P473	P473-S475 PolarHBondContact O-N 3.42Å
476	S	31	Very low	37.6	Very low	123 Å²	123	132.2 Å²	132.2	86%	0.86	78%	0.784	S	S	*	*			trans	-75.1	137.7	167.5	50.3	0	0	0	0	111.2	P474	P474-S476 PolarHBondContact O-N 3.01Å
477	S	32.5	Very low	38.6	Very low	108 Å²	108	132.6 Å²	132.6	76%	0.755	78%	0.777	S	S	*	*			trans	-145.3	138.8	166.8	61.8	0	0	0	0	110.3
478	P	39.7	Very low	39.4	Very low	111 Å²	111	128.8 Å²	128.8	72%	0.721	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-80.2	157.1	-176.6	33.1	-35.5	0	0	0	111.7	R480	P478-R480 PolarHBondContact O-N 3.03Å
479	P	37.4	Very low	39.8	Very low	130 Å²	130	128 Å²	128	84%	0.844	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-66.5	126.4	176.3	28.1	-33.7	0	0	0	110.6
480	R	31.4	Very low	41	Very low	245 Å²	245	125 Å²	125	93%	0.925	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-72	140.3	170.4	-73.3	-179.6	174.4	179	-1.6	110.1	P478 S482	P478-R480 PolarHBondContact O-N 3.03Å; R480-S482 PolarHBondContact O-N 3.44Å
481	S	36.7	Very low	42.3	Very low	118 Å²	118	117.7 Å²	117.7	83%	0.825	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-59.6	127.6	170.5	39.5	0	0	0	0	111.1	S483	S481-S483 PolarHBondContact O-N 2.91Å
482	S	40.2	Very low	43.7	Very low	119 Å²	119	116.4 Å²	116.4	83%	0.832	70%	0.703	S	S	*	*			trans	-74.9	108.1	172.9	50.7	0	0	0	0	110.1	R480	R480-S482 PolarHBondContact O-N 3.44Å
483	S	50.3	Low	45	Very low	104 Å²	104	110.6 Å²	110.6	73%	0.727	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-61.9	143.1	162.2	47.1	0	0	0	0	110.1	S481	S481-S483 PolarHBondContact O-N 2.91Å
484	P	46.6	Very low	46.3	Very low	88 Å²	88	109.6 Å²	109.6	57%	0.571	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-63.2	139.6	176.1	26	-33.1	0	0	0	110.3	S488	P484-S488 WeakPolarHBondContact CB-OG 3.32Å
485	S	58.8	Low	48	Very low	71 Å²	71	110.1 Å²	110.1	50%	0.497	66%	0.658	S	S	.	*	P	Polyproline II helix	trans	-69.4	151.4	178.9	61.7	0	0	0	0	111.1	L487 S488 L489	S485-L487 PolarHBondContact O-N 3.36Å; S485-S488 PolarHBondContact O-N 3.05Å; S485-S488 PolarHBondContact O-OG 3.41Å; S485-S488 VanDerWaalsContact O-OG 3.05Å; S485-L489 PolarHBondContact O-N 2.94Å
486	L	49.1	Very low	49.7	Very low	142 Å²	142	108.1 Å²	108.1	74%	0.743	64%	0.641	S	S	*	*	H	α-helix	trans	-52.6	-28	175.7	-85.8	156.8	0	0	0	112.9	L490	L486-L490 WeakPolarHBondContact O-CG 3.44Å; L486-L490 PolarHBondContact O-N 3.03Å
487	L	51.8	Low	51.5	Low	137 Å²	137	107 Å²	107	72%	0.717	62%	0.624	S	S	*	*	H	α-helix	trans	-65.8	-36.9	174.5	-80.4	157.9	0	0	0	113.7	S485 A491	S485-L487 PolarHBondContact O-N 3.36Å; L487-A491 WeakPolarHBondContact O-CB 3.43Å; L487-A491 PolarHBondContact O-N 2.98Å
488	S	53.1	Low	52.9	Low	45 Å²	45	104.9 Å²	104.9	32%	0.315	61%	0.608	S	S	.	*	H	α-helix	trans	-75	-32.7	177.6	69.7	0	0	0	0	112.1	P484 S485 A491 L492	P484-S488 WeakPolarHBondContact CB-OG 3.32Å; S485-S488 PolarHBondContact O-N 3.05Å; S485-S488 PolarHBondContact O-OG 3.41Å; S485-S488 VanDerWaalsContact O-OG 3.05Å; S488-A491 PolarHBondContact O-N 3.08Å; S488-L492 PolarHBondContact O-N 3.04Å
489	L	52.7	Low	54.1	Low	98 Å²	98	103.7 Å²	103.7	51%	0.513	60%	0.595	S	S	.	*	H	α-helix	trans	-66.8	-39.7	172.6	-73.8	166	0	0	0	111.8	S485 L492 S493	S485-L489 PolarHBondContact O-N 2.94Å; L489-L492 PolarHBondContact O-N 3.02Å; L489-S493 PolarHBondContact O-N 3.33Å; L489-S493 VanDerWaalsContact O-N 3.08Å
490	L	53.9	Low	55.2	Low	104 Å²	104	103.5 Å²	103.5	55%	0.545	58%	0.583	S	S	.	*	H	α-helix	trans	-66.6	-39.3	172.1	-73.5	167.5	0	0	0	112.4	L486 L492 S493 V494	L486-L490 WeakPolarHBondContact O-CG 3.44Å; L486-L490 PolarHBondContact O-N 3.03Å; L490-L492 VanDerWaalsContact C-N 3.35Å; L490-L492 PolarHBondContact O-N 3.48Å; L490-S493 PolarHBondContact O-N 2.98Å; L490-S493 PolarHBondContact O-OG 3.26Å; L490-V494 WeakPolarHBondContact O-CG2 3.45Å; L490-V494 PolarHBondContact O-N 3.05Å
491	A	57.2	Low	56.6	Low	63 Å²	63	98.7 Å²	98.7	52%	0.521	58%	0.575	S	S	.	*	H	α-helix	trans	-63	-40.8	175.7	0	0	0	0	0	112.2	L487 S488 F495	L487-A491 WeakPolarHBondContact O-CB 3.43Å; L487-A491 PolarHBondContact O-N 2.98Å; S488-A491 PolarHBondContact O-N 3.08Å; A491-F495 WeakPolarHBondContact O-CB 3.38Å; A491-F495 PolarHBondContact O-N 3.04Å
492	L	58.3	Low	57.6	Low	112 Å²	112	99.5 Å²	99.5	59%	0.586	57%	0.569	S	S	*	*	H	α-helix	trans	-64.9	-39.4	174.7	-91.9	150.5	0	0	0	112.7	S488 L489 L490 F495 T496	S488-L492 PolarHBondContact O-N 3.04Å; L489-L492 PolarHBondContact O-N 3.02Å; L490-L492 VanDerWaalsContact C-N 3.35Å; L490-L492 PolarHBondContact O-N 3.48Å; L492-F495 PolarHBondContact O-N 3.49Å; L492-T496 PolarHBondContact O-N 3.49Å; L492-T496 PolarHBondContact O-OG1 2.98Å
493	S	61.8	Low	58.4	Low	48 Å²	48	102.2 Å²	102.2	34%	0.336	57%	0.566	S	S	.	*	H	α-helix	trans	-70.2	-36.3	177.5	69.9	0	0	0	0	113	L489 L490 F495 T496 I497	L489-S493 PolarHBondContact O-N 3.33Å; L489-S493 VanDerWaalsContact O-N 3.08Å; L490-S493 PolarHBondContact O-N 2.98Å; L490-S493 PolarHBondContact O-OG 3.26Å; S493-F495 VanDerWaalsContact C-N 3.33Å; S493-T496 PolarHBondContact O-OG1 3.07Å; S493-T496 VanDerWaalsContact O-OG1 3.09Å; S493-I497 WeakPolarHBondContact O-CB 3.46Å; S493-I497 WeakPolarHBondContact O-CD1 3.45Å; S493-I497 WeakPolarHBondContact O-CG1 3.21Å; S493-I497 PolarHBondContact O-N 3.09Å; S493-I497 VanDerWaalsContact O-N 3.07Å
494	V	66.9	Low	58.2	Low	90 Å²	90	102.5 Å²	102.5	55%	0.545	59%	0.585	S	S	.	*	H	α-helix	trans	-66.3	-37.9	172.8	173.8	0	0	0	0	110.9	L490 C498	L490-V494 WeakPolarHBondContact O-CG2 3.45Å; L490-V494 PolarHBondContact O-N 3.05Å; V494-C498 WeakPolarHBondContact O-CB 3.38Å; V494-C498 PolarHBondContact O-N 3.44Å
495	F	68.5	Low	58.8	Low	141 Å²	141	103.2 Å²	103.2	62%	0.618	59%	0.586	S	S	*	*	H	α-helix	trans	-66.6	-41.7	178	-162	-97.5	0	0	0	112.5	A491 L492 S493 C498 L499	A491-F495 WeakPolarHBondContact O-CB 3.38Å; A491-F495 PolarHBondContact O-N 3.04Å; L492-F495 PolarHBondContact O-N 3.49Å; S493-F495 VanDerWaalsContact C-N 3.33Å; F495-C498 PolarHBondContact O-N 3.12Å; F495-L499 HydrophobicContact CD1-CD1 4Å; F495-L499 HydrophobicContact CE1-CD1 3.51Å; F495-L499 HydrophobicContact CZ-CD1 4.1Å; F495-L499 PolarHBondContact O-N 3.47Å
496	T	66	Low	58.8	Low	74 Å²	74	104.9 Å²	104.9	45%	0.454	59%	0.591	S	S	.	*	H	α-helix	trans	-69.8	-36.4	176.5	52.6	0	0	0	0	112.9	L492 S493 L499 H500	L492-T496 PolarHBondContact O-N 3.49Å; L492-T496 PolarHBondContact O-OG1 2.98Å; S493-T496 PolarHBondContact O-OG1 3.07Å; S493-T496 VanDerWaalsContact O-OG1 3.09Å; T496-L499 PolarHBondContact O-N 3.04Å; T496-H500 PolarHBondContact O-N 3.27Å
497	I	69.1	Low	59.3	Low	100 Å²	100	102.8 Å²	102.8	51%	0.513	58%	0.582	S	S	.	*	H	α-helix	trans	-64.1	-43	173.3	-69.3	165.9	0	0	0	110.9	S493 L499 H500 L501	S493-I497 WeakPolarHBondContact O-CB 3.46Å; S493-I497 WeakPolarHBondContact O-CD1 3.45Å; S493-I497 WeakPolarHBondContact O-CG1 3.21Å; S493-I497 PolarHBondContact O-N 3.09Å; S493-I497 VanDerWaalsContact O-N 3.07Å; I497-L499 VanDerWaalsContact C-N 3.33Å; I497-L499 PolarHBondContact O-N 3.24Å; I497-H500 PolarHBondContact O-N 3.17Å; I497-L501 HydrophobicContact CG2-CD1 3.95Å; I497-L501 WeakPolarHBondContact O-CB 3.37Å; I497-L501 WeakPolarHBondContact O-CG 3.38Å; I497-L501 PolarHBondContact O-N 3.14Å
498	C	61.9	Low	59.7	Low	63 Å²	63	100.8 Å²	100.8	43%	0.426	57%	0.574	S	S	.	*	H	α-helix	trans	-63.8	-35.5	173.6	-81.7	0	0	0	0	113	V494 F495 L502	V494-C498 WeakPolarHBondContact O-CB 3.38Å; V494-C498 PolarHBondContact O-N 3.44Å; F495-C498 PolarHBondContact O-N 3.12Å; C498-L502 WeakPolarHBondContact O-CB 3.49Å; C498-L502 WeakPolarHBondContact O-CG 3.47Å; C498-L502 PolarHBondContact O-N 3.14Å; C498-L502 VanDerWaalsContact O-N 3.17Å
499	L	63.6	Low	60.2	Low	85 Å²	85	104.3 Å²	104.3	45%	0.445	59%	0.59	S	S	.	*	H	α-helix	trans	-68.3	-43.4	178.1	-128.3	109	0	0	0	111.9	F495 T496 I497 L502 F503	F495-L499 HydrophobicContact CD1-CD1 4Å; F495-L499 HydrophobicContact CE1-CD1 3.51Å; F495-L499 HydrophobicContact CZ-CD1 4.1Å; F495-L499 PolarHBondContact O-N 3.47Å; T496-L499 PolarHBondContact O-N 3.04Å; I497-L499 VanDerWaalsContact C-N 3.33Å; I497-L499 PolarHBondContact O-N 3.24Å; L499-L502 PolarHBondContact O-N 3.47Å; L499-F503 HydrophobicContact CG-CD2 4.43Å; L499-F503 PolarHBondContact O-N 3.4Å; L499-F503 VanDerWaalsContact O-N 3.12Å
500	H	62.3	Low	60.7	Low	126 Å²	126	104.7 Å²	104.7	58%	0.583	60%	0.596	S	S	*	*	H	α-helix	trans	-62.1	-44.6	173.5	-88.6	-67.8	0	0	0	112	T496 I497 L502 F503 G504	T496-H500 PolarHBondContact O-N 3.27Å; I497-H500 PolarHBondContact O-N 3.17Å; H500-L502 PolarHBondContact O-N 3Å; H500-L502 VanDerWaalsContact O-N 3.14Å; H500-F503 PolarHBondContact O-N 2.89Å; H500-G504 PolarHBondContact ND1-O 2.79Å; H500-G504 CarbonylContact O-C 3.45Å; H500-G504 PolarHBondContact O-N 3.29Å
501	L	60.7	Low	61.1	Low	144 Å²	144	104.8 Å²	104.8	75%	0.754	60%	0.599	S	S	*	*	H	α-helix	trans	-65	-17.1	177.5	-73	169.5	0	0	0	114.4	I497	I497-L501 HydrophobicContact CG2-CD1 3.95Å; I497-L501 WeakPolarHBondContact O-CB 3.37Å; I497-L501 WeakPolarHBondContact O-CG 3.38Å; I497-L501 PolarHBondContact O-N 3.14Å
502	L	56.7	Low	61.4	Low	136 Å²	136	108 Å²	108	71%	0.712	61%	0.605	S	S	*	*	H	α-helix	trans	-96.3	-23.4	177.2	-78	167.8	0	0	0	114.2	C498 L499 H500	C498-L502 WeakPolarHBondContact O-CB 3.49Å; C498-L502 WeakPolarHBondContact O-CG 3.47Å; C498-L502 PolarHBondContact O-N 3.14Å; C498-L502 VanDerWaalsContact O-N 3.17Å; L499-L502 PolarHBondContact O-N 3.47Å; H500-L502 PolarHBondContact O-N 3Å; H500-L502 VanDerWaalsContact O-N 3.14Å
503	F	56.5	Low	61.7	Low	176 Å²	176	107.7 Å²	107.7	77%	0.772	61%	0.607	S	S	*	*	H	α-helix	trans	-124.3	-9.6	-172.9	-69.9	-76.1	0	0	0	115.8	L499 H500	L499-F503 HydrophobicContact CG-CD2 4.43Å; L499-F503 PolarHBondContact O-N 3.4Å; L499-F503 VanDerWaalsContact O-N 3.12Å; H500-F503 PolarHBondContact O-N 2.89Å
504	G	46.5	Very low	61.7	Low	109 Å²	109	113.1 Å²	113.1	100%	1.124	63%	0.631	S	S	*	*			trans	114.6	0	-178.5	0	0	0	0	0	113	H500	H500-G504 PolarHBondContact ND1-O 2.79Å; H500-G504 CarbonylContact O-C 3.45Å; H500-G504 PolarHBondContact O-N 3.29Å

Retrieved 504 of 504 residues in 86.2 ms (Link to these results)

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