A0A087XX78_POEFO Loading...

protein acetyllysine N-acetyltransferase

AlphaFold DB , UniProt , Accession A0A087XX78, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 677 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.4	Very low	32.5	Very low	241 Å²	241	132.5 Å²	132.5	100%	1.187	77%	0.77	S	S	*	*				0	74.9	0	-57.5	178.2	-173	0	0	105.3
2	A	33.1	Very low	32.1	Very low	82 Å²	82	132.3 Å²	132.3	68%	0.678	78%	0.779	S	S	*	*			cis	68.4	125.3	39.9	0	0	0	0	0	112.5
3	D	34.3	Very low	32	Very low	132 Å²	132	130.9 Å²	130.9	71%	0.706	78%	0.781	S	S	*	*			cis	-159.7	160.8	-11	-114.2	-45.6	0	0	0	113.1
4	R	34	Very low	31.6	Very low	187 Å²	187	126.1 Å²	126.1	71%	0.706	77%	0.771	S	S	*	*			trans	3.6	158.8	132.1	-62.3	168.9	90.7	-174.1	-3.6	118.3
5	E	38.8	Very low	31.3	Very low	130 Å²	130	127.4 Å²	127.4	61%	0.607	78%	0.78	S	S	*	*			cis	-165.4	146.8	1.2	-112.9	161.2	178.3	0	0	106.7
6	N	35.2	Very low	31.2	Very low	139 Å²	139	124.8 Å²	124.8	74%	0.743	77%	0.768	S	S	*	*				73.4	162.5	81.8	-159.8	16.1	0	0	0	115.8
7	A	29.6	Very low	31.1	Very low	85 Å²	85	127.7 Å²	127.7	70%	0.702	77%	0.771	S	S	*	*			trans	75.1	157	178.5	0	0	0	0	0	117.5
8	L	31.1	Very low	31	Very low	165 Å²	165	129.1 Å²	129.1	86%	0.864	77%	0.77	S	S	*	*			cis	161.1	143.1	-38.3	-101.7	163.1	0	0	0	108.2
9	G	27.8	Very low	30.9	Very low	65 Å²	65	130.3 Å²	130.3	67%	0.67	77%	0.772	S	S	*	*			trans	83.8	161.5	167.5	0	0	0	0	0	115.8
10	T	28.9	Very low	31.1	Very low	145 Å²	145	132.4 Å²	132.4	89%	0.89	77%	0.774	S	S	*	*			cis	-150.9	153.5	-5.7	-58.2	0	0	0	0	108.7
11	A	29.7	Very low	31.5	Very low	87 Å²	87	132 Å²	132	72%	0.719	78%	0.776	S	S	*	*			trans	-75.2	154	175	0	0	0	0	0	112.7
12	C	27.5	Very low	31.2	Very low	129 Å²	129	126.3 Å²	126.3	87%	0.872	75%	0.749	S	S	*	*				-169	143.4	129	-108.4	0	0	0	0	114.3
13	S	30	Very low	31.2	Very low	115 Å²	115	126.8 Å²	126.8	80%	0.804	75%	0.752	S	S	*	*			trans	-45.1	153.6	171.4	51.6	0	0	0	0	119.3
14	G	26.8	Very low	30.9	Very low	63 Å²	63	128.3 Å²	128.3	65%	0.649	75%	0.753	S	S	*	*				144.8	119.6	126.8	0	0	0	0	0	118.5
15	T	27.3	Very low	30.7	Very low	146 Å²	146	130.2 Å²	130.2	90%	0.896	76%	0.76	S	S	*	*			trans	60.2	154.1	150.2	46.9	0	0	0	0	119
16	S	29.2	Very low	30.2	Very low	86 Å²	86	127.5 Å²	127.5	60%	0.601	76%	0.755	S	S	*	*			cis	-167.4	173.4	-12.3	44.9	0	0	0	0	109.1
17	E	29.6	Very low	30.1	Very low	174 Å²	174	129.3 Å²	129.3	81%	0.813	76%	0.757	S	S	*	*			trans	65.1	167.4	165.2	-60.8	172	125	0	0	116.1
18	M	29.5	Very low	30.1	Very low	153 Å²	153	131.2 Å²	131.2	75%	0.754	75%	0.754	S	S	*	*			cis	-163	144	-36.3	-99.5	-68.9	-158.6	0	0	106
19	D	29.1	Very low	30	Very low	152 Å²	152	129.9 Å²	129.9	81%	0.813	75%	0.747	S	S	*	*			trans	50.1	145.9	161	-67.4	-35.2	0	0	0	123.4
20	E	35.8	Very low	31.3	Very low	171 Å²	171	132.2 Å²	132.2	80%	0.799	75%	0.751	S	S	*	*			trans	-73.2	167.9	167.3	-61.9	-172.2	114.5	0	0	113.1
21	P	38.8	Very low	31.5	Very low	126 Å²	126	130.7 Å²	130.7	82%	0.818	74%	0.741	S	S	*	*				-136.2	103.8	129.5	35.6	-24.1	0	0	0	116.1
22	I	30.2	Very low	31.5	Very low	121 Å²	121	132.1 Å²	132.1	62%	0.621	74%	0.741	S	S	*	*			trans	23.7	94.7	133.4	-50.6	178.6	0	0	0	118.6	K24	I22-K24 HydrophobicContact CG2-CD 4.47Å
23	A	31.3	Very low	31.8	Very low	91 Å²	91	131.5 Å²	131.5	75%	0.752	73%	0.729	S	S	*	*				62.6	-171.5	128	0	0	0	0	0	118.9
24	K	29.1	Very low	31.9	Very low	165 Å²	165	135 Å²	135	72%	0.717	73%	0.732	S	S	*	*			cis	-167.4	163.4	24.8	-133.6	155	-166.2	158.5	0	111.9	I22	I22-K24 HydrophobicContact CG2-CD 4.47Å
25	R	30	Very low	31.7	Very low	227 Å²	227	135.5 Å²	135.5	86%	0.857	74%	0.738	S	S	*	*			trans	72.7	159	152.8	-77.7	-176.9	170.3	165.6	-3.4	118.6
26	S	28.8	Very low	32.4	Very low	73 Å²	73	134.5 Å²	134.5	51%	0.51	73%	0.734	S	S	.	*			cis	-175	168.4	-14.7	54	0	0	0	0	109.4
27	K	31.3	Very low	32.3	Very low	176 Å²	176	142.3 Å²	142.3	77%	0.765	75%	0.75	S	S	*	*				-173.2	147.4	62.5	-108	139.2	-176.4	-173.6	0	108.5
28	I	31	Very low	32	Very low	126 Å²	126	138.3 Å²	138.3	65%	0.646	75%	0.746	S	S	*	*				78.2	140	51.7	-70.9	168.7	0	0	0	112.4
29	N	29.2	Very low	31.8	Very low	136 Å²	136	139.2 Å²	139.2	73%	0.727	75%	0.752	S	S	*	*			cis	-174.3	-140.8	-11.8	-92.3	-2.7	0	0	0	104.5
30	P	54.3	Low	31.8	Very low	114 Å²	114	140.3 Å²	140.3	74%	0.74	75%	0.753	S	S	*	*			cis	-114.4	-158.2	-41.2	23.7	1.6	0	0	0	110.3
31	V	33.6	Very low	31.3	Very low	114 Å²	114	138.1 Å²	138.1	69%	0.691	75%	0.751	S	S	*	*			cis	-140.7	-158.2	4.3	-133.3	0	0	0	0	107.1
32	T	29.3	Very low	30.7	Very low	117 Å²	117	138.6 Å²	138.6	72%	0.718	75%	0.747	S	S	*	*			cis	-136.9	121.2	5.7	27	0	0	0	0	112.2
33	N	34	Very low	30.5	Very low	116 Å²	116	138.2 Å²	138.2	62%	0.62	75%	0.75	S	S	*	*				56.8	113.3	123.5	-60.1	3.5	0	0	0	121.5
34	H	30.9	Very low	30.1	Very low	188 Å²	188	142.2 Å²	142.2	87%	0.87	76%	0.757	S	S	*	*				65.8	128.1	87	-59.8	-47.9	0	0	0	114
35	G	23.1	Very low	29.7	Very low	74 Å²	74	139.5 Å²	139.5	76%	0.763	76%	0.759	S	S	*	*			cis	140.7	175.7	16.5	0	0	0	0	0	108.2
36	P	43.2	Very low	29.4	Very low	125 Å²	125	134.2 Å²	134.2	81%	0.812	76%	0.755	S	S	*	*			cis	-138.4	-162	-5.3	44.7	-25.7	0	0	0	115
37	R	25.6	Very low	29.1	Very low	250 Å²	250	137.2 Å²	137.2	94%	0.943	77%	0.771	S	S	*	*			trans	89.8	143	168	-76.2	-173.5	172.8	-177.1	-2.1	118.8
38	A	24.8	Very low	28.9	Very low	89 Å²	89	133.9 Å²	133.9	74%	0.736	77%	0.77	S	S	*	*			trans	-115.3	163	-161.7	0	0	0	0	0	113.6
39	I	25.2	Very low	28.6	Very low	172 Å²	172	133 Å²	133	88%	0.882	78%	0.781	S	S	*	*			trans	-128.8	150.2	143.8	-78.9	178.4	0	0	0	106.1
40	E	27.5	Very low	28.4	Very low	176 Å²	176	130.9 Å²	130.9	82%	0.822	78%	0.782	S	S	*	*			trans	-98.1	-174.8	-170.8	-68.1	174.2	120	0	0	112.9
41	T	26.6	Very low	27.1	Very low	125 Å²	125	134 Å²	134	77%	0.767	79%	0.791	S	S	*	*			trans	-52.7	155.9	168.8	49.7	0	0	0	0	113
42	D	25.9	Very low	26.7	Very low	136 Å²	136	131.5 Å²	131.5	73%	0.727	79%	0.788	S	S	*	*				-162.8	168.6	106.1	-129	-58	0	0	0	115.3
43	T	25	Very low	26.6	Very low	113 Å²	113	132.1 Å²	132.1	69%	0.693	80%	0.797	S	S	*	*			trans	-51.5	163.1	160.2	57.6	0	0	0	0	114.2
44	I	24.8	Very low	26.4	Very low	175 Å²	175	136 Å²	136	90%	0.897	80%	0.803	S	S	*	*			trans	-122.9	98.4	154.3	-59.6	-177.9	0	0	0	108.7
45	S	20.1	Very low	26.4	Very low	107 Å²	107	133.5 Å²	133.5	75%	0.748	79%	0.792	S	S	*	*			trans	-112.1	148.3	153.8	-178.2	0	0	0	0	107.7
46	C	23.5	Very low	26.7	Very low	116 Å²	116	138.4 Å²	138.4	78%	0.784	80%	0.795	S	S	*	*			trans	-68.5	155	179.9	-58.9	0	0	0	0	112.4
47	V	23	Very low	26.1	Very low	137 Å²	137	136.7 Å²	136.7	83%	0.83	79%	0.791	S	S	*	*				-164.9	129.6	124.9	139.5	0	0	0	0	111.3
48	S	25.4	Very low	26.2	Very low	106 Å²	106	128 Å²	128	74%	0.741	78%	0.78	S	S	*	*			trans	-1.5	138.1	171.3	62.5	0	0	0	0	123.3
49	A	26	Very low	26.5	Very low	108 Å²	108	131.5 Å²	131.5	89%	0.893	79%	0.786	S	S	*	*			trans	-124.7	158.2	133.2	0	0	0	0	0	108.9
50	A	24.4	Very low	26.6	Very low	90 Å²	90	128.9 Å²	128.9	74%	0.744	78%	0.781	S	S	*	*			trans	-127.5	-178.8	-162	0	0	0	0	0	114.8
51	I	27	Very low	26.6	Very low	181 Å²	181	125.6 Å²	125.6	93%	0.928	79%	0.785	S	S	*	*			trans	81.7	117.6	176.2	-49.3	166.1	0	0	0	113.5
52	G	25.9	Very low	26.7	Very low	61 Å²	61	127.6 Å²	127.6	63%	0.629	79%	0.785	S	S	*	*			cis	169.1	179.7	-6	0	0	0	0	0	113.3
53	S	27.9	Very low	27.4	Very low	130 Å²	130	126.7 Å²	126.7	91%	0.909	79%	0.787	S	S	*	*			trans	75.8	135.3	178.6	-50.2	0	0	0	0	115
54	R	29.2	Very low	27.7	Very low	198 Å²	198	124.4 Å²	124.4	75%	0.747	78%	0.779	S	S	*	*			cis	-165.9	148.6	3.1	167	171.8	-174.2	-153.7	-12.9	111.1
55	E	29.8	Very low	28	Very low	134 Å²	134	123.9 Å²	123.9	63%	0.626	77%	0.773	S	S	*	*			trans	21.8	141.9	158.4	-63.7	144.8	-141.8	0	0	120.2
56	E	30.7	Very low	28.3	Very low	178 Å²	178	127 Å²	127	83%	0.832	77%	0.773	S	S	*	*			cis	-172.7	174.8	-2.7	-109.5	-166.3	103.6	0	0	106.1
57	A	30.2	Very low	28.5	Very low	89 Å²	89	129.4 Å²	129.4	74%	0.736	77%	0.77	S	S	*	*			cis	-168.1	171.6	-13.3	0	0	0	0	0	106.2
58	G	28	Very low	28.6	Very low	68 Å²	68	130.3 Å²	130.3	70%	0.701	77%	0.765	S	S	*	*			cis	164.4	156.6	-4.8	0	0	0	0	0	111.6
59	N	30.7	Very low	28.6	Very low	162 Å²	162	130.2 Å²	130.2	87%	0.866	77%	0.771	S	S	*	*			trans	65.8	152.2	173.6	-75.4	1.9	0	0	0	120.5
60	C	27.1	Very low	28.5	Very low	116 Å²	116	134.8 Å²	134.8	78%	0.784	77%	0.771	S	S	*	*			cis	176.8	134.8	-38.3	-111	0	0	0	0	110.5
61	A	26.8	Very low	29.6	Very low	108 Å²	108	136 Å²	136	89%	0.893	77%	0.771	S	S	*	*			trans	175	135.3	140.2	0	0	0	0	0	112.9
62	E	28.9	Very low	29.4	Very low	167 Å²	167	133.8 Å²	133.8	78%	0.78	77%	0.766	S	S	*	*			trans	-145	171	163.2	-152.6	-158.3	-103.6	0	0	107.1	A64	E62-A64 PolarHBondContact OE2-N 2.75Å
63	P	41.2	Very low	29.2	Very low	117 Å²	117	138.2 Å²	138.2	76%	0.76	77%	0.772	S	S	*	*				-157.5	140.6	91.7	38.4	-17.6	0	0	0	119.4
64	A	31.6	Very low	29	Very low	65 Å²	65	140.1 Å²	140.1	54%	0.537	77%	0.768	S	S	.	*				63.3	118.4	124.9	0	0	0	0	0	124.7	E62	E62-A64 PolarHBondContact OE2-N 2.75Å
65	E	29.6	Very low	28.8	Very low	163 Å²	163	134.6 Å²	134.6	76%	0.762	77%	0.765	S	S	*	*				45	143	128.9	-44.3	-169.7	127.1	0	0	122.6
66	K	27.1	Very low	28.7	Very low	172 Å²	172	135.2 Å²	135.2	75%	0.748	78%	0.778	S	S	*	*				-170	136.9	61.2	-84.4	-175.6	178.6	165.2	0	116.5
67	K	28.1	Very low	28.4	Very low	168 Å²	168	135.7 Å²	135.7	73%	0.73	78%	0.78	S	S	*	*			trans	56.6	134.9	135.2	-76.4	-173.2	159.3	-134.3	0	125.6
68	E	24.9	Very low	28.1	Very low	156 Å²	156	140.7 Å²	140.7	73%	0.729	79%	0.788	S	S	*	*			trans	70.8	113.7	135.7	-71.6	167.5	-157.6	0	0	122.5
69	A	25.4	Very low	28	Very low	104 Å²	104	142.1 Å²	142.1	86%	0.86	79%	0.793	S	S	*	*				178.1	159.2	113.6	0	0	0	0	0	114.2
70	K	23	Very low	28.3	Very low	203 Å²	203	140.4 Å²	140.4	88%	0.883	79%	0.791	S	S	*	*			trans	-157.1	160	167.2	-101.7	-166.6	-179.8	-176.7	0	107.7
71	P	47.5	Very low	28.2	Very low	115 Å²	115	139.7 Å²	139.7	75%	0.747	79%	0.794	S	S	*	*				-125.1	-171.9	-50.2	39.6	-24.2	0	0	0	110.1
72	V	23.1	Very low	28.3	Very low	136 Å²	136	140.5 Å²	140.5	82%	0.824	79%	0.793	S	S	*	*			trans	175.9	159.7	140.9	143.7	0	0	0	0	111.4
73	M	22.7	Very low	28.1	Very low	154 Å²	154	144.9 Å²	144.9	76%	0.759	80%	0.802	S	S	*	*			trans	-63.7	158.8	-178.6	-50.6	174.1	-73.7	0	0	114.7
74	M	23.8	Very low	27.3	Very low	169 Å²	169	143.1 Å²	143.1	83%	0.833	81%	0.805	S	S	*	*				-173.8	157.8	113.7	-100.9	-59.3	172.4	0	0	114.6
75	A	25	Very low	27	Very low	83 Å²	83	143.4 Å²	143.4	69%	0.686	81%	0.814	S	S	*	*			trans	23.3	141.8	154.2	0	0	0	0	0	123.1
76	V	27.3	Very low	26.9	Very low	147 Å²	147	142.6 Å²	142.6	89%	0.891	82%	0.815	S	S	*	*			trans	-97.7	126.5	159.5	177.3	0	0	0	0	108.8
77	E	23.7	Very low	27	Very low	187 Å²	187	140.9 Å²	140.9	87%	0.874	82%	0.815	S	S	*	*			trans	-98.3	154	173.1	-74.5	-164.5	123.2	0	0	113
78	Q	24.9	Very low	27.1	Very low	194 Å²	194	141 Å²	141	91%	0.907	82%	0.823	S	S	*	*			trans	-108.2	141.6	169.7	-61.5	176.2	-19.3	0	0	110
79	A	25.3	Very low	27.1	Very low	98 Å²	98	136.8 Å²	136.8	81%	0.81	82%	0.821	S	S	*	*			trans	-178.9	165.3	155.2	0	0	0	0	0	110.9
80	P	36.8	Very low	27.1	Very low	127 Å²	127	140 Å²	140	83%	0.825	82%	0.823	S	S	*	*			cis	-122	170.1	-9.5	37.8	-24.5	0	0	0	113.8
81	A	26.1	Very low	27.1	Very low	101 Å²	101	134.8 Å²	134.8	84%	0.835	81%	0.812	S	S	*	*			trans	-106.4	156.3	162.1	0	0	0	0	0	111.1
82	S	27.7	Very low	26.1	Very low	124 Å²	124	137.3 Å²	137.3	87%	0.867	82%	0.819	S	S	*	*			trans	-111.5	160.2	167.5	58.2	0	0	0	0	110.7
83	R	26.4	Very low	26.7	Very low	259 Å²	259	136.3 Å²	136.3	98%	0.977	82%	0.815	S	S	*	*			trans	-150.7	139.5	-158.8	-163.5	-179	-173.2	-160.5	2	114.8
84	G	23.4	Very low	27	Very low	80 Å²	80	135.4 Å²	135.4	83%	0.825	82%	0.818	S	S	*	*			trans	121.4	141.6	170	0	0	0	0	0	113.3
85	G	24.5	Very low	27	Very low	71 Å²	71	133 Å²	133	73%	0.732	82%	0.818	S	S	*	*			cis	-179.5	152.2	-7.1	0	0	0	0	0	114.1
86	D	28.6	Very low	27.1	Very low	146 Å²	146	137.4 Å²	137.4	78%	0.781	82%	0.824	S	S	*	*			trans	64.7	103.3	152.2	-57.8	-5.2	0	0	0	124.3
87	N	29.6	Very low	27.3	Very low	137 Å²	137	136.7 Å²	136.7	73%	0.733	82%	0.823	S	S	*	*				81.2	147.6	122.7	-64	-36.1	0	0	0	125
88	N	30	Very low	27.2	Very low	171 Å²	171	134.8 Å²	134.8	91%	0.914	82%	0.818	S	S	*	*			trans	81.3	134.9	179.1	-56.4	-29.2	0	0	0	116.4
89	G	24.2	Very low	27.2	Very low	67 Å²	67	134.6 Å²	134.6	69%	0.691	81%	0.814	S	S	*	*			cis	166.1	161.2	-8.1	0	0	0	0	0	112.5
90	L	25.7	Very low	27	Very low	171 Å²	171	135.7 Å²	135.7	90%	0.895	82%	0.815	S	S	*	*			trans	69.2	168.9	178.6	-55.6	164.1	0	0	0	116.5
91	S	23.9	Very low	26.5	Very low	94 Å²	94	135.3 Å²	135.3	66%	0.657	82%	0.815	S	S	*	*				178.5	124.4	-60.2	-93	0	0	0	0	111
92	L	25.7	Very low	26.4	Very low	167 Å²	167	134.2 Å²	134.2	87%	0.874	81%	0.814	S	S	*	*			trans	66.4	169.8	161.2	-59.5	173.2	0	0	0	117.5
93	P	36.3	Very low	26.3	Very low	115 Å²	115	138.2 Å²	138.2	75%	0.747	82%	0.816	S	S	*	*			cis	-135.1	-173.4	-47.4	39	-23.3	0	0	0	114.1
94	V	28.1	Very low	26.4	Very low	135 Å²	135	134.7 Å²	134.7	82%	0.818	82%	0.816	S	S	*	*			trans	-72.2	145.2	166	173.8	0	0	0	0	111.9
95	S	24.7	Very low	26.6	Very low	119 Å²	119	134.3 Å²	134.3	83%	0.832	81%	0.812	S	S	*	*			trans	-170.5	166.4	148.2	-104	0	0	0	0	114
96	E	26.3	Very low	26.7	Very low	176 Å²	176	138.4 Å²	138.4	82%	0.822	82%	0.817	S	S	*	*			trans	-79.4	163.8	-174.1	-49.6	167	127.7	0	0	114.7
97	P	30.7	Very low	26.7	Very low	132 Å²	132	135.2 Å²	135.2	86%	0.857	81%	0.806	S	S	*	*			trans	-105	121.3	165.8	35.3	-26.4	0	0	0	113.3
98	L	22.2	Very low	26.7	Very low	147 Å²	147	135 Å²	135	77%	0.77	81%	0.81	S	S	*	*			trans	-137.5	91.9	176.7	-146.3	167	0	0	0	113.8
99	K	24.6	Very low	26.6	Very low	190 Å²	190	130.5 Å²	130.5	83%	0.826	80%	0.796	S	S	*	*			trans	56.7	148.9	157.9	-66.8	-176.1	176.2	179.8	0	122.3
100	S	22.7	Very low	26.7	Very low	121 Å²	121	137.5 Å²	137.5	85%	0.846	81%	0.808	S	S	*	*			trans	81.6	151.8	156	90.1	0	0	0	0	116.5
101	S	24.3	Very low	26.7	Very low	118 Å²	118	132.7 Å²	132.7	83%	0.825	80%	0.799	S	S	*	*			cis	-152.1	161	-1	61.3	0	0	0	0	110.7
102	G	24.6	Very low	26.8	Very low	78 Å²	78	132.5 Å²	132.5	80%	0.804	80%	0.804	S	S	*	*			trans	173.9	57.2	179.4	0	0	0	0	0	119.9
103	K	26.8	Very low	26.8	Very low	209 Å²	209	131 Å²	131	91%	0.909	80%	0.801	S	S	*	*			trans	10.5	129.8	160	-66.3	-178.7	172.4	-175.6	0	121.2
104	L	27	Very low	26.3	Very low	185 Å²	185	134.9 Å²	134.9	97%	0.969	81%	0.81	S	S	*	*			trans	-111.3	174	144.2	-154.6	67.3	0	0	0	109.6
105	G	27.4	Very low	26.3	Very low	72 Å²	72	138 Å²	138	74%	0.742	82%	0.816	S	S	*	*			trans	-93.4	170	-162.1	0	0	0	0	0	118.7
106	D	27.3	Very low	26.3	Very low	156 Å²	156	136.1 Å²	136.1	83%	0.834	81%	0.814	S	S	*	*			trans	-64.3	164.4	170.1	-106.9	-55.6	0	0	0	113.4
107	S	28.9	Very low	26.4	Very low	80 Å²	80	133 Å²	133	56%	0.559	82%	0.818	S	S	*	*			cis	-162	152.7	9.3	-140.4	0	0	0	0	113.8
108	T	29.1	Very low	26.2	Very low	133 Å²	133	134.7 Å²	134.7	82%	0.816	82%	0.821	S	S	*	*			trans	62.2	148	151.6	55	0	0	0	0	120.5
109	A	28	Very low	26.2	Very low	75 Å²	75	136.9 Å²	136.9	62%	0.62	82%	0.824	S	S	*	*			cis	-160.9	150.5	3.1	0	0	0	0	0	113.7
110	F	26.1	Very low	26.4	Very low	215 Å²	215	136.1 Å²	136.1	94%	0.943	83%	0.828	S	S	*	*			trans	38.1	134.9	157.8	-58.9	-76.3	0	0	0	121.8
111	G	25.3	Very low	26.6	Very low	69 Å²	69	133.7 Å²	133.7	71%	0.711	82%	0.822	S	S	*	*			cis	164.8	165.7	-5	0	0	0	0	0	113.7
112	A	26.8	Very low	26.9	Very low	91 Å²	91	137 Å²	137	75%	0.752	82%	0.824	S	S	*	*			trans	66.9	102.9	176	0	0	0	0	0	117
113	T	25.6	Very low	27.1	Very low	135 Å²	135	140.7 Å²	140.7	83%	0.828	83%	0.825	S	S	*	*				64.7	133.4	86.7	59.7	0	0	0	0	114.7
114	E	26.7	Very low	27.3	Very low	196 Å²	196	136.8 Å²	136.8	92%	0.916	81%	0.814	S	S	*	*			cis	-126.9	-177.2	25.5	-61.3	-178.5	133	0	0	114.7
115	E	28.3	Very low	27.5	Very low	202 Å²	202	135.7 Å²	135.7	94%	0.944	81%	0.808	S	S	*	*			trans	-107.5	156	-177.6	-62.9	-177.3	134.9	0	0	113.5
116	G	24.6	Very low	27.5	Very low	78 Å²	78	139.9 Å²	139.9	80%	0.804	81%	0.813	S	S	*	*			trans	-164.5	117.2	168.5	0	0	0	0	0	110.8
117	A	27	Very low	27.6	Very low	110 Å²	110	143.5 Å²	143.5	91%	0.909	82%	0.815	S	S	*	*			trans	-74.9	157	-166	0	0	0	0	0	114.9
118	D	26.3	Very low	27.6	Very low	169 Å²	169	147.7 Å²	147.7	90%	0.904	83%	0.831	S	S	*	*			trans	-130.3	153.8	172.4	-139.6	-23.8	0	0	0	110.9
119	F	23.8	Very low	27.6	Very low	193 Å²	193	144.9 Å²	144.9	85%	0.846	83%	0.829	S	S	*	*			trans	-125.5	119.4	-158.5	-169.6	-87	0	0	0	112.3
120	L	28.8	Very low	27.5	Very low	174 Å²	174	149.8 Å²	149.8	91%	0.911	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-97	124.7	-179.2	-72	173.8	0	0	0	112.3
121	G	26.8	Very low	27.5	Very low	69 Å²	69	144 Å²	144	71%	0.711	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-91.5	170.4	177.2	0	0	0	0	0	114.6
122	H	30.2	Very low	27.6	Very low	189 Å²	189	147.5 Å²	147.5	88%	0.875	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-79.7	148.6	173.5	-77	-59.3	0	0	0	112.4
123	N	29	Very low	27.7	Very low	154 Å²	154	149 Å²	149	82%	0.824	84%	0.843	S	S	*	*			trans	-118.9	118.8	164.2	-91.4	-20.8	0	0	0	108.5
124	D	30.3	Very low	28.5	Very low	127 Å²	127	148 Å²	148	68%	0.679	84%	0.839	S	S	*	*			trans	-120.6	124.6	160.3	-89	-59.4	0	0	0	107.3	Q155	D124-Q155 PolarHBondContact OD1-NE2 2.98Å
125	L	30.4	Very low	28.4	Very low	162 Å²	162	148 Å²	148	85%	0.848	84%	0.839	S	S	*	*			trans	-111.4	116	-175.2	-79.9	170.7	0	0	0	111.5
126	L	28.9	Very low	28.4	Very low	160 Å²	160	147 Å²	147	84%	0.838	83%	0.834	S	S	*	*			trans	-69.8	125.9	169.8	-75.7	164.8	0	0	0	110.5	L180	L126-L180 HydrophobicContact CD1-CD2 4.32Å
127	R	28.1	Very low	28.7	Very low	232 Å²	232	150.4 Å²	150.4	88%	0.875	83%	0.832	S	S	*	*			trans	-145.7	105.1	172.7	-167.6	177.7	-173.9	-170	1.2	112.3
128	N	30.1	Very low	28.7	Very low	168 Å²	168	152.6 Å²	152.6	90%	0.898	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-87.3	135.1	163.8	-73	-23.6	0	0	0	109.4
129	G	28.6	Very low	29	Very low	75 Å²	75	153.4 Å²	153.4	77%	0.773	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-85.7	135.7	-173.3	0	0	0	0	0	114
130	L	26	Very low	29.5	Very low	178 Å²	178	153.1 Å²	153.1	93%	0.932	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-88	142.4	159.4	-74.8	166.2	0	0	0	109.3
131	A	25.9	Very low	29.5	Very low	94 Å²	94	153.1 Å²	153.1	78%	0.777	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-89.6	147.4	-179.8	0	0	0	0	0	112.4
132	V	26.9	Very low	29.7	Very low	141 Å²	141	156 Å²	156	86%	0.855	83%	0.828	S	S	*	*			trans	-136.4	142.6	167.7	-179.5	0	0	0	0	107.7
133	T	29.2	Very low	29.7	Very low	122 Å²	122	156.7 Å²	156.7	75%	0.748	82%	0.823	S	S	*	*			trans	-140.6	173.7	-178.8	64.6	0	0	0	0	109.2
134	P	41.8	Very low	29.7	Very low	115 Å²	115	154.3 Å²	154.3	75%	0.747	82%	0.818	S	S	*	*				-133.1	153	-78.5	37.1	-21	0	0	0	113.9
135	E	26.3	Very low	29.9	Very low	196 Å²	196	153.2 Å²	153.2	92%	0.916	82%	0.821	S	S	*	*			trans	-132	160.8	165.4	-68.6	-164.7	149.3	0	0	111.5
136	H	28.1	Very low	29.8	Very low	181 Å²	181	154.7 Å²	154.7	84%	0.838	82%	0.823	S	S	*	*			trans	-84.6	160.1	-167.9	-54.9	-33.7	0	0	0	114
137	I	30.4	Very low	29.8	Very low	150 Å²	150	151.7 Å²	151.7	77%	0.769	82%	0.821	S	S	*	*				177.4	122	119.5	-90.4	155.6	0	0	0	111.5
138	D	27.4	Very low	30.1	Very low	155 Å²	155	144.3 Å²	144.3	83%	0.829	81%	0.805	S	S	*	*			trans	52.7	175.5	148.4	-53.1	-12.1	0	0	0	123
139	E	32.6	Very low	30.2	Very low	186 Å²	186	141.9 Å²	141.9	87%	0.869	80%	0.801	S	S	*	*			trans	-109	171.7	-155.4	-54.7	-176.7	120.6	0	0	114.8
140	E	33.2	Very low	30.3	Very low	188 Å²	188	141.4 Å²	141.4	88%	0.879	79%	0.786	S	S	*	*			trans	56.6	108	165.1	-56.4	-157.7	143.8	0	0	119.6
141	D	29.1	Very low	30.7	Very low	173 Å²	173	139.1 Å²	139.1	93%	0.925	78%	0.775	S	S	*	*				-153.5	156.9	111.8	-143.7	-21.1	0	0	0	111.1
142	D	30.7	Very low	30.8	Very low	129 Å²	129	145.2 Å²	145.2	69%	0.69	78%	0.778	S	S	*	*			trans	-126.2	158.2	-173.3	-177.6	31	0	0	0	112.5
143	R	29.9	Very low	31	Very low	205 Å²	205	143.6 Å²	143.6	77%	0.774	77%	0.769	S	S	*	*			trans	81.1	87.5	170.4	-50.2	-175.4	177.1	-171.2	-2.9	119.1
144	S	30.8	Very low	31.1	Very low	104 Å²	104	143.9 Å²	143.9	73%	0.727	77%	0.772	S	S	*	*				52.8	125.6	120.6	66.4	0	0	0	0	120.9
145	S	32.9	Very low	30.6	Very low	104 Å²	104	144.9 Å²	144.9	73%	0.727	77%	0.767	S	S	*	*				-173.7	153.1	106.4	-80	0	0	0	0	113.6
146	H	29.5	Very low	31.1	Very low	192 Å²	192	140.6 Å²	140.6	89%	0.889	76%	0.756	S	S	*	*			trans	56.9	70.5	163.9	-63.5	-65	0	0	0	119.1
147	A	28.7	Very low	31.6	Very low	98 Å²	98	139.7 Å²	139.7	81%	0.81	75%	0.753	S	S	*	*			trans	-83.6	156.2	148.7	0	0	0	0	0	110.8
148	S	33.6	Very low	32.1	Very low	76 Å²	76	136.5 Å²	136.5	53%	0.531	74%	0.736	S	S	.	*			trans	-68.1	143.2	-179.9	-170.5	0	0	0	0	112.7	S150	S148-S150 VanDerWaalsContact C-N 3.28Å; S148-S150 WeakPolarHBondContact CB-OG 3.49Å; S148-S150 PolarHBondContact O-N 3.48Å; S148-S150 PolarHBondContact OG-N 3.46Å; S148-S150 PolarHBondContact OG-OG 3.06Å
149	S	33	Very low	32.9	Very low	117 Å²	117	132.4 Å²	132.4	82%	0.818	72%	0.72	S	S	*	*	S	Bend	trans	-89.4	15.9	177	-170.4	0	0	0	0	113.4
150	S	31.1	Very low	34	Very low	66 Å²	66	126.3 Å²	126.3	46%	0.462	70%	0.698	S	S	.	*	S	Bend	trans	-86.3	-31.1	-176.2	44.3	0	0	0	0	114.4	S148	S148-S150 VanDerWaalsContact C-N 3.28Å; S148-S150 WeakPolarHBondContact CB-OG 3.49Å; S148-S150 PolarHBondContact O-N 3.48Å; S148-S150 PolarHBondContact OG-N 3.46Å; S148-S150 PolarHBondContact OG-OG 3.06Å
151	D	32.8	Very low	35.1	Very low	130 Å²	130	122.7 Å²	122.7	70%	0.695	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	3.9	-156.9	-47.3	-19.5	0	0	0	113.6
152	W	29.5	Very low	36.4	Very low	221 Å²	221	116.6 Å²	116.6	84%	0.837	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	-6.1	-173.1	-74.9	94.2	0	0	0	115	P154	W152-P154 WeakPolarHBondContact O-CD 3.4Å
153	T	30.3	Very low	37.9	Very low	108 Å²	108	115.2 Å²	115.2	66%	0.663	63%	0.633	S	S	*	*	S	Bend	trans	-74.7	120.8	164.4	47.5	0	0	0	0	108.8	Q155	T153-Q155 PolarHBondContact O-N 2.91Å
154	P	31.1	Very low	39.4	Very low	127 Å²	127	105.7 Å²	105.7	83%	0.825	60%	0.598	S	S	*	*			trans	-60.6	112.6	174.5	-20.3	32.6	0	0	0	109.3	W152	W152-P154 WeakPolarHBondContact O-CD 3.4Å
155	Q	32.5	Very low	40.8	Very low	137 Å²	137	105.4 Å²	105.4	64%	0.64	59%	0.585	S	S	*	*			trans	-53.7	141.1	167.7	-79.1	-174.9	-46.8	0	0	108.3	D124 T153 Q157	D124-Q155 PolarHBondContact OD1-NE2 2.98Å; T153-Q155 PolarHBondContact O-N 2.91Å; Q155-Q157 PolarHBondContact O-N 2.77Å
156	P	34.9	Very low	42.2	Very low	106 Å²	106	106.4 Å²	106.4	69%	0.688	58%	0.578	S	S	*	*			trans	-59.9	115.5	176.8	25.4	-32.9	0	0	0	108.5	I158	P156-I158 HydrophobicContact CB-CG1 4.27Å; P156-I158 HydrophobicContact CG-CG1 4.45Å; P156-I158 PolarHBondContact O-N 2.71Å
157	Q	39.4	Very low	43.8	Very low	162 Å²	162	99.6 Å²	99.6	76%	0.757	55%	0.547	S	S	*	.			trans	-70.1	73.8	169.8	-70.3	-164.1	-92.1	0	0	108.8	Q155 S159	Q155-Q157 PolarHBondContact O-N 2.77Å; Q157-S159 PolarHBondContact O-N 3.2Å; Q157-S159 VanDerWaalsContact O-N 3.13Å
158	I	41.5	Very low	45.4	Very low	82 Å²	82	98.6 Å²	98.6	42%	0.421	53%	0.527	S	S	.	.			trans	-59.2	115.2	166.5	-56	175.1	0	0	0	105.3	P156 S160 S162	P156-I158 HydrophobicContact CB-CG1 4.27Å; P156-I158 HydrophobicContact CG-CG1 4.45Å; P156-I158 PolarHBondContact O-N 2.71Å; I158-S160 PolarHBondContact O-N 2.66Å; I158-S162 VanDerWaalsContact CG2-OG 3.29Å; I158-S162 WeakPolarHBondContact CG2-OG 3.44Å
159	S	43.3	Very low	46.6	Very low	70 Å²	70	105.3 Å²	105.3	49%	0.49	54%	0.54	S	S	.	.			trans	-54	140.6	172.7	169.1	0	0	0	0	108.7	Q157 Y161 S162 Y163	Q157-S159 PolarHBondContact O-N 3.2Å; Q157-S159 VanDerWaalsContact O-N 3.13Å; S159-Y161 PolarHBondContact O-N 3.29Å; S159-Y161 PolarHBondContact OG-N 3.3Å; S159-S162 WeakPolarHBondContact CB-OG 3.37Å; S159-S162 PolarHBondContact N-OG 3.14Å; S159-S162 WeakPolarHBondContact O-CA 3.2Å; S159-S162 PolarHBondContact O-N 2.92Å; S159-S162 PolarHBondContact O-OG 2.77Å; S159-Y163 PolarHBondContact O-N 3.44Å
160	S	57.3	Low	48.1	Very low	58 Å²	58	108 Å²	108	41%	0.406	54%	0.54	S	S	.	.	H	α-helix	trans	-51.5	-34.5	178.4	-30.6	0	0	0	0	111.3	I158 Y163 I164	I158-S160 PolarHBondContact O-N 2.66Å; S160-Y163 PolarHBondContact O-N 2.8Å; S160-I164 WeakPolarHBondContact O-CB 3.39Å; S160-I164 VanDerWaalsContact O-CD1 3.28Å; S160-I164 WeakPolarHBondContact O-CD1 3.45Å; S160-I164 WeakPolarHBondContact O-CG1 2.94Å; S160-I164 PolarHBondContact O-N 2.92Å
161	Y	55.1	Low	50.3	Low	112 Å²	112	107.3 Å²	107.3	44%	0.439	53%	0.533	S	S	.	.	H	α-helix	trans	-66.8	-41.7	174.5	-172.4	-108.3	0	0	0	113.6	S159 I164 Q165	S159-Y161 PolarHBondContact O-N 3.29Å; S159-Y161 PolarHBondContact OG-N 3.3Å; Y161-I164 PolarHBondContact O-N 3.42Å; Y161-Q165 HydrophobicContact CD1-CG 4.32Å; Y161-Q165 HydrophobicContact CE1-CG 3.97Å; Y161-Q165 VanDerWaalsContact CE1-NE2 3.32Å; Y161-Q165 WeakPolarHBondContact O-CB 3.29Å; Y161-Q165 WeakPolarHBondContact O-CG 3.41Å; Y161-Q165 PolarHBondContact O-N 2.87Å; Y161-Q165 PolarHBondContact OH-NE2 2.84Å
162	S	55.7	Low	52.6	Low	44 Å²	44	104.2 Å²	104.2	31%	0.308	52%	0.517	S	S	.	.	H	α-helix	trans	-72.7	-31.7	175.9	47.9	0	0	0	0	112.6	I158 S159 Q165 Q166	I158-S162 VanDerWaalsContact CG2-OG 3.29Å; I158-S162 WeakPolarHBondContact CG2-OG 3.44Å; S159-S162 WeakPolarHBondContact CB-OG 3.37Å; S159-S162 PolarHBondContact N-OG 3.14Å; S159-S162 WeakPolarHBondContact O-CA 3.2Å; S159-S162 PolarHBondContact O-N 2.92Å; S159-S162 PolarHBondContact O-OG 2.77Å; S162-Q165 PolarHBondContact O-N 3.06Å; S162-Q166 WeakPolarHBondContact O-CB 3.49Å; S162-Q166 PolarHBondContact O-N 2.93Å
163	Y	62.6	Low	55.2	Low	101 Å²	101	93.9 Å²	93.9	40%	0.396	48%	0.478	S	S	.	.	H	α-helix	trans	-62.2	-50.5	170.8	179.2	-95.7	0	0	0	109.9	S159 S160 Q165 Q166 H167	S159-Y163 PolarHBondContact O-N 3.44Å; S160-Y163 PolarHBondContact O-N 2.8Å; Y163-Q165 PolarHBondContact O-N 3.42Å; Y163-Q166 PolarHBondContact O-N 3.07Å; Y163-H167 AromaticContact CD2-CD2 3.72Å; Y163-H167 AromaticContact CD2-NE2 3.89Å; Y163-H167 AromaticContact CE1-CD2 3.9Å; Y163-H167 AromaticContact CE2-CD2 3.51Å; Y163-H167 AromaticContact CE2-NE2 3.34Å; Y163-H167 VanDerWaalsContact CE2-NE2 3.34Å; Y163-H167 WeakPolarHBondContact CE2-NE2 3.37Å; Y163-H167 AromaticContact CZ-CD2 3.6Å; Y163-H167 AromaticContact CZ-NE2 3.62Å; Y163-H167 PolarHBondContact O-CD2 2.9Å; Y163-H167 VanDerWaalsContact O-CD2 3.32Å; Y163-H167 PolarHBondContact O-N 3.23Å
164	I	62.8	Low	57.8	Low	4 Å²	4	91.8 Å²	91.8	2%	0.021	46%	0.458	C	S	.	.	H	α-helix	trans	-58.4	-46.1	174.5	-71.2	163.4	0	0	0	111.4	S160 Y161 Q166 H167 I168 W196 I199 I200	S160-I164 WeakPolarHBondContact O-CB 3.39Å; S160-I164 VanDerWaalsContact O-CD1 3.28Å; S160-I164 WeakPolarHBondContact O-CD1 3.45Å; S160-I164 WeakPolarHBondContact O-CG1 2.94Å; S160-I164 PolarHBondContact O-N 2.92Å; Y161-I164 PolarHBondContact O-N 3.42Å; I164-Q166 VanDerWaalsContact C-N 3.26Å; I164-Q166 PolarHBondContact O-N 2.83Å; I164-H167 PolarHBondContact O-N 3.04Å; I164-I168 HydrophobicContact CG2-CD1 3.54Å; I164-I168 HydrophobicContact CG2-CG1 4.03Å; I164-I168 VanDerWaalsContact O-CB 3.25Å; I164-I168 WeakPolarHBondContact O-CB 3.48Å; I164-I168 WeakPolarHBondContact O-CG1 3.41Å; I164-I168 PolarHBondContact O-N 2.86Å; I164-W196 HydrophobicContact CB-CZ3 4.31Å; I164-W196 HydrophobicContact CG1-CZ3 4.19Å; I164-W196 HydrophobicContact CG2-CE3 3.76Å; I164-W196 HydrophobicContact CG2-CZ3 3.89Å; I164-I199 HydrophobicContact CD1-CG2 3.8Å; I164-I199 HydrophobicContact CG1-CG2 3.92Å; I164-I200 HydrophobicContact CD1-CG1 3.83Å; I164-I200 HydrophobicContact CG2-CD1 4.16Å; I164-I200 HydrophobicContact CG2-CG1 3.86Å
165	Q	58.6	Low	60.3	Low	98 Å²	98	87 Å²	87	46%	0.458	43%	0.429	S	S	.	.	H	α-helix	trans	-60.9	-32.8	177.5	-79	-176.4	-46.2	0	0	113.6	Y161 S162 Y163	Y161-Q165 HydrophobicContact CD1-CG 4.32Å; Y161-Q165 HydrophobicContact CE1-CG 3.97Å; Y161-Q165 VanDerWaalsContact CE1-NE2 3.32Å; Y161-Q165 WeakPolarHBondContact O-CB 3.29Å; Y161-Q165 WeakPolarHBondContact O-CG 3.41Å; Y161-Q165 PolarHBondContact O-N 2.87Å; Y161-Q165 PolarHBondContact OH-NE2 2.84Å; S162-Q165 PolarHBondContact O-N 3.06Å; Y163-Q165 PolarHBondContact O-N 3.42Å
166	Q	62.6	Low	62.7	Low	126 Å²	126	81.2 Å²	81.2	59%	0.589	40%	0.402	S	S	*	.	H	α-helix	trans	-74.3	-48.3	175.4	-174.1	170.2	-22.5	0	0	111	S162 Y163 I164 I168	S162-Q166 WeakPolarHBondContact O-CB 3.49Å; S162-Q166 PolarHBondContact O-N 2.93Å; Y163-Q166 PolarHBondContact O-N 3.07Å; I164-Q166 VanDerWaalsContact C-N 3.26Å; I164-Q166 PolarHBondContact O-N 2.83Å; Q166-I168 PolarHBondContact O-N 3.09Å
167	H	62.6	Low	65	Low	49 Å²	49	76.2 Å²	76.2	23%	0.227	37%	0.369	C	S	.	.	H	α-helix	trans	-75.2	-21.1	-177.5	-77.7	-85.3	0	0	0	114.7	Y163 I164 R169 E170 T171 I176 W196	Y163-H167 AromaticContact CD2-CD2 3.72Å; Y163-H167 AromaticContact CD2-NE2 3.89Å; Y163-H167 AromaticContact CE1-CD2 3.9Å; Y163-H167 AromaticContact CE2-CD2 3.51Å; Y163-H167 AromaticContact CE2-NE2 3.34Å; Y163-H167 VanDerWaalsContact CE2-NE2 3.34Å; Y163-H167 WeakPolarHBondContact CE2-NE2 3.37Å; Y163-H167 AromaticContact CZ-CD2 3.6Å; Y163-H167 AromaticContact CZ-NE2 3.62Å; Y163-H167 PolarHBondContact O-CD2 2.9Å; Y163-H167 VanDerWaalsContact O-CD2 3.32Å; Y163-H167 PolarHBondContact O-N 3.23Å; I164-H167 PolarHBondContact O-N 3.04Å; H167-R169 PolarHBondContact O-N 3.45Å; H167-E170 PolarHBondContact O-N 2.8Å; H167-T171 PolarHBondContact ND1-OG1 3.26Å; H167-T171 PolarHBondContact O-N 3.39Å; H167-I176 HydrophobicContact CB-CD1 4.41Å; H167-W196 HydrophobicContact CB-CH2 3.78Å
168	I	62.4	Low	67	Low	76 Å²	76	74.9 Å²	74.9	39%	0.39	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-22.9	174.3	-91.7	169.6	0	0	0	113.5	I164 Q166 W196	I164-I168 HydrophobicContact CG2-CD1 3.54Å; I164-I168 HydrophobicContact CG2-CG1 4.03Å; I164-I168 VanDerWaalsContact O-CB 3.25Å; I164-I168 WeakPolarHBondContact O-CB 3.48Å; I164-I168 WeakPolarHBondContact O-CG1 3.41Å; I164-I168 PolarHBondContact O-N 2.86Å; Q166-I168 PolarHBondContact O-N 3.09Å; I168-W196 HydrophobicContact CB-CZ2 4.44Å; I168-W196 HydrophobicContact CD1-CD2 4.32Å; I168-W196 HydrophobicContact CD1-CE3 4.43Å; I168-W196 HydrophobicContact CD1-CG 4.49Å; I168-W196 HydrophobicContact CG1-CD2 3.49Å; I168-W196 VanDerWaalsContact CG1-CD2 3.49Å; I168-W196 HydrophobicContact CG1-CE3 3.79Å; I168-W196 HydrophobicContact CG1-CG 3.91Å; I168-W196 HydrophobicContact CG1-CH2 4.24Å; I168-W196 HydrophobicContact CG1-CZ2 3.99Å; I168-W196 HydrophobicContact CG1-CZ3 4.16Å
169	R	59.1	Low	69	Low	218 Å²	218	77.2 Å²	77.2	82%	0.823	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	-19.6	-179.3	-63.9	-175	175.8	-158.7	-2.5	114.6	H167	H167-R169 PolarHBondContact O-N 3.45Å
170	E	65.9	Low	70.7	Confident	173 Å²	173	76.6 Å²	76.6	81%	0.808	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.6	10.2	-161.8	-64.5	-177.5	-173.5	0	0	113.8	H167	H167-E170 PolarHBondContact O-N 2.8Å
171	T	76.6	Confident	71.9	Confident	51 Å²	51	76.5 Å²	76.5	31%	0.313	36%	0.357	S	S	.	.	S	Bend	trans	-144.9	141.2	-175.9	-53.4	0	0	0	0	113.2	H167 I176	H167-T171 PolarHBondContact ND1-OG1 3.26Å; H167-T171 PolarHBondContact O-N 3.39Å; T171-I176 HydrophobicContact CG2-CD1 3.76Å; T171-I176 HydrophobicContact CG2-CG1 4.04Å
172	D	80.9	Confident	72.9	Confident	66 Å²	66	76.4 Å²	76.4	35%	0.353	37%	0.369	S	S	.	.			trans	-68.3	119.7	172.8	164.5	33.7	0	0	0	110.9	R174 A175 R178	D172-R174 PolarHBondContact O-N 3.25Å; D172-R174 WeakPolarHBondContact OD1-CA 3.48Å; D172-R174 VanDerWaalsContact OD1-CB 3.28Å; D172-R174 WeakPolarHBondContact OD1-CB 3.43Å; D172-R174 PolarHBondContact OD1-N 3.43Å; D172-R174 WeakPolarHBondContact OD2-CB 3.46Å; D172-A175 HydrophobicContact CB-CB 4.26Å; D172-A175 WeakPolarHBondContact O-CB 3.5Å; D172-A175 PolarHBondContact O-N 3.06Å; D172-A175 PolarHBondContact OD2-N 2.95Å; D172-R178 IonicContact OD2-NH2 3.2Å; D172-R178 PolarHBondContact OD2-NH2 3.42Å
173	P	83.4	Confident	74	Confident	3 Å²	3	83.3 Å²	83.3	2%	0.019	40%	0.397	C	S	.	.	H	α-helix	trans	-67.3	-22.6	177.2	28.4	-34.6	0	0	0	113	A175 L177 D192 L195 W196 I199	P173-A175 VanDerWaalsContact C-N 3.26Å; P173-A175 PolarHBondContact O-N 3Å; P173-L177 WeakPolarHBondContact O-CB 3.37Å; P173-L177 WeakPolarHBondContact O-CG 3.16Å; P173-L177 PolarHBondContact O-N 2.86Å; P173-D192 HydrophobicContact CG-CB 3.91Å; P173-L195 HydrophobicContact CB-CB 3.81Å; P173-L195 HydrophobicContact CG-CB 3.85Å; P173-L195 HydrophobicContact CG-CD1 4.31Å; P173-W196 HydrophobicContact CB-CD2 3.91Å; P173-W196 HydrophobicContact CB-CG 4.05Å; P173-W196 HydrophobicContact CB-CZ2 4.27Å; P173-W196 HydrophobicContact CG-CG 4.43Å; P173-I199 HydrophobicContact CB-CD1 3.56Å
174	R	85	Confident	74.9	Confident	65 Å²	65	82 Å²	82	25%	0.245	40%	0.399	C	S	.	.	H	α-helix	trans	-66.7	-28.1	171.6	-61.4	-179.8	167.9	66.6	-0	111.8	D172 R178 L186 P188 L190 D192 L195	D172-R174 PolarHBondContact O-N 3.25Å; D172-R174 WeakPolarHBondContact OD1-CA 3.48Å; D172-R174 VanDerWaalsContact OD1-CB 3.28Å; D172-R174 WeakPolarHBondContact OD1-CB 3.43Å; D172-R174 PolarHBondContact OD1-N 3.43Å; D172-R174 WeakPolarHBondContact OD2-CB 3.46Å; R174-R178 WeakPolarHBondContact O-CB 3.19Å; R174-R178 VanDerWaalsContact O-CG 3.29Å; R174-R178 WeakPolarHBondContact O-CG 3.43Å; R174-R178 PolarHBondContact O-N 2.86Å; R174-R178 VanDerWaalsContact O-N 3.11Å; R174-R178 PolarHBondContact O-NE 3.05Å; R174-L186 HydrophobicContact CB-CD1 4.39Å; R174-P188 PolarHBondContact NH2-O 3.24Å; R174-L190 PolarHBondContact NH2-O 3.29Å; R174-D192 IonicContact NH1-OD1 3.91Å; R174-D192 PolarHBondContact NH1-OD1 3.27Å; R174-L195 HydrophobicContact CG-CD1 3.52Å; R174-L195 VanDerWaalsContact CZ-CD1 3.47Å
175	A	84.6	Confident	75.6	Confident	26 Å²	26	89.5 Å²	89.5	22%	0.215	44%	0.438	C	S	.	.	H	α-helix	trans	-68	-55.9	175.4	0	0	0	0	0	110	D172 P173 L177 R178 D179	D172-A175 HydrophobicContact CB-CB 4.26Å; D172-A175 WeakPolarHBondContact O-CB 3.5Å; D172-A175 PolarHBondContact O-N 3.06Å; D172-A175 PolarHBondContact OD2-N 2.95Å; P173-A175 VanDerWaalsContact C-N 3.26Å; P173-A175 PolarHBondContact O-N 3Å; A175-L177 PolarHBondContact O-N 3.44Å; A175-R178 VanDerWaalsContact CA-NH2 3.33Å; A175-R178 WeakPolarHBondContact O-CA 3.45Å; A175-R178 WeakPolarHBondContact O-CB 3.49Å; A175-R178 PolarHBondContact O-N 2.73Å; A175-D179 PolarHBondContact O-N 3.26Å
176	I	83.2	Confident	76.6	Confident	16 Å²	16	86.4 Å²	86.4	8%	0.082	42%	0.424	C	S	.	.	H	α-helix	trans	-56.6	-38.9	178.4	-62.4	165.4	0	0	0	111.4	H167 T171 D179 L180 W196 I199	H167-I176 HydrophobicContact CB-CD1 4.41Å; T171-I176 HydrophobicContact CG2-CD1 3.76Å; T171-I176 HydrophobicContact CG2-CG1 4.04Å; I176-D179 PolarHBondContact O-N 3.06Å; I176-L180 HydrophobicContact CG2-CD1 3.8Å; I176-L180 HydrophobicContact CG2-CG 4.27Å; I176-L180 WeakPolarHBondContact O-CB 3.33Å; I176-L180 VanDerWaalsContact O-CG 3.29Å; I176-L180 WeakPolarHBondContact O-CG 3.38Å; I176-L180 PolarHBondContact O-N 2.82Å; I176-W196 HydrophobicContact CD1-CH2 3.36Å; I176-W196 HydrophobicContact CD1-CZ2 4.22Å; I176-W196 HydrophobicContact CD1-CZ3 3.84Å; I176-I199 HydrophobicContact CB-CD1 3.83Å; I176-I199 HydrophobicContact CD1-CD1 4.31Å; I176-I199 HydrophobicContact CG2-CD1 3.81Å; I176-I199 HydrophobicContact CG2-CG1 4.09Å; I176-I199 HydrophobicContact CG2-CG2 3.97Å
177	L	81.4	Confident	77.6	Confident	0 Å²	0	83.3 Å²	83.3	0%	0	42%	0.415	C	S	.	.	H	α-helix	trans	-72.1	-28.2	176	-73.8	171.8	0	0	0	114.4	P173 A175 D179 L181 L186 L195 I198 I199 I202	P173-L177 WeakPolarHBondContact O-CB 3.37Å; P173-L177 WeakPolarHBondContact O-CG 3.16Å; P173-L177 PolarHBondContact O-N 2.86Å; A175-L177 PolarHBondContact O-N 3.44Å; L177-D179 VanDerWaalsContact C-N 3.32Å; L177-L181 WeakPolarHBondContact O-CA 3.27Å; L177-L181 WeakPolarHBondContact O-CB 3.08Å; L177-L181 PolarHBondContact O-N 2.9Å; L177-L186 HydrophobicContact CB-CD1 3.56Å; L177-L186 HydrophobicContact CB-CD2 4.22Å; L177-L186 HydrophobicContact CB-CG 4.48Å; L177-L186 HydrophobicContact CD1-CD1 4.17Å; L177-L186 HydrophobicContact CD1-CD2 4.12Å; L177-L195 HydrophobicContact CD1-CB 3.87Å; L177-L195 HydrophobicContact CD1-CD2 3.51Å; L177-L195 HydrophobicContact CD1-CG 4.3Å; L177-I198 HydrophobicContact CD1-CB 4.3Å; L177-I198 HydrophobicContact CD1-CG2 4.3Å; L177-I198 HydrophobicContact CD2-CB 4.3Å; L177-I198 HydrophobicContact CD2-CG2 3.7Å; L177-I199 HydrophobicContact CD1-CG1 4.13Å; L177-I199 HydrophobicContact CD2-CB 4.47Å; L177-I199 HydrophobicContact CD2-CG1 3.52Å; L177-I199 HydrophobicContact CG-CD1 4.09Å; L177-I199 HydrophobicContact CG-CG1 3.5Å; L177-I199 VanDerWaalsContact CG-CG1 3.5Å; L177-I202 HydrophobicContact CD2-CD1 3.69Å
178	R	83.2	Confident	78.4	Confident	134 Å²	134	86.4 Å²	86.4	51%	0.506	44%	0.439	S	S	.	.	H	α-helix	trans	-68.8	-34.3	170.5	-79.8	171.5	-79.2	144.3	-8.9	111.3	D172 R174 A175 P182	D172-R178 IonicContact OD2-NH2 3.2Å; D172-R178 PolarHBondContact OD2-NH2 3.42Å; R174-R178 WeakPolarHBondContact O-CB 3.19Å; R174-R178 VanDerWaalsContact O-CG 3.29Å; R174-R178 WeakPolarHBondContact O-CG 3.43Å; R174-R178 PolarHBondContact O-N 2.86Å; R174-R178 VanDerWaalsContact O-N 3.11Å; R174-R178 PolarHBondContact O-NE 3.05Å; A175-R178 VanDerWaalsContact CA-NH2 3.33Å; A175-R178 WeakPolarHBondContact O-CA 3.45Å; A175-R178 WeakPolarHBondContact O-CB 3.49Å; A175-R178 PolarHBondContact O-N 2.73Å; R178-P182 WeakPolarHBondContact O-CA 3.4Å
179	D	82.8	Confident	79.5	Confident	131 Å²	131	89.2 Å²	89.2	70%	0.701	46%	0.456	S	S	*	.	H	α-helix	trans	-76.1	-37	177.1	-56	-32.3	0	0	0	112	A175 I176 L177	A175-D179 PolarHBondContact O-N 3.26Å; I176-D179 PolarHBondContact O-N 3.06Å; L177-D179 VanDerWaalsContact C-N 3.32Å
180	L	79.3	Confident	80.8	Confident	58 Å²	58	80.9 Å²	80.9	30%	0.304	43%	0.427	S	S	.	.	H	α-helix	trans	-79	-31	177.4	-69.9	175.8	0	0	0	114.1	L126 I176 I199 I202	L126-L180 HydrophobicContact CD1-CD2 4.32Å; I176-L180 HydrophobicContact CG2-CD1 3.8Å; I176-L180 HydrophobicContact CG2-CG 4.27Å; I176-L180 WeakPolarHBondContact O-CB 3.33Å; I176-L180 VanDerWaalsContact O-CG 3.29Å; I176-L180 WeakPolarHBondContact O-CG 3.38Å; I176-L180 PolarHBondContact O-N 2.82Å; L180-I199 HydrophobicContact CD1-CG2 4.16Å; L180-I202 HydrophobicContact CD1-CG2 4.35Å
181	L	81.6	Confident	81.7	Confident	56 Å²	56	76.5 Å²	76.5	29%	0.293	41%	0.409	S	S	.	.			trans	-133.6	63.9	-177.3	-63.1	178.6	0	0	0	111.5	L177 E183 T184 I202	L177-L181 WeakPolarHBondContact O-CA 3.27Å; L177-L181 WeakPolarHBondContact O-CB 3.08Å; L177-L181 PolarHBondContact O-N 2.9Å; L181-E183 PolarHBondContact O-N 2.74Å; L181-T184 PolarHBondContact O-N 2.73Å; L181-I202 HydrophobicContact CD1-CD1 3.61Å; L181-I202 HydrophobicContact CD2-CD1 4.46Å; L181-I202 HydrophobicContact CG-CD1 3.96Å
182	P	77.1	Confident	82	Confident	109 Å²	109	78 Å²	78	71%	0.708	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-21.8	-170.7	23.2	-34.9	0	0	0	115.3	R178	R178-P182 WeakPolarHBondContact O-CA 3.4Å
183	E	78.8	Confident	81.7	Confident	190 Å²	190	81.5 Å²	81.5	89%	0.888	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-2	176.7	-59.9	-171.2	172.8	0	0	113.7	L181	L181-E183 PolarHBondContact O-N 2.74Å
184	T	80.6	Confident	81.7	Confident	72 Å²	72	84 Å²	84	44%	0.442	45%	0.446	S	S	.	.			trans	-98.9	115.3	-176.4	-58.3	0	0	0	0	112	L181 L186	L181-T184 PolarHBondContact O-N 2.73Å; T184-L186 PolarHBondContact O-N 3.47Å; T184-L186 VanDerWaalsContact O-N 3.14Å
185	I	78.3	Confident	81.6	Confident	163 Å²	163	80.9 Å²	80.9	84%	0.836	44%	0.435	S	S	*	.			trans	-73.6	104.6	170.8	-55.9	176.9	0	0	0	108.8
186	L	78.6	Confident	81.4	Confident	32 Å²	32	80.3 Å²	80.3	17%	0.168	43%	0.427	C	S	.	.			trans	-67.9	128.8	174.4	-60.2	169.5	0	0	0	110.2	R174 L177 T184 L195	R174-L186 HydrophobicContact CB-CD1 4.39Å; L177-L186 HydrophobicContact CB-CD1 3.56Å; L177-L186 HydrophobicContact CB-CD2 4.22Å; L177-L186 HydrophobicContact CB-CG 4.48Å; L177-L186 HydrophobicContact CD1-CD1 4.17Å; L177-L186 HydrophobicContact CD1-CD2 4.12Å; T184-L186 PolarHBondContact O-N 3.47Å; T184-L186 VanDerWaalsContact O-N 3.14Å; L186-L195 HydrophobicContact CD1-CD2 4.45Å; L186-L195 HydrophobicContact CD2-CD2 4.47Å
187	P	84.3	Confident	80.8	Confident	62 Å²	62	84 Å²	84	40%	0.403	44%	0.444	S	S	.	.			trans	-59.1	135.6	173.8	-22.4	32.1	0	0	0	111.5	D189 L190	P187-D189 WeakPolarHBondContact CB-OD1 3.17Å; P187-D189 PolarHBondContact O-N 3.13Å; P187-L190 HydrophobicContact CB-CG 4.2Å; P187-L190 HydrophobicContact CG-CD1 4.37Å; P187-L190 HydrophobicContact CG-CG 4.47Å; P187-L190 PolarHBondContact O-N 3.43Å
188	P	79.1	Confident	80.7	Confident	113 Å²	113	86.3 Å²	86.3	73%	0.734	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-22.9	-172.7	29.1	-35.6	0	0	0	112.9	R174	R174-P188 PolarHBondContact NH2-O 3.24Å
189	D	86.4	Confident	80.5	Confident	136 Å²	136	80.1 Å²	80.1	73%	0.727	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-6.6	-176.3	58.1	-51.4	0	0	0	114.9	P187	P187-D189 WeakPolarHBondContact CB-OD1 3.17Å; P187-D189 PolarHBondContact O-N 3.13Å
190	L	85.1	Confident	80	Confident	43 Å²	43	74.9 Å²	74.9	23%	0.225	40%	0.404	C	S	.	.			trans	-66.7	133.7	173.4	-63.9	-177.7	0	0	0	111.4	R174 P187 T194 L195 I198	R174-L190 PolarHBondContact NH2-O 3.29Å; P187-L190 HydrophobicContact CB-CG 4.2Å; P187-L190 HydrophobicContact CG-CD1 4.37Å; P187-L190 HydrophobicContact CG-CG 4.47Å; P187-L190 PolarHBondContact O-N 3.43Å; L190-T194 HydrophobicContact CD2-CG2 4.02Å; L190-L195 HydrophobicContact CB-CD1 4.34Å; L190-L195 HydrophobicContact CB-CD2 3.95Å; L190-L195 HydrophobicContact CB-CG 3.95Å; L190-L195 HydrophobicContact CD1-CD2 3.74Å; L190-I198 HydrophobicContact CD1-CD1 4.03Å
191	D	85.6	Confident	79.4	Confident	81 Å²	81	76.6 Å²	76.6	43%	0.433	41%	0.414	S	S	.	.			trans	-77.7	159.4	171.6	72.4	-83.8	0	0	0	111.9	M193 T194 L195	D191-M193 VanDerWaalsContact C-N 3.27Å; D191-M193 PolarHBondContact O-N 3.37Å; D191-M193 WeakPolarHBondContact OD2-CA 3.31Å; D191-M193 VanDerWaalsContact OD2-CB 3.26Å; D191-M193 WeakPolarHBondContact OD2-CB 3.4Å; D191-M193 PolarHBondContact OD2-N 3Å; D191-T194 PolarHBondContact O-N 3.19Å; D191-T194 VanDerWaalsContact O-N 3.15Å; D191-T194 VanDerWaalsContact OD1-CB 3.23Å; D191-T194 WeakPolarHBondContact OD1-CB 3.37Å; D191-T194 PolarHBondContact OD1-OG1 2.71Å; D191-T194 PolarHBondContact OD2-N 3.04Å; D191-L195 WeakPolarHBondContact O-CG 3.44Å; D191-L195 PolarHBondContact O-N 2.81Å
192	D	82.1	Confident	79	Confident	82 Å²	82	77.2 Å²	77.2	44%	0.439	42%	0.417	S	S	.	.	H	α-helix	trans	-66.8	-25.9	-174.4	-62.8	-13.4	0	0	0	113.2	P173 R174 L195 W196	P173-D192 HydrophobicContact CG-CB 3.91Å; R174-D192 IonicContact NH1-OD1 3.91Å; R174-D192 PolarHBondContact NH1-OD1 3.27Å; D192-L195 PolarHBondContact O-N 2.69Å; D192-W196 WeakPolarHBondContact O-CB 3.36Å; D192-W196 PolarHBondContact O-N 3.1Å
193	M	76.4	Confident	78.6	Confident	139 Å²	139	74 Å²	74	69%	0.685	40%	0.397	S	S	*	.	H	α-helix	trans	-73.3	-38.6	174	-65.8	-61.8	-55.1	0	0	111.4	D191 L195 W196 Q197	D191-M193 VanDerWaalsContact C-N 3.27Å; D191-M193 PolarHBondContact O-N 3.37Å; D191-M193 WeakPolarHBondContact OD2-CA 3.31Å; D191-M193 VanDerWaalsContact OD2-CB 3.26Å; D191-M193 WeakPolarHBondContact OD2-CB 3.4Å; D191-M193 PolarHBondContact OD2-N 3Å; M193-L195 VanDerWaalsContact C-N 3.34Å; M193-W196 PolarHBondContact O-N 3Å; M193-Q197 WeakPolarHBondContact O-CB 3.45Å; M193-Q197 PolarHBondContact O-N 2.85Å
194	T	81.5	Confident	78.1	Confident	56 Å²	56	67.3 Å²	67.3	34%	0.344	37%	0.366	S	S	.	.	H	α-helix	trans	-62.7	-41.2	171	-65.6	0	0	0	0	111.1	L190 D191 Q197 I198	L190-T194 HydrophobicContact CD2-CG2 4.02Å; D191-T194 PolarHBondContact O-N 3.19Å; D191-T194 VanDerWaalsContact O-N 3.15Å; D191-T194 VanDerWaalsContact OD1-CB 3.23Å; D191-T194 WeakPolarHBondContact OD1-CB 3.37Å; D191-T194 PolarHBondContact OD1-OG1 2.71Å; D191-T194 PolarHBondContact OD2-N 3.04Å; T194-Q197 WeakPolarHBondContact O-CB 3.45Å; T194-Q197 PolarHBondContact O-N 2.72Å; T194-I198 HydrophobicContact CG2-CD1 4.29Å; T194-I198 WeakPolarHBondContact O-CG1 3.34Å; T194-I198 PolarHBondContact O-N 3.18Å
195	L	83.4	Confident	77.6	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-65.8	-44.2	176	-66	164.4	0	0	0	111.9	P173 R174 L177 L186 L190 D191 D192 M193 Q197 I198 I199	P173-L195 HydrophobicContact CB-CB 3.81Å; P173-L195 HydrophobicContact CG-CB 3.85Å; P173-L195 HydrophobicContact CG-CD1 4.31Å; R174-L195 HydrophobicContact CG-CD1 3.52Å; R174-L195 VanDerWaalsContact CZ-CD1 3.47Å; L177-L195 HydrophobicContact CD1-CB 3.87Å; L177-L195 HydrophobicContact CD1-CD2 3.51Å; L177-L195 HydrophobicContact CD1-CG 4.3Å; L186-L195 HydrophobicContact CD1-CD2 4.45Å; L186-L195 HydrophobicContact CD2-CD2 4.47Å; L190-L195 HydrophobicContact CB-CD1 4.34Å; L190-L195 HydrophobicContact CB-CD2 3.95Å; L190-L195 HydrophobicContact CB-CG 3.95Å; L190-L195 HydrophobicContact CD1-CD2 3.74Å; D191-L195 WeakPolarHBondContact O-CG 3.44Å; D191-L195 PolarHBondContact O-N 2.81Å; D192-L195 PolarHBondContact O-N 2.69Å; M193-L195 VanDerWaalsContact C-N 3.34Å; L195-Q197 VanDerWaalsContact C-N 3.29Å; L195-Q197 PolarHBondContact O-N 2.84Å; L195-I198 WeakPolarHBondContact O-CB 3.3Å; L195-I198 PolarHBondContact O-N 3.49Å; L195-I198 VanDerWaalsContact O-N 3.09Å; L195-I199 WeakPolarHBondContact O-CG1 3.29Å; L195-I199 PolarHBondContact O-N 2.94Å
196	W	79.8	Confident	77.5	Confident	13 Å²	13	62.7 Å²	62.7	5%	0.049	35%	0.347	C	S	.	.	H	α-helix	trans	-59.4	-38.3	171.2	-83	118.6	0	0	0	112.6	I164 H167 I168 P173 I176 D192 M193 I198 I199 I200	I164-W196 HydrophobicContact CB-CZ3 4.31Å; I164-W196 HydrophobicContact CG1-CZ3 4.19Å; I164-W196 HydrophobicContact CG2-CE3 3.76Å; I164-W196 HydrophobicContact CG2-CZ3 3.89Å; H167-W196 HydrophobicContact CB-CH2 3.78Å; I168-W196 HydrophobicContact CB-CZ2 4.44Å; I168-W196 HydrophobicContact CD1-CD2 4.32Å; I168-W196 HydrophobicContact CD1-CE3 4.43Å; I168-W196 HydrophobicContact CD1-CG 4.49Å; I168-W196 HydrophobicContact CG1-CD2 3.49Å; I168-W196 VanDerWaalsContact CG1-CD2 3.49Å; I168-W196 HydrophobicContact CG1-CE3 3.79Å; I168-W196 HydrophobicContact CG1-CG 3.91Å; I168-W196 HydrophobicContact CG1-CH2 4.24Å; I168-W196 HydrophobicContact CG1-CZ2 3.99Å; I168-W196 HydrophobicContact CG1-CZ3 4.16Å; P173-W196 HydrophobicContact CB-CD2 3.91Å; P173-W196 HydrophobicContact CB-CG 4.05Å; P173-W196 HydrophobicContact CB-CZ2 4.27Å; P173-W196 HydrophobicContact CG-CG 4.43Å; I176-W196 HydrophobicContact CD1-CH2 3.36Å; I176-W196 HydrophobicContact CD1-CZ2 4.22Å; I176-W196 HydrophobicContact CD1-CZ3 3.84Å; D192-W196 WeakPolarHBondContact O-CB 3.36Å; D192-W196 PolarHBondContact O-N 3.1Å; M193-W196 PolarHBondContact O-N 3Å; W196-I198 VanDerWaalsContact C-N 3.32Å; W196-I198 PolarHBondContact O-N 3.41Å; W196-I199 HydrophobicContact CD2-CD1 4.11Å; W196-I199 HydrophobicContact CE3-CB 4.25Å; W196-I199 HydrophobicContact CE3-CD1 3.52Å; W196-I199 HydrophobicContact CE3-CG1 4.46Å; W196-I199 HydrophobicContact CE3-CG2 4.41Å; W196-I199 HydrophobicContact CH2-CD1 4.37Å; W196-I199 HydrophobicContact CZ3-CD1 3.67Å; W196-I199 HydrophobicContact CZ3-CG2 4.34Å; W196-I199 PolarHBondContact O-N 3.48Å; W196-I200 WeakPolarHBondContact O-CB 3.3Å; W196-I200 VanDerWaalsContact O-CG1 3.25Å; W196-I200 WeakPolarHBondContact O-CG1 3.36Å; W196-I200 PolarHBondContact O-N 2.95Å
197	Q	72	Confident	77.7	Confident	94 Å²	94	67.4 Å²	67.4	44%	0.439	37%	0.367	S	S	.	.	H	α-helix	trans	-64.8	-34.9	174.6	-171.5	60.7	72.7	0	0	112.1	M193 T194 L195 N201	M193-Q197 WeakPolarHBondContact O-CB 3.45Å; M193-Q197 PolarHBondContact O-N 2.85Å; T194-Q197 WeakPolarHBondContact O-CB 3.45Å; T194-Q197 PolarHBondContact O-N 2.72Å; L195-Q197 VanDerWaalsContact C-N 3.29Å; L195-Q197 PolarHBondContact O-N 2.84Å; Q197-N201 PolarHBondContact NE2-OD1 3.03Å; Q197-N201 WeakPolarHBondContact O-CB 3.47Å; Q197-N201 PolarHBondContact O-N 2.99Å; Q197-N201 PolarHBondContact O-ND2 3.33Å; Q197-N201 PolarHBondContact O-OD1 2.91Å
198	I	78.1	Confident	78.1	Confident	49 Å²	49	64.5 Å²	64.5	25%	0.251	35%	0.348	S	S	.	.	H	α-helix	trans	-66.7	-44.6	173	-64.4	163	0	0	0	110.5	L177 L190 T194 L195 W196 I200 N201 I202	L177-I198 HydrophobicContact CD1-CB 4.3Å; L177-I198 HydrophobicContact CD1-CG2 4.3Å; L177-I198 HydrophobicContact CD2-CB 4.3Å; L177-I198 HydrophobicContact CD2-CG2 3.7Å; L190-I198 HydrophobicContact CD1-CD1 4.03Å; T194-I198 HydrophobicContact CG2-CD1 4.29Å; T194-I198 WeakPolarHBondContact O-CG1 3.34Å; T194-I198 PolarHBondContact O-N 3.18Å; L195-I198 WeakPolarHBondContact O-CB 3.3Å; L195-I198 PolarHBondContact O-N 3.49Å; L195-I198 VanDerWaalsContact O-N 3.09Å; W196-I198 VanDerWaalsContact C-N 3.32Å; W196-I198 PolarHBondContact O-N 3.41Å; I198-I200 VanDerWaalsContact C-N 3.33Å; I198-I200 PolarHBondContact O-N 3.35Å; I198-N201 PolarHBondContact O-N 3.2Å; I198-I202 HydrophobicContact CG2-CD1 3.7Å; I198-I202 HydrophobicContact CG2-CG1 4.39Å; I198-I202 VanDerWaalsContact O-CG1 3.3Å; I198-I202 WeakPolarHBondContact O-CG1 3.49Å; I198-I202 PolarHBondContact O-N 2.93Å
199	I	80.6	Confident	78.8	Confident	3 Å²	3	69.2 Å²	69.2	2%	0.015	35%	0.351	C	S	.	.	H	α-helix	trans	-57.7	-46.4	175	-62.5	166.4	0	0	0	110.7	I164 P173 I176 L177 L180 L195 W196 N201 I202 S203	I164-I199 HydrophobicContact CD1-CG2 3.8Å; I164-I199 HydrophobicContact CG1-CG2 3.92Å; P173-I199 HydrophobicContact CB-CD1 3.56Å; I176-I199 HydrophobicContact CB-CD1 3.83Å; I176-I199 HydrophobicContact CD1-CD1 4.31Å; I176-I199 HydrophobicContact CG2-CD1 3.81Å; I176-I199 HydrophobicContact CG2-CG1 4.09Å; I176-I199 HydrophobicContact CG2-CG2 3.97Å; L177-I199 HydrophobicContact CD1-CG1 4.13Å; L177-I199 HydrophobicContact CD2-CB 4.47Å; L177-I199 HydrophobicContact CD2-CG1 3.52Å; L177-I199 HydrophobicContact CG-CD1 4.09Å; L177-I199 HydrophobicContact CG-CG1 3.5Å; L177-I199 VanDerWaalsContact CG-CG1 3.5Å; L180-I199 HydrophobicContact CD1-CG2 4.16Å; L195-I199 WeakPolarHBondContact O-CG1 3.29Å; L195-I199 PolarHBondContact O-N 2.94Å; W196-I199 HydrophobicContact CD2-CD1 4.11Å; W196-I199 HydrophobicContact CE3-CB 4.25Å; W196-I199 HydrophobicContact CE3-CD1 3.52Å; W196-I199 HydrophobicContact CE3-CG1 4.46Å; W196-I199 HydrophobicContact CE3-CG2 4.41Å; W196-I199 HydrophobicContact CH2-CD1 4.37Å; W196-I199 HydrophobicContact CZ3-CD1 3.67Å; W196-I199 HydrophobicContact CZ3-CG2 4.34Å; W196-I199 PolarHBondContact O-N 3.48Å; I199-N201 PolarHBondContact O-N 3.42Å; I199-I202 PolarHBondContact O-N 3.11Å; I199-S203 VanDerWaalsContact O-CB 3.23Å; I199-S203 WeakPolarHBondContact O-CB 3.37Å; I199-S203 PolarHBondContact O-N 2.78Å; I199-S203 PolarHBondContact O-OG 3.35Å
200	I	70.6	Confident	79.2	Confident	22 Å²	22	65.5 Å²	65.5	11%	0.113	33%	0.328	C	S	.	.	H	α-helix	trans	-58.6	-47.5	176.8	-71	165.1	0	0	0	110.5	I164 W196 I198 I202 S203 E204	I164-I200 HydrophobicContact CD1-CG1 3.83Å; I164-I200 HydrophobicContact CG2-CD1 4.16Å; I164-I200 HydrophobicContact CG2-CG1 3.86Å; W196-I200 WeakPolarHBondContact O-CB 3.3Å; W196-I200 VanDerWaalsContact O-CG1 3.25Å; W196-I200 WeakPolarHBondContact O-CG1 3.36Å; W196-I200 PolarHBondContact O-N 2.95Å; I198-I200 VanDerWaalsContact C-N 3.33Å; I198-I200 PolarHBondContact O-N 3.35Å; I200-I202 PolarHBondContact O-N 3.42Å; I200-S203 PolarHBondContact O-N 3.42Å; I200-E204 VanDerWaalsContact CG2-OE1 3.25Å; I200-E204 WeakPolarHBondContact CG2-OE1 3.37Å; I200-E204 WeakPolarHBondContact O-CG 3.4Å; I200-E204 PolarHBondContact O-N 2.88Å; I200-E204 VanDerWaalsContact O-N 3.17Å
201	N	68.2	Low	79.8	Confident	94 Å²	94	67.1 Å²	67.1	50%	0.503	33%	0.331	S	S	.	.	H	α-helix	trans	-64.7	-35.1	-179.5	-66.9	-12.1	0	0	0	113.2	Q197 I198 I199	Q197-N201 PolarHBondContact NE2-OD1 3.03Å; Q197-N201 WeakPolarHBondContact O-CB 3.47Å; Q197-N201 PolarHBondContact O-N 2.99Å; Q197-N201 PolarHBondContact O-ND2 3.33Å; Q197-N201 PolarHBondContact O-OD1 2.91Å; I198-N201 PolarHBondContact O-N 3.2Å; I199-N201 PolarHBondContact O-N 3.42Å
202	I	72.6	Confident	80.2	Confident	69 Å²	69	72.7 Å²	72.7	35%	0.354	35%	0.351	S	S	.	.	H	α-helix	trans	-72.9	-33.6	175	-66.1	162.5	0	0	0	111.1	L177 L180 L181 I198 I199 I200 E204	L177-I202 HydrophobicContact CD2-CD1 3.69Å; L180-I202 HydrophobicContact CD1-CG2 4.35Å; L181-I202 HydrophobicContact CD1-CD1 3.61Å; L181-I202 HydrophobicContact CD2-CD1 4.46Å; L181-I202 HydrophobicContact CG-CD1 3.96Å; I198-I202 HydrophobicContact CG2-CD1 3.7Å; I198-I202 HydrophobicContact CG2-CG1 4.39Å; I198-I202 VanDerWaalsContact O-CG1 3.3Å; I198-I202 WeakPolarHBondContact O-CG1 3.49Å; I198-I202 PolarHBondContact O-N 2.93Å; I199-I202 PolarHBondContact O-N 3.11Å; I200-I202 PolarHBondContact O-N 3.42Å; I202-E204 VanDerWaalsContact C-N 3.29Å; I202-E204 PolarHBondContact O-N 3.07Å
203	S	69.2	Low	80.9	Confident	41 Å²	41	73.3 Å²	73.3	29%	0.287	36%	0.355	S	S	.	.	H	α-helix	trans	-79.8	-8.7	-177.8	-61.3	0	0	0	0	114.1	I199 I200	I199-S203 VanDerWaalsContact O-CB 3.23Å; I199-S203 WeakPolarHBondContact O-CB 3.37Å; I199-S203 PolarHBondContact O-N 2.78Å; I199-S203 PolarHBondContact O-OG 3.35Å; I200-S203 PolarHBondContact O-N 3.42Å
204	E	67.3	Low	81.9	Confident	50 Å²	50	67.1 Å²	67.1	23%	0.234	33%	0.325	C	S	.	.	S	Bend	trans	-84.6	145.7	175.7	-81.1	173.2	-130	0	0	111.5	I200 I202 R419	I200-E204 VanDerWaalsContact CG2-OE1 3.25Å; I200-E204 WeakPolarHBondContact CG2-OE1 3.37Å; I200-E204 WeakPolarHBondContact O-CG 3.4Å; I200-E204 PolarHBondContact O-N 2.88Å; I200-E204 VanDerWaalsContact O-N 3.17Å; I202-E204 VanDerWaalsContact C-N 3.29Å; I202-E204 PolarHBondContact O-N 3.07Å; E204-R419 IonicContact OE1-CZ 3.56Å; E204-R419 IonicContact OE1-NH1 3.46Å; E204-R419 PolarHBondContact OE1-NH1 3.37Å; E204-R419 IonicContact OE1-NH2 3.51Å; E204-R419 PolarHBondContact OE1-NH2 3.07Å; E204-R419 IonicContact OE2-CZ 3.83Å; E204-R419 IonicContact OE2-NH1 3.74Å; E204-R419 IonicContact OE2-NH2 3.83Å; E204-R419 PolarHBondContact OE2-NH2 3.33Å
205	P	69.6	Low	82.6	Confident	47 Å²	47	66.2 Å²	66.2	31%	0.305	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-61	142.4	173.6	27.4	-34.5	0	0	0	110.2	K207 N426	P205-K207 PolarHBondContact O-N 3.01Å; P205-N426 HydrophobicContact CB-CB 4.42Å; P205-N426 WeakPolarHBondContact CB-O 3.35Å; P205-N426 HydrophobicContact CG-CB 3.91Å
206	P	76.8	Confident	83.2	Confident	91 Å²	91	68.3 Å²	68.3	59%	0.591	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-57.9	141.6	-175.3	23.9	-33.9	0	0	0	111.1	R208 H430	P206-R208 PolarHBondContact O-N 3.05Å; P206-R208 VanDerWaalsContact O-N 3.1Å; P206-H430 PolarHBondContact O-CE1 2.79Å
207	K	83	Confident	84	Confident	131 Å²	131	67.8 Å²	67.8	57%	0.57	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-59.2	118.6	179.4	-71.4	-170	177.4	-170.4	0	110.2	P205 R209 H444	P205-K207 PolarHBondContact O-N 3.01Å; K207-R209 PolarHBondContact O-N 2.73Å; K207-H444 PolarHBondContact NZ-O 3.11Å
208	R	92.9	Very high	85.1	Confident	1 Å²	1	67.8 Å²	67.8	0%	0.004	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-54.5	132.3	176.9	-173	-97.5	-178.1	-176.8	-0.3	109.6	P206 N426 H430 V432 N446 D448	P206-R208 PolarHBondContact O-N 3.05Å; P206-R208 VanDerWaalsContact O-N 3.1Å; R208-N426 PolarHBondContact N-OD1 3.5Å; R208-H430 HydrophobicContact CG-CB 3.94Å; R208-H430 PolarHBondContact NE-O 3.2Å; R208-H430 PolarHBondContact NH2-O 3.11Å; R208-V432 PolarHBondContact NH2-O 3.46Å; R208-N446 PolarHBondContact NH1-O 2.88Å; R208-N446 WeakPolarHBondContact O-CB 3.15Å; R208-N446 PolarHBondContact O-ND2 3.37Å; R208-D448 IonicContact CZ-OD1 3.61Å; R208-D448 IonicContact CZ-OD2 2.65Å; R208-D448 VanDerWaalsContact NH1-CG 3.26Å; R208-D448 IonicContact NH1-OD1 2.66Å; R208-D448 PolarHBondContact NH1-OD1 2.85Å; R208-D448 IonicContact NH1-OD2 3.79Å; R208-D448 PolarHBondContact NH1-OD2 3.07Å; R208-D448 IonicContact NH2-OD1 3.38Å; R208-D448 PolarHBondContact NH2-OD1 2.7Å; R208-D448 IonicContact NH2-OD2 2.7Å; R208-D448 PolarHBondContact NH2-OD2 3.42Å
209	R	93.5	Very high	86.1	Confident	212 Å²	212	67.3 Å²	67.3	80%	0.8	33%	0.327	S	S	*	.	P	Polyproline II helix	trans	-86.1	143.1	176.9	-65.9	-178.3	179.5	-179.2	0.1	109.5	K207	K207-R209 PolarHBondContact O-N 2.73Å
210	K	95.1	Very high	86.9	Confident	57 Å²	57	67.3 Å²	67.3	25%	0.248	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-59.5	135.3	173.3	-169.3	-164.2	164	-164	0	110.6	N215 N446 F447 D448 N593	K210-N215 PolarHBondContact NZ-OD1 3.08Å; K210-N446 HydrophobicContact CB-CB 4.34Å; K210-F447 WeakPolarHBondContact CG-O 3.23Å; K210-D448 WeakPolarHBondContact CE-O 2.99Å; K210-N593 WeakPolarHBondContact CE-OD1 2.9Å; K210-N593 PolarHBondContact NZ-OD1 2.86Å
211	R	96.7	Very high	88.2	Confident	78 Å²	78	67 Å²	67	29%	0.294	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-69	134.2	166.8	-81.9	-178.4	67.7	166.8	-4.8	110.1	D213 E431 D448	R211-D213 WeakPolarHBondContact CB-OD1 3.45Å; R211-D213 IonicContact CZ-OD2 3.27Å; R211-D213 IonicContact NE-OD1 3.99Å; R211-D213 PolarHBondContact NE-OD1 3.49Å; R211-D213 IonicContact NE-OD2 3.51Å; R211-D213 PolarHBondContact NE-OD2 3.45Å; R211-D213 IonicContact NH2-OD2 3.44Å; R211-D213 PolarHBondContact NH2-OD2 3.48Å; R211-E431 WeakPolarHBondContact CD-O 3.3Å; R211-E431 PolarHBondContact NH1-O 2.7Å; R211-D448 WeakPolarHBondContact CB-OD1 3.47Å; R211-D448 PolarHBondContact N-OD1 2.81Å
212	K	95.3	Very high	89.7	Confident	197 Å²	197	67.9 Å²	67.9	86%	0.857	33%	0.325	S	S	*	.	S	Bend	trans	-82.5	-20.1	-177.7	-69.1	-172.9	177.9	-176.4	0	113	N215	K212-N215 PolarHBondContact O-ND2 2.66Å
213	D	96.3	Very high	90.9	Very high	96 Å²	96	65.6 Å²	65.6	51%	0.513	31%	0.314	S	S	.	.	S	Bend	trans	-91.3	-3.7	-173.6	57.7	-60.3	0	0	0	113.9	R211	R211-D213 WeakPolarHBondContact CB-OD1 3.45Å; R211-D213 IonicContact CZ-OD2 3.27Å; R211-D213 IonicContact NE-OD1 3.99Å; R211-D213 PolarHBondContact NE-OD1 3.49Å; R211-D213 IonicContact NE-OD2 3.51Å; R211-D213 PolarHBondContact NE-OD2 3.45Å; R211-D213 IonicContact NH2-OD2 3.44Å; R211-D213 PolarHBondContact NH2-OD2 3.48Å
214	I	97.4	Very high	92.3	Very high	9 Å²	9	63.8 Å²	63.8	5%	0.046	30%	0.301	C	S	.	.			trans	-127.4	118.8	179.6	-61.4	174	0	0	0	107.4	D219 L223 P433 D448 V449	I214-D219 HydrophobicContact CG2-CB 4.01Å; I214-L223 HydrophobicContact CD1-CD1 4.26Å; I214-L223 HydrophobicContact CG2-CD1 3.97Å; I214-P433 HydrophobicContact CD1-CB 3.79Å; I214-P433 HydrophobicContact CD1-CG 3.67Å; I214-D448 HydrophobicContact CB-CB 4Å; I214-D448 HydrophobicContact CG2-CB 3.67Å; I214-V449 HydrophobicContact CG2-CG2 4.09Å
215	N	96.2	Very high	93.7	Very high	36 Å²	36	66.2 Å²	66.2	19%	0.193	31%	0.312	C	S	.	.			trans	-148	-29	-173.1	-62.5	-84.4	0	0	0	114.4	K210 K212 D219 N593	K210-N215 PolarHBondContact NZ-OD1 3.08Å; K212-N215 PolarHBondContact O-ND2 2.66Å; N215-D219 PolarHBondContact N-OD2 3.5Å; N215-N593 HydrophobicContact CB-CB 4.22Å; N215-N593 WeakPolarHBondContact O-CA 3.37Å; N215-N593 WeakPolarHBondContact O-CB 3.27Å
216	T	96.7	Very high	95	Very high	45 Å²	45	69.5 Å²	69.5	28%	0.276	32%	0.323	S	S	.	.	S	Bend	trans	-100.6	162.6	-164.7	63.1	0	0	0	0	113.2	E218 D219 V220 Y595	T216-E218 PolarHBondContact O-N 2.7Å; T216-D219 PolarHBondContact N-OD2 3.5Å; T216-D219 WeakPolarHBondContact O-CB 3.5Å; T216-D219 PolarHBondContact O-N 2.81Å; T216-D219 PolarHBondContact OG1-N 2.66Å; T216-D219 PolarHBondContact OG1-OD2 2.77Å; T216-V220 PolarHBondContact O-N 3.16Å; T216-Y595 VanDerWaalsContact CA-OH 3.3Å; T216-Y595 WeakPolarHBondContact CA-OH 3.19Å
217	L	95.6	Very high	96.1	Very high	1 Å²	1	65.6 Å²	65.6	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-64.3	-32.4	171	-176.5	53.7	0	0	0	111	V220 V221 L451 L462 R465 Y587 Y595	L217-V220 WeakPolarHBondContact O-CB 3.42Å; L217-V220 PolarHBondContact O-N 3.29Å; L217-V221 WeakPolarHBondContact O-CG2 3.21Å; L217-V221 PolarHBondContact O-N 2.9Å; L217-L451 HydrophobicContact CD1-CD1 4Å; L217-L451 HydrophobicContact CD1-CD2 4Å; L217-L462 HydrophobicContact CD1-CD2 3.69Å; L217-R465 VanDerWaalsContact CD2-CZ 3.47Å; L217-Y587 HydrophobicContact CD2-CE1 4.26Å; L217-Y587 HydrophobicContact CD2-CE2 4.41Å; L217-Y595 HydrophobicContact CB-CE1 3.99Å; L217-Y595 HydrophobicContact CB-CE2 4.2Å; L217-Y595 PolarHBondContact N-OH 3.46Å
218	E	96.6	Very high	96.8	Very high	94 Å²	94	66.3 Å²	66.3	44%	0.439	30%	0.301	S	S	.	.	H	α-helix	trans	-64.1	-39.9	173.3	-69.8	55.8	-126	0	0	111.3	T216 V220 V221 K222 R465	T216-E218 PolarHBondContact O-N 2.7Å; E218-V220 VanDerWaalsContact C-N 3.33Å; E218-V220 PolarHBondContact O-N 2.99Å; E218-V221 PolarHBondContact O-N 3.33Å; E218-K222 VanDerWaalsContact O-CB 3.31Å; E218-K222 WeakPolarHBondContact O-CB 3.37Å; E218-K222 PolarHBondContact O-N 3.22Å; E218-R465 IonicContact OE1-CZ 3.28Å; E218-R465 IonicContact OE1-NH1 2.66Å; E218-R465 PolarHBondContact OE1-NH1 3.47Å
219	D	97.9	Very high	97.1	Very high	40 Å²	40	70.7 Å²	70.7	21%	0.214	32%	0.318	C	S	.	.	H	α-helix	trans	-61.5	-41.6	171.6	-62.4	-48.6	0	0	0	111	I214 N215 T216 K222 L223	I214-D219 HydrophobicContact CG2-CB 4.01Å; N215-D219 PolarHBondContact N-OD2 3.5Å; T216-D219 PolarHBondContact N-OD2 3.5Å; T216-D219 WeakPolarHBondContact O-CB 3.5Å; T216-D219 PolarHBondContact O-N 2.81Å; T216-D219 PolarHBondContact OG1-N 2.66Å; T216-D219 PolarHBondContact OG1-OD2 2.77Å; D219-K222 PolarHBondContact O-N 3.38Å; D219-L223 WeakPolarHBondContact O-CB 3.38Å; D219-L223 WeakPolarHBondContact O-CD1 3.36Å; D219-L223 WeakPolarHBondContact O-CG 3.44Å; D219-L223 PolarHBondContact O-N 2.9Å
220	V	98.3	Very high	97.3	Very high	2 Å²	2	60.6 Å²	60.6	1%	0.012	28%	0.28	C	S	.	.	H	α-helix	trans	-63	-44.5	176.9	179	0	0	0	0	111.3	T216 L217 E218 L223 L224 V435 V449 L451 L462	T216-V220 PolarHBondContact O-N 3.16Å; L217-V220 WeakPolarHBondContact O-CB 3.42Å; L217-V220 PolarHBondContact O-N 3.29Å; E218-V220 VanDerWaalsContact C-N 3.33Å; E218-V220 PolarHBondContact O-N 2.99Å; V220-L223 PolarHBondContact O-N 3.1Å; V220-L224 HydrophobicContact CG1-CD1 3.9Å; V220-L224 WeakPolarHBondContact O-CB 3.41Å; V220-L224 WeakPolarHBondContact O-CG 3.37Å; V220-L224 PolarHBondContact O-N 3.44Å; V220-V435 HydrophobicContact CG1-CG1 4.12Å; V220-V435 HydrophobicContact CG1-CG2 4.31Å; V220-V435 HydrophobicContact CG2-CG1 4.07Å; V220-V435 HydrophobicContact CG2-CG2 3.93Å; V220-V449 HydrophobicContact CG2-CB 3.67Å; V220-V449 HydrophobicContact CG2-CG1 3.79Å; V220-V449 HydrophobicContact CG2-CG2 3.66Å; V220-L451 HydrophobicContact CG1-CD1 4.46Å; V220-L462 HydrophobicContact CG1-CD2 3.99Å
221	V	97.9	Very high	97.5	Very high	17 Å²	17	57.9 Å²	57.9	10%	0.103	27%	0.268	C	S	.	.	H	α-helix	trans	-64.3	-42.9	177.1	172.9	0	0	0	0	110.8	L217 E218 L224 H225 L462 R465 L466	L217-V221 WeakPolarHBondContact O-CG2 3.21Å; L217-V221 PolarHBondContact O-N 2.9Å; E218-V221 PolarHBondContact O-N 3.33Å; V221-L224 PolarHBondContact O-N 3.48Å; V221-H225 PolarHBondContact O-CD2 3.43Å; V221-H225 VanDerWaalsContact O-CD2 3.22Å; V221-H225 PolarHBondContact O-N 2.88Å; V221-L462 HydrophobicContact CG2-CD2 4.01Å; V221-R465 HydrophobicContact CG1-CB 4.17Å; V221-R465 HydrophobicContact CG2-CB 3.63Å; V221-R465 HydrophobicContact CG2-CG 4.44Å; V221-L466 HydrophobicContact CG1-CD2 4.21Å
222	K	98.3	Very high	97.6	Very high	111 Å²	111	54.2 Å²	54.2	48%	0.483	25%	0.254	S	S	.	.	H	α-helix	trans	-60.4	-48.6	174.6	-179.1	-175.1	171.9	-170.7	0	111.9	E218 D219 L224 H225 E226	E218-K222 VanDerWaalsContact O-CB 3.31Å; E218-K222 WeakPolarHBondContact O-CB 3.37Å; E218-K222 PolarHBondContact O-N 3.22Å; D219-K222 PolarHBondContact O-N 3.38Å; K222-L224 VanDerWaalsContact C-N 3.34Å; K222-L224 PolarHBondContact O-N 2.87Å; K222-H225 PolarHBondContact O-N 2.93Å; K222-H225 VanDerWaalsContact O-N 3.09Å; K222-E226 WeakPolarHBondContact CE-OE1 3.31Å; K222-E226 WeakPolarHBondContact CE-OE2 3.45Å; K222-E226 HydrophobicContact CG-CG 4.32Å; K222-E226 WeakPolarHBondContact O-CG 3.45Å; K222-E226 PolarHBondContact O-N 3.37Å
223	L	98.6	Very high	97.7	Very high	22 Å²	22	44.8 Å²	44.8	12%	0.115	21%	0.213	C	C	.	.	H	α-helix	trans	-58.2	-45.7	175.6	-73.1	167	0	0	0	111.1	I214 D219 V220 H225 E226 S227 L408 P433	I214-L223 HydrophobicContact CD1-CD1 4.26Å; I214-L223 HydrophobicContact CG2-CD1 3.97Å; D219-L223 WeakPolarHBondContact O-CB 3.38Å; D219-L223 WeakPolarHBondContact O-CD1 3.36Å; D219-L223 WeakPolarHBondContact O-CG 3.44Å; D219-L223 PolarHBondContact O-N 2.9Å; V220-L223 PolarHBondContact O-N 3.1Å; L223-H225 PolarHBondContact O-N 2.85Å; L223-E226 PolarHBondContact O-N 2.97Å; L223-S227 WeakPolarHBondContact O-CB 3.48Å; L223-S227 PolarHBondContact O-N 3.5Å; L223-S227 PolarHBondContact O-OG 3.18Å; L223-L408 HydrophobicContact CB-CD1 4.26Å; L223-L408 HydrophobicContact CB-CD2 4.15Å; L223-L408 HydrophobicContact CD1-CD1 4.23Å; L223-P433 HydrophobicContact CD1-CB 3.83Å; L223-P433 HydrophobicContact CD1-CG 4.37Å; L223-P433 HydrophobicContact CD2-CB 4.09Å; L223-P433 HydrophobicContact CD2-CG 3.75Å
224	L	98.1	Very high	97.8	Very high	3 Å²	3	40.2 Å²	40.2	2%	0.016	19%	0.189	C	C	.	.	H	α-helix	trans	-62.3	-27.9	175.9	-78.3	167.3	0	0	0	113.3	V220 V221 K222 I230 F303 K312 L408 I410 L462 L466	V220-L224 HydrophobicContact CG1-CD1 3.9Å; V220-L224 WeakPolarHBondContact O-CB 3.41Å; V220-L224 WeakPolarHBondContact O-CG 3.37Å; V220-L224 PolarHBondContact O-N 3.44Å; V221-L224 PolarHBondContact O-N 3.48Å; K222-L224 VanDerWaalsContact C-N 3.34Å; K222-L224 PolarHBondContact O-N 2.87Å; L224-I230 HydrophobicContact CD2-CD1 4.4Å; L224-F303 HydrophobicContact CD1-CZ 4.36Å; L224-F303 HydrophobicContact CD2-CZ 4Å; L224-K312 PolarHBondContact O-NZ 2.95Å; L224-L408 HydrophobicContact CD2-CD2 4.27Å; L224-I410 HydrophobicContact CD2-CD1 3.58Å; L224-L462 HydrophobicContact CD1-CD1 4.35Å; L224-L462 HydrophobicContact CD1-CD2 4.2Å; L224-L466 HydrophobicContact CB-CD1 4.41Å; L224-L466 HydrophobicContact CB-CD2 3.74Å; L224-L466 HydrophobicContact CD1-CD1 4.27Å
225	H	96.7	Very high	97.8	Very high	100 Å²	100	39.9 Å²	39.9	46%	0.463	19%	0.187	S	C	.	.	H	α-helix	trans	-77.6	-47.5	169.8	-78.2	-65.3	0	0	0	113.1	V221 K222 L223 K312 L466	V221-H225 PolarHBondContact O-CD2 3.43Å; V221-H225 VanDerWaalsContact O-CD2 3.22Å; V221-H225 PolarHBondContact O-N 2.88Å; K222-H225 PolarHBondContact O-N 2.93Å; K222-H225 VanDerWaalsContact O-N 3.09Å; L223-H225 PolarHBondContact O-N 2.85Å; H225-K312 PolarHBondContact O-NZ 2.92Å; H225-L466 PolarHBondContact CE1-O 2.84Å
226	E	97.9	Very high	97.6	Very high	116 Å²	116	39.5 Å²	39.5	54%	0.542	19%	0.189	S	C	.	.	H	α-helix	trans	-79.4	-36.5	-170.5	-69.1	179.2	170.6	0	0	114.2	K222 L223	K222-E226 WeakPolarHBondContact CE-OE1 3.31Å; K222-E226 WeakPolarHBondContact CE-OE2 3.45Å; K222-E226 HydrophobicContact CG-CG 4.32Å; K222-E226 WeakPolarHBondContact O-CG 3.45Å; K222-E226 PolarHBondContact O-N 3.37Å; L223-E226 PolarHBondContact O-N 2.97Å
227	S	98.5	Very high	97.5	Very high	9 Å²	9	38.5 Å²	38.5	6%	0.063	19%	0.187	C	C	.	.			trans	-67.4	149.2	-177.3	-65.6	0	0	0	0	113.4	L223 K312 D407 L408	L223-S227 WeakPolarHBondContact O-CB 3.48Å; L223-S227 PolarHBondContact O-N 3.5Å; L223-S227 PolarHBondContact O-OG 3.18Å; S227-K312 WeakPolarHBondContact O-CE 3.41Å; S227-K312 PolarHBondContact O-NZ 3.4Å; S227-D407 WeakPolarHBondContact CB-OD1 3.49Å; S227-L408 WeakPolarHBondContact OG-CB 3.35Å
228	K	98.3	Very high	97.5	Very high	147 Å²	147	38.4 Å²	38.4	64%	0.639	19%	0.187	S	C	*	.	S	Bend	trans	-131.9	-12.1	-172.4	-62.1	175.5	-172.9	171.2	0	113.8	K312 D407	K228-K312 CarbonylContact C-O 3.16Å; K228-K312 VanDerWaalsContact C-O 3.3Å; K228-D407 PolarHBondContact N-OD1 2.85Å; K228-D407 PolarHBondContact N-OD2 2.83Å
229	R	98.6	Very high	97.5	Very high	93 Å²	93	34 Å²	34	35%	0.351	17%	0.167	S	C	.	.	S	Bend	trans	-134.4	57	-177.4	-61.4	-170.8	-54.1	-56.2	-17.1	109	K312 L314 E405 V406 D407	R229-K312 PolarHBondContact N-O 2.99Å; R229-L314 VanDerWaalsContact C-CB 3.49Å; R229-L314 HydrophobicContact CB-CB 4.07Å; R229-L314 HydrophobicContact CB-CD2 4.33Å; R229-E405 WeakPolarHBondContact CD-OE2 3.39Å; R229-E405 IonicContact CZ-OE2 2.64Å; R229-E405 PolarHBondContact NE-O 3.21Å; R229-E405 IonicContact NE-OE2 2.92Å; R229-E405 PolarHBondContact NE-OE2 2.9Å; R229-E405 PolarHBondContact NH2-O 3.25Å; R229-V406 WeakPolarHBondContact O-CA 3.41Å; R229-D407 WeakPolarHBondContact CA-OD1 3.45Å; R229-D407 IonicContact CZ-OD2 2.91Å; R229-D407 VanDerWaalsContact N-CG 3.27Å; R229-D407 PolarHBondContact N-OD1 3.49Å; R229-D407 PolarHBondContact N-OD2 2.82Å; R229-D407 IonicContact NH1-OD2 3.81Å; R229-D407 PolarHBondContact O-N 3.21Å; R229-D407 VanDerWaalsContact O-N 3.16Å
230	I	98.8	Very high	97.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	125.9	-175.4	-53.1	171.6	0	0	0	109.9	L224 V232 L307 K312 L313 L314 R315 L408 I410	L224-I230 HydrophobicContact CD2-CD1 4.4Å; I230-V232 HydrophobicContact CG2-CG2 3.98Å; I230-L307 HydrophobicContact CD1-CD2 4.11Å; I230-K312 HydrophobicContact CD1-CB 4.07Å; I230-K312 PolarHBondContact N-O 3.43Å; I230-L313 CarbonylContact O-C 3.58Å; I230-L314 PolarHBondContact O-N 2.94Å; I230-R315 PolarHBondContact O-N 2.92Å; I230-L408 CarbonylContact C-O 3.42Å; I230-L408 WeakPolarHBondContact CA-O 3.46Å; I230-L408 HydrophobicContact CD1-CD2 4.29Å; I230-L408 HydrophobicContact CG1-CB 4.26Å; I230-L408 HydrophobicContact CG1-CD2 4.14Å; I230-L408 HydrophobicContact CG2-CB 4.33Å; I230-L408 HydrophobicContact CG2-CD2 4.11Å; I230-L408 HydrophobicContact CG2-CG 4.2Å; I230-I410 HydrophobicContact CG2-CD1 3.84Å; I230-I410 HydrophobicContact CG2-CG1 4.06Å
231	L	98.8	Very high	97	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	118.9	171.8	-164.6	165.5	0	0	0	108.8	R315 Y317 D402 V406 L408 L409 I410	L231-R315 WeakPolarHBondContact CA-O 3.36Å; L231-Y317 HydrophobicContact CD1-CD2 4.08Å; L231-Y317 HydrophobicContact CD1-CE2 3.82Å; L231-Y317 HydrophobicContact CD2-CD2 3.55Å; L231-Y317 HydrophobicContact CD2-CE2 4.17Å; L231-Y317 HydrophobicContact CD2-CG 4.41Å; L231-Y317 HydrophobicContact CG-CD2 3.79Å; L231-Y317 HydrophobicContact CG-CE2 3.94Å; L231-D402 HydrophobicContact CD1-CB 4.43Å; L231-V406 HydrophobicContact CB-CB 4.27Å; L231-V406 HydrophobicContact CB-CG2 3.53Å; L231-V406 HydrophobicContact CD1-CG2 4.47Å; L231-L408 PolarHBondContact N-O 2.98Å; L231-L409 HydrophobicContact CB-CD1 4.48Å; L231-L409 HydrophobicContact CD2-CD1 3.79Å; L231-L409 WeakPolarHBondContact O-CA 3.33Å; L231-I410 PolarHBondContact O-N 3.45Å
232	V	98.8	Very high	96.7	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	120.5	178.6	-174.1	0	0	0	0	110.2	I230 T234 I304 L307 L313 R315 N316 Y317 I410 I412	I230-V232 HydrophobicContact CG2-CG2 3.98Å; V232-T234 HydrophobicContact CG1-CG2 4.23Å; V232-I304 HydrophobicContact CG1-CD1 3.91Å; V232-I304 HydrophobicContact CG1-CG1 4.1Å; V232-L307 HydrophobicContact CG2-CD1 4.27Å; V232-L313 HydrophobicContact CB-CD1 4.13Å; V232-L313 HydrophobicContact CG2-CD1 3.61Å; V232-R315 PolarHBondContact N-O 3.19Å; V232-N316 CarbonylContact O-C 3.56Å; V232-N316 WeakPolarHBondContact O-CA 3.46Å; V232-N316 PolarHBondContact O-ND2 3.24Å; V232-Y317 PolarHBondContact O-N 2.85Å; V232-I410 CarbonylContact C-O 3.5Å; V232-I410 WeakPolarHBondContact CA-O 3.44Å; V232-I412 HydrophobicContact CG1-CD1 3.63Å; V232-I412 HydrophobicContact CG1-CG1 3.98Å
233	L	98.6	Very high	96.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	111.8	177.9	-161.7	176.7	0	0	0	109.4	Y317 Q319 I410 V411 I412 L416 V421 I424	L233-Y317 CarbonylContact C-O 3.6Å; L233-Y317 VanDerWaalsContact CA-O 3.31Å; L233-Y317 WeakPolarHBondContact CA-O 3.3Å; L233-Q319 HydrophobicContact CD2-CG 4.29Å; L233-I410 PolarHBondContact N-O 2.94Å; L233-V411 HydrophobicContact CB-CG2 4.28Å; L233-V411 WeakPolarHBondContact O-CA 3.28Å; L233-I412 PolarHBondContact O-N 3.17Å; L233-L416 HydrophobicContact CD1-CD2 3.68Å; L233-L416 HydrophobicContact CD2-CD2 3.68Å; L233-L416 HydrophobicContact CG-CD2 4.34Å; L233-V421 HydrophobicContact CD1-CG1 4.15Å; L233-V421 HydrophobicContact CD2-CG1 4.06Å; L233-V421 HydrophobicContact CG-CG1 4.25Å; L233-I424 HydrophobicContact CD1-CB 4.12Å; L233-I424 HydrophobicContact CD1-CD1 4.07Å; L233-I424 HydrophobicContact CD1-CG2 4.36Å
234	T	98.3	Very high	95.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	147	-177.8	41.5	0	0	0	0	113.4	V232 V238 I304 N316 Y317 T318 Q319 I412	V232-T234 HydrophobicContact CG1-CG2 4.23Å; T234-V238 HydrophobicContact CG2-CG1 3.94Å; T234-V238 HydrophobicContact CG2-CG2 4.16Å; T234-I304 HydrophobicContact CG2-CD1 3.5Å; T234-I304 VanDerWaalsContact CG2-CD1 3.5Å; T234-N316 PolarHBondContact OG1-ND2 3.37Å; T234-Y317 PolarHBondContact N-O 3.49Å; T234-T318 VanDerWaalsContact OG1-CA 3.27Å; T234-T318 WeakPolarHBondContact OG1-CA 3.23Å; T234-T318 WeakPolarHBondContact OG1-CB 3.35Å; T234-T318 PolarHBondContact OG1-OG1 2.92Å; T234-Q319 WeakPolarHBondContact O-CB 3.4Å; T234-Q319 PolarHBondContact O-N 3.41Å; T234-I412 WeakPolarHBondContact CA-O 3.29Å; T234-I412 HydrophobicContact CG2-CB 4.34Å
235	G	96	Very high	95	Very high	2 Å²	2	37.1 Å²	37.1	2%	0.021	21%	0.212	C	C	.	.			trans	-136.3	-173.5	167.9	0	0	0	0	0	112.3	G237 V238 N320 I412 G413	G235-G237 PolarHBondContact O-N 2.82Å; G235-V238 WeakPolarHBondContact O-CG2 3.29Å; G235-V238 PolarHBondContact O-N 3.04Å; G235-N320 WeakPolarHBondContact CA-OD1 3.23Å; G235-N320 PolarHBondContact O-ND2 3.28Å; G235-N320 PolarHBondContact O-OD1 3.2Å; G235-I412 PolarHBondContact N-O 3.31Å; G235-I412 VanDerWaalsContact N-O 3.1Å; G235-G413 CarbonylContact C-O 3.53Å; G235-G413 WeakPolarHBondContact CA-O 3.49Å
236	A	92.8	Very high	94.3	Very high	27 Å²	27	33.9 Å²	33.9	22%	0.223	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-54.6	-23.9	-167.8	0	0	0	0	0	114.9	V238 S239 V240 D246 N320 G413	A236-V238 PolarHBondContact O-N 3.04Å; A236-S239 PolarHBondContact O-N 2.84Å; A236-V240 PolarHBondContact O-N 3.06Å; A236-D246 HydrophobicContact CB-CB 3.99Å; A236-N320 WeakPolarHBondContact CA-OD1 3.44Å; A236-N320 PolarHBondContact N-OD1 2.84Å; A236-G413 PolarHBondContact N-O 2.96Å
237	G	94	Very high	93.3	Very high	24 Å²	24	30.7 Å²	30.7	25%	0.247	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-56.7	-27.3	175.8	0	0	0	0	0	114.8	G235 S239 G413	G235-G237 PolarHBondContact O-N 2.82Å; G237-S239 VanDerWaalsContact C-N 3.28Å; G237-S239 PolarHBondContact O-N 3.44Å; G237-G413 WeakPolarHBondContact CA-O 3.46Å; G237-G413 PolarHBondContact N-O 3.41Å
238	V	96.6	Very high	92.1	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-75.4	-15.7	174.5	-57.5	0	0	0	0	113.7	T234 G235 A236 S298 C300 H301 N320 I412	T234-V238 HydrophobicContact CG2-CG1 3.94Å; T234-V238 HydrophobicContact CG2-CG2 4.16Å; G235-V238 WeakPolarHBondContact O-CG2 3.29Å; G235-V238 PolarHBondContact O-N 3.04Å; A236-V238 PolarHBondContact O-N 3.04Å; V238-S298 WeakPolarHBondContact O-CB 3.49Å; V238-S298 PolarHBondContact O-OG 2.72Å; V238-C300 HydrophobicContact CB-CB 3.81Å; V238-C300 HydrophobicContact CG1-CB 3.74Å; V238-H301 PolarHBondContact O-CE1 3.5Å; V238-N320 WeakPolarHBondContact CG2-ND2 3.36Å; V238-I412 HydrophobicContact CG1-CB 4.05Å; V238-I412 HydrophobicContact CG1-CG2 3.52Å
239	S	95.2	Very high	90.9	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.007	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-9	-177.1	-57.4	0	0	0	0	113.8	A236 G237 S241 C242 I244 N320 D322	A236-S239 PolarHBondContact O-N 2.84Å; G237-S239 VanDerWaalsContact C-N 3.28Å; G237-S239 PolarHBondContact O-N 3.44Å; S239-S241 PolarHBondContact O-N 2.72Å; S239-C242 WeakPolarHBondContact O-CA 3.47Å; S239-C242 WeakPolarHBondContact O-CB 3.17Å; S239-C242 PolarHBondContact O-N 3.09Å; S239-I244 PolarHBondContact O-N 3.16Å; S239-N320 PolarHBondContact OG-ND2 3.25Å; S239-D322 WeakPolarHBondContact CB-OD2 3.39Å; S239-D322 PolarHBondContact OG-OD2 3.11Å
240	V	92.5	Very high	89.6	Confident	74 Å²	74	35.1 Å²	35.1	45%	0.448	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-58.1	-47.1	-178.7	176.9	0	0	0	0	112.1	A236 C242 G243 I244 D246	A236-V240 PolarHBondContact O-N 3.06Å; V240-C242 PolarHBondContact O-N 2.94Å; V240-G243 PolarHBondContact O-N 3.5Å; V240-G243 VanDerWaalsContact O-N 3.12Å; V240-I244 WeakPolarHBondContact CA-O 3.48Å; V240-D246 HydrophobicContact CG2-CB 4.05Å
241	S	93.3	Very high	88.3	Confident	72 Å²	72	40.3 Å²	40.3	50%	0.503	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-67.6	-16.6	176.3	55.1	0	0	0	0	114	S239 G243 S298 D456	S239-S241 PolarHBondContact O-N 2.72Å; S241-G243 PolarHBondContact O-N 2.84Å; S241-S298 VanDerWaalsContact OG-CB 3.28Å; S241-S298 WeakPolarHBondContact OG-CB 3.16Å; S241-D456 WeakPolarHBondContact CB-OD2 3.4Å; S241-D456 PolarHBondContact OG-OD2 3.41Å
242	C	92.8	Very high	87.1	Confident	19 Å²	19	40.3 Å²	40.3	13%	0.128	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-77.5	-7.2	174.7	-51.3	0	0	0	0	112.1	S239 V240 F295 Q296 S298 L324	S239-C242 WeakPolarHBondContact O-CA 3.47Å; S239-C242 WeakPolarHBondContact O-CB 3.17Å; S239-C242 PolarHBondContact O-N 3.09Å; V240-C242 PolarHBondContact O-N 2.94Å; C242-F295 VanDerWaalsContact O-CD1 3.29Å; C242-F295 WeakPolarHBondContact O-CD1 3.34Å; C242-Q296 WeakPolarHBondContact CB-O 3.46Å; C242-Q296 PolarHBondContact SG-O 2.85Å; C242-S298 VanDerWaalsContact SG-CB 3.56Å; C242-S298 PolarHBondContact SG-N 3.48Å; C242-S298 VanDerWaalsContact SG-N 3.38Å; C242-L324 HydrophobicContact CB-CD1 3.79Å
243	G	88.9	Confident	86.2	Confident	53 Å²	53	40.6 Å²	40.6	55%	0.546	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	94	3.6	-174.2	0	0	0	0	0	114.3	V240 S241 P245	V240-G243 PolarHBondContact O-N 3.5Å; V240-G243 VanDerWaalsContact O-N 3.12Å; S241-G243 PolarHBondContact O-N 2.84Å; G243-P245 WeakPolarHBondContact O-CD 3.13Å
244	I	88.2	Confident	85.1	Confident	14 Å²	14	42.3 Å²	42.3	7%	0.072	24%	0.235	C	C	.	.			trans	-90.8	108.8	176.1	-58.3	-178.4	0	0	0	107.9	S239 V240 I290 F295 D322 L324	S239-I244 PolarHBondContact O-N 3.16Å; V240-I244 WeakPolarHBondContact CA-O 3.48Å; I244-I290 HydrophobicContact CG2-CG2 3.95Å; I244-F295 HydrophobicContact CD1-CB 4.33Å; I244-F295 HydrophobicContact CD1-CD1 4.45Å; I244-F295 HydrophobicContact CD1-CD2 3.72Å; I244-F295 HydrophobicContact CD1-CE2 4.14Å; I244-F295 HydrophobicContact CD1-CG 3.9Å; I244-F295 HydrophobicContact CG1-CD1 3.83Å; I244-F295 HydrophobicContact CG1-CD2 3.84Å; I244-F295 HydrophobicContact CG1-CE1 3.9Å; I244-F295 HydrophobicContact CG1-CE2 3.95Å; I244-F295 HydrophobicContact CG1-CG 3.78Å; I244-F295 HydrophobicContact CG1-CZ 3.96Å; I244-D322 HydrophobicContact CD1-CB 3.48Å; I244-D322 VanDerWaalsContact CD1-CB 3.48Å; I244-L324 HydrophobicContact CD1-CD1 3.86Å
245	P	81.6	Confident	84	Confident	29 Å²	29	44.7 Å²	44.7	19%	0.188	25%	0.254	C	S	.	.			trans	-62.3	143.1	178.1	26.3	-33.7	0	0	0	110.4	G243 I253	G243-P245 WeakPolarHBondContact O-CD 3.13Å; P245-I253 HydrophobicContact CB-CG1 4.18Å; P245-I253 HydrophobicContact CG-CD1 4.37Å; P245-I253 HydrophobicContact CG-CG1 3.78Å; P245-I253 WeakPolarHBondContact O-CD1 3.47Å
246	D	81.4	Confident	83	Confident	31 Å²	31	50.2 Å²	50.2	17%	0.166	27%	0.274	C	S	.	.			trans	-73	169.4	171.7	85.7	-68.3	0	0	0	111.1	A236 V240 R248 S249 G252 I253	A236-D246 HydrophobicContact CB-CB 3.99Å; V240-D246 HydrophobicContact CG2-CB 4.05Å; D246-R248 WeakPolarHBondContact OD2-CA 3.33Å; D246-R248 PolarHBondContact OD2-N 2.94Å; D246-S249 WeakPolarHBondContact OD1-CB 3.41Å; D246-S249 PolarHBondContact OD1-N 2.81Å; D246-S249 PolarHBondContact OD1-OG 2.89Å; D246-S249 PolarHBondContact OD2-N 2.83Å; D246-G252 CarbonylContact O-C 3.52Å; D246-G252 WeakPolarHBondContact O-CA 3.28Å; D246-I253 PolarHBondContact O-N 3.3Å
247	F	77.1	Confident	82.1	Confident	50 Å²	50	49.3 Å²	49.3	22%	0.219	27%	0.266	C	S	.	.	S	Bend	trans	-77.2	-29.9	-178.1	-65.2	-78.5	0	0	0	113.9	I253 Y254 F271 F286	F247-I253 HydrophobicContact CD1-CB 4.16Å; F247-I253 HydrophobicContact CD1-CD1 3.48Å; F247-I253 VanDerWaalsContact CD1-CD1 3.48Å; F247-I253 HydrophobicContact CD1-CG1 4.43Å; F247-I253 HydrophobicContact CD1-CG2 4.38Å; F247-I253 HydrophobicContact CE1-CD1 3.45Å; F247-I253 VanDerWaalsContact CE1-CD1 3.45Å; F247-I253 HydrophobicContact CG-CD1 4.05Å; F247-I253 HydrophobicContact CZ-CD1 4Å; F247-Y254 HydrophobicContact CB-CD1 4.32Å; F247-Y254 HydrophobicContact CB-CD2 4.33Å; F247-Y254 HydrophobicContact CB-CE1 4.01Å; F247-Y254 HydrophobicContact CB-CE2 4.01Å; F247-Y254 HydrophobicContact CB-CG 4.48Å; F247-Y254 HydrophobicContact CD1-CD1 4.23Å; F247-Y254 AromaticContact CD1-CE1 3.64Å; F247-Y254 HydrophobicContact CD1-CE1 3.64Å; F247-Y254 HydrophobicContact CG-CE1 4.23Å; F247-Y254 WeakPolarHBondContact O-CB 3.39Å; F247-Y254 WeakPolarHBondContact O-CD2 3.13Å; F247-Y254 PolarHBondContact O-N 3.45Å; F247-F271 HydrophobicContact CD1-CE2 4.15Å; F247-F271 AromaticContact CE1-CE2 3.54Å; F247-F271 HydrophobicContact CE1-CE2 3.54Å; F247-F271 AromaticContact CE1-CZ 3.58Å; F247-F271 HydrophobicContact CE1-CZ 3.58Å; F247-F271 HydrophobicContact CZ-CE2 4.24Å; F247-F271 AromaticContact CZ-CZ 3.92Å; F247-F271 HydrophobicContact CZ-CZ 3.92Å; F247-F286 HydrophobicContact CE1-CE1 4.05Å; F247-F286 AromaticContact CE1-CZ 3.77Å; F247-F286 HydrophobicContact CE1-CZ 3.77Å; F247-F286 HydrophobicContact CZ-CE1 4.37Å; F247-F286 HydrophobicContact CZ-CZ 4.08Å
248	R	73.1	Confident	81.1	Confident	99 Å²	99	51.2 Å²	51.2	37%	0.374	28%	0.279	S	S	.	.	S	Bend	trans	-119.3	-16.5	-156.9	-70.7	178.8	172.3	152.4	-0.1	115.8	D246 Y254 S415	D246-R248 WeakPolarHBondContact OD2-CA 3.33Å; D246-R248 PolarHBondContact OD2-N 2.94Å; R248-Y254 HydrophobicContact CG-CD2 4.4Å; R248-Y254 HydrophobicContact CG-CE2 4.32Å; R248-S415 PolarHBondContact NH1-OG 3.01Å; R248-S415 VanDerWaalsContact NH1-OG 3.1Å
249	S	73.3	Confident	80.2	Confident	34 Å²	34	56.8 Å²	56.8	24%	0.238	31%	0.313	C	S	.	.	S	Bend	trans	-67.1	166.6	175	76.3	0	0	0	0	112.2	D246 D251 G252	D246-S249 WeakPolarHBondContact OD1-CB 3.41Å; D246-S249 PolarHBondContact OD1-N 2.81Å; D246-S249 PolarHBondContact OD1-OG 2.89Å; D246-S249 PolarHBondContact OD2-N 2.83Å; S249-D251 PolarHBondContact O-N 2.83Å; S249-D251 VanDerWaalsContact O-N 3.13Å; S249-G252 PolarHBondContact O-N 2.9Å
250	R	70.7	Confident	79.3	Confident	208 Å²	208	60.4 Å²	60.4	79%	0.785	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.6	-40.9	-178.9	178.1	-178	173	148.8	0.3	114.1	A255	R250-A255 WeakPolarHBondContact O-CB 3.47Å
251	D	71.6	Confident	78.7	Confident	109 Å²	109	58.8 Å²	58.8	58%	0.583	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110	9.5	-173.7	-50.1	-65.1	0	0	0	111.9	S249 R256	S249-D251 PolarHBondContact O-N 2.83Å; S249-D251 VanDerWaalsContact O-N 3.13Å; D251-R256 PolarHBondContact O-NE 3.19Å; D251-R256 VanDerWaalsContact O-NE 3.12Å; D251-R256 PolarHBondContact O-NH2 2.95Å
252	G	74.5	Confident	77.8	Confident	1 Å²	1	60.3 Å²	60.3	1%	0.01	33%	0.328	C	S	.	.	S	Bend	trans	-73.1	-180	-179.3	0	0	0	0	0	114.2	D246 S249 Y254 A255	D246-G252 CarbonylContact O-C 3.52Å; D246-G252 WeakPolarHBondContact O-CA 3.28Å; S249-G252 PolarHBondContact O-N 2.9Å; G252-Y254 VanDerWaalsContact C-N 3.32Å; G252-Y254 PolarHBondContact O-N 3.18Å; G252-A255 PolarHBondContact O-N 3.32Å
253	I	78.9	Confident	77	Confident	6 Å²	6	65.8 Å²	65.8	3%	0.031	36%	0.355	C	S	.	.	H	α-helix	trans	-55.8	-45.6	-170.4	-61.6	156.1	0	0	0	111.5	P245 D246 F247 A255 R256 L257 F286	P245-I253 HydrophobicContact CB-CG1 4.18Å; P245-I253 HydrophobicContact CG-CD1 4.37Å; P245-I253 HydrophobicContact CG-CG1 3.78Å; P245-I253 WeakPolarHBondContact O-CD1 3.47Å; D246-I253 PolarHBondContact O-N 3.3Å; F247-I253 HydrophobicContact CD1-CB 4.16Å; F247-I253 HydrophobicContact CD1-CD1 3.48Å; F247-I253 VanDerWaalsContact CD1-CD1 3.48Å; F247-I253 HydrophobicContact CD1-CG1 4.43Å; F247-I253 HydrophobicContact CD1-CG2 4.38Å; F247-I253 HydrophobicContact CE1-CD1 3.45Å; F247-I253 VanDerWaalsContact CE1-CD1 3.45Å; F247-I253 HydrophobicContact CG-CD1 4.05Å; F247-I253 HydrophobicContact CZ-CD1 4Å; I253-A255 VanDerWaalsContact C-N 3.28Å; I253-A255 PolarHBondContact O-N 2.92Å; I253-R256 PolarHBondContact O-N 2.92Å; I253-R256 VanDerWaalsContact O-N 3.09Å; I253-L257 HydrophobicContact CG2-CD1 3.64Å; I253-L257 HydrophobicContact CG2-CG 4.01Å; I253-L257 WeakPolarHBondContact O-CG 3.49Å; I253-L257 PolarHBondContact O-N 3.01Å; I253-L257 VanDerWaalsContact O-N 3.09Å; I253-F286 HydrophobicContact CB-CE2 4.37Å; I253-F286 HydrophobicContact CD1-CD2 4.46Å; I253-F286 HydrophobicContact CD1-CE2 3.37Å; I253-F286 HydrophobicContact CD1-CZ 3.53Å; I253-F286 HydrophobicContact CG1-CD2 4.48Å; I253-F286 HydrophobicContact CG1-CE2 3.72Å; I253-F286 HydrophobicContact CG1-CZ 4.37Å; I253-F286 HydrophobicContact CG2-CD2 3.76Å; I253-F286 HydrophobicContact CG2-CE2 3.72Å; I253-F286 HydrophobicContact CG2-CZ 4.41Å
254	Y	75.6	Confident	76.1	Confident	36 Å²	36	64.2 Å²	64.2	14%	0.141	33%	0.334	C	S	.	.	H	α-helix	trans	-64.2	-29	-175.6	-69.2	-6.9	0	0	0	114	F247 R248 G252 R256 L257 P267 Q268	F247-Y254 HydrophobicContact CB-CD1 4.32Å; F247-Y254 HydrophobicContact CB-CD2 4.33Å; F247-Y254 HydrophobicContact CB-CE1 4.01Å; F247-Y254 HydrophobicContact CB-CE2 4.01Å; F247-Y254 HydrophobicContact CB-CG 4.48Å; F247-Y254 HydrophobicContact CD1-CD1 4.23Å; F247-Y254 AromaticContact CD1-CE1 3.64Å; F247-Y254 HydrophobicContact CD1-CE1 3.64Å; F247-Y254 HydrophobicContact CG-CE1 4.23Å; F247-Y254 WeakPolarHBondContact O-CB 3.39Å; F247-Y254 WeakPolarHBondContact O-CD2 3.13Å; F247-Y254 PolarHBondContact O-N 3.45Å; R248-Y254 HydrophobicContact CG-CD2 4.4Å; R248-Y254 HydrophobicContact CG-CE2 4.32Å; G252-Y254 VanDerWaalsContact C-N 3.32Å; G252-Y254 PolarHBondContact O-N 3.18Å; Y254-R256 VanDerWaalsContact C-N 3.34Å; Y254-L257 HydrophobicContact CD1-CD1 4.29Å; Y254-P267 HydrophobicContact CD1-CB 3.43Å; Y254-P267 VanDerWaalsContact CD1-CB 3.43Å; Y254-P267 HydrophobicContact CD2-CB 3.76Å; Y254-P267 HydrophobicContact CE1-CB 4.07Å; Y254-P267 WeakPolarHBondContact CE1-O 3.48Å; Y254-P267 HydrophobicContact CE2-CB 4.36Å; Y254-P267 HydrophobicContact CG-CB 3.24Å; Y254-P267 HydrophobicContact CG-CG 4.15Å; Y254-Q268 HydrophobicContact CE2-CG 3.7Å
255	A	75.6	Confident	75.4	Confident	49 Å²	49	68.5 Å²	68.5	41%	0.405	36%	0.363	S	S	.	.	H	α-helix	trans	-70.4	-31	176.1	0	0	0	0	0	112.4	R250 G252 I253	R250-A255 WeakPolarHBondContact O-CB 3.47Å; G252-A255 PolarHBondContact O-N 3.32Å; I253-A255 VanDerWaalsContact C-N 3.28Å; I253-A255 PolarHBondContact O-N 2.92Å
256	R	75.4	Confident	75.1	Confident	118 Å²	118	69.6 Å²	69.6	45%	0.445	37%	0.367	S	S	.	.	H	α-helix	trans	-81.5	-43.1	-179.6	-53.5	176.3	-162.7	-175.6	1.4	111.5	D251 I253 Y254 A258 V259 D260	D251-R256 PolarHBondContact O-NE 3.19Å; D251-R256 VanDerWaalsContact O-NE 3.12Å; D251-R256 PolarHBondContact O-NH2 2.95Å; I253-R256 PolarHBondContact O-N 2.92Å; I253-R256 VanDerWaalsContact O-N 3.09Å; Y254-R256 VanDerWaalsContact C-N 3.34Å; R256-A258 VanDerWaalsContact C-N 3.26Å; R256-A258 PolarHBondContact O-N 3.41Å; R256-V259 WeakPolarHBondContact O-CB 3.23Å; R256-V259 PolarHBondContact O-N 3.49Å; R256-D260 PolarHBondContact O-N 3.17Å
257	L	74.1	Confident	74.5	Confident	9 Å²	9	69.8 Å²	69.8	5%	0.047	37%	0.37	C	S	.	.	H	α-helix	trans	-59.8	-34.1	-179.5	-68.9	175.8	0	0	0	113.4	I253 Y254 V259 D260 F261 L264 M270	I253-L257 HydrophobicContact CG2-CD1 3.64Å; I253-L257 HydrophobicContact CG2-CG 4.01Å; I253-L257 WeakPolarHBondContact O-CG 3.49Å; I253-L257 PolarHBondContact O-N 3.01Å; I253-L257 VanDerWaalsContact O-N 3.09Å; Y254-L257 HydrophobicContact CD1-CD1 4.29Å; L257-V259 PolarHBondContact O-N 3.28Å; L257-D260 PolarHBondContact O-N 2.98Å; L257-F261 HydrophobicContact CD2-CD2 4.03Å; L257-F261 HydrophobicContact CD2-CE2 4.21Å; L257-F261 PolarHBondContact O-N 3.46Å; L257-L264 HydrophobicContact CB-CD1 4.05Å; L257-M270 HydrophobicContact CD1-CB 4.49Å; L257-M270 HydrophobicContact CD1-CE 3.46Å; L257-M270 VanDerWaalsContact CD1-CE 3.46Å; L257-M270 HydrophobicContact CD1-SD 3.66Å; L257-M270 HydrophobicContact CD2-CE 3.36Å; L257-M270 HydrophobicContact CD2-SD 4.41Å; L257-M270 HydrophobicContact CG-CE 4.03Å
258	A	71.9	Confident	74.4	Confident	63 Å²	63	70.9 Å²	70.9	52%	0.521	38%	0.376	S	S	.	.	H	α-helix	trans	-64.9	-20.7	176.3	0	0	0	0	0	113.8	R256	R256-A258 VanDerWaalsContact C-N 3.26Å; R256-A258 PolarHBondContact O-N 3.41Å
259	V	77.8	Confident	74.9	Confident	118 Å²	118	67 Å²	67	72%	0.715	36%	0.364	S	S	*	.	H	α-helix	trans	-88.5	-42.8	173.9	-175.3	0	0	0	0	110.7	R256 L257	R256-V259 WeakPolarHBondContact O-CB 3.23Å; R256-V259 PolarHBondContact O-N 3.49Å; L257-V259 PolarHBondContact O-N 3.28Å
260	D	77.5	Confident	75.5	Confident	76 Å²	76	65.5 Å²	65.5	41%	0.406	35%	0.353	S	S	.	.	H	α-helix	trans	-75.6	-27.3	-176.2	-87	-31.6	0	0	0	114.5	R256 L257 K285	R256-D260 PolarHBondContact O-N 3.17Å; L257-D260 PolarHBondContact O-N 2.98Å; D260-K285 IonicContact OD1-NZ 2.65Å; D260-K285 PolarHBondContact OD1-NZ 2.99Å; D260-K285 WeakPolarHBondContact OD2-CE 3.49Å; D260-K285 IonicContact OD2-NZ 2.83Å; D260-K285 PolarHBondContact OD2-NZ 2.66Å
261	F	78.9	Confident	76.3	Confident	40 Å²	40	56.3 Å²	56.3	18%	0.175	32%	0.319	C	S	.	.			trans	-139.9	78.2	-175.8	-62.3	-71.9	0	0	0	110.7	L257 D263 L264 P282 K285	L257-F261 HydrophobicContact CD2-CD2 4.03Å; L257-F261 HydrophobicContact CD2-CE2 4.21Å; L257-F261 PolarHBondContact O-N 3.46Å; F261-D263 PolarHBondContact O-N 3.38Å; F261-D263 VanDerWaalsContact O-N 3.09Å; F261-L264 HydrophobicContact CB-CD1 3.75Å; F261-L264 HydrophobicContact CB-CG 3.99Å; F261-L264 WeakPolarHBondContact O-CB 3.46Å; F261-L264 PolarHBondContact O-N 3.09Å; F261-L264 VanDerWaalsContact O-N 3.1Å; F261-P282 HydrophobicContact CD1-CB 4.25Å; F261-P282 HydrophobicContact CD1-CG 3.81Å; F261-P282 HydrophobicContact CD2-CB 3.86Å; F261-P282 HydrophobicContact CD2-CG 4.31Å; F261-P282 HydrophobicContact CE1-CB 4.2Å; F261-P282 HydrophobicContact CE1-CG 3.88Å; F261-P282 HydrophobicContact CE2-CB 3.79Å; F261-P282 HydrophobicContact CE2-CG 4.36Å; F261-P282 HydrophobicContact CG-CB 4.09Å; F261-P282 HydrophobicContact CG-CG 4.03Å; F261-P282 HydrophobicContact CZ-CB 3.97Å; F261-P282 HydrophobicContact CZ-CG 4.15Å; F261-K285 HydrophobicContact CE2-CB 4.25Å; F261-K285 HydrophobicContact CE2-CD 3.75Å; F261-K285 HydrophobicContact CZ-CB 4Å; F261-K285 HydrophobicContact CZ-CD 3.6Å; F261-K285 HydrophobicContact CZ-CG 4.41Å
262	P	75.6	Confident	77.1	Confident	105 Å²	105	53.5 Å²	53.5	68%	0.682	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-15.3	-179.3	26.6	-35.7	0	0	0	114	L264	P262-L264 VanDerWaalsContact C-N 3.29Å; P262-L264 PolarHBondContact O-N 3.19Å
263	D	75	Confident	77.8	Confident	133 Å²	133	53.6 Å²	53.6	71%	0.711	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	5.4	175.5	-58.3	-46.4	0	0	0	114.1	F261 P265	F261-D263 PolarHBondContact O-N 3.38Å; F261-D263 VanDerWaalsContact O-N 3.09Å; D263-P265 WeakPolarHBondContact O-CD 3.25Å
264	L	71.4	Confident	78.4	Confident	20 Å²	20	58.3 Å²	58.3	11%	0.105	33%	0.326	C	S	.	.			trans	-77.6	117.9	167.6	-80.3	169.1	0	0	0	109.6	L257 F261 P262 D266 Y275	L257-L264 HydrophobicContact CB-CD1 4.05Å; F261-L264 HydrophobicContact CB-CD1 3.75Å; F261-L264 HydrophobicContact CB-CG 3.99Å; F261-L264 WeakPolarHBondContact O-CB 3.46Å; F261-L264 PolarHBondContact O-N 3.09Å; F261-L264 VanDerWaalsContact O-N 3.1Å; P262-L264 VanDerWaalsContact C-N 3.29Å; P262-L264 PolarHBondContact O-N 3.19Å; L264-D266 PolarHBondContact O-N 2.89Å; L264-Y275 HydrophobicContact CD2-CD2 4.39Å; L264-Y275 HydrophobicContact CD2-CE1 4.05Å; L264-Y275 HydrophobicContact CD2-CE2 3.7Å
265	P	72.8	Confident	79.1	Confident	104 Å²	104	57.4 Å²	57.4	68%	0.675	32%	0.323	S	S	*	.	S	Bend	trans	-61.1	-36.8	176.5	-21.4	32.7	0	0	0	112.3	D263	D263-P265 WeakPolarHBondContact O-CD 3.25Å
266	D	74.1	Confident	79.9	Confident	52 Å²	52	55.1 Å²	55.1	28%	0.278	30%	0.304	S	S	.	.	S	Bend	trans	-148.8	163.4	167.3	96.8	112.6	0	0	0	109.3	L264 Q268 S269	L264-D266 PolarHBondContact O-N 2.89Å; D266-Q268 VanDerWaalsContact C-N 3.3Å; D266-Q268 VanDerWaalsContact CG-N 3.33Å; D266-Q268 PolarHBondContact O-N 2.97Å; D266-Q268 WeakPolarHBondContact OD1-CB 3.39Å; D266-Q268 WeakPolarHBondContact OD1-CG 3.28Å; D266-Q268 PolarHBondContact OD1-N 3.26Å; D266-Q268 PolarHBondContact OD1-NE2 3.29Å; D266-Q268 VanDerWaalsContact OD1-NE2 3.07Å; D266-Q268 PolarHBondContact OD2-N 2.98Å; D266-S269 VanDerWaalsContact O-CB 3.23Å; D266-S269 WeakPolarHBondContact O-CB 3.39Å; D266-S269 PolarHBondContact O-N 2.78Å; D266-S269 PolarHBondContact O-OG 3.38Å; D266-S269 PolarHBondContact OD2-N 2.81Å; D266-S269 PolarHBondContact OD2-OG 3.31Å
267	P	69.9	Low	80.8	Confident	35 Å²	35	54.6 Å²	54.6	23%	0.227	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-66.9	-22.9	179.1	-26	38	0	0	0	115.6	Y254 S269 M270	Y254-P267 HydrophobicContact CD1-CB 3.43Å; Y254-P267 VanDerWaalsContact CD1-CB 3.43Å; Y254-P267 HydrophobicContact CD2-CB 3.76Å; Y254-P267 HydrophobicContact CE1-CB 4.07Å; Y254-P267 WeakPolarHBondContact CE1-O 3.48Å; Y254-P267 HydrophobicContact CE2-CB 4.36Å; Y254-P267 HydrophobicContact CG-CB 3.24Å; Y254-P267 HydrophobicContact CG-CG 4.15Å; P267-S269 VanDerWaalsContact C-N 3.27Å; P267-S269 PolarHBondContact O-N 2.69Å; P267-M270 PolarHBondContact O-N 2.92Å
268	Q	75.6	Confident	81.6	Confident	73 Å²	73	62.1 Å²	62.1	34%	0.341	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-71.5	-24.5	176.6	-60.5	169.9	99	0	0	112	Y254 D266 M270 F271 F387	Y254-Q268 HydrophobicContact CE2-CG 3.7Å; D266-Q268 VanDerWaalsContact C-N 3.3Å; D266-Q268 VanDerWaalsContact CG-N 3.33Å; D266-Q268 PolarHBondContact O-N 2.97Å; D266-Q268 WeakPolarHBondContact OD1-CB 3.39Å; D266-Q268 WeakPolarHBondContact OD1-CG 3.28Å; D266-Q268 PolarHBondContact OD1-N 3.26Å; D266-Q268 PolarHBondContact OD1-NE2 3.29Å; D266-Q268 VanDerWaalsContact OD1-NE2 3.07Å; D266-Q268 PolarHBondContact OD2-N 2.98Å; Q268-M270 PolarHBondContact O-N 2.8Å; Q268-F271 PolarHBondContact O-N 3.47Å; Q268-F387 HydrophobicContact CB-CD2 4.48Å; Q268-F387 HydrophobicContact CB-CE2 3.85Å; Q268-F387 HydrophobicContact CB-CZ 4.45Å
269	S	82.7	Confident	82.5	Confident	18 Å²	18	60.3 Å²	60.3	13%	0.126	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-54.7	-19.6	174.1	-62.1	0	0	0	0	114	D266 P267 F271 D272 Y275	D266-S269 VanDerWaalsContact O-CB 3.23Å; D266-S269 WeakPolarHBondContact O-CB 3.39Å; D266-S269 PolarHBondContact O-N 2.78Å; D266-S269 PolarHBondContact O-OG 3.38Å; D266-S269 PolarHBondContact OD2-N 2.81Å; D266-S269 PolarHBondContact OD2-OG 3.31Å; P267-S269 VanDerWaalsContact C-N 3.27Å; P267-S269 PolarHBondContact O-N 2.69Å; S269-F271 PolarHBondContact O-N 3.24Å; S269-D272 PolarHBondContact O-N 3.07Å; S269-D272 VanDerWaalsContact O-N 3.11Å; S269-Y275 WeakPolarHBondContact O-CB 3.34Å
270	M	85.6	Confident	83.3	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.01	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-55.7	-34	168.8	168.9	162.5	-69.6	0	0	113.2	L257 P267 Q268 P282 F283 F286	L257-M270 HydrophobicContact CD1-CB 4.49Å; L257-M270 HydrophobicContact CD1-CE 3.46Å; L257-M270 VanDerWaalsContact CD1-CE 3.46Å; L257-M270 HydrophobicContact CD1-SD 3.66Å; L257-M270 HydrophobicContact CD2-CE 3.36Å; L257-M270 HydrophobicContact CD2-SD 4.41Å; L257-M270 HydrophobicContact CG-CE 4.03Å; P267-M270 PolarHBondContact O-N 2.92Å; Q268-M270 PolarHBondContact O-N 2.8Å; M270-P282 HydrophobicContact CE-CB 3.71Å; M270-P282 WeakPolarHBondContact CE-O 3.32Å; M270-F283 HydrophobicContact CG-CB 4.29Å; M270-F283 HydrophobicContact CG-CD2 4.45Å; M270-F286 HydrophobicContact CE-CB 3.84Å; M270-F286 HydrophobicContact SD-CB 3.53Å; M270-F286 VanDerWaalsContact SD-CB 3.53Å; M270-F286 HydrophobicContact SD-CD1 3.73Å; M270-F286 HydrophobicContact SD-CG 3.72Å
271	F	87.3	Confident	83.9	Confident	15 Å²	15	59.4 Å²	59.4	7%	0.066	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-105.2	16.7	178.8	-61.6	-88.3	0	0	0	111.8	F247 Q268 S269 F283 F286 I321 F386 F387	F247-F271 HydrophobicContact CD1-CE2 4.15Å; F247-F271 AromaticContact CE1-CE2 3.54Å; F247-F271 HydrophobicContact CE1-CE2 3.54Å; F247-F271 AromaticContact CE1-CZ 3.58Å; F247-F271 HydrophobicContact CE1-CZ 3.58Å; F247-F271 HydrophobicContact CZ-CE2 4.24Å; F247-F271 AromaticContact CZ-CZ 3.92Å; F247-F271 HydrophobicContact CZ-CZ 3.92Å; Q268-F271 PolarHBondContact O-N 3.47Å; S269-F271 PolarHBondContact O-N 3.24Å; F271-F283 HydrophobicContact CD1-CD2 4.45Å; F271-F283 HydrophobicContact CD1-CE2 4.41Å; F271-F283 HydrophobicContact CE1-CD2 4.26Å; F271-F283 HydrophobicContact CE1-CE2 4.03Å; F271-F286 HydrophobicContact CZ-CD1 4.1Å; F271-F286 AromaticContact CZ-CE1 3.69Å; F271-F286 HydrophobicContact CZ-CE1 3.69Å; F271-I321 HydrophobicContact CE1-CD1 4.21Å; F271-F386 VanDerWaalsContact C-CD2 3.44Å; F271-F386 HydrophobicContact CD1-CD1 4.38Å; F271-F386 HydrophobicContact CD1-CE1 4.08Å; F271-F386 HydrophobicContact CD1-CZ 4.41Å; F271-F386 CarbonylContact O-C 3.35Å; F271-F386 VanDerWaalsContact O-CA 3.24Å; F271-F386 WeakPolarHBondContact O-CA 3.38Å; F271-F386 WeakPolarHBondContact O-CB 3.24Å; F271-F386 WeakPolarHBondContact O-CD2 3.48Å; F271-F386 VanDerWaalsContact O-CG 3.3Å; F271-F386 WeakPolarHBondContact O-CG 3.42Å; F271-F387 HydrophobicContact CB-CD2 3.88Å; F271-F387 HydrophobicContact CB-CE2 3.94Å; F271-F387 WeakPolarHBondContact O-CD2 3.27Å; F271-F387 PolarHBondContact O-N 2.88Å
272	D	89.6	Confident	84.4	Confident	50 Å²	50	57.5 Å²	57.5	27%	0.267	28%	0.283	S	S	.	.	B	Isolated β-bridge	trans	-84.8	133.3	171.2	178.5	-89	0	0	0	110.5	S269 E274 Y275 F276	S269-D272 PolarHBondContact O-N 3.07Å; S269-D272 VanDerWaalsContact O-N 3.11Å; D272-E274 PolarHBondContact O-N 3.03Å; D272-E274 WeakPolarHBondContact OD1-CA 3.48Å; D272-E274 WeakPolarHBondContact OD1-CB 3.33Å; D272-E274 PolarHBondContact OD1-N 2.91Å; D272-Y275 PolarHBondContact OD1-N 3Å; D272-F276 WeakPolarHBondContact O-CB 3.14Å; D272-F276 PolarHBondContact O-N 3.34Å
273	I	89.6	Confident	85.2	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.021	25%	0.251	C	S	.	.	H	α-helix	trans	-71.5	-27.4	-173.8	-167.2	56.2	0	0	0	113.5	R277 L346 K381 F386 F387 E389	I273-R277 WeakPolarHBondContact O-CD 3.26Å; I273-R277 VanDerWaalsContact O-CG 3.25Å; I273-R277 WeakPolarHBondContact O-CG 3.48Å; I273-R277 PolarHBondContact O-N 3.29Å; I273-L346 HydrophobicContact CD1-CD2 4.41Å; I273-K381 HydrophobicContact CD1-CD 3.87Å; I273-F386 HydrophobicContact CB-CB 4.12Å; I273-F386 HydrophobicContact CD1-CB 4.44Å; I273-F386 HydrophobicContact CD1-CD2 4.4Å; I273-F387 WeakPolarHBondContact CG2-O 3.44Å; I273-F387 PolarHBondContact N-O 3.42Å; I273-F387 VanDerWaalsContact N-O 3.13Å; I273-E389 HydrophobicContact CB-CG 4.2Å; I273-E389 HydrophobicContact CD1-CG 4.33Å; I273-E389 VanDerWaalsContact CD1-OE1 3.29Å; I273-E389 WeakPolarHBondContact CD1-OE1 3.34Å; I273-E389 HydrophobicContact CG1-CG 4.02Å
274	E	90.9	Very high	86	Confident	105 Å²	105	46.5 Å²	46.5	49%	0.491	22%	0.218	S	C	.	.	H	α-helix	trans	-82.7	-38	177	-54.3	-54.6	155	0	0	111	D272 F276 R277 R278	D272-E274 PolarHBondContact O-N 3.03Å; D272-E274 WeakPolarHBondContact OD1-CA 3.48Å; D272-E274 WeakPolarHBondContact OD1-CB 3.33Å; D272-E274 PolarHBondContact OD1-N 2.91Å; E274-F276 VanDerWaalsContact C-N 3.33Å; E274-F276 PolarHBondContact O-N 2.75Å; E274-R277 PolarHBondContact O-N 3.27Å; E274-R277 IonicContact OE1-CZ 3.23Å; E274-R277 VanDerWaalsContact OE1-CZ 3.27Å; E274-R277 IonicContact OE1-NH1 3.12Å; E274-R277 PolarHBondContact OE1-NH1 3.02Å; E274-R277 IonicContact OE1-NH2 2.78Å; E274-R277 WeakPolarHBondContact OE2-CD 3.38Å; E274-R277 IonicContact OE2-CZ 2.7Å; E274-R277 IonicContact OE2-NE 2.68Å; E274-R277 IonicContact OE2-NH1 2.72Å; E274-R277 PolarHBondContact OE2-NH1 3.43Å; E274-R278 PolarHBondContact O-N 2.86Å; E274-R278 VanDerWaalsContact O-N 3.1Å
275	Y	89.6	Confident	86.9	Confident	16 Å²	16	48.5 Å²	48.5	6%	0.063	23%	0.226	C	C	.	.	H	α-helix	trans	-57.4	-47.7	167.8	-169.7	-70.5	0	0	0	110.2	L264 S269 D272 R277 R278 D279 P282	L264-Y275 HydrophobicContact CD2-CD2 4.39Å; L264-Y275 HydrophobicContact CD2-CE1 4.05Å; L264-Y275 HydrophobicContact CD2-CE2 3.7Å; S269-Y275 WeakPolarHBondContact O-CB 3.34Å; D272-Y275 PolarHBondContact OD1-N 3Å; Y275-R277 VanDerWaalsContact C-N 3.3Å; Y275-R277 PolarHBondContact O-N 3Å; Y275-R278 VanDerWaalsContact CD2-NH2 3.32Å; Y275-R278 CarbonylContact O-C 3.55Å; Y275-R278 WeakPolarHBondContact O-CA 3.37Å; Y275-R278 WeakPolarHBondContact O-CB 3.45Å; Y275-R278 PolarHBondContact O-N 2.92Å; Y275-D279 HydrophobicContact CE1-CB 4.25Å; Y275-D279 WeakPolarHBondContact CE1-O 3.21Å; Y275-D279 PolarHBondContact O-N 3.06Å; Y275-P282 HydrophobicContact CE1-CG 3.99Å
276	F	93.5	Very high	87.6	Confident	1 Å²	1	43.7 Å²	43.7	0%	0.004	19%	0.194	C	C	.	.	H	α-helix	trans	-61.7	-34.3	-179.8	-176.5	-94.9	0	0	0	113.6	D272 E274 R278 D279 P280 F283 F284 L346 I379 K381 F386	D272-F276 WeakPolarHBondContact O-CB 3.14Å; D272-F276 PolarHBondContact O-N 3.34Å; E274-F276 VanDerWaalsContact C-N 3.33Å; E274-F276 PolarHBondContact O-N 2.75Å; F276-R278 VanDerWaalsContact C-N 3.33Å; F276-D279 CarbonylContact O-C 3.54Å; F276-P280 HydrophobicContact CD2-CB 3.77Å; F276-P280 HydrophobicContact CE1-CB 4.24Å; F276-P280 HydrophobicContact CE2-CB 3.46Å; F276-P280 VanDerWaalsContact CE2-CB 3.46Å; F276-P280 HydrophobicContact CG-CB 4.29Å; F276-P280 HydrophobicContact CZ-CB 3.73Å; F276-F283 HydrophobicContact CD2-CB 3.96Å; F276-F283 HydrophobicContact CD2-CD1 4.34Å; F276-F283 HydrophobicContact CD2-CG 4.23Å; F276-F283 HydrophobicContact CE2-CB 4Å; F276-F283 AromaticContact CE2-CD1 3.64Å; F276-F283 HydrophobicContact CE2-CD1 3.64Å; F276-F283 HydrophobicContact CE2-CE1 4.43Å; F276-F283 AromaticContact CE2-CG 3.98Å; F276-F283 HydrophobicContact CE2-CG 3.98Å; F276-F284 HydrophobicContact CE2-CD2 4.3Å; F276-F284 AromaticContact CE2-CE2 3.76Å; F276-F284 HydrophobicContact CE2-CE2 3.76Å; F276-F284 HydrophobicContact CE2-CZ 4.22Å; F276-F284 AromaticContact CZ-CE2 3.6Å; F276-F284 HydrophobicContact CZ-CE2 3.6Å; F276-F284 AromaticContact CZ-CZ 3.89Å; F276-F284 HydrophobicContact CZ-CZ 3.89Å; F276-L346 HydrophobicContact CD1-CD1 4.18Å; F276-L346 HydrophobicContact CE1-CD1 4.01Å; F276-L346 HydrophobicContact CE1-CD2 4.37Å; F276-L346 HydrophobicContact CE1-CG 4.46Å; F276-I379 HydrophobicContact CE1-CG2 4.01Å; F276-I379 HydrophobicContact CZ-CG2 3.87Å; F276-K381 HydrophobicContact CD1-CD 3.99Å; F276-K381 HydrophobicContact CE1-CB 3.82Å; F276-K381 HydrophobicContact CE1-CD 3.82Å; F276-K381 HydrophobicContact CE1-CG 3.96Å; F276-K381 HydrophobicContact CZ-CB 4.05Å; F276-K381 HydrophobicContact CZ-CD 4.37Å; F276-K381 HydrophobicContact CZ-CG 4.11Å; F276-F386 HydrophobicContact CB-CD2 4.07Å; F276-F386 HydrophobicContact CB-CE2 3.73Å; F276-F386 AromaticContact CD2-CE2 3.63Å; F276-F386 HydrophobicContact CD2-CE2 3.63Å; F276-F386 HydrophobicContact CD2-CZ 4.08Å; F276-F386 HydrophobicContact CE2-CE2 4.39Å; F276-F386 HydrophobicContact CE2-CZ 4.43Å; F276-F386 HydrophobicContact CG-CD2 4.39Å; F276-F386 AromaticContact CG-CE2 3.71Å; F276-F386 HydrophobicContact CG-CE2 3.71Å; F276-F386 HydrophobicContact CG-CZ 4.48Å
277	R	93.3	Very high	88.4	Confident	107 Å²	107	41.2 Å²	41.2	40%	0.404	18%	0.181	S	C	.	.	H	α-helix	trans	-69	-31.7	172.8	-71.3	167.2	-162.4	168.2	11.2	112.3	I273 E274 Y275 L346 L377	I273-R277 WeakPolarHBondContact O-CD 3.26Å; I273-R277 VanDerWaalsContact O-CG 3.25Å; I273-R277 WeakPolarHBondContact O-CG 3.48Å; I273-R277 PolarHBondContact O-N 3.29Å; E274-R277 PolarHBondContact O-N 3.27Å; E274-R277 IonicContact OE1-CZ 3.23Å; E274-R277 VanDerWaalsContact OE1-CZ 3.27Å; E274-R277 IonicContact OE1-NH1 3.12Å; E274-R277 PolarHBondContact OE1-NH1 3.02Å; E274-R277 IonicContact OE1-NH2 2.78Å; E274-R277 WeakPolarHBondContact OE2-CD 3.38Å; E274-R277 IonicContact OE2-CZ 2.7Å; E274-R277 IonicContact OE2-NE 2.68Å; E274-R277 IonicContact OE2-NH1 2.72Å; E274-R277 PolarHBondContact OE2-NH1 3.43Å; Y275-R277 VanDerWaalsContact C-N 3.3Å; Y275-R277 PolarHBondContact O-N 3Å; R277-L346 HydrophobicContact CG-CD1 4.26Å; R277-L377 HydrophobicContact CB-CD2 3.89Å; R277-L377 HydrophobicContact CG-CD2 4.23Å; R277-L377 WeakPolarHBondContact O-CD2 3.31Å
278	R	91.4	Very high	89.3	Confident	168 Å²	168	43.6 Å²	43.6	63%	0.634	19%	0.188	S	C	*	.	H	α-helix	trans	-77.6	-46.9	176.9	-174.7	-177.9	70.4	158.9	5.9	112.1	E274 Y275 F276	E274-R278 PolarHBondContact O-N 2.86Å; E274-R278 VanDerWaalsContact O-N 3.1Å; Y275-R278 VanDerWaalsContact CD2-NH2 3.32Å; Y275-R278 CarbonylContact O-C 3.55Å; Y275-R278 WeakPolarHBondContact O-CA 3.37Å; Y275-R278 WeakPolarHBondContact O-CB 3.45Å; Y275-R278 PolarHBondContact O-N 2.92Å; F276-R278 VanDerWaalsContact C-N 3.33Å
279	D	91	Very high	89.8	Confident	25 Å²	25	44.3 Å²	44.3	13%	0.134	19%	0.191	C	C	.	.			trans	-150.1	107.2	175.2	-171.9	2.6	0	0	0	111.9	Y275 F276 R281	Y275-D279 HydrophobicContact CE1-CB 4.25Å; Y275-D279 WeakPolarHBondContact CE1-O 3.21Å; Y275-D279 PolarHBondContact O-N 3.06Å; F276-D279 CarbonylContact O-C 3.54Å; D279-R281 VanDerWaalsContact C-N 3.34Å; D279-R281 VanDerWaalsContact CG-NE 3.31Å; D279-R281 WeakPolarHBondContact OD1-CB 3.46Å; D279-R281 WeakPolarHBondContact OD1-CG 3.45Å; D279-R281 IonicContact OD1-CZ 3.01Å; D279-R281 PolarHBondContact OD1-N 3.48Å; D279-R281 IonicContact OD1-NE 2.67Å; D279-R281 PolarHBondContact OD1-NE 2.95Å; D279-R281 IonicContact OD1-NH2 3.28Å; D279-R281 IonicContact OD2-CZ 3.99Å; D279-R281 VanDerWaalsContact OD2-CZ 3.28Å; D279-R281 IonicContact OD2-NE 2.88Å; D279-R281 PolarHBondContact OD2-NE 3.16Å; D279-R281 VanDerWaalsContact OD2-NE 3.08Å; D279-R281 IonicContact OD2-NH2 2.67Å; D279-R281 PolarHBondContact OD2-NH2 3.29Å
280	P	93.6	Very high	89.9	Confident	15 Å²	15	43.7 Å²	43.7	10%	0.097	19%	0.186	C	C	.	.			trans	-84	-6.7	177.2	36.6	-39.1	0	0	0	113.3	F276 F283 F284 V366 I379	F276-P280 HydrophobicContact CD2-CB 3.77Å; F276-P280 HydrophobicContact CE1-CB 4.24Å; F276-P280 HydrophobicContact CE2-CB 3.46Å; F276-P280 VanDerWaalsContact CE2-CB 3.46Å; F276-P280 HydrophobicContact CG-CB 4.29Å; F276-P280 HydrophobicContact CZ-CB 3.73Å; P280-F283 PolarHBondContact O-N 3.23Å; P280-F284 HydrophobicContact CB-CD2 3.9Å; P280-F284 HydrophobicContact CB-CE2 3.88Å; P280-F284 WeakPolarHBondContact O-CD2 3.27Å; P280-F284 PolarHBondContact O-N 3.16Å; P280-F284 VanDerWaalsContact O-N 3.1Å; P280-V366 HydrophobicContact CG-CG1 3.88Å; P280-V366 HydrophobicContact CG-CG2 4.12Å; P280-I379 HydrophobicContact CB-CD1 4.3Å; P280-I379 HydrophobicContact CG-CD1 3.87Å
281	R	91.1	Very high	90	Very high	160 Å²	160	43.6 Å²	43.6	60%	0.604	19%	0.186	S	C	*	.	H	α-helix	trans	-61.9	-40.4	-171.7	-62.7	171.9	-63.4	170.8	5.9	113.5	D279 F283 F284 K285 V366	D279-R281 VanDerWaalsContact C-N 3.34Å; D279-R281 VanDerWaalsContact CG-NE 3.31Å; D279-R281 WeakPolarHBondContact OD1-CB 3.46Å; D279-R281 WeakPolarHBondContact OD1-CG 3.45Å; D279-R281 IonicContact OD1-CZ 3.01Å; D279-R281 PolarHBondContact OD1-N 3.48Å; D279-R281 IonicContact OD1-NE 2.67Å; D279-R281 PolarHBondContact OD1-NE 2.95Å; D279-R281 IonicContact OD1-NH2 3.28Å; D279-R281 IonicContact OD2-CZ 3.99Å; D279-R281 VanDerWaalsContact OD2-CZ 3.28Å; D279-R281 IonicContact OD2-NE 2.88Å; D279-R281 PolarHBondContact OD2-NE 3.16Å; D279-R281 VanDerWaalsContact OD2-NE 3.08Å; D279-R281 IonicContact OD2-NH2 2.67Å; D279-R281 PolarHBondContact OD2-NH2 3.29Å; R281-F283 PolarHBondContact O-N 3.03Å; R281-F284 PolarHBondContact O-N 2.83Å; R281-K285 PolarHBondContact O-N 2.78Å; R281-V366 HydrophobicContact CG-CG2 4.28Å
282	P	89.3	Confident	89.8	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59.5	-47.4	176.8	-26	37.2	0	0	0	112.2	F261 M270 Y275 F284 K285 F286	F261-P282 HydrophobicContact CD1-CB 4.25Å; F261-P282 HydrophobicContact CD1-CG 3.81Å; F261-P282 HydrophobicContact CD2-CB 3.86Å; F261-P282 HydrophobicContact CD2-CG 4.31Å; F261-P282 HydrophobicContact CE1-CB 4.2Å; F261-P282 HydrophobicContact CE1-CG 3.88Å; F261-P282 HydrophobicContact CE2-CB 3.79Å; F261-P282 HydrophobicContact CE2-CG 4.36Å; F261-P282 HydrophobicContact CG-CB 4.09Å; F261-P282 HydrophobicContact CG-CG 4.03Å; F261-P282 HydrophobicContact CZ-CB 3.97Å; F261-P282 HydrophobicContact CZ-CG 4.15Å; M270-P282 HydrophobicContact CE-CB 3.71Å; M270-P282 WeakPolarHBondContact CE-O 3.32Å; Y275-P282 HydrophobicContact CE1-CG 3.99Å; P282-F284 PolarHBondContact O-N 2.95Å; P282-K285 PolarHBondContact O-N 2.9Å; P282-F286 PolarHBondContact O-N 2.86Å; P282-F286 VanDerWaalsContact O-N 3.12Å
283	F	92.2	Very high	89.5	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.009	21%	0.214	C	C	.	.	H	α-helix	trans	-59.5	-44.8	177.5	172.5	-91.9	0	0	0	111.5	M270 F271 F276 P280 R281 K285 F286 A287 F340 P382 I384 F386	M270-F283 HydrophobicContact CG-CB 4.29Å; M270-F283 HydrophobicContact CG-CD2 4.45Å; F271-F283 HydrophobicContact CD1-CD2 4.45Å; F271-F283 HydrophobicContact CD1-CE2 4.41Å; F271-F283 HydrophobicContact CE1-CD2 4.26Å; F271-F283 HydrophobicContact CE1-CE2 4.03Å; F276-F283 HydrophobicContact CD2-CB 3.96Å; F276-F283 HydrophobicContact CD2-CD1 4.34Å; F276-F283 HydrophobicContact CD2-CG 4.23Å; F276-F283 HydrophobicContact CE2-CB 4Å; F276-F283 AromaticContact CE2-CD1 3.64Å; F276-F283 HydrophobicContact CE2-CD1 3.64Å; F276-F283 HydrophobicContact CE2-CE1 4.43Å; F276-F283 AromaticContact CE2-CG 3.98Å; F276-F283 HydrophobicContact CE2-CG 3.98Å; P280-F283 PolarHBondContact O-N 3.23Å; R281-F283 PolarHBondContact O-N 3.03Å; F283-K285 VanDerWaalsContact C-N 3.33Å; F283-K285 PolarHBondContact O-N 2.81Å; F283-F286 PolarHBondContact O-N 2.83Å; F283-A287 HydrophobicContact CD1-CB 4.4Å; F283-A287 HydrophobicContact CE1-CB 3.99Å; F283-A287 HydrophobicContact CZ-CB 4.22Å; F283-A287 VanDerWaalsContact O-CB 3.26Å; F283-A287 WeakPolarHBondContact O-CB 3.5Å; F283-A287 PolarHBondContact O-N 3.18Å; F283-F340 AromaticContact CZ-CE1 3.96Å; F283-F340 HydrophobicContact CZ-CE1 3.96Å; F283-F340 HydrophobicContact CZ-CZ 4.07Å; F283-P382 HydrophobicContact CE1-CG 3.86Å; F283-P382 HydrophobicContact CZ-CG 4.03Å; F283-I384 HydrophobicContact CE2-CD1 4.36Å; F283-I384 HydrophobicContact CZ-CD1 4.09Å; F283-F386 HydrophobicContact CD1-CZ 4.42Å; F283-F386 HydrophobicContact CD2-CE1 4.19Å; F283-F386 HydrophobicContact CD2-CE2 4.37Å; F283-F386 AromaticContact CD2-CZ 3.49Å; F283-F386 HydrophobicContact CD2-CZ 3.49Å; F283-F386 VanDerWaalsContact CD2-CZ 3.49Å; F283-F386 AromaticContact CE2-CE1 3.87Å; F283-F386 HydrophobicContact CE2-CE1 3.87Å; F283-F386 AromaticContact CE2-CZ 3.6Å; F283-F386 HydrophobicContact CE2-CZ 3.6Å; F283-F386 AromaticContact CG-CZ 3.92Å; F283-F386 HydrophobicContact CG-CZ 3.92Å; F283-F386 HydrophobicContact CZ-CE1 4.35Å; F283-F386 HydrophobicContact CZ-CZ 4.13Å
284	F	92.6	Very high	89.3	Confident	5 Å²	5	50 Å²	50	2%	0.022	24%	0.236	C	C	.	.	H	α-helix	trans	-73.2	-21.2	-179.7	-73.8	-60.8	0	0	0	114.4	F276 P280 R281 P282 A287 I361 Q364 V366 P367 I379 P382	F276-F284 HydrophobicContact CE2-CD2 4.3Å; F276-F284 AromaticContact CE2-CE2 3.76Å; F276-F284 HydrophobicContact CE2-CE2 3.76Å; F276-F284 HydrophobicContact CE2-CZ 4.22Å; F276-F284 AromaticContact CZ-CE2 3.6Å; F276-F284 HydrophobicContact CZ-CE2 3.6Å; F276-F284 AromaticContact CZ-CZ 3.89Å; F276-F284 HydrophobicContact CZ-CZ 3.89Å; P280-F284 HydrophobicContact CB-CD2 3.9Å; P280-F284 HydrophobicContact CB-CE2 3.88Å; P280-F284 WeakPolarHBondContact O-CD2 3.27Å; P280-F284 PolarHBondContact O-N 3.16Å; P280-F284 VanDerWaalsContact O-N 3.1Å; R281-F284 PolarHBondContact O-N 2.83Å; P282-F284 PolarHBondContact O-N 2.95Å; F284-A287 HydrophobicContact CD1-CB 4.39Å; F284-I361 HydrophobicContact CD1-CD1 4.05Å; F284-I361 HydrophobicContact CD1-CG1 3.81Å; F284-I361 HydrophobicContact CE1-CD1 4.01Å; F284-I361 HydrophobicContact CE1-CG1 4.1Å; F284-Q364 PolarHBondContact O-NE2 2.7Å; F284-V366 HydrophobicContact CD2-CB 4.4Å; F284-V366 HydrophobicContact CD2-CG1 4.03Å; F284-V366 HydrophobicContact CD2-CG2 4.11Å; F284-V366 HydrophobicContact CE2-CG1 3.85Å; F284-P367 HydrophobicContact CD1-CG 4.44Å; F284-P367 HydrophobicContact CE1-CG 3.7Å; F284-P367 HydrophobicContact CE2-CG 4.4Å; F284-P367 HydrophobicContact CZ-CG 3.67Å; F284-I379 HydrophobicContact CE2-CG2 3.77Å; F284-I379 HydrophobicContact CZ-CG2 4.05Å; F284-P382 HydrophobicContact CE1-CG 4.36Å
285	K	89	Confident	89.3	Confident	61 Å²	61	47 Å²	47	27%	0.265	22%	0.222	S	C	.	.	H	α-helix	trans	-65.5	-51.8	165.6	-176.4	175.2	171.5	-171.7	0	110.8	D260 F261 R281 P282 F283 K288 Q364	D260-K285 IonicContact OD1-NZ 2.65Å; D260-K285 PolarHBondContact OD1-NZ 2.99Å; D260-K285 WeakPolarHBondContact OD2-CE 3.49Å; D260-K285 IonicContact OD2-NZ 2.83Å; D260-K285 PolarHBondContact OD2-NZ 2.66Å; F261-K285 HydrophobicContact CE2-CB 4.25Å; F261-K285 HydrophobicContact CE2-CD 3.75Å; F261-K285 HydrophobicContact CZ-CB 4Å; F261-K285 HydrophobicContact CZ-CD 3.6Å; F261-K285 HydrophobicContact CZ-CG 4.41Å; R281-K285 PolarHBondContact O-N 2.78Å; P282-K285 PolarHBondContact O-N 2.9Å; F283-K285 VanDerWaalsContact C-N 3.33Å; F283-K285 PolarHBondContact O-N 2.81Å; K285-K288 PolarHBondContact O-N 3.06Å; K285-Q364 VanDerWaalsContact CA-OE1 3.29Å
286	F	87.7	Confident	89.5	Confident	3 Å²	3	52.6 Å²	52.6	1%	0.013	25%	0.249	C	C	.	.	H	α-helix	trans	-63.4	-41.1	177.7	171.1	-110.8	0	0	0	113.6	F247 I253 M270 F271 P282 F283 K288 E289 I290	F247-F286 HydrophobicContact CE1-CE1 4.05Å; F247-F286 AromaticContact CE1-CZ 3.77Å; F247-F286 HydrophobicContact CE1-CZ 3.77Å; F247-F286 HydrophobicContact CZ-CE1 4.37Å; F247-F286 HydrophobicContact CZ-CZ 4.08Å; I253-F286 HydrophobicContact CB-CE2 4.37Å; I253-F286 HydrophobicContact CD1-CD2 4.46Å; I253-F286 HydrophobicContact CD1-CE2 3.37Å; I253-F286 HydrophobicContact CD1-CZ 3.53Å; I253-F286 HydrophobicContact CG1-CD2 4.48Å; I253-F286 HydrophobicContact CG1-CE2 3.72Å; I253-F286 HydrophobicContact CG1-CZ 4.37Å; I253-F286 HydrophobicContact CG2-CD2 3.76Å; I253-F286 HydrophobicContact CG2-CE2 3.72Å; I253-F286 HydrophobicContact CG2-CZ 4.41Å; M270-F286 HydrophobicContact CE-CB 3.84Å; M270-F286 HydrophobicContact SD-CB 3.53Å; M270-F286 VanDerWaalsContact SD-CB 3.53Å; M270-F286 HydrophobicContact SD-CD1 3.73Å; M270-F286 HydrophobicContact SD-CG 3.72Å; F271-F286 HydrophobicContact CZ-CD1 4.1Å; F271-F286 AromaticContact CZ-CE1 3.69Å; F271-F286 HydrophobicContact CZ-CE1 3.69Å; P282-F286 PolarHBondContact O-N 2.86Å; P282-F286 VanDerWaalsContact O-N 3.12Å; F283-F286 PolarHBondContact O-N 2.83Å; F286-K288 PolarHBondContact O-N 2.96Å; F286-E289 WeakPolarHBondContact O-CB 3.28Å; F286-E289 PolarHBondContact O-N 3.01Å; F286-I290 HydrophobicContact CD1-CD1 4.39Å; F286-I290 HydrophobicContact CD1-CG1 4.49Å; F286-I290 HydrophobicContact CE1-CD1 3.38Å; F286-I290 HydrophobicContact CE1-CG1 3.83Å; F286-I290 HydrophobicContact CE2-CD1 4.39Å; F286-I290 HydrophobicContact CE2-CG1 4.31Å; F286-I290 HydrophobicContact CE2-CG2 3.77Å; F286-I290 HydrophobicContact CZ-CB 4.4Å; F286-I290 HydrophobicContact CZ-CD1 3.4Å; F286-I290 HydrophobicContact CZ-CG1 3.75Å; F286-I290 HydrophobicContact CZ-CG2 3.76Å; F286-I290 PolarHBondContact O-N 2.89Å
287	A	90.6	Very high	89.6	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-59	-23.4	-178.3	0	0	0	0	0	113.9	F283 F284 F291 F340 I361	F283-A287 HydrophobicContact CD1-CB 4.4Å; F283-A287 HydrophobicContact CE1-CB 3.99Å; F283-A287 HydrophobicContact CZ-CB 4.22Å; F283-A287 VanDerWaalsContact O-CB 3.26Å; F283-A287 WeakPolarHBondContact O-CB 3.5Å; F283-A287 PolarHBondContact O-N 3.18Å; F284-A287 HydrophobicContact CD1-CB 4.39Å; A287-F291 WeakPolarHBondContact O-CB 3.31Å; A287-F291 PolarHBondContact O-N 2.81Å; A287-F340 HydrophobicContact CB-CE1 3.71Å; A287-F340 HydrophobicContact CB-CZ 3.87Å; A287-I361 HydrophobicContact CB-CG2 4.18Å
288	K	89.3	Confident	89.8	Confident	85 Å²	85	48.1 Å²	48.1	37%	0.37	23%	0.234	S	C	.	.	H	α-helix	trans	-70.8	-38.5	173.2	170.7	172.9	177.5	167.3	0	112.4	K285 F286 Q294 I361 L362 Q364	K285-K288 PolarHBondContact O-N 3.06Å; F286-K288 PolarHBondContact O-N 2.96Å; K288-Q294 PolarHBondContact O-NE2 2.94Å; K288-I361 HydrophobicContact CB-CG2 4.07Å; K288-L362 WeakPolarHBondContact CE-O 3.37Å; K288-L362 HydrophobicContact CG-CD2 4.14Å; K288-L362 PolarHBondContact NZ-O 2.93Å; K288-Q364 HydrophobicContact CD-CG 4.02Å
289	E	85.6	Confident	90.1	Very high	88 Å²	88	41.5 Å²	41.5	41%	0.411	21%	0.212	S	C	.	.	H	α-helix	trans	-65.9	-41.9	-179.5	-64.9	179.5	-142.1	0	0	111	F286 F295	F286-E289 WeakPolarHBondContact O-CB 3.28Å; F286-E289 PolarHBondContact O-N 3.01Å; E289-F295 WeakPolarHBondContact O-CE2 3.44Å; E289-F295 VanDerWaalsContact O-CZ 3.27Å; E289-F295 WeakPolarHBondContact O-CZ 3.34Å
290	I	85.7	Confident	90.4	Very high	5 Å²	5	40.3 Å²	40.3	3%	0.026	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	17	-177.2	67.4	158.5	0	0	0	114.6	I244 F286 I321 F340	I244-I290 HydrophobicContact CG2-CG2 3.95Å; F286-I290 HydrophobicContact CD1-CD1 4.39Å; F286-I290 HydrophobicContact CD1-CG1 4.49Å; F286-I290 HydrophobicContact CE1-CD1 3.38Å; F286-I290 HydrophobicContact CE1-CG1 3.83Å; F286-I290 HydrophobicContact CE2-CD1 4.39Å; F286-I290 HydrophobicContact CE2-CG1 4.31Å; F286-I290 HydrophobicContact CE2-CG2 3.77Å; F286-I290 HydrophobicContact CZ-CB 4.4Å; F286-I290 HydrophobicContact CZ-CD1 3.4Å; F286-I290 HydrophobicContact CZ-CG1 3.75Å; F286-I290 HydrophobicContact CZ-CG2 3.76Å; F286-I290 PolarHBondContact O-N 2.89Å; I290-I321 HydrophobicContact CD1-CD1 3.6Å; I290-I321 HydrophobicContact CD1-CG1 3.99Å; I290-F340 HydrophobicContact CD1-CE2 3.53Å; I290-F340 HydrophobicContact CD1-CZ 4.08Å; I290-F340 HydrophobicContact CG1-CE2 3.79Å; I290-F340 HydrophobicContact CG1-CZ 4.11Å
291	F	86.4	Confident	90.7	Very high	1 Å²	1	39.6 Å²	39.6	0%	0.004	20%	0.202	C	C	.	.			trans	-67.4	133.5	-175.4	-158	-91.8	0	0	0	112.1	A287 Q294 F340 C354 R358 I361	A287-F291 WeakPolarHBondContact O-CB 3.31Å; A287-F291 PolarHBondContact O-N 2.81Å; F291-Q294 PolarHBondContact O-NE2 2.75Å; F291-F340 HydrophobicContact CD2-CD1 4.33Å; F291-F340 HydrophobicContact CE2-CD1 4.31Å; F291-C354 HydrophobicContact CZ-CB 4.25Å; F291-R358 HydrophobicContact CD1-CG 4.14Å; F291-R358 HydrophobicContact CE1-CB 3.84Å; F291-R358 HydrophobicContact CE1-CG 3.61Å; F291-R358 HydrophobicContact CZ-CB 3.87Å; F291-R358 HydrophobicContact CZ-CG 4.11Å; F291-I361 HydrophobicContact CD2-CD1 4.18Å; F291-I361 HydrophobicContact CD2-CG2 4.09Å; F291-I361 HydrophobicContact CE2-CD1 3.78Å
292	P	84.4	Confident	91	Very high	20 Å²	20	37.7 Å²	37.7	13%	0.13	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	150.6	-175.5	-30.4	36.2	0	0	0	116.5	F340 R358	P292-F340 HydrophobicContact CG-CB 3.78Å; P292-F340 HydrophobicContact CG-CG 4.45Å; P292-R358 PolarHBondContact O-NH1 3.44Å; P292-R358 PolarHBondContact O-NH2 3.03Å
293	G	82.5	Confident	91.4	Very high	77 Å²	77	37.8 Å²	37.8	79%	0.794	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	92.8	3.7	179.7	0	0	0	0	0	115.4
294	Q	84.8	Confident	91.7	Very high	105 Å²	105	37.7 Å²	37.7	49%	0.491	20%	0.195	S	C	.	.	S	Bend	trans	-101.3	-16	178.9	-64.3	-179.5	96.1	0	0	114	K288 F291	K288-Q294 PolarHBondContact O-NE2 2.94Å; F291-Q294 PolarHBondContact O-NE2 2.75Å
295	F	91.1	Very high	92	Very high	42 Å²	42	37.6 Å²	37.6	18%	0.184	19%	0.194	C	C	.	.			trans	-119.7	160.5	-168.5	-56.5	-71.8	0	0	0	112.1	C242 I244 E289 L324	C242-F295 VanDerWaalsContact O-CD1 3.29Å; C242-F295 WeakPolarHBondContact O-CD1 3.34Å; I244-F295 HydrophobicContact CD1-CB 4.33Å; I244-F295 HydrophobicContact CD1-CD1 4.45Å; I244-F295 HydrophobicContact CD1-CD2 3.72Å; I244-F295 HydrophobicContact CD1-CE2 4.14Å; I244-F295 HydrophobicContact CD1-CG 3.9Å; I244-F295 HydrophobicContact CG1-CD1 3.83Å; I244-F295 HydrophobicContact CG1-CD2 3.84Å; I244-F295 HydrophobicContact CG1-CE1 3.9Å; I244-F295 HydrophobicContact CG1-CE2 3.95Å; I244-F295 HydrophobicContact CG1-CG 3.78Å; I244-F295 HydrophobicContact CG1-CZ 3.96Å; E289-F295 WeakPolarHBondContact O-CE2 3.44Å; E289-F295 VanDerWaalsContact O-CZ 3.27Å; E289-F295 WeakPolarHBondContact O-CZ 3.34Å; F295-L324 HydrophobicContact CB-CD1 4.44Å; F295-L324 HydrophobicContact CB-CD2 4.03Å
296	Q	94.3	Very high	92.4	Very high	134 Å²	134	35.6 Å²	35.6	63%	0.626	19%	0.186	S	C	*	.			trans	-119.8	140.1	179	-70.1	-63.5	-44.7	0	0	110.5	C242	C242-Q296 WeakPolarHBondContact CB-O 3.46Å; C242-Q296 PolarHBondContact SG-O 2.85Å
297	P	96.6	Very high	92.9	Very high	8 Å²	8	35.4 Å²	35.4	5%	0.052	19%	0.185	C	C	.	.			trans	-69.8	132.9	-176.7	-17.7	30.1	0	0	0	113.5	H301 R302 L324 V327 A328	P297-H301 HydrophobicContact CB-CB 3.64Å; P297-R302 PolarHBondContact O-NE 2.97Å; P297-R302 PolarHBondContact O-NH2 2.88Å; P297-L324 HydrophobicContact CG-CD2 4.16Å; P297-V327 HydrophobicContact CG-CB 3.81Å; P297-V327 HydrophobicContact CG-CG1 3.68Å; P297-A328 HydrophobicContact CB-CB 3.84Å; P297-A328 HydrophobicContact CG-CB 4.02Å
298	S	97.1	Very high	93.3	Very high	6 Å²	6	36.1 Å²	36.1	4%	0.042	19%	0.189	C	C	.	.			trans	-64.3	165.2	176.1	58.5	0	0	0	0	114.2	V238 S241 C242 C300 H301 R302	V238-S298 WeakPolarHBondContact O-CB 3.49Å; V238-S298 PolarHBondContact O-OG 2.72Å; S241-S298 VanDerWaalsContact OG-CB 3.28Å; S241-S298 WeakPolarHBondContact OG-CB 3.16Å; C242-S298 VanDerWaalsContact SG-CB 3.56Å; C242-S298 PolarHBondContact SG-N 3.48Å; C242-S298 VanDerWaalsContact SG-N 3.38Å; S298-C300 PolarHBondContact O-N 2.68Å; S298-H301 PolarHBondContact O-N 3.49Å; S298-H301 PolarHBondContact OG-ND1 2.75Å; S298-R302 WeakPolarHBondContact O-CG 3.2Å; S298-R302 PolarHBondContact O-N 2.83Å; S298-R302 VanDerWaalsContact O-N 3.11Å
299	P	97.4	Very high	93.7	Very high	29 Å²	29	38.8 Å²	38.8	19%	0.188	20%	0.201	C	C	.	.	H	α-helix	trans	-45.6	-42.6	167.1	-29.5	34.1	0	0	0	114.1	H301 R302 F303 D456 F475	P299-H301 PolarHBondContact O-N 2.9Å; P299-R302 PolarHBondContact O-N 3.29Å; P299-R302 VanDerWaalsContact O-N 3.11Å; P299-F303 WeakPolarHBondContact O-CB 3.15Å; P299-F303 PolarHBondContact O-N 3.25Å; P299-D456 HydrophobicContact CB-CB 4.17Å; P299-D456 WeakPolarHBondContact CB-OD1 3.35Å; P299-D456 VanDerWaalsContact CD-OD1 3.32Å; P299-D456 WeakPolarHBondContact CD-OD1 3.19Å; P299-D456 HydrophobicContact CG-CB 4.1Å; P299-F475 HydrophobicContact CB-CD1 4.1Å; P299-F475 HydrophobicContact CB-CE1 3.99Å; P299-F475 HydrophobicContact CG-CD1 3.5Å; P299-F475 HydrophobicContact CG-CE1 3.55Å
300	C	98	Very high	94.2	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-53.3	-49.2	173.9	-71.9	0	0	0	0	113.1	V238 S298 R302 F303 I304 C455 D456	V238-C300 HydrophobicContact CB-CB 3.81Å; V238-C300 HydrophobicContact CG1-CB 3.74Å; S298-C300 PolarHBondContact O-N 2.68Å; C300-R302 VanDerWaalsContact C-N 3.32Å; C300-R302 PolarHBondContact O-N 3.04Å; C300-F303 PolarHBondContact O-N 3.45Å; C300-I304 WeakPolarHBondContact O-CG1 3.48Å; C300-I304 PolarHBondContact O-N 2.88Å; C300-C455 VanDerWaalsContact SG-CB 3.56Å; C300-D456 PolarHBondContact N-OD1 3.05Å; C300-D456 PolarHBondContact SG-OD1 3.2Å
301	H	98.4	Very high	94.8	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-65.2	-36.2	177.7	-66.5	95.6	0	0	0	112.2	V238 P297 S298 P299 I304 S305 L324 A328	V238-H301 PolarHBondContact O-CE1 3.5Å; P297-H301 HydrophobicContact CB-CB 3.64Å; S298-H301 PolarHBondContact O-N 3.49Å; S298-H301 PolarHBondContact OG-ND1 2.75Å; P299-H301 PolarHBondContact O-N 2.9Å; H301-I304 PolarHBondContact O-N 2.71Å; H301-S305 WeakPolarHBondContact O-CB 3.47Å; H301-S305 PolarHBondContact O-N 3.47Å; H301-L324 WeakPolarHBondContact NE2-CB 3.44Å; H301-A328 HydrophobicContact CB-CB 3.79Å
302	R	97.9	Very high	95.4	Very high	120 Å²	120	40.5 Å²	40.5	45%	0.453	22%	0.217	S	C	.	.	H	α-helix	trans	-70.7	-35.7	179.3	-65.5	169.2	-173.5	-102.6	-6	112.2	P297 S298 P299 C300 S305 M306 L473	P297-R302 PolarHBondContact O-NE 2.97Å; P297-R302 PolarHBondContact O-NH2 2.88Å; S298-R302 WeakPolarHBondContact O-CG 3.2Å; S298-R302 PolarHBondContact O-N 2.83Å; S298-R302 VanDerWaalsContact O-N 3.11Å; P299-R302 PolarHBondContact O-N 3.29Å; P299-R302 VanDerWaalsContact O-N 3.11Å; C300-R302 VanDerWaalsContact C-N 3.32Å; C300-R302 PolarHBondContact O-N 3.04Å; R302-S305 WeakPolarHBondContact O-CB 3.45Å; R302-S305 PolarHBondContact O-N 2.97Å; R302-M306 PolarHBondContact O-N 3.28Å; R302-L473 HydrophobicContact CB-CD2 4.29Å
303	F	98.4	Very high	96.1	Very high	1 Å²	1	39.6 Å²	39.6	0%	0.004	21%	0.211	C	C	.	.	H	α-helix	trans	-62.5	-47.2	171.7	173.5	-101.2	0	0	0	111.8	L224 P299 C300 S305 M306 L307 I459 L466 F470	L224-F303 HydrophobicContact CD1-CZ 4.36Å; L224-F303 HydrophobicContact CD2-CZ 4Å; P299-F303 WeakPolarHBondContact O-CB 3.15Å; P299-F303 PolarHBondContact O-N 3.25Å; C300-F303 PolarHBondContact O-N 3.45Å; F303-S305 VanDerWaalsContact C-N 3.3Å; F303-S305 PolarHBondContact O-N 3.15Å; F303-M306 WeakPolarHBondContact O-CB 3.33Å; F303-M306 PolarHBondContact O-N 2.93Å; F303-L307 HydrophobicContact CD1-CD1 4.15Å; F303-L307 HydrophobicContact CE1-CD1 3.62Å; F303-L307 HydrophobicContact CE1-CG 4.31Å; F303-L307 HydrophobicContact CZ-CD1 3.98Å; F303-L307 HydrophobicContact CZ-CD2 4.45Å; F303-L307 HydrophobicContact CZ-CG 4.35Å; F303-L307 PolarHBondContact O-N 3.39Å; F303-I459 HydrophobicContact CB-CG2 3.65Å; F303-I459 HydrophobicContact CD1-CD1 3.68Å; F303-I459 HydrophobicContact CD2-CG2 4.24Å; F303-I459 HydrophobicContact CE1-CD1 3.85Å; F303-I459 HydrophobicContact CG-CD1 4.05Å; F303-I459 HydrophobicContact CG-CG2 3.94Å; F303-I459 HydrophobicContact CZ-CD1 4.37Å; F303-L466 HydrophobicContact CE2-CD1 3.88Å; F303-F470 AromaticContact CD2-CD1 3.79Å; F303-F470 HydrophobicContact CD2-CD1 3.79Å; F303-F470 AromaticContact CD2-CE1 3.87Å; F303-F470 HydrophobicContact CD2-CE1 3.87Å; F303-F470 AromaticContact CE2-CD1 3.85Å; F303-F470 HydrophobicContact CE2-CD1 3.85Å; F303-F470 AromaticContact CE2-CE1 3.74Å; F303-F470 HydrophobicContact CE2-CE1 3.74Å
304	I	98.5	Very high	96.8	Very high	1 Å²	1	37 Å²	37	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-61.8	-40.4	175.6	-62.4	166.4	0	0	0	110.8	V232 T234 C300 H301 M306 L307 D308 L313 N316 V330	V232-I304 HydrophobicContact CG1-CD1 3.91Å; V232-I304 HydrophobicContact CG1-CG1 4.1Å; T234-I304 HydrophobicContact CG2-CD1 3.5Å; T234-I304 VanDerWaalsContact CG2-CD1 3.5Å; C300-I304 WeakPolarHBondContact O-CG1 3.48Å; C300-I304 PolarHBondContact O-N 2.88Å; H301-I304 PolarHBondContact O-N 2.71Å; I304-M306 VanDerWaalsContact C-N 3.28Å; I304-M306 PolarHBondContact O-N 2.61Å; I304-L307 PolarHBondContact O-N 2.81Å; I304-D308 PolarHBondContact O-N 2.63Å; I304-L313 HydrophobicContact CG2-CD1 4.35Å; I304-L313 HydrophobicContact CG2-CD2 3.89Å; I304-N316 HydrophobicContact CG2-CB 3.91Å; I304-V330 HydrophobicContact CB-CG2 4.32Å; I304-V330 HydrophobicContact CG2-CG1 4Å; I304-V330 HydrophobicContact CG2-CG2 3.87Å
305	S	98.4	Very high	97.5	Very high	2 Å²	2	34.7 Å²	34.7	1%	0.014	17%	0.166	C	C	.	.	H	α-helix	trans	-60.8	-33.9	173.1	-179	0	0	0	0	112.8	H301 R302 F303 K309 A328	H301-S305 WeakPolarHBondContact O-CB 3.47Å; H301-S305 PolarHBondContact O-N 3.47Å; R302-S305 WeakPolarHBondContact O-CB 3.45Å; R302-S305 PolarHBondContact O-N 2.97Å; F303-S305 VanDerWaalsContact C-N 3.3Å; F303-S305 PolarHBondContact O-N 3.15Å; S305-K309 WeakPolarHBondContact O-CB 3.25Å; S305-K309 VanDerWaalsContact O-CD 3.32Å; S305-K309 WeakPolarHBondContact O-CD 3.25Å; S305-K309 VanDerWaalsContact O-CG 3.23Å; S305-K309 WeakPolarHBondContact O-CG 3.19Å; S305-K309 PolarHBondContact O-N 3.09Å; S305-K309 VanDerWaalsContact O-N 3.07Å; S305-K309 WeakPolarHBondContact OG-CE 3.43Å; S305-K309 PolarHBondContact OG-NZ 3.06Å; S305-A328 VanDerWaalsContact CB-O 3.27Å; S305-A328 WeakPolarHBondContact CB-O 3.32Å; S305-A328 PolarHBondContact OG-O 2.9Å
306	M	97.9	Very high	97.9	Very high	19 Å²	19	32.7 Å²	32.7	9%	0.094	16%	0.157	C	C	.	.	H	α-helix	trans	-72	-42.1	174.4	-165.6	60	69.6	0	0	112.4	R302 F303 I304 D308 K309 Q310 D469 F470 Q472 L473	R302-M306 PolarHBondContact O-N 3.28Å; F303-M306 WeakPolarHBondContact O-CB 3.33Å; F303-M306 PolarHBondContact O-N 2.93Å; I304-M306 VanDerWaalsContact C-N 3.28Å; I304-M306 PolarHBondContact O-N 2.61Å; M306-D308 VanDerWaalsContact C-N 3.26Å; M306-D308 PolarHBondContact O-N 3.25Å; M306-K309 PolarHBondContact O-N 3.04Å; M306-Q310 PolarHBondContact O-N 3.04Å; M306-D469 WeakPolarHBondContact CE-O 3.26Å; M306-D469 HydrophobicContact CG-CB 4.49Å; M306-D469 HydrophobicContact SD-CB 4.01Å; M306-F470 HydrophobicContact CB-CD1 4.34Å; M306-F470 HydrophobicContact CB-CE1 3.94Å; M306-F470 HydrophobicContact CG-CD1 4Å; M306-F470 HydrophobicContact CG-CE1 3.71Å; M306-F470 HydrophobicContact CG-CZ 4.09Å; M306-Q472 HydrophobicContact CE-CG 4.48Å; M306-L473 HydrophobicContact CB-CD1 3.93Å; M306-L473 HydrophobicContact CE-CD1 4.3Å; M306-L473 HydrophobicContact CE-CD2 4.01Å; M306-L473 HydrophobicContact CE-CG 4.33Å; M306-L473 HydrophobicContact CG-CD1 4.34Å
307	L	98.2	Very high	98.1	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-59.5	-36.1	174	-66.4	176.7	0	0	0	112.3	I230 V232 F303 I304 G311 K312 L313 F470	I230-L307 HydrophobicContact CD1-CD2 4.11Å; V232-L307 HydrophobicContact CG2-CD1 4.27Å; F303-L307 HydrophobicContact CD1-CD1 4.15Å; F303-L307 HydrophobicContact CE1-CD1 3.62Å; F303-L307 HydrophobicContact CE1-CG 4.31Å; F303-L307 HydrophobicContact CZ-CD1 3.98Å; F303-L307 HydrophobicContact CZ-CD2 4.45Å; F303-L307 HydrophobicContact CZ-CG 4.35Å; F303-L307 PolarHBondContact O-N 3.39Å; I304-L307 PolarHBondContact O-N 2.81Å; L307-G311 PolarHBondContact O-N 3.04Å; L307-K312 PolarHBondContact O-N 3.39Å; L307-L313 HydrophobicContact CB-CB 4.13Å; L307-L313 PolarHBondContact O-N 2.78Å; L307-F470 HydrophobicContact CD2-CE1 4.1Å; L307-F470 HydrophobicContact CD2-CZ 3.91Å
308	D	98.4	Very high	98.1	Very high	14 Å²	14	26 Å²	26	8%	0.075	13%	0.125	C	C	.	.	H	α-helix	trans	-71.9	-43.5	175.4	-153.4	-8.1	0	0	0	111.9	I304 M306 Q310 G311 L313 Q331 R332	I304-D308 PolarHBondContact O-N 2.63Å; M306-D308 VanDerWaalsContact C-N 3.26Å; M306-D308 PolarHBondContact O-N 3.25Å; D308-Q310 VanDerWaalsContact C-N 3.32Å; D308-Q310 PolarHBondContact O-N 2.82Å; D308-G311 WeakPolarHBondContact O-CA 3.47Å; D308-G311 PolarHBondContact O-N 2.97Å; D308-L313 HydrophobicContact CB-CB 4.13Å; D308-L313 HydrophobicContact CB-CD2 3.77Å; D308-Q331 WeakPolarHBondContact OD2-CA 3.45Å; D308-Q331 PolarHBondContact OD2-N 3.29Å; D308-R332 WeakPolarHBondContact OD1-CD 3.31Å; D308-R332 WeakPolarHBondContact OD1-CG 3.34Å; D308-R332 IonicContact OD1-CZ 3.3Å; D308-R332 IonicContact OD1-NE 3.29Å; D308-R332 PolarHBondContact OD1-NE 3.11Å; D308-R332 PolarHBondContact OD2-N 2.85Å
309	K	97.6	Very high	98	Very high	141 Å²	141	26.7 Å²	26.7	61%	0.613	13%	0.128	S	C	*	.	H	α-helix	trans	-61.3	-36.7	175.9	-75.3	162.2	-176.1	151.8	0	113.3	S305 M306 G311	S305-K309 WeakPolarHBondContact O-CB 3.25Å; S305-K309 VanDerWaalsContact O-CD 3.32Å; S305-K309 WeakPolarHBondContact O-CD 3.25Å; S305-K309 VanDerWaalsContact O-CG 3.23Å; S305-K309 WeakPolarHBondContact O-CG 3.19Å; S305-K309 PolarHBondContact O-N 3.09Å; S305-K309 VanDerWaalsContact O-N 3.07Å; S305-K309 WeakPolarHBondContact OG-CE 3.43Å; S305-K309 PolarHBondContact OG-NZ 3.06Å; M306-K309 PolarHBondContact O-N 3.04Å; K309-G311 PolarHBondContact O-N 3.4Å
310	Q	97	Very high	97.9	Very high	68 Å²	68	25.8 Å²	25.8	32%	0.318	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-0.1	172.3	-68.3	-176.1	-11.2	0	0	113.3	M306 D308 K312 D469 F470	M306-Q310 PolarHBondContact O-N 3.04Å; D308-Q310 VanDerWaalsContact C-N 3.32Å; D308-Q310 PolarHBondContact O-N 2.82Å; Q310-K312 VanDerWaalsContact C-N 3.26Å; Q310-K312 HydrophobicContact CB-CD 4.11Å; Q310-K312 HydrophobicContact CB-CG 3.83Å; Q310-K312 PolarHBondContact O-N 3.38Å; Q310-D469 PolarHBondContact NE2-OD2 2.55Å; Q310-F470 VanDerWaalsContact OE1-CE2 3.25Å; Q310-F470 VanDerWaalsContact OE1-CZ 3.23Å
311	G	97.9	Very high	97.6	Very high	33 Å²	33	26.4 Å²	26.4	34%	0.34	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.7	7.1	178	0	0	0	0	0	115.5	L307 D308 K309	L307-G311 PolarHBondContact O-N 3.04Å; D308-G311 WeakPolarHBondContact O-CA 3.47Å; D308-G311 PolarHBondContact O-N 2.97Å; K309-G311 PolarHBondContact O-N 3.4Å
312	K	98.4	Very high	97.2	Very high	30 Å²	30	26.9 Å²	26.9	13%	0.13	13%	0.127	C	C	.	.			trans	-86.8	-24.5	-172.3	-46.5	-170.2	72.9	173.7	0	113.7	L224 H225 S227 K228 R229 I230 L307 Q310 L314	L224-K312 PolarHBondContact O-NZ 2.95Å; H225-K312 PolarHBondContact O-NZ 2.92Å; S227-K312 WeakPolarHBondContact O-CE 3.41Å; S227-K312 PolarHBondContact O-NZ 3.4Å; K228-K312 CarbonylContact C-O 3.16Å; K228-K312 VanDerWaalsContact C-O 3.3Å; R229-K312 PolarHBondContact N-O 2.99Å; I230-K312 HydrophobicContact CD1-CB 4.07Å; I230-K312 PolarHBondContact N-O 3.43Å; L307-K312 PolarHBondContact O-N 3.39Å; Q310-K312 VanDerWaalsContact C-N 3.26Å; Q310-K312 HydrophobicContact CB-CD 4.11Å; Q310-K312 HydrophobicContact CB-CG 3.83Å; Q310-K312 PolarHBondContact O-N 3.38Å; K312-L314 PolarHBondContact O-N 2.85Å
313	L	98.8	Very high	96.9	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	117.3	174.1	-172.8	69	0	0	0	109.2	I230 V232 I304 L307 D308 R315 N316 V330 R332	I230-L313 CarbonylContact O-C 3.58Å; V232-L313 HydrophobicContact CB-CD1 4.13Å; V232-L313 HydrophobicContact CG2-CD1 3.61Å; I304-L313 HydrophobicContact CG2-CD1 4.35Å; I304-L313 HydrophobicContact CG2-CD2 3.89Å; L307-L313 HydrophobicContact CB-CB 4.13Å; L307-L313 PolarHBondContact O-N 2.78Å; D308-L313 HydrophobicContact CB-CB 4.13Å; D308-L313 HydrophobicContact CB-CD2 3.77Å; L313-R315 WeakPolarHBondContact CD1-O 3.23Å; L313-N316 HydrophobicContact CD1-CB 4.39Å; L313-N316 HydrophobicContact CD2-CB 4.14Å; L313-V330 HydrophobicContact CD2-CG1 3.78Å; L313-R332 HydrophobicContact CD2-CB 4.21Å; L313-R332 WeakPolarHBondContact O-CD 3.17Å; L313-R332 PolarHBondContact O-NH1 2.91Å
314	L	98.6	Very high	96.8	Very high	24 Å²	24	22 Å²	22	13%	0.126	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	-52.6	164.9	175.8	61.9	0	0	0	109.4	R229 I230 K312 D402 E405 V406	R229-L314 VanDerWaalsContact C-CB 3.49Å; R229-L314 HydrophobicContact CB-CB 4.07Å; R229-L314 HydrophobicContact CB-CD2 4.33Å; I230-L314 PolarHBondContact O-N 2.94Å; K312-L314 PolarHBondContact O-N 2.85Å; L314-D402 HydrophobicContact CD2-CB 3.84Å; L314-D402 HydrophobicContact CG-CB 4.3Å; L314-E405 HydrophobicContact CD1-CB 4.46Å; L314-E405 HydrophobicContact CD2-CB 4.04Å; L314-V406 HydrophobicContact CD2-CB 3.95Å
315	R	98.6	Very high	96.6	Very high	56 Å²	56	22 Å²	22	21%	0.211	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	146.9	179.4	-149.5	75.5	70.4	178.7	-4.8	111.8	I230 L231 V232 L313 Y317 R332 I334 D402	I230-R315 PolarHBondContact O-N 2.92Å; L231-R315 WeakPolarHBondContact CA-O 3.36Å; V232-R315 PolarHBondContact N-O 3.19Å; L313-R315 WeakPolarHBondContact CD1-O 3.23Å; R315-Y317 HydrophobicContact CB-CD2 3.85Å; R315-Y317 HydrophobicContact CB-CE2 3.51Å; R315-Y317 HydrophobicContact CG-CD2 3.86Å; R315-Y317 HydrophobicContact CG-CE2 3.49Å; R315-Y317 VanDerWaalsContact CG-CE2 3.49Å; R315-R332 CarbonylContact C-O 3.3Å; R315-R332 WeakPolarHBondContact CA-O 3.47Å; R315-R332 VanDerWaalsContact CD-O 3.26Å; R315-R332 WeakPolarHBondContact CD-O 3.41Å; R315-R332 WeakPolarHBondContact CG-O 3.33Å; R315-I334 HydrophobicContact CG-CB 4.44Å; R315-I334 HydrophobicContact CG-CG1 3.56Å; R315-D402 WeakPolarHBondContact CB-OD2 3.29Å; R315-D402 WeakPolarHBondContact CG-OD2 3.32Å; R315-D402 IonicContact CZ-OD1 2.71Å; R315-D402 IonicContact CZ-OD2 3.19Å; R315-D402 IonicContact NE-OD1 3.48Å; R315-D402 PolarHBondContact NE-OD1 3.26Å; R315-D402 IonicContact NE-OD2 2.68Å; R315-D402 PolarHBondContact NE-OD2 3.42Å; R315-D402 IonicContact NH2-OD1 3.01Å; R315-D402 PolarHBondContact NH2-OD1 3.04Å; R315-D402 IonicContact NH2-OD2 2.91Å; R315-D402 PolarHBondContact NH2-OD2 3.36Å
316	N	98.7	Very high	96.4	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	111.4	159.7	170.5	-135	0	0	0	110.4	V232 T234 I304 L313 V330 R332 I333 I334	V232-N316 CarbonylContact O-C 3.56Å; V232-N316 WeakPolarHBondContact O-CA 3.46Å; V232-N316 PolarHBondContact O-ND2 3.24Å; T234-N316 PolarHBondContact OG1-ND2 3.37Å; I304-N316 HydrophobicContact CG2-CB 3.91Å; L313-N316 HydrophobicContact CD1-CB 4.39Å; L313-N316 HydrophobicContact CD2-CB 4.14Å; N316-V330 HydrophobicContact CB-CG1 4.46Å; N316-R332 PolarHBondContact N-O 2.79Å; N316-I333 CarbonylContact O-C 3.54Å; N316-I333 WeakPolarHBondContact O-CA 3.27Å; N316-I334 PolarHBondContact O-N 3.12Å
317	Y	98.5	Very high	96.2	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	99.2	173	-76.7	-95.5	0	0	0	109.3	L231 V232 L233 T234 R315 I334 F395 A398 M399 D402 I424	L231-Y317 HydrophobicContact CD1-CD2 4.08Å; L231-Y317 HydrophobicContact CD1-CE2 3.82Å; L231-Y317 HydrophobicContact CD2-CD2 3.55Å; L231-Y317 HydrophobicContact CD2-CE2 4.17Å; L231-Y317 HydrophobicContact CD2-CG 4.41Å; L231-Y317 HydrophobicContact CG-CD2 3.79Å; L231-Y317 HydrophobicContact CG-CE2 3.94Å; V232-Y317 PolarHBondContact O-N 2.85Å; L233-Y317 CarbonylContact C-O 3.6Å; L233-Y317 VanDerWaalsContact CA-O 3.31Å; L233-Y317 WeakPolarHBondContact CA-O 3.3Å; T234-Y317 PolarHBondContact N-O 3.49Å; R315-Y317 HydrophobicContact CB-CD2 3.85Å; R315-Y317 HydrophobicContact CB-CE2 3.51Å; R315-Y317 HydrophobicContact CG-CD2 3.86Å; R315-Y317 HydrophobicContact CG-CE2 3.49Å; R315-Y317 VanDerWaalsContact CG-CE2 3.49Å; Y317-I334 WeakPolarHBondContact CA-O 3.32Å; Y317-I334 HydrophobicContact CD1-CB 3.73Å; Y317-I334 HydrophobicContact CD1-CG1 4.26Å; Y317-I334 HydrophobicContact CD1-CG2 3.7Å; Y317-I334 HydrophobicContact CE1-CB 3.84Å; Y317-I334 HydrophobicContact CE1-CG1 3.9Å; Y317-I334 HydrophobicContact CE1-CG2 3.72Å; Y317-I334 HydrophobicContact CG-CB 4.26Å; Y317-F395 AromaticContact CD1-CD2 3.84Å; Y317-F395 HydrophobicContact CD1-CD2 3.84Å; Y317-F395 AromaticContact CD1-CE2 3.8Å; Y317-F395 HydrophobicContact CD1-CE2 3.8Å; Y317-F395 AromaticContact CE1-CD2 3.89Å; Y317-F395 HydrophobicContact CE1-CD2 3.89Å; Y317-F395 HydrophobicContact CE1-CE2 4.03Å; Y317-A398 WeakPolarHBondContact OH-CB 3.38Å; Y317-A398 PolarHBondContact OH-O 2.97Å; Y317-M399 HydrophobicContact CD1-SD 4.23Å; Y317-M399 HydrophobicContact CE1-CG 3.72Å; Y317-M399 HydrophobicContact CE1-SD 3.59Å; Y317-M399 VanDerWaalsContact CE1-SD 3.59Å; Y317-M399 HydrophobicContact CE2-SD 4.03Å; Y317-M399 PolarHBondContact OH-N 2.83Å; Y317-M399 VanDerWaalsContact OH-N 3.1Å; Y317-D402 WeakPolarHBondContact CE2-OD2 3.24Å; Y317-D402 PolarHBondContact OH-OD2 2.87Å; Y317-I424 HydrophobicContact CD1-CD1 4.27Å; Y317-I424 HydrophobicContact CG-CD1 4.37Å
318	T	97.8	Very high	96.1	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	138.1	179.5	-170.2	0	0	0	0	112.2	T234 N320 E325 I333 I334 Q335 C336	T234-T318 VanDerWaalsContact OG1-CA 3.27Å; T234-T318 WeakPolarHBondContact OG1-CA 3.23Å; T234-T318 WeakPolarHBondContact OG1-CB 3.35Å; T234-T318 PolarHBondContact OG1-OG1 2.92Å; T318-N320 WeakPolarHBondContact OG1-CB 3.41Å; T318-N320 PolarHBondContact OG1-N 3.34Å; T318-N320 VanDerWaalsContact OG1-N 3.08Å; T318-E325 WeakPolarHBondContact CB-OE1 3.4Å; T318-E325 HydrophobicContact CG2-CG 4.3Å; T318-E325 WeakPolarHBondContact CG2-OE1 3.39Å; T318-E325 PolarHBondContact OG1-OE1 3.15Å; T318-I333 HydrophobicContact CG2-CG2 3.89Å; T318-I334 PolarHBondContact N-O 3.44Å; T318-Q335 HydrophobicContact CG2-CB 4.2Å; T318-Q335 HydrophobicContact CG2-CG 3.66Å; T318-C336 VanDerWaalsContact O-CB 3.31Å; T318-C336 WeakPolarHBondContact O-CB 3.38Å; T318-C336 PolarHBondContact O-N 2.78Å; T318-C336 PolarHBondContact O-SG 2.87Å
319	Q	95.1	Very high	96	Very high	22 Å²	22	31.7 Å²	31.7	10%	0.103	17%	0.173	C	C	.	.			trans	-90.6	-3.7	168.3	-62.5	-165.8	-85.5	0	0	112.5	L233 T234 H337 S414 V421	L233-Q319 HydrophobicContact CD2-CG 4.29Å; T234-Q319 WeakPolarHBondContact O-CB 3.4Å; T234-Q319 PolarHBondContact O-N 3.41Å; Q319-H337 PolarHBondContact NE2-CE1 2.96Å; Q319-H337 VanDerWaalsContact NE2-CE1 3.31Å; Q319-H337 PolarHBondContact O-ND1 2.87Å; Q319-S414 PolarHBondContact OE1-OG 3.14Å; Q319-V421 HydrophobicContact CG-CB 4.33Å; Q319-V421 HydrophobicContact CG-CG1 3.76Å; Q319-V421 HydrophobicContact CG-CG2 4.45Å
320	N	94.1	Very high	96	Very high	10 Å²	10	25.3 Å²	25.3	5%	0.053	15%	0.146	C	C	.	.			trans	-81.2	160.7	-178.1	-59.6	-15.4	0	0	0	111.5	G235 A236 V238 S239 T318	G235-N320 WeakPolarHBondContact CA-OD1 3.23Å; G235-N320 PolarHBondContact O-ND2 3.28Å; G235-N320 PolarHBondContact O-OD1 3.2Å; A236-N320 WeakPolarHBondContact CA-OD1 3.44Å; A236-N320 PolarHBondContact N-OD1 2.84Å; V238-N320 WeakPolarHBondContact CG2-ND2 3.36Å; S239-N320 PolarHBondContact OG-ND2 3.25Å; T318-N320 WeakPolarHBondContact OG1-CB 3.41Å; T318-N320 PolarHBondContact OG1-N 3.34Å; T318-N320 VanDerWaalsContact OG1-N 3.08Å
321	I	92.8	Very high	96.1	Very high	13 Å²	13	30.2 Å²	30.2	7%	0.067	17%	0.169	C	C	.	.	S	Bend	trans	-123.3	-1.1	-178.3	54.6	171.1	0	0	0	112.3	F271 I290 H337 F340 I384	F271-I321 HydrophobicContact CE1-CD1 4.21Å; I290-I321 HydrophobicContact CD1-CD1 3.6Å; I290-I321 HydrophobicContact CD1-CG1 3.99Å; I321-H337 HydrophobicContact CG2-CB 4.26Å; I321-F340 HydrophobicContact CD1-CE2 4.02Å; I321-F340 HydrophobicContact CG1-CE2 4.39Å; I321-I384 HydrophobicContact CB-CD1 4.21Å; I321-I384 HydrophobicContact CB-CG1 4.22Å; I321-I384 HydrophobicContact CD1-CD1 3.86Å; I321-I384 HydrophobicContact CG2-CD1 4.42Å; I321-I384 HydrophobicContact CG2-CG1 4.01Å; I321-I384 HydrophobicContact CG2-CG2 3.96Å
322	D	90.7	Very high	96	Very high	11 Å²	11	33.2 Å²	33.2	6%	0.059	17%	0.17	C	C	.	.	S	Bend	trans	-79.6	-15	-174.6	58.5	38.8	0	0	0	114.1	S239 I244 L324	S239-D322 WeakPolarHBondContact CB-OD2 3.39Å; S239-D322 PolarHBondContact OG-OD2 3.11Å; I244-D322 HydrophobicContact CD1-CB 3.48Å; I244-D322 VanDerWaalsContact CD1-CB 3.48Å; D322-L324 VanDerWaalsContact C-N 3.28Å; D322-L324 HydrophobicContact CB-CG 4.38Å; D322-L324 PolarHBondContact O-N 2.88Å; D322-L324 WeakPolarHBondContact OD1-CB 3.4Å; D322-L324 PolarHBondContact OD1-N 2.94Å
323	T	91.5	Very high	96	Very high	13 Å²	13	33.1 Å²	33.1	8%	0.08	17%	0.17	C	C	.	.			trans	65.9	16.7	179.9	65.9	0	0	0	0	115.8	E325 Q326 V327	T323-E325 PolarHBondContact O-N 2.89Å; T323-Q326 WeakPolarHBondContact O-CB 3.45Å; T323-Q326 PolarHBondContact O-N 2.92Å; T323-V327 PolarHBondContact O-N 2.91Å
324	L	94.4	Very high	95.9	Very high	6 Å²	6	33.5 Å²	33.5	3%	0.031	17%	0.172	C	C	.	.	H	α-helix	trans	-64.5	-22.3	-178.6	-73.3	175.9	0	0	0	113.8	C242 I244 F295 P297 H301 D322 Q326 V327 A328	C242-L324 HydrophobicContact CB-CD1 3.79Å; I244-L324 HydrophobicContact CD1-CD1 3.86Å; F295-L324 HydrophobicContact CB-CD1 4.44Å; F295-L324 HydrophobicContact CB-CD2 4.03Å; P297-L324 HydrophobicContact CG-CD2 4.16Å; H301-L324 WeakPolarHBondContact NE2-CB 3.44Å; D322-L324 VanDerWaalsContact C-N 3.28Å; D322-L324 HydrophobicContact CB-CG 4.38Å; D322-L324 PolarHBondContact O-N 2.88Å; D322-L324 WeakPolarHBondContact OD1-CB 3.4Å; D322-L324 PolarHBondContact OD1-N 2.94Å; L324-Q326 VanDerWaalsContact C-N 3.35Å; L324-V327 PolarHBondContact O-N 2.67Å; L324-A328 WeakPolarHBondContact O-CB 3.42Å; L324-A328 PolarHBondContact O-N 3.31Å
325	E	95.6	Very high	95.9	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-62.5	-41.6	172	-52.5	81.3	175.9	0	0	111.5	T318 T323 A328 G329 V330 I333	T318-E325 WeakPolarHBondContact CB-OE1 3.4Å; T318-E325 HydrophobicContact CG2-CG 4.3Å; T318-E325 WeakPolarHBondContact CG2-OE1 3.39Å; T318-E325 PolarHBondContact OG1-OE1 3.15Å; T323-E325 PolarHBondContact O-N 2.89Å; E325-A328 PolarHBondContact O-N 3.11Å; E325-G329 PolarHBondContact O-N 3.19Å; E325-V330 HydrophobicContact CB-CB 4.44Å; E325-V330 HydrophobicContact CB-CG2 4.45Å; E325-V330 WeakPolarHBondContact O-CB 3.43Å; E325-V330 WeakPolarHBondContact O-CG2 3.38Å; E325-V330 PolarHBondContact O-N 2.85Å; E325-I333 HydrophobicContact CB-CD1 3.62Å; E325-I333 HydrophobicContact CB-CG1 3.99Å; E325-I333 HydrophobicContact CB-CG2 4.22Å; E325-I333 HydrophobicContact CG-CG2 4.44Å
326	Q	93.6	Very high	95.7	Very high	98 Å²	98	31.6 Å²	31.6	46%	0.458	17%	0.165	S	C	.	.	H	α-helix	trans	-67.8	-41.4	176.2	-58.9	-173.1	12.1	0	0	110.9	T323 L324 A328 G329 I333	T323-Q326 WeakPolarHBondContact O-CB 3.45Å; T323-Q326 PolarHBondContact O-N 2.92Å; L324-Q326 VanDerWaalsContact C-N 3.35Å; Q326-A328 VanDerWaalsContact C-N 3.26Å; Q326-A328 PolarHBondContact O-N 2.77Å; Q326-G329 WeakPolarHBondContact O-CA 3.26Å; Q326-G329 PolarHBondContact O-N 2.92Å; Q326-I333 HydrophobicContact CB-CD1 4.4Å; Q326-I333 HydrophobicContact CG-CD1 3.68Å
327	V	94.4	Very high	95.4	Very high	86 Å²	86	33.1 Å²	33.1	52%	0.521	17%	0.172	S	C	.	.	H	α-helix	trans	-66	-30.2	178	-177.2	0	0	0	0	111.5	P297 T323 L324 G329	P297-V327 HydrophobicContact CG-CB 3.81Å; P297-V327 HydrophobicContact CG-CG1 3.68Å; T323-V327 PolarHBondContact O-N 2.91Å; L324-V327 PolarHBondContact O-N 2.67Å; V327-G329 PolarHBondContact O-N 3.1Å
328	A	96.2	Very high	95.2	Very high	17 Å²	17	33.7 Å²	33.7	14%	0.14	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-8.3	170.8	0	0	0	0	0	113.7	P297 H301 S305 L324 E325 Q326 V330	P297-A328 HydrophobicContact CB-CB 3.84Å; P297-A328 HydrophobicContact CG-CB 4.02Å; H301-A328 HydrophobicContact CB-CB 3.79Å; S305-A328 VanDerWaalsContact CB-O 3.27Å; S305-A328 WeakPolarHBondContact CB-O 3.32Å; S305-A328 PolarHBondContact OG-O 2.9Å; L324-A328 WeakPolarHBondContact O-CB 3.42Å; L324-A328 PolarHBondContact O-N 3.31Å; E325-A328 PolarHBondContact O-N 3.11Å; Q326-A328 VanDerWaalsContact C-N 3.26Å; Q326-A328 PolarHBondContact O-N 2.77Å; A328-V330 HydrophobicContact CB-CG2 4.41Å
329	G	96.4	Very high	95	Very high	36 Å²	36	34.1 Å²	34.1	37%	0.371	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.9	23.9	-178.3	0	0	0	0	0	114.5	E325 Q326 V327	E325-G329 PolarHBondContact O-N 3.19Å; Q326-G329 WeakPolarHBondContact O-CA 3.26Å; Q326-G329 PolarHBondContact O-N 2.92Å; V327-G329 PolarHBondContact O-N 3.1Å
330	V	97.9	Very high	94.8	Very high	8 Å²	8	33.1 Å²	33.1	5%	0.048	18%	0.176	C	C	.	.			trans	-68.6	135.6	166.2	-170.9	0	0	0	0	107.9	I304 L313 N316 E325 A328 I333	I304-V330 HydrophobicContact CB-CG2 4.32Å; I304-V330 HydrophobicContact CG2-CG1 4Å; I304-V330 HydrophobicContact CG2-CG2 3.87Å; L313-V330 HydrophobicContact CD2-CG1 3.78Å; N316-V330 HydrophobicContact CB-CG1 4.46Å; E325-V330 HydrophobicContact CB-CB 4.44Å; E325-V330 HydrophobicContact CB-CG2 4.45Å; E325-V330 WeakPolarHBondContact O-CB 3.43Å; E325-V330 WeakPolarHBondContact O-CG2 3.38Å; E325-V330 PolarHBondContact O-N 2.85Å; A328-V330 HydrophobicContact CB-CG2 4.41Å; V330-I333 HydrophobicContact CB-CD1 4.05Å; V330-I333 HydrophobicContact CB-CG1 3.77Å; V330-I333 HydrophobicContact CG1-CD1 4.46Å; V330-I333 HydrophobicContact CG1-CG1 3.63Å; V330-I333 VanDerWaalsContact O-CD1 3.23Å; V330-I333 WeakPolarHBondContact O-CD1 3.48Å
331	Q	97.3	Very high	94.7	Very high	170 Å²	170	34.4 Å²	34.4	79%	0.794	19%	0.188	S	C	*	.			trans	-105.4	-38.1	-178.7	-58.2	-177.7	19.9	0	0	111.3	D308 I333	D308-Q331 WeakPolarHBondContact OD2-CA 3.45Å; D308-Q331 PolarHBondContact OD2-N 3.29Å; Q331-I333 PolarHBondContact O-N 2.9Å
332	R	97.6	Very high	94.8	Very high	96 Å²	96	35.1 Å²	35.1	36%	0.362	19%	0.193	S	C	.	.	S	Bend	trans	-85.2	46.1	-174.8	-59.8	176.1	-167.6	-159.1	-3.2	113	D308 L313 R315 N316	D308-R332 WeakPolarHBondContact OD1-CD 3.31Å; D308-R332 WeakPolarHBondContact OD1-CG 3.34Å; D308-R332 IonicContact OD1-CZ 3.3Å; D308-R332 IonicContact OD1-NE 3.29Å; D308-R332 PolarHBondContact OD1-NE 3.11Å; D308-R332 PolarHBondContact OD2-N 2.85Å; L313-R332 HydrophobicContact CD2-CB 4.21Å; L313-R332 WeakPolarHBondContact O-CD 3.17Å; L313-R332 PolarHBondContact O-NH1 2.91Å; R315-R332 CarbonylContact C-O 3.3Å; R315-R332 WeakPolarHBondContact CA-O 3.47Å; R315-R332 VanDerWaalsContact CD-O 3.26Å; R315-R332 WeakPolarHBondContact CD-O 3.41Å; R315-R332 WeakPolarHBondContact CG-O 3.33Å; N316-R332 PolarHBondContact N-O 2.79Å
333	I	97.5	Very high	95.1	Very high	29 Å²	29	34.6 Å²	34.6	15%	0.149	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	141.5	-175.9	-44.3	158.7	0	0	0	111.4	N316 T318 E325 Q326 V330 Q331 Q335	N316-I333 CarbonylContact O-C 3.54Å; N316-I333 WeakPolarHBondContact O-CA 3.27Å; T318-I333 HydrophobicContact CG2-CG2 3.89Å; E325-I333 HydrophobicContact CB-CD1 3.62Å; E325-I333 HydrophobicContact CB-CG1 3.99Å; E325-I333 HydrophobicContact CB-CG2 4.22Å; E325-I333 HydrophobicContact CG-CG2 4.44Å; Q326-I333 HydrophobicContact CB-CD1 4.4Å; Q326-I333 HydrophobicContact CG-CD1 3.68Å; V330-I333 HydrophobicContact CB-CD1 4.05Å; V330-I333 HydrophobicContact CB-CG1 3.77Å; V330-I333 HydrophobicContact CG1-CD1 4.46Å; V330-I333 HydrophobicContact CG1-CG1 3.63Å; V330-I333 VanDerWaalsContact O-CD1 3.23Å; V330-I333 WeakPolarHBondContact O-CD1 3.48Å; Q331-I333 PolarHBondContact O-N 2.9Å; I333-Q335 HydrophobicContact CG2-CG 3.94Å
334	I	97.6	Very high	95.4	Very high	8 Å²	8	35.1 Å²	35.1	4%	0.041	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	109.4	160.1	-60.7	-68.6	0	0	0	108.2	R315 N316 Y317 T318 C336 L394 F395 A398	R315-I334 HydrophobicContact CG-CB 4.44Å; R315-I334 HydrophobicContact CG-CG1 3.56Å; N316-I334 PolarHBondContact O-N 3.12Å; Y317-I334 WeakPolarHBondContact CA-O 3.32Å; Y317-I334 HydrophobicContact CD1-CB 3.73Å; Y317-I334 HydrophobicContact CD1-CG1 4.26Å; Y317-I334 HydrophobicContact CD1-CG2 3.7Å; Y317-I334 HydrophobicContact CE1-CB 3.84Å; Y317-I334 HydrophobicContact CE1-CG1 3.9Å; Y317-I334 HydrophobicContact CE1-CG2 3.72Å; Y317-I334 HydrophobicContact CG-CB 4.26Å; T318-I334 PolarHBondContact N-O 3.44Å; I334-C336 PolarHBondContact O-N 2.82Å; I334-L394 HydrophobicContact CD1-CD2 4.13Å; I334-L394 HydrophobicContact CD1-CG 3.88Å; I334-F395 HydrophobicContact CG2-CB 4.17Å; I334-F395 HydrophobicContact CG2-CD2 4.02Å; I334-A398 HydrophobicContact CD1-CB 3.62Å; I334-A398 HydrophobicContact CG1-CB 3.96Å
335	Q	96.8	Very high	95.5	Very high	39 Å²	39	34.9 Å²	34.9	18%	0.182	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	92	175.8	-70.5	163.8	-124.7	0	0	109.6	T318 I333 H337 G338 S339	T318-Q335 HydrophobicContact CG2-CB 4.2Å; T318-Q335 HydrophobicContact CG2-CG 3.66Å; I333-Q335 HydrophobicContact CG2-CG 3.94Å; Q335-H337 VanDerWaalsContact C-N 3.27Å; Q335-H337 PolarHBondContact O-N 3.45Å; Q335-G338 PolarHBondContact NE2-O 2.77Å; Q335-G338 PolarHBondContact O-N 2.77Å; Q335-G338 VanDerWaalsContact O-N 3.11Å; Q335-S339 PolarHBondContact NE2-OG 3.31Å
336	C	94.4	Very high	95.5	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-36.2	-169	-54.4	0	0	0	0	112.2	T318 I334 L391 P392 F395 V421	T318-C336 VanDerWaalsContact O-CB 3.31Å; T318-C336 WeakPolarHBondContact O-CB 3.38Å; T318-C336 PolarHBondContact O-N 2.78Å; T318-C336 PolarHBondContact O-SG 2.87Å; I334-C336 PolarHBondContact O-N 2.82Å; C336-L391 HydrophobicContact CB-CD2 4.27Å; C336-L391 WeakPolarHBondContact O-CD2 3.46Å; C336-L391 WeakPolarHBondContact O-CG 3.31Å; C336-P392 WeakPolarHBondContact O-CD 3.03Å; C336-F395 HydrophobicContact CB-CD2 4.07Å; C336-F395 HydrophobicContact CB-CE2 4.26Å; C336-V421 HydrophobicContact CB-CG2 3.62Å
337	H	93.4	Very high	95.7	Very high	33 Å²	33	34.6 Å²	34.6	15%	0.153	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	19.2	179	-51.9	149.2	0	0	0	113.1	Q319 I321 Q335 I384 V385	Q319-H337 PolarHBondContact NE2-CE1 2.96Å; Q319-H337 VanDerWaalsContact NE2-CE1 3.31Å; Q319-H337 PolarHBondContact O-ND1 2.87Å; I321-H337 HydrophobicContact CG2-CB 4.26Å; Q335-H337 VanDerWaalsContact C-N 3.27Å; Q335-H337 PolarHBondContact O-N 3.45Å; H337-I384 CarbonylContact O-C 3.52Å; H337-I384 VanDerWaalsContact O-CA 3.31Å; H337-I384 WeakPolarHBondContact O-CA 3.3Å; H337-V385 HydrophobicContact CB-CB 4.48Å; H337-V385 PolarHBondContact O-N 2.91Å
338	G	94	Very high	95.8	Very high	11 Å²	11	33.3 Å²	33.3	11%	0.113	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	74	-151.7	-179.3	0	0	0	0	0	113.6	Q335 D383	Q335-G338 PolarHBondContact NE2-O 2.77Å; Q335-G338 PolarHBondContact O-N 2.77Å; Q335-G338 VanDerWaalsContact O-N 3.11Å; G338-D383 CarbonylContact C-O 3.44Å; G338-D383 VanDerWaalsContact CA-O 3.24Å; G338-D383 WeakPolarHBondContact CA-O 3.45Å
339	S	93.4	Very high	95.8	Very high	9 Å²	9	39.4 Å²	39.4	6%	0.063	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.4	177.1	173.5	59.1	0	0	0	0	113.6	Q335 A341 D383	Q335-S339 PolarHBondContact NE2-OG 3.31Å; S339-A341 PolarHBondContact O-N 2.93Å; S339-A341 WeakPolarHBondContact OG-CB 3.33Å; S339-A341 PolarHBondContact OG-N 3.39Å; S339-D383 PolarHBondContact N-O 3.23Å; S339-D383 CarbonylContact O-C 3.54Å; S339-D383 PolarHBondContact O-N 2.83Å
340	F	91.5	Very high	95.9	Very high	1 Å²	1	40.9 Å²	40.9	0%	0.004	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	-10.9	168.2	-72.1	-76.7	0	0	0	115.9	F283 A287 I290 F291 P292 I321 T342 C354 P382 I384	F283-F340 AromaticContact CZ-CE1 3.96Å; F283-F340 HydrophobicContact CZ-CE1 3.96Å; F283-F340 HydrophobicContact CZ-CZ 4.07Å; A287-F340 HydrophobicContact CB-CE1 3.71Å; A287-F340 HydrophobicContact CB-CZ 3.87Å; I290-F340 HydrophobicContact CD1-CE2 3.53Å; I290-F340 HydrophobicContact CD1-CZ 4.08Å; I290-F340 HydrophobicContact CG1-CE2 3.79Å; I290-F340 HydrophobicContact CG1-CZ 4.11Å; F291-F340 HydrophobicContact CD2-CD1 4.33Å; F291-F340 HydrophobicContact CE2-CD1 4.31Å; P292-F340 HydrophobicContact CG-CB 3.78Å; P292-F340 HydrophobicContact CG-CG 4.45Å; I321-F340 HydrophobicContact CD1-CE2 4.02Å; I321-F340 HydrophobicContact CG1-CE2 4.39Å; F340-T342 PolarHBondContact O-N 3.42Å; F340-C354 WeakPolarHBondContact O-CB 3.37Å; F340-P382 HydrophobicContact CD1-CB 3.81Å; F340-P382 HydrophobicContact CD1-CG 3.87Å; F340-P382 HydrophobicContact CE1-CB 4.08Å; F340-P382 HydrophobicContact CE1-CG 3.87Å; F340-I384 HydrophobicContact CD1-CD1 4.16Å; F340-I384 HydrophobicContact CD2-CD1 3.94Å; F340-I384 HydrophobicContact CE1-CD1 3.86Å; F340-I384 HydrophobicContact CE2-CD1 3.61Å; F340-I384 HydrophobicContact CG-CD1 4.18Å; F340-I384 HydrophobicContact CZ-CD1 3.58Å
341	A	91.3	Very high	95.9	Very high	37 Å²	37	45.9 Å²	45.9	31%	0.306	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.8	-33.2	-169.5	0	0	0	0	0	114.2	S339 C354	S339-A341 PolarHBondContact O-N 2.93Å; S339-A341 WeakPolarHBondContact OG-CB 3.33Å; S339-A341 PolarHBondContact OG-N 3.39Å; A341-C354 WeakPolarHBondContact O-CB 3.48Å; A341-C354 PolarHBondContact O-N 2.61Å
342	T	94.6	Very high	95.9	Very high	28 Å²	28	38.7 Å²	38.7	17%	0.172	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	164.2	174.3	52.7	0	0	0	0	110.2	F340 K351 V352 D383	F340-T342 PolarHBondContact O-N 3.42Å; T342-K351 WeakPolarHBondContact OG1-CE 3.26Å; T342-K351 PolarHBondContact OG1-NZ 3.29Å; T342-V352 CarbonylContact C-O 3.53Å; T342-V352 VanDerWaalsContact CA-O 3.24Å; T342-V352 WeakPolarHBondContact CA-O 3.45Å; T342-V352 WeakPolarHBondContact CB-O 3.27Å; T342-D383 WeakPolarHBondContact CB-OD2 3.49Å; T342-D383 WeakPolarHBondContact O-CB 3.39Å; T342-D383 PolarHBondContact O-N 3.34Å; T342-D383 PolarHBondContact OG1-OD2 2.9Å
343	A	96.9	Very high	95.8	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	144.1	177.4	0	0	0	0	0	112	K351 V352 I357 K381	A343-K351 CarbonylContact O-C 3.54Å; A343-K351 VanDerWaalsContact O-CA 3.29Å; A343-K351 WeakPolarHBondContact O-CA 3.15Å; A343-V352 HydrophobicContact CB-CG2 4.26Å; A343-V352 PolarHBondContact N-O 2.62Å; A343-V352 PolarHBondContact O-N 3.42Å; A343-I357 HydrophobicContact CB-CD1 3.47Å; A343-I357 VanDerWaalsContact CB-CD1 3.47Å; A343-I357 HydrophobicContact CB-CG1 4.36Å; A343-K381 CarbonylContact C-O 3.56Å; A343-K381 WeakPolarHBondContact CA-O 3.27Å; A343-K381 WeakPolarHBondContact CB-O 3.21Å
344	S	97.7	Very high	95.4	Very high	25 Å²	25	39.6 Å²	39.6	18%	0.175	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	140.4	-176.7	-58.6	0	0	0	0	112.2	L346 Y350 K381 D383	S344-L346 PolarHBondContact O-N 2.91Å; S344-Y350 CarbonylContact C-O 3.58Å; S344-Y350 WeakPolarHBondContact CA-O 3.35Å; S344-K381 PolarHBondContact N-O 3.32Å; S344-K381 PolarHBondContact O-N 3.35Å; S344-D383 WeakPolarHBondContact CB-OD1 3.4Å; S344-D383 PolarHBondContact N-OD1 3.02Å; S344-D383 PolarHBondContact OG-OD1 3.07Å; S344-D383 PolarHBondContact OG-OD2 3.39Å
345	C	97.8	Very high	95.2	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	128.1	169.2	-179.2	0	0	0	0	110.4	V347 C348 K349 Y350 C369 I379 M380	C345-V347 PolarHBondContact O-N 3.45Å; C345-V347 VanDerWaalsContact O-N 3.16Å; C345-V347 PolarHBondContact SG-N 3.11Å; C345-V347 VanDerWaalsContact SG-N 3.44Å; C345-C348 VanDerWaalsContact SG-SG 3.66Å; C345-K349 VanDerWaalsContact O-CA 3.3Å; C345-K349 WeakPolarHBondContact O-CA 3.49Å; C345-K349 PolarHBondContact O-N 3.47Å; C345-K349 VanDerWaalsContact O-N 3.11Å; C345-Y350 PolarHBondContact N-O 3.01Å; C345-C369 HydrophobicContact CB-CB 3.89Å; C345-C369 VanDerWaalsContact CB-SG 3.59Å; C345-C369 WeakPolarHBondContact SG-CB 3.49Å; C345-C369 VanDerWaalsContact SG-SG 3.69Å; C345-I379 WeakPolarHBondContact CA-O 3.2Å; C345-M380 HydrophobicContact CB-SD 3.72Å
346	L	96	Very high	95.2	Very high	26 Å²	26	46.3 Å²	46.3	14%	0.136	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-39	175.9	-67.8	-178.7	0	0	0	112.7	I273 F276 R277 S344 K349 I379 K381	I273-L346 HydrophobicContact CD1-CD2 4.41Å; F276-L346 HydrophobicContact CD1-CD1 4.18Å; F276-L346 HydrophobicContact CE1-CD1 4.01Å; F276-L346 HydrophobicContact CE1-CD2 4.37Å; F276-L346 HydrophobicContact CE1-CG 4.46Å; R277-L346 HydrophobicContact CG-CD1 4.26Å; S344-L346 PolarHBondContact O-N 2.91Å; L346-K349 PolarHBondContact O-NZ 3.13Å; L346-I379 HydrophobicContact CD1-CB 4.29Å; L346-I379 HydrophobicContact CD1-CD1 4.4Å; L346-I379 PolarHBondContact N-O 3.11Å; L346-I379 VanDerWaalsContact N-O 3.07Å; L346-K381 HydrophobicContact CD2-CB 3.81Å; L346-K381 HydrophobicContact CD2-CD 3.73Å; L346-K381 HydrophobicContact CD2-CG 4.38Å; L346-K381 HydrophobicContact CG-CB 4.34Å
347	V	96.6	Very high	95.2	Very high	68 Å²	68	46.6 Å²	46.6	41%	0.412	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-69.7	-172.8	-177.7	0	0	0	0	111.9	C345 I375 L377 A378	C345-V347 PolarHBondContact O-N 3.45Å; C345-V347 VanDerWaalsContact O-N 3.16Å; C345-V347 PolarHBondContact SG-N 3.11Å; C345-V347 VanDerWaalsContact SG-N 3.44Å; V347-I375 HydrophobicContact CG1-CD1 4.4Å; V347-I375 HydrophobicContact CG2-CG2 4.09Å; V347-L377 HydrophobicContact CG2-CB 4.21Å; V347-A378 HydrophobicContact CG2-CB 4.49Å
348	C	96.7	Very high	95.2	Very high	58 Å²	58	47.7 Å²	47.7	39%	0.392	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	1.5	-171.3	66.4	0	0	0	0	114.7	C345 Y350 C369 C372	C345-C348 VanDerWaalsContact SG-SG 3.66Å; C348-Y350 PolarHBondContact O-N 3.47Å; C348-Y350 VanDerWaalsContact SG-CB 3.56Å; C348-C369 VanDerWaalsContact SG-SG 3.7Å; C348-C372 PolarHBondContact SG-SG 3.11Å
349	K	96.9	Very high	95.3	Very high	145 Å²	145	50 Å²	50	63%	0.63	28%	0.278	S	S	*	.			trans	53.4	19.5	-174.9	-49.4	-51.5	-173.8	-167.8	0	114.8	C345 L346 K351	C345-K349 VanDerWaalsContact O-CA 3.3Å; C345-K349 WeakPolarHBondContact O-CA 3.49Å; C345-K349 PolarHBondContact O-N 3.47Å; C345-K349 VanDerWaalsContact O-N 3.11Å; L346-K349 PolarHBondContact O-NZ 3.13Å; K349-K351 PolarHBondContact O-N 3.09Å
350	Y	97.4	Very high	95.4	Very high	68 Å²	68	52.3 Å²	52.3	27%	0.267	29%	0.29	S	S	.	.			trans	-61.6	126.4	169.7	175.7	-128.5	0	0	0	109.6	S344 C345 C348 V352 P370 R371 M380	S344-Y350 CarbonylContact C-O 3.58Å; S344-Y350 WeakPolarHBondContact CA-O 3.35Å; C345-Y350 PolarHBondContact N-O 3.01Å; C348-Y350 PolarHBondContact O-N 3.47Å; C348-Y350 VanDerWaalsContact SG-CB 3.56Å; Y350-V352 HydrophobicContact CD1-CG1 4.31Å; Y350-V352 HydrophobicContact CE1-CG1 3.63Å; Y350-V352 HydrophobicContact CE2-CG1 4.49Å; Y350-P370 HydrophobicContact CD1-CG 4.36Å; Y350-P370 HydrophobicContact CE1-CG 3.86Å; Y350-R371 HydrophobicContact CD1-CG 3.85Å; Y350-R371 HydrophobicContact CE1-CG 4.2Å; Y350-R371 HydrophobicContact CG-CG 4.2Å; Y350-M380 WeakPolarHBondContact O-CE 3.37Å
351	K	97.9	Very high	95.6	Very high	112 Å²	112	52.3 Å²	52.3	49%	0.487	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	142.6	-172.3	-174.7	-178.9	172.6	94.5	0	110.8	T342 A343 K349 D383	T342-K351 WeakPolarHBondContact OG1-CE 3.26Å; T342-K351 PolarHBondContact OG1-NZ 3.29Å; A343-K351 CarbonylContact O-C 3.54Å; A343-K351 VanDerWaalsContact O-CA 3.29Å; A343-K351 WeakPolarHBondContact O-CA 3.15Å; K349-K351 PolarHBondContact O-N 3.09Å; K351-D383 IonicContact NZ-OD2 3.67Å; K351-D383 PolarHBondContact NZ-OD2 3.03Å
352	V	97.1	Very high	95.6	Very high	19 Å²	19	53 Å²	53	12%	0.115	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	161.7	176.9	-57.4	0	0	0	0	110.5	T342 A343 Y350 A356 I357 M380	T342-V352 CarbonylContact C-O 3.53Å; T342-V352 VanDerWaalsContact CA-O 3.24Å; T342-V352 WeakPolarHBondContact CA-O 3.45Å; T342-V352 WeakPolarHBondContact CB-O 3.27Å; A343-V352 HydrophobicContact CB-CG2 4.26Å; A343-V352 PolarHBondContact N-O 2.62Å; A343-V352 PolarHBondContact O-N 3.42Å; Y350-V352 HydrophobicContact CD1-CG1 4.31Å; Y350-V352 HydrophobicContact CE1-CG1 3.63Å; Y350-V352 HydrophobicContact CE2-CG1 4.49Å; V352-A356 HydrophobicContact CB-CB 3.92Å; V352-A356 HydrophobicContact CG2-CB 3.96Å; V352-I357 HydrophobicContact CG2-CG2 4.11Å; V352-M380 HydrophobicContact CB-CE 4.31Å; V352-M380 HydrophobicContact CG1-CE 3.89Å; V352-M380 HydrophobicContact CG2-CE 3.57Å
353	D	95.7	Very high	95.6	Very high	112 Å²	112	57.5 Å²	57.5	60%	0.599	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.2	158.4	172.4	-52.7	-70.3	0	0	0	112.1	E355 A356	D353-E355 PolarHBondContact O-N 2.65Å; D353-E355 VanDerWaalsContact O-N 3.14Å; D353-A356 WeakPolarHBondContact O-CB 3.32Å; D353-A356 PolarHBondContact O-N 2.96Å; D353-A356 VanDerWaalsContact O-N 3.09Å
354	C	90.4	Very high	95.5	Very high	32 Å²	32	61.4 Å²	61.4	22%	0.216	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-39.6	-177.2	67.6	0	0	0	0	113.9	F291 F340 A341 A356 I357 R358	F291-C354 HydrophobicContact CZ-CB 4.25Å; F340-C354 WeakPolarHBondContact O-CB 3.37Å; A341-C354 WeakPolarHBondContact O-CB 3.48Å; A341-C354 PolarHBondContact O-N 2.61Å; C354-A356 VanDerWaalsContact C-N 3.26Å; C354-A356 PolarHBondContact O-N 3.29Å; C354-I357 VanDerWaalsContact O-CG1 3.31Å; C354-I357 WeakPolarHBondContact O-CG1 3.46Å; C354-I357 PolarHBondContact O-N 3.42Å; C354-R358 PolarHBondContact O-N 3.26Å
355	E	92.9	Very high	95.4	Very high	118 Å²	118	63.9 Å²	63.9	55%	0.551	34%	0.343	S	S	*	.	H	α-helix	trans	-64.6	-31	-175.5	-164.6	58.1	-149.8	0	0	112.1	D353 I357 R358	D353-E355 PolarHBondContact O-N 2.65Å; D353-E355 VanDerWaalsContact O-N 3.14Å; E355-I357 PolarHBondContact O-N 2.55Å; E355-R358 WeakPolarHBondContact O-CB 3.43Å; E355-R358 PolarHBondContact O-N 2.77Å; E355-R358 WeakPolarHBondContact OE1-CD 3.43Å; E355-R358 WeakPolarHBondContact OE2-CD 3.44Å; E355-R358 IonicContact OE2-NH1 2.67Å
356	A	95.7	Very high	95.3	Very high	70 Å²	70	65.6 Å²	65.6	58%	0.579	35%	0.354	S	S	*	.	H	α-helix	trans	-66.4	-17.7	179.5	0	0	0	0	0	113.7	V352 D353 C354	V352-A356 HydrophobicContact CB-CB 3.92Å; V352-A356 HydrophobicContact CG2-CB 3.96Å; D353-A356 WeakPolarHBondContact O-CB 3.32Å; D353-A356 PolarHBondContact O-N 2.96Å; D353-A356 VanDerWaalsContact O-N 3.09Å; C354-A356 VanDerWaalsContact C-N 3.26Å; C354-A356 PolarHBondContact O-N 3.29Å
357	I	95.1	Very high	95.3	Very high	6 Å²	6	64.4 Å²	64.4	3%	0.031	35%	0.347	C	S	.	.	H	α-helix	trans	-115.6	0.2	174.8	64	166.9	0	0	0	113.4	A343 V352 C354 E355 A359 D360 I361 P367 M380 P382	A343-I357 HydrophobicContact CB-CD1 3.47Å; A343-I357 VanDerWaalsContact CB-CD1 3.47Å; A343-I357 HydrophobicContact CB-CG1 4.36Å; V352-I357 HydrophobicContact CG2-CG2 4.11Å; C354-I357 VanDerWaalsContact O-CG1 3.31Å; C354-I357 WeakPolarHBondContact O-CG1 3.46Å; C354-I357 PolarHBondContact O-N 3.42Å; E355-I357 PolarHBondContact O-N 2.55Å; I357-A359 PolarHBondContact O-N 3.26Å; I357-D360 PolarHBondContact O-N 3.34Å; I357-I361 HydrophobicContact CD1-CD1 3.76Å; I357-I361 HydrophobicContact CG1-CD1 4.08Å; I357-I361 WeakPolarHBondContact O-CG1 3.3Å; I357-I361 PolarHBondContact O-N 2.8Å; I357-P367 HydrophobicContact CB-CB 3.92Å; I357-P367 HydrophobicContact CB-CG 4.23Å; I357-P367 HydrophobicContact CG2-CB 3.78Å; I357-P367 HydrophobicContact CG2-CG 4.36Å; I357-M380 HydrophobicContact CG2-CB 3.98Å; I357-M380 HydrophobicContact CG2-CG 4.42Å; I357-P382 HydrophobicContact CD1-CG 4.09Å
358	R	94.2	Very high	95.3	Very high	56 Å²	56	69.7 Å²	69.7	21%	0.211	36%	0.36	C	S	.	.	H	α-helix	trans	-58.6	-46.7	-178.1	-179.4	179.4	-167.4	104.3	13.1	111.8	F291 P292 C354 E355 D360 I361 L362	F291-R358 HydrophobicContact CD1-CG 4.14Å; F291-R358 HydrophobicContact CE1-CB 3.84Å; F291-R358 HydrophobicContact CE1-CG 3.61Å; F291-R358 HydrophobicContact CZ-CB 3.87Å; F291-R358 HydrophobicContact CZ-CG 4.11Å; P292-R358 PolarHBondContact O-NH1 3.44Å; P292-R358 PolarHBondContact O-NH2 3.03Å; C354-R358 PolarHBondContact O-N 3.26Å; E355-R358 WeakPolarHBondContact O-CB 3.43Å; E355-R358 PolarHBondContact O-N 2.77Å; E355-R358 WeakPolarHBondContact OE1-CD 3.43Å; E355-R358 WeakPolarHBondContact OE2-CD 3.44Å; E355-R358 IonicContact OE2-NH1 2.67Å; R358-D360 VanDerWaalsContact C-N 3.35Å; R358-D360 PolarHBondContact O-N 3.07Å; R358-I361 PolarHBondContact O-N 3.14Å; R358-L362 HydrophobicContact CG-CD1 3.7Å; R358-L362 HydrophobicContact CG-CG 4.14Å; R358-L362 WeakPolarHBondContact O-CB 3.22Å; R358-L362 VanDerWaalsContact O-CG 3.3Å; R358-L362 WeakPolarHBondContact O-CG 3.46Å; R358-L362 PolarHBondContact O-N 3.4Å
359	A	95.2	Very high	95.3	Very high	60 Å²	60	67.3 Å²	67.3	50%	0.496	34%	0.344	S	S	.	.	H	α-helix	trans	-60.1	-44.3	-177.8	0	0	0	0	0	111.9	I357 N363	I357-A359 PolarHBondContact O-N 3.26Å; A359-N363 VanDerWaalsContact O-CB 3.26Å; A359-N363 WeakPolarHBondContact O-CB 3.16Å; A359-N363 VanDerWaalsContact O-CG 3.27Å; A359-N363 PolarHBondContact O-N 3.47Å; A359-N363 PolarHBondContact O-ND2 3.21Å
360	D	96.2	Very high	95.2	Very high	58 Å²	58	65.2 Å²	65.2	31%	0.31	35%	0.345	S	S	.	.	H	α-helix	trans	-63.1	-50.4	178.8	-70	-11.9	0	0	0	110.9	I357 R358 L362 N363 Q364 V365 P367	I357-D360 PolarHBondContact O-N 3.34Å; R358-D360 VanDerWaalsContact C-N 3.35Å; R358-D360 PolarHBondContact O-N 3.07Å; D360-L362 PolarHBondContact O-N 3.31Å; D360-N363 CarbonylContact O-C 3.41Å; D360-N363 PolarHBondContact O-N 3.04Å; D360-Q364 PolarHBondContact O-N 2.86Å; D360-V365 CarbonylContact C-O 3.35Å; D360-V365 HydrophobicContact CB-CB 4.22Å; D360-V365 PolarHBondContact O-N 3.1Å; D360-P367 HydrophobicContact CB-CB 3.88Å; D360-P367 VanDerWaalsContact OD2-CA 3.32Å; D360-P367 WeakPolarHBondContact OD2-CA 3.47Å; D360-P367 WeakPolarHBondContact OD2-CB 3.47Å
361	I	94.4	Very high	95.1	Very high	0 Å²	0	70.1 Å²	70.1	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-60.3	-47.6	-179.3	-68.3	176	0	0	0	111.7	F284 A287 K288 F291 I357 R358 N363 Q364 P367	F284-I361 HydrophobicContact CD1-CD1 4.05Å; F284-I361 HydrophobicContact CD1-CG1 3.81Å; F284-I361 HydrophobicContact CE1-CD1 4.01Å; F284-I361 HydrophobicContact CE1-CG1 4.1Å; A287-I361 HydrophobicContact CB-CG2 4.18Å; K288-I361 HydrophobicContact CB-CG2 4.07Å; F291-I361 HydrophobicContact CD2-CD1 4.18Å; F291-I361 HydrophobicContact CD2-CG2 4.09Å; F291-I361 HydrophobicContact CE2-CD1 3.78Å; I357-I361 HydrophobicContact CD1-CD1 3.76Å; I357-I361 HydrophobicContact CG1-CD1 4.08Å; I357-I361 WeakPolarHBondContact O-CG1 3.3Å; I357-I361 PolarHBondContact O-N 2.8Å; R358-I361 PolarHBondContact O-N 3.14Å; I361-N363 VanDerWaalsContact C-N 3.29Å; I361-N363 PolarHBondContact O-N 2.91Å; I361-Q364 PolarHBondContact O-N 3.09Å; I361-Q364 PolarHBondContact O-NE2 2.81Å; I361-P367 HydrophobicContact CG1-CG 4.46Å
362	L	92.7	Very high	95	Very high	52 Å²	52	65.8 Å²	65.8	27%	0.272	35%	0.347	S	S	.	.	H	α-helix	trans	-64.6	-34.3	179.3	-66.9	-178.1	0	0	0	112.1	K288 R358 D360 Q364	K288-L362 WeakPolarHBondContact CE-O 3.37Å; K288-L362 HydrophobicContact CG-CD2 4.14Å; K288-L362 PolarHBondContact NZ-O 2.93Å; R358-L362 HydrophobicContact CG-CD1 3.7Å; R358-L362 HydrophobicContact CG-CG 4.14Å; R358-L362 WeakPolarHBondContact O-CB 3.22Å; R358-L362 VanDerWaalsContact O-CG 3.3Å; R358-L362 WeakPolarHBondContact O-CG 3.46Å; R358-L362 PolarHBondContact O-N 3.4Å; D360-L362 PolarHBondContact O-N 3.31Å; L362-Q364 VanDerWaalsContact C-N 3.28Å; L362-Q364 PolarHBondContact O-N 3.5Å
363	N	95.1	Very high	94.3	Very high	122 Å²	122	69 Å²	69	65%	0.652	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	1.7	174.1	-68.6	-42.5	0	0	0	114	A359 D360 I361 V365	A359-N363 VanDerWaalsContact O-CB 3.26Å; A359-N363 WeakPolarHBondContact O-CB 3.16Å; A359-N363 VanDerWaalsContact O-CG 3.27Å; A359-N363 PolarHBondContact O-N 3.47Å; A359-N363 PolarHBondContact O-ND2 3.21Å; D360-N363 CarbonylContact O-C 3.41Å; D360-N363 PolarHBondContact O-N 3.04Å; I361-N363 VanDerWaalsContact C-N 3.29Å; I361-N363 PolarHBondContact O-N 2.91Å; N363-V365 HydrophobicContact CB-CG2 4.31Å; N363-V365 PolarHBondContact O-N 2.95Å
364	Q	93.3	Very high	93.8	Very high	83 Å²	83	71.4 Å²	71.4	39%	0.388	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.3	30.2	-179	-60.1	-75.3	-91.2	0	0	114.2	F284 K285 K288 D360 I361 L362	F284-Q364 PolarHBondContact O-NE2 2.7Å; K285-Q364 VanDerWaalsContact CA-OE1 3.29Å; K288-Q364 HydrophobicContact CD-CG 4.02Å; D360-Q364 PolarHBondContact O-N 2.86Å; I361-Q364 PolarHBondContact O-N 3.09Å; I361-Q364 PolarHBondContact O-NE2 2.81Å; L362-Q364 VanDerWaalsContact C-N 3.28Å; L362-Q364 PolarHBondContact O-N 3.5Å
365	V	95.5	Very high	93.9	Very high	76 Å²	76	73.5 Å²	73.5	46%	0.461	39%	0.391	S	S	.	.			trans	-93.7	139.5	168.8	-178.9	0	0	0	0	108.4	D360 N363 P367	D360-V365 CarbonylContact C-O 3.35Å; D360-V365 HydrophobicContact CB-CB 4.22Å; D360-V365 PolarHBondContact O-N 3.1Å; N363-V365 HydrophobicContact CB-CG2 4.31Å; N363-V365 PolarHBondContact O-N 2.95Å; V365-P367 VanDerWaalsContact O-CD 3.31Å; V365-P367 WeakPolarHBondContact O-CD 3.36Å
366	V	95.8	Very high	93.8	Very high	37 Å²	37	73.1 Å²	73.1	22%	0.224	40%	0.399	C	S	.	.			trans	-75.8	114.7	174.3	175.6	0	0	0	0	108.7	P280 R281 F284 R368 I379	P280-V366 HydrophobicContact CG-CG1 3.88Å; P280-V366 HydrophobicContact CG-CG2 4.12Å; R281-V366 HydrophobicContact CG-CG2 4.28Å; F284-V366 HydrophobicContact CD2-CB 4.4Å; F284-V366 HydrophobicContact CD2-CG1 4.03Å; F284-V366 HydrophobicContact CD2-CG2 4.11Å; F284-V366 HydrophobicContact CE2-CG1 3.85Å; V366-R368 PolarHBondContact O-N 2.84Å; V366-I379 HydrophobicContact CG1-CG1 4.04Å; V366-I379 HydrophobicContact CG1-CG2 3.9Å
367	P	96.4	Very high	93.6	Very high	0 Å²	0	73.6 Å²	73.6	0%	0	39%	0.391	C	S	.	.			trans	-66.6	128.3	-175.6	26.7	-35.2	0	0	0	111.4	F284 I357 D360 I361 V365 M380	F284-P367 HydrophobicContact CD1-CG 4.44Å; F284-P367 HydrophobicContact CE1-CG 3.7Å; F284-P367 HydrophobicContact CE2-CG 4.4Å; F284-P367 HydrophobicContact CZ-CG 3.67Å; I357-P367 HydrophobicContact CB-CB 3.92Å; I357-P367 HydrophobicContact CB-CG 4.23Å; I357-P367 HydrophobicContact CG2-CB 3.78Å; I357-P367 HydrophobicContact CG2-CG 4.36Å; D360-P367 HydrophobicContact CB-CB 3.88Å; D360-P367 VanDerWaalsContact OD2-CA 3.32Å; D360-P367 WeakPolarHBondContact OD2-CA 3.47Å; D360-P367 WeakPolarHBondContact OD2-CB 3.47Å; I361-P367 HydrophobicContact CG1-CG 4.46Å; V365-P367 VanDerWaalsContact O-CD 3.31Å; V365-P367 WeakPolarHBondContact O-CD 3.36Å; P367-M380 HydrophobicContact CB-CB 4.16Å; P367-M380 HydrophobicContact CG-CB 4.32Å; P367-M380 PolarHBondContact O-N 3.36Å
368	R	96.3	Very high	93.7	Very high	179 Å²	179	73.5 Å²	73.5	68%	0.675	39%	0.391	S	S	*	.	B	Isolated β-bridge	trans	-107.4	152.7	-177.6	-68.8	-170.6	177.3	-166.2	-1.4	112	V366 P370 A378	V366-R368 PolarHBondContact O-N 2.84Å; R368-P370 WeakPolarHBondContact O-CD 3.42Å; R368-A378 CarbonylContact C-O 3.58Å; R368-A378 WeakPolarHBondContact CA-O 3.32Å
369	C	97.1	Very high	93.8	Very high	8 Å²	8	71.2 Å²	71.2	5%	0.054	38%	0.384	C	S	.	.			trans	-75.8	122.2	-178.1	-173.8	0	0	0	0	111.7	C345 C348 R371 C372 A378 M380	C345-C369 HydrophobicContact CB-CB 3.89Å; C345-C369 VanDerWaalsContact CB-SG 3.59Å; C345-C369 WeakPolarHBondContact SG-CB 3.49Å; C345-C369 VanDerWaalsContact SG-SG 3.69Å; C348-C369 VanDerWaalsContact SG-SG 3.7Å; C369-R371 PolarHBondContact O-N 3.46Å; C369-C372 HydrophobicContact CB-CB 4.25Å; C369-C372 PolarHBondContact O-N 3.08Å; C369-A378 HydrophobicContact CB-CB 4.14Å; C369-A378 WeakPolarHBondContact CB-O 3.28Å; C369-A378 PolarHBondContact N-O 3.01Å; C369-M380 HydrophobicContact CB-CG 4.42Å; C369-M380 HydrophobicContact CB-SD 3.63Å
370	P	94.6	Very high	94	Very high	101 Å²	101	68.5 Å²	68.5	66%	0.656	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-2.6	179.6	30.8	-37.4	0	0	0	114	Y350 R368	Y350-P370 HydrophobicContact CD1-CG 4.36Å; Y350-P370 HydrophobicContact CE1-CG 3.86Å; R368-P370 WeakPolarHBondContact O-CD 3.42Å
371	R	95.4	Very high	94	Very high	171 Å²	171	66.3 Å²	66.3	65%	0.645	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	-10.7	177.1	-61.3	-169.9	-178.3	-168	-1.6	114.2	Y350 C369	Y350-R371 HydrophobicContact CD1-CG 3.85Å; Y350-R371 HydrophobicContact CE1-CG 4.2Å; Y350-R371 HydrophobicContact CG-CG 4.2Å; C369-R371 PolarHBondContact O-N 3.46Å
372	C	94.9	Very high	94.1	Very high	21 Å²	21	66.3 Å²	66.3	14%	0.142	35%	0.348	C	S	.	.	S	Bend	trans	-128.9	66.3	-175.1	-72.3	0	0	0	0	110.2	C348 C369 I375 A378	C348-C372 PolarHBondContact SG-SG 3.11Å; C369-C372 HydrophobicContact CB-CB 4.25Å; C369-C372 PolarHBondContact O-N 3.08Å; C372-I375 HydrophobicContact CB-CD1 4.3Å; C372-A378 HydrophobicContact CB-CB 3.54Å; C372-A378 WeakPolarHBondContact O-CB 3.36Å
373	S	83.1	Confident	94.2	Very high	88 Å²	88	65.8 Å²	65.8	62%	0.615	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	147	169.5	-51.3	0	0	0	0	111.3	I375	S373-I375 PolarHBondContact O-N 3.47Å
374	D	85.2	Confident	94.2	Very high	162 Å²	162	60.2 Å²	60.2	87%	0.866	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.9	1.6	167.3	-46.7	-48.5	0	0	0	117.5	P376	D374-P376 WeakPolarHBondContact O-CD 3.24Å
375	I	93.2	Very high	94.1	Very high	76 Å²	76	57.6 Å²	57.6	39%	0.39	31%	0.305	S	S	.	.			trans	-90.4	116.5	170.7	-59	177.4	0	0	0	109.4	V347 C372 S373 L377 A378	V347-I375 HydrophobicContact CG1-CD1 4.4Å; V347-I375 HydrophobicContact CG2-CG2 4.09Å; C372-I375 HydrophobicContact CB-CD1 4.3Å; S373-I375 PolarHBondContact O-N 3.47Å; I375-L377 VanDerWaalsContact C-N 3.29Å; I375-L377 PolarHBondContact O-N 3.3Å; I375-A378 HydrophobicContact CB-CB 3.99Å; I375-A378 HydrophobicContact CG2-CB 4.32Å; I375-A378 VanDerWaalsContact O-CB 3.25Å; I375-A378 WeakPolarHBondContact O-CB 3.43Å; I375-A378 PolarHBondContact O-N 2.89Å
376	P	89.6	Confident	93.9	Very high	110 Å²	110	54.1 Å²	54.1	71%	0.714	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-34.6	-175.9	-27.2	36.1	0	0	0	114.7	D374 A378	D374-P376 WeakPolarHBondContact O-CD 3.24Å; P376-A378 VanDerWaalsContact C-N 3.28Å; P376-A378 PolarHBondContact O-N 3.07Å
377	L	93.5	Very high	93.3	Very high	79 Å²	79	56 Å²	56	41%	0.414	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	2.9	177.8	-71.1	173.1	0	0	0	114	R277 V347 I375 I379	R277-L377 HydrophobicContact CB-CD2 3.89Å; R277-L377 HydrophobicContact CG-CD2 4.23Å; R277-L377 WeakPolarHBondContact O-CD2 3.31Å; V347-L377 HydrophobicContact CG2-CB 4.21Å; I375-L377 VanDerWaalsContact C-N 3.29Å; I375-L377 PolarHBondContact O-N 3.3Å; L377-I379 PolarHBondContact O-N 3.2Å
378	A	96.4	Very high	92.6	Very high	4 Å²	4	59.7 Å²	59.7	3%	0.033	33%	0.327	C	S	.	.			trans	-77.1	54.2	178.1	0	0	0	0	0	112.7	V347 R368 C369 C372 I375 P376	V347-A378 HydrophobicContact CG2-CB 4.49Å; R368-A378 CarbonylContact C-O 3.58Å; R368-A378 WeakPolarHBondContact CA-O 3.32Å; C369-A378 HydrophobicContact CB-CB 4.14Å; C369-A378 WeakPolarHBondContact CB-O 3.28Å; C369-A378 PolarHBondContact N-O 3.01Å; C372-A378 HydrophobicContact CB-CB 3.54Å; C372-A378 WeakPolarHBondContact O-CB 3.36Å; I375-A378 HydrophobicContact CB-CB 3.99Å; I375-A378 HydrophobicContact CG2-CB 4.32Å; I375-A378 VanDerWaalsContact O-CB 3.25Å; I375-A378 WeakPolarHBondContact O-CB 3.43Å; I375-A378 PolarHBondContact O-N 2.89Å; P376-A378 VanDerWaalsContact C-N 3.28Å; P376-A378 PolarHBondContact O-N 3.07Å
379	I	97.1	Very high	92	Very high	9 Å²	9	54.3 Å²	54.3	5%	0.046	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-87.2	141.4	177.5	-61.8	152.5	0	0	0	109	F276 P280 F284 C345 L346 V366 L377 K381	F276-I379 HydrophobicContact CE1-CG2 4.01Å; F276-I379 HydrophobicContact CZ-CG2 3.87Å; P280-I379 HydrophobicContact CB-CD1 4.3Å; P280-I379 HydrophobicContact CG-CD1 3.87Å; F284-I379 HydrophobicContact CE2-CG2 3.77Å; F284-I379 HydrophobicContact CZ-CG2 4.05Å; C345-I379 WeakPolarHBondContact CA-O 3.2Å; L346-I379 HydrophobicContact CD1-CB 4.29Å; L346-I379 HydrophobicContact CD1-CD1 4.4Å; L346-I379 PolarHBondContact N-O 3.11Å; L346-I379 VanDerWaalsContact N-O 3.07Å; V366-I379 HydrophobicContact CG1-CG1 4.04Å; V366-I379 HydrophobicContact CG1-CG2 3.9Å; L377-I379 PolarHBondContact O-N 3.2Å; I379-K381 PolarHBondContact O-N 3.25Å
380	M	97.6	Very high	91.3	Very high	3 Å²	3	61.1 Å²	61.1	2%	0.015	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	92.6	170.5	-60.8	-59.9	-66.3	0	0	109	C345 Y350 V352 I357 P367 C369	C345-M380 HydrophobicContact CB-SD 3.72Å; Y350-M380 WeakPolarHBondContact O-CE 3.37Å; V352-M380 HydrophobicContact CB-CE 4.31Å; V352-M380 HydrophobicContact CG1-CE 3.89Å; V352-M380 HydrophobicContact CG2-CE 3.57Å; I357-M380 HydrophobicContact CG2-CB 3.98Å; I357-M380 HydrophobicContact CG2-CG 4.42Å; P367-M380 HydrophobicContact CB-CB 4.16Å; P367-M380 HydrophobicContact CG-CB 4.32Å; P367-M380 PolarHBondContact O-N 3.36Å; C369-M380 HydrophobicContact CB-CG 4.42Å; C369-M380 HydrophobicContact CB-SD 3.63Å
381	K	96.9	Very high	90.9	Very high	11 Å²	11	57.5 Å²	57.5	5%	0.048	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	127.1	177	176.1	170	170.9	-83.6	0	108.8	I273 F276 A343 S344 L346 I379 I384 E389	I273-K381 HydrophobicContact CD1-CD 3.87Å; F276-K381 HydrophobicContact CD1-CD 3.99Å; F276-K381 HydrophobicContact CE1-CB 3.82Å; F276-K381 HydrophobicContact CE1-CD 3.82Å; F276-K381 HydrophobicContact CE1-CG 3.96Å; F276-K381 HydrophobicContact CZ-CB 4.05Å; F276-K381 HydrophobicContact CZ-CD 4.37Å; F276-K381 HydrophobicContact CZ-CG 4.11Å; A343-K381 CarbonylContact C-O 3.56Å; A343-K381 WeakPolarHBondContact CA-O 3.27Å; A343-K381 WeakPolarHBondContact CB-O 3.21Å; S344-K381 PolarHBondContact N-O 3.32Å; S344-K381 PolarHBondContact O-N 3.35Å; L346-K381 HydrophobicContact CD2-CB 3.81Å; L346-K381 HydrophobicContact CD2-CD 3.73Å; L346-K381 HydrophobicContact CD2-CG 4.38Å; L346-K381 HydrophobicContact CG-CB 4.34Å; I379-K381 PolarHBondContact O-N 3.25Å; K381-I384 PolarHBondContact NZ-O 2.67Å; K381-E389 IonicContact NZ-OE1 3.56Å; K381-E389 PolarHBondContact NZ-OE1 2.9Å; K381-E389 IonicContact NZ-OE2 2.75Å; K381-E389 PolarHBondContact NZ-OE2 3.42Å
382	P	96.4	Very high	90.7	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.2	147	168.3	-26.1	36	0	0	0	111.2	F283 F284 F340 I357 I384	F283-P382 HydrophobicContact CE1-CG 3.86Å; F283-P382 HydrophobicContact CZ-CG 4.03Å; F284-P382 HydrophobicContact CE1-CG 4.36Å; F340-P382 HydrophobicContact CD1-CB 3.81Å; F340-P382 HydrophobicContact CD1-CG 3.87Å; F340-P382 HydrophobicContact CE1-CB 4.08Å; F340-P382 HydrophobicContact CE1-CG 3.87Å; I357-P382 HydrophobicContact CD1-CG 4.09Å; P382-I384 HydrophobicContact CB-CD1 4.11Å; P382-I384 HydrophobicContact CB-CG1 4.42Å; P382-I384 PolarHBondContact O-N 3.44Å
383	D	95.5	Very high	90.4	Very high	42 Å²	42	56.9 Å²	56.9	23%	0.225	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	55	-175.4	-64.4	-31.9	0	0	0	111.8	G338 S339 T342 S344 K351	G338-D383 CarbonylContact C-O 3.44Å; G338-D383 VanDerWaalsContact CA-O 3.24Å; G338-D383 WeakPolarHBondContact CA-O 3.45Å; S339-D383 PolarHBondContact N-O 3.23Å; S339-D383 CarbonylContact O-C 3.54Å; S339-D383 PolarHBondContact O-N 2.83Å; T342-D383 WeakPolarHBondContact CB-OD2 3.49Å; T342-D383 WeakPolarHBondContact O-CB 3.39Å; T342-D383 PolarHBondContact O-N 3.34Å; T342-D383 PolarHBondContact OG1-OD2 2.9Å; S344-D383 WeakPolarHBondContact CB-OD1 3.4Å; S344-D383 PolarHBondContact N-OD1 3.02Å; S344-D383 PolarHBondContact OG-OD1 3.07Å; S344-D383 PolarHBondContact OG-OD2 3.39Å; K351-D383 IonicContact NZ-OD2 3.67Å; K351-D383 PolarHBondContact NZ-OD2 3.03Å
384	I	94.5	Very high	90.7	Very high	5 Å²	5	57.9 Å²	57.9	3%	0.026	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	135.7	171.3	-66.9	163.8	0	0	0	107.8	F283 I321 H337 F340 K381 P382 F386	F283-I384 HydrophobicContact CE2-CD1 4.36Å; F283-I384 HydrophobicContact CZ-CD1 4.09Å; I321-I384 HydrophobicContact CB-CD1 4.21Å; I321-I384 HydrophobicContact CB-CG1 4.22Å; I321-I384 HydrophobicContact CD1-CD1 3.86Å; I321-I384 HydrophobicContact CG2-CD1 4.42Å; I321-I384 HydrophobicContact CG2-CG1 4.01Å; I321-I384 HydrophobicContact CG2-CG2 3.96Å; H337-I384 CarbonylContact O-C 3.52Å; H337-I384 VanDerWaalsContact O-CA 3.31Å; H337-I384 WeakPolarHBondContact O-CA 3.3Å; F340-I384 HydrophobicContact CD1-CD1 4.16Å; F340-I384 HydrophobicContact CD2-CD1 3.94Å; F340-I384 HydrophobicContact CE1-CD1 3.86Å; F340-I384 HydrophobicContact CE2-CD1 3.61Å; F340-I384 HydrophobicContact CG-CD1 4.18Å; F340-I384 HydrophobicContact CZ-CD1 3.58Å; K381-I384 PolarHBondContact NZ-O 2.67Å; P382-I384 HydrophobicContact CB-CD1 4.11Å; P382-I384 HydrophobicContact CB-CG1 4.42Å; P382-I384 PolarHBondContact O-N 3.44Å; I384-F386 HydrophobicContact CB-CD1 4.44Å; I384-F386 HydrophobicContact CB-CE1 4.17Å; I384-F386 HydrophobicContact CG2-CD1 4.07Å; I384-F386 HydrophobicContact CG2-CE1 3.98Å; I384-F386 WeakPolarHBondContact O-CD1 3.29Å; I384-F386 PolarHBondContact O-N 2.84Å
385	V	91.9	Very high	91.1	Very high	27 Å²	27	50.6 Å²	50.6	16%	0.164	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-72.9	120.1	175.8	-177.2	0	0	0	0	109.1	H337 E389 L391 P392	H337-V385 HydrophobicContact CB-CB 4.48Å; H337-V385 PolarHBondContact O-N 2.91Å; V385-E389 HydrophobicContact CG1-CB 4.18Å; V385-L391 HydrophobicContact CG1-CD1 4.24Å; V385-P392 HydrophobicContact CG2-CG 4.36Å
386	F	90.1	Very high	90.9	Very high	3 Å²	3	51.6 Å²	51.6	1%	0.013	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-94.2	159.7	174.7	-83.9	37.9	0	0	0	110.2	F271 I273 F276 F283 I384 G388 E389	F271-F386 VanDerWaalsContact C-CD2 3.44Å; F271-F386 HydrophobicContact CD1-CD1 4.38Å; F271-F386 HydrophobicContact CD1-CE1 4.08Å; F271-F386 HydrophobicContact CD1-CZ 4.41Å; F271-F386 CarbonylContact O-C 3.35Å; F271-F386 VanDerWaalsContact O-CA 3.24Å; F271-F386 WeakPolarHBondContact O-CA 3.38Å; F271-F386 WeakPolarHBondContact O-CB 3.24Å; F271-F386 WeakPolarHBondContact O-CD2 3.48Å; F271-F386 VanDerWaalsContact O-CG 3.3Å; F271-F386 WeakPolarHBondContact O-CG 3.42Å; I273-F386 HydrophobicContact CB-CB 4.12Å; I273-F386 HydrophobicContact CD1-CB 4.44Å; I273-F386 HydrophobicContact CD1-CD2 4.4Å; F276-F386 HydrophobicContact CB-CD2 4.07Å; F276-F386 HydrophobicContact CB-CE2 3.73Å; F276-F386 AromaticContact CD2-CE2 3.63Å; F276-F386 HydrophobicContact CD2-CE2 3.63Å; F276-F386 HydrophobicContact CD2-CZ 4.08Å; F276-F386 HydrophobicContact CE2-CE2 4.39Å; F276-F386 HydrophobicContact CE2-CZ 4.43Å; F276-F386 HydrophobicContact CG-CD2 4.39Å; F276-F386 AromaticContact CG-CE2 3.71Å; F276-F386 HydrophobicContact CG-CE2 3.71Å; F276-F386 HydrophobicContact CG-CZ 4.48Å; F283-F386 HydrophobicContact CD1-CZ 4.42Å; F283-F386 HydrophobicContact CD2-CE1 4.19Å; F283-F386 HydrophobicContact CD2-CE2 4.37Å; F283-F386 AromaticContact CD2-CZ 3.49Å; F283-F386 HydrophobicContact CD2-CZ 3.49Å; F283-F386 VanDerWaalsContact CD2-CZ 3.49Å; F283-F386 AromaticContact CE2-CE1 3.87Å; F283-F386 HydrophobicContact CE2-CE1 3.87Å; F283-F386 AromaticContact CE2-CZ 3.6Å; F283-F386 HydrophobicContact CE2-CZ 3.6Å; F283-F386 AromaticContact CG-CZ 3.92Å; F283-F386 HydrophobicContact CG-CZ 3.92Å; F283-F386 HydrophobicContact CZ-CE1 4.35Å; F283-F386 HydrophobicContact CZ-CZ 4.13Å; I384-F386 HydrophobicContact CB-CD1 4.44Å; I384-F386 HydrophobicContact CB-CE1 4.17Å; I384-F386 HydrophobicContact CG2-CD1 4.07Å; I384-F386 HydrophobicContact CG2-CE1 3.98Å; I384-F386 WeakPolarHBondContact O-CD1 3.29Å; I384-F386 PolarHBondContact O-N 2.84Å; F386-G388 PolarHBondContact O-N 2.77Å; F386-E389 HydrophobicContact CB-CG 4.26Å; F386-E389 PolarHBondContact N-OE2 3.37Å; F386-E389 WeakPolarHBondContact O-CB 3.44Å; F386-E389 PolarHBondContact O-N 2.87Å
387	F	84.6	Confident	91	Very high	78 Å²	78	53 Å²	53	34%	0.342	28%	0.28	S	S	.	.	B	Isolated β-bridge	trans	-57.4	132.2	166.9	-60.3	-69.2	0	0	0	109.1	Q268 F271 I273 V418	Q268-F387 HydrophobicContact CB-CD2 4.48Å; Q268-F387 HydrophobicContact CB-CE2 3.85Å; Q268-F387 HydrophobicContact CB-CZ 4.45Å; F271-F387 HydrophobicContact CB-CD2 3.88Å; F271-F387 HydrophobicContact CB-CE2 3.94Å; F271-F387 WeakPolarHBondContact O-CD2 3.27Å; F271-F387 PolarHBondContact O-N 2.88Å; I273-F387 WeakPolarHBondContact CG2-O 3.44Å; I273-F387 PolarHBondContact N-O 3.42Å; I273-F387 VanDerWaalsContact N-O 3.13Å; F387-V418 HydrophobicContact CE1-CG1 4.32Å
388	G	80	Confident	91	Very high	77 Å²	77	49.3 Å²	49.3	79%	0.794	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	89	-8	-169.7	0	0	0	0	0	115.2	F386	F386-G388 PolarHBondContact O-N 2.77Å
389	E	84.6	Confident	90.9	Very high	65 Å²	65	50.1 Å²	50.1	30%	0.304	26%	0.264	S	S	.	.	S	Bend	trans	-100.2	153.3	171.2	-63	-179.7	147.9	0	0	112.1	I273 K381 V385 F386	I273-E389 HydrophobicContact CB-CG 4.2Å; I273-E389 HydrophobicContact CD1-CG 4.33Å; I273-E389 VanDerWaalsContact CD1-OE1 3.29Å; I273-E389 WeakPolarHBondContact CD1-OE1 3.34Å; I273-E389 HydrophobicContact CG1-CG 4.02Å; K381-E389 IonicContact NZ-OE1 3.56Å; K381-E389 PolarHBondContact NZ-OE1 2.9Å; K381-E389 IonicContact NZ-OE2 2.75Å; K381-E389 PolarHBondContact NZ-OE2 3.42Å; V385-E389 HydrophobicContact CG1-CB 4.18Å; F386-E389 HydrophobicContact CB-CG 4.26Å; F386-E389 PolarHBondContact N-OE2 3.37Å; F386-E389 WeakPolarHBondContact O-CB 3.44Å; F386-E389 PolarHBondContact O-N 2.87Å
390	N	82.7	Confident	90.6	Very high	152 Å²	152	56.1 Å²	56.1	81%	0.813	29%	0.29	S	S	*	.	P	Polyproline II helix	trans	-76.8	150.4	173	-70.8	-39.7	0	0	0	111.2
391	L	86.8	Confident	90.4	Very high	24 Å²	24	61.6 Å²	61.6	13%	0.126	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-68.3	159.2	169.8	-83.9	73.9	0	0	0	111.1	C336 V385 E393 F395 P420 V421	C336-L391 HydrophobicContact CB-CD2 4.27Å; C336-L391 WeakPolarHBondContact O-CD2 3.46Å; C336-L391 WeakPolarHBondContact O-CG 3.31Å; V385-L391 HydrophobicContact CG1-CD1 4.24Å; L391-E393 PolarHBondContact O-N 2.96Å; L391-F395 HydrophobicContact CB-CD1 4.34Å; L391-F395 HydrophobicContact CD2-CD1 3.84Å; L391-F395 HydrophobicContact CD2-CD2 4.26Å; L391-F395 HydrophobicContact CD2-CE1 3.99Å; L391-F395 HydrophobicContact CD2-CE2 4.38Å; L391-F395 HydrophobicContact CD2-CG 4Å; L391-F395 HydrophobicContact CD2-CZ 4.26Å; L391-P420 HydrophobicContact CD1-CG 3.95Å; L391-P420 HydrophobicContact CD2-CG 3.69Å; L391-P420 HydrophobicContact CG-CG 4.37Å; L391-V421 HydrophobicContact CD2-CG2 3.99Å
392	P	89.7	Confident	90.5	Very high	50 Å²	50	61.2 Å²	61.2	33%	0.325	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-60.5	139.2	179.5	-20.6	33.4	0	0	0	110.9	C336 V385 L394 F395	C336-P392 WeakPolarHBondContact O-CD 3.03Å; V385-P392 HydrophobicContact CG2-CG 4.36Å; P392-L394 PolarHBondContact O-N 3.28Å; P392-F395 VanDerWaalsContact O-CB 3.28Å; P392-F395 WeakPolarHBondContact O-CB 3.35Å; P392-F395 PolarHBondContact O-N 3.08Å
393	E	88.1	Confident	90.3	Very high	129 Å²	129	64.5 Å²	64.5	60%	0.603	33%	0.329	S	S	*	.	H	α-helix	trans	-55.1	-31.3	-180	-161.2	-136.5	119.1	0	0	112.5	L391 F395 H396 R397	L391-E393 PolarHBondContact O-N 2.96Å; E393-F395 VanDerWaalsContact C-N 3.26Å; E393-F395 PolarHBondContact O-N 2.79Å; E393-H396 PolarHBondContact O-N 2.92Å; E393-H396 VanDerWaalsContact O-N 3.16Å; E393-R397 WeakPolarHBondContact O-CB 3.41Å; E393-R397 PolarHBondContact O-N 3.36Å; E393-R397 IonicContact OE1-CZ 3.43Å; E393-R397 VanDerWaalsContact OE1-CZ 3.28Å; E393-R397 IonicContact OE1-NE 3.36Å; E393-R397 PolarHBondContact OE1-NE 3.13Å; E393-R397 VanDerWaalsContact OE1-NE 3.08Å; E393-R397 IonicContact OE1-NH2 3.26Å; E393-R397 PolarHBondContact OE1-NH2 2.74Å; E393-R397 IonicContact OE2-NH2 2.73Å; E393-R397 PolarHBondContact OE2-NH2 3.1Å
394	L	91.4	Very high	90.2	Very high	109 Å²	109	67.6 Å²	67.6	57%	0.571	35%	0.345	S	S	*	.	H	α-helix	trans	-56.1	-35	173.8	-174.8	64.4	0	0	0	113.3	I334 P392 A398	I334-L394 HydrophobicContact CD1-CD2 4.13Å; I334-L394 HydrophobicContact CD1-CG 3.88Å; P392-L394 PolarHBondContact O-N 3.28Å; L394-A398 WeakPolarHBondContact O-CB 3.23Å; L394-A398 PolarHBondContact O-N 3.36Å
395	F	93.4	Very high	90.4	Very high	9 Å²	9	71.9 Å²	71.9	4%	0.039	37%	0.365	C	S	.	.	H	α-helix	trans	-62.4	-49.6	175.1	169.5	-94.4	0	0	0	111.1	Y317 I334 C336 L391 P392 E393 A398 M399 P420 V421 I424	Y317-F395 AromaticContact CD1-CD2 3.84Å; Y317-F395 HydrophobicContact CD1-CD2 3.84Å; Y317-F395 AromaticContact CD1-CE2 3.8Å; Y317-F395 HydrophobicContact CD1-CE2 3.8Å; Y317-F395 AromaticContact CE1-CD2 3.89Å; Y317-F395 HydrophobicContact CE1-CD2 3.89Å; Y317-F395 HydrophobicContact CE1-CE2 4.03Å; I334-F395 HydrophobicContact CG2-CB 4.17Å; I334-F395 HydrophobicContact CG2-CD2 4.02Å; C336-F395 HydrophobicContact CB-CD2 4.07Å; C336-F395 HydrophobicContact CB-CE2 4.26Å; L391-F395 HydrophobicContact CB-CD1 4.34Å; L391-F395 HydrophobicContact CD2-CD1 3.84Å; L391-F395 HydrophobicContact CD2-CD2 4.26Å; L391-F395 HydrophobicContact CD2-CE1 3.99Å; L391-F395 HydrophobicContact CD2-CE2 4.38Å; L391-F395 HydrophobicContact CD2-CG 4Å; L391-F395 HydrophobicContact CD2-CZ 4.26Å; P392-F395 VanDerWaalsContact O-CB 3.28Å; P392-F395 WeakPolarHBondContact O-CB 3.35Å; P392-F395 PolarHBondContact O-N 3.08Å; E393-F395 VanDerWaalsContact C-N 3.26Å; E393-F395 PolarHBondContact O-N 2.79Å; F395-A398 PolarHBondContact O-N 2.89Å; F395-M399 HydrophobicContact CD2-CG 4.48Å; F395-M399 HydrophobicContact CE1-CG 4.26Å; F395-M399 HydrophobicContact CE2-CG 4.09Å; F395-M399 HydrophobicContact CZ-CG 3.96Å; F395-M399 WeakPolarHBondContact O-CB 3.36Å; F395-M399 WeakPolarHBondContact O-CG 3.32Å; F395-M399 PolarHBondContact O-N 3.48Å; F395-P420 HydrophobicContact CE1-CG 3.89Å; F395-P420 HydrophobicContact CZ-CG 4.34Å; F395-V421 HydrophobicContact CE2-CG2 4.18Å; F395-V421 HydrophobicContact CZ-CG2 4.31Å; F395-I424 HydrophobicContact CE2-CD1 3.98Å; F395-I424 HydrophobicContact CZ-CD1 4.14Å; F395-I424 HydrophobicContact CZ-CG1 4.49Å
396	H	87.7	Confident	90.7	Very high	98 Å²	98	71 Å²	71	45%	0.454	36%	0.36	S	S	.	.	H	α-helix	trans	-66.8	-39.1	179.8	-64.8	-80.7	0	0	0	111.7	E393 K400	E393-H396 PolarHBondContact O-N 2.92Å; E393-H396 VanDerWaalsContact O-N 3.16Å; H396-K400 WeakPolarHBondContact O-CB 3.24Å; H396-K400 PolarHBondContact O-N 2.64Å
397	R	91.3	Very high	91.1	Very high	138 Å²	138	72.7 Å²	72.7	52%	0.521	37%	0.369	S	S	.	.	H	α-helix	trans	-64.9	-46.3	177	-167.6	-175.6	-65.3	-157.9	2.3	111.9	E393 K400 Q401	E393-R397 WeakPolarHBondContact O-CB 3.41Å; E393-R397 PolarHBondContact O-N 3.36Å; E393-R397 IonicContact OE1-CZ 3.43Å; E393-R397 VanDerWaalsContact OE1-CZ 3.28Å; E393-R397 IonicContact OE1-NE 3.36Å; E393-R397 PolarHBondContact OE1-NE 3.13Å; E393-R397 VanDerWaalsContact OE1-NE 3.08Å; E393-R397 IonicContact OE1-NH2 3.26Å; E393-R397 PolarHBondContact OE1-NH2 2.74Å; E393-R397 IonicContact OE2-NH2 2.73Å; E393-R397 PolarHBondContact OE2-NH2 3.1Å; R397-K400 PolarHBondContact O-N 2.84Å; R397-Q401 WeakPolarHBondContact O-CG 3.16Å; R397-Q401 PolarHBondContact O-N 3.18Å
398	A	94.8	Very high	91.8	Very high	3 Å²	3	69 Å²	69	3%	0.025	35%	0.353	C	S	.	.	H	α-helix	trans	-66.4	-45.1	176.8	0	0	0	0	0	111.2	Y317 I334 L394 F395 K400 Q401 D402	Y317-A398 WeakPolarHBondContact OH-CB 3.38Å; Y317-A398 PolarHBondContact OH-O 2.97Å; I334-A398 HydrophobicContact CD1-CB 3.62Å; I334-A398 HydrophobicContact CG1-CB 3.96Å; L394-A398 WeakPolarHBondContact O-CB 3.23Å; L394-A398 PolarHBondContact O-N 3.36Å; F395-A398 PolarHBondContact O-N 2.89Å; A398-K400 VanDerWaalsContact C-N 3.26Å; A398-K400 PolarHBondContact O-N 3.19Å; A398-Q401 WeakPolarHBondContact O-CA 3.49Å; A398-Q401 PolarHBondContact O-N 3.19Å; A398-D402 WeakPolarHBondContact O-CB 3.28Å; A398-D402 VanDerWaalsContact O-CG 3.28Å; A398-D402 PolarHBondContact O-N 3.01Å
399	M	93.4	Very high	92.7	Very high	21 Å²	21	65.3 Å²	65.3	10%	0.103	32%	0.315	C	S	.	.	H	α-helix	trans	-60.1	-34.5	176.9	-81	-57	-46.2	0	0	112.7	Y317 F395 Q401 K403 I424	Y317-M399 HydrophobicContact CD1-SD 4.23Å; Y317-M399 HydrophobicContact CE1-CG 3.72Å; Y317-M399 HydrophobicContact CE1-SD 3.59Å; Y317-M399 VanDerWaalsContact CE1-SD 3.59Å; Y317-M399 HydrophobicContact CE2-SD 4.03Å; Y317-M399 PolarHBondContact OH-N 2.83Å; Y317-M399 VanDerWaalsContact OH-N 3.1Å; F395-M399 HydrophobicContact CD2-CG 4.48Å; F395-M399 HydrophobicContact CE1-CG 4.26Å; F395-M399 HydrophobicContact CE2-CG 4.09Å; F395-M399 HydrophobicContact CZ-CG 3.96Å; F395-M399 WeakPolarHBondContact O-CB 3.36Å; F395-M399 WeakPolarHBondContact O-CG 3.32Å; F395-M399 PolarHBondContact O-N 3.48Å; M399-Q401 PolarHBondContact O-N 2.95Å; M399-K403 HydrophobicContact CE-CB 4.45Å; M399-K403 VanDerWaalsContact O-CB 3.27Å; M399-K403 WeakPolarHBondContact O-CB 3.41Å; M399-K403 WeakPolarHBondContact O-CG 3.44Å; M399-K403 PolarHBondContact O-N 2.92Å; M399-I424 HydrophobicContact CE-CG1 4.06Å; M399-I424 HydrophobicContact CE-CG2 4.11Å; M399-I424 HydrophobicContact SD-CD1 3.82Å; M399-I424 HydrophobicContact SD-CG1 3.85Å; M399-I424 HydrophobicContact SD-CG2 4.31Å
400	K	91	Very high	93.4	Very high	135 Å²	135	62.4 Å²	62.4	59%	0.587	30%	0.301	S	S	*	.	H	α-helix	trans	-68.2	-22.1	175.4	-174.7	164.3	-177.7	165	0	113.3	H396 R397 A398	H396-K400 WeakPolarHBondContact O-CB 3.24Å; H396-K400 PolarHBondContact O-N 2.64Å; R397-K400 PolarHBondContact O-N 2.84Å; A398-K400 VanDerWaalsContact C-N 3.26Å; A398-K400 PolarHBondContact O-N 3.19Å
401	Q	94.6	Very high	94.1	Very high	117 Å²	117	55.1 Å²	55.1	55%	0.547	26%	0.262	S	S	.	.	H	α-helix	trans	-93.1	-48.2	176.7	-66.3	174.8	-34.1	0	0	111.5	R397 A398 M399 K403	R397-Q401 WeakPolarHBondContact O-CG 3.16Å; R397-Q401 PolarHBondContact O-N 3.18Å; A398-Q401 WeakPolarHBondContact O-CA 3.49Å; A398-Q401 PolarHBondContact O-N 3.19Å; M399-Q401 PolarHBondContact O-N 2.95Å; Q401-K403 PolarHBondContact O-N 3.27Å
402	D	97.2	Very high	94.7	Very high	3 Å²	3	54 Å²	54	2%	0.016	26%	0.256	C	S	.	.	H	α-helix	trans	-74.3	-25.6	-170	-62.6	-12.9	0	0	0	113.2	L231 L314 R315 Y317 A398 D404 E405 V406	L231-D402 HydrophobicContact CD1-CB 4.43Å; L314-D402 HydrophobicContact CD2-CB 3.84Å; L314-D402 HydrophobicContact CG-CB 4.3Å; R315-D402 WeakPolarHBondContact CB-OD2 3.29Å; R315-D402 WeakPolarHBondContact CG-OD2 3.32Å; R315-D402 IonicContact CZ-OD1 2.71Å; R315-D402 IonicContact CZ-OD2 3.19Å; R315-D402 IonicContact NE-OD1 3.48Å; R315-D402 PolarHBondContact NE-OD1 3.26Å; R315-D402 IonicContact NE-OD2 2.68Å; R315-D402 PolarHBondContact NE-OD2 3.42Å; R315-D402 IonicContact NH2-OD1 3.01Å; R315-D402 PolarHBondContact NH2-OD1 3.04Å; R315-D402 IonicContact NH2-OD2 2.91Å; R315-D402 PolarHBondContact NH2-OD2 3.36Å; Y317-D402 WeakPolarHBondContact CE2-OD2 3.24Å; Y317-D402 PolarHBondContact OH-OD2 2.87Å; A398-D402 WeakPolarHBondContact O-CB 3.28Å; A398-D402 VanDerWaalsContact O-CG 3.28Å; A398-D402 PolarHBondContact O-N 3.01Å; D402-D404 VanDerWaalsContact C-N 3.32Å; D402-D404 PolarHBondContact O-N 2.83Å; D402-E405 PolarHBondContact O-N 2.99Å; D402-V406 PolarHBondContact O-N 2.58Å
403	K	93.5	Very high	95	Very high	70 Å²	70	51.9 Å²	51.9	30%	0.304	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-32.2	-171.9	68.3	172.6	-168.2	75.4	0	114.8	M399 Q401 I428 P429	M399-K403 HydrophobicContact CE-CB 4.45Å; M399-K403 VanDerWaalsContact O-CB 3.27Å; M399-K403 WeakPolarHBondContact O-CB 3.41Å; M399-K403 WeakPolarHBondContact O-CG 3.44Å; M399-K403 PolarHBondContact O-N 2.92Å; Q401-K403 PolarHBondContact O-N 3.27Å; K403-I428 HydrophobicContact CB-CG2 4.33Å; K403-P429 WeakPolarHBondContact O-CD 3.33Å
404	D	93.5	Very high	95.4	Very high	106 Å²	106	46 Å²	46	57%	0.567	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-10.9	-177.2	-61.2	-34.3	0	0	0	111.7	D402	D402-D404 VanDerWaalsContact C-N 3.32Å; D402-D404 PolarHBondContact O-N 2.83Å
405	E	97.9	Very high	95.3	Very high	96 Å²	96	41.9 Å²	41.9	45%	0.449	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-32.2	-180	-75.2	-66.3	161	0	0	112.8	R229 L314 D402 D407	R229-E405 WeakPolarHBondContact CD-OE2 3.39Å; R229-E405 IonicContact CZ-OE2 2.64Å; R229-E405 PolarHBondContact NE-O 3.21Å; R229-E405 IonicContact NE-OE2 2.92Å; R229-E405 PolarHBondContact NE-OE2 2.9Å; R229-E405 PolarHBondContact NH2-O 3.25Å; L314-E405 HydrophobicContact CD1-CB 4.46Å; L314-E405 HydrophobicContact CD2-CB 4.04Å; D402-E405 PolarHBondContact O-N 2.99Å; E405-D407 PolarHBondContact O-N 3.34Å
406	V	98.5	Very high	95.3	Very high	9 Å²	9	41.5 Å²	41.5	6%	0.055	20%	0.195	C	C	.	.			trans	-56.8	130.7	-173.2	57.3	0	0	0	0	113.4	R229 L231 L314 D402 L408 I428 V432	R229-V406 WeakPolarHBondContact O-CA 3.41Å; L231-V406 HydrophobicContact CB-CB 4.27Å; L231-V406 HydrophobicContact CB-CG2 3.53Å; L231-V406 HydrophobicContact CD1-CG2 4.47Å; L314-V406 HydrophobicContact CD2-CB 3.95Å; D402-V406 PolarHBondContact O-N 2.58Å; V406-L408 VanDerWaalsContact CG2-O 3.31Å; V406-L408 WeakPolarHBondContact CG2-O 3.42Å; V406-I428 HydrophobicContact CG1-CB 4.06Å; V406-I428 HydrophobicContact CG1-CD1 4.25Å; V406-I428 HydrophobicContact CG1-CG2 3.95Å; V406-V432 HydrophobicContact CG1-CG1 4.45Å; V406-V432 HydrophobicContact CG1-CG2 4.3Å; V406-V432 HydrophobicContact CG2-CG1 4.15Å; V406-V432 WeakPolarHBondContact O-CG2 3.4Å
407	D	98.5	Very high	95.1	Very high	37 Å²	37	42.1 Å²	42.1	20%	0.198	20%	0.197	C	C	.	.	S	Bend	trans	-110.6	-7.1	177.1	62.2	15.2	0	0	0	114.5	S227 K228 R229 E405	S227-D407 WeakPolarHBondContact CB-OD1 3.49Å; K228-D407 PolarHBondContact N-OD1 2.85Å; K228-D407 PolarHBondContact N-OD2 2.83Å; R229-D407 WeakPolarHBondContact CA-OD1 3.45Å; R229-D407 IonicContact CZ-OD2 2.91Å; R229-D407 VanDerWaalsContact N-CG 3.27Å; R229-D407 PolarHBondContact N-OD1 3.49Å; R229-D407 PolarHBondContact N-OD2 2.82Å; R229-D407 IonicContact NH1-OD2 3.81Å; R229-D407 PolarHBondContact O-N 3.21Å; R229-D407 VanDerWaalsContact O-N 3.16Å; E405-D407 PolarHBondContact O-N 3.34Å
408	L	98.9	Very high	94.8	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	132.1	171.8	173.3	63.2	0	0	0	110.3	L223 L224 S227 I230 L231 V406 I410 P433 V435	L223-L408 HydrophobicContact CB-CD1 4.26Å; L223-L408 HydrophobicContact CB-CD2 4.15Å; L223-L408 HydrophobicContact CD1-CD1 4.23Å; L224-L408 HydrophobicContact CD2-CD2 4.27Å; S227-L408 WeakPolarHBondContact OG-CB 3.35Å; I230-L408 CarbonylContact C-O 3.42Å; I230-L408 WeakPolarHBondContact CA-O 3.46Å; I230-L408 HydrophobicContact CD1-CD2 4.29Å; I230-L408 HydrophobicContact CG1-CB 4.26Å; I230-L408 HydrophobicContact CG1-CD2 4.14Å; I230-L408 HydrophobicContact CG2-CB 4.33Å; I230-L408 HydrophobicContact CG2-CD2 4.11Å; I230-L408 HydrophobicContact CG2-CG 4.2Å; L231-L408 PolarHBondContact N-O 2.98Å; V406-L408 VanDerWaalsContact CG2-O 3.31Å; V406-L408 WeakPolarHBondContact CG2-O 3.42Å; L408-I410 HydrophobicContact CD1-CG1 4.5Å; L408-I410 HydrophobicContact CD2-CD1 3.99Å; L408-I410 HydrophobicContact CD2-CG1 4.13Å; L408-I410 HydrophobicContact CG-CD1 4.4Å; L408-I410 HydrophobicContact CG-CG1 3.98Å; L408-P433 HydrophobicContact CD1-CB 3.91Å; L408-V435 HydrophobicContact CD1-CG2 4.29Å
409	L	98.8	Very high	94.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	131.4	169.3	175	67.5	0	0	0	110.5	L231 V411 P425 I428 P433 Q434 V435	L231-L409 HydrophobicContact CB-CD1 4.48Å; L231-L409 HydrophobicContact CD2-CD1 3.79Å; L231-L409 WeakPolarHBondContact O-CA 3.33Å; L409-V411 HydrophobicContact CD1-CG2 4.48Å; L409-V411 HydrophobicContact CD2-CG2 4.39Å; L409-V411 HydrophobicContact CG-CG2 4.34Å; L409-P425 HydrophobicContact CD2-CB 3.83Å; L409-P425 HydrophobicContact CD2-CG 4.08Å; L409-I428 HydrophobicContact CB-CD1 3.86Å; L409-I428 HydrophobicContact CD2-CD1 3.88Å; L409-I428 HydrophobicContact CG-CD1 4.36Å; L409-P433 PolarHBondContact N-O 2.85Å; L409-Q434 HydrophobicContact CB-CB 4.46Å; L409-Q434 HydrophobicContact CB-CG 4.14Å; L409-Q434 HydrophobicContact CD2-CB 4.29Å; L409-Q434 HydrophobicContact CD2-CG 3.96Å; L409-Q434 WeakPolarHBondContact O-CA 3.34Å; L409-V435 PolarHBondContact O-N 3.11Å
410	I	98.9	Very high	93.8	Very high	3 Å²	3	42.7 Å²	42.7	2%	0.015	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	122.4	170.7	-45.7	179.4	0	0	0	109.2	L224 I230 L231 V232 L233 L408 I412 V435 I437	L224-I410 HydrophobicContact CD2-CD1 3.58Å; I230-I410 HydrophobicContact CG2-CD1 3.84Å; I230-I410 HydrophobicContact CG2-CG1 4.06Å; L231-I410 PolarHBondContact O-N 3.45Å; V232-I410 CarbonylContact C-O 3.5Å; V232-I410 WeakPolarHBondContact CA-O 3.44Å; L233-I410 PolarHBondContact N-O 2.94Å; L408-I410 HydrophobicContact CD1-CG1 4.5Å; L408-I410 HydrophobicContact CD2-CD1 3.99Å; L408-I410 HydrophobicContact CD2-CG1 4.13Å; L408-I410 HydrophobicContact CG-CD1 4.4Å; L408-I410 HydrophobicContact CG-CG1 3.98Å; I410-I412 HydrophobicContact CG2-CD1 4.1Å; I410-I412 HydrophobicContact CG2-CG1 3.75Å; I410-V435 WeakPolarHBondContact CA-O 3.43Å; I410-V435 HydrophobicContact CG2-CB 4.49Å; I410-I437 HydrophobicContact CG2-CD1 4.03Å; I410-I437 HydrophobicContact CG2-CG1 4.35Å
411	V	98.8	Very high	93.8	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	120.1	174	177.7	0	0	0	0	108.6	L233 L409 L416 V435 L436 I437 F447	L233-V411 HydrophobicContact CB-CG2 4.28Å; L233-V411 WeakPolarHBondContact O-CA 3.28Å; L409-V411 HydrophobicContact CD1-CG2 4.48Å; L409-V411 HydrophobicContact CD2-CG2 4.39Å; L409-V411 HydrophobicContact CG-CG2 4.34Å; V411-L416 HydrophobicContact CG1-CD1 3.78Å; V411-L416 HydrophobicContact CG1-CG 4.11Å; V411-L416 HydrophobicContact CG2-CD1 4Å; V411-V435 PolarHBondContact N-O 2.88Å; V411-L436 HydrophobicContact CB-CD1 4.01Å; V411-L436 HydrophobicContact CG1-CD1 3.89Å; V411-I437 PolarHBondContact O-N 3.01Å; V411-F447 HydrophobicContact CB-CE1 4.1Å; V411-F447 HydrophobicContact CB-CZ 4.27Å; V411-F447 HydrophobicContact CG2-CE1 3.66Å; V411-F447 HydrophobicContact CG2-CZ 3.91Å
412	I	98.6	Very high	93.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	120.8	-176.2	-44.6	-178.8	0	0	0	110.8	V232 L233 T234 G235 V238 I410 S414 I437 C455 I459	V232-I412 HydrophobicContact CG1-CD1 3.63Å; V232-I412 HydrophobicContact CG1-CG1 3.98Å; L233-I412 PolarHBondContact O-N 3.17Å; T234-I412 WeakPolarHBondContact CA-O 3.29Å; T234-I412 HydrophobicContact CG2-CB 4.34Å; G235-I412 PolarHBondContact N-O 3.31Å; G235-I412 VanDerWaalsContact N-O 3.1Å; V238-I412 HydrophobicContact CG1-CB 4.05Å; V238-I412 HydrophobicContact CG1-CG2 3.52Å; I410-I412 HydrophobicContact CG2-CD1 4.1Å; I410-I412 HydrophobicContact CG2-CG1 3.75Å; I412-S414 VanDerWaalsContact C-N 3.25Å; I412-S414 PolarHBondContact O-N 3.48Å; I412-I437 CarbonylContact C-O 3.59Å; I412-I437 VanDerWaalsContact CA-O 3.3Å; I412-I437 WeakPolarHBondContact CA-O 3.47Å; I412-I437 HydrophobicContact CB-CB 4.49Å; I412-I437 HydrophobicContact CD1-CD1 4.47Å; I412-I437 HydrophobicContact CG1-CB 4.32Å; I412-I437 HydrophobicContact CG1-CD1 4.35Å; I412-I437 HydrophobicContact CG2-CB 4.15Å; I412-I437 HydrophobicContact CG2-CG2 4.03Å; I412-C455 HydrophobicContact CG2-CB 4.17Å; I412-I459 HydrophobicContact CD1-CD1 4.46Å
413	G	96.8	Very high	93.2	Very high	5 Å²	5	32.8 Å²	32.8	5%	0.052	16%	0.164	C	C	.	.	S	Bend	trans	63.4	23.4	171.6	0	0	0	0	0	115.4	G235 A236 G237 I437	G235-G413 CarbonylContact C-O 3.53Å; G235-G413 WeakPolarHBondContact CA-O 3.49Å; A236-G413 PolarHBondContact N-O 2.96Å; G237-G413 WeakPolarHBondContact CA-O 3.46Å; G237-G413 PolarHBondContact N-O 3.41Å; G413-I437 PolarHBondContact N-O 2.86Å
414	S	95	Very high	93.2	Very high	7 Å²	7	29.6 Å²	29.6	5%	0.049	15%	0.15	C	C	.	.			trans	-118.4	138.6	175.2	-173.3	0	0	0	0	112.4	Q319 I412 L416	Q319-S414 PolarHBondContact OE1-OG 3.14Å; I412-S414 VanDerWaalsContact C-N 3.25Å; I412-S414 PolarHBondContact O-N 3.48Å; S414-L416 VanDerWaalsContact C-N 3.34Å; S414-L416 PolarHBondContact OG-N 2.67Å; S414-L416 VanDerWaalsContact OG-N 3.11Å
415	S	91.3	Very high	93.3	Very high	21 Å²	21	24.6 Å²	24.6	15%	0.147	12%	0.123	C	C	.	.			trans	-83.5	-8.1	171.3	51.8	0	0	0	0	113.7	R248 K417 E440 H444	R248-S415 PolarHBondContact NH1-OG 3.01Å; R248-S415 VanDerWaalsContact NH1-OG 3.1Å; S415-K417 VanDerWaalsContact C-N 3.25Å; S415-K417 WeakPolarHBondContact O-CG 3.49Å; S415-K417 PolarHBondContact O-N 3.11Å; S415-K417 VanDerWaalsContact O-N 3.12Å; S415-E440 WeakPolarHBondContact CB-OE1 3.46Å; S415-H444 PolarHBondContact O-CE1 3.38Å
416	L	91.4	Very high	93	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.01	11%	0.106	C	C	.	.			trans	46.1	42.5	178.9	-61.9	-179.4	0	0	0	114.8	L233 V411 S414 A422 P425 L442 H444 L445 F447	L233-L416 HydrophobicContact CD1-CD2 3.68Å; L233-L416 HydrophobicContact CD2-CD2 3.68Å; L233-L416 HydrophobicContact CG-CD2 4.34Å; V411-L416 HydrophobicContact CG1-CD1 3.78Å; V411-L416 HydrophobicContact CG1-CG 4.11Å; V411-L416 HydrophobicContact CG2-CD1 4Å; S414-L416 VanDerWaalsContact C-N 3.34Å; S414-L416 PolarHBondContact OG-N 2.67Å; S414-L416 VanDerWaalsContact OG-N 3.11Å; L416-A422 HydrophobicContact CB-CB 4.37Å; L416-A422 WeakPolarHBondContact O-CB 3.37Å; L416-P425 HydrophobicContact CD1-CG 3.87Å; L416-L442 HydrophobicContact CB-CD1 4.27Å; L416-L442 HydrophobicContact CD1-CD1 4.09Å; L416-L442 HydrophobicContact CG-CD1 4.24Å; L416-H444 PolarHBondContact O-NE2 3.27Å; L416-L445 HydrophobicContact CB-CD1 4.26Å; L416-L445 HydrophobicContact CD1-CD1 3.56Å; L416-F447 HydrophobicContact CD1-CZ 4.44Å
417	K	85.5	Confident	92.6	Very high	110 Å²	110	22.9 Å²	22.9	48%	0.478	12%	0.121	S	C	.	.			trans	-97.4	2.5	178.1	-47	177.2	172	149.3	0	113.3	S415 E440	S415-K417 VanDerWaalsContact C-N 3.25Å; S415-K417 WeakPolarHBondContact O-CG 3.49Å; S415-K417 PolarHBondContact O-N 3.11Å; S415-K417 VanDerWaalsContact O-N 3.12Å; K417-E440 IonicContact NZ-OE1 3.98Å; K417-E440 PolarHBondContact NZ-OE1 3.44Å; K417-E440 IonicContact NZ-OE2 2.8Å; K417-E440 PolarHBondContact NZ-OE2 3.16Å
418	V	83.4	Confident	92.5	Very high	29 Å²	29	21.4 Å²	21.4	18%	0.176	11%	0.113	C	C	.	.	S	Bend	trans	-120.3	123.3	-175.8	-177	0	0	0	0	110.7	F387 A422	F387-V418 HydrophobicContact CE1-CG1 4.32Å; V418-A422 WeakPolarHBondContact O-CB 3.35Å; V418-A422 PolarHBondContact O-N 2.68Å
419	R	82.3	Confident	92.4	Very high	108 Å²	108	23.7 Å²	23.7	41%	0.408	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	154	177.8	-68.6	-179.3	-179.5	-159.1	-6.2	110.9	E204 A422 L423	E204-R419 IonicContact OE1-CZ 3.56Å; E204-R419 IonicContact OE1-NH1 3.46Å; E204-R419 PolarHBondContact OE1-NH1 3.37Å; E204-R419 IonicContact OE1-NH2 3.51Å; E204-R419 PolarHBondContact OE1-NH2 3.07Å; E204-R419 IonicContact OE2-CZ 3.83Å; E204-R419 IonicContact OE2-NH1 3.74Å; E204-R419 IonicContact OE2-NH2 3.83Å; E204-R419 PolarHBondContact OE2-NH2 3.33Å; R419-A422 HydrophobicContact CG-CB 4.42Å; R419-L423 HydrophobicContact CG-CG 4.43Å
420	P	86.4	Confident	92.2	Very high	38 Å²	38	26.7 Å²	26.7	25%	0.247	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	cis	-82.8	-10.3	0.5	35.1	-36.3	0	0	0	113.9	L391 F395 A422 L423	L391-P420 HydrophobicContact CD1-CG 3.95Å; L391-P420 HydrophobicContact CD2-CG 3.69Å; L391-P420 HydrophobicContact CG-CG 4.37Å; F395-P420 HydrophobicContact CE1-CG 3.89Å; F395-P420 HydrophobicContact CZ-CG 4.34Å; P420-A422 PolarHBondContact O-N 2.94Å; P420-L423 VanDerWaalsContact O-CB 3.29Å; P420-L423 WeakPolarHBondContact O-CB 3.11Å; P420-L423 PolarHBondContact O-N 2.76Å
421	V	89.5	Confident	92.1	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-57.2	-36.3	-175.4	-170.4	0	0	0	0	112.6	L233 Q319 C336 L391 F395 L423 I424	L233-V421 HydrophobicContact CD1-CG1 4.15Å; L233-V421 HydrophobicContact CD2-CG1 4.06Å; L233-V421 HydrophobicContact CG-CG1 4.25Å; Q319-V421 HydrophobicContact CG-CB 4.33Å; Q319-V421 HydrophobicContact CG-CG1 3.76Å; Q319-V421 HydrophobicContact CG-CG2 4.45Å; C336-V421 HydrophobicContact CB-CG2 3.62Å; L391-V421 HydrophobicContact CD2-CG2 3.99Å; F395-V421 HydrophobicContact CE2-CG2 4.18Å; F395-V421 HydrophobicContact CZ-CG2 4.31Å; V421-L423 PolarHBondContact O-N 3.39Å; V421-I424 HydrophobicContact CG1-CD1 3.85Å; V421-I424 WeakPolarHBondContact O-CG1 3.36Å; V421-I424 PolarHBondContact O-N 3.4Å; V421-I424 VanDerWaalsContact O-N 3.16Å
422	A	90.1	Very high	92	Very high	10 Å²	10	33.4 Å²	33.4	8%	0.083	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-57.6	-16.3	173.2	0	0	0	0	0	115.4	L416 V418 R419 P420	L416-A422 HydrophobicContact CB-CB 4.37Å; L416-A422 WeakPolarHBondContact O-CB 3.37Å; V418-A422 WeakPolarHBondContact O-CB 3.35Å; V418-A422 PolarHBondContact O-N 2.68Å; R419-A422 HydrophobicContact CG-CB 4.42Å; P420-A422 PolarHBondContact O-N 2.94Å
423	L	89.3	Confident	92	Very high	37 Å²	37	33.9 Å²	33.9	19%	0.194	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-87.8	-14.9	-179.6	-55.7	176.3	0	0	0	113.1	R419 P420 V421 P425 N426 S427	R419-L423 HydrophobicContact CG-CG 4.43Å; P420-L423 VanDerWaalsContact O-CB 3.29Å; P420-L423 WeakPolarHBondContact O-CB 3.11Å; P420-L423 PolarHBondContact O-N 2.76Å; V421-L423 PolarHBondContact O-N 3.39Å; L423-P425 VanDerWaalsContact C-CD 3.49Å; L423-N426 PolarHBondContact O-N 2.98Å; L423-S427 WeakPolarHBondContact O-CB 3.07Å; L423-S427 PolarHBondContact O-N 2.52Å; L423-S427 VanDerWaalsContact O-N 3.09Å; L423-S427 PolarHBondContact O-OG 3.36Å
424	I	93.3	Very high	92.1	Very high	3 Å²	3	33.7 Å²	33.7	2%	0.015	18%	0.175	C	C	.	.	H	α-helix	trans	-51.4	-46.3	-176.7	-65.9	173.7	0	0	0	112.8	L233 Y317 F395 M399 V421 N426 S427	L233-I424 HydrophobicContact CD1-CB 4.12Å; L233-I424 HydrophobicContact CD1-CD1 4.07Å; L233-I424 HydrophobicContact CD1-CG2 4.36Å; Y317-I424 HydrophobicContact CD1-CD1 4.27Å; Y317-I424 HydrophobicContact CG-CD1 4.37Å; F395-I424 HydrophobicContact CE2-CD1 3.98Å; F395-I424 HydrophobicContact CZ-CD1 4.14Å; F395-I424 HydrophobicContact CZ-CG1 4.49Å; M399-I424 HydrophobicContact CE-CG1 4.06Å; M399-I424 HydrophobicContact CE-CG2 4.11Å; M399-I424 HydrophobicContact SD-CD1 3.82Å; M399-I424 HydrophobicContact SD-CG1 3.85Å; M399-I424 HydrophobicContact SD-CG2 4.31Å; V421-I424 HydrophobicContact CG1-CD1 3.85Å; V421-I424 WeakPolarHBondContact O-CG1 3.36Å; V421-I424 PolarHBondContact O-N 3.4Å; V421-I424 VanDerWaalsContact O-N 3.16Å; I424-N426 PolarHBondContact O-N 2.95Å; I424-S427 PolarHBondContact O-N 3.46Å
425	P	95.5	Very high	92.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.8	-22.8	-178.7	-21.8	34.1	0	0	0	114.9	L409 L416 L423 Q434 L445	L409-P425 HydrophobicContact CD2-CB 3.83Å; L409-P425 HydrophobicContact CD2-CG 4.08Å; L416-P425 HydrophobicContact CD1-CG 3.87Å; L423-P425 VanDerWaalsContact C-CD 3.49Å; P425-Q434 PolarHBondContact O-NE2 2.92Å; P425-L445 HydrophobicContact CB-CD1 4.44Å; P425-L445 HydrophobicContact CB-CD2 4.28Å; P425-L445 HydrophobicContact CG-CD1 4.06Å
426	N	92.1	Very high	92.7	Very high	16 Å²	16	32.5 Å²	32.5	9%	0.086	17%	0.166	C	C	.	.	H	α-helix	trans	-97.2	-5.2	173.3	-64.3	-41.2	0	0	0	112.8	P205 R208 L423 I424	P205-N426 HydrophobicContact CB-CB 4.42Å; P205-N426 WeakPolarHBondContact CB-O 3.35Å; P205-N426 HydrophobicContact CG-CB 3.91Å; R208-N426 PolarHBondContact N-OD1 3.5Å; L423-N426 PolarHBondContact O-N 2.98Å; I424-N426 PolarHBondContact O-N 2.95Å
427	S	91.3	Very high	93	Very high	53 Å²	53	32.5 Å²	32.5	37%	0.371	17%	0.166	S	C	.	.	H	α-helix	trans	-98.5	-2	-176.3	-55.5	0	0	0	0	113.9	L423 I424	L423-S427 WeakPolarHBondContact O-CB 3.07Å; L423-S427 PolarHBondContact O-N 2.52Å; L423-S427 VanDerWaalsContact O-N 3.09Å; L423-S427 PolarHBondContact O-OG 3.36Å; I424-S427 PolarHBondContact O-N 3.46Å
428	I	95.2	Very high	93.6	Very high	6 Å²	6	27.7 Å²	27.7	3%	0.031	15%	0.146	C	C	.	.	S	Bend	trans	-108.2	158.5	175.7	66.7	174.5	0	0	0	109.9	K403 V406 L409 H430 V432	K403-I428 HydrophobicContact CB-CG2 4.33Å; V406-I428 HydrophobicContact CG1-CB 4.06Å; V406-I428 HydrophobicContact CG1-CD1 4.25Å; V406-I428 HydrophobicContact CG1-CG2 3.95Å; L409-I428 HydrophobicContact CB-CD1 3.86Å; L409-I428 HydrophobicContact CD2-CD1 3.88Å; L409-I428 HydrophobicContact CG-CD1 4.36Å; I428-H430 PolarHBondContact O-N 3.06Å; I428-V432 HydrophobicContact CD1-CB 4.09Å; I428-V432 HydrophobicContact CD1-CG1 3.94Å
429	P	96.1	Very high	94.1	Very high	49 Å²	49	30.8 Å²	30.8	32%	0.318	15%	0.154	S	C	.	.			trans	-52.4	136.7	178.8	-24.9	32.6	0	0	0	111.8	K403 E431 V432	K403-P429 WeakPolarHBondContact O-CD 3.33Å; P429-E431 WeakPolarHBondContact CB-OE2 3.42Å; P429-E431 PolarHBondContact O-N 2.65Å; P429-V432 HydrophobicContact CB-CG2 4.13Å; P429-V432 HydrophobicContact CG-CG2 4.44Å; P429-V432 WeakPolarHBondContact O-CB 3.47Å; P429-V432 WeakPolarHBondContact O-CG2 3.25Å; P429-V432 PolarHBondContact O-N 3.23Å
430	H	95.4	Very high	94.6	Very high	64 Å²	64	28.7 Å²	28.7	30%	0.296	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-23.8	-170.9	-67.8	-16.3	0	0	0	112.8	P206 R208 I428 V432	P206-H430 PolarHBondContact O-CE1 2.79Å; R208-H430 HydrophobicContact CG-CB 3.94Å; R208-H430 PolarHBondContact NE-O 3.2Å; R208-H430 PolarHBondContact NH2-O 3.11Å; I428-H430 PolarHBondContact O-N 3.06Å; H430-V432 VanDerWaalsContact C-N 3.25Å; H430-V432 PolarHBondContact O-N 3.26Å
431	E	96.4	Very high	95	Very high	132 Å²	132	28.3 Å²	28.3	62%	0.617	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-24.7	175.8	-59.4	64.9	-139.5	0	0	111.8	R211 P429 P433	R211-E431 WeakPolarHBondContact CD-O 3.3Å; R211-E431 PolarHBondContact NH1-O 2.7Å; P429-E431 WeakPolarHBondContact CB-OE2 3.42Å; P429-E431 PolarHBondContact O-N 2.65Å; E431-P433 WeakPolarHBondContact O-CD 3.36Å
432	V	98.3	Very high	95.2	Very high	12 Å²	12	28.5 Å²	28.5	7%	0.073	15%	0.147	C	C	.	.	S	Bend	trans	-63.5	127	177.8	-179.7	0	0	0	0	109.3	R208 V406 I428 P429 H430 Q434	R208-V432 PolarHBondContact NH2-O 3.46Å; V406-V432 HydrophobicContact CG1-CG1 4.45Å; V406-V432 HydrophobicContact CG1-CG2 4.3Å; V406-V432 HydrophobicContact CG2-CG1 4.15Å; V406-V432 WeakPolarHBondContact O-CG2 3.4Å; I428-V432 HydrophobicContact CD1-CB 4.09Å; I428-V432 HydrophobicContact CD1-CG1 3.94Å; P429-V432 HydrophobicContact CB-CG2 4.13Å; P429-V432 HydrophobicContact CG-CG2 4.44Å; P429-V432 WeakPolarHBondContact O-CB 3.47Å; P429-V432 WeakPolarHBondContact O-CG2 3.25Å; P429-V432 PolarHBondContact O-N 3.23Å; H430-V432 VanDerWaalsContact C-N 3.25Å; H430-V432 PolarHBondContact O-N 3.26Å; V432-Q434 WeakPolarHBondContact O-CG 3.41Å
433	P	98.6	Very high	95.3	Very high	9 Å²	9	34.1 Å²	34.1	6%	0.058	18%	0.183	C	C	.	.			trans	-61.6	141.4	174.5	-24.4	35.9	0	0	0	112.1	I214 L223 L408 L409 E431 D448	I214-P433 HydrophobicContact CD1-CB 3.79Å; I214-P433 HydrophobicContact CD1-CG 3.67Å; L223-P433 HydrophobicContact CD1-CB 3.83Å; L223-P433 HydrophobicContact CD1-CG 4.37Å; L223-P433 HydrophobicContact CD2-CB 4.09Å; L223-P433 HydrophobicContact CD2-CG 3.75Å; L408-P433 HydrophobicContact CD1-CB 3.91Å; L409-P433 PolarHBondContact N-O 2.85Å; E431-P433 WeakPolarHBondContact O-CD 3.36Å; P433-D448 VanDerWaalsContact CA-OD2 3.3Å; P433-D448 WeakPolarHBondContact CA-OD2 3.4Å
434	Q	98.6	Very high	95.1	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.009	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	117.4	-177.6	-52.1	-166.6	-0.1	0	0	111.2	L409 P425 V432 F447 D448	L409-Q434 HydrophobicContact CB-CB 4.46Å; L409-Q434 HydrophobicContact CB-CG 4.14Å; L409-Q434 HydrophobicContact CD2-CB 4.29Å; L409-Q434 HydrophobicContact CD2-CG 3.96Å; L409-Q434 WeakPolarHBondContact O-CA 3.34Å; P425-Q434 PolarHBondContact O-NE2 2.92Å; V432-Q434 WeakPolarHBondContact O-CG 3.41Å; Q434-F447 HydrophobicContact CB-CD1 3.86Å; Q434-F447 HydrophobicContact CB-CE1 4.37Å; Q434-D448 PolarHBondContact N-OD2 2.7Å; Q434-D448 PolarHBondContact O-N 2.86Å
435	V	98.8	Very high	95.1	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.012	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	136.4	179.3	-177.7	0	0	0	0	110.3	V220 L408 L409 I410 V411 I437 L451	V220-V435 HydrophobicContact CG1-CG1 4.12Å; V220-V435 HydrophobicContact CG1-CG2 4.31Å; V220-V435 HydrophobicContact CG2-CG1 4.07Å; V220-V435 HydrophobicContact CG2-CG2 3.93Å; L408-V435 HydrophobicContact CD1-CG2 4.29Å; L409-V435 PolarHBondContact O-N 3.11Å; I410-V435 WeakPolarHBondContact CA-O 3.43Å; I410-V435 HydrophobicContact CG2-CB 4.49Å; V411-V435 PolarHBondContact N-O 2.88Å; V435-I437 HydrophobicContact CG1-CG1 4.47Å; V435-L451 HydrophobicContact CG1-CD1 4.48Å
436	L	98.8	Very high	95.1	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	131.9	172.6	179.9	66.4	0	0	0	110.2	V411 N438 L442 F447 V449 E450 L451 L452	V411-L436 HydrophobicContact CB-CD1 4.01Å; V411-L436 HydrophobicContact CG1-CD1 3.89Å; L436-N438 HydrophobicContact CD1-CB 3.69Å; L436-N438 HydrophobicContact CD2-CB 4.4Å; L436-N438 HydrophobicContact CG-CB 3.95Å; L436-L442 HydrophobicContact CD1-CD1 3.77Å; L436-L442 HydrophobicContact CD1-CG 4.19Å; L436-L442 HydrophobicContact CD2-CD1 4.37Å; L436-L442 HydrophobicContact CD2-CG 3.94Å; L436-F447 HydrophobicContact CB-CB 4.14Å; L436-F447 HydrophobicContact CB-CD1 3.84Å; L436-F447 HydrophobicContact CB-CD2 3.87Å; L436-F447 HydrophobicContact CB-CE1 4.2Å; L436-F447 HydrophobicContact CB-CE2 4.23Å; L436-F447 HydrophobicContact CB-CG 3.67Å; L436-F447 HydrophobicContact CB-CZ 4.38Å; L436-F447 HydrophobicContact CD1-CE2 4.18Å; L436-F447 HydrophobicContact CD1-CZ 4.14Å; L436-F447 HydrophobicContact CD2-CD2 4.06Å; L436-F447 HydrophobicContact CD2-CE2 4.2Å; L436-F447 HydrophobicContact CG-CD2 4.41Å; L436-F447 HydrophobicContact CG-CE2 4.44Å; L436-V449 PolarHBondContact N-O 3.02Å; L436-E450 HydrophobicContact CD2-CG 4.32Å; L436-L451 WeakPolarHBondContact O-CB 3.49Å; L436-L451 PolarHBondContact O-N 2.77Å; L436-L452 HydrophobicContact CD2-CD2 4.09Å
437	I	98.7	Very high	95.4	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.01	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	95.8	168.7	-58.3	-179.4	0	0	0	106.8	I410 V411 I412 G413 V435 L451 C455 I458 I459 L462	I410-I437 HydrophobicContact CG2-CD1 4.03Å; I410-I437 HydrophobicContact CG2-CG1 4.35Å; V411-I437 PolarHBondContact O-N 3.01Å; I412-I437 CarbonylContact C-O 3.59Å; I412-I437 VanDerWaalsContact CA-O 3.3Å; I412-I437 WeakPolarHBondContact CA-O 3.47Å; I412-I437 HydrophobicContact CB-CB 4.49Å; I412-I437 HydrophobicContact CD1-CD1 4.47Å; I412-I437 HydrophobicContact CG1-CB 4.32Å; I412-I437 HydrophobicContact CG1-CD1 4.35Å; I412-I437 HydrophobicContact CG2-CB 4.15Å; I412-I437 HydrophobicContact CG2-CG2 4.03Å; G413-I437 PolarHBondContact N-O 2.86Å; V435-I437 HydrophobicContact CG1-CG1 4.47Å; I437-L451 WeakPolarHBondContact CA-O 3.32Å; I437-L451 HydrophobicContact CG1-CB 4.3Å; I437-L451 HydrophobicContact CG1-CD1 4.22Å; I437-C455 HydrophobicContact CG2-CB 4.2Å; I437-I458 HydrophobicContact CD1-CG2 4.3Å; I437-I458 HydrophobicContact CG1-CG2 4.32Å; I437-I458 HydrophobicContact CG2-CB 4.04Å; I437-I458 HydrophobicContact CG2-CD1 3.94Å; I437-I458 HydrophobicContact CG2-CG2 3.89Å; I437-I459 HydrophobicContact CD1-CD1 3.88Å; I437-L462 HydrophobicContact CD1-CD1 3.82Å
438	N	97.5	Very high	95.7	Very high	10 Å²	10	35.8 Å²	35.8	5%	0.053	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	161.9	-173.7	-168.7	46.8	0	0	0	113.2	L436 E440 L451 L452 G453	L436-N438 HydrophobicContact CD1-CB 3.69Å; L436-N438 HydrophobicContact CD2-CB 4.4Å; L436-N438 HydrophobicContact CG-CB 3.95Å; N438-E440 VanDerWaalsContact ND2-CG 3.35Å; N438-E440 WeakPolarHBondContact ND2-CG 3.41Å; N438-E440 PolarHBondContact ND2-N 2.87Å; N438-E440 PolarHBondContact ND2-O 2.64Å; N438-L451 PolarHBondContact N-O 3.27Å; N438-L451 VanDerWaalsContact N-O 3.11Å; N438-L452 CarbonylContact O-C 3.56Å; N438-L452 WeakPolarHBondContact O-CA 3.45Å; N438-G453 CarbonylContact C-O 3.53Å; N438-G453 PolarHBondContact O-N 3.29Å
439	R	94.3	Very high	95.9	Very high	94 Å²	94	35.5 Å²	35.5	36%	0.355	18%	0.184	S	C	.	.	S	Bend	trans	-75.7	-30.1	-179.7	-164.2	167.9	176.4	-130.9	-19.2	114.1	G599 E601	R439-G599 WeakPolarHBondContact CG-O 3.4Å; R439-G599 PolarHBondContact NE-O 2.95Å; R439-E601 HydrophobicContact CG-CG 4.22Å; R439-E601 IonicContact CZ-OE1 2.71Å; R439-E601 IonicContact NH1-OE1 3.15Å; R439-E601 PolarHBondContact NH1-OE1 2.68Å; R439-E601 VanDerWaalsContact NH2-CD 3.31Å; R439-E601 IonicContact NH2-OE1 3.52Å; R439-E601 PolarHBondContact NH2-OE1 3.48Å; R439-E601 PolarHBondContact O-N 2.93Å
440	E	93	Very high	96	Very high	63 Å²	63	34.2 Å²	34.2	29%	0.294	17%	0.174	S	C	.	.	S	Bend	trans	-116.1	145.4	173.9	61	174.5	167	0	0	110.8	S415 K417 N438 L442	S415-E440 WeakPolarHBondContact CB-OE1 3.46Å; K417-E440 IonicContact NZ-OE1 3.98Å; K417-E440 PolarHBondContact NZ-OE1 3.44Å; K417-E440 IonicContact NZ-OE2 2.8Å; K417-E440 PolarHBondContact NZ-OE2 3.16Å; N438-E440 VanDerWaalsContact ND2-CG 3.35Å; N438-E440 WeakPolarHBondContact ND2-CG 3.41Å; N438-E440 PolarHBondContact ND2-N 2.87Å; N438-E440 PolarHBondContact ND2-O 2.64Å; E440-L442 HydrophobicContact CG-CD2 4.28Å
441	P	95.1	Very high	96.1	Very high	31 Å²	31	31.1 Å²	31.1	20%	0.201	16%	0.16	C	C	.	.			trans	-66.6	161.1	165.3	30.6	-34	0	0	0	110.4	P443 L452	P441-P443 WeakPolarHBondContact O-CD 3.39Å; P441-L452 HydrophobicContact CB-CD1 4.02Å; P441-L452 HydrophobicContact CB-CD2 4.41Å; P441-L452 HydrophobicContact CG-CD1 4.36Å
442	L	94	Very high	96.2	Very high	3 Å²	3	24.9 Å²	24.9	2%	0.016	13%	0.13	C	C	.	.			trans	-116.8	87.9	-175.1	-57.2	-172.4	0	0	0	111.8	L416 L436 E440 H444 L445 F447	L416-L442 HydrophobicContact CB-CD1 4.27Å; L416-L442 HydrophobicContact CD1-CD1 4.09Å; L416-L442 HydrophobicContact CG-CD1 4.24Å; L436-L442 HydrophobicContact CD1-CD1 3.77Å; L436-L442 HydrophobicContact CD1-CG 4.19Å; L436-L442 HydrophobicContact CD2-CD1 4.37Å; L436-L442 HydrophobicContact CD2-CG 3.94Å; E440-L442 HydrophobicContact CG-CD2 4.28Å; L442-H444 PolarHBondContact O-N 3.25Å; L442-L445 HydrophobicContact CD1-CD1 4.33Å; L442-L445 PolarHBondContact O-N 3.14Å; L442-F447 HydrophobicContact CB-CE2 4.24Å; L442-F447 HydrophobicContact CD1-CE2 3.96Å; L442-F447 HydrophobicContact CD1-CZ 4.26Å; L442-F447 HydrophobicContact CG-CE2 4.47Å
443	P	90.6	Very high	96.1	Very high	128 Å²	128	24.3 Å²	24.3	83%	0.831	13%	0.127	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-7.7	-170.7	-24	34.8	0	0	0	116.2	P441	P441-P443 WeakPolarHBondContact O-CD 3.39Å
444	H	86.6	Confident	95.9	Very high	63 Å²	63	27.8 Å²	27.8	29%	0.292	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-9.5	177.2	57.3	-64	0	0	0	114.2	K207 S415 L416 L442	K207-H444 PolarHBondContact NZ-O 3.11Å; S415-H444 PolarHBondContact O-CE1 3.38Å; L416-H444 PolarHBondContact O-NE2 3.27Å; L442-H444 PolarHBondContact O-N 3.25Å
445	L	93.1	Very high	95.9	Very high	8 Å²	8	28.2 Å²	28.2	4%	0.042	15%	0.148	C	C	.	.	S	Bend	trans	-132	158.3	-173.9	-64.3	173.4	0	0	0	111.7	L416 P425 L442 F447	L416-L445 HydrophobicContact CB-CD1 4.26Å; L416-L445 HydrophobicContact CD1-CD1 3.56Å; P425-L445 HydrophobicContact CB-CD1 4.44Å; P425-L445 HydrophobicContact CB-CD2 4.28Å; P425-L445 HydrophobicContact CG-CD1 4.06Å; L442-L445 HydrophobicContact CD1-CD1 4.33Å; L442-L445 PolarHBondContact O-N 3.14Å; L445-F447 HydrophobicContact CB-CD2 4.28Å; L445-F447 HydrophobicContact CB-CE2 3.66Å; L445-F447 HydrophobicContact CB-CZ 4.3Å; L445-F447 HydrophobicContact CD1-CE2 4Å; L445-F447 HydrophobicContact CD1-CZ 3.98Å
446	N	95.1	Very high	95.7	Very high	71 Å²	71	29 Å²	29	38%	0.38	15%	0.153	S	C	.	.			trans	-121.4	97.2	-178.7	-54.6	-62.1	0	0	0	111.4	R208 K210	R208-N446 PolarHBondContact NH1-O 2.88Å; R208-N446 WeakPolarHBondContact O-CB 3.15Å; R208-N446 PolarHBondContact O-ND2 3.37Å; K210-N446 HydrophobicContact CB-CB 4.34Å
447	F	97.7	Very high	95.6	Very high	3 Å²	3	30.5 Å²	30.5	1%	0.013	17%	0.168	C	C	.	.			trans	-87.8	151.2	175.9	-65	-87	0	0	0	111.7	K210 V411 L416 Q434 L436 L442 L445 E450 N593	K210-F447 WeakPolarHBondContact CG-O 3.23Å; V411-F447 HydrophobicContact CB-CE1 4.1Å; V411-F447 HydrophobicContact CB-CZ 4.27Å; V411-F447 HydrophobicContact CG2-CE1 3.66Å; V411-F447 HydrophobicContact CG2-CZ 3.91Å; L416-F447 HydrophobicContact CD1-CZ 4.44Å; Q434-F447 HydrophobicContact CB-CD1 3.86Å; Q434-F447 HydrophobicContact CB-CE1 4.37Å; L436-F447 HydrophobicContact CB-CB 4.14Å; L436-F447 HydrophobicContact CB-CD1 3.84Å; L436-F447 HydrophobicContact CB-CD2 3.87Å; L436-F447 HydrophobicContact CB-CE1 4.2Å; L436-F447 HydrophobicContact CB-CE2 4.23Å; L436-F447 HydrophobicContact CB-CG 3.67Å; L436-F447 HydrophobicContact CB-CZ 4.38Å; L436-F447 HydrophobicContact CD1-CE2 4.18Å; L436-F447 HydrophobicContact CD1-CZ 4.14Å; L436-F447 HydrophobicContact CD2-CD2 4.06Å; L436-F447 HydrophobicContact CD2-CE2 4.2Å; L436-F447 HydrophobicContact CG-CD2 4.41Å; L436-F447 HydrophobicContact CG-CE2 4.44Å; L442-F447 HydrophobicContact CB-CE2 4.24Å; L442-F447 HydrophobicContact CD1-CE2 3.96Å; L442-F447 HydrophobicContact CD1-CZ 4.26Å; L442-F447 HydrophobicContact CG-CE2 4.47Å; L445-F447 HydrophobicContact CB-CD2 4.28Å; L445-F447 HydrophobicContact CB-CE2 3.66Å; L445-F447 HydrophobicContact CB-CZ 4.3Å; L445-F447 HydrophobicContact CD1-CE2 4Å; L445-F447 HydrophobicContact CD1-CZ 3.98Å; F447-E450 HydrophobicContact CB-CG 4.31Å; F447-N593 PolarHBondContact O-ND2 3.43Å
448	D	98.3	Very high	95.5	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.168	C	C	.	.	S	Bend	trans	-75.9	-36.4	178.6	-57.3	-36.7	0	0	0	111.6	R208 K210 R211 I214 P433 Q434 N593	R208-D448 IonicContact CZ-OD1 3.61Å; R208-D448 IonicContact CZ-OD2 2.65Å; R208-D448 VanDerWaalsContact NH1-CG 3.26Å; R208-D448 IonicContact NH1-OD1 2.66Å; R208-D448 PolarHBondContact NH1-OD1 2.85Å; R208-D448 IonicContact NH1-OD2 3.79Å; R208-D448 PolarHBondContact NH1-OD2 3.07Å; R208-D448 IonicContact NH2-OD1 3.38Å; R208-D448 PolarHBondContact NH2-OD1 2.7Å; R208-D448 IonicContact NH2-OD2 2.7Å; R208-D448 PolarHBondContact NH2-OD2 3.42Å; K210-D448 WeakPolarHBondContact CE-O 2.99Å; R211-D448 WeakPolarHBondContact CB-OD1 3.47Å; R211-D448 PolarHBondContact N-OD1 2.81Å; I214-D448 HydrophobicContact CB-CB 4Å; I214-D448 HydrophobicContact CG2-CB 3.67Å; P433-D448 VanDerWaalsContact CA-OD2 3.3Å; P433-D448 WeakPolarHBondContact CA-OD2 3.4Å; Q434-D448 PolarHBondContact N-OD2 2.7Å; Q434-D448 PolarHBondContact O-N 2.86Å; D448-N593 WeakPolarHBondContact O-CB 3.31Å; D448-N593 VanDerWaalsContact O-CG 3.26Å; D448-N593 PolarHBondContact O-ND2 3.09Å
449	V	98.6	Very high	95.5	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	131.1	173.4	-168.5	0	0	0	0	109.3	I214 V220 L436 L451 Y595	I214-V449 HydrophobicContact CG2-CG2 4.09Å; V220-V449 HydrophobicContact CG2-CB 3.67Å; V220-V449 HydrophobicContact CG2-CG1 3.79Å; V220-V449 HydrophobicContact CG2-CG2 3.66Å; L436-V449 PolarHBondContact N-O 3.02Å; V449-L451 HydrophobicContact CG1-CD2 3.69Å; V449-L451 HydrophobicContact CG1-CG 4.34Å; V449-Y595 HydrophobicContact CG1-CD2 3.82Å; V449-Y595 HydrophobicContact CG1-CE2 3.92Å
450	E	98.4	Very high	95.6	Very high	21 Å²	21	26 Å²	26	10%	0.098	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	102	176.1	-67.5	-177.1	-176.3	0	0	109.7	L436 F447 L452 N593 R594 Y595	L436-E450 HydrophobicContact CD2-CG 4.32Å; F447-E450 HydrophobicContact CB-CG 4.31Å; E450-L452 HydrophobicContact CB-CD1 4.5Å; E450-L452 HydrophobicContact CB-CD2 4.18Å; E450-L452 HydrophobicContact CB-CG 4.14Å; E450-N593 PolarHBondContact N-O 2.93Å; E450-R594 HydrophobicContact CB-CB 4.47Å; E450-R594 HydrophobicContact CB-CG 4.47Å; E450-R594 WeakPolarHBondContact O-CA 3.33Å; E450-R594 IonicContact OE1-NH2 2.81Å; E450-R594 IonicContact OE2-CZ 3.81Å; E450-R594 IonicContact OE2-NE 2.82Å; E450-R594 PolarHBondContact OE2-NE 2.93Å; E450-R594 IonicContact OE2-NH2 2.7Å; E450-R594 PolarHBondContact OE2-NH2 2.75Å; E450-Y595 PolarHBondContact O-N 2.92Å
451	L	98.4	Very high	95.8	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	105.2	170.8	-49.2	-175.6	0	0	0	107.9	L217 V220 V435 L436 I437 N438 V449 I458 L462 Y595 F597	L217-L451 HydrophobicContact CD1-CD1 4Å; L217-L451 HydrophobicContact CD1-CD2 4Å; V220-L451 HydrophobicContact CG1-CD1 4.46Å; V435-L451 HydrophobicContact CG1-CD1 4.48Å; L436-L451 WeakPolarHBondContact O-CB 3.49Å; L436-L451 PolarHBondContact O-N 2.77Å; I437-L451 WeakPolarHBondContact CA-O 3.32Å; I437-L451 HydrophobicContact CG1-CB 4.3Å; I437-L451 HydrophobicContact CG1-CD1 4.22Å; N438-L451 PolarHBondContact N-O 3.27Å; N438-L451 VanDerWaalsContact N-O 3.11Å; V449-L451 HydrophobicContact CG1-CD2 3.69Å; V449-L451 HydrophobicContact CG1-CG 4.34Å; L451-I458 HydrophobicContact CB-CD1 4.12Å; L451-I458 HydrophobicContact CB-CG2 3.75Å; L451-I458 HydrophobicContact CD1-CG2 3.67Å; L451-I458 HydrophobicContact CG-CG2 4.35Å; L451-I458 WeakPolarHBondContact O-CD1 3.13Å; L451-L462 HydrophobicContact CD1-CD1 4Å; L451-L462 HydrophobicContact CD1-CD2 4.41Å; L451-L462 HydrophobicContact CD1-CG 4.47Å; L451-Y595 HydrophobicContact CD2-CD2 3.67Å; L451-Y595 HydrophobicContact CD2-CG 3.89Å; L451-F597 HydrophobicContact CB-CE2 4.2Å; L451-F597 HydrophobicContact CD2-CE2 4.35Å
452	L	98	Very high	95.9	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	123	-170.4	-58.2	-177.6	0	0	0	111.6	L436 N438 P441 E450 R594 Y595 F597 A600 V602	L436-L452 HydrophobicContact CD2-CD2 4.09Å; N438-L452 CarbonylContact O-C 3.56Å; N438-L452 WeakPolarHBondContact O-CA 3.45Å; P441-L452 HydrophobicContact CB-CD1 4.02Å; P441-L452 HydrophobicContact CB-CD2 4.41Å; P441-L452 HydrophobicContact CG-CD1 4.36Å; E450-L452 HydrophobicContact CB-CD1 4.5Å; E450-L452 HydrophobicContact CB-CD2 4.18Å; E450-L452 HydrophobicContact CB-CG 4.14Å; L452-R594 HydrophobicContact CD1-CG 3.72Å; L452-R594 HydrophobicContact CG-CG 4.35Å; L452-Y595 PolarHBondContact N-O 2.88Å; L452-F597 PolarHBondContact O-N 3.06Å; L452-A600 HydrophobicContact CB-CB 4.2Å; L452-A600 WeakPolarHBondContact O-CB 3.46Å; L452-V602 HydrophobicContact CB-CG2 4.3Å; L452-V602 HydrophobicContact CD1-CG2 3.6Å
453	G	96.3	Very high	96	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.128	C	C	.	.	S	Bend	trans	153	-166.6	-176.5	0	0	0	0	0	114.7	N438 C455 H598	N438-G453 CarbonylContact C-O 3.53Å; N438-G453 PolarHBondContact O-N 3.29Å; G453-C455 PolarHBondContact O-N 3.19Å; G453-H598 VanDerWaalsContact CA-O 3.27Å; G453-H598 WeakPolarHBondContact CA-O 3.49Å
454	D	95	Very high	96.2	Very high	83 Å²	83	17.5 Å²	17.5	44%	0.444	10%	0.097	S	C	.	.			trans	-67.9	120.3	173.8	-67.3	-33.7	0	0	0	110	D456 G457 I458 H598 G599	D454-D456 VanDerWaalsContact C-N 3.33Å; D454-D456 PolarHBondContact O-N 3.14Å; D454-G457 PolarHBondContact O-N 3.45Å; D454-I458 PolarHBondContact O-N 3.18Å; D454-H598 PolarHBondContact N-O 2.94Å; D454-G599 WeakPolarHBondContact OD2-CA 3.32Å
455	C	96.9	Very high	96.6	Very high	11 Å²	11	18 Å²	18	7%	0.074	10%	0.097	C	C	.	.	H	α-helix	trans	-60.6	-39.2	-165.9	-60.5	0	0	0	0	113.1	C300 I412 I437 G453 G457 I458 I459	C300-C455 VanDerWaalsContact SG-CB 3.56Å; I412-C455 HydrophobicContact CG2-CB 4.17Å; I437-C455 HydrophobicContact CG2-CB 4.2Å; G453-C455 PolarHBondContact O-N 3.19Å; C455-G457 VanDerWaalsContact C-N 3.33Å; C455-G457 PolarHBondContact O-N 3.09Å; C455-I458 PolarHBondContact O-N 3.3Å; C455-I459 WeakPolarHBondContact O-CB 3.42Å; C455-I459 VanDerWaalsContact O-CG1 3.31Å; C455-I459 WeakPolarHBondContact O-CG1 3.31Å; C455-I459 PolarHBondContact O-N 3.47Å
456	D	96.5	Very high	96.7	Very high	19 Å²	19	18.4 Å²	18.4	10%	0.102	10%	0.099	C	C	.	.	H	α-helix	trans	-67	-30.9	177.6	-71.6	-39.1	0	0	0	113.2	S241 P299 C300 D454 N460 F475	S241-D456 WeakPolarHBondContact CB-OD2 3.4Å; S241-D456 PolarHBondContact OG-OD2 3.41Å; P299-D456 HydrophobicContact CB-CB 4.17Å; P299-D456 WeakPolarHBondContact CB-OD1 3.35Å; P299-D456 VanDerWaalsContact CD-OD1 3.32Å; P299-D456 WeakPolarHBondContact CD-OD1 3.19Å; P299-D456 HydrophobicContact CG-CB 4.1Å; C300-D456 PolarHBondContact N-OD1 3.05Å; C300-D456 PolarHBondContact SG-OD1 3.2Å; D454-D456 VanDerWaalsContact C-N 3.33Å; D454-D456 PolarHBondContact O-N 3.14Å; D456-N460 WeakPolarHBondContact O-CB 3.04Å; D456-N460 PolarHBondContact O-N 2.99Å; D456-F475 HydrophobicContact CB-CE1 4.22Å; D456-F475 HydrophobicContact CB-CZ 4.3Å; D456-F475 WeakPolarHBondContact O-CE1 3.48Å
457	G	95.6	Very high	96.6	Very high	31 Å²	31	15.9 Å²	15.9	32%	0.32	9%	0.089	S	C	.	.	H	α-helix	trans	-68.8	-42.8	175.1	0	0	0	0	0	111.8	D454 C455 N460 E461	D454-G457 PolarHBondContact O-N 3.45Å; C455-G457 VanDerWaalsContact C-N 3.33Å; C455-G457 PolarHBondContact O-N 3.09Å; G457-N460 PolarHBondContact O-N 3.24Å; G457-E461 PolarHBondContact O-N 3.25Å; G457-E461 VanDerWaalsContact O-N 3.14Å
458	I	97.4	Very high	96.4	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-63.9	-43.4	174.8	-62	167.8	0	0	0	110.7	I437 L451 D454 C455 N460 E461 L462 F597	I437-I458 HydrophobicContact CD1-CG2 4.3Å; I437-I458 HydrophobicContact CG1-CG2 4.32Å; I437-I458 HydrophobicContact CG2-CB 4.04Å; I437-I458 HydrophobicContact CG2-CD1 3.94Å; I437-I458 HydrophobicContact CG2-CG2 3.89Å; L451-I458 HydrophobicContact CB-CD1 4.12Å; L451-I458 HydrophobicContact CB-CG2 3.75Å; L451-I458 HydrophobicContact CD1-CG2 3.67Å; L451-I458 HydrophobicContact CG-CG2 4.35Å; L451-I458 WeakPolarHBondContact O-CD1 3.13Å; D454-I458 PolarHBondContact O-N 3.18Å; C455-I458 PolarHBondContact O-N 3.3Å; I458-N460 PolarHBondContact O-N 3.06Å; I458-E461 PolarHBondContact O-N 2.99Å; I458-L462 HydrophobicContact CG2-CD1 4.16Å; I458-L462 WeakPolarHBondContact O-CG 3.48Å; I458-L462 PolarHBondContact O-N 3.01Å; I458-F597 HydrophobicContact CD1-CD2 4Å; I458-F597 HydrophobicContact CD1-CE2 4.48Å; I458-F597 HydrophobicContact CD1-CG 4.44Å; I458-F597 HydrophobicContact CG1-CB 4.21Å; I458-F597 HydrophobicContact CG1-CD1 4.19Å; I458-F597 HydrophobicContact CG1-CD2 3.65Å; I458-F597 HydrophobicContact CG1-CE1 4.5Å; I458-F597 HydrophobicContact CG1-CE2 3.99Å; I458-F597 HydrophobicContact CG1-CG 3.77Å; I458-F597 HydrophobicContact CG1-CZ 4.41Å
459	I	97.8	Very high	96.1	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.01	14%	0.138	C	C	.	.	H	α-helix	trans	-64.9	-36.9	176.4	-70.3	-61.5	0	0	0	111.6	F303 I412 I437 C455 L462 C463	F303-I459 HydrophobicContact CB-CG2 3.65Å; F303-I459 HydrophobicContact CD1-CD1 3.68Å; F303-I459 HydrophobicContact CD2-CG2 4.24Å; F303-I459 HydrophobicContact CE1-CD1 3.85Å; F303-I459 HydrophobicContact CG-CD1 4.05Å; F303-I459 HydrophobicContact CG-CG2 3.94Å; F303-I459 HydrophobicContact CZ-CD1 4.37Å; I412-I459 HydrophobicContact CD1-CD1 4.46Å; I437-I459 HydrophobicContact CD1-CD1 3.88Å; C455-I459 WeakPolarHBondContact O-CB 3.42Å; C455-I459 VanDerWaalsContact O-CG1 3.31Å; C455-I459 WeakPolarHBondContact O-CG1 3.31Å; C455-I459 PolarHBondContact O-N 3.47Å; I459-L462 HydrophobicContact CD1-CD1 4.29Å; I459-L462 PolarHBondContact O-N 3.43Å; I459-C463 WeakPolarHBondContact O-CB 3.5Å; I459-C463 PolarHBondContact O-N 3.36Å; I459-C463 PolarHBondContact O-SG 3.27Å
460	N	96.2	Very high	95.8	Very high	8 Å²	8	23 Å²	23	4%	0.043	14%	0.14	C	C	.	.	H	α-helix	trans	-62.5	-43.3	174.6	-167.1	102	0	0	0	111.8	D456 G457 I458 C463 H464 C474 F475 N476	D456-N460 WeakPolarHBondContact O-CB 3.04Å; D456-N460 PolarHBondContact O-N 2.99Å; G457-N460 PolarHBondContact O-N 3.24Å; I458-N460 PolarHBondContact O-N 3.06Å; N460-C463 PolarHBondContact O-N 2.82Å; N460-H464 PolarHBondContact ND2-CE1 3.32Å; N460-H464 PolarHBondContact O-N 3.1Å; N460-C474 WeakPolarHBondContact OD1-CA 3.39Å; N460-F475 HydrophobicContact CB-CD1 4.32Å; N460-F475 HydrophobicContact CB-CE1 3.72Å; N460-F475 HydrophobicContact CB-CZ 4.1Å; N460-F475 VanDerWaalsContact OD1-CD1 3.28Å; N460-F475 WeakPolarHBondContact OD1-CD1 3.47Å; N460-F475 WeakPolarHBondContact OD1-CE1 3.48Å; N460-F475 PolarHBondContact OD1-N 3.2Å; N460-N476 PolarHBondContact ND2-O 3.23Å; N460-N476 PolarHBondContact OD1-N 2.8Å; N460-N476 VanDerWaalsContact OD1-N 3.14Å
461	E	96.3	Very high	95.5	Very high	5 Å²	5	27.7 Å²	27.7	2%	0.023	16%	0.162	C	C	.	.	H	α-helix	trans	-66.2	-41.7	176.3	-178.2	60.6	-160.5	0	0	112.1	G457 I458 C463 H464 R465 L480 F597	G457-E461 PolarHBondContact O-N 3.25Å; G457-E461 VanDerWaalsContact O-N 3.14Å; I458-E461 PolarHBondContact O-N 2.99Å; E461-C463 PolarHBondContact O-N 3.12Å; E461-H464 PolarHBondContact O-N 2.99Å; E461-H464 IonicContact OE2-ND1 3.84Å; E461-R465 WeakPolarHBondContact O-CG 3.19Å; E461-R465 PolarHBondContact O-N 2.78Å; E461-R465 VanDerWaalsContact O-N 3.16Å; E461-R465 IonicContact OE1-CZ 3.48Å; E461-R465 VanDerWaalsContact OE1-CZ 3.23Å; E461-R465 IonicContact OE1-NE 3.08Å; E461-R465 PolarHBondContact OE1-NE 3.27Å; E461-R465 IonicContact OE1-NH2 3.5Å; E461-R465 PolarHBondContact OE1-NH2 3.47Å; E461-L480 PolarHBondContact OE2-N 3.41Å; E461-F597 HydrophobicContact CB-CE1 4.39Å; E461-F597 HydrophobicContact CG-CE1 4.27Å
462	L	97	Very high	95.2	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-63.1	-40	173.1	-73.1	172.2	0	0	0	112.1	L217 V220 V221 L224 I437 L451 I458 I459 R465 L466	L217-L462 HydrophobicContact CD1-CD2 3.69Å; V220-L462 HydrophobicContact CG1-CD2 3.99Å; V221-L462 HydrophobicContact CG2-CD2 4.01Å; L224-L462 HydrophobicContact CD1-CD1 4.35Å; L224-L462 HydrophobicContact CD1-CD2 4.2Å; I437-L462 HydrophobicContact CD1-CD1 3.82Å; L451-L462 HydrophobicContact CD1-CD1 4Å; L451-L462 HydrophobicContact CD1-CD2 4.41Å; L451-L462 HydrophobicContact CD1-CG 4.47Å; I458-L462 HydrophobicContact CG2-CD1 4.16Å; I458-L462 WeakPolarHBondContact O-CG 3.48Å; I458-L462 PolarHBondContact O-N 3.01Å; I459-L462 HydrophobicContact CD1-CD1 4.29Å; I459-L462 PolarHBondContact O-N 3.43Å; L462-R465 PolarHBondContact O-N 2.88Å; L462-L466 WeakPolarHBondContact O-CB 3.46Å; L462-L466 VanDerWaalsContact O-CG 3.27Å; L462-L466 WeakPolarHBondContact O-CG 3.25Å; L462-L466 PolarHBondContact O-N 3.26Å
463	C	96.8	Very high	94.9	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.007	20%	0.2	C	C	.	.	H	α-helix	trans	-63.6	-39.4	176.2	-76.7	0	0	0	0	112.7	I459 N460 E461 G467 F470 C474	I459-C463 WeakPolarHBondContact O-CB 3.5Å; I459-C463 PolarHBondContact O-N 3.36Å; I459-C463 PolarHBondContact O-SG 3.27Å; N460-C463 PolarHBondContact O-N 2.82Å; E461-C463 PolarHBondContact O-N 3.12Å; C463-G467 PolarHBondContact O-N 2.9Å; C463-F470 HydrophobicContact CB-CB 4.11Å; C463-F470 WeakPolarHBondContact CB-O 3.17Å; C463-C474 WeakPolarHBondContact CB-SG 3.29Å
464	H	94.9	Very high	94.7	Very high	38 Å²	38	37.1 Å²	37.1	18%	0.176	21%	0.21	C	C	.	.	H	α-helix	trans	-58.9	-45.4	171.1	-74	148.4	0	0	0	112	N460 E461 G467 C474 N476 L478 T479	N460-H464 PolarHBondContact ND2-CE1 3.32Å; N460-H464 PolarHBondContact O-N 3.1Å; E461-H464 PolarHBondContact O-N 2.99Å; E461-H464 IonicContact OE2-ND1 3.84Å; H464-G467 PolarHBondContact O-N 3.05Å; H464-C474 PolarHBondContact CD2-SG 3.33Å; H464-N476 PolarHBondContact CE1-O 3.34Å; H464-N476 PolarHBondContact NE2-O 3.49Å; H464-N476 VanDerWaalsContact NE2-O 3.13Å; H464-L478 PolarHBondContact CE1-O 3.29Å; H464-T479 HydrophobicContact CB-CG2 4.07Å
465	R	95	Very high	94.3	Very high	75 Å²	75	39.2 Å²	39.2	28%	0.283	22%	0.215	S	C	.	.	H	α-helix	trans	-73.3	-28.7	-176.4	-66.4	-175.9	-172.9	-142.2	1.8	113.8	L217 E218 V221 E461 L462 Y587	L217-R465 VanDerWaalsContact CD2-CZ 3.47Å; E218-R465 IonicContact OE1-CZ 3.28Å; E218-R465 IonicContact OE1-NH1 2.66Å; E218-R465 PolarHBondContact OE1-NH1 3.47Å; V221-R465 HydrophobicContact CG1-CB 4.17Å; V221-R465 HydrophobicContact CG2-CB 3.63Å; V221-R465 HydrophobicContact CG2-CG 4.44Å; E461-R465 WeakPolarHBondContact O-CG 3.19Å; E461-R465 PolarHBondContact O-N 2.78Å; E461-R465 VanDerWaalsContact O-N 3.16Å; E461-R465 IonicContact OE1-CZ 3.48Å; E461-R465 VanDerWaalsContact OE1-CZ 3.23Å; E461-R465 IonicContact OE1-NE 3.08Å; E461-R465 PolarHBondContact OE1-NE 3.27Å; E461-R465 IonicContact OE1-NH2 3.5Å; E461-R465 PolarHBondContact OE1-NH2 3.47Å; L462-R465 PolarHBondContact O-N 2.88Å; R465-Y587 PolarHBondContact NH2-OH 3.33Å
466	L	95.2	Very high	93.6	Very high	16 Å²	16	41.7 Å²	41.7	8%	0.084	23%	0.228	C	C	.	.	H	α-helix	trans	-76.9	-33	173	-69.4	169.2	0	0	0	112.9	V221 L224 H225 F303 L462 F470	V221-L466 HydrophobicContact CG1-CD2 4.21Å; L224-L466 HydrophobicContact CB-CD1 4.41Å; L224-L466 HydrophobicContact CB-CD2 3.74Å; L224-L466 HydrophobicContact CD1-CD1 4.27Å; H225-L466 PolarHBondContact CE1-O 2.84Å; F303-L466 HydrophobicContact CE2-CD1 3.88Å; L462-L466 WeakPolarHBondContact O-CB 3.46Å; L462-L466 VanDerWaalsContact O-CG 3.27Å; L462-L466 WeakPolarHBondContact O-CG 3.25Å; L462-L466 PolarHBondContact O-N 3.26Å; L466-F470 HydrophobicContact CB-CB 3.97Å; L466-F470 HydrophobicContact CB-CD2 3.69Å; L466-F470 HydrophobicContact CB-CE2 4.44Å; L466-F470 HydrophobicContact CB-CG 3.93Å; L466-F470 HydrophobicContact CD1-CB 4.48Å; L466-F470 HydrophobicContact CD1-CD1 4.02Å; L466-F470 HydrophobicContact CD1-CD2 3.99Å; L466-F470 HydrophobicContact CD1-CE1 4.24Å; L466-F470 HydrophobicContact CD1-CE2 4.21Å; L466-F470 HydrophobicContact CD1-CG 3.89Å; L466-F470 HydrophobicContact CD1-CZ 4.34Å; L466-F470 HydrophobicContact CG-CD2 4.42Å
467	G	93.3	Very high	92.8	Very high	17 Å²	17	47 Å²	47	18%	0.175	26%	0.261	C	S	.	.			trans	62.6	-169.6	179.1	0	0	0	0	0	114.9	C463 H464 D469 F470	C463-G467 PolarHBondContact O-N 2.9Å; H464-G467 PolarHBondContact O-N 3.05Å; G467-D469 PolarHBondContact O-N 3.44Å; G467-F470 PolarHBondContact O-N 3.35Å
468	G	92.1	Very high	92.1	Very high	56 Å²	56	50.5 Å²	50.5	58%	0.577	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	58.7	-124.9	173.4	0	0	0	0	0	112.5	F470 E471	G468-F470 PolarHBondContact O-N 3.26Å; G468-F470 VanDerWaalsContact O-N 3.09Å; G468-E471 WeakPolarHBondContact O-CB 3.34Å; G468-E471 PolarHBondContact O-N 3.13Å
469	D	92.1	Very high	91.6	Very high	87 Å²	87	54.5 Å²	54.5	47%	0.465	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-59.1	-20.4	178.2	-69.9	-25.7	0	0	0	114	M306 Q310 G467 Q472	M306-D469 WeakPolarHBondContact CE-O 3.26Å; M306-D469 HydrophobicContact CG-CB 4.49Å; M306-D469 HydrophobicContact SD-CB 4.01Å; Q310-D469 PolarHBondContact NE2-OD2 2.55Å; G467-D469 PolarHBondContact O-N 3.44Å; D469-Q472 WeakPolarHBondContact O-CG 3.45Å; D469-Q472 PolarHBondContact O-NE2 3.29Å
470	F	93.7	Very high	91.2	Very high	10 Å²	10	55.7 Å²	55.7	4%	0.044	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-84.2	-27.3	176.7	-65.8	-82	0	0	0	112.6	F303 M306 L307 Q310 C463 L466 G467 G468 Q472 L473	F303-F470 AromaticContact CD2-CD1 3.79Å; F303-F470 HydrophobicContact CD2-CD1 3.79Å; F303-F470 AromaticContact CD2-CE1 3.87Å; F303-F470 HydrophobicContact CD2-CE1 3.87Å; F303-F470 AromaticContact CE2-CD1 3.85Å; F303-F470 HydrophobicContact CE2-CD1 3.85Å; F303-F470 AromaticContact CE2-CE1 3.74Å; F303-F470 HydrophobicContact CE2-CE1 3.74Å; M306-F470 HydrophobicContact CB-CD1 4.34Å; M306-F470 HydrophobicContact CB-CE1 3.94Å; M306-F470 HydrophobicContact CG-CD1 4Å; M306-F470 HydrophobicContact CG-CE1 3.71Å; M306-F470 HydrophobicContact CG-CZ 4.09Å; L307-F470 HydrophobicContact CD2-CE1 4.1Å; L307-F470 HydrophobicContact CD2-CZ 3.91Å; Q310-F470 VanDerWaalsContact OE1-CE2 3.25Å; Q310-F470 VanDerWaalsContact OE1-CZ 3.23Å; C463-F470 HydrophobicContact CB-CB 4.11Å; C463-F470 WeakPolarHBondContact CB-O 3.17Å; L466-F470 HydrophobicContact CB-CB 3.97Å; L466-F470 HydrophobicContact CB-CD2 3.69Å; L466-F470 HydrophobicContact CB-CE2 4.44Å; L466-F470 HydrophobicContact CB-CG 3.93Å; L466-F470 HydrophobicContact CD1-CB 4.48Å; L466-F470 HydrophobicContact CD1-CD1 4.02Å; L466-F470 HydrophobicContact CD1-CD2 3.99Å; L466-F470 HydrophobicContact CD1-CE1 4.24Å; L466-F470 HydrophobicContact CD1-CE2 4.21Å; L466-F470 HydrophobicContact CD1-CG 3.89Å; L466-F470 HydrophobicContact CD1-CZ 4.34Å; L466-F470 HydrophobicContact CG-CD2 4.42Å; G467-F470 PolarHBondContact O-N 3.35Å; G468-F470 PolarHBondContact O-N 3.26Å; G468-F470 VanDerWaalsContact O-N 3.09Å; F470-Q472 VanDerWaalsContact C-N 3.25Å; F470-Q472 PolarHBondContact O-N 3.35Å; F470-L473 HydrophobicContact CD1-CD1 4.32Å; F470-L473 VanDerWaalsContact O-CB 3.26Å; F470-L473 WeakPolarHBondContact O-CB 3.33Å; F470-L473 PolarHBondContact O-N 3.34Å
471	E	91	Very high	90.9	Very high	119 Å²	119	60.3 Å²	60.3	56%	0.556	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-63.1	-32.7	-178.2	-162.3	176.5	167.7	0	0	111.8	G468 L473 C474	G468-E471 WeakPolarHBondContact O-CB 3.34Å; G468-E471 PolarHBondContact O-N 3.13Å; E471-L473 PolarHBondContact O-N 3.37Å; E471-L473 VanDerWaalsContact O-N 3.09Å; E471-C474 WeakPolarHBondContact O-CB 3.33Å; E471-C474 PolarHBondContact O-N 3.2Å; E471-C474 VanDerWaalsContact O-N 3.11Å
472	Q	92.1	Very high	90.8	Very high	135 Å²	135	63.8 Å²	63.8	63%	0.631	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-66.7	-6.9	173.9	84	-165.5	-59.6	0	0	114.3	M306 D469 F470	M306-Q472 HydrophobicContact CE-CG 4.48Å; D469-Q472 WeakPolarHBondContact O-CG 3.45Å; D469-Q472 PolarHBondContact O-NE2 3.29Å; F470-Q472 VanDerWaalsContact C-N 3.25Å; F470-Q472 PolarHBondContact O-N 3.35Å
473	L	92.1	Very high	90.7	Very high	34 Å²	34	65.6 Å²	65.6	18%	0.178	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-96.6	-11.5	175.8	-51.7	-179.2	0	0	0	112.7	R302 M306 F470 E471 F475	R302-L473 HydrophobicContact CB-CD2 4.29Å; M306-L473 HydrophobicContact CB-CD1 3.93Å; M306-L473 HydrophobicContact CE-CD1 4.3Å; M306-L473 HydrophobicContact CE-CD2 4.01Å; M306-L473 HydrophobicContact CE-CG 4.33Å; M306-L473 HydrophobicContact CG-CD1 4.34Å; F470-L473 HydrophobicContact CD1-CD1 4.32Å; F470-L473 VanDerWaalsContact O-CB 3.26Å; F470-L473 WeakPolarHBondContact O-CB 3.33Å; F470-L473 PolarHBondContact O-N 3.34Å; E471-L473 PolarHBondContact O-N 3.37Å; E471-L473 VanDerWaalsContact O-N 3.09Å; L473-F475 PolarHBondContact O-N 3.39Å
474	C	91.1	Very high	90.4	Very high	30 Å²	30	70.2 Å²	70.2	20%	0.203	38%	0.381	C	S	.	.			trans	-69.8	128	179.3	-64.9	0	0	0	0	110.7	N460 C463 H464 E471	N460-C474 WeakPolarHBondContact OD1-CA 3.39Å; C463-C474 WeakPolarHBondContact CB-SG 3.29Å; H464-C474 PolarHBondContact CD2-SG 3.33Å; E471-C474 WeakPolarHBondContact O-CB 3.33Å; E471-C474 PolarHBondContact O-N 3.2Å; E471-C474 VanDerWaalsContact O-N 3.11Å
475	F	87.9	Confident	90.1	Very high	127 Å²	127	75.9 Å²	75.9	56%	0.557	41%	0.408	S	S	*	.	S	Bend	trans	-102.9	-16.3	177.8	62.4	-91.6	0	0	0	112.5	P299 D456 N460 L473	P299-F475 HydrophobicContact CB-CD1 4.1Å; P299-F475 HydrophobicContact CB-CE1 3.99Å; P299-F475 HydrophobicContact CG-CD1 3.5Å; P299-F475 HydrophobicContact CG-CE1 3.55Å; D456-F475 HydrophobicContact CB-CE1 4.22Å; D456-F475 HydrophobicContact CB-CZ 4.3Å; D456-F475 WeakPolarHBondContact O-CE1 3.48Å; N460-F475 HydrophobicContact CB-CD1 4.32Å; N460-F475 HydrophobicContact CB-CE1 3.72Å; N460-F475 HydrophobicContact CB-CZ 4.1Å; N460-F475 VanDerWaalsContact OD1-CD1 3.28Å; N460-F475 WeakPolarHBondContact OD1-CD1 3.47Å; N460-F475 WeakPolarHBondContact OD1-CE1 3.48Å; N460-F475 PolarHBondContact OD1-N 3.2Å; L473-F475 PolarHBondContact O-N 3.39Å
476	N	82.5	Confident	89.6	Confident	63 Å²	63	77.3 Å²	77.3	34%	0.337	42%	0.416	S	S	.	.			trans	-121.2	128.8	169.7	179.4	10.5	0	0	0	108.4	N460 H464 L478	N460-N476 PolarHBondContact ND2-O 3.23Å; N460-N476 PolarHBondContact OD1-N 2.8Å; N460-N476 VanDerWaalsContact OD1-N 3.14Å; H464-N476 PolarHBondContact CE1-O 3.34Å; H464-N476 PolarHBondContact NE2-O 3.49Å; H464-N476 VanDerWaalsContact NE2-O 3.13Å; N476-L478 VanDerWaalsContact C-N 3.32Å; N476-L478 WeakPolarHBondContact OD1-CB 3.12Å; N476-L478 PolarHBondContact OD1-N 3.08Å; N476-L478 VanDerWaalsContact OD1-N 3.09Å
477	T	78.1	Confident	89.1	Confident	130 Å²	130	77.3 Å²	77.3	80%	0.798	42%	0.417	S	S	*	.			trans	-85.7	-0.8	-178.9	56.5	0	0	0	0	113.8
478	L	81.9	Confident	88.3	Confident	105 Å²	105	81.8 Å²	81.8	55%	0.55	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-84.9	116.2	175	-62.3	173.6	0	0	0	110.1	H464 N476	H464-L478 PolarHBondContact CE1-O 3.29Å; N476-L478 VanDerWaalsContact C-N 3.32Å; N476-L478 WeakPolarHBondContact OD1-CB 3.12Å; N476-L478 PolarHBondContact OD1-N 3.08Å; N476-L478 VanDerWaalsContact OD1-N 3.09Å
479	T	86.2	Confident	87.4	Confident	85 Å²	85	85 Å²	85	52%	0.521	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-70.7	139.9	162.4	50.7	0	0	0	0	110	H464	H464-T479 HydrophobicContact CB-CG2 4.07Å
480	L	90.3	Very high	86.1	Confident	27 Å²	27	87.7 Å²	87.7	14%	0.141	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-87.4	142.5	-179.9	-60.4	177	0	0	0	111.7	E461 Y587 F597	E461-L480 PolarHBondContact OE2-N 3.41Å; L480-Y587 HydrophobicContact CB-CD1 3.64Å; L480-Y587 HydrophobicContact CB-CE1 4.16Å; L480-Y587 HydrophobicContact CD1-CD1 4.45Å; L480-F597 HydrophobicContact CD1-CD1 3.71Å; L480-F597 HydrophobicContact CD1-CE1 4Å
481	N	90.3	Very high	84.2	Confident	104 Å²	104	91.8 Å²	91.8	56%	0.556	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.5	141.3	177.9	-59.2	-86	0	0	0	110.9	G585 Q586 Y587	N481-G585 PolarHBondContact N-O 2.82Å; N481-G585 PolarHBondContact ND2-O 2.82Å; N481-Q586 CarbonylContact O-C 3.58Å; N481-Q586 VanDerWaalsContact O-CA 3.27Å; N481-Q586 WeakPolarHBondContact O-CA 3.13Å; N481-Y587 PolarHBondContact O-N 3.38Å
482	E	93.6	Very high	82.2	Confident	79 Å²	79	93.1 Å²	93.1	37%	0.369	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	135.4	172.3	-166.5	155.7	133.6	0	0	111.3	Y587 F589	E482-Y587 HydrophobicContact CB-CE2 3.73Å; E482-Y587 HydrophobicContact CG-CD2 4.32Å; E482-Y587 HydrophobicContact CG-CE2 3.53Å; E482-Y587 WeakPolarHBondContact OE2-CE2 3.06Å; E482-Y587 PolarHBondContact OE2-OH 3.25Å; E482-F589 HydrophobicContact CG-CB 3.96Å; E482-F589 WeakPolarHBondContact OE1-CB 3.15Å
483	I	93.9	Very high	79.8	Confident	40 Å²	40	91.9 Å²	91.9	21%	0.205	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	149	161.6	65.7	173	0	0	0	109.3	P487 L582 Q586 Y587 L588 F589	I483-P487 HydrophobicContact CD1-CG 3.69Å; I483-L582 HydrophobicContact CD1-CD2 3.88Å; I483-Q586 HydrophobicContact CG2-CG 4.1Å; I483-Y587 WeakPolarHBondContact CG1-O 3.45Å; I483-Y587 PolarHBondContact N-O 3.18Å; I483-L588 HydrophobicContact CD1-CB 4.38Å; I483-L588 HydrophobicContact CG1-CB 4Å; I483-L588 HydrophobicContact CG1-CD1 4.11Å; I483-L588 CarbonylContact O-C 3.56Å; I483-L588 WeakPolarHBondContact O-CA 3.3Å; I483-F589 PolarHBondContact O-N 3.1Å
484	T	91.8	Very high	77.5	Confident	98 Å²	98	95.5 Å²	95.5	60%	0.601	53%	0.527	S	S	*	.			trans	-109.1	-16.8	177.9	53.1	0	0	0	0	113.2	F589	T484-F589 HydrophobicContact CG2-CD1 4.34Å
485	E	88.3	Confident	75.2	Confident	157 Å²	157	99 Å²	99	73%	0.734	55%	0.55	S	S	*	.	S	Bend	trans	-94.5	140.1	-176.9	-65.5	-171.2	172.1	0	0	112.5	P487	E485-P487 WeakPolarHBondContact O-CD 3.23Å; E485-P487 VanDerWaalsContact O-N 3.16Å
486	K	85.2	Confident	73.1	Confident	105 Å²	105	98.9 Å²	98.9	46%	0.457	56%	0.561	S	S	.	*			trans	-43.2	103.5	167.3	67.2	65.1	173.8	172.5	0	113.3	L588 D609	K486-L588 HydrophobicContact CB-CD1 4.44Å; K486-L588 HydrophobicContact CB-CD2 3.86Å; K486-L588 HydrophobicContact CG-CD2 4.3Å; K486-D609 IonicContact NZ-OD1 2.81Å; K486-D609 PolarHBondContact NZ-OD1 3.49Å; K486-D609 IonicContact NZ-OD2 3.59Å; K486-D609 PolarHBondContact NZ-OD2 3.33Å
487	P	83.4	Confident	71.4	Confident	16 Å²	16	103 Å²	103	10%	0.104	58%	0.584	C	S	.	*	P	Polyproline II helix	trans	-58.2	138.3	172	-22.9	33.9	0	0	0	110.8	I483 E485 R581 L582	I483-P487 HydrophobicContact CD1-CG 3.69Å; E485-P487 WeakPolarHBondContact O-CD 3.23Å; E485-P487 VanDerWaalsContact O-N 3.16Å; P487-R581 HydrophobicContact CB-CB 3.83Å; P487-R581 VanDerWaalsContact CB-O 3.23Å; P487-R581 WeakPolarHBondContact CB-O 3.32Å; P487-L582 HydrophobicContact CG-CD2 4.07Å
488	P	77.8	Confident	69.3	Low	110 Å²	110	105.6 Å²	105.6	71%	0.714	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-59.9	149.3	-170.7	23	-33.4	0	0	0	111.8	L490 R581	P488-L490 PolarHBondContact O-N 3.47Å; P488-R581 WeakPolarHBondContact O-CD 3.42Å
489	R	73.1	Confident	67	Low	123 Å²	123	105.3 Å²	105.3	46%	0.464	60%	0.6	S	S	.	*	P	Polyproline II helix	trans	-64.9	124	170.1	-64.2	179.4	-176	172.8	0.7	107.5	A491 S606 E610	R489-A491 PolarHBondContact O-N 3.28Å; R489-S606 PolarHBondContact NH2-O 3.27Å; R489-S606 PolarHBondContact NH2-OG 3.17Å; R489-E610 IonicContact NH1-OE1 2.75Å
490	L	64.3	Low	64.6	Low	144 Å²	144	107 Å²	107	75%	0.754	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-57	131.5	162.3	-66.9	172.9	0	0	0	107.2	P488 D492	P488-L490 PolarHBondContact O-N 3.47Å; L490-D492 PolarHBondContact O-N 3.16Å
491	A	53.4	Low	61.9	Low	97 Å²	97	111.9 Å²	111.9	80%	0.802	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-61.7	131.8	179.1	0	0	0	0	0	109.9	R489	R489-A491 PolarHBondContact O-N 3.28Å
492	D	50	Low	58.9	Low	146 Å²	146	114.5 Å²	114.5	78%	0.781	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-59.6	140.5	169.2	-70.9	-56.8	0	0	0	109	L490	L490-D492 PolarHBondContact O-N 3.16Å
493	P	41.8	Very low	56.6	Low	109 Å²	109	115.6 Å²	115.6	71%	0.708	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-59.4	142.4	174.7	26.8	-34.1	0	0	0	109.2
494	P	42	Very low	53.6	Low	111 Å²	111	120 Å²	120	72%	0.721	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-57	145.4	179.1	24.9	-34.1	0	0	0	110.2
495	P	43.1	Very low	50.7	Low	103 Å²	103	122.9 Å²	122.9	67%	0.669	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-56.9	144.4	172.8	27	-34.5	0	0	0	109.2	D497	P495-D497 PolarHBondContact O-N 2.98Å
496	P	44.2	Very low	47.8	Very low	124 Å²	124	124.6 Å²	124.6	81%	0.805	72%	0.719	S	S	*	*			trans	-62.3	115.1	177.5	26.1	-33.2	0	0	0	109.1	E498	P496-E498 PolarHBondContact O-N 3.28Å
497	D	45.9	Very low	45.6	Very low	150 Å²	150	124.6 Å²	124.6	80%	0.802	73%	0.73	S	S	*	*			trans	-53.7	132.9	-176.1	-73.1	-57.9	0	0	0	111.6	P495 A499	P495-D497 PolarHBondContact O-N 2.98Å; D497-A499 PolarHBondContact O-N 3.17Å
498	E	35.9	Very low	43.2	Very low	185 Å²	185	129.8 Å²	129.8	86%	0.864	76%	0.764	S	S	*	*			trans	-67	102.5	173.3	-68.6	-167.6	153	0	0	109.1	P496 S500	P496-E498 PolarHBondContact O-N 3.28Å; E498-S500 PolarHBondContact O-N 2.93Å
499	A	32.9	Very low	40.8	Very low	99 Å²	99	133.5 Å²	133.5	82%	0.818	77%	0.772	S	S	*	*			trans	-60.3	92.7	-176	0	0	0	0	0	111.6	D497 T501	D497-A499 PolarHBondContact O-N 3.17Å; A499-T501 PolarHBondContact O-N 3.14Å
500	S	35.8	Very low	38.6	Very low	120 Å²	120	135.9 Å²	135.9	84%	0.839	79%	0.788	S	S	*	*			trans	-67	131	178.4	-70.8	0	0	0	0	110.5	E498	E498-S500 PolarHBondContact O-N 2.93Å
501	T	33.1	Very low	36.7	Very low	130 Å²	130	134.2 Å²	134.2	80%	0.798	78%	0.784	S	S	*	*			trans	-78.5	129.9	-175	51.5	0	0	0	0	112.6	A499	A499-T501 PolarHBondContact O-N 3.14Å
502	D	28.1	Very low	35.4	Very low	159 Å²	159	139 Å²	139	85%	0.85	79%	0.79	S	S	*	*				-161.6	146.3	121.3	-127.9	-5.6	0	0	0	112.4
503	P	45.5	Very low	34.3	Very low	102 Å²	102	137.4 Å²	137.4	66%	0.662	79%	0.79	S	S	*	*			trans	-114.9	136.6	175.6	36.9	-25.7	0	0	0	113.5
504	T	30.4	Very low	33.6	Very low	131 Å²	131	140.4 Å²	140.4	80%	0.804	80%	0.795	S	S	*	*			trans	-159.9	140.7	144.6	-2.7	0	0	0	0	115.6
505	D	30.6	Very low	32.9	Very low	160 Å²	160	141.6 Å²	141.6	86%	0.856	80%	0.795	S	S	*	*			trans	69.3	153.8	152.8	-74.3	-38.4	0	0	0	124.5
506	K	26.8	Very low	32.2	Very low	192 Å²	192	142.5 Å²	142.5	84%	0.835	80%	0.798	S	S	*	*			trans	-132.2	179.4	-165.6	-85.9	-176.3	175.2	-175.9	0	108.7
507	P	39	Very low	31.3	Very low	106 Å²	106	142.8 Å²	142.8	69%	0.688	80%	0.798	S	S	*	*			cis	-121.7	-162.1	-32.3	33.2	-14.9	0	0	0	109.7
508	P	33.7	Very low	30.5	Very low	125 Å²	125	144.2 Å²	144.2	81%	0.812	80%	0.8	S	S	*	*				-137.6	161.5	112.2	37.1	-27.1	0	0	0	114.3
509	E	27.2	Very low	29.9	Very low	187 Å²	187	142.1 Å²	142.1	87%	0.874	80%	0.8	S	S	*	*			trans	-87.2	176.8	168.4	-73.4	-179.3	128.3	0	0	112.1
510	E	26.9	Very low	29.6	Very low	174 Å²	174	143.8 Å²	143.8	81%	0.813	80%	0.8	S	S	*	*			trans	-47.9	168.5	174.3	-43.7	-179.4	165.1	0	0	114.6
511	T	24.4	Very low	28.9	Very low	108 Å²	108	144 Å²	144	66%	0.663	80%	0.796	S	S	*	*			cis	-159.4	153.9	19.1	-25.5	0	0	0	0	109.7
512	Q	25.7	Very low	29.3	Very low	197 Å²	197	143.3 Å²	143.3	92%	0.921	79%	0.794	S	S	*	*				175.3	145.8	122.8	-96.7	169.8	33.3	0	0	112.8
513	S	27.9	Very low	29.2	Very low	113 Å²	113	140.9 Å²	140.9	79%	0.79	79%	0.789	S	S	*	*			trans	-149.8	146.5	178.2	56	0	0	0	0	110.9
514	E	26.4	Very low	28.3	Very low	173 Å²	173	144 Å²	144	81%	0.808	80%	0.795	S	S	*	*			trans	-132.7	118.4	171.5	-75.4	-151.7	124.1	0	0	107.6
515	N	28.4	Very low	28.5	Very low	135 Å²	135	144.1 Å²	144.1	72%	0.722	80%	0.798	S	S	*	*				74.4	136	88.6	-81.9	-31.2	0	0	0	112.9
516	V	28.1	Very low	28.1	Very low	122 Å²	122	140.9 Å²	140.9	74%	0.739	79%	0.787	S	S	*	*			cis	-145.1	179.7	1.5	-105.4	0	0	0	0	107.9
517	T	24.5	Very low	28.2	Very low	130 Å²	130	137 Å²	137	80%	0.798	78%	0.784	S	S	*	*			cis	-148.5	-151	23.8	-29.3	0	0	0	0	111
518	Q	29.7	Very low	27.6	Very low	180 Å²	180	138.9 Å²	138.9	84%	0.841	79%	0.788	S	S	*	*			trans	-148.2	163.5	-175.5	-64.3	177.2	-19	0	0	113
519	T	22.8	Very low	27.2	Very low	142 Å²	142	139.5 Å²	139.5	87%	0.871	79%	0.79	S	S	*	*			trans	176.5	144.9	147.9	21.5	0	0	0	0	109.4
520	V	25.9	Very low	27.4	Very low	134 Å²	134	134.8 Å²	134.8	81%	0.812	78%	0.783	S	S	*	*			cis	-157.8	171.7	-25.2	80.7	0	0	0	0	109.5
521	T	22.6	Very low	27.5	Very low	123 Å²	123	131 Å²	131	76%	0.755	78%	0.776	S	S	*	*			trans	-122.9	-173.2	-177.6	51.6	0	0	0	0	110.1
522	P	40.6	Very low	27.8	Very low	116 Å²	116	134.9 Å²	134.9	75%	0.753	79%	0.787	S	S	*	*			cis	-125.4	-158.5	7.5	29.7	-2.1	0	0	0	112.2
523	S	26.4	Very low	27.9	Very low	108 Å²	108	131.2 Å²	131.2	76%	0.755	78%	0.782	S	S	*	*			cis	-158.1	170.2	21.4	-46.3	0	0	0	0	113.7
524	E	27.3	Very low	28	Very low	167 Å²	167	130.2 Å²	130.2	78%	0.78	78%	0.781	S	S	*	*			trans	-84.9	-175.5	163.9	-52.5	-172.1	142.1	0	0	112.8
525	P	33.2	Very low	28	Very low	135 Å²	135	130 Å²	130	88%	0.877	79%	0.785	S	S	*	*				-136.3	164.9	77.8	39	-25.1	0	0	0	116.1
526	C	22.2	Very low	28	Very low	92 Å²	92	127.5 Å²	127.5	62%	0.622	78%	0.784	S	S	*	*			trans	-127.1	156.2	-175.2	178.4	0	0	0	0	112.6
527	S	28.6	Very low	28	Very low	111 Å²	111	126.5 Å²	126.5	78%	0.776	79%	0.788	S	S	*	*			trans	-178.7	110	150.3	28.8	0	0	0	0	118
528	N	28.3	Very low	27.9	Very low	144 Å²	144	129.6 Å²	129.6	77%	0.77	79%	0.793	S	S	*	*			trans	28.1	131.9	130.1	-55.4	-15.5	0	0	0	124.7
529	T	25	Very low	27.8	Very low	138 Å²	138	126.2 Å²	126.2	85%	0.847	79%	0.79	S	S	*	*				-174.5	126	116.7	19.1	0	0	0	0	109
530	A	30.6	Very low	28.7	Very low	89 Å²	89	125.7 Å²	125.7	74%	0.736	79%	0.789	S	S	*	*				76.5	137.1	71.8	0	0	0	0	0	114.6
531	S	29.7	Very low	28.9	Very low	94 Å²	94	127 Å²	127	66%	0.657	79%	0.786	S	S	*	*			cis	-177.7	163.9	-7.1	51.9	0	0	0	0	113.4
532	Q	30.8	Very low	29.4	Very low	190 Å²	190	126.8 Å²	126.8	89%	0.888	79%	0.787	S	S	*	*			trans	73.5	157.6	161.6	-64.5	167.6	17.9	0	0	117.8
533	S	27.4	Very low	28.7	Very low	119 Å²	119	129.5 Å²	129.5	83%	0.832	79%	0.789	S	S	*	*			cis	-138.6	-177.4	8.6	59.4	0	0	0	0	113.5
534	A	30.3	Very low	28.7	Very low	92 Å²	92	135.5 Å²	135.5	76%	0.76	80%	0.796	S	S	*	*			trans	-153.2	154.8	179.9	0	0	0	0	0	113.3
535	D	26.1	Very low	28.7	Very low	168 Å²	168	136.3 Å²	136.3	90%	0.898	80%	0.8	S	S	*	*			trans	179.1	156.9	164.3	-91.9	-32.2	0	0	0	107.9
536	A	28.5	Very low	28.5	Very low	84 Å²	84	137.1 Å²	137.1	69%	0.694	80%	0.796	S	S	*	*			cis	-166	150.9	-26.3	0	0	0	0	0	111.1
537	A	27.3	Very low	28.8	Very low	100 Å²	100	137.1 Å²	137.1	83%	0.826	80%	0.803	S	S	*	*			trans	69.2	150.8	152.1	0	0	0	0	0	124.4
538	E	23.2	Very low	28.7	Very low	195 Å²	195	136.2 Å²	136.2	91%	0.911	80%	0.802	S	S	*	*			trans	89.4	136.2	148.3	-147.6	153.7	-121.1	0	0	121.7
539	S	27	Very low	28.8	Very low	110 Å²	110	137.7 Å²	137.7	77%	0.769	80%	0.802	S	S	*	*			trans	-131.7	159.4	176.6	-53.1	0	0	0	0	109.1
540	P	41.4	Very low	28.9	Very low	131 Å²	131	136.8 Å²	136.8	85%	0.851	79%	0.792	S	S	*	*				-147	179.3	120.6	36.6	-20.2	0	0	0	115.5
541	E	30.3	Very low	28.7	Very low	161 Å²	161	141.7 Å²	141.7	75%	0.752	80%	0.799	S	S	*	*			trans	-76.8	-177.3	179.4	-51.5	176.6	137.2	0	0	113.6
542	P	33.8	Very low	28.6	Very low	119 Å²	119	142 Å²	142	77%	0.773	81%	0.808	S	S	*	*				-141.2	124.8	100.2	35.4	-21.3	0	0	0	116.8
543	Q	24.5	Very low	28.3	Very low	172 Å²	172	136.7 Å²	136.7	80%	0.804	80%	0.804	S	S	*	*				51.1	143.5	114.8	-62.8	-179.3	-23.8	0	0	123
544	R	27.8	Very low	28.2	Very low	235 Å²	235	140.7 Å²	140.7	89%	0.887	81%	0.81	S	S	*	*			trans	-123	156.5	161.4	-64.1	176.6	173.8	-176.2	-1.8	108.9
545	E	27.4	Very low	28	Very low	184 Å²	184	141.3 Å²	141.3	86%	0.86	82%	0.815	S	S	*	*			trans	-178.2	116.5	139.3	-104.3	165.2	-155.5	0	0	112
546	D	27.6	Very low	28	Very low	152 Å²	152	143 Å²	143	81%	0.813	81%	0.814	S	S	*	*				25.9	160	117.5	-60.6	-53	0	0	0	122.6
547	A	29.1	Very low	28	Very low	92 Å²	92	147 Å²	147	76%	0.76	82%	0.822	S	S	*	*			cis	-176.2	153.4	-23.8	0	0	0	0	0	111.9
548	A	25.9	Very low	28.1	Very low	92 Å²	92	151 Å²	151	76%	0.76	82%	0.824	S	S	*	*			trans	-174.2	135.9	156.8	0	0	0	0	0	109.1
549	K	30.6	Very low	28.3	Very low	174 Å²	174	148.6 Å²	148.6	76%	0.757	82%	0.823	S	S	*	*			cis	73.4	133.7	48.8	-70	-166.8	140.8	-67.6	0	114
550	D	28	Very low	28.3	Very low	119 Å²	119	148.7 Å²	148.7	64%	0.636	82%	0.823	S	S	*	*			cis	-155	163.9	-6.9	-86	-42.4	0	0	0	108.5
551	E	26.6	Very low	28	Very low	192 Å²	192	149.6 Å²	149.6	90%	0.897	81%	0.814	S	S	*	*			trans	166.7	159.3	141.3	-92.8	-74	91.8	0	0	110.4
552	A	27	Very low	28.1	Very low	101 Å²	101	147.6 Å²	147.6	84%	0.835	81%	0.814	S	S	*	*			trans	-137.9	159.6	-169.6	0	0	0	0	0	114.7
553	G	23.9	Very low	28.4	Very low	79 Å²	79	145.5 Å²	145.5	81%	0.814	80%	0.797	S	S	*	*			trans	-162.9	126.3	172.3	0	0	0	0	0	113
554	E	26.7	Very low	28.8	Very low	203 Å²	203	141.8 Å²	141.8	95%	0.949	78%	0.783	S	S	*	*			trans	-91.6	137.9	178.6	-64.5	-176.3	96.7	0	0	112.7
555	A	25.2	Very low	29.2	Very low	105 Å²	105	140.7 Å²	140.7	87%	0.868	78%	0.779	S	S	*	*			trans	-163.9	147.6	142.1	0	0	0	0	0	111.3
556	K	26.9	Very low	29.6	Very low	203 Å²	203	139 Å²	139	88%	0.883	77%	0.768	S	S	*	*			trans	-91.8	149.7	175.1	-62.7	166.2	-178.2	166.7	0	110.9
557	I	26.8	Very low	29.9	Very low	167 Å²	167	139 Å²	139	86%	0.856	76%	0.757	S	S	*	*			trans	-157.9	152.6	136	-103.5	151.2	0	0	0	108.8
558	Q	29.8	Very low	30.2	Very low	185 Å²	185	142 Å²	142	86%	0.864	75%	0.75	S	S	*	*			trans	-93.6	140.2	-170.9	-63.4	147.2	-55.6	0	0	112.2
559	T	27.5	Very low	30.6	Very low	145 Å²	145	146.7 Å²	146.7	89%	0.89	75%	0.748	S	S	*	*			trans	-131.1	134.2	156.3	52.8	0	0	0	0	108.6
560	S	28.3	Very low	30.6	Very low	111 Å²	111	145 Å²	145	78%	0.776	74%	0.744	S	S	*	*			trans	-126.8	134.1	-173	64	0	0	0	0	112.6
561	K	34.2	Very low	31	Very low	151 Å²	151	142.9 Å²	142.9	66%	0.657	74%	0.739	S	S	*	*			trans	61.7	127.6	174.5	-62.3	-179.6	177.5	-179.7	0	116.5	N564	K561-N564 WeakPolarHBondContact CE-OD1 3.48Å; K561-N564 PolarHBondContact NZ-ND2 3.17Å
562	P	33	Very low	31.7	Very low	118 Å²	118	140.5 Å²	140.5	77%	0.766	72%	0.722	S	S	*	*	S	Bend		-122.4	14.5	107.5	36.1	-34.5	0	0	0	114.6	N564	P562-N564 PolarHBondContact O-N 3.41Å
563	D	38.8	Very low	32.5	Very low	76 Å²	76	141 Å²	141	41%	0.406	71%	0.714	S	S	.	*	H	α-helix	trans	-70.3	-29.8	-166.4	-121.7	14.6	0	0	0	116	R565 K566 R567	D563-R565 PolarHBondContact O-N 3.18Å; D563-R565 VanDerWaalsContact O-N 3.17Å; D563-K566 PolarHBondContact O-N 3.42Å; D563-R567 PolarHBondContact O-N 3.37Å; D563-R567 IonicContact OD2-CZ 3.08Å; D563-R567 IonicContact OD2-NE 2.77Å; D563-R567 IonicContact OD2-NH2 2.87Å; D563-R567 PolarHBondContact OD2-NH2 3.17Å
564	N	33.9	Very low	33.6	Very low	94 Å²	94	142.1 Å²	142.1	50%	0.503	71%	0.71	S	S	.	*	H	α-helix	trans	-58.6	-32.6	-178.4	-83.1	42.4	0	0	0	112.7	K561 P562 Y568	K561-N564 WeakPolarHBondContact CE-OD1 3.48Å; K561-N564 PolarHBondContact NZ-ND2 3.17Å; P562-N564 PolarHBondContact O-N 3.41Å; N564-Y568 PolarHBondContact O-N 3.4Å; N564-Y568 VanDerWaalsContact O-N 3.16Å
565	R	36.3	Very low	35.6	Very low	212 Å²	212	137.1 Å²	137.1	80%	0.8	68%	0.682	S	S	*	*	H	α-helix	trans	-74.3	-32.6	-175.2	-144.1	174.4	-174.6	-177.5	0	112.4	D563 W569	D563-R565 PolarHBondContact O-N 3.18Å; D563-R565 VanDerWaalsContact O-N 3.17Å; R565-W569 PolarHBondContact O-N 3.44Å
566	K	36	Very low	38.2	Very low	147 Å²	147	135 Å²	135	64%	0.639	66%	0.661	S	S	*	*	H	α-helix	trans	-70.9	-46	173	-77.5	-174.6	174.9	-179.5	0	111.7	D563 Y568 W569 M570	D563-K566 PolarHBondContact O-N 3.42Å; K566-Y568 PolarHBondContact O-N 2.98Å; K566-W569 PolarHBondContact O-N 3.43Å; K566-M570 WeakPolarHBondContact O-CG 3.18Å; K566-M570 PolarHBondContact O-N 3.38Å
567	R	33.3	Very low	41.1	Very low	153 Å²	153	126 Å²	126	58%	0.577	62%	0.623	S	S	*	*	H	α-helix	trans	-61.5	-45.4	-179	-64.1	-177.9	-165.8	-176.6	4.4	111.8	D563 W569 M570 S571	D563-R567 PolarHBondContact O-N 3.37Å; D563-R567 IonicContact OD2-CZ 3.08Å; D563-R567 IonicContact OD2-NE 2.77Å; D563-R567 IonicContact OD2-NH2 2.87Å; D563-R567 PolarHBondContact OD2-NH2 3.17Å; R567-W569 VanDerWaalsContact C-N 3.29Å; R567-W569 PolarHBondContact O-N 2.9Å; R567-M570 PolarHBondContact O-N 2.98Å; R567-M570 VanDerWaalsContact O-N 3.14Å; R567-S571 PolarHBondContact O-N 3.06Å; R567-S571 PolarHBondContact O-OG 3.43Å
568	Y	35.4	Very low	44	Very low	155 Å²	155	118.3 Å²	118.3	61%	0.608	58%	0.583	S	S	*	*	H	α-helix	trans	-63.7	-31.9	178.7	-160	-98.3	0	0	0	113.5	N564 K566	N564-Y568 PolarHBondContact O-N 3.4Å; N564-Y568 VanDerWaalsContact O-N 3.16Å; K566-Y568 PolarHBondContact O-N 2.98Å
569	W	35.3	Very low	46.9	Very low	191 Å²	191	109.7 Å²	109.7	72%	0.723	54%	0.544	S	S	*	.	H	α-helix	trans	-68.9	-47.4	170.1	-97.7	74.4	0	0	0	112.2	R565 K566 R567 S571 R572 V573	R565-W569 PolarHBondContact O-N 3.44Å; K566-W569 PolarHBondContact O-N 3.43Å; R567-W569 VanDerWaalsContact C-N 3.29Å; R567-W569 PolarHBondContact O-N 2.9Å; W569-S571 VanDerWaalsContact C-N 3.31Å; W569-S571 PolarHBondContact O-N 3.22Å; W569-R572 PolarHBondContact O-N 2.78Å; W569-R572 VanDerWaalsContact O-N 3.08Å; W569-V573 PolarHBondContact O-N 3.1Å
570	M	30.1	Very low	49.9	Very low	137 Å²	137	110.5 Å²	110.5	68%	0.675	54%	0.535	S	S	*	.	H	α-helix	trans	-60.6	-38.6	178.9	-73.5	171.7	154.7	0	0	112.5	K566 R567 R572 V573 S574	K566-M570 WeakPolarHBondContact O-CG 3.18Å; K566-M570 PolarHBondContact O-N 3.38Å; R567-M570 PolarHBondContact O-N 2.98Å; R567-M570 VanDerWaalsContact O-N 3.14Å; M570-R572 VanDerWaalsContact C-N 3.28Å; M570-R572 PolarHBondContact O-N 3.45Å; M570-V573 PolarHBondContact O-N 3.33Å; M570-S574 PolarHBondContact O-N 2.93Å
571	S	36.8	Very low	52.8	Low	76 Å²	76	106.9 Å²	106.9	53%	0.531	50%	0.504	S	S	.	.	H	α-helix	trans	-62.5	-30	174.4	-60.7	0	0	0	0	113.7	R567 W569	R567-S571 PolarHBondContact O-N 3.06Å; R567-S571 PolarHBondContact O-OG 3.43Å; W569-S571 VanDerWaalsContact C-N 3.31Å; W569-S571 PolarHBondContact O-N 3.22Å
572	R	41.3	Very low	55.4	Low	142 Å²	142	100.3 Å²	100.3	54%	0.536	48%	0.476	S	S	.	.	H	α-helix	trans	-74.5	-37.4	173.6	-72.8	-175.7	172.3	-149.6	-8.6	112.4	W569 M570 S574 R575	W569-R572 PolarHBondContact O-N 2.78Å; W569-R572 VanDerWaalsContact O-N 3.08Å; M570-R572 VanDerWaalsContact C-N 3.28Å; M570-R572 PolarHBondContact O-N 3.45Å; R572-S574 PolarHBondContact O-N 2.91Å; R572-R575 PolarHBondContact O-N 3.44Å
573	V	42.9	Very low	58	Low	110 Å²	110	99.7 Å²	99.7	67%	0.667	47%	0.467	S	S	*	.	H	α-helix	trans	-63.5	-23	176.6	177.6	0	0	0	0	112.3	W569 M570	W569-V573 PolarHBondContact O-N 3.1Å; M570-V573 PolarHBondContact O-N 3.33Å
574	S	47.4	Very low	60.1	Low	104 Å²	104	99.3 Å²	99.3	73%	0.727	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-9.1	179.5	-160.4	0	0	0	0	115.4	M570 R572	M570-S574 PolarHBondContact O-N 2.93Å; R572-S574 PolarHBondContact O-N 2.91Å
575	R	67.6	Low	62.6	Low	98 Å²	98	96 Å²	96	37%	0.37	47%	0.469	S	S	.	.	S	Bend	trans	-92.7	135.4	-177.9	-70.1	-170.9	176.3	178.7	4.3	111.8	R572 Y603 S604	R572-R575 PolarHBondContact O-N 3.44Å; R575-Y603 HydrophobicContact CB-CD1 4.28Å; R575-Y603 WeakPolarHBondContact O-CE1 3.45Å; R575-S604 PolarHBondContact NH1-O 3.01Å
576	S	79.8	Confident	65.3	Low	60 Å²	60	87.9 Å²	87.9	42%	0.42	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-76.3	132	170.9	58.5	0	0	0	0	111	R581	S576-R581 PolarHBondContact O-NH2 3.47Å
577	P	88.1	Confident	68.1	Low	13 Å²	13	81 Å²	81	8%	0.084	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-67.4	153.3	174.4	29.2	-34.6	0	0	0	110.8	S579 K580 V602 Y603	P577-S579 PolarHBondContact O-N 3.25Å; P577-K580 HydrophobicContact CG-CD 4.24Å; P577-K580 HydrophobicContact CG-CG 4.14Å; P577-K580 PolarHBondContact O-N 3.43Å; P577-K580 VanDerWaalsContact O-N 3.14Å; P577-V602 CarbonylContact C-O 3.54Å; P577-V602 VanDerWaalsContact CA-O 3.24Å; P577-V602 WeakPolarHBondContact CA-O 3.16Å; P577-V602 WeakPolarHBondContact CB-O 3.19Å; P577-Y603 HydrophobicContact CB-CD1 4.18Å; P577-Y603 HydrophobicContact CB-CE1 3.99Å; P577-Y603 HydrophobicContact CG-CE1 4.36Å
578	I	88.4	Confident	71.1	Confident	6 Å²	6	73.8 Å²	73.8	3%	0.031	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-61.1	-35.5	-172.6	-59.8	172.2	0	0	0	111.2	K580 R581 L588 V602 S604	I578-K580 PolarHBondContact O-N 3.29Å; I578-K580 VanDerWaalsContact O-N 3.11Å; I578-R581 WeakPolarHBondContact O-CB 3.44Å; I578-R581 PolarHBondContact O-N 3.27Å; I578-L588 HydrophobicContact CG2-CD2 3.64Å; I578-V602 HydrophobicContact CD1-CG1 4.17Å; I578-V602 PolarHBondContact N-O 3.03Å; I578-S604 WeakPolarHBondContact CG1-OG 3.45Å
579	S	90.4	Very high	74	Confident	5 Å²	5	68.2 Å²	68.2	4%	0.035	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-55.8	-25.2	176.9	58.8	0	0	0	0	115	P577 R581 F597 A600	P577-S579 PolarHBondContact O-N 3.25Å; S579-R581 PolarHBondContact O-N 2.95Å; S579-F597 VanDerWaalsContact CB-O 3.23Å; S579-F597 WeakPolarHBondContact CB-O 3.12Å; S579-A600 WeakPolarHBondContact CB-O 3.34Å; S579-A600 PolarHBondContact OG-O 2.85Å
580	K	89.9	Confident	76.7	Confident	161 Å²	161	62.7 Å²	62.7	70%	0.7	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-80.6	-0.7	176	-71.2	-170	179.1	-171.5	0	114	P577 I578	P577-K580 HydrophobicContact CG-CD 4.24Å; P577-K580 HydrophobicContact CG-CG 4.14Å; P577-K580 PolarHBondContact O-N 3.43Å; P577-K580 VanDerWaalsContact O-N 3.14Å; I578-K580 PolarHBondContact O-N 3.29Å; I578-K580 VanDerWaalsContact O-N 3.11Å
581	R	89.9	Confident	79.6	Confident	35 Å²	35	59.7 Å²	59.7	13%	0.132	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-111	2.3	178.9	-45.5	-176.3	-156.6	142.6	11.4	112.8	P487 P488 S576 I578 S579 S604	P487-R581 HydrophobicContact CB-CB 3.83Å; P487-R581 VanDerWaalsContact CB-O 3.23Å; P487-R581 WeakPolarHBondContact CB-O 3.32Å; P488-R581 WeakPolarHBondContact O-CD 3.42Å; S576-R581 PolarHBondContact O-NH2 3.47Å; I578-R581 WeakPolarHBondContact O-CB 3.44Å; I578-R581 PolarHBondContact O-N 3.27Å; S579-R581 PolarHBondContact O-N 2.95Å; R581-S604 PolarHBondContact NH1-OG 3.08Å; R581-S604 PolarHBondContact NH2-OG 3.01Å
582	L	89.5	Confident	82.1	Confident	13 Å²	13	60.1 Å²	60.1	7%	0.068	34%	0.342	C	S	.	.	S	Bend	trans	-85.3	133	175.8	-61.4	171.3	0	0	0	110	I483 P487 L588 I596 H598	I483-L582 HydrophobicContact CD1-CD2 3.88Å; P487-L582 HydrophobicContact CG-CD2 4.07Å; L582-L588 HydrophobicContact CD2-CB 3.8Å; L582-I596 VanDerWaalsContact CD1-O 3.28Å; L582-I596 WeakPolarHBondContact CD1-O 3.46Å; L582-H598 WeakPolarHBondContact CB-NE2 3.46Å; L582-H598 PolarHBondContact O-NE2 2.78Å
583	D	87.7	Confident	84.7	Confident	106 Å²	106	54.2 Å²	54.2	57%	0.567	32%	0.321	S	S	*	.			trans	-63.5	153.1	168.2	-61.8	-50.2	0	0	0	110	G585 Q586 H598	D583-G585 PolarHBondContact O-N 3.12Å; D583-Q586 HydrophobicContact CB-CG 4.28Å; D583-Q586 PolarHBondContact O-N 3.09Å; D583-Q586 VanDerWaalsContact O-N 3.08Å; D583-Q586 PolarHBondContact OD2-NE2 3.27Å; D583-Q586 PolarHBondContact OD2-OE1 3.12Å; D583-H598 PolarHBondContact O-CE1 3.5Å; D583-H598 PolarHBondContact O-NE2 3.45Å
584	G	81.8	Confident	87.2	Confident	68 Å²	68	52.3 Å²	52.3	70%	0.701	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	7.1	-173.2	0	0	0	0	0	117
585	G	87.2	Confident	89.6	Confident	24 Å²	24	47.4 Å²	47.4	25%	0.247	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.3	22.6	176.5	0	0	0	0	0	113.7	N481 D583	N481-G585 PolarHBondContact N-O 2.82Å; N481-G585 PolarHBondContact ND2-O 2.82Å; D583-G585 PolarHBondContact O-N 3.12Å
586	Q	93	Very high	91	Very high	41 Å²	41	42.8 Å²	42.8	19%	0.192	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	152.8	-175.8	-69.1	163.7	-0.3	0	0	113	N481 I483 D583 H598	N481-Q586 CarbonylContact O-C 3.58Å; N481-Q586 VanDerWaalsContact O-CA 3.27Å; N481-Q586 WeakPolarHBondContact O-CA 3.13Å; I483-Q586 HydrophobicContact CG2-CG 4.1Å; D583-Q586 HydrophobicContact CB-CG 4.28Å; D583-Q586 PolarHBondContact O-N 3.09Å; D583-Q586 VanDerWaalsContact O-N 3.08Å; D583-Q586 PolarHBondContact OD2-NE2 3.27Å; D583-Q586 PolarHBondContact OD2-OE1 3.12Å; Q586-H598 PolarHBondContact O-CE1 3.09Å; Q586-H598 VanDerWaalsContact O-CE1 3.28Å
587	Y	94.9	Very high	91.8	Very high	3 Å²	3	40.2 Å²	40.2	1%	0.012	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	149.8	155.7	66.2	-100.5	0	0	0	109.9	L217 R465 L480 N481 E482 I483 Y595 I596 F597	L217-Y587 HydrophobicContact CD2-CE1 4.26Å; L217-Y587 HydrophobicContact CD2-CE2 4.41Å; R465-Y587 PolarHBondContact NH2-OH 3.33Å; L480-Y587 HydrophobicContact CB-CD1 3.64Å; L480-Y587 HydrophobicContact CB-CE1 4.16Å; L480-Y587 HydrophobicContact CD1-CD1 4.45Å; N481-Y587 PolarHBondContact O-N 3.38Å; E482-Y587 HydrophobicContact CB-CE2 3.73Å; E482-Y587 HydrophobicContact CG-CD2 4.32Å; E482-Y587 HydrophobicContact CG-CE2 3.53Å; E482-Y587 WeakPolarHBondContact OE2-CE2 3.06Å; E482-Y587 PolarHBondContact OE2-OH 3.25Å; I483-Y587 WeakPolarHBondContact CG1-O 3.45Å; I483-Y587 PolarHBondContact N-O 3.18Å; Y587-Y595 AromaticContact CD2-CD1 3.8Å; Y587-Y595 HydrophobicContact CD2-CD1 3.8Å; Y587-Y595 AromaticContact CE2-CD1 3.5Å; Y587-Y595 HydrophobicContact CE2-CD1 3.5Å; Y587-Y595 AromaticContact CE2-CE1 3.84Å; Y587-Y595 HydrophobicContact CE2-CE1 3.84Å; Y587-I596 WeakPolarHBondContact CA-O 3.48Å; Y587-F597 HydrophobicContact CD1-CD1 4.29Å; Y587-F597 AromaticContact CD1-CE1 3.67Å; Y587-F597 HydrophobicContact CD1-CE1 3.67Å; Y587-F597 HydrophobicContact CD1-CZ 4.17Å; Y587-F597 HydrophobicContact CD2-CZ 4.46Å; Y587-F597 HydrophobicContact CE1-CE1 4.46Å; Y587-F597 HydrophobicContact CG-CD1 4.16Å; Y587-F597 AromaticContact CG-CE1 3.78Å; Y587-F597 HydrophobicContact CG-CE1 3.78Å; Y587-F597 HydrophobicContact CG-CZ 4.04Å
588	L	95.3	Very high	92.1	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.01	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	119.1	-179.8	166.6	68.5	0	0	0	111.1	I483 K486 I578 L582 Y595 I596	I483-L588 HydrophobicContact CD1-CB 4.38Å; I483-L588 HydrophobicContact CG1-CB 4Å; I483-L588 HydrophobicContact CG1-CD1 4.11Å; I483-L588 CarbonylContact O-C 3.56Å; I483-L588 WeakPolarHBondContact O-CA 3.3Å; K486-L588 HydrophobicContact CB-CD1 4.44Å; K486-L588 HydrophobicContact CB-CD2 3.86Å; K486-L588 HydrophobicContact CG-CD2 4.3Å; I578-L588 HydrophobicContact CG2-CD2 3.64Å; L582-L588 HydrophobicContact CD2-CB 3.8Å; L588-Y595 CarbonylContact O-C 3.5Å; L588-Y595 WeakPolarHBondContact O-CA 3.38Å; L588-I596 HydrophobicContact CB-CB 4.28Å; L588-I596 HydrophobicContact CD2-CD1 4.24Å; L588-I596 PolarHBondContact N-O 3.49Å; L588-I596 PolarHBondContact O-N 3.2Å
589	F	96.1	Very high	92.2	Very high	38 Å²	38	43.1 Å²	43.1	17%	0.167	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	124.7	163.7	176.7	-124.3	0	0	0	110.3	E482 I483 T484 A591 R594 Y595	E482-F589 HydrophobicContact CG-CB 3.96Å; E482-F589 WeakPolarHBondContact OE1-CB 3.15Å; I483-F589 PolarHBondContact O-N 3.1Å; T484-F589 HydrophobicContact CG2-CD1 4.34Å; F589-A591 HydrophobicContact CE1-CB 4.31Å; F589-A591 HydrophobicContact CZ-CB 4.34Å; F589-R594 WeakPolarHBondContact CD2-O 3.43Å; F589-Y595 HydrophobicContact CB-CD1 4.06Å; F589-Y595 HydrophobicContact CB-CE1 3.83Å; F589-Y595 AromaticContact CD2-CD1 3.88Å; F589-Y595 HydrophobicContact CD2-CD1 3.88Å; F589-Y595 HydrophobicContact CD2-CD2 4.14Å; F589-Y595 AromaticContact CD2-CE1 3.43Å; F589-Y595 HydrophobicContact CD2-CE1 3.43Å; F589-Y595 VanDerWaalsContact CD2-CE1 3.43Å; F589-Y595 AromaticContact CD2-CE2 3.71Å; F589-Y595 HydrophobicContact CD2-CE2 3.71Å; F589-Y595 HydrophobicContact CD2-CG 4.23Å; F589-Y595 AromaticContact CD2-CZ 3.33Å; F589-Y595 HydrophobicContact CE2-CE1 4.25Å; F589-Y595 AromaticContact CE2-CE2 3.83Å; F589-Y595 HydrophobicContact CE2-CE2 3.83Å; F589-Y595 AromaticContact CE2-CZ 3.68Å; F589-Y595 HydrophobicContact CG-CD1 4.39Å; F589-Y595 AromaticContact CG-CE1 3.87Å; F589-Y595 HydrophobicContact CG-CE1 3.87Å
590	Q	93.6	Very high	92.3	Very high	75 Å²	75	42.9 Å²	42.9	35%	0.35	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	112.3	170.1	-177.1	178.1	0.8	0	0	108.8	R594	Q590-R594 HydrophobicContact CB-CB 4.31Å; Q590-R594 PolarHBondContact N-O 3.27Å; Q590-R594 PolarHBondContact O-N 3.31Å
591	A	89.3	Confident	92.4	Very high	74 Å²	74	38.8 Å²	38.8	61%	0.612	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	145.8	178.8	0	0	0	0	0	112.3	F589	F589-A591 HydrophobicContact CE1-CB 4.31Å; F589-A591 HydrophobicContact CZ-CB 4.34Å
592	P	90.4	Very high	92.3	Very high	85 Å²	85	37.8 Å²	37.8	55%	0.552	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	cis	-89.4	-16.3	5.4	31.3	-30.2	0	0	0	115.5
593	N	95.2	Very high	92.2	Very high	18 Å²	18	41.8 Å²	41.8	10%	0.096	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-156	22	-169.6	68.4	-77.6	0	0	0	116.3	K210 N215 F447 D448 E450	K210-N593 WeakPolarHBondContact CE-OD1 2.9Å; K210-N593 PolarHBondContact NZ-OD1 2.86Å; N215-N593 HydrophobicContact CB-CB 4.22Å; N215-N593 WeakPolarHBondContact O-CA 3.37Å; N215-N593 WeakPolarHBondContact O-CB 3.27Å; F447-N593 PolarHBondContact O-ND2 3.43Å; D448-N593 WeakPolarHBondContact O-CB 3.31Å; D448-N593 VanDerWaalsContact O-CG 3.26Å; D448-N593 PolarHBondContact O-ND2 3.09Å; E450-N593 PolarHBondContact N-O 2.93Å
594	R	96.4	Very high	91.6	Very high	69 Å²	69	37.3 Å²	37.3	26%	0.26	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	130	-178	177.4	175.1	-70.7	151.8	4.1	110	E450 L452 F589 Q590 I596	E450-R594 HydrophobicContact CB-CB 4.47Å; E450-R594 HydrophobicContact CB-CG 4.47Å; E450-R594 WeakPolarHBondContact O-CA 3.33Å; E450-R594 IonicContact OE1-NH2 2.81Å; E450-R594 IonicContact OE2-CZ 3.81Å; E450-R594 IonicContact OE2-NE 2.82Å; E450-R594 PolarHBondContact OE2-NE 2.93Å; E450-R594 IonicContact OE2-NH2 2.7Å; E450-R594 PolarHBondContact OE2-NH2 2.75Å; L452-R594 HydrophobicContact CD1-CG 3.72Å; L452-R594 HydrophobicContact CG-CG 4.35Å; F589-R594 WeakPolarHBondContact CD2-O 3.43Å; Q590-R594 HydrophobicContact CB-CB 4.31Å; Q590-R594 PolarHBondContact N-O 3.27Å; Q590-R594 PolarHBondContact O-N 3.31Å; R594-I596 HydrophobicContact CG-CD1 4.45Å; R594-I596 HydrophobicContact CG-CG1 4.03Å
595	Y	97.4	Very high	90.7	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.008	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	127	176.6	-69	-91.4	0	0	0	108.6	T216 L217 V449 E450 L451 L452 Y587 L588 F589	T216-Y595 VanDerWaalsContact CA-OH 3.3Å; T216-Y595 WeakPolarHBondContact CA-OH 3.19Å; L217-Y595 HydrophobicContact CB-CE1 3.99Å; L217-Y595 HydrophobicContact CB-CE2 4.2Å; L217-Y595 PolarHBondContact N-OH 3.46Å; V449-Y595 HydrophobicContact CG1-CD2 3.82Å; V449-Y595 HydrophobicContact CG1-CE2 3.92Å; E450-Y595 PolarHBondContact O-N 2.92Å; L451-Y595 HydrophobicContact CD2-CD2 3.67Å; L451-Y595 HydrophobicContact CD2-CG 3.89Å; L452-Y595 PolarHBondContact N-O 2.88Å; Y587-Y595 AromaticContact CD2-CD1 3.8Å; Y587-Y595 HydrophobicContact CD2-CD1 3.8Å; Y587-Y595 AromaticContact CE2-CD1 3.5Å; Y587-Y595 HydrophobicContact CE2-CD1 3.5Å; Y587-Y595 AromaticContact CE2-CE1 3.84Å; Y587-Y595 HydrophobicContact CE2-CE1 3.84Å; L588-Y595 CarbonylContact O-C 3.5Å; L588-Y595 WeakPolarHBondContact O-CA 3.38Å; F589-Y595 HydrophobicContact CB-CD1 4.06Å; F589-Y595 HydrophobicContact CB-CE1 3.83Å; F589-Y595 AromaticContact CD2-CD1 3.88Å; F589-Y595 HydrophobicContact CD2-CD1 3.88Å; F589-Y595 HydrophobicContact CD2-CD2 4.14Å; F589-Y595 AromaticContact CD2-CE1 3.43Å; F589-Y595 HydrophobicContact CD2-CE1 3.43Å; F589-Y595 VanDerWaalsContact CD2-CE1 3.43Å; F589-Y595 AromaticContact CD2-CE2 3.71Å; F589-Y595 HydrophobicContact CD2-CE2 3.71Å; F589-Y595 HydrophobicContact CD2-CG 4.23Å; F589-Y595 AromaticContact CD2-CZ 3.33Å; F589-Y595 HydrophobicContact CE2-CE1 4.25Å; F589-Y595 AromaticContact CE2-CE2 3.83Å; F589-Y595 HydrophobicContact CE2-CE2 3.83Å; F589-Y595 AromaticContact CE2-CZ 3.68Å; F589-Y595 HydrophobicContact CG-CD1 4.39Å; F589-Y595 AromaticContact CG-CE1 3.87Å; F589-Y595 HydrophobicContact CG-CE1 3.87Å
596	I	96.6	Very high	89.1	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	108.5	-172.8	-57.2	176.9	0	0	0	108.3	L582 Y587 L588 R594 A600 V602	L582-I596 VanDerWaalsContact CD1-O 3.28Å; L582-I596 WeakPolarHBondContact CD1-O 3.46Å; Y587-I596 WeakPolarHBondContact CA-O 3.48Å; L588-I596 HydrophobicContact CB-CB 4.28Å; L588-I596 HydrophobicContact CD2-CD1 4.24Å; L588-I596 PolarHBondContact N-O 3.49Å; L588-I596 PolarHBondContact O-N 3.2Å; R594-I596 HydrophobicContact CG-CD1 4.45Å; R594-I596 HydrophobicContact CG-CG1 4.03Å; I596-A600 HydrophobicContact CG2-CB 3.99Å; I596-V602 HydrophobicContact CD1-CB 4.15Å; I596-V602 HydrophobicContact CD1-CG1 3.91Å; I596-V602 HydrophobicContact CD1-CG2 4.28Å; I596-V602 HydrophobicContact CG1-CG2 4.37Å
597	F	96.3	Very high	86.5	Confident	6 Å²	6	46.1 Å²	46.1	3%	0.026	24%	0.242	C	C	.	.			trans	-98.1	177.1	176.2	-61.6	-102	0	0	0	110.2	L451 L452 I458 E461 L480 S579 Y587 A600	L451-F597 HydrophobicContact CB-CE2 4.2Å; L451-F597 HydrophobicContact CD2-CE2 4.35Å; L452-F597 PolarHBondContact O-N 3.06Å; I458-F597 HydrophobicContact CD1-CD2 4Å; I458-F597 HydrophobicContact CD1-CE2 4.48Å; I458-F597 HydrophobicContact CD1-CG 4.44Å; I458-F597 HydrophobicContact CG1-CB 4.21Å; I458-F597 HydrophobicContact CG1-CD1 4.19Å; I458-F597 HydrophobicContact CG1-CD2 3.65Å; I458-F597 HydrophobicContact CG1-CE1 4.5Å; I458-F597 HydrophobicContact CG1-CE2 3.99Å; I458-F597 HydrophobicContact CG1-CG 3.77Å; I458-F597 HydrophobicContact CG1-CZ 4.41Å; E461-F597 HydrophobicContact CB-CE1 4.39Å; E461-F597 HydrophobicContact CG-CE1 4.27Å; L480-F597 HydrophobicContact CD1-CD1 3.71Å; L480-F597 HydrophobicContact CD1-CE1 4Å; S579-F597 VanDerWaalsContact CB-O 3.23Å; S579-F597 WeakPolarHBondContact CB-O 3.12Å; Y587-F597 HydrophobicContact CD1-CD1 4.29Å; Y587-F597 AromaticContact CD1-CE1 3.67Å; Y587-F597 HydrophobicContact CD1-CE1 3.67Å; Y587-F597 HydrophobicContact CD1-CZ 4.17Å; Y587-F597 HydrophobicContact CD2-CZ 4.46Å; Y587-F597 HydrophobicContact CE1-CE1 4.46Å; Y587-F597 HydrophobicContact CG-CD1 4.16Å; Y587-F597 AromaticContact CG-CE1 3.78Å; Y587-F597 HydrophobicContact CG-CE1 3.78Å; Y587-F597 HydrophobicContact CG-CZ 4.04Å; F597-A600 WeakPolarHBondContact O-CB 3.42Å
598	H	94.1	Very high	83.9	Confident	59 Å²	59	54 Å²	54	27%	0.273	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	152.8	169.4	-59.6	83.5	0	0	0	112	G453 D454 L582 D583 Q586 A600	G453-H598 VanDerWaalsContact CA-O 3.27Å; G453-H598 WeakPolarHBondContact CA-O 3.49Å; D454-H598 PolarHBondContact N-O 2.94Å; L582-H598 WeakPolarHBondContact CB-NE2 3.46Å; L582-H598 PolarHBondContact O-NE2 2.78Å; D583-H598 PolarHBondContact O-CE1 3.5Å; D583-H598 PolarHBondContact O-NE2 3.45Å; Q586-H598 PolarHBondContact O-CE1 3.09Å; Q586-H598 VanDerWaalsContact O-CE1 3.28Å; H598-A600 PolarHBondContact O-N 3.39Å
599	G	91.1	Very high	81.2	Confident	22 Å²	22	57.6 Å²	57.6	23%	0.227	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	-22.4	-177.2	0	0	0	0	0	115.9	R439 D454	R439-G599 WeakPolarHBondContact CG-O 3.4Å; R439-G599 PolarHBondContact NE-O 2.95Å; D454-G599 WeakPolarHBondContact OD2-CA 3.32Å
600	A	92.9	Very high	78.4	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.323	C	S	.	.			trans	-60.9	136.3	-172.5	0	0	0	0	0	113.6	L452 S579 I596 F597 H598 V602	L452-A600 HydrophobicContact CB-CB 4.2Å; L452-A600 WeakPolarHBondContact O-CB 3.46Å; S579-A600 WeakPolarHBondContact CB-O 3.34Å; S579-A600 PolarHBondContact OG-O 2.85Å; I596-A600 HydrophobicContact CG2-CB 3.99Å; F597-A600 WeakPolarHBondContact O-CB 3.42Å; H598-A600 PolarHBondContact O-N 3.39Å; A600-V602 VanDerWaalsContact C-N 3.29Å; A600-V602 HydrophobicContact CB-CG2 4.31Å; A600-V602 PolarHBondContact O-N 3.37Å
601	E	90.9	Very high	75.6	Confident	74 Å²	74	65.3 Å²	65.3	35%	0.346	34%	0.344	S	S	.	.			trans	-95.3	50.9	178.6	-68.2	-173.2	152.4	0	0	111.5	R439 Y603	R439-E601 HydrophobicContact CG-CG 4.22Å; R439-E601 IonicContact CZ-OE1 2.71Å; R439-E601 IonicContact NH1-OE1 3.15Å; R439-E601 PolarHBondContact NH1-OE1 2.68Å; R439-E601 VanDerWaalsContact NH2-CD 3.31Å; R439-E601 IonicContact NH2-OE1 3.52Å; R439-E601 PolarHBondContact NH2-OE1 3.48Å; R439-E601 PolarHBondContact O-N 2.93Å; E601-Y603 HydrophobicContact CB-CE2 4.17Å; E601-Y603 WeakPolarHBondContact O-CD2 3.26Å; E601-Y603 WeakPolarHBondContact O-CE2 3.36Å
602	V	89.2	Confident	73.2	Confident	14 Å²	14	67.2 Å²	67.2	9%	0.085	35%	0.353	C	S	.	.			trans	-98.1	126.7	172.9	-171.5	0	0	0	0	109.5	L452 P577 I578 I596 A600	L452-V602 HydrophobicContact CB-CG2 4.3Å; L452-V602 HydrophobicContact CD1-CG2 3.6Å; P577-V602 CarbonylContact C-O 3.54Å; P577-V602 VanDerWaalsContact CA-O 3.24Å; P577-V602 WeakPolarHBondContact CA-O 3.16Å; P577-V602 WeakPolarHBondContact CB-O 3.19Å; I578-V602 HydrophobicContact CD1-CG1 4.17Å; I578-V602 PolarHBondContact N-O 3.03Å; I596-V602 HydrophobicContact CD1-CB 4.15Å; I596-V602 HydrophobicContact CD1-CG1 3.91Å; I596-V602 HydrophobicContact CD1-CG2 4.28Å; I596-V602 HydrophobicContact CG1-CG2 4.37Å; A600-V602 VanDerWaalsContact C-N 3.29Å; A600-V602 HydrophobicContact CB-CG2 4.31Å; A600-V602 PolarHBondContact O-N 3.37Å
603	Y	85.9	Confident	70.5	Confident	98 Å²	98	68.9 Å²	68.9	38%	0.384	37%	0.367	S	S	.	.			trans	-109.9	152.5	-176.3	-62.1	-93.9	0	0	0	111.2	R575 P577 E601 D605	R575-Y603 HydrophobicContact CB-CD1 4.28Å; R575-Y603 WeakPolarHBondContact O-CE1 3.45Å; P577-Y603 HydrophobicContact CB-CD1 4.18Å; P577-Y603 HydrophobicContact CB-CE1 3.99Å; P577-Y603 HydrophobicContact CG-CE1 4.36Å; E601-Y603 HydrophobicContact CB-CE2 4.17Å; E601-Y603 WeakPolarHBondContact O-CD2 3.26Å; E601-Y603 WeakPolarHBondContact O-CE2 3.36Å; Y603-D605 PolarHBondContact O-N 2.67Å
604	S	76.5	Confident	67.5	Low	11 Å²	11	73.8 Å²	73.8	8%	0.077	40%	0.402	C	S	.	.			trans	-77.4	99.4	172.6	-49.9	0	0	0	0	109.9	R575 I578 R581 S606	R575-S604 PolarHBondContact NH1-O 3.01Å; I578-S604 WeakPolarHBondContact CG1-OG 3.45Å; R581-S604 PolarHBondContact NH1-OG 3.08Å; R581-S604 PolarHBondContact NH2-OG 3.01Å; S604-S606 PolarHBondContact O-N 2.67Å
605	D	63	Low	64.5	Low	130 Å²	130	76.2 Å²	76.2	70%	0.695	43%	0.429	S	S	*	.			trans	-81.5	88.4	164.4	-78.8	-32	0	0	0	108.9	Y603	Y603-D605 PolarHBondContact O-N 2.67Å
606	S	52.2	Low	61.4	Low	12 Å²	12	79.7 Å²	79.7	8%	0.084	47%	0.465	C	S	.	.			trans	-154.8	108.2	173.6	48.2	0	0	0	0	113.1	R489 S604 E608 D609	R489-S606 PolarHBondContact NH2-O 3.27Å; R489-S606 PolarHBondContact NH2-OG 3.17Å; S604-S606 PolarHBondContact O-N 2.67Å; S606-E608 VanDerWaalsContact C-N 3.28Å; S606-D609 WeakPolarHBondContact CB-OD2 3.46Å; S606-D609 VanDerWaalsContact OG-CG 3.27Å; S606-D609 PolarHBondContact OG-OD2 3.06Å
607	E	39.4	Very low	58.6	Low	176 Å²	176	84.9 Å²	84.9	82%	0.822	50%	0.501	S	S	*	.	S	Bend	trans	-92.3	0.8	144.9	-67	176.8	-177.4	0	0	110.3
608	E	39.2	Very low	55.4	Low	170 Å²	170	92.6 Å²	92.6	79%	0.794	54%	0.543	S	S	*	.	S	Bend	trans	-100.7	-11.9	-175.2	-60.7	175.4	-172	0	0	113.6	S606 E610	S606-E608 VanDerWaalsContact C-N 3.28Å; E608-E610 PolarHBondContact O-N 2.96Å
609	D	40	Very low	52.7	Low	77 Å²	77	95.3 Å²	95.3	41%	0.412	57%	0.568	S	S	.	*	G	3₁₀ helix	trans	-73.1	-9.4	178.4	-84	-26.2	0	0	0	112.3	K486 S606 T611	K486-D609 IonicContact NZ-OD1 2.81Å; K486-D609 PolarHBondContact NZ-OD1 3.49Å; K486-D609 IonicContact NZ-OD2 3.59Å; K486-D609 PolarHBondContact NZ-OD2 3.33Å; S606-D609 WeakPolarHBondContact CB-OD2 3.46Å; S606-D609 VanDerWaalsContact OG-CG 3.27Å; S606-D609 PolarHBondContact OG-OD2 3.06Å; D609-T611 PolarHBondContact O-N 3.41Å
610	E	37.5	Very low	49.9	Very low	144 Å²	144	102.6 Å²	102.6	67%	0.673	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-82.3	-0.7	-173.2	-62.4	-66.5	146.2	0	0	114.7	R489 E608	R489-E610 IonicContact NH1-OE1 2.75Å; E608-E610 PolarHBondContact O-N 2.96Å
611	T	33.8	Very low	47.1	Very low	130 Å²	130	105.3 Å²	105.3	80%	0.798	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-122.7	37.6	-174.7	52.7	0	0	0	0	114.6	D609	D609-T611 PolarHBondContact O-N 3.41Å
612	S	38.3	Very low	44.3	Very low	115 Å²	115	107.9 Å²	107.9	80%	0.804	66%	0.656	S	S	*	*	S	Bend	trans	-132.8	34.2	176	-168.5	0	0	0	0	115.5
613	S	34.8	Very low	41.5	Very low	119 Å²	119	114 Å²	114	83%	0.832	69%	0.689	S	S	*	*			trans	-148.3	82.3	167	65.7	0	0	0	0	113.4
614	S	32.3	Very low	38.8	Very low	121 Å²	121	113.9 Å²	113.9	85%	0.846	70%	0.701	S	S	*	*			trans	-142.5	102.9	163.4	-170.6	0	0	0	0	110.1	G616	S614-G616 PolarHBondContact O-N 2.79Å
615	C	33.7	Very low	36.8	Very low	121 Å²	121	118.6 Å²	118.6	82%	0.818	73%	0.734	S	S	*	*			trans	-81.3	93.8	175.8	51.4	0	0	0	0	110.4	S617	C615-S617 PolarHBondContact O-N 3.49Å
616	G	31.3	Very low	35.5	Very low	74 Å²	74	120.3 Å²	120.3	76%	0.763	74%	0.738	S	S	*	*			trans	-82	97.4	165.5	0	0	0	0	0	110.4	S614	S614-G616 PolarHBondContact O-N 2.79Å
617	S	37.6	Very low	34.5	Very low	109 Å²	109	126.6 Å²	126.6	76%	0.762	77%	0.77	S	S	*	*			trans	-84	111.4	171.9	-62.5	0	0	0	0	110.5	C615	C615-S617 PolarHBondContact O-N 3.49Å
618	D	30.4	Very low	34.1	Very low	169 Å²	169	121.7 Å²	121.7	90%	0.904	77%	0.767	S	S	*	*			trans	-129.3	124.2	157.8	-84.9	-51.7	0	0	0	108.3
619	S	37.4	Very low	34.9	Very low	116 Å²	116	119.7 Å²	119.7	81%	0.811	77%	0.769	S	S	*	*			trans	-106.3	130.5	179	-62.9	0	0	0	0	109.3
620	D	32.6	Very low	34.5	Very low	174 Å²	174	125.6 Å²	125.6	93%	0.93	79%	0.794	S	S	*	*			trans	-151.3	137.5	157.1	-123.4	-24.8	0	0	0	115.4
621	G	33.3	Very low	34.1	Very low	58 Å²	58	125.9 Å²	125.9	60%	0.598	80%	0.8	S	S	*	*			trans	18.3	127.3	163.1	0	0	0	0	0	124.6
622	S	32.8	Very low	33.8	Very low	127 Å²	127	125.2 Å²	125.2	89%	0.888	80%	0.799	S	S	*	*			trans	73.1	150.6	135.3	-62.9	0	0	0	0	119.2
623	D	29.7	Very low	33.4	Very low	144 Å²	144	125.5 Å²	125.5	77%	0.77	80%	0.801	S	S	*	*			cis	-159.6	-179.5	-21.8	-170.2	12.3	0	0	0	107.7
624	C	30.2	Very low	33.4	Very low	95 Å²	95	129.3 Å²	129.3	64%	0.642	81%	0.806	S	S	*	*			trans	-33.1	148.9	176.2	60.6	0	0	0	0	117.1
625	S	34.2	Very low	33.3	Very low	109 Å²	109	128.4 Å²	128.4	76%	0.762	81%	0.806	S	S	*	*				-165.1	176.2	54.9	-64	0	0	0	0	114.5
626	Q	34.1	Very low	33.3	Very low	167 Å²	167	132.2 Å²	132.2	78%	0.78	81%	0.812	S	S	*	*			trans	-66.7	174	162.9	-54.7	158.9	-128.6	0	0	111
627	D	32.5	Very low	33.3	Very low	144 Å²	144	136.8 Å²	136.8	77%	0.77	82%	0.819	S	S	*	*			cis	-165.4	172.8	37	-99.3	-47.6	0	0	0	111
628	G	30.2	Very low	32.8	Very low	73 Å²	73	135 Å²	135	75%	0.753	82%	0.817	S	S	*	*			trans	91.3	124.7	141.7	0	0	0	0	0	120.3
629	P	56.7	Low	32.7	Very low	127 Å²	127	131.9 Å²	131.9	83%	0.825	82%	0.815	S	S	*	*			trans	-121.4	125.6	170.2	36.6	-23	0	0	0	114.8
630	E	31.8	Very low	32.3	Very low	201 Å²	201	137.8 Å²	137.8	94%	0.939	82%	0.82	S	S	*	*			trans	-154.2	165.4	168.9	-66.1	-173.5	165.7	0	0	108.5
631	D	28.3	Very low	32.8	Very low	151 Å²	151	134.5 Å²	134.5	81%	0.807	81%	0.808	S	S	*	*			cis	-163.6	-176.6	-44.2	-166	6.3	0	0	0	106.8
632	C	27.3	Very low	32.6	Very low	115 Å²	115	138.4 Å²	138.4	78%	0.777	82%	0.82	S	S	*	*			trans	-69.7	154.4	-172.3	-57.8	0	0	0	0	116.5
633	S	30.6	Very low	32.4	Very low	122 Å²	122	135.3 Å²	135.3	85%	0.853	81%	0.808	S	S	*	*			trans	-168.5	149.1	135.1	26.6	0	0	0	0	113.2
634	E	34.1	Very low	32.3	Very low	198 Å²	198	136.4 Å²	136.4	93%	0.925	81%	0.814	S	S	*	*			trans	-95.5	153.7	172.2	-57.5	169.6	119.3	0	0	110.7
635	A	30.2	Very low	32.4	Very low	102 Å²	102	140.8 Å²	140.8	84%	0.843	83%	0.825	S	S	*	*			trans	-159.9	120.9	156.2	0	0	0	0	0	111.4
636	E	34.4	Very low	32.4	Very low	201 Å²	201	139.7 Å²	139.7	94%	0.939	82%	0.823	S	S	*	*			trans	-90	141.8	153.3	-71	-160.7	143.7	0	0	109.5
637	D	30.1	Very low	33	Very low	171 Å²	171	136.8 Å²	136.8	91%	0.914	82%	0.819	S	S	*	*			trans	-154.2	157	144.2	-160.3	-1.7	0	0	0	109
638	G	27.9	Very low	32.9	Very low	70 Å²	70	137.3 Å²	137.3	72%	0.722	82%	0.821	S	S	*	*			trans	-153.1	115.6	-172.8	0	0	0	0	0	114.8
639	A	28.6	Very low	33	Very low	105 Å²	105	143.3 Å²	143.3	87%	0.868	82%	0.82	S	S	*	*			trans	-145.8	139.3	170.7	0	0	0	0	0	114
640	R	28.3	Very low	31.7	Very low	240 Å²	240	142.8 Å²	142.8	91%	0.906	81%	0.811	S	S	*	*			trans	-80.5	172.9	159.9	-81.2	-179.7	175	-175.3	-0.8	108.9
641	P	43	Very low	31.5	Very low	105 Å²	105	139.9 Å²	139.9	68%	0.682	81%	0.807	S	S	*	*			cis	-155.8	-169.5	34.9	44.9	-22.4	0	0	0	119
642	T	29.2	Very low	31.5	Very low	140 Å²	140	140.3 Å²	140.3	86%	0.859	81%	0.808	S	S	*	*			trans	63.1	145.3	159	47.3	0	0	0	0	119.3
643	G	29	Very low	32.9	Very low	62 Å²	62	140.4 Å²	140.4	64%	0.639	81%	0.807	S	S	*	*			cis	147	133.1	-8.4	0	0	0	0	0	112.8
644	D	28.3	Very low	34.2	Very low	166 Å²	166	139.4 Å²	139.4	89%	0.888	80%	0.798	S	S	*	*			trans	165.7	157.9	164.2	-89.7	-20.3	0	0	0	108.3
645	E	32	Very low	34.2	Very low	187 Å²	187	135.8 Å²	135.8	87%	0.874	79%	0.785	S	S	*	*			cis	-142	-159.4	-4.6	-140.5	-169.9	171.5	0	0	110.9
646	A	33.3	Very low	34.4	Very low	87 Å²	87	138.3 Å²	138.3	72%	0.719	78%	0.779	S	S	*	*			trans	-123.5	-149.5	-159.5	0	0	0	0	0	115.9
647	P	48.4	Very low	34.5	Very low	106 Å²	106	137.7 Å²	137.7	69%	0.688	78%	0.776	S	S	*	*				-137.4	172.9	-89.1	42.3	-26.3	0	0	0	118.9
648	L	30.1	Very low	34.4	Very low	155 Å²	155	133.8 Å²	133.8	81%	0.812	77%	0.768	S	S	*	*			trans	68.8	161.2	158.5	-63.1	153.4	0	0	0	116.8
649	R	31	Very low	34.5	Very low	199 Å²	199	136.7 Å²	136.7	75%	0.751	77%	0.772	S	S	*	*			cis	-163	162.8	4	-139.1	-179.8	149.2	144.2	0.7	112.8
650	D	29.1	Very low	35.5	Very low	116 Å²	116	137.7 Å²	137.7	62%	0.62	77%	0.77	S	S	*	*			trans	30.9	147.8	153.9	-52.2	-18.8	0	0	0	121.5
651	T	27.7	Very low	35.7	Very low	139 Å²	139	132.6 Å²	132.6	85%	0.853	77%	0.765	S	S	*	*				-175	174.1	56.1	-33.5	0	0	0	0	112.6
652	L	29.5	Very low	35	Very low	160 Å²	160	135.8 Å²	135.8	84%	0.838	78%	0.776	S	S	*	*			trans	-113.3	-170.6	176.5	-64.5	165.1	0	0	0	111.8
653	P	57.4	Low	35.1	Very low	117 Å²	117	137.1 Å²	137.1	76%	0.76	77%	0.772	S	S	*	*			cis	-119	-125.9	-29	24.7	1.8	0	0	0	108.9
654	P	57.8	Low	35.1	Very low	101 Å²	101	140.7 Å²	140.7	66%	0.656	78%	0.782	S	S	*	*			cis	-138.8	-163.6	-24.1	44.7	-25.1	0	0	0	116.2
655	N	32.6	Very low	35.3	Very low	122 Å²	122	139.7 Å²	139.7	65%	0.652	78%	0.777	S	S	*	*			trans	68.7	143.5	162.7	-70	34.6	0	0	0	120.1
656	E	35.4	Very low	35.1	Very low	156 Å²	156	140.5 Å²	140.5	73%	0.729	78%	0.777	S	S	*	*			cis	-162.8	150.3	-7.8	-117.1	164.4	170.6	0	0	112.3
657	E	35.8	Very low	34.9	Very low	187 Å²	187	142.1 Å²	142.1	87%	0.874	78%	0.778	S	S	*	*			trans	38.7	162.5	157.4	-56.2	-159.7	142.9	0	0	122.8
658	A	28	Very low	34	Very low	90 Å²	90	142.2 Å²	142.2	74%	0.744	78%	0.782	S	S	*	*			cis	-149.9	-178.6	15.5	0	0	0	0	0	113.8
659	T	29.9	Very low	34	Very low	131 Å²	131	144 Å²	144	80%	0.804	79%	0.786	S	S	*	*			trans	-127.7	170	176.1	63.2	0	0	0	0	111.8
660	P	48.9	Very low	34.1	Very low	126 Å²	126	143.5 Å²	143.5	82%	0.818	79%	0.792	S	S	*	*				-150	175.5	90.3	39	-20	0	0	0	116.7
661	T	33	Very low	34.2	Very low	132 Å²	132	143.4 Å²	143.4	81%	0.81	80%	0.8	S	S	*	*			trans	-99.5	167.3	-176.6	42.6	0	0	0	0	115
662	L	28.1	Very low	34.4	Very low	173 Å²	173	143.6 Å²	143.6	91%	0.906	79%	0.791	S	S	*	*			trans	-159.2	150.3	140.6	-111.9	169.4	0	0	0	112.4
663	Q	31.3	Very low	34.7	Very low	168 Å²	168	146.1 Å²	146.1	79%	0.785	79%	0.79	S	S	*	*			trans	-113.6	158.4	173.1	-66.9	172.5	-91.5	0	0	110.2
664	T	29.7	Very low	33.6	Very low	137 Å²	137	148.6 Å²	148.6	84%	0.84	80%	0.795	S	S	*	*			trans	-161.1	131.6	146	8.9	0	0	0	0	111.2
665	D	31.8	Very low	32.8	Very low	145 Å²	145	148.9 Å²	148.9	78%	0.775	80%	0.795	S	S	*	*			trans	-78.8	152.5	162	-58.7	-75.4	0	0	0	110.6
666	F	27.7	Very low	33.1	Very low	203 Å²	203	151.3 Å²	151.3	89%	0.89	80%	0.802	S	S	*	*			trans	-151.7	149.7	152.1	-110.5	-74.9	0	0	0	111.9
667	T	29.9	Very low	33.2	Very low	121 Å²	121	155 Å²	155	74%	0.742	83%	0.825	S	S	*	*			trans	-109.4	153.4	-169.6	53.2	0	0	0	0	113.2
668	S	29.5	Very low	33	Very low	108 Å²	108	153.4 Å²	153.4	76%	0.755	82%	0.823	S	S	*	*			trans	61.4	124.6	145.9	173	0	0	0	0	119.4
669	E	30.8	Very low	33.3	Very low	193 Å²	193	156.7 Å²	156.7	90%	0.902	83%	0.827	S	S	*	*				-165.2	163.5	115.5	-112	175.6	-178.6	0	0	114.4
670	H	32.1	Very low	33.5	Very low	189 Å²	189	158.1 Å²	158.1	88%	0.875	83%	0.828	S	S	*	*			trans	-99.6	141.7	177.3	-96.5	-65.9	0	0	0	111.6
671	S	30.3	Very low	32.6	Very low	113 Å²	113	160 Å²	160	79%	0.79	83%	0.829	S	S	*	*			trans	-162.6	108.5	146.5	-161.7	0	0	0	0	108.1
672	E	32.7	Very low	32.6	Very low	143 Å²	143	161.8 Å²	161.8	67%	0.668	83%	0.83	S	S	*	*				61.6	107.9	80.5	-76.7	-115.7	103.3	0	0	115.1
673	R	35.7	Very low	32.9	Very low	213 Å²	213	161 Å²	161	80%	0.804	83%	0.825	S	S	*	*			trans	20.4	135	144.7	-64.4	168.5	168.5	151.6	-8.8	119.9
674	I	34.3	Very low	33	Very low	170 Å²	170	160.5 Å²	160.5	87%	0.872	83%	0.828	S	S	*	*				-142.8	142.7	129.5	-103.8	150	0	0	0	109.4
675	T	40.4	Very low	33.2	Very low	107 Å²	107	162.3 Å²	162.3	66%	0.656	83%	0.827	S	S	*	*			trans	-115.3	-179.4	174.4	47	0	0	0	0	110.2
676	H	39.3	Very low	33.3	Very low	173 Å²	173	163.8 Å²	163.8	80%	0.801	83%	0.831	S	S	*	*			trans	86	143.3	-173	-52.4	-73.2	0	0	0	113.8
677	L	37.5	Very low	33.9	Very low	232 Å²	232	160.2 Å²	160.2	100%	1.215	83%	0.825	S	S	*	*			cis	-134.2	0	9.3	-140.8	162.5	0	0	0	111.4

Retrieved 677 of 677 residues in 1383.6 ms (Link to these results)

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