A0A087XQU3_POEFO Loading...

Ribosome biogenesis protein BOP1

Component of the PeBoW complex, which is required for maturation of 28S and 5.8S ribosomal RNAs and formation of the 60S ribosome.

AlphaFold DB , UniProt , Accession A0A087XQU3, Species POEFO (Poecilia formosa, Amazon molly), Gene BOP1, Length 751 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.7	Very low	33.3	Very low	221 Å²	221	151 Å²	151	100%	1.089	82%	0.824	S	S	*	*				0	63.1	0	-50.5	172.6	-164.8	0	0	106.3
2	E	33	Very low	33.2	Very low	184 Å²	184	152.8 Å²	152.8	86%	0.86	82%	0.823	S	S	*	*				72.7	129.1	79	-67.3	165.7	130.5	0	0	111.9
3	A	36.8	Very low	33	Very low	87 Å²	87	153.4 Å²	153.4	72%	0.719	82%	0.817	S	S	*	*			cis	163	177.5	-22.8	0	0	0	0	0	105.9
4	S	33.8	Very low	32.7	Very low	108 Å²	108	158.9 Å²	158.9	76%	0.755	82%	0.821	S	S	*	*			trans	71	134	-176	75.3	0	0	0	0	113.3
5	R	35.6	Very low	32.5	Very low	248 Å²	248	155.5 Å²	155.5	94%	0.936	83%	0.825	S	S	*	*				64	131.2	52.9	-56.8	172.3	179.4	178.1	-0.5	112.1
6	G	31.9	Very low	32.2	Very low	72 Å²	72	150.9 Å²	150.9	74%	0.742	83%	0.827	S	S	*	*			cis	145.8	141.5	-11.3	0	0	0	0	0	114.5
7	N	32.3	Very low	32	Very low	160 Å²	160	151.9 Å²	151.9	86%	0.856	83%	0.827	S	S	*	*			trans	78.2	161	158	-153.2	13.7	0	0	0	119.9
8	V	32.8	Very low	32.1	Very low	102 Å²	102	153.4 Å²	153.4	62%	0.618	82%	0.824	S	S	*	*			trans	84.2	101.9	161.4	-170.8	0	0	0	0	120.6
9	Q	30.6	Very low	32.1	Very low	177 Å²	177	153.8 Å²	153.8	83%	0.827	82%	0.817	S	S	*	*			trans	36.6	131.8	131	-53.2	172.9	-8.9	0	0	122.1
10	K	28.9	Very low	32	Very low	212 Å²	212	151.2 Å²	151.2	92%	0.922	81%	0.808	S	S	*	*				-163.5	161.9	103.9	-115	-178.9	179.7	-175	0	113.5
11	A	32.4	Very low	31.8	Very low	90 Å²	90	151.3 Å²	151.3	74%	0.744	80%	0.803	S	S	*	*			trans	-140.8	143.6	170.4	0	0	0	0	0	109.5
12	E	31.6	Very low	31.4	Very low	173 Å²	173	149 Å²	149	81%	0.808	79%	0.787	S	S	*	*			trans	169.6	121.3	157.3	-100	177.7	161.6	0	0	106.6
13	Q	30.2	Very low	31.2	Very low	160 Å²	160	146.1 Å²	146.1	75%	0.748	78%	0.782	S	S	*	*				100.5	148.4	65.3	-91.7	-160	45.7	0	0	112.8
14	R	29.3	Very low	30.8	Very low	231 Å²	231	148.7 Å²	148.7	87%	0.872	78%	0.784	S	S	*	*			trans	80.3	112.6	178.2	-54.5	179.9	178.6	-171.6	-1.7	114.2
15	A	29.5	Very low	30.6	Very low	107 Å²	107	151.7 Å²	151.7	88%	0.884	78%	0.784	S	S	*	*			cis	87.1	105.9	42.2	0	0	0	0	0	113.9
16	G	27.2	Very low	30.2	Very low	82 Å²	82	147.7 Å²	147.7	85%	0.845	77%	0.773	S	S	*	*			trans	-138.8	120.8	166.3	0	0	0	0	0	108.4
17	M	30.2	Very low	29.9	Very low	169 Å²	169	155 Å²	155	83%	0.833	78%	0.778	S	S	*	*			trans	-147.1	155.1	-170.6	-177	178.3	78.5	0	0	108.8
18	K	33.3	Very low	29.6	Very low	179 Å²	179	152.2 Å²	152.2	78%	0.778	77%	0.771	S	S	*	*			trans	111.7	146.4	174.1	-69.2	165.6	-175.3	172.1	0	112.7
19	K	32.2	Very low	29.2	Very low	160 Å²	160	155.9 Å²	155.9	70%	0.696	78%	0.779	S	S	*	*			cis	-152.2	141.9	0.9	-113.3	173.3	169.6	-164	0	107.4
20	T	29.9	Very low	28.9	Very low	101 Å²	101	155.2 Å²	155.2	62%	0.62	78%	0.776	S	S	*	*				48.1	143.3	92.5	81.6	0	0	0	0	115.1
21	E	28.1	Very low	28.8	Very low	154 Å²	154	152 Å²	152	72%	0.72	77%	0.768	S	S	*	*				-143.8	143.7	51.8	-74.9	-172.9	143.3	0	0	112.6
22	K	30	Very low	28.6	Very low	173 Å²	173	155.7 Å²	155.7	75%	0.752	77%	0.77	S	S	*	*				56.4	135.5	84.4	-58.3	179.7	174.9	176.2	0	113.4
23	T	27.8	Very low	28.3	Very low	123 Å²	123	154.6 Å²	154.6	76%	0.755	77%	0.765	S	S	*	*				-153.8	151.1	53.3	40	0	0	0	0	116.7
24	N	29.7	Very low	27.9	Very low	141 Å²	141	156.5 Å²	156.5	75%	0.754	77%	0.774	S	S	*	*			trans	18.9	150.8	134.9	-70.5	-37.7	0	0	0	121.4
25	K	29.3	Very low	27.7	Very low	172 Å²	172	153.3 Å²	153.3	75%	0.748	77%	0.769	S	S	*	*			cis	-171	147.1	33.3	-140.6	167	-171.6	173.6	0	114.7
26	K	27.5	Very low	27.6	Very low	163 Å²	163	156 Å²	156	71%	0.709	76%	0.764	S	S	*	*			trans	58.2	126.6	145.7	-92.8	-176.2	175.3	-173.3	0	122.8
27	R	25.1	Very low	27.6	Very low	226 Å²	226	160.1 Å²	160.1	85%	0.853	76%	0.761	S	S	*	*			trans	57.4	142.2	132.4	-75.2	-176.1	179.2	-175.1	-2.3	119.2
28	S	25.5	Very low	27.4	Very low	101 Å²	101	159.8 Å²	159.8	71%	0.706	76%	0.757	S	S	*	*			cis	-168.5	161.6	13.9	44.7	0	0	0	0	114.4
29	K	25.8	Very low	27	Very low	180 Å²	180	156.8 Å²	156.8	78%	0.783	75%	0.749	S	S	*	*			trans	79.8	147.6	146.1	-103.9	-171.8	165.7	-153.7	0	120.1
30	Q	24.5	Very low	26.8	Very low	163 Å²	163	156.7 Å²	156.7	76%	0.762	75%	0.751	S	S	*	*			trans	74.1	104.8	159	-74.4	166.4	-105	0	0	118.7
31	D	25.2	Very low	26.6	Very low	143 Å²	143	160.2 Å²	160.2	77%	0.765	77%	0.766	S	S	*	*			trans	-82.4	-173.4	145.7	-51.8	-83.5	0	0	0	109.5
32	E	28.2	Very low	26.4	Very low	169 Å²	169	160.9 Å²	160.9	79%	0.79	77%	0.767	S	S	*	*			trans	71.8	139	170.8	-63.1	158.5	-179.6	0	0	114.3
33	E	25.9	Very low	26.2	Very low	149 Å²	149	160.4 Å²	160.4	70%	0.696	77%	0.772	S	S	*	*			cis	-162.7	159.2	4.2	-124.3	156.1	-162	0	0	111.3
34	E	21.8	Very low	26.1	Very low	201 Å²	201	161.2 Å²	161.2	94%	0.939	77%	0.771	S	S	*	*			trans	-142.7	83.9	156.6	-82.7	-168.9	167.2	0	0	109.1
35	E	26.1	Very low	25.9	Very low	164 Å²	164	160.9 Å²	160.9	77%	0.766	77%	0.769	S	S	*	*			trans	-93.9	154.6	143.9	-58.1	-171.3	143.8	0	0	105.4
36	E	27.3	Very low	25.8	Very low	164 Å²	164	159.4 Å²	159.4	77%	0.766	77%	0.769	S	S	*	*				-158.2	150.9	56.5	-93.1	177.1	167.2	0	0	108.7
37	E	26.5	Very low	25.7	Very low	168 Å²	168	160.8 Å²	160.8	79%	0.785	78%	0.775	S	S	*	*				49.1	144.7	91.4	-65.2	-170.7	-177.9	0	0	115.5
38	E	25.1	Very low	25.8	Very low	162 Å²	162	154 Å²	154	76%	0.757	76%	0.763	S	S	*	*			cis	-165.7	-173.6	-30	-139.9	175.9	-165.3	0	0	107.2
39	D	25.8	Very low	25.9	Very low	115 Å²	115	156.2 Å²	156.2	62%	0.615	77%	0.766	S	S	*	*			trans	56.2	106.1	155.2	-82.3	-3	0	0	0	124.3
40	Q	27.7	Very low	26.1	Very low	158 Å²	158	154.2 Å²	154.2	74%	0.738	76%	0.759	S	S	*	*				46.6	119.4	111.8	-62.4	179.6	75	0	0	120.8
41	L	25.3	Very low	26.2	Very low	176 Å²	176	154 Å²	154	92%	0.921	76%	0.758	S	S	*	*			trans	-148.8	142.2	141.4	-114.6	169.2	0	0	0	111.8
42	F	25.2	Very low	26.3	Very low	168 Å²	168	153.4 Å²	153.4	74%	0.737	76%	0.755	S	S	*	*			trans	-78.8	141.9	174.8	-87.1	-112	0	0	0	111.2
43	N	24.9	Very low	26.3	Very low	163 Å²	163	153.7 Å²	153.7	87%	0.872	76%	0.756	S	S	*	*				-166.6	141.3	124.7	-101.4	-27.8	0	0	0	112.6
44	L	26.4	Very low	26.3	Very low	140 Å²	140	153.1 Å²	153.1	73%	0.733	76%	0.758	S	S	*	*			trans	-99.7	134.2	160.1	-59.7	89.1	0	0	0	108.1
45	N	25.7	Very low	26.7	Very low	134 Å²	134	150.2 Å²	150.2	72%	0.717	75%	0.748	S	S	*	*				167.3	137	110.1	-103.1	-17.4	0	0	0	114.4
46	N	26.7	Very low	26.8	Very low	140 Å²	140	146.4 Å²	146.4	75%	0.749	74%	0.74	S	S	*	*			trans	59.8	148.8	138.7	-72.3	-19.2	0	0	0	123.2
47	K	26	Very low	26.9	Very low	192 Å²	192	144.8 Å²	144.8	84%	0.835	74%	0.737	S	S	*	*			trans	71.9	121	171	-61.8	-163	168.6	-164.4	0	115.6
48	S	25.7	Very low	27.2	Very low	84 Å²	84	140.6 Å²	140.6	59%	0.587	73%	0.726	S	S	*	*			cis	92.2	116.9	25.1	81.9	0	0	0	0	114.5
49	L	28.7	Very low	27.6	Very low	147 Å²	147	140.8 Å²	140.8	77%	0.77	73%	0.727	S	S	*	*			trans	67.6	149.9	162.6	-54.2	164	0	0	0	113.1
50	E	28.4	Very low	27.9	Very low	139 Å²	139	142.9 Å²	142.9	65%	0.65	73%	0.733	S	S	*	*			cis	-150.2	178.5	7.6	-129.3	134.5	-136.7	0	0	109.1
51	E	27.5	Very low	28.1	Very low	157 Å²	157	140.8 Å²	140.8	73%	0.734	74%	0.736	S	S	*	*			trans	-12.9	152.4	145.5	-67.5	143.2	-154.1	0	0	117.1
52	D	26.7	Very low	28.7	Very low	132 Å²	132	137.8 Å²	137.8	71%	0.706	73%	0.725	S	S	*	*			cis	-165.7	-169.3	1.6	-112.5	-21.1	0	0	0	110.5
53	E	28.4	Very low	28.9	Very low	174 Å²	174	139.6 Å²	139.6	81%	0.813	73%	0.728	S	S	*	*			trans	34.2	143.7	141.9	-71.1	-179.2	-179.8	0	0	122.2
54	D	26.1	Very low	29.3	Very low	137 Å²	137	136.5 Å²	136.5	73%	0.733	72%	0.719	S	S	*	*			cis	-171.5	-170.4	-14.2	-160.4	0.7	0	0	0	108.6
55	L	31.5	Very low	29.6	Very low	140 Å²	140	132.9 Å²	132.9	73%	0.733	72%	0.716	S	S	*	*			trans	76.3	123.8	168.7	-48.7	-177.6	0	0	0	116.2
56	S	26.8	Very low	30.1	Very low	85 Å²	85	134.5 Å²	134.5	59%	0.594	72%	0.723	S	S	*	*				78.3	141.7	70.9	123	0	0	0	0	113.3
57	D	29.7	Very low	30.3	Very low	130 Å²	130	136.9 Å²	136.9	70%	0.695	73%	0.73	S	S	*	*			cis	-148.2	153.3	10	-117.8	-37	0	0	0	113.2
58	S	32.3	Very low	30.7	Very low	80 Å²	80	134.5 Å²	134.5	56%	0.559	73%	0.727	S	S	*	*				47.1	164.2	124.7	95.7	0	0	0	0	121.5
59	E	33.6	Very low	31	Very low	165 Å²	165	135.8 Å²	135.8	77%	0.771	74%	0.735	S	S	*	*			cis	-150.9	-179.2	-16.3	35.9	-149.8	122.5	0	0	106.8
60	E	32.7	Very low	31.1	Very low	159 Å²	159	132 Å²	132	74%	0.743	73%	0.732	S	S	*	*			cis	-171.1	-179.1	43.5	-153.2	-169.5	175.7	0	0	111.5	V62	E60-V62 HydrophobicContact CG-CG2 4.36Å
61	S	32.3	Very low	31.2	Very low	114 Å²	114	131.5 Å²	131.5	80%	0.797	74%	0.744	S	S	*	*			trans	85	120.1	173.7	73.8	0	0	0	0	118.1
62	V	37	Very low	31.3	Very low	114 Å²	114	131.5 Å²	131.5	69%	0.691	75%	0.749	S	S	*	*			cis	161.6	153.1	-41.2	159.2	0	0	0	0	108.2	E60	E60-V62 HydrophobicContact CG-CG2 4.36Å
63	Y	28.9	Very low	32.3	Very low	206 Å²	206	130 Å²	130	81%	0.808	75%	0.746	S	S	*	*			trans	76.1	126.4	172.4	-112.8	-117.7	0	0	0	116.5
64	S	35.1	Very low	32.4	Very low	97 Å²	97	127.8 Å²	127.8	68%	0.678	74%	0.74	S	S	*	*			cis	72	157.9	25.2	86.9	0	0	0	0	115.6
65	G	32.7	Very low	32.7	Very low	65 Å²	65	128.9 Å²	128.9	67%	0.67	74%	0.741	S	S	*	*			cis	-132.6	-179.2	-12.2	0	0	0	0	0	109.7
66	L	34.7	Very low	32.6	Very low	167 Å²	167	129.5 Å²	129.5	87%	0.874	74%	0.74	S	S	*	*			cis	88.2	107.1	32.8	-143	-179	0	0	0	114
67	E	32.7	Very low	32.6	Very low	191 Å²	191	133.3 Å²	133.3	89%	0.893	75%	0.749	S	S	*	*			trans	-166.7	132.7	164.5	-98.4	170.4	-152	0	0	104.9
68	D	32.8	Very low	32.5	Very low	142 Å²	142	134.6 Å²	134.6	76%	0.759	75%	0.75	S	S	*	*			cis	109.1	147.7	8.3	-164.6	44.6	0	0	0	116.3
69	S	32.9	Very low	32.3	Very low	110 Å²	110	139.6 Å²	139.6	77%	0.769	77%	0.765	S	S	*	*			trans	66.2	135.3	-175	-64.1	0	0	0	0	116.9
70	G	31.1	Very low	32	Very low	69 Å²	69	134.8 Å²	134.8	71%	0.711	76%	0.76	S	S	*	*			cis	144	122.3	-5	0	0	0	0	0	112.3
71	S	29.9	Very low	31.8	Very low	128 Å²	128	136.8 Å²	136.8	90%	0.895	77%	0.769	S	S	*	*			trans	-168.6	131.1	171.8	-70.1	0	0	0	0	112.9
72	D	30.2	Very low	31.7	Very low	157 Å²	157	139 Å²	139	84%	0.84	77%	0.772	S	S	*	*			trans	-91.9	-177	165.7	-71.2	-55.4	0	0	0	111.3
73	P	47.6	Very low	31.4	Very low	99 Å²	99	137 Å²	137	64%	0.643	77%	0.774	S	S	*	*			cis	-134.7	-163.7	-10.9	22.1	5	0	0	0	114.2
74	D	30.9	Very low	31.3	Very low	128 Å²	128	130.2 Å²	130.2	68%	0.684	77%	0.767	S	S	*	*			trans	108.5	109.1	141	-61.4	-32.3	0	0	0	121.3
75	E	31	Very low	30.9	Very low	161 Å²	161	130.7 Å²	130.7	75%	0.752	77%	0.771	S	S	*	*			trans	79.6	114.9	133.7	-64.6	176.4	169.4	0	0	123.4
76	E	29.4	Very low	30.7	Very low	152 Å²	152	134.2 Å²	134.2	71%	0.71	77%	0.774	S	S	*	*			trans	67.6	107.1	135.2	-63.2	174.8	-178.9	0	0	120.1
77	E	27.6	Very low	30.5	Very low	166 Å²	166	132.5 Å²	132.5	78%	0.776	77%	0.766	S	S	*	*				91.2	146.6	101.7	-76.2	176.3	179.3	0	0	112.5
78	E	27.8	Very low	30.4	Very low	157 Å²	157	131.6 Å²	131.6	73%	0.734	77%	0.767	S	S	*	*			cis	-151.2	165	16.6	-135.7	172.7	-167.4	0	0	108.8
79	E	27.8	Very low	30.3	Very low	184 Å²	184	131.5 Å²	131.5	86%	0.86	77%	0.766	S	S	*	*			trans	28.4	151.9	154.2	-66.7	178.7	-177.3	0	0	123.7
80	G	27.1	Very low	30.1	Very low	65 Å²	65	134.8 Å²	134.8	67%	0.67	77%	0.77	S	S	*	*			cis	168.8	-160.9	6.2	0	0	0	0	0	111.8
81	E	29.3	Very low	30	Very low	200 Å²	200	138.5 Å²	138.5	94%	0.935	77%	0.773	S	S	*	*			trans	65.3	143	-179	-60.3	-178.4	-174.5	0	0	117.9
82	D	30.1	Very low	30	Very low	162 Å²	162	140.6 Å²	140.6	87%	0.866	77%	0.769	S	S	*	*			cis	-160.4	156.9	-34.6	-169.3	16.3	0	0	0	108.2
83	G	29.1	Very low	29.9	Very low	70 Å²	70	140.1 Å²	140.1	72%	0.722	76%	0.762	S	S	*	*			trans	-171.5	109.3	177.6	0	0	0	0	0	113.1
84	G	27.7	Very low	29	Very low	65 Å²	65	141.1 Å²	141.1	67%	0.67	76%	0.762	S	S	*	*			trans	-100	-166.8	-179.1	0	0	0	0	0	115
85	S	26.3	Very low	28.9	Very low	107 Å²	107	143.7 Å²	143.7	75%	0.748	77%	0.77	S	S	*	*			trans	66.6	129.6	-177.7	53.8	0	0	0	0	116.9
86	D	29.2	Very low	28.7	Very low	139 Å²	139	143.4 Å²	143.4	74%	0.743	77%	0.768	S	S	*	*			cis	-148.3	154.5	-8.8	-77.9	-36.5	0	0	0	109.5
87	D	29.3	Very low	28.6	Very low	131 Å²	131	141.6 Å²	141.6	70%	0.701	76%	0.763	S	S	*	*			trans	26.3	135.2	144.2	-43.8	-21.5	0	0	0	123
88	D	31.1	Very low	28.6	Very low	171 Å²	171	141 Å²	141	91%	0.914	76%	0.76	S	S	*	*				-150.7	141.9	125.6	-107.7	-28	0	0	0	107.4
89	D	30.2	Very low	28.4	Very low	140 Å²	140	139.3 Å²	139.3	75%	0.749	76%	0.756	S	S	*	*			trans	-96.9	-176.6	-156.5	-69.7	-58.3	0	0	0	117.2
90	E	29.7	Very low	28.4	Very low	179 Å²	179	137.7 Å²	137.7	84%	0.836	75%	0.749	S	S	*	*			trans	81.1	130.7	160.7	-57.3	-177.6	-173.9	0	0	119.5
91	D	28.8	Very low	28.4	Very low	147 Å²	147	141.6 Å²	141.6	79%	0.786	75%	0.748	S	S	*	*			cis	-163.8	176.6	-24.5	-121.8	-0.8	0	0	0	112.9
92	E	30.6	Very low	28.1	Very low	173 Å²	173	136.8 Å²	136.8	81%	0.808	74%	0.736	S	S	*	*			trans	-70.7	-170.1	-170.1	-58.9	179.4	148.7	0	0	115.4
93	E	28.4	Very low	27.9	Very low	147 Å²	147	135.9 Å²	135.9	69%	0.687	74%	0.736	S	S	*	*			cis	-145.7	164.1	18.4	-52.7	167.1	105.6	0	0	110.6
94	D	27.8	Very low	27.9	Very low	120 Å²	120	138.6 Å²	138.6	64%	0.642	74%	0.739	S	S	*	*				-116.4	-99	-57.9	176.1	26.4	0	0	0	108.1	Q96	D94-Q96 PolarHBondContact OD2-NE2 2.81Å
95	E	28.9	Very low	27.9	Very low	182 Å²	182	145.2 Å²	145.2	85%	0.85	75%	0.749	S	S	*	*			cis	-132.5	160.4	-11.3	-95.4	-164.6	98.1	0	0	110
96	Q	26.8	Very low	27.9	Very low	155 Å²	155	149.3 Å²	149.3	72%	0.724	75%	0.753	S	S	*	*			trans	-84.5	178.4	-178.2	-61.6	149.3	50.6	0	0	111	D94	D94-Q96 PolarHBondContact OD2-NE2 2.81Å
97	D	26.8	Very low	27.7	Very low	114 Å²	114	147.7 Å²	147.7	61%	0.61	75%	0.753	S	S	*	*			cis	-150.7	175.8	10.8	-161.6	13.8	0	0	0	113.1
98	Q	27.3	Very low	27.6	Very low	152 Å²	152	151 Å²	151	71%	0.71	76%	0.761	S	S	*	*			trans	-58.8	152	169.6	-50.7	145.7	78.6	0	0	112.5
99	N	25.3	Very low	27.4	Very low	122 Å²	122	152.2 Å²	152.2	65%	0.652	76%	0.758	S	S	*	*				-161.7	148.2	103.3	-116.2	-91.4	0	0	0	116.2	K101	N99-K101 PolarHBondContact OD1-NZ 3.32Å
100	E	27	Very low	27.2	Very low	150 Å²	150	153.9 Å²	153.9	70%	0.701	76%	0.759	S	S	*	*			trans	-65.2	157.9	158.1	-24.3	160.8	107.9	0	0	110.3
101	K	26.1	Very low	27.1	Very low	148 Å²	148	153.3 Å²	153.3	64%	0.643	76%	0.756	S	S	*	*				-164.3	147.7	105.4	-103.1	140.4	-156.2	73	0	117.7	N99	N99-K101 PolarHBondContact OD1-NZ 3.32Å
102	S	24.4	Very low	27.1	Very low	99 Å²	99	150 Å²	150	69%	0.692	76%	0.757	S	S	*	*			trans	-38.5	139.3	167	55.8	0	0	0	0	116.1
103	T	25.5	Very low	27	Very low	142 Å²	142	144.9 Å²	144.9	87%	0.871	75%	0.751	S	S	*	*			trans	-80.6	122.9	163	51.9	0	0	0	0	111.9
104	V	28.4	Very low	27	Very low	128 Å²	128	145.9 Å²	145.9	78%	0.776	76%	0.761	S	S	*	*			trans	-133	105.3	163	-177.9	0	0	0	0	110.7
105	K	28.7	Very low	27.2	Very low	204 Å²	204	149.5 Å²	149.5	89%	0.887	77%	0.774	S	S	*	*			trans	-72.7	142.8	168	-66.7	172	179.1	170.2	0	110.4
106	K	25.6	Very low	27.4	Very low	192 Å²	192	150 Å²	150	84%	0.835	78%	0.776	S	S	*	*			trans	-142.7	155.5	152.2	-132.8	175.4	-175.2	179.3	0	111.1
107	S	24.7	Very low	28	Very low	105 Å²	105	152.2 Å²	152.2	73%	0.734	78%	0.783	S	S	*	*			trans	-142.9	134	-161.3	49.3	0	0	0	0	115
108	K	28.2	Very low	28.5	Very low	202 Å²	202	156.2 Å²	156.2	88%	0.878	80%	0.798	S	S	*	*			trans	65.5	143.7	151.9	-76	-171.9	170	-177.8	0	121.1
109	K	26.1	Very low	29.2	Very low	195 Å²	195	155.4 Å²	155.4	85%	0.848	80%	0.804	S	S	*	*			trans	91.7	142.1	167.8	-61.6	-177.6	176.8	-178.4	0	114.7
110	K	26.5	Very low	30.2	Very low	175 Å²	175	158.7 Å²	158.7	76%	0.761	81%	0.812	S	S	*	*			cis	-140.2	173.6	19.6	-153.6	172.9	175.7	-154.3	0	114.2
111	E	26.7	Very low	31.1	Very low	167 Å²	167	159.1 Å²	159.1	78%	0.78	81%	0.812	S	S	*	*			trans	-59.9	146.5	179.5	-56.8	114.9	131.9	0	0	114.2
112	G	29.4	Very low	32.4	Very low	79 Å²	79	160.4 Å²	160.4	81%	0.814	82%	0.82	S	S	*	*			trans	175	98.5	169.2	0	0	0	0	0	110.3
113	G	28.8	Very low	34.1	Very low	65 Å²	65	161.5 Å²	161.5	67%	0.67	82%	0.818	S	S	*	*			trans	-78.4	166.2	168.9	0	0	0	0	0	111.5
114	D	27.8	Very low	35.6	Very low	167 Å²	167	161.2 Å²	161.2	89%	0.893	81%	0.807	S	S	*	*			cis	-144.9	-167	6.2	-76.5	-51	0	0	0	110.4
115	E	32.9	Very low	37	Very low	196 Å²	196	163.8 Å²	163.8	92%	0.916	80%	0.804	S	S	*	*			trans	84.3	91.7	177.2	-56.6	-164	177.1	0	0	116.4
116	E	32.1	Very low	38.5	Very low	194 Å²	194	160.5 Å²	160.5	91%	0.907	80%	0.796	S	S	*	*			trans	-74.2	143.3	173	-58.8	171.8	138	0	0	111.9
117	K	39.4	Very low	39.9	Very low	201 Å²	201	160.3 Å²	160.3	87%	0.874	80%	0.798	S	S	*	*			trans	-134.2	119.5	153.7	-78.7	-171.8	177.6	177.2	0	109.4
118	E	37.2	Very low	40.9	Very low	197 Å²	197	160.3 Å²	160.3	92%	0.921	79%	0.79	S	S	*	*			trans	-64	134.7	168.4	-62.4	-178.7	123.5	0	0	109.9
119	V	41.8	Very low	42.3	Very low	136 Å²	136	155.7 Å²	155.7	82%	0.824	78%	0.778	S	S	*	*			trans	-119.8	127.2	158.2	-178.5	0	0	0	0	105.6
120	K	46.9	Very low	43.8	Very low	191 Å²	191	151.5 Å²	151.5	83%	0.83	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-68.1	144.3	176.9	-64.9	178.7	178.1	-179.8	0	109.1
121	K	45.5	Very low	44.9	Very low	158 Å²	158	150.1 Å²	150.1	69%	0.687	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-69	134.3	153.7	-94	-163.9	156.4	-159.1	0	108.4	E124	K121-E124 WeakPolarHBondContact CE-OE1 3.3Å; K121-E124 IonicContact NZ-OE1 3.21Å; K121-E124 PolarHBondContact NZ-OE1 2.98Å; K121-E124 IonicContact NZ-OE2 2.73Å; K121-E124 PolarHBondContact NZ-OE2 3.25Å
122	E	54.8	Low	46.3	Very low	176 Å²	176	149 Å²	149	82%	0.822	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-81.6	165.2	158.6	-72.4	159.9	158.1	0	0	108.1
123	D	59.2	Low	47.5	Very low	122 Å²	122	150 Å²	150	65%	0.652	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-78.5	136.8	-174.4	-138.8	-37	0	0	0	110.3	Y125	D123-Y125 PolarHBondContact O-N 2.96Å
124	E	56.7	Low	48.9	Very low	135 Å²	135	150.4 Å²	150.4	63%	0.631	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	6.1	-166.7	-70.6	174.1	138	0	0	113.1	K121	K121-E124 WeakPolarHBondContact CE-OE1 3.3Å; K121-E124 IonicContact NZ-OE1 3.21Å; K121-E124 PolarHBondContact NZ-OE1 2.98Å; K121-E124 IonicContact NZ-OE2 2.73Å; K121-E124 PolarHBondContact NZ-OE2 3.25Å
125	Y	58.7	Low	50.2	Low	182 Å²	182	148.7 Å²	148.7	71%	0.714	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.5	-4.4	-177.3	-67.4	-81.9	0	0	0	115.2	D123 H127	D123-Y125 PolarHBondContact O-N 2.96Å; Y125-H127 PolarHBondContact O-N 3.04Å
126	D	59	Low	51.6	Low	136 Å²	136	147.5 Å²	147.5	73%	0.727	72%	0.716	S	S	*	*	S	Bend	trans	-69	-16.3	-178.6	-93	-15.2	0	0	0	113.5
127	H	56.2	Low	53.1	Low	187 Å²	187	139.2 Å²	139.2	87%	0.866	68%	0.678	S	S	*	*	S	Bend	trans	-141.6	6.9	-167.5	-70.7	-20.2	0	0	0	116	Y125	Y125-H127 PolarHBondContact O-N 3.04Å
128	D	44.6	Very low	54.6	Low	106 Å²	106	133 Å²	133	57%	0.567	66%	0.657	S	S	*	*			trans	-117.4	101.9	176.7	-166.8	-18.4	0	0	0	110.1	S130	D128-S130 VanDerWaalsContact C-N 3.33Å; D128-S130 VanDerWaalsContact OD1-CB 3.31Å; D128-S130 WeakPolarHBondContact OD1-CB 3.5Å; D128-S130 PolarHBondContact OD1-N 3.38Å
129	T	59	Low	56.2	Low	104 Å²	104	124.7 Å²	124.7	64%	0.638	62%	0.62	S	S	*	*			trans	-87	2	-175.5	50.7	0	0	0	0	113.6	D131 E132	T129-D131 PolarHBondContact O-N 3.41Å; T129-E132 PolarHBondContact O-N 3.43Å
130	S	56.3	Low	57.6	Low	107 Å²	107	119.5 Å²	119.5	75%	0.748	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-8.7	-175	-173.1	0	0	0	0	114.8	D128	D128-S130 VanDerWaalsContact C-N 3.33Å; D128-S130 VanDerWaalsContact OD1-CB 3.31Å; D128-S130 WeakPolarHBondContact OD1-CB 3.5Å; D128-S130 PolarHBondContact OD1-N 3.38Å
131	D	51	Low	58.8	Low	146 Å²	146	118.5 Å²	118.5	78%	0.781	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.4	11.9	-178.9	-133.4	8.3	0	0	0	112.1	T129 E133	T129-D131 PolarHBondContact O-N 3.41Å; D131-E133 VanDerWaalsContact C-N 3.27Å; D131-E133 PolarHBondContact O-N 3.31Å
132	E	55.8	Low	60.3	Low	144 Å²	144	113.6 Å²	113.6	67%	0.673	58%	0.578	S	S	*	*			trans	-79.2	62.5	175.8	-73	-154.2	134.5	0	0	112.9	T129 D134	T129-E132 PolarHBondContact O-N 3.43Å; E132-D134 PolarHBondContact O-N 2.99Å
133	E	53.9	Low	61.3	Low	101 Å²	101	108.7 Å²	108.7	47%	0.472	56%	0.561	S	S	.	*			trans	-61.2	132.2	150.8	-71.1	-149	107.2	0	0	108.3	D131 I135 K192	D131-E133 VanDerWaalsContact C-N 3.27Å; D131-E133 PolarHBondContact O-N 3.31Å; E133-I135 WeakPolarHBondContact O-CA 3.41Å; E133-I135 WeakPolarHBondContact O-CG1 3.45Å; E133-I135 PolarHBondContact O-N 3.49Å; E133-K192 IonicContact OE1-NZ 2.71Å; E133-K192 PolarHBondContact OE1-NZ 3.03Å
134	D	57.3	Low	62	Low	73 Å²	73	105.4 Å²	105.4	39%	0.39	54%	0.543	S	S	.	.			trans	-56.9	102.3	-179.3	-178.6	27.8	0	0	0	110.5	E132 R136 N137	E132-D134 PolarHBondContact O-N 2.99Å; D134-R136 VanDerWaalsContact CG-NE 3.26Å; D134-R136 PolarHBondContact O-N 3.42Å; D134-R136 IonicContact OD1-CZ 2.68Å; D134-R136 VanDerWaalsContact OD1-CZ 3.22Å; D134-R136 IonicContact OD1-NE 2.92Å; D134-R136 PolarHBondContact OD1-NE 3.23Å; D134-R136 IonicContact OD1-NH2 2.86Å; D134-R136 PolarHBondContact OD1-NH2 3.11Å; D134-R136 IonicContact OD2-CZ 2.66Å; D134-R136 VanDerWaalsContact OD2-CZ 3.28Å; D134-R136 IonicContact OD2-NE 3.7Å; D134-R136 PolarHBondContact OD2-NE 2.55Å; D134-R136 IonicContact OD2-NH2 3.21Å; D134-R136 PolarHBondContact OD2-NH2 3.35Å; D134-N137 PolarHBondContact O-N 3.13Å
135	I	57.1	Low	63	Low	131 Å²	131	104.8 Å²	104.8	67%	0.672	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-6.9	-159.7	-32.8	176.2	0	0	0	113	E133	E133-I135 WeakPolarHBondContact O-CA 3.41Å; E133-I135 WeakPolarHBondContact O-CG1 3.45Å; E133-I135 PolarHBondContact O-N 3.49Å
136	R	60.7	Low	63.9	Low	171 Å²	171	104.5 Å²	104.5	65%	0.645	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-45.3	169.2	-70.5	170.3	-108	-167	1.9	112.3	D134 I162	D134-R136 VanDerWaalsContact CG-NE 3.26Å; D134-R136 PolarHBondContact O-N 3.42Å; D134-R136 IonicContact OD1-CZ 2.68Å; D134-R136 VanDerWaalsContact OD1-CZ 3.22Å; D134-R136 IonicContact OD1-NE 2.92Å; D134-R136 PolarHBondContact OD1-NE 3.23Å; D134-R136 IonicContact OD1-NH2 2.86Å; D134-R136 PolarHBondContact OD1-NH2 3.11Å; D134-R136 IonicContact OD2-CZ 2.66Å; D134-R136 VanDerWaalsContact OD2-CZ 3.28Å; D134-R136 IonicContact OD2-NE 3.7Å; D134-R136 PolarHBondContact OD2-NE 2.55Å; D134-R136 IonicContact OD2-NH2 3.21Å; D134-R136 PolarHBondContact OD2-NH2 3.35Å; R136-I162 WeakPolarHBondContact O-CD1 3.27Å
137	N	64.6	Low	64.7	Low	20 Å²	20	100.2 Å²	100.2	11%	0.107	51%	0.512	C	S	.	.			trans	-116	92.7	-166.2	-169	9	0	0	0	114.3	D134 V139 I162 K192	D134-N137 PolarHBondContact O-N 3.13Å; N137-V139 PolarHBondContact O-N 3.49Å; N137-V139 WeakPolarHBondContact OD1-CG1 3.38Å; N137-V139 WeakPolarHBondContact OD1-CG2 3.43Å; N137-I162 HydrophobicContact CB-CD1 3.94Å; N137-K192 PolarHBondContact ND2-O 3.48Å; N137-K192 VanDerWaalsContact ND2-O 3.07Å
138	T	70.8	Confident	65.4	Low	69 Å²	69	97.5 Å²	97.5	42%	0.423	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	27.4	-171	81	0	0	0	0	114.9	Y155 L157	T138-Y155 PolarHBondContact OG1-O 2.56Å; T138-L157 HydrophobicContact CG2-CB 4.25Å; T138-L157 HydrophobicContact CG2-CD1 4.16Å
139	V	70.8	Confident	67	Low	24 Å²	24	100.1 Å²	100.1	15%	0.145	51%	0.511	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-24.5	-177.4	-70.1	0	0	0	0	114.1	N137 I142 M144 Y147	N137-V139 PolarHBondContact O-N 3.49Å; N137-V139 WeakPolarHBondContact OD1-CG1 3.38Å; N137-V139 WeakPolarHBondContact OD1-CG2 3.43Å; V139-I142 HydrophobicContact CB-CD1 4.18Å; V139-I142 HydrophobicContact CB-CG1 4.29Å; V139-M144 HydrophobicContact CG2-SD 4.22Å; V139-Y147 HydrophobicContact CG1-CE2 4.11Å
140	G	71.1	Confident	67.8	Low	26 Å²	26	100.4 Å²	100.4	27%	0.268	50%	0.504	S	S	.	.			trans	62.3	-162.8	-173.3	0	0	0	0	0	113.2	I142	G140-I142 PolarHBondContact O-N 3.4Å
141	N	72.7	Confident	68.9	Low	171 Å²	171	99.4 Å²	99.4	91%	0.914	50%	0.495	S	S	*	.	S	Bend	trans	-81.4	81.8	-176.6	-167.3	1.4	0	0	0	112.3
142	I	76.5	Confident	70.2	Confident	55 Å²	55	93 Å²	93	28%	0.282	46%	0.46	S	S	.	.	S	Bend	trans	-127.3	155	171.5	52.9	171.3	0	0	0	112	V139 G140 M144 Y147	V139-I142 HydrophobicContact CB-CD1 4.18Å; V139-I142 HydrophobicContact CB-CG1 4.29Å; G140-I142 PolarHBondContact O-N 3.4Å; I142-M144 PolarHBondContact O-N 2.88Å; I142-Y147 HydrophobicContact CD1-CE2 4.1Å
143	P	76.6	Confident	71.1	Confident	72 Å²	72	87 Å²	87	47%	0.468	43%	0.433	S	S	.	.			trans	-60.3	106.8	178.2	-25	35.8	0	0	0	112.7	E145 W146	P143-E145 PolarHBondContact O-N 2.84Å; P143-W146 PolarHBondContact O-N 2.95Å; P143-W146 VanDerWaalsContact O-N 3.09Å
144	M	73.1	Confident	72.3	Confident	53 Å²	53	82.2 Å²	82.2	26%	0.261	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-59.7	-13.6	-179.3	-61.1	-64	-80.1	0	0	113.6	V139 I142 W146 Y147 V153	V139-M144 HydrophobicContact CG2-SD 4.22Å; I142-M144 PolarHBondContact O-N 2.88Å; M144-W146 PolarHBondContact O-N 3.18Å; M144-Y147 PolarHBondContact O-N 2.93Å; M144-Y147 VanDerWaalsContact O-N 3.08Å; M144-V153 HydrophobicContact CE-CG1 3.31Å
145	E	77.5	Confident	73.3	Confident	123 Å²	123	83.1 Å²	83.1	58%	0.575	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-52.8	-35.6	170.2	-58.3	-146.6	111.4	0	0	113.4	P143 Y147 K148	P143-E145 PolarHBondContact O-N 2.84Å; E145-Y147 PolarHBondContact O-N 2.82Å; E145-Y147 VanDerWaalsContact O-N 3.11Å; E145-K148 HydrophobicContact CB-CD 4.22Å; E145-K148 HydrophobicContact CG-CD 4.45Å; E145-K148 VanDerWaalsContact O-CB 3.28Å; E145-K148 WeakPolarHBondContact O-CB 3.01Å; E145-K148 PolarHBondContact O-N 3.47Å; E145-K148 IonicContact OE1-NZ 2.67Å; E145-K148 PolarHBondContact OE1-NZ 2.73Å
146	W	76.8	Confident	74.1	Confident	176 Å²	176	79.5 Å²	79.5	67%	0.667	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-62.7	-20	179.5	-61.9	-6.3	0	0	0	113.2	P143 M144 F150	P143-W146 PolarHBondContact O-N 2.95Å; P143-W146 VanDerWaalsContact O-N 3.09Å; M144-W146 PolarHBondContact O-N 3.18Å; W146-F150 WeakPolarHBondContact O-CD2 3.48Å
147	Y	76.2	Confident	74.7	Confident	46 Å²	46	78.5 Å²	78.5	18%	0.18	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-96.3	-1.8	174.3	-66.7	-76.5	0	0	0	113.6	V139 I142 M144 E145 D149 F150 H152 K164	V139-Y147 HydrophobicContact CG1-CE2 4.11Å; I142-Y147 HydrophobicContact CD1-CE2 4.1Å; M144-Y147 PolarHBondContact O-N 2.93Å; M144-Y147 VanDerWaalsContact O-N 3.08Å; E145-Y147 PolarHBondContact O-N 2.82Å; E145-Y147 VanDerWaalsContact O-N 3.11Å; Y147-D149 PolarHBondContact O-N 2.92Å; Y147-F150 PolarHBondContact O-N 3.48Å; Y147-F150 VanDerWaalsContact O-N 3.11Å; Y147-H152 WeakPolarHBondContact CD1-O 3.26Å; Y147-K164 WeakPolarHBondContact O-CE 3.35Å; Y147-K164 PolarHBondContact O-NZ 2.85Å
148	K	71.7	Confident	75.2	Confident	129 Å²	129	83.6 Å²	83.6	56%	0.561	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-51.9	-177.8	-82.9	173.7	174.6	-178.1	0	112.3	E145 F150 K164	E145-K148 HydrophobicContact CB-CD 4.22Å; E145-K148 HydrophobicContact CG-CD 4.45Å; E145-K148 VanDerWaalsContact O-CB 3.28Å; E145-K148 WeakPolarHBondContact O-CB 3.01Å; E145-K148 PolarHBondContact O-N 3.47Å; E145-K148 IonicContact OE1-NZ 2.67Å; E145-K148 PolarHBondContact OE1-NZ 2.73Å; K148-F150 PolarHBondContact O-N 3.32Å; K148-K164 PolarHBondContact O-NZ 2.68Å
149	D	77.2	Confident	75.3	Confident	161 Å²	161	82.8 Å²	82.8	86%	0.861	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-7.2	-177.2	-59.8	-24.9	0	0	0	114.3	Y147	Y147-D149 PolarHBondContact O-N 2.92Å
150	F	76.1	Confident	75.7	Confident	111 Å²	111	87.1 Å²	87.1	49%	0.487	45%	0.448	S	S	.	.	S	Bend	trans	-100.5	147.7	-178.1	-67.6	-78.4	0	0	0	112.3	W146 Y147 K148 H152 K164	W146-F150 WeakPolarHBondContact O-CD2 3.48Å; Y147-F150 PolarHBondContact O-N 3.48Å; Y147-F150 VanDerWaalsContact O-N 3.11Å; K148-F150 PolarHBondContact O-N 3.32Å; F150-H152 PolarHBondContact O-N 3.24Å; F150-K164 WeakPolarHBondContact O-CE 3.28Å; F150-K164 PolarHBondContact O-NZ 3.22Å
151	P	78.9	Confident	76.1	Confident	86 Å²	86	90.4 Å²	90.4	56%	0.558	46%	0.455	S	S	*	.	S	Bend	trans	-78.1	3.3	177.3	33.2	-37.5	0	0	0	113.8	K164	P151-K164 PolarHBondContact O-N 3.11Å
152	H	79.1	Confident	76.4	Confident	11 Å²	11	84.2 Å²	84.2	5%	0.051	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	151.4	-176.7	70.9	-54.2	0	0	0	109.4	Y147 F150 Y155 K161 I162 F163	Y147-H152 WeakPolarHBondContact CD1-O 3.26Å; F150-H152 PolarHBondContact O-N 3.24Å; H152-Y155 AromaticContact NE2-CE2 3.87Å; H152-Y155 AromaticContact NE2-CZ 3.74Å; H152-Y155 PolarHBondContact NE2-OH 3.28Å; H152-K161 HydrophobicContact CB-CB 4.23Å; H152-K161 PolarHBondContact CE1-NZ 2.83Å; H152-K161 VanDerWaalsContact CE1-NZ 3.32Å; H152-K161 PolarHBondContact NE2-NZ 3.29Å; H152-I162 CarbonylContact C-O 3.57Å; H152-I162 WeakPolarHBondContact CA-O 3.48Å; H152-I162 WeakPolarHBondContact CB-O 3.4Å; H152-F163 HydrophobicContact CB-CD1 4.29Å
153	V	74.7	Confident	76.4	Confident	18 Å²	18	88.3 Å²	88.3	11%	0.109	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	105.8	179.2	171.2	0	0	0	0	106.6	M144 I162 K164	M144-V153 HydrophobicContact CE-CG1 3.31Å; V153-I162 PolarHBondContact N-O 3.22Å; V153-I162 WeakPolarHBondContact O-CB 3.28Å; V153-K164 HydrophobicContact CG2-CD 4.21Å; V153-K164 VanDerWaalsContact CG2-CE 3.48Å; V153-K164 HydrophobicContact CG2-CG 3.67Å
154	G	78.1	Confident	76.1	Confident	0 Å²	0	88.1 Å²	88.1	0%	0	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	67.6	-163.2	179.9	0	0	0	0	0	115.7
155	Y	79.3	Confident	75.9	Confident	93 Å²	93	89.2 Å²	89.2	37%	0.365	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	152	-179.5	-65.7	-104.7	0	0	0	109.9	T138 H152 G159 K160 K161	T138-Y155 PolarHBondContact OG1-O 2.56Å; H152-Y155 AromaticContact NE2-CE2 3.87Å; H152-Y155 AromaticContact NE2-CZ 3.74Å; H152-Y155 PolarHBondContact NE2-OH 3.28Å; Y155-G159 WeakPolarHBondContact CD1-O 3.19Å; Y155-K160 CarbonylContact C-O 3.55Å; Y155-K160 WeakPolarHBondContact CA-O 3.32Å; Y155-K160 VanDerWaalsContact CB-O 3.26Å; Y155-K160 WeakPolarHBondContact CB-O 3.42Å; Y155-K160 WeakPolarHBondContact CD1-O 3.43Å; Y155-K161 HydrophobicContact CD1-CG 3.8Å; Y155-K161 HydrophobicContact CE1-CB 4.49Å; Y155-K161 HydrophobicContact CE1-CD 4.23Å; Y155-K161 HydrophobicContact CE1-CG 3.34Å; Y155-K161 VanDerWaalsContact OH-CE 3.3Å; Y155-K161 WeakPolarHBondContact OH-CE 3.22Å; Y155-K161 PolarHBondContact OH-NZ 2.83Å; Y155-K161 VanDerWaalsContact OH-NZ 3.09Å
156	D	73.9	Confident	75.2	Confident	54 Å²	54	90.5 Å²	90.5	29%	0.289	45%	0.449	S	S	.	.			trans	-64.1	163.9	168.6	-58.3	-21.2	0	0	0	110.4	D158 G159 K160 I162	D156-D158 HydrophobicContact CB-CB 4.46Å; D156-D158 PolarHBondContact O-N 2.86Å; D156-D158 VanDerWaalsContact O-N 3.08Å; D156-G159 WeakPolarHBondContact O-CA 3.46Å; D156-G159 PolarHBondContact O-N 3.5Å; D156-K160 HydrophobicContact CB-CB 4.37Å; D156-K160 PolarHBondContact N-O 3.01Å; D156-K160 WeakPolarHBondContact OD2-CB 3.3Å; D156-I162 VanDerWaalsContact OD1-CG1 3.23Å; D156-I162 WeakPolarHBondContact OD1-CG1 3.43Å
157	L	72.6	Confident	74.3	Confident	150 Å²	150	90.2 Å²	90.2	79%	0.785	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-29.7	169.7	-159.2	79.1	0	0	0	113.4	T138 G159	T138-L157 HydrophobicContact CG2-CB 4.25Å; T138-L157 HydrophobicContact CG2-CD1 4.16Å; L157-G159 VanDerWaalsContact C-N 3.28Å; L157-G159 PolarHBondContact O-N 3.14Å
158	D	76.3	Confident	73.2	Confident	127 Å²	127	94.7 Å²	94.7	68%	0.679	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-4.8	174.5	-91.9	-8.6	0	0	0	114.4	D156 K160	D156-D158 HydrophobicContact CB-CB 4.46Å; D156-D158 PolarHBondContact O-N 2.86Å; D156-D158 VanDerWaalsContact O-N 3.08Å; D158-K160 HydrophobicContact CB-CD 4.11Å; D158-K160 HydrophobicContact CB-CG 4.29Å; D158-K160 IonicContact OD2-NZ 3.69Å; D158-K160 PolarHBondContact OD2-NZ 2.84Å
159	G	72.8	Confident	72.8	Confident	53 Å²	53	93.1 Å²	93.1	55%	0.546	47%	0.468	S	S	.	.	S	Bend	trans	78.2	20.8	-176.3	0	0	0	0	0	115.3	Y155 D156 L157	Y155-G159 WeakPolarHBondContact CD1-O 3.19Å; D156-G159 WeakPolarHBondContact O-CA 3.46Å; D156-G159 PolarHBondContact O-N 3.5Å; L157-G159 VanDerWaalsContact C-N 3.28Å; L157-G159 PolarHBondContact O-N 3.14Å
160	K	78.2	Confident	72.2	Confident	115 Å²	115	91.5 Å²	91.5	50%	0.5	46%	0.46	S	S	.	.			trans	-90.5	152.4	175.1	-60.5	160.9	-174.1	149.6	0	110.5	Y155 D156 D158	Y155-K160 CarbonylContact C-O 3.55Å; Y155-K160 WeakPolarHBondContact CA-O 3.32Å; Y155-K160 VanDerWaalsContact CB-O 3.26Å; Y155-K160 WeakPolarHBondContact CB-O 3.42Å; Y155-K160 WeakPolarHBondContact CD1-O 3.43Å; D156-K160 HydrophobicContact CB-CB 4.37Å; D156-K160 PolarHBondContact N-O 3.01Å; D156-K160 WeakPolarHBondContact OD2-CB 3.3Å; D158-K160 HydrophobicContact CB-CD 4.11Å; D158-K160 HydrophobicContact CB-CG 4.29Å; D158-K160 IonicContact OD2-NZ 3.69Å; D158-K160 PolarHBondContact OD2-NZ 2.84Å
161	K	80.6	Confident	72.1	Confident	94 Å²	94	95 Å²	95	41%	0.409	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	127.9	-178.4	-69	-177.4	177.4	-118	0	112.1	H152 Y155 F163	H152-K161 HydrophobicContact CB-CB 4.23Å; H152-K161 PolarHBondContact CE1-NZ 2.83Å; H152-K161 VanDerWaalsContact CE1-NZ 3.32Å; H152-K161 PolarHBondContact NE2-NZ 3.29Å; Y155-K161 HydrophobicContact CD1-CG 3.8Å; Y155-K161 HydrophobicContact CE1-CB 4.49Å; Y155-K161 HydrophobicContact CE1-CD 4.23Å; Y155-K161 HydrophobicContact CE1-CG 3.34Å; Y155-K161 VanDerWaalsContact OH-CE 3.3Å; Y155-K161 WeakPolarHBondContact OH-CE 3.22Å; Y155-K161 PolarHBondContact OH-NZ 2.83Å; Y155-K161 VanDerWaalsContact OH-NZ 3.09Å; K161-F163 HydrophobicContact CB-CE2 4.06Å; K161-F163 HydrophobicContact CB-CZ 4.27Å; K161-F163 WeakPolarHBondContact O-CD2 3.2Å; K161-F163 PolarHBondContact O-N 2.8Å
162	I	77.9	Confident	71.7	Confident	41 Å²	41	97 Å²	97	21%	0.21	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	104.7	172.8	-51.9	155.8	0	0	0	108.1	R136 N137 H152 V153 D156	R136-I162 WeakPolarHBondContact O-CD1 3.27Å; N137-I162 HydrophobicContact CB-CD1 3.94Å; H152-I162 CarbonylContact C-O 3.57Å; H152-I162 WeakPolarHBondContact CA-O 3.48Å; H152-I162 WeakPolarHBondContact CB-O 3.4Å; V153-I162 PolarHBondContact N-O 3.22Å; V153-I162 WeakPolarHBondContact O-CB 3.28Å; D156-I162 VanDerWaalsContact OD1-CG1 3.23Å; D156-I162 WeakPolarHBondContact OD1-CG1 3.43Å
163	F	76.7	Confident	71.3	Confident	141 Å²	141	99.8 Å²	99.8	62%	0.618	50%	0.498	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74	143.1	179.7	-70.9	-85.5	0	0	0	111.5	H152 K161	H152-F163 HydrophobicContact CB-CD1 4.29Å; K161-F163 HydrophobicContact CB-CE2 4.06Å; K161-F163 HydrophobicContact CB-CZ 4.27Å; K161-F163 WeakPolarHBondContact O-CD2 3.2Å; K161-F163 PolarHBondContact O-N 2.8Å
164	K	71.1	Confident	71.2	Confident	69 Å²	69	102.2 Å²	102.2	30%	0.3	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-62.2	146.6	172.7	-70.1	176.2	178.6	165.4	0	110.3	Y147 K148 F150 P151 V153	Y147-K164 WeakPolarHBondContact O-CE 3.35Å; Y147-K164 PolarHBondContact O-NZ 2.85Å; K148-K164 PolarHBondContact O-NZ 2.68Å; F150-K164 WeakPolarHBondContact O-CE 3.28Å; F150-K164 PolarHBondContact O-NZ 3.22Å; P151-K164 PolarHBondContact O-N 3.11Å; V153-K164 HydrophobicContact CG2-CD 4.21Å; V153-K164 VanDerWaalsContact CG2-CE 3.48Å; V153-K164 HydrophobicContact CG2-CG 3.67Å
165	P	68.2	Low	71.2	Confident	76 Å²	76	108.3 Å²	108.3	49%	0.494	54%	0.537	S	S	.	.	P	Polyproline II helix	trans	-57.5	143.3	165.5	25.9	-33.1	0	0	0	110	R167	P165-R167 PolarHBondContact O-N 2.98Å
166	I	62.6	Low	71	Confident	149 Å²	149	107.7 Å²	107.7	76%	0.764	54%	0.54	S	S	*	.			trans	-75.3	94.9	-173.3	-56.7	175.4	0	0	0	109.2	N168	I166-N168 PolarHBondContact O-N 3.37Å
167	R	58.3	Low	71.1	Confident	170 Å²	170	107.5 Å²	107.5	64%	0.642	54%	0.539	S	S	*	.			trans	-68.6	95.3	174.6	-114.7	-177.3	163.7	138.7	-1.3	110.3	P165	P165-R167 PolarHBondContact O-N 2.98Å
168	N	53.8	Low	71.2	Confident	141 Å²	141	107.2 Å²	107.2	75%	0.754	53%	0.531	S	S	*	.			trans	-113.4	23.7	168	-76.2	6.9	0	0	0	111.6	I166	I166-N168 PolarHBondContact O-N 3.37Å
169	K	62.5	Low	71.2	Confident	95 Å²	95	108.1 Å²	108.1	41%	0.413	53%	0.533	S	S	.	.			trans	-86.5	130.3	165.7	-74.3	-164.6	-178.2	-173.5	0	108.4	D173 D174 D177	K169-D173 HydrophobicContact CB-CB 4.22Å; K169-D173 HydrophobicContact CD-CB 4.35Å; K169-D173 HydrophobicContact CG-CB 4.31Å; K169-D174 VanDerWaalsContact CD-OD1 3.23Å; K169-D174 WeakPolarHBondContact CD-OD1 3.44Å; K169-D174 IonicContact NZ-OD1 3.14Å; K169-D177 IonicContact NZ-OD2 2.62Å; K169-D177 PolarHBondContact NZ-OD2 3.1Å
170	D	65.4	Low	71	Confident	127 Å²	127	113.3 Å²	113.3	68%	0.679	54%	0.543	S	S	*	.			trans	-88.1	165.2	169.9	-81.8	-28	0	0	0	110.2	L172 D173	D170-L172 PolarHBondContact O-N 3.21Å; D170-D173 PolarHBondContact N-OD2 2.94Å; D170-D173 VanDerWaalsContact N-OD2 3.11Å; D170-D173 PolarHBondContact O-N 3.34Å
171	E	72.4	Confident	70.8	Confident	184 Å²	184	111.2 Å²	111.2	86%	0.86	54%	0.538	S	S	*	.	H	α-helix	trans	-56.2	-19.4	179.6	-61.4	-179.8	158.8	0	0	113.8	F175	E171-F175 PolarHBondContact O-N 3.39Å
172	L	71.4	Confident	70.6	Confident	130 Å²	130	111.4 Å²	111.4	68%	0.681	55%	0.549	S	S	*	.	H	α-helix	trans	-75.1	-32.1	175.3	-140.5	81.2	0	0	0	112.9	D170 L176	D170-L172 PolarHBondContact O-N 3.21Å; L172-L176 WeakPolarHBondContact O-CG 3.3Å; L172-L176 PolarHBondContact O-N 2.89Å; L172-L176 VanDerWaalsContact O-N 3.12Å
173	D	71.2	Confident	70.5	Confident	68 Å²	68	113 Å²	113	36%	0.364	56%	0.557	S	S	.	*	H	α-helix	trans	-74.7	-44.5	-178.5	-61.8	-41.7	0	0	0	110.5	K169 D170 F175 L176 D177	K169-D173 HydrophobicContact CB-CB 4.22Å; K169-D173 HydrophobicContact CD-CB 4.35Å; K169-D173 HydrophobicContact CG-CB 4.31Å; D170-D173 PolarHBondContact N-OD2 2.94Å; D170-D173 VanDerWaalsContact N-OD2 3.11Å; D170-D173 PolarHBondContact O-N 3.34Å; D173-F175 PolarHBondContact O-N 3.06Å; D173-L176 PolarHBondContact O-N 3.34Å; D173-L176 VanDerWaalsContact O-N 3.08Å; D173-D177 PolarHBondContact O-N 3.06Å
174	D	72.4	Confident	70.5	Confident	70 Å²	70	111 Å²	111	37%	0.374	55%	0.546	S	S	.	.	H	α-helix	trans	-63.1	-28.3	175.2	-77.4	-1.8	0	0	0	111.7	K169 K178	K169-D174 VanDerWaalsContact CD-OD1 3.23Å; K169-D174 WeakPolarHBondContact CD-OD1 3.44Å; K169-D174 IonicContact NZ-OD1 3.14Å; D174-K178 PolarHBondContact O-N 3.49Å
175	F	77.2	Confident	70.5	Confident	127 Å²	127	116.4 Å²	116.4	56%	0.557	57%	0.565	S	S	*	*	H	α-helix	trans	-72.7	-38.8	171.6	-176.3	-91.8	0	0	0	112.7	E171 D173 K178 M179	E171-F175 PolarHBondContact O-N 3.39Å; D173-F175 PolarHBondContact O-N 3.06Å; F175-K178 PolarHBondContact O-N 3.45Å; F175-M179 HydrophobicContact CE1-SD 3.89Å; F175-M179 HydrophobicContact CZ-CE 4.24Å; F175-M179 HydrophobicContact CZ-SD 4.02Å; F175-M179 PolarHBondContact O-N 2.86Å
176	L	75.6	Confident	71.1	Confident	81 Å²	81	114 Å²	114	42%	0.424	55%	0.547	S	S	.	.	H	α-helix	trans	-69.8	-43.9	177.4	-74.7	168.3	0	0	0	112	L172 D173 K178 M179 E180	L172-L176 WeakPolarHBondContact O-CG 3.3Å; L172-L176 PolarHBondContact O-N 2.89Å; L172-L176 VanDerWaalsContact O-N 3.12Å; D173-L176 PolarHBondContact O-N 3.34Å; D173-L176 VanDerWaalsContact O-N 3.08Å; L176-K178 PolarHBondContact O-N 2.93Å; L176-M179 PolarHBondContact O-N 2.94Å; L176-E180 PolarHBondContact O-N 3.41Å
177	D	75.3	Confident	72	Confident	50 Å²	50	109.1 Å²	109.1	27%	0.267	52%	0.524	S	S	.	.	H	α-helix	trans	-55.4	-37.3	174	-93.6	-40.7	0	0	0	111.4	K169 D173 M179 N181	K169-D177 IonicContact NZ-OD2 2.62Å; K169-D177 PolarHBondContact NZ-OD2 3.1Å; D173-D177 PolarHBondContact O-N 3.06Å; D177-M179 VanDerWaalsContact C-N 3.33Å; D177-M179 PolarHBondContact O-N 2.87Å; D177-N181 WeakPolarHBondContact O-CB 3.35Å; D177-N181 PolarHBondContact O-N 2.88Å; D177-N181 PolarHBondContact OD1-ND2 3.01Å
178	K	75.6	Confident	73	Confident	143 Å²	143	105 Å²	105	62%	0.622	52%	0.517	S	S	*	.	H	α-helix	trans	-74.5	-16	177.9	-168.7	161.9	-172	160.5	0	114.7	D174 F175 L176 Y184	D174-K178 PolarHBondContact O-N 3.49Å; F175-K178 PolarHBondContact O-N 3.45Å; L176-K178 PolarHBondContact O-N 2.93Å; K178-Y184 HydrophobicContact CB-CE1 4.37Å; K178-Y184 HydrophobicContact CB-CE2 4.13Å; K178-Y184 HydrophobicContact CD-CE1 4.05Å; K178-Y184 HydrophobicContact CG-CD1 4.38Å; K178-Y184 HydrophobicContact CG-CE1 3.85Å; K178-Y184 HydrophobicContact CG-CE2 4.49Å
179	M	76.3	Confident	74	Confident	147 Å²	147	101.6 Å²	101.6	72%	0.724	50%	0.497	S	S	*	.	H	α-helix	trans	-104.8	-34	179.4	-95.8	-164.3	164.2	0	0	114.5	F175 L176 D177	F175-M179 HydrophobicContact CE1-SD 3.89Å; F175-M179 HydrophobicContact CZ-CE 4.24Å; F175-M179 HydrophobicContact CZ-SD 4.02Å; F175-M179 PolarHBondContact O-N 2.86Å; L176-M179 PolarHBondContact O-N 2.94Å; D177-M179 VanDerWaalsContact C-N 3.33Å; D177-M179 PolarHBondContact O-N 2.87Å
180	E	68.4	Low	74.4	Confident	161 Å²	161	99.3 Å²	99.3	75%	0.752	49%	0.489	S	S	*	.	H	α-helix	trans	-109.6	-14.6	-172.5	-62.7	-161.2	144.5	0	0	114.8	L176 P182	L176-E180 PolarHBondContact O-N 3.41Å; E180-P182 WeakPolarHBondContact O-CD 3.3Å
181	N	73.7	Confident	74.4	Confident	72 Å²	72	101.6 Å²	101.6	39%	0.385	49%	0.493	S	S	.	.			trans	-91.5	112.5	-173.4	-162.6	-18.7	0	0	0	112.7	D177 D183 Y184	D177-N181 WeakPolarHBondContact O-CB 3.35Å; D177-N181 PolarHBondContact O-N 2.88Å; D177-N181 PolarHBondContact OD1-ND2 3.01Å; N181-D183 VanDerWaalsContact C-N 3.3Å; N181-D183 PolarHBondContact O-N 3.49Å; N181-Y184 WeakPolarHBondContact O-CB 3.49Å; N181-Y184 PolarHBondContact O-N 2.95Å
182	P	76.1	Confident	74.2	Confident	98 Å²	98	97.4 Å²	97.4	64%	0.636	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-25.5	-171.6	-22.4	35	0	0	0	115.4	E180 W185	E180-P182 WeakPolarHBondContact O-CD 3.3Å; P182-W185 PolarHBondContact O-NE1 2.7Å; P182-W185 VanDerWaalsContact O-NE1 3.14Å
183	D	75.8	Confident	74	Confident	73 Å²	73	93.5 Å²	93.5	39%	0.39	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	8	-177	-65.8	-66.6	0	0	0	112.9	N181 W185 K186 T187 V198	N181-D183 VanDerWaalsContact C-N 3.3Å; N181-D183 PolarHBondContact O-N 3.49Å; D183-W185 PolarHBondContact O-N 2.97Å; D183-K186 WeakPolarHBondContact O-CA 3.37Å; D183-K186 WeakPolarHBondContact O-CB 3.39Å; D183-K186 PolarHBondContact O-N 3Å; D183-K186 IonicContact OD1-NZ 2.69Å; D183-T187 PolarHBondContact O-N 3.26Å; D183-T187 PolarHBondContact O-OG1 2.82Å; D183-V198 HydrophobicContact CB-CG1 4.47Å
184	Y	77.8	Confident	73.7	Confident	99 Å²	99	91.8 Å²	91.8	39%	0.388	45%	0.449	S	S	.	.	G	3₁₀ helix	trans	-54.2	-37.7	177.4	-174.5	-89	0	0	0	112.4	K178 N181 K186 T187	K178-Y184 HydrophobicContact CB-CE1 4.37Å; K178-Y184 HydrophobicContact CB-CE2 4.13Å; K178-Y184 HydrophobicContact CD-CE1 4.05Å; K178-Y184 HydrophobicContact CG-CD1 4.38Å; K178-Y184 HydrophobicContact CG-CE1 3.85Å; K178-Y184 HydrophobicContact CG-CE2 4.49Å; N181-Y184 WeakPolarHBondContact O-CB 3.49Å; N181-Y184 PolarHBondContact O-N 2.95Å; Y184-K186 VanDerWaalsContact C-N 3.28Å; Y184-K186 PolarHBondContact O-N 3.26Å; Y184-T187 WeakPolarHBondContact O-CB 3.37Å; Y184-T187 PolarHBondContact O-N 3.04Å; Y184-T187 VanDerWaalsContact O-N 3.1Å
185	W	71.1	Confident	73.7	Confident	184 Å²	184	90.8 Å²	90.8	70%	0.697	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-72.8	-14.5	177.5	71.3	-85.4	0	0	0	114.5	P182 D183	P182-W185 PolarHBondContact O-NE1 2.7Å; P182-W185 VanDerWaalsContact O-NE1 3.14Å; D183-W185 PolarHBondContact O-N 2.97Å
186	K	80	Confident	73.6	Confident	26 Å²	26	89.4 Å²	89.4	11%	0.113	45%	0.446	C	S	.	.	G	3₁₀ helix	trans	-92.7	0.9	170	-63.1	-177.3	176	175.8	0	112.3	D183 Y184 V198 L199 E201 I204	D183-K186 WeakPolarHBondContact O-CA 3.37Å; D183-K186 WeakPolarHBondContact O-CB 3.39Å; D183-K186 PolarHBondContact O-N 3Å; D183-K186 IonicContact OD1-NZ 2.69Å; Y184-K186 VanDerWaalsContact C-N 3.28Å; Y184-K186 PolarHBondContact O-N 3.26Å; K186-V198 HydrophobicContact CB-CG1 3.87Å; K186-V198 WeakPolarHBondContact O-CA 3.45Å; K186-L199 PolarHBondContact O-N 2.64Å; K186-E201 IonicContact NZ-OE1 2.9Å; K186-E201 PolarHBondContact NZ-OE1 3.03Å; K186-I204 HydrophobicContact CD-CD1 3.9Å; K186-I204 HydrophobicContact CG-CD1 3.95Å
187	T	81.4	Confident	73.7	Confident	46 Å²	46	89.9 Å²	89.9	28%	0.282	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	124.6	-169.5	-53.2	0	0	0	0	111.3	D183 Y184 D196 I197 V198	D183-T187 PolarHBondContact O-N 3.26Å; D183-T187 PolarHBondContact O-OG1 2.82Å; Y184-T187 WeakPolarHBondContact O-CB 3.37Å; Y184-T187 PolarHBondContact O-N 3.04Å; Y184-T187 VanDerWaalsContact O-N 3.1Å; T187-D196 HydrophobicContact CG2-CB 3.86Å; T187-I197 CarbonylContact C-O 3.58Å; T187-I197 WeakPolarHBondContact CA-O 3.44Å; T187-V198 HydrophobicContact CG2-CG2 4.26Å
188	V	78.9	Confident	74	Confident	83 Å²	83	91.5 Å²	91.5	50%	0.503	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	133.2	-178.2	-176.5	0	0	0	0	109.7	I197 L199	V188-I197 PolarHBondContact N-O 3Å; V188-I197 PolarHBondContact O-N 2.82Å; V188-L199 HydrophobicContact CG2-CD1 4.19Å; V188-L199 HydrophobicContact CG2-CG 4.33Å
189	H	74.6	Confident	74.3	Confident	70 Å²	70	88 Å²	88	32%	0.324	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	110.7	178.8	-171.7	76.5	0	0	0	111.3	K191 D196	H189-K191 PolarHBondContact O-N 3.42Å; H189-D196 IonicContact CE1-OD1 2.61Å; H189-D196 IonicContact CG-OD1 2.7Å; H189-D196 IonicContact ND1-OD1 2.66Å; H189-D196 PolarHBondContact ND1-OD1 3.39Å
190	D	71.9	Confident	74.7	Confident	47 Å²	47	83.6 Å²	83.6	25%	0.251	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	119.5	175	169.4	35.8	0	0	0	111.3	K192 T193 A194 S195 I197	D190-K192 VanDerWaalsContact C-N 3.33Å; D190-K192 PolarHBondContact O-N 3.23Å; D190-K192 WeakPolarHBondContact OD1-CB 3.49Å; D190-K192 PolarHBondContact OD1-N 2.9Å; D190-T193 VanDerWaalsContact OD2-CB 3.22Å; D190-T193 WeakPolarHBondContact OD2-CB 3.32Å; D190-T193 VanDerWaalsContact OD2-CG2 3.27Å; D190-T193 WeakPolarHBondContact OD2-CG2 3.42Å; D190-T193 PolarHBondContact OD2-N 2.95Å; D190-T193 PolarHBondContact OD2-OG1 3.17Å; D190-A194 WeakPolarHBondContact O-CA 3.47Å; D190-A194 PolarHBondContact O-N 2.94Å; D190-S195 PolarHBondContact N-O 3.3Å; D190-I197 HydrophobicContact CB-CD1 4.14Å
191	K	66.2	Low	75.3	Confident	175 Å²	175	82.7 Å²	82.7	76%	0.761	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-22.4	179	-62.4	165.1	-173.2	162.4	0	113.1	H189	H189-K191 PolarHBondContact O-N 3.42Å
192	K	67.1	Low	75.7	Confident	96 Å²	96	87.3 Å²	87.3	42%	0.417	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-43	-179.4	-72	-176.5	-177.7	173.3	0	112.7	E133 N137 D190	E133-K192 IonicContact OE1-NZ 2.71Å; E133-K192 PolarHBondContact OE1-NZ 3.03Å; N137-K192 PolarHBondContact ND2-O 3.48Å; N137-K192 VanDerWaalsContact ND2-O 3.07Å; D190-K192 VanDerWaalsContact C-N 3.33Å; D190-K192 PolarHBondContact O-N 3.23Å; D190-K192 WeakPolarHBondContact OD1-CB 3.49Å; D190-K192 PolarHBondContact OD1-N 2.9Å
193	T	66.9	Low	75.9	Confident	47 Å²	47	87.3 Å²	87.3	29%	0.288	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-16.1	178.6	63.4	0	0	0	0	114	D190 S195	D190-T193 VanDerWaalsContact OD2-CB 3.22Å; D190-T193 WeakPolarHBondContact OD2-CB 3.32Å; D190-T193 VanDerWaalsContact OD2-CG2 3.27Å; D190-T193 WeakPolarHBondContact OD2-CG2 3.42Å; D190-T193 PolarHBondContact OD2-N 2.95Å; D190-T193 PolarHBondContact OD2-OG1 3.17Å; T193-S195 PolarHBondContact OG1-OG 2.85Å
194	A	66.1	Low	76.3	Confident	33 Å²	33	85.7 Å²	85.7	27%	0.273	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.9	42.7	-171.5	0	0	0	0	0	113.3	D190	D190-A194 WeakPolarHBondContact O-CA 3.47Å; D190-A194 PolarHBondContact O-N 2.94Å
195	S	70.8	Confident	76.6	Confident	49 Å²	49	86.6 Å²	86.6	34%	0.343	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	151.1	178.1	69.4	0	0	0	0	112.5	D190 T193	D190-S195 PolarHBondContact N-O 3.3Å; T193-S195 PolarHBondContact OG1-OG 2.85Å
196	D	75.6	Confident	77.1	Confident	97 Å²	97	81.2 Å²	81.2	52%	0.519	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	126.2	-178	-54.5	-58.6	0	0	0	110.4	T187 H189	T187-D196 HydrophobicContact CG2-CB 3.86Å; H189-D196 IonicContact CE1-OD1 2.61Å; H189-D196 IonicContact CG-OD1 2.7Å; H189-D196 IonicContact ND1-OD1 2.66Å; H189-D196 PolarHBondContact ND1-OD1 3.39Å
197	I	77.5	Confident	77.2	Confident	92 Å²	92	82.3 Å²	82.3	47%	0.472	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	129	-175.2	-55.6	177	0	0	0	109.1	T187 V188 D190	T187-I197 CarbonylContact C-O 3.58Å; T187-I197 WeakPolarHBondContact CA-O 3.44Å; V188-I197 PolarHBondContact N-O 3Å; V188-I197 PolarHBondContact O-N 2.82Å; D190-I197 HydrophobicContact CB-CD1 4.14Å
198	V	81.6	Confident	77.3	Confident	83 Å²	83	83.4 Å²	83.4	50%	0.503	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	126.8	177.7	-165.7	0	0	0	0	110	D183 K186 T187	D183-V198 HydrophobicContact CB-CG1 4.47Å; K186-V198 HydrophobicContact CB-CG1 3.87Å; K186-V198 WeakPolarHBondContact O-CA 3.45Å; T187-V198 HydrophobicContact CG2-CG2 4.26Å
199	L	81.9	Confident	77.5	Confident	71 Å²	71	81.6 Å²	81.6	37%	0.372	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-70	142.7	179.6	-66.2	175.9	0	0	0	112.4	K186 V188 I204	K186-L199 PolarHBondContact O-N 2.64Å; V188-L199 HydrophobicContact CG2-CD1 4.19Å; V188-L199 HydrophobicContact CG2-CG 4.33Å; L199-I204 HydrophobicContact CB-CD1 4.26Å; L199-I204 HydrophobicContact CB-CG1 4.24Å
200	S	85.4	Confident	77.9	Confident	53 Å²	53	83 Å²	83	37%	0.371	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-80.8	157.1	176.5	71.4	0	0	0	0	112.5	E202 Q203 I204	S200-E202 VanDerWaalsContact C-N 3.28Å; S200-E202 PolarHBondContact O-N 3.04Å; S200-Q203 PolarHBondContact O-N 3.33Å; S200-Q203 VanDerWaalsContact OG-CD 3.29Å; S200-Q203 WeakPolarHBondContact OG-CG 3.44Å; S200-Q203 PolarHBondContact OG-OE1 2.9Å; S200-I204 WeakPolarHBondContact O-CG1 3.48Å; S200-I204 PolarHBondContact O-N 3.19Å; S200-I204 VanDerWaalsContact O-N 3.09Å
201	E	80.1	Confident	78.5	Confident	143 Å²	143	88 Å²	88	67%	0.668	45%	0.449	S	S	*	.	H	α-helix	trans	-69.2	-26.6	-177.3	-53	-158.8	135.1	0	0	112.7	K186 I204 E205	K186-E201 IonicContact NZ-OE1 2.9Å; K186-E201 PolarHBondContact NZ-OE1 3.03Å; E201-I204 PolarHBondContact O-N 3.32Å; E201-E205 PolarHBondContact O-N 3.42Å
202	E	82	Confident	79.3	Confident	168 Å²	168	85.5 Å²	85.5	79%	0.785	44%	0.438	S	S	*	.	H	α-helix	trans	-68.7	-39.6	174.4	-63.5	-178.3	176.5	0	0	111.8	S200 E205 L206	S200-E202 VanDerWaalsContact C-N 3.28Å; S200-E202 PolarHBondContact O-N 3.04Å; E202-E205 PolarHBondContact O-N 2.87Å; E202-L206 PolarHBondContact O-N 3.13Å
203	Q	82.3	Confident	79.8	Confident	99 Å²	99	84.5 Å²	84.5	46%	0.463	45%	0.454	S	S	.	.	H	α-helix	trans	-65.8	-43.6	173.1	-70.2	164.3	-55.6	0	0	111.1	S200 E205 L206 V207	S200-Q203 PolarHBondContact O-N 3.33Å; S200-Q203 VanDerWaalsContact OG-CD 3.29Å; S200-Q203 WeakPolarHBondContact OG-CG 3.44Å; S200-Q203 PolarHBondContact OG-OE1 2.9Å; Q203-E205 VanDerWaalsContact C-N 3.28Å; Q203-E205 PolarHBondContact O-N 3.49Å; Q203-L206 WeakPolarHBondContact O-CB 3.48Å; Q203-L206 PolarHBondContact O-N 2.76Å; Q203-L206 VanDerWaalsContact O-N 3.16Å; Q203-V207 WeakPolarHBondContact O-CG2 3.15Å; Q203-V207 PolarHBondContact O-N 2.97Å
204	I	83.4	Confident	80.5	Confident	39 Å²	39	87.8 Å²	87.8	20%	0.2	47%	0.467	C	S	.	.	H	α-helix	trans	-63.2	-34.8	176.9	-65.5	166.9	0	0	0	111.2	K186 L199 S200 E201 N208	K186-I204 HydrophobicContact CD-CD1 3.9Å; K186-I204 HydrophobicContact CG-CD1 3.95Å; L199-I204 HydrophobicContact CB-CD1 4.26Å; L199-I204 HydrophobicContact CB-CG1 4.24Å; S200-I204 WeakPolarHBondContact O-CG1 3.48Å; S200-I204 PolarHBondContact O-N 3.19Å; S200-I204 VanDerWaalsContact O-N 3.09Å; E201-I204 PolarHBondContact O-N 3.32Å; I204-N208 VanDerWaalsContact O-CB 3.31Å; I204-N208 WeakPolarHBondContact O-CB 3.34Å; I204-N208 PolarHBondContact O-N 2.99Å; I204-N208 VanDerWaalsContact O-N 3.12Å; I204-N208 PolarHBondContact O-ND2 3.23Å
205	E	83.1	Confident	81	Confident	117 Å²	117	91.7 Å²	91.7	55%	0.547	48%	0.478	S	S	.	.	H	α-helix	trans	-70.8	-38.6	173.1	-152	-161	128.5	0	0	112.3	E201 E202 Q203 N208 R209	E201-E205 PolarHBondContact O-N 3.42Å; E202-E205 PolarHBondContact O-N 2.87Å; Q203-E205 VanDerWaalsContact C-N 3.28Å; Q203-E205 PolarHBondContact O-N 3.49Å; E205-N208 CarbonylContact O-C 3.41Å; E205-N208 WeakPolarHBondContact O-CB 3.31Å; E205-N208 PolarHBondContact O-N 3.42Å; E205-R209 VanDerWaalsContact CD-NH2 3.3Å; E205-R209 WeakPolarHBondContact O-CB 3.28Å; E205-R209 PolarHBondContact O-N 2.84Å; E205-R209 IonicContact OE1-CZ 2.61Å; E205-R209 IonicContact OE1-NE 2.95Å; E205-R209 IonicContact OE1-NH2 2.74Å; E205-R209 PolarHBondContact OE1-NH2 3.09Å; E205-R209 IonicContact OE2-NH2 3.4Å
206	L	82.5	Confident	81.1	Confident	71 Å²	71	90.7 Å²	90.7	37%	0.372	48%	0.475	S	S	.	.	H	α-helix	trans	-61.6	-50.4	176.2	178.5	61.3	0	0	0	111.9	E202 Q203 N208 R209 L210	E202-L206 PolarHBondContact O-N 3.13Å; Q203-L206 WeakPolarHBondContact O-CB 3.48Å; Q203-L206 PolarHBondContact O-N 2.76Å; Q203-L206 VanDerWaalsContact O-N 3.16Å; L206-N208 VanDerWaalsContact C-N 3.26Å; L206-N208 PolarHBondContact O-N 3.43Å; L206-R209 WeakPolarHBondContact O-CA 3.5Å; L206-R209 VanDerWaalsContact O-CB 3.32Å; L206-R209 WeakPolarHBondContact O-CB 3.35Å; L206-R209 PolarHBondContact O-N 3.4Å; L206-L210 HydrophobicContact CD1-CD1 4.29Å; L206-L210 HydrophobicContact CD1-CG 4.33Å; L206-L210 HydrophobicContact CG-CD1 4.14Å; L206-L210 WeakPolarHBondContact O-CG 3.47Å; L206-L210 PolarHBondContact O-N 3.1Å
207	V	82.6	Confident	81.1	Confident	50 Å²	50	90.6 Å²	90.6	30%	0.303	47%	0.474	S	S	.	.	H	α-helix	trans	-57.1	-42.7	174	174.1	0	0	0	0	110.3	Q203 R209 L210 Q211	Q203-V207 WeakPolarHBondContact O-CG2 3.15Å; Q203-V207 PolarHBondContact O-N 2.97Å; V207-R209 PolarHBondContact O-N 3.35Å; V207-L210 PolarHBondContact O-N 3.02Å; V207-Q211 WeakPolarHBondContact O-CB 3.17Å; V207-Q211 PolarHBondContact O-N 2.86Å
208	N	83.4	Confident	81	Confident	69 Å²	69	91.4 Å²	91.4	37%	0.369	48%	0.483	S	S	.	.	H	α-helix	trans	-63.2	-23.2	173.9	-97.9	-88.5	0	0	0	114.5	I204 E205 L206 K212	I204-N208 VanDerWaalsContact O-CB 3.31Å; I204-N208 WeakPolarHBondContact O-CB 3.34Å; I204-N208 PolarHBondContact O-N 2.99Å; I204-N208 VanDerWaalsContact O-N 3.12Å; I204-N208 PolarHBondContact O-ND2 3.23Å; E205-N208 CarbonylContact O-C 3.41Å; E205-N208 WeakPolarHBondContact O-CB 3.31Å; E205-N208 PolarHBondContact O-N 3.42Å; L206-N208 VanDerWaalsContact C-N 3.26Å; L206-N208 PolarHBondContact O-N 3.43Å; N208-K212 VanDerWaalsContact O-CD 3.3Å; N208-K212 WeakPolarHBondContact O-CD 3.4Å; N208-K212 VanDerWaalsContact O-CG 3.31Å; N208-K212 WeakPolarHBondContact O-CG 3.49Å; N208-K212 PolarHBondContact O-NZ 2.84Å; N208-K212 PolarHBondContact OD1-NZ 2.91Å
209	R	83.3	Confident	80.8	Confident	44 Å²	44	93.9 Å²	93.9	17%	0.166	49%	0.494	C	S	.	.	H	α-helix	trans	-83.4	-45.3	177.8	-150.7	176.4	-64.2	138.4	0.5	109.6	E205 L206 V207 K212 Q214 F215 G216	E205-R209 VanDerWaalsContact CD-NH2 3.3Å; E205-R209 WeakPolarHBondContact O-CB 3.28Å; E205-R209 PolarHBondContact O-N 2.84Å; E205-R209 IonicContact OE1-CZ 2.61Å; E205-R209 IonicContact OE1-NE 2.95Å; E205-R209 IonicContact OE1-NH2 2.74Å; E205-R209 PolarHBondContact OE1-NH2 3.09Å; E205-R209 IonicContact OE2-NH2 3.4Å; L206-R209 WeakPolarHBondContact O-CA 3.5Å; L206-R209 VanDerWaalsContact O-CB 3.32Å; L206-R209 WeakPolarHBondContact O-CB 3.35Å; L206-R209 PolarHBondContact O-N 3.4Å; V207-R209 PolarHBondContact O-N 3.35Å; R209-K212 PolarHBondContact O-N 3.02Å; R209-K212 VanDerWaalsContact O-N 3.17Å; R209-Q214 HydrophobicContact CG-CB 3.86Å; R209-Q214 WeakPolarHBondContact O-CB 3.36Å; R209-Q214 PolarHBondContact O-N 3.22Å; R209-Q214 VanDerWaalsContact O-N 3.14Å; R209-F215 WeakPolarHBondContact CD-O 3.47Å; R209-G216 PolarHBondContact NH1-O 2.77Å
210	L	83.1	Confident	80.7	Confident	99 Å²	99	96.5 Å²	96.5	52%	0.518	50%	0.502	S	S	.	.	H	α-helix	trans	-62	-49	176.5	-66.1	171.8	0	0	0	112.3	L206 V207 K212 G213	L206-L210 HydrophobicContact CD1-CD1 4.29Å; L206-L210 HydrophobicContact CD1-CG 4.33Å; L206-L210 HydrophobicContact CG-CD1 4.14Å; L206-L210 WeakPolarHBondContact O-CG 3.47Å; L206-L210 PolarHBondContact O-N 3.1Å; V207-L210 PolarHBondContact O-N 3.02Å; L210-K212 PolarHBondContact O-N 3.41Å; L210-G213 PolarHBondContact O-N 2.82Å
211	Q	83.8	Confident	80.1	Confident	154 Å²	154	98.1 Å²	98.1	72%	0.72	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-22.2	174.8	-84.6	-166.9	-19	0	0	114	V207 G213	V207-Q211 WeakPolarHBondContact O-CB 3.17Å; V207-Q211 PolarHBondContact O-N 2.86Å; Q211-G213 VanDerWaalsContact C-N 3.32Å
212	K	83.7	Confident	79.8	Confident	122 Å²	122	96.7 Å²	96.7	53%	0.53	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	8.2	177.2	-66.2	176.3	-170	62.5	0	112.8	N208 R209 L210 Q214	N208-K212 VanDerWaalsContact O-CD 3.3Å; N208-K212 WeakPolarHBondContact O-CD 3.4Å; N208-K212 VanDerWaalsContact O-CG 3.31Å; N208-K212 WeakPolarHBondContact O-CG 3.49Å; N208-K212 PolarHBondContact O-NZ 2.84Å; N208-K212 PolarHBondContact OD1-NZ 2.91Å; R209-K212 PolarHBondContact O-N 3.02Å; R209-K212 VanDerWaalsContact O-N 3.17Å; L210-K212 PolarHBondContact O-N 3.41Å; K212-Q214 VanDerWaalsContact C-N 3.26Å; K212-Q214 HydrophobicContact CB-CG 4.4Å; K212-Q214 PolarHBondContact O-N 3.4Å
213	G	77.8	Confident	79.6	Confident	74 Å²	74	97 Å²	97	76%	0.763	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.9	25.1	-177.6	0	0	0	0	0	113.5	L210 Q211	L210-G213 PolarHBondContact O-N 2.82Å; Q211-G213 VanDerWaalsContact C-N 3.32Å
214	Q	81	Confident	79.2	Confident	117 Å²	117	99.3 Å²	99.3	55%	0.547	51%	0.506	S	S	.	.			trans	-100.7	146.2	179	-64.6	-176.2	-25.6	0	0	110.7	R209 K212	R209-Q214 HydrophobicContact CG-CB 3.86Å; R209-Q214 WeakPolarHBondContact O-CB 3.36Å; R209-Q214 PolarHBondContact O-N 3.22Å; R209-Q214 VanDerWaalsContact O-N 3.14Å; K212-Q214 VanDerWaalsContact C-N 3.26Å; K212-Q214 HydrophobicContact CB-CG 4.4Å; K212-Q214 PolarHBondContact O-N 3.4Å
215	F	76.6	Confident	78.8	Confident	115 Å²	115	103 Å²	103	50%	0.504	53%	0.533	S	S	.	.			trans	-59.4	142.3	176.1	-59.6	-74.8	0	0	0	111.6	R209 F220 E222	R209-F215 WeakPolarHBondContact CD-O 3.47Å; F215-F220 HydrophobicContact CB-CB 4.43Å; F215-F220 HydrophobicContact CB-CD1 4.35Å; F215-F220 HydrophobicContact CD1-CD1 4.04Å; F215-F220 HydrophobicContact CD1-CE1 4.28Å; F215-F220 AromaticContact CD2-CD1 3.77Å; F215-F220 HydrophobicContact CD2-CD1 3.77Å; F215-F220 HydrophobicContact CD2-CE1 4.35Å; F215-F220 HydrophobicContact CE1-CD1 4.28Å; F215-F220 HydrophobicContact CE1-CE1 4.09Å; F215-F220 HydrophobicContact CE2-CD1 4.02Å; F215-F220 HydrophobicContact CE2-CE1 4.17Å; F215-F220 AromaticContact CG-CD1 3.78Å; F215-F220 HydrophobicContact CG-CD1 3.78Å; F215-F220 HydrophobicContact CG-CE1 4.41Å; F215-F220 HydrophobicContact CZ-CD1 4.27Å; F215-F220 HydrophobicContact CZ-CE1 4.04Å; F215-E222 HydrophobicContact CE2-CB 4.37Å; F215-E222 HydrophobicContact CE2-CG 4.23Å; F215-E222 HydrophobicContact CZ-CG 4.38Å
216	G	73.2	Confident	78.5	Confident	27 Å²	27	104.4 Å²	104.4	28%	0.278	55%	0.55	S	S	.	.	S	Bend	trans	-63.9	-44.9	-176.6	0	0	0	0	0	113.6	R209	R209-G216 PolarHBondContact NH1-O 2.77Å
217	D	75.2	Confident	78.2	Confident	95 Å²	95	106.6 Å²	106.6	51%	0.508	57%	0.566	S	S	.	*	S	Bend	trans	-76.1	124.5	172.9	179.5	13.1	0	0	0	111.1	N219 F220	D217-N219 PolarHBondContact O-N 3.13Å; D217-N219 PolarHBondContact OD1-N 2.69Å; D217-N219 PolarHBondContact OD1-ND2 2.71Å; D217-F220 PolarHBondContact O-N 2.95Å
218	V	75.1	Confident	77.8	Confident	109 Å²	109	110.5 Å²	110.5	66%	0.661	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	-21.2	178.2	-175.8	0	0	0	0	112.5
219	N	78.2	Confident	77.1	Confident	136 Å²	136	116.1 Å²	116.1	73%	0.727	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	-2.3	-173.7	-54.6	-81.4	0	0	0	114.4	D217	D217-N219 PolarHBondContact O-N 3.13Å; D217-N219 PolarHBondContact OD1-N 2.69Å; D217-N219 PolarHBondContact OD1-ND2 2.71Å
220	F	78.5	Confident	76.3	Confident	125 Å²	125	121.5 Å²	121.5	55%	0.548	63%	0.627	S	S	.	*			trans	-70.7	138.6	-175.7	-172.7	-104.3	0	0	0	112.8	F215 D217	F215-F220 HydrophobicContact CB-CB 4.43Å; F215-F220 HydrophobicContact CB-CD1 4.35Å; F215-F220 HydrophobicContact CD1-CD1 4.04Å; F215-F220 HydrophobicContact CD1-CE1 4.28Å; F215-F220 AromaticContact CD2-CD1 3.77Å; F215-F220 HydrophobicContact CD2-CD1 3.77Å; F215-F220 HydrophobicContact CD2-CE1 4.35Å; F215-F220 HydrophobicContact CE1-CD1 4.28Å; F215-F220 HydrophobicContact CE1-CE1 4.09Å; F215-F220 HydrophobicContact CE2-CD1 4.02Å; F215-F220 HydrophobicContact CE2-CE1 4.17Å; F215-F220 AromaticContact CG-CD1 3.78Å; F215-F220 HydrophobicContact CG-CD1 3.78Å; F215-F220 HydrophobicContact CG-CE1 4.41Å; F215-F220 HydrophobicContact CZ-CD1 4.27Å; F215-F220 HydrophobicContact CZ-CE1 4.04Å; D217-F220 PolarHBondContact O-N 2.95Å
221	N	74.1	Confident	75.7	Confident	87 Å²	87	119.9 Å²	119.9	47%	0.465	62%	0.624	S	S	.	*			trans	-119.6	105.3	-176.2	178.8	24.6	0	0	0	110.8	Y223 E224	N221-Y223 PolarHBondContact O-N 3.17Å; N221-Y223 VanDerWaalsContact O-N 3.15Å; N221-E224 HydrophobicContact CB-CG 4.37Å
222	E	72.2	Confident	75.2	Confident	113 Å²	113	118.8 Å²	118.8	53%	0.528	62%	0.623	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61	-25.1	-172.2	-165.1	-173.8	139.6	0	0	114.6	F215	F215-E222 HydrophobicContact CE2-CB 4.37Å; F215-E222 HydrophobicContact CE2-CG 4.23Å; F215-E222 HydrophobicContact CZ-CG 4.38Å
223	Y	78.9	Confident	74.6	Confident	175 Å²	175	120.2 Å²	120.2	69%	0.686	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.2	40.2	-164.9	-55.5	-49.5	0	0	0	114.9	N221	N221-Y223 PolarHBondContact O-N 3.17Å; N221-Y223 VanDerWaalsContact O-N 3.15Å
224	E	74	Confident	74.4	Confident	148 Å²	148	122.9 Å²	122.9	69%	0.692	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-71.1	134.5	173.1	-60.2	-139.7	139.9	0	0	112.6	N221	N221-E224 HydrophobicContact CB-CG 4.37Å
225	P	75.5	Confident	74.2	Confident	116 Å²	116	123.6 Å²	123.6	75%	0.753	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-76.2	132.4	-177.8	30	-34.3	0	0	0	112.4
226	T	75.8	Confident	74.3	Confident	147 Å²	147	125.6 Å²	125.6	90%	0.902	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-65.3	131.3	-177.1	2.5	0	0	0	0	113
227	V	76.5	Confident	74.6	Confident	117 Å²	117	131.5 Å²	131.5	71%	0.709	68%	0.677	S	S	*	*			trans	-103.5	113.5	-179	-178.9	0	0	0	0	111.2	F229	V227-F229 VanDerWaalsContact C-N 3.31Å; V227-F229 WeakPolarHBondContact O-CD1 3.43Å; V227-F229 PolarHBondContact O-N 2.83Å
228	E	74.1	Confident	74.8	Confident	131 Å²	131	132.2 Å²	132.2	61%	0.612	69%	0.686	S	S	*	*			trans	-77.6	67.3	-178.9	-77.3	-162.3	-123.9	0	0	113.7	F230 S231 N232	E228-F230 VanDerWaalsContact C-N 3.3Å; E228-F230 PolarHBondContact O-N 3.33Å; E228-S231 WeakPolarHBondContact CB-OG 3.4Å; E228-S231 VanDerWaalsContact OE2-CB 3.31Å; E228-S231 WeakPolarHBondContact OE2-CB 3.38Å; E228-S231 PolarHBondContact OE2-OG 2.86Å; E228-N232 PolarHBondContact O-ND2 2.7Å
229	F	69.5	Low	75	Confident	187 Å²	187	132.4 Å²	132.4	82%	0.82	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-10.8	-175.6	67.3	-95.6	0	0	0	115.6	V227	V227-F229 VanDerWaalsContact C-N 3.31Å; V227-F229 WeakPolarHBondContact O-CD1 3.43Å; V227-F229 PolarHBondContact O-N 2.83Å
230	F	64.8	Low	75.1	Confident	158 Å²	158	129.9 Å²	129.9	69%	0.693	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.8	-31.4	-173.2	-175.9	-105.7	0	0	0	114.6	E228 N232	E228-F230 VanDerWaalsContact C-N 3.3Å; E228-F230 PolarHBondContact O-N 3.33Å; F230-N232 VanDerWaalsContact C-N 3.29Å; F230-N232 PolarHBondContact O-N 2.86Å
231	S	70.5	Confident	75.2	Confident	65 Å²	65	131.9 Å²	131.9	46%	0.455	69%	0.694	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.9	-13.1	-175.9	30.4	0	0	0	0	114.8	E228 D233	E228-S231 WeakPolarHBondContact CB-OG 3.4Å; E228-S231 VanDerWaalsContact OE2-CB 3.31Å; E228-S231 WeakPolarHBondContact OE2-CB 3.38Å; E228-S231 PolarHBondContact OE2-OG 2.86Å; S231-D233 VanDerWaalsContact C-N 3.35Å; S231-D233 PolarHBondContact O-N 2.68Å
232	N	73.1	Confident	75.5	Confident	131 Å²	131	137.7 Å²	137.7	70%	0.701	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-31.2	-178.5	-88.4	-75.4	0	0	0	113.9	E228 F230	E228-N232 PolarHBondContact O-ND2 2.7Å; F230-N232 VanDerWaalsContact C-N 3.29Å; F230-N232 PolarHBondContact O-N 2.86Å
233	D	71.8	Confident	76.1	Confident	151 Å²	151	138 Å²	138	81%	0.807	72%	0.721	S	S	*	*	S	Bend	trans	-102.8	105.6	-178.5	-84.5	-27.1	0	0	0	112.4	S231 M235	S231-D233 VanDerWaalsContact C-N 3.35Å; S231-D233 PolarHBondContact O-N 2.68Å; D233-M235 PolarHBondContact O-N 3Å
234	V	73.1	Confident	76.2	Confident	130 Å²	130	132.8 Å²	132.8	79%	0.788	71%	0.714	S	S	*	*			trans	-81.9	117.1	-175.1	-176.2	0	0	0	0	112.4
235	M	77.4	Confident	76.6	Confident	133 Å²	133	129.5 Å²	129.5	66%	0.655	70%	0.701	S	S	*	*			trans	-73	128	177.1	-71.2	-170.3	-74.8	0	0	113.5	D233 V239	D233-M235 PolarHBondContact O-N 3Å; M235-V239 HydrophobicContact CE-CG2 4.05Å; M235-V239 HydrophobicContact SD-CG2 4.47Å
236	I	77.8	Confident	76.9	Confident	156 Å²	156	132.2 Å²	132.2	80%	0.8	70%	0.701	S	S	*	*	S	Bend	trans	-82	-15.5	-175.9	-57.8	171.3	0	0	0	113
237	H	79.8	Confident	77	Confident	151 Å²	151	134.6 Å²	134.6	70%	0.699	69%	0.694	S	S	*	*	S	Bend	trans	-131	146.4	-175.4	-69	-20.8	0	0	0	112.1
238	P	80.8	Confident	77.2	Confident	110 Å²	110	132.9 Å²	132.9	71%	0.714	69%	0.687	S	S	*	*			trans	-66.1	141.2	175.4	28.6	-34.8	0	0	0	111.1	T240	P238-T240 PolarHBondContact O-N 3.04Å
239	V	78.8	Confident	77.6	Confident	113 Å²	113	134.3 Å²	134.3	69%	0.685	69%	0.691	S	S	*	*	S	Bend	trans	-61.3	-15.9	-173.4	-178.9	0	0	0	0	113.7	M235	M235-V239 HydrophobicContact CE-CG2 4.05Å; M235-V239 HydrophobicContact SD-CG2 4.47Å
240	T	80.4	Confident	78.4	Confident	83 Å²	83	130.3 Å²	130.3	51%	0.509	68%	0.677	S	S	.	*			trans	-138.6	141.9	171.1	74.5	0	0	0	0	112.2	P238	P238-T240 PolarHBondContact O-N 3.04Å
241	N	81	Confident	79.3	Confident	167 Å²	167	128.1 Å²	128.1	89%	0.893	68%	0.679	S	S	*	*			trans	-100.7	62.6	172.1	-171.1	11.5	0	0	0	110.5
242	R	80.5	Confident	80.1	Confident	209 Å²	209	127.5 Å²	127.5	79%	0.789	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-87.9	133.8	171.9	-76.1	-179.9	170.8	168.1	-2.8	109.3
243	P	83.4	Confident	80.7	Confident	119 Å²	119	127.6 Å²	127.6	77%	0.773	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-64.7	141.6	171	29	-34.1	0	0	0	110
244	A	81.3	Confident	81.4	Confident	66 Å²	66	126.1 Å²	126.1	55%	0.545	67%	0.666	S	S	.	*	P	Polyproline II helix	trans	-73.2	144	-177.5	0	0	0	0	0	112.6	F249	A244-F249 HydrophobicContact CB-CE2 3.64Å; A244-F249 HydrophobicContact CB-CZ 3.75Å
245	D	83.4	Confident	82.1	Confident	80 Å²	80	125.5 Å²	125.5	43%	0.428	65%	0.654	S	S	.	*	P	Polyproline II helix	trans	-67	151.8	179.8	-70.5	-29.6	0	0	0	112.2	R247 S248 F249	D245-R247 HydrophobicContact CB-CG 3.64Å; D245-R247 PolarHBondContact O-N 2.82Å; D245-R247 VanDerWaalsContact O-N 3.16Å; D245-R247 IonicContact OD2-CZ 3.15Å; D245-R247 IonicContact OD2-NE 3.41Å; D245-R247 PolarHBondContact OD2-NE 2.8Å; D245-R247 IonicContact OD2-NH2 2.62Å; D245-R247 PolarHBondContact OD2-NH2 2.9Å; D245-S248 VanDerWaalsContact O-CB 3.29Å; D245-S248 WeakPolarHBondContact O-CB 3.34Å; D245-S248 PolarHBondContact O-N 3.02Å; D245-S248 PolarHBondContact O-OG 2.92Å; D245-F249 WeakPolarHBondContact O-CD2 3.19Å
246	K	80.3	Confident	82.7	Confident	172 Å²	172	126.3 Å²	126.3	75%	0.748	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-58.6	-29.3	173.2	-66.8	-177.1	179.2	178.3	0	113.4	S248 F249 I250	K246-S248 PolarHBondContact O-N 2.81Å; K246-F249 PolarHBondContact O-N 2.98Å; K246-F249 VanDerWaalsContact O-N 3.11Å; K246-I250 HydrophobicContact CB-CD1 4.11Å; K246-I250 WeakPolarHBondContact O-CG1 3.14Å; K246-I250 PolarHBondContact O-N 3.47Å; K246-I250 VanDerWaalsContact O-N 3.1Å
247	R	79.3	Confident	83.2	Confident	198 Å²	198	123.6 Å²	123.6	75%	0.747	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-66.2	-13.7	174.3	62.1	176	167.7	165.7	-1.4	114.1	D245 F249	D245-R247 HydrophobicContact CB-CG 3.64Å; D245-R247 PolarHBondContact O-N 2.82Å; D245-R247 VanDerWaalsContact O-N 3.16Å; D245-R247 IonicContact OD2-CZ 3.15Å; D245-R247 IonicContact OD2-NE 3.41Å; D245-R247 PolarHBondContact OD2-NE 2.8Å; D245-R247 IonicContact OD2-NH2 2.62Å; D245-R247 PolarHBondContact OD2-NH2 2.9Å; R247-F249 VanDerWaalsContact C-N 3.33Å
248	S	79.8	Confident	83.6	Confident	81 Å²	81	123 Å²	123	57%	0.566	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-82.5	-10.3	172.9	-55.5	0	0	0	0	113.2	D245 K246	D245-S248 VanDerWaalsContact O-CB 3.29Å; D245-S248 WeakPolarHBondContact O-CB 3.34Å; D245-S248 PolarHBondContact O-N 3.02Å; D245-S248 PolarHBondContact O-OG 2.92Å; K246-S248 PolarHBondContact O-N 2.81Å
249	F	82.8	Confident	84	Confident	160 Å²	160	121.3 Å²	121.3	70%	0.702	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.2	-10.3	-176.9	-54.1	-74.2	0	0	0	113.9	A244 D245 K246 R247	A244-F249 HydrophobicContact CB-CE2 3.64Å; A244-F249 HydrophobicContact CB-CZ 3.75Å; D245-F249 WeakPolarHBondContact O-CD2 3.19Å; K246-F249 PolarHBondContact O-N 2.98Å; K246-F249 VanDerWaalsContact O-N 3.11Å; R247-F249 VanDerWaalsContact C-N 3.33Å
250	I	86	Confident	84.5	Confident	103 Å²	103	119.2 Å²	119.2	53%	0.528	61%	0.611	S	S	.	*	S	Bend	trans	-112.7	137.6	179.8	-61.2	174.2	0	0	0	107.9	K246	K246-I250 HydrophobicContact CB-CD1 4.11Å; K246-I250 WeakPolarHBondContact O-CG1 3.14Å; K246-I250 PolarHBondContact O-N 3.47Å; K246-I250 VanDerWaalsContact O-N 3.1Å
251	P	84.3	Confident	84.8	Confident	113 Å²	113	121.5 Å²	121.5	73%	0.734	61%	0.614	S	S	*	*			trans	-49.9	139.5	176.8	-29.3	36	0	0	0	113.1
252	S	87.5	Confident	85.1	Confident	51 Å²	51	117.6 Å²	117.6	36%	0.357	59%	0.593	S	S	.	*			trans	-76.1	133.4	-162.7	85.1	0	0	0	0	112.7	I254 E255 K256	S252-I254 VanDerWaalsContact C-N 3.34Å; S252-I254 PolarHBondContact O-N 2.83Å; S252-E255 PolarHBondContact O-N 3.49Å; S252-E255 WeakPolarHBondContact OG-CB 3.48Å; S252-E255 PolarHBondContact OG-N 2.77Å; S252-E255 PolarHBondContact OG-OE2 2.85Å; S252-K256 PolarHBondContact O-N 3.3Å; S252-K256 VanDerWaalsContact O-N 3.09Å
253	L	85.6	Confident	85.4	Confident	133 Å²	133	111.7 Å²	111.7	70%	0.696	58%	0.579	S	S	*	*	H	α-helix	trans	-71.3	-30.5	-175.9	-64.8	176.6	0	0	0	112.6	K256 E257	L253-K256 WeakPolarHBondContact O-CB 3.39Å; L253-K256 PolarHBondContact O-N 2.9Å; L253-E257 PolarHBondContact O-N 3.08Å
254	I	86.1	Confident	85.6	Confident	121 Å²	121	111 Å²	111	62%	0.621	57%	0.565	S	S	*	*	H	α-helix	trans	-68.3	-41.9	177.7	-59.7	170.6	0	0	0	110.3	S252 E257 K258	S252-I254 VanDerWaalsContact C-N 3.34Å; S252-I254 PolarHBondContact O-N 2.83Å; I254-E257 PolarHBondContact O-N 2.83Å; I254-K258 WeakPolarHBondContact O-CG 3.42Å; I254-K258 PolarHBondContact O-N 2.96Å
255	E	87.8	Confident	85.9	Confident	116 Å²	116	108.4 Å²	108.4	54%	0.542	55%	0.545	S	S	.	.	H	α-helix	trans	-64.3	-42.5	172.8	179.6	-174.8	-173.6	0	0	111.5	S252 E257 K258 V259	S252-E255 PolarHBondContact O-N 3.49Å; S252-E255 WeakPolarHBondContact OG-CB 3.48Å; S252-E255 PolarHBondContact OG-N 2.77Å; S252-E255 PolarHBondContact OG-OE2 2.85Å; E255-E257 PolarHBondContact O-N 2.96Å; E255-K258 PolarHBondContact O-N 3.43Å; E255-V259 HydrophobicContact CG-CG2 4.48Å; E255-V259 WeakPolarHBondContact O-CB 3.45Å; E255-V259 VanDerWaalsContact O-CG2 3.26Å; E255-V259 WeakPolarHBondContact O-CG2 3.3Å; E255-V259 PolarHBondContact O-N 3.46Å
256	K	89.9	Confident	86	Confident	150 Å²	150	107.9 Å²	107.9	65%	0.652	54%	0.541	S	S	*	.	H	α-helix	trans	-56.9	-38.8	173.4	-175.6	-173.5	174.7	-171.8	0	112.1	S252 L253 S260	S252-K256 PolarHBondContact O-N 3.3Å; S252-K256 VanDerWaalsContact O-N 3.09Å; L253-K256 WeakPolarHBondContact O-CB 3.39Å; L253-K256 PolarHBondContact O-N 2.9Å; K256-S260 PolarHBondContact O-N 2.93Å
257	E	89.1	Confident	86.2	Confident	100 Å²	100	108.4 Å²	108.4	47%	0.467	54%	0.543	S	S	.	.	H	α-helix	trans	-71.1	-45.1	175.2	-163.2	-159.7	126.8	0	0	112.4	L253 I254 E255 V259 S260 K261	L253-E257 PolarHBondContact O-N 3.08Å; I254-E257 PolarHBondContact O-N 2.83Å; E255-E257 PolarHBondContact O-N 2.96Å; E257-V259 VanDerWaalsContact C-N 3.29Å; E257-V259 PolarHBondContact O-N 2.88Å; E257-S260 PolarHBondContact O-N 2.85Å; E257-S260 VanDerWaalsContact O-N 3.1Å; E257-S260 PolarHBondContact O-OG 3.24Å; E257-K261 PolarHBondContact O-N 3.39Å; E257-K261 WeakPolarHBondContact OE1-CE 3.36Å; E257-K261 IonicContact OE1-NZ 2.8Å; E257-K261 PolarHBondContact OE1-NZ 2.86Å
258	K	87.5	Confident	86.4	Confident	138 Å²	138	104.1 Å²	104.1	60%	0.6	53%	0.533	S	S	*	.	H	α-helix	trans	-58.9	-41.9	174	-72.6	-174.5	177.2	-169.1	0	111.5	I254 E255 K261 L262	I254-K258 WeakPolarHBondContact O-CG 3.42Å; I254-K258 PolarHBondContact O-N 2.96Å; E255-K258 PolarHBondContact O-N 3.43Å; K258-K261 PolarHBondContact O-N 3.25Å; K258-L262 WeakPolarHBondContact O-CB 3.48Å; K258-L262 VanDerWaalsContact O-CG 3.29Å; K258-L262 WeakPolarHBondContact O-CG 3.43Å; K258-L262 PolarHBondContact O-N 3.36Å
259	V	89.5	Confident	86.4	Confident	75 Å²	75	102 Å²	102	46%	0.455	53%	0.525	S	S	.	.	H	α-helix	trans	-64.1	-38.3	174.2	170	0	0	0	0	111.4	E255 E257 L262 V263	E255-V259 HydrophobicContact CG-CG2 4.48Å; E255-V259 WeakPolarHBondContact O-CB 3.45Å; E255-V259 VanDerWaalsContact O-CG2 3.26Å; E255-V259 WeakPolarHBondContact O-CG2 3.3Å; E255-V259 PolarHBondContact O-N 3.46Å; E257-V259 VanDerWaalsContact C-N 3.29Å; E257-V259 PolarHBondContact O-N 2.88Å; V259-L262 PolarHBondContact O-N 2.99Å; V259-V263 HydrophobicContact CG1-CG2 4.24Å; V259-V263 WeakPolarHBondContact O-CB 3.4Å; V259-V263 VanDerWaalsContact O-CG2 3.23Å; V259-V263 WeakPolarHBondContact O-CG2 3.46Å; V259-V263 PolarHBondContact O-N 3.16Å
260	S	88.3	Confident	86.5	Confident	68 Å²	68	103.2 Å²	103.2	48%	0.476	52%	0.524	S	S	.	.	H	α-helix	trans	-67.6	-39.1	176.6	76.2	0	0	0	0	112.3	K256 E257 V263 H264	K256-S260 PolarHBondContact O-N 2.93Å; E257-S260 PolarHBondContact O-N 2.85Å; E257-S260 VanDerWaalsContact O-N 3.1Å; E257-S260 PolarHBondContact O-OG 3.24Å; S260-V263 PolarHBondContact O-N 2.85Å; S260-H264 PolarHBondContact O-N 2.88Å
261	K	87.8	Confident	86.2	Confident	131 Å²	131	101.7 Å²	101.7	57%	0.57	52%	0.517	S	S	*	.	H	α-helix	trans	-61.9	-46.7	172	-74.2	171.4	168.2	168.9	0	111.7	E257 K258 V263 H264 A265	E257-K261 PolarHBondContact O-N 3.39Å; E257-K261 WeakPolarHBondContact OE1-CE 3.36Å; E257-K261 IonicContact OE1-NZ 2.8Å; E257-K261 PolarHBondContact OE1-NZ 2.86Å; K258-K261 PolarHBondContact O-N 3.25Å; K261-V263 PolarHBondContact O-N 2.96Å; K261-H264 WeakPolarHBondContact O-CB 3.27Å; K261-H264 PolarHBondContact O-N 2.85Å; K261-A265 PolarHBondContact O-N 2.68Å
262	L	86.8	Confident	85.8	Confident	86 Å²	86	104.9 Å²	104.9	45%	0.45	52%	0.519	S	S	.	.	H	α-helix	trans	-62.7	-41.4	175	-70.5	170.6	0	0	0	112.5	K258 V259 H264 A265 I266 I271	K258-L262 WeakPolarHBondContact O-CB 3.48Å; K258-L262 VanDerWaalsContact O-CG 3.29Å; K258-L262 WeakPolarHBondContact O-CG 3.43Å; K258-L262 PolarHBondContact O-N 3.36Å; V259-L262 PolarHBondContact O-N 2.99Å; L262-H264 VanDerWaalsContact C-N 3.32Å; L262-H264 PolarHBondContact O-N 3.42Å; L262-A265 PolarHBondContact O-N 2.91Å; L262-I266 WeakPolarHBondContact O-CB 3.33Å; L262-I266 WeakPolarHBondContact O-CD1 3.38Å; L262-I266 VanDerWaalsContact O-CG1 3.22Å; L262-I266 WeakPolarHBondContact O-CG1 3.48Å; L262-I266 PolarHBondContact O-N 2.71Å; L262-I271 HydrophobicContact CD2-CD1 3.54Å
263	V	88	Confident	85.4	Confident	84 Å²	84	106.4 Å²	106.4	51%	0.509	53%	0.527	S	S	.	.	H	α-helix	trans	-65	-35.3	175.7	166.1	0	0	0	0	111.5	V259 S260 K261 K267	V259-V263 HydrophobicContact CG1-CG2 4.24Å; V259-V263 WeakPolarHBondContact O-CB 3.4Å; V259-V263 VanDerWaalsContact O-CG2 3.23Å; V259-V263 WeakPolarHBondContact O-CG2 3.46Å; V259-V263 PolarHBondContact O-N 3.16Å; S260-V263 PolarHBondContact O-N 2.85Å; K261-V263 PolarHBondContact O-N 2.96Å; V263-K267 WeakPolarHBondContact O-CB 3.32Å; V263-K267 PolarHBondContact O-N 3.05Å
264	H	85.8	Confident	84.7	Confident	104 Å²	104	111.7 Å²	111.7	48%	0.481	54%	0.538	S	S	.	.	H	α-helix	trans	-64	-51.2	171.8	-172.8	89.3	0	0	0	111.1	S260 K261 L262 I266 K267 M268	S260-H264 PolarHBondContact O-N 2.88Å; K261-H264 WeakPolarHBondContact O-CB 3.27Å; K261-H264 PolarHBondContact O-N 2.85Å; L262-H264 VanDerWaalsContact C-N 3.32Å; L262-H264 PolarHBondContact O-N 3.42Å; H264-I266 VanDerWaalsContact C-N 3.27Å; H264-I266 PolarHBondContact O-N 2.88Å; H264-K267 WeakPolarHBondContact O-CA 3.19Å; H264-K267 WeakPolarHBondContact O-CB 3.48Å; H264-K267 PolarHBondContact O-N 3.09Å; H264-M268 WeakPolarHBondContact O-CG 3.49Å; H264-M268 PolarHBondContact O-N 2.88Å
265	A	87.4	Confident	83.8	Confident	13 Å²	13	115.9 Å²	115.9	11%	0.107	55%	0.546	C	S	.	.	H	α-helix	trans	-61.2	-32.3	177.3	0	0	0	0	0	113.4	K261 L262 G269 W270 I271	K261-A265 PolarHBondContact O-N 2.68Å; L262-A265 PolarHBondContact O-N 2.91Å; A265-G269 PolarHBondContact O-N 2.88Å; A265-W270 HydrophobicContact CB-CE3 4.13Å; A265-W270 PolarHBondContact O-N 2.89Å; A265-I271 HydrophobicContact CB-CB 4.28Å; A265-I271 HydrophobicContact CB-CD1 3.77Å; A265-I271 HydrophobicContact CB-CG1 3.9Å; A265-I271 PolarHBondContact O-N 2.92Å; A265-I271 VanDerWaalsContact O-N 3.15Å
266	I	86.2	Confident	82.6	Confident	69 Å²	69	116.5 Å²	116.5	35%	0.354	56%	0.558	S	S	.	*	H	α-helix	trans	-68.2	-41.7	171	-70.8	161.9	0	0	0	111.3	L262 H264 G269 I271	L262-I266 WeakPolarHBondContact O-CB 3.33Å; L262-I266 WeakPolarHBondContact O-CD1 3.38Å; L262-I266 VanDerWaalsContact O-CG1 3.22Å; L262-I266 WeakPolarHBondContact O-CG1 3.48Å; L262-I266 PolarHBondContact O-N 2.71Å; H264-I266 VanDerWaalsContact C-N 3.27Å; H264-I266 PolarHBondContact O-N 2.88Å; I266-G269 PolarHBondContact O-N 3.17Å; I266-G269 VanDerWaalsContact O-N 3.13Å; I266-I271 WeakPolarHBondContact CA-O 3.5Å; I266-I271 HydrophobicContact CG1-CB 4.01Å; I266-I271 HydrophobicContact CG1-CG2 3.9Å; I266-I271 VanDerWaalsContact CG1-O 3.31Å; I266-I271 WeakPolarHBondContact CG1-O 3.31Å
267	K	85.1	Confident	81.4	Confident	183 Å²	183	117.3 Å²	117.3	80%	0.796	56%	0.564	S	S	*	*	H	α-helix	trans	-69.1	-33.2	179.3	-170.4	-179.2	177.7	-171.3	0	112.7	V263 H264 G269	V263-K267 WeakPolarHBondContact O-CB 3.32Å; V263-K267 PolarHBondContact O-N 3.05Å; H264-K267 WeakPolarHBondContact O-CA 3.19Å; H264-K267 WeakPolarHBondContact O-CB 3.48Å; H264-K267 PolarHBondContact O-N 3.09Å; K267-G269 VanDerWaalsContact C-N 3.26Å
268	M	83.4	Confident	80.1	Confident	107 Å²	107	118.2 Å²	118.2	53%	0.527	57%	0.572	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.1	-8.6	172.1	-58.6	-59.7	-83.8	0	0	112.7	H264 W270	H264-M268 WeakPolarHBondContact O-CG 3.49Å; H264-M268 PolarHBondContact O-N 2.88Å; M268-W270 VanDerWaalsContact C-N 3.33Å; M268-W270 HydrophobicContact CB-CD2 3.95Å; M268-W270 HydrophobicContact CB-CE3 4.43Å; M268-W270 HydrophobicContact CB-CG 4.27Å; M268-W270 HydrophobicContact CB-CZ2 4.23Å; M268-W270 HydrophobicContact CE-CZ2 4.48Å; M268-W270 HydrophobicContact CG-CZ2 4.49Å; M268-W270 PolarHBondContact O-N 2.91Å
269	G	78.7	Confident	78.8	Confident	38 Å²	38	119 Å²	119	39%	0.392	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	84.2	-1.3	175.7	0	0	0	0	0	115.7	A265 I266 K267	A265-G269 PolarHBondContact O-N 2.88Å; I266-G269 PolarHBondContact O-N 3.17Å; I266-G269 VanDerWaalsContact O-N 3.13Å; K267-G269 VanDerWaalsContact C-N 3.26Å
270	W	85.6	Confident	77.3	Confident	185 Å²	185	118.7 Å²	118.7	70%	0.701	58%	0.584	S	S	*	*	S	Bend	trans	-62.8	-48.9	177.5	-54.1	-25.2	0	0	0	111.2	A265 M268	A265-W270 HydrophobicContact CB-CE3 4.13Å; A265-W270 PolarHBondContact O-N 2.89Å; M268-W270 VanDerWaalsContact C-N 3.33Å; M268-W270 HydrophobicContact CB-CD2 3.95Å; M268-W270 HydrophobicContact CB-CE3 4.43Å; M268-W270 HydrophobicContact CB-CG 4.27Å; M268-W270 HydrophobicContact CB-CZ2 4.23Å; M268-W270 HydrophobicContact CE-CZ2 4.48Å; M268-W270 HydrophobicContact CG-CZ2 4.49Å; M268-W270 PolarHBondContact O-N 2.91Å
271	I	80.6	Confident	76	Confident	71 Å²	71	127.5 Å²	127.5	36%	0.364	61%	0.606	S	S	.	*	S	Bend	trans	-98.1	109.3	173.5	-63.4	179.3	0	0	0	108.8	L262 A265 I266	L262-I271 HydrophobicContact CD2-CD1 3.54Å; A265-I271 HydrophobicContact CB-CB 4.28Å; A265-I271 HydrophobicContact CB-CD1 3.77Å; A265-I271 HydrophobicContact CB-CG1 3.9Å; A265-I271 PolarHBondContact O-N 2.92Å; A265-I271 VanDerWaalsContact O-N 3.15Å; I266-I271 WeakPolarHBondContact CA-O 3.5Å; I266-I271 HydrophobicContact CG1-CB 4.01Å; I266-I271 HydrophobicContact CG1-CG2 3.9Å; I266-I271 VanDerWaalsContact CG1-O 3.31Å; I266-I271 WeakPolarHBondContact CG1-O 3.31Å
272	K	75.9	Confident	74.7	Confident	179 Å²	179	123.6 Å²	123.6	78%	0.778	60%	0.604	S	S	*	*			trans	-79.2	122.6	170	-70.7	162.3	-171.8	160.7	0	108	R274	K272-R274 PolarHBondContact O-N 3Å
273	P	78.8	Confident	73.6	Confident	83 Å²	83	129.2 Å²	129.2	54%	0.539	62%	0.619	S	S	.	*			trans	-60.3	142.3	179.2	25.6	-33.9	0	0	0	109.6	R275	P273-R275 PolarHBondContact O-N 3.21Å
274	R	70.9	Confident	72.9	Confident	244 Å²	244	135.3 Å²	135.3	92%	0.921	64%	0.639	S	S	*	*			trans	-59.7	93.3	-176	-173	177.9	-174.4	168.4	2.4	110.4	K272	K272-R274 PolarHBondContact O-N 3Å
275	R	66.2	Low	72.3	Confident	209 Å²	209	138.9 Å²	138.9	79%	0.789	65%	0.65	S	S	*	*			trans	-57.8	144.5	165.8	-67.9	-174.2	177.9	-176.3	-0.4	107.8	P273 Q277	P273-R275 PolarHBondContact O-N 3.21Å; R275-Q277 PolarHBondContact O-N 3.42Å
276	V	64.4	Low	72	Confident	130 Å²	130	143 Å²	143	79%	0.788	67%	0.67	S	S	*	*			trans	-52.8	138.1	160.3	-177.2	0	0	0	0	106.7	D278	V276-D278 PolarHBondContact O-N 3.36Å
277	Q	63.2	Low	71.5	Confident	167 Å²	167	145.1 Å²	145.1	78%	0.78	68%	0.681	S	S	*	*			trans	-64.7	111.1	175.6	-70.7	-175.2	-1.7	0	0	107.7	R275 D279	R275-Q277 PolarHBondContact O-N 3.42Å; Q277-D279 PolarHBondContact O-N 2.94Å
278	D	62.2	Low	71.1	Confident	119 Å²	119	144.3 Å²	144.3	64%	0.636	67%	0.673	S	S	*	*			trans	-63.6	119.6	167.8	-76.7	-58.3	0	0	0	107.7	V276 S280	V276-D278 PolarHBondContact O-N 3.36Å; D278-S280 PolarHBondContact O-N 2.96Å; D278-S280 PolarHBondContact O-OG 3.33Å
279	D	60.3	Low	70.8	Confident	154 Å²	154	142.2 Å²	142.2	82%	0.824	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	25.6	172.5	-71.7	-40.2	0	0	0	113.8	Q277 R281	Q277-D279 PolarHBondContact O-N 2.94Å; D279-R281 VanDerWaalsContact C-N 3.29Å
280	S	59	Low	70.6	Confident	68 Å²	68	148 Å²	148	48%	0.476	70%	0.695	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.4	-21.9	170.7	62.5	0	0	0	0	113.8	D278 G282 R283	D278-S280 PolarHBondContact O-N 2.96Å; D278-S280 PolarHBondContact O-OG 3.33Å; S280-G282 PolarHBondContact O-N 3.44Å; S280-R283 PolarHBondContact O-N 2.88Å
281	R	59.3	Low	69.8	Low	253 Å²	253	144.3 Å²	144.3	96%	0.955	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	66.8	171.3	-75.3	-173.5	170.8	-172.8	-3.4	110.8	D279	D279-R281 VanDerWaalsContact C-N 3.29Å
282	G	61.3	Low	69.3	Low	50 Å²	50	146.3 Å²	146.3	52%	0.515	70%	0.697	S	S	.	*	T	Hydrogen-bonded Turn	trans	158	-9.1	-170.6	0	0	0	0	0	113.8	S280 F284	S280-G282 PolarHBondContact O-N 3.44Å; G282-F284 WeakPolarHBondContact O-CD2 3.45Å; G282-F284 PolarHBondContact O-N 3.07Å
283	R	64.1	Low	68.7	Low	204 Å²	204	142.7 Å²	142.7	77%	0.77	69%	0.694	S	S	*	*			trans	-74.7	90.3	170.6	-77.3	-171.9	175.6	-177.4	0.2	110.8	S280 Y285	S280-R283 PolarHBondContact O-N 2.88Å; R283-Y285 PolarHBondContact O-N 3.05Å; R283-Y285 VanDerWaalsContact O-N 3.17Å
284	F	72.7	Confident	68.1	Low	211 Å²	211	141.6 Å²	141.6	93%	0.925	69%	0.689	S	S	*	*			trans	-55.3	116.6	160.6	-55.1	-80.9	0	0	0	108.8	G282	G282-F284 WeakPolarHBondContact O-CD2 3.45Å; G282-F284 PolarHBondContact O-N 3.07Å
285	Y	73.9	Confident	67.7	Low	180 Å²	180	133.9 Å²	133.9	71%	0.706	67%	0.665	S	S	*	*			trans	-105.8	139.8	170.1	60.1	-85	0	0	0	108.6	R283 L287	R283-Y285 PolarHBondContact O-N 3.05Å; R283-Y285 VanDerWaalsContact O-N 3.17Å; Y285-L287 HydrophobicContact CD2-CD2 4.38Å; Y285-L287 HydrophobicContact CD2-CG 4.5Å; Y285-L287 HydrophobicContact CE2-CD2 3.6Å; Y285-L287 HydrophobicContact CE2-CG 4.1Å; Y285-L287 PolarHBondContact O-N 2.96Å
286	D	80.3	Confident	67.4	Low	99 Å²	99	130.5 Å²	130.5	53%	0.529	66%	0.661	S	S	.	*			trans	-75.1	108.9	177.6	178	8.4	0	0	0	109.5	W288 A289	D286-W288 PolarHBondContact O-N 3.32Å; D286-W288 WeakPolarHBondContact OD1-CA 3.32Å; D286-W288 PolarHBondContact OD1-N 3Å; D286-A289 HydrophobicContact CB-CB 3.96Å; D286-A289 PolarHBondContact O-N 3.5Å; D286-A289 PolarHBondContact OD1-N 2.8Å; D286-A289 PolarHBondContact OD2-N 3.33Å
287	L	75.2	Confident	67.1	Low	114 Å²	114	128 Å²	128	60%	0.597	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	-23.6	176.7	-75.1	159.6	0	0	0	112.6	Y285	Y285-L287 HydrophobicContact CD2-CD2 4.38Å; Y285-L287 HydrophobicContact CD2-CG 4.5Å; Y285-L287 HydrophobicContact CE2-CD2 3.6Å; Y285-L287 HydrophobicContact CE2-CG 4.1Å; Y285-L287 PolarHBondContact O-N 2.96Å
288	W	77.6	Confident	67	Low	165 Å²	165	127.2 Å²	127.2	63%	0.625	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.6	-3.1	-172.7	-55.7	-79.8	0	0	0	113.6	D286 N290 E291	D286-W288 PolarHBondContact O-N 3.32Å; D286-W288 WeakPolarHBondContact OD1-CA 3.32Å; D286-W288 PolarHBondContact OD1-N 3Å; W288-N290 PolarHBondContact O-N 3.22Å; W288-E291 HydrophobicContact CB-CB 4.49Å; W288-E291 PolarHBondContact O-N 2.91Å
289	A	77.6	Confident	66.8	Low	63 Å²	63	128.6 Å²	128.6	52%	0.521	65%	0.651	S	S	.	*	T	Hydrogen-bonded Turn	trans	-54.7	-26.7	-176.8	0	0	0	0	0	114.6	D286	D286-A289 HydrophobicContact CB-CB 3.96Å; D286-A289 PolarHBondContact O-N 3.5Å; D286-A289 PolarHBondContact OD1-N 2.8Å; D286-A289 PolarHBondContact OD2-N 3.33Å
290	N	73.5	Confident	66.8	Low	159 Å²	159	130.8 Å²	130.8	85%	0.85	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122	21.3	179.2	-61.4	-42.7	0	0	0	112.5	W288 D292	W288-N290 PolarHBondContact O-N 3.22Å; N290-D292 PolarHBondContact O-N 3.37Å
291	E	69.9	Low	66.8	Low	108 Å²	108	136 Å²	136	51%	0.505	67%	0.672	S	S	.	*			trans	-75.7	99.7	-175	-167.4	176.8	-127.1	0	0	112.3	W288 S293 I295	W288-E291 HydrophobicContact CB-CB 4.49Å; W288-E291 PolarHBondContact O-N 2.91Å; E291-S293 PolarHBondContact O-N 3.38Å; E291-S293 VanDerWaalsContact O-N 3.14Å; E291-I295 HydrophobicContact CG-CD1 4.21Å
292	D	68.2	Low	67.3	Low	114 Å²	114	129.9 Å²	129.9	61%	0.61	65%	0.654	S	S	*	*			trans	-61.7	113.9	171.5	-103.4	-26.2	0	0	0	111.1	N290 S294 I295	N290-D292 PolarHBondContact O-N 3.37Å; D292-S294 PolarHBondContact O-N 2.89Å; D292-I295 WeakPolarHBondContact O-CG1 3.27Å; D292-I295 PolarHBondContact O-N 3.17Å
293	S	64.9	Low	68.1	Low	103 Å²	103	130.8 Å²	130.8	72%	0.72	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.2	-11.9	175.4	61.9	0	0	0	0	115.4	E291 I295	E291-S293 PolarHBondContact O-N 3.38Å; E291-S293 VanDerWaalsContact O-N 3.14Å; S293-I295 VanDerWaalsContact C-N 3.25Å; S293-I295 PolarHBondContact O-N 3.03Å
294	S	64.8	Low	68.8	Low	60 Å²	60	125.6 Å²	125.6	42%	0.42	64%	0.64	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65	-21.7	170.2	77.6	0	0	0	0	114.3	D292 A297	D292-S294 PolarHBondContact O-N 2.89Å; S294-A297 WeakPolarHBondContact O-CB 3.43Å; S294-A297 PolarHBondContact O-N 3.07Å
295	I	63	Low	69.3	Low	81 Å²	81	117 Å²	117	42%	0.415	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.6	-45.2	-178.7	-64.3	165	0	0	0	110.5	E291 D292 S293 A297 K298	E291-I295 HydrophobicContact CG-CD1 4.21Å; D292-I295 WeakPolarHBondContact O-CG1 3.27Å; D292-I295 PolarHBondContact O-N 3.17Å; S293-I295 VanDerWaalsContact C-N 3.25Å; S293-I295 PolarHBondContact O-N 3.03Å; I295-A297 PolarHBondContact O-N 2.78Å; I295-K298 WeakPolarHBondContact O-CB 3.47Å; I295-K298 PolarHBondContact O-N 3.19Å
296	L	60.3	Low	69.7	Low	138 Å²	138	112.6 Å²	112.6	72%	0.723	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	-29.1	176.4	-73	165.9	0	0	0	113	K298	L296-K298 VanDerWaalsContact C-N 3.26Å; L296-K298 PolarHBondContact O-N 3.44Å
297	A	58.8	Low	70	Confident	78 Å²	78	117.4 Å²	117.4	65%	0.645	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-12.8	178.5	0	0	0	0	0	113.9	S294 I295	S294-A297 WeakPolarHBondContact O-CB 3.43Å; S294-A297 PolarHBondContact O-N 3.07Å; I295-A297 PolarHBondContact O-N 2.78Å
298	K	59.2	Low	70.5	Confident	150 Å²	150	116.3 Å²	116.3	65%	0.652	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-31.7	179.9	-63.9	173.9	-176.8	171.1	0	112.6	I295 L296 K300	I295-K298 WeakPolarHBondContact O-CB 3.47Å; I295-K298 PolarHBondContact O-N 3.19Å; L296-K298 VanDerWaalsContact C-N 3.26Å; L296-K298 PolarHBondContact O-N 3.44Å; K298-K300 VanDerWaalsContact C-N 3.32Å; K298-K300 PolarHBondContact O-N 2.96Å
299	H	59.3	Low	70.9	Confident	149 Å²	149	113.4 Å²	113.4	69%	0.69	61%	0.613	S	S	*	*			trans	-79.2	73.4	177.1	-87.2	-92.6	0	0	0	112.5	M301 H302	H299-M301 PolarHBondContact O-N 2.99Å; H299-H302 PolarHBondContact O-N 3.24Å
300	K	59.1	Low	71.5	Confident	200 Å²	200	118 Å²	118	87%	0.87	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.7	-11.8	-173.3	-71.9	-178.3	177.8	175.8	0	117.2	K298	K298-K300 VanDerWaalsContact C-N 3.32Å; K298-K300 PolarHBondContact O-N 2.96Å
301	M	59.3	Low	72.3	Confident	177 Å²	177	115.3 Å²	115.3	87%	0.872	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.3	7	-176.7	-57.9	-146.7	-57.8	0	0	115.8	H299 L303	H299-M301 PolarHBondContact O-N 2.99Å; M301-L303 PolarHBondContact O-N 3.19Å; M301-L303 VanDerWaalsContact O-N 3.11Å
302	H	71.3	Confident	73.2	Confident	125 Å²	125	111.6 Å²	111.6	58%	0.579	61%	0.61	S	S	*	*			trans	-72.7	108.3	173.4	178	-115.3	0	0	0	110.7	H299 P304	H299-H302 PolarHBondContact O-N 3.24Å; H302-P304 VanDerWaalsContact O-CD 3.3Å; H302-P304 WeakPolarHBondContact O-CD 3.48Å
303	L	76.3	Confident	74.3	Confident	69 Å²	69	112.7 Å²	112.7	36%	0.361	61%	0.611	S	S	.	*			trans	-80.6	110	169.2	-70.1	176.4	0	0	0	109.3	M301 R378 R380	M301-L303 PolarHBondContact O-N 3.19Å; M301-L303 VanDerWaalsContact O-N 3.11Å; L303-R378 HydrophobicContact CB-CB 4.28Å; L303-R378 VanDerWaalsContact CD1-O 3.23Å; L303-R378 WeakPolarHBondContact CD1-O 3.27Å; L303-R378 PolarHBondContact O-NH1 3.2Å; L303-R380 HydrophobicContact CD2-CB 4.02Å
304	P	79.9	Confident	75.6	Confident	95 Å²	95	110.4 Å²	110.4	62%	0.617	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-62.8	144.6	179.9	28.1	-35.1	0	0	0	109.9	H302	H302-P304 VanDerWaalsContact O-CD 3.3Å; H302-P304 WeakPolarHBondContact O-CD 3.48Å
305	A	82.4	Confident	76.7	Confident	31 Å²	31	112.4 Å²	112.4	26%	0.256	59%	0.592	S	S	.	*	P	Polyproline II helix	trans	-56.5	141.1	173.8	0	0	0	0	0	110.8	K307 L373	A305-K307 PolarHBondContact O-N 3.44Å; A305-L373 HydrophobicContact CB-CD2 3.35Å
306	P	83.6	Confident	78.1	Confident	86 Å²	86	110.6 Å²	110.6	56%	0.558	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-59.4	134.5	173.1	26.3	-33.7	0	0	0	109.1	R369	P306-R369 PolarHBondContact O-NH2 3.34Å
307	K	86.6	Confident	79.6	Confident	200 Å²	200	108.6 Å²	108.6	87%	0.87	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-74.1	145	174.3	-63.3	-172.3	178.4	-174.3	0	109.5	A305	A305-K307 PolarHBondContact O-N 3.44Å
308	I	85.3	Confident	81.2	Confident	91 Å²	91	108.5 Å²	108.5	47%	0.467	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-59.9	140.2	168.3	-54.7	174.5	0	0	0	107.5	R369	I308-R369 HydrophobicContact CD1-CG 4.15Å
309	P	86.4	Confident	82.9	Confident	104 Å²	104	101.4 Å²	101.4	68%	0.675	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-57.7	159.4	170.8	24.9	-34.4	0	0	0	111.6
310	L	90	Very high	84.6	Confident	161 Å²	161	96.8 Å²	96.8	84%	0.843	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-76.6	141	170.5	-62.3	176	0	0	0	109.3	G312	L310-G312 PolarHBondContact O-N 2.81Å
311	P	89.2	Confident	86.1	Confident	101 Å²	101	91.6 Å²	91.6	66%	0.656	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-49.4	127.1	178.6	-34	38.8	0	0	0	114	E315	P311-E315 VanDerWaalsContact CA-OE2 3.27Å; P311-E315 WeakPolarHBondContact CA-OE2 3.41Å; P311-E315 WeakPolarHBondContact CB-OE2 3.42Å
312	G	89.8	Confident	87.6	Confident	30 Å²	30	91.7 Å²	91.7	31%	0.309	50%	0.496	S	S	.	.			trans	-88.8	175.2	-178.9	0	0	0	0	0	113.9	L310 E314 E315	L310-G312 PolarHBondContact O-N 2.81Å; G312-E314 PolarHBondContact O-N 2.83Å; G312-E315 PolarHBondContact O-N 3.02Å; G312-E315 VanDerWaalsContact O-N 3.16Å
313	H	91.9	Very high	88.5	Confident	138 Å²	138	89.1 Å²	89.1	64%	0.639	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-64.5	-21.3	172.5	-64.7	-51.2	0	0	0	113.3	S316 P319 F323	H313-S316 WeakPolarHBondContact O-CB 3.21Å; H313-S316 PolarHBondContact O-N 2.91Å; H313-P319 WeakPolarHBondContact O-CB 3.3Å; H313-F323 HydrophobicContact CB-CE2 4.17Å; H313-F323 HydrophobicContact CB-CZ 4.23Å
314	E	90.8	Very high	89.2	Confident	54 Å²	54	89.2 Å²	89.2	25%	0.252	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-72.3	-27	174.1	61.9	-156.2	162	0	0	113.6	G312 S316 F323 L343 F345 P347	G312-E314 PolarHBondContact O-N 2.83Å; E314-S316 VanDerWaalsContact C-N 3.32Å; E314-F323 HydrophobicContact CB-CD1 3.75Å; E314-F323 HydrophobicContact CB-CE1 4.34Å; E314-F323 HydrophobicContact CB-CG 4.4Å; E314-L343 HydrophobicContact CG-CD2 4.44Å; E314-F345 HydrophobicContact CG-CZ 4.36Å; E314-F345 WeakPolarHBondContact O-CE2 3.35Å; E314-P347 HydrophobicContact CB-CG 4.4Å
315	E	89.3	Confident	89.8	Confident	102 Å²	102	87.4 Å²	87.4	48%	0.477	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-83.9	-5.6	173	-70.3	177.9	-161.5	0	0	112.9	P311 G312 F345	P311-E315 VanDerWaalsContact CA-OE2 3.27Å; P311-E315 WeakPolarHBondContact CA-OE2 3.41Å; P311-E315 WeakPolarHBondContact CB-OE2 3.42Å; G312-E315 PolarHBondContact O-N 3.02Å; G312-E315 VanDerWaalsContact O-N 3.16Å; E315-F345 HydrophobicContact CB-CZ 4.33Å; E315-F345 HydrophobicContact CG-CE1 3.69Å; E315-F345 HydrophobicContact CG-CE2 4.48Å; E315-F345 HydrophobicContact CG-CZ 3.46Å; E315-F345 VanDerWaalsContact CG-CZ 3.46Å
316	S	91.7	Very high	90.3	Very high	43 Å²	43	89.5 Å²	89.5	30%	0.301	48%	0.475	S	S	.	.	S	Bend	trans	-61.7	138.9	176.3	-178.3	0	0	0	0	111.1	H313 E314 N318 P319	H313-S316 WeakPolarHBondContact O-CB 3.21Å; H313-S316 PolarHBondContact O-N 2.91Å; E314-S316 VanDerWaalsContact C-N 3.32Å; S316-N318 PolarHBondContact O-N 3.09Å; S316-N318 VanDerWaalsContact O-N 3.16Å; S316-N318 VanDerWaalsContact OG-C 3.22Å; S316-N318 PolarHBondContact OG-N 3Å; S316-N318 VanDerWaalsContact OG-N 3.07Å; S316-N318 PolarHBondContact OG-O 3.14Å; S316-P319 WeakPolarHBondContact O-CD 3.19Å
317	Y	91.8	Very high	90.7	Very high	97 Å²	97	92.1 Å²	92.1	38%	0.38	48%	0.484	S	S	.	.	S	Bend	trans	-62.8	-18.5	168.5	80.9	-89.9	0	0	0	113	Y350 L353 V356	Y317-Y350 WeakPolarHBondContact O-CD2 3.18Å; Y317-Y350 PolarHBondContact O-N 2.85Å; Y317-L353 HydrophobicContact CD1-CD1 4.21Å; Y317-L353 HydrophobicContact CE1-CD1 4.36Å; Y317-L353 HydrophobicContact CG-CD1 4.49Å; Y317-V356 HydrophobicContact CD2-CG2 3.97Å; Y317-V356 HydrophobicContact CG-CG2 3.92Å
318	N	92.8	Very high	91	Very high	75 Å²	75	90.1 Å²	90.1	40%	0.401	48%	0.478	S	S	.	.	S	Bend	trans	-133	76.6	177.5	-177.3	23.1	0	0	0	107.9	S316 K349	S316-N318 PolarHBondContact O-N 3.09Å; S316-N318 VanDerWaalsContact O-N 3.16Å; S316-N318 VanDerWaalsContact OG-C 3.22Å; S316-N318 PolarHBondContact OG-N 3Å; S316-N318 VanDerWaalsContact OG-N 3.07Å; S316-N318 PolarHBondContact OG-O 3.14Å; N318-K349 WeakPolarHBondContact OD1-CE 3.3Å
319	P	94.1	Very high	91.3	Very high	1 Å²	1	90.4 Å²	90.4	1%	0.006	48%	0.478	C	S	.	.			trans	-77.7	155.4	-179.5	33.4	-32.7	0	0	0	110.6	H313 S316 F323 M324 K349	H313-P319 WeakPolarHBondContact O-CB 3.3Å; S316-P319 WeakPolarHBondContact O-CD 3.19Å; P319-F323 HydrophobicContact CB-CB 4.3Å; P319-M324 HydrophobicContact CG-SD 3.88Å; P319-K349 HydrophobicContact CG-CB 4.26Å
320	P	94.3	Very high	91.6	Very high	52 Å²	52	88.9 Å²	88.9	34%	0.338	46%	0.46	S	S	.	.			trans	-57.2	149.9	165.9	-19.6	31.1	0	0	0	110.9	E322 F323	P320-E322 PolarHBondContact O-N 3.34Å; P320-E322 VanDerWaalsContact O-N 3.12Å; P320-F323 HydrophobicContact CB-CD2 3.98Å; P320-F323 HydrophobicContact CB-CE2 4.35Å; P320-F323 HydrophobicContact CG-CD2 3.91Å; P320-F323 HydrophobicContact CG-CE2 4.02Å; P320-F323 PolarHBondContact O-N 2.96Å
321	P	90.6	Very high	91.7	Very high	92 Å²	92	83 Å²	83	60%	0.597	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-61.4	-24	-177.1	26.6	-34.8	0	0	0	113.2	F323 M324	P321-F323 PolarHBondContact O-N 3.42Å; P321-M324 WeakPolarHBondContact O-CB 3.45Å; P321-M324 PolarHBondContact O-N 3.08Å; P321-M324 VanDerWaalsContact O-N 3.11Å
322	E	90.9	Very high	91.9	Very high	178 Å²	178	83 Å²	83	83%	0.832	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-62.7	-18.4	175.3	-63.8	168.6	-165	0	0	114.2	P320	P320-E322 PolarHBondContact O-N 3.34Å; P320-E322 VanDerWaalsContact O-N 3.12Å
323	F	90.4	Very high	92.1	Very high	71 Å²	71	83.2 Å²	83.2	31%	0.311	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-99.4	-4.1	176.2	-66	-90.1	0	0	0	113.1	H313 E314 P319 P320 P321 P347	H313-F323 HydrophobicContact CB-CE2 4.17Å; H313-F323 HydrophobicContact CB-CZ 4.23Å; E314-F323 HydrophobicContact CB-CD1 3.75Å; E314-F323 HydrophobicContact CB-CE1 4.34Å; E314-F323 HydrophobicContact CB-CG 4.4Å; P319-F323 HydrophobicContact CB-CB 4.3Å; P320-F323 HydrophobicContact CB-CD2 3.98Å; P320-F323 HydrophobicContact CB-CE2 4.35Å; P320-F323 HydrophobicContact CG-CD2 3.91Å; P320-F323 HydrophobicContact CG-CE2 4.02Å; P320-F323 PolarHBondContact O-N 2.96Å; P321-F323 PolarHBondContact O-N 3.42Å; F323-P347 VanDerWaalsContact O-CB 3.31Å; F323-P347 WeakPolarHBondContact O-CB 3.32Å; F323-P347 WeakPolarHBondContact O-CG 3.49Å
324	M	90.8	Very high	92	Very high	71 Å²	71	81.4 Å²	81.4	35%	0.35	41%	0.412	S	S	.	.	S	Bend	trans	-80.2	122.6	174.8	-66.5	-63.8	-49.9	0	0	109.1	P319 P321 P347 K349	P319-M324 HydrophobicContact CG-SD 3.88Å; P321-M324 WeakPolarHBondContact O-CB 3.45Å; P321-M324 PolarHBondContact O-N 3.08Å; P321-M324 VanDerWaalsContact O-N 3.11Å; M324-P347 WeakPolarHBondContact CE-O 3.39Å; M324-K349 HydrophobicContact SD-CB 3.84Å
325	F	92.3	Very high	92.1	Very high	57 Å²	57	86 Å²	86	25%	0.25	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-62.3	141.2	177.3	-66.6	1	0	0	0	111	E329 K330 W333 L343 I346 P347	F325-E329 HydrophobicContact CB-CB 4.18Å; F325-E329 HydrophobicContact CG-CB 4.46Å; F325-K330 HydrophobicContact CB-CB 4.49Å; F325-W333 HydrophobicContact CE2-CB 4.1Å; F325-W333 AromaticContact CE2-CD1 3.77Å; F325-W333 AromaticContact CE2-CG 3.89Å; F325-W333 HydrophobicContact CE2-CG 3.89Å; F325-L343 HydrophobicContact CE1-CD1 4.29Å; F325-L343 HydrophobicContact CZ-CD1 4.2Å; F325-I346 HydrophobicContact CD2-CG1 4.43Å; F325-I346 HydrophobicContact CD2-CG2 3.93Å; F325-I346 HydrophobicContact CE2-CG1 4.26Å; F325-I346 HydrophobicContact CE2-CG2 4.3Å; F325-I346 HydrophobicContact CG-CG2 4.4Å; F325-P347 HydrophobicContact CD1-CG 4.48Å; F325-P347 HydrophobicContact CE1-CG 4.03Å; F325-P347 HydrophobicContact CZ-CG 4.5Å
326	T	93.7	Very high	92.3	Very high	75 Å²	75	85.5 Å²	85.5	46%	0.46	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-67.9	161.6	161.8	59.6	0	0	0	0	111	E328 E329 K330	T326-E328 PolarHBondContact O-N 3.14Å; T326-E329 WeakPolarHBondContact CB-OE2 3.48Å; T326-E329 WeakPolarHBondContact CG2-OE2 3.48Å; T326-E329 PolarHBondContact N-OE2 3.38Å; T326-E329 PolarHBondContact O-N 3.14Å; T326-E329 WeakPolarHBondContact OG1-CB 3.41Å; T326-E329 VanDerWaalsContact OG1-CD 3.32Å; T326-E329 VanDerWaalsContact OG1-CG 3.27Å; T326-E329 WeakPolarHBondContact OG1-CG 3.48Å; T326-E329 PolarHBondContact OG1-N 3.22Å; T326-E329 PolarHBondContact OG1-OE2 3.34Å; T326-K330 WeakPolarHBondContact O-CB 3.32Å; T326-K330 PolarHBondContact O-N 3.07Å
327	D	92	Very high	92.3	Very high	141 Å²	141	89 Å²	89	75%	0.754	45%	0.447	S	S	*	.	H	α-helix	trans	-62.4	-29.9	177.9	-66.4	-56.4	0	0	0	112.5	A331	D327-A331 WeakPolarHBondContact O-CB 3.43Å; D327-A331 PolarHBondContact O-N 3.13Å
328	E	93.7	Very high	92.1	Very high	158 Å²	158	88.3 Å²	88.3	74%	0.738	45%	0.454	S	S	*	.	H	α-helix	trans	-68.3	-48.7	173.6	-63.8	-176.1	-176.1	0	0	111.7	T326 K330 A331 L332	T326-E328 PolarHBondContact O-N 3.14Å; E328-K330 VanDerWaalsContact C-N 3.3Å; E328-K330 PolarHBondContact O-N 3.13Å; E328-A331 PolarHBondContact O-N 2.98Å; E328-L332 WeakPolarHBondContact O-CG 3.38Å; E328-L332 PolarHBondContact O-N 2.66Å
329	E	91.9	Very high	91.6	Very high	98 Å²	98	90.3 Å²	90.3	46%	0.458	47%	0.474	S	S	.	.	H	α-helix	trans	-63.4	-36.8	175.6	-71.2	165.9	126.2	0	0	112	F325 T326 L332 W333	F325-E329 HydrophobicContact CB-CB 4.18Å; F325-E329 HydrophobicContact CG-CB 4.46Å; T326-E329 WeakPolarHBondContact CB-OE2 3.48Å; T326-E329 WeakPolarHBondContact CG2-OE2 3.48Å; T326-E329 PolarHBondContact N-OE2 3.38Å; T326-E329 PolarHBondContact O-N 3.14Å; T326-E329 WeakPolarHBondContact OG1-CB 3.41Å; T326-E329 VanDerWaalsContact OG1-CD 3.32Å; T326-E329 VanDerWaalsContact OG1-CG 3.27Å; T326-E329 WeakPolarHBondContact OG1-CG 3.48Å; T326-E329 PolarHBondContact OG1-N 3.22Å; T326-E329 PolarHBondContact OG1-OE2 3.34Å; E329-L332 PolarHBondContact O-N 2.79Å; E329-W333 WeakPolarHBondContact O-CB 3.32Å; E329-W333 PolarHBondContact O-N 2.86Å
330	K	92.2	Very high	91.4	Very high	72 Å²	72	96.5 Å²	96.5	31%	0.313	51%	0.507	S	S	.	.	H	α-helix	trans	-63.2	-45.5	174.3	-178.8	-177.8	170.4	-70	0	111.2	F325 T326 E328 L332 W333 E334 I346	F325-K330 HydrophobicContact CB-CB 4.49Å; T326-K330 WeakPolarHBondContact O-CB 3.32Å; T326-K330 PolarHBondContact O-N 3.07Å; E328-K330 VanDerWaalsContact C-N 3.3Å; E328-K330 PolarHBondContact O-N 3.13Å; K330-L332 VanDerWaalsContact C-N 3.33Å; K330-L332 PolarHBondContact O-N 3.23Å; K330-W333 PolarHBondContact O-N 3.09Å; K330-E334 WeakPolarHBondContact CE-OE1 3.22Å; K330-E334 IonicContact NZ-OE1 3.68Å; K330-E334 PolarHBondContact NZ-OE1 2.86Å; K330-E334 IonicContact NZ-OE2 3.58Å; K330-E334 PolarHBondContact NZ-OE2 2.66Å; K330-E334 WeakPolarHBondContact O-CB 3.45Å; K330-E334 WeakPolarHBondContact O-CG 3.13Å; K330-E334 PolarHBondContact O-N 2.91Å; K330-I346 HydrophobicContact CG-CD1 4.27Å
331	A	92.1	Very high	91.1	Very high	38 Å²	38	96.6 Å²	96.6	31%	0.314	50%	0.501	S	S	.	.	H	α-helix	trans	-62.9	-39.3	176.1	0	0	0	0	0	111.9	D327 E328 E334 Q335	D327-A331 WeakPolarHBondContact O-CB 3.43Å; D327-A331 PolarHBondContact O-N 3.13Å; E328-A331 PolarHBondContact O-N 2.98Å; A331-E334 PolarHBondContact O-N 3.47Å; A331-Q335 WeakPolarHBondContact O-CB 3.28Å; A331-Q335 VanDerWaalsContact O-CG 3.25Å; A331-Q335 WeakPolarHBondContact O-CG 3.4Å; A331-Q335 PolarHBondContact O-N 2.84Å
332	L	92.5	Very high	90.9	Very high	100 Å²	100	101.1 Å²	101.1	52%	0.524	51%	0.511	S	S	.	.	H	α-helix	trans	-65.3	-40.6	173.9	-71.7	167.2	0	0	0	112.5	E328 E329 K330 Q335 Q336	E328-L332 WeakPolarHBondContact O-CG 3.38Å; E328-L332 PolarHBondContact O-N 2.66Å; E329-L332 PolarHBondContact O-N 2.79Å; K330-L332 VanDerWaalsContact C-N 3.33Å; K330-L332 PolarHBondContact O-N 3.23Å; L332-Q335 PolarHBondContact O-N 2.71Å; L332-Q336 WeakPolarHBondContact O-CG 3.34Å; L332-Q336 PolarHBondContact O-N 2.92Å
333	W	93.6	Very high	90.8	Very high	34 Å²	34	93.6 Å²	93.6	13%	0.129	48%	0.476	C	S	.	.	H	α-helix	trans	-67.5	-36	175.6	-175.9	96	0	0	0	112.3	F325 E329 K330 Q335 Q336 R341 L343 I346	F325-W333 HydrophobicContact CE2-CB 4.1Å; F325-W333 AromaticContact CE2-CD1 3.77Å; F325-W333 AromaticContact CE2-CG 3.89Å; F325-W333 HydrophobicContact CE2-CG 3.89Å; E329-W333 WeakPolarHBondContact O-CB 3.32Å; E329-W333 PolarHBondContact O-N 2.86Å; K330-W333 PolarHBondContact O-N 3.09Å; W333-Q335 VanDerWaalsContact C-N 3.31Å; W333-Q336 PolarHBondContact O-N 3.17Å; W333-R341 PolarHBondContact O-NE 3.01Å; W333-R341 PolarHBondContact O-NH2 2.67Å; W333-L343 PolarHBondContact NE1-O 2.93Å; W333-I346 HydrophobicContact CD2-CD1 4.38Å; W333-I346 HydrophobicContact CD2-CG1 3.89Å; W333-I346 HydrophobicContact CE3-CD1 3.68Å; W333-I346 HydrophobicContact CE3-CG1 3.66Å; W333-I346 HydrophobicContact CH2-CD1 4.27Å; W333-I346 HydrophobicContact CH2-CG1 3.92Å; W333-I346 HydrophobicContact CZ2-CG1 4.13Å; W333-I346 HydrophobicContact CZ3-CD1 3.62Å; W333-I346 HydrophobicContact CZ3-CG1 3.68Å
334	E	90.8	Very high	90.7	Very high	100 Å²	100	92.8 Å²	92.8	47%	0.467	48%	0.478	S	S	.	.	H	α-helix	trans	-69.4	-28.9	174.3	-73.1	174.6	169.1	0	0	112.1	K330 A331	K330-E334 WeakPolarHBondContact CE-OE1 3.22Å; K330-E334 IonicContact NZ-OE1 3.68Å; K330-E334 PolarHBondContact NZ-OE1 2.86Å; K330-E334 IonicContact NZ-OE2 3.58Å; K330-E334 PolarHBondContact NZ-OE2 2.66Å; K330-E334 WeakPolarHBondContact O-CB 3.45Å; K330-E334 WeakPolarHBondContact O-CG 3.13Å; K330-E334 PolarHBondContact O-N 2.91Å; A331-E334 PolarHBondContact O-N 3.47Å
335	Q	93.3	Very high	90.5	Very high	150 Å²	150	91 Å²	91	70%	0.701	47%	0.468	S	S	*	.	H	α-helix	trans	-80.5	-22.6	173.4	-72.6	169.7	29.4	0	0	114.8	A331 L332 W333	A331-Q335 WeakPolarHBondContact O-CB 3.28Å; A331-Q335 VanDerWaalsContact O-CG 3.25Å; A331-Q335 WeakPolarHBondContact O-CG 3.4Å; A331-Q335 PolarHBondContact O-N 2.84Å; L332-Q335 PolarHBondContact O-N 2.71Å; W333-Q335 VanDerWaalsContact C-N 3.31Å
336	Q	93	Very high	90.4	Very high	92 Å²	92	89.8 Å²	89.8	43%	0.43	46%	0.464	S	S	.	.	S	Bend	trans	-74.2	141.4	178.5	-80.9	173.3	-2.3	0	0	112	L332 W333 R341	L332-Q336 WeakPolarHBondContact O-CG 3.34Å; L332-Q336 PolarHBondContact O-N 2.92Å; W333-Q336 PolarHBondContact O-N 3.17Å; Q336-R341 HydrophobicContact CB-CG 3.91Å; Q336-R341 PolarHBondContact O-NE 2.93Å; Q336-R341 PolarHBondContact O-NH2 3.05Å
337	D	91.6	Very high	90.4	Very high	118 Å²	118	86.3 Å²	86.3	63%	0.631	44%	0.443	S	S	*	.			trans	-63.7	143.8	171.9	-77.1	-52.9	0	0	0	111.6	S339 D340 R341	D337-S339 PolarHBondContact O-N 3.16Å; D337-D340 PolarHBondContact O-N 2.98Å; D337-D340 VanDerWaalsContact O-N 3.08Å; D337-R341 WeakPolarHBondContact O-CG 3.4Å
338	P	86.9	Confident	90.3	Very high	82 Å²	82	85.2 Å²	85.2	53%	0.532	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-32.8	-173	-30.4	36.6	0	0	0	115.8
339	S	84	Confident	90.2	Very high	117 Å²	117	83 Å²	83	82%	0.818	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-28.7	-178	-50.7	0	0	0	0	114.4	D337	D337-S339 PolarHBondContact O-N 3.16Å
340	D	88.6	Confident	90.3	Very high	131 Å²	131	81 Å²	81	70%	0.701	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-8.5	-177.5	-76.2	-21.4	0	0	0	112.6	D337 K342	D337-D340 PolarHBondContact O-N 2.98Å; D337-D340 VanDerWaalsContact O-N 3.08Å; D340-K342 PolarHBondContact O-N 3.25Å
341	R	88.9	Confident	90.4	Very high	53 Å²	53	82.8 Å²	82.8	20%	0.2	43%	0.427	C	S	.	.			trans	-67.8	118.7	-179.2	-68.3	173.9	-168.6	-164.8	-0.1	110.8	W333 Q336 D337 L343	W333-R341 PolarHBondContact O-NE 3.01Å; W333-R341 PolarHBondContact O-NH2 2.67Å; Q336-R341 HydrophobicContact CB-CG 3.91Å; Q336-R341 PolarHBondContact O-NE 2.93Å; Q336-R341 PolarHBondContact O-NH2 3.05Å; D337-R341 WeakPolarHBondContact O-CG 3.4Å; R341-L343 PolarHBondContact O-N 2.95Å; R341-L343 VanDerWaalsContact O-N 3.13Å
342	K	86.7	Confident	90.5	Very high	187 Å²	187	83 Å²	83	81%	0.813	43%	0.427	S	S	*	.	S	Bend	trans	-53.8	-33.1	175.9	-175.2	-167.8	168.5	-152.4	0	113.5	D340	D340-K342 PolarHBondContact O-N 3.25Å
343	L	87.7	Confident	90.5	Very high	20 Å²	20	84 Å²	84	11%	0.105	43%	0.432	C	S	.	.	S	Bend	trans	-126.7	132.9	174.4	-64.5	177.6	0	0	0	109.4	E314 F325 W333 R341 F345 P347	E314-L343 HydrophobicContact CG-CD2 4.44Å; F325-L343 HydrophobicContact CE1-CD1 4.29Å; F325-L343 HydrophobicContact CZ-CD1 4.2Å; W333-L343 PolarHBondContact NE1-O 2.93Å; R341-L343 PolarHBondContact O-N 2.95Å; R341-L343 VanDerWaalsContact O-N 3.13Å; L343-F345 PolarHBondContact O-N 2.88Å; L343-P347 HydrophobicContact CD1-CG 4.14Å
344	P	87.6	Confident	90.5	Very high	54 Å²	54	94.2 Å²	94.2	35%	0.351	47%	0.47	S	S	.	.	S	Bend	trans	-76.7	-5.4	-179.6	30.1	-33.2	0	0	0	113.7	R361	P344-R361 PolarHBondContact O-NH1 2.97Å
345	F	88.4	Confident	90.6	Very high	33 Å²	33	95 Å²	95	15%	0.145	47%	0.474	C	S	.	.	S	Bend	trans	-133.6	163.1	177.1	66.9	-88	0	0	0	110.8	E314 E315 L343 P347 F359	E314-F345 HydrophobicContact CG-CZ 4.36Å; E314-F345 WeakPolarHBondContact O-CE2 3.35Å; E315-F345 HydrophobicContact CB-CZ 4.33Å; E315-F345 HydrophobicContact CG-CE1 3.69Å; E315-F345 HydrophobicContact CG-CE2 4.48Å; E315-F345 HydrophobicContact CG-CZ 3.46Å; E315-F345 VanDerWaalsContact CG-CZ 3.46Å; L343-F345 PolarHBondContact O-N 2.88Å; F345-P347 HydrophobicContact CE2-CB 4.46Å; F345-P347 HydrophobicContact CE2-CG 4.03Å; F345-F359 HydrophobicContact CB-CE2 4.11Å; F345-F359 HydrophobicContact CB-CZ 4.2Å
346	I	90.1	Very high	90.6	Very high	33 Å²	33	90.6 Å²	90.6	17%	0.169	46%	0.457	C	S	.	.			trans	-94.4	123.6	169.3	-60.2	166.2	0	0	0	107.9	F325 K330 W333	F325-I346 HydrophobicContact CD2-CG1 4.43Å; F325-I346 HydrophobicContact CD2-CG2 3.93Å; F325-I346 HydrophobicContact CE2-CG1 4.26Å; F325-I346 HydrophobicContact CE2-CG2 4.3Å; F325-I346 HydrophobicContact CG-CG2 4.4Å; K330-I346 HydrophobicContact CG-CD1 4.27Å; W333-I346 HydrophobicContact CD2-CD1 4.38Å; W333-I346 HydrophobicContact CD2-CG1 3.89Å; W333-I346 HydrophobicContact CE3-CD1 3.68Å; W333-I346 HydrophobicContact CE3-CG1 3.66Å; W333-I346 HydrophobicContact CH2-CD1 4.27Å; W333-I346 HydrophobicContact CH2-CG1 3.92Å; W333-I346 HydrophobicContact CZ2-CG1 4.13Å; W333-I346 HydrophobicContact CZ3-CD1 3.62Å; W333-I346 HydrophobicContact CZ3-CG1 3.68Å
347	P	92.4	Very high	90.6	Very high	2 Å²	2	89.7 Å²	89.7	1%	0.013	46%	0.459	C	S	.	.			trans	-56.2	136.1	175.2	-26.6	35.7	0	0	0	112.3	E314 F323 M324 F325 L343 F345	E314-P347 HydrophobicContact CB-CG 4.4Å; F323-P347 VanDerWaalsContact O-CB 3.31Å; F323-P347 WeakPolarHBondContact O-CB 3.32Å; F323-P347 WeakPolarHBondContact O-CG 3.49Å; M324-P347 WeakPolarHBondContact CE-O 3.39Å; F325-P347 HydrophobicContact CD1-CG 4.48Å; F325-P347 HydrophobicContact CE1-CG 4.03Å; F325-P347 HydrophobicContact CZ-CG 4.5Å; L343-P347 HydrophobicContact CD1-CG 4.14Å; F345-P347 HydrophobicContact CE2-CB 4.46Å; F345-P347 HydrophobicContact CE2-CG 4.03Å
348	K	89.8	Confident	90.5	Very high	118 Å²	118	88.9 Å²	88.9	51%	0.513	47%	0.469	S	S	.	.			trans	-138.4	132.8	-176.2	-75.2	178.1	-177	178.9	0	111.6	Y350	K348-Y350 HydrophobicContact CB-CE2 3.77Å
349	K	93.3	Very high	90.6	Very high	111 Å²	111	89.5 Å²	89.5	48%	0.483	46%	0.463	S	S	.	.			trans	-96.9	116.5	179.3	-172.2	172.9	-171.4	174.2	0	111.8	N318 P319 M324	N318-K349 WeakPolarHBondContact OD1-CE 3.3Å; P319-K349 HydrophobicContact CG-CB 4.26Å; M324-K349 HydrophobicContact SD-CB 3.84Å
350	Y	93.8	Very high	90.9	Very high	55 Å²	55	89.5 Å²	89.5	22%	0.216	46%	0.464	C	S	.	.			trans	-106.9	128.8	172.5	-53.4	-85.3	0	0	0	109.1	Y317 K348 S352 Q355 V356 P357	Y317-Y350 WeakPolarHBondContact O-CD2 3.18Å; Y317-Y350 PolarHBondContact O-N 2.85Å; K348-Y350 HydrophobicContact CB-CE2 3.77Å; Y350-S352 PolarHBondContact O-N 3.09Å; Y350-Q355 WeakPolarHBondContact CD1-O 3.44Å; Y350-V356 HydrophobicContact CD2-CG2 4.13Å; Y350-V356 HydrophobicContact CG-CG2 4.19Å; Y350-P357 VanDerWaalsContact CE1-CD 3.47Å; Y350-P357 HydrophobicContact CE1-CG 4.16Å; Y350-P357 VanDerWaalsContact CZ-CD 3.45Å
351	P	92.9	Very high	90.8	Very high	110 Å²	110	86.2 Å²	86.2	71%	0.714	44%	0.441	S	S	*	.	S	Bend	trans	-73.5	-8.7	-175.3	30.4	-36.7	0	0	0	113.9	Q355	P351-Q355 VanDerWaalsContact CD-OE1 3.25Å
352	S	93.9	Very high	90.9	Very high	44 Å²	44	89.4 Å²	89.4	31%	0.308	46%	0.457	S	S	.	.	S	Bend	trans	-153.8	151.8	170.6	69.1	0	0	0	0	112	Y350 R354 Q355	Y350-S352 PolarHBondContact O-N 3.09Å; S352-R354 PolarHBondContact O-N 2.62Å; S352-R354 VanDerWaalsContact O-N 3.12Å; S352-Q355 PolarHBondContact O-N 3.41Å
353	L	92.5	Very high	91.2	Very high	121 Å²	121	87.1 Å²	87.1	63%	0.634	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-57.3	-27.9	179.3	-173.7	62.1	0	0	0	113.2	Y317 Q355 V356	Y317-L353 HydrophobicContact CD1-CD1 4.21Å; Y317-L353 HydrophobicContact CE1-CD1 4.36Å; Y317-L353 HydrophobicContact CG-CD1 4.49Å; L353-Q355 PolarHBondContact O-N 2.84Å; L353-V356 HydrophobicContact CD1-CG2 4.15Å; L353-V356 WeakPolarHBondContact O-CG2 3.26Å; L353-V356 PolarHBondContact O-N 3.23Å
354	R	93.5	Very high	91.3	Very high	248 Å²	248	90.5 Å²	90.5	94%	0.936	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-68.9	-14.6	177.7	-64.5	-179.6	-177.9	-114.8	2	114.1	S352	S352-R354 PolarHBondContact O-N 2.62Å; S352-R354 VanDerWaalsContact O-N 3.12Å
355	Q	93	Very high	91.4	Very high	116 Å²	116	89.5 Å²	89.5	54%	0.542	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-102.7	3	179.4	-67	-180	-4.9	0	0	112.8	Y350 P351 S352 L353 P357	Y350-Q355 WeakPolarHBondContact CD1-O 3.44Å; P351-Q355 VanDerWaalsContact CD-OE1 3.25Å; S352-Q355 PolarHBondContact O-N 3.41Å; L353-Q355 PolarHBondContact O-N 2.84Å; Q355-P357 WeakPolarHBondContact O-CD 3.33Å
356	V	93.8	Very high	91.5	Very high	57 Å²	57	92.8 Å²	92.8	35%	0.345	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-75.9	117.9	177.9	-177.5	0	0	0	0	108.7	Y317 Y350 L353	Y317-V356 HydrophobicContact CD2-CG2 3.97Å; Y317-V356 HydrophobicContact CG-CG2 3.92Å; Y350-V356 HydrophobicContact CD2-CG2 4.13Å; Y350-V356 HydrophobicContact CG-CG2 4.19Å; L353-V356 HydrophobicContact CD1-CG2 4.15Å; L353-V356 WeakPolarHBondContact O-CG2 3.26Å; L353-V356 PolarHBondContact O-N 3.23Å
357	P	92.4	Very high	91.7	Very high	74 Å²	74	97.2 Å²	97.2	48%	0.481	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-75.4	162.3	-179.9	32.7	-35.9	0	0	0	111.3	Y350 Q355 F359	Y350-P357 VanDerWaalsContact CE1-CD 3.47Å; Y350-P357 HydrophobicContact CE1-CG 4.16Å; Y350-P357 VanDerWaalsContact CZ-CD 3.45Å; Q355-P357 WeakPolarHBondContact O-CD 3.33Å; P357-F359 PolarHBondContact O-N 3.48Å
358	A	90.9	Very high	91.6	Very high	100 Å²	100	100.5 Å²	100.5	83%	0.826	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-59.7	132	165.4	0	0	0	0	0	110.1	S360	A358-S360 PolarHBondContact O-N 2.82Å
359	F	88.9	Confident	91.6	Very high	95 Å²	95	97 Å²	97	42%	0.417	49%	0.486	S	S	.	.			trans	-79.2	106.9	-175.4	-179.2	-119.5	0	0	0	111.2	F345 P357 R361 F362 E365	F345-F359 HydrophobicContact CB-CE2 4.11Å; F345-F359 HydrophobicContact CB-CZ 4.2Å; P357-F359 PolarHBondContact O-N 3.48Å; F359-R361 VanDerWaalsContact C-N 3.34Å; F359-R361 HydrophobicContact CE1-CB 3.91Å; F359-R361 HydrophobicContact CE2-CB 4.5Å; F359-R361 HydrophobicContact CZ-CB 3.83Å; F359-R361 PolarHBondContact O-N 2.76Å; F359-F362 HydrophobicContact CD1-CB 3.92Å; F359-F362 VanDerWaalsContact O-CB 3.23Å; F359-F362 WeakPolarHBondContact O-CB 3.47Å; F359-F362 PolarHBondContact O-N 3.23Å; F359-E365 VanDerWaalsContact CE1-OE1 3.29Å; F359-E365 WeakPolarHBondContact CE1-OE1 3.37Å; F359-E365 WeakPolarHBondContact CZ-OE1 3.4Å
360	S	89	Confident	91.5	Very high	118 Å²	118	95.4 Å²	95.4	83%	0.825	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-30.3	-170.3	54.4	0	0	0	0	115	A358 F362	A358-S360 PolarHBondContact O-N 2.82Å; S360-F362 VanDerWaalsContact C-N 3.32Å; S360-F362 PolarHBondContact O-N 3.31Å
361	R	87.9	Confident	91.4	Very high	61 Å²	61	96 Å²	96	23%	0.23	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-2.6	175.6	-67.8	-164.9	78.6	-162.1	-2.7	114	P344 F359 I363 H364 E365 E368	P344-R361 PolarHBondContact O-NH1 2.97Å; F359-R361 VanDerWaalsContact C-N 3.34Å; F359-R361 HydrophobicContact CE1-CB 3.91Å; F359-R361 HydrophobicContact CE2-CB 4.5Å; F359-R361 HydrophobicContact CZ-CB 3.83Å; F359-R361 PolarHBondContact O-N 2.76Å; R361-I363 PolarHBondContact O-N 2.9Å; R361-H364 PolarHBondContact NE-CD2 3.03Å; R361-H364 PolarHBondContact NH2-CD2 3.18Å; R361-H364 PolarHBondContact NH2-NE2 2.68Å; R361-H364 WeakPolarHBondContact O-CB 3.46Å; R361-H364 PolarHBondContact O-N 2.82Å; R361-H364 VanDerWaalsContact O-N 3.09Å; R361-E365 HydrophobicContact CB-CG 4.38Å; R361-E365 PolarHBondContact O-N 3.1Å; R361-E368 IonicContact NH2-OE1 2.95Å; R361-E368 PolarHBondContact NH2-OE1 2.78Å; R361-E368 IonicContact NH2-OE2 3.73Å; R361-E368 PolarHBondContact NH2-OE2 2.74Å
362	F	89.9	Confident	91.2	Very high	121 Å²	121	94.4 Å²	94.4	53%	0.531	48%	0.48	S	S	.	.	H	α-helix	trans	-51.8	-53	-172.9	179.2	-102.8	0	0	0	113.9	F359 S360 H364 E365 R366	F359-F362 HydrophobicContact CD1-CB 3.92Å; F359-F362 VanDerWaalsContact O-CB 3.23Å; F359-F362 WeakPolarHBondContact O-CB 3.47Å; F359-F362 PolarHBondContact O-N 3.23Å; S360-F362 VanDerWaalsContact C-N 3.32Å; S360-F362 PolarHBondContact O-N 3.31Å; F362-H364 VanDerWaalsContact C-N 3.31Å; F362-H364 PolarHBondContact O-N 2.88Å; F362-E365 PolarHBondContact O-N 2.6Å; F362-R366 HydrophobicContact CE1-CG 4.22Å; F362-R366 HydrophobicContact CE2-CG 4.22Å; F362-R366 HydrophobicContact CZ-CG 4.01Å; F362-R366 WeakPolarHBondContact O-CG 3.06Å; F362-R366 PolarHBondContact O-N 3.02Å
363	I	93.2	Very high	91	Very high	139 Å²	139	95.4 Å²	95.4	71%	0.713	48%	0.482	S	S	*	.	H	α-helix	trans	-62.6	-42.7	-179	-60.1	174.2	0	0	0	110.4	R361 R366 F367	R361-I363 PolarHBondContact O-N 2.9Å; I363-R366 PolarHBondContact O-N 3.3Å; I363-F367 WeakPolarHBondContact O-CB 3.46Å; I363-F367 PolarHBondContact O-N 2.93Å
364	H	90.7	Very high	90.7	Very high	91 Å²	91	99.1 Å²	99.1	42%	0.421	49%	0.488	S	S	.	.	H	α-helix	trans	-64.7	-47.3	-179.1	177.4	88.5	0	0	0	111.5	R361 F362 R366 F367 E368	R361-H364 PolarHBondContact NE-CD2 3.03Å; R361-H364 PolarHBondContact NH2-CD2 3.18Å; R361-H364 PolarHBondContact NH2-NE2 2.68Å; R361-H364 WeakPolarHBondContact O-CB 3.46Å; R361-H364 PolarHBondContact O-N 2.82Å; R361-H364 VanDerWaalsContact O-N 3.09Å; F362-H364 VanDerWaalsContact C-N 3.31Å; F362-H364 PolarHBondContact O-N 2.88Å; H364-R366 VanDerWaalsContact C-N 3.31Å; H364-R366 PolarHBondContact O-N 2.76Å; H364-F367 CarbonylContact O-C 3.49Å; H364-F367 WeakPolarHBondContact O-CB 3.28Å; H364-F367 PolarHBondContact O-N 3.27Å; H364-F367 VanDerWaalsContact O-N 3.09Å; H364-E368 VanDerWaalsContact CD2-CD 3.45Å; H364-E368 IonicContact CD2-OE1 3.61Å; H364-E368 IonicContact CD2-OE2 2.62Å; H364-E368 PolarHBondContact CD2-OE2 3.45Å; H364-E368 IonicContact CE1-OE1 3.59Å; H364-E368 IonicContact CG-OE2 3.22Å; H364-E368 IonicContact NE2-OE1 3.13Å; H364-E368 PolarHBondContact NE2-OE1 3.02Å; H364-E368 IonicContact NE2-OE2 3.56Å; H364-E368 WeakPolarHBondContact O-CB 3.42Å; H364-E368 WeakPolarHBondContact O-CG 3.3Å; H364-E368 PolarHBondContact O-N 2.79Å
365	E	88.6	Confident	90.6	Very high	32 Å²	32	92.6 Å²	92.6	15%	0.15	47%	0.472	C	S	.	.	H	α-helix	trans	-62.3	-35.4	173.9	-72.7	-178.2	-174.7	0	0	113	F359 R361 F362 F367 E368 R369	F359-E365 VanDerWaalsContact CE1-OE1 3.29Å; F359-E365 WeakPolarHBondContact CE1-OE1 3.37Å; F359-E365 WeakPolarHBondContact CZ-OE1 3.4Å; R361-E365 HydrophobicContact CB-CG 4.38Å; R361-E365 PolarHBondContact O-N 3.1Å; F362-E365 PolarHBondContact O-N 2.6Å; E365-F367 VanDerWaalsContact C-N 3.34Å; E365-E368 WeakPolarHBondContact CA-OE2 3.43Å; E365-R369 WeakPolarHBondContact O-CB 3.45Å; E365-R369 PolarHBondContact O-N 3.45Å
366	R	91.7	Very high	90.3	Very high	102 Å²	102	90.1 Å²	90.1	39%	0.385	47%	0.466	S	S	.	.	H	α-helix	trans	-68.8	-36	174.8	-67	-41.5	88	164.4	7.9	111.3	F362 I363 H364 C370	F362-R366 HydrophobicContact CE1-CG 4.22Å; F362-R366 HydrophobicContact CE2-CG 4.22Å; F362-R366 HydrophobicContact CZ-CG 4.01Å; F362-R366 WeakPolarHBondContact O-CG 3.06Å; F362-R366 PolarHBondContact O-N 3.02Å; I363-R366 PolarHBondContact O-N 3.3Å; H364-R366 VanDerWaalsContact C-N 3.31Å; H364-R366 PolarHBondContact O-N 2.76Å; R366-C370 PolarHBondContact O-N 3.09Å; R366-C370 VanDerWaalsContact O-N 3.09Å; R366-C370 PolarHBondContact O-SG 2.9Å; R366-C370 VanDerWaalsContact O-SG 3.33Å
367	F	93.7	Very high	90.2	Very high	127 Å²	127	93.5 Å²	93.5	56%	0.557	49%	0.49	S	S	*	.	H	α-helix	trans	-70.8	-50.1	176.3	179.1	-106.2	0	0	0	112.3	I363 H364 E365 R369 C370 L371	I363-F367 WeakPolarHBondContact O-CB 3.46Å; I363-F367 PolarHBondContact O-N 2.93Å; H364-F367 CarbonylContact O-C 3.49Å; H364-F367 WeakPolarHBondContact O-CB 3.28Å; H364-F367 PolarHBondContact O-N 3.27Å; H364-F367 VanDerWaalsContact O-N 3.09Å; E365-F367 VanDerWaalsContact C-N 3.34Å; F367-R369 PolarHBondContact O-N 3.39Å; F367-C370 WeakPolarHBondContact O-CA 3.3Å; F367-C370 WeakPolarHBondContact O-CB 3.3Å; F367-C370 PolarHBondContact O-N 3.27Å; F367-L371 HydrophobicContact CD1-CD1 4.2Å; F367-L371 HydrophobicContact CE1-CD1 3.71Å; F367-L371 HydrophobicContact CE1-CG 4.29Å; F367-L371 HydrophobicContact CZ-CD1 4.1Å; F367-L371 HydrophobicContact CZ-CD2 4.25Å; F367-L371 HydrophobicContact CZ-CG 4.34Å; F367-L371 PolarHBondContact O-N 3.22Å
368	E	89.9	Confident	89.9	Confident	71 Å²	71	95 Å²	95	33%	0.332	49%	0.486	S	S	.	.	H	α-helix	trans	-49.8	-45.7	169.9	-71.5	172.7	125.5	0	0	110.1	R361 H364 E365 C370 L371 D372	R361-E368 IonicContact NH2-OE1 2.95Å; R361-E368 PolarHBondContact NH2-OE1 2.78Å; R361-E368 IonicContact NH2-OE2 3.73Å; R361-E368 PolarHBondContact NH2-OE2 2.74Å; H364-E368 VanDerWaalsContact CD2-CD 3.45Å; H364-E368 IonicContact CD2-OE1 3.61Å; H364-E368 IonicContact CD2-OE2 2.62Å; H364-E368 PolarHBondContact CD2-OE2 3.45Å; H364-E368 IonicContact CE1-OE1 3.59Å; H364-E368 IonicContact CG-OE2 3.22Å; H364-E368 IonicContact NE2-OE1 3.13Å; H364-E368 PolarHBondContact NE2-OE1 3.02Å; H364-E368 IonicContact NE2-OE2 3.56Å; H364-E368 WeakPolarHBondContact O-CB 3.42Å; H364-E368 WeakPolarHBondContact O-CG 3.3Å; H364-E368 PolarHBondContact O-N 2.79Å; E365-E368 WeakPolarHBondContact CA-OE2 3.43Å; E368-C370 VanDerWaalsContact C-N 3.32Å; E368-C370 PolarHBondContact O-N 3.23Å; E368-L371 CarbonylContact O-C 3.56Å; E368-L371 WeakPolarHBondContact O-CA 3.1Å; E368-L371 WeakPolarHBondContact O-CB 3.42Å; E368-L371 PolarHBondContact O-N 3.26Å; E368-L371 VanDerWaalsContact O-N 3.07Å; E368-D372 PolarHBondContact O-N 2.57Å
369	R	90.3	Very high	89.6	Confident	45 Å²	45	97.2 Å²	97.2	17%	0.17	48%	0.479	C	S	.	.	H	α-helix	trans	-66.1	-27.3	177.8	-179.4	58.3	-165.4	148.2	1.4	114.6	P306 I308 E365 F367 D372 L373	P306-R369 PolarHBondContact O-NH2 3.34Å; I308-R369 HydrophobicContact CD1-CG 4.15Å; E365-R369 WeakPolarHBondContact O-CB 3.45Å; E365-R369 PolarHBondContact O-N 3.45Å; F367-R369 PolarHBondContact O-N 3.39Å; R369-D372 IonicContact NH1-OD2 3.28Å; R369-L373 VanDerWaalsContact O-CG 3.32Å; R369-L373 WeakPolarHBondContact O-CG 3.44Å; R369-L373 PolarHBondContact O-N 2.82Å
370	C	91.8	Very high	89.3	Confident	76 Å²	76	102.6 Å²	102.6	51%	0.514	50%	0.497	S	S	.	.	H	α-helix	trans	-74	-36.7	170.7	-72.8	0	0	0	0	111.4	R366 F367 E368 L373 Y374	R366-C370 PolarHBondContact O-N 3.09Å; R366-C370 VanDerWaalsContact O-N 3.09Å; R366-C370 PolarHBondContact O-SG 2.9Å; R366-C370 VanDerWaalsContact O-SG 3.33Å; F367-C370 WeakPolarHBondContact O-CA 3.3Å; F367-C370 WeakPolarHBondContact O-CB 3.3Å; F367-C370 PolarHBondContact O-N 3.27Å; E368-C370 VanDerWaalsContact C-N 3.32Å; E368-C370 PolarHBondContact O-N 3.23Å; C370-L373 WeakPolarHBondContact O-CB 3.45Å; C370-L373 PolarHBondContact O-N 3.11Å; C370-Y374 PolarHBondContact O-N 2.98Å; C370-Y374 VanDerWaalsContact O-N 3.15Å
371	L	91.3	Very high	89.1	Confident	67 Å²	67	104.7 Å²	104.7	35%	0.351	49%	0.491	S	S	.	.	H	α-helix	trans	-64.8	-42	172.2	-59.1	180	0	0	0	111.4	F367 E368 L373 Y374 L375	F367-L371 HydrophobicContact CD1-CD1 4.2Å; F367-L371 HydrophobicContact CE1-CD1 3.71Å; F367-L371 HydrophobicContact CE1-CG 4.29Å; F367-L371 HydrophobicContact CZ-CD1 4.1Å; F367-L371 HydrophobicContact CZ-CD2 4.25Å; F367-L371 HydrophobicContact CZ-CG 4.34Å; F367-L371 PolarHBondContact O-N 3.22Å; E368-L371 CarbonylContact O-C 3.56Å; E368-L371 WeakPolarHBondContact O-CA 3.1Å; E368-L371 WeakPolarHBondContact O-CB 3.42Å; E368-L371 PolarHBondContact O-N 3.26Å; E368-L371 VanDerWaalsContact O-N 3.07Å; L371-L373 PolarHBondContact O-N 3.34Å; L371-Y374 PolarHBondContact O-N 2.99Å; L371-L375 HydrophobicContact CB-CD1 4.35Å; L371-L375 HydrophobicContact CD2-CD1 4.01Å; L371-L375 WeakPolarHBondContact O-CB 3.27Å; L371-L375 PolarHBondContact O-N 3.28Å
372	D	89	Confident	89	Confident	78 Å²	78	109.9 Å²	109.9	42%	0.417	52%	0.52	S	S	.	.	H	α-helix	trans	-55	-34.9	171.8	-74.4	-18.4	0	0	0	113.3	E368 R369	E368-D372 PolarHBondContact O-N 2.57Å; R369-D372 IonicContact NH1-OD2 3.28Å
373	L	88.5	Confident	88.7	Confident	65 Å²	65	114.6 Å²	114.6	34%	0.34	53%	0.534	S	S	.	.	H	α-helix	trans	-77.5	-34.5	-177.6	-79.1	169.9	0	0	0	112.1	A305 R369 C370 L371 R378	A305-L373 HydrophobicContact CB-CD2 3.35Å; R369-L373 VanDerWaalsContact O-CG 3.32Å; R369-L373 WeakPolarHBondContact O-CG 3.44Å; R369-L373 PolarHBondContact O-N 2.82Å; C370-L373 WeakPolarHBondContact O-CB 3.45Å; C370-L373 PolarHBondContact O-N 3.11Å; L371-L373 PolarHBondContact O-N 3.34Å; L373-R378 PolarHBondContact O-NH2 2.81Å
374	Y	87.6	Confident	88.5	Confident	198 Å²	198	113.5 Å²	113.5	78%	0.776	53%	0.533	S	S	*	.	H	α-helix	trans	-96.3	-50.2	-172.8	177.3	-124.6	0	0	0	113.4	C370 L371	C370-Y374 PolarHBondContact O-N 2.98Å; C370-Y374 VanDerWaalsContact O-N 3.15Å; L371-Y374 PolarHBondContact O-N 2.99Å
375	L	90.9	Very high	88.3	Confident	111 Å²	111	116.1 Å²	116.1	58%	0.581	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-34.6	-170.8	-60.1	178.9	0	0	0	113.7	L371	L371-L375 HydrophobicContact CB-CD1 4.35Å; L371-L375 HydrophobicContact CD2-CD1 4.01Å; L371-L375 WeakPolarHBondContact O-CB 3.27Å; L371-L375 PolarHBondContact O-N 3.28Å
376	C	87.4	Confident	88.4	Confident	64 Å²	64	118 Å²	118	43%	0.432	56%	0.564	S	S	.	*	S	Bend	trans	-76.5	125.9	-169.7	-66.7	0	0	0	0	112.9	R378	C376-R378 PolarHBondContact O-N 3.26Å
377	P	89.8	Confident	88.3	Confident	128 Å²	128	118.1 Å²	118.1	83%	0.831	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-68.7	125.6	-177.4	26.9	-34.3	0	0	0	111.8
378	R	86.3	Confident	88.2	Confident	105 Å²	105	117 Å²	117	40%	0.396	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-88.9	118.9	-175.6	-53.9	-178.4	-164.2	160.4	7.8	110.6	L303 L373 C376	L303-R378 HydrophobicContact CB-CB 4.28Å; L303-R378 VanDerWaalsContact CD1-O 3.23Å; L303-R378 WeakPolarHBondContact CD1-O 3.27Å; L303-R378 PolarHBondContact O-NH1 3.2Å; L373-R378 PolarHBondContact O-NH2 2.81Å; C376-R378 PolarHBondContact O-N 3.26Å
379	Q	85.6	Confident	88.3	Confident	147 Å²	147	121.2 Å²	121.2	69%	0.687	60%	0.598	S	S	*	*			trans	-123	132.8	179.2	-167.5	-170.2	47.6	0	0	112	K381	Q379-K381 PolarHBondContact O-N 3.22Å
380	R	83.1	Confident	88.2	Confident	209 Å²	209	124 Å²	124	79%	0.789	62%	0.616	S	S	*	*			trans	-74.4	86.2	174.3	-173.9	-177.3	177.4	-178.8	-0.7	111.4	L303	L303-R380 HydrophobicContact CD2-CB 4.02Å
381	K	83.6	Confident	88.1	Confident	162 Å²	162	126.4 Å²	126.4	70%	0.704	62%	0.623	S	S	*	*			trans	-79.7	122.5	174	-66.1	-175.2	178.5	179	0	111.3	Q379 R383	Q379-K381 PolarHBondContact O-N 3.22Å; K381-R383 PolarHBondContact O-N 2.9Å
382	M	85.6	Confident	88	Confident	170 Å²	170	128.6 Å²	128.6	84%	0.837	63%	0.634	S	S	*	*			trans	-79.2	101.8	173.4	-70	178.9	64.7	0	0	110.1	V384	M382-V384 PolarHBondContact O-N 3.44Å
383	R	84.9	Confident	88	Confident	219 Å²	219	129.1 Å²	129.1	83%	0.826	64%	0.641	S	S	*	*			trans	-77.4	120.3	174.1	-66.4	-175.6	69.3	164	2.1	109.9	K381 N385	K381-R383 PolarHBondContact O-N 2.9Å; R383-N385 PolarHBondContact O-N 2.9Å
384	V	87.5	Confident	88	Confident	116 Å²	116	135.9 Å²	135.9	70%	0.703	67%	0.668	S	S	*	*			trans	-84.8	89.8	-179.7	-179	0	0	0	0	109.2	M382 V386	M382-V384 PolarHBondContact O-N 3.44Å; V384-V386 VanDerWaalsContact C-N 3.28Å; V384-V386 HydrophobicContact CG1-CB 3.93Å; V384-V386 HydrophobicContact CG1-CG2 3.51Å; V384-V386 PolarHBondContact O-N 2.99Å
385	N	87.8	Confident	88.1	Confident	146 Å²	146	129.7 Å²	129.7	78%	0.781	65%	0.648	S	S	*	*			trans	-80.9	74.2	175.6	-66.6	-2.2	0	0	0	109.8	R383	R383-N385 PolarHBondContact O-N 2.9Å
386	V	90.4	Very high	88.3	Confident	72 Å²	72	127 Å²	127	44%	0.436	64%	0.637	S	S	.	*			trans	-124.1	140.6	-178.5	174.3	0	0	0	0	109.2	V384 D390 L391	V384-V386 VanDerWaalsContact C-N 3.28Å; V384-V386 HydrophobicContact CG1-CB 3.93Å; V384-V386 HydrophobicContact CG1-CG2 3.51Å; V384-V386 PolarHBondContact O-N 2.99Å; V386-D390 HydrophobicContact CG1-CB 3.75Å; V386-L391 HydrophobicContact CG1-CD2 3.9Å; V386-L391 HydrophobicContact CG1-CG 4.3Å
387	N	89.5	Confident	88.6	Confident	105 Å²	105	131 Å²	131	56%	0.561	65%	0.648	S	S	*	*			trans	-68.2	144.3	178.6	-49.2	-68.2	0	0	0	109.9	E389 D390	N387-E389 PolarHBondContact O-N 3.38Å; N387-E389 VanDerWaalsContact O-N 3.09Å; N387-D390 WeakPolarHBondContact CB-OD2 3.17Å; N387-D390 PolarHBondContact ND2-OD2 3.37Å; N387-D390 PolarHBondContact O-N 2.7Å
388	P	92.2	Very high	88.7	Confident	104 Å²	104	127.4 Å²	127.4	68%	0.675	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-23.3	-179.5	25.2	-34.6	0	0	0	113.2
389	E	91	Very high	89.1	Confident	158 Å²	158	130.7 Å²	130.7	74%	0.738	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	-34.9	176	-57.5	-169.4	166.7	0	0	113	N387 L391 I392	N387-E389 PolarHBondContact O-N 3.38Å; N387-E389 VanDerWaalsContact O-N 3.09Å; E389-L391 PolarHBondContact O-N 3.11Å; E389-I392 WeakPolarHBondContact O-CB 3.46Å; E389-I392 PolarHBondContact O-N 3.49Å
390	D	89.5	Confident	89.5	Confident	104 Å²	104	129 Å²	129	56%	0.556	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-18.5	179.8	-69.9	-53.7	0	0	0	112.6	V386 N387 I392	V386-D390 HydrophobicContact CG1-CB 3.75Å; N387-D390 WeakPolarHBondContact CB-OD2 3.17Å; N387-D390 PolarHBondContact ND2-OD2 3.37Å; N387-D390 PolarHBondContact O-N 2.7Å; D390-I392 VanDerWaalsContact C-N 3.29Å
391	L	89.6	Confident	90.1	Very high	126 Å²	126	120.1 Å²	120.1	66%	0.66	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-11.9	173.9	-55.7	177.9	0	0	0	112.9	V386 E389	V386-L391 HydrophobicContact CG1-CD2 3.9Å; V386-L391 HydrophobicContact CG1-CG 4.3Å; E389-L391 PolarHBondContact O-N 3.11Å
392	I	87.9	Confident	90.6	Very high	113 Å²	113	118.6 Å²	118.6	58%	0.579	60%	0.6	S	S	*	*	S	Bend	trans	-87.5	126.5	-177.3	-55.4	178.4	0	0	0	109.3	E389 D390 K394	E389-I392 WeakPolarHBondContact O-CB 3.46Å; E389-I392 PolarHBondContact O-N 3.49Å; D390-I392 VanDerWaalsContact C-N 3.29Å; I392-K394 PolarHBondContact O-N 2.98Å
393	P	88.8	Confident	91	Very high	89 Å²	89	113.4 Å²	113.4	58%	0.578	58%	0.579	S	S	*	*			trans	-63.4	137.1	178.5	26.1	-34.3	0	0	0	111.2	L395	P393-L395 VanDerWaalsContact C-N 3.34Å; P393-L395 HydrophobicContact CB-CD2 4.44Å; P393-L395 HydrophobicContact CB-CG 4.37Å; P393-L395 HydrophobicContact CG-CD1 4.37Å; P393-L395 HydrophobicContact CG-CG 4.32Å; P393-L395 PolarHBondContact O-N 3.36Å
394	K	88.5	Confident	91.6	Very high	208 Å²	208	103.7 Å²	103.7	90%	0.904	54%	0.543	S	S	*	.			trans	-73.8	83	-179.6	-63.7	-179.2	-178.1	177.9	0	110.7	I392	I392-K394 PolarHBondContact O-N 2.98Å
395	L	90.2	Very high	92	Very high	67 Å²	67	98.2 Å²	98.2	35%	0.351	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-94	153	178	-57.8	179.4	0	0	0	111.6	P393 V710	P393-L395 VanDerWaalsContact C-N 3.34Å; P393-L395 HydrophobicContact CB-CD2 4.44Å; P393-L395 HydrophobicContact CB-CG 4.37Å; P393-L395 HydrophobicContact CG-CD1 4.37Å; P393-L395 HydrophobicContact CG-CG 4.32Å; P393-L395 PolarHBondContact O-N 3.36Å; L395-V710 HydrophobicContact CB-CG1 4.38Å; L395-V710 HydrophobicContact CB-CG2 4.22Å; L395-V710 HydrophobicContact CD1-CG1 4.28Å; L395-V710 HydrophobicContact CD1-CG2 4.32Å; L395-V710 HydrophobicContact CD2-CG2 4.31Å
396	P	94.6	Very high	92.4	Very high	54 Å²	54	93.7 Å²	93.7	35%	0.351	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-56.8	150.4	168.6	-24.3	35	0	0	0	112.1	L401 L708	P396-L401 HydrophobicContact CB-CD1 4.31Å; P396-L401 HydrophobicContact CB-CD2 4.34Å; P396-L401 HydrophobicContact CB-CG 4.37Å; P396-L708 HydrophobicContact CG-CD2 4.19Å
397	K	93.4	Very high	92.6	Very high	150 Å²	150	94.2 Å²	94.2	65%	0.652	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-74.3	140.9	-178.5	-61.7	171.7	-179.8	171.2	0	108.8	K399 D400	K397-K399 PolarHBondContact O-N 2.61Å; K397-D400 WeakPolarHBondContact CB-OD2 3.36Å; K397-D400 PolarHBondContact N-OD2 2.87Å; K397-D400 WeakPolarHBondContact O-CB 3.43Å; K397-D400 PolarHBondContact O-N 3.11Å
398	P	93.7	Very high	92.9	Very high	51 Å²	51	92.9 Å²	92.9	33%	0.331	48%	0.481	S	S	.	.	G	3₁₀ helix	trans	-54.2	-29.5	178.9	-31	36.9	0	0	0	114.5	D400 L401 F404 V712	P398-D400 PolarHBondContact O-N 3.43Å; P398-L401 PolarHBondContact O-N 2.75Å; P398-L401 VanDerWaalsContact O-N 3.12Å; P398-F404 HydrophobicContact CB-CZ 4.15Å; P398-F404 WeakPolarHBondContact O-CE1 3.46Å; P398-V712 HydrophobicContact CB-CB 4.21Å; P398-V712 HydrophobicContact CB-CG1 4.2Å
399	K	94.1	Very high	93	Very high	174 Å²	174	90.3 Å²	90.3	76%	0.757	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-56.9	-33.3	174.5	-67.3	-169.6	177.7	-173.2	0	113.2	K397 L401	K397-K399 PolarHBondContact O-N 2.61Å; K399-L401 VanDerWaalsContact C-N 3.27Å; K399-L401 PolarHBondContact O-N 3.47Å
400	D	94.6	Very high	93.3	Very high	112 Å²	112	85 Å²	85	60%	0.599	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-83.3	-8.6	-175.3	-40.8	-30.2	0	0	0	111.7	K397 P398	K397-D400 WeakPolarHBondContact CB-OD2 3.36Å; K397-D400 PolarHBondContact N-OD2 2.87Å; K397-D400 WeakPolarHBondContact O-CB 3.43Å; K397-D400 PolarHBondContact O-N 3.11Å; P398-D400 PolarHBondContact O-N 3.43Å
401	L	94.9	Very high	93.7	Very high	22 Å²	22	81.3 Å²	81.3	12%	0.115	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-110.7	17.9	-174.8	-61	179.8	0	0	0	113.1	P396 P398 K399 H696 V710 V712	P396-L401 HydrophobicContact CB-CD1 4.31Å; P396-L401 HydrophobicContact CB-CD2 4.34Å; P396-L401 HydrophobicContact CB-CG 4.37Å; P398-L401 PolarHBondContact O-N 2.75Å; P398-L401 VanDerWaalsContact O-N 3.12Å; K399-L401 VanDerWaalsContact C-N 3.27Å; K399-L401 PolarHBondContact O-N 3.47Å; L401-H696 HydrophobicContact CB-CB 4.47Å; L401-H696 HydrophobicContact CD1-CB 4.08Å; L401-V710 HydrophobicContact CD1-CB 3.88Å; L401-V710 HydrophobicContact CD1-CG1 3.84Å; L401-V710 HydrophobicContact CD1-CG2 4.07Å; L401-V712 HydrophobicContact CB-CG1 4.24Å; L401-V712 HydrophobicContact CD1-CG1 4.1Å
402	Q	93.1	Very high	94	Very high	130 Å²	130	75.3 Å²	75.3	61%	0.607	40%	0.395	S	S	*	.			trans	-70.8	151.8	176	-72.5	-174.4	-4.1	0	0	112	F404	Q402-F404 HydrophobicContact CB-CE1 4.41Å; Q402-F404 HydrophobicContact CG-CD1 4.1Å; Q402-F404 HydrophobicContact CG-CE1 3.53Å; Q402-F404 HydrophobicContact CG-CZ 4.22Å
403	P	95.8	Very high	94.4	Very high	62 Å²	62	79 Å²	79	40%	0.403	40%	0.401	S	S	.	.			cis	-88.1	151.9	3.9	36.1	-36.1	0	0	0	114	Y680 P736	P403-Y680 HydrophobicContact CG-CD1 4.21Å; P403-Y680 HydrophobicContact CG-CE1 3.81Å; P403-P736 HydrophobicContact CB-CB 4.18Å; P403-P736 HydrophobicContact CB-CG 3.85Å; P403-P736 HydrophobicContact CG-CB 4.15Å; P403-P736 HydrophobicContact CG-CG 3.96Å
404	F	96.3	Very high	94.6	Very high	15 Å²	15	76.7 Å²	76.7	7%	0.066	39%	0.394	C	S	.	.			trans	-155.6	156.4	167.6	54.5	-90.3	0	0	0	107.7	P398 Q402 T406 L682 V712 K713	P398-F404 HydrophobicContact CB-CZ 4.15Å; P398-F404 WeakPolarHBondContact O-CE1 3.46Å; Q402-F404 HydrophobicContact CB-CE1 4.41Å; Q402-F404 HydrophobicContact CG-CD1 4.1Å; Q402-F404 HydrophobicContact CG-CE1 3.53Å; Q402-F404 HydrophobicContact CG-CZ 4.22Å; F404-T406 HydrophobicContact CD2-CG2 4.01Å; F404-T406 HydrophobicContact CE2-CG2 3.79Å; F404-T406 WeakPolarHBondContact O-CG2 3.45Å; F404-L682 HydrophobicContact CB-CD1 4.07Å; F404-L682 HydrophobicContact CB-CD2 3.91Å; F404-V712 HydrophobicContact CB-CG2 3.98Å; F404-V712 HydrophobicContact CD1-CB 4.04Å; F404-V712 HydrophobicContact CD1-CG1 4.41Å; F404-V712 HydrophobicContact CD1-CG2 3.98Å; F404-V712 HydrophobicContact CD2-CB 4.03Å; F404-V712 HydrophobicContact CD2-CG2 3.71Å; F404-V712 HydrophobicContact CE1-CB 4.01Å; F404-V712 HydrophobicContact CE1-CG1 4.36Å; F404-V712 HydrophobicContact CE1-CG2 4.43Å; F404-V712 HydrophobicContact CE2-CB 3.97Å; F404-V712 HydrophobicContact CE2-CG2 4.17Å; F404-V712 HydrophobicContact CG-CB 4.07Å; F404-V712 HydrophobicContact CG-CG2 3.6Å; F404-V712 HydrophobicContact CZ-CB 3.97Å; F404-K713 HydrophobicContact CD2-CB 4Å; F404-K713 HydrophobicContact CE2-CB 3.99Å
405	P	96.6	Very high	95	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	35%	0.354	C	S	.	.			trans	-72.8	141.8	-174.7	27.2	-28.1	0	0	0	111.4	V694 L715 P736 V738 F750 T751	P405-V694 HydrophobicContact CG-CG2 4.25Å; P405-L715 HydrophobicContact CG-CD1 4.4Å; P405-P736 WeakPolarHBondContact CB-O 3.31Å; P405-P736 WeakPolarHBondContact CD-O 3.34Å; P405-P736 WeakPolarHBondContact CG-O 3.3Å; P405-V738 HydrophobicContact CG-CB 4.11Å; P405-V738 HydrophobicContact CG-CG2 3.86Å; P405-F750 HydrophobicContact CB-CB 4.05Å; P405-F750 WeakPolarHBondContact CB-O 3.32Å; P405-T751 VanDerWaalsContact CA-C 3.45Å; P405-T751 WeakPolarHBondContact CA-OXT 3.29Å
406	T	94.9	Very high	95.3	Very high	52 Å²	52	69.3 Å²	69.3	32%	0.319	37%	0.372	S	S	.	.			trans	-129.5	-26.6	-169.7	62.9	0	0	0	0	114.7	F404 K713 T751	F404-T406 HydrophobicContact CD2-CG2 4.01Å; F404-T406 HydrophobicContact CE2-CG2 3.79Å; F404-T406 WeakPolarHBondContact O-CG2 3.45Å; T406-K713 WeakPolarHBondContact O-CE 3.48Å; T406-K713 PolarHBondContact O-NZ 3.43Å; T406-T751 PolarHBondContact N-O 2.8Å; T406-T751 PolarHBondContact OG1-O 2.79Å
407	T	94.8	Very high	95.3	Very high	82 Å²	82	67.4 Å²	67.4	50%	0.503	36%	0.363	S	S	.	.	S	Bend	trans	-136.2	153.5	-173.9	55.1	0	0	0	0	111	A409 F750 T751	T407-A409 PolarHBondContact O-N 3.24Å; T407-F750 CarbonylContact O-C 3.56Å; T407-F750 WeakPolarHBondContact O-CA 3.34Å; T407-T751 PolarHBondContact N-O 2.86Å; T407-T751 VanDerWaalsContact N-O 3.07Å; T407-T751 PolarHBondContact O-N 2.73Å
408	Q	96	Very high	95.4	Very high	78 Å²	78	62.1 Å²	62.1	36%	0.364	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	114.7	174.7	-172.8	-162.2	-91.7	0	0	108.9	V411 R748 L749 F750	Q408-V411 HydrophobicContact CG-CG2 4.39Å; Q408-V411 VanDerWaalsContact NE2-CG2 3.33Å; Q408-R748 HydrophobicContact CG-CB 4.45Å; Q408-L749 CarbonylContact C-O 3.59Å; Q408-F750 HydrophobicContact CB-CD1 3.85Å; Q408-F750 HydrophobicContact CB-CE1 3.62Å; Q408-F750 HydrophobicContact CB-CZ 4.31Å; Q408-F750 HydrophobicContact CG-CD1 4.44Å; Q408-F750 HydrophobicContact CG-CE1 4.07Å; Q408-F750 HydrophobicContact CG-CZ 4.28Å
409	A	95.5	Very high	95.6	Very high	49 Å²	49	59.7 Å²	59.7	41%	0.405	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-50.9	-179.1	0	0	0	0	0	112.5	T407 L749 T751	T407-A409 PolarHBondContact O-N 3.24Å; A409-L749 HydrophobicContact CB-CG 4.42Å; A409-L749 PolarHBondContact N-O 3.26Å; A409-T751 HydrophobicContact CB-CG2 3.74Å
410	L	96.7	Very high	95.7	Very high	48 Å²	48	56.3 Å²	56.3	25%	0.251	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	154.6	-175.1	-61.9	175.5	0	0	0	112	V445 C446 R748 L749	L410-V445 VanDerWaalsContact CD1-O 3.32Å; L410-V445 WeakPolarHBondContact CD1-O 3.35Å; L410-C446 WeakPolarHBondContact CD1-O 3.44Å; L410-R748 WeakPolarHBondContact O-CA 3.39Å; L410-L749 HydrophobicContact CB-CB 4.18Å; L410-L749 HydrophobicContact CB-CD2 4.41Å; L410-L749 HydrophobicContact CD1-CD2 4.04Å; L410-L749 HydrophobicContact CG-CD2 4.35Å; L410-L749 PolarHBondContact N-O 3.48Å; L410-L749 PolarHBondContact O-N 3.11Å
411	V	97.2	Very high	95.8	Very high	25 Å²	25	51.5 Å²	51.5	15%	0.152	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	110	174.7	-174.5	0	0	0	0	108.6	Q408 R413 T746 I747 R748	Q408-V411 HydrophobicContact CG-CG2 4.39Å; Q408-V411 VanDerWaalsContact NE2-CG2 3.33Å; V411-R413 HydrophobicContact CG1-CG 4Å; V411-R413 PolarHBondContact O-N 2.82Å; V411-T746 HydrophobicContact CG1-CG2 3.92Å; V411-I747 CarbonylContact C-O 3.51Å; V411-I747 WeakPolarHBondContact CA-O 3.45Å; V411-R748 HydrophobicContact CG1-CG 4.27Å; V411-R748 HydrophobicContact CG2-CG 4.31Å
412	Y	97.5	Very high	95.9	Very high	1 Å²	1	50.7 Å²	50.7	0%	0.004	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	115	175.2	-48.8	-99.5	0	0	0	107.6	L431 W443 V445 S448 F739 I747 L749	Y412-L431 HydrophobicContact CD1-CD2 4.4Å; Y412-L431 HydrophobicContact CD2-CD2 4.23Å; Y412-L431 HydrophobicContact CE1-CD2 4.18Å; Y412-L431 HydrophobicContact CE2-CD2 4.02Å; Y412-L431 HydrophobicContact CG-CD2 4.47Å; Y412-W443 HydrophobicContact CD1-CB 3.8Å; Y412-W443 HydrophobicContact CD1-CD2 4.02Å; Y412-W443 AromaticContact CD1-CE3 3.92Å; Y412-W443 HydrophobicContact CD1-CE3 3.92Å; Y412-W443 AromaticContact CD1-CG 4Å; Y412-W443 HydrophobicContact CD1-CG 4Å; Y412-W443 HydrophobicContact CE1-CB 4.11Å; Y412-W443 HydrophobicContact CG-CD2 4.43Å; Y412-W443 HydrophobicContact CG-CE3 4.35Å; Y412-V445 PolarHBondContact OH-O 3.42Å; Y412-S448 VanDerWaalsContact CE1-CA 3.47Å; Y412-F739 HydrophobicContact CE2-CD1 4.24Å; Y412-F739 HydrophobicContact CE2-CE1 4.43Å; Y412-I747 HydrophobicContact CD2-CB 3.82Å; Y412-I747 HydrophobicContact CD2-CG2 4.1Å; Y412-I747 WeakPolarHBondContact CD2-O 3.42Å; Y412-I747 HydrophobicContact CG-CB 4.26Å; Y412-I747 PolarHBondContact N-O 3.32Å; Y412-I747 PolarHBondContact O-N 3.29Å; Y412-L749 HydrophobicContact CE2-CB 3.93Å
413	R	96.1	Very high	96.1	Very high	190 Å²	190	45.4 Å²	45.4	72%	0.717	26%	0.257	S	S	*	.			trans	-115.4	140.1	179.8	-66.4	-172.1	175.8	109.6	-7.1	110.1	V411 W443 T746	V411-R413 HydrophobicContact CG1-CG 4Å; V411-R413 PolarHBondContact O-N 2.82Å; R413-W443 WeakPolarHBondContact O-CH2 3.41Å; R413-W443 WeakPolarHBondContact O-CZ3 3.28Å; R413-T746 HydrophobicContact CG-CG2 4.49Å
414	G	93.1	Very high	96.2	Very high	41 Å²	41	43 Å²	43	42%	0.423	24%	0.241	S	C	.	.			trans	155.3	-24.9	171	0	0	0	0	0	114.7	R441	G414-R441 PolarHBondContact O-NH1 2.86Å; G414-R441 PolarHBondContact O-NH2 3.28Å
415	H	96.4	Very high	96.1	Very high	14 Å²	14	42.6 Å²	42.6	7%	0.065	24%	0.24	C	C	.	.			trans	-63.9	148.1	168.1	-78.4	-66.2	0	0	0	110.7	V419 S433 S435 D437 S439 R441 W443	H415-V419 HydrophobicContact CB-CG2 3.96Å; H415-S433 PolarHBondContact NE2-OG 2.89Å; H415-S435 VanDerWaalsContact CE1-CB 3.4Å; H415-S435 WeakPolarHBondContact CE1-CB 3.49Å; H415-S435 WeakPolarHBondContact ND1-CB 3.27Å; H415-D437 VanDerWaalsContact CA-OD2 3.28Å; H415-D437 WeakPolarHBondContact CA-OD2 3.24Å; H415-D437 IonicContact CE1-OD1 3.98Å; H415-D437 IonicContact CE1-OD2 3.81Å; H415-D437 IonicContact CG-OD2 2.74Å; H415-D437 VanDerWaalsContact ND1-CG 3.32Å; H415-D437 IonicContact ND1-OD1 2.86Å; H415-D437 PolarHBondContact ND1-OD1 2.85Å; H415-D437 VanDerWaalsContact ND1-OD1 3.14Å; H415-D437 IonicContact ND1-OD2 3.67Å; H415-D437 PolarHBondContact ND1-OD2 2.87Å; H415-S439 PolarHBondContact CE1-O 3.25Å; H415-S439 PolarHBondContact CE1-OG 2.85Å; H415-S439 VanDerWaalsContact CE1-OG 3.28Å; H415-S439 PolarHBondContact ND1-OG 3.28Å; H415-R441 VanDerWaalsContact CE1-CD 3.48Å; H415-R441 WeakPolarHBondContact CE1-CD 3.49Å; H415-R441 PolarHBondContact CE1-NE 3.29Å; H415-R441 PolarHBondContact ND1-NE 2.91Å; H415-W443 AromaticContact CD2-CZ2 3.89Å
416	S	95.2	Very high	96	Very high	105 Å²	105	43.8 Å²	43.8	73%	0.734	25%	0.247	S	C	*	.	S	Bend	trans	-105.8	-7.1	175.4	51.4	0	0	0	0	113.7	D437	S416-D437 PolarHBondContact N-OD2 2.84Å; S416-D437 VanDerWaalsContact OG-CB 3.27Å; S416-D437 WeakPolarHBondContact OG-CB 3.38Å
417	G	94.4	Very high	95.8	Very high	15 Å²	15	44.3 Å²	44.3	16%	0.155	25%	0.253	C	S	.	.	S	Bend	trans	-126.7	178.6	178.1	0	0	0	0	0	112.3	V419 S435 A745	G417-V419 PolarHBondContact O-N 3.49Å; G417-S435 PolarHBondContact O-OG 3.41Å; G417-S435 VanDerWaalsContact O-OG 3.13Å; G417-A745 WeakPolarHBondContact O-CA 3.48Å; G417-A745 WeakPolarHBondContact O-CB 3.45Å
418	L	96	Very high	95.8	Very high	39 Å²	39	40.5 Å²	40.5	20%	0.204	23%	0.23	C	C	.	.			trans	-57.5	138.3	179	-59.3	89.7	0	0	0	110.4	S435 D436 L724 L727 A743	L418-S435 WeakPolarHBondContact O-CA 3.12Å; L418-S435 WeakPolarHBondContact O-CB 3.15Å; L418-S435 PolarHBondContact O-OG 3Å; L418-D436 PolarHBondContact O-N 2.99Å; L418-L724 HydrophobicContact CD2-CD1 3.55Å; L418-L727 HydrophobicContact CB-CD1 3.99Å; L418-L727 HydrophobicContact CD2-CD1 4.2Å; L418-A743 HydrophobicContact CD2-CB 3.81Å; L418-A743 HydrophobicContact CG-CB 4.37Å
419	V	97.6	Very high	95.7	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	96	177.7	-173.4	0	0	0	0	108.9	H415 G417 I422 G434 S741 G742 I747	H415-V419 HydrophobicContact CB-CG2 3.96Å; G417-V419 PolarHBondContact O-N 3.49Å; V419-I422 HydrophobicContact CG1-CG2 4.16Å; V419-G434 CarbonylContact C-O 3.56Å; V419-G434 WeakPolarHBondContact CG1-O 3.45Å; V419-S741 WeakPolarHBondContact O-CB 3.49Å; V419-S741 PolarHBondContact O-OG 3.43Å; V419-G742 PolarHBondContact N-O 2.87Å; V419-G742 VanDerWaalsContact N-O 3.09Å; V419-I747 HydrophobicContact CB-CG1 4.49Å; V419-I747 HydrophobicContact CG1-CD1 4.33Å; V419-I747 HydrophobicContact CG1-CG1 3.93Å; V419-I747 HydrophobicContact CG2-CG1 4.43Å
420	R	95.9	Very high	95.7	Very high	103 Å²	103	42.1 Å²	42.1	39%	0.389	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	-33.4	-169.3	-72.8	-165.5	179.7	-88.2	-15.9	114.7	G434 D436 V460	R420-G434 PolarHBondContact N-O 3.42Å; R420-D436 WeakPolarHBondContact CD-OD1 3.41Å; R420-D436 IonicContact CZ-OD1 2.82Å; R420-D436 IonicContact CZ-OD2 3.97Å; R420-D436 VanDerWaalsContact CZ-OD2 3.3Å; R420-D436 VanDerWaalsContact NE-CG 3.3Å; R420-D436 IonicContact NE-OD1 3.25Å; R420-D436 PolarHBondContact NE-OD1 3.2Å; R420-D436 IonicContact NE-OD2 3.22Å; R420-D436 PolarHBondContact NE-OD2 2.97Å; R420-D436 VanDerWaalsContact NE-OD2 3.13Å; R420-D436 IonicContact NH2-OD1 2.67Å; R420-D436 IonicContact NH2-OD2 3.79Å; R420-D436 PolarHBondContact NH2-OD2 3.4Å; R420-V460 WeakPolarHBondContact CB-O 3.46Å
421	S	97.4	Very high	95.7	Very high	10 Å²	10	39.9 Å²	39.9	7%	0.07	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	148.2	-175.5	-174.3	0	0	0	0	112.7	S433 G434 V463 D728	S421-S433 WeakPolarHBondContact O-CA 3.48Å; S421-G434 PolarHBondContact O-N 2.9Å; S421-V463 PolarHBondContact OG-N 2.92Å; S421-D728 WeakPolarHBondContact CA-OD2 3.45Å; S421-D728 WeakPolarHBondContact CB-OD2 3.49Å; S421-D728 PolarHBondContact OG-OD2 3Å
422	I	98	Very high	95.7	Very high	5 Å²	5	38.7 Å²	38.7	3%	0.026	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	142.5	-178.1	47.8	168.8	0	0	0	112.4	V419 L431 V432 D728 T730 F739 I747	V419-I422 HydrophobicContact CG1-CG2 4.16Å; I422-L431 HydrophobicContact CB-CD1 4.35Å; I422-V432 CarbonylContact C-O 3.59Å; I422-V432 VanDerWaalsContact CA-O 3.3Å; I422-V432 WeakPolarHBondContact CA-O 3.13Å; I422-D728 HydrophobicContact CG1-CB 4.08Å; I422-D728 PolarHBondContact N-OD2 3.38Å; I422-T730 HydrophobicContact CB-CG2 4.5Å; I422-T730 HydrophobicContact CD1-CG2 3.91Å; I422-T730 HydrophobicContact CG1-CG2 3.98Å; I422-F739 HydrophobicContact CD1-CB 3.78Å; I422-I747 HydrophobicContact CD1-CG2 4.16Å; I422-I747 HydrophobicContact CG2-CD1 4.13Å; I422-I747 HydrophobicContact CG2-CG1 4.15Å; I422-I747 HydrophobicContact CG2-CG2 4.06Å
423	S	97.6	Very high	95.8	Very high	20 Å²	20	38.6 Å²	38.6	14%	0.14	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	133.4	-179.1	-158.5	0	0	0	0	112.1	V432 V463 W465	S423-V432 PolarHBondContact N-O 2.96Å; S423-V432 PolarHBondContact O-N 3.14Å; S423-V463 WeakPolarHBondContact CB-O 3.22Å; S423-W465 PolarHBondContact OG-N 2.88Å
424	V	96.6	Very high	95.8	Very high	12 Å²	12	29.6 Å²	29.6	7%	0.073	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	138.8	-179.7	-168.5	0	0	0	0	109.8	L431 T730 F739	V424-L431 HydrophobicContact CG2-CD1 3.85Å; V424-T730 HydrophobicContact CG2-CG2 3.77Å; V424-F739 HydrophobicContact CG1-CE2 4.31Å; V424-F739 HydrophobicContact CG2-CD2 3.52Å; V424-F739 HydrophobicContact CG2-CE2 3.51Å; V424-F739 HydrophobicContact CG2-CG 4.39Å; V424-F739 HydrophobicContact CG2-CZ 4.37Å
425	S	95.1	Very high	96	Very high	6 Å²	6	27.6 Å²	27.6	4%	0.042	15%	0.154	C	C	.	.			trans	-60	149.3	172.3	-176.6	0	0	0	0	112.2	S427 G428 W430 W465	S425-S427 PolarHBondContact O-N 3.09Å; S425-S427 VanDerWaalsContact O-N 3.09Å; S425-S427 PolarHBondContact OG-OG 3.19Å; S425-G428 PolarHBondContact O-N 2.94Å; S425-W430 WeakPolarHBondContact CB-O 3.35Å; S425-W430 PolarHBondContact N-O 2.9Å; S425-W465 WeakPolarHBondContact OG-CH2 3.42Å; S425-W465 WeakPolarHBondContact OG-CZ3 3.41Å
426	P	93.3	Very high	96	Very high	24 Å²	24	29.2 Å²	29.2	16%	0.156	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-27.3	170.9	-27.2	35.5	0	0	0	114.4	G428 N466 P469	P426-G428 VanDerWaalsContact C-N 3.33Å; P426-N466 WeakPolarHBondContact CD-O 3.24Å; P426-N466 WeakPolarHBondContact CG-O 3.41Å; P426-P469 HydrophobicContact CB-CB 4.1Å
427	S	92	Very high	96	Very high	63 Å²	63	25.9 Å²	25.9	44%	0.441	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-11.4	176.5	69.1	0	0	0	0	114.3	S425 Q429	S425-S427 PolarHBondContact O-N 3.09Å; S425-S427 VanDerWaalsContact O-N 3.09Å; S425-S427 PolarHBondContact OG-OG 3.19Å; S427-Q429 PolarHBondContact O-N 3.26Å; S427-Q429 VanDerWaalsContact O-N 3.08Å
428	G	93.4	Very high	96	Very high	2 Å²	2	25.6 Å²	25.6	2%	0.021	13%	0.134	C	C	.	.	S	Bend	trans	74.5	-20.1	-174.8	0	0	0	0	0	115.6	S425 P426 W430 V445 H732	S425-G428 PolarHBondContact O-N 2.94Å; P426-G428 VanDerWaalsContact C-N 3.33Å; G428-W430 PolarHBondContact O-N 3.25Å; G428-V445 VanDerWaalsContact O-CG2 3.31Å; G428-V445 WeakPolarHBondContact O-CG2 3.35Å; G428-H732 VanDerWaalsContact CA-NE2 3.26Å; G428-H732 WeakPolarHBondContact CA-NE2 3.49Å; G428-H732 PolarHBondContact O-NE2 3.38Å
429	Q	94.5	Very high	96	Very high	121 Å²	121	23.8 Å²	23.8	57%	0.565	13%	0.125	S	C	*	.	S	Bend	trans	-68.4	-31.9	-175.3	-66.6	170.5	-25.3	0	0	113.9	S427 V445	S427-Q429 PolarHBondContact O-N 3.26Å; S427-Q429 VanDerWaalsContact O-N 3.08Å; Q429-V445 WeakPolarHBondContact O-CB 3.44Å; Q429-V445 PolarHBondContact O-N 2.95Å
430	W	95.8	Very high	95.9	Very high	41 Å²	41	23.8 Å²	23.8	16%	0.155	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	136	-173.8	-52.7	111.7	0	0	0	112	S425 G428 W443 E444 L451 W465 L489	S425-W430 WeakPolarHBondContact CB-O 3.35Å; S425-W430 PolarHBondContact N-O 2.9Å; G428-W430 PolarHBondContact O-N 3.25Å; W430-W443 WeakPolarHBondContact CA-O 3.46Å; W430-E444 HydrophobicContact CE3-CB 4.31Å; W430-E444 HydrophobicContact CZ3-CB 3.82Å; W430-E444 HydrophobicContact CZ3-CG 4.37Å; W430-L451 HydrophobicContact CE3-CD2 4.42Å; W430-L451 HydrophobicContact CH2-CD2 3.47Å; W430-L451 VanDerWaalsContact CH2-CD2 3.47Å; W430-L451 HydrophobicContact CZ2-CD2 4.37Å; W430-L451 HydrophobicContact CZ3-CB 4.4Å; W430-L451 HydrophobicContact CZ3-CD2 3.48Å; W430-L451 VanDerWaalsContact CZ3-CD2 3.48Å; W430-W465 HydrophobicContact CB-CZ2 4.1Å; W430-L489 HydrophobicContact CD2-CB 4.26Å; W430-L489 HydrophobicContact CD2-CD1 3.91Å; W430-L489 HydrophobicContact CE3-CD1 4Å; W430-L489 HydrophobicContact CG-CB 4.37Å; W430-L489 HydrophobicContact CG-CD1 4.25Å; W430-L489 HydrophobicContact CZ2-CB 4.38Å; W430-L489 HydrophobicContact CZ3-CD1 4.46Å; W430-L489 PolarHBondContact NE1-O 2.85Å
431	L	97.3	Very high	96	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	142.6	170.7	176.6	72	0	0	0	108.6	Y412 I422 V424 W443 V445 F739 I747	Y412-L431 HydrophobicContact CD1-CD2 4.4Å; Y412-L431 HydrophobicContact CD2-CD2 4.23Å; Y412-L431 HydrophobicContact CE1-CD2 4.18Å; Y412-L431 HydrophobicContact CE2-CD2 4.02Å; Y412-L431 HydrophobicContact CG-CD2 4.47Å; I422-L431 HydrophobicContact CB-CD1 4.35Å; V424-L431 HydrophobicContact CG2-CD1 3.85Å; L431-W443 HydrophobicContact CB-CB 4.36Å; L431-W443 PolarHBondContact N-O 3.43Å; L431-W443 PolarHBondContact O-N 3.04Å; L431-V445 HydrophobicContact CB-CG2 3.87Å; L431-F739 HydrophobicContact CD1-CB 4.36Å; L431-F739 HydrophobicContact CD1-CD1 4.07Å; L431-F739 HydrophobicContact CD1-CD2 4.47Å; L431-F739 HydrophobicContact CD1-CE1 4.46Å; L431-F739 HydrophobicContact CD1-CG 4.06Å; L431-F739 HydrophobicContact CD2-CD1 3.7Å; L431-F739 HydrophobicContact CD2-CE1 4.06Å; L431-F739 HydrophobicContact CD2-CG 4.42Å; L431-F739 HydrophobicContact CG-CD1 4.45Å; L431-I747 HydrophobicContact CD2-CD1 4.45Å; L431-I747 HydrophobicContact CD2-CG2 4.07Å
432	V	97.3	Very high	95.9	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	142.3	172.3	180	0	0	0	0	110.3	I422 S423 V440 R441 L442 V463 V474	I422-V432 CarbonylContact C-O 3.59Å; I422-V432 VanDerWaalsContact CA-O 3.3Å; I422-V432 WeakPolarHBondContact CA-O 3.13Å; S423-V432 PolarHBondContact N-O 2.96Å; S423-V432 PolarHBondContact O-N 3.14Å; V432-V440 HydrophobicContact CG1-CG1 3.56Å; V432-R441 VanDerWaalsContact CA-O 3.28Å; V432-R441 WeakPolarHBondContact CA-O 3.28Å; V432-L442 HydrophobicContact CG2-CB 4.32Å; V432-L442 HydrophobicContact CG2-CD2 3.42Å; V432-L442 VanDerWaalsContact CG2-CD2 3.42Å; V432-L442 HydrophobicContact CG2-CG 3.71Å; V432-V463 HydrophobicContact CB-CG1 4.46Å; V432-V463 HydrophobicContact CG1-CG1 3.81Å; V432-V474 HydrophobicContact CG1-CG1 4.34Å
433	S	97.9	Very high	95.9	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	147.1	176.5	55.1	0	0	0	0	112.4	H415 S421 V440 R441 W443 I747	H415-S433 PolarHBondContact NE2-OG 2.89Å; S421-S433 WeakPolarHBondContact O-CA 3.48Å; S433-V440 WeakPolarHBondContact O-CA 3.29Å; S433-R441 PolarHBondContact N-O 2.65Å; S433-R441 PolarHBondContact O-N 2.9Å; S433-W443 PolarHBondContact OG-NE1 3.26Å; S433-I747 VanDerWaalsContact CB-CD1 3.45Å
434	G	97.3	Very high	95.8	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	140	165.7	0	0	0	0	0	111	V419 R420 S421	V419-G434 CarbonylContact C-O 3.56Å; V419-G434 WeakPolarHBondContact CG1-O 3.45Å; R420-G434 PolarHBondContact N-O 3.42Å; S421-G434 PolarHBondContact O-N 2.9Å
435	S	97.3	Very high	95.7	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	162	-178.9	179.7	0	0	0	0	112.8	H415 G417 L418 D437 S439 V460	H415-S435 VanDerWaalsContact CE1-CB 3.4Å; H415-S435 WeakPolarHBondContact CE1-CB 3.49Å; H415-S435 WeakPolarHBondContact ND1-CB 3.27Å; G417-S435 PolarHBondContact O-OG 3.41Å; G417-S435 VanDerWaalsContact O-OG 3.13Å; L418-S435 WeakPolarHBondContact O-CA 3.12Å; L418-S435 WeakPolarHBondContact O-CB 3.15Å; L418-S435 PolarHBondContact O-OG 3Å; S435-D437 WeakPolarHBondContact CB-OD1 3.45Å; S435-D437 PolarHBondContact O-N 2.87Å; S435-D437 PolarHBondContact OG-N 2.67Å; S435-S439 PolarHBondContact N-O 3.43Å; S435-V460 PolarHBondContact O-N 2.85Å; S435-V460 VanDerWaalsContact O-N 3.1Å
436	D	95.5	Very high	95.7	Very high	47 Å²	47	26.9 Å²	26.9	25%	0.251	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-7.3	167.2	-72.5	-12.5	0	0	0	113.2	L418 R420 G438	L418-D436 PolarHBondContact O-N 2.99Å; R420-D436 WeakPolarHBondContact CD-OD1 3.41Å; R420-D436 IonicContact CZ-OD1 2.82Å; R420-D436 IonicContact CZ-OD2 3.97Å; R420-D436 VanDerWaalsContact CZ-OD2 3.3Å; R420-D436 VanDerWaalsContact NE-CG 3.3Å; R420-D436 IonicContact NE-OD1 3.25Å; R420-D436 PolarHBondContact NE-OD1 3.2Å; R420-D436 IonicContact NE-OD2 3.22Å; R420-D436 PolarHBondContact NE-OD2 2.97Å; R420-D436 VanDerWaalsContact NE-OD2 3.13Å; R420-D436 IonicContact NH2-OD1 2.67Å; R420-D436 IonicContact NH2-OD2 3.79Å; R420-D436 PolarHBondContact NH2-OD2 3.4Å; D436-G438 PolarHBondContact O-N 3.25Å
437	D	95.1	Very high	95.7	Very high	35 Å²	35	28.2 Å²	28.2	19%	0.187	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	5.9	171.7	77.2	-2.4	0	0	0	114.8	H415 S416 S435 S439 R441	H415-D437 VanDerWaalsContact CA-OD2 3.28Å; H415-D437 WeakPolarHBondContact CA-OD2 3.24Å; H415-D437 IonicContact CE1-OD1 3.98Å; H415-D437 IonicContact CE1-OD2 3.81Å; H415-D437 IonicContact CG-OD2 2.74Å; H415-D437 VanDerWaalsContact ND1-CG 3.32Å; H415-D437 IonicContact ND1-OD1 2.86Å; H415-D437 PolarHBondContact ND1-OD1 2.85Å; H415-D437 VanDerWaalsContact ND1-OD1 3.14Å; H415-D437 IonicContact ND1-OD2 3.67Å; H415-D437 PolarHBondContact ND1-OD2 2.87Å; S416-D437 PolarHBondContact N-OD2 2.84Å; S416-D437 VanDerWaalsContact OG-CB 3.27Å; S416-D437 WeakPolarHBondContact OG-CB 3.38Å; S435-D437 WeakPolarHBondContact CB-OD1 3.45Å; S435-D437 PolarHBondContact O-N 2.87Å; S435-D437 PolarHBondContact OG-N 2.67Å; D437-S439 VanDerWaalsContact CG-OG 3.25Å; D437-S439 PolarHBondContact O-N 2.95Å; D437-S439 WeakPolarHBondContact OD1-CA 3.34Å; D437-S439 VanDerWaalsContact OD1-CB 3.28Å; D437-S439 WeakPolarHBondContact OD1-CB 3.38Å; D437-S439 PolarHBondContact OD1-N 2.89Å; D437-S439 PolarHBondContact OD1-OG 3.47Å; D437-S439 PolarHBondContact OD2-OG 2.98Å; D437-R441 IonicContact OD2-CZ 3.74Å; D437-R441 IonicContact OD2-NE 3.89Å; D437-R441 IonicContact OD2-NH2 2.82Å; D437-R441 PolarHBondContact OD2-NH2 3.37Å
438	G	94.7	Very high	95.8	Very high	10 Å²	10	26.8 Å²	26.8	10%	0.103	15%	0.147	C	C	.	.	S	Bend	trans	77.6	3.1	-179.6	0	0	0	0	0	114.6	D436 Q455 V456	D436-G438 PolarHBondContact O-N 3.25Å; G438-Q455 PolarHBondContact O-OE1 2.72Å; G438-V456 WeakPolarHBondContact O-CG2 3.3Å; G438-V456 PolarHBondContact O-N 3.28Å
439	S	95.6	Very high	95.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	144.8	-177.2	80.1	0	0	0	0	113.9	H415 S435 D437 R441 V454 Q455	H415-S439 PolarHBondContact CE1-O 3.25Å; H415-S439 PolarHBondContact CE1-OG 2.85Å; H415-S439 VanDerWaalsContact CE1-OG 3.28Å; H415-S439 PolarHBondContact ND1-OG 3.28Å; S435-S439 PolarHBondContact N-O 3.43Å; D437-S439 VanDerWaalsContact CG-OG 3.25Å; D437-S439 PolarHBondContact O-N 2.95Å; D437-S439 WeakPolarHBondContact OD1-CA 3.34Å; D437-S439 VanDerWaalsContact OD1-CB 3.28Å; D437-S439 WeakPolarHBondContact OD1-CB 3.38Å; D437-S439 PolarHBondContact OD1-N 2.89Å; D437-S439 PolarHBondContact OD1-OG 3.47Å; D437-S439 PolarHBondContact OD2-OG 2.98Å; S439-R441 PolarHBondContact OG-NE 3.48Å; S439-V454 WeakPolarHBondContact CA-O 3.46Å; S439-Q455 VanDerWaalsContact CB-OE1 3.24Å
440	V	96.8	Very high	95.9	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.006	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	128.9	164	-179.7	0	0	0	0	107.6	V432 S433 V454 V456 V460 V476	V432-V440 HydrophobicContact CG1-CG1 3.56Å; S433-V440 WeakPolarHBondContact O-CA 3.29Å; V440-V454 HydrophobicContact CB-CB 4.44Å; V440-V454 PolarHBondContact N-O 2.81Å; V440-V454 PolarHBondContact O-N 3.45Å; V440-V456 HydrophobicContact CG2-CG1 4.04Å; V440-V456 HydrophobicContact CG2-CG2 4.14Å; V440-V460 HydrophobicContact CG2-CG1 4.4Å; V440-V460 HydrophobicContact CG2-CG2 3.93Å; V440-V476 HydrophobicContact CG1-CG2 4.14Å; V440-V476 HydrophobicContact CG2-CB 4.42Å; V440-V476 HydrophobicContact CG2-CG1 3.57Å; V440-V476 HydrophobicContact CG2-CG2 3.93Å
441	R	96.6	Very high	95.7	Very high	37 Å²	37	32.8 Å²	32.8	14%	0.14	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	135.7	-176.4	-65.2	-174.9	-164	-153.4	19.6	112	G414 H415 V432 S433 D437 S439 W443 T453	G414-R441 PolarHBondContact O-NH1 2.86Å; G414-R441 PolarHBondContact O-NH2 3.28Å; H415-R441 VanDerWaalsContact CE1-CD 3.48Å; H415-R441 WeakPolarHBondContact CE1-CD 3.49Å; H415-R441 PolarHBondContact CE1-NE 3.29Å; H415-R441 PolarHBondContact ND1-NE 2.91Å; V432-R441 VanDerWaalsContact CA-O 3.28Å; V432-R441 WeakPolarHBondContact CA-O 3.28Å; S433-R441 PolarHBondContact N-O 2.65Å; S433-R441 PolarHBondContact O-N 2.9Å; D437-R441 IonicContact OD2-CZ 3.74Å; D437-R441 IonicContact OD2-NE 3.89Å; D437-R441 IonicContact OD2-NH2 2.82Å; D437-R441 PolarHBondContact OD2-NH2 3.37Å; S439-R441 PolarHBondContact OG-NE 3.48Å; R441-W443 HydrophobicContact CB-CZ2 3.81Å; R441-W443 HydrophobicContact CG-CZ2 4.43Å; R441-W443 PolarHBondContact O-NE1 3.47Å; R441-T453 HydrophobicContact CG-CG2 4Å
442	L	96.3	Very high	95.5	Very high	5 Å²	5	35.8 Å²	35.8	3%	0.026	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	123.1	178.4	-62.4	115.7	0	0	0	109	V432 L451 K452 V454 P487 L489	V432-L442 HydrophobicContact CG2-CB 4.32Å; V432-L442 HydrophobicContact CG2-CD2 3.42Å; V432-L442 VanDerWaalsContact CG2-CD2 3.42Å; V432-L442 HydrophobicContact CG2-CG 3.71Å; L442-L451 PolarHBondContact O-N 3.03Å; L442-K452 HydrophobicContact CB-CB 4.38Å; L442-K452 HydrophobicContact CD1-CB 3.85Å; L442-K452 HydrophobicContact CD1-CD 4.21Å; L442-K452 HydrophobicContact CD1-CG 4.22Å; L442-K452 PolarHBondContact N-O 3.29Å; L442-K452 PolarHBondContact O-N 2.97Å; L442-V454 HydrophobicContact CD1-CG2 4.44Å; L442-P487 HydrophobicContact CD1-CB 4.36Å; L442-P487 HydrophobicContact CD2-CB 3.48Å; L442-P487 VanDerWaalsContact CD2-CB 3.48Å; L442-P487 HydrophobicContact CD2-CG 4.11Å; L442-L489 HydrophobicContact CB-CD1 3.96Å; L442-L489 HydrophobicContact CD2-CD1 3.65Å; L442-L489 HydrophobicContact CG-CD1 4.38Å
443	W	97.2	Very high	95.3	Very high	3 Å²	3	38.4 Å²	38.4	1%	0.011	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	139.6	-172.2	-46.9	83.1	0	0	0	111.1	Y412 R413 H415 W430 L431 S433 R441 R449 C450 I747	Y412-W443 HydrophobicContact CD1-CB 3.8Å; Y412-W443 HydrophobicContact CD1-CD2 4.02Å; Y412-W443 AromaticContact CD1-CE3 3.92Å; Y412-W443 HydrophobicContact CD1-CE3 3.92Å; Y412-W443 AromaticContact CD1-CG 4Å; Y412-W443 HydrophobicContact CD1-CG 4Å; Y412-W443 HydrophobicContact CE1-CB 4.11Å; Y412-W443 HydrophobicContact CG-CD2 4.43Å; Y412-W443 HydrophobicContact CG-CE3 4.35Å; R413-W443 WeakPolarHBondContact O-CH2 3.41Å; R413-W443 WeakPolarHBondContact O-CZ3 3.28Å; H415-W443 AromaticContact CD2-CZ2 3.89Å; W430-W443 WeakPolarHBondContact CA-O 3.46Å; L431-W443 HydrophobicContact CB-CB 4.36Å; L431-W443 PolarHBondContact N-O 3.43Å; L431-W443 PolarHBondContact O-N 3.04Å; S433-W443 PolarHBondContact OG-NE1 3.26Å; R441-W443 HydrophobicContact CB-CZ2 3.81Å; R441-W443 HydrophobicContact CG-CZ2 4.43Å; R441-W443 PolarHBondContact O-NE1 3.47Å; W443-R449 WeakPolarHBondContact CA-O 3.37Å; W443-C450 HydrophobicContact CD2-CB 4.29Å; W443-C450 HydrophobicContact CE3-CB 3.65Å; W443-C450 HydrophobicContact CH2-CB 4.19Å; W443-C450 HydrophobicContact CZ3-CB 3.61Å; W443-I747 HydrophobicContact CZ2-CD1 4.33Å
444	E	96	Very high	95.2	Very high	77 Å²	77	38.5 Å²	38.5	36%	0.36	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	123.2	165.1	-179.5	177.6	-153.1	0	0	109.2	W430 C446 S447 S448 R449	W430-E444 HydrophobicContact CE3-CB 4.31Å; W430-E444 HydrophobicContact CZ3-CB 3.82Å; W430-E444 HydrophobicContact CZ3-CG 4.37Å; E444-C446 PolarHBondContact O-N 3.37Å; E444-S447 WeakPolarHBondContact CB-OG 3.48Å; E444-S447 VanDerWaalsContact CD-OG 3.24Å; E444-S447 WeakPolarHBondContact CG-OG 3.11Å; E444-S447 VanDerWaalsContact OE2-CB 3.3Å; E444-S447 WeakPolarHBondContact OE2-CB 3.43Å; E444-S447 PolarHBondContact OE2-OG 2.9Å; E444-S448 WeakPolarHBondContact O-CA 3.27Å; E444-S448 PolarHBondContact O-N 2.94Å; E444-S448 VanDerWaalsContact O-N 3.1Å; E444-R449 PolarHBondContact N-O 2.96Å
445	V	95.8	Very high	95	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.006	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-47.6	-173.7	161.8	0	0	0	0	111.9	L410 Y412 G428 Q429 L431 S447 W737 F739	L410-V445 VanDerWaalsContact CD1-O 3.32Å; L410-V445 WeakPolarHBondContact CD1-O 3.35Å; Y412-V445 PolarHBondContact OH-O 3.42Å; G428-V445 VanDerWaalsContact O-CG2 3.31Å; G428-V445 WeakPolarHBondContact O-CG2 3.35Å; Q429-V445 WeakPolarHBondContact O-CB 3.44Å; Q429-V445 PolarHBondContact O-N 2.95Å; L431-V445 HydrophobicContact CB-CG2 3.87Å; V445-S447 PolarHBondContact O-N 3.38Å; V445-W737 HydrophobicContact CG1-CZ3 4.27Å; V445-F739 HydrophobicContact CB-CE1 4.49Å; V445-F739 HydrophobicContact CB-CZ 4.35Å; V445-F739 HydrophobicContact CG1-CE1 3.96Å; V445-F739 HydrophobicContact CG1-CZ 3.69Å; V445-F739 HydrophobicContact CG2-CE1 3.88Å; V445-F739 HydrophobicContact CG2-CZ 3.68Å
446	C	93.2	Very high	94.6	Very high	97 Å²	97	44.2 Å²	44.2	66%	0.655	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-23.3	-170.8	-59.5	0	0	0	0	114.8	L410 E444	L410-C446 WeakPolarHBondContact CD1-O 3.44Å; E444-C446 PolarHBondContact O-N 3.37Å
447	S	93.3	Very high	94.2	Very high	52 Å²	52	45.9 Å²	45.9	36%	0.364	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-13.5	-176.9	71.8	0	0	0	0	113.6	E444 V445 R449	E444-S447 WeakPolarHBondContact CB-OG 3.48Å; E444-S447 VanDerWaalsContact CD-OG 3.24Å; E444-S447 WeakPolarHBondContact CG-OG 3.11Å; E444-S447 VanDerWaalsContact OE2-CB 3.3Å; E444-S447 WeakPolarHBondContact OE2-CB 3.43Å; E444-S447 PolarHBondContact OE2-OG 2.9Å; V445-S447 PolarHBondContact O-N 3.38Å; S447-R449 PolarHBondContact O-N 3.28Å; S447-R449 WeakPolarHBondContact OG-CB 3.23Å; S447-R449 PolarHBondContact OG-N 2.97Å; S447-R449 VanDerWaalsContact OG-N 3.11Å
448	S	94.6	Very high	94	Very high	34 Å²	34	44.7 Å²	44.7	24%	0.238	26%	0.258	C	S	.	.			trans	59.3	12.3	-166.3	69	0	0	0	0	116.3	Y412 E444 C450	Y412-S448 VanDerWaalsContact CE1-CA 3.47Å; E444-S448 WeakPolarHBondContact O-CA 3.27Å; E444-S448 PolarHBondContact O-N 2.94Å; E444-S448 VanDerWaalsContact O-N 3.1Å; S448-C450 PolarHBondContact O-N 2.83Å
449	R	95.1	Very high	94	Very high	166 Å²	166	45.9 Å²	45.9	63%	0.626	27%	0.266	S	S	*	.			trans	-70	127.6	177.7	-177.9	178.2	178.5	176.5	1.3	111.4	W443 E444 S447 L451	W443-R449 WeakPolarHBondContact CA-O 3.37Å; E444-R449 PolarHBondContact N-O 2.96Å; S447-R449 PolarHBondContact O-N 3.28Å; S447-R449 WeakPolarHBondContact OG-CB 3.23Å; S447-R449 PolarHBondContact OG-N 2.97Å; S447-R449 VanDerWaalsContact OG-N 3.11Å; R449-L451 PolarHBondContact O-N 3.44Å
450	C	95.3	Very high	94.1	Very high	43 Å²	43	45.9 Å²	45.9	29%	0.291	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	119.3	162.2	-168.2	0	0	0	0	108.8	W443 S448	W443-C450 HydrophobicContact CD2-CB 4.29Å; W443-C450 HydrophobicContact CE3-CB 3.65Å; W443-C450 HydrophobicContact CH2-CB 4.19Å; W443-C450 HydrophobicContact CZ3-CB 3.61Å; S448-C450 PolarHBondContact O-N 2.83Å
451	L	92.3	Very high	94	Very high	81 Å²	81	48.3 Å²	48.3	42%	0.424	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-39.5	179.9	179	60.1	0	0	0	111.9	W430 L442 R449 L489	W430-L451 HydrophobicContact CE3-CD2 4.42Å; W430-L451 HydrophobicContact CH2-CD2 3.47Å; W430-L451 VanDerWaalsContact CH2-CD2 3.47Å; W430-L451 HydrophobicContact CZ2-CD2 4.37Å; W430-L451 HydrophobicContact CZ3-CB 4.4Å; W430-L451 HydrophobicContact CZ3-CD2 3.48Å; W430-L451 VanDerWaalsContact CZ3-CD2 3.48Å; L442-L451 PolarHBondContact O-N 3.03Å; R449-L451 PolarHBondContact O-N 3.44Å; L451-L489 HydrophobicContact CD2-CD1 4.25Å; L451-L489 HydrophobicContact CD2-CD2 3.57Å
452	K	91.9	Very high	94	Very high	62 Å²	62	47 Å²	47	27%	0.27	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	134.8	179.8	-169	-179.4	-164.9	-175.8	0	110.4	L442 V454 Q529	L442-K452 HydrophobicContact CB-CB 4.38Å; L442-K452 HydrophobicContact CD1-CB 3.85Å; L442-K452 HydrophobicContact CD1-CD 4.21Å; L442-K452 HydrophobicContact CD1-CG 4.22Å; L442-K452 PolarHBondContact N-O 3.29Å; L442-K452 PolarHBondContact O-N 2.97Å; K452-V454 HydrophobicContact CD-CG2 4.25Å; K452-V454 HydrophobicContact CG-CG2 4.35Å; K452-Q529 VanDerWaalsContact CE-O 3.3Å; K452-Q529 WeakPolarHBondContact CE-O 3.45Å; K452-Q529 PolarHBondContact NZ-O 3.02Å
453	T	94.4	Very high	94.1	Very high	55 Å²	55	47 Å²	47	34%	0.337	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	132.5	167.2	-57.5	0	0	0	0	107.6	R441	R441-T453 HydrophobicContact CG-CG2 4Å
454	V	94.1	Very high	94.1	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.012	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	126.7	172.3	174.5	0	0	0	0	107.1	S439 V440 L442 K452 V456 L485 Q529 I531	S439-V454 WeakPolarHBondContact CA-O 3.46Å; V440-V454 HydrophobicContact CB-CB 4.44Å; V440-V454 PolarHBondContact N-O 2.81Å; V440-V454 PolarHBondContact O-N 3.45Å; L442-V454 HydrophobicContact CD1-CG2 4.44Å; K452-V454 HydrophobicContact CD-CG2 4.25Å; K452-V454 HydrophobicContact CG-CG2 4.35Å; V454-V456 HydrophobicContact CG1-CG1 3.91Å; V454-L485 HydrophobicContact CB-CD2 4.31Å; V454-L485 HydrophobicContact CG1-CD2 3.89Å; V454-L485 HydrophobicContact CG2-CD2 4.27Å; V454-Q529 HydrophobicContact CG1-CB 4.08Å; V454-Q529 WeakPolarHBondContact CG2-O 3.35Å; V454-I531 HydrophobicContact CG1-CD1 4.13Å; V454-I531 HydrophobicContact CG1-CG1 4.13Å
455	Q	93.3	Very high	94.1	Very high	102 Å²	102	44.4 Å²	44.4	48%	0.477	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	123.7	177.6	-62	-64.9	5.2	0	0	109	G438 S439 Q529	G438-Q455 PolarHBondContact O-OE1 2.72Å; S439-Q455 VanDerWaalsContact CB-OE1 3.24Å; Q455-Q529 PolarHBondContact O-OE1 3.02Å
456	V	90.6	Very high	94.1	Very high	18 Å²	18	44.3 Å²	44.3	11%	0.109	26%	0.263	C	S	.	.			trans	-117.6	7	-174.9	-58.8	0	0	0	0	113.4	G438 V440 V454 G458 V460 V478 L483 I531	G438-V456 WeakPolarHBondContact O-CG2 3.3Å; G438-V456 PolarHBondContact O-N 3.28Å; V440-V456 HydrophobicContact CG2-CG1 4.04Å; V440-V456 HydrophobicContact CG2-CG2 4.14Å; V454-V456 HydrophobicContact CG1-CG1 3.91Å; V456-G458 PolarHBondContact O-N 3.26Å; V456-V460 HydrophobicContact CG2-CG2 3.56Å; V456-V478 HydrophobicContact CB-CG2 3.93Å; V456-V478 HydrophobicContact CG2-CG1 4.38Å; V456-V478 HydrophobicContact CG2-CG2 3.57Å; V456-L483 HydrophobicContact CB-CD1 3.98Å; V456-L483 HydrophobicContact CG1-CD1 3.89Å; V456-I531 HydrophobicContact CG1-CD1 4.3Å
457	G	86	Confident	94.2	Very high	83 Å²	83	40.9 Å²	40.9	86%	0.856	24%	0.239	S	C	*	.	S	Bend	trans	75.7	-11.1	166.5	0	0	0	0	0	116.9
458	G	91.6	Very high	94.1	Very high	10 Å²	10	40.2 Å²	40.2	10%	0.103	23%	0.232	C	C	.	.	S	Bend	trans	-146.7	167.3	-179	0	0	0	0	0	112.9	V456 V460	V456-G458 PolarHBondContact O-N 3.26Å; G458-V460 PolarHBondContact O-N 2.91Å
459	A	94.8	Very high	94	Very high	34 Å²	34	43.3 Å²	43.3	28%	0.281	25%	0.251	S	S	.	.			trans	-66.4	121.7	-173.4	0	0	0	0	0	112.3	K461	A459-K461 PolarHBondContact O-N 2.93Å
460	V	96.8	Very high	93.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	108.3	-174.4	-174	0	0	0	0	110.7	R420 S435 V440 V456 G458 V463 V476 V478	R420-V460 WeakPolarHBondContact CB-O 3.46Å; S435-V460 PolarHBondContact O-N 2.85Å; S435-V460 VanDerWaalsContact O-N 3.1Å; V440-V460 HydrophobicContact CG2-CG1 4.4Å; V440-V460 HydrophobicContact CG2-CG2 3.93Å; V456-V460 HydrophobicContact CG2-CG2 3.56Å; G458-V460 PolarHBondContact O-N 2.91Å; V460-V463 HydrophobicContact CG1-CG2 3.52Å; V460-V476 HydrophobicContact CG1-CG1 3.63Å; V460-V476 HydrophobicContact CG2-CG1 4.36Å; V460-V478 HydrophobicContact CG2-CG2 4.48Å
461	K	95.3	Very high	93.7	Very high	52 Å²	52	37 Å²	37	23%	0.226	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	-39.7	-175.5	-67.5	-178.5	178.6	178.7	0	114.3	A459 T477 V541 H542	A459-K461 PolarHBondContact O-N 2.93Å; K461-T477 PolarHBondContact N-O 3.1Å; K461-V541 WeakPolarHBondContact CD-O 3.46Å; K461-H542 PolarHBondContact NZ-CE1 3.07Å; K461-H542 PolarHBondContact NZ-NE2 3.38Å
462	S	97	Very high	93.7	Very high	10 Å²	10	33.2 Å²	33.2	7%	0.07	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	141.4	-175.2	-179.5	0	0	0	0	110.6	T477 H542 V544	S462-T477 PolarHBondContact N-OG1 2.81Å; S462-T477 PolarHBondContact O-N 2.81Å; S462-T477 PolarHBondContact O-OG1 2.84Å; S462-H542 WeakPolarHBondContact CB-O 3.31Å; S462-V544 PolarHBondContact OG-N 3.17Å; S462-V544 VanDerWaalsContact OG-N 3.16Å
463	V	97.5	Very high	93.9	Very high	5 Å²	5	30.3 Å²	30.3	3%	0.03	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	135.6	175.5	-175.3	0	0	0	0	109.6	S421 S423 V432 V460 V474 A475 V476	S421-V463 PolarHBondContact OG-N 2.92Å; S423-V463 WeakPolarHBondContact CB-O 3.22Å; V432-V463 HydrophobicContact CB-CG1 4.46Å; V432-V463 HydrophobicContact CG1-CG1 3.81Å; V460-V463 HydrophobicContact CG1-CG2 3.52Å; V463-V474 HydrophobicContact CG1-CG1 3.49Å; V463-V474 VanDerWaalsContact CG1-CG1 3.49Å; V463-A475 CarbonylContact C-O 3.51Å; V463-A475 WeakPolarHBondContact CA-O 3.3Å; V463-V476 HydrophobicContact CG1-CG2 3.97Å; V463-V476 HydrophobicContact CG2-CG1 4.48Å; V463-V476 HydrophobicContact CG2-CG2 4.2Å
464	A	97.4	Very high	94	Very high	12 Å²	12	27.8 Å²	27.8	10%	0.099	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	122.6	176.5	0	0	0	0	0	111.9	A475 V544 W546	A464-A475 PolarHBondContact N-O 2.96Å; A464-A475 PolarHBondContact O-N 2.85Å; A464-V544 HydrophobicContact CB-CG1 4.04Å; A464-W546 PolarHBondContact O-NE1 3.35Å
465	W	96.6	Very high	94.1	Very high	13 Å²	13	27.7 Å²	27.7	5%	0.049	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	142.5	164.5	-98.7	85.7	0	0	0	110.9	S423 S425 W430 V474 P487	S423-W465 PolarHBondContact OG-N 2.88Å; S425-W465 WeakPolarHBondContact OG-CH2 3.42Å; S425-W465 WeakPolarHBondContact OG-CZ3 3.41Å; W430-W465 HydrophobicContact CB-CZ2 4.1Å; W465-V474 HydrophobicContact CD2-CG2 3.89Å; W465-V474 HydrophobicContact CG-CG2 4.09Å; W465-V474 HydrophobicContact CZ2-CG2 4.23Å; W465-P487 HydrophobicContact CH2-CG 4.49Å
466	N	95.8	Very high	94.3	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	16%	0.16	C	C	.	.			trans	-61.6	126.2	167.8	-168.5	-45	0	0	0	109.1	P426 N468 L473 W546 G550	P426-N466 WeakPolarHBondContact CD-O 3.24Å; P426-N466 WeakPolarHBondContact CG-O 3.41Å; N466-N468 VanDerWaalsContact C-N 3.27Å; N466-N468 PolarHBondContact O-N 3.28Å; N466-N468 WeakPolarHBondContact OD1-CB 3.48Å; N466-N468 PolarHBondContact OD1-N 3.23Å; N466-N468 VanDerWaalsContact OD1-N 3.14Å; N466-L473 HydrophobicContact CB-CB 4.01Å; N466-L473 VanDerWaalsContact CB-O 3.32Å; N466-L473 WeakPolarHBondContact CB-O 3.49Å; N466-L473 PolarHBondContact N-O 3.39Å; N466-W546 HydrophobicContact CB-CD2 4.3Å; N466-W546 HydrophobicContact CB-CZ2 4.17Å; N466-W546 WeakPolarHBondContact ND2-CZ3 3.27Å; N466-G550 PolarHBondContact ND2-O 3.25Å; N466-G550 WeakPolarHBondContact OD1-CA 3.45Å
467	P	93.7	Very high	94.6	Very high	24 Å²	24	22 Å²	22	16%	0.156	16%	0.155	C	C	.	.	S	Bend	trans	-76.2	-12.9	-173	29.5	-36.4	0	0	0	113.7	W546 H547	P467-W546 HydrophobicContact CG-CB 3.88Å; P467-H547 VanDerWaalsContact CG-O 3.3Å; P467-H547 WeakPolarHBondContact CG-O 3.19Å
468	N	93	Very high	95	Very high	39 Å²	39	18.7 Å²	18.7	21%	0.209	12%	0.118	C	C	.	.			trans	-82.2	118.6	-178.8	179.4	-3.1	0	0	0	110.6	N466 S470 L471 K549	N466-N468 VanDerWaalsContact C-N 3.27Å; N466-N468 PolarHBondContact O-N 3.28Å; N466-N468 WeakPolarHBondContact OD1-CB 3.48Å; N466-N468 PolarHBondContact OD1-N 3.23Å; N466-N468 VanDerWaalsContact OD1-N 3.14Å; N468-S470 PolarHBondContact ND2-OG 2.89Å; N468-S470 PolarHBondContact O-N 3.12Å; N468-S470 VanDerWaalsContact O-N 3.14Å; N468-S470 PolarHBondContact OD1-N 3.23Å; N468-S470 PolarHBondContact OD1-OG 3.02Å; N468-S470 VanDerWaalsContact OD1-OG 3.13Å; N468-L471 HydrophobicContact CB-CD1 4.35Å; N468-L471 PolarHBondContact O-N 3.11Å; N468-K549 PolarHBondContact ND2-O 3.48Å; N468-K549 VanDerWaalsContact ND2-O 3.14Å
469	P	91.3	Very high	95.1	Very high	99 Å²	99	22 Å²	22	64%	0.643	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-13.2	-178.5	29	-36.7	0	0	0	114.4	P426 L471	P426-P469 HydrophobicContact CB-CB 4.1Å; P469-L471 PolarHBondContact O-N 3.12Å
470	S	91.6	Very high	95	Very high	60 Å²	60	22.3 Å²	22.3	42%	0.42	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	1.8	172.6	82.5	0	0	0	0	113.6	N468	N468-S470 PolarHBondContact ND2-OG 2.89Å; N468-S470 PolarHBondContact O-N 3.12Å; N468-S470 VanDerWaalsContact O-N 3.14Å; N468-S470 PolarHBondContact OD1-N 3.23Å; N468-S470 PolarHBondContact OD1-OG 3.02Å; N468-S470 VanDerWaalsContact OD1-OG 3.13Å
471	L	92.1	Very high	95	Very high	17 Å²	17	22.6 Å²	22.6	9%	0.089	14%	0.136	C	C	.	.			trans	-131.9	141.4	-178.3	-62.1	172.6	0	0	0	110.9	N468 P469 S498 L501	N468-L471 HydrophobicContact CB-CD1 4.35Å; N468-L471 PolarHBondContact O-N 3.11Å; P469-L471 PolarHBondContact O-N 3.12Å; L471-S498 WeakPolarHBondContact CA-OG 3.35Å; L471-L501 HydrophobicContact CD1-CD2 3.66Å; L471-L501 HydrophobicContact CD2-CB 4.48Å; L471-L501 HydrophobicContact CD2-CD2 3.91Å; L471-L501 HydrophobicContact CG-CD2 4.47Å
472	C	93.3	Very high	95	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.007	13%	0.125	C	C	.	.			trans	-117.1	77.6	174.9	-171.7	0	0	0	0	108.3	P487 A490 V494 S498	C472-P487 WeakPolarHBondContact O-CD 3.25Å; C472-A490 HydrophobicContact CB-CB 3.71Å; C472-V494 HydrophobicContact CB-CG1 3.84Å; C472-S498 PolarHBondContact N-OG 2.78Å
473	L	95	Very high	95	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.124	C	C	.	.			trans	-132.5	143.6	-177.5	-64.9	176.1	0	0	0	110.5	N466 I484 L485 L501 L502 L571	N466-L473 HydrophobicContact CB-CB 4.01Å; N466-L473 VanDerWaalsContact CB-O 3.32Å; N466-L473 WeakPolarHBondContact CB-O 3.49Å; N466-L473 PolarHBondContact N-O 3.39Å; L473-I484 HydrophobicContact CD2-CG2 4.32Å; L473-L485 WeakPolarHBondContact CA-O 3.35Å; L473-L501 HydrophobicContact CD1-CD2 4.16Å; L473-L502 HydrophobicContact CD1-CD2 4.42Å; L473-L502 HydrophobicContact CD2-CD1 3.71Å; L473-L502 HydrophobicContact CD2-CD2 4.34Å; L473-L502 HydrophobicContact CD2-CG 4.19Å; L473-L571 HydrophobicContact CD1-CD2 3.78Å
474	V	96.4	Very high	94.9	Very high	3 Å²	3	19.8 Å²	19.8	2%	0.018	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	131	175.7	-174	0	0	0	0	108.9	V432 V463 W465 V476 L485 P487	V432-V474 HydrophobicContact CG1-CG1 4.34Å; V463-V474 HydrophobicContact CG1-CG1 3.49Å; V463-V474 VanDerWaalsContact CG1-CG1 3.49Å; W465-V474 HydrophobicContact CD2-CG2 3.89Å; W465-V474 HydrophobicContact CG-CG2 4.09Å; W465-V474 HydrophobicContact CZ2-CG2 4.23Å; V474-V476 HydrophobicContact CG1-CG2 4.14Å; V474-L485 PolarHBondContact N-O 2.89Å; V474-L485 PolarHBondContact O-N 2.88Å; V474-P487 HydrophobicContact CG2-CG 4.16Å
475	A	97.3	Very high	94.7	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	135.5	169.9	0	0	0	0	0	110	V463 A464 V482 L483 I484 V544 W546	V463-A475 CarbonylContact C-O 3.51Å; V463-A475 WeakPolarHBondContact CA-O 3.3Å; A464-A475 PolarHBondContact N-O 2.96Å; A464-A475 PolarHBondContact O-N 2.85Å; A475-V482 HydrophobicContact CB-CG1 4.23Å; A475-L483 WeakPolarHBondContact CA-O 3.45Å; A475-I484 HydrophobicContact CB-CD1 3.87Å; A475-V544 HydrophobicContact CB-CG1 4.09Å; A475-V544 HydrophobicContact CB-CG2 3.74Å; A475-W546 HydrophobicContact CB-CZ2 3.79Å
476	V	97.4	Very high	94.5	Very high	0 Å²	0	19 Å²	19	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	130.4	-176	172.6	0	0	0	0	108.6	V440 V460 V463 V474 V478 V482 L483 L485	V440-V476 HydrophobicContact CG1-CG2 4.14Å; V440-V476 HydrophobicContact CG2-CB 4.42Å; V440-V476 HydrophobicContact CG2-CG1 3.57Å; V440-V476 HydrophobicContact CG2-CG2 3.93Å; V460-V476 HydrophobicContact CG1-CG1 3.63Å; V460-V476 HydrophobicContact CG2-CG1 4.36Å; V463-V476 HydrophobicContact CG1-CG2 3.97Å; V463-V476 HydrophobicContact CG2-CG1 4.48Å; V463-V476 HydrophobicContact CG2-CG2 4.2Å; V474-V476 HydrophobicContact CG1-CG2 4.14Å; V476-V478 HydrophobicContact CG1-CG2 3.82Å; V476-V482 CarbonylContact O-C 3.57Å; V476-V482 WeakPolarHBondContact O-CA 3.4Å; V476-L483 HydrophobicContact CB-CB 4.42Å; V476-L483 PolarHBondContact N-O 2.9Å; V476-L483 PolarHBondContact O-N 2.81Å; V476-L485 HydrophobicContact CB-CD1 3.9Å; V476-L485 HydrophobicContact CG2-CD1 3.52Å
477	T	96.9	Very high	94.1	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	121.4	176.4	69.5	0	0	0	0	111.1	K461 S462 A481 V482 V541 V544	K461-T477 PolarHBondContact N-O 3.1Å; S462-T477 PolarHBondContact N-OG1 2.81Å; S462-T477 PolarHBondContact O-N 2.81Å; S462-T477 PolarHBondContact O-OG1 2.84Å; T477-A481 WeakPolarHBondContact CA-O 3.38Å; T477-V482 HydrophobicContact CG2-CG2 4.33Å; T477-V541 HydrophobicContact CG2-CB 4.34Å; T477-V541 HydrophobicContact CG2-CG1 3.73Å; T477-V544 HydrophobicContact CG2-CB 3.62Å; T477-V544 HydrophobicContact CG2-CG1 3.68Å
478	V	94.9	Very high	93.7	Very high	13 Å²	13	20.9 Å²	20.9	8%	0.079	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	117.9	178.7	-170.9	0	0	0	0	108	V456 V460 V476 S480 A481 L483	V456-V478 HydrophobicContact CB-CG2 3.93Å; V456-V478 HydrophobicContact CG2-CG1 4.38Å; V456-V478 HydrophobicContact CG2-CG2 3.57Å; V460-V478 HydrophobicContact CG2-CG2 4.48Å; V476-V478 HydrophobicContact CG1-CG2 3.82Å; V478-S480 PolarHBondContact O-N 2.95Å; V478-A481 PolarHBondContact N-O 2.92Å; V478-A481 PolarHBondContact O-N 2.86Å; V478-L483 HydrophobicContact CG2-CD1 3.85Å; V478-L483 HydrophobicContact CG2-CG 4.43Å
479	D	92.8	Very high	93.3	Very high	81 Å²	81	20.5 Å²	20.5	43%	0.433	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	43.1	-110.9	-174.8	-62.3	-51.6	0	0	0	113	P540 V541	D479-P540 CarbonylContact O-C 3.54Å; D479-P540 WeakPolarHBondContact O-CA 3.14Å; D479-V541 PolarHBondContact O-N 3.12Å
480	S	93.9	Very high	93	Very high	39 Å²	39	17.6 Å²	17.6	27%	0.273	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	23.8	178.3	58.6	0	0	0	0	114.2	V478 Q536 H537	V478-S480 PolarHBondContact O-N 2.95Å; S480-Q536 PolarHBondContact O-NE2 2.86Å; S480-Q536 PolarHBondContact OG-NE2 2.89Å; S480-H537 WeakPolarHBondContact O-CA 3.23Å; S480-H537 VanDerWaalsContact O-CB 3.27Å; S480-H537 WeakPolarHBondContact O-CB 3.42Å; S480-H537 PolarHBondContact O-N 3.21Å
481	A	95.1	Very high	92.8	Very high	7 Å²	7	20.7 Å²	20.7	6%	0.058	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	150.7	178.6	0	0	0	0	0	112.9	T477 V478 K534 I535	T477-A481 WeakPolarHBondContact CA-O 3.38Å; V478-A481 PolarHBondContact N-O 2.92Å; V478-A481 PolarHBondContact O-N 2.86Å; A481-K534 HydrophobicContact CB-CG 4.24Å; A481-I535 CarbonylContact C-O 3.48Å; A481-I535 VanDerWaalsContact CA-O 3.3Å; A481-I535 WeakPolarHBondContact CA-O 3.38Å
482	V	96.6	Very high	92.7	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	118.4	162.4	-172.4	0	0	0	0	108.3	A475 V476 T477 I484 I535 V541 V544 L553	A475-V482 HydrophobicContact CB-CG1 4.23Å; V476-V482 CarbonylContact O-C 3.57Å; V476-V482 WeakPolarHBondContact O-CA 3.4Å; T477-V482 HydrophobicContact CG2-CG2 4.33Å; V482-I484 HydrophobicContact CG1-CD1 4.34Å; V482-I535 HydrophobicContact CB-CB 4.26Å; V482-I535 PolarHBondContact N-O 2.81Å; V482-I535 PolarHBondContact O-N 3.45Å; V482-V541 HydrophobicContact CG2-CB 4.43Å; V482-V541 HydrophobicContact CG2-CG1 4.03Å; V482-V541 HydrophobicContact CG2-CG2 4.18Å; V482-V544 HydrophobicContact CG1-CG2 4.22Å; V482-L553 HydrophobicContact CG1-CD1 4.3Å
483	L	95.7	Very high	92.6	Very high	8 Å²	8	36.3 Å²	36.3	4%	0.042	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	133.6	176	-56.7	178.8	0	0	0	109.1	V456 A475 V476 V478 L485 I531 K534	V456-L483 HydrophobicContact CB-CD1 3.98Å; V456-L483 HydrophobicContact CG1-CD1 3.89Å; A475-L483 WeakPolarHBondContact CA-O 3.45Å; V476-L483 HydrophobicContact CB-CB 4.42Å; V476-L483 PolarHBondContact N-O 2.9Å; V476-L483 PolarHBondContact O-N 2.81Å; V478-L483 HydrophobicContact CG2-CD1 3.85Å; V478-L483 HydrophobicContact CG2-CG 4.43Å; L483-L485 HydrophobicContact CB-CD1 3.95Å; L483-I531 HydrophobicContact CB-CG2 4.17Å; L483-I531 HydrophobicContact CD1-CD1 4.4Å; L483-I531 HydrophobicContact CD2-CG2 4.27Å; L483-K534 HydrophobicContact CD2-CB 3.82Å; L483-K534 HydrophobicContact CD2-CD 4.15Å; L483-K534 HydrophobicContact CD2-CG 3.82Å
484	I	95.8	Very high	92.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	119.7	171.1	-51.7	-59.5	0	0	0	108.2	L473 A475 V482 L502 R532 L533 I535 W546 L553 L571	L473-I484 HydrophobicContact CD2-CG2 4.32Å; A475-I484 HydrophobicContact CB-CD1 3.87Å; V482-I484 HydrophobicContact CG1-CD1 4.34Å; I484-L502 HydrophobicContact CG2-CD2 3.93Å; I484-R532 PolarHBondContact O-N 3.33Å; I484-L533 HydrophobicContact CB-CB 4.17Å; I484-L533 HydrophobicContact CG1-CB 4.26Å; I484-L533 PolarHBondContact N-O 2.8Å; I484-L533 PolarHBondContact O-N 3Å; I484-I535 HydrophobicContact CG1-CD1 4.47Å; I484-W546 HydrophobicContact CD1-CH2 4.41Å; I484-W546 HydrophobicContact CD1-CZ2 4.42Å; I484-L553 HydrophobicContact CD1-CD2 4.3Å; I484-L571 HydrophobicContact CG2-CD2 4.46Å
485	L	93.8	Very high	92.2	Very high	6 Å²	6	39.5 Å²	39.5	3%	0.031	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	137.9	-178.4	-62.5	81.7	0	0	0	110.8	V454 L473 V474 V476 L483 P487 G530 I531	V454-L485 HydrophobicContact CB-CD2 4.31Å; V454-L485 HydrophobicContact CG1-CD2 3.89Å; V454-L485 HydrophobicContact CG2-CD2 4.27Å; L473-L485 WeakPolarHBondContact CA-O 3.35Å; V474-L485 PolarHBondContact N-O 2.89Å; V474-L485 PolarHBondContact O-N 2.88Å; V476-L485 HydrophobicContact CB-CD1 3.9Å; V476-L485 HydrophobicContact CG2-CD1 3.52Å; L483-L485 HydrophobicContact CB-CD1 3.95Å; L485-P487 WeakPolarHBondContact O-CD 3.49Å; L485-G530 CarbonylContact C-O 3.55Å; L485-G530 VanDerWaalsContact CA-O 3.3Å; L485-G530 WeakPolarHBondContact CA-O 3.36Å; L485-I531 HydrophobicContact CD2-CG1 4.22Å; L485-I531 HydrophobicContact CG-CG1 4.16Å
486	S	92.1	Very high	91.8	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.014	24%	0.24	C	C	.	.			trans	-102	93.6	164.8	178.4	0	0	0	0	107.3	A488 E499 G530	S486-A488 PolarHBondContact O-N 3.34Å; S486-E499 VanDerWaalsContact CB-OE1 3.3Å; S486-E499 WeakPolarHBondContact CB-OE1 3.38Å; S486-E499 PolarHBondContact OG-OE1 3.48Å; S486-G530 PolarHBondContact N-O 2.84Å
487	P	86.5	Confident	91.5	Very high	8 Å²	8	44.9 Å²	44.9	5%	0.052	26%	0.256	C	S	.	.			trans	-76.7	-8.4	-173.3	31.9	-36.8	0	0	0	113.7	L442 W465 C472 V474 L485 L489	L442-P487 HydrophobicContact CD1-CB 4.36Å; L442-P487 HydrophobicContact CD2-CB 3.48Å; L442-P487 VanDerWaalsContact CD2-CB 3.48Å; L442-P487 HydrophobicContact CD2-CG 4.11Å; W465-P487 HydrophobicContact CH2-CG 4.49Å; C472-P487 WeakPolarHBondContact O-CD 3.25Å; V474-P487 HydrophobicContact CG2-CG 4.16Å; L485-P487 WeakPolarHBondContact O-CD 3.49Å; P487-L489 VanDerWaalsContact C-N 3.34Å; P487-L489 HydrophobicContact CB-CG 4.22Å; P487-L489 PolarHBondContact O-N 3.04Å
488	A	85.8	Confident	91.3	Very high	56 Å²	56	44.9 Å²	44.9	46%	0.463	26%	0.256	S	S	.	.			trans	58.8	33.8	-179.5	0	0	0	0	0	115.3	S486 I495	S486-A488 PolarHBondContact O-N 3.34Å; A488-I495 HydrophobicContact CB-CD1 3.95Å
489	L	85.3	Confident	91	Very high	30 Å²	30	46.7 Å²	46.7	16%	0.157	26%	0.263	C	S	.	.			trans	-102.9	32.6	-178.5	-57.7	-172.1	0	0	0	113.9	W430 L442 L451 P487	W430-L489 HydrophobicContact CD2-CB 4.26Å; W430-L489 HydrophobicContact CD2-CD1 3.91Å; W430-L489 HydrophobicContact CE3-CD1 4Å; W430-L489 HydrophobicContact CG-CB 4.37Å; W430-L489 HydrophobicContact CG-CD1 4.25Å; W430-L489 HydrophobicContact CZ2-CB 4.38Å; W430-L489 HydrophobicContact CZ3-CD1 4.46Å; W430-L489 PolarHBondContact NE1-O 2.85Å; L442-L489 HydrophobicContact CB-CD1 3.96Å; L442-L489 HydrophobicContact CD2-CD1 3.65Å; L442-L489 HydrophobicContact CG-CD1 4.38Å; L451-L489 HydrophobicContact CD2-CD1 4.25Å; L451-L489 HydrophobicContact CD2-CD2 3.57Å; P487-L489 VanDerWaalsContact C-N 3.34Å; P487-L489 HydrophobicContact CB-CG 4.22Å; P487-L489 PolarHBondContact O-N 3.04Å
490	A	85.4	Confident	90.9	Very high	38 Å²	38	52.5 Å²	52.5	31%	0.314	28%	0.279	S	S	.	.	S	Bend	trans	-140.1	174.9	-179.4	0	0	0	0	0	111	C472 V494 I495	C472-A490 HydrophobicContact CB-CB 3.71Å; A490-V494 HydrophobicContact CB-CB 3.87Å; A490-V494 HydrophobicContact CB-CG1 3.73Å; A490-I495 WeakPolarHBondContact O-CD1 3.37Å
491	D	87.7	Confident	90.7	Very high	126 Å²	126	52.2 Å²	52.2	67%	0.674	28%	0.275	S	S	*	.			trans	-56.5	149.2	177.1	-68.7	-45.7	0	0	0	112.4	Q493 V494 I495	D491-Q493 PolarHBondContact O-N 3.19Å; D491-V494 HydrophobicContact CB-CG2 4.4Å; D491-V494 WeakPolarHBondContact O-CA 3.39Å; D491-V494 WeakPolarHBondContact O-CB 3.44Å; D491-V494 PolarHBondContact O-N 3.46Å; D491-I495 PolarHBondContact O-N 3.47Å
492	K	89.2	Confident	90.3	Very high	186 Å²	186	52.4 Å²	52.4	81%	0.809	27%	0.274	S	S	*	.	H	α-helix	trans	-53.1	-31.3	-178.9	-169.6	175.3	-177.9	178.5	0	113	S496	K492-S496 WeakPolarHBondContact O-CB 3.38Å; K492-S496 PolarHBondContact O-N 2.95Å; K492-S496 PolarHBondContact O-OG 2.87Å
493	Q	91.3	Very high	89.7	Confident	160 Å²	160	56.2 Å²	56.2	75%	0.748	30%	0.301	S	S	*	.	H	α-helix	trans	-66.8	-48.6	173.6	-67.7	-175.5	-6.7	0	0	112.2	D491 I495 S496 A497	D491-Q493 PolarHBondContact O-N 3.19Å; Q493-I495 PolarHBondContact O-N 2.73Å; Q493-S496 PolarHBondContact O-N 2.86Å; Q493-S496 PolarHBondContact O-OG 2.9Å; Q493-A497 WeakPolarHBondContact O-CB 3.29Å; Q493-A497 PolarHBondContact O-N 2.99Å
494	V	91.4	Very high	88.8	Confident	29 Å²	29	57.1 Å²	57.1	18%	0.176	31%	0.31	C	S	.	.	H	α-helix	trans	-62.9	-41.9	177.8	178.7	0	0	0	0	110.9	C472 A490 D491 A497 S498	C472-V494 HydrophobicContact CB-CG1 3.84Å; A490-V494 HydrophobicContact CB-CB 3.87Å; A490-V494 HydrophobicContact CB-CG1 3.73Å; D491-V494 HydrophobicContact CB-CG2 4.4Å; D491-V494 WeakPolarHBondContact O-CA 3.39Å; D491-V494 WeakPolarHBondContact O-CB 3.44Å; D491-V494 PolarHBondContact O-N 3.46Å; V494-A497 PolarHBondContact O-N 3.05Å; V494-S498 WeakPolarHBondContact O-CB 3.49Å; V494-S498 PolarHBondContact O-N 3.1Å; V494-S498 PolarHBondContact O-OG 2.88Å
495	I	90.7	Very high	87.4	Confident	40 Å²	40	65.4 Å²	65.4	21%	0.205	35%	0.348	C	S	.	.	H	α-helix	trans	-61.4	-49.4	173.8	-62.5	173.4	0	0	0	110.1	A488 A490 D491 Q493 A497 S498 E499	A488-I495 HydrophobicContact CB-CD1 3.95Å; A490-I495 WeakPolarHBondContact O-CD1 3.37Å; D491-I495 PolarHBondContact O-N 3.47Å; Q493-I495 PolarHBondContact O-N 2.73Å; I495-A497 VanDerWaalsContact C-N 3.3Å; I495-A497 PolarHBondContact O-N 3.34Å; I495-S498 WeakPolarHBondContact O-CB 3.34Å; I495-S498 PolarHBondContact O-N 2.82Å; I495-E499 HydrophobicContact CG2-CG 4.23Å; I495-E499 WeakPolarHBondContact O-CG 3.22Å; I495-E499 PolarHBondContact O-N 3.19Å
496	S	90.6	Very high	86.1	Confident	72 Å²	72	71 Å²	71	50%	0.503	38%	0.375	S	S	.	.	H	α-helix	trans	-63.5	-33.1	-179.8	71.5	0	0	0	0	113.7	K492 Q493 R500	K492-S496 WeakPolarHBondContact O-CB 3.38Å; K492-S496 PolarHBondContact O-N 2.95Å; K492-S496 PolarHBondContact O-OG 2.87Å; Q493-S496 PolarHBondContact O-N 2.86Å; Q493-S496 PolarHBondContact O-OG 2.9Å; S496-R500 WeakPolarHBondContact O-CB 3.27Å; S496-R500 PolarHBondContact O-N 2.77Å
497	A	91.1	Very high	84.7	Confident	41 Å²	41	76.5 Å²	76.5	34%	0.339	40%	0.4	S	S	.	.	H	α-helix	trans	-68.7	-36	172.6	0	0	0	0	0	112	Q493 V494 I495 L501	Q493-A497 WeakPolarHBondContact O-CB 3.29Å; Q493-A497 PolarHBondContact O-N 2.99Å; V494-A497 PolarHBondContact O-N 3.05Å; I495-A497 VanDerWaalsContact C-N 3.3Å; I495-A497 PolarHBondContact O-N 3.34Å; A497-L501 PolarHBondContact O-N 3.22Å
498	S	91.8	Very high	83	Confident	0 Å²	0	85.2 Å²	85.2	0%	0	44%	0.44	C	S	.	.	H	α-helix	trans	-70	-49.3	178.2	-53.8	0	0	0	0	111.8	L471 C472 V494 I495 R500 L501 L502	L471-S498 WeakPolarHBondContact CA-OG 3.35Å; C472-S498 PolarHBondContact N-OG 2.78Å; V494-S498 WeakPolarHBondContact O-CB 3.49Å; V494-S498 PolarHBondContact O-N 3.1Å; V494-S498 PolarHBondContact O-OG 2.88Å; I495-S498 WeakPolarHBondContact O-CB 3.34Å; I495-S498 PolarHBondContact O-N 2.82Å; S498-R500 VanDerWaalsContact C-N 3.3Å; S498-R500 PolarHBondContact O-N 2.84Å; S498-L501 WeakPolarHBondContact O-CB 3.47Å; S498-L501 PolarHBondContact O-N 2.74Å; S498-L501 VanDerWaalsContact O-N 3.17Å; S498-L502 WeakPolarHBondContact O-CG 3.36Å; S498-L502 PolarHBondContact O-N 2.88Å; S498-L502 VanDerWaalsContact O-N 3.09Å
499	E	88.8	Confident	81.5	Confident	52 Å²	52	84.7 Å²	84.7	24%	0.243	44%	0.44	C	S	.	.	H	α-helix	trans	-63.3	-36.9	175.7	-59	-68.1	175.8	0	0	110.8	S486 I495 L501 L502 S503 R532	S486-E499 VanDerWaalsContact CB-OE1 3.3Å; S486-E499 WeakPolarHBondContact CB-OE1 3.38Å; S486-E499 PolarHBondContact OG-OE1 3.48Å; I495-E499 HydrophobicContact CG2-CG 4.23Å; I495-E499 WeakPolarHBondContact O-CG 3.22Å; I495-E499 PolarHBondContact O-N 3.19Å; E499-L501 VanDerWaalsContact C-N 3.34Å; E499-L501 PolarHBondContact O-N 2.87Å; E499-L502 PolarHBondContact O-N 2.87Å; E499-S503 WeakPolarHBondContact O-CB 3.21Å; E499-S503 PolarHBondContact O-N 3.39Å; E499-S503 PolarHBondContact O-OG 3.01Å; E499-R532 IonicContact OE1-CZ 3.58Å; E499-R532 IonicContact OE1-NE 3.8Å; E499-R532 PolarHBondContact OE1-NE 2.85Å; E499-R532 VanDerWaalsContact OE1-NE 3.11Å; E499-R532 IonicContact OE1-NH2 3.14Å; E499-R532 PolarHBondContact OE1-NH2 3.26Å; E499-R532 IonicContact OE2-CZ 3.71Å; E499-R532 IonicContact OE2-NE 2.8Å; E499-R532 PolarHBondContact OE2-NE 3.1Å; E499-R532 IonicContact OE2-NH2 3.39Å
500	R	89.9	Confident	79.5	Confident	203 Å²	203	89.8 Å²	89.8	77%	0.766	48%	0.475	S	S	*	.	H	α-helix	trans	-65.4	-30.8	174.1	-177.3	175.3	-179.1	171.5	2.6	113.8	S496 S498 S503	S496-R500 WeakPolarHBondContact O-CB 3.27Å; S496-R500 PolarHBondContact O-N 2.77Å; S498-R500 VanDerWaalsContact C-N 3.3Å; S498-R500 PolarHBondContact O-N 2.84Å; R500-S503 PolarHBondContact O-OG 2.95Å
501	L	89.6	Confident	77.8	Confident	33 Å²	33	91.9 Å²	91.9	17%	0.173	49%	0.487	C	S	.	.	H	α-helix	trans	-71.7	-39.5	173	176.4	62.7	0	0	0	111.1	L471 L473 A497 S498 E499 A504 L571	L471-L501 HydrophobicContact CD1-CD2 3.66Å; L471-L501 HydrophobicContact CD2-CB 4.48Å; L471-L501 HydrophobicContact CD2-CD2 3.91Å; L471-L501 HydrophobicContact CG-CD2 4.47Å; L473-L501 HydrophobicContact CD1-CD2 4.16Å; A497-L501 PolarHBondContact O-N 3.22Å; S498-L501 WeakPolarHBondContact O-CB 3.47Å; S498-L501 PolarHBondContact O-N 2.74Å; S498-L501 VanDerWaalsContact O-N 3.17Å; E499-L501 VanDerWaalsContact C-N 3.34Å; E499-L501 PolarHBondContact O-N 2.87Å; L501-A504 VanDerWaalsContact O-CB 3.32Å; L501-A504 WeakPolarHBondContact O-CB 3.25Å; L501-A504 PolarHBondContact O-N 2.83Å; L501-L571 HydrophobicContact CD2-CD2 4.26Å; L501-L571 HydrophobicContact CG-CB 4.43Å
502	L	87.9	Confident	75.8	Confident	10 Å²	10	95.7 Å²	95.7	5%	0.052	50%	0.501	C	S	.	.	H	α-helix	trans	-71.9	-35.5	178.2	-64	171.9	0	0	0	112.4	L473 I484 S498 E499 A504 R532 L533 L571 R574	L473-L502 HydrophobicContact CD1-CD2 4.42Å; L473-L502 HydrophobicContact CD2-CD1 3.71Å; L473-L502 HydrophobicContact CD2-CD2 4.34Å; L473-L502 HydrophobicContact CD2-CG 4.19Å; I484-L502 HydrophobicContact CG2-CD2 3.93Å; S498-L502 WeakPolarHBondContact O-CG 3.36Å; S498-L502 PolarHBondContact O-N 2.88Å; S498-L502 VanDerWaalsContact O-N 3.09Å; E499-L502 PolarHBondContact O-N 2.87Å; L502-A504 PolarHBondContact O-N 3.31Å; L502-R532 HydrophobicContact CD1-CB 3.74Å; L502-R532 HydrophobicContact CD1-CG 3.69Å; L502-L533 HydrophobicContact CD2-CD1 3.65Å; L502-L533 HydrophobicContact CD2-CG 4.12Å; L502-L571 HydrophobicContact CD2-CD2 4.12Å; L502-R574 PolarHBondContact O-NH2 2.82Å
503	S	83.9	Confident	74.3	Confident	81 Å²	81	89.1 Å²	89.1	57%	0.566	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	7.5	175.8	80.4	0	0	0	0	113.9	E499 R500 Q505	E499-S503 WeakPolarHBondContact O-CB 3.21Å; E499-S503 PolarHBondContact O-N 3.39Å; E499-S503 PolarHBondContact O-OG 3.01Å; R500-S503 PolarHBondContact O-OG 2.95Å; S503-Q505 PolarHBondContact O-N 3.33Å
504	A	76.2	Confident	73	Confident	26 Å²	26	87.9 Å²	87.9	22%	0.215	49%	0.492	C	S	.	.			trans	-65.7	126.2	171.7	0	0	0	0	0	109.6	L501 L502 S572 R574	L501-A504 VanDerWaalsContact O-CB 3.32Å; L501-A504 WeakPolarHBondContact O-CB 3.25Å; L501-A504 PolarHBondContact O-N 2.83Å; L502-A504 PolarHBondContact O-N 3.31Å; A504-S572 WeakPolarHBondContact CB-O 3.5Å; A504-R574 PolarHBondContact O-NE 3.28Å
505	Q	66.4	Low	72.2	Confident	174 Å²	174	91.1 Å²	91.1	81%	0.813	51%	0.505	S	S	*	.			trans	-68.3	151.1	179.9	-72.1	-177.9	-48.4	0	0	111.4	S503 E507	S503-Q505 PolarHBondContact O-N 3.33Å; Q505-E507 PolarHBondContact O-N 3.22Å
506	Q	67.1	Low	71.8	Confident	125 Å²	125	92 Å²	92	58%	0.584	51%	0.513	S	S	*	.			trans	-70.3	115.4	171.2	-179.3	173.6	-23.7	0	0	109.3	E508	Q506-E508 PolarHBondContact O-N 3.06Å
507	E	61.6	Low	71.9	Confident	117 Å²	117	88.8 Å²	88.8	55%	0.547	49%	0.491	S	S	.	.			trans	-66.9	123.4	168.2	-69.9	176.3	150.7	0	0	109.2	Q505 G509 R573	Q505-E507 PolarHBondContact O-N 3.22Å; E507-G509 PolarHBondContact O-N 2.92Å; E507-R573 IonicContact OE1-CZ 3.75Å; E507-R573 IonicContact OE1-NH1 3.56Å; E507-R573 VanDerWaalsContact OE2-CD 3.31Å; E507-R573 WeakPolarHBondContact OE2-CD 3.37Å; E507-R573 IonicContact OE2-CZ 3.91Å; E507-R573 IonicContact OE2-NE 3.94Å; E507-R573 PolarHBondContact OE2-NE 2.86Å; E507-R573 IonicContact OE2-NH1 3.28Å; E507-R573 PolarHBondContact OE2-NH1 3.34Å
508	E	51.9	Low	71.9	Confident	190 Å²	190	91.1 Å²	91.1	89%	0.888	50%	0.501	S	S	*	.			trans	-72.4	72.4	171.4	-67.9	-168.5	152.8	0	0	111.1	Q506	Q506-E508 PolarHBondContact O-N 3.06Å
509	G	53.2	Low	72	Confident	45 Å²	45	93.1 Å²	93.1	46%	0.464	51%	0.508	S	S	.	.			trans	-67.9	146.5	162.8	0	0	0	0	0	110.7	E507 S511	E507-G509 PolarHBondContact O-N 2.92Å; G509-S511 PolarHBondContact O-N 2.8Å
510	P	44.5	Very low	72.1	Confident	137 Å²	137	92.6 Å²	92.6	89%	0.89	51%	0.511	S	S	*	.			trans	-60.9	113.1	-177.8	24.8	-34	0	0	0	110.5
511	S	48.9	Very low	72.1	Confident	83 Å²	83	88.7 Å²	88.7	58%	0.58	50%	0.501	S	S	*	.			trans	-109.5	94.6	-177.8	49.9	0	0	0	0	110.9	G509 G513	G509-S511 PolarHBondContact O-N 2.8Å; S511-G513 PolarHBondContact O-N 2.91Å
512	E	46.9	Very low	71.9	Confident	205 Å²	205	88 Å²	88	96%	0.958	50%	0.498	S	S	*	.			trans	-71.6	94.6	168.5	-66.6	-176.1	149	0	0	109.8
513	G	56.8	Low	71.6	Confident	49 Å²	49	95.6 Å²	95.6	51%	0.505	53%	0.533	S	S	.	.	S	Bend	trans	97.5	167.1	169.2	0	0	0	0	0	116.3	S511 Q515	S511-G513 PolarHBondContact O-N 2.91Å; G513-Q515 PolarHBondContact O-N 3.46Å
514	P	63.8	Low	71.6	Confident	134 Å²	134	94.1 Å²	94.1	87%	0.87	53%	0.53	S	S	*	.			trans	-69.7	126	-176.4	28.4	-34.5	0	0	0	111.6
515	Q	74.1	Confident	71.8	Confident	96 Å²	96	100.4 Å²	100.4	45%	0.449	56%	0.555	S	S	.	*			trans	-78.2	140.6	176.2	-64.6	-172.6	34.2	0	0	111.1	G513 V517	G513-Q515 PolarHBondContact O-N 3.46Å; Q515-V517 PolarHBondContact O-N 2.89Å
516	P	83.4	Confident	72.6	Confident	58 Å²	58	95.8 Å²	95.8	38%	0.377	53%	0.534	S	S	.	.	S	Bend	trans	-75.6	-1.4	-177	32.1	-37.8	0	0	0	114.2	P538 M564 F567	P516-P538 WeakPolarHBondContact O-CD 3.29Å; P516-M564 HydrophobicContact CB-CE 4.23Å; P516-M564 HydrophobicContact CB-SD 3.98Å; P516-M564 HydrophobicContact CG-CE 4.16Å; P516-M564 HydrophobicContact CG-SD 4.19Å; P516-F567 HydrophobicContact CG-CE1 4.02Å; P516-F567 HydrophobicContact CG-CZ 3.84Å
517	V	91.5	Very high	73.4	Confident	6 Å²	6	93.4 Å²	93.4	4%	0.036	52%	0.524	C	S	.	.	S	Bend	trans	-129.1	123.3	179	175.3	0	0	0	0	108.2	Q515 I535 Q536 F567 S576	Q515-V517 PolarHBondContact O-N 2.89Å; V517-I535 HydrophobicContact CG1-CG2 3.39Å; V517-Q536 WeakPolarHBondContact CA-O 3.35Å; V517-F567 HydrophobicContact CG2-CD1 3.83Å; V517-F567 HydrophobicContact CG2-CD2 4.45Å; V517-F567 HydrophobicContact CG2-CE1 3.66Å; V517-F567 HydrophobicContact CG2-CE2 4.29Å; V517-F567 HydrophobicContact CG2-CG 4.23Å; V517-F567 HydrophobicContact CG2-CZ 3.9Å; V517-S576 VanDerWaalsContact CG1-OG 3.28Å; V517-S576 WeakPolarHBondContact CG1-OG 3.4Å
518	V	92.9	Very high	74.4	Confident	90 Å²	90	94.2 Å²	94.2	55%	0.545	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	139.5	-176	-179.3	0	0	0	0	109.6	I535 Q536	V518-I535 CarbonylContact O-C 3.57Å; V518-Q536 HydrophobicContact CB-CB 4.39Å; V518-Q536 PolarHBondContact N-O 3.25Å; V518-Q536 PolarHBondContact O-N 3.05Å
519	W	92.6	Very high	76	Confident	41 Å²	41	87.7 Å²	87.7	16%	0.155	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	138.1	173.5	-67.3	68	0	0	0	109.5	L533 I535 H569 R574 S576	W519-L533 HydrophobicContact CE3-CD1 4.33Å; W519-L533 HydrophobicContact CZ3-CD1 4.17Å; W519-I535 HydrophobicContact CD2-CG1 4.05Å; W519-I535 HydrophobicContact CE3-CD1 4.21Å; W519-I535 HydrophobicContact CE3-CG1 3.85Å; W519-I535 HydrophobicContact CH2-CD1 3.64Å; W519-I535 HydrophobicContact CH2-CG1 4.19Å; W519-I535 HydrophobicContact CZ2-CD1 3.98Å; W519-I535 HydrophobicContact CZ2-CG1 4.36Å; W519-I535 HydrophobicContact CZ3-CD1 3.75Å; W519-I535 HydrophobicContact CZ3-CG1 3.92Å; W519-H569 HydrophobicContact CH2-CB 4.09Å; W519-H569 HydrophobicContact CZ2-CB 3.85Å; W519-R574 HydrophobicContact CD2-CB 4Å; W519-R574 VanDerWaalsContact CE2-C 3.42Å; W519-R574 VanDerWaalsContact CE2-O 3.28Å; W519-R574 HydrophobicContact CE3-CB 3.92Å; W519-R574 HydrophobicContact CE3-CG 4.22Å; W519-R574 HydrophobicContact CG-CB 4.37Å; W519-R574 HydrophobicContact CZ3-CB 4.34Å; W519-R574 HydrophobicContact CZ3-CG 4.5Å; W519-R574 PolarHBondContact NE1-O 3.44Å; W519-R574 VanDerWaalsContact NE1-O 3.17Å; W519-S576 PolarHBondContact NE1-OG 3.45Å
520	S	91.3	Very high	77.6	Confident	42 Å²	42	85.8 Å²	85.8	29%	0.294	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	139.6	178.1	40.6	0	0	0	0	109.8	L533 K534	S520-L533 WeakPolarHBondContact O-CA 3.44Å; S520-K534 PolarHBondContact N-O 3.07Å; S520-K534 PolarHBondContact O-N 2.99Å; S520-K534 WeakPolarHBondContact OG-CB 3.23Å; S520-K534 PolarHBondContact OG-O 3.09Å
521	E	89.6	Confident	79.8	Confident	121 Å²	121	79.2 Å²	79.2	57%	0.565	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.4	151.8	162.2	-63.6	-169.8	-172	0	0	109	L533 R574	E521-L533 HydrophobicContact CG-CD2 3.9Å; E521-R574 IonicContact OE1-CZ 3.11Å; E521-R574 IonicContact OE1-NH1 2.7Å; E521-R574 PolarHBondContact OE1-NH1 2.99Å; E521-R574 IonicContact OE1-NH2 2.85Å; E521-R574 PolarHBondContact OE1-NH2 3.33Å
522	M	86.1	Confident	81.8	Confident	19 Å²	19	78 Å²	78	9%	0.094	42%	0.422	C	S	.	.			trans	-100.1	129.2	179.5	-59.3	-53.5	-64.7	0	0	110.6	E526 L527 I531 R532 K534	M522-E526 HydrophobicContact CB-CB 4.39Å; M522-E526 HydrophobicContact CE-CB 4.1Å; M522-E526 HydrophobicContact CE-CG 4.28Å; M522-E526 VanDerWaalsContact CE-OE1 3.26Å; M522-E526 WeakPolarHBondContact CE-OE1 3.44Å; M522-E526 WeakPolarHBondContact CE-OE2 3.39Å; M522-L527 WeakPolarHBondContact O-CD1 3.27Å; M522-I531 HydrophobicContact CG-CB 4.46Å; M522-I531 HydrophobicContact CG-CG2 3.85Å; M522-R532 PolarHBondContact N-O 2.84Å; M522-K534 HydrophobicContact CE-CD 4.26Å; M522-K534 HydrophobicContact CG-CB 4.28Å; M522-K534 HydrophobicContact SD-CB 3.37Å; M522-K534 WeakPolarHBondContact SD-CB 3.38Å; M522-K534 HydrophobicContact SD-CD 3.85Å; M522-K534 HydrophobicContact SD-CG 4.28Å
523	E	82	Confident	84	Confident	169 Å²	169	68.4 Å²	68.4	79%	0.79	38%	0.377	S	S	*	.			trans	-107.5	169.4	177.5	-63.1	-172.8	174.3	0	0	111.4
524	G	83.6	Confident	85.8	Confident	50 Å²	50	69.1 Å²	69.1	52%	0.515	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	66	-137.3	172.4	0	0	0	0	0	115.1	E526 L527 N528	G524-E526 PolarHBondContact O-N 2.82Å; G524-L527 WeakPolarHBondContact O-CB 3.3Å; G524-L527 PolarHBondContact O-N 3.38Å; G524-N528 PolarHBondContact O-N 3.27Å
525	E	80.4	Confident	87.3	Confident	157 Å²	157	62.8 Å²	62.8	73%	0.734	33%	0.325	S	S	*	.	H	α-helix	trans	-67.2	-32.5	-170.8	-61.9	-166.8	161.1	0	0	113.7	L527 N528 Q529	E525-L527 VanDerWaalsContact C-N 3.27Å; E525-L527 PolarHBondContact O-N 3.31Å; E525-N528 WeakPolarHBondContact O-CB 3.3Å; E525-N528 PolarHBondContact O-N 3.04Å; E525-N528 VanDerWaalsContact O-N 3.13Å; E525-Q529 WeakPolarHBondContact O-CG 3.48Å; E525-Q529 PolarHBondContact O-N 2.87Å
526	E	82.6	Confident	88.3	Confident	78 Å²	78	61.1 Å²	61.1	36%	0.364	32%	0.318	S	S	.	.	H	α-helix	trans	-64.1	-34.4	178.3	-68.9	179.6	96.2	0	0	111.5	M522 G524 Q529 G530 I531	M522-E526 HydrophobicContact CB-CB 4.39Å; M522-E526 HydrophobicContact CE-CB 4.1Å; M522-E526 HydrophobicContact CE-CG 4.28Å; M522-E526 VanDerWaalsContact CE-OE1 3.26Å; M522-E526 WeakPolarHBondContact CE-OE1 3.44Å; M522-E526 WeakPolarHBondContact CE-OE2 3.39Å; G524-E526 PolarHBondContact O-N 2.82Å; E526-Q529 PolarHBondContact O-N 3.08Å; E526-G530 PolarHBondContact O-N 3.5Å; E526-I531 HydrophobicContact CB-CB 4.4Å; E526-I531 HydrophobicContact CB-CD1 4.07Å; E526-I531 HydrophobicContact CG-CD1 4.29Å; E526-I531 WeakPolarHBondContact O-CB 3.35Å; E526-I531 PolarHBondContact O-N 2.67Å
527	L	84.2	Confident	88.8	Confident	74 Å²	74	58.7 Å²	58.7	39%	0.387	30%	0.301	S	S	.	.	H	α-helix	trans	-65.4	-39	173.2	-170.2	72.5	0	0	0	112.2	M522 G524 E525 G530 I531 R532	M522-L527 WeakPolarHBondContact O-CD1 3.27Å; G524-L527 WeakPolarHBondContact O-CB 3.3Å; G524-L527 PolarHBondContact O-N 3.38Å; E525-L527 VanDerWaalsContact C-N 3.27Å; E525-L527 PolarHBondContact O-N 3.31Å; L527-G530 WeakPolarHBondContact O-CA 3.48Å; L527-G530 PolarHBondContact O-N 2.88Å; L527-I531 WeakPolarHBondContact CA-O 3.37Å; L527-R532 VanDerWaalsContact CD1-NH1 3.33Å; L527-R532 PolarHBondContact O-NH1 3.13Å
528	N	83.3	Confident	88.8	Confident	135 Å²	135	61.9 Å²	61.9	72%	0.722	32%	0.322	S	S	*	.	H	α-helix	trans	-67.5	-35.9	175	-67.7	-31.9	0	0	0	111.8	G524 E525 G530	G524-N528 PolarHBondContact O-N 3.27Å; E525-N528 WeakPolarHBondContact O-CB 3.3Å; E525-N528 PolarHBondContact O-N 3.04Å; E525-N528 VanDerWaalsContact O-N 3.13Å; N528-G530 PolarHBondContact O-N 2.86Å
529	Q	84	Confident	88.8	Confident	53 Å²	53	60.8 Å²	60.8	25%	0.248	31%	0.31	C	S	.	.	H	α-helix	trans	-67.6	-13.6	170.7	-64.5	-167	56.9	0	0	112.9	K452 V454 Q455 E525 E526	K452-Q529 VanDerWaalsContact CE-O 3.3Å; K452-Q529 WeakPolarHBondContact CE-O 3.45Å; K452-Q529 PolarHBondContact NZ-O 3.02Å; V454-Q529 HydrophobicContact CG1-CB 4.08Å; V454-Q529 WeakPolarHBondContact CG2-O 3.35Å; Q455-Q529 PolarHBondContact O-OE1 3.02Å; E525-Q529 WeakPolarHBondContact O-CG 3.48Å; E525-Q529 PolarHBondContact O-N 2.87Å; E526-Q529 PolarHBondContact O-N 3.08Å
530	G	86.5	Confident	88.9	Confident	4 Å²	4	61.8 Å²	61.8	4%	0.041	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	96.4	10.8	176.4	0	0	0	0	0	114.1	L485 S486 E526 L527 N528	L485-G530 CarbonylContact C-O 3.55Å; L485-G530 VanDerWaalsContact CA-O 3.3Å; L485-G530 WeakPolarHBondContact CA-O 3.36Å; S486-G530 PolarHBondContact N-O 2.84Å; E526-G530 PolarHBondContact O-N 3.5Å; L527-G530 WeakPolarHBondContact O-CA 3.48Å; L527-G530 PolarHBondContact O-N 2.88Å; N528-G530 PolarHBondContact O-N 2.86Å
531	I	91.3	Very high	89.1	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	143.5	167.3	-45	176	0	0	0	107.2	V454 V456 L483 L485 M522 E526 L527	V454-I531 HydrophobicContact CG1-CD1 4.13Å; V454-I531 HydrophobicContact CG1-CG1 4.13Å; V456-I531 HydrophobicContact CG1-CD1 4.3Å; L483-I531 HydrophobicContact CB-CG2 4.17Å; L483-I531 HydrophobicContact CD1-CD1 4.4Å; L483-I531 HydrophobicContact CD2-CG2 4.27Å; L485-I531 HydrophobicContact CD2-CG1 4.22Å; L485-I531 HydrophobicContact CG-CG1 4.16Å; M522-I531 HydrophobicContact CG-CB 4.46Å; M522-I531 HydrophobicContact CG-CG2 3.85Å; E526-I531 HydrophobicContact CB-CB 4.4Å; E526-I531 HydrophobicContact CB-CD1 4.07Å; E526-I531 HydrophobicContact CG-CD1 4.29Å; E526-I531 WeakPolarHBondContact O-CB 3.35Å; E526-I531 PolarHBondContact O-N 2.67Å; L527-I531 WeakPolarHBondContact CA-O 3.37Å
532	R	91.3	Very high	89.3	Confident	56 Å²	56	57.7 Å²	57.7	21%	0.211	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	-53.4	-173.6	-70.2	-74	-174.7	-89.9	-3.8	112.9	I484 E499 L502 M522 L527	I484-R532 PolarHBondContact O-N 3.33Å; E499-R532 IonicContact OE1-CZ 3.58Å; E499-R532 IonicContact OE1-NE 3.8Å; E499-R532 PolarHBondContact OE1-NE 2.85Å; E499-R532 VanDerWaalsContact OE1-NE 3.11Å; E499-R532 IonicContact OE1-NH2 3.14Å; E499-R532 PolarHBondContact OE1-NH2 3.26Å; E499-R532 IonicContact OE2-CZ 3.71Å; E499-R532 IonicContact OE2-NE 2.8Å; E499-R532 PolarHBondContact OE2-NE 3.1Å; E499-R532 IonicContact OE2-NH2 3.39Å; L502-R532 HydrophobicContact CD1-CB 3.74Å; L502-R532 HydrophobicContact CD1-CG 3.69Å; M522-R532 PolarHBondContact N-O 2.84Å; L527-R532 VanDerWaalsContact CD1-NH1 3.33Å; L527-R532 PolarHBondContact O-NH1 3.13Å
533	L	92.7	Very high	89.8	Confident	4 Å²	4	59 Å²	59	2%	0.021	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	142.9	178.3	-58.1	176.5	0	0	0	109.9	I484 L502 W519 S520 E521	I484-L533 HydrophobicContact CB-CB 4.17Å; I484-L533 HydrophobicContact CG1-CB 4.26Å; I484-L533 PolarHBondContact N-O 2.8Å; I484-L533 PolarHBondContact O-N 3Å; L502-L533 HydrophobicContact CD2-CD1 3.65Å; L502-L533 HydrophobicContact CD2-CG 4.12Å; W519-L533 HydrophobicContact CE3-CD1 4.33Å; W519-L533 HydrophobicContact CZ3-CD1 4.17Å; S520-L533 WeakPolarHBondContact O-CA 3.44Å; E521-L533 HydrophobicContact CG-CD2 3.9Å
534	K	94.1	Very high	90.5	Very high	65 Å²	65	51.1 Å²	51.1	28%	0.283	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	119.2	169.4	171.6	176.5	-178.4	176	0	108.9	A481 L483 S520 M522	A481-K534 HydrophobicContact CB-CG 4.24Å; L483-K534 HydrophobicContact CD2-CB 3.82Å; L483-K534 HydrophobicContact CD2-CD 4.15Å; L483-K534 HydrophobicContact CD2-CG 3.82Å; S520-K534 PolarHBondContact N-O 3.07Å; S520-K534 PolarHBondContact O-N 2.99Å; S520-K534 WeakPolarHBondContact OG-CB 3.23Å; S520-K534 PolarHBondContact OG-O 3.09Å; M522-K534 HydrophobicContact CE-CD 4.26Å; M522-K534 HydrophobicContact CG-CB 4.28Å; M522-K534 HydrophobicContact SD-CB 3.37Å; M522-K534 WeakPolarHBondContact SD-CB 3.38Å; M522-K534 HydrophobicContact SD-CD 3.85Å; M522-K534 HydrophobicContact SD-CG 4.28Å
535	I	95.3	Very high	91.1	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	107.3	174.6	-52.3	175.5	0	0	0	106.1	A481 V482 I484 V517 V518 W519 H537 L553 H569	A481-I535 CarbonylContact C-O 3.48Å; A481-I535 VanDerWaalsContact CA-O 3.3Å; A481-I535 WeakPolarHBondContact CA-O 3.38Å; V482-I535 HydrophobicContact CB-CB 4.26Å; V482-I535 PolarHBondContact N-O 2.81Å; V482-I535 PolarHBondContact O-N 3.45Å; I484-I535 HydrophobicContact CG1-CD1 4.47Å; V517-I535 HydrophobicContact CG1-CG2 3.39Å; V518-I535 CarbonylContact O-C 3.57Å; W519-I535 HydrophobicContact CD2-CG1 4.05Å; W519-I535 HydrophobicContact CE3-CD1 4.21Å; W519-I535 HydrophobicContact CE3-CG1 3.85Å; W519-I535 HydrophobicContact CH2-CD1 3.64Å; W519-I535 HydrophobicContact CH2-CG1 4.19Å; W519-I535 HydrophobicContact CZ2-CD1 3.98Å; W519-I535 HydrophobicContact CZ2-CG1 4.36Å; W519-I535 HydrophobicContact CZ3-CD1 3.75Å; W519-I535 HydrophobicContact CZ3-CG1 3.92Å; I535-H537 PolarHBondContact O-CD2 3.28Å; I535-L553 HydrophobicContact CD1-CD2 4.35Å; I535-H569 HydrophobicContact CD1-CB 4.49Å
536	Q	95.4	Very high	91.9	Very high	61 Å²	61	43.4 Å²	43.4	29%	0.285	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	126.9	-177.2	-176	60.4	53.7	0	0	110.4	S480 V517 V518	S480-Q536 PolarHBondContact O-NE2 2.86Å; S480-Q536 PolarHBondContact OG-NE2 2.89Å; V517-Q536 WeakPolarHBondContact CA-O 3.35Å; V518-Q536 HydrophobicContact CB-CB 4.39Å; V518-Q536 PolarHBondContact N-O 3.25Å; V518-Q536 PolarHBondContact O-N 3.05Å
537	H	94.4	Very high	92.6	Very high	7 Å²	7	41.2 Å²	41.2	3%	0.032	21%	0.209	C	C	.	.			trans	-108.8	162.3	-179.1	-70.8	-104.3	0	0	0	111.9	S480 I535 V541 S555 M557 H569	S480-H537 WeakPolarHBondContact O-CA 3.23Å; S480-H537 VanDerWaalsContact O-CB 3.27Å; S480-H537 WeakPolarHBondContact O-CB 3.42Å; S480-H537 PolarHBondContact O-N 3.21Å; I535-H537 PolarHBondContact O-CD2 3.28Å; H537-V541 HydrophobicContact CB-CG2 3.98Å; H537-S555 PolarHBondContact CE1-OG 3.05Å; H537-S555 VanDerWaalsContact CE1-OG 3.23Å; H537-M557 HydrophobicContact CB-CE 4.47Å; H537-M557 HydrophobicContact CB-SD 3.67Å; H537-M557 WeakPolarHBondContact ND1-CE 3.29Å; H537-H569 AromaticContact CE1-CE1 3.31Å; H537-H569 PolarHBondContact CE1-CE1 3.44Å; H537-H569 AromaticContact CE1-NE2 3.51Å; H537-H569 AromaticContact NE2-CE1 3.56Å; H537-H569 AromaticContact NE2-NE2 3.86Å
538	P	91.8	Very high	93	Very high	73 Å²	73	40.2 Å²	40.2	47%	0.474	21%	0.208	S	C	.	.	S	Bend	trans	-81.3	-14.1	178.4	33	-34.8	0	0	0	113.3	P516	P516-P538 WeakPolarHBondContact O-CD 3.29Å
539	K	93	Very high	93.4	Very high	67 Å²	67	41.3 Å²	41.3	29%	0.291	21%	0.206	S	C	.	.	S	Bend	trans	-143.4	162.3	-177.7	-69.3	-164.2	174.9	-170.8	0	111.9	V541 M557 D559 S561	K539-V541 PolarHBondContact O-N 3.31Å; K539-M557 HydrophobicContact CB-CB 4.49Å; K539-M557 HydrophobicContact CB-CG 4.5Å; K539-M557 HydrophobicContact CB-SD 4.16Å; K539-D559 HydrophobicContact CD-CB 3.96Å; K539-D559 WeakPolarHBondContact CD-OD2 3.39Å; K539-D559 WeakPolarHBondContact CE-OD2 3.48Å; K539-D559 IonicContact NZ-OD1 3.77Å; K539-D559 PolarHBondContact NZ-OD1 3.47Å; K539-D559 IonicContact NZ-OD2 2.84Å; K539-D559 PolarHBondContact NZ-OD2 3.17Å; K539-S561 PolarHBondContact NZ-OG 2.73Å
540	P	93.6	Very high	93.8	Very high	62 Å²	62	38.8 Å²	38.8	40%	0.403	19%	0.194	S	C	.	.			trans	-65.1	123.8	-175.1	-24.8	36	0	0	0	114.1	D479 H542	D479-P540 CarbonylContact O-C 3.54Å; D479-P540 WeakPolarHBondContact O-CA 3.14Å; P540-H542 PolarHBondContact O-CE1 3.16Å; P540-H542 PolarHBondContact O-ND1 3.01Å
541	V	95.3	Very high	94.2	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.201	C	C	.	.			trans	-81.4	130.6	178.5	-170.2	0	0	0	0	109.1	K461 T477 D479 V482 H537 K539 V556 M557	K461-V541 WeakPolarHBondContact CD-O 3.46Å; T477-V541 HydrophobicContact CG2-CB 4.34Å; T477-V541 HydrophobicContact CG2-CG1 3.73Å; D479-V541 PolarHBondContact O-N 3.12Å; V482-V541 HydrophobicContact CG2-CB 4.43Å; V482-V541 HydrophobicContact CG2-CG1 4.03Å; V482-V541 HydrophobicContact CG2-CG2 4.18Å; H537-V541 HydrophobicContact CB-CG2 3.98Å; K539-V541 PolarHBondContact O-N 3.31Å; V541-V556 CarbonylContact C-O 3.54Å; V541-V556 WeakPolarHBondContact CA-O 3.34Å; V541-M557 HydrophobicContact CB-CG 4.47Å; V541-M557 HydrophobicContact CG2-CG 3.95Å; V541-M557 HydrophobicContact CG2-SD 4.43Å
542	H	94.4	Very high	94.4	Very high	77 Å²	77	44.3 Å²	44.3	36%	0.356	22%	0.217	S	C	.	.			trans	-111.2	-25.7	-176.2	-73.3	69.5	0	0	0	113.8	K461 S462 P540 V556 P558	K461-H542 PolarHBondContact NZ-CE1 3.07Å; K461-H542 PolarHBondContact NZ-NE2 3.38Å; S462-H542 WeakPolarHBondContact CB-O 3.31Å; P540-H542 PolarHBondContact O-CE1 3.16Å; P540-H542 PolarHBondContact O-ND1 3.01Å; H542-V556 PolarHBondContact N-O 3.09Å; H542-P558 HydrophobicContact CB-CG 3.87Å; H542-P558 VanDerWaalsContact CG-CG 3.45Å; H542-P558 VanDerWaalsContact ND1-CD 3.35Å; H542-P558 WeakPolarHBondContact ND1-CD 3.27Å; H542-P558 VanDerWaalsContact ND1-CG 3.34Å; H542-P558 WeakPolarHBondContact ND1-CG 3.21Å
543	Q	96.2	Very high	94.6	Very high	46 Å²	46	41.7 Å²	41.7	22%	0.215	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	142.9	176.3	-160.4	-163.2	17.7	0	0	110.5	S555 V556 A589 V590	Q543-S555 WeakPolarHBondContact O-CA 3.24Å; Q543-V556 HydrophobicContact CB-CB 4.04Å; Q543-V556 HydrophobicContact CB-CG2 3.98Å; Q543-V556 PolarHBondContact O-N 3.16Å; Q543-A589 VanDerWaalsContact OE1-CA 3.23Å; Q543-V590 PolarHBondContact OE1-O 2.74Å
544	V	96.9	Very high	94.8	Very high	5 Å²	5	41.5 Å²	41.5	3%	0.03	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	141.9	162.7	64	0	0	0	0	110.3	S462 A464 A475 T477 V482 L553 A554	S462-V544 PolarHBondContact OG-N 3.17Å; S462-V544 VanDerWaalsContact OG-N 3.16Å; A464-V544 HydrophobicContact CB-CG1 4.04Å; A475-V544 HydrophobicContact CB-CG1 4.09Å; A475-V544 HydrophobicContact CB-CG2 3.74Å; T477-V544 HydrophobicContact CG2-CB 3.62Å; T477-V544 HydrophobicContact CG2-CG1 3.68Å; V482-V544 HydrophobicContact CG1-CG2 4.22Å; V544-L553 HydrophobicContact CG2-CB 4.5Å; V544-L553 HydrophobicContact CG2-CD1 3.51Å; V544-A554 WeakPolarHBondContact CA-O 3.38Å
545	T	96.8	Very high	94.9	Very high	27 Å²	27	38.4 Å²	38.4	17%	0.166	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	147.5	174.9	-169.1	0	0	0	0	111.2	L553 A554 V590 F592	T545-L553 CarbonylContact O-C 3.55Å; T545-L553 VanDerWaalsContact O-CA 3.27Å; T545-L553 WeakPolarHBondContact O-CA 3.32Å; T545-L553 WeakPolarHBondContact O-CB 3.49Å; T545-A554 HydrophobicContact CG2-CB 4.07Å; T545-A554 PolarHBondContact N-O 3.26Å; T545-A554 PolarHBondContact O-N 3.25Å; T545-V590 HydrophobicContact CG2-CG2 3.75Å; T545-F592 HydrophobicContact CG2-CD2 4.17Å; T545-F592 HydrophobicContact CG2-CE2 4.23Å
546	W	97.2	Very high	95	Very high	17 Å²	17	38.4 Å²	38.4	6%	0.064	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	146.2	-178.2	-70.4	97.1	0	0	0	111.9	A464 N466 P467 A475 I484 G550 L553 L571 F592	A464-W546 PolarHBondContact O-NE1 3.35Å; N466-W546 HydrophobicContact CB-CD2 4.3Å; N466-W546 HydrophobicContact CB-CZ2 4.17Å; N466-W546 WeakPolarHBondContact ND2-CZ3 3.27Å; P467-W546 HydrophobicContact CG-CB 3.88Å; A475-W546 HydrophobicContact CB-CZ2 3.79Å; I484-W546 HydrophobicContact CD1-CH2 4.41Å; I484-W546 HydrophobicContact CD1-CZ2 4.42Å; W546-G550 VanDerWaalsContact CZ3-O 3.3Å; W546-G550 WeakPolarHBondContact CZ3-O 3.33Å; W546-L553 HydrophobicContact CD2-CB 4.18Å; W546-L553 HydrophobicContact CE3-CB 3.96Å; W546-L553 HydrophobicContact CH2-CD2 4.42Å; W546-L553 HydrophobicContact CZ3-CB 4.32Å; W546-L553 HydrophobicContact CZ3-CD2 4.3Å; W546-L571 HydrophobicContact CH2-CD1 3.95Å; W546-L571 HydrophobicContact CH2-CD2 3.79Å; W546-L571 HydrophobicContact CZ3-CD1 3.85Å; W546-L571 HydrophobicContact CZ3-CD2 4.06Å; W546-F592 VanDerWaalsContact C-CD2 3.49Å
547	H	96.3	Very high	94.9	Very high	33 Å²	33	35.6 Å²	35.6	15%	0.153	18%	0.18	C	C	.	.			trans	-71.2	147.6	162.8	-178.9	-97.7	0	0	0	110	P467 K549 G550 Y552 F592	P467-H547 VanDerWaalsContact CG-O 3.3Å; P467-H547 WeakPolarHBondContact CG-O 3.19Å; H547-K549 PolarHBondContact ND1-N 3.41Å; H547-K549 PolarHBondContact O-N 2.88Å; H547-G550 PolarHBondContact O-N 3.03Å; H547-Y552 WeakPolarHBondContact CB-O 3.48Å; H547-Y552 PolarHBondContact N-O 3.48Å; H547-F592 HydrophobicContact CB-CD1 4.14Å; H547-F592 HydrophobicContact CB-CD2 3.98Å; H547-F592 HydrophobicContact CB-CE1 4.26Å; H547-F592 HydrophobicContact CB-CE2 4.09Å; H547-F592 HydrophobicContact CB-CG 3.99Å; H547-F592 HydrophobicContact CB-CZ 4.23Å; H547-F592 AromaticContact CD2-CD1 3.69Å; H547-F592 AromaticContact CD2-CG 3.95Å
548	S	93	Very high	94.7	Very high	53 Å²	53	37 Å²	37	37%	0.371	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-26.5	-172.9	54.7	0	0	0	0	115.2	P594	S548-P594 WeakPolarHBondContact CB-O 3.34Å; S548-P594 PolarHBondContact OG-O 3.14Å
549	K	92.8	Very high	94.4	Very high	157 Å²	157	34.6 Å²	34.6	68%	0.683	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-15	175.7	-64.3	-175.2	178.3	-176.6	0	115.6	N468 H547 D551	N468-K549 PolarHBondContact ND2-O 3.48Å; N468-K549 VanDerWaalsContact ND2-O 3.14Å; H547-K549 PolarHBondContact ND1-N 3.41Å; H547-K549 PolarHBondContact O-N 2.88Å; K549-D551 PolarHBondContact O-N 3.49Å
550	G	92.3	Very high	93.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.191	C	C	.	.	S	Bend	trans	82.4	-1.2	175.1	0	0	0	0	0	118.4	N466 W546 H547	N466-G550 PolarHBondContact ND2-O 3.25Å; N466-G550 WeakPolarHBondContact OD1-CA 3.45Å; W546-G550 VanDerWaalsContact CZ3-O 3.3Å; W546-G550 WeakPolarHBondContact CZ3-O 3.33Å; H547-G550 PolarHBondContact O-N 3.03Å
551	D	93.8	Very high	93.2	Very high	33 Å²	33	40.1 Å²	40.1	18%	0.176	20%	0.204	C	C	.	.	S	Bend	trans	-88.4	-34.6	173.6	178.6	40.8	0	0	0	112.6	K549 Q570 L571 S572	K549-D551 PolarHBondContact O-N 3.49Å; D551-Q570 VanDerWaalsContact OD2-CG 3.27Å; D551-Q570 WeakPolarHBondContact OD2-CG 3.47Å; D551-Q570 PolarHBondContact OD2-NE2 3.2Å; D551-L571 PolarHBondContact O-N 3.29Å; D551-S572 WeakPolarHBondContact OD1-CB 3.08Å; D551-S572 PolarHBondContact OD1-N 2.91Å; D551-S572 PolarHBondContact OD1-OG 2.79Å; D551-S572 PolarHBondContact OD2-OG 3.09Å; D551-S572 VanDerWaalsContact OD2-OG 3.05Å
552	Y	95.6	Very high	92.5	Very high	88 Å²	88	41.5 Å²	41.5	35%	0.345	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	139.4	178.3	-65	-90.2	0	0	0	111.7	H547 I568 H569 Q570	H547-Y552 WeakPolarHBondContact CB-O 3.48Å; H547-Y552 PolarHBondContact N-O 3.48Å; Y552-I568 HydrophobicContact CD1-CG2 3.87Å; Y552-H569 VanDerWaalsContact CA-O 3.24Å; Y552-H569 WeakPolarHBondContact CA-O 3.45Å; Y552-Q570 HydrophobicContact CD1-CB 3.94Å; Y552-Q570 HydrophobicContact CD1-CG 4.13Å; Y552-Q570 HydrophobicContact CE1-CB 3.76Å; Y552-Q570 HydrophobicContact CE1-CG 3.76Å; Y552-Q570 HydrophobicContact CE2-CG 4.48Å; Y552-Q570 PolarHBondContact OH-NE2 3.35Å
553	L	96.1	Very high	92	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	162.8	162.1	73.5	123.7	0	0	0	110.5	V482 I484 I535 V544 T545 W546 I568 H569 L571	V482-L553 HydrophobicContact CG1-CD1 4.3Å; I484-L553 HydrophobicContact CD1-CD2 4.3Å; I535-L553 HydrophobicContact CD1-CD2 4.35Å; V544-L553 HydrophobicContact CG2-CB 4.5Å; V544-L553 HydrophobicContact CG2-CD1 3.51Å; T545-L553 CarbonylContact O-C 3.55Å; T545-L553 VanDerWaalsContact O-CA 3.27Å; T545-L553 WeakPolarHBondContact O-CA 3.32Å; T545-L553 WeakPolarHBondContact O-CB 3.49Å; W546-L553 HydrophobicContact CD2-CB 4.18Å; W546-L553 HydrophobicContact CE3-CB 3.96Å; W546-L553 HydrophobicContact CH2-CD2 4.42Å; W546-L553 HydrophobicContact CZ3-CB 4.32Å; W546-L553 HydrophobicContact CZ3-CD2 4.3Å; L553-I568 WeakPolarHBondContact O-CA 3.49Å; L553-H569 HydrophobicContact CD1-CB 4.48Å; L553-H569 HydrophobicContact CD2-CB 3.89Å; L553-H569 HydrophobicContact CG-CB 3.88Å; L553-H569 PolarHBondContact N-O 3.47Å; L553-H569 PolarHBondContact O-N 3.13Å; L553-L571 HydrophobicContact CD2-CD1 3.38Å
554	A	97.1	Very high	91.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	144.9	167.7	0	0	0	0	0	110.3	V544 T545 F567 I568 V590 F592 F599	V544-A554 WeakPolarHBondContact CA-O 3.38Å; T545-A554 HydrophobicContact CG2-CB 4.07Å; T545-A554 PolarHBondContact N-O 3.26Å; T545-A554 PolarHBondContact O-N 3.25Å; A554-F567 CarbonylContact C-O 3.51Å; A554-F567 VanDerWaalsContact CA-O 3.23Å; A554-F567 WeakPolarHBondContact CA-O 3.37Å; A554-I568 HydrophobicContact CB-CG1 4.32Å; A554-V590 HydrophobicContact CB-CG2 3.95Å; A554-F592 HydrophobicContact CB-CE2 3.64Å; A554-F592 HydrophobicContact CB-CZ 3.74Å; A554-F599 HydrophobicContact CB-CE2 3.85Å; A554-F599 HydrophobicContact CB-CZ 3.88Å
555	S	96.6	Very high	91.4	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	149.7	176.9	60.1	0	0	0	0	110.4	H537 Q543 V566 F567 H569	H537-S555 PolarHBondContact CE1-OG 3.05Å; H537-S555 VanDerWaalsContact CE1-OG 3.23Å; Q543-S555 WeakPolarHBondContact O-CA 3.24Å; S555-V566 WeakPolarHBondContact O-CA 3.35Å; S555-F567 PolarHBondContact N-O 2.67Å; S555-F567 PolarHBondContact O-N 2.6Å; S555-F567 PolarHBondContact OG-O 3.28Å; S555-H569 WeakPolarHBondContact CB-NE2 3.46Å; S555-H569 PolarHBondContact OG-NE2 3.29Å
556	V	95.9	Very high	91.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	125.1	177.1	-169.4	0	0	0	0	110.6	V541 H542 Q543 Q565 V587 V590	V541-V556 CarbonylContact C-O 3.54Å; V541-V556 WeakPolarHBondContact CA-O 3.34Å; H542-V556 PolarHBondContact N-O 3.09Å; Q543-V556 HydrophobicContact CB-CB 4.04Å; Q543-V556 HydrophobicContact CB-CG2 3.98Å; Q543-V556 PolarHBondContact O-N 3.16Å; V556-Q565 WeakPolarHBondContact CA-O 3.46Å; V556-V587 HydrophobicContact CG1-CB 4.24Å; V556-V587 HydrophobicContact CG1-CG1 3.73Å; V556-V590 HydrophobicContact CG2-CB 4.1Å; V556-V590 HydrophobicContact CG2-CG1 3.72Å; V556-V590 HydrophobicContact CG2-CG2 3.46Å; V556-V590 VanDerWaalsContact CG2-CG2 3.46Å
557	M	93.9	Very high	91.2	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.01	21%	0.21	C	C	.	.			trans	-117.7	88.6	173.1	-71.6	169.9	-79.4	0	0	108.7	H537 K539 V541 D559 M564 Q565 F567	H537-M557 HydrophobicContact CB-CE 4.47Å; H537-M557 HydrophobicContact CB-SD 3.67Å; H537-M557 WeakPolarHBondContact ND1-CE 3.29Å; K539-M557 HydrophobicContact CB-CB 4.49Å; K539-M557 HydrophobicContact CB-CG 4.5Å; K539-M557 HydrophobicContact CB-SD 4.16Å; V541-M557 HydrophobicContact CB-CG 4.47Å; V541-M557 HydrophobicContact CG2-CG 3.95Å; V541-M557 HydrophobicContact CG2-SD 4.43Å; M557-D559 PolarHBondContact O-N 3.5Å; M557-D559 VanDerWaalsContact O-N 3.1Å; M557-M564 VanDerWaalsContact CE-O 3.27Å; M557-M564 WeakPolarHBondContact CE-O 3.47Å; M557-Q565 PolarHBondContact N-O 2.85Å; M557-Q565 VanDerWaalsContact O-CA 3.24Å; M557-Q565 WeakPolarHBondContact O-CA 3.43Å; M557-Q565 VanDerWaalsContact O-CB 3.28Å; M557-Q565 WeakPolarHBondContact O-CB 3.41Å; M557-Q565 WeakPolarHBondContact O-CG 3.47Å; M557-F567 HydrophobicContact CE-CD2 3.36Å; M557-F567 HydrophobicContact CE-CE2 3.61Å; M557-F567 HydrophobicContact CE-CG 4.48Å
558	P	89.5	Confident	91.1	Very high	37 Å²	37	40.2 Å²	40.2	24%	0.24	21%	0.208	C	C	.	.			trans	-60	114.9	174.1	24.9	-33.9	0	0	0	110.2	H542 L586 V587	H542-P558 HydrophobicContact CB-CG 3.87Å; H542-P558 VanDerWaalsContact CG-CG 3.45Å; H542-P558 VanDerWaalsContact ND1-CD 3.35Å; H542-P558 WeakPolarHBondContact ND1-CD 3.27Å; H542-P558 VanDerWaalsContact ND1-CG 3.34Å; H542-P558 WeakPolarHBondContact ND1-CG 3.21Å; P558-L586 HydrophobicContact CB-CD1 3.85Å; P558-L586 HydrophobicContact CB-CG 4.37Å; P558-V587 WeakPolarHBondContact CB-O 3.39Å
559	D	86.9	Confident	91.2	Very high	22 Å²	22	37.7 Å²	37.7	12%	0.118	19%	0.19	C	C	.	.			trans	-151.8	136.4	179.8	166.5	39.5	0	0	0	109.8	K539 M557 S561 S562 Q565	K539-D559 HydrophobicContact CD-CB 3.96Å; K539-D559 WeakPolarHBondContact CD-OD2 3.39Å; K539-D559 WeakPolarHBondContact CE-OD2 3.48Å; K539-D559 IonicContact NZ-OD1 3.77Å; K539-D559 PolarHBondContact NZ-OD1 3.47Å; K539-D559 IonicContact NZ-OD2 2.84Å; K539-D559 PolarHBondContact NZ-OD2 3.17Å; M557-D559 PolarHBondContact O-N 3.5Å; M557-D559 VanDerWaalsContact O-N 3.1Å; D559-S561 PolarHBondContact OD1-N 2.96Å; D559-S561 PolarHBondContact OD1-OG 3.1Å; D559-S561 PolarHBondContact OD2-OG 3.28Å; D559-S562 WeakPolarHBondContact OD2-CB 3.42Å; D559-S562 PolarHBondContact OD2-N 3.41Å; D559-S562 PolarHBondContact OD2-OG 3.5Å; D559-Q565 HydrophobicContact CB-CG 4.4Å; D559-Q565 PolarHBondContact O-NE2 3.04Å
560	H	79.9	Confident	91.3	Very high	149 Å²	149	31.2 Å²	31.2	69%	0.69	16%	0.162	S	C	*	.	S	Bend	trans	-81.1	-25.3	178.2	-67.9	-93.7	0	0	0	113.2
561	S	80.4	Confident	91.2	Very high	96 Å²	96	31.4 Å²	31.4	67%	0.671	16%	0.163	S	C	*	.	S	Bend	trans	-91.6	-26.3	-167.4	59.7	0	0	0	0	114.9	K539 D559	K539-S561 PolarHBondContact NZ-OG 2.73Å; D559-S561 PolarHBondContact OD1-N 2.96Å; D559-S561 PolarHBondContact OD1-OG 3.1Å; D559-S561 PolarHBondContact OD2-OG 3.28Å
562	S	80.8	Confident	91.1	Very high	29 Å²	29	31.5 Å²	31.5	20%	0.203	17%	0.167	C	C	.	.			trans	-114.5	158.6	-177.7	77.7	0	0	0	0	114.3	D559 M564 Q565	D559-S562 WeakPolarHBondContact OD2-CB 3.42Å; D559-S562 PolarHBondContact OD2-N 3.41Å; D559-S562 PolarHBondContact OD2-OG 3.5Å; S562-M564 PolarHBondContact OG-N 2.8Å; S562-Q565 PolarHBondContact O-NE2 3.2Å
563	H	83.6	Confident	90.7	Very high	86 Å²	86	33 Å²	33	40%	0.398	17%	0.171	S	C	.	.	S	Bend	trans	-83.7	5.5	167.2	68.1	-86.3	0	0	0	112.5	Q565 N578 N583	H563-Q565 VanDerWaalsContact C-N 3.34Å; H563-Q565 PolarHBondContact O-N 3.33Å; H563-N578 PolarHBondContact O-ND2 2.95Å; H563-N578 VanDerWaalsContact O-ND2 3.09Å; H563-N583 VanDerWaalsContact C-ND2 3.26Å; H563-N583 PolarHBondContact O-ND2 3.15Å
564	M	87.8	Confident	90.4	Very high	56 Å²	56	34.7 Å²	34.7	28%	0.276	18%	0.178	S	C	.	.			trans	-97.1	37.4	-173.2	-68.9	-170.7	178.5	0	0	112.5	P516 M557 S562 F567	P516-M564 HydrophobicContact CB-CE 4.23Å; P516-M564 HydrophobicContact CB-SD 3.98Å; P516-M564 HydrophobicContact CG-CE 4.16Å; P516-M564 HydrophobicContact CG-SD 4.19Å; M557-M564 VanDerWaalsContact CE-O 3.27Å; M557-M564 WeakPolarHBondContact CE-O 3.47Å; S562-M564 PolarHBondContact OG-N 2.8Å; M564-F567 HydrophobicContact CB-CE2 3.98Å; M564-F567 HydrophobicContact CB-CZ 4.38Å; M564-F567 HydrophobicContact CG-CE2 4.49Å; M564-F567 HydrophobicContact CG-CZ 4.42Å
565	Q	92.8	Very high	90	Very high	9 Å²	9	41 Å²	41	4%	0.042	20%	0.202	C	C	.	.	S	Bend	trans	-84.1	-14.1	-173	-59.3	169.4	42.2	0	0	114.7	V556 M557 D559 S562 H563 N583 V587	V556-Q565 WeakPolarHBondContact CA-O 3.46Å; M557-Q565 PolarHBondContact N-O 2.85Å; M557-Q565 VanDerWaalsContact O-CA 3.24Å; M557-Q565 WeakPolarHBondContact O-CA 3.43Å; M557-Q565 VanDerWaalsContact O-CB 3.28Å; M557-Q565 WeakPolarHBondContact O-CB 3.41Å; M557-Q565 WeakPolarHBondContact O-CG 3.47Å; D559-Q565 HydrophobicContact CB-CG 4.4Å; D559-Q565 PolarHBondContact O-NE2 3.04Å; S562-Q565 PolarHBondContact O-NE2 3.2Å; H563-Q565 VanDerWaalsContact C-N 3.34Å; H563-Q565 PolarHBondContact O-N 3.33Å; Q565-N583 WeakPolarHBondContact CB-ND2 3.34Å; Q565-N583 PolarHBondContact N-ND2 3.2Å; Q565-V587 HydrophobicContact CB-CB 4.38Å; Q565-V587 HydrophobicContact CB-CG2 4.24Å
566	V	94.4	Very high	89.9	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	133.3	179.5	-177.3	0	0	0	0	109.3	S555 N578 F580 V587 V590 F599	S555-V566 WeakPolarHBondContact O-CA 3.35Å; V566-N578 PolarHBondContact O-OD1 2.99Å; V566-F580 HydrophobicContact CB-CD2 4.21Å; V566-F580 HydrophobicContact CB-CE2 4.13Å; V566-F580 HydrophobicContact CG1-CE2 4.23Å; V566-F580 HydrophobicContact CG2-CE2 4.3Å; V566-V587 HydrophobicContact CG2-CB 4.29Å; V566-V587 HydrophobicContact CG2-CG1 3.9Å; V566-V587 HydrophobicContact CG2-CG2 4.04Å; V566-V590 HydrophobicContact CG1-CG1 4.29Å; V566-V590 HydrophobicContact CG2-CG1 4.03Å; V566-F599 HydrophobicContact CG1-CE1 4.02Å; V566-F599 HydrophobicContact CG1-CZ 3.99Å
567	F	95	Very high	89.6	Confident	6 Å²	6	45.7 Å²	45.7	3%	0.026	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	146.9	167	-77.4	-106.2	0	0	0	110	P516 V517 A554 S555 M557 M564 H569 Q577 N578	P516-F567 HydrophobicContact CG-CE1 4.02Å; P516-F567 HydrophobicContact CG-CZ 3.84Å; V517-F567 HydrophobicContact CG2-CD1 3.83Å; V517-F567 HydrophobicContact CG2-CD2 4.45Å; V517-F567 HydrophobicContact CG2-CE1 3.66Å; V517-F567 HydrophobicContact CG2-CE2 4.29Å; V517-F567 HydrophobicContact CG2-CG 4.23Å; V517-F567 HydrophobicContact CG2-CZ 3.9Å; A554-F567 CarbonylContact C-O 3.51Å; A554-F567 VanDerWaalsContact CA-O 3.23Å; A554-F567 WeakPolarHBondContact CA-O 3.37Å; S555-F567 PolarHBondContact N-O 2.67Å; S555-F567 PolarHBondContact O-N 2.6Å; S555-F567 PolarHBondContact OG-O 3.28Å; M557-F567 HydrophobicContact CE-CD2 3.36Å; M557-F567 HydrophobicContact CE-CE2 3.61Å; M557-F567 HydrophobicContact CE-CG 4.48Å; M564-F567 HydrophobicContact CB-CE2 3.98Å; M564-F567 HydrophobicContact CB-CZ 4.38Å; M564-F567 HydrophobicContact CG-CE2 4.49Å; M564-F567 HydrophobicContact CG-CZ 4.42Å; F567-H569 WeakPolarHBondContact CB-NE2 3.43Å; F567-Q577 WeakPolarHBondContact CA-O 3.49Å; F567-N578 HydrophobicContact CD1-CB 4.21Å; F567-N578 HydrophobicContact CE1-CB 3.94Å; F567-N578 HydrophobicContact CZ-CB 4.12Å
568	I	95.9	Very high	89.5	Confident	22 Å²	22	47.7 Å²	47.7	11%	0.113	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	131.7	166	-62.9	175.4	0	0	0	107.1	Y552 L553 A554 Q577 P579 F592 F599 L612	Y552-I568 HydrophobicContact CD1-CG2 3.87Å; L553-I568 WeakPolarHBondContact O-CA 3.49Å; A554-I568 HydrophobicContact CB-CG1 4.32Å; I568-Q577 PolarHBondContact N-O 2.95Å; I568-Q577 PolarHBondContact O-N 3.02Å; I568-P579 HydrophobicContact CD1-CB 4.24Å; I568-P579 HydrophobicContact CD1-CG 3.99Å; I568-P579 HydrophobicContact CG1-CG 4.21Å; I568-F592 HydrophobicContact CD1-CE1 4.4Å; I568-F592 HydrophobicContact CG1-CZ 4.48Å; I568-F592 HydrophobicContact CG2-CZ 4.45Å; I568-F599 HydrophobicContact CD1-CZ 4.47Å; I568-L612 HydrophobicContact CD1-CD2 4.17Å
569	H	95	Very high	89.5	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	144.3	-177.4	-46.8	-96.7	0	0	0	109.2	W519 I535 H537 Y552 L553 S555 F567 R575 S576	W519-H569 HydrophobicContact CH2-CB 4.09Å; W519-H569 HydrophobicContact CZ2-CB 3.85Å; I535-H569 HydrophobicContact CD1-CB 4.49Å; H537-H569 AromaticContact CE1-CE1 3.31Å; H537-H569 PolarHBondContact CE1-CE1 3.44Å; H537-H569 AromaticContact CE1-NE2 3.51Å; H537-H569 AromaticContact NE2-CE1 3.56Å; H537-H569 AromaticContact NE2-NE2 3.86Å; Y552-H569 VanDerWaalsContact CA-O 3.24Å; Y552-H569 WeakPolarHBondContact CA-O 3.45Å; L553-H569 HydrophobicContact CD1-CB 4.48Å; L553-H569 HydrophobicContact CD2-CB 3.89Å; L553-H569 HydrophobicContact CG-CB 3.88Å; L553-H569 PolarHBondContact N-O 3.47Å; L553-H569 PolarHBondContact O-N 3.13Å; S555-H569 WeakPolarHBondContact CB-NE2 3.46Å; S555-H569 PolarHBondContact OG-NE2 3.29Å; F567-H569 WeakPolarHBondContact CB-NE2 3.43Å; H569-R575 CarbonylContact C-O 3.48Å; H569-R575 WeakPolarHBondContact CA-O 3.39Å; H569-S576 PolarHBondContact ND1-OG 3.48Å
570	Q	93.9	Very high	89.5	Confident	21 Å²	21	48.4 Å²	48.4	10%	0.098	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	117.9	174.9	-169.6	179.8	13.5	0	0	109.4	D551 Y552 S572 R574 R575	D551-Q570 VanDerWaalsContact OD2-CG 3.27Å; D551-Q570 WeakPolarHBondContact OD2-CG 3.47Å; D551-Q570 PolarHBondContact OD2-NE2 3.2Å; Y552-Q570 HydrophobicContact CD1-CB 3.94Å; Y552-Q570 HydrophobicContact CD1-CG 4.13Å; Y552-Q570 HydrophobicContact CE1-CB 3.76Å; Y552-Q570 HydrophobicContact CE1-CG 3.76Å; Y552-Q570 HydrophobicContact CE2-CG 4.48Å; Y552-Q570 PolarHBondContact OH-NE2 3.35Å; Q570-S572 PolarHBondContact NE2-OG 3.26Å; Q570-R574 WeakPolarHBondContact O-CA 3.2Å; Q570-R574 PolarHBondContact O-N 3.07Å; Q570-R575 PolarHBondContact N-O 3.06Å; Q570-R575 PolarHBondContact O-N 3.48Å
571	L	91.2	Very high	89.8	Confident	3 Å²	3	52.6 Å²	52.6	2%	0.016	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-63.9	-51.2	-178.3	-97.6	67.3	0	0	0	111.5	L473 I484 L501 L502 W546 D551 L553 R573 R574	L473-L571 HydrophobicContact CD1-CD2 3.78Å; I484-L571 HydrophobicContact CG2-CD2 4.46Å; L501-L571 HydrophobicContact CD2-CD2 4.26Å; L501-L571 HydrophobicContact CG-CB 4.43Å; L502-L571 HydrophobicContact CD2-CD2 4.12Å; W546-L571 HydrophobicContact CH2-CD1 3.95Å; W546-L571 HydrophobicContact CH2-CD2 3.79Å; W546-L571 HydrophobicContact CZ3-CD1 3.85Å; W546-L571 HydrophobicContact CZ3-CD2 4.06Å; D551-L571 PolarHBondContact O-N 3.29Å; L553-L571 HydrophobicContact CD2-CD1 3.38Å; L571-R573 PolarHBondContact O-N 2.98Å; L571-R574 PolarHBondContact O-N 3.33Å
572	S	90.3	Very high	90	Very high	36 Å²	36	58.4 Å²	58.4	25%	0.252	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-59.7	-14.4	-174.6	55	0	0	0	0	115.6	A504 D551 Q570	A504-S572 WeakPolarHBondContact CB-O 3.5Å; D551-S572 WeakPolarHBondContact OD1-CB 3.08Å; D551-S572 PolarHBondContact OD1-N 2.91Å; D551-S572 PolarHBondContact OD1-OG 2.79Å; D551-S572 PolarHBondContact OD2-OG 3.09Å; D551-S572 VanDerWaalsContact OD2-OG 3.05Å; Q570-S572 PolarHBondContact NE2-OG 3.26Å
573	R	88.2	Confident	90.1	Very high	118 Å²	118	58.5 Å²	58.5	45%	0.445	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-125.8	3.8	177.1	-61.6	-170.4	-178	-142.1	1.2	113.9	E507 L571 R575	E507-R573 IonicContact OE1-CZ 3.75Å; E507-R573 IonicContact OE1-NH1 3.56Å; E507-R573 VanDerWaalsContact OE2-CD 3.31Å; E507-R573 WeakPolarHBondContact OE2-CD 3.37Å; E507-R573 IonicContact OE2-CZ 3.91Å; E507-R573 IonicContact OE2-NE 3.94Å; E507-R573 PolarHBondContact OE2-NE 2.86Å; E507-R573 IonicContact OE2-NH1 3.28Å; E507-R573 PolarHBondContact OE2-NH1 3.34Å; L571-R573 PolarHBondContact O-N 2.98Å; R573-R575 HydrophobicContact CB-CB 4.31Å; R573-R575 PolarHBondContact O-N 2.87Å; R573-R575 VanDerWaalsContact O-N 3.09Å
574	R	89.3	Confident	90.1	Very high	37 Å²	37	61.2 Å²	61.2	14%	0.14	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.4	37.7	-175.3	-56.6	177.2	-180	-156.3	-5.3	113.3	L502 A504 W519 E521 Q570 L571	L502-R574 PolarHBondContact O-NH2 2.82Å; A504-R574 PolarHBondContact O-NE 3.28Å; W519-R574 HydrophobicContact CD2-CB 4Å; W519-R574 VanDerWaalsContact CE2-C 3.42Å; W519-R574 VanDerWaalsContact CE2-O 3.28Å; W519-R574 HydrophobicContact CE3-CB 3.92Å; W519-R574 HydrophobicContact CE3-CG 4.22Å; W519-R574 HydrophobicContact CG-CB 4.37Å; W519-R574 HydrophobicContact CZ3-CB 4.34Å; W519-R574 HydrophobicContact CZ3-CG 4.5Å; W519-R574 PolarHBondContact NE1-O 3.44Å; W519-R574 VanDerWaalsContact NE1-O 3.17Å; E521-R574 IonicContact OE1-CZ 3.11Å; E521-R574 IonicContact OE1-NH1 2.7Å; E521-R574 PolarHBondContact OE1-NH1 2.99Å; E521-R574 IonicContact OE1-NH2 2.85Å; E521-R574 PolarHBondContact OE1-NH2 3.33Å; Q570-R574 WeakPolarHBondContact O-CA 3.2Å; Q570-R574 PolarHBondContact O-N 3.07Å; L571-R574 PolarHBondContact O-N 3.33Å
575	R	89.6	Confident	90	Very high	131 Å²	131	60.8 Å²	60.8	49%	0.494	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	134.8	-171.6	-171.7	174.1	179.1	-175.4	1.8	111	H569 Q570 R573 Q577	H569-R575 CarbonylContact C-O 3.48Å; H569-R575 WeakPolarHBondContact CA-O 3.39Å; Q570-R575 PolarHBondContact N-O 3.06Å; Q570-R575 PolarHBondContact O-N 3.48Å; R573-R575 HydrophobicContact CB-CB 4.31Å; R573-R575 PolarHBondContact O-N 2.87Å; R573-R575 VanDerWaalsContact O-N 3.09Å; R575-Q577 HydrophobicContact CG-CG 4.37Å
576	S	92.8	Very high	90	Very high	9 Å²	9	61.1 Å²	61.1	6%	0.063	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	142.4	172.8	-62.7	0	0	0	0	110.5	V517 W519 H569	V517-S576 VanDerWaalsContact CG1-OG 3.28Å; V517-S576 WeakPolarHBondContact CG1-OG 3.4Å; W519-S576 PolarHBondContact NE1-OG 3.45Å; H569-S576 PolarHBondContact ND1-OG 3.48Å
577	Q	91.3	Very high	90	Very high	90 Å²	90	61.2 Å²	61.2	42%	0.421	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	134	178	-57	-176.2	35.1	0	0	109.7	F567 I568 R575 P579	F567-Q577 WeakPolarHBondContact CA-O 3.49Å; I568-Q577 PolarHBondContact N-O 2.95Å; I568-Q577 PolarHBondContact O-N 3.02Å; R575-Q577 HydrophobicContact CG-CG 4.37Å; Q577-P579 WeakPolarHBondContact O-CD 3.35Å
578	N	90.9	Very high	90	Very high	45 Å²	45	62.8 Å²	62.8	24%	0.241	29%	0.285	C	S	.	.			trans	-86.6	113.3	163.8	-179.6	-4	0	0	0	107.9	H563 V566 F567 F580	H563-N578 PolarHBondContact O-ND2 2.95Å; H563-N578 VanDerWaalsContact O-ND2 3.09Å; V566-N578 PolarHBondContact O-OD1 2.99Å; F567-N578 HydrophobicContact CD1-CB 4.21Å; F567-N578 HydrophobicContact CE1-CB 3.94Å; F567-N578 HydrophobicContact CZ-CB 4.12Å; N578-F580 PolarHBondContact ND2-O 3.09Å; N578-F580 PolarHBondContact O-N 3.21Å; N578-F580 PolarHBondContact OD1-N 3.23Å; N578-F580 PolarHBondContact OD1-O 3.34Å
579	P	88.6	Confident	90	Very high	53 Å²	53	62 Å²	62	34%	0.344	28%	0.281	S	S	.	.			trans	-72.6	-7.7	-179.6	30.7	-35.9	0	0	0	113.7	I568 Q577	I568-P579 HydrophobicContact CD1-CB 4.24Å; I568-P579 HydrophobicContact CD1-CG 3.99Å; I568-P579 HydrophobicContact CG1-CG 4.21Å; Q577-P579 WeakPolarHBondContact O-CD 3.35Å
580	F	88.8	Confident	90.1	Very high	20 Å²	20	62 Å²	62	9%	0.088	28%	0.281	C	S	.	.			trans	-124.3	122.7	-171.7	-53.3	-51.5	0	0	0	113.3	V566 N578 R582 N583 F599 V601 Y610	V566-F580 HydrophobicContact CB-CD2 4.21Å; V566-F580 HydrophobicContact CB-CE2 4.13Å; V566-F580 HydrophobicContact CG1-CE2 4.23Å; V566-F580 HydrophobicContact CG2-CE2 4.3Å; N578-F580 PolarHBondContact ND2-O 3.09Å; N578-F580 PolarHBondContact O-N 3.21Å; N578-F580 PolarHBondContact OD1-N 3.23Å; N578-F580 PolarHBondContact OD1-O 3.34Å; F580-R582 VanDerWaalsContact C-N 3.34Å; F580-N583 WeakPolarHBondContact CB-OD1 3.41Å; F580-F599 HydrophobicContact CE2-CE1 4.18Å; F580-F599 HydrophobicContact CZ-CD1 4.04Å; F580-F599 HydrophobicContact CZ-CE1 4.06Å; F580-V601 HydrophobicContact CE2-CG2 3.78Å; F580-V601 HydrophobicContact CZ-CG2 3.64Å; F580-Y610 HydrophobicContact CD1-CE1 4.27Å; F580-Y610 AromaticContact CE1-CD1 3.79Å; F580-Y610 HydrophobicContact CE1-CD1 3.79Å; F580-Y610 AromaticContact CE1-CD2 3.91Å; F580-Y610 HydrophobicContact CE1-CD2 3.91Å; F580-Y610 AromaticContact CE1-CE1 3.78Å; F580-Y610 HydrophobicContact CE1-CE1 3.78Å; F580-Y610 AromaticContact CE1-CE2 3.9Å; F580-Y610 HydrophobicContact CE1-CE2 3.9Å; F580-Y610 AromaticContact CE1-CG 3.85Å; F580-Y610 HydrophobicContact CE1-CG 3.85Å; F580-Y610 AromaticContact CE1-CZ 3.84Å; F580-Y610 AromaticContact CZ-CD2 3.9Å; F580-Y610 HydrophobicContact CZ-CD2 3.9Å; F580-Y610 AromaticContact CZ-CE2 3.93Å; F580-Y610 HydrophobicContact CZ-CE2 3.93Å; F580-Y610 HydrophobicContact CZ-CG 4.24Å
581	R	85.5	Confident	90.2	Very high	238 Å²	238	62 Å²	62	90%	0.898	28%	0.283	S	S	*	.	S	Bend	trans	-67.4	-31.9	171.9	-63.2	-175.6	-177.3	-177.4	0.7	112.9
582	R	84.3	Confident	90.5	Very high	218 Å²	218	62.5 Å²	62.5	82%	0.823	29%	0.286	S	S	*	.	S	Bend	trans	-149.9	132.3	178.3	-62	-179.3	76.4	177.4	4.2	110.1	F580	F580-R582 VanDerWaalsContact C-N 3.34Å
583	N	82.7	Confident	90.8	Very high	31 Å²	31	60.9 Å²	60.9	17%	0.166	27%	0.274	C	S	.	.			trans	-91.7	143.1	174.3	-60.6	-33.3	0	0	0	110.8	H563 Q565 F580	H563-N583 VanDerWaalsContact C-ND2 3.26Å; H563-N583 PolarHBondContact O-ND2 3.15Å; Q565-N583 WeakPolarHBondContact CB-ND2 3.34Å; Q565-N583 PolarHBondContact N-ND2 3.2Å; F580-N583 WeakPolarHBondContact CB-OD1 3.41Å
584	K	83.3	Confident	91	Very high	143 Å²	143	57.2 Å²	57.2	62%	0.622	27%	0.265	S	S	*	.	S	Bend	trans	-104.1	76.6	-178.8	-70.2	-166.8	175.2	-169.9	0	111	R608	K584-R608 PolarHBondContact O-NH1 2.93Å; K584-R608 PolarHBondContact O-NH2 3.38Å
585	G	87	Confident	91.2	Very high	47 Å²	47	61.6 Å²	61.6	49%	0.485	29%	0.291	S	S	.	.	S	Bend	trans	92.9	173.3	-174.3	0	0	0	0	0	113	V587	G585-V587 PolarHBondContact O-N 2.81Å
586	L	92.3	Very high	91.4	Very high	16 Å²	16	60.5 Å²	60.5	8%	0.084	29%	0.286	C	S	.	.			trans	-65.9	122	-178	-175.4	68.8	0	0	0	111.5	P558 Q588 T603 Q604 W627	P558-L586 HydrophobicContact CB-CD1 3.85Å; P558-L586 HydrophobicContact CB-CG 4.37Å; L586-Q588 VanDerWaalsContact CD2-NE2 3.34Å; L586-T603 CarbonylContact O-C 3.6Å; L586-T603 WeakPolarHBondContact O-CA 3.28Å; L586-T603 VanDerWaalsContact O-CB 3.29Å; L586-T603 WeakPolarHBondContact O-CB 3.49Å; L586-Q604 PolarHBondContact O-N 2.87Å; L586-W627 HydrophobicContact CD2-CZ3 4.49Å
587	V	94.8	Very high	91.5	Very high	1 Å²	1	63 Å²	63	1%	0.006	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	130.1	171.3	-175.2	0	0	0	0	109.8	V556 P558 Q565 V566 G585 V590 V601 T603	V556-V587 HydrophobicContact CG1-CB 4.24Å; V556-V587 HydrophobicContact CG1-CG1 3.73Å; P558-V587 WeakPolarHBondContact CB-O 3.39Å; Q565-V587 HydrophobicContact CB-CB 4.38Å; Q565-V587 HydrophobicContact CB-CG2 4.24Å; V566-V587 HydrophobicContact CG2-CB 4.29Å; V566-V587 HydrophobicContact CG2-CG1 3.9Å; V566-V587 HydrophobicContact CG2-CG2 4.04Å; G585-V587 PolarHBondContact O-N 2.81Å; V587-V590 HydrophobicContact CG1-CG1 3.95Å; V587-V601 HydrophobicContact CB-CG1 4.43Å; V587-V601 HydrophobicContact CG1-CG1 3.75Å; V587-V601 HydrophobicContact CG2-CG1 3.78Å; V587-T603 HydrophobicContact CG2-CG2 3.97Å
588	Q	94.4	Very high	91.8	Very high	40 Å²	40	62 Å²	62	19%	0.187	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	-45.2	178.9	-70.6	-71.6	-21	0	0	111.3	L586 A602 Q604 I628	L586-Q588 VanDerWaalsContact CD2-NE2 3.34Å; Q588-A602 PolarHBondContact N-O 3.35Å; Q588-Q604 HydrophobicContact CG-CB 4.5Å; Q588-I628 WeakPolarHBondContact CG-O 3.46Å
589	A	95.5	Very high	92.1	Very high	4 Å²	4	59.9 Å²	59.9	3%	0.033	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	157.7	-179.8	0	0	0	0	0	112	Q543 A602 I631	Q543-A589 VanDerWaalsContact OE1-CA 3.23Å; A589-A602 HydrophobicContact CB-CB 4.25Å; A589-A602 PolarHBondContact N-O 3.37Å; A589-A602 WeakPolarHBondContact O-CA 3.34Å; A589-A602 WeakPolarHBondContact O-CB 3.45Å; A589-A602 PolarHBondContact O-N 3.41Å; A589-I631 HydrophobicContact CB-CG1 4.18Å
590	V	96.9	Very high	92.5	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.006	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	158.7	172.4	-57.1	0	0	0	0	111.4	Q543 T545 A554 V556 V566 V587 F599 F600 V601	Q543-V590 PolarHBondContact OE1-O 2.74Å; T545-V590 HydrophobicContact CG2-CG2 3.75Å; A554-V590 HydrophobicContact CB-CG2 3.95Å; V556-V590 HydrophobicContact CG2-CB 4.1Å; V556-V590 HydrophobicContact CG2-CG1 3.72Å; V556-V590 HydrophobicContact CG2-CG2 3.46Å; V556-V590 VanDerWaalsContact CG2-CG2 3.46Å; V566-V590 HydrophobicContact CG1-CG1 4.29Å; V566-V590 HydrophobicContact CG2-CG1 4.03Å; V587-V590 HydrophobicContact CG1-CG1 3.95Å; V590-F599 HydrophobicContact CB-CE1 4.39Å; V590-F599 HydrophobicContact CB-CE2 4.11Å; V590-F599 HydrophobicContact CB-CZ 3.69Å; V590-F599 HydrophobicContact CG1-CE1 4.35Å; V590-F599 HydrophobicContact CG1-CZ 4.01Å; V590-F599 HydrophobicContact CG2-CE2 4.2Å; V590-F599 HydrophobicContact CG2-CZ 3.89Å; V590-F600 CarbonylContact C-O 3.57Å; V590-F600 VanDerWaalsContact CA-O 3.23Å; V590-F600 WeakPolarHBondContact CA-O 3.31Å; V590-F600 WeakPolarHBondContact CB-O 3.44Å; V590-V601 HydrophobicContact CG1-CG1 4.29Å; V590-V601 HydrophobicContact CG1-CG2 4.26Å
591	S	96.8	Very high	92.8	Very high	20 Å²	20	56.6 Å²	56.6	14%	0.14	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	140.8	175.1	-165.2	0	0	0	0	110.9	F600	S591-F600 PolarHBondContact N-O 2.8Å; S591-F600 PolarHBondContact O-N 2.94Å
592	F	97	Very high	93.3	Very high	15 Å²	15	45.2 Å²	45.2	7%	0.066	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	142.2	167	-67	-83.2	0	0	0	109.7	T545 W546 H547 A554 I568 F599 L612	T545-F592 HydrophobicContact CG2-CD2 4.17Å; T545-F592 HydrophobicContact CG2-CE2 4.23Å; W546-F592 VanDerWaalsContact C-CD2 3.49Å; H547-F592 HydrophobicContact CB-CD1 4.14Å; H547-F592 HydrophobicContact CB-CD2 3.98Å; H547-F592 HydrophobicContact CB-CE1 4.26Å; H547-F592 HydrophobicContact CB-CE2 4.09Å; H547-F592 HydrophobicContact CB-CG 3.99Å; H547-F592 HydrophobicContact CB-CZ 4.23Å; H547-F592 AromaticContact CD2-CD1 3.69Å; H547-F592 AromaticContact CD2-CG 3.95Å; A554-F592 HydrophobicContact CB-CE2 3.64Å; A554-F592 HydrophobicContact CB-CZ 3.74Å; I568-F592 HydrophobicContact CD1-CE1 4.4Å; I568-F592 HydrophobicContact CG1-CZ 4.48Å; I568-F592 HydrophobicContact CG2-CZ 4.45Å; F592-F599 AromaticContact CD1-CD2 3.59Å; F592-F599 HydrophobicContact CD1-CD2 3.59Å; F592-F599 HydrophobicContact CD1-CE2 4.07Å; F592-F599 HydrophobicContact CD2-CE2 4.39Å; F592-F599 AromaticContact CE1-CD2 3.69Å; F592-F599 HydrophobicContact CE1-CD2 3.69Å; F592-F599 AromaticContact CE1-CE2 3.85Å; F592-F599 HydrophobicContact CE1-CE2 3.85Å; F592-F599 HydrophobicContact CE2-CE2 4.2Å; F592-F599 HydrophobicContact CG-CD2 4.08Å; F592-F599 HydrophobicContact CG-CE2 4.34Å; F592-F599 HydrophobicContact CZ-CD2 4.26Å; F592-F599 AromaticContact CZ-CE2 3.94Å; F592-F599 HydrophobicContact CZ-CE2 3.94Å; F592-L612 HydrophobicContact CD1-CD1 4.4Å; F592-L612 HydrophobicContact CE1-CD1 4.28Å
593	H	96.6	Very high	93.8	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	18%	0.184	C	C	.	.			trans	-64.6	139.5	166.4	-177.2	-60.9	0	0	0	109.2	I595 R596 Y598 F600	H593-I595 PolarHBondContact ND1-N 3.26Å; H593-I595 VanDerWaalsContact ND1-N 3.19Å; H593-I595 PolarHBondContact O-N 3.11Å; H593-R596 WeakPolarHBondContact CB-O 3.32Å; H593-R596 PolarHBondContact CE1-N 3.36Å; H593-R596 VanDerWaalsContact CE1-N 3.34Å; H593-R596 PolarHBondContact ND1-N 3.3Å; H593-R596 PolarHBondContact ND1-O 2.84Å; H593-R596 PolarHBondContact NE2-NH1 3.44Å; H593-Y598 WeakPolarHBondContact CB-O 3.38Å; H593-Y598 AromaticContact CD2-CD2 3.69Å; H593-Y598 PolarHBondContact N-O 3.18Å; H593-F600 HydrophobicContact CB-CD2 4.42Å; H593-F600 HydrophobicContact CB-CE2 3.74Å
594	P	93.4	Very high	94.3	Very high	41 Å²	41	35.3 Å²	35.3	27%	0.266	18%	0.184	S	C	.	.	S	Bend	trans	-63.7	-43.5	-172.4	21	-32.7	0	0	0	114	S548 S635	S548-P594 WeakPolarHBondContact CB-O 3.34Å; S548-P594 PolarHBondContact OG-O 3.14Å; P594-S635 VanDerWaalsContact CG-O 3.24Å; P594-S635 WeakPolarHBondContact CG-O 3.29Å
595	I	92.6	Very high	94.8	Very high	130 Å²	130	37 Å²	37	67%	0.667	19%	0.186	S	C	*	.	S	Bend	trans	-108.9	-59	-172	-53.2	172.4	0	0	0	113.5	H593	H593-I595 PolarHBondContact ND1-N 3.26Å; H593-I595 VanDerWaalsContact ND1-N 3.19Å; H593-I595 PolarHBondContact O-N 3.11Å
596	R	94.4	Very high	95.2	Very high	107 Å²	107	35.2 Å²	35.2	40%	0.404	17%	0.166	S	C	.	.	S	Bend	trans	-78.3	156.4	-178.5	-54.8	-177.7	-167.5	120	-9.4	111.5	H593 Y598 D638	H593-R596 WeakPolarHBondContact CB-O 3.32Å; H593-R596 PolarHBondContact CE1-N 3.36Å; H593-R596 VanDerWaalsContact CE1-N 3.34Å; H593-R596 PolarHBondContact ND1-N 3.3Å; H593-R596 PolarHBondContact ND1-O 2.84Å; H593-R596 PolarHBondContact NE2-NH1 3.44Å; R596-Y598 HydrophobicContact CB-CD2 3.77Å; R596-Y598 HydrophobicContact CB-CE2 4.05Å; R596-Y598 PolarHBondContact O-N 3.39Å; R596-D638 IonicContact CZ-OD1 2.64Å; R596-D638 VanDerWaalsContact CZ-OD1 3.22Å; R596-D638 IonicContact NH1-OD1 3.76Å; R596-D638 PolarHBondContact NH1-OD1 2.94Å; R596-D638 IonicContact NH2-OD1 3.76Å; R596-D638 PolarHBondContact NH2-OD1 3.35Å; R596-D638 IonicContact NH2-OD2 3.82Å
597	P	95.1	Very high	95.4	Very high	62 Å²	62	34.4 Å²	34.4	40%	0.403	16%	0.162	S	C	.	.	S	Bend	trans	-79.6	50.8	-178.7	35.4	-38.3	0	0	0	113.4	L612 V613	P597-L612 PolarHBondContact O-N 2.99Å; P597-V613 HydrophobicContact CB-CG2 3.88Å; P597-V613 HydrophobicContact CG-CG2 3.73Å
598	Y	96.3	Very high	95.4	Very high	69 Å²	69	35.4 Å²	35.4	27%	0.271	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	150.1	172.8	-64.9	-57.8	0	0	0	111.4	H593 R596 I609 Y610 N611 T618	H593-Y598 WeakPolarHBondContact CB-O 3.38Å; H593-Y598 AromaticContact CD2-CD2 3.69Å; H593-Y598 PolarHBondContact N-O 3.18Å; R596-Y598 HydrophobicContact CB-CD2 3.77Å; R596-Y598 HydrophobicContact CB-CE2 4.05Å; R596-Y598 PolarHBondContact O-N 3.39Å; Y598-I609 HydrophobicContact CD1-CG2 4.25Å; Y598-I609 HydrophobicContact CG-CG2 4.23Å; Y598-Y610 CarbonylContact C-O 3.6Å; Y598-Y610 VanDerWaalsContact CA-O 3.27Å; Y598-Y610 WeakPolarHBondContact CA-O 3.28Å; Y598-N611 HydrophobicContact CD1-CB 4.03Å; Y598-N611 HydrophobicContact CE1-CB 3.88Å; Y598-T618 HydrophobicContact CE1-CG2 4.01Å
599	F	96.8	Very high	95.5	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	125.5	178.9	-174.2	-115.5	0	0	0	110.1	A554 V566 I568 F580 V590 F592 V601 Y610 L612	A554-F599 HydrophobicContact CB-CE2 3.85Å; A554-F599 HydrophobicContact CB-CZ 3.88Å; V566-F599 HydrophobicContact CG1-CE1 4.02Å; V566-F599 HydrophobicContact CG1-CZ 3.99Å; I568-F599 HydrophobicContact CD1-CZ 4.47Å; F580-F599 HydrophobicContact CE2-CE1 4.18Å; F580-F599 HydrophobicContact CZ-CD1 4.04Å; F580-F599 HydrophobicContact CZ-CE1 4.06Å; V590-F599 HydrophobicContact CB-CE1 4.39Å; V590-F599 HydrophobicContact CB-CE2 4.11Å; V590-F599 HydrophobicContact CB-CZ 3.69Å; V590-F599 HydrophobicContact CG1-CE1 4.35Å; V590-F599 HydrophobicContact CG1-CZ 4.01Å; V590-F599 HydrophobicContact CG2-CE2 4.2Å; V590-F599 HydrophobicContact CG2-CZ 3.89Å; F592-F599 AromaticContact CD1-CD2 3.59Å; F592-F599 HydrophobicContact CD1-CD2 3.59Å; F592-F599 HydrophobicContact CD1-CE2 4.07Å; F592-F599 HydrophobicContact CD2-CE2 4.39Å; F592-F599 AromaticContact CE1-CD2 3.69Å; F592-F599 HydrophobicContact CE1-CD2 3.69Å; F592-F599 AromaticContact CE1-CE2 3.85Å; F592-F599 HydrophobicContact CE1-CE2 3.85Å; F592-F599 HydrophobicContact CE2-CE2 4.2Å; F592-F599 HydrophobicContact CG-CD2 4.08Å; F592-F599 HydrophobicContact CG-CE2 4.34Å; F592-F599 HydrophobicContact CZ-CD2 4.26Å; F592-F599 AromaticContact CZ-CE2 3.94Å; F592-F599 HydrophobicContact CZ-CE2 3.94Å; F599-V601 HydrophobicContact CD1-CG2 3.73Å; F599-V601 HydrophobicContact CE1-CG2 3.61Å; F599-Y610 PolarHBondContact N-O 2.91Å; F599-Y610 PolarHBondContact O-N 3.37Å; F599-L612 HydrophobicContact CB-CD1 4.07Å; F599-L612 HydrophobicContact CB-CD2 3.75Å; F599-L612 HydrophobicContact CB-CG 3.88Å; F599-L612 HydrophobicContact CG-CD2 4.3Å
600	F	97.1	Very high	95.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	127.7	-177.9	-63.6	-94.2	0	0	0	109.9	V590 S591 H593 V607 R608 I609 I631 V633 V640 L654	V590-F600 CarbonylContact C-O 3.57Å; V590-F600 VanDerWaalsContact CA-O 3.23Å; V590-F600 WeakPolarHBondContact CA-O 3.31Å; V590-F600 WeakPolarHBondContact CB-O 3.44Å; S591-F600 PolarHBondContact N-O 2.8Å; S591-F600 PolarHBondContact O-N 2.94Å; H593-F600 HydrophobicContact CB-CD2 4.42Å; H593-F600 HydrophobicContact CB-CE2 3.74Å; F600-V607 HydrophobicContact CB-CG1 4.31Å; F600-V607 HydrophobicContact CD1-CG1 4.26Å; F600-R608 WeakPolarHBondContact CA-O 3.28Å; F600-I609 HydrophobicContact CD1-CD1 4.05Å; F600-I609 HydrophobicContact CD1-CG1 3.75Å; F600-I609 HydrophobicContact CD1-CG2 4.47Å; F600-I609 HydrophobicContact CE1-CD1 3.48Å; F600-I609 VanDerWaalsContact CE1-CD1 3.48Å; F600-I609 HydrophobicContact CE1-CG1 3.71Å; F600-I609 HydrophobicContact CE1-CG2 4.26Å; F600-I609 HydrophobicContact CZ-CD1 4.34Å; F600-I631 HydrophobicContact CB-CD1 3.88Å; F600-V633 HydrophobicContact CD2-CG2 3.58Å; F600-V633 HydrophobicContact CE2-CB 4.37Å; F600-V633 HydrophobicContact CE2-CG1 3.8Å; F600-V633 HydrophobicContact CE2-CG2 3.58Å; F600-V633 HydrophobicContact CG-CG2 4.13Å; F600-V633 HydrophobicContact CZ-CG1 4.03Å; F600-V633 HydrophobicContact CZ-CG2 4.14Å; F600-V640 HydrophobicContact CD1-CG2 4.08Å; F600-V640 HydrophobicContact CE1-CG2 3.48Å; F600-V640 VanDerWaalsContact CE1-CG2 3.48Å; F600-V640 HydrophobicContact CZ-CG2 3.91Å; F600-L654 HydrophobicContact CE1-CD1 4.01Å; F600-L654 HydrophobicContact CZ-CD1 4Å
601	V	96.1	Very high	95.5	Very high	4 Å²	4	36.1 Å²	36.1	2%	0.024	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	104	176.5	-177.1	0	0	0	0	109	F580 V587 V590 F599 T603 V607 R608 Y610	F580-V601 HydrophobicContact CE2-CG2 3.78Å; F580-V601 HydrophobicContact CZ-CG2 3.64Å; V587-V601 HydrophobicContact CB-CG1 4.43Å; V587-V601 HydrophobicContact CG1-CG1 3.75Å; V587-V601 HydrophobicContact CG2-CG1 3.78Å; V590-V601 HydrophobicContact CG1-CG1 4.29Å; V590-V601 HydrophobicContact CG1-CG2 4.26Å; F599-V601 HydrophobicContact CD1-CG2 3.73Å; F599-V601 HydrophobicContact CE1-CG2 3.61Å; V601-T603 HydrophobicContact CG1-CG2 4.46Å; V601-T603 PolarHBondContact O-N 3.45Å; V601-V607 WeakPolarHBondContact O-CA 3.24Å; V601-R608 PolarHBondContact N-O 3.24Å; V601-R608 PolarHBondContact O-N 2.94Å; V601-Y610 HydrophobicContact CB-CD2 4.49Å; V601-Y610 HydrophobicContact CB-CE2 4.08Å; V601-Y610 HydrophobicContact CG2-CD2 3.92Å; V601-Y610 HydrophobicContact CG2-CE2 3.85Å
602	A	96.3	Very high	95.3	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	106.1	171.3	0	0	0	0	0	109.6	Q588 A589 V607 I628 I631	Q588-A602 PolarHBondContact N-O 3.35Å; A589-A602 HydrophobicContact CB-CB 4.25Å; A589-A602 PolarHBondContact N-O 3.37Å; A589-A602 WeakPolarHBondContact O-CA 3.34Å; A589-A602 WeakPolarHBondContact O-CB 3.45Å; A589-A602 PolarHBondContact O-N 3.41Å; A602-V607 HydrophobicContact CB-CG2 4.13Å; A602-I628 HydrophobicContact CB-CG2 4.05Å; A602-I631 HydrophobicContact CB-CD1 4.03Å; A602-I631 HydrophobicContact CB-CG1 4.11Å; A602-I631 HydrophobicContact CB-CG2 3.77Å
603	T	94.8	Very high	95.1	Very high	5 Å²	5	42.8 Å²	42.8	3%	0.031	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	157.7	161.9	56.3	0	0	0	0	110.4	L586 V587 V601 R605 S606 R608 I628	L586-T603 CarbonylContact O-C 3.6Å; L586-T603 WeakPolarHBondContact O-CA 3.28Å; L586-T603 VanDerWaalsContact O-CB 3.29Å; L586-T603 WeakPolarHBondContact O-CB 3.49Å; V587-T603 HydrophobicContact CG2-CG2 3.97Å; V601-T603 HydrophobicContact CG1-CG2 4.46Å; V601-T603 PolarHBondContact O-N 3.45Å; T603-R605 PolarHBondContact O-N 3.08Å; T603-S606 PolarHBondContact N-O 2.89Å; T603-S606 PolarHBondContact O-N 3.12Å; T603-S606 VanDerWaalsContact O-O 3.04Å; T603-S606 PolarHBondContact OG1-O 2.95Å; T603-S606 PolarHBondContact OG1-OG 2.7Å; T603-R608 PolarHBondContact OG1-NH1 3.29Å; T603-I628 WeakPolarHBondContact O-CD1 3.47Å
604	Q	93.4	Very high	95	Very high	35 Å²	35	49 Å²	49	16%	0.164	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-34.2	-41.4	-177.4	-176.1	-172.7	-16.2	0	0	116.7	L586 Q588 K626 W627 I628	L586-Q604 PolarHBondContact O-N 2.87Å; Q588-Q604 HydrophobicContact CG-CB 4.5Å; Q604-K626 VanDerWaalsContact CG-O 3.29Å; Q604-K626 WeakPolarHBondContact CG-O 3.36Å; Q604-K626 PolarHBondContact NE2-O 3.41Å; Q604-W627 HydrophobicContact CG-CD2 3.83Å; Q604-W627 HydrophobicContact CG-CE3 3.56Å; Q604-W627 HydrophobicContact CG-CG 4.29Å; Q604-W627 HydrophobicContact CG-CZ3 4.01Å; Q604-W627 VanDerWaalsContact NE2-CD2 3.32Å; Q604-W627 VanDerWaalsContact NE2-CZ2 3.29Å; Q604-W627 CarbonylContact O-C 3.58Å; Q604-W627 WeakPolarHBondContact O-CA 3.46Å; Q604-I628 PolarHBondContact O-N 3.36Å
605	R	93.1	Very high	94.8	Very high	179 Å²	179	55.7 Å²	55.7	68%	0.675	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112	-9.2	-179.2	-58.7	-175	-173.4	-177.6	2.6	115.3	T603	T603-R605 PolarHBondContact O-N 3.08Å
606	S	95.3	Very high	94.9	Very high	9 Å²	9	53.4 Å²	53.4	6%	0.063	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	146.1	-170.8	62.9	0	0	0	0	113.7	T603 L621	T603-S606 PolarHBondContact N-O 2.89Å; T603-S606 PolarHBondContact O-N 3.12Å; T603-S606 VanDerWaalsContact O-O 3.04Å; T603-S606 PolarHBondContact OG1-O 2.95Å; T603-S606 PolarHBondContact OG1-OG 2.7Å; S606-L621 WeakPolarHBondContact CA-O 3.44Å; S606-L621 VanDerWaalsContact CB-O 3.25Å; S606-L621 WeakPolarHBondContact CB-O 3.4Å
607	V	96.4	Very high	94.9	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	129.5	173	-171.5	0	0	0	0	108.8	F600 V601 A602 L621 I628 I631	F600-V607 HydrophobicContact CB-CG1 4.31Å; F600-V607 HydrophobicContact CD1-CG1 4.26Å; V601-V607 WeakPolarHBondContact O-CA 3.24Å; A602-V607 HydrophobicContact CB-CG2 4.13Å; V607-L621 HydrophobicContact CB-CB 4.24Å; V607-L621 HydrophobicContact CB-CD1 4.27Å; V607-L621 PolarHBondContact N-O 2.87Å; V607-L621 VanDerWaalsContact N-O 3.1Å; V607-L621 PolarHBondContact O-N 2.69Å; V607-I628 HydrophobicContact CG2-CD1 3.98Å; V607-I631 HydrophobicContact CG2-CG2 3.92Å
608	R	95.4	Very high	94.8	Very high	22 Å²	22	51.7 Å²	51.7	8%	0.083	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	137.3	175.1	-66.3	-178.8	-166.4	81.5	-2.7	110.1	K584 F600 V601 T603 Y610 M617 K620	K584-R608 PolarHBondContact O-NH1 2.93Å; K584-R608 PolarHBondContact O-NH2 3.38Å; F600-R608 WeakPolarHBondContact CA-O 3.28Å; V601-R608 PolarHBondContact N-O 3.24Å; V601-R608 PolarHBondContact O-N 2.94Å; T603-R608 PolarHBondContact OG1-NH1 3.29Å; R608-Y610 HydrophobicContact CB-CD2 4.3Å; R608-Y610 HydrophobicContact CB-CE2 3.55Å; R608-Y610 WeakPolarHBondContact CD-OH 3.38Å; R608-M617 HydrophobicContact CB-CG 4.41Å; R608-M617 HydrophobicContact CB-SD 4.3Å; R608-M617 HydrophobicContact CG-SD 4.09Å; R608-K620 HydrophobicContact CG-CG 4.31Å
609	I	96.4	Very high	94.7	Very high	6 Å²	6	51.7 Å²	51.7	3%	0.031	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	127.5	176.8	-45.7	-173.8	0	0	0	107.9	Y598 F600 M617 T618 K619 L621 L654	Y598-I609 HydrophobicContact CD1-CG2 4.25Å; Y598-I609 HydrophobicContact CG-CG2 4.23Å; F600-I609 HydrophobicContact CD1-CD1 4.05Å; F600-I609 HydrophobicContact CD1-CG1 3.75Å; F600-I609 HydrophobicContact CD1-CG2 4.47Å; F600-I609 HydrophobicContact CE1-CD1 3.48Å; F600-I609 VanDerWaalsContact CE1-CD1 3.48Å; F600-I609 HydrophobicContact CE1-CG1 3.71Å; F600-I609 HydrophobicContact CE1-CG2 4.26Å; F600-I609 HydrophobicContact CZ-CD1 4.34Å; I609-M617 CarbonylContact O-C 3.38Å; I609-M617 WeakPolarHBondContact O-CA 3.39Å; I609-M617 WeakPolarHBondContact O-CG 3.5Å; I609-T618 PolarHBondContact O-N 3.45Å; I609-T618 PolarHBondContact O-OG1 2.9Å; I609-K619 HydrophobicContact CB-CB 4.48Å; I609-K619 HydrophobicContact CD1-CB 4.08Å; I609-K619 HydrophobicContact CG1-CB 4.3Å; I609-K619 PolarHBondContact N-O 3.39Å; I609-L621 HydrophobicContact CD1-CD1 4.44Å; I609-L654 HydrophobicContact CD1-CD1 3.96Å; I609-L654 HydrophobicContact CD1-CD2 3.79Å; I609-L654 HydrophobicContact CD1-CG 4.47Å
610	Y	95.5	Very high	94.7	Very high	35 Å²	35	56.1 Å²	56.1	14%	0.137	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	140.8	177.5	-65.1	-91.3	0	0	0	110.4	F580 Y598 F599 V601 R608 E616 M617	F580-Y610 HydrophobicContact CD1-CE1 4.27Å; F580-Y610 AromaticContact CE1-CD1 3.79Å; F580-Y610 HydrophobicContact CE1-CD1 3.79Å; F580-Y610 AromaticContact CE1-CD2 3.91Å; F580-Y610 HydrophobicContact CE1-CD2 3.91Å; F580-Y610 AromaticContact CE1-CE1 3.78Å; F580-Y610 HydrophobicContact CE1-CE1 3.78Å; F580-Y610 AromaticContact CE1-CE2 3.9Å; F580-Y610 HydrophobicContact CE1-CE2 3.9Å; F580-Y610 AromaticContact CE1-CG 3.85Å; F580-Y610 HydrophobicContact CE1-CG 3.85Å; F580-Y610 AromaticContact CE1-CZ 3.84Å; F580-Y610 AromaticContact CZ-CD2 3.9Å; F580-Y610 HydrophobicContact CZ-CD2 3.9Å; F580-Y610 AromaticContact CZ-CE2 3.93Å; F580-Y610 HydrophobicContact CZ-CE2 3.93Å; F580-Y610 HydrophobicContact CZ-CG 4.24Å; Y598-Y610 CarbonylContact C-O 3.6Å; Y598-Y610 VanDerWaalsContact CA-O 3.27Å; Y598-Y610 WeakPolarHBondContact CA-O 3.28Å; F599-Y610 PolarHBondContact N-O 2.91Å; F599-Y610 PolarHBondContact O-N 3.37Å; V601-Y610 HydrophobicContact CB-CD2 4.49Å; V601-Y610 HydrophobicContact CB-CE2 4.08Å; V601-Y610 HydrophobicContact CG2-CD2 3.92Å; V601-Y610 HydrophobicContact CG2-CE2 3.85Å; R608-Y610 HydrophobicContact CB-CD2 4.3Å; R608-Y610 HydrophobicContact CB-CE2 3.55Å; R608-Y610 WeakPolarHBondContact CD-OH 3.38Å; Y610-E616 CarbonylContact C-O 3.52Å; Y610-E616 WeakPolarHBondContact CA-O 3.32Å; Y610-M617 HydrophobicContact CD1-CB 3.96Å; Y610-M617 HydrophobicContact CD1-CG 4.29Å; Y610-M617 HydrophobicContact CE1-CB 3.85Å; Y610-M617 HydrophobicContact CE1-CG 4.07Å
611	N	95.9	Very high	94.7	Very high	18 Å²	18	56.1 Å²	56.1	10%	0.096	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	112.7	169.8	-176.1	-33.3	0	0	0	108.8	Y598 V613 K614 Q615 E616 T618	Y598-N611 HydrophobicContact CD1-CB 4.03Å; Y598-N611 HydrophobicContact CE1-CB 3.88Å; N611-V613 VanDerWaalsContact C-N 3.3Å; N611-V613 PolarHBondContact O-N 3.1Å; N611-V613 PolarHBondContact OD1-N 3.41Å; N611-K614 HydrophobicContact CB-CB 4.14Å; N611-K614 PolarHBondContact O-N 3.4Å; N611-K614 PolarHBondContact OD1-N 3.47Å; N611-K614 VanDerWaalsContact OD1-N 3.1Å; N611-Q615 WeakPolarHBondContact O-CA 3.25Å; N611-Q615 PolarHBondContact O-N 3.19Å; N611-E616 HydrophobicContact CB-CG 4.26Å; N611-E616 PolarHBondContact N-O 2.85Å; N611-T618 HydrophobicContact CB-CG2 3.92Å
612	L	93.1	Very high	94.6	Very high	59 Å²	59	59.8 Å²	59.8	31%	0.309	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-26.8	-175.7	-65.3	179.4	0	0	0	113.2	I568 F592 P597 F599	I568-L612 HydrophobicContact CD1-CD2 4.17Å; F592-L612 HydrophobicContact CD1-CD1 4.4Å; F592-L612 HydrophobicContact CE1-CD1 4.28Å; P597-L612 PolarHBondContact O-N 2.99Å; F599-L612 HydrophobicContact CB-CD1 4.07Å; F599-L612 HydrophobicContact CB-CD2 3.75Å; F599-L612 HydrophobicContact CB-CG 3.88Å; F599-L612 HydrophobicContact CG-CD2 4.3Å
613	V	93.4	Very high	94.3	Very high	116 Å²	116	59.8 Å²	59.8	70%	0.703	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-41.3	178.8	178.2	0	0	0	0	111.2	P597 N611	P597-V613 HydrophobicContact CB-CG2 3.88Å; P597-V613 HydrophobicContact CG-CG2 3.73Å; N611-V613 VanDerWaalsContact C-N 3.3Å; N611-V613 PolarHBondContact O-N 3.1Å; N611-V613 PolarHBondContact OD1-N 3.41Å
614	K	93.4	Very high	94	Very high	133 Å²	133	63.8 Å²	63.8	58%	0.578	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-15	178.8	-72.3	-173.7	168.8	-170.3	0	114.6	N611 E616	N611-K614 HydrophobicContact CB-CB 4.14Å; N611-K614 PolarHBondContact O-N 3.4Å; N611-K614 PolarHBondContact OD1-N 3.47Å; N611-K614 VanDerWaalsContact OD1-N 3.1Å; K614-E616 HydrophobicContact CB-CB 4.49Å; K614-E616 HydrophobicContact CB-CG 3.88Å; K614-E616 HydrophobicContact CD-CG 4.05Å; K614-E616 WeakPolarHBondContact CD-OE1 3.35Å; K614-E616 WeakPolarHBondContact CE-OE1 3.35Å; K614-E616 IonicContact NZ-OE1 2.71Å; K614-E616 PolarHBondContact NZ-OE1 3.29Å; K614-E616 IonicContact NZ-OE2 3.3Å; K614-E616 PolarHBondContact O-N 2.64Å
615	Q	91.1	Very high	93.8	Very high	181 Å²	181	62.6 Å²	62.6	85%	0.846	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.9	23.6	-173.5	-53.5	-175.8	-12.7	0	0	114.6	N611	N611-Q615 WeakPolarHBondContact O-CA 3.25Å; N611-Q615 PolarHBondContact O-N 3.19Å
616	E	93.6	Very high	93.8	Very high	81 Å²	81	61.4 Å²	61.4	38%	0.379	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	157	-179.9	75.5	-174.6	-175.7	0	0	112.8	Y610 N611 K614 T618	Y610-E616 CarbonylContact C-O 3.52Å; Y610-E616 WeakPolarHBondContact CA-O 3.32Å; N611-E616 HydrophobicContact CB-CG 4.26Å; N611-E616 PolarHBondContact N-O 2.85Å; K614-E616 HydrophobicContact CB-CB 4.49Å; K614-E616 HydrophobicContact CB-CG 3.88Å; K614-E616 HydrophobicContact CD-CG 4.05Å; K614-E616 WeakPolarHBondContact CD-OE1 3.35Å; K614-E616 WeakPolarHBondContact CE-OE1 3.35Å; K614-E616 IonicContact NZ-OE1 2.71Å; K614-E616 PolarHBondContact NZ-OE1 3.29Å; K614-E616 IonicContact NZ-OE2 3.3Å; K614-E616 PolarHBondContact O-N 2.64Å; E616-T618 HydrophobicContact CG-CG2 4.31Å
617	M	93.9	Very high	93.7	Very high	81 Å²	81	66.3 Å²	66.3	40%	0.399	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	132.1	165.2	-166.8	-158.2	-38.4	0	0	109	R608 I609 Y610 K620	R608-M617 HydrophobicContact CB-CG 4.41Å; R608-M617 HydrophobicContact CB-SD 4.3Å; R608-M617 HydrophobicContact CG-SD 4.09Å; I609-M617 CarbonylContact O-C 3.38Å; I609-M617 WeakPolarHBondContact O-CA 3.39Å; I609-M617 WeakPolarHBondContact O-CG 3.5Å; Y610-M617 HydrophobicContact CD1-CB 3.96Å; Y610-M617 HydrophobicContact CD1-CG 4.29Å; Y610-M617 HydrophobicContact CE1-CB 3.85Å; Y610-M617 HydrophobicContact CE1-CG 4.07Å; M617-K620 HydrophobicContact SD-CB 4.27Å
618	T	94.1	Very high	93.7	Very high	53 Å²	53	66.3 Å²	66.3	33%	0.325	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	-43.4	-179.3	55.4	0	0	0	0	113.6	Y598 I609 N611 E616	Y598-T618 HydrophobicContact CE1-CG2 4.01Å; I609-T618 PolarHBondContact O-N 3.45Å; I609-T618 PolarHBondContact O-OG1 2.9Å; N611-T618 HydrophobicContact CB-CG2 3.92Å; E616-T618 HydrophobicContact CG-CG2 4.31Å
619	K	94.5	Very high	93.7	Very high	68 Å²	68	65.9 Å²	65.9	30%	0.296	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	145.8	-179.7	-62.3	-177.7	179.5	178	0	111	I609 L654 D655	I609-K619 HydrophobicContact CB-CB 4.48Å; I609-K619 HydrophobicContact CD1-CB 4.08Å; I609-K619 HydrophobicContact CG1-CB 4.3Å; I609-K619 PolarHBondContact N-O 3.39Å; K619-L654 PolarHBondContact NZ-O 2.86Å; K619-D655 IonicContact NZ-OD1 2.71Å; K619-D655 PolarHBondContact NZ-OD1 2.99Å
620	K	95.9	Very high	93.7	Very high	94 Å²	94	66.3 Å²	66.3	41%	0.409	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	109.7	171	176.4	-158	170.9	-161.9	0	108.4	R608 M617 T658	R608-K620 HydrophobicContact CG-CG 4.31Å; M617-K620 HydrophobicContact SD-CB 4.27Å; K620-T658 WeakPolarHBondContact O-CB 3.5Å
621	L	96.4	Very high	93.8	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	129.2	177.2	-48.8	179.5	0	0	0	110.2	S606 V607 I609 F652 L654 T658	S606-L621 WeakPolarHBondContact CA-O 3.44Å; S606-L621 VanDerWaalsContact CB-O 3.25Å; S606-L621 WeakPolarHBondContact CB-O 3.4Å; V607-L621 HydrophobicContact CB-CB 4.24Å; V607-L621 HydrophobicContact CB-CD1 4.27Å; V607-L621 PolarHBondContact N-O 2.87Å; V607-L621 VanDerWaalsContact N-O 3.1Å; V607-L621 PolarHBondContact O-N 2.69Å; I609-L621 HydrophobicContact CD1-CD1 4.44Å; L621-F652 HydrophobicContact CB-CD1 4Å; L621-F652 HydrophobicContact CB-CE1 3.69Å; L621-F652 HydrophobicContact CB-CE2 4.43Å; L621-F652 HydrophobicContact CB-CG 4.48Å; L621-F652 HydrophobicContact CB-CZ 3.89Å; L621-F652 HydrophobicContact CD1-CB 4.14Å; L621-F652 HydrophobicContact CD1-CD1 4.16Å; L621-F652 HydrophobicContact CD1-CD2 4.13Å; L621-F652 HydrophobicContact CD1-CG 3.9Å; L621-F652 HydrophobicContact CD2-CD1 4.4Å; L621-F652 HydrophobicContact CG-CD1 4.41Å; L621-L654 HydrophobicContact CD1-CD2 3.55Å; L621-L654 HydrophobicContact CD2-CD2 3.99Å; L621-L654 HydrophobicContact CG-CD2 4.36Å; L621-T658 CarbonylContact C-O 3.57Å; L621-T658 WeakPolarHBondContact CA-O 3.34Å
622	Q	94.9	Very high	93.8	Very high	81 Å²	81	65.2 Å²	65.2	38%	0.379	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	112.6	178.1	-55.6	-160.5	18.1	0	0	109.4	N624 T658 P660	Q622-N624 VanDerWaalsContact C-N 3.33Å; Q622-N624 PolarHBondContact O-N 3.11Å; Q622-T658 PolarHBondContact N-O 2.95Å; Q622-P660 WeakPolarHBondContact O-CD 3.23Å
623	A	89.7	Confident	94	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.308	C	S	.	.			trans	-86.5	-2	-173.2	0	0	0	0	0	114.8	S625 I628 S650 F652	A623-S625 PolarHBondContact O-N 3.28Å; A623-S625 PolarHBondContact O-OG 3.18Å; A623-I628 HydrophobicContact CB-CD1 3.73Å; A623-I628 HydrophobicContact CB-CG1 4.11Å; A623-S650 PolarHBondContact O-OG 3.14Å; A623-F652 HydrophobicContact CB-CE2 4.39Å; A623-F652 HydrophobicContact CB-CZ 3.9Å
624	N	89.1	Confident	94.1	Very high	88 Å²	88	59.1 Å²	59.1	47%	0.471	28%	0.28	S	S	.	.			trans	41.6	44.6	-175.6	-63.4	8.6	0	0	0	112.1	Q622 R648 M663	Q622-N624 VanDerWaalsContact C-N 3.33Å; Q622-N624 PolarHBondContact O-N 3.11Å; N624-R648 PolarHBondContact O-NH1 2.86Å; N624-M663 HydrophobicContact CB-CE 4.21Å
625	S	89.1	Confident	94	Very high	11 Å²	11	55.2 Å²	55.2	8%	0.077	27%	0.27	C	S	.	.			trans	-137	140.8	-176.6	-63.3	0	0	0	0	107.8	A623 D646	A623-S625 PolarHBondContact O-N 3.28Å; A623-S625 PolarHBondContact O-OG 3.18Å; S625-D646 WeakPolarHBondContact CA-OD2 3.42Å; S625-D646 VanDerWaalsContact CB-OD2 3.3Å; S625-D646 WeakPolarHBondContact CB-OD2 3.41Å
626	K	91.8	Very high	94	Very high	153 Å²	153	47.9 Å²	47.9	67%	0.665	24%	0.242	S	C	*	.	S	Bend	trans	-75.9	-29.8	-177.1	-65.1	-175.3	175.9	-174.5	0	111.9	Q604 D646	Q604-K626 VanDerWaalsContact CG-O 3.29Å; Q604-K626 WeakPolarHBondContact CG-O 3.36Å; Q604-K626 PolarHBondContact NE2-O 3.41Å; K626-D646 PolarHBondContact N-OD2 2.97Å
627	W	94.4	Very high	93.9	Very high	113 Å²	113	44 Å²	44	43%	0.428	22%	0.224	S	C	.	.			trans	-145.7	100.2	-179.5	-63.8	89.2	0	0	0	112.3	L586 Q604 S644 Y645 D646	L586-W627 HydrophobicContact CD2-CZ3 4.49Å; Q604-W627 HydrophobicContact CG-CD2 3.83Å; Q604-W627 HydrophobicContact CG-CE3 3.56Å; Q604-W627 HydrophobicContact CG-CG 4.29Å; Q604-W627 HydrophobicContact CG-CZ3 4.01Å; Q604-W627 VanDerWaalsContact NE2-CD2 3.32Å; Q604-W627 VanDerWaalsContact NE2-CZ2 3.29Å; Q604-W627 CarbonylContact O-C 3.58Å; Q604-W627 WeakPolarHBondContact O-CA 3.46Å; W627-S644 VanDerWaalsContact O-CA 3.3Å; W627-S644 WeakPolarHBondContact O-CA 3.2Å; W627-S644 VanDerWaalsContact O-CB 3.27Å; W627-S644 WeakPolarHBondContact O-CB 3.27Å; W627-Y645 HydrophobicContact CB-CD2 3.79Å; W627-Y645 HydrophobicContact CB-CG 4.41Å; W627-Y645 WeakPolarHBondContact O-CD2 3.38Å; W627-Y645 PolarHBondContact O-N 2.97Å; W627-D646 PolarHBondContact N-OD2 3.36Å
628	I	96.6	Very high	93.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	136.5	165.9	-63.2	179.4	0	0	0	109.5	Q588 A602 T603 Q604 V607 A623 I631 C642	Q588-I628 WeakPolarHBondContact CG-O 3.46Å; A602-I628 HydrophobicContact CB-CG2 4.05Å; T603-I628 WeakPolarHBondContact O-CD1 3.47Å; Q604-I628 PolarHBondContact O-N 3.36Å; V607-I628 HydrophobicContact CG2-CD1 3.98Å; A623-I628 HydrophobicContact CB-CD1 3.73Å; A623-I628 HydrophobicContact CB-CG1 4.11Å; I628-I631 HydrophobicContact CG2-CG2 4.45Å; I628-C642 VanDerWaalsContact CG2-SG 3.5Å
629	S	96	Very high	93.8	Very high	13 Å²	13	40.4 Å²	40.4	9%	0.091	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	-46.2	177.5	53.5	0	0	0	0	112.8	G643 S644 V671 R672	S629-G643 PolarHBondContact N-O 3.35Å; S629-G643 PolarHBondContact OG-O 3.04Å; S629-G643 VanDerWaalsContact OG-O 3.11Å; S629-S644 PolarHBondContact OG-N 3.42Å; S629-V671 VanDerWaalsContact CB-O 3.22Å; S629-V671 WeakPolarHBondContact CB-O 3.42Å; S629-V671 PolarHBondContact OG-O 2.96Å; S629-R672 PolarHBondContact OG-O 3Å
630	S	95.8	Very high	93.9	Very high	14 Å²	14	37.2 Å²	37.2	10%	0.098	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	157.1	-172.1	47.7	0	0	0	0	111.9	C642 G643 R672 S673 V674	S630-C642 WeakPolarHBondContact O-CA 3.17Å; S630-G643 PolarHBondContact O-N 3.24Å; S630-R672 VanDerWaalsContact CB-O 3.3Å; S630-R672 WeakPolarHBondContact CB-O 3.11Å; S630-R672 PolarHBondContact OG-O 3.17Å; S630-S673 VanDerWaalsContact OG-CA 3.31Å; S630-S673 WeakPolarHBondContact OG-CA 3.36Å; S630-V674 PolarHBondContact OG-N 3.03Å
631	I	97.1	Very high	94	Very high	16 Å²	16	32.7 Å²	32.7	8%	0.082	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	145.6	174	52.5	161.2	0	0	0	111.1	A589 F600 A602 V607 I628 I641 C642	A589-I631 HydrophobicContact CB-CG1 4.18Å; F600-I631 HydrophobicContact CB-CD1 3.88Å; A602-I631 HydrophobicContact CB-CD1 4.03Å; A602-I631 HydrophobicContact CB-CG1 4.11Å; A602-I631 HydrophobicContact CB-CG2 3.77Å; V607-I631 HydrophobicContact CG2-CG2 3.92Å; I628-I631 HydrophobicContact CG2-CG2 4.45Å; I631-I641 WeakPolarHBondContact CA-O 3.41Å; I631-C642 HydrophobicContact CG2-CB 4.2Å
632	A	96.9	Very high	94	Very high	14 Å²	14	32.8 Å²	32.8	12%	0.116	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	141.1	166.4	0	0	0	0	0	110.5	V640 I641 V674 Y676	A632-V640 WeakPolarHBondContact O-CA 2.94Å; A632-I641 HydrophobicContact CB-CD1 4.24Å; A632-I641 HydrophobicContact CB-CG1 3.87Å; A632-I641 PolarHBondContact N-O 3.14Å; A632-I641 PolarHBondContact O-N 2.93Å; A632-V674 HydrophobicContact CB-CG2 4.23Å; A632-V674 WeakPolarHBondContact CB-O 3.31Å; A632-Y676 HydrophobicContact CB-CD2 3.92Å; A632-Y676 WeakPolarHBondContact O-CE2 3.31Å
633	V	96.6	Very high	94.1	Very high	20 Å²	20	28.9 Å²	28.9	12%	0.121	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	136.3	180	-173.6	0	0	0	0	108.4	F600 V640 Y676	F600-V633 HydrophobicContact CD2-CG2 3.58Å; F600-V633 HydrophobicContact CE2-CB 4.37Å; F600-V633 HydrophobicContact CE2-CG1 3.8Å; F600-V633 HydrophobicContact CE2-CG2 3.58Å; F600-V633 HydrophobicContact CG-CG2 4.13Å; F600-V633 HydrophobicContact CZ-CG1 4.03Å; F600-V633 HydrophobicContact CZ-CG2 4.14Å; V633-V640 HydrophobicContact CG1-CG2 4.45Å; V633-V640 HydrophobicContact CG2-CG2 4.38Å; V633-Y676 VanDerWaalsContact C-CD2 3.41Å; V633-Y676 WeakPolarHBondContact O-CD2 3.43Å
634	H	95.6	Very high	94.5	Very high	28 Å²	28	29 Å²	29	13%	0.13	15%	0.153	C	C	.	.			trans	-63.3	153.8	176.5	-177.2	-115.1	0	0	0	110.9	G636 G637 H639 Y676	H634-G636 VanDerWaalsContact C-N 3.27Å; H634-G636 PolarHBondContact O-N 2.87Å; H634-G637 WeakPolarHBondContact O-CA 3.48Å; H634-G637 PolarHBondContact O-N 2.93Å; H634-H639 HydrophobicContact CB-CB 3.97Å; H634-H639 WeakPolarHBondContact CB-O 3.34Å; H634-H639 PolarHBondContact N-O 3.03Å; H634-Y676 HydrophobicContact CB-CD2 4.37Å; H634-Y676 HydrophobicContact CB-CE1 4.23Å; H634-Y676 HydrophobicContact CB-CE2 3.9Å; H634-Y676 AromaticContact CD2-CD1 3.89Å; H634-Y676 AromaticContact CD2-CE1 3.75Å; H634-Y676 VanDerWaalsContact N-CE2 3.29Å
635	S	91.8	Very high	94.8	Very high	51 Å²	51	28.7 Å²	28.7	36%	0.357	15%	0.146	S	C	.	.	S	Bend	trans	-60.1	-32	-174.3	54.2	0	0	0	0	114.1	P594 R678	P594-S635 VanDerWaalsContact CG-O 3.24Å; P594-S635 WeakPolarHBondContact CG-O 3.29Å; S635-R678 WeakPolarHBondContact CB-O 3.38Å; S635-R678 PolarHBondContact OG-O 2.79Å
636	G	90.6	Very high	95.1	Very high	26 Å²	26	30.1 Å²	30.1	27%	0.268	15%	0.153	S	C	.	.	S	Bend	trans	-71.4	-33.5	170.3	0	0	0	0	0	114.2	H634	H634-G636 VanDerWaalsContact C-N 3.27Å; H634-G636 PolarHBondContact O-N 2.87Å
637	G	91.3	Very high	95.3	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.129	C	C	.	.	S	Bend	trans	107.2	-18.4	179.6	0	0	0	0	0	115.9	H634 H639 L654	H634-G637 WeakPolarHBondContact O-CA 3.48Å; H634-G637 PolarHBondContact O-N 2.93Å; G637-H639 PolarHBondContact O-N 3.17Å; G637-L654 WeakPolarHBondContact O-CD1 3.23Å
638	D	91.5	Very high	95.4	Very high	45 Å²	45	22.6 Å²	22.6	24%	0.241	12%	0.124	C	C	.	.	S	Bend	trans	-84.7	-2.9	-170	-45.7	-79.7	0	0	0	114.8	R596 L654	R596-D638 IonicContact CZ-OD1 2.64Å; R596-D638 VanDerWaalsContact CZ-OD1 3.22Å; R596-D638 IonicContact NH1-OD1 3.76Å; R596-D638 PolarHBondContact NH1-OD1 2.94Å; R596-D638 IonicContact NH2-OD1 3.76Å; R596-D638 PolarHBondContact NH2-OD1 3.35Å; R596-D638 IonicContact NH2-OD2 3.82Å; D638-L654 VanDerWaalsContact O-CB 3.28Å; D638-L654 WeakPolarHBondContact O-CB 3.46Å; D638-L654 VanDerWaalsContact O-CG 3.24Å; D638-L654 WeakPolarHBondContact O-CG 3.49Å; D638-L654 PolarHBondContact O-N 3.19Å
639	H	95.1	Very high	95.4	Very high	14 Å²	14	22.9 Å²	22.9	7%	0.065	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	150.7	173.2	-55	-83.2	0	0	0	111.8	H634 G637 W651 F652 D653 V699	H634-H639 HydrophobicContact CB-CB 3.97Å; H634-H639 WeakPolarHBondContact CB-O 3.34Å; H634-H639 PolarHBondContact N-O 3.03Å; G637-H639 PolarHBondContact O-N 3.17Å; H639-W651 HydrophobicContact CB-CZ2 4.15Å; H639-W651 AromaticContact ND1-NE1 3.62Å; H639-F652 VanDerWaalsContact CA-O 3.28Å; H639-F652 WeakPolarHBondContact CA-O 3.48Å; H639-F652 WeakPolarHBondContact CB-O 3.4Å; H639-D653 IonicContact CE1-OD2 3.88Å; H639-D653 PolarHBondContact CE1-OD2 2.92Å; H639-D653 VanDerWaalsContact CE1-OD2 3.25Å; H639-D653 WeakPolarHBondContact ND1-CA 3.45Å; H639-D653 IonicContact ND1-OD2 3.3Å; H639-V699 WeakPolarHBondContact CD2-CG2 3.15Å; H639-V699 VanDerWaalsContact NE2-CG1 3.28Å; H639-V699 WeakPolarHBondContact NE2-CG1 3.19Å
640	V	96.5	Very high	95.4	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	132.4	-179.9	-179.8	0	0	0	0	109.7	F600 A632 V633 F652 L654	F600-V640 HydrophobicContact CD1-CG2 4.08Å; F600-V640 HydrophobicContact CE1-CG2 3.48Å; F600-V640 VanDerWaalsContact CE1-CG2 3.48Å; F600-V640 HydrophobicContact CZ-CG2 3.91Å; A632-V640 WeakPolarHBondContact O-CA 2.94Å; V633-V640 HydrophobicContact CG1-CG2 4.45Å; V633-V640 HydrophobicContact CG2-CG2 4.38Å; V640-F652 HydrophobicContact CB-CB 4.39Å; V640-F652 PolarHBondContact N-O 2.78Å; V640-F652 PolarHBondContact O-N 2.92Å; V640-L654 HydrophobicContact CG2-CD1 4.23Å; V640-L654 HydrophobicContact CG2-CD2 3.96Å; V640-L654 HydrophobicContact CG2-CG 4.34Å
641	I	97.3	Very high	95.5	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	146.1	165.1	56.3	-176.7	0	0	0	110.5	I631 A632 L649 S650 W651 V674 Y676 F683	I631-I641 WeakPolarHBondContact CA-O 3.41Å; A632-I641 HydrophobicContact CB-CD1 4.24Å; A632-I641 HydrophobicContact CB-CG1 3.87Å; A632-I641 PolarHBondContact N-O 3.14Å; A632-I641 PolarHBondContact O-N 2.93Å; I641-L649 HydrophobicContact CB-CD2 4.37Å; I641-L649 HydrophobicContact CG2-CD2 4.09Å; I641-S650 WeakPolarHBondContact CA-O 3.38Å; I641-W651 HydrophobicContact CG2-CB 4.45Å; I641-W651 HydrophobicContact CG2-CD2 4.05Å; I641-W651 HydrophobicContact CG2-CE3 3.41Å; I641-W651 VanDerWaalsContact CG2-CE3 3.41Å; I641-W651 HydrophobicContact CG2-CG 4.5Å; I641-W651 HydrophobicContact CG2-CZ3 4Å; I641-V674 HydrophobicContact CD1-CB 3.99Å; I641-V674 HydrophobicContact CD1-CG2 4.33Å; I641-V674 HydrophobicContact CG1-CB 4.2Å; I641-V674 HydrophobicContact CG1-CG2 4Å; I641-Y676 HydrophobicContact CB-CE2 4.39Å; I641-Y676 HydrophobicContact CD1-CD2 4.05Å; I641-Y676 HydrophobicContact CD1-CE2 3.94Å; I641-Y676 HydrophobicContact CD1-CG 4.43Å; I641-Y676 HydrophobicContact CG1-CD2 4.07Å; I641-Y676 HydrophobicContact CG1-CE2 3.65Å; I641-Y676 HydrophobicContact CG2-CE2 4.27Å; I641-F683 HydrophobicContact CD1-CB 3.9Å; I641-F683 HydrophobicContact CD1-CD2 3.82Å; I641-F683 HydrophobicContact CD1-CG 4.21Å; I641-F683 HydrophobicContact CG2-CD2 4.42Å
642	C	97	Very high	95.4	Very high	1 Å²	1	21 Å²	21	1%	0.007	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	119	-176.1	176.6	0	0	0	0	109	I628 S630 I631 L649 S650 F652	I628-C642 VanDerWaalsContact CG2-SG 3.5Å; S630-C642 WeakPolarHBondContact O-CA 3.17Å; I631-C642 HydrophobicContact CG2-CB 4.2Å; C642-L649 WeakPolarHBondContact O-CA 3.48Å; C642-S650 PolarHBondContact N-O 3Å; C642-S650 PolarHBondContact O-N 2.71Å; C642-F652 HydrophobicContact CB-CD2 4.39Å; C642-F652 HydrophobicContact CB-CE2 3.87Å
643	G	97.1	Very high	95.3	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	149.8	170.5	0	0	0	0	0	111	S629 S630	S629-G643 PolarHBondContact N-O 3.35Å; S629-G643 PolarHBondContact OG-O 3.04Å; S629-G643 VanDerWaalsContact OG-O 3.11Å; S630-G643 PolarHBondContact O-N 3.24Å
644	S	97.3	Very high	95.2	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.007	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	153.5	171.6	84.5	0	0	0	0	113.2	W627 S629 D646 C647 R648 V671	W627-S644 VanDerWaalsContact O-CA 3.3Å; W627-S644 WeakPolarHBondContact O-CA 3.2Å; W627-S644 VanDerWaalsContact O-CB 3.27Å; W627-S644 WeakPolarHBondContact O-CB 3.27Å; S629-S644 PolarHBondContact OG-N 3.42Å; S644-D646 PolarHBondContact O-N 3.27Å; S644-D646 WeakPolarHBondContact OG-CB 3.07Å; S644-D646 PolarHBondContact OG-N 3.16Å; S644-C647 PolarHBondContact O-N 3.12Å; S644-R648 PolarHBondContact N-O 2.88Å; S644-R648 WeakPolarHBondContact OG-CB 3.35Å; S644-R648 PolarHBondContact OG-N 3.28Å; S644-R648 PolarHBondContact OG-O 2.81Å; S644-V671 PolarHBondContact O-N 2.84Å
645	Y	96.6	Very high	95	Very high	82 Å²	82	25.3 Å²	25.3	32%	0.322	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-17.7	170.8	-63.9	-79.7	0	0	0	112	W627 C647 A670	W627-Y645 HydrophobicContact CB-CD2 3.79Å; W627-Y645 HydrophobicContact CB-CG 4.41Å; W627-Y645 WeakPolarHBondContact O-CD2 3.38Å; W627-Y645 PolarHBondContact O-N 2.97Å; Y645-C647 PolarHBondContact O-N 3.09Å; Y645-A670 HydrophobicContact CD1-CB 3.73Å; Y645-A670 HydrophobicContact CG-CB 4.4Å; Y645-A670 WeakPolarHBondContact O-CA 3.3Å
646	D	95.4	Very high	95	Very high	42 Å²	42	27.3 Å²	27.3	23%	0.225	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	17.4	174.7	-47.1	-68.7	0	0	0	113.9	S625 K626 W627 S644 R648	S625-D646 WeakPolarHBondContact CA-OD2 3.42Å; S625-D646 VanDerWaalsContact CB-OD2 3.3Å; S625-D646 WeakPolarHBondContact CB-OD2 3.41Å; K626-D646 PolarHBondContact N-OD2 2.97Å; W627-D646 PolarHBondContact N-OD2 3.36Å; S644-D646 PolarHBondContact O-N 3.27Å; S644-D646 WeakPolarHBondContact OG-CB 3.07Å; S644-D646 PolarHBondContact OG-N 3.16Å; D646-R648 VanDerWaalsContact C-N 3.27Å; D646-R648 HydrophobicContact CB-CG 4.47Å; D646-R648 PolarHBondContact O-N 2.67Å
647	C	95.7	Very high	95.1	Very high	24 Å²	24	28.4 Å²	28.4	16%	0.162	15%	0.145	C	C	.	.	S	Bend	trans	63	24.8	-177	-42.9	0	0	0	0	114.3	S644 Y645 K669	S644-C647 PolarHBondContact O-N 3.12Å; Y645-C647 PolarHBondContact O-N 3.09Å; C647-K669 WeakPolarHBondContact CB-O 3.38Å; C647-K669 VanDerWaalsContact SG-CA 3.57Å; C647-K669 PolarHBondContact SG-O 2.91Å; C647-K669 VanDerWaalsContact SG-O 3.38Å
648	R	95.6	Very high	95.3	Very high	83 Å²	83	31.5 Å²	31.5	31%	0.313	16%	0.164	S	C	.	.			trans	-111.7	147	-177.3	-60.3	162.4	-176.7	-153.2	-6.2	110.9	N624 S644 D646 M663	N624-R648 PolarHBondContact O-NH1 2.86Å; S644-R648 PolarHBondContact N-O 2.88Å; S644-R648 WeakPolarHBondContact OG-CB 3.35Å; S644-R648 PolarHBondContact OG-N 3.28Å; S644-R648 PolarHBondContact OG-O 2.81Å; D646-R648 VanDerWaalsContact C-N 3.27Å; D646-R648 HydrophobicContact CB-CG 4.47Å; D646-R648 PolarHBondContact O-N 2.67Å; R648-M663 HydrophobicContact CB-CG 4.33Å; R648-M663 HydrophobicContact CB-SD 4.42Å; R648-M663 HydrophobicContact CG-CG 4.46Å; R648-M663 HydrophobicContact CG-SD 4.08Å
649	L	96.7	Very high	95.5	Very high	7 Å²	7	35.3 Å²	35.3	4%	0.037	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	122	159.7	-177.5	150.2	0	0	0	108.6	I641 C642 L664 V674 F683	I641-L649 HydrophobicContact CB-CD2 4.37Å; I641-L649 HydrophobicContact CG2-CD2 4.09Å; C642-L649 WeakPolarHBondContact O-CA 3.48Å; L649-L664 HydrophobicContact CB-CB 4.47Å; L649-L664 HydrophobicContact CD2-CD1 4.31Å; L649-L664 PolarHBondContact N-O 3.4Å; L649-L664 PolarHBondContact O-N 3.15Å; L649-V674 HydrophobicContact CD1-CG1 3.81Å; L649-F683 HydrophobicContact CD1-CD2 4.41Å; L649-F683 HydrophobicContact CD1-CE2 4.11Å; L649-F683 HydrophobicContact CD2-CE2 3.98Å
650	S	96.3	Very high	95.5	Very high	1 Å²	1	36 Å²	36	1%	0.007	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	118.7	178.6	-73	0	0	0	0	109.8	A623 I641 C642	A623-S650 PolarHBondContact O-OG 3.14Å; I641-S650 WeakPolarHBondContact CA-O 3.38Å; C642-S650 PolarHBondContact N-O 3Å; C642-S650 PolarHBondContact O-N 2.71Å
651	W	97	Very high	95.4	Very high	1 Å²	1	40 Å²	40	0%	0.004	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	122.6	169.5	-176.4	-71.2	0	0	0	109.5	H639 I641 P660 Y661 K662 Y676 F683 V699 P707 I709	H639-W651 HydrophobicContact CB-CZ2 4.15Å; H639-W651 AromaticContact ND1-NE1 3.62Å; I641-W651 HydrophobicContact CG2-CB 4.45Å; I641-W651 HydrophobicContact CG2-CD2 4.05Å; I641-W651 HydrophobicContact CG2-CE3 3.41Å; I641-W651 VanDerWaalsContact CG2-CE3 3.41Å; I641-W651 HydrophobicContact CG2-CG 4.5Å; I641-W651 HydrophobicContact CG2-CZ3 4Å; W651-P660 CarbonylContact O-C 3.59Å; W651-P660 WeakPolarHBondContact O-CA 3.48Å; W651-Y661 AromaticContact CD1-CD1 3.94Å; W651-Y661 PolarHBondContact O-N 3.42Å; W651-K662 HydrophobicContact CB-CB 4.47Å; W651-K662 PolarHBondContact N-O 3.21Å; W651-K662 PolarHBondContact O-N 3.06Å; W651-Y676 AromaticContact CH2-CE1 3.83Å; W651-Y676 HydrophobicContact CH2-CE1 3.83Å; W651-Y676 WeakPolarHBondContact CH2-OH 3.46Å; W651-Y676 AromaticContact CZ3-CE1 3.83Å; W651-Y676 HydrophobicContact CZ3-CE1 3.83Å; W651-Y676 AromaticContact CZ3-CZ 3.99Å; W651-Y676 WeakPolarHBondContact CZ3-OH 3.41Å; W651-F683 HydrophobicContact CE3-CD1 4.47Å; W651-F683 AromaticContact CE3-CE1 3.98Å; W651-F683 HydrophobicContact CE3-CE1 3.98Å; W651-F683 HydrophobicContact CE3-CE2 4.47Å; W651-F683 AromaticContact CE3-CZ 3.97Å; W651-F683 HydrophobicContact CE3-CZ 3.97Å; W651-F683 HydrophobicContact CH2-CE1 4.5Å; W651-F683 AromaticContact CZ3-CD1 3.67Å; W651-F683 HydrophobicContact CZ3-CD1 3.67Å; W651-F683 AromaticContact CZ3-CE1 3.48Å; W651-F683 HydrophobicContact CZ3-CE1 3.48Å; W651-F683 VanDerWaalsContact CZ3-CE1 3.48Å; W651-F683 HydrophobicContact CZ3-CG 4.27Å; W651-F683 AromaticContact CZ3-CZ 3.94Å; W651-F683 HydrophobicContact CZ3-CZ 3.94Å; W651-V699 HydrophobicContact CH2-CG2 4.48Å; W651-V699 HydrophobicContact CZ2-CG2 4.1Å; W651-P707 HydrophobicContact CZ2-CB 4.02Å; W651-P707 HydrophobicContact CZ2-CG 4.3Å; W651-I709 HydrophobicContact CB-CD1 4.01Å; W651-I709 HydrophobicContact CD2-CD1 3.44Å; W651-I709 VanDerWaalsContact CD2-CD1 3.44Å; W651-I709 HydrophobicContact CD2-CG1 4.12Å; W651-I709 HydrophobicContact CE3-CD1 3.82Å; W651-I709 HydrophobicContact CE3-CG1 4.1Å; W651-I709 HydrophobicContact CG-CD1 3.53Å; W651-I709 HydrophobicContact CH2-CG1 4.49Å; W651-I709 HydrophobicContact CZ2-CD1 4.47Å; W651-I709 HydrophobicContact CZ3-CD1 4.48Å; W651-I709 HydrophobicContact CZ3-CG1 4.3Å
652	F	96.3	Very high	95.3	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	128.3	170.8	-63.2	-83.3	0	0	0	110.3	L621 A623 H639 V640 C642 L654 P660	L621-F652 HydrophobicContact CB-CD1 4Å; L621-F652 HydrophobicContact CB-CE1 3.69Å; L621-F652 HydrophobicContact CB-CE2 4.43Å; L621-F652 HydrophobicContact CB-CG 4.48Å; L621-F652 HydrophobicContact CB-CZ 3.89Å; L621-F652 HydrophobicContact CD1-CB 4.14Å; L621-F652 HydrophobicContact CD1-CD1 4.16Å; L621-F652 HydrophobicContact CD1-CD2 4.13Å; L621-F652 HydrophobicContact CD1-CG 3.9Å; L621-F652 HydrophobicContact CD2-CD1 4.4Å; L621-F652 HydrophobicContact CG-CD1 4.41Å; A623-F652 HydrophobicContact CB-CE2 4.39Å; A623-F652 HydrophobicContact CB-CZ 3.9Å; H639-F652 VanDerWaalsContact CA-O 3.28Å; H639-F652 WeakPolarHBondContact CA-O 3.48Å; H639-F652 WeakPolarHBondContact CB-O 3.4Å; V640-F652 HydrophobicContact CB-CB 4.39Å; V640-F652 PolarHBondContact N-O 2.78Å; V640-F652 PolarHBondContact O-N 2.92Å; C642-F652 HydrophobicContact CB-CD2 4.39Å; C642-F652 HydrophobicContact CB-CE2 3.87Å; F652-L654 HydrophobicContact CB-CD2 4.45Å; F652-P660 HydrophobicContact CD1-CB 4.28Å; F652-P660 HydrophobicContact CE1-CB 4.11Å
653	D	94.9	Very high	95.2	Very high	25 Å²	25	46.6 Å²	46.6	13%	0.134	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	122	154.6	179.7	-43.9	0	0	0	106.6	H639 D655 L656 S657	H639-D653 IonicContact CE1-OD2 3.88Å; H639-D653 PolarHBondContact CE1-OD2 2.92Å; H639-D653 VanDerWaalsContact CE1-OD2 3.25Å; H639-D653 WeakPolarHBondContact ND1-CA 3.45Å; H639-D653 IonicContact ND1-OD2 3.3Å; D653-D655 VanDerWaalsContact C-N 3.31Å; D653-D655 PolarHBondContact O-N 3.25Å; D653-D655 PolarHBondContact OD1-N 3.38Å; D653-L656 HydrophobicContact CB-CB 3.83Å; D653-L656 HydrophobicContact CB-CD2 4.47Å; D653-L656 VanDerWaalsContact CG-CB 3.48Å; D653-L656 WeakPolarHBondContact OD1-CB 3.47Å; D653-L656 PolarHBondContact OD1-N 3.44Å; D653-S657 PolarHBondContact O-N 2.99Å; D653-S657 VanDerWaalsContact O-O 3.11Å
654	L	93.3	Very high	95	Very high	17 Å²	17	47.3 Å²	47.3	9%	0.089	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-25.2	-170.7	-65	-174	0	0	0	113	F600 I609 K619 L621 G637 D638 V640 F652	F600-L654 HydrophobicContact CE1-CD1 4.01Å; F600-L654 HydrophobicContact CZ-CD1 4Å; I609-L654 HydrophobicContact CD1-CD1 3.96Å; I609-L654 HydrophobicContact CD1-CD2 3.79Å; I609-L654 HydrophobicContact CD1-CG 4.47Å; K619-L654 PolarHBondContact NZ-O 2.86Å; L621-L654 HydrophobicContact CD1-CD2 3.55Å; L621-L654 HydrophobicContact CD2-CD2 3.99Å; L621-L654 HydrophobicContact CG-CD2 4.36Å; G637-L654 WeakPolarHBondContact O-CD1 3.23Å; D638-L654 VanDerWaalsContact O-CB 3.28Å; D638-L654 WeakPolarHBondContact O-CB 3.46Å; D638-L654 VanDerWaalsContact O-CG 3.24Å; D638-L654 WeakPolarHBondContact O-CG 3.49Å; D638-L654 PolarHBondContact O-N 3.19Å; V640-L654 HydrophobicContact CG2-CD1 4.23Å; V640-L654 HydrophobicContact CG2-CD2 3.96Å; V640-L654 HydrophobicContact CG2-CG 4.34Å; F652-L654 HydrophobicContact CB-CD2 4.45Å
655	D	91.3	Very high	94.9	Very high	112 Å²	112	56 Å²	56	60%	0.599	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102	-23.7	-175	-71.3	-31	0	0	0	112.5	K619 D653	K619-D655 IonicContact NZ-OD1 2.71Å; K619-D655 PolarHBondContact NZ-OD1 2.99Å; D653-D655 VanDerWaalsContact C-N 3.31Å; D653-D655 PolarHBondContact O-N 3.25Å; D653-D655 PolarHBondContact OD1-N 3.38Å
656	L	91.8	Very high	94.8	Very high	93 Å²	93	56.4 Å²	56.4	49%	0.487	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-45.6	170.7	-175.6	68.2	0	0	0	113.3	D653 Y661	D653-L656 HydrophobicContact CB-CB 3.83Å; D653-L656 HydrophobicContact CB-CD2 4.47Å; D653-L656 VanDerWaalsContact CG-CB 3.48Å; D653-L656 WeakPolarHBondContact OD1-CB 3.47Å; D653-L656 PolarHBondContact OD1-N 3.44Å; L656-Y661 HydrophobicContact CD2-CD2 3.51Å; L656-Y661 HydrophobicContact CD2-CE2 4.26Å; L656-Y661 HydrophobicContact CD2-CG 4.21Å
657	S	93.1	Very high	94.8	Very high	49 Å²	49	55 Å²	55	34%	0.343	26%	0.263	S	S	.	.			trans	-163	160.3	-175.3	-159.9	0	0	0	0	115.7	D653 K659	D653-S657 PolarHBondContact O-N 2.99Å; D653-S657 VanDerWaalsContact O-O 3.11Å; S657-K659 WeakPolarHBondContact CB-O 3.32Å; S657-K659 PolarHBondContact OG-N 2.93Å
658	T	95	Very high	94.8	Very high	65 Å²	65	62.9 Å²	62.9	40%	0.399	30%	0.295	S	S	.	.	S	Bend	trans	-83.7	-15.2	165.3	55.3	0	0	0	0	113.1	K620 L621 Q622	K620-T658 WeakPolarHBondContact O-CB 3.5Å; L621-T658 CarbonylContact C-O 3.57Å; L621-T658 WeakPolarHBondContact CA-O 3.34Å; Q622-T658 PolarHBondContact N-O 2.95Å
659	K	95.3	Very high	94.8	Very high	125 Å²	125	61.8 Å²	61.8	54%	0.543	29%	0.292	S	S	.	.	S	Bend	trans	-89.8	155.8	169.8	-65.6	177.9	-178.6	176.8	0	108.9	S657 Y661	S657-K659 WeakPolarHBondContact CB-O 3.32Å; S657-K659 PolarHBondContact OG-N 2.93Å; K659-Y661 PolarHBondContact O-N 2.81Å
660	P	95.6	Very high	94.9	Very high	28 Å²	28	62 Å²	62	18%	0.182	30%	0.295	C	S	.	.			trans	-66.3	135.7	-179.7	27.5	-35.4	0	0	0	111.3	Q622 W651 F652 M663	Q622-P660 WeakPolarHBondContact O-CD 3.23Å; W651-P660 CarbonylContact O-C 3.59Å; W651-P660 WeakPolarHBondContact O-CA 3.48Å; F652-P660 HydrophobicContact CD1-CB 4.28Å; F652-P660 HydrophobicContact CE1-CB 4.11Å; P660-M663 HydrophobicContact CG-CE 4.08Å
661	Y	94.7	Very high	94.9	Very high	85 Å²	85	62 Å²	62	33%	0.333	30%	0.295	S	S	.	.	S	Bend	trans	-63.6	-43.1	173.9	164.4	-113	0	0	0	111.4	W651 L656 K659 N706 P707 I709	W651-Y661 AromaticContact CD1-CD1 3.94Å; W651-Y661 PolarHBondContact O-N 3.42Å; L656-Y661 HydrophobicContact CD2-CD2 3.51Å; L656-Y661 HydrophobicContact CD2-CE2 4.26Å; L656-Y661 HydrophobicContact CD2-CG 4.21Å; K659-Y661 PolarHBondContact O-N 2.81Å; Y661-N706 HydrophobicContact CE2-CB 4.03Å; Y661-P707 HydrophobicContact CD1-CG 3.93Å; Y661-P707 HydrophobicContact CE1-CG 3.84Å; Y661-I709 HydrophobicContact CD1-CD1 3.99Å; Y661-I709 HydrophobicContact CE1-CD1 3.93Å
662	K	94.3	Very high	94.9	Very high	64 Å²	64	65.3 Å²	65.3	28%	0.278	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	130.6	179.2	-161	174.8	-173.1	174.6	0	109.7	W651 L664 I709	W651-K662 HydrophobicContact CB-CB 4.47Å; W651-K662 PolarHBondContact N-O 3.21Å; W651-K662 PolarHBondContact O-N 3.06Å; K662-L664 HydrophobicContact CD-CD2 3.98Å; K662-L664 HydrophobicContact CG-CD2 3.93Å; K662-I709 HydrophobicContact CB-CD1 4.04Å; K662-I709 HydrophobicContact CD-CB 3.98Å; K662-I709 HydrophobicContact CD-CD1 3.88Å; K662-I709 HydrophobicContact CD-CG2 4.22Å; K662-I709 PolarHBondContact NZ-O 3.03Å
663	M	95.3	Very high	95	Very high	74 Å²	74	66 Å²	66	37%	0.365	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	122.4	173.4	-171.4	179.2	-72.1	0	0	108.9	N624 R648 P660	N624-M663 HydrophobicContact CB-CE 4.21Å; R648-M663 HydrophobicContact CB-CG 4.33Å; R648-M663 HydrophobicContact CB-SD 4.42Å; R648-M663 HydrophobicContact CG-CG 4.46Å; R648-M663 HydrophobicContact CG-SD 4.08Å; P660-M663 HydrophobicContact CG-CE 4.08Å
664	L	93.8	Very high	95.1	Very high	16 Å²	16	65.2 Å²	65.2	8%	0.084	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	131.3	-179.9	-55.7	-177	0	0	0	109.7	L649 K662 F683 I709	L649-L664 HydrophobicContact CB-CB 4.47Å; L649-L664 HydrophobicContact CD2-CD1 4.31Å; L649-L664 PolarHBondContact N-O 3.4Å; L649-L664 PolarHBondContact O-N 3.15Å; K662-L664 HydrophobicContact CD-CD2 3.98Å; K662-L664 HydrophobicContact CG-CD2 3.93Å; L664-F683 HydrophobicContact CD1-CZ 4.3Å; L664-I709 HydrophobicContact CD1-CG2 3.94Å
665	R	94.9	Very high	95.3	Very high	182 Å²	182	64.9 Å²	64.9	69%	0.687	31%	0.308	S	S	*	.			trans	-123	61.9	176.7	-163.7	-176.1	-175.1	-171.3	-1	110
666	H	93.8	Very high	95.6	Very high	92 Å²	92	60.8 Å²	60.8	43%	0.426	29%	0.285	S	S	.	.			trans	-91.2	-20.4	-177	-60.8	-43.1	0	0	0	113.8	I693	H666-I693 HydrophobicContact CB-CD1 3.54Å
667	H	96.5	Very high	95.8	Very high	12 Å²	12	56.6 Å²	56.6	6%	0.056	26%	0.262	C	S	.	.			trans	-88.7	151.3	177.5	-75.3	-71.8	0	0	0	112.2	V671 S685 S687 D689 S691	H667-V671 HydrophobicContact CB-CG2 4.34Å; H667-S685 PolarHBondContact CD2-OG 3.26Å; H667-S685 PolarHBondContact NE2-O 2.69Å; H667-S685 PolarHBondContact NE2-OG 3.01Å; H667-S687 VanDerWaalsContact CE1-CB 3.48Å; H667-S687 WeakPolarHBondContact CE1-CB 3.49Å; H667-S687 WeakPolarHBondContact ND1-CB 3.32Å; H667-D689 WeakPolarHBondContact CA-OD2 3.35Å; H667-D689 WeakPolarHBondContact CB-OD2 3.49Å; H667-D689 IonicContact CG-OD2 3.98Å; H667-D689 IonicContact ND1-OD1 2.69Å; H667-D689 PolarHBondContact ND1-OD1 2.74Å; H667-D689 IonicContact ND1-OD2 3.66Å; H667-D689 PolarHBondContact ND1-OD2 2.95Å; H667-D689 VanDerWaalsContact ND1-OD2 3.11Å; H667-S691 PolarHBondContact CE1-OG 2.86Å; H667-S691 PolarHBondContact ND1-OG 2.76Å
668	K	95	Very high	95.7	Very high	190 Å²	190	61 Å²	61	83%	0.826	27%	0.271	S	S	*	.	S	Bend	trans	-90.2	-22.9	177.4	-69.3	-169.4	175.2	-169.3	0	113.6	D689	K668-D689 HydrophobicContact CB-CB 4.2Å; K668-D689 PolarHBondContact N-OD2 3.07Å
669	K	96.8	Very high	95.5	Very high	59 Å²	59	60.9 Å²	60.9	26%	0.257	28%	0.283	S	S	.	.	S	Bend	trans	-124.6	179.8	176.9	-73	-179.6	160.4	-174.8	0	110.4	C647 V671 S687 D688 D689 D723	C647-K669 WeakPolarHBondContact CB-O 3.38Å; C647-K669 VanDerWaalsContact SG-CA 3.57Å; C647-K669 PolarHBondContact SG-O 2.91Å; C647-K669 VanDerWaalsContact SG-O 3.38Å; K669-V671 PolarHBondContact O-N 2.92Å; K669-S687 PolarHBondContact O-OG 3.33Å; K669-S687 VanDerWaalsContact O-OG 3.11Å; K669-D688 HydrophobicContact CB-CB 3.87Å; K669-D688 HydrophobicContact CD-CB 3.84Å; K669-D688 VanDerWaalsContact CD-O 3.3Å; K669-D688 WeakPolarHBondContact CD-O 3.48Å; K669-D689 HydrophobicContact CB-CB 4.16Å; K669-D689 HydrophobicContact CD-CB 4.47Å; K669-D689 HydrophobicContact CG-CB 4.34Å; K669-D723 PolarHBondContact NZ-O 2.69Å; K669-D723 IonicContact NZ-OD1 2.6Å; K669-D723 PolarHBondContact NZ-OD1 2.62Å
670	A	97.1	Very high	95.6	Very high	13 Å²	13	59 Å²	59	11%	0.107	27%	0.274	C	S	.	.			trans	-45.1	137.1	174.9	0	0	0	0	0	112.9	Y645 S687 D688	Y645-A670 HydrophobicContact CD1-CB 3.73Å; Y645-A670 HydrophobicContact CG-CB 4.4Å; Y645-A670 WeakPolarHBondContact O-CA 3.3Å; A670-S687 VanDerWaalsContact O-CA 3.23Å; A670-S687 WeakPolarHBondContact O-CA 3.42Å; A670-S687 VanDerWaalsContact O-CB 3.27Å; A670-S687 WeakPolarHBondContact O-CB 3.44Å; A670-S687 PolarHBondContact O-OG 3.22Å; A670-D688 PolarHBondContact O-N 3.24Å; A670-D688 VanDerWaalsContact O-N 3.17Å
671	V	97.6	Very high	95.6	Very high	1 Å²	1	60 Å²	60	1%	0.006	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	122.5	167.5	-177.2	0	0	0	0	107	S629 S644 H667 K669 V674 A686	S629-V671 VanDerWaalsContact CB-O 3.22Å; S629-V671 WeakPolarHBondContact CB-O 3.42Å; S629-V671 PolarHBondContact OG-O 2.96Å; S644-V671 PolarHBondContact O-N 2.84Å; H667-V671 HydrophobicContact CB-CG2 4.34Å; K669-V671 PolarHBondContact O-N 2.92Å; V671-V674 HydrophobicContact CG1-CG1 3.74Å; V671-A686 CarbonylContact C-O 3.59Å; V671-A686 WeakPolarHBondContact CA-O 3.42Å; V671-A686 WeakPolarHBondContact CG1-O 3.46Å
672	R	96.9	Very high	95.7	Very high	70 Å²	70	56 Å²	56	26%	0.264	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-63.2	-178.7	-71.9	-78	174.4	-175.4	-11.1	111	S629 S630 A686 D688 V726 L727	S629-R672 PolarHBondContact OG-O 3Å; S630-R672 VanDerWaalsContact CB-O 3.3Å; S630-R672 WeakPolarHBondContact CB-O 3.11Å; S630-R672 PolarHBondContact OG-O 3.17Å; R672-A686 PolarHBondContact N-O 3.04Å; R672-D688 WeakPolarHBondContact CG-OD1 3.49Å; R672-D688 IonicContact CZ-OD1 3.53Å; R672-D688 IonicContact CZ-OD2 3.41Å; R672-D688 VanDerWaalsContact NE-CG 3.25Å; R672-D688 IonicContact NE-OD1 2.73Å; R672-D688 PolarHBondContact NE-OD1 3.46Å; R672-D688 IonicContact NE-OD2 3.47Å; R672-D688 PolarHBondContact NE-OD2 2.61Å; R672-D688 IonicContact NH2-OD1 3.1Å; R672-D688 IonicContact NH2-OD2 3.78Å; R672-D688 PolarHBondContact NH2-OD2 3.02Å; R672-V726 WeakPolarHBondContact CB-O 3.38Å; R672-V726 WeakPolarHBondContact CG-O 3.41Å; R672-L727 VanDerWaalsContact CB-O 3.3Å; R672-L727 WeakPolarHBondContact CB-O 3.23Å
673	S	97.3	Very high	95.9	Very high	15 Å²	15	53.1 Å²	53.1	11%	0.105	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	151.8	-177.3	-171.4	0	0	0	0	111.6	S630 A686 D728	S630-S673 VanDerWaalsContact OG-CA 3.31Å; S630-S673 WeakPolarHBondContact OG-CA 3.36Å; S673-A686 PolarHBondContact O-N 3.18Å; S673-D728 VanDerWaalsContact CB-OD1 3.28Å; S673-D728 WeakPolarHBondContact CB-OD1 3.03Å; S673-D728 PolarHBondContact OG-OD1 3.15Å
674	V	97.7	Very high	96	Very high	8 Å²	8	49.6 Å²	49.6	5%	0.048	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	140	176.4	-62.9	0	0	0	0	109.3	S630 A632 I641 L649 V671 A684	S630-V674 PolarHBondContact OG-N 3.03Å; A632-V674 HydrophobicContact CB-CG2 4.23Å; A632-V674 WeakPolarHBondContact CB-O 3.31Å; I641-V674 HydrophobicContact CD1-CB 3.99Å; I641-V674 HydrophobicContact CD1-CG2 4.33Å; I641-V674 HydrophobicContact CG1-CB 4.2Å; I641-V674 HydrophobicContact CG1-CG2 4Å; L649-V674 HydrophobicContact CD1-CG1 3.81Å; V671-V674 HydrophobicContact CG1-CG1 3.74Å; V674-A684 WeakPolarHBondContact CA-O 3.3Å
675	A	97.4	Very high	96.2	Very high	10 Å²	10	49.1 Å²	49.1	8%	0.083	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	149.3	-177.7	0	0	0	0	0	112.2	F683 A684 V729 F731	A675-F683 CarbonylContact O-C 3.55Å; A675-F683 VanDerWaalsContact O-CA 3.22Å; A675-F683 WeakPolarHBondContact O-CA 3.39Å; A675-F683 WeakPolarHBondContact O-CB 3.48Å; A675-A684 PolarHBondContact N-O 3.4Å; A675-A684 PolarHBondContact O-N 2.9Å; A675-V729 HydrophobicContact CB-CG1 4.23Å; A675-V729 WeakPolarHBondContact CB-O 3.38Å; A675-F731 HydrophobicContact CB-CD2 4.01Å; A675-F731 HydrophobicContact CB-CE2 4.31Å; A675-F731 WeakPolarHBondContact O-CE2 3.26Å
676	Y	97.3	Very high	96.3	Very high	26 Å²	26	40.4 Å²	40.4	10%	0.102	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	145.3	165.3	-81.4	-74.7	0	0	0	110.1	A632 V633 H634 I641 W651 F683 F731	A632-Y676 HydrophobicContact CB-CD2 3.92Å; A632-Y676 WeakPolarHBondContact O-CE2 3.31Å; V633-Y676 VanDerWaalsContact C-CD2 3.41Å; V633-Y676 WeakPolarHBondContact O-CD2 3.43Å; H634-Y676 HydrophobicContact CB-CD2 4.37Å; H634-Y676 HydrophobicContact CB-CE1 4.23Å; H634-Y676 HydrophobicContact CB-CE2 3.9Å; H634-Y676 AromaticContact CD2-CD1 3.89Å; H634-Y676 AromaticContact CD2-CE1 3.75Å; H634-Y676 VanDerWaalsContact N-CE2 3.29Å; I641-Y676 HydrophobicContact CB-CE2 4.39Å; I641-Y676 HydrophobicContact CD1-CD2 4.05Å; I641-Y676 HydrophobicContact CD1-CE2 3.94Å; I641-Y676 HydrophobicContact CD1-CG 4.43Å; I641-Y676 HydrophobicContact CG1-CD2 4.07Å; I641-Y676 HydrophobicContact CG1-CE2 3.65Å; I641-Y676 HydrophobicContact CG2-CE2 4.27Å; W651-Y676 AromaticContact CH2-CE1 3.83Å; W651-Y676 HydrophobicContact CH2-CE1 3.83Å; W651-Y676 WeakPolarHBondContact CH2-OH 3.46Å; W651-Y676 AromaticContact CZ3-CE1 3.83Å; W651-Y676 HydrophobicContact CZ3-CE1 3.83Å; W651-Y676 AromaticContact CZ3-CZ 3.99Å; W651-Y676 WeakPolarHBondContact CZ3-OH 3.41Å; Y676-F683 HydrophobicContact CD1-CB 3.71Å; Y676-F683 HydrophobicContact CE1-CB 4Å; Y676-F683 HydrophobicContact CG-CB 4.38Å; Y676-F731 VanDerWaalsContact C-CD2 3.48Å
677	H	97	Very high	96.5	Very high	4 Å²	4	36 Å²	36	2%	0.019	18%	0.18	C	C	.	.			trans	-74.6	150.3	161.1	-177.6	-81.8	0	0	0	109.7	G679 Y680 L682 F731 H732 Q735	H677-G679 PolarHBondContact CE1-N 2.83Å; H677-G679 PolarHBondContact ND1-N 2.87Å; H677-Y680 AromaticContact CE1-CD2 3.35Å; H677-Y680 WeakPolarHBondContact CE1-CD2 3.49Å; H677-Y680 PolarHBondContact CE1-N 2.59Å; H677-Y680 VanDerWaalsContact CE1-N 3.26Å; H677-Y680 AromaticContact ND1-CD2 3.81Å; H677-Y680 PolarHBondContact ND1-N 3.46Å; H677-Y680 PolarHBondContact ND1-O 2.77Å; H677-Y680 AromaticContact NE2-CD2 3.64Å; H677-L682 HydrophobicContact CB-CB 4.09Å; H677-L682 PolarHBondContact N-O 2.62Å; H677-F731 HydrophobicContact CB-CB 4.11Å; H677-F731 HydrophobicContact CB-CD1 3.65Å; H677-F731 HydrophobicContact CB-CD2 4.08Å; H677-F731 HydrophobicContact CB-CE1 3.97Å; H677-F731 HydrophobicContact CB-CE2 4.39Å; H677-F731 HydrophobicContact CB-CG 3.69Å; H677-F731 HydrophobicContact CB-CZ 4.33Å; H677-F731 AromaticContact CD2-CD1 3.8Å; H677-H732 PolarHBondContact CD2-O 3.48Å; H677-H732 VanDerWaalsContact CD2-O 3.26Å; H677-H732 PolarHBondContact NE2-O 3.47Å; H677-Q735 PolarHBondContact CD2-O 2.91Å; H677-Q735 VanDerWaalsContact CD2-O 3.27Å; H677-Q735 PolarHBondContact NE2-O 3.49Å; H677-Q735 VanDerWaalsContact NE2-O 3.09Å
678	R	90.9	Very high	96.5	Very high	141 Å²	141	36 Å²	36	53%	0.532	18%	0.179	S	C	.	.	S	Bend	trans	-78.1	-39.9	-174.4	-64.3	-173.8	-178.8	-170.6	2.4	114.2	S635	S635-R678 WeakPolarHBondContact CB-O 3.38Å; S635-R678 PolarHBondContact OG-O 2.79Å
679	G	91.2	Very high	96.6	Very high	63 Å²	63	28.5 Å²	28.5	65%	0.649	15%	0.149	S	C	*	.	S	Bend	trans	-102.1	-69.4	-178.7	0	0	0	0	0	114.9	H677	H677-G679 PolarHBondContact CE1-N 2.83Å; H677-G679 PolarHBondContact ND1-N 2.87Å
680	Y	95.6	Very high	96.5	Very high	86 Å²	86	26 Å²	26	34%	0.337	14%	0.14	S	C	.	.	S	Bend	trans	-56.2	145.1	172.7	-60.8	-71.3	0	0	0	112.9	P403 H677 L682 P736	P403-Y680 HydrophobicContact CG-CD1 4.21Å; P403-Y680 HydrophobicContact CG-CE1 3.81Å; H677-Y680 AromaticContact CE1-CD2 3.35Å; H677-Y680 WeakPolarHBondContact CE1-CD2 3.49Å; H677-Y680 PolarHBondContact CE1-N 2.59Å; H677-Y680 VanDerWaalsContact CE1-N 3.26Å; H677-Y680 AromaticContact ND1-CD2 3.81Å; H677-Y680 PolarHBondContact ND1-N 3.46Å; H677-Y680 PolarHBondContact ND1-O 2.77Å; H677-Y680 AromaticContact NE2-CD2 3.64Å; Y680-L682 PolarHBondContact O-N 2.87Å; Y680-P736 HydrophobicContact CD2-CB 3.94Å; Y680-P736 HydrophobicContact CE2-CB 4.07Å; Y680-P736 HydrophobicContact CE2-CG 4.18Å
681	P	96	Very high	96.5	Very high	49 Å²	49	25.8 Å²	25.8	32%	0.318	14%	0.138	S	C	.	.	S	Bend	trans	-76.5	57.9	177.4	34.7	-38.6	0	0	0	111.9	H696 G697	P681-H696 WeakPolarHBondContact O-CA 3.27Å; P681-G697 PolarHBondContact O-N 2.82Å
682	L	97.4	Very high	96.5	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.01	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	143.9	-179.3	-61.1	177.6	0	0	0	110.9	F404 H677 Y680 C695 F731 P736	F404-L682 HydrophobicContact CB-CD1 4.07Å; F404-L682 HydrophobicContact CB-CD2 3.91Å; H677-L682 HydrophobicContact CB-CB 4.09Å; H677-L682 PolarHBondContact N-O 2.62Å; Y680-L682 PolarHBondContact O-N 2.87Å; L682-C695 WeakPolarHBondContact CA-O 3.49Å; L682-F731 HydrophobicContact CB-CE1 3.95Å; L682-F731 HydrophobicContact CB-CZ 3.98Å; L682-F731 HydrophobicContact CD1-CE1 4.36Å; L682-P736 HydrophobicContact CD1-CB 4.02Å
683	F	97.8	Very high	96.6	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.009	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	158.4	166.5	71.5	-82.2	0	0	0	110.9	I641 L649 W651 L664 A675 Y676 C695 I709	I641-F683 HydrophobicContact CD1-CB 3.9Å; I641-F683 HydrophobicContact CD1-CD2 3.82Å; I641-F683 HydrophobicContact CD1-CG 4.21Å; I641-F683 HydrophobicContact CG2-CD2 4.42Å; L649-F683 HydrophobicContact CD1-CD2 4.41Å; L649-F683 HydrophobicContact CD1-CE2 4.11Å; L649-F683 HydrophobicContact CD2-CE2 3.98Å; W651-F683 HydrophobicContact CE3-CD1 4.47Å; W651-F683 AromaticContact CE3-CE1 3.98Å; W651-F683 HydrophobicContact CE3-CE1 3.98Å; W651-F683 HydrophobicContact CE3-CE2 4.47Å; W651-F683 AromaticContact CE3-CZ 3.97Å; W651-F683 HydrophobicContact CE3-CZ 3.97Å; W651-F683 HydrophobicContact CH2-CE1 4.5Å; W651-F683 AromaticContact CZ3-CD1 3.67Å; W651-F683 HydrophobicContact CZ3-CD1 3.67Å; W651-F683 AromaticContact CZ3-CE1 3.48Å; W651-F683 HydrophobicContact CZ3-CE1 3.48Å; W651-F683 VanDerWaalsContact CZ3-CE1 3.48Å; W651-F683 HydrophobicContact CZ3-CG 4.27Å; W651-F683 AromaticContact CZ3-CZ 3.94Å; W651-F683 HydrophobicContact CZ3-CZ 3.94Å; L664-F683 HydrophobicContact CD1-CZ 4.3Å; A675-F683 CarbonylContact O-C 3.55Å; A675-F683 VanDerWaalsContact O-CA 3.22Å; A675-F683 WeakPolarHBondContact O-CA 3.39Å; A675-F683 WeakPolarHBondContact O-CB 3.48Å; Y676-F683 HydrophobicContact CD1-CB 3.71Å; Y676-F683 HydrophobicContact CE1-CB 4Å; Y676-F683 HydrophobicContact CG-CB 4.38Å; F683-C695 HydrophobicContact CD1-CB 3.73Å; F683-C695 WeakPolarHBondContact CD1-O 3.45Å; F683-C695 HydrophobicContact CD2-CB 4.15Å; F683-C695 HydrophobicContact CE1-CB 3.24Å; F683-C695 HydrophobicContact CE2-CB 3.7Å; F683-C695 HydrophobicContact CG-CB 4.18Å; F683-C695 HydrophobicContact CZ-CB 3.24Å; F683-C695 PolarHBondContact N-O 3.44Å; F683-C695 PolarHBondContact O-N 3.36Å; F683-I709 HydrophobicContact CE1-CG2 4.05Å; F683-I709 HydrophobicContact CZ-CG2 3.79Å
684	A	97.9	Very high	96.6	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	148.5	-177.5	0	0	0	0	0	111.3	V674 A675 V692 I693 V694 V729 F731 V738	V674-A684 WeakPolarHBondContact CA-O 3.3Å; A675-A684 PolarHBondContact N-O 3.4Å; A675-A684 PolarHBondContact O-N 2.9Å; A684-V692 HydrophobicContact CB-CG1 4.04Å; A684-I693 CarbonylContact C-O 3.53Å; A684-I693 VanDerWaalsContact CA-O 3.29Å; A684-I693 WeakPolarHBondContact CA-O 3.33Å; A684-V694 HydrophobicContact CB-CG2 4.28Å; A684-V729 HydrophobicContact CB-CG2 4.02Å; A684-F731 HydrophobicContact CB-CE2 3.62Å; A684-F731 HydrophobicContact CB-CZ 3.74Å; A684-V738 HydrophobicContact CB-CG2 4.38Å
685	S	98	Very high	96.6	Very high	6 Å²	6	21.9 Å²	21.9	4%	0.042	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	133.3	170.9	58.4	0	0	0	0	110.9	H667 V692 I693	H667-S685 PolarHBondContact CD2-OG 3.26Å; H667-S685 PolarHBondContact NE2-O 2.69Å; H667-S685 PolarHBondContact NE2-OG 3.01Å; S685-V692 CarbonylContact O-C 3.49Å; S685-V692 VanDerWaalsContact O-CA 3.28Å; S685-V692 WeakPolarHBondContact O-CA 3.49Å; S685-I693 PolarHBondContact N-O 3.27Å; S685-I693 PolarHBondContact O-N 3.23Å
686	A	97.7	Very high	96.5	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	144.8	177.1	0	0	0	0	0	111	V671 R672 S673 V692 V726 V729	V671-A686 CarbonylContact C-O 3.59Å; V671-A686 WeakPolarHBondContact CA-O 3.42Å; V671-A686 WeakPolarHBondContact CG1-O 3.46Å; R672-A686 PolarHBondContact N-O 3.04Å; S673-A686 PolarHBondContact O-N 3.18Å; A686-V692 HydrophobicContact CB-CG2 4.29Å; A686-V726 HydrophobicContact CB-CB 3.83Å; A686-V726 HydrophobicContact CB-CG1 3.53Å; A686-V729 HydrophobicContact CB-CB 3.85Å; A686-V729 HydrophobicContact CB-CG1 3.88Å
687	S	97.8	Very high	96.4	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	157.3	-177	179	0	0	0	0	113.8	H667 K669 A670 D689 G690 S691 V726	H667-S687 VanDerWaalsContact CE1-CB 3.48Å; H667-S687 WeakPolarHBondContact CE1-CB 3.49Å; H667-S687 WeakPolarHBondContact ND1-CB 3.32Å; K669-S687 PolarHBondContact O-OG 3.33Å; K669-S687 VanDerWaalsContact O-OG 3.11Å; A670-S687 VanDerWaalsContact O-CA 3.23Å; A670-S687 WeakPolarHBondContact O-CA 3.42Å; A670-S687 VanDerWaalsContact O-CB 3.27Å; A670-S687 WeakPolarHBondContact O-CB 3.44Å; A670-S687 PolarHBondContact O-OG 3.22Å; S687-D689 WeakPolarHBondContact CB-OD1 3.48Å; S687-D689 PolarHBondContact O-N 2.75Å; S687-D689 VanDerWaalsContact O-N 3.09Å; S687-D689 PolarHBondContact OG-N 2.97Å; S687-G690 PolarHBondContact O-N 3.08Å; S687-G690 VanDerWaalsContact O-N 3.13Å; S687-S691 PolarHBondContact N-O 2.89Å; S687-V726 PolarHBondContact O-N 3.13Å
688	D	97.3	Very high	96.3	Very high	10 Å²	10	22.5 Å²	22.5	5%	0.053	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-8.4	168.3	-69.2	-29.6	0	0	0	113.9	K669 A670 R672 G690 G725	K669-D688 HydrophobicContact CB-CB 3.87Å; K669-D688 HydrophobicContact CD-CB 3.84Å; K669-D688 VanDerWaalsContact CD-O 3.3Å; K669-D688 WeakPolarHBondContact CD-O 3.48Å; A670-D688 PolarHBondContact O-N 3.24Å; A670-D688 VanDerWaalsContact O-N 3.17Å; R672-D688 WeakPolarHBondContact CG-OD1 3.49Å; R672-D688 IonicContact CZ-OD1 3.53Å; R672-D688 IonicContact CZ-OD2 3.41Å; R672-D688 VanDerWaalsContact NE-CG 3.25Å; R672-D688 IonicContact NE-OD1 2.73Å; R672-D688 PolarHBondContact NE-OD1 3.46Å; R672-D688 IonicContact NE-OD2 3.47Å; R672-D688 PolarHBondContact NE-OD2 2.61Å; R672-D688 IonicContact NH2-OD1 3.1Å; R672-D688 IonicContact NH2-OD2 3.78Å; R672-D688 PolarHBondContact NH2-OD2 3.02Å; D688-G690 PolarHBondContact O-N 3.11Å; D688-G725 PolarHBondContact OD1-N 2.61Å
689	D	96	Very high	96.4	Very high	34 Å²	34	17.7 Å²	17.7	18%	0.182	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	5.9	170.4	70.2	22.3	0	0	0	114.4	H667 K668 K669 S687 S691	H667-D689 WeakPolarHBondContact CA-OD2 3.35Å; H667-D689 WeakPolarHBondContact CB-OD2 3.49Å; H667-D689 IonicContact CG-OD2 3.98Å; H667-D689 IonicContact ND1-OD1 2.69Å; H667-D689 PolarHBondContact ND1-OD1 2.74Å; H667-D689 IonicContact ND1-OD2 3.66Å; H667-D689 PolarHBondContact ND1-OD2 2.95Å; H667-D689 VanDerWaalsContact ND1-OD2 3.11Å; K668-D689 HydrophobicContact CB-CB 4.2Å; K668-D689 PolarHBondContact N-OD2 3.07Å; K669-D689 HydrophobicContact CB-CB 4.16Å; K669-D689 HydrophobicContact CD-CB 4.47Å; K669-D689 HydrophobicContact CG-CB 4.34Å; S687-D689 WeakPolarHBondContact CB-OD1 3.48Å; S687-D689 PolarHBondContact O-N 2.75Å; S687-D689 VanDerWaalsContact O-N 3.09Å; S687-D689 PolarHBondContact OG-N 2.97Å; D689-S691 PolarHBondContact O-N 3.26Å; D689-S691 WeakPolarHBondContact OD1-CB 3.39Å; D689-S691 PolarHBondContact OD1-N 2.92Å; D689-S691 VanDerWaalsContact OD1-N 3.08Å; D689-S691 PolarHBondContact OD1-OG 2.71Å
690	G	95.3	Very high	96.4	Very high	7 Å²	7	18.1 Å²	18.1	7%	0.072	9%	0.094	C	C	.	.	S	Bend	trans	75.9	7	176.6	0	0	0	0	0	114.1	S687 D688	S687-G690 PolarHBondContact O-N 3.08Å; S687-G690 VanDerWaalsContact O-N 3.13Å; D688-G690 PolarHBondContact O-N 3.11Å
691	S	96.6	Very high	95.9	Very high	8 Å²	8	22 Å²	22	6%	0.056	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	153.5	177.9	77.6	0	0	0	0	113.4	H667 S687 D689 L715	H667-S691 PolarHBondContact CE1-OG 2.86Å; H667-S691 PolarHBondContact ND1-OG 2.76Å; S687-S691 PolarHBondContact N-O 2.89Å; D689-S691 PolarHBondContact O-N 3.26Å; D689-S691 WeakPolarHBondContact OD1-CB 3.39Å; D689-S691 PolarHBondContact OD1-N 2.92Å; D689-S691 VanDerWaalsContact OD1-N 3.08Å; D689-S691 PolarHBondContact OD1-OG 2.71Å; S691-L715 VanDerWaalsContact CA-O 3.29Å; S691-L715 WeakPolarHBondContact CA-O 3.41Å; S691-L715 WeakPolarHBondContact CB-O 3.23Å
692	V	97.8	Very high	95.5	Very high	2 Å²	2	23.8 Å²	23.8	1%	0.012	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	123.3	164.1	-179.2	0	0	0	0	107.7	A684 S685 A686 V694 L715 V726 V729 V738	A684-V692 HydrophobicContact CB-CG1 4.04Å; S685-V692 CarbonylContact O-C 3.49Å; S685-V692 VanDerWaalsContact O-CA 3.28Å; S685-V692 WeakPolarHBondContact O-CA 3.49Å; A686-V692 HydrophobicContact CB-CG2 4.29Å; V692-V694 HydrophobicContact CG1-CG2 4.5Å; V692-L715 HydrophobicContact CB-CB 4.28Å; V692-L715 HydrophobicContact CB-CD1 4.5Å; V692-L715 PolarHBondContact N-O 3.32Å; V692-L715 WeakPolarHBondContact O-CA 3.38Å; V692-L715 WeakPolarHBondContact O-CB 3.31Å; V692-L715 PolarHBondContact O-N 3.01Å; V692-V726 HydrophobicContact CG2-CB 4.37Å; V692-V726 HydrophobicContact CG2-CG1 3.85Å; V692-V726 HydrophobicContact CG2-CG2 4.08Å; V692-V729 HydrophobicContact CG1-CG2 3.87Å; V692-V738 HydrophobicContact CG1-CG1 4.23Å
693	I	97.7	Very high	94.8	Very high	7 Å²	7	31.9 Å²	31.9	4%	0.036	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	123.7	177.6	-60.4	-179.7	0	0	0	107.9	H666 A684 S685 V714	H666-I693 HydrophobicContact CB-CD1 3.54Å; A684-I693 CarbonylContact C-O 3.53Å; A684-I693 VanDerWaalsContact CA-O 3.29Å; A684-I693 WeakPolarHBondContact CA-O 3.33Å; S685-I693 PolarHBondContact N-O 3.27Å; S685-I693 PolarHBondContact O-N 3.23Å; I693-V714 HydrophobicContact CD1-CG2 4.45Å; I693-V714 HydrophobicContact CG1-CG1 4.21Å; I693-V714 HydrophobicContact CG1-CG2 4.18Å
694	V	97.9	Very high	94.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	130.8	176.1	-175.5	0	0	0	0	109.2	P405 A684 V692 V712 K713 L715 V738	P405-V694 HydrophobicContact CG-CG2 4.25Å; A684-V694 HydrophobicContact CB-CG2 4.28Å; V692-V694 HydrophobicContact CG1-CG2 4.5Å; V694-V712 HydrophobicContact CB-CG2 4.42Å; V694-V712 HydrophobicContact CG1-CG2 4.13Å; V694-V712 VanDerWaalsContact O-CG2 3.25Å; V694-V712 WeakPolarHBondContact O-CG2 3.35Å; V694-V712 PolarHBondContact O-N 3.11Å; V694-K713 PolarHBondContact N-O 2.86Å; V694-K713 PolarHBondContact O-N 3.24Å; V694-K713 VanDerWaalsContact O-N 3.14Å; V694-L715 HydrophobicContact CG2-CD1 3.64Å; V694-L715 HydrophobicContact CG2-CG 4.27Å; V694-V738 HydrophobicContact CG2-CG2 4.3Å
695	C	97.1	Very high	94	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.02	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	140.9	-178.1	-65.7	0	0	0	0	109.8	L682 F683 V710	L682-C695 WeakPolarHBondContact CA-O 3.49Å; F683-C695 HydrophobicContact CD1-CB 3.73Å; F683-C695 WeakPolarHBondContact CD1-O 3.45Å; F683-C695 HydrophobicContact CD2-CB 4.15Å; F683-C695 HydrophobicContact CE1-CB 3.24Å; F683-C695 HydrophobicContact CE2-CB 3.7Å; F683-C695 HydrophobicContact CG-CB 4.18Å; F683-C695 HydrophobicContact CZ-CB 3.24Å; F683-C695 PolarHBondContact N-O 3.44Å; F683-C695 PolarHBondContact O-N 3.36Å; C695-V710 CarbonylContact C-O 3.54Å; C695-V710 WeakPolarHBondContact CA-O 3.42Å
696	H	96.9	Very high	93.7	Very high	21 Å²	21	47.1 Å²	47.1	10%	0.097	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	131	163.3	-168.3	111.2	0	0	0	107.9	L401 P681 T698 I709 V710 V712	L401-H696 HydrophobicContact CB-CB 4.47Å; L401-H696 HydrophobicContact CD1-CB 4.08Å; P681-H696 WeakPolarHBondContact O-CA 3.27Å; H696-T698 PolarHBondContact CD2-OG1 3.01Å; H696-T698 PolarHBondContact NE2-OG1 3.44Å; H696-I709 WeakPolarHBondContact O-CA 3.22Å; H696-V710 PolarHBondContact N-O 3.09Å; H696-V710 PolarHBondContact O-N 3.04Å; H696-V712 HydrophobicContact CB-CG1 3.82Å
697	G	95.4	Very high	93.5	Very high	2 Å²	2	47.3 Å²	47.3	2%	0.021	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	83.7	-178.5	0	0	0	0	0	110	P681 V699 L708	P681-G697 PolarHBondContact O-N 2.82Å; G697-V699 PolarHBondContact O-N 2.93Å; G697-L708 CarbonylContact C-O 3.6Å; G697-L708 WeakPolarHBondContact CA-O 3.48Å
698	T	93.5	Very high	93.3	Very high	30 Å²	30	49.3 Å²	49.3	18%	0.184	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	115.5	178.5	-29.6	0	0	0	0	109.5	H696 Y700 P707 L708	H696-T698 PolarHBondContact CD2-OG1 3.01Å; H696-T698 PolarHBondContact NE2-OG1 3.44Å; T698-Y700 HydrophobicContact CG2-CD1 4.39Å; T698-Y700 HydrophobicContact CG2-CE1 3.87Å; T698-P707 CarbonylContact O-C 3.56Å; T698-P707 WeakPolarHBondContact O-CA 3.16Å; T698-P707 WeakPolarHBondContact O-CB 3.28Å; T698-L708 PolarHBondContact N-O 2.77Å; T698-L708 PolarHBondContact O-N 2.55Å
699	V	93	Very high	93.2	Very high	39 Å²	39	48.9 Å²	48.9	24%	0.236	26%	0.257	C	S	.	.			trans	-91	132.3	164.8	172.4	0	0	0	0	107.8	H639 W651 G697	H639-V699 WeakPolarHBondContact CD2-CG2 3.15Å; H639-V699 VanDerWaalsContact NE2-CG1 3.28Å; H639-V699 WeakPolarHBondContact NE2-CG1 3.19Å; W651-V699 HydrophobicContact CH2-CG2 4.48Å; W651-V699 HydrophobicContact CZ2-CG2 4.1Å; G697-V699 PolarHBondContact O-N 2.93Å
700	Y	91.1	Very high	93.2	Very high	72 Å²	72	47.5 Å²	47.5	28%	0.282	25%	0.249	S	C	.	.			trans	-99.6	148.9	179	-60.9	-76.4	0	0	0	110.7	T698 D702 Q705 N706 L708	T698-Y700 HydrophobicContact CG2-CD1 4.39Å; T698-Y700 HydrophobicContact CG2-CE1 3.87Å; Y700-D702 VanDerWaalsContact C-N 3.28Å; Y700-Q705 HydrophobicContact CD1-CG 4.43Å; Y700-Q705 HydrophobicContact CD2-CB 4.12Å; Y700-Q705 HydrophobicContact CD2-CG 3.52Å; Y700-Q705 HydrophobicContact CE2-CG 3.93Å; Y700-Q705 HydrophobicContact CG-CB 4.14Å; Y700-Q705 VanDerWaalsContact CG-CD 3.45Å; Y700-Q705 HydrophobicContact CG-CG 3.8Å; Y700-Q705 VanDerWaalsContact CZ-NE2 3.3Å; Y700-N706 WeakPolarHBondContact CD2-O 3.42Å; Y700-N706 WeakPolarHBondContact CE2-O 3.4Å; Y700-L708 HydrophobicContact CE2-CB 3.92Å; Y700-L708 WeakPolarHBondContact OH-CB 3.22Å
701	N	85.1	Confident	93.2	Very high	169 Å²	169	49.6 Å²	49.6	90%	0.904	26%	0.262	S	S	*	.	S	Bend	trans	-80.2	-11.9	174.7	-66.5	-17.9	0	0	0	112.6
702	D	88.9	Confident	93.2	Very high	86 Å²	86	50 Å²	50	46%	0.46	26%	0.263	S	S	.	.	S	Bend	trans	-82.1	117.1	170.7	-179	2.4	0	0	0	109.4	Y700 L704 Q705	Y700-D702 VanDerWaalsContact C-N 3.28Å; D702-L704 PolarHBondContact O-N 3.26Å; D702-L704 VanDerWaalsContact O-N 3.13Å; D702-L704 PolarHBondContact OD1-N 3.31Å; D702-Q705 HydrophobicContact CB-CB 4.13Å; D702-Q705 PolarHBondContact O-N 2.99Å
703	L	81.1	Confident	93.2	Very high	172 Å²	172	53.7 Å²	53.7	90%	0.901	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-14.5	179.7	-63	172.3	0	0	0	113.5
704	L	89.3	Confident	93.2	Very high	158 Å²	158	56.6 Å²	56.6	83%	0.827	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-9.6	174.5	-60.1	178.2	0	0	0	113.2	D702	D702-L704 PolarHBondContact O-N 3.26Å; D702-L704 VanDerWaalsContact O-N 3.13Å; D702-L704 PolarHBondContact OD1-N 3.31Å
705	Q	91	Very high	93.1	Very high	92 Å²	92	56.8 Å²	56.8	43%	0.43	30%	0.298	S	S	.	.	S	Bend	trans	-104	100.5	-175.2	-166.1	179.2	-0.4	0	0	112.3	Y700 D702	Y700-Q705 HydrophobicContact CD1-CG 4.43Å; Y700-Q705 HydrophobicContact CD2-CB 4.12Å; Y700-Q705 HydrophobicContact CD2-CG 3.52Å; Y700-Q705 HydrophobicContact CE2-CG 3.93Å; Y700-Q705 HydrophobicContact CG-CB 4.14Å; Y700-Q705 VanDerWaalsContact CG-CD 3.45Å; Y700-Q705 HydrophobicContact CG-CG 3.8Å; Y700-Q705 VanDerWaalsContact CZ-NE2 3.3Å; D702-Q705 HydrophobicContact CB-CB 4.13Å; D702-Q705 PolarHBondContact O-N 2.99Å
706	N	91.3	Very high	93	Very high	78 Å²	78	66 Å²	66	42%	0.417	33%	0.333	S	S	.	.			trans	-53.4	145.6	176.1	-68.8	-75.1	0	0	0	113.2	Y661 Y700	Y661-N706 HydrophobicContact CE2-CB 4.03Å; Y700-N706 WeakPolarHBondContact CD2-O 3.42Å; Y700-N706 WeakPolarHBondContact CE2-O 3.4Å
707	P	93.6	Very high	92.8	Very high	4 Å²	4	66.6 Å²	66.6	3%	0.026	34%	0.344	C	S	.	.			trans	-67.9	135	-174.1	25.7	-33.8	0	0	0	113.7	W651 Y661 T698 I709	W651-P707 HydrophobicContact CZ2-CB 4.02Å; W651-P707 HydrophobicContact CZ2-CG 4.3Å; Y661-P707 HydrophobicContact CD1-CG 3.93Å; Y661-P707 HydrophobicContact CE1-CG 3.84Å; T698-P707 CarbonylContact O-C 3.56Å; T698-P707 WeakPolarHBondContact O-CA 3.16Å; T698-P707 WeakPolarHBondContact O-CB 3.28Å; P707-I709 PolarHBondContact O-N 3.03Å
708	L	93.9	Very high	92.8	Very high	41 Å²	41	67.2 Å²	67.2	22%	0.215	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	112.6	179.9	173.2	64	0	0	0	110.8	P396 G697 T698 Y700 V710	P396-L708 HydrophobicContact CG-CD2 4.19Å; G697-L708 CarbonylContact C-O 3.6Å; G697-L708 WeakPolarHBondContact CA-O 3.48Å; T698-L708 PolarHBondContact N-O 2.77Å; T698-L708 PolarHBondContact O-N 2.55Å; Y700-L708 HydrophobicContact CE2-CB 3.92Å; Y700-L708 WeakPolarHBondContact OH-CB 3.22Å; L708-V710 HydrophobicContact CD1-CG2 3.77Å; L708-V710 HydrophobicContact CG-CG2 4.01Å
709	I	95.4	Very high	92.9	Very high	2 Å²	2	69.9 Å²	69.9	1%	0.01	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	110	-175.8	-59	163.3	0	0	0	110.4	W651 Y661 K662 L664 F683 H696 P707	W651-I709 HydrophobicContact CB-CD1 4.01Å; W651-I709 HydrophobicContact CD2-CD1 3.44Å; W651-I709 VanDerWaalsContact CD2-CD1 3.44Å; W651-I709 HydrophobicContact CD2-CG1 4.12Å; W651-I709 HydrophobicContact CE3-CD1 3.82Å; W651-I709 HydrophobicContact CE3-CG1 4.1Å; W651-I709 HydrophobicContact CG-CD1 3.53Å; W651-I709 HydrophobicContact CH2-CG1 4.49Å; W651-I709 HydrophobicContact CZ2-CD1 4.47Å; W651-I709 HydrophobicContact CZ3-CD1 4.48Å; W651-I709 HydrophobicContact CZ3-CG1 4.3Å; Y661-I709 HydrophobicContact CD1-CD1 3.99Å; Y661-I709 HydrophobicContact CE1-CD1 3.93Å; K662-I709 HydrophobicContact CB-CD1 4.04Å; K662-I709 HydrophobicContact CD-CB 3.98Å; K662-I709 HydrophobicContact CD-CD1 3.88Å; K662-I709 HydrophobicContact CD-CG2 4.22Å; K662-I709 PolarHBondContact NZ-O 3.03Å; L664-I709 HydrophobicContact CD1-CG2 3.94Å; F683-I709 HydrophobicContact CE1-CG2 4.05Å; F683-I709 HydrophobicContact CZ-CG2 3.79Å; H696-I709 WeakPolarHBondContact O-CA 3.22Å; P707-I709 PolarHBondContact O-N 3.03Å
710	V	96	Very high	93.1	Very high	4 Å²	4	71.7 Å²	71.7	2%	0.024	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	122.3	-175.5	-176.3	0	0	0	0	110.7	L395 L401 C695 H696 L708 V712	L395-V710 HydrophobicContact CB-CG1 4.38Å; L395-V710 HydrophobicContact CB-CG2 4.22Å; L395-V710 HydrophobicContact CD1-CG1 4.28Å; L395-V710 HydrophobicContact CD1-CG2 4.32Å; L395-V710 HydrophobicContact CD2-CG2 4.31Å; L401-V710 HydrophobicContact CD1-CB 3.88Å; L401-V710 HydrophobicContact CD1-CG1 3.84Å; L401-V710 HydrophobicContact CD1-CG2 4.07Å; C695-V710 CarbonylContact C-O 3.54Å; C695-V710 WeakPolarHBondContact CA-O 3.42Å; H696-V710 PolarHBondContact N-O 3.09Å; H696-V710 PolarHBondContact O-N 3.04Å; L708-V710 HydrophobicContact CD1-CG2 3.77Å; L708-V710 HydrophobicContact CG-CG2 4.01Å; V710-V712 HydrophobicContact CG1-CG1 4.46Å; V710-V712 PolarHBondContact O-N 2.94Å
711	P	95.5	Very high	93.2	Very high	52 Å²	52	70.2 Å²	70.2	34%	0.338	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	122.8	170.3	29.3	-32.5	0	0	0	110.2
712	V	96.2	Very high	93.4	Very high	15 Å²	15	70.6 Å²	70.6	9%	0.091	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	-31.8	-174.6	-68.4	0	0	0	0	113.6	P398 L401 F404 V694 H696 V710	P398-V712 HydrophobicContact CB-CB 4.21Å; P398-V712 HydrophobicContact CB-CG1 4.2Å; L401-V712 HydrophobicContact CB-CG1 4.24Å; L401-V712 HydrophobicContact CD1-CG1 4.1Å; F404-V712 HydrophobicContact CB-CG2 3.98Å; F404-V712 HydrophobicContact CD1-CB 4.04Å; F404-V712 HydrophobicContact CD1-CG1 4.41Å; F404-V712 HydrophobicContact CD1-CG2 3.98Å; F404-V712 HydrophobicContact CD2-CB 4.03Å; F404-V712 HydrophobicContact CD2-CG2 3.71Å; F404-V712 HydrophobicContact CE1-CB 4.01Å; F404-V712 HydrophobicContact CE1-CG1 4.36Å; F404-V712 HydrophobicContact CE1-CG2 4.43Å; F404-V712 HydrophobicContact CE2-CB 3.97Å; F404-V712 HydrophobicContact CE2-CG2 4.17Å; F404-V712 HydrophobicContact CG-CB 4.07Å; F404-V712 HydrophobicContact CG-CG2 3.6Å; F404-V712 HydrophobicContact CZ-CB 3.97Å; V694-V712 HydrophobicContact CB-CG2 4.42Å; V694-V712 HydrophobicContact CG1-CG2 4.13Å; V694-V712 VanDerWaalsContact O-CG2 3.25Å; V694-V712 WeakPolarHBondContact O-CG2 3.35Å; V694-V712 PolarHBondContact O-N 3.11Å; H696-V712 HydrophobicContact CB-CG1 3.82Å; V710-V712 HydrophobicContact CG1-CG1 4.46Å; V710-V712 PolarHBondContact O-N 2.94Å
713	K	96.9	Very high	93.6	Very high	81 Å²	81	72.2 Å²	72.2	35%	0.352	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	138.3	179.9	-168.2	72.1	-179.4	-163	0	112.4	F404 T406 V694 L715	F404-K713 HydrophobicContact CD2-CB 4Å; F404-K713 HydrophobicContact CE2-CB 3.99Å; T406-K713 WeakPolarHBondContact O-CE 3.48Å; T406-K713 PolarHBondContact O-NZ 3.43Å; V694-K713 PolarHBondContact N-O 2.86Å; V694-K713 PolarHBondContact O-N 3.24Å; V694-K713 VanDerWaalsContact O-N 3.14Å; K713-L715 HydrophobicContact CG-CD2 3.63Å; K713-L715 HydrophobicContact CG-CG 4.2Å
714	V	97.4	Very high	94.3	Very high	67 Å²	67	65.8 Å²	65.8	41%	0.406	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	115.1	159.8	-175.4	0	0	0	0	107.6	I693 R716	I693-V714 HydrophobicContact CD1-CG2 4.45Å; I693-V714 HydrophobicContact CG1-CG1 4.21Å; I693-V714 HydrophobicContact CG1-CG2 4.18Å; V714-R716 HydrophobicContact CG1-CG 4.19Å
715	L	97.1	Very high	94.6	Very high	5 Å²	5	58.2 Å²	58.2	3%	0.026	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	135.1	173	-56.8	172.1	0	0	0	108.4	P405 S691 V692 V694 K713 V738 F750	P405-L715 HydrophobicContact CG-CD1 4.4Å; S691-L715 VanDerWaalsContact CA-O 3.29Å; S691-L715 WeakPolarHBondContact CA-O 3.41Å; S691-L715 WeakPolarHBondContact CB-O 3.23Å; V692-L715 HydrophobicContact CB-CB 4.28Å; V692-L715 HydrophobicContact CB-CD1 4.5Å; V692-L715 PolarHBondContact N-O 3.32Å; V692-L715 WeakPolarHBondContact O-CA 3.38Å; V692-L715 WeakPolarHBondContact O-CB 3.31Å; V692-L715 PolarHBondContact O-N 3.01Å; V694-L715 HydrophobicContact CG2-CD1 3.64Å; V694-L715 HydrophobicContact CG2-CG 4.27Å; K713-L715 HydrophobicContact CG-CD2 3.63Å; K713-L715 HydrophobicContact CG-CG 4.2Å; L715-V738 HydrophobicContact CD1-CG1 4.47Å; L715-F750 HydrophobicContact CB-CD1 4.05Å; L715-F750 HydrophobicContact CB-CE1 3.95Å; L715-F750 HydrophobicContact CB-CG 4.46Å; L715-F750 HydrophobicContact CB-CZ 4.29Å; L715-F750 HydrophobicContact CD1-CB 3.78Å; L715-F750 HydrophobicContact CD1-CD1 4.05Å; L715-F750 HydrophobicContact CD1-CD2 4.17Å; L715-F750 HydrophobicContact CD1-CG 3.75Å; L715-F750 HydrophobicContact CD2-CB 4.37Å; L715-F750 HydrophobicContact CD2-CD1 3.79Å; L715-F750 HydrophobicContact CD2-CE1 4.4Å; L715-F750 HydrophobicContact CD2-CG 4.28Å; L715-F750 HydrophobicContact CG-CD1 4.18Å; L715-F750 HydrophobicContact CG-CG 4.39Å
716	R	95.3	Very high	94.9	Very high	197 Å²	197	53.9 Å²	53.9	74%	0.743	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.7	149.8	177.9	-64.3	-175.8	-178.3	164.9	2.4	109.1	V714	V714-R716 HydrophobicContact CG1-CG 4.19Å
717	G	91.6	Very high	95.2	Very high	33 Å²	33	51 Å²	51	34%	0.34	27%	0.265	S	S	.	.			trans	169.4	-35.9	172.9	0	0	0	0	0	113.7	R748	G717-R748 PolarHBondContact O-NH1 2.99Å; G717-R748 PolarHBondContact O-NH2 2.67Å
718	H	96.1	Very high	95.4	Very high	14 Å²	14	51.9 Å²	51.9	7%	0.065	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-61.2	139.7	178.1	-76.2	-75.5	0	0	0	111.5	V726 S740 G742 D744 T746 R748	H718-V726 HydrophobicContact CB-CG2 4.17Å; H718-S740 PolarHBondContact CD2-OG 3.09Å; H718-S740 PolarHBondContact NE2-O 3.49Å; H718-S740 PolarHBondContact NE2-OG 3.42Å; H718-G742 PolarHBondContact CE1-N 2.77Å; H718-G742 WeakPolarHBondContact ND1-CA 3.31Å; H718-D744 VanDerWaalsContact CA-OD2 3.31Å; H718-D744 WeakPolarHBondContact CA-OD2 3.26Å; H718-D744 IonicContact CE1-OD1 2.9Å; H718-D744 IonicContact CG-OD2 3.34Å; H718-D744 IonicContact ND1-OD1 2.65Å; H718-D744 PolarHBondContact ND1-OD1 2.94Å; H718-D744 IonicContact ND1-OD2 3.11Å; H718-D744 PolarHBondContact ND1-OD2 3.09Å; H718-T746 PolarHBondContact CE1-O 3Å; H718-T746 PolarHBondContact ND1-OG1 3.22Å; H718-R748 VanDerWaalsContact CE1-CD 3.5Å; H718-R748 WeakPolarHBondContact CE1-CD 3.47Å; H718-R748 PolarHBondContact ND1-NE 2.88Å
719	V	95.6	Very high	95.6	Very high	86 Å²	86	50.1 Å²	50.1	52%	0.521	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-82	137.7	171.9	-176.5	0	0	0	0	108.4	T721 D744	V719-T721 HydrophobicContact CG1-CG2 4.41Å; V719-D744 HydrophobicContact CB-CB 3.9Å; V719-D744 PolarHBondContact N-OD2 3.37Å
720	I	96.1	Very high	95.7	Very high	78 Å²	78	51.6 Å²	51.6	40%	0.4	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-80.8	125.6	174.8	-58.5	176.1	0	0	0	107.9	L724	I720-L724 CarbonylContact C-O 3.53Å; I720-L724 VanDerWaalsContact CA-O 3.27Å; I720-L724 WeakPolarHBondContact CA-O 3.47Å; I720-L724 VanDerWaalsContact CG2-O 3.32Å; I720-L724 WeakPolarHBondContact CG2-O 3.16Å
721	T	93.1	Very high	95.8	Very high	40 Å²	40	52 Å²	52	25%	0.245	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-129	130.8	179	58.7	0	0	0	0	109.5	V719 D723 L724 A743	V719-T721 HydrophobicContact CG1-CG2 4.41Å; T721-D723 PolarHBondContact O-N 3.35Å; T721-L724 PolarHBondContact N-O 3.08Å; T721-L724 WeakPolarHBondContact O-CB 3.46Å; T721-L724 PolarHBondContact O-N 3.44Å; T721-A743 WeakPolarHBondContact OG1-CB 3.47Å; T721-A743 PolarHBondContact OG1-O 3.3Å
722	H	90	Very high	95.9	Very high	178 Å²	178	50.2 Å²	50.2	82%	0.824	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	45.5	-175.2	-53.6	-74.5	0	0	0	113.4	L724	H722-L724 PolarHBondContact O-N 2.81Å
723	D	92.8	Very high	95.8	Very high	119 Å²	119	50.3 Å²	50.3	64%	0.636	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.9	-2.4	-172.9	-87.3	-59.1	0	0	0	117.6	K669 T721	K669-D723 PolarHBondContact NZ-O 2.69Å; K669-D723 IonicContact NZ-OD1 2.6Å; K669-D723 PolarHBondContact NZ-OD1 2.62Å; T721-D723 PolarHBondContact O-N 3.35Å
724	L	95.8	Very high	95.7	Very high	37 Å²	37	50.6 Å²	50.6	19%	0.194	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-86.5	149.4	173.1	-60.3	174.2	0	0	0	111.2	L418 I720 T721 H722 L727 A743	L418-L724 HydrophobicContact CD2-CD1 3.55Å; I720-L724 CarbonylContact C-O 3.53Å; I720-L724 VanDerWaalsContact CA-O 3.27Å; I720-L724 WeakPolarHBondContact CA-O 3.47Å; I720-L724 VanDerWaalsContact CG2-O 3.32Å; I720-L724 WeakPolarHBondContact CG2-O 3.16Å; T721-L724 PolarHBondContact N-O 3.08Å; T721-L724 WeakPolarHBondContact O-CB 3.46Å; T721-L724 PolarHBondContact O-N 3.44Å; H722-L724 PolarHBondContact O-N 2.81Å; L724-L727 HydrophobicContact CB-CD2 4.34Å; L724-L727 HydrophobicContact CD2-CD2 4.44Å; L724-A743 HydrophobicContact CB-CB 3.59Å
725	G	96.1	Very high	95.7	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.265	C	S	.	.			trans	-126.8	-106.3	-175.7	0	0	0	0	0	111.7	D688 G742 A743	D688-G725 PolarHBondContact OD1-N 2.61Å; G725-G742 WeakPolarHBondContact O-CA 3.42Å; G725-A743 PolarHBondContact O-N 3.24Å
726	V	97.8	Very high	95.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	121	175.5	-167.6	0	0	0	0	109.4	R672 A686 S687 V692 H718 S741	R672-V726 WeakPolarHBondContact CB-O 3.38Å; R672-V726 WeakPolarHBondContact CG-O 3.41Å; A686-V726 HydrophobicContact CB-CB 3.83Å; A686-V726 HydrophobicContact CB-CG1 3.53Å; S687-V726 PolarHBondContact O-N 3.13Å; V692-V726 HydrophobicContact CG2-CB 4.37Å; V692-V726 HydrophobicContact CG2-CG1 3.85Å; V692-V726 HydrophobicContact CG2-CG2 4.08Å; H718-V726 HydrophobicContact CB-CG2 4.17Å; V726-S741 CarbonylContact C-O 3.6Å; V726-S741 WeakPolarHBondContact CA-O 3.34Å; V726-S741 WeakPolarHBondContact CG1-O 3.5Å
727	L	97.4	Very high	95.7	Very high	19 Å²	19	45 Å²	45	10%	0.099	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-43.5	-173.3	-62	178.4	0	0	0	112.4	L418 R672 L724 S741 A743	L418-L727 HydrophobicContact CB-CD1 3.99Å; L418-L727 HydrophobicContact CD2-CD1 4.2Å; R672-L727 VanDerWaalsContact CB-O 3.3Å; R672-L727 WeakPolarHBondContact CB-O 3.23Å; L724-L727 HydrophobicContact CB-CD2 4.34Å; L724-L727 HydrophobicContact CD2-CD2 4.44Å; L727-S741 PolarHBondContact N-O 3.47Å; L727-A743 HydrophobicContact CD1-CB 4.46Å
728	D	97.8	Very high	96	Very high	22 Å²	22	43.5 Å²	43.5	12%	0.118	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	155	179.4	-160.4	10.3	0	0	0	112.2	S421 I422 S673 S740 S741	S421-D728 WeakPolarHBondContact CA-OD2 3.45Å; S421-D728 WeakPolarHBondContact CB-OD2 3.49Å; S421-D728 PolarHBondContact OG-OD2 3Å; I422-D728 HydrophobicContact CG1-CB 4.08Å; I422-D728 PolarHBondContact N-OD2 3.38Å; S673-D728 VanDerWaalsContact CB-OD1 3.28Å; S673-D728 WeakPolarHBondContact CB-OD1 3.03Å; S673-D728 PolarHBondContact OG-OD1 3.15Å; D728-S740 WeakPolarHBondContact O-CA 3.33Å; D728-S741 WeakPolarHBondContact CB-OG 3.43Å; D728-S741 PolarHBondContact N-OG 2.98Å; D728-S741 VanDerWaalsContact N-OG 3.16Å; D728-S741 PolarHBondContact O-N 3.32Å
729	V	97.8	Very high	96.1	Very high	4 Å²	4	42.8 Å²	42.8	2%	0.024	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	135.9	-178.3	67.6	0	0	0	0	110.4	A675 A684 A686 V692 V738 F739	A675-V729 HydrophobicContact CB-CG1 4.23Å; A675-V729 WeakPolarHBondContact CB-O 3.38Å; A684-V729 HydrophobicContact CB-CG2 4.02Å; A686-V729 HydrophobicContact CB-CB 3.85Å; A686-V729 HydrophobicContact CB-CG1 3.88Å; V692-V729 HydrophobicContact CG1-CG2 3.87Å; V729-V738 HydrophobicContact CG2-CG1 3.75Å; V729-F739 WeakPolarHBondContact CA-O 3.31Å
730	T	97.6	Very high	96.2	Very high	32 Å²	32	38.7 Å²	38.7	20%	0.196	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	152.6	178.9	-168.6	0	0	0	0	111.1	I422 V424 F739	I422-T730 HydrophobicContact CB-CG2 4.5Å; I422-T730 HydrophobicContact CD1-CG2 3.91Å; I422-T730 HydrophobicContact CG1-CG2 3.98Å; V424-T730 HydrophobicContact CG2-CG2 3.77Å; T730-F739 HydrophobicContact CG2-CB 4.02Å; T730-F739 HydrophobicContact CG2-CD2 4.33Å; T730-F739 PolarHBondContact N-O 2.85Å; T730-F739 PolarHBondContact O-N 3.41Å
731	F	97.8	Very high	96.3	Very high	12 Å²	12	35 Å²	35	5%	0.053	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	150.7	179.7	-80.7	-89.1	0	0	0	111.4	A675 Y676 H677 L682 A684 W737 V738	A675-F731 HydrophobicContact CB-CD2 4.01Å; A675-F731 HydrophobicContact CB-CE2 4.31Å; A675-F731 WeakPolarHBondContact O-CE2 3.26Å; Y676-F731 VanDerWaalsContact C-CD2 3.48Å; H677-F731 HydrophobicContact CB-CB 4.11Å; H677-F731 HydrophobicContact CB-CD1 3.65Å; H677-F731 HydrophobicContact CB-CD2 4.08Å; H677-F731 HydrophobicContact CB-CE1 3.97Å; H677-F731 HydrophobicContact CB-CE2 4.39Å; H677-F731 HydrophobicContact CB-CG 3.69Å; H677-F731 HydrophobicContact CB-CZ 4.33Å; H677-F731 AromaticContact CD2-CD1 3.8Å; L682-F731 HydrophobicContact CB-CE1 3.95Å; L682-F731 HydrophobicContact CB-CZ 3.98Å; L682-F731 HydrophobicContact CD1-CE1 4.36Å; A684-F731 HydrophobicContact CB-CE2 3.62Å; A684-F731 HydrophobicContact CB-CZ 3.74Å; F731-W737 WeakPolarHBondContact CA-O 3.46Å; F731-W737 WeakPolarHBondContact CD1-O 3.22Å; F731-V738 HydrophobicContact CD1-CG2 3.62Å; F731-V738 HydrophobicContact CE1-CG2 3.32Å; F731-V738 HydrophobicContact CE2-CG2 4.28Å; F731-V738 HydrophobicContact CG-CG2 4.25Å; F731-V738 HydrophobicContact CZ-CG2 3.7Å
732	H	97.6	Very high	96.4	Very high	15 Å²	15	33.1 Å²	33.1	7%	0.069	17%	0.168	C	C	.	.			trans	-60.4	142	161.4	-170.1	-95.6	0	0	0	109.6	G428 H677 T734 Q735 W737 F739	G428-H732 VanDerWaalsContact CA-NE2 3.26Å; G428-H732 WeakPolarHBondContact CA-NE2 3.49Å; G428-H732 PolarHBondContact O-NE2 3.38Å; H677-H732 PolarHBondContact CD2-O 3.48Å; H677-H732 VanDerWaalsContact CD2-O 3.26Å; H677-H732 PolarHBondContact NE2-O 3.47Å; H732-T734 VanDerWaalsContact C-N 3.25Å; H732-T734 PolarHBondContact CE1-OG1 2.78Å; H732-T734 PolarHBondContact ND1-N 2.66Å; H732-T734 PolarHBondContact ND1-OG1 3.01Å; H732-T734 PolarHBondContact O-N 3.38Å; H732-Q735 HydrophobicContact CB-CB 4.21Å; H732-Q735 VanDerWaalsContact ND1-CB 3.33Å; H732-Q735 WeakPolarHBondContact ND1-CB 3.38Å; H732-Q735 WeakPolarHBondContact ND1-CG 3.48Å; H732-Q735 PolarHBondContact ND1-N 2.95Å; H732-W737 HydrophobicContact CB-CB 3.98Å; H732-W737 HydrophobicContact CB-CE3 4.49Å; H732-W737 PolarHBondContact N-O 3.17Å; H732-F739 HydrophobicContact CB-CE2 3.93Å
733	P	94.9	Very high	96.7	Very high	18 Å²	18	25 Å²	25	12%	0.117	13%	0.132	C	C	.	.	S	Bend	trans	-65.8	-24	-173	23.7	-35.1	0	0	0	114.6
734	T	94.9	Very high	96.9	Very high	87 Å²	87	20.7 Å²	20.7	53%	0.534	11%	0.109	S	C	.	.	S	Bend	trans	-133.5	-3.9	-170.7	56.9	0	0	0	0	115.3	H732	H732-T734 VanDerWaalsContact C-N 3.25Å; H732-T734 PolarHBondContact CE1-OG1 2.78Å; H732-T734 PolarHBondContact ND1-N 2.66Å; H732-T734 PolarHBondContact ND1-OG1 3.01Å; H732-T734 PolarHBondContact O-N 3.38Å
735	Q	95.9	Very high	96.9	Very high	77 Å²	77	20 Å²	20	36%	0.36	11%	0.109	S	C	.	.	S	Bend	trans	-126.6	150.8	-175.3	-66.1	-67.5	-9.4	0	0	109	H677 H732 W737	H677-Q735 PolarHBondContact CD2-O 2.91Å; H677-Q735 VanDerWaalsContact CD2-O 3.27Å; H677-Q735 PolarHBondContact NE2-O 3.49Å; H677-Q735 VanDerWaalsContact NE2-O 3.09Å; H732-Q735 HydrophobicContact CB-CB 4.21Å; H732-Q735 VanDerWaalsContact ND1-CB 3.33Å; H732-Q735 WeakPolarHBondContact ND1-CB 3.38Å; H732-Q735 WeakPolarHBondContact ND1-CG 3.48Å; H732-Q735 PolarHBondContact ND1-N 2.95Å; Q735-W737 HydrophobicContact CB-CB 4.5Å; Q735-W737 HydrophobicContact CB-CD2 3.76Å; Q735-W737 HydrophobicContact CB-CE3 4.17Å; Q735-W737 HydrophobicContact CB-CG 3.9Å; Q735-W737 HydrophobicContact CG-CD2 4.39Å; Q735-W737 HydrophobicContact CG-CZ2 4.47Å; Q735-W737 PolarHBondContact O-N 2.84Å
736	P	96.2	Very high	96.9	Very high	11 Å²	11	20.7 Å²	20.7	7%	0.071	11%	0.113	C	C	.	.	S	Bend	trans	-76.6	45.3	-178.3	35.3	-36.1	0	0	0	111.5	P403 P405 Y680 L682	P403-P736 HydrophobicContact CB-CB 4.18Å; P403-P736 HydrophobicContact CB-CG 3.85Å; P403-P736 HydrophobicContact CG-CB 4.15Å; P403-P736 HydrophobicContact CG-CG 3.96Å; P405-P736 WeakPolarHBondContact CB-O 3.31Å; P405-P736 WeakPolarHBondContact CD-O 3.34Å; P405-P736 WeakPolarHBondContact CG-O 3.3Å; Y680-P736 HydrophobicContact CD2-CB 3.94Å; Y680-P736 HydrophobicContact CE2-CB 4.07Å; Y680-P736 HydrophobicContact CE2-CG 4.18Å; L682-P736 HydrophobicContact CD1-CB 4.02Å
737	W	97.3	Very high	96.9	Very high	64 Å²	64	20.8 Å²	20.8	24%	0.242	11%	0.114	C	C	.	.			trans	-110.2	143.7	-175.2	-60.1	-12.7	0	0	0	110.7	V445 F731 H732 Q735 L749 F750 T751	V445-W737 HydrophobicContact CG1-CZ3 4.27Å; F731-W737 WeakPolarHBondContact CA-O 3.46Å; F731-W737 WeakPolarHBondContact CD1-O 3.22Å; H732-W737 HydrophobicContact CB-CB 3.98Å; H732-W737 HydrophobicContact CB-CE3 4.49Å; H732-W737 PolarHBondContact N-O 3.17Å; Q735-W737 HydrophobicContact CB-CB 4.5Å; Q735-W737 HydrophobicContact CB-CD2 3.76Å; Q735-W737 HydrophobicContact CB-CE3 4.17Å; Q735-W737 HydrophobicContact CB-CG 3.9Å; Q735-W737 HydrophobicContact CG-CD2 4.39Å; Q735-W737 HydrophobicContact CG-CZ2 4.47Å; Q735-W737 PolarHBondContact O-N 2.84Å; W737-L749 HydrophobicContact CB-CD1 3.86Å; W737-L749 HydrophobicContact CD2-CD1 4.49Å; W737-L749 HydrophobicContact CE3-CD1 4.31Å; W737-L749 HydrophobicContact CG-CD1 4.36Å; W737-F750 VanDerWaalsContact CA-O 3.3Å; W737-F750 WeakPolarHBondContact CA-O 3.4Å; W737-T751 HydrophobicContact CD2-CG2 4.01Å; W737-T751 HydrophobicContact CG-CG2 3.89Å
738	V	97.9	Very high	96.9	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	131.8	179.1	159.6	0	0	0	0	109.9	P405 A684 V692 V694 L715 V729 F731 L749 F750	P405-V738 HydrophobicContact CG-CB 4.11Å; P405-V738 HydrophobicContact CG-CG2 3.86Å; A684-V738 HydrophobicContact CB-CG2 4.38Å; V692-V738 HydrophobicContact CG1-CG1 4.23Å; V694-V738 HydrophobicContact CG2-CG2 4.3Å; L715-V738 HydrophobicContact CD1-CG1 4.47Å; V729-V738 HydrophobicContact CG2-CG1 3.75Å; F731-V738 HydrophobicContact CD1-CG2 3.62Å; F731-V738 HydrophobicContact CE1-CG2 3.32Å; F731-V738 HydrophobicContact CE2-CG2 4.28Å; F731-V738 HydrophobicContact CG-CG2 4.25Å; F731-V738 HydrophobicContact CZ-CG2 3.7Å; V738-L749 WeakPolarHBondContact O-CA 2.97Å; V738-F750 PolarHBondContact N-O 3.16Å; V738-F750 PolarHBondContact O-N 2.95Å
739	F	98.2	Very high	97	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	138.7	164	-54.9	-90	0	0	0	109.1	Y412 I422 V424 L431 V445 V729 T730 H732 R748 L749	Y412-F739 HydrophobicContact CE2-CD1 4.24Å; Y412-F739 HydrophobicContact CE2-CE1 4.43Å; I422-F739 HydrophobicContact CD1-CB 3.78Å; V424-F739 HydrophobicContact CG1-CE2 4.31Å; V424-F739 HydrophobicContact CG2-CD2 3.52Å; V424-F739 HydrophobicContact CG2-CE2 3.51Å; V424-F739 HydrophobicContact CG2-CG 4.39Å; V424-F739 HydrophobicContact CG2-CZ 4.37Å; L431-F739 HydrophobicContact CD1-CB 4.36Å; L431-F739 HydrophobicContact CD1-CD1 4.07Å; L431-F739 HydrophobicContact CD1-CD2 4.47Å; L431-F739 HydrophobicContact CD1-CE1 4.46Å; L431-F739 HydrophobicContact CD1-CG 4.06Å; L431-F739 HydrophobicContact CD2-CD1 3.7Å; L431-F739 HydrophobicContact CD2-CE1 4.06Å; L431-F739 HydrophobicContact CD2-CG 4.42Å; L431-F739 HydrophobicContact CG-CD1 4.45Å; V445-F739 HydrophobicContact CB-CE1 4.49Å; V445-F739 HydrophobicContact CB-CZ 4.35Å; V445-F739 HydrophobicContact CG1-CE1 3.96Å; V445-F739 HydrophobicContact CG1-CZ 3.69Å; V445-F739 HydrophobicContact CG2-CE1 3.88Å; V445-F739 HydrophobicContact CG2-CZ 3.68Å; V729-F739 WeakPolarHBondContact CA-O 3.31Å; T730-F739 HydrophobicContact CG2-CB 4.02Å; T730-F739 HydrophobicContact CG2-CD2 4.33Å; T730-F739 PolarHBondContact N-O 2.85Å; T730-F739 PolarHBondContact O-N 3.41Å; H732-F739 HydrophobicContact CB-CE2 3.93Å; F739-R748 CarbonylContact C-O 3.59Å; F739-R748 WeakPolarHBondContact CA-O 3.47Å; F739-L749 HydrophobicContact CD1-CB 4.31Å; F739-L749 HydrophobicContact CD1-CD1 4.03Å; F739-L749 HydrophobicContact CE1-CB 4.38Å; F739-L749 HydrophobicContact CE1-CD1 3.74Å; F739-L749 HydrophobicContact CE1-CG 4.44Å; F739-L749 HydrophobicContact CZ-CD1 4.01Å
740	S	98.1	Very high	97	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	140.9	173.5	65.2	0	0	0	0	111.9	H718 D728 I747 R748 F750	H718-S740 PolarHBondContact CD2-OG 3.09Å; H718-S740 PolarHBondContact NE2-O 3.49Å; H718-S740 PolarHBondContact NE2-OG 3.42Å; D728-S740 WeakPolarHBondContact O-CA 3.33Å; S740-I747 CarbonylContact O-C 3.54Å; S740-I747 VanDerWaalsContact O-CA 3.32Å; S740-I747 WeakPolarHBondContact O-CA 3.34Å; S740-I747 VanDerWaalsContact O-CG2 3.27Å; S740-I747 WeakPolarHBondContact O-CG2 3.23Å; S740-R748 PolarHBondContact N-O 2.97Å; S740-R748 PolarHBondContact O-N 3.03Å; S740-F750 WeakPolarHBondContact OG-CE2 3.38Å
741	S	97.4	Very high	96.8	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	138.1	-180	76	0	0	0	0	111.6	V419 V726 L727 D728	V419-S741 WeakPolarHBondContact O-CB 3.49Å; V419-S741 PolarHBondContact O-OG 3.43Å; V726-S741 CarbonylContact C-O 3.6Å; V726-S741 WeakPolarHBondContact CA-O 3.34Å; V726-S741 WeakPolarHBondContact CG1-O 3.5Å; L727-S741 PolarHBondContact N-O 3.47Å; D728-S741 WeakPolarHBondContact CB-OG 3.43Å; D728-S741 PolarHBondContact N-OG 2.98Å; D728-S741 VanDerWaalsContact N-OG 3.16Å; D728-S741 PolarHBondContact O-N 3.32Å
742	G	95.7	Very high	96.8	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	156.1	-174.2	0	0	0	0	0	114.5	V419 H718 G725 D744 T746	V419-G742 PolarHBondContact N-O 2.87Å; V419-G742 VanDerWaalsContact N-O 3.09Å; H718-G742 PolarHBondContact CE1-N 2.77Å; H718-G742 WeakPolarHBondContact ND1-CA 3.31Å; G725-G742 WeakPolarHBondContact O-CA 3.42Å; G742-D744 PolarHBondContact O-N 2.9Å; G742-T746 PolarHBondContact N-O 3.1Å
743	A	96.4	Very high	96.7	Very high	8 Å²	8	22.3 Å²	22.3	7%	0.066	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-15.4	157.7	0	0	0	0	0	112.2	L418 T721 L724 G725 L727 A745	L418-A743 HydrophobicContact CD2-CB 3.81Å; L418-A743 HydrophobicContact CG-CB 4.37Å; T721-A743 WeakPolarHBondContact OG1-CB 3.47Å; T721-A743 PolarHBondContact OG1-O 3.3Å; L724-A743 HydrophobicContact CB-CB 3.59Å; G725-A743 PolarHBondContact O-N 3.24Å; L727-A743 HydrophobicContact CD1-CB 4.46Å; A743-A745 PolarHBondContact O-N 3.49Å
744	D	95.7	Very high	96.8	Very high	28 Å²	28	22.6 Å²	22.6	15%	0.15	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	18.7	174.1	69.5	-2.5	0	0	0	115	H718 V719 G742 T746 R748	H718-D744 VanDerWaalsContact CA-OD2 3.31Å; H718-D744 WeakPolarHBondContact CA-OD2 3.26Å; H718-D744 IonicContact CE1-OD1 2.9Å; H718-D744 IonicContact CG-OD2 3.34Å; H718-D744 IonicContact ND1-OD1 2.65Å; H718-D744 PolarHBondContact ND1-OD1 2.94Å; H718-D744 IonicContact ND1-OD2 3.11Å; H718-D744 PolarHBondContact ND1-OD2 3.09Å; V719-D744 HydrophobicContact CB-CB 3.9Å; V719-D744 PolarHBondContact N-OD2 3.37Å; G742-D744 PolarHBondContact O-N 2.9Å; D744-T746 VanDerWaalsContact CG-OG1 3.24Å; D744-T746 PolarHBondContact O-N 3.49Å; D744-T746 WeakPolarHBondContact OD1-CB 3.29Å; D744-T746 PolarHBondContact OD1-N 2.91Å; D744-T746 PolarHBondContact OD1-OG1 3.31Å; D744-T746 PolarHBondContact OD2-OG1 3.49Å; D744-R748 IonicContact OD2-CZ 3.02Å; D744-R748 IonicContact OD2-NE 3.67Å; D744-R748 IonicContact OD2-NH2 3.86Å; D744-R748 PolarHBondContact OD2-NH2 3.1Å
745	A	96.2	Very high	96.9	Very high	22 Å²	22	18.8 Å²	18.8	18%	0.182	10%	0.098	C	C	.	.	S	Bend	trans	56.7	12.5	-176	0	0	0	0	0	115.6	G417 A743	G417-A745 WeakPolarHBondContact O-CA 3.48Å; G417-A745 WeakPolarHBondContact O-CB 3.45Å; A743-A745 PolarHBondContact O-N 3.49Å
746	T	97	Very high	97	Very high	16 Å²	16	15.1 Å²	15.1	10%	0.098	8%	0.081	C	C	.	.			trans	-106.8	156.3	176.1	72.4	0	0	0	0	112.6	V411 R413 H718 G742 D744 R748	V411-T746 HydrophobicContact CG1-CG2 3.92Å; R413-T746 HydrophobicContact CG-CG2 4.49Å; H718-T746 PolarHBondContact CE1-O 3Å; H718-T746 PolarHBondContact ND1-OG1 3.22Å; G742-T746 PolarHBondContact N-O 3.1Å; D744-T746 VanDerWaalsContact CG-OG1 3.24Å; D744-T746 PolarHBondContact O-N 3.49Å; D744-T746 WeakPolarHBondContact OD1-CB 3.29Å; D744-T746 PolarHBondContact OD1-N 2.91Å; D744-T746 PolarHBondContact OD1-OG1 3.31Å; D744-T746 PolarHBondContact OD2-OG1 3.49Å; T746-R748 PolarHBondContact OG1-NE 2.91Å
747	I	97.9	Very high	97	Very high	1 Å²	1	15.4 Å²	15.4	1%	0.005	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	146.7	160.4	-44.2	153.4	0	0	0	106.7	V411 Y412 V419 I422 L431 S433 W443 S740	V411-I747 CarbonylContact C-O 3.51Å; V411-I747 WeakPolarHBondContact CA-O 3.45Å; Y412-I747 HydrophobicContact CD2-CB 3.82Å; Y412-I747 HydrophobicContact CD2-CG2 4.1Å; Y412-I747 WeakPolarHBondContact CD2-O 3.42Å; Y412-I747 HydrophobicContact CG-CB 4.26Å; Y412-I747 PolarHBondContact N-O 3.32Å; Y412-I747 PolarHBondContact O-N 3.29Å; V419-I747 HydrophobicContact CB-CG1 4.49Å; V419-I747 HydrophobicContact CG1-CD1 4.33Å; V419-I747 HydrophobicContact CG1-CG1 3.93Å; V419-I747 HydrophobicContact CG2-CG1 4.43Å; I422-I747 HydrophobicContact CD1-CG2 4.16Å; I422-I747 HydrophobicContact CG2-CD1 4.13Å; I422-I747 HydrophobicContact CG2-CG1 4.15Å; I422-I747 HydrophobicContact CG2-CG2 4.06Å; L431-I747 HydrophobicContact CD2-CD1 4.45Å; L431-I747 HydrophobicContact CD2-CG2 4.07Å; S433-I747 VanDerWaalsContact CB-CD1 3.45Å; W443-I747 HydrophobicContact CZ2-CD1 4.33Å; S740-I747 CarbonylContact O-C 3.54Å; S740-I747 VanDerWaalsContact O-CA 3.32Å; S740-I747 WeakPolarHBondContact O-CA 3.34Å; S740-I747 VanDerWaalsContact O-CG2 3.27Å; S740-I747 WeakPolarHBondContact O-CG2 3.23Å
748	R	97.8	Very high	97	Very high	28 Å²	28	11.9 Å²	11.9	11%	0.106	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	134.4	-175.9	-62	179	-174.6	-136.5	15.9	110.5	Q408 L410 V411 G717 H718 F739 S740 D744 T746 F750	Q408-R748 HydrophobicContact CG-CB 4.45Å; L410-R748 WeakPolarHBondContact O-CA 3.39Å; V411-R748 HydrophobicContact CG1-CG 4.27Å; V411-R748 HydrophobicContact CG2-CG 4.31Å; G717-R748 PolarHBondContact O-NH1 2.99Å; G717-R748 PolarHBondContact O-NH2 2.67Å; H718-R748 VanDerWaalsContact CE1-CD 3.5Å; H718-R748 WeakPolarHBondContact CE1-CD 3.47Å; H718-R748 PolarHBondContact ND1-NE 2.88Å; F739-R748 CarbonylContact C-O 3.59Å; F739-R748 WeakPolarHBondContact CA-O 3.47Å; S740-R748 PolarHBondContact N-O 2.97Å; S740-R748 PolarHBondContact O-N 3.03Å; D744-R748 IonicContact OD2-CZ 3.02Å; D744-R748 IonicContact OD2-NE 3.67Å; D744-R748 IonicContact OD2-NH2 3.86Å; D744-R748 PolarHBondContact OD2-NH2 3.1Å; T746-R748 PolarHBondContact OG1-NE 2.91Å; R748-F750 HydrophobicContact CB-CD2 4.41Å; R748-F750 HydrophobicContact CB-CE2 3.71Å; R748-F750 HydrophobicContact CB-CZ 4.24Å
749	L	97.9	Very high	97	Very high	5 Å²	5	12.8 Å²	12.8	3%	0.026	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	128.2	172.1	170.4	62.5	0	0	0	108.8	Q408 A409 L410 Y412 W737 V738 F739 T751	Q408-L749 CarbonylContact C-O 3.59Å; A409-L749 HydrophobicContact CB-CG 4.42Å; A409-L749 PolarHBondContact N-O 3.26Å; L410-L749 HydrophobicContact CB-CB 4.18Å; L410-L749 HydrophobicContact CB-CD2 4.41Å; L410-L749 HydrophobicContact CD1-CD2 4.04Å; L410-L749 HydrophobicContact CG-CD2 4.35Å; L410-L749 PolarHBondContact N-O 3.48Å; L410-L749 PolarHBondContact O-N 3.11Å; Y412-L749 HydrophobicContact CE2-CB 3.93Å; W737-L749 HydrophobicContact CB-CD1 3.86Å; W737-L749 HydrophobicContact CD2-CD1 4.49Å; W737-L749 HydrophobicContact CE3-CD1 4.31Å; W737-L749 HydrophobicContact CG-CD1 4.36Å; V738-L749 WeakPolarHBondContact O-CA 2.97Å; F739-L749 HydrophobicContact CD1-CB 4.31Å; F739-L749 HydrophobicContact CD1-CD1 4.03Å; F739-L749 HydrophobicContact CE1-CB 4.38Å; F739-L749 HydrophobicContact CE1-CD1 3.74Å; F739-L749 HydrophobicContact CE1-CG 4.44Å; F739-L749 HydrophobicContact CZ-CD1 4.01Å; L749-T751 HydrophobicContact CD1-CG2 4.24Å; L749-T751 HydrophobicContact CD2-CG2 4.29Å; L749-T751 HydrophobicContact CG-CG2 4.02Å
750	F	97.7	Very high	96.9	Very high	4 Å²	4	13.9 Å²	13.9	2%	0.018	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	137	172.1	-62.4	-94.8	0	0	0	110.6	P405 T407 Q408 L715 W737 V738 S740 R748	P405-F750 HydrophobicContact CB-CB 4.05Å; P405-F750 WeakPolarHBondContact CB-O 3.32Å; T407-F750 CarbonylContact O-C 3.56Å; T407-F750 WeakPolarHBondContact O-CA 3.34Å; Q408-F750 HydrophobicContact CB-CD1 3.85Å; Q408-F750 HydrophobicContact CB-CE1 3.62Å; Q408-F750 HydrophobicContact CB-CZ 4.31Å; Q408-F750 HydrophobicContact CG-CD1 4.44Å; Q408-F750 HydrophobicContact CG-CE1 4.07Å; Q408-F750 HydrophobicContact CG-CZ 4.28Å; L715-F750 HydrophobicContact CB-CD1 4.05Å; L715-F750 HydrophobicContact CB-CE1 3.95Å; L715-F750 HydrophobicContact CB-CG 4.46Å; L715-F750 HydrophobicContact CB-CZ 4.29Å; L715-F750 HydrophobicContact CD1-CB 3.78Å; L715-F750 HydrophobicContact CD1-CD1 4.05Å; L715-F750 HydrophobicContact CD1-CD2 4.17Å; L715-F750 HydrophobicContact CD1-CG 3.75Å; L715-F750 HydrophobicContact CD2-CB 4.37Å; L715-F750 HydrophobicContact CD2-CD1 3.79Å; L715-F750 HydrophobicContact CD2-CE1 4.4Å; L715-F750 HydrophobicContact CD2-CG 4.28Å; L715-F750 HydrophobicContact CG-CD1 4.18Å; L715-F750 HydrophobicContact CG-CG 4.39Å; W737-F750 VanDerWaalsContact CA-O 3.3Å; W737-F750 WeakPolarHBondContact CA-O 3.4Å; V738-F750 PolarHBondContact N-O 3.16Å; V738-F750 PolarHBondContact O-N 2.95Å; S740-F750 WeakPolarHBondContact OG-CE2 3.38Å; R748-F750 HydrophobicContact CB-CD2 4.41Å; R748-F750 HydrophobicContact CB-CE2 3.71Å; R748-F750 HydrophobicContact CB-CZ 4.24Å
751	T	94.5	Very high	96.8	Very high	55 Å²	55	15.2 Å²	15.2	34%	0.337	9%	0.09	S	C	.	.			trans	-132.6	0	-174.1	61.7	0	0	0	0	112.4	P405 T406 T407 A409 W737 L749	P405-T751 VanDerWaalsContact CA-C 3.45Å; P405-T751 WeakPolarHBondContact CA-OXT 3.29Å; T406-T751 PolarHBondContact N-O 2.8Å; T406-T751 PolarHBondContact OG1-O 2.79Å; T407-T751 PolarHBondContact N-O 2.86Å; T407-T751 VanDerWaalsContact N-O 3.07Å; T407-T751 PolarHBondContact O-N 2.73Å; A409-T751 HydrophobicContact CB-CG2 3.74Å; W737-T751 HydrophobicContact CD2-CG2 4.01Å; W737-T751 HydrophobicContact CG-CG2 3.89Å; L749-T751 HydrophobicContact CD1-CG2 4.24Å; L749-T751 HydrophobicContact CD2-CG2 4.29Å; L749-T751 HydrophobicContact CG-CG2 4.02Å

Retrieved 751 of 751 residues in 200.2 ms (Link to these results)

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