A0A2K5TM34_MACFA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A2K5TM34, Species MACFA (Macaca fascicularis, Crab-eating macaque), Gene n/a, Length 597 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	41.3	Very low	36.1	Very low	244 Å²	244	139.2 Å²	139.2	100%	1.202	83%	0.826	S	S	*	*				0	160.5	0	-80.2	-173.8	159.7	0	0	109.2
2	S	35.4	Very low	36.1	Very low	113 Å²	113	134.8 Å²	134.8	79%	0.79	80%	0.801	S	S	*	*			trans	78.8	89.7	179.9	-60.1	0	0	0	0	119.6
3	S	40.4	Very low	35.8	Very low	101 Å²	101	135.1 Å²	135.1	71%	0.706	80%	0.796	S	S	*	*				77.2	135.8	115	77.6	0	0	0	0	124.1
4	K	39.9	Very low	35.7	Very low	208 Å²	208	137 Å²	137	90%	0.904	80%	0.8	S	S	*	*			trans	73.5	143.3	159.2	-59.2	173.1	-179.3	179.9	0	116.7
5	G	34.2	Very low	35.4	Very low	73 Å²	73	135.1 Å²	135.1	75%	0.753	81%	0.807	S	S	*	*			cis	170.9	-179.4	-3.6	0	0	0	0	0	112.3
6	S	31.7	Very low	35.3	Very low	120 Å²	120	136.6 Å²	136.6	84%	0.839	81%	0.809	S	S	*	*			trans	81.7	127.6	-177.3	-149	0	0	0	0	115.1
7	S	34.2	Very low	34.9	Very low	104 Å²	104	132.2 Å²	132.2	73%	0.727	80%	0.799	S	S	*	*			cis	74.7	133.9	34.9	-141.8	0	0	0	0	112.2
8	T	36.3	Very low	34.7	Very low	106 Å²	106	130.6 Å²	130.6	65%	0.65	80%	0.795	S	S	*	*			cis	-148.7	172.7	24.3	52.3	0	0	0	0	114.4
9	D	36.5	Very low	34.6	Very low	158 Å²	158	132.1 Å²	132.1	85%	0.845	80%	0.797	S	S	*	*			trans	56.4	127	154.8	-47.2	-40	0	0	0	120
10	G	32.9	Very low	34.4	Very low	79 Å²	79	131.3 Å²	131.3	81%	0.814	80%	0.798	S	S	*	*			cis	-171.7	-158.3	2.3	0	0	0	0	0	109.7
11	R	33.9	Very low	34.2	Very low	225 Å²	225	130.3 Å²	130.3	85%	0.849	80%	0.797	S	S	*	*			cis	-149.8	-105	0.7	-167.3	-156.4	144.1	101	4.2	112.7
12	T	36.2	Very low	34	Very low	87 Å²	87	124.1 Å²	124.1	53%	0.534	78%	0.777	S	S	.	*			trans	-152.4	163.5	-165.8	62	0	0	0	0	110.9
13	D	32.3	Very low	34.6	Very low	138 Å²	138	123.9 Å²	123.9	74%	0.738	77%	0.773	S	S	*	*			cis	-150.1	171.1	35.7	-96.9	-63.2	0	0	0	115.6
14	L	34	Very low	34.3	Very low	162 Å²	162	127.7 Å²	127.7	85%	0.848	78%	0.78	S	S	*	*			trans	-90.9	153.9	-171.9	-64.6	138.6	0	0	0	114.6
15	A	32.3	Very low	33.9	Very low	109 Å²	109	125.3 Å²	125.3	90%	0.901	77%	0.772	S	S	*	*			trans	-152.5	148	138.3	0	0	0	0	0	110
16	N	32.8	Very low	33.7	Very low	159 Å²	159	128.7 Å²	128.7	85%	0.85	77%	0.77	S	S	*	*			trans	-144	159.6	-161.5	-166.1	16.2	0	0	0	111.5
17	G	29.1	Very low	33.6	Very low	62 Å²	62	128.2 Å²	128.2	64%	0.639	77%	0.767	S	S	*	*			trans	100.9	109	176.1	0	0	0	0	0	113.2
18	S	32	Very low	33.4	Very low	102 Å²	102	127.2 Å²	127.2	71%	0.713	77%	0.773	S	S	*	*			cis	79.3	111.5	33.6	-44.5	0	0	0	0	114.8
19	L	32.5	Very low	33.3	Very low	160 Å²	160	127 Å²	127	84%	0.838	78%	0.782	S	S	*	*				156.8	137.1	109.8	-82.9	178.1	0	0	0	114.4
20	S	29.1	Very low	33.1	Very low	116 Å²	116	128.9 Å²	128.9	81%	0.811	79%	0.785	S	S	*	*			trans	65.6	156.1	150.3	74.1	0	0	0	0	118.4
21	S	30.5	Very low	33.2	Very low	111 Å²	111	134.3 Å²	134.3	78%	0.776	79%	0.79	S	S	*	*			cis	-156.3	157.4	6.8	38.5	0	0	0	0	111.2
22	S	37.3	Very low	33.1	Very low	113 Å²	113	127.6 Å²	127.6	79%	0.79	79%	0.79	S	S	*	*			trans	-87.7	157	158.8	-53	0	0	0	0	110.8
23	P	48.4	Very low	32.9	Very low	109 Å²	109	134.1 Å²	134.1	71%	0.708	81%	0.805	S	S	*	*				-131.3	159.8	101.6	8.4	15.4	0	0	0	112.2
24	E	34.3	Very low	32.9	Very low	180 Å²	180	135.6 Å²	135.6	84%	0.841	81%	0.808	S	S	*	*				50.4	134	78.9	-61	-178.7	159.3	0	0	113.1
25	E	32.2	Very low	32.8	Very low	159 Å²	159	133.8 Å²	133.8	74%	0.743	80%	0.804	S	S	*	*			cis	-162.8	179.6	20.6	-145	-171.3	-162.2	0	0	112.2
26	M	28.4	Very low	32.8	Very low	143 Å²	143	134.4 Å²	134.4	70%	0.704	80%	0.801	S	S	*	*			trans	74.3	113.4	146.8	-77.4	-71.7	-151.8	0	0	124.5
27	S	31.2	Very low	32.9	Very low	111 Å²	111	132.3 Å²	132.3	78%	0.776	80%	0.799	S	S	*	*				50.3	132.4	126.6	72.8	0	0	0	0	123.2
28	G	28.8	Very low	33	Very low	83 Å²	83	132.9 Å²	132.9	86%	0.856	81%	0.805	S	S	*	*			trans	174.6	109.4	157	0	0	0	0	0	112.3
29	A	34.8	Very low	33	Very low	102 Å²	102	135.4 Å²	135.4	84%	0.843	81%	0.809	S	S	*	*			trans	-101.3	142.1	168.3	0	0	0	0	0	109.1
30	E	31.8	Very low	33	Very low	197 Å²	197	136.8 Å²	136.8	92%	0.921	81%	0.811	S	S	*	*			trans	-161.3	164.7	144.8	-124.7	174.7	-158.6	0	0	112.9
31	E	34.9	Very low	33.3	Very low	193 Å²	193	137.7 Å²	137.7	90%	0.902	81%	0.811	S	S	*	*			trans	-77.3	147.1	-173.1	-60.3	175.4	112.1	0	0	112.7
32	G	31.3	Very low	33.4	Very low	84 Å²	84	141.1 Å²	141.1	87%	0.866	82%	0.815	S	S	*	*			trans	-132.5	98.4	171	0	0	0	0	0	110.3
33	R	33.3	Very low	33.1	Very low	223 Å²	223	140.1 Å²	140.1	84%	0.842	81%	0.814	S	S	*	*			trans	-101.5	159.9	-179	-162.5	-178	-174.4	157.8	-0.7	109.8
34	E	31.8	Very low	32.3	Very low	169 Å²	169	140.7 Å²	140.7	79%	0.79	82%	0.82	S	S	*	*			trans	73.3	153.4	170.6	-37.2	-172.3	166.1	0	0	114.6
35	T	30.9	Very low	32.2	Very low	125 Å²	125	139.4 Å²	139.4	77%	0.767	82%	0.819	S	S	*	*			cis	-135.6	153.1	5.2	43.8	0	0	0	0	110.9
36	S	33.5	Very low	32.2	Very low	121 Å²	121	140 Å²	140	85%	0.846	83%	0.827	S	S	*	*			trans	-85.3	128.5	164.4	54.1	0	0	0	0	110.9
37	S	35.3	Very low	32.3	Very low	115 Å²	115	138.5 Å²	138.5	80%	0.804	83%	0.83	S	S	*	*			trans	-102.1	109.3	165.9	59	0	0	0	0	110.2
38	G	29.9	Very low	32.3	Very low	74 Å²	74	141.3 Å²	141.3	76%	0.763	84%	0.835	S	S	*	*			trans	-73.6	151.1	170.8	0	0	0	0	0	111.7
39	I	33	Very low	32.5	Very low	155 Å²	155	142.7 Å²	142.7	80%	0.795	83%	0.832	S	S	*	*			trans	-124.7	111.1	162.9	-66.8	177.5	0	0	0	106.1	V41	I39-V41 HydrophobicContact CG2-CG2 4.31Å
40	E	33	Very low	32.4	Very low	189 Å²	189	146.1 Å²	146.1	88%	0.883	84%	0.835	S	S	*	*			trans	-77.9	140.8	170.5	-62.2	175.3	146.5	0	0	108.7
41	V	35.6	Very low	32.5	Very low	136 Å²	136	143.1 Å²	143.1	82%	0.824	83%	0.831	S	S	*	*			trans	-132.5	116.8	164.2	-171.8	0	0	0	0	106.7	I39	I39-V41 HydrophobicContact CG2-CG2 4.31Å
42	E	30.9	Very low	32.2	Very low	183 Å²	183	137.6 Å²	137.6	86%	0.855	83%	0.825	S	S	*	*			trans	-68.3	146.3	-172.3	-65.4	180	120.1	0	0	112.6
43	A	30.7	Very low	32.2	Very low	92 Å²	92	141.2 Å²	141.2	76%	0.76	82%	0.824	S	S	*	*			trans	-77.7	156.4	166.2	0	0	0	0	0	110.6
44	S	33.2	Very low	32.2	Very low	120 Å²	120	138 Å²	138	84%	0.839	82%	0.824	S	S	*	*			trans	-143	92.1	169	-71.3	0	0	0	0	109.8
45	D	31.5	Very low	32	Very low	154 Å²	154	133.2 Å²	133.2	82%	0.824	82%	0.82	S	S	*	*			trans	-72.9	131.2	165.5	-77.8	-41.2	0	0	0	109.9
46	L	31.4	Very low	31.8	Very low	172 Å²	172	130.7 Å²	130.7	90%	0.901	82%	0.819	S	S	*	*			trans	-136.4	103.9	156.7	-80.6	179.1	0	0	0	109.8
47	S	32.2	Very low	32.8	Very low	110 Å²	110	130.2 Å²	130.2	77%	0.769	81%	0.813	S	S	*	*			trans	-106.2	129.1	162.7	54.1	0	0	0	0	108.7
48	L	31.4	Very low	32.6	Very low	171 Å²	171	130.7 Å²	130.7	90%	0.895	81%	0.807	S	S	*	*			trans	-140.5	117.6	165.1	-79.7	-180	0	0	0	109.4
49	S	32.7	Very low	32.8	Very low	112 Å²	112	137.1 Å²	137.1	78%	0.783	81%	0.808	S	S	*	*			trans	-100.9	141	161.5	50.5	0	0	0	0	108.6
50	L	31.8	Very low	32.5	Very low	174 Å²	174	135.3 Å²	135.3	91%	0.911	80%	0.804	S	S	*	*			trans	-150.9	151.5	163.3	-103.9	173.8	0	0	0	110
51	T	33.4	Very low	32.5	Very low	134 Å²	134	130.9 Å²	130.9	82%	0.822	79%	0.794	S	S	*	*			trans	-120.7	148.4	-159.2	48.6	0	0	0	0	113.7
52	G	29.5	Very low	32.3	Very low	76 Å²	76	129.5 Å²	129.5	78%	0.784	79%	0.786	S	S	*	*			trans	82.1	163.1	156.5	0	0	0	0	0	116.8
53	D	31.7	Very low	32.4	Very low	160 Å²	160	127.6 Å²	127.6	86%	0.856	78%	0.777	S	S	*	*			cis	-163.4	164.4	-20.2	-165.2	15.8	0	0	0	109.5
54	D	32.2	Very low	32.4	Very low	156 Å²	156	128.4 Å²	128.4	83%	0.834	78%	0.778	S	S	*	*			trans	71.2	150.7	154.9	-149.9	8.4	0	0	0	121.4
55	G	28.9	Very low	32.4	Very low	69 Å²	69	132.9 Å²	132.9	71%	0.711	78%	0.776	S	S	*	*			trans	125.2	68	162.7	0	0	0	0	0	119.4
56	G	26.9	Very low	32.3	Very low	72 Å²	72	128.5 Å²	128.5	74%	0.742	77%	0.767	S	S	*	*			trans	-86.9	-163.9	153.2	0	0	0	0	0	112
57	P	53.3	Low	32.5	Very low	111 Å²	111	126 Å²	126	72%	0.721	76%	0.759	S	S	*	*			cis	-140.1	-167.8	-7.5	42.3	-23.9	0	0	0	114.8
58	N	31.9	Very low	32.5	Very low	125 Å²	125	126.9 Å²	126.9	67%	0.668	76%	0.755	S	S	*	*			trans	68.8	146.2	166.6	-69.3	-46.1	0	0	0	116.5
59	R	32.6	Very low	32.5	Very low	208 Å²	208	124.2 Å²	124.2	79%	0.785	75%	0.746	S	S	*	*			cis	-166.2	177.7	0.5	-106.1	165.1	-162	-166.4	-0.2	107.5
60	T	28.7	Very low	32.6	Very low	118 Å²	118	127.5 Å²	127.5	72%	0.724	75%	0.749	S	S	*	*			cis	-156.2	-180	15.1	-13.5	0	0	0	0	112.3
61	S	32.6	Very low	32.6	Very low	95 Å²	95	125 Å²	125	66%	0.664	75%	0.747	S	S	*	*			trans	-18.6	165.3	152.7	64	0	0	0	0	121.2
62	T	31.7	Very low	32.7	Very low	108 Å²	108	124.1 Å²	124.1	66%	0.663	75%	0.746	S	S	*	*			cis	-154.9	142.4	28	19	0	0	0	0	110
63	E	31.6	Very low	32.6	Very low	142 Å²	142	124.2 Å²	124.2	66%	0.664	75%	0.746	S	S	*	*				56	146.5	95.3	-56.8	-165.7	116.5	0	0	116.7	R65	E63-R65 IonicContact OE1-CZ 3.81Å; E63-R65 IonicContact OE1-NH1 2.71Å; E63-R65 PolarHBondContact OE1-NH1 2.71Å
64	S	31.4	Very low	32.9	Very low	110 Å²	110	125.5 Å²	125.5	77%	0.769	75%	0.747	S	S	*	*			cis	-132.3	166.7	15.1	61.6	0	0	0	0	112.7
65	R	32.8	Very low	32.9	Very low	214 Å²	214	126 Å²	126	81%	0.808	75%	0.75	S	S	*	*			cis	96.3	114.5	11.6	-170.5	-176.6	177.2	-175.3	-0.9	115.3	E63	E63-R65 IonicContact OE1-CZ 3.81Å; E63-R65 IonicContact OE1-NH1 2.71Å; E63-R65 PolarHBondContact OE1-NH1 2.71Å
66	G	29.9	Very low	33.5	Very low	61 Å²	61	131.9 Å²	131.9	63%	0.629	76%	0.756	S	S	*	*			trans	150.8	91.1	179.5	0	0	0	0	0	111.7
67	T	34.8	Very low	33.7	Very low	121 Å²	121	136.5 Å²	136.5	74%	0.742	76%	0.764	S	S	*	*				74.9	143.8	74.7	73.4	0	0	0	0	113.1
68	D	31.9	Very low	32.8	Very low	128 Å²	128	135.6 Å²	135.6	68%	0.684	76%	0.76	S	S	*	*			cis	-153.1	160.4	31.8	-83.2	-73.1	0	0	0	114.8
69	T	32.6	Very low	32.7	Very low	115 Å²	115	136.8 Å²	136.8	71%	0.706	77%	0.766	S	S	*	*			trans	31	155.3	145	61.7	0	0	0	0	123.1
70	E	34.9	Very low	32.8	Very low	180 Å²	180	132.1 Å²	132.1	84%	0.841	77%	0.766	S	S	*	*			cis	-167.3	163.3	-9.6	-114.3	177.2	-165.8	0	0	109.1
71	S	30.4	Very low	33.1	Very low	123 Å²	123	135.7 Å²	135.7	86%	0.86	78%	0.776	S	S	*	*			trans	144.2	141.8	139.2	-167.8	0	0	0	0	113.7
72	S	35.2	Very low	33	Very low	115 Å²	115	140.5 Å²	140.5	80%	0.804	79%	0.788	S	S	*	*			trans	-93.1	157	-167.7	52.2	0	0	0	0	115.2
73	G	28.7	Very low	32.8	Very low	77 Å²	77	142.7 Å²	142.7	79%	0.794	80%	0.796	S	S	*	*			trans	-165.1	107.8	158.7	0	0	0	0	0	109.7
74	E	38.1	Very low	32.8	Very low	187 Å²	187	142.1 Å²	142.1	87%	0.874	80%	0.802	S	S	*	*			trans	-77.1	153.3	166.8	-60.5	-178.3	129.5	0	0	109
75	D	32.3	Very low	32.7	Very low	166 Å²	166	139.3 Å²	139.3	89%	0.888	79%	0.791	S	S	*	*			trans	-165.8	147.5	131.6	-94.4	-33.3	0	0	0	110.4
76	K	40.6	Very low	32.4	Very low	193 Å²	193	138.6 Å²	138.6	84%	0.839	80%	0.796	S	S	*	*			trans	-101.5	154.3	169.7	-62.5	170.6	-179.4	169.4	0	107.5
77	D	30.9	Very low	32.4	Very low	170 Å²	170	146 Å²	146	91%	0.909	81%	0.807	S	S	*	*			trans	-152.6	144.7	145.6	-94.2	-35.5	0	0	0	111.7
78	S	34.5	Very low	32	Very low	92 Å²	92	146.1 Å²	146.1	64%	0.643	81%	0.812	S	S	*	*			trans	-96.9	164.5	159.5	50.2	0	0	0	0	108.8
79	D	31	Very low	31.9	Very low	150 Å²	150	147.3 Å²	147.3	80%	0.802	82%	0.817	S	S	*	*				176	158.2	115.8	-88.7	-0.8	0	0	0	113.8
80	S	34.4	Very low	31.5	Very low	110 Å²	110	149.3 Å²	149.3	77%	0.769	82%	0.823	S	S	*	*			trans	-81.2	158.1	175.6	48	0	0	0	0	112.7
81	M	34	Very low	31	Very low	192 Å²	192	148.1 Å²	148.1	95%	0.946	82%	0.823	S	S	*	*			trans	-129.1	114.5	163.6	-78.2	-172.4	167.1	0	0	111.9
82	E	31.7	Very low	30.8	Very low	196 Å²	196	150.4 Å²	150.4	92%	0.916	82%	0.82	S	S	*	*			trans	-112.8	141.6	142.3	-66.3	-177	149.1	0	0	106.2
83	D	27.8	Very low	30.4	Very low	155 Å²	155	151.1 Å²	151.1	83%	0.829	81%	0.814	S	S	*	*				-177.4	160	124.4	-157.9	5.5	0	0	0	111.2
84	T	31.7	Very low	30.4	Very low	130 Å²	130	159.6 Å²	159.6	80%	0.798	82%	0.823	S	S	*	*			trans	-94.2	172.1	178.5	45.7	0	0	0	0	113.5
85	G	28.5	Very low	29.9	Very low	51 Å²	51	155.8 Å²	155.8	53%	0.526	81%	0.812	S	S	.	*			trans	135.1	93.3	169.2	0	0	0	0	0	112.7
86	H	27.5	Very low	29.8	Very low	198 Å²	198	156.1 Å²	156.1	92%	0.917	81%	0.808	S	S	*	*				49.3	105.6	86.9	-76.2	-80.5	0	0	0	115.3
87	Y	28.1	Very low	29.1	Very low	218 Å²	218	152.1 Å²	152.1	86%	0.855	80%	0.795	S	S	*	*			trans	-118.3	126	164.6	-84.5	-87.1	0	0	0	110.4
88	S	27.8	Very low	28.9	Very low	122 Å²	122	153.7 Å²	153.7	85%	0.853	79%	0.789	S	S	*	*			trans	-108	141.1	161.3	-64.1	0	0	0	0	108.3
89	I	28.4	Very low	28.5	Very low	154 Å²	154	154.7 Å²	154.7	79%	0.79	80%	0.795	S	S	*	*			trans	-107.5	130.1	179	-65	174.4	0	0	0	108.6
90	N	24.1	Very low	28.3	Very low	157 Å²	157	155.5 Å²	155.5	84%	0.84	79%	0.794	S	S	*	*			trans	-104.5	141.9	163.4	-93.5	15.4	0	0	0	109.3
91	D	26.2	Very low	28	Very low	155 Å²	155	158.5 Å²	158.5	83%	0.829	80%	0.796	S	S	*	*			trans	-68.2	156	166.1	-79.4	-62.3	0	0	0	112.6
92	E	26.2	Very low	27.6	Very low	171 Å²	171	158 Å²	158	80%	0.799	79%	0.791	S	S	*	*				-173.6	121.2	117.2	-99.8	-161.9	149.1	0	0	114.7
93	N	27	Very low	27.2	Very low	129 Å²	129	158.3 Å²	158.3	69%	0.69	79%	0.793	S	S	*	*			trans	51.7	126.1	133.7	-69.5	-35.8	0	0	0	124.4
94	R	26.8	Very low	27.2	Very low	256 Å²	256	159.7 Å²	159.7	97%	0.966	80%	0.795	S	S	*	*			trans	-152.5	151.5	134.9	-119.8	175	176.2	176.2	-1.1	111.9
95	V	28.7	Very low	27	Very low	107 Å²	107	162 Å²	162	65%	0.648	80%	0.796	S	S	*	*			trans	-130.5	165.1	-149	-169.6	0	0	0	0	114
96	H	29.8	Very low	26.9	Very low	172 Å²	172	168.6 Å²	168.6	80%	0.796	81%	0.813	S	S	*	*			trans	97.6	143	164.6	-59.8	-62.9	0	0	0	117.5
97	D	25.8	Very low	27	Very low	109 Å²	109	168 Å²	168	58%	0.583	81%	0.811	S	S	*	*			cis	-150.7	151.4	13.1	-158.7	17.7	0	0	0	114.6
98	R	27.1	Very low	27.2	Very low	204 Å²	204	165.9 Å²	165.9	77%	0.77	81%	0.809	S	S	*	*			trans	49.7	151.1	156.8	-82.7	166.6	171	142.2	-9.3	122.6
99	S	25.8	Very low	27.2	Very low	112 Å²	112	169.7 Å²	169.7	78%	0.783	81%	0.813	S	S	*	*			cis	-143.7	166.6	23.7	56.4	0	0	0	0	115.6
100	E	26.9	Very low	27.4	Very low	167 Å²	167	170.7 Å²	170.7	78%	0.78	82%	0.815	S	S	*	*			trans	-64.4	164.2	173.7	-66.5	139.2	175.1	0	0	112.2
101	E	27.3	Very low	28	Very low	173 Å²	173	171.6 Å²	171.6	81%	0.808	81%	0.814	S	S	*	*				-157.7	149	63.2	-79.9	167.6	173.3	0	0	114.9
102	E	26.8	Very low	28.3	Very low	181 Å²	181	170.4 Å²	170.4	85%	0.846	80%	0.803	S	S	*	*			trans	57.8	106.7	148.3	-63.8	179.3	-171.8	0	0	123.3
103	E	23.6	Very low	28.7	Very low	203 Å²	203	170 Å²	170	95%	0.949	80%	0.801	S	S	*	*			trans	-140.5	136.2	138.8	-75.1	-167.3	162.1	0	0	109.5
104	E	28	Very low	29	Very low	185 Å²	185	168.2 Å²	168.2	86%	0.864	80%	0.797	S	S	*	*			trans	-111.5	138.9	167.7	-79.8	-174.2	159.2	0	0	110
105	E	26.8	Very low	29.4	Very low	177 Å²	177	165.9 Å²	165.9	83%	0.827	79%	0.788	S	S	*	*			trans	28.7	130.5	148.1	-49.1	-173.2	167.4	0	0	119.4
106	E	26.8	Very low	29.8	Very low	190 Å²	190	168.3 Å²	168.3	89%	0.888	79%	0.786	S	S	*	*				-165.8	-179	72.1	-90.7	-171.4	165.7	0	0	113.3
107	E	28.4	Very low	30	Very low	187 Å²	187	169.3 Å²	169.3	87%	0.874	78%	0.783	S	S	*	*			trans	-90.3	168.7	-156.7	-59.7	-179.8	139.3	0	0	117.9
108	E	32.4	Very low	30.5	Very low	173 Å²	173	168.4 Å²	168.4	81%	0.808	78%	0.781	S	S	*	*			trans	-1.8	126.9	158.2	-55.4	-177.4	165	0	0	121.2
109	E	28.5	Very low	30.9	Very low	202 Å²	202	165 Å²	165	94%	0.944	77%	0.774	S	S	*	*				-140	140.6	130	-85.8	-157.2	157	0	0	111
110	E	32.9	Very low	31.4	Very low	175 Å²	175	168.9 Å²	168.9	82%	0.818	77%	0.771	S	S	*	*			trans	-96.4	167.9	-163.8	-89.3	-164.1	135.8	0	0	116.7
111	E	35.6	Very low	31.8	Very low	175 Å²	175	169 Å²	169	82%	0.818	77%	0.769	S	S	*	*	S	Bend	trans	56.4	57	148.6	-67	-141.3	139.4	0	0	122.5
112	E	33.4	Very low	32.1	Very low	131 Å²	131	169 Å²	169	61%	0.612	76%	0.762	S	S	*	*	S	Bend	trans	-136	-21.3	149.1	-95.2	-134.3	158.9	0	0	116	R116	E112-R116 IonicContact OE2-CZ 2.74Å; E112-R116 IonicContact OE2-NE 2.67Å; E112-R116 IonicContact OE2-NH2 2.86Å; E112-R116 PolarHBondContact OE2-NH2 3.4Å
113	Q	33.7	Very low	32.6	Very low	161 Å²	161	162.6 Å²	162.6	75%	0.752	74%	0.739	S	S	*	*	H	α-helix	trans	-76.3	-29.6	-166.4	-59.1	-159.7	21.3	0	0	118.2	R115 R116 R117	Q113-R115 PolarHBondContact O-N 3.37Å; Q113-R116 PolarHBondContact O-N 3.15Å; Q113-R117 PolarHBondContact O-N 2.7Å; Q113-R117 VanDerWaalsContact O-N 3.14Å
114	P	34.3	Very low	33.2	Very low	93 Å²	93	157.9 Å²	157.9	60%	0.604	72%	0.721	S	S	*	*	H	α-helix	trans	-69	-34.8	-173.1	25.2	-32	0	0	0	112.7	R117 V118	P114-R117 PolarHBondContact O-N 3.39Å; P114-V118 WeakPolarHBondContact O-CG2 3.23Å; P114-V118 PolarHBondContact O-N 3.16Å
115	R	34.7	Very low	33.7	Very low	206 Å²	206	158.5 Å²	158.5	78%	0.777	72%	0.715	S	S	*	*	H	α-helix	trans	-66.1	-43.2	178.1	-72.4	-176.2	175.3	177.1	1.4	112.2	Q113 R117 V118 Q119	Q113-R115 PolarHBondContact O-N 3.37Å; R115-R117 VanDerWaalsContact C-N 3.34Å; R115-R117 PolarHBondContact O-N 3.24Å; R115-V118 PolarHBondContact O-N 2.81Å; R115-Q119 WeakPolarHBondContact O-CB 3.28Å; R115-Q119 WeakPolarHBondContact O-CG 3.45Å; R115-Q119 PolarHBondContact O-N 3.17Å
116	R	36.7	Very low	34.4	Very low	158 Å²	158	154.9 Å²	154.9	60%	0.596	70%	0.701	S	S	*	*	H	α-helix	trans	-67.6	-32	176.5	-65	-170.9	-169.8	-168.9	7.6	112.6	E112 Q113 R120	E112-R116 IonicContact OE2-CZ 2.74Å; E112-R116 IonicContact OE2-NE 2.67Å; E112-R116 IonicContact OE2-NH2 2.86Å; E112-R116 PolarHBondContact OE2-NH2 3.4Å; Q113-R116 PolarHBondContact O-N 3.15Å; R116-R120 WeakPolarHBondContact O-CB 3.38Å; R116-R120 PolarHBondContact O-N 2.84Å
117	R	34.2	Very low	35.2	Very low	194 Å²	194	151.8 Å²	151.8	73%	0.732	69%	0.687	S	S	*	*	H	α-helix	trans	-73.8	-37.4	177.8	-147.4	172.4	-172.3	-178.8	2.3	112.2	Q113 P114 R115 K121	Q113-R117 PolarHBondContact O-N 2.7Å; Q113-R117 VanDerWaalsContact O-N 3.14Å; P114-R117 PolarHBondContact O-N 3.39Å; R115-R117 VanDerWaalsContact C-N 3.34Å; R115-R117 PolarHBondContact O-N 3.24Å; R117-K121 PolarHBondContact O-N 3.16Å
118	V	36	Very low	36.3	Very low	90 Å²	90	148 Å²	148	55%	0.545	67%	0.673	S	S	.	*	H	α-helix	trans	-70.4	-40.9	171.4	174.3	0	0	0	0	111.5	P114 R115 K121 R122	P114-V118 WeakPolarHBondContact O-CG2 3.23Å; P114-V118 PolarHBondContact O-N 3.16Å; R115-V118 PolarHBondContact O-N 2.81Å; V118-K121 PolarHBondContact O-N 3.47Å; V118-R122 PolarHBondContact O-N 3.33Å
119	Q	36.8	Very low	37.5	Very low	132 Å²	132	143.2 Å²	143.2	62%	0.617	66%	0.658	S	S	*	*	H	α-helix	trans	-65.2	-38.6	174	-77.9	176.5	-17.9	0	0	112.6	R115 R122 A123	R115-Q119 WeakPolarHBondContact O-CB 3.28Å; R115-Q119 WeakPolarHBondContact O-CG 3.45Å; R115-Q119 PolarHBondContact O-N 3.17Å; Q119-R122 PolarHBondContact O-N 2.99Å; Q119-A123 VanDerWaalsContact O-CB 3.25Å; Q119-A123 WeakPolarHBondContact O-CB 3.31Å; Q119-A123 PolarHBondContact O-N 2.78Å
120	R	34.9	Very low	38.9	Very low	193 Å²	193	136 Å²	136	73%	0.728	63%	0.63	S	S	*	*	H	α-helix	trans	-66.6	-38.4	171.7	-87.8	179.3	154.3	175.2	-7.5	112.9	R116 N124	R116-R120 WeakPolarHBondContact O-CB 3.38Å; R116-R120 PolarHBondContact O-N 2.84Å; R120-N124 WeakPolarHBondContact O-CB 3.46Å; R120-N124 PolarHBondContact O-N 3Å; R120-N124 PolarHBondContact O-OD1 3.24Å
121	K	35.2	Very low	40.4	Very low	169 Å²	169	131.9 Å²	131.9	74%	0.735	61%	0.614	S	S	*	*	H	α-helix	trans	-66.4	-35.7	173.2	-92.2	-168.8	171.2	-173.2	0	112.8	R117 V118 R125	R117-K121 PolarHBondContact O-N 3.16Å; V118-K121 PolarHBondContact O-N 3.47Å; K121-R125 VanDerWaalsContact O-CB 3.29Å; K121-R125 WeakPolarHBondContact O-CB 3.4Å; K121-R125 PolarHBondContact O-N 3.45Å
122	R	35	Very low	41.9	Very low	175 Å²	175	127.7 Å²	127.7	66%	0.66	60%	0.597	S	S	*	*	H	α-helix	trans	-66.4	-57	169.7	-85.6	-174.2	169.9	173.9	-3.4	110.9	V118 Q119 N124 R125 D126	V118-R122 PolarHBondContact O-N 3.33Å; Q119-R122 PolarHBondContact O-N 2.99Å; R122-N124 VanDerWaalsContact C-N 3.32Å; R122-N124 PolarHBondContact O-N 3.45Å; R122-R125 CarbonylContact O-C 3.57Å; R122-R125 WeakPolarHBondContact O-CA 3.21Å; R122-R125 WeakPolarHBondContact O-CB 3.44Å; R122-R125 PolarHBondContact O-N 2.83Å; R122-D126 VanDerWaalsContact C-OD2 3.28Å; R122-D126 WeakPolarHBondContact O-CB 3.47Å; R122-D126 PolarHBondContact O-N 3.06Å; R122-D126 VanDerWaalsContact O-OD2 3.09Å
123	A	37	Very low	43.6	Very low	45 Å²	45	125.9 Å²	125.9	37%	0.372	59%	0.589	S	S	.	*	H	α-helix	trans	-53.8	-44.3	-179	0	0	0	0	0	113	Q119 D126 Q127	Q119-A123 VanDerWaalsContact O-CB 3.25Å; Q119-A123 WeakPolarHBondContact O-CB 3.31Å; Q119-A123 PolarHBondContact O-N 2.78Å; A123-D126 PolarHBondContact O-N 3.3Å; A123-Q127 VanDerWaalsContact O-CB 3.26Å; A123-Q127 WeakPolarHBondContact O-CB 3.26Å; A123-Q127 PolarHBondContact O-N 3.31Å
124	N	36.6	Very low	45.4	Very low	105 Å²	105	125.8 Å²	125.8	56%	0.561	58%	0.581	S	S	*	*	H	α-helix	trans	-64	-42.1	174.8	-76.8	26.9	0	0	0	112.3	R120 R122 Q127 D128	R120-N124 WeakPolarHBondContact O-CB 3.46Å; R120-N124 PolarHBondContact O-N 3Å; R120-N124 PolarHBondContact O-OD1 3.24Å; R122-N124 VanDerWaalsContact C-N 3.32Å; R122-N124 PolarHBondContact O-N 3.45Å; N124-Q127 PolarHBondContact O-N 3.45Å; N124-D128 WeakPolarHBondContact O-CB 3.33Å; N124-D128 PolarHBondContact O-N 3.24Å
125	R	37.9	Very low	47.3	Very low	197 Å²	197	124 Å²	124	74%	0.743	57%	0.574	S	S	*	*	H	α-helix	trans	-67.2	-35.5	177	-178.9	176.8	174.2	175.4	-0.9	112.5	K121 R122 S129	K121-R125 VanDerWaalsContact O-CB 3.29Å; K121-R125 WeakPolarHBondContact O-CB 3.4Å; K121-R125 PolarHBondContact O-N 3.45Å; R122-R125 CarbonylContact O-C 3.57Å; R122-R125 WeakPolarHBondContact O-CA 3.21Å; R122-R125 WeakPolarHBondContact O-CB 3.44Å; R122-R125 PolarHBondContact O-N 2.83Å; R125-S129 WeakPolarHBondContact O-CB 3.47Å; R125-S129 PolarHBondContact O-N 3.42Å
126	D	41.1	Very low	49	Very low	101 Å²	101	115 Å²	115	54%	0.54	54%	0.541	S	S	.	.	H	α-helix	trans	-71.7	-35.1	176.3	-58.1	-32.6	0	0	0	110.4	R122 A123 S130	R122-D126 VanDerWaalsContact C-OD2 3.28Å; R122-D126 WeakPolarHBondContact O-CB 3.47Å; R122-D126 PolarHBondContact O-N 3.06Å; R122-D126 VanDerWaalsContact O-OD2 3.09Å; A123-D126 PolarHBondContact O-N 3.3Å; D126-S130 WeakPolarHBondContact O-CB 3.47Å; D126-S130 PolarHBondContact O-N 3.07Å; D126-S130 VanDerWaalsContact O-N 3.13Å
127	Q	43.1	Very low	50.9	Low	125 Å²	125	112 Å²	112	58%	0.584	53%	0.534	S	S	*	.	H	α-helix	trans	-69.1	-52.8	174.4	-154.4	90.9	49.4	0	0	111.2	A123 N124 S129 S130 D131	A123-Q127 VanDerWaalsContact O-CB 3.26Å; A123-Q127 WeakPolarHBondContact O-CB 3.26Å; A123-Q127 PolarHBondContact O-N 3.31Å; N124-Q127 PolarHBondContact O-N 3.45Å; Q127-S129 VanDerWaalsContact C-N 3.32Å; Q127-S129 PolarHBondContact O-N 3.2Å; Q127-S130 PolarHBondContact O-N 3.45Å; Q127-S130 PolarHBondContact O-OG 2.91Å; Q127-D131 PolarHBondContact O-N 3.49Å; Q127-D131 VanDerWaalsContact O-N 3.11Å
128	D	52.1	Low	52.9	Low	108 Å²	108	108 Å²	108	58%	0.578	53%	0.527	S	S	*	.	H	α-helix	trans	-56.2	-46.5	175.5	-75.7	-28.9	0	0	0	110.3	N124 S130 D131 D132	N124-D128 WeakPolarHBondContact O-CB 3.33Å; N124-D128 PolarHBondContact O-N 3.24Å; D128-S130 PolarHBondContact O-N 2.95Å; D128-D131 PolarHBondContact O-N 3.49Å; D128-D132 WeakPolarHBondContact O-CB 3.17Å; D128-D132 PolarHBondContact O-N 3.18Å
129	S	56.8	Low	54.9	Low	72 Å²	72	106.1 Å²	106.1	50%	0.503	51%	0.51	S	S	.	.	H	α-helix	trans	-59.3	-31.5	176.1	-175.1	0	0	0	0	113.4	R125 Q127 E133	R125-S129 WeakPolarHBondContact O-CB 3.47Å; R125-S129 PolarHBondContact O-N 3.42Å; Q127-S129 VanDerWaalsContact C-N 3.32Å; Q127-S129 PolarHBondContact O-N 3.2Å; S129-E133 WeakPolarHBondContact O-CB 3.37Å; S129-E133 PolarHBondContact O-N 3.37Å; S129-E133 VanDerWaalsContact O-N 3.08Å
130	S	59.4	Low	56.6	Low	50 Å²	50	100 Å²	100	35%	0.35	48%	0.482	S	S	.	.	H	α-helix	trans	-78.1	-33.2	179.4	76.4	0	0	0	0	113	D126 Q127 D128 R134	D126-S130 WeakPolarHBondContact O-CB 3.47Å; D126-S130 PolarHBondContact O-N 3.07Å; D126-S130 VanDerWaalsContact O-N 3.13Å; Q127-S130 PolarHBondContact O-N 3.45Å; Q127-S130 PolarHBondContact O-OG 2.91Å; D128-S130 PolarHBondContact O-N 2.95Å; S130-R134 WeakPolarHBondContact O-CB 3.42Å; S130-R134 PolarHBondContact O-N 2.81Å
131	D	64.8	Low	58.6	Low	90 Å²	90	93.2 Å²	93.2	48%	0.481	46%	0.464	S	S	.	.	H	α-helix	trans	-77.8	-34.7	174.3	-77.5	-26.4	0	0	0	111.2	Q127 D128 R134 A135	Q127-D131 PolarHBondContact O-N 3.49Å; Q127-D131 VanDerWaalsContact O-N 3.11Å; D128-D131 PolarHBondContact O-N 3.49Å; D131-R134 PolarHBondContact O-N 3.25Å; D131-A135 WeakPolarHBondContact O-CB 3.41Å; D131-A135 PolarHBondContact O-N 3.2Å
132	D	65.3	Low	60.5	Low	87 Å²	87	88.2 Å²	88.2	47%	0.465	45%	0.45	S	S	.	.	H	α-helix	trans	-63.3	-38.6	170.3	-108.6	-49.1	0	0	0	112.8	D128 L136 K526	D128-D132 WeakPolarHBondContact O-CB 3.17Å; D128-D132 PolarHBondContact O-N 3.18Å; D132-L136 WeakPolarHBondContact O-CB 3.38Å; D132-L136 PolarHBondContact O-N 3.2Å; D132-K526 IonicContact OD1-NZ 2.8Å; D132-K526 PolarHBondContact OD1-NZ 3.07Å
133	E	68.9	Low	62.3	Low	93 Å²	93	81 Å²	81	44%	0.435	42%	0.424	S	S	.	.	H	α-helix	trans	-69.5	-41.1	174.4	-179.1	158.3	-144.6	0	0	111.5	S129 L136 E137 K523	S129-E133 WeakPolarHBondContact O-CB 3.37Å; S129-E133 PolarHBondContact O-N 3.37Å; S129-E133 VanDerWaalsContact O-N 3.08Å; E133-L136 WeakPolarHBondContact O-CB 3.41Å; E133-L136 PolarHBondContact O-N 3.14Å; E133-E137 WeakPolarHBondContact O-CG 3.34Å; E133-E137 PolarHBondContact O-N 2.97Å; E133-K523 IonicContact OE1-NZ 2.7Å; E133-K523 PolarHBondContact OE1-NZ 3.29Å
134	R	73.3	Confident	64	Low	159 Å²	159	81 Å²	81	60%	0.6	42%	0.42	S	S	*	.	H	α-helix	trans	-61.7	-46.8	173.9	-172.3	-169.7	-59.9	-105	-2.9	111.8	S130 D131 L136 E137 D138	S130-R134 WeakPolarHBondContact O-CB 3.42Å; S130-R134 PolarHBondContact O-N 2.81Å; D131-R134 PolarHBondContact O-N 3.25Å; R134-L136 VanDerWaalsContact C-N 3.26Å; R134-L136 PolarHBondContact O-N 3.24Å; R134-E137 PolarHBondContact O-N 2.66Å; R134-E137 VanDerWaalsContact O-N 3.13Å; R134-D138 PolarHBondContact O-N 2.89Å
135	A	73.6	Confident	65.9	Low	55 Å²	55	78.9 Å²	78.9	46%	0.455	41%	0.413	S	S	.	.	H	α-helix	trans	-62.7	-34.5	177.5	0	0	0	0	0	112.3	D131 W139	D131-A135 WeakPolarHBondContact O-CB 3.41Å; D131-A135 PolarHBondContact O-N 3.2Å; A135-W139 VanDerWaalsContact O-CB 3.25Å; A135-W139 WeakPolarHBondContact O-CB 3.44Å; A135-W139 PolarHBondContact O-N 2.85Å
136	L	69.9	Low	67.6	Low	17 Å²	17	74.5 Å²	74.5	9%	0.089	42%	0.419	C	S	.	.	H	α-helix	trans	-67.7	-40.3	172.6	174.2	58.4	0	0	0	112	D132 E133 R134 W139 V140 I522 K523 K526	D132-L136 WeakPolarHBondContact O-CB 3.38Å; D132-L136 PolarHBondContact O-N 3.2Å; E133-L136 WeakPolarHBondContact O-CB 3.41Å; E133-L136 PolarHBondContact O-N 3.14Å; R134-L136 VanDerWaalsContact C-N 3.26Å; R134-L136 PolarHBondContact O-N 3.24Å; L136-W139 HydrophobicContact CD1-CE3 3.66Å; L136-W139 HydrophobicContact CD1-CZ3 3.72Å; L136-V140 HydrophobicContact CD1-CG2 4.1Å; L136-V140 VanDerWaalsContact O-CB 3.31Å; L136-V140 WeakPolarHBondContact O-CB 3.43Å; L136-V140 WeakPolarHBondContact O-CG2 3.41Å; L136-V140 PolarHBondContact O-N 3.1Å; L136-I522 HydrophobicContact CD1-CG2 4.44Å; L136-K523 HydrophobicContact CD2-CB 4.2Å; L136-K523 HydrophobicContact CD2-CD 4.34Å; L136-K523 HydrophobicContact CD2-CG 3.73Å; L136-K523 HydrophobicContact CG-CG 4.02Å; L136-K526 HydrophobicContact CD1-CB 4.38Å; L136-K526 HydrophobicContact CD1-CD 3.85Å; L136-K526 HydrophobicContact CD2-CD 4.04Å; L136-K526 HydrophobicContact CG-CD 4.36Å
137	E	75.9	Confident	69.4	Low	96 Å²	96	71.4 Å²	71.4	45%	0.449	40%	0.403	S	S	.	.	H	α-helix	trans	-69.3	-41.1	175.2	-73	-166.7	164.7	0	0	113.3	E133 R134 S141 K523	E133-E137 WeakPolarHBondContact O-CG 3.34Å; E133-E137 PolarHBondContact O-N 2.97Å; R134-E137 PolarHBondContact O-N 2.66Å; R134-E137 VanDerWaalsContact O-N 3.13Å; E137-S141 WeakPolarHBondContact O-CB 3.34Å; E137-S141 PolarHBondContact O-N 3.48Å; E137-S141 PolarHBondContact O-OG 2.82Å; E137-K523 IonicContact OE1-NZ 3.69Å; E137-K523 PolarHBondContact OE1-NZ 2.73Å
138	D	77.6	Confident	71.2	Confident	109 Å²	109	70.3 Å²	70.3	58%	0.583	41%	0.406	S	S	*	.	H	α-helix	trans	-63.1	-45.2	174.1	-77.1	-24.2	0	0	0	110.6	R134 S141 S142	R134-D138 PolarHBondContact O-N 2.89Å; D138-S141 PolarHBondContact O-N 2.88Å; D138-S142 PolarHBondContact O-N 2.83Å
139	W	76.6	Confident	72.4	Confident	50 Å²	50	76.5 Å²	76.5	19%	0.189	42%	0.421	C	S	.	.	H	α-helix	trans	-61.4	-53.4	174.9	168.7	51.6	0	0	0	111.8	A135 L136 S141 S142 E143 K429 I522	A135-W139 VanDerWaalsContact O-CB 3.25Å; A135-W139 WeakPolarHBondContact O-CB 3.44Å; A135-W139 PolarHBondContact O-N 2.85Å; L136-W139 HydrophobicContact CD1-CE3 3.66Å; L136-W139 HydrophobicContact CD1-CZ3 3.72Å; W139-S141 PolarHBondContact O-N 3.08Å; W139-S142 WeakPolarHBondContact O-CA 3.27Å; W139-S142 WeakPolarHBondContact O-CB 3.22Å; W139-S142 PolarHBondContact O-N 2.84Å; W139-S142 PolarHBondContact O-OG 2.74Å; W139-E143 HydrophobicContact CZ2-CG 4.06Å; W139-E143 PolarHBondContact NE1-OE1 3.23Å; W139-E143 WeakPolarHBondContact O-CG 3.26Å; W139-E143 PolarHBondContact O-N 2.81Å; W139-K429 HydrophobicContact CH2-CB 4.05Å; W139-K429 HydrophobicContact CZ2-CB 3.35Å; W139-K429 HydrophobicContact CZ2-CD 3.95Å; W139-K429 HydrophobicContact CZ2-CG 4.31Å; W139-I522 HydrophobicContact CE3-CG2 4.35Å; W139-I522 HydrophobicContact CH2-CG2 3.31Å; W139-I522 HydrophobicContact CZ2-CG2 4.43Å; W139-I522 HydrophobicContact CZ3-CG2 3.27Å
140	V	74.4	Confident	73.6	Confident	3 Å²	3	75.3 Å²	75.3	2%	0.018	41%	0.412	C	S	.	.	H	α-helix	trans	-58.7	-36	178.4	167.9	0	0	0	0	111.7	L136 E143 T144 K519 I522	L136-V140 HydrophobicContact CD1-CG2 4.1Å; L136-V140 VanDerWaalsContact O-CB 3.31Å; L136-V140 WeakPolarHBondContact O-CB 3.43Å; L136-V140 WeakPolarHBondContact O-CG2 3.41Å; L136-V140 PolarHBondContact O-N 3.1Å; V140-E143 PolarHBondContact O-N 3.05Å; V140-T144 WeakPolarHBondContact O-CB 3.43Å; V140-T144 WeakPolarHBondContact O-CG2 3.3Å; V140-T144 PolarHBondContact O-N 2.97Å; V140-T144 PolarHBondContact O-OG1 3.35Å; V140-K519 HydrophobicContact CG1-CB 3.99Å; V140-K519 HydrophobicContact CG1-CD 3.66Å; V140-K519 HydrophobicContact CG1-CG 3.52Å; V140-I522 HydrophobicContact CG2-CB 4.29Å; V140-I522 HydrophobicContact CG2-CG2 3.65Å
141	S	75.8	Confident	74.6	Confident	52 Å²	52	84.5 Å²	84.5	36%	0.364	44%	0.439	S	S	.	.	H	α-helix	trans	-72.6	-31.1	176.7	-58.1	0	0	0	0	112.6	E137 D138 W139 S145 K519	E137-S141 WeakPolarHBondContact O-CB 3.34Å; E137-S141 PolarHBondContact O-N 3.48Å; E137-S141 PolarHBondContact O-OG 2.82Å; D138-S141 PolarHBondContact O-N 2.88Å; W139-S141 PolarHBondContact O-N 3.08Å; S141-S145 PolarHBondContact O-N 2.71Å; S141-S145 VanDerWaalsContact O-N 3.14Å; S141-K519 PolarHBondContact OG-NZ 2.94Å
142	S	75.6	Confident	75.7	Confident	63 Å²	63	82.3 Å²	82.3	44%	0.441	42%	0.424	S	S	.	.	H	α-helix	trans	-67.1	-45.3	170.5	76.9	0	0	0	0	112	D138 W139 T144 S145 Q468	D138-S142 PolarHBondContact O-N 2.83Å; W139-S142 WeakPolarHBondContact O-CA 3.27Å; W139-S142 WeakPolarHBondContact O-CB 3.22Å; W139-S142 PolarHBondContact O-N 2.84Å; W139-S142 PolarHBondContact O-OG 2.74Å; S142-T144 VanDerWaalsContact C-N 3.29Å; S142-T144 PolarHBondContact O-N 2.99Å; S142-S145 WeakPolarHBondContact O-CB 3.44Å; S142-S145 PolarHBondContact O-N 3.13Å; S142-S145 PolarHBondContact O-OG 3.15Å; S142-Q468 PolarHBondContact O-NE2 3.22Å; S142-Q468 VanDerWaalsContact O-NE2 3.17Å
143	E	72.8	Confident	76.8	Confident	23 Å²	23	84 Å²	84	11%	0.107	43%	0.429	C	S	.	.	H	α-helix	trans	-65.1	-30.5	178.5	-64.3	-67.4	-178.8	0	0	112.7	W139 V140 Q468	W139-E143 HydrophobicContact CZ2-CG 4.06Å; W139-E143 PolarHBondContact NE1-OE1 3.23Å; W139-E143 WeakPolarHBondContact O-CG 3.26Å; W139-E143 PolarHBondContact O-N 2.81Å; V140-E143 PolarHBondContact O-N 3.05Å; E143-Q468 WeakPolarHBondContact O-CB 3.45Å; E143-Q468 WeakPolarHBondContact O-CG 3.45Å; E143-Q468 PolarHBondContact O-NE2 2.97Å
144	T	71.6	Confident	77.7	Confident	47 Å²	47	82.1 Å²	82.1	29%	0.288	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	8	179.5	55.1	0	0	0	0	114.1	V140 S142 L515 L518	V140-T144 WeakPolarHBondContact O-CB 3.43Å; V140-T144 WeakPolarHBondContact O-CG2 3.3Å; V140-T144 PolarHBondContact O-N 2.97Å; V140-T144 PolarHBondContact O-OG1 3.35Å; S142-T144 VanDerWaalsContact C-N 3.29Å; S142-T144 PolarHBondContact O-N 2.99Å; T144-L515 HydrophobicContact CG2-CD1 4.46Å; T144-L518 HydrophobicContact CG2-CD2 3.97Å
145	S	77	Confident	78.5	Confident	59 Å²	59	81.3 Å²	81.3	41%	0.413	44%	0.436	S	S	.	.	S	Bend	trans	-65.1	149.7	179.4	68.6	0	0	0	0	112.8	S141 S142 L147 Q468	S141-S145 PolarHBondContact O-N 2.71Å; S141-S145 VanDerWaalsContact O-N 3.14Å; S142-S145 WeakPolarHBondContact O-CB 3.44Å; S142-S145 PolarHBondContact O-N 3.13Å; S142-S145 PolarHBondContact O-OG 3.15Å; S145-L147 PolarHBondContact O-N 3.35Å; S145-L147 VanDerWaalsContact O-N 3.1Å; S145-Q468 PolarHBondContact O-NE2 3.3Å; S145-Q468 PolarHBondContact OG-NE2 3.06Å
146	A	74.6	Confident	79.3	Confident	105 Å²	105	81.4 Å²	81.4	87%	0.868	43%	0.432	S	S	*	.			trans	-66	110.6	-168.1	0	0	0	0	0	113.4
147	L	77.6	Confident	80.3	Confident	37 Å²	37	80.9 Å²	80.9	19%	0.194	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-65.4	146.4	177.7	-82.6	166.8	0	0	0	113.4	S145 I470	S145-L147 PolarHBondContact O-N 3.35Å; S145-L147 VanDerWaalsContact O-N 3.1Å; L147-I470 HydrophobicContact CD1-CG2 3.42Å; L147-I470 VanDerWaalsContact CD1-CG2 3.42Å
148	P	81.6	Confident	80.9	Confident	101 Å²	101	79.4 Å²	79.4	66%	0.656	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-54.8	145.5	172.9	-22.9	32.6	0	0	0	111.8	R177	P148-R177 PolarHBondContact O-NH1 3.23Å; P148-R177 PolarHBondContact O-NH2 2.94Å
149	R	77.1	Confident	81.6	Confident	238 Å²	238	82.7 Å²	82.7	90%	0.898	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-49.7	138.7	-176.9	-71.1	-174.1	176.5	-171.3	-1.4	112	R151	R149-R151 PolarHBondContact O-N 3.39Å
150	P	81.4	Confident	82.2	Confident	47 Å²	47	84.6 Å²	84.6	31%	0.305	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-52.4	132.4	179.4	-26.7	34.5	0	0	0	112.1	V178	P150-V178 HydrophobicContact CG-CB 4.42Å
151	R	81.6	Confident	83	Confident	244 Å²	244	89.9 Å²	89.9	92%	0.921	46%	0.46	S	S	*	.	S	Bend	trans	-71.5	-34.2	-177.2	-69.1	179.4	63.7	176.2	-0.2	113.1	R149	R149-R151 PolarHBondContact O-N 3.39Å
152	W	88.4	Confident	83.7	Confident	43 Å²	43	93.4 Å²	93.4	16%	0.163	47%	0.471	C	S	.	.			trans	-79.6	138.8	-179.7	-175.7	88	0	0	0	111.2	A154 A157 F169 A173 A176 V178 F179	W152-A154 HydrophobicContact CH2-CB 3.76Å; W152-A154 HydrophobicContact CZ3-CB 3.75Å; W152-A157 HydrophobicContact CZ2-CB 3.83Å; W152-F169 HydrophobicContact CH2-CE2 4.17Å; W152-F169 HydrophobicContact CH2-CZ 4.26Å; W152-F169 HydrophobicContact CZ2-CD2 4.21Å; W152-F169 AromaticContact CZ2-CE2 3.75Å; W152-F169 HydrophobicContact CZ2-CE2 3.75Å; W152-F169 HydrophobicContact CZ2-CZ 4.15Å; W152-A173 HydrophobicContact CH2-CB 4.22Å; W152-A173 HydrophobicContact CZ2-CB 3.93Å; W152-A176 HydrophobicContact CB-CB 3.95Å; W152-A176 HydrophobicContact CD2-CB 3.92Å; W152-A176 HydrophobicContact CE3-CB 3.88Å; W152-A176 HydrophobicContact CG-CB 3.99Å; W152-V178 HydrophobicContact CE3-CG1 4.22Å; W152-V178 HydrophobicContact CZ3-CG1 4.45Å; W152-F179 HydrophobicContact CE3-CE2 4.45Å; W152-F179 AromaticContact CH2-CE2 3.86Å; W152-F179 HydrophobicContact CH2-CE2 3.86Å; W152-F179 HydrophobicContact CH2-CZ 4.32Å; W152-F179 HydrophobicContact CZ3-CD2 4.39Å; W152-F179 AromaticContact CZ3-CE2 3.62Å; W152-F179 HydrophobicContact CZ3-CE2 3.62Å; W152-F179 HydrophobicContact CZ3-CZ 4.49Å
153	Q	87.6	Confident	84.4	Confident	123 Å²	123	95.7 Å²	95.7	58%	0.575	48%	0.477	S	S	*	.			trans	-131.4	129.1	-177.8	-62.4	-176.2	6	0	0	110.4	L155 P156 A157	Q153-L155 PolarHBondContact O-N 2.63Å; Q153-P156 HydrophobicContact CB-CG 3.93Å; Q153-P156 WeakPolarHBondContact O-CD 3.45Å; Q153-A157 WeakPolarHBondContact O-CB 3.25Å; Q153-A157 PolarHBondContact O-N 3.25Å
154	A	88	Confident	85.1	Confident	53 Å²	53	97.9 Å²	97.9	44%	0.438	51%	0.506	S	S	.	.	H	α-helix	trans	-65	-43	-172.1	0	0	0	0	0	113.9	W152 L158	W152-A154 HydrophobicContact CH2-CB 3.76Å; W152-A154 HydrophobicContact CZ3-CB 3.75Å; A154-L158 WeakPolarHBondContact O-CB 3.21Å; A154-L158 PolarHBondContact O-N 3.28Å
155	L	90.4	Very high	85.7	Confident	143 Å²	143	99.8 Å²	99.8	75%	0.749	52%	0.521	S	S	*	.	H	α-helix	trans	-68.8	-46.4	-176.1	-67.8	176.1	0	0	0	113.4	Q153 R159	Q153-L155 PolarHBondContact O-N 2.63Å; L155-R159 WeakPolarHBondContact O-CB 3.47Å; L155-R159 PolarHBondContact O-N 3.28Å
156	P	90.2	Very high	85.8	Confident	56 Å²	56	98 Å²	98	36%	0.364	51%	0.509	S	S	.	.	H	α-helix	trans	-59.2	-49.4	171.4	-25.8	35.7	0	0	0	112.7	Q153 L158 R159 E160	Q153-P156 HydrophobicContact CB-CG 3.93Å; Q153-P156 WeakPolarHBondContact O-CD 3.45Å; P156-L158 VanDerWaalsContact C-N 3.33Å; P156-L158 PolarHBondContact O-N 3.42Å; P156-R159 WeakPolarHBondContact O-CB 3.46Å; P156-R159 PolarHBondContact O-N 2.83Å; P156-R159 VanDerWaalsContact O-N 3.15Å; P156-E160 WeakPolarHBondContact O-CG 3.2Å; P156-E160 PolarHBondContact O-N 3.25Å
157	A	89.9	Confident	85.9	Confident	7 Å²	7	98 Å²	98	6%	0.058	51%	0.509	C	S	.	.	H	α-helix	trans	-62.5	-38.9	-178.6	0	0	0	0	0	112.4	W152 Q153 E160 R161 F169	W152-A157 HydrophobicContact CZ2-CB 3.83Å; Q153-A157 WeakPolarHBondContact O-CB 3.25Å; Q153-A157 PolarHBondContact O-N 3.25Å; A157-E160 PolarHBondContact O-N 3.3Å; A157-R161 PolarHBondContact O-N 2.76Å; A157-F169 HydrophobicContact CB-CD2 3.78Å; A157-F169 HydrophobicContact CB-CE2 4.06Å
158	L	89.9	Confident	86.3	Confident	64 Å²	64	103.8 Å²	103.8	34%	0.335	53%	0.528	S	S	.	.	H	α-helix	trans	-65.7	-44.3	174.7	-179	62.2	0	0	0	111	A154 P156 E160 R161 E162 F169	A154-L158 WeakPolarHBondContact O-CB 3.21Å; A154-L158 PolarHBondContact O-N 3.28Å; P156-L158 VanDerWaalsContact C-N 3.33Å; P156-L158 PolarHBondContact O-N 3.42Å; L158-E160 VanDerWaalsContact C-N 3.34Å; L158-E160 PolarHBondContact O-N 2.85Å; L158-R161 WeakPolarHBondContact O-CB 3.5Å; L158-R161 PolarHBondContact O-N 3.33Å; L158-R161 VanDerWaalsContact O-N 3.15Å; L158-E162 HydrophobicContact CD1-CG 4.43Å; L158-E162 WeakPolarHBondContact O-CG 3.29Å; L158-E162 PolarHBondContact O-N 3.07Å; L158-F169 HydrophobicContact CB-CE2 4.04Å
159	R	90.9	Very high	86.6	Confident	179 Å²	179	100.8 Å²	100.8	68%	0.675	51%	0.505	S	S	*	.	H	α-helix	trans	-60.5	-43.3	176.3	-177.9	-177.4	177.2	-163.2	-1.8	111.7	L155 P156 R161 E162 L163	L155-R159 WeakPolarHBondContact O-CB 3.47Å; L155-R159 PolarHBondContact O-N 3.28Å; P156-R159 WeakPolarHBondContact O-CB 3.46Å; P156-R159 PolarHBondContact O-N 2.83Å; P156-R159 VanDerWaalsContact O-N 3.15Å; R159-R161 VanDerWaalsContact C-N 3.28Å; R159-R161 PolarHBondContact O-N 2.7Å; R159-E162 PolarHBondContact O-N 3.08Å; R159-L163 HydrophobicContact CG-CD1 3.83Å; R159-L163 HydrophobicContact CG-CG 4.34Å; R159-L163 WeakPolarHBondContact O-CB 3.49Å; R159-L163 VanDerWaalsContact O-CG 3.25Å; R159-L163 WeakPolarHBondContact O-CG 3.23Å; R159-L163 PolarHBondContact O-N 3.26Å
160	E	90.4	Very high	87.1	Confident	89 Å²	89	92.7 Å²	92.7	42%	0.416	48%	0.481	S	S	.	.	H	α-helix	trans	-63.9	-33.1	176.1	-72.6	172.5	-159.4	0	0	112.3	P156 A157 L158 G164 S165 S166	P156-E160 WeakPolarHBondContact O-CG 3.2Å; P156-E160 PolarHBondContact O-N 3.25Å; A157-E160 PolarHBondContact O-N 3.3Å; L158-E160 VanDerWaalsContact C-N 3.34Å; L158-E160 PolarHBondContact O-N 2.85Å; E160-G164 PolarHBondContact O-N 3.07Å; E160-S165 WeakPolarHBondContact O-CA 3.42Å; E160-S165 WeakPolarHBondContact O-CB 3.36Å; E160-S165 PolarHBondContact O-N 3.17Å; E160-S166 PolarHBondContact O-N 3.34Å
161	R	90.4	Very high	87.4	Confident	114 Å²	114	94.8 Å²	94.8	43%	0.43	48%	0.484	S	S	.	.	H	α-helix	trans	-65.8	-52.5	171.7	-169.3	-170.2	76.6	172.7	7.1	112.1	A157 L158 R159 L163 G164 S166 F169	A157-R161 PolarHBondContact O-N 2.76Å; L158-R161 WeakPolarHBondContact O-CB 3.5Å; L158-R161 PolarHBondContact O-N 3.33Å; L158-R161 VanDerWaalsContact O-N 3.15Å; R159-R161 VanDerWaalsContact C-N 3.28Å; R159-R161 PolarHBondContact O-N 2.7Å; R161-L163 VanDerWaalsContact C-N 3.27Å; R161-L163 PolarHBondContact O-N 3.03Å; R161-G164 PolarHBondContact O-N 3.07Å; R161-S166 WeakPolarHBondContact CA-O 3.38Å; R161-F169 HydrophobicContact CB-CB 4.16Å; R161-F169 HydrophobicContact CG-CB 4.18Å
162	E	90.8	Very high	87.9	Confident	126 Å²	126	86.1 Å²	86.1	59%	0.589	45%	0.454	S	S	*	.	H	α-helix	trans	-65	-30.9	-178.5	-60.8	-46.1	119.8	0	0	112.6	L158 R159 G164	L158-E162 HydrophobicContact CD1-CG 4.43Å; L158-E162 WeakPolarHBondContact O-CG 3.29Å; L158-E162 PolarHBondContact O-N 3.07Å; R159-E162 PolarHBondContact O-N 3.08Å; E162-G164 PolarHBondContact O-N 3.19Å
163	L	91.5	Very high	87.9	Confident	112 Å²	112	84.2 Å²	84.2	59%	0.586	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	4.9	172.7	-66.2	176	0	0	0	113.6	R159 R161 S165	R159-L163 HydrophobicContact CG-CD1 3.83Å; R159-L163 HydrophobicContact CG-CG 4.34Å; R159-L163 WeakPolarHBondContact O-CB 3.49Å; R159-L163 VanDerWaalsContact O-CG 3.25Å; R159-L163 WeakPolarHBondContact O-CG 3.23Å; R159-L163 PolarHBondContact O-N 3.26Å; R161-L163 VanDerWaalsContact C-N 3.27Å; R161-L163 PolarHBondContact O-N 3.03Å; L163-S165 PolarHBondContact O-N 3.47Å; L163-S165 PolarHBondContact O-OG 3.15Å
164	G	86.7	Confident	88.1	Confident	68 Å²	68	79 Å²	79	70%	0.701	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	10.9	-176.2	0	0	0	0	0	114.6	E160 R161 E162	E160-G164 PolarHBondContact O-N 3.07Å; R161-G164 PolarHBondContact O-N 3.07Å; E162-G164 PolarHBondContact O-N 3.19Å
165	S	84.1	Confident	88.3	Confident	88 Å²	88	77 Å²	77	62%	0.615	41%	0.41	S	S	*	.	S	Bend	trans	-80.8	-24.6	-174.3	-56.5	0	0	0	0	112.6	E160 L163	E160-S165 WeakPolarHBondContact O-CA 3.42Å; E160-S165 WeakPolarHBondContact O-CB 3.36Å; E160-S165 PolarHBondContact O-N 3.17Å; L163-S165 PolarHBondContact O-N 3.47Å; L163-S165 PolarHBondContact O-OG 3.15Å
166	S	78.7	Confident	88.5	Confident	21 Å²	21	70.4 Å²	70.4	15%	0.147	38%	0.375	C	S	.	.			trans	-145.2	116.2	172.7	-176.3	0	0	0	0	112.2	E160 R161 R168	E160-S166 PolarHBondContact O-N 3.34Å; R161-S166 WeakPolarHBondContact CA-O 3.38Å; S166-R168 PolarHBondContact O-N 3.48Å; S166-R168 PolarHBondContact OG-N 3.01Å
167	A	77.9	Confident	88.7	Confident	105 Å²	105	69 Å²	69	87%	0.868	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-0.2	168.3	0	0	0	0	0	113.1	F169	A167-F169 PolarHBondContact O-N 3.49Å
168	R	84.6	Confident	88.8	Confident	159 Å²	159	70.7 Å²	70.7	60%	0.6	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	6	-171.1	-64.1	-176.6	171.5	166.6	-2.1	114.9	S166 V170 Y171 E172	S166-R168 PolarHBondContact O-N 3.48Å; S166-R168 PolarHBondContact OG-N 3.01Å; R168-V170 VanDerWaalsContact C-N 3.35Å; R168-V170 PolarHBondContact O-N 2.95Å; R168-Y171 WeakPolarHBondContact O-CB 3.24Å; R168-Y171 PolarHBondContact O-N 2.81Å; R168-Y171 VanDerWaalsContact O-N 3.12Å; R168-E172 HydrophobicContact CB-CG 4.15Å; R168-E172 WeakPolarHBondContact O-CG 3.33Å; R168-E172 PolarHBondContact O-N 3.45Å
169	F	88.6	Confident	89	Confident	38 Å²	38	69.8 Å²	69.8	17%	0.167	37%	0.366	C	S	.	.	H	α-helix	trans	-47.3	-51.8	-177.5	178.9	-91.6	0	0	0	113.9	W152 A157 L158 R161 A167 A173	W152-F169 HydrophobicContact CH2-CE2 4.17Å; W152-F169 HydrophobicContact CH2-CZ 4.26Å; W152-F169 HydrophobicContact CZ2-CD2 4.21Å; W152-F169 AromaticContact CZ2-CE2 3.75Å; W152-F169 HydrophobicContact CZ2-CE2 3.75Å; W152-F169 HydrophobicContact CZ2-CZ 4.15Å; A157-F169 HydrophobicContact CB-CD2 3.78Å; A157-F169 HydrophobicContact CB-CE2 4.06Å; L158-F169 HydrophobicContact CB-CE2 4.04Å; R161-F169 HydrophobicContact CB-CB 4.16Å; R161-F169 HydrophobicContact CG-CB 4.18Å; A167-F169 PolarHBondContact O-N 3.49Å; F169-A173 VanDerWaalsContact O-CB 3.26Å; F169-A173 WeakPolarHBondContact O-CB 3.47Å; F169-A173 PolarHBondContact O-N 3.31Å
170	V	86.9	Confident	89.2	Confident	67 Å²	67	61.2 Å²	61.2	41%	0.406	33%	0.333	S	S	.	.	H	α-helix	trans	-68.5	-43.9	-178.2	-178.3	0	0	0	0	111	R168 E172 A173 C174 H489 L490	R168-V170 VanDerWaalsContact C-N 3.35Å; R168-V170 PolarHBondContact O-N 2.95Å; V170-E172 PolarHBondContact O-N 3.22Å; V170-A173 PolarHBondContact O-N 2.8Å; V170-C174 PolarHBondContact O-N 3.47Å; V170-C174 PolarHBondContact O-SG 3.46Å; V170-H489 WeakPolarHBondContact CG1-O 3.21Å; V170-L490 HydrophobicContact CG1-CD2 4.33Å
171	Y	88.9	Confident	89.4	Confident	91 Å²	91	58.8 Å²	58.8	36%	0.357	32%	0.322	S	S	.	.	H	α-helix	trans	-56	-49.5	176.8	-179.1	-78.4	0	0	0	111	R168 C174 G175 P445 K446	R168-Y171 WeakPolarHBondContact O-CB 3.24Å; R168-Y171 PolarHBondContact O-N 2.81Å; R168-Y171 VanDerWaalsContact O-N 3.12Å; Y171-C174 PolarHBondContact O-N 3.36Å; Y171-G175 PolarHBondContact O-N 3.26Å; Y171-P445 HydrophobicContact CD1-CG 3.79Å; Y171-P445 HydrophobicContact CD2-CB 3.78Å; Y171-P445 HydrophobicContact CD2-CG 3.82Å; Y171-P445 HydrophobicContact CE1-CB 4.27Å; Y171-P445 HydrophobicContact CE1-CG 3.72Å; Y171-P445 HydrophobicContact CE2-CB 3.47Å; Y171-P445 VanDerWaalsContact CE2-CB 3.47Å; Y171-P445 HydrophobicContact CE2-CG 3.78Å; Y171-P445 HydrophobicContact CG-CB 4.31Å; Y171-P445 HydrophobicContact CG-CG 3.82Å; Y171-P445 WeakPolarHBondContact O-CG 3.37Å; Y171-P445 PolarHBondContact OH-O 3.47Å; Y171-K446 HydrophobicContact CE1-CD 4.36Å; Y171-K446 HydrophobicContact CE1-CG 4.17Å; Y171-K446 WeakPolarHBondContact OH-CE 3.1Å; Y171-K446 WeakPolarHBondContact OH-CG 3.38Å
172	E	90.3	Very high	89.6	Confident	62 Å²	62	57 Å²	57	29%	0.29	32%	0.315	S	S	.	.	H	α-helix	trans	-70.6	-34.6	179.1	-66.7	176	-175.9	0	0	113	R168 V170 G175 A176	R168-E172 HydrophobicContact CB-CG 4.15Å; R168-E172 WeakPolarHBondContact O-CG 3.33Å; R168-E172 PolarHBondContact O-N 3.45Å; V170-E172 PolarHBondContact O-N 3.22Å; E172-G175 CarbonylContact O-C 3.58Å; E172-G175 PolarHBondContact O-N 2.97Å; E172-A176 WeakPolarHBondContact O-CB 3.38Å; E172-A176 PolarHBondContact O-N 3.47Å
173	A	89.8	Confident	89.9	Confident	4 Å²	4	51.4 Å²	51.4	3%	0.033	29%	0.289	C	S	.	.	H	α-helix	trans	-64.9	-37.4	173.9	0	0	0	0	0	112.2	W152 F169 V170 G175 A176 F179	W152-A173 HydrophobicContact CH2-CB 4.22Å; W152-A173 HydrophobicContact CZ2-CB 3.93Å; F169-A173 VanDerWaalsContact O-CB 3.26Å; F169-A173 WeakPolarHBondContact O-CB 3.47Å; F169-A173 PolarHBondContact O-N 3.31Å; V170-A173 PolarHBondContact O-N 2.8Å; A173-G175 VanDerWaalsContact C-N 3.29Å; A173-G175 PolarHBondContact O-N 2.98Å; A173-A176 WeakPolarHBondContact O-CB 3.33Å; A173-A176 PolarHBondContact O-N 2.74Å; A173-A176 VanDerWaalsContact O-N 3.1Å; A173-F179 HydrophobicContact CB-CE1 4.21Å; A173-F179 HydrophobicContact CB-CE2 4.23Å; A173-F179 HydrophobicContact CB-CZ 4.02Å
174	C	91.8	Very high	90.1	Very high	12 Å²	12	53.4 Å²	53.4	8%	0.081	29%	0.289	C	S	.	.	H	α-helix	trans	-64.4	-34.1	174.1	-64.2	0	0	0	0	112.2	V170 Y171 A176 Y443	V170-C174 PolarHBondContact O-N 3.47Å; V170-C174 PolarHBondContact O-SG 3.46Å; Y171-C174 PolarHBondContact O-N 3.36Å; C174-A176 VanDerWaalsContact C-N 3.34Å; C174-Y443 WeakPolarHBondContact O-CE1 3.47Å
175	G	92.6	Very high	90.6	Very high	13 Å²	13	53.8 Å²	53.8	13%	0.134	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	0.5	172.1	0	0	0	0	0	115	Y171 E172 A173 F449	Y171-G175 PolarHBondContact O-N 3.26Å; E172-G175 CarbonylContact O-C 3.58Å; E172-G175 PolarHBondContact O-N 2.97Å; A173-G175 VanDerWaalsContact C-N 3.29Å; A173-G175 PolarHBondContact O-N 2.98Å; G175-F449 VanDerWaalsContact O-CE2 3.32Å; G175-F449 WeakPolarHBondContact O-CE2 3.47Å
176	A	93.7	Very high	91.2	Very high	4 Å²	4	52.5 Å²	52.5	3%	0.033	26%	0.259	C	S	.	.			trans	-87.8	121.2	-174.5	0	0	0	0	0	112.1	W152 E172 A173 C174 V178 F179	W152-A176 HydrophobicContact CB-CB 3.95Å; W152-A176 HydrophobicContact CD2-CB 3.92Å; W152-A176 HydrophobicContact CE3-CB 3.88Å; W152-A176 HydrophobicContact CG-CB 3.99Å; E172-A176 WeakPolarHBondContact O-CB 3.38Å; E172-A176 PolarHBondContact O-N 3.47Å; A173-A176 WeakPolarHBondContact O-CB 3.33Å; A173-A176 PolarHBondContact O-N 2.74Å; A173-A176 VanDerWaalsContact O-N 3.1Å; C174-A176 VanDerWaalsContact C-N 3.34Å; A176-V178 HydrophobicContact CB-CG1 4.22Å; A176-V178 PolarHBondContact O-N 3.44Å; A176-V178 VanDerWaalsContact O-N 3.08Å; A176-F179 HydrophobicContact CB-CD2 4.11Å; A176-F179 WeakPolarHBondContact O-CB 3.19Å; A176-F179 PolarHBondContact O-N 3.18Å
177	R	93.8	Very high	92	Very high	27 Å²	27	52.8 Å²	52.8	10%	0.102	26%	0.258	C	S	.	.	H	α-helix	trans	-55.7	-32.6	-178.8	-165.2	176.4	70.7	-138.8	2.8	114.1	P148 F179 V180 Q181 F449 E463 I470	P148-R177 PolarHBondContact O-NH1 3.23Å; P148-R177 PolarHBondContact O-NH2 2.94Å; R177-F179 PolarHBondContact O-N 2.75Å; R177-V180 PolarHBondContact O-N 2.9Å; R177-Q181 HydrophobicContact CG-CG 4.13Å; R177-Q181 WeakPolarHBondContact O-CG 3.5Å; R177-Q181 PolarHBondContact O-N 3.29Å; R177-F449 HydrophobicContact CB-CE1 4.01Å; R177-F449 HydrophobicContact CB-CZ 3.85Å; R177-F449 HydrophobicContact CG-CE1 3.93Å; R177-F449 HydrophobicContact CG-CZ 4.26Å; R177-E463 WeakPolarHBondContact CD-OE1 3.47Å; R177-E463 IonicContact CZ-OE1 3.75Å; R177-E463 IonicContact NE-OE1 3.76Å; R177-E463 IonicContact NH1-OE1 3.72Å; R177-E463 PolarHBondContact NH1-OE1 2.75Å; R177-I470 HydrophobicContact CG-CD1 3.78Å
178	V	92.6	Very high	92.9	Very high	42 Å²	42	49.2 Å²	49.2	26%	0.255	23%	0.231	S	C	.	.	H	α-helix	trans	-63.2	-23.2	177	66.8	0	0	0	0	113.3	P150 W152 A176 R182	P150-V178 HydrophobicContact CG-CB 4.42Å; W152-V178 HydrophobicContact CE3-CG1 4.22Å; W152-V178 HydrophobicContact CZ3-CG1 4.45Å; A176-V178 HydrophobicContact CB-CG1 4.22Å; A176-V178 PolarHBondContact O-N 3.44Å; A176-V178 VanDerWaalsContact O-N 3.08Å; V178-R182 VanDerWaalsContact O-CD 3.3Å; V178-R182 WeakPolarHBondContact O-CD 3.49Å; V178-R182 VanDerWaalsContact O-CG 3.29Å; V178-R182 WeakPolarHBondContact O-CG 3.49Å
179	F	93.8	Very high	93.5	Very high	44 Å²	44	41.8 Å²	41.8	19%	0.193	20%	0.203	C	C	.	.	H	α-helix	trans	-77.3	-49	171.6	-81	-119.7	0	0	0	110.3	W152 A173 A176 R177 Q181 R182 F183 P491 P507	W152-F179 HydrophobicContact CE3-CE2 4.45Å; W152-F179 AromaticContact CH2-CE2 3.86Å; W152-F179 HydrophobicContact CH2-CE2 3.86Å; W152-F179 HydrophobicContact CH2-CZ 4.32Å; W152-F179 HydrophobicContact CZ3-CD2 4.39Å; W152-F179 AromaticContact CZ3-CE2 3.62Å; W152-F179 HydrophobicContact CZ3-CE2 3.62Å; W152-F179 HydrophobicContact CZ3-CZ 4.49Å; A173-F179 HydrophobicContact CB-CE1 4.21Å; A173-F179 HydrophobicContact CB-CE2 4.23Å; A173-F179 HydrophobicContact CB-CZ 4.02Å; A176-F179 HydrophobicContact CB-CD2 4.11Å; A176-F179 WeakPolarHBondContact O-CB 3.19Å; A176-F179 PolarHBondContact O-N 3.18Å; R177-F179 PolarHBondContact O-N 2.75Å; F179-Q181 VanDerWaalsContact C-N 3.34Å; F179-Q181 PolarHBondContact O-N 3.16Å; F179-R182 PolarHBondContact O-N 2.77Å; F179-F183 PolarHBondContact O-N 3.1Å; F179-P491 HydrophobicContact CD1-CB 3.78Å; F179-P491 HydrophobicContact CD1-CG 3.75Å; F179-P491 HydrophobicContact CE1-CG 4.08Å; F179-P507 HydrophobicContact CB-CB 4.06Å; F179-P507 HydrophobicContact CD1-CB 3.96Å; F179-P507 HydrophobicContact CD1-CG 3.63Å; F179-P507 HydrophobicContact CE1-CG 4.21Å; F179-P507 HydrophobicContact CG-CB 4.29Å; F179-P507 HydrophobicContact CG-CG 4.44Å; F179-P507 VanDerWaalsContact O-CB 3.29Å; F179-P507 WeakPolarHBondContact O-CB 3.43Å
180	V	94.8	Very high	93.8	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58	-44.5	179.3	177.9	0	0	0	0	112.2	R177 R182 F183 Y443 F449 L461 I470 Q471	R177-V180 PolarHBondContact O-N 2.9Å; V180-R182 PolarHBondContact O-N 2.89Å; V180-R182 VanDerWaalsContact O-N 3.07Å; V180-F183 HydrophobicContact CB-CD2 4.42Å; V180-F183 HydrophobicContact CG1-CD2 4.15Å; V180-F183 HydrophobicContact CG1-CE2 4.4Å; V180-F183 HydrophobicContact CG2-CE2 4.33Å; V180-F183 PolarHBondContact O-N 3.19Å; V180-F183 VanDerWaalsContact O-N 3.14Å; V180-Y443 HydrophobicContact CG2-CD1 3.83Å; V180-Y443 HydrophobicContact CG2-CE1 3.47Å; V180-Y443 VanDerWaalsContact CG2-CE1 3.47Å; V180-F449 HydrophobicContact CG2-CD2 3.92Å; V180-F449 HydrophobicContact CG2-CE2 3.85Å; V180-F449 HydrophobicContact CG2-CG 4.28Å; V180-F449 HydrophobicContact CG2-CZ 4.2Å; V180-L461 HydrophobicContact CG1-CB 4.17Å; V180-L461 HydrophobicContact CG1-CD2 3.84Å; V180-L461 HydrophobicContact CG1-CG 4.5Å; V180-I470 HydrophobicContact CB-CD1 4.01Å; V180-I470 HydrophobicContact CG1-CD1 3.52Å; V180-I470 HydrophobicContact CG1-CG1 4.12Å; V180-Q471 HydrophobicContact CG1-CB 3.96Å; V180-Q471 WeakPolarHBondContact O-CG 3.45Å; V180-Q471 PolarHBondContact O-NE2 3.13Å
181	Q	94.6	Very high	94	Very high	38 Å²	38	46.4 Å²	46.4	18%	0.178	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-13.4	177	-70.3	-176.2	-69.3	0	0	113.7	R177 F179 Q471 S512 T513	R177-Q181 HydrophobicContact CG-CG 4.13Å; R177-Q181 WeakPolarHBondContact O-CG 3.5Å; R177-Q181 PolarHBondContact O-N 3.29Å; F179-Q181 VanDerWaalsContact C-N 3.34Å; F179-Q181 PolarHBondContact O-N 3.16Å; Q181-Q471 VanDerWaalsContact C-NE2 3.29Å; Q181-Q471 PolarHBondContact O-NE2 3.3Å; Q181-Q471 VanDerWaalsContact O-NE2 3.1Å; Q181-S512 CarbonylContact O-C 3.53Å; Q181-S512 WeakPolarHBondContact O-CA 3.28Å; Q181-T513 HydrophobicContact CB-CG2 4.24Å; Q181-T513 HydrophobicContact CG-CG2 4.42Å; Q181-T513 WeakPolarHBondContact O-CB 3.25Å; Q181-T513 PolarHBondContact O-N 2.69Å
182	R	95.6	Very high	94.3	Very high	75 Å²	75	42.3 Å²	42.3	28%	0.283	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.9	7.7	179.8	-65.5	176.8	64.2	-146.1	-5.2	113.4	V178 F179 V180 R184 P507 T508 A509	V178-R182 VanDerWaalsContact O-CD 3.3Å; V178-R182 WeakPolarHBondContact O-CD 3.49Å; V178-R182 VanDerWaalsContact O-CG 3.29Å; V178-R182 WeakPolarHBondContact O-CG 3.49Å; F179-R182 PolarHBondContact O-N 2.77Å; V180-R182 PolarHBondContact O-N 2.89Å; V180-R182 VanDerWaalsContact O-N 3.07Å; R182-R184 PolarHBondContact O-N 2.73Å; R182-P507 HydrophobicContact CB-CB 4.37Å; R182-P507 CarbonylContact O-C 3.58Å; R182-P507 VanDerWaalsContact O-C 3.26Å; R182-P507 VanDerWaalsContact O-CA 3.29Å; R182-P507 WeakPolarHBondContact O-CA 3.49Å; R182-T508 PolarHBondContact O-N 3.13Å; R182-A509 HydrophobicContact CB-CB 4.3Å; R182-A509 PolarHBondContact NE-O 3.29Å; R182-A509 PolarHBondContact NH2-O 3.45Å; R182-A509 VanDerWaalsContact O-CB 3.27Å; R182-A509 WeakPolarHBondContact O-CB 3.37Å; R182-A509 PolarHBondContact O-N 2.97Å
183	F	96.9	Very high	94.5	Very high	10 Å²	10	44.1 Å²	44.1	4%	0.044	23%	0.233	C	C	.	.			trans	-55.9	134.4	174.6	-88.8	-49	0	0	0	111.7	F179 V180 Y443 L461 Q471 M473 L493 W505 A506	F179-F183 PolarHBondContact O-N 3.1Å; V180-F183 HydrophobicContact CB-CD2 4.42Å; V180-F183 HydrophobicContact CG1-CD2 4.15Å; V180-F183 HydrophobicContact CG1-CE2 4.4Å; V180-F183 HydrophobicContact CG2-CE2 4.33Å; V180-F183 PolarHBondContact O-N 3.19Å; V180-F183 VanDerWaalsContact O-N 3.14Å; F183-Y443 HydrophobicContact CE2-CE1 4.2Å; F183-Y443 HydrophobicContact CE2-CE2 4.05Å; F183-Y443 AromaticContact CE2-CZ 3.82Å; F183-Y443 HydrophobicContact CZ-CE1 4.34Å; F183-Y443 AromaticContact CZ-CE2 3.67Å; F183-Y443 HydrophobicContact CZ-CE2 3.67Å; F183-Y443 AromaticContact CZ-CZ 3.53Å; F183-Y443 WeakPolarHBondContact CZ-OH 3.33Å; F183-L461 HydrophobicContact CD2-CD2 4.42Å; F183-L461 HydrophobicContact CE2-CD2 4.22Å; F183-Q471 HydrophobicContact CB-CG 4.45Å; F183-M473 HydrophobicContact CB-CE 4.4Å; F183-M473 HydrophobicContact CB-SD 3.47Å; F183-M473 WeakPolarHBondContact CB-SD 3.25Å; F183-M473 HydrophobicContact CG-SD 4.4Å; F183-L493 HydrophobicContact CZ-CB 4.19Å; F183-W505 HydrophobicContact CD1-CB 4.13Å; F183-W505 HydrophobicContact CE1-CB 4.46Å; F183-A506 WeakPolarHBondContact CA-O 3.48Å
184	R	96.4	Very high	94.6	Very high	153 Å²	153	44.3 Å²	44.3	58%	0.577	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-143.7	150.9	176.1	-170.7	176.3	-178.2	170.2	3.6	108.9	R182 Q186 W505 A506 A509	R182-R184 PolarHBondContact O-N 2.73Å; R184-Q186 PolarHBondContact O-N 2.78Å; R184-Q186 PolarHBondContact O-NE2 3.11Å; R184-W505 WeakPolarHBondContact O-CA 3.29Å; R184-A506 PolarHBondContact N-O 3.11Å; R184-A506 PolarHBondContact O-N 2.87Å; R184-A509 HydrophobicContact CB-CB 4.37Å
185	L	96.5	Very high	94.6	Very high	76 Å²	76	44.2 Å²	44.2	40%	0.398	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	127.1	169.5	-178.1	61.6	0	0	0	109.5	K503 W505	L185-K503 HydrophobicContact CD1-CB 3.77Å; L185-K503 HydrophobicContact CD1-CG 4.21Å; L185-W505 HydrophobicContact CB-CE3 4.07Å; L185-W505 HydrophobicContact CB-CH2 3.79Å; L185-W505 HydrophobicContact CB-CZ2 4.34Å; L185-W505 HydrophobicContact CB-CZ3 3.68Å; L185-W505 HydrophobicContact CD1-CD2 4.47Å; L185-W505 HydrophobicContact CD1-CH2 4.29Å; L185-W505 HydrophobicContact CD1-CZ2 3.99Å; L185-W505 HydrophobicContact CG-CH2 4.48Å; L185-W505 VanDerWaalsContact N-CE3 3.26Å
186	Q	96.4	Very high	94.8	Very high	62 Å²	62	43.6 Å²	43.6	29%	0.29	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-46.5	174.2	-54.7	-50.3	-70.3	0	0	111.4	R184 R225 I504 A506 T508	R184-Q186 PolarHBondContact O-N 2.78Å; R184-Q186 PolarHBondContact O-NE2 3.11Å; Q186-R225 PolarHBondContact O-NH2 2.73Å; Q186-I504 PolarHBondContact N-O 3.09Å; Q186-A506 HydrophobicContact CG-CB 3.46Å; Q186-A506 VanDerWaalsContact CG-CB 3.46Å; Q186-A506 PolarHBondContact NE2-O 3.05Å; Q186-T508 VanDerWaalsContact CD-OG1 3.27Å; Q186-T508 PolarHBondContact NE2-OG1 3.29Å; Q186-T508 VanDerWaalsContact OE1-CG2 3.29Å; Q186-T508 PolarHBondContact OE1-OG1 2.83Å
187	H	95.9	Very high	94.7	Very high	27 Å²	27	45 Å²	45	13%	0.125	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170	156.3	-176	46.7	-96.3	0	0	0	111.6	W222 R225 I504	H187-W222 PolarHBondContact NE2-O 2.9Å; H187-R225 VanDerWaalsContact CB-CZ 3.45Å; H187-R225 VanDerWaalsContact ND1-CZ 3.33Å; H187-R225 PolarHBondContact ND1-NE 3.06Å; H187-R225 PolarHBondContact ND1-NH2 2.83Å; H187-I504 PolarHBondContact O-N 2.83Å
188	G	95.8	Very high	94.8	Very high	29 Å²	29	43.9 Å²	43.9	30%	0.299	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	161	159.4	0	0	0	0	0	111.5	V502	G188-V502 CarbonylContact C-O 3.49Å; G188-V502 VanDerWaalsContact CA-O 3.31Å; G188-V502 WeakPolarHBondContact CA-O 3.34Å
189	L	97.1	Very high	95.1	Very high	4 Å²	4	42.4 Å²	42.4	2%	0.021	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	108.4	166.3	-52.7	173.7	0	0	0	106.5	L208 W220 W222 R225 D501 V502 I504	L189-L208 HydrophobicContact CD1-CD2 4.28Å; L189-W220 HydrophobicContact CB-CD2 4.03Å; L189-W220 HydrophobicContact CB-CE3 3.91Å; L189-W220 HydrophobicContact CB-CH2 4.15Å; L189-W220 HydrophobicContact CB-CZ2 4.26Å; L189-W220 HydrophobicContact CB-CZ3 3.98Å; L189-W220 HydrophobicContact CD1-CB 3.99Å; L189-W220 HydrophobicContact CD1-CD2 4.01Å; L189-W220 HydrophobicContact CD1-CE3 4.38Å; L189-W220 HydrophobicContact CD1-CG 3.84Å; L189-W222 HydrophobicContact CD1-CB 4.08Å; L189-R225 HydrophobicContact CD2-CB 4.05Å; L189-R225 HydrophobicContact CD2-CG 4.37Å; L189-D501 VanDerWaalsContact O-CA 3.32Å; L189-D501 WeakPolarHBondContact O-CA 3.36Å; L189-V502 HydrophobicContact CB-CB 4.16Å; L189-V502 HydrophobicContact CD1-CB 4.3Å; L189-V502 HydrophobicContact CD1-CG1 4.4Å; L189-V502 PolarHBondContact N-O 3.34Å; L189-V502 PolarHBondContact O-N 2.83Å; L189-I504 HydrophobicContact CD1-CD1 4.13Å; L189-I504 HydrophobicContact CD1-CG1 4.13Å; L189-I504 HydrophobicContact CG-CG1 4.22Å
190	E	95.1	Very high	95.3	Very high	152 Å²	152	41.4 Å²	41.4	71%	0.71	22%	0.218	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100.1	134.8	-175.5	-65.6	175.9	-166.5	0	0	110.1	W220 D501	E190-W220 WeakPolarHBondContact O-CH2 3.05Å; E190-D501 HydrophobicContact CG-CB 4.15Å
191	G	92.3	Very high	95.4	Very high	49 Å²	49	41.7 Å²	41.7	51%	0.505	22%	0.22	S	C	.	.			trans	169.5	-24.8	176.6	0	0	0	0	0	115.2
192	H	95.6	Very high	95.5	Very high	5 Å²	5	40 Å²	40	2%	0.023	21%	0.211	C	C	.	.			trans	-73.1	155.6	167.8	-78.2	-66.6	0	0	0	111.4	V196 S210 S212 D214	H192-V196 HydrophobicContact CB-CG2 3.88Å; H192-S210 PolarHBondContact CD2-OG 3.21Å; H192-S210 PolarHBondContact NE2-OG 2.96Å; H192-S212 WeakPolarHBondContact ND1-CB 3.3Å; H192-D214 VanDerWaalsContact CA-OD2 3.26Å; H192-D214 WeakPolarHBondContact CA-OD2 3.49Å; H192-D214 WeakPolarHBondContact CB-OD2 3.33Å; H192-D214 IonicContact CE1-OD1 3.75Å; H192-D214 IonicContact CG-OD2 3.28Å; H192-D214 IonicContact ND1-OD1 2.66Å; H192-D214 PolarHBondContact ND1-OD1 2.95Å; H192-D214 IonicContact ND1-OD2 2.82Å; H192-D214 PolarHBondContact ND1-OD2 3.29Å
193	T	94.6	Very high	95.4	Very high	101 Å²	101	41 Å²	41	62%	0.62	22%	0.219	S	C	*	.	S	Bend	trans	-113.5	-3	177.1	64.5	0	0	0	0	113.5	D214	T193-D214 PolarHBondContact N-OD2 2.92Å; T193-D214 VanDerWaalsContact OG1-CB 3.28Å; T193-D214 WeakPolarHBondContact OG1-CB 3.46Å
194	G	91.5	Very high	95.2	Very high	8 Å²	8	48.9 Å²	48.9	8%	0.082	25%	0.249	C	C	.	.	S	Bend	trans	-123.5	-179.7	173.1	0	0	0	0	0	112	S212 H500	G194-S212 WeakPolarHBondContact CA-OG 3.4Å; G194-S212 PolarHBondContact O-OG 3.29Å; G194-S212 VanDerWaalsContact O-OG 3.13Å; G194-H500 WeakPolarHBondContact O-CA 3.17Å; G194-H500 WeakPolarHBondContact O-CB 3.31Å
195	C	92.1	Very high	95.2	Very high	9 Å²	9	41.7 Å²	41.7	6%	0.061	22%	0.222	C	C	.	.			trans	-60.3	143.7	174	-50.6	0	0	0	0	110.2	S212 D213 L498 R555	C195-S212 WeakPolarHBondContact O-CA 3.42Å; C195-S212 VanDerWaalsContact O-CB 3.25Å; C195-S212 WeakPolarHBondContact O-CB 3.46Å; C195-S212 PolarHBondContact O-OG 3.22Å; C195-D213 PolarHBondContact O-N 2.95Å; C195-D213 VanDerWaalsContact O-N 3.08Å; C195-L498 HydrophobicContact CB-CD2 4.39Å; C195-L498 PolarHBondContact SG-O 3.1Å; C195-L498 VanDerWaalsContact SG-O 3.41Å; C195-R555 PolarHBondContact SG-NH1 3.43Å
196	V	94.9	Very high	95.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	107.3	-179.8	-178.7	0	0	0	0	110.1	H192 L199 S496 D499 V502	H192-V196 HydrophobicContact CB-CG2 3.88Å; V196-L199 HydrophobicContact CG1-CD2 4.25Å; V196-S496 WeakPolarHBondContact O-CB 3.5Å; V196-S496 PolarHBondContact O-OG 2.98Å; V196-D499 PolarHBondContact N-O 2.93Å; V196-V502 HydrophobicContact CG1-CG2 4.01Å
197	N	93.3	Very high	95.1	Very high	33 Å²	33	40.6 Å²	40.6	18%	0.176	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-1.2	-170.1	-45.9	-61.9	0	0	0	114.3	G211 D213 V239 F240 C483	N197-G211 PolarHBondContact N-O 3.39Å; N197-D213 PolarHBondContact ND2-OD1 3.38Å; N197-V239 WeakPolarHBondContact CB-O 3.32Å; N197-V239 PolarHBondContact ND2-O 2.99Å; N197-F240 HydrophobicContact CB-CD1 4.5Å; N197-C483 PolarHBondContact O-SG 3.44Å
198	T	95.7	Very high	95.2	Very high	5 Å²	5	39.3 Å²	39.3	3%	0.031	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	143.8	180	-176.9	0	0	0	0	111.5	S210 G211 Q241 A242	T198-S210 VanDerWaalsContact O-CA 3.29Å; T198-S210 WeakPolarHBondContact O-CA 3.16Å; T198-G211 VanDerWaalsContact CG2-CA 3.49Å; T198-G211 PolarHBondContact O-N 3.43Å; T198-Q241 WeakPolarHBondContact OG1-CA 3.43Å; T198-Q241 WeakPolarHBondContact OG1-CG 3.26Å; T198-A242 HydrophobicContact CG2-CB 3.92Å; T198-A242 PolarHBondContact OG1-N 3.01Å; T198-A242 VanDerWaalsContact OG1-N 3.14Å
199	L	98	Very high	95.3	Very high	11 Å²	11	38 Å²	38	6%	0.058	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	135.4	173.3	-65.2	177.5	0	0	0	107.8	V196 L208 A209 C483 E485 A494 T495 V502	V196-L199 HydrophobicContact CG1-CD2 4.25Å; L199-L208 HydrophobicContact CB-CD1 4.3Å; L199-L208 HydrophobicContact CD2-CD2 4.48Å; L199-A209 WeakPolarHBondContact CA-O 3.41Å; L199-C483 HydrophobicContact CD1-CB 4.31Å; L199-C483 HydrophobicContact CG-CB 4.35Å; L199-E485 HydrophobicContact CB-CB 3.78Å; L199-A494 HydrophobicContact CD1-CB 4.07Å; L199-T495 VanDerWaalsContact CD1-C 3.43Å; L199-V502 HydrophobicContact CD1-CG1 4.01Å; L199-V502 HydrophobicContact CD2-CB 4.18Å; L199-V502 HydrophobicContact CD2-CG1 3.43Å; L199-V502 VanDerWaalsContact CD2-CG1 3.43Å; L199-V502 HydrophobicContact CD2-CG2 3.65Å; L199-V502 HydrophobicContact CG-CG1 4.4Å
200	H	98.1	Very high	95.4	Very high	23 Å²	23	37.8 Å²	37.8	11%	0.106	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	120.6	174.1	-164.4	-97.3	0	0	0	111	A209 A242 K243 F244 E485	H200-A209 PolarHBondContact N-O 3.5Å; H200-A209 PolarHBondContact O-N 3.03Å; H200-A242 WeakPolarHBondContact CB-O 3.46Å; H200-K243 HydrophobicContact CB-CB 4.49Å; H200-K243 HydrophobicContact CB-CG 4.15Å; H200-K243 VanDerWaalsContact CD2-CG 3.48Å; H200-K243 WeakPolarHBondContact CD2-CG 3.48Å; H200-F244 PolarHBondContact ND1-N 3.35Å; H200-E485 WeakPolarHBondContact CA-OE1 3.5Å; H200-E485 IonicContact CD2-OE1 3.65Å; H200-E485 PolarHBondContact CD2-OE1 2.93Å; H200-E485 VanDerWaalsContact CD2-OE1 3.31Å; H200-E485 IonicContact CG-OE1 2.89Å
201	F	98	Very high	95.5	Very high	6 Å²	6	30.5 Å²	30.5	3%	0.026	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	149.8	170.2	-76	-76.6	0	0	0	110.1	W207 L208 W222 E485 P486 H487 P488 V492 A494	F201-W207 CarbonylContact C-O 3.38Å; F201-W207 WeakPolarHBondContact CA-O 3.18Å; F201-L208 HydrophobicContact CD1-CB 4.07Å; F201-L208 HydrophobicContact CD1-CD1 4.06Å; F201-L208 HydrophobicContact CD2-CD1 4.12Å; F201-L208 HydrophobicContact CE1-CB 3.94Å; F201-L208 HydrophobicContact CE1-CD1 4.06Å; F201-L208 HydrophobicContact CE1-CD2 4.35Å; F201-L208 HydrophobicContact CE1-CG 4.35Å; F201-L208 HydrophobicContact CE2-CD1 4.12Å; F201-L208 HydrophobicContact CG-CD1 4.08Å; F201-L208 HydrophobicContact CZ-CD1 4.09Å; F201-L208 HydrophobicContact CZ-CD2 4.29Å; F201-W222 AromaticContact CE1-CD1 3.68Å; F201-W222 HydrophobicContact CE1-CD2 4.34Å; F201-W222 HydrophobicContact CE1-CG 4.09Å; F201-W222 AromaticContact CE1-NE1 3.65Å; F201-E485 HydrophobicContact CD2-CG 3.75Å; F201-E485 HydrophobicContact CE2-CG 4.3Å; F201-E485 WeakPolarHBondContact CE2-O 3.3Å; F201-P486 WeakPolarHBondContact CD2-O 3.31Å; F201-H487 AromaticContact CD1-CD2 3.86Å; F201-H487 HydrophobicContact CD2-CB 4.18Å; F201-H487 AromaticContact CE1-CD2 3.67Å; F201-H487 HydrophobicContact CE2-CB 3.83Å; F201-H487 HydrophobicContact CZ-CB 4.02Å; F201-P488 HydrophobicContact CB-CG 4.34Å; F201-V492 HydrophobicContact CZ-CG1 4.46Å; F201-A494 HydrophobicContact CE2-CB 3.9Å; F201-A494 HydrophobicContact CZ-CB 3.94Å
202	N	95.7	Very high	95.7	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.005	14%	0.138	C	C	.	.			trans	-69.4	163.8	164.4	75.9	-33.8	0	0	0	110	R204 G205 T206 W207 F244 D250	N202-R204 PolarHBondContact O-N 3.4Å; N202-G205 PolarHBondContact O-N 3.14Å; N202-G205 VanDerWaalsContact OD1-C 3.28Å; N202-G205 WeakPolarHBondContact OD1-CA 3.46Å; N202-G205 PolarHBondContact OD1-N 2.84Å; N202-T206 PolarHBondContact ND2-OG1 2.79Å; N202-T206 PolarHBondContact OD1-N 2.89Å; N202-T206 PolarHBondContact OD1-OG1 2.85Å; N202-W207 HydrophobicContact CB-CB 4.48Å; N202-W207 PolarHBondContact N-O 3.47Å; N202-W207 PolarHBondContact OD1-N 2.85Å; N202-W207 PolarHBondContact OD1-O 3.47Å; N202-F244 HydrophobicContact CB-CB 4.46Å; N202-F244 HydrophobicContact CB-CD1 4.28Å; N202-F244 HydrophobicContact CB-CD2 3.65Å; N202-F244 HydrophobicContact CB-CE1 4.45Å; N202-F244 HydrophobicContact CB-CE2 3.84Å; N202-F244 HydrophobicContact CB-CG 3.87Å; N202-F244 HydrophobicContact CB-CZ 4.25Å; N202-D250 WeakPolarHBondContact CB-OD1 3.22Å; N202-D250 PolarHBondContact ND2-OD1 2.85Å; N202-D250 PolarHBondContact ND2-OD2 2.96Å
203	Q	93.5	Very high	95.7	Very high	96 Å²	96	29.3 Å²	29.3	45%	0.449	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-24.7	-175.8	-171.6	179.3	0.5	0	0	113.2	N247 H489	Q203-N247 PolarHBondContact NE2-OD1 2.94Å; Q203-N247 PolarHBondContact OE1-OD1 2.98Å; Q203-H489 PolarHBondContact O-NE2 3.16Å
204	R	93.6	Very high	95.7	Very high	176 Å²	176	25.8 Å²	25.8	66%	0.664	12%	0.122	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-13.7	176.3	-57.1	176.3	64.7	177.6	0.6	113.8	N202 T206	N202-R204 PolarHBondContact O-N 3.4Å; R204-T206 HydrophobicContact CB-CG2 4.12Å; R204-T206 PolarHBondContact O-N 2.94Å
205	G	95.4	Very high	95.9	Very high	2 Å²	2	27.8 Å²	27.8	2%	0.021	13%	0.13	C	C	.	.	S	Bend	trans	71.7	0.9	-172.3	0	0	0	0	0	115.2	N202 W207 W222 H487	N202-G205 PolarHBondContact O-N 3.14Å; N202-G205 VanDerWaalsContact OD1-C 3.28Å; N202-G205 WeakPolarHBondContact OD1-CA 3.46Å; N202-G205 PolarHBondContact OD1-N 2.84Å; G205-W207 VanDerWaalsContact C-N 3.35Å; G205-W207 PolarHBondContact O-N 2.88Å; G205-W222 PolarHBondContact O-NE1 3.46Å; G205-H487 VanDerWaalsContact CA-NE2 3.35Å; G205-H487 WeakPolarHBondContact CA-NE2 3.25Å; G205-H487 PolarHBondContact O-NE2 3.45Å
206	T	95.1	Very high	96.2	Very high	60 Å²	60	29.9 Å²	29.9	37%	0.368	14%	0.138	S	C	.	.	S	Bend	trans	-71.1	-29.7	-178.6	54.1	0	0	0	0	113.3	N202 R204	N202-T206 PolarHBondContact ND2-OG1 2.79Å; N202-T206 PolarHBondContact OD1-N 2.89Å; N202-T206 PolarHBondContact OD1-OG1 2.85Å; R204-T206 HydrophobicContact CB-CG2 4.12Å; R204-T206 PolarHBondContact O-N 2.94Å
207	W	96.4	Very high	96.3	Very high	56 Å²	56	29.9 Å²	29.9	21%	0.212	14%	0.138	C	C	.	.			trans	-126.8	149.8	-177.8	-66.6	-24.6	0	0	0	111.5	F201 N202 G205 V219 W220 V228 F244 D250	F201-W207 CarbonylContact C-O 3.38Å; F201-W207 WeakPolarHBondContact CA-O 3.18Å; N202-W207 HydrophobicContact CB-CB 4.48Å; N202-W207 PolarHBondContact N-O 3.47Å; N202-W207 PolarHBondContact OD1-N 2.85Å; N202-W207 PolarHBondContact OD1-O 3.47Å; G205-W207 VanDerWaalsContact C-N 3.35Å; G205-W207 PolarHBondContact O-N 2.88Å; W207-V219 HydrophobicContact CB-CG1 3.85Å; W207-V219 HydrophobicContact CD2-CG1 4.27Å; W207-V219 HydrophobicContact CE3-CG1 4.31Å; W207-V219 HydrophobicContact CG-CG1 4.11Å; W207-W220 VanDerWaalsContact CA-O 3.31Å; W207-W220 WeakPolarHBondContact CA-O 3.4Å; W207-V228 HydrophobicContact CZ2-CG1 4.17Å; W207-F244 HydrophobicContact CB-CZ 4.36Å; W207-D250 HydrophobicContact CE3-CB 4.11Å; W207-D250 HydrophobicContact CZ3-CB 3.93Å
208	L	98.1	Very high	96.5	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	126.5	174.8	178.5	60.4	0	0	0	108.2	L189 L199 F201 V219 W220 W222 A494 V502 I504	L189-L208 HydrophobicContact CD1-CD2 4.28Å; L199-L208 HydrophobicContact CB-CD1 4.3Å; L199-L208 HydrophobicContact CD2-CD2 4.48Å; F201-L208 HydrophobicContact CD1-CB 4.07Å; F201-L208 HydrophobicContact CD1-CD1 4.06Å; F201-L208 HydrophobicContact CD2-CD1 4.12Å; F201-L208 HydrophobicContact CE1-CB 3.94Å; F201-L208 HydrophobicContact CE1-CD1 4.06Å; F201-L208 HydrophobicContact CE1-CD2 4.35Å; F201-L208 HydrophobicContact CE1-CG 4.35Å; F201-L208 HydrophobicContact CE2-CD1 4.12Å; F201-L208 HydrophobicContact CG-CD1 4.08Å; F201-L208 HydrophobicContact CZ-CD1 4.09Å; F201-L208 HydrophobicContact CZ-CD2 4.29Å; L208-V219 CarbonylContact O-C 3.58Å; L208-V219 WeakPolarHBondContact O-CA 3.34Å; L208-W220 HydrophobicContact CB-CB 4.46Å; L208-W220 PolarHBondContact N-O 3.12Å; L208-W220 VanDerWaalsContact N-O 3.13Å; L208-W220 VanDerWaalsContact O-CD1 3.28Å; L208-W220 PolarHBondContact O-N 3.46Å; L208-W222 HydrophobicContact CB-CB 4.38Å; L208-A494 HydrophobicContact CD1-CB 4.3Å; L208-A494 HydrophobicContact CD2-CB 3.73Å; L208-V502 HydrophobicContact CD2-CG1 3.81Å; L208-I504 HydrophobicContact CD2-CD1 3.87Å
209	A	98.1	Very high	96.6	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	140.1	169.1	0	0	0	0	0	110	L199 H200 V218 V219 F244 L253	L199-A209 WeakPolarHBondContact CA-O 3.41Å; H200-A209 PolarHBondContact N-O 3.5Å; H200-A209 PolarHBondContact O-N 3.03Å; A209-V218 CarbonylContact C-O 3.59Å; A209-V218 WeakPolarHBondContact CA-O 3.47Å; A209-V219 HydrophobicContact CB-CG2 4.31Å; A209-F244 HydrophobicContact CB-CD2 4.26Å; A209-F244 HydrophobicContact CB-CE2 3.59Å; A209-F244 HydrophobicContact CB-CZ 4.06Å; A209-L253 HydrophobicContact CB-CD2 4.07Å
210	S	98.3	Very high	96.6	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	151.6	169.1	64.9	0	0	0	0	111.5	H192 T198 V217 V218 W220	H192-S210 PolarHBondContact CD2-OG 3.21Å; H192-S210 PolarHBondContact NE2-OG 2.96Å; T198-S210 VanDerWaalsContact O-CA 3.29Å; T198-S210 WeakPolarHBondContact O-CA 3.16Å; S210-V217 CarbonylContact O-C 3.53Å; S210-V217 VanDerWaalsContact O-CA 3.26Å; S210-V217 WeakPolarHBondContact O-CA 3.18Å; S210-V217 WeakPolarHBondContact O-CG1 3.34Å; S210-V218 PolarHBondContact N-O 2.79Å; S210-V218 PolarHBondContact O-N 2.87Å; S210-W220 PolarHBondContact OG-NE1 2.9Å
211	G	97.3	Very high	96.5	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	149.1	178.5	0	0	0	0	0	111	N197 T198	N197-G211 PolarHBondContact N-O 3.39Å; T198-G211 VanDerWaalsContact CG2-CA 3.49Å; T198-G211 PolarHBondContact O-N 3.43Å
212	S	96.4	Very high	96.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	169.2	-161.6	177.4	0	0	0	0	114.2	H192 G194 C195 D214 L215 K216 V239	H192-S212 WeakPolarHBondContact ND1-CB 3.3Å; G194-S212 WeakPolarHBondContact CA-OG 3.4Å; G194-S212 PolarHBondContact O-OG 3.29Å; G194-S212 VanDerWaalsContact O-OG 3.13Å; C195-S212 WeakPolarHBondContact O-CA 3.42Å; C195-S212 VanDerWaalsContact O-CB 3.25Å; C195-S212 WeakPolarHBondContact O-CB 3.46Å; C195-S212 PolarHBondContact O-OG 3.22Å; S212-D214 VanDerWaalsContact CB-OD1 3.3Å; S212-D214 WeakPolarHBondContact CB-OD1 3.44Å; S212-D214 PolarHBondContact O-N 3.41Å; S212-D214 PolarHBondContact OG-N 2.91Å; S212-L215 PolarHBondContact O-N 2.86Å; S212-K216 PolarHBondContact N-O 2.92Å; S212-V239 PolarHBondContact O-N 3.45Å; S212-V239 VanDerWaalsContact O-N 3.17Å
213	D	94.7	Very high	96.5	Very high	29 Å²	29	33 Å²	33	16%	0.155	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-21.1	165.8	-71.4	5.8	0	0	0	113.5	C195 N197 L215 N238	C195-D213 PolarHBondContact O-N 2.95Å; C195-D213 VanDerWaalsContact O-N 3.08Å; N197-D213 PolarHBondContact ND2-OD1 3.38Å; D213-L215 PolarHBondContact O-N 3.19Å; D213-N238 WeakPolarHBondContact OD1-CB 3.17Å; D213-N238 VanDerWaalsContact OD1-CG 3.28Å; D213-N238 PolarHBondContact OD1-ND2 2.88Å; D213-N238 PolarHBondContact OD2-ND2 2.71Å
214	D	95.7	Very high	96.6	Very high	27 Å²	27	37.5 Å²	37.5	14%	0.144	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	5.3	175.8	67.8	16.1	0	0	0	114.7	H192 T193 S212 K216	H192-D214 VanDerWaalsContact CA-OD2 3.26Å; H192-D214 WeakPolarHBondContact CA-OD2 3.49Å; H192-D214 WeakPolarHBondContact CB-OD2 3.33Å; H192-D214 IonicContact CE1-OD1 3.75Å; H192-D214 IonicContact CG-OD2 3.28Å; H192-D214 IonicContact ND1-OD1 2.66Å; H192-D214 PolarHBondContact ND1-OD1 2.95Å; H192-D214 IonicContact ND1-OD2 2.82Å; H192-D214 PolarHBondContact ND1-OD2 3.29Å; T193-D214 PolarHBondContact N-OD2 2.92Å; T193-D214 VanDerWaalsContact OG1-CB 3.28Å; T193-D214 WeakPolarHBondContact OG1-CB 3.46Å; S212-D214 VanDerWaalsContact CB-OD1 3.3Å; S212-D214 WeakPolarHBondContact CB-OD1 3.44Å; S212-D214 PolarHBondContact O-N 3.41Å; S212-D214 PolarHBondContact OG-N 2.91Å; D214-K216 PolarHBondContact O-N 3.19Å; D214-K216 WeakPolarHBondContact OD1-CB 3.36Å; D214-K216 PolarHBondContact OD1-N 3.32Å
215	L	96.4	Very high	96.7	Very high	50 Å²	50	35.3 Å²	35.3	26%	0.262	16%	0.162	S	C	.	.	S	Bend	trans	69.4	1.9	179.4	-44.5	-178.5	0	0	0	115.1	S212 D213 S233 S237	S212-L215 PolarHBondContact O-N 2.86Å; D213-L215 PolarHBondContact O-N 3.19Å; L215-S233 WeakPolarHBondContact O-CB 3.35Å; L215-S233 PolarHBondContact O-N 2.9Å; L215-S233 VanDerWaalsContact O-N 3.08Å; L215-S233 PolarHBondContact O-OG 3.42Å; L215-S237 VanDerWaalsContact CD2-O 3.31Å; L215-S237 WeakPolarHBondContact CD2-O 3.1Å
216	K	96.9	Very high	96.6	Very high	52 Å²	52	40.9 Å²	40.9	23%	0.226	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	161.5	177.3	-69.6	160.6	157	-86	0	112.4	S212 D214 D230 F231 E232	S212-K216 PolarHBondContact N-O 2.92Å; D214-K216 PolarHBondContact O-N 3.19Å; D214-K216 WeakPolarHBondContact OD1-CB 3.36Å; D214-K216 PolarHBondContact OD1-N 3.32Å; K216-D230 IonicContact NZ-OD1 2.7Å; K216-D230 PolarHBondContact NZ-OD1 3.4Å; K216-D230 IonicContact NZ-OD2 3.04Å; K216-D230 PolarHBondContact NZ-OD2 3.16Å; K216-F231 WeakPolarHBondContact CA-O 3.31Å; K216-E232 VanDerWaalsContact CE-OE1 3.23Å; K216-E232 WeakPolarHBondContact CE-OE1 3.33Å; K216-E232 IonicContact NZ-OE1 3.73Å
217	V	97.9	Very high	96.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	131.4	162.1	168.2	0	0	0	0	108.5	S210 F231 V239 A242 L253 M255	S210-V217 CarbonylContact O-C 3.53Å; S210-V217 VanDerWaalsContact O-CA 3.26Å; S210-V217 WeakPolarHBondContact O-CA 3.18Å; S210-V217 WeakPolarHBondContact O-CG1 3.34Å; V217-F231 HydrophobicContact CB-CE1 3.91Å; V217-F231 HydrophobicContact CB-CE2 4.1Å; V217-F231 HydrophobicContact CB-CZ 3.65Å; V217-F231 HydrophobicContact CG1-CE1 3.7Å; V217-F231 HydrophobicContact CG1-CZ 3.62Å; V217-F231 PolarHBondContact N-O 3.32Å; V217-F231 WeakPolarHBondContact O-CD1 3.4Å; V217-F231 PolarHBondContact O-N 3.2Å; V217-F231 VanDerWaalsContact O-N 3.1Å; V217-V239 HydrophobicContact CG2-CG1 4.15Å; V217-A242 HydrophobicContact CG1-CB 4.17Å; V217-A242 HydrophobicContact CG2-CB 3.88Å; V217-L253 HydrophobicContact CG1-CD1 4.03Å; V217-M255 HydrophobicContact CB-SD 4.42Å; V217-M255 HydrophobicContact CG2-SD 3.72Å
218	V	97.6	Very high	96.6	Very high	4 Å²	4	40.1 Å²	40.1	2%	0.024	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	133.9	177.3	-176.4	0	0	0	0	108.6	A209 S210 W220 P227 L229 D230	A209-V218 CarbonylContact C-O 3.59Å; A209-V218 WeakPolarHBondContact CA-O 3.47Å; S210-V218 PolarHBondContact N-O 2.79Å; S210-V218 PolarHBondContact O-N 2.87Å; V218-W220 HydrophobicContact CB-CZ2 3.95Å; V218-W220 HydrophobicContact CG1-CD2 3.79Å; V218-W220 HydrophobicContact CG1-CE3 4.23Å; V218-W220 HydrophobicContact CG1-CG 4.37Å; V218-W220 HydrophobicContact CG1-CH2 3.93Å; V218-W220 HydrophobicContact CG1-CZ2 3.46Å; V218-W220 VanDerWaalsContact CG1-CZ2 3.46Å; V218-W220 HydrophobicContact CG1-CZ3 4.29Å; V218-W220 HydrophobicContact CG2-CZ2 4.5Å; V218-P227 HydrophobicContact CG1-CB 3.82Å; V218-L229 CarbonylContact C-O 3.53Å; V218-L229 VanDerWaalsContact CA-O 3.25Å; V218-L229 WeakPolarHBondContact CA-O 3.4Å; V218-L229 VanDerWaalsContact CG1-O 3.29Å; V218-L229 WeakPolarHBondContact CG1-O 3.48Å; V218-D230 HydrophobicContact CG2-CB 4.33Å
219	V	97.5	Very high	96.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	129	170.7	179.6	0	0	0	0	108.4	W207 L208 A209 V228 L229 F244 L253	W207-V219 HydrophobicContact CB-CG1 3.85Å; W207-V219 HydrophobicContact CD2-CG1 4.27Å; W207-V219 HydrophobicContact CE3-CG1 4.31Å; W207-V219 HydrophobicContact CG-CG1 4.11Å; L208-V219 CarbonylContact O-C 3.58Å; L208-V219 WeakPolarHBondContact O-CA 3.34Å; A209-V219 HydrophobicContact CB-CG2 4.31Å; V219-V228 WeakPolarHBondContact O-CA 3.47Å; V219-V228 PolarHBondContact O-N 3.03Å; V219-L229 HydrophobicContact CB-CB 3.93Å; V219-L229 HydrophobicContact CB-CD1 3.98Å; V219-L229 HydrophobicContact CB-CG 4.23Å; V219-L229 HydrophobicContact CG2-CB 4.21Å; V219-L229 HydrophobicContact CG2-CD1 3.83Å; V219-L229 PolarHBondContact N-O 2.67Å; V219-L229 PolarHBondContact O-N 2.97Å; V219-L229 VanDerWaalsContact O-N 3.11Å; V219-F244 HydrophobicContact CG1-CZ 3.82Å; V219-F244 HydrophobicContact CG2-CZ 4.08Å; V219-L253 HydrophobicContact CG2-CD1 4.04Å
220	W	97.6	Very high	96.2	Very high	4 Å²	4	44.9 Å²	44.9	2%	0.015	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	138.5	-171.4	-53.3	91.4	0	0	0	112.3	L189 E190 W207 L208 S210 V218 W222 Q226 P227	L189-W220 HydrophobicContact CB-CD2 4.03Å; L189-W220 HydrophobicContact CB-CE3 3.91Å; L189-W220 HydrophobicContact CB-CH2 4.15Å; L189-W220 HydrophobicContact CB-CZ2 4.26Å; L189-W220 HydrophobicContact CB-CZ3 3.98Å; L189-W220 HydrophobicContact CD1-CB 3.99Å; L189-W220 HydrophobicContact CD1-CD2 4.01Å; L189-W220 HydrophobicContact CD1-CE3 4.38Å; L189-W220 HydrophobicContact CD1-CG 3.84Å; E190-W220 WeakPolarHBondContact O-CH2 3.05Å; W207-W220 VanDerWaalsContact CA-O 3.31Å; W207-W220 WeakPolarHBondContact CA-O 3.4Å; L208-W220 HydrophobicContact CB-CB 4.46Å; L208-W220 PolarHBondContact N-O 3.12Å; L208-W220 VanDerWaalsContact N-O 3.13Å; L208-W220 VanDerWaalsContact O-CD1 3.28Å; L208-W220 PolarHBondContact O-N 3.46Å; S210-W220 PolarHBondContact OG-NE1 2.9Å; V218-W220 HydrophobicContact CB-CZ2 3.95Å; V218-W220 HydrophobicContact CG1-CD2 3.79Å; V218-W220 HydrophobicContact CG1-CE3 4.23Å; V218-W220 HydrophobicContact CG1-CG 4.37Å; V218-W220 HydrophobicContact CG1-CH2 3.93Å; V218-W220 HydrophobicContact CG1-CZ2 3.46Å; V218-W220 VanDerWaalsContact CG1-CZ2 3.46Å; V218-W220 HydrophobicContact CG1-CZ3 4.29Å; V218-W220 HydrophobicContact CG2-CZ2 4.5Å; W220-W222 VanDerWaalsContact C-N 3.32Å; W220-W222 PolarHBondContact O-N 3.14Å; W220-Q226 WeakPolarHBondContact CA-O 3.3Å; W220-P227 HydrophobicContact CE3-CB 4.18Å; W220-P227 HydrophobicContact CZ3-CB 4.13Å; W220-P227 HydrophobicContact CZ3-CG 4.45Å
221	D	96.6	Very high	96.1	Very high	19 Å²	19	45.7 Å²	45.7	10%	0.102	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	89.6	149.1	-174.8	-31	0	0	0	106.2	V223 R224 R225 Q226 V228	D221-V223 PolarHBondContact O-N 3.16Å; D221-V223 PolarHBondContact OD1-N 2.79Å; D221-R224 HydrophobicContact CB-CB 4.18Å; D221-R224 PolarHBondContact O-N 2.73Å; D221-R224 WeakPolarHBondContact OD1-CB 3.36Å; D221-R224 WeakPolarHBondContact OD1-CG 3.33Å; D221-R224 PolarHBondContact OD1-N 2.64Å; D221-R224 WeakPolarHBondContact OD2-CD 3.48Å; D221-R224 WeakPolarHBondContact OD2-CG 3.26Å; D221-R224 IonicContact OD2-CZ 2.73Å; D221-R224 IonicContact OD2-NE 2.96Å; D221-R224 IonicContact OD2-NH1 2.64Å; D221-R224 PolarHBondContact OD2-NH1 3.37Å; D221-R225 PolarHBondContact O-N 3.35Å; D221-Q226 PolarHBondContact N-O 2.94Å; D221-Q226 PolarHBondContact O-N 3.47Å; D221-V228 HydrophobicContact CB-CG2 3.7Å
222	W	96.6	Very high	96.1	Very high	25 Å²	25	51 Å²	51	10%	0.095	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-19.9	-173.8	67.1	-92.9	0	0	0	113	H187 L189 F201 G205 L208 W220 H487 L490 V492 I504	H187-W222 PolarHBondContact NE2-O 2.9Å; L189-W222 HydrophobicContact CD1-CB 4.08Å; F201-W222 AromaticContact CE1-CD1 3.68Å; F201-W222 HydrophobicContact CE1-CD2 4.34Å; F201-W222 HydrophobicContact CE1-CG 4.09Å; F201-W222 AromaticContact CE1-NE1 3.65Å; G205-W222 PolarHBondContact O-NE1 3.46Å; L208-W222 HydrophobicContact CB-CB 4.38Å; W220-W222 VanDerWaalsContact C-N 3.32Å; W220-W222 PolarHBondContact O-N 3.14Å; W222-H487 AromaticContact CE2-CD2 3.98Å; W222-H487 AromaticContact CZ2-CD2 3.59Å; W222-H487 AromaticContact CZ2-NE2 3.64Å; W222-L490 HydrophobicContact CH2-CD1 4.22Å; W222-L490 HydrophobicContact CZ2-CD1 4.17Å; W222-V492 HydrophobicContact CH2-CG1 4.34Å; W222-V492 HydrophobicContact CH2-CG2 3.98Å; W222-V492 HydrophobicContact CZ3-CG1 4.17Å; W222-V492 HydrophobicContact CZ3-CG2 4.22Å; W222-I504 HydrophobicContact CB-CD1 4.38Å; W222-I504 HydrophobicContact CE3-CG2 4.03Å; W222-I504 HydrophobicContact CZ3-CG2 4.3Å
223	V	95.9	Very high	96.2	Very high	93 Å²	93	51 Å²	51	56%	0.564	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-48.2	175.5	-177.3	0	0	0	0	109.9	D221 R225	D221-V223 PolarHBondContact O-N 3.16Å; D221-V223 PolarHBondContact OD1-N 2.79Å; V223-R225 VanDerWaalsContact C-N 3.25Å; V223-R225 PolarHBondContact O-N 3.12Å
224	R	95.8	Very high	96.3	Very high	190 Å²	190	51.1 Å²	51.1	72%	0.717	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-10.9	176.5	-65	-172	-178.8	128.8	-13.4	113.8	D221 Q226	D221-R224 HydrophobicContact CB-CB 4.18Å; D221-R224 PolarHBondContact O-N 2.73Å; D221-R224 WeakPolarHBondContact OD1-CB 3.36Å; D221-R224 WeakPolarHBondContact OD1-CG 3.33Å; D221-R224 PolarHBondContact OD1-N 2.64Å; D221-R224 WeakPolarHBondContact OD2-CD 3.48Å; D221-R224 WeakPolarHBondContact OD2-CG 3.26Å; D221-R224 IonicContact OD2-CZ 2.73Å; D221-R224 IonicContact OD2-NE 2.96Å; D221-R224 IonicContact OD2-NH1 2.64Å; D221-R224 PolarHBondContact OD2-NH1 3.37Å; R224-Q226 HydrophobicContact CB-CG 4.43Å
225	R	96	Very high	96.4	Very high	130 Å²	130	50.2 Å²	50.2	49%	0.491	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.4	41.9	-176.8	-48.4	176.5	177.3	178.7	-6.6	112.2	Q186 H187 L189 D221 V223	Q186-R225 PolarHBondContact O-NH2 2.73Å; H187-R225 VanDerWaalsContact CB-CZ 3.45Å; H187-R225 VanDerWaalsContact ND1-CZ 3.33Å; H187-R225 PolarHBondContact ND1-NE 3.06Å; H187-R225 PolarHBondContact ND1-NH2 2.83Å; L189-R225 HydrophobicContact CD2-CB 4.05Å; L189-R225 HydrophobicContact CD2-CG 4.37Å; D221-R225 PolarHBondContact O-N 3.35Å; V223-R225 VanDerWaalsContact C-N 3.25Å; V223-R225 PolarHBondContact O-N 3.12Å
226	Q	94.6	Very high	96.4	Very high	119 Å²	119	56.2 Å²	56.2	56%	0.556	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.9	142.1	-176.2	-68.1	-64.4	-72.1	0	0	111.5	W220 D221 R224	W220-Q226 WeakPolarHBondContact CA-O 3.3Å; D221-Q226 PolarHBondContact N-O 2.94Å; D221-Q226 PolarHBondContact O-N 3.47Å; R224-Q226 HydrophobicContact CB-CG 4.43Å
227	P	95.6	Very high	96.3	Very high	71 Å²	71	55.2 Å²	55.2	46%	0.461	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	130.5	166.3	30.7	-32.8	0	0	0	109.5	V218 W220	V218-P227 HydrophobicContact CG1-CB 3.82Å; W220-P227 HydrophobicContact CE3-CB 4.18Å; W220-P227 HydrophobicContact CZ3-CB 4.13Å; W220-P227 HydrophobicContact CZ3-CG 4.45Å
228	V	94.1	Very high	96.1	Very high	29 Å²	29	56.2 Å²	56.2	18%	0.176	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	-32.4	170.7	177.5	0	0	0	0	110.1	W207 V219 D221 Q271	W207-V228 HydrophobicContact CZ2-CG1 4.17Å; V219-V228 WeakPolarHBondContact O-CA 3.47Å; V219-V228 PolarHBondContact O-N 3.03Å; D221-V228 HydrophobicContact CB-CG2 3.7Å; V228-Q271 HydrophobicContact CG1-CB 4.22Å; V228-Q271 VanDerWaalsContact CG1-CD 3.43Å; V228-Q271 HydrophobicContact CG1-CG 3.83Å
229	L	94.6	Very high	96	Very high	12 Å²	12	56 Å²	56	6%	0.063	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	140	173.7	-61.7	167.8	0	0	0	109.5	V218 V219 F231 L267 Q271	V218-L229 CarbonylContact C-O 3.53Å; V218-L229 VanDerWaalsContact CA-O 3.25Å; V218-L229 WeakPolarHBondContact CA-O 3.4Å; V218-L229 VanDerWaalsContact CG1-O 3.29Å; V218-L229 WeakPolarHBondContact CG1-O 3.48Å; V219-L229 HydrophobicContact CB-CB 3.93Å; V219-L229 HydrophobicContact CB-CD1 3.98Å; V219-L229 HydrophobicContact CB-CG 4.23Å; V219-L229 HydrophobicContact CG2-CB 4.21Å; V219-L229 HydrophobicContact CG2-CD1 3.83Å; V219-L229 PolarHBondContact N-O 2.67Å; V219-L229 PolarHBondContact O-N 2.97Å; V219-L229 VanDerWaalsContact O-N 3.11Å; L229-F231 HydrophobicContact CB-CD1 4.32Å; L229-L267 HydrophobicContact CD1-CD1 3.72Å; L229-L267 HydrophobicContact CD1-CD2 3.9Å; L229-L267 HydrophobicContact CD1-CG 4.26Å; L229-Q271 HydrophobicContact CD2-CB 4.13Å; L229-Q271 WeakPolarHBondContact CD2-O 2.95Å
230	D	94.9	Very high	96	Very high	89 Å²	89	57.9 Å²	57.9	48%	0.476	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	124.5	159.2	170.4	9.7	0	0	0	106.4	K216 V218	K216-D230 IonicContact NZ-OD1 2.7Å; K216-D230 PolarHBondContact NZ-OD1 3.4Å; K216-D230 IonicContact NZ-OD2 3.04Å; K216-D230 PolarHBondContact NZ-OD2 3.16Å; V218-D230 HydrophobicContact CG2-CB 4.33Å
231	F	96.3	Very high	95.9	Very high	17 Å²	17	58.6 Å²	58.6	8%	0.075	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	150.5	178.1	67.5	-85.2	0	0	0	113.2	K216 V217 L229 S233 L253 M255 A265 L267 C273 T276	K216-F231 WeakPolarHBondContact CA-O 3.31Å; V217-F231 HydrophobicContact CB-CE1 3.91Å; V217-F231 HydrophobicContact CB-CE2 4.1Å; V217-F231 HydrophobicContact CB-CZ 3.65Å; V217-F231 HydrophobicContact CG1-CE1 3.7Å; V217-F231 HydrophobicContact CG1-CZ 3.62Å; V217-F231 PolarHBondContact N-O 3.32Å; V217-F231 WeakPolarHBondContact O-CD1 3.4Å; V217-F231 PolarHBondContact O-N 3.2Å; V217-F231 VanDerWaalsContact O-N 3.1Å; L229-F231 HydrophobicContact CB-CD1 4.32Å; F231-S233 PolarHBondContact O-N 3.19Å; F231-L253 HydrophobicContact CE1-CD1 4.03Å; F231-L253 HydrophobicContact CZ-CD1 3.79Å; F231-M255 HydrophobicContact CE2-CE 4.41Å; F231-M255 HydrophobicContact CE2-SD 4.09Å; F231-M255 HydrophobicContact CZ-SD 4.3Å; F231-A265 HydrophobicContact CE2-CB 3.73Å; F231-A265 HydrophobicContact CZ-CB 3.91Å; F231-L267 HydrophobicContact CE1-CD2 4.1Å; F231-L267 HydrophobicContact CZ-CD2 4.31Å; F231-C273 HydrophobicContact CB-CB 3.67Å; F231-C273 HydrophobicContact CD1-CB 3.93Å; F231-C273 HydrophobicContact CD2-CB 3.78Å; F231-C273 HydrophobicContact CE2-CB 4.4Å; F231-C273 HydrophobicContact CG-CB 3.52Å; F231-T276 HydrophobicContact CD2-CG2 4.21Å; F231-T276 HydrophobicContact CE2-CG2 4.09Å
232	E	97	Very high	96	Very high	110 Å²	110	57.7 Å²	57.7	51%	0.514	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	119	171	-64.5	-58.8	146.6	0	0	110.3	K216 G234	K216-E232 VanDerWaalsContact CE-OE1 3.23Å; K216-E232 WeakPolarHBondContact CE-OE1 3.33Å; K216-E232 IonicContact NZ-OE1 3.73Å; E232-G234 PolarHBondContact O-N 3.26Å; E232-G234 VanDerWaalsContact O-N 3.16Å
233	S	97	Very high	96.1	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.281	C	S	.	.			trans	-65.8	-20.2	-178.3	69.8	0	0	0	0	113.3	L215 F231 H235 V239 M255 R263 T276	L215-S233 WeakPolarHBondContact O-CB 3.35Å; L215-S233 PolarHBondContact O-N 2.9Å; L215-S233 VanDerWaalsContact O-N 3.08Å; L215-S233 PolarHBondContact O-OG 3.42Å; F231-S233 PolarHBondContact O-N 3.19Å; S233-H235 PolarHBondContact O-N 3.24Å; S233-H235 WeakPolarHBondContact OG-CB 3.23Å; S233-H235 PolarHBondContact OG-CD2 2.8Å; S233-H235 PolarHBondContact OG-N 3.13Å; S233-H235 VanDerWaalsContact OG-N 3.16Å; S233-V239 WeakPolarHBondContact OG-CG2 3.29Å; S233-M255 WeakPolarHBondContact O-CE 3.36Å; S233-R263 WeakPolarHBondContact O-CD 3.33Å; S233-R263 PolarHBondContact O-NE 2.87Å; S233-T276 WeakPolarHBondContact O-CB 3.32Å; S233-T276 PolarHBondContact O-OG1 3.25Å
234	G	97.1	Very high	96.1	Very high	32 Å²	32	53.3 Å²	53.3	33%	0.33	26%	0.255	S	S	.	.			trans	75	8	-171.8	0	0	0	0	0	114.2	E232 R263	E232-G234 PolarHBondContact O-N 3.26Å; E232-G234 VanDerWaalsContact O-N 3.16Å; G234-R263 PolarHBondContact O-NE 2.72Å; G234-R263 PolarHBondContact O-NH1 2.81Å
235	H	97.6	Very high	96.2	Very high	8 Å²	8	44.3 Å²	44.3	4%	0.037	22%	0.222	C	C	.	.			trans	-75.8	156.7	165.7	-70.9	-74.7	0	0	0	111.2	S233 V239 A257 D259 Q261 R263	S233-H235 PolarHBondContact O-N 3.24Å; S233-H235 WeakPolarHBondContact OG-CB 3.23Å; S233-H235 PolarHBondContact OG-CD2 2.8Å; S233-H235 PolarHBondContact OG-N 3.13Å; S233-H235 VanDerWaalsContact OG-N 3.16Å; H235-V239 HydrophobicContact CB-CG2 4.47Å; H235-A257 HydrophobicContact CB-CB 3.87Å; H235-A257 VanDerWaalsContact CG-CB 3.43Å; H235-A257 WeakPolarHBondContact ND1-CB 3.31Å; H235-D259 WeakPolarHBondContact CA-OD2 3.34Å; H235-D259 IonicContact CE1-OD1 2.74Å; H235-D259 IonicContact ND1-OD1 3.58Å; H235-D259 PolarHBondContact ND1-OD1 2.97Å; H235-D259 VanDerWaalsContact ND1-OD1 3.07Å; H235-D259 IonicContact ND1-OD2 2.97Å; H235-Q261 PolarHBondContact CE1-O 2.66Å; H235-R263 VanDerWaalsContact CE1-CD 3.46Å; H235-R263 WeakPolarHBondContact CE1-CD 3.3Å; H235-R263 VanDerWaalsContact CE1-CG 3.49Å; H235-R263 WeakPolarHBondContact CE1-CG 3.49Å
236	K	96.1	Very high	96	Very high	176 Å²	176	38.9 Å²	38.9	77%	0.765	20%	0.203	S	C	*	.	S	Bend	trans	-104	0	179.6	-61.1	-175.3	177.7	-173.9	0	113.7	D259	K236-D259 HydrophobicContact CB-CB 4.36Å; K236-D259 PolarHBondContact N-OD2 3.44Å
237	S	95.6	Very high	95.8	Very high	32 Å²	32	37 Å²	37	22%	0.224	20%	0.197	C	C	.	.	S	Bend	trans	-156	172.5	179.9	-164.3	0	0	0	0	109.1	L215 V239	L215-S237 VanDerWaalsContact CD2-O 3.31Å; L215-S237 WeakPolarHBondContact CD2-O 3.1Å; S237-V239 PolarHBondContact O-N 2.83Å
238	N	93.6	Very high	95.4	Very high	20 Å²	20	34.4 Å²	34.4	11%	0.107	18%	0.18	C	C	.	.			trans	-42.3	124.3	-168	-49	35.7	0	0	0	112.5	D213 F240 A257 R258	D213-N238 WeakPolarHBondContact OD1-CB 3.17Å; D213-N238 VanDerWaalsContact OD1-CG 3.28Å; D213-N238 PolarHBondContact OD1-ND2 2.88Å; D213-N238 PolarHBondContact OD2-ND2 2.71Å; N238-F240 HydrophobicContact CB-CD1 4.12Å; N238-F240 HydrophobicContact CB-CE1 3.81Å; N238-F240 PolarHBondContact O-N 3.29Å; N238-A257 WeakPolarHBondContact O-CA 3.27Å; N238-A257 VanDerWaalsContact O-CB 3.24Å; N238-A257 WeakPolarHBondContact O-CB 3.33Å; N238-R258 HydrophobicContact CB-CB 4.36Å; N238-R258 PolarHBondContact O-N 3.42Å
239	V	96.8	Very high	95.1	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	115.3	174.4	-176.6	0	0	0	0	107.6	N197 S212 V217 S233 H235 S237	N197-V239 WeakPolarHBondContact CB-O 3.32Å; N197-V239 PolarHBondContact ND2-O 2.99Å; S212-V239 PolarHBondContact O-N 3.45Å; S212-V239 VanDerWaalsContact O-N 3.17Å; V217-V239 HydrophobicContact CG2-CG1 4.15Å; S233-V239 WeakPolarHBondContact OG-CG2 3.29Å; H235-V239 HydrophobicContact CB-CG2 4.47Å; S237-V239 PolarHBondContact O-N 2.83Å
240	F	95.6	Very high	94.8	Very high	40 Å²	40	36.6 Å²	36.6	18%	0.175	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	-26.9	-177.3	-73.8	-18.6	0	0	0	112.4	N197 N238 C256 R258 A285 H287	N197-F240 HydrophobicContact CB-CD1 4.5Å; N238-F240 HydrophobicContact CB-CD1 4.12Å; N238-F240 HydrophobicContact CB-CE1 3.81Å; N238-F240 PolarHBondContact O-N 3.29Å; F240-C256 PolarHBondContact N-O 2.93Å; F240-R258 HydrophobicContact CD2-CB 4.25Å; F240-R258 HydrophobicContact CE1-CB 4.19Å; F240-R258 HydrophobicContact CE2-CB 3.64Å; F240-R258 HydrophobicContact CE2-CG 4.01Å; F240-R258 HydrophobicContact CZ-CB 3.61Å; F240-R258 HydrophobicContact CZ-CG 3.87Å; F240-A285 HydrophobicContact CE2-CB 3.95Å; F240-H287 AromaticContact CD2-ND1 3.71Å; F240-H287 AromaticContact CE2-CE1 3.61Å; F240-H287 AromaticContact CE2-ND1 3.6Å
241	Q	97.1	Very high	94.7	Very high	19 Å²	19	34.6 Å²	34.6	9%	0.089	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	146.4	168.3	-136.9	172.1	53.4	0	0	113.6	T198 K243 M255 C256 K288 L289	T198-Q241 WeakPolarHBondContact OG1-CA 3.43Å; T198-Q241 WeakPolarHBondContact OG1-CG 3.26Å; Q241-K243 HydrophobicContact CG-CD 4.43Å; Q241-K243 HydrophobicContact CG-CG 4.06Å; Q241-K243 VanDerWaalsContact OE1-CE 3.26Å; Q241-M255 CarbonylContact O-C 3.52Å; Q241-M255 WeakPolarHBondContact O-CA 3.37Å; Q241-C256 VanDerWaalsContact CB-SG 3.51Å; Q241-C256 PolarHBondContact N-O 3.1Å; Q241-C256 PolarHBondContact O-N 2.74Å; Q241-K288 VanDerWaalsContact NE2-CG 3.32Å; Q241-L289 VanDerWaalsContact OE1-CB 3.27Å; Q241-L289 PolarHBondContact OE1-O 2.93Å; Q241-L289 VanDerWaalsContact OE1-O 3.12Å
242	A	97.9	Very high	94.6	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	119.8	169.9	0	0	0	0	0	107.7	T198 H200 V217 A254 M255	T198-A242 HydrophobicContact CG2-CB 3.92Å; T198-A242 PolarHBondContact OG1-N 3.01Å; T198-A242 VanDerWaalsContact OG1-N 3.14Å; H200-A242 WeakPolarHBondContact CB-O 3.46Å; V217-A242 HydrophobicContact CG1-CB 4.17Å; V217-A242 HydrophobicContact CG2-CB 3.88Å; A242-A254 CarbonylContact C-O 3.48Å; A242-A254 WeakPolarHBondContact CA-O 3.41Å; A242-M255 HydrophobicContact CB-CG 4.14Å
243	K	98	Very high	94.6	Very high	20 Å²	20	29.7 Å²	29.7	9%	0.087	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	138.2	-173.2	-68	-167.3	161.1	169.3	0	112.2	H200 Q241 L253 A254 L289 L291	H200-K243 HydrophobicContact CB-CB 4.49Å; H200-K243 HydrophobicContact CB-CG 4.15Å; H200-K243 VanDerWaalsContact CD2-CG 3.48Å; H200-K243 WeakPolarHBondContact CD2-CG 3.48Å; Q241-K243 HydrophobicContact CG-CD 4.43Å; Q241-K243 HydrophobicContact CG-CG 4.06Å; Q241-K243 VanDerWaalsContact OE1-CE 3.26Å; K243-L253 VanDerWaalsContact C-CD2 3.43Å; K243-L253 CarbonylContact O-C 3.18Å; K243-L253 VanDerWaalsContact O-CA 3.31Å; K243-L253 WeakPolarHBondContact O-CA 3.44Å; K243-A254 PolarHBondContact N-O 2.93Å; K243-A254 PolarHBondContact O-N 2.71Å; K243-L289 PolarHBondContact NZ-O 2.85Å; K243-L291 HydrophobicContact CB-CD1 4.19Å; K243-L291 HydrophobicContact CB-CD2 4.22Å; K243-L291 HydrophobicContact CB-CG 4.49Å; K243-L291 HydrophobicContact CD-CD1 4.01Å; K243-L291 HydrophobicContact CD-CD2 4.32Å; K243-L291 HydrophobicContact CD-CG 3.95Å
244	F	97.4	Very high	94.7	Very high	5 Å²	5	29.7 Å²	29.7	2%	0.022	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	131.4	170.2	-67.7	-80.3	0	0	0	109.9	H200 N202 W207 A209 V219 D250 L253 L267 L291	H200-F244 PolarHBondContact ND1-N 3.35Å; N202-F244 HydrophobicContact CB-CB 4.46Å; N202-F244 HydrophobicContact CB-CD1 4.28Å; N202-F244 HydrophobicContact CB-CD2 3.65Å; N202-F244 HydrophobicContact CB-CE1 4.45Å; N202-F244 HydrophobicContact CB-CE2 3.84Å; N202-F244 HydrophobicContact CB-CG 3.87Å; N202-F244 HydrophobicContact CB-CZ 4.25Å; W207-F244 HydrophobicContact CB-CZ 4.36Å; A209-F244 HydrophobicContact CB-CD2 4.26Å; A209-F244 HydrophobicContact CB-CE2 3.59Å; A209-F244 HydrophobicContact CB-CZ 4.06Å; V219-F244 HydrophobicContact CG1-CZ 3.82Å; V219-F244 HydrophobicContact CG2-CZ 4.08Å; F244-D250 HydrophobicContact CD1-CB 4.4Å; F244-D250 HydrophobicContact CE1-CB 4.47Å; F244-L253 HydrophobicContact CB-CD2 4.37Å; F244-L253 HydrophobicContact CD1-CD2 3.58Å; F244-L253 HydrophobicContact CD1-CG 4.15Å; F244-L253 HydrophobicContact CD2-CD2 4Å; F244-L253 HydrophobicContact CE1-CD2 3.75Å; F244-L253 HydrophobicContact CE1-CG 4.15Å; F244-L253 HydrophobicContact CE2-CD2 4.17Å; F244-L253 HydrophobicContact CG-CD2 3.72Å; F244-L253 HydrophobicContact CZ-CD2 4.04Å; F244-L267 HydrophobicContact CE1-CD1 4.22Å; F244-L291 VanDerWaalsContact O-CD1 3.29Å; F244-L291 WeakPolarHBondContact O-CD1 3.46Å
245	L	96.4	Very high	94.7	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.01	16%	0.164	C	C	.	.	P	Polyproline II helix	trans	-70.9	131.1	170.3	-65.3	-170.5	0	0	0	109.6	S248 T252 A254 L291 P296 F299 L313	L245-S248 WeakPolarHBondContact O-CB 3.23Å; L245-S248 PolarHBondContact O-N 3Å; L245-S248 PolarHBondContact O-OG 3.31Å; L245-T252 HydrophobicContact CD1-CG2 3.57Å; L245-T252 HydrophobicContact CG-CG2 4.04Å; L245-T252 PolarHBondContact N-O 3.44Å; L245-A254 HydrophobicContact CD2-CB 3.76Å; L245-A254 HydrophobicContact CG-CB 4.38Å; L245-L291 HydrophobicContact CD2-CD2 3.62Å; L245-P296 WeakPolarHBondContact CD1-O 3.48Å; L245-F299 HydrophobicContact CD1-CD1 4.36Å; L245-F299 HydrophobicContact CD1-CE1 4.36Å; L245-F299 HydrophobicContact CD2-CB 4.49Å; L245-F299 HydrophobicContact CD2-CD1 3.75Å; L245-F299 HydrophobicContact CD2-CE1 4.21Å; L245-F299 HydrophobicContact CD2-CG 4.24Å; L245-L313 HydrophobicContact CD1-CD1 3.57Å
246	P	93.3	Very high	94.8	Very high	16 Å²	16	27.8 Å²	27.8	10%	0.104	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	150.9	179.9	-23.4	35.4	0	0	0	111.7	S248 L291 P293 S295 P296	P246-S248 PolarHBondContact O-N 3.43Å; P246-L291 HydrophobicContact CG-CB 4.19Å; P246-L291 HydrophobicContact CG-CD1 4.2Å; P246-P293 WeakPolarHBondContact CB-O 3.11Å; P246-S295 CarbonylContact O-C 3.48Å; P246-P296 WeakPolarHBondContact O-CA 3.35Å; P246-P296 WeakPolarHBondContact O-CB 3.47Å
247	N	90.4	Very high	94.8	Very high	78 Å²	78	19.4 Å²	19.4	42%	0.417	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	9.3	176.6	-55.8	-31	0	0	0	115.4	Q203 G249 D294 P296	Q203-N247 PolarHBondContact NE2-OD1 2.94Å; Q203-N247 PolarHBondContact OE1-OD1 2.98Å; N247-G249 VanDerWaalsContact C-N 3.28Å; N247-G249 PolarHBondContact O-N 2.86Å; N247-D294 VanDerWaalsContact ND2-C 3.35Å; N247-D294 WeakPolarHBondContact ND2-CA 3.17Å; N247-D294 PolarHBondContact ND2-O 2.76Å; N247-P296 HydrophobicContact CB-CB 4.47Å
248	S	87	Confident	94.9	Very high	17 Å²	17	22.7 Å²	22.7	12%	0.119	13%	0.133	C	C	.	.	S	Bend	trans	-83.6	6	179.6	70.2	0	0	0	0	114.3	L245 P246 D250 S251	L245-S248 WeakPolarHBondContact O-CB 3.23Å; L245-S248 PolarHBondContact O-N 3Å; L245-S248 PolarHBondContact O-OG 3.31Å; P246-S248 PolarHBondContact O-N 3.43Å; S248-D250 PolarHBondContact O-N 3.09Å; S248-S251 WeakPolarHBondContact O-CB 3.36Å; S248-S251 PolarHBondContact O-N 2.75Å; S248-S251 PolarHBondContact O-OG 3.35Å
249	G	86.4	Confident	95	Very high	70 Å²	70	23.3 Å²	23.3	72%	0.722	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.1	29	-173.8	0	0	0	0	0	113.4	N247 S251	N247-G249 VanDerWaalsContact C-N 3.28Å; N247-G249 PolarHBondContact O-N 2.86Å; G249-S251 PolarHBondContact O-N 2.67Å; G249-S251 VanDerWaalsContact O-N 3.16Å
250	D	89.9	Confident	95	Very high	17 Å²	17	23.4 Å²	23.4	9%	0.091	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	14.5	-175.1	-48.9	-38.6	0	0	0	114.4	N202 W207 F244 S248	N202-D250 WeakPolarHBondContact CB-OD1 3.22Å; N202-D250 PolarHBondContact ND2-OD1 2.85Å; N202-D250 PolarHBondContact ND2-OD2 2.96Å; W207-D250 HydrophobicContact CE3-CB 4.11Å; W207-D250 HydrophobicContact CZ3-CB 3.93Å; F244-D250 HydrophobicContact CD1-CB 4.4Å; F244-D250 HydrophobicContact CE1-CB 4.47Å; S248-D250 PolarHBondContact O-N 3.09Å
251	S	91.9	Very high	95.1	Very high	48 Å²	48	22 Å²	22	34%	0.336	13%	0.132	S	C	.	.			trans	-83.8	-9.6	-177.9	70	0	0	0	0	114.8	S248 G249 L267	S248-S251 WeakPolarHBondContact O-CB 3.36Å; S248-S251 PolarHBondContact O-N 2.75Å; S248-S251 PolarHBondContact O-OG 3.35Å; G249-S251 PolarHBondContact O-N 2.67Å; G249-S251 VanDerWaalsContact O-N 3.16Å; S251-L267 WeakPolarHBondContact O-CB 3.28Å; S251-L267 PolarHBondContact O-N 2.98Å
252	T	94.9	Very high	95.2	Very high	23 Å²	23	21.1 Å²	21.1	14%	0.141	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	124	-171.1	-51.7	0	0	0	0	111.7	L245 V264 L313	L245-T252 HydrophobicContact CD1-CG2 3.57Å; L245-T252 HydrophobicContact CG-CG2 4.04Å; L245-T252 PolarHBondContact N-O 3.44Å; T252-V264 HydrophobicContact CG2-CG1 3.4Å; T252-V264 VanDerWaalsContact CG2-CG1 3.4Å; T252-L313 HydrophobicContact CG2-CD1 4.33Å
253	L	96.8	Very high	95.2	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	127.9	171.5	-76.9	170.5	0	0	0	110.2	A209 V217 V219 F231 K243 F244 V264 A265 L267	A209-L253 HydrophobicContact CB-CD2 4.07Å; V217-L253 HydrophobicContact CG1-CD1 4.03Å; V219-L253 HydrophobicContact CG2-CD1 4.04Å; F231-L253 HydrophobicContact CE1-CD1 4.03Å; F231-L253 HydrophobicContact CZ-CD1 3.79Å; K243-L253 VanDerWaalsContact C-CD2 3.43Å; K243-L253 CarbonylContact O-C 3.18Å; K243-L253 VanDerWaalsContact O-CA 3.31Å; K243-L253 WeakPolarHBondContact O-CA 3.44Å; F244-L253 HydrophobicContact CB-CD2 4.37Å; F244-L253 HydrophobicContact CD1-CD2 3.58Å; F244-L253 HydrophobicContact CD1-CG 4.15Å; F244-L253 HydrophobicContact CD2-CD2 4Å; F244-L253 HydrophobicContact CE1-CD2 3.75Å; F244-L253 HydrophobicContact CE1-CG 4.15Å; F244-L253 HydrophobicContact CE2-CD2 4.17Å; F244-L253 HydrophobicContact CG-CD2 3.72Å; F244-L253 HydrophobicContact CZ-CD2 4.04Å; L253-V264 CarbonylContact O-C 3.57Å; L253-V264 VanDerWaalsContact O-CA 3.27Å; L253-V264 WeakPolarHBondContact O-CA 3.06Å; L253-A265 HydrophobicContact CB-CB 4.25Å; L253-A265 PolarHBondContact N-O 3.03Å; L253-A265 VanDerWaalsContact N-O 3.09Å; L253-A265 PolarHBondContact O-N 3.26Å; L253-L267 HydrophobicContact CD1-CD1 3.8Å; L253-L267 HydrophobicContact CD1-CD2 4.37Å; L253-L267 HydrophobicContact CD1-CG 4.47Å; L253-L267 HydrophobicContact CG-CD1 3.92Å
254	A	98.3	Very high	95.2	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	138	165.6	0	0	0	0	0	110.3	A242 K243 L245 V264 L289 F299	A242-A254 CarbonylContact C-O 3.48Å; A242-A254 WeakPolarHBondContact CA-O 3.41Å; K243-A254 PolarHBondContact N-O 2.93Å; K243-A254 PolarHBondContact O-N 2.71Å; L245-A254 HydrophobicContact CD2-CB 3.76Å; L245-A254 HydrophobicContact CG-CB 4.38Å; A254-V264 HydrophobicContact CB-CG2 4.42Å; A254-L289 HydrophobicContact CB-CD1 3.77Å; A254-F299 HydrophobicContact CB-CD1 4.41Å; A254-F299 HydrophobicContact CB-CD2 4.28Å; A254-F299 HydrophobicContact CB-CE1 3.95Å; A254-F299 HydrophobicContact CB-CE2 3.8Å; A254-F299 HydrophobicContact CB-CZ 3.62Å
255	M	98.4	Very high	95.2	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	145	-172.8	-55.3	179.6	-60	0	0	111.5	V217 F231 S233 Q241 A242 V262 R263 A265 T276	V217-M255 HydrophobicContact CB-SD 4.42Å; V217-M255 HydrophobicContact CG2-SD 3.72Å; F231-M255 HydrophobicContact CE2-CE 4.41Å; F231-M255 HydrophobicContact CE2-SD 4.09Å; F231-M255 HydrophobicContact CZ-SD 4.3Å; S233-M255 WeakPolarHBondContact O-CE 3.36Å; Q241-M255 CarbonylContact O-C 3.52Å; Q241-M255 WeakPolarHBondContact O-CA 3.37Å; A242-M255 HydrophobicContact CB-CG 4.14Å; M255-V262 CarbonylContact O-C 3.42Å; M255-V262 WeakPolarHBondContact O-CA 3.28Å; M255-R263 HydrophobicContact CE-CB 3.92Å; M255-R263 PolarHBondContact N-O 2.75Å; M255-R263 PolarHBondContact O-N 3.01Å; M255-A265 HydrophobicContact CE-CB 4.03Å; M255-A265 HydrophobicContact SD-CB 4.49Å; M255-T276 HydrophobicContact CE-CG2 4.02Å
256	C	98.3	Very high	95.1	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	155.6	170.6	72.5	0	0	0	0	111.3	F240 Q241 V262 S286 L289	F240-C256 PolarHBondContact N-O 2.93Å; Q241-C256 VanDerWaalsContact CB-SG 3.51Å; Q241-C256 PolarHBondContact N-O 3.1Å; Q241-C256 PolarHBondContact O-N 2.74Å; C256-V262 HydrophobicContact CB-CG2 4.41Å; C256-S286 PolarHBondContact SG-O 3.28Å; C256-L289 HydrophobicContact CB-CD1 4.46Å; C256-L289 HydrophobicContact CB-CD2 3.89Å; C256-L289 HydrophobicContact CB-CG 4.1Å
257	A	97.5	Very high	95	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	171.9	-170.6	0	0	0	0	0	113.4	H235 N238 D259 G260 Q261 S286	H235-A257 HydrophobicContact CB-CB 3.87Å; H235-A257 VanDerWaalsContact CG-CB 3.43Å; H235-A257 WeakPolarHBondContact ND1-CB 3.31Å; N238-A257 WeakPolarHBondContact O-CA 3.27Å; N238-A257 VanDerWaalsContact O-CB 3.24Å; N238-A257 WeakPolarHBondContact O-CB 3.33Å; A257-D259 PolarHBondContact O-N 3.01Å; A257-G260 PolarHBondContact O-N 3Å; A257-Q261 PolarHBondContact N-O 2.86Å; A257-S286 PolarHBondContact N-O 3.12Å; A257-S286 PolarHBondContact O-N 2.91Å; A257-S286 VanDerWaalsContact O-N 3.07Å
258	R	96.6	Very high	94.6	Very high	101 Å²	101	23.1 Å²	23.1	38%	0.381	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-21.8	175.6	-168.8	174.9	-178	-175.6	0.4	114.4	N238 F240 G260 A285	N238-R258 HydrophobicContact CB-CB 4.36Å; N238-R258 PolarHBondContact O-N 3.42Å; F240-R258 HydrophobicContact CD2-CB 4.25Å; F240-R258 HydrophobicContact CE1-CB 4.19Å; F240-R258 HydrophobicContact CE2-CB 3.64Å; F240-R258 HydrophobicContact CE2-CG 4.01Å; F240-R258 HydrophobicContact CZ-CB 3.61Å; F240-R258 HydrophobicContact CZ-CG 3.87Å; R258-G260 PolarHBondContact O-N 3.1Å; R258-A285 HydrophobicContact CG-CB 4.3Å
259	D	96.3	Very high	94	Very high	34 Å²	34	27.6 Å²	27.6	18%	0.182	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	4.4	174.8	73.4	-3	0	0	0	114.2	H235 K236 A257 Q261 Q281	H235-D259 WeakPolarHBondContact CA-OD2 3.34Å; H235-D259 IonicContact CE1-OD1 2.74Å; H235-D259 IonicContact ND1-OD1 3.58Å; H235-D259 PolarHBondContact ND1-OD1 2.97Å; H235-D259 VanDerWaalsContact ND1-OD1 3.07Å; H235-D259 IonicContact ND1-OD2 2.97Å; K236-D259 HydrophobicContact CB-CB 4.36Å; K236-D259 PolarHBondContact N-OD2 3.44Å; A257-D259 PolarHBondContact O-N 3.01Å; D259-Q261 PolarHBondContact O-N 3.12Å; D259-Q261 VanDerWaalsContact O-N 3.15Å; D259-Q261 VanDerWaalsContact OD1-CB 3.26Å; D259-Q261 WeakPolarHBondContact OD1-CB 3.26Å; D259-Q261 PolarHBondContact OD1-N 3.19Å; D259-Q261 PolarHBondContact OD2-NE2 3.1Å; D259-Q281 PolarHBondContact O-NE2 3.46Å
260	G	97	Very high	93.1	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.01	17%	0.173	C	C	.	.	S	Bend	trans	72.8	-2.7	179.5	0	0	0	0	0	114.1	A257 R258 Q281 H282 G284	A257-G260 PolarHBondContact O-N 3Å; R258-G260 PolarHBondContact O-N 3.1Å; G260-Q281 VanDerWaalsContact C-NE2 3.29Å; G260-Q281 WeakPolarHBondContact O-CA 3.27Å; G260-Q281 PolarHBondContact O-NE2 3.34Å; G260-H282 PolarHBondContact O-N 2.85Å; G260-G284 WeakPolarHBondContact CA-O 3.26Å
261	Q	98.3	Very high	92.3	Very high	12 Å²	12	34 Å²	34	6%	0.056	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	146	175.7	-63.6	-177.9	61.5	0	0	110.2	H235 A257 D259 R263 R278 Q281	H235-Q261 PolarHBondContact CE1-O 2.66Å; A257-Q261 PolarHBondContact N-O 2.86Å; D259-Q261 PolarHBondContact O-N 3.12Å; D259-Q261 VanDerWaalsContact O-N 3.15Å; D259-Q261 VanDerWaalsContact OD1-CB 3.26Å; D259-Q261 WeakPolarHBondContact OD1-CB 3.26Å; D259-Q261 PolarHBondContact OD1-N 3.19Å; D259-Q261 PolarHBondContact OD2-NE2 3.1Å; Q261-R263 HydrophobicContact CB-CG 4.18Å; Q261-R278 HydrophobicContact CB-CG 4.37Å; Q261-R278 HydrophobicContact CG-CG 4.35Å; Q261-Q281 VanDerWaalsContact CG-OE1 3.27Å
262	V	98.6	Very high	91.9	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	127.4	157.2	-175.8	0	0	0	0	106.8	M255 C256 V279 A280 L289 F299	M255-V262 CarbonylContact O-C 3.42Å; M255-V262 WeakPolarHBondContact O-CA 3.28Å; C256-V262 HydrophobicContact CB-CG2 4.41Å; V262-V279 HydrophobicContact CB-CG2 4.07Å; V262-V279 HydrophobicContact CG1-CG2 3.71Å; V262-V279 WeakPolarHBondContact O-CG2 3.33Å; V262-V279 PolarHBondContact O-N 3.01Å; V262-A280 HydrophobicContact CB-CB 3.82Å; V262-A280 HydrophobicContact CG2-CB 3.93Å; V262-A280 PolarHBondContact N-O 3.11Å; V262-A280 PolarHBondContact O-N 3.24Å; V262-L289 HydrophobicContact CG1-CD2 4.11Å; V262-F299 HydrophobicContact CG1-CE2 3.8Å; V262-F299 HydrophobicContact CG1-CZ 4.17Å
263	R	98.4	Very high	91.7	Very high	29 Å²	29	35 Å²	35	11%	0.109	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	157	-177.9	-61.8	178.7	72.7	81.7	-0.2	110.1	S233 G234 H235 M255 Q261 T276 K277 R278	S233-R263 WeakPolarHBondContact O-CD 3.33Å; S233-R263 PolarHBondContact O-NE 2.87Å; G234-R263 PolarHBondContact O-NE 2.72Å; G234-R263 PolarHBondContact O-NH1 2.81Å; H235-R263 VanDerWaalsContact CE1-CD 3.46Å; H235-R263 WeakPolarHBondContact CE1-CD 3.3Å; H235-R263 VanDerWaalsContact CE1-CG 3.49Å; H235-R263 WeakPolarHBondContact CE1-CG 3.49Å; M255-R263 HydrophobicContact CE-CB 3.92Å; M255-R263 PolarHBondContact N-O 2.75Å; M255-R263 PolarHBondContact O-N 3.01Å; Q261-R263 HydrophobicContact CB-CG 4.18Å; R263-T276 PolarHBondContact NH2-O 2.7Å; R263-T276 PolarHBondContact NH2-OG1 3.41Å; R263-K277 CarbonylContact C-O 3.36Å; R263-K277 WeakPolarHBondContact CA-O 3.47Å; R263-R278 HydrophobicContact CG-CB 4.44Å
264	V	97.9	Very high	91.2	Very high	16 Å²	16	41 Å²	41	10%	0.097	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	131.4	171.4	174.5	0	0	0	0	108.7	T252 L253 A254 T276 K277 V279 F299 L313	T252-V264 HydrophobicContact CG2-CG1 3.4Å; T252-V264 VanDerWaalsContact CG2-CG1 3.4Å; L253-V264 CarbonylContact O-C 3.57Å; L253-V264 VanDerWaalsContact O-CA 3.27Å; L253-V264 WeakPolarHBondContact O-CA 3.06Å; A254-V264 HydrophobicContact CB-CG2 4.42Å; V264-T276 CarbonylContact O-C 3.5Å; V264-T276 WeakPolarHBondContact O-CA 3.35Å; V264-K277 PolarHBondContact N-O 2.81Å; V264-K277 PolarHBondContact O-N 3.32Å; V264-V279 HydrophobicContact CB-CG1 4.33Å; V264-V279 HydrophobicContact CG2-CG1 3.96Å; V264-V279 HydrophobicContact CG2-CG2 4.02Å; V264-F299 HydrophobicContact CG2-CE1 4.21Å; V264-F299 HydrophobicContact CG2-CZ 3.97Å; V264-L313 HydrophobicContact CG1-CD1 4.05Å; V264-L313 HydrophobicContact CG2-CD1 4.11Å; V264-L313 HydrophobicContact CG2-CD2 3.85Å
265	A	97.1	Very high	90.8	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	130.8	174.4	0	0	0	0	0	110.2	F231 L253 M255 L267 N275 T276	F231-A265 HydrophobicContact CE2-CB 3.73Å; F231-A265 HydrophobicContact CZ-CB 3.91Å; L253-A265 HydrophobicContact CB-CB 4.25Å; L253-A265 PolarHBondContact N-O 3.03Å; L253-A265 VanDerWaalsContact N-O 3.09Å; L253-A265 PolarHBondContact O-N 3.26Å; M255-A265 HydrophobicContact CE-CB 4.03Å; M255-A265 HydrophobicContact SD-CB 4.49Å; A265-L267 HydrophobicContact CB-CD2 4.4Å; A265-N275 WeakPolarHBondContact CA-O 3.43Å; A265-T276 HydrophobicContact CB-CG2 3.82Å
266	E	93.9	Very high	90.6	Very high	92 Å²	92	46.9 Å²	46.9	43%	0.43	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	120.4	169.7	-168.4	-167.6	153	0	0	109.2	K274 N275	E266-K274 HydrophobicContact CG-CD 4.49Å; E266-K274 PolarHBondContact O-N 2.84Å; E266-K274 WeakPolarHBondContact OE1-CD 3.23Å; E266-K274 WeakPolarHBondContact OE1-CE 3.44Å; E266-K274 IonicContact OE1-NZ 2.66Å; E266-K274 PolarHBondContact OE1-NZ 2.85Å; E266-N275 PolarHBondContact N-O 2.82Å
267	L	91.1	Very high	90.5	Very high	8 Å²	8	52.6 Å²	52.6	4%	0.042	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	128.3	178.8	-51.1	-175.3	0	0	0	109.3	L229 F231 F244 S251 L253 A265 C273	L229-L267 HydrophobicContact CD1-CD1 3.72Å; L229-L267 HydrophobicContact CD1-CD2 3.9Å; L229-L267 HydrophobicContact CD1-CG 4.26Å; F231-L267 HydrophobicContact CE1-CD2 4.1Å; F231-L267 HydrophobicContact CZ-CD2 4.31Å; F244-L267 HydrophobicContact CE1-CD1 4.22Å; S251-L267 WeakPolarHBondContact O-CB 3.28Å; S251-L267 PolarHBondContact O-N 2.98Å; L253-L267 HydrophobicContact CD1-CD1 3.8Å; L253-L267 HydrophobicContact CD1-CD2 4.37Å; L253-L267 HydrophobicContact CD1-CG 4.47Å; L253-L267 HydrophobicContact CG-CD1 3.92Å; A265-L267 HydrophobicContact CB-CD2 4.4Å; L267-C273 HydrophobicContact CD2-CB 4.14Å
268	S	82.6	Confident	90.5	Very high	17 Å²	17	59.6 Å²	59.6	12%	0.119	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-76.5	155.8	176.5	74.8	0	0	0	0	111.9	T270 Q271 C272	S268-T270 WeakPolarHBondContact CB-OG1 3.27Å; S268-T270 PolarHBondContact O-N 2.77Å; S268-T270 PolarHBondContact OG-N 2.83Å; S268-T270 PolarHBondContact OG-OG1 2.86Å; S268-Q271 PolarHBondContact O-N 2.9Å; S268-Q271 VanDerWaalsContact O-N 3.1Å; S268-Q271 PolarHBondContact OG-N 3.14Å; S268-C272 PolarHBondContact N-O 2.84Å; S268-C272 PolarHBondContact OG-N 2.79Å; S268-C272 PolarHBondContact OG-O 3.16Å; S268-C272 PolarHBondContact OG-SG 3.48Å
269	A	73.3	Confident	90.6	Very high	112 Å²	112	55.4 Å²	55.4	93%	0.926	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-21	166.2	0	0	0	0	0	113	Q271	A269-Q271 VanDerWaalsContact C-N 3.26Å; A269-Q271 PolarHBondContact O-N 2.74Å
270	T	67.9	Low	90.7	Very high	116 Å²	116	54.2 Å²	54.2	71%	0.712	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	13.1	175.8	53.5	0	0	0	0	113.9	S268	S268-T270 WeakPolarHBondContact CB-OG1 3.27Å; S268-T270 PolarHBondContact O-N 2.77Å; S268-T270 PolarHBondContact OG-N 2.83Å; S268-T270 PolarHBondContact OG-OG1 2.86Å
271	Q	74.3	Confident	90.7	Very high	104 Å²	104	58.5 Å²	58.5	49%	0.486	31%	0.309	S	S	.	.	S	Bend	trans	57.6	55	178.7	-59.4	172.7	-12.6	0	0	112.4	V228 L229 S268 A269	V228-Q271 HydrophobicContact CG1-CB 4.22Å; V228-Q271 VanDerWaalsContact CG1-CD 3.43Å; V228-Q271 HydrophobicContact CG1-CG 3.83Å; L229-Q271 HydrophobicContact CD2-CB 4.13Å; L229-Q271 WeakPolarHBondContact CD2-O 2.95Å; S268-Q271 PolarHBondContact O-N 2.9Å; S268-Q271 VanDerWaalsContact O-N 3.1Å; S268-Q271 PolarHBondContact OG-N 3.14Å; A269-Q271 VanDerWaalsContact C-N 3.26Å; A269-Q271 PolarHBondContact O-N 2.74Å
272	C	83.1	Confident	90.7	Very high	60 Å²	60	58.1 Å²	58.1	41%	0.405	31%	0.307	S	S	.	.			trans	-135.6	153.8	159.6	68.5	0	0	0	0	111.2	S268	S268-C272 PolarHBondContact N-O 2.84Å; S268-C272 PolarHBondContact OG-N 2.79Å; S268-C272 PolarHBondContact OG-O 3.16Å; S268-C272 PolarHBondContact OG-SG 3.48Å
273	C	89.9	Confident	90.7	Very high	34 Å²	34	67.6 Å²	67.6	23%	0.23	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	121.4	165.6	-177.4	0	0	0	0	108.6	F231 L267	F231-C273 HydrophobicContact CB-CB 3.67Å; F231-C273 HydrophobicContact CD1-CB 3.93Å; F231-C273 HydrophobicContact CD2-CB 3.78Å; F231-C273 HydrophobicContact CE2-CB 4.4Å; F231-C273 HydrophobicContact CG-CB 3.52Å; L267-C273 HydrophobicContact CD2-CB 4.14Å
274	K	85.6	Confident	90.5	Very high	125 Å²	125	67.3 Å²	67.3	54%	0.543	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	-42.3	178.8	-60.3	-173.6	-165.2	165	0	112.1	E266	E266-K274 HydrophobicContact CG-CD 4.49Å; E266-K274 PolarHBondContact O-N 2.84Å; E266-K274 WeakPolarHBondContact OE1-CD 3.23Å; E266-K274 WeakPolarHBondContact OE1-CE 3.44Å; E266-K274 IonicContact OE1-NZ 2.66Å; E266-K274 PolarHBondContact OE1-NZ 2.85Å
275	N	89.9	Confident	90.4	Very high	102 Å²	102	66.7 Å²	66.7	55%	0.545	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	153.3	-173	-170	9.5	0	0	0	110.4	A265 E266	A265-N275 WeakPolarHBondContact CA-O 3.43Å; E266-N275 PolarHBondContact N-O 2.82Å
276	T	95.9	Very high	90.4	Very high	22 Å²	22	66.7 Å²	66.7	14%	0.135	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	118.9	166.9	63.5	0	0	0	0	109.9	F231 S233 M255 R263 V264 A265	F231-T276 HydrophobicContact CD2-CG2 4.21Å; F231-T276 HydrophobicContact CE2-CG2 4.09Å; S233-T276 WeakPolarHBondContact O-CB 3.32Å; S233-T276 PolarHBondContact O-OG1 3.25Å; M255-T276 HydrophobicContact CE-CG2 4.02Å; R263-T276 PolarHBondContact NH2-O 2.7Å; R263-T276 PolarHBondContact NH2-OG1 3.41Å; V264-T276 CarbonylContact O-C 3.5Å; V264-T276 WeakPolarHBondContact O-CA 3.35Å; A265-T276 HydrophobicContact CB-CG2 3.82Å
277	K	95.9	Very high	90.4	Very high	120 Å²	120	63.3 Å²	63.3	52%	0.522	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	129.4	-177.5	-178.7	-179.8	177	-175.7	0	110.3	R263 V264	R263-K277 CarbonylContact C-O 3.36Å; R263-K277 WeakPolarHBondContact CA-O 3.47Å; V264-K277 PolarHBondContact N-O 2.81Å; V264-K277 PolarHBondContact O-N 3.32Å
278	R	97.7	Very high	90.7	Very high	146 Å²	146	64.1 Å²	64.1	55%	0.551	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.2	127.2	167.8	-175.7	-178.8	62.4	-126.4	-0.5	109.6	Q261 R263 A280	Q261-R278 HydrophobicContact CB-CG 4.37Å; Q261-R278 HydrophobicContact CG-CG 4.35Å; R263-R278 HydrophobicContact CG-CB 4.44Å; R278-A280 WeakPolarHBondContact CG-O 3.47Å
279	V	98.1	Very high	91.4	Very high	14 Å²	14	63.3 Å²	63.3	9%	0.085	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	-29.6	-178.9	-63.3	0	0	0	0	113.1	V262 V264 F299 I311 L313 P318 A319	V262-V279 HydrophobicContact CB-CG2 4.07Å; V262-V279 HydrophobicContact CG1-CG2 3.71Å; V262-V279 WeakPolarHBondContact O-CG2 3.33Å; V262-V279 PolarHBondContact O-N 3.01Å; V264-V279 HydrophobicContact CB-CG1 4.33Å; V264-V279 HydrophobicContact CG2-CG1 3.96Å; V264-V279 HydrophobicContact CG2-CG2 4.02Å; V279-F299 HydrophobicContact CG2-CZ 4.35Å; V279-I311 HydrophobicContact CB-CG2 4.25Å; V279-I311 HydrophobicContact CG2-CG2 4.04Å; V279-L313 HydrophobicContact CB-CD2 4.48Å; V279-L313 HydrophobicContact CG1-CD2 3.87Å; V279-P318 HydrophobicContact CB-CB 4.17Å; V279-P318 HydrophobicContact CB-CG 4.43Å; V279-P318 HydrophobicContact CG1-CB 4.45Å; V279-P318 HydrophobicContact CG1-CG 4.34Å; V279-A319 VanDerWaalsContact O-CB 3.29Å; V279-A319 WeakPolarHBondContact O-CB 3.33Å
280	A	98	Very high	92.6	Very high	8 Å²	8	58 Å²	58	7%	0.066	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	168	173.5	0	0	0	0	0	112.2	V262 R278 F309 A319	V262-A280 HydrophobicContact CB-CB 3.82Å; V262-A280 HydrophobicContact CG2-CB 3.93Å; V262-A280 PolarHBondContact N-O 3.11Å; V262-A280 PolarHBondContact O-N 3.24Å; R278-A280 WeakPolarHBondContact CG-O 3.47Å; A280-F309 HydrophobicContact CB-CD2 4.24Å; A280-F309 HydrophobicContact CB-CG 4.47Å; A280-A319 HydrophobicContact CB-CB 3.58Å
281	Q	97.9	Very high	94	Very high	91 Å²	91	53.9 Å²	53.9	43%	0.425	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	114	174.6	179.1	71.1	65.2	0	0	109.5	D259 G260 Q261	D259-Q281 PolarHBondContact O-NE2 3.46Å; G260-Q281 VanDerWaalsContact C-NE2 3.29Å; G260-Q281 WeakPolarHBondContact O-CA 3.27Å; G260-Q281 PolarHBondContact O-NE2 3.34Å; Q261-Q281 VanDerWaalsContact CG-OE1 3.27Å
282	H	98.4	Very high	94.9	Very high	4 Å²	4	51.4 Å²	51.4	2%	0.019	25%	0.251	C	S	.	.			trans	-78.8	159.4	165.8	-70.2	-94.3	0	0	0	110.8	G260 G284 S286 S301 G303 D305 V307 F309	G260-H282 PolarHBondContact O-N 2.85Å; H282-G284 VanDerWaalsContact C-N 3.35Å; H282-G284 WeakPolarHBondContact CB-O 3.34Å; H282-S286 PolarHBondContact CD2-OG 2.89Å; H282-S286 VanDerWaalsContact CD2-OG 3.29Å; H282-S286 PolarHBondContact NE2-OG 3.33Å; H282-S301 PolarHBondContact NE2-OG 3.45Å; H282-G303 PolarHBondContact CE1-N 2.86Å; H282-D305 WeakPolarHBondContact CA-OD2 3.38Å; H282-D305 IonicContact CE1-OD1 3.74Å; H282-D305 IonicContact CG-OD1 3.23Å; H282-D305 IonicContact CG-OD2 3.85Å; H282-D305 IonicContact ND1-OD1 2.76Å; H282-D305 PolarHBondContact ND1-OD1 3.08Å; H282-D305 IonicContact ND1-OD2 3.77Å; H282-V307 PolarHBondContact CE1-O 3.31Å; H282-V307 VanDerWaalsContact CE1-O 3.29Å; H282-F309 AromaticContact CD2-CD2 3.98Å; H282-F309 AromaticContact CE1-CD2 3.49Å; H282-F309 VanDerWaalsContact CE1-CD2 3.49Å; H282-F309 WeakPolarHBondContact CE1-CD2 3.26Å; H282-F309 AromaticContact CE1-CE2 3.78Å; H282-F309 AromaticContact CG-CE2 3.91Å; H282-F309 AromaticContact ND1-CD2 3.96Å; H282-F309 AromaticContact ND1-CE2 3.75Å; H282-F309 AromaticContact NE2-CD2 3.51Å; H282-F309 AromaticContact NE2-CE2 3.96Å
283	K	97.1	Very high	95.3	Very high	200 Å²	200	50.7 Å²	50.7	87%	0.87	25%	0.245	S	C	*	.	S	Bend	trans	-85.6	-2.9	173.5	-63.4	-169.7	175.2	-166.9	0	114.4	D305	K283-D305 HydrophobicContact CB-CB 3.83Å; K283-D305 PolarHBondContact N-OD2 2.78Å
284	G	94.9	Very high	95.2	Very high	22 Å²	22	55 Å²	55	23%	0.227	27%	0.266	C	S	.	.	S	Bend	trans	-140.8	-166.8	171	0	0	0	0	0	109.2	G260 H282	G260-G284 WeakPolarHBondContact CA-O 3.26Å; H282-G284 VanDerWaalsContact C-N 3.35Å; H282-G284 WeakPolarHBondContact CB-O 3.34Å
285	A	95.7	Very high	95.5	Very high	4 Å²	4	49.7 Å²	49.7	3%	0.033	25%	0.245	C	C	.	.			trans	-62	145.6	179.3	0	0	0	0	0	112.2	F240 R258 G303 E304	F240-A285 HydrophobicContact CE2-CB 3.95Å; R258-A285 HydrophobicContact CG-CB 4.3Å; A285-G303 CarbonylContact O-C 3.53Å; A285-G303 WeakPolarHBondContact O-CA 3.34Å; A285-E304 VanDerWaalsContact CB-CD 3.48Å; A285-E304 HydrophobicContact CB-CG 4.07Å; A285-E304 WeakPolarHBondContact CB-OE2 3.25Å; A285-E304 PolarHBondContact N-OE2 3.18Å; A285-E304 PolarHBondContact O-N 2.8Å
286	S	97	Very high	95.8	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	102.1	172.6	-170.5	0	0	0	0	108.5	C256 A257 H282 A302	C256-S286 PolarHBondContact SG-O 3.28Å; A257-S286 PolarHBondContact N-O 3.12Å; A257-S286 PolarHBondContact O-N 2.91Å; A257-S286 VanDerWaalsContact O-N 3.07Å; H282-S286 PolarHBondContact CD2-OG 2.89Å; H282-S286 VanDerWaalsContact CD2-OG 3.29Å; H282-S286 PolarHBondContact NE2-OG 3.33Å; S286-A302 PolarHBondContact OG-O 3.47Å
287	H	93.6	Very high	95.7	Very high	21 Å²	21	47.3 Å²	47.3	10%	0.097	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-37.7	-167.6	-79.8	-74.4	0	0	0	113.8	F240 A302 E304 Y335	F240-H287 AromaticContact CD2-ND1 3.71Å; F240-H287 AromaticContact CE2-CE1 3.61Å; F240-H287 AromaticContact CE2-ND1 3.6Å; H287-A302 PolarHBondContact N-O 2.95Å; H287-E304 IonicContact CD2-OE1 3.15Å; H287-E304 IonicContact CE1-OE1 3.93Å; H287-E304 VanDerWaalsContact NE2-CG 3.33Å; H287-E304 WeakPolarHBondContact NE2-CG 3.08Å; H287-E304 IonicContact NE2-OE1 3.88Å; H287-E304 PolarHBondContact NE2-OE1 2.91Å; H287-Y335 WeakPolarHBondContact CB-O 3.34Å; H287-Y335 AromaticContact CD2-CD1 3.69Å; H287-Y335 AromaticContact NE2-CD1 3.72Å
288	K	96.7	Very high	95.8	Very high	24 Å²	24	42.4 Å²	42.4	10%	0.104	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	143.6	-170.2	-145.2	179.6	-175.9	-171.5	0	113.2	Q241 A302 T336 I337 C392 L393	Q241-K288 VanDerWaalsContact NE2-CG 3.32Å; K288-A302 PolarHBondContact O-N 2.78Å; K288-T336 VanDerWaalsContact CD-OG1 3.28Å; K288-T336 WeakPolarHBondContact CD-OG1 3.17Å; K288-T336 PolarHBondContact NZ-OG1 2.93Å; K288-T336 VanDerWaalsContact NZ-OG1 3.09Å; K288-I337 HydrophobicContact CB-CG2 4.19Å; K288-I337 WeakPolarHBondContact O-CG2 3.19Å; K288-C392 PolarHBondContact NZ-SG 3.28Å; K288-L393 PolarHBondContact NZ-O 3.38Å; K288-L393 VanDerWaalsContact NZ-O 3.07Å
289	L	98.3	Very high	95.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	142	170.1	-52.5	176.8	0	0	0	110.5	Q241 K243 A254 C256 V262 F299 L300 S301	Q241-L289 VanDerWaalsContact OE1-CB 3.27Å; Q241-L289 PolarHBondContact OE1-O 2.93Å; Q241-L289 VanDerWaalsContact OE1-O 3.12Å; K243-L289 PolarHBondContact NZ-O 2.85Å; A254-L289 HydrophobicContact CB-CD1 3.77Å; C256-L289 HydrophobicContact CB-CD1 4.46Å; C256-L289 HydrophobicContact CB-CD2 3.89Å; C256-L289 HydrophobicContact CB-CG 4.1Å; V262-L289 HydrophobicContact CG1-CD2 4.11Å; L289-F299 HydrophobicContact CD1-CE2 4.32Å; L289-F299 HydrophobicContact CD2-CD2 4.19Å; L289-F299 HydrophobicContact CD2-CE2 4.05Å; L289-L300 CarbonylContact C-O 3.5Å; L289-L300 VanDerWaalsContact CA-O 3.27Å; L289-L300 WeakPolarHBondContact CA-O 3.47Å; L289-S301 VanDerWaalsContact CD2-CB 3.46Å
290	A	98.2	Very high	95.8	Very high	2 Å²	2	35.2 Å²	35.2	2%	0.017	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	119.2	168	0	0	0	0	0	109.7	F299 L300 I337 V339	A290-F299 WeakPolarHBondContact O-CB 3.38Å; A290-L300 HydrophobicContact CB-CB 4.4Å; A290-L300 PolarHBondContact N-O 3.01Å; A290-L300 PolarHBondContact O-N 3.34Å; A290-I337 HydrophobicContact CB-CB 4.45Å; A290-I337 HydrophobicContact CB-CG1 3.93Å; A290-I337 HydrophobicContact CB-CG2 4.04Å; A290-V339 HydrophobicContact CB-CB 4.43Å; A290-V339 HydrophobicContact CB-CG2 3.83Å
291	L	96.9	Very high	95.8	Very high	28 Å²	28	34.8 Å²	34.8	15%	0.147	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	145.3	177.1	-56.7	175.5	0	0	0	109.8	K243 F244 L245 P246 F299	K243-L291 HydrophobicContact CB-CD1 4.19Å; K243-L291 HydrophobicContact CB-CD2 4.22Å; K243-L291 HydrophobicContact CB-CG 4.49Å; K243-L291 HydrophobicContact CD-CD1 4.01Å; K243-L291 HydrophobicContact CD-CD2 4.32Å; K243-L291 HydrophobicContact CD-CG 3.95Å; F244-L291 VanDerWaalsContact O-CD1 3.29Å; F244-L291 WeakPolarHBondContact O-CD1 3.46Å; L245-L291 HydrophobicContact CD2-CD2 3.62Å; P246-L291 HydrophobicContact CG-CB 4.19Å; P246-L291 HydrophobicContact CG-CD1 4.2Å; L291-F299 HydrophobicContact CD2-CB 4.29Å
292	E	94.6	Very high	95.8	Very high	53 Å²	53	30.5 Å²	30.5	25%	0.248	16%	0.164	C	C	.	.			trans	-86.4	118.7	164.5	179.9	165.3	-157.3	0	0	108.6	D294 S295 T298 T344	E292-D294 VanDerWaalsContact C-N 3.25Å; E292-D294 PolarHBondContact O-N 3.49Å; E292-S295 PolarHBondContact O-N 3.02Å; E292-S295 VanDerWaalsContact O-N 3.08Å; E292-T298 PolarHBondContact OE2-OG1 3.49Å; E292-T344 HydrophobicContact CG-CG2 4.05Å; E292-T344 WeakPolarHBondContact OE1-CB 3.18Å; E292-T344 PolarHBondContact OE1-OG1 3.44Å; E292-T344 VanDerWaalsContact OE1-OG1 3.12Å
293	P	90.4	Very high	95.7	Very high	45 Å²	45	30.3 Å²	30.3	29%	0.292	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-34.5	-166.7	-30.7	34.8	0	0	0	116.3	P246 P341	P246-P293 WeakPolarHBondContact CB-O 3.11Å; P293-P341 HydrophobicContact CG-CB 4.47Å
294	D	88.2	Confident	95.7	Very high	124 Å²	124	24.8 Å²	24.8	66%	0.663	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.7	-3.3	-175.4	-65.7	-52.5	0	0	0	113.9	N247 E292	N247-D294 VanDerWaalsContact ND2-C 3.35Å; N247-D294 WeakPolarHBondContact ND2-CA 3.17Å; N247-D294 PolarHBondContact ND2-O 2.76Å; E292-D294 VanDerWaalsContact C-N 3.25Å; E292-D294 PolarHBondContact O-N 3.49Å
295	S	92.8	Very high	95.8	Very high	13 Å²	13	24.8 Å²	24.8	9%	0.091	14%	0.135	C	C	.	.			trans	-104.8	126.6	-171.9	-172.4	0	0	0	0	114.3	P246 E292 C297 T298	P246-S295 CarbonylContact O-C 3.48Å; E292-S295 PolarHBondContact O-N 3.02Å; E292-S295 VanDerWaalsContact O-N 3.08Å; S295-C297 VanDerWaalsContact C-N 3.26Å; S295-C297 PolarHBondContact O-N 2.94Å; S295-C297 PolarHBondContact OG-N 2.78Å; S295-T298 WeakPolarHBondContact CB-OG1 3.39Å; S295-T298 PolarHBondContact OG-N 3.21Å; S295-T298 PolarHBondContact OG-OG1 2.91Å
296	P	94.7	Very high	95.9	Very high	59 Å²	59	24.6 Å²	24.6	38%	0.383	13%	0.134	S	C	.	.	S	Bend	trans	-82.1	0.1	173	35.4	-36.6	0	0	0	114.2	L245 P246 N247	L245-P296 WeakPolarHBondContact CD1-O 3.48Å; P246-P296 WeakPolarHBondContact O-CA 3.35Å; P246-P296 WeakPolarHBondContact O-CB 3.47Å; N247-P296 HydrophobicContact CB-CB 4.47Å
297	C	95.2	Very high	95.9	Very high	16 Å²	16	25.2 Å²	25.2	11%	0.108	14%	0.137	C	C	.	.	S	Bend	trans	-142.6	-9.9	-167.8	61.4	0	0	0	0	115.2	S295 D312 L313 R314	S295-C297 VanDerWaalsContact C-N 3.26Å; S295-C297 PolarHBondContact O-N 2.94Å; S295-C297 PolarHBondContact OG-N 2.78Å; C297-D312 WeakPolarHBondContact O-CA 3.44Å; C297-L313 HydrophobicContact CB-CB 4.33Å; C297-L313 PolarHBondContact O-N 3.03Å; C297-R314 HydrophobicContact CB-CG 4.08Å; C297-R314 VanDerWaalsContact SG-CD 3.59Å; C297-R314 PolarHBondContact SG-NE 2.89Å; C297-R314 VanDerWaalsContact SG-NE 3.44Å
298	T	96.3	Very high	96.1	Very high	17 Å²	17	24.2 Å²	24.2	10%	0.104	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	135.9	177	48.9	0	0	0	0	112.5	E292 S295 I311 D312	E292-T298 PolarHBondContact OE2-OG1 3.49Å; S295-T298 WeakPolarHBondContact CB-OG1 3.39Å; S295-T298 PolarHBondContact OG-N 3.21Å; S295-T298 PolarHBondContact OG-OG1 2.91Å; T298-I311 VanDerWaalsContact CA-O 3.23Å; T298-I311 WeakPolarHBondContact CA-O 3.37Å; T298-D312 HydrophobicContact CG2-CB 3.85Å
299	F	97.9	Very high	96.2	Very high	3 Å²	3	24.4 Å²	24.4	1%	0.013	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	163.5	174.6	62.5	-83.9	0	0	0	110.5	L245 A254 V262 V264 V279 L289 A290 L291 I311 L313	L245-F299 HydrophobicContact CD1-CD1 4.36Å; L245-F299 HydrophobicContact CD1-CE1 4.36Å; L245-F299 HydrophobicContact CD2-CB 4.49Å; L245-F299 HydrophobicContact CD2-CD1 3.75Å; L245-F299 HydrophobicContact CD2-CE1 4.21Å; L245-F299 HydrophobicContact CD2-CG 4.24Å; A254-F299 HydrophobicContact CB-CD1 4.41Å; A254-F299 HydrophobicContact CB-CD2 4.28Å; A254-F299 HydrophobicContact CB-CE1 3.95Å; A254-F299 HydrophobicContact CB-CE2 3.8Å; A254-F299 HydrophobicContact CB-CZ 3.62Å; V262-F299 HydrophobicContact CG1-CE2 3.8Å; V262-F299 HydrophobicContact CG1-CZ 4.17Å; V264-F299 HydrophobicContact CG2-CE1 4.21Å; V264-F299 HydrophobicContact CG2-CZ 3.97Å; V279-F299 HydrophobicContact CG2-CZ 4.35Å; L289-F299 HydrophobicContact CD1-CE2 4.32Å; L289-F299 HydrophobicContact CD2-CD2 4.19Å; L289-F299 HydrophobicContact CD2-CE2 4.05Å; A290-F299 WeakPolarHBondContact O-CB 3.38Å; L291-F299 HydrophobicContact CD2-CB 4.29Å; F299-I311 HydrophobicContact CD1-CB 4.26Å; F299-I311 HydrophobicContact CD1-CG2 4.37Å; F299-I311 HydrophobicContact CD2-CB 4.35Å; F299-I311 HydrophobicContact CD2-CD1 4.03Å; F299-I311 HydrophobicContact CE1-CB 3.99Å; F299-I311 HydrophobicContact CE1-CG2 3.69Å; F299-I311 HydrophobicContact CE2-CB 4.08Å; F299-I311 HydrophobicContact CE2-CD1 3.87Å; F299-I311 HydrophobicContact CE2-CG1 4.08Å; F299-I311 HydrophobicContact CE2-CG2 4.37Å; F299-I311 HydrophobicContact CG-CB 4.44Å; F299-I311 HydrophobicContact CZ-CB 3.9Å; F299-I311 HydrophobicContact CZ-CD1 4.49Å; F299-I311 HydrophobicContact CZ-CG1 4.2Å; F299-I311 HydrophobicContact CZ-CG2 3.69Å; F299-I311 PolarHBondContact N-O 2.76Å; F299-I311 VanDerWaalsContact N-O 3.09Å; F299-I311 PolarHBondContact O-N 2.9Å; F299-L313 HydrophobicContact CE1-CD1 4.28Å; F299-L313 HydrophobicContact CE1-CD2 4.14Å; F299-L313 HydrophobicContact CE1-CG 4.21Å
300	L	98.5	Very high	96.2	Very high	5 Å²	5	26.1 Å²	26.1	3%	0.026	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	149	177.1	-51.6	-178.1	0	0	0	110.9	L289 A290 V308 F309 L322 I337 V339 F347	L289-L300 CarbonylContact C-O 3.5Å; L289-L300 VanDerWaalsContact CA-O 3.27Å; L289-L300 WeakPolarHBondContact CA-O 3.47Å; A290-L300 HydrophobicContact CB-CB 4.4Å; A290-L300 PolarHBondContact N-O 3.01Å; A290-L300 PolarHBondContact O-N 3.34Å; L300-V308 HydrophobicContact CB-CG1 4.28Å; L300-F309 VanDerWaalsContact CA-O 3.28Å; L300-F309 WeakPolarHBondContact CA-O 3.4Å; L300-L322 HydrophobicContact CD1-CD2 4.29Å; L300-L322 HydrophobicContact CD2-CD2 3.91Å; L300-I337 HydrophobicContact CB-CD1 3.8Å; L300-I337 HydrophobicContact CD1-CD1 3.95Å; L300-V339 HydrophobicContact CD1-CG2 3.82Å; L300-V339 HydrophobicContact CG-CG2 4.27Å; L300-F347 HydrophobicContact CD1-CB 3.96Å; L300-F347 HydrophobicContact CD1-CD1 3.92Å; L300-F347 HydrophobicContact CD1-CD2 4.25Å; L300-F347 HydrophobicContact CD1-CE1 4.5Å; L300-F347 HydrophobicContact CD1-CG 3.77Å
301	S	98.6	Very high	96.2	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	144.6	167.9	73.8	0	0	0	0	111.2	H282 L289 V308 F309	H282-S301 PolarHBondContact NE2-OG 3.45Å; L289-S301 VanDerWaalsContact CD2-CB 3.46Å; S301-V308 CarbonylContact O-C 3.52Å; S301-V308 VanDerWaalsContact O-CA 3.26Å; S301-V308 WeakPolarHBondContact O-CA 3.06Å; S301-F309 PolarHBondContact N-O 2.86Å; S301-F309 PolarHBondContact O-N 3.06Å
302	A	98.3	Very high	96.2	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	150.5	174.8	0	0	0	0	0	111.3	S286 H287 K288 V308 L334 I337	S286-A302 PolarHBondContact OG-O 3.47Å; H287-A302 PolarHBondContact N-O 2.95Å; K288-A302 PolarHBondContact O-N 2.78Å; A302-V308 HydrophobicContact CB-CG2 4.44Å; A302-L334 HydrophobicContact CB-CB 3.93Å; A302-L334 HydrophobicContact CB-CD1 3.97Å; A302-I337 HydrophobicContact CB-CB 3.79Å; A302-I337 HydrophobicContact CB-CD1 4.32Å; A302-I337 HydrophobicContact CB-CG2 3.61Å
303	G	96.6	Very high	96.3	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	173.3	-179.4	0	0	0	0	0	115.4	H282 A285 D305 A306 V307 L334	H282-G303 PolarHBondContact CE1-N 2.86Å; A285-G303 CarbonylContact O-C 3.53Å; A285-G303 WeakPolarHBondContact O-CA 3.34Å; G303-D305 PolarHBondContact O-N 3.05Å; G303-D305 VanDerWaalsContact O-N 3.16Å; G303-A306 PolarHBondContact O-N 2.63Å; G303-A306 VanDerWaalsContact O-N 3.14Å; G303-V307 PolarHBondContact N-O 2.87Å; G303-L334 CarbonylContact C-O 3.59Å; G303-L334 WeakPolarHBondContact O-CB 3.29Å; G303-L334 PolarHBondContact O-N 3Å
304	E	96	Very high	96.5	Very high	85 Å²	85	31.5 Å²	31.5	40%	0.397	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-18.6	-176.8	-63.4	176.4	159.3	0	0	113.7	A285 H287 A306 G333 Y335	A285-E304 VanDerWaalsContact CB-CD 3.48Å; A285-E304 HydrophobicContact CB-CG 4.07Å; A285-E304 WeakPolarHBondContact CB-OE2 3.25Å; A285-E304 PolarHBondContact N-OE2 3.18Å; A285-E304 PolarHBondContact O-N 2.8Å; H287-E304 IonicContact CD2-OE1 3.15Å; H287-E304 IonicContact CE1-OE1 3.93Å; H287-E304 VanDerWaalsContact NE2-CG 3.33Å; H287-E304 WeakPolarHBondContact NE2-CG 3.08Å; H287-E304 IonicContact NE2-OE1 3.88Å; H287-E304 PolarHBondContact NE2-OE1 2.91Å; E304-A306 PolarHBondContact O-N 2.91Å; E304-A306 VanDerWaalsContact O-N 3.12Å; E304-G333 WeakPolarHBondContact O-CA 3.39Å; E304-Y335 HydrophobicContact CG-CE1 4.3Å
305	D	96.8	Very high	96.9	Very high	22 Å²	22	30.3 Å²	30.3	12%	0.118	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	7.1	175.2	66.3	-12.7	0	0	0	114	H282 K283 G303 V307	H282-D305 WeakPolarHBondContact CA-OD2 3.38Å; H282-D305 IonicContact CE1-OD1 3.74Å; H282-D305 IonicContact CG-OD1 3.23Å; H282-D305 IonicContact CG-OD2 3.85Å; H282-D305 IonicContact ND1-OD1 2.76Å; H282-D305 PolarHBondContact ND1-OD1 3.08Å; H282-D305 IonicContact ND1-OD2 3.77Å; K283-D305 HydrophobicContact CB-CB 3.83Å; K283-D305 PolarHBondContact N-OD2 2.78Å; G303-D305 PolarHBondContact O-N 3.05Å; G303-D305 VanDerWaalsContact O-N 3.16Å; D305-V307 HydrophobicContact CB-CG2 4.43Å; D305-V307 PolarHBondContact O-N 2.87Å; D305-V307 WeakPolarHBondContact OD1-CB 3.05Å; D305-V307 PolarHBondContact OD1-N 2.61Å
306	A	97.5	Very high	96.8	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.188	C	C	.	.	S	Bend	trans	65.4	12.5	-174.7	0	0	0	0	0	114.3	G303 E304 V324 T325 K331 V332	G303-A306 PolarHBondContact O-N 2.63Å; G303-A306 VanDerWaalsContact O-N 3.14Å; E304-A306 PolarHBondContact O-N 2.91Å; E304-A306 VanDerWaalsContact O-N 3.12Å; A306-V324 HydrophobicContact CB-CG1 4.21Å; A306-V324 CarbonylContact O-C 3.57Å; A306-V324 WeakPolarHBondContact O-CA 2.86Å; A306-T325 WeakPolarHBondContact CB-O 3.47Å; A306-T325 PolarHBondContact O-N 2.87Å; A306-K331 HydrophobicContact CB-CB 3.78Å; A306-K331 HydrophobicContact CB-CD 4.49Å; A306-K331 HydrophobicContact CB-CG 4.29Å; A306-V332 WeakPolarHBondContact CA-O 3.4Å; A306-V332 WeakPolarHBondContact CB-O 3.44Å
307	V	98.1	Very high	96.8	Very high	12 Å²	12	45.1 Å²	45.1	7%	0.073	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	138.9	-177.6	179.8	0	0	0	0	110.5	H282 G303 D305 F309 K321 V324	H282-V307 PolarHBondContact CE1-O 3.31Å; H282-V307 VanDerWaalsContact CE1-O 3.29Å; G303-V307 PolarHBondContact N-O 2.87Å; D305-V307 HydrophobicContact CB-CG2 4.43Å; D305-V307 PolarHBondContact O-N 2.87Å; D305-V307 WeakPolarHBondContact OD1-CB 3.05Å; D305-V307 PolarHBondContact OD1-N 2.61Å; V307-F309 HydrophobicContact CB-CE2 4.46Å; V307-F309 HydrophobicContact CG1-CD1 4.23Å; V307-F309 HydrophobicContact CG1-CD2 3.98Å; V307-F309 HydrophobicContact CG1-CE1 4.07Å; V307-F309 HydrophobicContact CG1-CE2 3.8Å; V307-F309 HydrophobicContact CG1-CG 4.19Å; V307-F309 HydrophobicContact CG1-CZ 3.84Å; V307-K321 HydrophobicContact CG1-CG 3.78Å; V307-V324 HydrophobicContact CG2-CG2 4.43Å
308	V	98.4	Very high	96.8	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	124.8	155.7	-178	0	0	0	0	108.4	L300 S301 A302 L322 V323 L334 I337 F347 V349	L300-V308 HydrophobicContact CB-CG1 4.28Å; S301-V308 CarbonylContact O-C 3.52Å; S301-V308 VanDerWaalsContact O-CA 3.26Å; S301-V308 WeakPolarHBondContact O-CA 3.06Å; A302-V308 HydrophobicContact CB-CG2 4.44Å; V308-L322 HydrophobicContact CG1-CB 4.39Å; V308-L322 HydrophobicContact CG1-CD2 4.15Å; V308-L322 WeakPolarHBondContact O-CB 3.32Å; V308-L322 PolarHBondContact O-N 3.12Å; V308-V323 HydrophobicContact CB-CG1 3.83Å; V308-V323 HydrophobicContact CG2-CG1 3.87Å; V308-V323 PolarHBondContact N-O 2.86Å; V308-V323 PolarHBondContact O-N 2.86Å; V308-L334 HydrophobicContact CG2-CD1 3.57Å; V308-I337 HydrophobicContact CG1-CD1 3.56Å; V308-I337 HydrophobicContact CG2-CD1 4.09Å; V308-F347 HydrophobicContact CG1-CE2 4.23Å; V308-F347 HydrophobicContact CG1-CZ 4.47Å; V308-F347 HydrophobicContact CG2-CE2 4.11Å; V308-V349 HydrophobicContact CG2-CG1 4.04Å
309	F	98.4	Very high	96.9	Very high	29 Å²	29	45.6 Å²	45.6	13%	0.127	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	143.8	165.1	-67.6	-74.7	0	0	0	109.7	A280 H282 L300 S301 V307 I311 A319 S320 K321	A280-F309 HydrophobicContact CB-CD2 4.24Å; A280-F309 HydrophobicContact CB-CG 4.47Å; H282-F309 AromaticContact CD2-CD2 3.98Å; H282-F309 AromaticContact CE1-CD2 3.49Å; H282-F309 VanDerWaalsContact CE1-CD2 3.49Å; H282-F309 WeakPolarHBondContact CE1-CD2 3.26Å; H282-F309 AromaticContact CE1-CE2 3.78Å; H282-F309 AromaticContact CG-CE2 3.91Å; H282-F309 AromaticContact ND1-CD2 3.96Å; H282-F309 AromaticContact ND1-CE2 3.75Å; H282-F309 AromaticContact NE2-CD2 3.51Å; H282-F309 AromaticContact NE2-CE2 3.96Å; L300-F309 VanDerWaalsContact CA-O 3.28Å; L300-F309 WeakPolarHBondContact CA-O 3.4Å; S301-F309 PolarHBondContact N-O 2.86Å; S301-F309 PolarHBondContact O-N 3.06Å; V307-F309 HydrophobicContact CB-CE2 4.46Å; V307-F309 HydrophobicContact CG1-CD1 4.23Å; V307-F309 HydrophobicContact CG1-CD2 3.98Å; V307-F309 HydrophobicContact CG1-CE1 4.07Å; V307-F309 HydrophobicContact CG1-CE2 3.8Å; V307-F309 HydrophobicContact CG1-CG 4.19Å; V307-F309 HydrophobicContact CG1-CZ 3.84Å; F309-I311 HydrophobicContact CB-CD1 4.01Å; F309-A319 HydrophobicContact CD1-CB 4.36Å; F309-S320 CarbonylContact C-O 3.57Å; F309-S320 WeakPolarHBondContact CA-O 3.34Å; F309-K321 HydrophobicContact CD1-CB 4.29Å; F309-K321 HydrophobicContact CE1-CB 4.19Å
310	T	97.6	Very high	96.8	Very high	35 Å²	35	48.6 Å²	48.6	22%	0.215	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	134.5	155.4	-176.5	0	0	0	0	108.3	A319 S320 L322	T310-A319 WeakPolarHBondContact O-CA 3.29Å; T310-S320 PolarHBondContact N-O 3.09Å; T310-S320 PolarHBondContact O-N 3.36Å; T310-L322 HydrophobicContact CG2-CB 4.4Å
311	I	98.3	Very high	96.7	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	124.2	179.5	-60	88.5	0	0	0	107.8	V279 T298 F299 F309 L313 P318 A319	V279-I311 HydrophobicContact CB-CG2 4.25Å; V279-I311 HydrophobicContact CG2-CG2 4.04Å; T298-I311 VanDerWaalsContact CA-O 3.23Å; T298-I311 WeakPolarHBondContact CA-O 3.37Å; F299-I311 HydrophobicContact CD1-CB 4.26Å; F299-I311 HydrophobicContact CD1-CG2 4.37Å; F299-I311 HydrophobicContact CD2-CB 4.35Å; F299-I311 HydrophobicContact CD2-CD1 4.03Å; F299-I311 HydrophobicContact CE1-CB 3.99Å; F299-I311 HydrophobicContact CE1-CG2 3.69Å; F299-I311 HydrophobicContact CE2-CB 4.08Å; F299-I311 HydrophobicContact CE2-CD1 3.87Å; F299-I311 HydrophobicContact CE2-CG1 4.08Å; F299-I311 HydrophobicContact CE2-CG2 4.37Å; F299-I311 HydrophobicContact CG-CB 4.44Å; F299-I311 HydrophobicContact CZ-CB 3.9Å; F299-I311 HydrophobicContact CZ-CD1 4.49Å; F299-I311 HydrophobicContact CZ-CG1 4.2Å; F299-I311 HydrophobicContact CZ-CG2 3.69Å; F299-I311 PolarHBondContact N-O 2.76Å; F299-I311 VanDerWaalsContact N-O 3.09Å; F299-I311 PolarHBondContact O-N 2.9Å; F309-I311 HydrophobicContact CB-CD1 4.01Å; I311-L313 HydrophobicContact CG2-CD2 3.71Å; I311-L313 HydrophobicContact CG2-CG 4.49Å; I311-P318 CarbonylContact C-O 3.2Å; I311-P318 VanDerWaalsContact CA-O 3.3Å; I311-P318 WeakPolarHBondContact CA-O 3.39Å; I311-P318 HydrophobicContact CG2-CB 3.95Å; I311-A319 HydrophobicContact CG1-CB 4.36Å
312	D	97.2	Very high	96.6	Very high	17 Å²	17	55.9 Å²	55.9	9%	0.091	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	108	170.7	-177.6	-11.5	0	0	0	109.6	C297 T298 R314 Q315 P318	C297-D312 WeakPolarHBondContact O-CA 3.44Å; T298-D312 HydrophobicContact CG2-CB 3.85Å; D312-R314 PolarHBondContact O-N 2.76Å; D312-R314 VanDerWaalsContact O-N 3.11Å; D312-R314 WeakPolarHBondContact OD1-CB 3.48Å; D312-R314 IonicContact OD1-CZ 3.93Å; D312-R314 PolarHBondContact OD1-N 3.19Å; D312-R314 IonicContact OD1-NE 3.9Å; D312-R314 PolarHBondContact OD1-NE 3.41Å; D312-R314 IonicContact OD1-NH2 3.64Å; D312-R314 PolarHBondContact OD1-NH2 3.03Å; D312-R314 IonicContact OD2-CZ 3.71Å; D312-R314 IonicContact OD2-NE 3.6Å; D312-R314 PolarHBondContact OD2-NE 2.87Å; D312-R314 IonicContact OD2-NH2 2.86Å; D312-R314 PolarHBondContact OD2-NH2 2.87Å; D312-Q315 HydrophobicContact CB-CG 3.96Å; D312-Q315 PolarHBondContact O-N 2.97Å; D312-Q315 VanDerWaalsContact O-N 3.16Å; D312-Q315 PolarHBondContact OD2-NE2 3.3Å; D312-P318 PolarHBondContact N-O 3Å; D312-P318 VanDerWaalsContact O-CA 3.3Å; D312-P318 WeakPolarHBondContact O-CA 3.12Å; D312-P318 WeakPolarHBondContact O-CB 3.46Å
313	L	96.1	Very high	96.5	Very high	51 Å²	51	56 Å²	56	27%	0.267	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-9.4	-174.2	-59.2	-176.2	0	0	0	114.5	L245 T252 V264 V279 C297 F299 I311 Q315 P318	L245-L313 HydrophobicContact CD1-CD1 3.57Å; T252-L313 HydrophobicContact CG2-CD1 4.33Å; V264-L313 HydrophobicContact CG1-CD1 4.05Å; V264-L313 HydrophobicContact CG2-CD1 4.11Å; V264-L313 HydrophobicContact CG2-CD2 3.85Å; V279-L313 HydrophobicContact CB-CD2 4.48Å; V279-L313 HydrophobicContact CG1-CD2 3.87Å; C297-L313 HydrophobicContact CB-CB 4.33Å; C297-L313 PolarHBondContact O-N 3.03Å; F299-L313 HydrophobicContact CE1-CD1 4.28Å; F299-L313 HydrophobicContact CE1-CD2 4.14Å; F299-L313 HydrophobicContact CE1-CG 4.21Å; I311-L313 HydrophobicContact CG2-CD2 3.71Å; I311-L313 HydrophobicContact CG2-CG 4.49Å; L313-Q315 VanDerWaalsContact C-N 3.34Å; L313-P318 HydrophobicContact CD2-CB 4.37Å
314	R	95.6	Very high	96.6	Very high	174 Å²	174	56.7 Å²	56.7	66%	0.657	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-13.4	176	-56	167.4	-64.1	-170.5	3.8	112.7	C297 D312	C297-R314 HydrophobicContact CB-CG 4.08Å; C297-R314 VanDerWaalsContact SG-CD 3.59Å; C297-R314 PolarHBondContact SG-NE 2.89Å; C297-R314 VanDerWaalsContact SG-NE 3.44Å; D312-R314 PolarHBondContact O-N 2.76Å; D312-R314 VanDerWaalsContact O-N 3.11Å; D312-R314 WeakPolarHBondContact OD1-CB 3.48Å; D312-R314 IonicContact OD1-CZ 3.93Å; D312-R314 PolarHBondContact OD1-N 3.19Å; D312-R314 IonicContact OD1-NE 3.9Å; D312-R314 PolarHBondContact OD1-NE 3.41Å; D312-R314 IonicContact OD1-NH2 3.64Å; D312-R314 PolarHBondContact OD1-NH2 3.03Å; D312-R314 IonicContact OD2-CZ 3.71Å; D312-R314 IonicContact OD2-NE 3.6Å; D312-R314 PolarHBondContact OD2-NE 2.87Å; D312-R314 IonicContact OD2-NH2 2.86Å; D312-R314 PolarHBondContact OD2-NH2 2.87Å
315	Q	95.6	Very high	96.6	Very high	99 Å²	99	52.6 Å²	52.6	46%	0.463	25%	0.254	S	S	.	.	S	Bend	trans	-93.7	143.3	-176.1	-57.1	-177.4	22.2	0	0	111.3	D312 L313 R317 P318	D312-Q315 HydrophobicContact CB-CG 3.96Å; D312-Q315 PolarHBondContact O-N 2.97Å; D312-Q315 VanDerWaalsContact O-N 3.16Å; D312-Q315 PolarHBondContact OD2-NE2 3.3Å; L313-Q315 VanDerWaalsContact C-N 3.34Å; Q315-R317 PolarHBondContact O-N 3.15Å; Q315-R317 VanDerWaalsContact O-N 3.15Å; Q315-P318 WeakPolarHBondContact O-CD 3.28Å; Q315-P318 WeakPolarHBondContact O-CG 3.03Å
316	D	91.8	Very high	96.5	Very high	168 Å²	168	53.9 Å²	53.9	90%	0.898	26%	0.258	S	S	*	.	S	Bend	trans	-56	-32.8	176.3	-65.8	-37.4	0	0	0	112.8
317	R	94.6	Very high	96.2	Very high	214 Å²	214	55.7 Å²	55.7	81%	0.808	27%	0.267	S	S	*	.	S	Bend	trans	-115.3	89.5	171.4	-66.7	-178.6	62.6	152.3	0.8	108.2	Q315 A319	Q315-R317 PolarHBondContact O-N 3.15Å; Q315-R317 VanDerWaalsContact O-N 3.15Å; R317-A319 VanDerWaalsContact C-N 3.32Å; R317-A319 PolarHBondContact O-N 3.07Å
318	P	95.1	Very high	95.7	Very high	14 Å²	14	64 Å²	64	9%	0.091	30%	0.302	C	S	.	.			trans	-62	-35.1	-168	-27.7	35.4	0	0	0	114.8	V279 I311 D312 L313 Q315	V279-P318 HydrophobicContact CB-CB 4.17Å; V279-P318 HydrophobicContact CB-CG 4.43Å; V279-P318 HydrophobicContact CG1-CB 4.45Å; V279-P318 HydrophobicContact CG1-CG 4.34Å; I311-P318 CarbonylContact C-O 3.2Å; I311-P318 VanDerWaalsContact CA-O 3.3Å; I311-P318 WeakPolarHBondContact CA-O 3.39Å; I311-P318 HydrophobicContact CG2-CB 3.95Å; D312-P318 PolarHBondContact N-O 3Å; D312-P318 VanDerWaalsContact O-CA 3.3Å; D312-P318 WeakPolarHBondContact O-CA 3.12Å; D312-P318 WeakPolarHBondContact O-CB 3.46Å; L313-P318 HydrophobicContact CD2-CB 4.37Å; Q315-P318 WeakPolarHBondContact O-CD 3.28Å; Q315-P318 WeakPolarHBondContact O-CG 3.03Å
319	A	97.4	Very high	95.1	Very high	30 Å²	30	70.7 Å²	70.7	25%	0.248	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	124.6	-174.4	0	0	0	0	0	113	V279 A280 F309 T310 I311 R317	V279-A319 VanDerWaalsContact O-CB 3.29Å; V279-A319 WeakPolarHBondContact O-CB 3.33Å; A280-A319 HydrophobicContact CB-CB 3.58Å; F309-A319 HydrophobicContact CD1-CB 4.36Å; T310-A319 WeakPolarHBondContact O-CA 3.29Å; I311-A319 HydrophobicContact CG1-CB 4.36Å; R317-A319 VanDerWaalsContact C-N 3.32Å; R317-A319 PolarHBondContact O-N 3.07Å
320	S	96.7	Very high	94.8	Very high	66 Å²	66	77 Å²	77	46%	0.462	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	143.1	166.6	-173.7	0	0	0	0	110.4	F309 T310 L322	F309-S320 CarbonylContact C-O 3.57Å; F309-S320 WeakPolarHBondContact CA-O 3.34Å; T310-S320 PolarHBondContact N-O 3.09Å; T310-S320 PolarHBondContact O-N 3.36Å; S320-L322 PolarHBondContact O-N 3.07Å
321	K	96.4	Very high	94.8	Very high	123 Å²	123	82.4 Å²	82.4	54%	0.535	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	119.5	177	-172.2	-163.9	-65.8	173.1	0	108.6	V307 F309 V324	V307-K321 HydrophobicContact CG1-CG 3.78Å; F309-K321 HydrophobicContact CD1-CB 4.29Å; F309-K321 HydrophobicContact CE1-CB 4.19Å; K321-V324 HydrophobicContact CD-CG2 3.81Å
322	L	96.1	Very high	94.6	Very high	34 Å²	34	82.8 Å²	82.8	18%	0.178	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	-46.8	-177.8	-179.1	60.7	0	0	0	112.1	L300 V308 T310 S320 F347 Q361 I364	L300-L322 HydrophobicContact CD1-CD2 4.29Å; L300-L322 HydrophobicContact CD2-CD2 3.91Å; V308-L322 HydrophobicContact CG1-CB 4.39Å; V308-L322 HydrophobicContact CG1-CD2 4.15Å; V308-L322 WeakPolarHBondContact O-CB 3.32Å; V308-L322 PolarHBondContact O-N 3.12Å; T310-L322 HydrophobicContact CG2-CB 4.4Å; S320-L322 PolarHBondContact O-N 3.07Å; L322-F347 HydrophobicContact CD2-CD1 4.44Å; L322-F347 HydrophobicContact CD2-CE1 3.65Å; L322-F347 HydrophobicContact CD2-CZ 3.87Å; L322-F347 HydrophobicContact CG-CE1 4.45Å; L322-F347 HydrophobicContact CG-CZ 4.47Å; L322-Q361 HydrophobicContact CD2-CG 4.17Å; L322-I364 HydrophobicContact CD1-CD1 3.8Å; L322-I364 HydrophobicContact CD2-CD1 4.47Å; L322-I364 HydrophobicContact CG-CD1 3.77Å
323	V	97.1	Very high	94.6	Very high	2 Å²	2	82.4 Å²	82.4	1%	0.012	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	153.8	176.6	62.5	0	0	0	0	111.2	V308 F347 Y359 I364	V308-V323 HydrophobicContact CB-CG1 3.83Å; V308-V323 HydrophobicContact CG2-CG1 3.87Å; V308-V323 PolarHBondContact N-O 2.86Å; V308-V323 PolarHBondContact O-N 2.86Å; V323-F347 HydrophobicContact CG1-CE2 4.43Å; V323-F347 HydrophobicContact CG1-CZ 3.99Å; V323-Y359 HydrophobicContact CG2-CD1 4.46Å; V323-Y359 HydrophobicContact CG2-CE1 3.86Å; V323-I364 HydrophobicContact CB-CD1 4.08Å; V323-I364 HydrophobicContact CB-CG2 3.94Å; V323-I364 HydrophobicContact CG1-CD1 4.41Å; V323-I364 HydrophobicContact CG2-CG2 3.79Å
324	V	97	Very high	94.6	Very high	15 Å²	15	80 Å²	80	9%	0.091	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	114.8	161.8	-172.8	0	0	0	0	107.6	A306 V307 K321 K326 K331 N370	A306-V324 HydrophobicContact CB-CG1 4.21Å; A306-V324 CarbonylContact O-C 3.57Å; A306-V324 WeakPolarHBondContact O-CA 2.86Å; V307-V324 HydrophobicContact CG2-CG2 4.43Å; K321-V324 HydrophobicContact CD-CG2 3.81Å; V324-K326 PolarHBondContact O-N 2.98Å; V324-K331 HydrophobicContact CG1-CD 4.41Å; V324-K331 HydrophobicContact CG1-CG 4.28Å; V324-N370 PolarHBondContact O-ND2 2.71Å; V324-N370 PolarHBondContact O-OD1 3.07Å
325	T	96.6	Very high	94.7	Very high	0 Å²	0	72.2 Å²	72.2	0%	0	34%	0.342	C	S	.	.			trans	-74.1	127.1	-179.5	-62.9	0	0	0	0	111	A306 V332 L334 V349 Y359	A306-T325 WeakPolarHBondContact CB-O 3.47Å; A306-T325 PolarHBondContact O-N 2.87Å; T325-V332 HydrophobicContact CG2-CB 4.11Å; T325-V332 PolarHBondContact O-N 2.89Å; T325-L334 HydrophobicContact CG2-CD2 4.14Å; T325-V349 HydrophobicContact CG2-CG2 4.48Å; T325-Y359 WeakPolarHBondContact CG2-OH 3.27Å; T325-Y359 PolarHBondContact OG1-OH 2.91Å; T325-Y359 VanDerWaalsContact OG1-OH 3.14Å
326	K	94.6	Very high	94.8	Very high	49 Å²	49	67.5 Å²	67.5	21%	0.213	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	156.7	176.9	-56.8	-179.2	-168	170.5	0	112	V324 E329 K330 N370	V324-K326 PolarHBondContact O-N 2.98Å; K326-E329 IonicContact NZ-OE1 3.57Å; K326-E329 IonicContact NZ-OE2 3.07Å; K326-E329 PolarHBondContact NZ-OE2 3.43Å; K326-K330 CarbonylContact C-O 3.57Å; K326-K330 WeakPolarHBondContact CA-O 3.32Å; K326-N370 WeakPolarHBondContact CD-OD1 3.23Å; K326-N370 WeakPolarHBondContact CG-OD1 3.47Å
327	E	92.3	Very high	95.1	Very high	38 Å²	38	59.5 Å²	59.5	18%	0.178	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	119.4	163.1	-172.3	62.3	-148.2	0	0	108.1	E329 K330 V332 F355 R357 K375	E327-E329 VanDerWaalsContact C-N 3.33Å; E327-E329 PolarHBondContact O-N 2.77Å; E327-K330 PolarHBondContact N-O 3.31Å; E327-K330 WeakPolarHBondContact O-CB 3.47Å; E327-K330 PolarHBondContact O-N 3.34Å; E327-V332 HydrophobicContact CB-CG2 3.88Å; E327-F355 HydrophobicContact CG-CD2 4.5Å; E327-F355 HydrophobicContact CG-CE2 4.49Å; E327-R357 IonicContact OE2-CZ 3.55Å; E327-R357 IonicContact OE2-NE 2.83Å; E327-R357 IonicContact OE2-NH2 3.45Å; E327-R357 PolarHBondContact OE2-NH2 2.93Å; E327-K375 IonicContact OE1-NZ 2.67Å; E327-K375 PolarHBondContact OE1-NZ 2.91Å; E327-K375 IonicContact OE2-NZ 2.75Å; E327-K375 PolarHBondContact OE2-NZ 2.93Å
328	K	87.3	Confident	95.3	Very high	186 Å²	186	52 Å²	52	81%	0.809	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	52.5	-178.5	-56.6	176	-176.2	176.6	0	112.1	K330	K328-K330 PolarHBondContact O-N 3.32Å
329	E	85.6	Confident	95.4	Very high	140 Å²	140	51.7 Å²	51.7	65%	0.654	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.5	-7.1	-171.7	-65.6	-49.7	116.8	0	0	118.2	K326 E327	K326-E329 IonicContact NZ-OE1 3.57Å; K326-E329 IonicContact NZ-OE2 3.07Å; K326-E329 PolarHBondContact NZ-OE2 3.43Å; E327-E329 VanDerWaalsContact C-N 3.33Å; E327-E329 PolarHBondContact O-N 2.77Å
330	K	92.9	Very high	95.4	Very high	163 Å²	163	50.6 Å²	50.6	71%	0.709	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-82.1	132.9	174.9	-61.8	-174.1	179.7	-175.3	0	110.3	K326 E327 K328	K326-K330 CarbonylContact C-O 3.57Å; K326-K330 WeakPolarHBondContact CA-O 3.32Å; E327-K330 PolarHBondContact N-O 3.31Å; E327-K330 WeakPolarHBondContact O-CB 3.47Å; E327-K330 PolarHBondContact O-N 3.34Å; K328-K330 PolarHBondContact O-N 3.32Å
331	K	95.7	Very high	95.3	Very high	148 Å²	148	49.7 Å²	49.7	64%	0.643	23%	0.231	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-65.8	135.9	173.5	-70.8	-175.5	-178	-179.6	0	110.7	A306 V324	A306-K331 HydrophobicContact CB-CB 3.78Å; A306-K331 HydrophobicContact CB-CD 4.49Å; A306-K331 HydrophobicContact CB-CG 4.29Å; V324-K331 HydrophobicContact CG1-CD 4.41Å; V324-K331 HydrophobicContact CG1-CG 4.28Å
332	V	95.8	Very high	95.3	Very high	8 Å²	8	47.2 Å²	47.2	5%	0.048	23%	0.233	C	C	.	.			trans	-109.4	107.5	177.2	-176.7	0	0	0	0	108.4	A306 T325 E327 L334 D353	A306-V332 WeakPolarHBondContact CA-O 3.4Å; A306-V332 WeakPolarHBondContact CB-O 3.44Å; T325-V332 HydrophobicContact CG2-CB 4.11Å; T325-V332 PolarHBondContact O-N 2.89Å; E327-V332 HydrophobicContact CB-CG2 3.88Å; V332-L334 PolarHBondContact O-N 3.07Å; V332-D353 HydrophobicContact CG1-CB 4.18Å; V332-D353 WeakPolarHBondContact CG2-OD2 3.23Å
333	G	96.2	Very high	95.2	Very high	9 Å²	9	47.9 Å²	47.9	9%	0.093	24%	0.237	C	C	.	.			trans	-60.6	134.8	176.9	0	0	0	0	0	110.9	E304 G351 R352	E304-G333 WeakPolarHBondContact O-CA 3.39Å; G333-G351 CarbonylContact O-C 3.59Å; G333-G351 WeakPolarHBondContact O-CA 3.31Å; G333-R352 PolarHBondContact O-N 3.38Å
334	L	97.4	Very high	95.1	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	129.2	-172.2	-58.3	179	0	0	0	111.3	A302 G303 V308 T325 V332 V349	A302-L334 HydrophobicContact CB-CB 3.93Å; A302-L334 HydrophobicContact CB-CD1 3.97Å; G303-L334 CarbonylContact C-O 3.59Å; G303-L334 WeakPolarHBondContact O-CB 3.29Å; G303-L334 PolarHBondContact O-N 3Å; V308-L334 HydrophobicContact CG2-CD1 3.57Å; T325-L334 HydrophobicContact CG2-CD2 4.14Å; V332-L334 PolarHBondContact O-N 3.07Å; L334-V349 HydrophobicContact CD1-CB 4.23Å; L334-V349 HydrophobicContact CD1-CG1 4.24Å; L334-V349 HydrophobicContact CD1-CG2 4.45Å; L334-V349 HydrophobicContact CD2-CB 4.02Å; L334-V349 HydrophobicContact CD2-CG2 3.9Å
335	Y	95.9	Very high	95	Very high	11 Å²	11	52.1 Å²	52.1	4%	0.043	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	-21.5	175.2	-56	-33.4	0	0	0	111.7	H287 E304 G350 R352 N389 F540 D541	H287-Y335 WeakPolarHBondContact CB-O 3.34Å; H287-Y335 AromaticContact CD2-CD1 3.69Å; H287-Y335 AromaticContact NE2-CD1 3.72Å; E304-Y335 HydrophobicContact CG-CE1 4.3Å; Y335-G350 PolarHBondContact N-O 3.38Å; Y335-R352 HydrophobicContact CE2-CB 4.23Å; Y335-N389 HydrophobicContact CE2-CB 4.27Å; Y335-F540 HydrophobicContact CE2-CE1 4.03Å; Y335-D541 PolarHBondContact OH-OD1 3.26Å
336	T	97.6	Very high	95	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	145	-176.2	-178.2	0	0	0	0	113.2	K288 V349 G350 I390 L393	K288-T336 VanDerWaalsContact CD-OG1 3.28Å; K288-T336 WeakPolarHBondContact CD-OG1 3.17Å; K288-T336 PolarHBondContact NZ-OG1 2.93Å; K288-T336 VanDerWaalsContact NZ-OG1 3.09Å; T336-V349 WeakPolarHBondContact O-CA 2.74Å; T336-G350 WeakPolarHBondContact CG2-O 3.38Å; T336-G350 PolarHBondContact N-O 2.98Å; T336-G350 PolarHBondContact O-N 2.96Å; T336-I390 HydrophobicContact CG2-CG2 3.88Å; T336-L393 HydrophobicContact CG2-CB 4.25Å; T336-L393 HydrophobicContact CG2-CD2 3.72Å; T336-L393 HydrophobicContact CG2-CG 3.68Å; T336-L393 PolarHBondContact OG1-N 3.08Å; T336-L393 VanDerWaalsContact OG1-N 3.07Å
337	I	98.5	Very high	95.2	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	148	172.2	-176.8	163.8	0	0	0	109.7	K288 A290 L300 A302 V308 F347 A348 V349	K288-I337 HydrophobicContact CB-CG2 4.19Å; K288-I337 WeakPolarHBondContact O-CG2 3.19Å; A290-I337 HydrophobicContact CB-CB 4.45Å; A290-I337 HydrophobicContact CB-CG1 3.93Å; A290-I337 HydrophobicContact CB-CG2 4.04Å; L300-I337 HydrophobicContact CB-CD1 3.8Å; L300-I337 HydrophobicContact CD1-CD1 3.95Å; A302-I337 HydrophobicContact CB-CB 3.79Å; A302-I337 HydrophobicContact CB-CD1 4.32Å; A302-I337 HydrophobicContact CB-CG2 3.61Å; V308-I337 HydrophobicContact CG1-CD1 3.56Å; V308-I337 HydrophobicContact CG2-CD1 4.09Å; I337-F347 HydrophobicContact CD1-CD2 3.7Å; I337-F347 HydrophobicContact CD1-CE2 4.14Å; I337-F347 HydrophobicContact CD1-CG 4.47Å; I337-F347 HydrophobicContact CG1-CD2 4.06Å; I337-A348 CarbonylContact C-O 3.56Å; I337-A348 VanDerWaalsContact CA-O 3.29Å; I337-A348 WeakPolarHBondContact CA-O 3.43Å; I337-V349 HydrophobicContact CB-CG1 4.16Å; I337-V349 HydrophobicContact CD1-CG1 3.97Å; I337-V349 HydrophobicContact CG1-CG1 3.91Å
338	F	98.3	Very high	95.5	Very high	56 Å²	56	49.8 Å²	49.8	25%	0.246	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	134.9	172.4	-153	-84.1	0	0	0	110.6	F347 A348 L393 V394 Y395	F338-F347 CarbonylContact O-C 3.54Å; F338-F347 VanDerWaalsContact O-CA 3.31Å; F338-F347 WeakPolarHBondContact O-CA 3.4Å; F338-A348 PolarHBondContact N-O 2.69Å; F338-A348 PolarHBondContact O-N 3.26Å; F338-L393 HydrophobicContact CB-CD1 3.54Å; F338-V394 HydrophobicContact CD2-CB 4.28Å; F338-V394 HydrophobicContact CD2-CG1 3.96Å; F338-V394 HydrophobicContact CE2-CB 4.21Å; F338-V394 HydrophobicContact CE2-CG1 3.88Å; F338-Y395 HydrophobicContact CB-CD2 4.41Å; F338-Y395 AromaticContact CD1-CD2 3.95Å; F338-Y395 HydrophobicContact CD1-CD2 3.95Å; F338-Y395 HydrophobicContact CD1-CG 4.47Å
339	V	98.1	Very high	96	Very high	7 Å²	7	40.9 Å²	40.9	4%	0.042	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	137.1	176	167.1	0	0	0	0	109.1	A290 L300 P341 F347	A290-V339 HydrophobicContact CB-CB 4.43Å; A290-V339 HydrophobicContact CB-CG2 3.83Å; L300-V339 HydrophobicContact CD1-CG2 3.82Å; L300-V339 HydrophobicContact CG-CG2 4.27Å; V339-P341 WeakPolarHBondContact O-CD 3.29Å; V339-F347 HydrophobicContact CG2-CB 4.16Å
340	N	97.4	Very high	96.6	Very high	7 Å²	7	34.2 Å²	34.2	4%	0.037	18%	0.177	C	C	.	.			trans	-66.6	119	177.3	178.2	-24	0	0	0	109.5	A342 N343 T344 Q346 Y395 G399	N340-A342 VanDerWaalsContact C-N 3.27Å; N340-A342 PolarHBondContact O-N 3.01Å; N340-A342 PolarHBondContact OD1-N 3.3Å; N340-N343 WeakPolarHBondContact CB-O 3.48Å; N340-N343 CarbonylContact O-C 3.58Å; N340-N343 PolarHBondContact O-N 3.45Å; N340-N343 PolarHBondContact OD1-N 3.11Å; N340-T344 PolarHBondContact O-N 3.31Å; N340-Q346 HydrophobicContact CB-CB 4Å; N340-Q346 WeakPolarHBondContact CB-O 3.3Å; N340-Q346 PolarHBondContact N-O 2.92Å; N340-Y395 HydrophobicContact CB-CD1 4.39Å; N340-Y395 HydrophobicContact CB-CD2 4.15Å; N340-Y395 HydrophobicContact CB-CE1 4.13Å; N340-Y395 HydrophobicContact CB-CE2 3.87Å; N340-Y395 HydrophobicContact CB-CG 4.38Å; N340-G399 PolarHBondContact ND2-O 3.09Å; N340-G399 VanDerWaalsContact OD1-CA 3.29Å; N340-G399 WeakPolarHBondContact OD1-CA 3.13Å
341	P	95.1	Very high	96.7	Very high	48 Å²	48	26.5 Å²	26.5	31%	0.312	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-21.2	-173.1	27.8	-34.7	0	0	0	113.8	P293 V339 S396	P293-P341 HydrophobicContact CG-CB 4.47Å; V339-P341 WeakPolarHBondContact O-CD 3.29Å; P341-S396 VanDerWaalsContact CG-O 3.23Å; P341-S396 WeakPolarHBondContact CG-O 3.45Å
342	A	94.8	Very high	96.6	Very high	71 Å²	71	26.2 Å²	26.2	59%	0.587	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-8.8	176.4	0	0	0	0	0	113.5	N340 D398	N340-A342 VanDerWaalsContact C-N 3.27Å; N340-A342 PolarHBondContact O-N 3.01Å; N340-A342 PolarHBondContact OD1-N 3.3Å; A342-D398 WeakPolarHBondContact CB-O 3.47Å
343	N	95.2	Very high	96.4	Very high	48 Å²	48	26.5 Å²	26.5	26%	0.257	14%	0.14	S	C	.	.			trans	-152.1	87	178.8	179.1	10.6	0	0	0	109.5	N340 H345 Q346	N340-N343 WeakPolarHBondContact CB-O 3.48Å; N340-N343 CarbonylContact O-C 3.58Å; N340-N343 PolarHBondContact O-N 3.45Å; N340-N343 PolarHBondContact OD1-N 3.11Å; N343-H345 PolarHBondContact O-N 2.89Å; N343-Q346 WeakPolarHBondContact ND2-CG 3.45Å; N343-Q346 PolarHBondContact ND2-NE2 2.86Å; N343-Q346 PolarHBondContact O-N 2.71Å
344	T	94.8	Very high	96.3	Very high	27 Å²	27	27 Å²	27	17%	0.166	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-20.1	-172.6	67.6	0	0	0	0	113.8	E292 N340 Q346 Q361	E292-T344 HydrophobicContact CG-CG2 4.05Å; E292-T344 WeakPolarHBondContact OE1-CB 3.18Å; E292-T344 PolarHBondContact OE1-OG1 3.44Å; E292-T344 VanDerWaalsContact OE1-OG1 3.12Å; N340-T344 PolarHBondContact O-N 3.31Å; T344-Q346 PolarHBondContact O-N 3.33Å; T344-Q361 PolarHBondContact O-NE2 2.92Å
345	H	95.1	Very high	96.3	Very high	79 Å²	79	28.2 Å²	28.2	37%	0.366	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-11.3	171.3	-54.5	-53.7	0	0	0	113.9	N343 D360 Q361 R362	N343-H345 PolarHBondContact O-N 2.89Å; H345-D360 CarbonylContact O-C 3.41Å; H345-D360 WeakPolarHBondContact O-CA 3.33Å; H345-Q361 WeakPolarHBondContact O-CG 3.46Å; H345-Q361 PolarHBondContact O-N 3.09Å; H345-R362 HydrophobicContact CB-CG 4.41Å; H345-R362 PolarHBondContact CD2-NH1 3.2Å
346	Q	96.8	Very high	96.3	Very high	37 Å²	37	27.7 Å²	27.7	17%	0.173	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	141	174.6	-74.6	178.7	-0.7	0	0	111.8	N340 N343 T344 I358 Y359 D360	N340-Q346 HydrophobicContact CB-CB 4Å; N340-Q346 WeakPolarHBondContact CB-O 3.3Å; N340-Q346 PolarHBondContact N-O 2.92Å; N343-Q346 WeakPolarHBondContact ND2-CG 3.45Å; N343-Q346 PolarHBondContact ND2-NE2 2.86Å; N343-Q346 PolarHBondContact O-N 2.71Å; T344-Q346 PolarHBondContact O-N 3.33Å; Q346-I358 HydrophobicContact CB-CG2 4.49Å; Q346-Y359 VanDerWaalsContact CA-O 3.26Å; Q346-Y359 WeakPolarHBondContact CA-O 3.45Å; Q346-D360 HydrophobicContact CG-CB 4.29Å
347	F	98	Very high	96.4	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	152.4	171.1	67.8	-83.5	0	0	0	110.1	L300 V308 L322 V323 I337 F338 V339 V349 I358 Y359 Q361 I364	L300-F347 HydrophobicContact CD1-CB 3.96Å; L300-F347 HydrophobicContact CD1-CD1 3.92Å; L300-F347 HydrophobicContact CD1-CD2 4.25Å; L300-F347 HydrophobicContact CD1-CE1 4.5Å; L300-F347 HydrophobicContact CD1-CG 3.77Å; V308-F347 HydrophobicContact CG1-CE2 4.23Å; V308-F347 HydrophobicContact CG1-CZ 4.47Å; V308-F347 HydrophobicContact CG2-CE2 4.11Å; L322-F347 HydrophobicContact CD2-CD1 4.44Å; L322-F347 HydrophobicContact CD2-CE1 3.65Å; L322-F347 HydrophobicContact CD2-CZ 3.87Å; L322-F347 HydrophobicContact CG-CE1 4.45Å; L322-F347 HydrophobicContact CG-CZ 4.47Å; V323-F347 HydrophobicContact CG1-CE2 4.43Å; V323-F347 HydrophobicContact CG1-CZ 3.99Å; I337-F347 HydrophobicContact CD1-CD2 3.7Å; I337-F347 HydrophobicContact CD1-CE2 4.14Å; I337-F347 HydrophobicContact CD1-CG 4.47Å; I337-F347 HydrophobicContact CG1-CD2 4.06Å; F338-F347 CarbonylContact O-C 3.54Å; F338-F347 VanDerWaalsContact O-CA 3.31Å; F338-F347 WeakPolarHBondContact O-CA 3.4Å; V339-F347 HydrophobicContact CG2-CB 4.16Å; F347-V349 HydrophobicContact CD2-CG1 3.73Å; F347-V349 HydrophobicContact CE2-CG1 3.7Å; F347-I358 WeakPolarHBondContact O-CA 3.48Å; F347-Y359 HydrophobicContact CD2-CD2 4.36Å; F347-Y359 VanDerWaalsContact CE1-CB 3.47Å; F347-Y359 HydrophobicContact CE1-CG 4.28Å; F347-Y359 AromaticContact CE2-CD2 3.64Å; F347-Y359 HydrophobicContact CE2-CD2 3.64Å; F347-Y359 HydrophobicContact CE2-CE2 4.46Å; F347-Y359 HydrophobicContact CE2-CG 4.04Å; F347-Y359 VanDerWaalsContact CZ-CB 3.43Å; F347-Y359 AromaticContact CZ-CD2 3.84Å; F347-Y359 HydrophobicContact CZ-CD2 3.84Å; F347-Y359 AromaticContact CZ-CG 3.73Å; F347-Y359 HydrophobicContact CZ-CG 3.73Å; F347-Y359 PolarHBondContact N-O 2.71Å; F347-Y359 VanDerWaalsContact N-O 3.13Å; F347-Y359 PolarHBondContact O-N 3.43Å; F347-Q361 HydrophobicContact CD1-CG 3.64Å; F347-Q361 HydrophobicContact CE1-CG 3.74Å; F347-I364 HydrophobicContact CE1-CD1 4.13Å; F347-I364 HydrophobicContact CZ-CD1 4.2Å
348	A	98.5	Very high	96.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	144	175.7	0	0	0	0	0	110.6	I337 F338 R357 I358 L393 Y395 L402	I337-A348 CarbonylContact C-O 3.56Å; I337-A348 VanDerWaalsContact CA-O 3.29Å; I337-A348 WeakPolarHBondContact CA-O 3.43Å; F338-A348 PolarHBondContact N-O 2.69Å; F338-A348 PolarHBondContact O-N 3.26Å; A348-R357 CarbonylContact C-O 3.59Å; A348-R357 WeakPolarHBondContact CA-O 3.29Å; A348-I358 HydrophobicContact CB-CG1 4.27Å; A348-L393 HydrophobicContact CB-CD1 3.76Å; A348-L393 HydrophobicContact CB-CD2 4.28Å; A348-Y395 HydrophobicContact CB-CD2 4.47Å; A348-Y395 HydrophobicContact CB-CE2 3.57Å; A348-L402 HydrophobicContact CB-CD1 3.96Å; A348-L402 HydrophobicContact CB-CD2 3.73Å
349	V	98.6	Very high	96.3	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	156.9	174	-53.4	0	0	0	0	111.8	V308 T325 L334 T336 I337 F347 R357 Y359	V308-V349 HydrophobicContact CG2-CG1 4.04Å; T325-V349 HydrophobicContact CG2-CG2 4.48Å; L334-V349 HydrophobicContact CD1-CB 4.23Å; L334-V349 HydrophobicContact CD1-CG1 4.24Å; L334-V349 HydrophobicContact CD1-CG2 4.45Å; L334-V349 HydrophobicContact CD2-CB 4.02Å; L334-V349 HydrophobicContact CD2-CG2 3.9Å; T336-V349 WeakPolarHBondContact O-CA 2.74Å; I337-V349 HydrophobicContact CB-CG1 4.16Å; I337-V349 HydrophobicContact CD1-CG1 3.97Å; I337-V349 HydrophobicContact CG1-CG1 3.91Å; F347-V349 HydrophobicContact CD2-CG1 3.73Å; F347-V349 HydrophobicContact CE2-CG1 3.7Å; V349-R357 HydrophobicContact CG2-CB 4.02Å; V349-R357 PolarHBondContact N-O 3.11Å; V349-R357 PolarHBondContact O-N 2.85Å; V349-Y359 HydrophobicContact CG2-CD2 4.27Å; V349-Y359 HydrophobicContact CG2-CE2 3.65Å
350	G	97.3	Very high	96.2	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	162.1	173.8	0	0	0	0	0	110.3	Y335 T336	Y335-G350 PolarHBondContact N-O 3.38Å; T336-G350 WeakPolarHBondContact CG2-O 3.38Å; T336-G350 PolarHBondContact N-O 2.98Å; T336-G350 PolarHBondContact O-N 2.96Å
351	G	95	Very high	96	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.1	-124.5	-179.2	0	0	0	0	0	111.6	G333 D353 N389 I390	G333-G351 CarbonylContact O-C 3.59Å; G333-G351 WeakPolarHBondContact O-CA 3.31Å; G351-D353 PolarHBondContact O-N 3.03Å; G351-D353 VanDerWaalsContact O-O 3.14Å; G351-N389 CarbonylContact O-C 3.53Å; G351-N389 WeakPolarHBondContact O-CA 3.37Å; G351-N389 WeakPolarHBondContact O-CB 3.26Å; G351-I390 WeakPolarHBondContact CA-O 3.3Å; G351-I390 PolarHBondContact O-N 3.35Å
352	R	93.3	Very high	96	Very high	142 Å²	142	32.2 Å²	32.2	54%	0.536	15%	0.154	S	C	.	.	S	Bend	trans	-75.6	42.7	-173	-157.7	-165.5	179	123.4	12.2	114.9	G333 Y335 N389 D541	G333-R352 PolarHBondContact O-N 3.38Å; Y335-R352 HydrophobicContact CE2-CB 4.23Å; R352-N389 VanDerWaalsContact C-OD1 3.28Å; R352-N389 VanDerWaalsContact CA-OD1 3.25Å; R352-N389 WeakPolarHBondContact CA-OD1 3.3Å; R352-D541 IonicContact CZ-OD2 2.71Å; R352-D541 IonicContact NH1-OD2 2.82Å; R352-D541 PolarHBondContact NH1-OD2 3.04Å; R352-D541 IonicContact NH2-OD2 2.66Å; R352-D541 PolarHBondContact NH2-OD2 3.17Å
353	D	93.1	Very high	95.8	Very high	14 Å²	14	36.1 Å²	36.1	8%	0.075	16%	0.158	C	C	.	.	S	Bend	trans	-163.4	178.9	161.7	69.2	15.6	0	0	0	111.1	V332 G351 F355 R357 A388 I390	V332-D353 HydrophobicContact CG1-CB 4.18Å; V332-D353 WeakPolarHBondContact CG2-OD2 3.23Å; G351-D353 PolarHBondContact O-N 3.03Å; G351-D353 VanDerWaalsContact O-O 3.14Å; D353-F355 VanDerWaalsContact C-N 3.27Å; D353-F355 PolarHBondContact O-N 3.04Å; D353-F355 PolarHBondContact OD1-N 2.66Å; D353-F355 VanDerWaalsContact OD1-N 3.07Å; D353-R357 VanDerWaalsContact CG-NH1 3.34Å; D353-R357 IonicContact OD1-CZ 3.74Å; D353-R357 IonicContact OD1-NH1 3.53Å; D353-R357 PolarHBondContact OD1-NH1 3.09Å; D353-R357 IonicContact OD1-NH2 3.97Å; D353-R357 IonicContact OD2-CZ 2.87Å; D353-R357 VanDerWaalsContact OD2-CZ 3.28Å; D353-R357 IonicContact OD2-NH1 2.73Å; D353-R357 PolarHBondContact OD2-NH1 2.96Å; D353-R357 IonicContact OD2-NH2 3.8Å; D353-R357 PolarHBondContact OD2-NH2 2.82Å; D353-A388 CarbonylContact C-O 3.51Å; D353-I390 PolarHBondContact O-N 3.19Å
354	Q	93.9	Very high	95.7	Very high	19 Å²	19	35.8 Å²	35.8	9%	0.089	16%	0.155	C	C	.	.	S	Bend	trans	-81.3	1.3	-175.1	66.4	-91.4	68.4	0	0	114.4	C377 L381 A388 Y406	Q354-C377 WeakPolarHBondContact CG-SG 3.49Å; Q354-L381 HydrophobicContact CB-CB 4.35Å; Q354-L381 PolarHBondContact NE2-O 3.07Å; Q354-A388 VanDerWaalsContact CA-O 3.29Å; Q354-A388 WeakPolarHBondContact CA-O 3.33Å; Q354-A388 WeakPolarHBondContact CB-O 3.47Å; Q354-A388 PolarHBondContact N-O 2.87Å; Q354-A388 VanDerWaalsContact N-O 3.09Å; Q354-Y406 HydrophobicContact CB-CE1 4.15Å; Q354-Y406 VanDerWaalsContact O-CE1 3.29Å; Q354-Y406 WeakPolarHBondContact O-CE1 3.39Å; Q354-Y406 PolarHBondContact O-OH 2.85Å
355	F	96.3	Very high	95.3	Very high	27 Å²	27	37.6 Å²	37.6	12%	0.118	16%	0.164	C	C	.	.			trans	-106.3	110.8	-165.4	-67.9	-68.8	0	0	0	113.3	E327 D353 R357 K375 C377	E327-F355 HydrophobicContact CG-CD2 4.5Å; E327-F355 HydrophobicContact CG-CE2 4.49Å; D353-F355 VanDerWaalsContact C-N 3.27Å; D353-F355 PolarHBondContact O-N 3.04Å; D353-F355 PolarHBondContact OD1-N 2.66Å; D353-F355 VanDerWaalsContact OD1-N 3.07Å; F355-R357 PolarHBondContact O-N 2.76Å; F355-R357 PolarHBondContact O-NH1 3.31Å; F355-K375 HydrophobicContact CB-CD 3.89Å; F355-K375 HydrophobicContact CB-CG 3.84Å; F355-K375 HydrophobicContact CD1-CD 3.71Å; F355-K375 HydrophobicContact CD1-CG 3.64Å; F355-K375 HydrophobicContact CE1-CD 4.39Å; F355-K375 HydrophobicContact CG-CD 3.79Å; F355-K375 HydrophobicContact CG-CG 3.99Å; F355-C377 HydrophobicContact CD1-CB 3.6Å; F355-C377 HydrophobicContact CE1-CB 3.72Å
356	V	97.8	Very high	94.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	122.6	166.9	-179.5	0	0	0	0	107.8	K375 F376 I390 L393 L402 A404 F414	V356-K375 CarbonylContact O-C 3.49Å; V356-K375 WeakPolarHBondContact O-CA 3.31Å; V356-F376 HydrophobicContact CB-CB 4.33Å; V356-F376 PolarHBondContact N-O 3.04Å; V356-F376 PolarHBondContact O-N 2.92Å; V356-I390 HydrophobicContact CB-CD1 4.29Å; V356-I390 HydrophobicContact CG2-CD1 3.55Å; V356-I390 HydrophobicContact CG2-CG1 4.34Å; V356-I390 VanDerWaalsContact N-CD1 3.34Å; V356-L393 HydrophobicContact CG1-CD2 4.42Å; V356-L402 HydrophobicContact CG1-CD2 3.41Å; V356-L402 VanDerWaalsContact CG1-CD2 3.41Å; V356-L402 HydrophobicContact CG1-CG 4.24Å; V356-A404 HydrophobicContact CG2-CB 3.72Å; V356-F414 HydrophobicContact CG2-CE2 4.17Å
357	R	97.8	Very high	94.1	Very high	1 Å²	1	44.5 Å²	44.5	0%	0.004	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	127.8	-178.6	-67.8	173.2	-177.3	80.8	2	110.9	E327 A348 V349 D353 F355 Y359 V372 K374 K375	E327-R357 IonicContact OE2-CZ 3.55Å; E327-R357 IonicContact OE2-NE 2.83Å; E327-R357 IonicContact OE2-NH2 3.45Å; E327-R357 PolarHBondContact OE2-NH2 2.93Å; A348-R357 CarbonylContact C-O 3.59Å; A348-R357 WeakPolarHBondContact CA-O 3.29Å; V349-R357 HydrophobicContact CG2-CB 4.02Å; V349-R357 PolarHBondContact N-O 3.11Å; V349-R357 PolarHBondContact O-N 2.85Å; D353-R357 VanDerWaalsContact CG-NH1 3.34Å; D353-R357 IonicContact OD1-CZ 3.74Å; D353-R357 IonicContact OD1-NH1 3.53Å; D353-R357 PolarHBondContact OD1-NH1 3.09Å; D353-R357 IonicContact OD1-NH2 3.97Å; D353-R357 IonicContact OD2-CZ 2.87Å; D353-R357 VanDerWaalsContact OD2-CZ 3.28Å; D353-R357 IonicContact OD2-NH1 2.73Å; D353-R357 PolarHBondContact OD2-NH1 2.96Å; D353-R357 IonicContact OD2-NH2 3.8Å; D353-R357 PolarHBondContact OD2-NH2 2.82Å; F355-R357 PolarHBondContact O-N 2.76Å; F355-R357 PolarHBondContact O-NH1 3.31Å; R357-Y359 HydrophobicContact CB-CD2 4.46Å; R357-Y359 HydrophobicContact CB-CE2 3.85Å; R357-V372 HydrophobicContact CB-CG1 4.24Å; R357-V372 HydrophobicContact CB-CG2 4.47Å; R357-V372 HydrophobicContact CG-CG1 4.21Å; R357-V372 HydrophobicContact CG-CG2 4.31Å; R357-K374 WeakPolarHBondContact CA-O 3.23Å; R357-K375 HydrophobicContact CG-CD 4.4Å; R357-K375 HydrophobicContact CG-CG 4.26Å
358	I	97.8	Very high	93.5	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.01	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	133.1	170.4	-57.3	179.3	0	0	0	108.5	Q346 F347 A348 L373 K374 F376 Y395 L402	Q346-I358 HydrophobicContact CB-CG2 4.49Å; F347-I358 WeakPolarHBondContact O-CA 3.48Å; A348-I358 HydrophobicContact CB-CG1 4.27Å; I358-L373 HydrophobicContact CG2-CD2 4.47Å; I358-L373 WeakPolarHBondContact O-CB 3.27Å; I358-L373 PolarHBondContact O-N 2.99Å; I358-K374 HydrophobicContact CB-CB 4.35Å; I358-K374 PolarHBondContact N-O 2.82Å; I358-K374 PolarHBondContact O-N 3.21Å; I358-F376 HydrophobicContact CD1-CD2 4.35Å; I358-F376 HydrophobicContact CD1-CE2 3.7Å; I358-Y395 WeakPolarHBondContact CD1-OH 3.24Å; I358-L402 HydrophobicContact CD1-CD2 4.04Å; I358-L402 HydrophobicContact CG1-CD2 4.08Å
359	Y	97.8	Very high	92.9	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	150.6	174.1	-68.1	-87.9	0	0	0	110	V323 T325 Q346 F347 V349 R357 I364 N370 G371 V372	V323-Y359 HydrophobicContact CG2-CD1 4.46Å; V323-Y359 HydrophobicContact CG2-CE1 3.86Å; T325-Y359 WeakPolarHBondContact CG2-OH 3.27Å; T325-Y359 PolarHBondContact OG1-OH 2.91Å; T325-Y359 VanDerWaalsContact OG1-OH 3.14Å; Q346-Y359 VanDerWaalsContact CA-O 3.26Å; Q346-Y359 WeakPolarHBondContact CA-O 3.45Å; F347-Y359 HydrophobicContact CD2-CD2 4.36Å; F347-Y359 VanDerWaalsContact CE1-CB 3.47Å; F347-Y359 HydrophobicContact CE1-CG 4.28Å; F347-Y359 AromaticContact CE2-CD2 3.64Å; F347-Y359 HydrophobicContact CE2-CD2 3.64Å; F347-Y359 HydrophobicContact CE2-CE2 4.46Å; F347-Y359 HydrophobicContact CE2-CG 4.04Å; F347-Y359 VanDerWaalsContact CZ-CB 3.43Å; F347-Y359 AromaticContact CZ-CD2 3.84Å; F347-Y359 HydrophobicContact CZ-CD2 3.84Å; F347-Y359 AromaticContact CZ-CG 3.73Å; F347-Y359 HydrophobicContact CZ-CG 3.73Å; F347-Y359 PolarHBondContact N-O 2.71Å; F347-Y359 VanDerWaalsContact N-O 3.13Å; F347-Y359 PolarHBondContact O-N 3.43Å; V349-Y359 HydrophobicContact CG2-CD2 4.27Å; V349-Y359 HydrophobicContact CG2-CE2 3.65Å; R357-Y359 HydrophobicContact CB-CD2 4.46Å; R357-Y359 HydrophobicContact CB-CE2 3.85Å; Y359-I364 HydrophobicContact CD1-CD1 4.49Å; Y359-N370 WeakPolarHBondContact CE1-O 3.47Å; Y359-G371 VanDerWaalsContact CD1-O 3.23Å; Y359-G371 WeakPolarHBondContact CD1-O 3.4Å; Y359-V372 HydrophobicContact CD1-CG2 4.47Å; Y359-V372 HydrophobicContact CE1-CB 4.37Å; Y359-V372 HydrophobicContact CE1-CG2 3.59Å; Y359-V372 HydrophobicContact CE2-CG2 4.45Å; Y359-V372 WeakPolarHBondContact OH-CG2 3.41Å
360	D	96.3	Very high	92.4	Very high	9 Å²	9	56.7 Å²	56.7	5%	0.048	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	118.6	161.1	-173	-43.9	0	0	0	107.8	H345 Q346 R362 K363 I364 L373	H345-D360 CarbonylContact O-C 3.41Å; H345-D360 WeakPolarHBondContact O-CA 3.33Å; Q346-D360 HydrophobicContact CG-CB 4.29Å; D360-R362 PolarHBondContact O-N 2.82Å; D360-R362 WeakPolarHBondContact OD1-CB 3.35Å; D360-R362 IonicContact OD1-CZ 2.91Å; D360-R362 PolarHBondContact OD1-N 2.76Å; D360-R362 IonicContact OD1-NE 3.38Å; D360-R362 PolarHBondContact OD1-NE 3.39Å; D360-R362 IonicContact OD1-NH2 3.61Å; D360-R362 IonicContact OD2-CZ 3.45Å; D360-R362 IonicContact OD2-NE 2.77Å; D360-R362 IonicContact OD2-NH2 3.21Å; D360-R362 PolarHBondContact OD2-NH2 2.93Å; D360-K363 HydrophobicContact CB-CB 4.35Å; D360-K363 CarbonylContact O-C 3.39Å; D360-K363 PolarHBondContact O-N 2.66Å; D360-I364 VanDerWaalsContact O-CG1 3.32Å; D360-I364 WeakPolarHBondContact O-CG1 3.48Å; D360-L373 HydrophobicContact CB-CD2 4.34Å
361	Q	94.1	Very high	92.1	Very high	52 Å²	52	57 Å²	57	24%	0.243	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-23.8	-177.3	-63	-165.9	59.5	0	0	113.1	L322 T344 H345 F347	L322-Q361 HydrophobicContact CD2-CG 4.17Å; T344-Q361 PolarHBondContact O-NE2 2.92Å; H345-Q361 WeakPolarHBondContact O-CG 3.46Å; H345-Q361 PolarHBondContact O-N 3.09Å; F347-Q361 HydrophobicContact CD1-CG 3.64Å; F347-Q361 HydrophobicContact CE1-CG 3.74Å
362	R	93.9	Very high	92.1	Very high	149 Å²	149	57.7 Å²	57.7	56%	0.562	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-4.7	-178	-52.3	165	-64.2	-177.6	4	113.2	H345 D360	H345-R362 HydrophobicContact CB-CG 4.41Å; H345-R362 PolarHBondContact CD2-NH1 3.2Å; D360-R362 PolarHBondContact O-N 2.82Å; D360-R362 WeakPolarHBondContact OD1-CB 3.35Å; D360-R362 IonicContact OD1-CZ 2.91Å; D360-R362 PolarHBondContact OD1-N 2.76Å; D360-R362 IonicContact OD1-NE 3.38Å; D360-R362 PolarHBondContact OD1-NE 3.39Å; D360-R362 IonicContact OD1-NH2 3.61Å; D360-R362 IonicContact OD2-CZ 3.45Å; D360-R362 IonicContact OD2-NE 2.77Å; D360-R362 IonicContact OD2-NH2 3.21Å; D360-R362 PolarHBondContact OD2-NH2 2.93Å
363	K	91.4	Very high	92.2	Very high	153 Å²	153	54.5 Å²	54.5	67%	0.665	26%	0.262	S	S	*	.			trans	-138.5	37.6	-172.5	-61.6	-169.7	174.2	-169.5	0	112.7	D360 D365	D360-K363 HydrophobicContact CB-CB 4.35Å; D360-K363 CarbonylContact O-C 3.39Å; D360-K363 PolarHBondContact O-N 2.66Å; K363-D365 PolarHBondContact O-N 2.87Å
364	I	91.8	Very high	92.3	Very high	40 Å²	40	56 Å²	56	21%	0.205	27%	0.268	C	S	.	.			trans	-89.2	100.8	174	-52	-172.2	0	0	0	108.3	L322 V323 F347 Y359 D360	L322-I364 HydrophobicContact CD1-CD1 3.8Å; L322-I364 HydrophobicContact CD2-CD1 4.47Å; L322-I364 HydrophobicContact CG-CD1 3.77Å; V323-I364 HydrophobicContact CB-CD1 4.08Å; V323-I364 HydrophobicContact CB-CG2 3.94Å; V323-I364 HydrophobicContact CG1-CD1 4.41Å; V323-I364 HydrophobicContact CG2-CG2 3.79Å; F347-I364 HydrophobicContact CE1-CD1 4.13Å; F347-I364 HydrophobicContact CZ-CD1 4.2Å; Y359-I364 HydrophobicContact CD1-CD1 4.49Å; D360-I364 VanDerWaalsContact O-CG1 3.32Å; D360-I364 WeakPolarHBondContact O-CG1 3.48Å
365	D	86.3	Confident	92.4	Very high	66 Å²	66	57 Å²	57	35%	0.353	27%	0.272	S	S	.	.			trans	-110.2	120.7	168.2	-170.1	-26.8	0	0	0	108.9	K363 N367 E368 N370 G371	K363-D365 PolarHBondContact O-N 2.87Å; D365-N367 PolarHBondContact O-N 3.28Å; D365-N367 WeakPolarHBondContact OD1-CB 3.4Å; D365-N367 PolarHBondContact OD1-N 3.46Å; D365-N367 PolarHBondContact OD1-ND2 3.4Å; D365-E368 HydrophobicContact CB-CB 4.26Å; D365-E368 HydrophobicContact CB-CG 4.44Å; D365-E368 PolarHBondContact O-N 2.97Å; D365-N370 CarbonylContact O-C 3.57Å; D365-G371 PolarHBondContact O-N 3.38Å
366	E	83.6	Confident	92.5	Very high	113 Å²	113	55.8 Å²	55.8	53%	0.528	27%	0.267	S	S	.	.	S	Bend	trans	-62.2	-23.9	179.6	-63	-166.8	163.2	0	0	112.5
367	N	84.3	Confident	92.4	Very high	147 Å²	147	56 Å²	56	79%	0.786	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-29.7	-178.9	-51.3	-76.7	0	0	0	112.9	D365	D365-N367 PolarHBondContact O-N 3.28Å; D365-N367 WeakPolarHBondContact OD1-CB 3.4Å; D365-N367 PolarHBondContact OD1-N 3.46Å; D365-N367 PolarHBondContact OD1-ND2 3.4Å
368	E	85.2	Confident	92.3	Very high	146 Å²	146	56 Å²	56	68%	0.682	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	90.3	-178.1	-63.4	-165.9	162.8	0	0	110.6	D365 N370 G371	D365-E368 HydrophobicContact CB-CB 4.26Å; D365-E368 HydrophobicContact CB-CG 4.44Å; D365-E368 PolarHBondContact O-N 2.97Å; E368-N370 PolarHBondContact O-N 2.75Å; E368-N370 VanDerWaalsContact O-N 3.09Å; E368-G371 PolarHBondContact O-N 3.4Å
369	N	84.9	Confident	92.2	Very high	98 Å²	98	60.5 Å²	60.5	52%	0.524	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	53	33.2	179.6	-168.7	37	0	0	0	113	G371 V372	N369-G371 PolarHBondContact O-N 3.35Å; N369-G371 VanDerWaalsContact O-N 3.11Å; N369-V372 PolarHBondContact ND2-O 3.02Å; N369-V372 WeakPolarHBondContact O-CB 3.23Å; N369-V372 WeakPolarHBondContact O-CG2 3.35Å; N369-V372 PolarHBondContact O-N 3.31Å; N369-V372 VanDerWaalsContact O-N 3.09Å
370	N	89.7	Confident	92	Very high	12 Å²	12	64.4 Å²	64.4	6%	0.064	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	55.2	25.6	-175.1	-165.4	92.5	0	0	0	113.3	V324 K326 Y359 D365 E368 V372	V324-N370 PolarHBondContact O-ND2 2.71Å; V324-N370 PolarHBondContact O-OD1 3.07Å; K326-N370 WeakPolarHBondContact CD-OD1 3.23Å; K326-N370 WeakPolarHBondContact CG-OD1 3.47Å; Y359-N370 WeakPolarHBondContact CE1-O 3.47Å; D365-N370 CarbonylContact O-C 3.57Å; E368-N370 PolarHBondContact O-N 2.75Å; E368-N370 VanDerWaalsContact O-N 3.09Å; N370-V372 VanDerWaalsContact C-N 3.32Å; N370-V372 PolarHBondContact O-N 2.85Å
371	G	90	Very high	91.8	Very high	7 Å²	7	64.3 Å²	64.3	7%	0.072	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	77.3	8.6	-178.9	0	0	0	0	0	115.2	Y359 D365 E368 N369 L373	Y359-G371 VanDerWaalsContact CD1-O 3.23Å; Y359-G371 WeakPolarHBondContact CD1-O 3.4Å; D365-G371 PolarHBondContact O-N 3.38Å; E368-G371 PolarHBondContact O-N 3.4Å; N369-G371 PolarHBondContact O-N 3.35Å; N369-G371 VanDerWaalsContact O-N 3.11Å; G371-L373 PolarHBondContact O-N 2.99Å
372	V	95.5	Very high	91.5	Very high	14 Å²	14	64.4 Å²	64.4	9%	0.085	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	117	-179.6	177.9	0	0	0	0	110	R357 Y359 N369 N370 K374 K375	R357-V372 HydrophobicContact CB-CG1 4.24Å; R357-V372 HydrophobicContact CB-CG2 4.47Å; R357-V372 HydrophobicContact CG-CG1 4.21Å; R357-V372 HydrophobicContact CG-CG2 4.31Å; Y359-V372 HydrophobicContact CD1-CG2 4.47Å; Y359-V372 HydrophobicContact CE1-CB 4.37Å; Y359-V372 HydrophobicContact CE1-CG2 3.59Å; Y359-V372 HydrophobicContact CE2-CG2 4.45Å; Y359-V372 WeakPolarHBondContact OH-CG2 3.41Å; N369-V372 PolarHBondContact ND2-O 3.02Å; N369-V372 WeakPolarHBondContact O-CB 3.23Å; N369-V372 WeakPolarHBondContact O-CG2 3.35Å; N369-V372 PolarHBondContact O-N 3.31Å; N369-V372 VanDerWaalsContact O-N 3.09Å; N370-V372 VanDerWaalsContact C-N 3.32Å; N370-V372 PolarHBondContact O-N 2.85Å; V372-K374 WeakPolarHBondContact CG1-O 3.47Å; V372-K375 HydrophobicContact CG1-CB 4.22Å
373	L	95.1	Very high	91	Very high	76 Å²	76	64.6 Å²	64.6	40%	0.398	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	-41.9	178.8	-179.7	68.8	0	0	0	112.1	I358 D360 G371	I358-L373 HydrophobicContact CG2-CD2 4.47Å; I358-L373 WeakPolarHBondContact O-CB 3.27Å; I358-L373 PolarHBondContact O-N 2.99Å; D360-L373 HydrophobicContact CB-CD2 4.34Å; G371-L373 PolarHBondContact O-N 2.99Å
374	K	95.9	Very high	90.6	Very high	45 Å²	45	59.4 Å²	59.4	20%	0.196	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	145.5	174.7	-61.7	-172.5	-176.3	-175.6	0	110.5	R357 I358 V372 F376 S416 S417 H418	R357-K374 WeakPolarHBondContact CA-O 3.23Å; I358-K374 HydrophobicContact CB-CB 4.35Å; I358-K374 PolarHBondContact N-O 2.82Å; I358-K374 PolarHBondContact O-N 3.21Å; V372-K374 WeakPolarHBondContact CG1-O 3.47Å; K374-F376 HydrophobicContact CB-CE2 4.29Å; K374-F376 HydrophobicContact CB-CZ 4.23Å; K374-F376 HydrophobicContact CD-CE2 4.47Å; K374-F376 HydrophobicContact CD-CZ 3.9Å; K374-S416 PolarHBondContact NZ-O 2.92Å; K374-S417 PolarHBondContact NZ-O 2.6Å; K374-H418 WeakPolarHBondContact CD-O 3.36Å; K374-H418 WeakPolarHBondContact CE-O 3.43Å; K374-H418 PolarHBondContact NZ-O 3.21Å
375	K	95.4	Very high	89.7	Confident	39 Å²	39	66.8 Å²	66.8	17%	0.17	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	125	176.6	-166.4	163.7	76.2	-176.1	0	109.2	E327 F355 V356 R357 V372 D420 G421	E327-K375 IonicContact OE1-NZ 2.67Å; E327-K375 PolarHBondContact OE1-NZ 2.91Å; E327-K375 IonicContact OE2-NZ 2.75Å; E327-K375 PolarHBondContact OE2-NZ 2.93Å; F355-K375 HydrophobicContact CB-CD 3.89Å; F355-K375 HydrophobicContact CB-CG 3.84Å; F355-K375 HydrophobicContact CD1-CD 3.71Å; F355-K375 HydrophobicContact CD1-CG 3.64Å; F355-K375 HydrophobicContact CE1-CD 4.39Å; F355-K375 HydrophobicContact CG-CD 3.79Å; F355-K375 HydrophobicContact CG-CG 3.99Å; V356-K375 CarbonylContact O-C 3.49Å; V356-K375 WeakPolarHBondContact O-CA 3.31Å; R357-K375 HydrophobicContact CG-CD 4.4Å; R357-K375 HydrophobicContact CG-CG 4.26Å; V372-K375 HydrophobicContact CG1-CB 4.22Å; K375-D420 WeakPolarHBondContact CA-OD1 3.31Å; K375-D420 PolarHBondContact N-OD1 3.21Å; K375-G421 WeakPolarHBondContact O-CA 3.45Å; K375-G421 PolarHBondContact O-N 3.49Å
376	F	97.4	Very high	89.1	Confident	2 Å²	2	66 Å²	66	1%	0.009	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	143.6	177.8	-58.9	-61.2	0	0	0	110.8	V356 I358 K374 F414 S419 A422	V356-F376 HydrophobicContact CB-CB 4.33Å; V356-F376 PolarHBondContact N-O 3.04Å; V356-F376 PolarHBondContact O-N 2.92Å; I358-F376 HydrophobicContact CD1-CD2 4.35Å; I358-F376 HydrophobicContact CD1-CE2 3.7Å; K374-F376 HydrophobicContact CB-CE2 4.29Å; K374-F376 HydrophobicContact CB-CZ 4.23Å; K374-F376 HydrophobicContact CD-CE2 4.47Å; K374-F376 HydrophobicContact CD-CZ 3.9Å; F376-F414 HydrophobicContact CB-CD1 3.59Å; F376-F414 HydrophobicContact CB-CD2 4.4Å; F376-F414 HydrophobicContact CB-CE1 3.82Å; F376-F414 HydrophobicContact CB-CG 3.91Å; F376-F414 HydrophobicContact CB-CZ 4.32Å; F376-F414 HydrophobicContact CD1-CD1 4.38Å; F376-F414 HydrophobicContact CD2-CB 4.11Å; F376-F414 HydrophobicContact CD2-CG 4.37Å; F376-F414 HydrophobicContact CE2-CB 4.49Å; F376-F414 HydrophobicContact CG-CB 4.26Å; F376-F414 HydrophobicContact CG-CD1 4.01Å; F376-F414 HydrophobicContact CG-CG 4.18Å; F376-S419 WeakPolarHBondContact CE1-O 3.26Å; F376-A422 HydrophobicContact CD1-CB 4.35Å; F376-A422 HydrophobicContact CE1-CB 4.07Å
377	C	96.2	Very high	88.9	Confident	5 Å²	5	66.8 Å²	66.8	3%	0.034	34%	0.341	C	S	.	.			trans	-157.3	140.4	174.8	175.3	0	0	0	0	108.2	Q354 F355 H379 V382	Q354-C377 WeakPolarHBondContact CG-SG 3.49Å; F355-C377 HydrophobicContact CD1-CB 3.6Å; F355-C377 HydrophobicContact CE1-CB 3.72Å; C377-H379 PolarHBondContact O-N 2.85Å; C377-V382 HydrophobicContact CB-CG2 3.98Å; C377-V382 VanDerWaalsContact SG-CG2 3.58Å
378	P	96.3	Very high	89.2	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.306	C	S	.	.			trans	-57.6	128.2	168.8	-21.9	35.3	0	0	0	109.6	H380 L381 Y406 Y412 F414 Y424	P378-H380 VanDerWaalsContact CB-CE1 3.48Å; P378-H380 WeakPolarHBondContact CB-CE1 3.49Å; P378-H380 PolarHBondContact O-N 3.07Å; P378-L381 HydrophobicContact CB-CD1 4.08Å; P378-L381 HydrophobicContact CB-CG 4.15Å; P378-L381 HydrophobicContact CG-CD1 3.84Å; P378-L381 HydrophobicContact CG-CG 4.45Å; P378-L381 PolarHBondContact O-N 3.39Å; P378-Y406 WeakPolarHBondContact CD-OH 3.29Å; P378-Y406 HydrophobicContact CG-CE2 4.41Å; P378-Y412 HydrophobicContact CB-CD1 4.3Å; P378-Y412 HydrophobicContact CB-CE1 4.07Å; P378-Y412 HydrophobicContact CG-CD1 3.86Å; P378-Y412 HydrophobicContact CG-CD2 3.65Å; P378-Y412 HydrophobicContact CG-CE1 3.97Å; P378-Y412 HydrophobicContact CG-CE2 3.81Å; P378-Y412 HydrophobicContact CG-CG 3.67Å; P378-F414 HydrophobicContact CG-CZ 4.09Å; P378-Y424 HydrophobicContact CB-CD1 3.82Å; P378-Y424 HydrophobicContact CB-CE1 4.03Å; P378-Y424 HydrophobicContact CG-CD1 4.27Å
379	H	95.1	Very high	89.5	Confident	98 Å²	98	54 Å²	54	45%	0.454	28%	0.278	S	S	.	.	H	α-helix	trans	-58.3	-28.7	-169.6	-68.3	173	0	0	0	114.4	C377 L381 G421	C377-H379 PolarHBondContact O-N 2.85Å; H379-L381 VanDerWaalsContact C-N 3.32Å; H379-L381 PolarHBondContact O-N 3.05Å; H379-G421 PolarHBondContact NE2-O 2.92Å
380	H	92.9	Very high	90	Very high	81 Å²	81	49.4 Å²	49.4	38%	0.375	25%	0.254	S	S	.	.	H	α-helix	trans	-72.3	-21.4	176	62	-81.6	0	0	0	113.6	P378 E409 Y412 R427	P378-H380 VanDerWaalsContact CB-CE1 3.48Å; P378-H380 WeakPolarHBondContact CB-CE1 3.49Å; P378-H380 PolarHBondContact O-N 3.07Å; H380-E409 IonicContact NE2-OE2 2.75Å; H380-Y412 AromaticContact CE1-CE1 3.96Å; H380-Y412 AromaticContact CE1-CZ 3.82Å; H380-Y412 PolarHBondContact CE1-OH 2.87Å; H380-Y412 PolarHBondContact NE2-OH 3.36Å; H380-Y412 VanDerWaalsContact NE2-OH 3.1Å; H380-R427 PolarHBondContact CE1-NH1 3.33Å; H380-R427 VanDerWaalsContact CE1-NH1 3.34Å; H380-R427 PolarHBondContact NE2-NH1 3.01Å
381	L	92.1	Very high	90.2	Very high	8 Å²	8	48.9 Å²	48.9	4%	0.042	25%	0.251	C	S	.	.	H	α-helix	trans	-90.8	-10.3	178.3	-57	-179.2	0	0	0	113.3	Q354 P378 H379 N383 A388 Y406 E409 Y412	Q354-L381 HydrophobicContact CB-CB 4.35Å; Q354-L381 PolarHBondContact NE2-O 3.07Å; P378-L381 HydrophobicContact CB-CD1 4.08Å; P378-L381 HydrophobicContact CB-CG 4.15Å; P378-L381 HydrophobicContact CG-CD1 3.84Å; P378-L381 HydrophobicContact CG-CG 4.45Å; P378-L381 PolarHBondContact O-N 3.39Å; H379-L381 VanDerWaalsContact C-N 3.32Å; H379-L381 PolarHBondContact O-N 3.05Å; L381-N383 PolarHBondContact O-N 3.11Å; L381-A388 HydrophobicContact CD1-CB 4.08Å; L381-Y406 HydrophobicContact CD1-CD1 4.03Å; L381-Y406 HydrophobicContact CD1-CE1 4.14Å; L381-E409 HydrophobicContact CD1-CG 4.12Å; L381-E409 HydrophobicContact CD2-CG 3.99Å; L381-Y412 HydrophobicContact CD1-CE2 4.46Å
382	V	88.8	Confident	90.6	Very high	54 Å²	54	49 Å²	49	33%	0.327	25%	0.25	S	S	.	.	H	α-helix	trans	-65.5	-40.4	-178.3	178.9	0	0	0	0	111.7	C377	C377-V382 HydrophobicContact CB-CG2 3.98Å; C377-V382 VanDerWaalsContact SG-CG2 3.58Å
383	N	83.6	Confident	90.6	Very high	152 Å²	152	48.3 Å²	48.3	81%	0.813	25%	0.246	S	C	*	.	S	Bend	trans	-117.4	20.2	-178.7	-61.8	-30.1	0	0	0	112.3	L381	L381-N383 PolarHBondContact O-N 3.11Å
384	S	82.4	Confident	90.8	Very high	44 Å²	44	44.9 Å²	44.9	31%	0.308	23%	0.229	S	C	.	.			trans	-68.2	141.7	175.9	176.2	0	0	0	0	110.7	S386	S384-S386 VanDerWaalsContact CB-O 3.27Å; S384-S386 WeakPolarHBondContact CB-O 3.33Å; S384-S386 PolarHBondContact OG-N 2.85Å; S384-S386 PolarHBondContact OG-O 2.88Å
385	E	72.4	Confident	90.9	Very high	195 Å²	195	43.1 Å²	43.1	91%	0.911	22%	0.221	S	C	*	.	S	Bend	trans	-69.5	-42.4	174.1	-62.6	-172.3	163.6	0	0	111
386	S	75.4	Confident	91	Very high	49 Å²	49	41.3 Å²	41.3	34%	0.343	21%	0.213	S	C	.	.	S	Bend	trans	-76.8	129.6	167.4	177.1	0	0	0	0	110.5	S384	S384-S386 VanDerWaalsContact CB-O 3.27Å; S384-S386 WeakPolarHBondContact CB-O 3.33Å; S384-S386 PolarHBondContact OG-N 2.85Å; S384-S386 PolarHBondContact OG-O 2.88Å
387	K	78.9	Confident	90.9	Very high	130 Å²	130	45.3 Å²	45.3	57%	0.565	23%	0.232	S	C	*	.			trans	-97.2	98.3	-178.2	-70.1	178.2	-171	132.8	0	111.1	N389	K387-N389 PolarHBondContact O-ND2 3.46Å
388	A	89.4	Confident	90.9	Very high	7 Å²	7	47.8 Å²	47.8	6%	0.058	25%	0.245	C	C	.	.			trans	-62.8	139.5	166.9	0	0	0	0	0	111	D353 Q354 L381 Y406 E409	D353-A388 CarbonylContact C-O 3.51Å; Q354-A388 VanDerWaalsContact CA-O 3.29Å; Q354-A388 WeakPolarHBondContact CA-O 3.33Å; Q354-A388 WeakPolarHBondContact CB-O 3.47Å; Q354-A388 PolarHBondContact N-O 2.87Å; Q354-A388 VanDerWaalsContact N-O 3.09Å; L381-A388 HydrophobicContact CD1-CB 4.08Å; A388-Y406 HydrophobicContact CB-CD1 3.88Å; A388-E409 HydrophobicContact CB-CG 4.34Å
389	N	92.2	Very high	90.9	Very high	19 Å²	19	48 Å²	48	10%	0.102	25%	0.246	C	C	.	.			trans	-112	146.5	177.3	-54	-76.2	0	0	0	108.6	Y335 G351 R352 K387 Y406 N407	Y335-N389 HydrophobicContact CE2-CB 4.27Å; G351-N389 CarbonylContact O-C 3.53Å; G351-N389 WeakPolarHBondContact O-CA 3.37Å; G351-N389 WeakPolarHBondContact O-CB 3.26Å; R352-N389 VanDerWaalsContact C-OD1 3.28Å; R352-N389 VanDerWaalsContact CA-OD1 3.25Å; R352-N389 WeakPolarHBondContact CA-OD1 3.3Å; K387-N389 PolarHBondContact O-ND2 3.46Å; N389-Y406 CarbonylContact O-C 3.54Å; N389-Y406 VanDerWaalsContact O-CA 3.29Å; N389-Y406 WeakPolarHBondContact O-CA 3.39Å; N389-N407 WeakPolarHBondContact CA-OD1 3.35Å; N389-N407 VanDerWaalsContact CB-OD1 3.26Å; N389-N407 WeakPolarHBondContact CB-OD1 2.98Å; N389-N407 PolarHBondContact N-OD1 3.42Å; N389-N407 PolarHBondContact ND2-OD1 3.31Å; N389-N407 VanDerWaalsContact ND2-OD1 3.11Å; N389-N407 PolarHBondContact O-N 3.27Å; N389-N407 PolarHBondContact O-OD1 2.88Å
390	I	95.6	Very high	90.9	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	115.2	176.8	-62.7	152.8	0	0	0	109.3	T336 G351 D353 V356 A404 Y406	T336-I390 HydrophobicContact CG2-CG2 3.88Å; G351-I390 WeakPolarHBondContact CA-O 3.3Å; G351-I390 PolarHBondContact O-N 3.35Å; D353-I390 PolarHBondContact O-N 3.19Å; V356-I390 HydrophobicContact CB-CD1 4.29Å; V356-I390 HydrophobicContact CG2-CD1 3.55Å; V356-I390 HydrophobicContact CG2-CG1 4.34Å; V356-I390 VanDerWaalsContact N-CD1 3.34Å; I390-A404 HydrophobicContact CG2-CB 4.37Å; I390-Y406 HydrophobicContact CD1-CE1 4.17Å; I390-Y406 HydrophobicContact CG1-CD1 3.91Å; I390-Y406 HydrophobicContact CG1-CD2 4.46Å; I390-Y406 HydrophobicContact CG1-CE1 3.52Å; I390-Y406 HydrophobicContact CG1-CE2 4.1Å; I390-Y406 HydrophobicContact CG1-CG 4.38Å
391	T	94.7	Very high	91.2	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.012	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-39.5	-179.8	60.2	0	0	0	0	112.1	S405 N407 N433 V437 K438 F540	T391-S405 PolarHBondContact N-O 2.82Å; T391-S405 PolarHBondContact OG1-O 3.31Å; T391-N407 HydrophobicContact CG2-CB 3.89Å; T391-N433 PolarHBondContact OG1-ND2 3.23Å; T391-V437 WeakPolarHBondContact O-CG1 3.16Å; T391-K438 PolarHBondContact OG1-O 3.41Å; T391-F540 HydrophobicContact CG2-CE2 4.38Å; T391-F540 HydrophobicContact CG2-CZ 3.94Å
392	C	96.6	Very high	91.5	Very high	8 Å²	8	43.8 Å²	43.8	5%	0.054	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	145.6	178.5	-176.4	0	0	0	0	111.7	K288 A404 S405 K438 V440	K288-C392 PolarHBondContact NZ-SG 3.28Å; C392-A404 WeakPolarHBondContact O-CA 3.21Å; C392-S405 PolarHBondContact O-N 3.41Å; C392-K438 WeakPolarHBondContact CB-O 3.05Å; C392-V440 HydrophobicContact CB-CG1 4.15Å
393	L	97.3	Very high	91.9	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	152.3	168.1	66.8	85.6	0	0	0	111.6	K288 T336 F338 A348 V356 L402 L403 A404	K288-L393 PolarHBondContact NZ-O 3.38Å; K288-L393 VanDerWaalsContact NZ-O 3.07Å; T336-L393 HydrophobicContact CG2-CB 4.25Å; T336-L393 HydrophobicContact CG2-CD2 3.72Å; T336-L393 HydrophobicContact CG2-CG 3.68Å; T336-L393 PolarHBondContact OG1-N 3.08Å; T336-L393 VanDerWaalsContact OG1-N 3.07Å; F338-L393 HydrophobicContact CB-CD1 3.54Å; A348-L393 HydrophobicContact CB-CD1 3.76Å; A348-L393 HydrophobicContact CB-CD2 4.28Å; V356-L393 HydrophobicContact CG1-CD2 4.42Å; L393-L402 HydrophobicContact CD1-CD1 4.12Å; L393-L403 CarbonylContact C-O 3.56Å; L393-L403 WeakPolarHBondContact CA-O 3.41Å; L393-L403 WeakPolarHBondContact CB-O 3.41Å; L393-A404 HydrophobicContact CB-CB 4.41Å
394	V	97.9	Very high	92.6	Very high	5 Å²	5	34 Å²	34	3%	0.03	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	143.3	174.4	-65.3	0	0	0	0	110.8	F338 L402 L403 V440 F442	F338-V394 HydrophobicContact CD2-CB 4.28Å; F338-V394 HydrophobicContact CD2-CG1 3.96Å; F338-V394 HydrophobicContact CE2-CB 4.21Å; F338-V394 HydrophobicContact CE2-CG1 3.88Å; V394-L402 WeakPolarHBondContact O-CD1 3.44Å; V394-L403 HydrophobicContact CG2-CB 3.92Å; V394-L403 HydrophobicContact CG2-CD2 4.06Å; V394-L403 PolarHBondContact N-O 2.85Å; V394-L403 PolarHBondContact O-N 3.48Å; V394-V440 WeakPolarHBondContact CG1-O 3.42Å; V394-F442 HydrophobicContact CG2-CD2 3.76Å; V394-F442 HydrophobicContact CG2-CE2 3.98Å
395	Y	98.2	Very high	93.3	Very high	8 Å²	8	31.9 Å²	31.9	3%	0.031	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	153.7	168.6	-86.1	-82.5	0	0	0	111	F338 N340 A348 I358 E401 L402 F442	F338-Y395 HydrophobicContact CB-CD2 4.41Å; F338-Y395 AromaticContact CD1-CD2 3.95Å; F338-Y395 HydrophobicContact CD1-CD2 3.95Å; F338-Y395 HydrophobicContact CD1-CG 4.47Å; N340-Y395 HydrophobicContact CB-CD1 4.39Å; N340-Y395 HydrophobicContact CB-CD2 4.15Å; N340-Y395 HydrophobicContact CB-CE1 4.13Å; N340-Y395 HydrophobicContact CB-CE2 3.87Å; N340-Y395 HydrophobicContact CB-CG 4.38Å; A348-Y395 HydrophobicContact CB-CD2 4.47Å; A348-Y395 HydrophobicContact CB-CE2 3.57Å; I358-Y395 WeakPolarHBondContact CD1-OH 3.24Å; Y395-E401 WeakPolarHBondContact CA-O 3.36Å; Y395-E401 WeakPolarHBondContact CD1-O 3.21Å; Y395-L402 HydrophobicContact CD1-CB 4.37Å; Y395-L402 HydrophobicContact CD1-CD1 3.96Å; Y395-L402 HydrophobicContact CD2-CD1 3.78Å; Y395-L402 HydrophobicContact CE1-CB 4.33Å; Y395-L402 HydrophobicContact CE1-CD1 4.06Å; Y395-L402 HydrophobicContact CE1-CD2 4.47Å; Y395-L402 HydrophobicContact CE2-CD1 3.89Å; Y395-L402 HydrophobicContact CG-CD1 3.84Å; Y395-F442 WeakPolarHBondContact O-CD2 3.46Å
396	S	97.5	Very high	94.3	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.007	12%	0.119	C	C	.	.			trans	-65.2	163.5	166.5	58.6	0	0	0	0	111.4	P341 D398 G399 T400 E401	P341-S396 VanDerWaalsContact CG-O 3.23Å; P341-S396 WeakPolarHBondContact CG-O 3.45Å; S396-D398 VanDerWaalsContact CB-OD1 3.29Å; S396-D398 WeakPolarHBondContact CB-OD1 3.44Å; S396-D398 PolarHBondContact O-N 2.87Å; S396-D398 PolarHBondContact OG-OD1 2.8Å; S396-G399 PolarHBondContact O-N 3.27Å; S396-G399 PolarHBondContact OG-N 2.92Å; S396-T400 PolarHBondContact OG-N 2.83Å; S396-E401 PolarHBondContact N-O 2.85Å; S396-E401 PolarHBondContact OG-N 3.03Å; S396-E401 PolarHBondContact OG-O 2.73Å
397	H	95	Very high	95	Very high	86 Å²	86	20.9 Å²	20.9	40%	0.398	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-27.1	-179.7	74.8	-58.7	0	0	0	114.9	P445 K446 S447	H397-P445 PolarHBondContact CD2-O 3.31Å; H397-P445 VanDerWaalsContact CD2-O 3.3Å; H397-K446 PolarHBondContact CE1-O 3.02Å; H397-K446 PolarHBondContact ND1-O 2.87Å; H397-S447 PolarHBondContact N-OG 2.89Å
398	D	95.9	Very high	95.3	Very high	57 Å²	57	16 Å²	16	31%	0.305	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109	2.8	-178.2	65.3	-24.1	0	0	0	113.3	A342 S396 T400	A342-D398 WeakPolarHBondContact CB-O 3.47Å; S396-D398 VanDerWaalsContact CB-OD1 3.29Å; S396-D398 WeakPolarHBondContact CB-OD1 3.44Å; S396-D398 PolarHBondContact O-N 2.87Å; S396-D398 PolarHBondContact OG-OD1 2.8Å; D398-T400 HydrophobicContact CB-CG2 4.38Å; D398-T400 PolarHBondContact O-N 2.94Å; D398-T400 VanDerWaalsContact O-N 3.12Å; D398-T400 PolarHBondContact OD1-N 3Å; D398-T400 PolarHBondContact OD1-OG1 3.14Å; D398-T400 VanDerWaalsContact OD1-OG1 3.13Å; D398-T400 WeakPolarHBondContact OD2-CB 3.38Å; D398-T400 WeakPolarHBondContact OD2-CG2 3.49Å; D398-T400 PolarHBondContact OD2-OG1 2.9Å
399	G	96.3	Very high	95.4	Very high	3 Å²	3	17.3 Å²	17.3	3%	0.031	9%	0.091	C	C	.	.	S	Bend	trans	69	3.9	178.8	0	0	0	0	0	116.3	N340 S396 S416	N340-G399 PolarHBondContact ND2-O 3.09Å; N340-G399 VanDerWaalsContact OD1-CA 3.29Å; N340-G399 WeakPolarHBondContact OD1-CA 3.13Å; S396-G399 PolarHBondContact O-N 3.27Å; S396-G399 PolarHBondContact OG-N 2.92Å; G399-S416 PolarHBondContact O-OG 3Å
400	T	96.8	Very high	95.5	Very high	64 Å²	64	16.7 Å²	16.7	39%	0.393	9%	0.087	S	C	.	.	S	Bend	trans	-81.8	-22.6	-177.6	65.9	0	0	0	0	113	S396 D398 N415 S416	S396-T400 PolarHBondContact OG-N 2.83Å; D398-T400 HydrophobicContact CB-CG2 4.38Å; D398-T400 PolarHBondContact O-N 2.94Å; D398-T400 VanDerWaalsContact O-N 3.12Å; D398-T400 PolarHBondContact OD1-N 3Å; D398-T400 PolarHBondContact OD1-OG1 3.14Å; D398-T400 VanDerWaalsContact OD1-OG1 3.13Å; D398-T400 WeakPolarHBondContact OD2-CB 3.38Å; D398-T400 WeakPolarHBondContact OD2-CG2 3.49Å; D398-T400 PolarHBondContact OD2-OG1 2.9Å; T400-N415 PolarHBondContact O-OD1 3.01Å; T400-S416 WeakPolarHBondContact CA-OG 3.44Å; T400-S416 PolarHBondContact O-N 3.13Å; T400-S416 PolarHBondContact O-OG 3.35Å; T400-S416 VanDerWaalsContact O-OG 3.1Å
401	E	97.7	Very high	95.6	Very high	36 Å²	36	16.7 Å²	16.7	17%	0.168	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	151.8	178.3	-52.5	172.6	126.6	0	0	110.6	Y395 S396 L413 F414 K464	Y395-E401 WeakPolarHBondContact CA-O 3.36Å; Y395-E401 WeakPolarHBondContact CD1-O 3.21Å; S396-E401 PolarHBondContact N-O 2.85Å; S396-E401 PolarHBondContact OG-N 3.03Å; S396-E401 PolarHBondContact OG-O 2.73Å; E401-L413 HydrophobicContact CB-CD1 3.84Å; E401-L413 HydrophobicContact CB-CG 4.38Å; E401-F414 CarbonylContact C-O 3.26Å; E401-F414 VanDerWaalsContact CA-O 3.31Å; E401-F414 WeakPolarHBondContact CA-O 3.45Å; E401-K464 WeakPolarHBondContact OE2-CD 3.4Å; E401-K464 VanDerWaalsContact OE2-CE 3.31Å; E401-K464 WeakPolarHBondContact OE2-CE 3.13Å; E401-K464 IonicContact OE2-NZ 3.31Å; E401-K464 PolarHBondContact OE2-NZ 2.74Å
402	L	98	Very high	95.8	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	116.7	-178	-175.1	60	0	0	0	108.8	A348 V356 I358 L393 V394 Y395 F414	A348-L402 HydrophobicContact CB-CD1 3.96Å; A348-L402 HydrophobicContact CB-CD2 3.73Å; V356-L402 HydrophobicContact CG1-CD2 3.41Å; V356-L402 VanDerWaalsContact CG1-CD2 3.41Å; V356-L402 HydrophobicContact CG1-CG 4.24Å; I358-L402 HydrophobicContact CD1-CD2 4.04Å; I358-L402 HydrophobicContact CG1-CD2 4.08Å; L393-L402 HydrophobicContact CD1-CD1 4.12Å; V394-L402 WeakPolarHBondContact O-CD1 3.44Å; Y395-L402 HydrophobicContact CD1-CB 4.37Å; Y395-L402 HydrophobicContact CD1-CD1 3.96Å; Y395-L402 HydrophobicContact CD2-CD1 3.78Å; Y395-L402 HydrophobicContact CE1-CB 4.33Å; Y395-L402 HydrophobicContact CE1-CD1 4.06Å; Y395-L402 HydrophobicContact CE1-CD2 4.47Å; Y395-L402 HydrophobicContact CE2-CD1 3.89Å; Y395-L402 HydrophobicContact CG-CD1 3.84Å; L402-F414 PolarHBondContact N-O 3.44Å; L402-F414 PolarHBondContact O-N 2.69Å
403	L	98.4	Very high	95.9	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	134.2	-179.2	-169.5	72.9	0	0	0	109.2	L393 V394 I411 Y412 L413 Y428 V440 F442 V450	L393-L403 CarbonylContact C-O 3.56Å; L393-L403 WeakPolarHBondContact CA-O 3.41Å; L393-L403 WeakPolarHBondContact CB-O 3.41Å; V394-L403 HydrophobicContact CG2-CB 3.92Å; V394-L403 HydrophobicContact CG2-CD2 4.06Å; V394-L403 PolarHBondContact N-O 2.85Å; V394-L403 PolarHBondContact O-N 3.48Å; L403-I411 HydrophobicContact CD1-CG2 3.51Å; L403-I411 HydrophobicContact CD2-CG2 4.36Å; L403-I411 HydrophobicContact CG-CG2 3.77Å; L403-Y412 WeakPolarHBondContact CA-O 3.37Å; L403-L413 HydrophobicContact CB-CD1 4.29Å; L403-L413 HydrophobicContact CD1-CB 4.26Å; L403-L413 HydrophobicContact CD1-CD1 3.93Å; L403-Y428 HydrophobicContact CD1-CD2 4.16Å; L403-Y428 HydrophobicContact CD1-CE2 3.71Å; L403-V440 HydrophobicContact CD2-CG1 4.25Å; L403-V440 HydrophobicContact CD2-CG2 3.56Å; L403-V440 HydrophobicContact CG-CG1 4.41Å; L403-V440 HydrophobicContact CG-CG2 4.23Å; L403-F442 HydrophobicContact CB-CE1 4.37Å; L403-F442 HydrophobicContact CB-CE2 3.74Å; L403-F442 HydrophobicContact CB-CZ 3.64Å; L403-F442 HydrophobicContact CD2-CD1 4.38Å; L403-F442 HydrophobicContact CD2-CE1 4.19Å; L403-F442 HydrophobicContact CD2-CE2 4.37Å; L403-F442 HydrophobicContact CD2-CZ 4.21Å; L403-F442 HydrophobicContact CG-CZ 4.36Å; L403-V450 HydrophobicContact CD1-CG1 4.41Å; L403-V450 HydrophobicContact CD1-CG2 4.08Å; L403-V450 HydrophobicContact CD2-CB 4.46Å; L403-V450 HydrophobicContact CD2-CG1 3.76Å; L403-V450 HydrophobicContact CD2-CG2 3.96Å
404	A	98.1	Very high	95.9	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	130.7	178	0	0	0	0	0	111	V356 I390 C392 L393 Y406 I411 Y412 F414	V356-A404 HydrophobicContact CG2-CB 3.72Å; I390-A404 HydrophobicContact CG2-CB 4.37Å; C392-A404 WeakPolarHBondContact O-CA 3.21Å; L393-A404 HydrophobicContact CB-CB 4.41Å; A404-Y406 HydrophobicContact CB-CD2 4.39Å; A404-Y406 HydrophobicContact CB-CE2 3.83Å; A404-I411 CarbonylContact O-C 3.49Å; A404-I411 WeakPolarHBondContact O-CA 3.5Å; A404-Y412 PolarHBondContact N-O 2.85Å; A404-Y412 PolarHBondContact O-N 2.88Å; A404-F414 HydrophobicContact CB-CE2 4.27Å
405	S	96.4	Very high	95.9	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	132.4	170.7	-176.6	0	0	0	0	109.4	T391 C392 N433	T391-S405 PolarHBondContact N-O 2.82Å; T391-S405 PolarHBondContact OG1-O 3.31Å; C392-S405 PolarHBondContact O-N 3.41Å; S405-N433 PolarHBondContact OG-ND2 2.87Å
406	Y	94.6	Very high	95.7	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	146.2	-178	-74.8	-107.8	0	0	0	110	Q354 P378 L381 A388 N389 I390 A404 Y412 N433	Q354-Y406 HydrophobicContact CB-CE1 4.15Å; Q354-Y406 VanDerWaalsContact O-CE1 3.29Å; Q354-Y406 WeakPolarHBondContact O-CE1 3.39Å; Q354-Y406 PolarHBondContact O-OH 2.85Å; P378-Y406 WeakPolarHBondContact CD-OH 3.29Å; P378-Y406 HydrophobicContact CG-CE2 4.41Å; L381-Y406 HydrophobicContact CD1-CD1 4.03Å; L381-Y406 HydrophobicContact CD1-CE1 4.14Å; A388-Y406 HydrophobicContact CB-CD1 3.88Å; N389-Y406 CarbonylContact O-C 3.54Å; N389-Y406 VanDerWaalsContact O-CA 3.29Å; N389-Y406 WeakPolarHBondContact O-CA 3.39Å; I390-Y406 HydrophobicContact CD1-CE1 4.17Å; I390-Y406 HydrophobicContact CG1-CD1 3.91Å; I390-Y406 HydrophobicContact CG1-CD2 4.46Å; I390-Y406 HydrophobicContact CG1-CE1 3.52Å; I390-Y406 HydrophobicContact CG1-CE2 4.1Å; I390-Y406 HydrophobicContact CG1-CG 4.38Å; A404-Y406 HydrophobicContact CB-CD2 4.39Å; A404-Y406 HydrophobicContact CB-CE2 3.83Å; Y406-Y412 AromaticContact CD2-CD2 3.61Å; Y406-Y412 HydrophobicContact CD2-CD2 3.61Å; Y406-Y412 HydrophobicContact CD2-CE2 4.18Å; Y406-Y412 AromaticContact CE2-CD2 3.8Å; Y406-Y412 HydrophobicContact CE2-CD2 3.8Å; Y406-Y412 HydrophobicContact CG-CD2 4.44Å; Y406-N433 PolarHBondContact O-ND2 2.78Å
407	N	90.6	Very high	95.5	Very high	13 Å²	13	22.6 Å²	22.6	7%	0.07	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	146.2	171.5	86.7	-64.6	0	0	0	110.7	N389 T391 E409 N433 F540	N389-N407 WeakPolarHBondContact CA-OD1 3.35Å; N389-N407 VanDerWaalsContact CB-OD1 3.26Å; N389-N407 WeakPolarHBondContact CB-OD1 2.98Å; N389-N407 PolarHBondContact N-OD1 3.42Å; N389-N407 PolarHBondContact ND2-OD1 3.31Å; N389-N407 VanDerWaalsContact ND2-OD1 3.11Å; N389-N407 PolarHBondContact O-N 3.27Å; N389-N407 PolarHBondContact O-OD1 2.88Å; T391-N407 HydrophobicContact CG2-CB 3.89Å; N407-E409 PolarHBondContact O-N 3.43Å; N407-N433 CarbonylContact C-O 3.58Å; N407-N433 WeakPolarHBondContact CA-O 3.35Å; N407-F540 HydrophobicContact CB-CD2 3.8Å; N407-F540 HydrophobicContact CB-CE2 3.58Å; N407-F540 HydrophobicContact CB-CZ 4.22Å; N407-F540 WeakPolarHBondContact ND2-CD2 3.46Å
408	D	85.3	Confident	95.5	Very high	26 Å²	26	21.9 Å²	21.9	14%	0.139	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	1.7	-171.1	-145.9	18.6	0	0	0	116	R432 N433 R529	D408-R432 IonicContact OD1-CZ 2.76Å; D408-R432 IonicContact OD1-NH1 3.31Å; D408-R432 PolarHBondContact OD1-NH1 3.14Å; D408-R432 IonicContact OD1-NH2 3.43Å; D408-R432 PolarHBondContact OD1-NH2 2.77Å; D408-N433 PolarHBondContact N-O 2.79Å; D408-R529 VanDerWaalsContact O-CD 3.3Å; D408-R529 WeakPolarHBondContact O-CD 3.2Å; D408-R529 PolarHBondContact O-NE 2.83Å
409	E	91.1	Very high	95.5	Very high	35 Å²	35	23.3 Å²	23.3	16%	0.164	14%	0.138	C	C	.	.	S	Bend	trans	-124.7	-176.5	-168.6	-102.5	-64.9	149.1	0	0	112	H380 L381 A388 N407 Y412 R427 H431	H380-E409 IonicContact NE2-OE2 2.75Å; L381-E409 HydrophobicContact CD1-CG 4.12Å; L381-E409 HydrophobicContact CD2-CG 3.99Å; A388-E409 HydrophobicContact CB-CG 4.34Å; N407-E409 PolarHBondContact O-N 3.43Å; E409-Y412 PolarHBondContact OE2-OH 2.85Å; E409-R427 IonicContact OE1-NH2 2.72Å; E409-R427 IonicContact OE2-CZ 3.15Å; E409-R427 IonicContact OE2-NH2 2.73Å; E409-R427 PolarHBondContact OE2-NH2 3.42Å; E409-H431 PolarHBondContact O-CE1 3.47Å
410	D	94.1	Very high	95.4	Very high	6 Å²	6	27.5 Å²	27.5	3%	0.032	16%	0.16	C	C	.	.			trans	-89.9	175.6	-179.8	-67.3	-28.6	0	0	0	113.3	Y412 R427 Y428 K429 R529	D410-Y412 HydrophobicContact CB-CE2 4.2Å; D410-Y412 VanDerWaalsContact O-CD2 3.24Å; D410-Y412 WeakPolarHBondContact O-CD2 3.24Å; D410-Y412 WeakPolarHBondContact O-CE2 3.4Å; D410-R427 HydrophobicContact CB-CG 3.85Å; D410-R427 IonicContact OD2-CZ 3.91Å; D410-R427 IonicContact OD2-NE 3.52Å; D410-R427 PolarHBondContact OD2-NE 2.89Å; D410-R427 IonicContact OD2-NH2 3.59Å; D410-R427 PolarHBondContact OD2-NH2 2.89Å; D410-Y428 WeakPolarHBondContact CB-O 3.42Å; D410-K429 WeakPolarHBondContact OD2-CG 3.37Å; D410-R529 IonicContact OD1-CZ 2.76Å; D410-R529 IonicContact OD1-NH1 3.94Å; D410-R529 PolarHBondContact OD1-NH1 3.1Å; D410-R529 IonicContact OD1-NH2 3.8Å; D410-R529 PolarHBondContact OD1-NH2 2.85Å; D410-R529 IonicContact OD2-NH1 2.72Å
411	I	97.6	Very high	95.3	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	131.8	176.1	-59.1	157.5	0	0	0	108.6	L403 A404 R427 Y428 V440 S452 W462	L403-I411 HydrophobicContact CD1-CG2 3.51Å; L403-I411 HydrophobicContact CD2-CG2 4.36Å; L403-I411 HydrophobicContact CG-CG2 3.77Å; A404-I411 CarbonylContact O-C 3.49Å; A404-I411 WeakPolarHBondContact O-CA 3.5Å; I411-R427 CarbonylContact O-C 3.57Å; I411-R427 VanDerWaalsContact O-CA 3.3Å; I411-R427 WeakPolarHBondContact O-CA 3.29Å; I411-Y428 HydrophobicContact CB-CD2 4.17Å; I411-Y428 HydrophobicContact CG2-CD2 3.97Å; I411-Y428 PolarHBondContact N-O 3.44Å; I411-Y428 PolarHBondContact O-N 3.47Å; I411-V440 HydrophobicContact CD1-CG2 3.94Å; I411-V440 HydrophobicContact CG1-CG2 4.36Å; I411-V440 HydrophobicContact CG2-CG2 4Å; I411-S452 VanDerWaalsContact CD1-CB 3.48Å; I411-W462 HydrophobicContact CD1-CH2 3.71Å; I411-W462 HydrophobicContact CD1-CZ3 3.91Å
412	Y	98.3	Very high	95.2	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	138.8	-176.8	-62.4	-83.6	0	0	0	111.8	P378 H380 L381 L403 A404 Y406 E409 D410 Y424 K426 R427	P378-Y412 HydrophobicContact CB-CD1 4.3Å; P378-Y412 HydrophobicContact CB-CE1 4.07Å; P378-Y412 HydrophobicContact CG-CD1 3.86Å; P378-Y412 HydrophobicContact CG-CD2 3.65Å; P378-Y412 HydrophobicContact CG-CE1 3.97Å; P378-Y412 HydrophobicContact CG-CE2 3.81Å; P378-Y412 HydrophobicContact CG-CG 3.67Å; H380-Y412 AromaticContact CE1-CE1 3.96Å; H380-Y412 AromaticContact CE1-CZ 3.82Å; H380-Y412 PolarHBondContact CE1-OH 2.87Å; H380-Y412 PolarHBondContact NE2-OH 3.36Å; H380-Y412 VanDerWaalsContact NE2-OH 3.1Å; L381-Y412 HydrophobicContact CD1-CE2 4.46Å; L403-Y412 WeakPolarHBondContact CA-O 3.37Å; A404-Y412 PolarHBondContact N-O 2.85Å; A404-Y412 PolarHBondContact O-N 2.88Å; Y406-Y412 AromaticContact CD2-CD2 3.61Å; Y406-Y412 HydrophobicContact CD2-CD2 3.61Å; Y406-Y412 HydrophobicContact CD2-CE2 4.18Å; Y406-Y412 AromaticContact CE2-CD2 3.8Å; Y406-Y412 HydrophobicContact CE2-CD2 3.8Å; Y406-Y412 HydrophobicContact CG-CD2 4.44Å; E409-Y412 PolarHBondContact OE2-OH 2.85Å; D410-Y412 HydrophobicContact CB-CE2 4.2Å; D410-Y412 VanDerWaalsContact O-CD2 3.24Å; D410-Y412 WeakPolarHBondContact O-CD2 3.24Å; D410-Y412 WeakPolarHBondContact O-CE2 3.4Å; Y412-Y424 AromaticContact CD1-CD1 3.4Å; Y412-Y424 HydrophobicContact CD1-CD1 3.4Å; Y412-Y424 VanDerWaalsContact CD1-CD1 3.4Å; Y412-Y424 AromaticContact CD1-CD2 3.97Å; Y412-Y424 HydrophobicContact CD1-CD2 3.97Å; Y412-Y424 AromaticContact CD1-CE1 3.7Å; Y412-Y424 HydrophobicContact CD1-CE1 3.7Å; Y412-Y424 HydrophobicContact CD1-CE2 4.25Å; Y412-Y424 AromaticContact CD1-CG 3.55Å; Y412-Y424 HydrophobicContact CD1-CG 3.55Å; Y412-Y424 AromaticContact CE1-CD1 3.76Å; Y412-Y424 HydrophobicContact CE1-CD1 3.76Å; Y412-Y424 AromaticContact CE1-CE1 3.56Å; Y412-Y424 HydrophobicContact CE1-CE1 3.56Å; Y412-Y424 HydrophobicContact CE1-CE2 4.42Å; Y412-Y424 HydrophobicContact CE1-CG 4.27Å; Y412-Y424 AromaticContact CE1-CZ 3.91Å; Y412-Y424 HydrophobicContact CG-CD1 4.39Å; Y412-Y424 HydrophobicContact CG-CG 4.45Å; Y412-K426 WeakPolarHBondContact CA-O 3.33Å; Y412-R427 HydrophobicContact CD1-CB 4.07Å; Y412-R427 HydrophobicContact CD1-CG 4.09Å; Y412-R427 HydrophobicContact CE1-CB 3.99Å; Y412-R427 HydrophobicContact CE1-CG 3.59Å; Y412-R427 PolarHBondContact OH-NE 3.25Å; Y412-R427 PolarHBondContact OH-NH1 2.86Å; Y412-R427 PolarHBondContact OH-NH2 3.02Å
413	L	98.5	Very high	95.1	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	119.7	174.6	-173.9	73.4	0	0	0	109.7	E401 L403 Y424 V425 K426 Y428 F442 K464	E401-L413 HydrophobicContact CB-CD1 3.84Å; E401-L413 HydrophobicContact CB-CG 4.38Å; L403-L413 HydrophobicContact CB-CD1 4.29Å; L403-L413 HydrophobicContact CD1-CB 4.26Å; L403-L413 HydrophobicContact CD1-CD1 3.93Å; L413-Y424 CarbonylContact O-C 3.58Å; L413-Y424 WeakPolarHBondContact O-CA 3.49Å; L413-V425 PolarHBondContact O-N 2.89Å; L413-K426 HydrophobicContact CB-CB 3.95Å; L413-K426 HydrophobicContact CD2-CB 4.2Å; L413-K426 HydrophobicContact CD2-CD 3.99Å; L413-K426 HydrophobicContact CD2-CG 4.1Å; L413-K426 PolarHBondContact N-O 2.82Å; L413-K426 PolarHBondContact O-N 2.86Å; L413-Y428 HydrophobicContact CB-CE2 4.16Å; L413-F442 HydrophobicContact CD1-CE1 4.01Å; L413-F442 HydrophobicContact CD1-CZ 3.61Å; L413-K464 HydrophobicContact CD2-CD 4.39Å; L413-K464 HydrophobicContact CD2-CG 4.36Å
414	F	98.3	Very high	95.1	Very high	1 Å²	1	31.3 Å²	31.3	0%	0.004	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	152.8	173.3	-57.2	-84.3	0	0	0	110.3	V356 F376 P378 E401 L402 A404	V356-F414 HydrophobicContact CG2-CE2 4.17Å; F376-F414 HydrophobicContact CB-CD1 3.59Å; F376-F414 HydrophobicContact CB-CD2 4.4Å; F376-F414 HydrophobicContact CB-CE1 3.82Å; F376-F414 HydrophobicContact CB-CG 3.91Å; F376-F414 HydrophobicContact CB-CZ 4.32Å; F376-F414 HydrophobicContact CD1-CD1 4.38Å; F376-F414 HydrophobicContact CD2-CB 4.11Å; F376-F414 HydrophobicContact CD2-CG 4.37Å; F376-F414 HydrophobicContact CE2-CB 4.49Å; F376-F414 HydrophobicContact CG-CB 4.26Å; F376-F414 HydrophobicContact CG-CD1 4.01Å; F376-F414 HydrophobicContact CG-CG 4.18Å; P378-F414 HydrophobicContact CG-CZ 4.09Å; E401-F414 CarbonylContact C-O 3.26Å; E401-F414 VanDerWaalsContact CA-O 3.31Å; E401-F414 WeakPolarHBondContact CA-O 3.45Å; L402-F414 PolarHBondContact N-O 3.44Å; L402-F414 PolarHBondContact O-N 2.69Å; A404-F414 HydrophobicContact CB-CE2 4.27Å
415	N	96.8	Very high	95	Very high	41 Å²	41	34.7 Å²	34.7	22%	0.219	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	119.6	172.4	178.7	-19	0	0	0	108.7	T400 S417 H418 V425	T400-N415 PolarHBondContact O-OD1 3.01Å; N415-S417 VanDerWaalsContact CG-OG 3.26Å; N415-S417 PolarHBondContact ND2-OG 3.2Å; N415-S417 PolarHBondContact O-N 2.94Å; N415-S417 WeakPolarHBondContact OD1-CB 3.22Å; N415-S417 PolarHBondContact OD1-N 3.28Å; N415-S417 PolarHBondContact OD1-OG 3.11Å; N415-H418 PolarHBondContact ND2-NE2 3.49Å; N415-H418 WeakPolarHBondContact O-CB 3.35Å; N415-H418 PolarHBondContact O-N 3.42Å; N415-H418 VanDerWaalsContact O-N 3.1Å; N415-V425 HydrophobicContact CB-CG2 3.84Å
416	S	93.6	Very high	95.1	Very high	20 Å²	20	36.9 Å²	36.9	14%	0.14	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-17.9	-175.2	73.2	0	0	0	0	113	K374 G399 T400	K374-S416 PolarHBondContact NZ-O 2.92Å; G399-S416 PolarHBondContact O-OG 3Å; T400-S416 WeakPolarHBondContact CA-OG 3.44Å; T400-S416 PolarHBondContact O-N 3.13Å; T400-S416 PolarHBondContact O-OG 3.35Å; T400-S416 VanDerWaalsContact O-OG 3.1Å
417	S	93.4	Very high	95.2	Very high	86 Å²	86	39.5 Å²	39.5	60%	0.601	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-25.5	173.6	71.6	0	0	0	0	113.8	K374 N415	K374-S417 PolarHBondContact NZ-O 2.6Å; N415-S417 VanDerWaalsContact CG-OG 3.26Å; N415-S417 PolarHBondContact ND2-OG 3.2Å; N415-S417 PolarHBondContact O-N 2.94Å; N415-S417 WeakPolarHBondContact OD1-CB 3.22Å; N415-S417 PolarHBondContact OD1-N 3.28Å; N415-S417 PolarHBondContact OD1-OG 3.11Å
418	H	95.9	Very high	95.4	Very high	72 Å²	72	38.9 Å²	38.9	33%	0.333	22%	0.221	S	C	.	.	S	Bend	trans	-62.3	159.6	-178.4	-70.3	-170.9	0	0	0	112.4	K374 N415 A422	K374-H418 WeakPolarHBondContact CD-O 3.36Å; K374-H418 WeakPolarHBondContact CE-O 3.43Å; K374-H418 PolarHBondContact NZ-O 3.21Å; N415-H418 PolarHBondContact ND2-NE2 3.49Å; N415-H418 WeakPolarHBondContact O-CB 3.35Å; N415-H418 PolarHBondContact O-N 3.42Å; N415-H418 VanDerWaalsContact O-N 3.1Å; H418-A422 HydrophobicContact CB-CB 3.65Å
419	S	95.6	Very high	95.9	Very high	86 Å²	86	41 Å²	41	60%	0.601	23%	0.229	S	C	*	.	P	Polyproline II helix	trans	-63.1	162.8	176.9	59	0	0	0	0	112.5	F376 A422	F376-S419 WeakPolarHBondContact CE1-O 3.26Å; S419-A422 VanDerWaalsContact O-CB 3.25Å; S419-A422 WeakPolarHBondContact O-CB 3.46Å; S419-A422 PolarHBondContact O-N 3.22Å
420	D	95.4	Very high	95.9	Very high	92 Å²	92	39.6 Å²	39.6	49%	0.492	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	144.2	168.9	-170.5	43	0	0	0	111.7	K375 A422	K375-D420 WeakPolarHBondContact CA-OD1 3.31Å; K375-D420 PolarHBondContact N-OD1 3.21Å; D420-A422 PolarHBondContact O-N 3.4Å
421	G	94	Very high	95.8	Very high	40 Å²	40	39.3 Å²	39.3	41%	0.412	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	6.1	-178.7	0	0	0	0	0	116.5	K375 H379	K375-G421 WeakPolarHBondContact O-CA 3.45Å; K375-G421 PolarHBondContact O-N 3.49Å; H379-G421 PolarHBondContact NE2-O 2.92Å
422	A	95.9	Very high	95.5	Very high	16 Å²	16	39.6 Å²	39.6	13%	0.132	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-64.8	147.3	-179	0	0	0	0	0	113.4	F376 H418 S419 D420	F376-A422 HydrophobicContact CD1-CB 4.35Å; F376-A422 HydrophobicContact CE1-CB 4.07Å; H418-A422 HydrophobicContact CB-CB 3.65Å; S419-A422 VanDerWaalsContact O-CB 3.25Å; S419-A422 WeakPolarHBondContact O-CB 3.46Å; S419-A422 PolarHBondContact O-N 3.22Å; D420-A422 PolarHBondContact O-N 3.4Å
423	Q	96.1	Very high	95.1	Very high	64 Å²	64	39.6 Å²	39.6	30%	0.299	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-66.5	155.7	174.6	-174	65	-53.2	0	0	111.3
424	Y	97.2	Very high	94.3	Very high	60 Å²	60	41.1 Å²	41.1	24%	0.235	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-58.2	152.6	168.2	66.1	-97.5	0	0	0	112.2	P378 Y412 L413 K426 R427	P378-Y424 HydrophobicContact CB-CD1 3.82Å; P378-Y424 HydrophobicContact CB-CE1 4.03Å; P378-Y424 HydrophobicContact CG-CD1 4.27Å; Y412-Y424 AromaticContact CD1-CD1 3.4Å; Y412-Y424 HydrophobicContact CD1-CD1 3.4Å; Y412-Y424 VanDerWaalsContact CD1-CD1 3.4Å; Y412-Y424 AromaticContact CD1-CD2 3.97Å; Y412-Y424 HydrophobicContact CD1-CD2 3.97Å; Y412-Y424 AromaticContact CD1-CE1 3.7Å; Y412-Y424 HydrophobicContact CD1-CE1 3.7Å; Y412-Y424 HydrophobicContact CD1-CE2 4.25Å; Y412-Y424 AromaticContact CD1-CG 3.55Å; Y412-Y424 HydrophobicContact CD1-CG 3.55Å; Y412-Y424 AromaticContact CE1-CD1 3.76Å; Y412-Y424 HydrophobicContact CE1-CD1 3.76Å; Y412-Y424 AromaticContact CE1-CE1 3.56Å; Y412-Y424 HydrophobicContact CE1-CE1 3.56Å; Y412-Y424 HydrophobicContact CE1-CE2 4.42Å; Y412-Y424 HydrophobicContact CE1-CG 4.27Å; Y412-Y424 AromaticContact CE1-CZ 3.91Å; Y412-Y424 HydrophobicContact CG-CD1 4.39Å; Y412-Y424 HydrophobicContact CG-CG 4.45Å; L413-Y424 CarbonylContact O-C 3.58Å; L413-Y424 WeakPolarHBondContact O-CA 3.49Å; Y424-K426 WeakPolarHBondContact CD2-O 3.29Å; Y424-R427 HydrophobicContact CD2-CB 4.34Å; Y424-R427 HydrophobicContact CE2-CB 3.81Å
425	V	97.3	Very high	93	Very high	70 Å²	70	41.8 Å²	41.8	42%	0.424	24%	0.237	S	C	.	.	S	Bend	trans	-88.4	-37.4	174.5	-172.5	0	0	0	0	111.2	L413 N415	L413-V425 PolarHBondContact O-N 2.89Å; N415-V425 HydrophobicContact CB-CG2 3.84Å
426	K	97.3	Very high	92	Very high	46 Å²	46	40.3 Å²	40.3	20%	0.2	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	154.4	-179.2	-56.6	-172.7	-178.4	-166.7	0	112.3	Y412 L413 Y424 Y428 K464 S465	Y412-K426 WeakPolarHBondContact CA-O 3.33Å; L413-K426 HydrophobicContact CB-CB 3.95Å; L413-K426 HydrophobicContact CD2-CB 4.2Å; L413-K426 HydrophobicContact CD2-CD 3.99Å; L413-K426 HydrophobicContact CD2-CG 4.1Å; L413-K426 PolarHBondContact N-O 2.82Å; L413-K426 PolarHBondContact O-N 2.86Å; Y424-K426 WeakPolarHBondContact CD2-O 3.29Å; K426-Y428 HydrophobicContact CB-CE2 4.26Å; K426-K464 WeakPolarHBondContact CD-O 3.45Å; K426-K464 WeakPolarHBondContact CE-O 3.43Å; K426-K464 PolarHBondContact NZ-O 3.2Å; K426-S465 PolarHBondContact NZ-O 3.31Å
427	R	96.5	Very high	91.4	Very high	56 Å²	56	41.4 Å²	41.4	21%	0.211	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	124.8	177.3	179	-179.5	-179.4	139.7	10.2	107.8	H380 E409 D410 I411 Y412 Y424 K429	H380-R427 PolarHBondContact CE1-NH1 3.33Å; H380-R427 VanDerWaalsContact CE1-NH1 3.34Å; H380-R427 PolarHBondContact NE2-NH1 3.01Å; E409-R427 IonicContact OE1-NH2 2.72Å; E409-R427 IonicContact OE2-CZ 3.15Å; E409-R427 IonicContact OE2-NH2 2.73Å; E409-R427 PolarHBondContact OE2-NH2 3.42Å; D410-R427 HydrophobicContact CB-CG 3.85Å; D410-R427 IonicContact OD2-CZ 3.91Å; D410-R427 IonicContact OD2-NE 3.52Å; D410-R427 PolarHBondContact OD2-NE 2.89Å; D410-R427 IonicContact OD2-NH2 3.59Å; D410-R427 PolarHBondContact OD2-NH2 2.89Å; I411-R427 CarbonylContact O-C 3.57Å; I411-R427 VanDerWaalsContact O-CA 3.3Å; I411-R427 WeakPolarHBondContact O-CA 3.29Å; Y412-R427 HydrophobicContact CD1-CB 4.07Å; Y412-R427 HydrophobicContact CD1-CG 4.09Å; Y412-R427 HydrophobicContact CE1-CB 3.99Å; Y412-R427 HydrophobicContact CE1-CG 3.59Å; Y412-R427 PolarHBondContact OH-NE 3.25Å; Y412-R427 PolarHBondContact OH-NH1 2.86Å; Y412-R427 PolarHBondContact OH-NH2 3.02Å; Y424-R427 HydrophobicContact CD2-CB 4.34Å; Y424-R427 HydrophobicContact CE2-CB 3.81Å; R427-K429 HydrophobicContact CG-CG 4.18Å
428	Y	96.4	Very high	91	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	126.7	177.1	-49	-89.1	0	0	0	109.6	L403 D410 I411 L413 K426 V450 W462 K464 C467	L403-Y428 HydrophobicContact CD1-CD2 4.16Å; L403-Y428 HydrophobicContact CD1-CE2 3.71Å; D410-Y428 WeakPolarHBondContact CB-O 3.42Å; I411-Y428 HydrophobicContact CB-CD2 4.17Å; I411-Y428 HydrophobicContact CG2-CD2 3.97Å; I411-Y428 PolarHBondContact N-O 3.44Å; I411-Y428 PolarHBondContact O-N 3.47Å; L413-Y428 HydrophobicContact CB-CE2 4.16Å; K426-Y428 HydrophobicContact CB-CE2 4.26Å; Y428-V450 HydrophobicContact CD2-CG1 4.43Å; Y428-V450 HydrophobicContact CD2-CG2 4.48Å; Y428-V450 HydrophobicContact CE1-CB 4.44Å; Y428-V450 HydrophobicContact CE1-CG2 4.13Å; Y428-V450 HydrophobicContact CE2-CG2 3.89Å; Y428-W462 HydrophobicContact CD1-CB 3.66Å; Y428-W462 HydrophobicContact CD1-CD2 4.35Å; Y428-W462 AromaticContact CD1-CG 3.81Å; Y428-W462 HydrophobicContact CD1-CG 3.81Å; Y428-W462 HydrophobicContact CE1-CB 4.18Å; Y428-W462 HydrophobicContact CG-CD2 4.47Å; Y428-W462 HydrophobicContact CG-CG 4.36Å; Y428-K464 WeakPolarHBondContact OH-CG 3.48Å; Y428-C467 HydrophobicContact CD1-CB 4.02Å; Y428-C467 HydrophobicContact CE1-CB 4.08Å
429	K	94	Very high	90.6	Very high	69 Å²	69	34.8 Å²	34.8	30%	0.3	20%	0.2	S	C	.	.			trans	-116.3	165.5	-167.2	-62.6	-167.5	173.3	-177	0	112.2	W139 D410 R427 W462	W139-K429 HydrophobicContact CH2-CB 4.05Å; W139-K429 HydrophobicContact CZ2-CB 3.35Å; W139-K429 HydrophobicContact CZ2-CD 3.95Å; W139-K429 HydrophobicContact CZ2-CG 4.31Å; D410-K429 WeakPolarHBondContact OD2-CG 3.37Å; R427-K429 HydrophobicContact CG-CG 4.18Å; K429-W462 WeakPolarHBondContact O-CZ2 3.44Å; K429-W462 PolarHBondContact O-NE1 3.22Å; K429-W462 VanDerWaalsContact O-NE1 3.08Å
430	G	91.1	Very high	90.7	Very high	6 Å²	6	30.9 Å²	30.9	6%	0.062	17%	0.173	C	C	.	.	S	Bend	trans	103	-22.4	170.1	0	0	0	0	0	115.5	F460 N525	G430-F460 WeakPolarHBondContact O-CZ 3.46Å; G430-N525 PolarHBondContact O-ND2 3.49Å
431	H	92.6	Very high	90.8	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.157	C	C	.	.			trans	-76.9	163.5	173	85.9	-36.6	0	0	0	112.9	E409 S452 F460 W462 R529	E409-H431 PolarHBondContact O-CE1 3.47Å; H431-S452 PolarHBondContact CD2-OG 2.89Å; H431-F460 HydrophobicContact CB-CD2 3.88Å; H431-F460 HydrophobicContact CB-CE2 4Å; H431-F460 HydrophobicContact CB-CG 4.31Å; H431-W462 HydrophobicContact CB-CH2 4.03Å; H431-W462 HydrophobicContact CB-CZ2 4.26Å; H431-R529 PolarHBondContact O-NH2 3.12Å; H431-R529 VanDerWaalsContact O-NH2 3.1Å
432	R	90.5	Very high	91	Very high	7 Å²	7	26.7 Å²	26.7	3%	0.026	14%	0.14	C	C	.	.			trans	-118.7	127.5	174.5	-165.3	86.2	-169.1	99.9	-1.2	109.8	D408 N434 S454 D455 D532	D408-R432 IonicContact OD1-CZ 2.76Å; D408-R432 IonicContact OD1-NH1 3.31Å; D408-R432 PolarHBondContact OD1-NH1 3.14Å; D408-R432 IonicContact OD1-NH2 3.43Å; D408-R432 PolarHBondContact OD1-NH2 2.77Å; R432-N434 PolarHBondContact NH2-ND2 3.29Å; R432-S454 PolarHBondContact N-OG 2.83Å; R432-S454 CarbonylContact O-C 3.57Å; R432-S454 VanDerWaalsContact O-CA 3.32Å; R432-S454 WeakPolarHBondContact O-CA 3.46Å; R432-S454 PolarHBondContact O-OG 2.86Å; R432-D455 HydrophobicContact CB-CB 4.25Å; R432-D455 HydrophobicContact CG-CB 4.12Å; R432-D455 PolarHBondContact O-N 3.19Å; R432-D532 IonicContact CZ-OD2 3.59Å; R432-D532 IonicContact NE-OD2 3.54Å; R432-D532 IonicContact NH2-OD2 3.61Å; R432-D532 PolarHBondContact NH2-OD2 2.76Å
433	N	90.1	Very high	91	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.135	C	C	.	.			trans	-138.8	71.8	179.6	177.1	12	0	0	0	108.4	T391 S405 Y406 N407 D408 T436 K438	T391-N433 PolarHBondContact OG1-ND2 3.23Å; S405-N433 PolarHBondContact OG-ND2 2.87Å; Y406-N433 PolarHBondContact O-ND2 2.78Å; N407-N433 CarbonylContact C-O 3.58Å; N407-N433 WeakPolarHBondContact CA-O 3.35Å; D408-N433 PolarHBondContact N-O 2.79Å; N433-T436 PolarHBondContact OD1-O 2.8Å; N433-K438 HydrophobicContact CB-CB 4.38Å; N433-K438 HydrophobicContact CB-CG 3.75Å; N433-K438 VanDerWaalsContact CG-CG 3.44Å; N433-K438 VanDerWaalsContact OD1-CG 3.23Å; N433-K438 WeakPolarHBondContact OD1-CG 3.32Å
434	N	82.6	Confident	91	Very high	32 Å²	32	24 Å²	24	17%	0.171	13%	0.129	C	C	.	.	S	Bend	trans	-116.4	-47.8	-178.3	-171	19.6	0	0	0	112.2	R432 D455 D532 F540	R432-N434 PolarHBondContact NH2-ND2 3.29Å; N434-D455 PolarHBondContact N-OD2 3.29Å; N434-D532 PolarHBondContact ND2-OD2 2.78Å; N434-F540 VanDerWaalsContact O-CD2 3.27Å; N434-F540 WeakPolarHBondContact O-CD2 3.46Å
435	A	71.3	Confident	90.8	Very high	15 Å²	15	22.7 Å²	22.7	12%	0.124	13%	0.128	C	C	.	.	S	Bend	trans	-86	-22.2	-168	0	0	0	0	0	114	D455 F547	A435-D455 PolarHBondContact N-OD2 3.09Å; A435-F547 HydrophobicContact CB-CD2 4.16Å; A435-F547 HydrophobicContact CB-CE2 4.17Å; A435-F547 HydrophobicContact CB-CG 4.34Å; A435-F547 HydrophobicContact CB-CZ 4.36Å
436	T	75.4	Confident	90.6	Very high	10 Å²	10	23.9 Å²	23.9	6%	0.061	13%	0.128	C	C	.	.	S	Bend	trans	-146.1	160	-171.2	59.2	0	0	0	0	112.4	N433 K438 D455 V480 N482	N433-T436 PolarHBondContact OD1-O 2.8Å; T436-K438 PolarHBondContact O-N 3.24Å; T436-K438 VanDerWaalsContact OG1-CE 3.23Å; T436-K438 WeakPolarHBondContact OG1-CE 3.38Å; T436-K438 PolarHBondContact OG1-NZ 2.91Å; T436-D455 PolarHBondContact OG1-OD1 3.15Å; T436-V480 HydrophobicContact CG2-CG1 4.1Å; T436-N482 PolarHBondContact OG1-OD1 2.76Å; T436-N482 VanDerWaalsContact OG1-OD1 3.1Å
437	V	81.2	Confident	90.6	Very high	43 Å²	43	21.9 Å²	21.9	26%	0.261	12%	0.119	S	C	.	.			trans	-71.9	112.7	176.8	178.3	0	0	0	0	110.1	T391 F540 M544	T391-V437 WeakPolarHBondContact O-CG1 3.16Å; V437-F540 HydrophobicContact CG2-CZ 4.11Å; V437-M544 HydrophobicContact CG2-CE 3.77Å; V437-M544 HydrophobicContact CG2-SD 4.32Å
438	K	84.8	Confident	90.5	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.12	C	C	.	.			trans	-90.1	129	176.8	-59.5	-59.4	173.8	-165.5	0	113.6	T391 C392 N433 T436 D455 V481 N482	T391-K438 PolarHBondContact OG1-O 3.41Å; C392-K438 WeakPolarHBondContact CB-O 3.05Å; N433-K438 HydrophobicContact CB-CB 4.38Å; N433-K438 HydrophobicContact CB-CG 3.75Å; N433-K438 VanDerWaalsContact CG-CG 3.44Å; N433-K438 VanDerWaalsContact OD1-CG 3.23Å; N433-K438 WeakPolarHBondContact OD1-CG 3.32Å; T436-K438 PolarHBondContact O-N 3.24Å; T436-K438 VanDerWaalsContact OG1-CE 3.23Å; T436-K438 WeakPolarHBondContact OG1-CE 3.38Å; T436-K438 PolarHBondContact OG1-NZ 2.91Å; K438-D455 WeakPolarHBondContact CE-OD1 3.46Å; K438-D455 IonicContact NZ-OD1 2.73Å; K438-D455 PolarHBondContact NZ-OD1 3.18Å; K438-V481 WeakPolarHBondContact CD-O 3.29Å; K438-V481 WeakPolarHBondContact CE-O 3.36Å; K438-V481 PolarHBondContact NZ-O 2.79Å; K438-N482 PolarHBondContact NZ-OD1 3.1Å
439	G	88.1	Confident	90.6	Very high	19 Å²	19	21.7 Å²	21.7	20%	0.196	12%	0.121	C	C	.	.			trans	-69.1	135.5	160.5	0	0	0	0	0	111.3	N482	G439-N482 WeakPolarHBondContact CA-O 3.23Å; G439-N482 PolarHBondContact N-O 3.32Å
440	V	96.8	Very high	90.8	Very high	3 Å²	3	18.4 Å²	18.4	2%	0.018	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	141.8	166.9	70.9	0	0	0	0	108	C392 V394 L403 I411 V450 V451	C392-V440 HydrophobicContact CB-CG1 4.15Å; V394-V440 WeakPolarHBondContact CG1-O 3.42Å; L403-V440 HydrophobicContact CD2-CG1 4.25Å; L403-V440 HydrophobicContact CD2-CG2 3.56Å; L403-V440 HydrophobicContact CG-CG1 4.41Å; L403-V440 HydrophobicContact CG-CG2 4.23Å; I411-V440 HydrophobicContact CD1-CG2 3.94Å; I411-V440 HydrophobicContact CG1-CG2 4.36Å; I411-V440 HydrophobicContact CG2-CG2 4Å; V440-V450 HydrophobicContact CG2-CG1 4.16Å; V440-V451 WeakPolarHBondContact CG2-O 3.49Å
441	N	97.8	Very high	91.1	Very high	32 Å²	32	18.1 Å²	18.1	17%	0.171	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	162.5	-179.9	-143.8	-25.9	0	0	0	111.8	V451 L484 P486	N441-V451 HydrophobicContact CB-CG1 3.87Å; N441-V451 PolarHBondContact N-O 2.9Å; N441-V451 WeakPolarHBondContact O-CG1 3.35Å; N441-V451 PolarHBondContact O-N 2.89Å; N441-L484 PolarHBondContact ND2-O 3.13Å; N441-P486 HydrophobicContact CB-CG 4.37Å; N441-P486 WeakPolarHBondContact ND2-CD 3.48Å
442	F	97.9	Very high	91.3	Very high	13 Å²	13	18.1 Å²	18.1	6%	0.057	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	147.7	163.6	-72.3	-72	0	0	0	109.6	V394 Y395 L403 L413 F449 V450 K464 P486	V394-F442 HydrophobicContact CG2-CD2 3.76Å; V394-F442 HydrophobicContact CG2-CE2 3.98Å; Y395-F442 WeakPolarHBondContact O-CD2 3.46Å; L403-F442 HydrophobicContact CB-CE1 4.37Å; L403-F442 HydrophobicContact CB-CE2 3.74Å; L403-F442 HydrophobicContact CB-CZ 3.64Å; L403-F442 HydrophobicContact CD2-CD1 4.38Å; L403-F442 HydrophobicContact CD2-CE1 4.19Å; L403-F442 HydrophobicContact CD2-CE2 4.37Å; L403-F442 HydrophobicContact CD2-CZ 4.21Å; L403-F442 HydrophobicContact CG-CZ 4.36Å; L413-F442 HydrophobicContact CD1-CE1 4.01Å; L413-F442 HydrophobicContact CD1-CZ 3.61Å; F442-F449 WeakPolarHBondContact CA-O 3.19Å; F442-V450 HydrophobicContact CD1-CG2 3.97Å; F442-V450 HydrophobicContact CE1-CG2 3.97Å; F442-K464 HydrophobicContact CD1-CD 4.47Å; F442-K464 HydrophobicContact CE1-CD 3.89Å; F442-P486 WeakPolarHBondContact O-CG 3.14Å
443	Y	97.1	Very high	91.5	Very high	5 Å²	5	17.8 Å²	17.8	2%	0.02	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	147.3	173.8	178.7	-83	0	0	0	110.1	C174 V180 F183 E448 F449 P486 P491	C174-Y443 WeakPolarHBondContact O-CE1 3.47Å; V180-Y443 HydrophobicContact CG2-CD1 3.83Å; V180-Y443 HydrophobicContact CG2-CE1 3.47Å; V180-Y443 VanDerWaalsContact CG2-CE1 3.47Å; F183-Y443 HydrophobicContact CE2-CE1 4.2Å; F183-Y443 HydrophobicContact CE2-CE2 4.05Å; F183-Y443 AromaticContact CE2-CZ 3.82Å; F183-Y443 HydrophobicContact CZ-CE1 4.34Å; F183-Y443 AromaticContact CZ-CE2 3.67Å; F183-Y443 HydrophobicContact CZ-CE2 3.67Å; F183-Y443 AromaticContact CZ-CZ 3.53Å; F183-Y443 WeakPolarHBondContact CZ-OH 3.33Å; Y443-E448 PolarHBondContact O-N 3.14Å; Y443-F449 HydrophobicContact CD1-CB 4.27Å; Y443-F449 AromaticContact CD1-CD2 3.75Å; Y443-F449 HydrophobicContact CD1-CD2 3.75Å; Y443-F449 HydrophobicContact CD1-CG 4.33Å; Y443-F449 HydrophobicContact CE1-CD2 4.33Å; Y443-F449 PolarHBondContact N-O 3.37Å; Y443-F449 PolarHBondContact O-N 3.45Å; Y443-P486 HydrophobicContact CD2-CB 3.9Å; Y443-P486 HydrophobicContact CD2-CG 4.21Å; Y443-P486 HydrophobicContact CE2-CB 4.48Å; Y443-P491 WeakPolarHBondContact OH-CA 3.14Å
444	G	94.4	Very high	91.7	Very high	17 Å²	17	17.8 Å²	17.8	18%	0.175	10%	0.102	C	C	.	.	S	Bend	trans	85	147.1	-167.6	0	0	0	0	0	112.3	K446 S447 E448	G444-K446 VanDerWaalsContact C-N 3.25Å; G444-K446 PolarHBondContact O-N 3.04Å; G444-S447 PolarHBondContact O-N 2.99Å; G444-E448 VanDerWaalsContact CA-OE2 3.23Å; G444-E448 WeakPolarHBondContact CA-OE2 3.23Å
445	P	92.9	Very high	92.1	Very high	33 Å²	33	17.7 Å²	17.7	21%	0.214	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-2	-167.9	35	-38.2	0	0	0	114.7	Y171 H397 E448	Y171-P445 HydrophobicContact CD1-CG 3.79Å; Y171-P445 HydrophobicContact CD2-CB 3.78Å; Y171-P445 HydrophobicContact CD2-CG 3.82Å; Y171-P445 HydrophobicContact CE1-CB 4.27Å; Y171-P445 HydrophobicContact CE1-CG 3.72Å; Y171-P445 HydrophobicContact CE2-CB 3.47Å; Y171-P445 VanDerWaalsContact CE2-CB 3.47Å; Y171-P445 HydrophobicContact CE2-CG 3.78Å; Y171-P445 HydrophobicContact CG-CB 4.31Å; Y171-P445 HydrophobicContact CG-CG 3.82Å; Y171-P445 WeakPolarHBondContact O-CG 3.37Å; Y171-P445 PolarHBondContact OH-O 3.47Å; H397-P445 PolarHBondContact CD2-O 3.31Å; H397-P445 VanDerWaalsContact CD2-O 3.3Å; P445-E448 WeakPolarHBondContact CD-OE2 3.46Å
446	K	94	Very high	93	Very high	95 Å²	95	18 Å²	18	41%	0.413	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113	18.1	164.6	-61.4	174.9	170.6	153.9	0	112.3	Y171 H397 G444 E448	Y171-K446 HydrophobicContact CE1-CD 4.36Å; Y171-K446 HydrophobicContact CE1-CG 4.17Å; Y171-K446 WeakPolarHBondContact OH-CE 3.1Å; Y171-K446 WeakPolarHBondContact OH-CG 3.38Å; H397-K446 PolarHBondContact CE1-O 3.02Å; H397-K446 PolarHBondContact ND1-O 2.87Å; G444-K446 VanDerWaalsContact C-N 3.25Å; G444-K446 PolarHBondContact O-N 3.04Å; K446-E448 VanDerWaalsContact C-N 3.29Å; K446-E448 WeakPolarHBondContact CA-OE2 3.29Å; K446-E448 HydrophobicContact CB-CG 4.34Å; K446-E448 PolarHBondContact N-OE2 2.88Å; K446-E448 PolarHBondContact O-N 2.99Å
447	S	96.8	Very high	93.8	Very high	4 Å²	4	17.7 Å²	17.7	3%	0.028	10%	0.102	C	C	.	.			trans	56.4	45.5	-172.7	-50.8	0	0	0	0	111	H397 G444 F449 K464	H397-S447 PolarHBondContact N-OG 2.89Å; G444-S447 PolarHBondContact O-N 2.99Å; S447-F449 PolarHBondContact O-N 3.5Å; S447-K464 WeakPolarHBondContact O-CD 3.49Å; S447-K464 WeakPolarHBondContact O-CE 3.4Å; S447-K464 PolarHBondContact O-NZ 3.36Å
448	E	95.9	Very high	94.5	Very high	48 Å²	48	17.2 Å²	17.2	22%	0.224	10%	0.097	C	C	.	.			trans	-65.3	-25.6	-179.8	-67.1	92.7	155.3	0	0	112.9	Y443 G444 P445 K446 K464	Y443-E448 PolarHBondContact O-N 3.14Å; G444-E448 VanDerWaalsContact CA-OE2 3.23Å; G444-E448 WeakPolarHBondContact CA-OE2 3.23Å; P445-E448 WeakPolarHBondContact CD-OE2 3.46Å; K446-E448 VanDerWaalsContact C-N 3.29Å; K446-E448 WeakPolarHBondContact CA-OE2 3.29Å; K446-E448 HydrophobicContact CB-CG 4.34Å; K446-E448 PolarHBondContact N-OE2 2.88Å; K446-E448 PolarHBondContact O-N 2.99Å; E448-K464 WeakPolarHBondContact O-CB 3.42Å; E448-K464 PolarHBondContact O-N 2.93Å
449	F	97.4	Very high	95	Very high	4 Å²	4	17.2 Å²	17.2	2%	0.018	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	157.3	-175.6	-51	-75.9	0	0	0	111.4	G175 R177 V180 F442 Y443 S447 W462 E463 I470	G175-F449 VanDerWaalsContact O-CE2 3.32Å; G175-F449 WeakPolarHBondContact O-CE2 3.47Å; R177-F449 HydrophobicContact CB-CE1 4.01Å; R177-F449 HydrophobicContact CB-CZ 3.85Å; R177-F449 HydrophobicContact CG-CE1 3.93Å; R177-F449 HydrophobicContact CG-CZ 4.26Å; V180-F449 HydrophobicContact CG2-CD2 3.92Å; V180-F449 HydrophobicContact CG2-CE2 3.85Å; V180-F449 HydrophobicContact CG2-CG 4.28Å; V180-F449 HydrophobicContact CG2-CZ 4.2Å; F442-F449 WeakPolarHBondContact CA-O 3.19Å; Y443-F449 HydrophobicContact CD1-CB 4.27Å; Y443-F449 AromaticContact CD1-CD2 3.75Å; Y443-F449 HydrophobicContact CD1-CD2 3.75Å; Y443-F449 HydrophobicContact CD1-CG 4.33Å; Y443-F449 HydrophobicContact CE1-CD2 4.33Å; Y443-F449 PolarHBondContact N-O 3.37Å; Y443-F449 PolarHBondContact O-N 3.45Å; S447-F449 PolarHBondContact O-N 3.5Å; F449-W462 CarbonylContact C-O 3.56Å; F449-W462 VanDerWaalsContact CA-O 3.25Å; F449-W462 WeakPolarHBondContact CA-O 3.49Å; F449-W462 WeakPolarHBondContact CB-O 3.26Å; F449-E463 HydrophobicContact CD1-CB 4.34Å; F449-E463 HydrophobicContact CD1-CG 4.43Å; F449-E463 HydrophobicContact CE1-CB 4.41Å; F449-E463 HydrophobicContact CE1-CG 4.16Å; F449-I470 HydrophobicContact CD1-CD1 3.24Å; F449-I470 HydrophobicContact CD1-CG1 4.46Å; F449-I470 HydrophobicContact CE1-CD1 3.37Å; F449-I470 HydrophobicContact CG-CD1 4.25Å; F449-I470 HydrophobicContact CZ-CD1 4.43Å
450	V	98.3	Very high	95.5	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	141.1	168.4	169.5	0	0	0	0	108.2	L403 Y428 V440 F442 L461 W462	L403-V450 HydrophobicContact CD1-CG1 4.41Å; L403-V450 HydrophobicContact CD1-CG2 4.08Å; L403-V450 HydrophobicContact CD2-CB 4.46Å; L403-V450 HydrophobicContact CD2-CG1 3.76Å; L403-V450 HydrophobicContact CD2-CG2 3.96Å; Y428-V450 HydrophobicContact CD2-CG1 4.43Å; Y428-V450 HydrophobicContact CD2-CG2 4.48Å; Y428-V450 HydrophobicContact CE1-CB 4.44Å; Y428-V450 HydrophobicContact CE1-CG2 4.13Å; Y428-V450 HydrophobicContact CE2-CG2 3.89Å; V440-V450 HydrophobicContact CG2-CG1 4.16Å; F442-V450 HydrophobicContact CD1-CG2 3.97Å; F442-V450 HydrophobicContact CE1-CG2 3.97Å; V450-L461 CarbonylContact O-C 3.51Å; V450-L461 VanDerWaalsContact O-CA 3.26Å; V450-L461 WeakPolarHBondContact O-CA 3.45Å; V450-W462 HydrophobicContact CB-CE3 4.28Å; V450-W462 HydrophobicContact CG1-CE3 3.87Å; V450-W462 HydrophobicContact CG1-CZ3 4.22Å; V450-W462 PolarHBondContact N-O 2.91Å; V450-W462 PolarHBondContact O-N 3.44Å
451	V	97.9	Very high	95.5	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	135	176.2	59.2	0	0	0	0	110.5	V440 N441 I459 F460 L461 L484 L493	V440-V451 WeakPolarHBondContact CG2-O 3.49Å; N441-V451 HydrophobicContact CB-CG1 3.87Å; N441-V451 PolarHBondContact N-O 2.9Å; N441-V451 WeakPolarHBondContact O-CG1 3.35Å; N441-V451 PolarHBondContact O-N 2.89Å; V451-I459 HydrophobicContact CG2-CG2 3.8Å; V451-F460 WeakPolarHBondContact CA-O 3.49Å; V451-L461 HydrophobicContact CB-CD2 3.98Å; V451-L461 HydrophobicContact CB-CG 3.93Å; V451-L461 HydrophobicContact CG2-CD1 4.21Å; V451-L461 HydrophobicContact CG2-CD2 3.97Å; V451-L461 HydrophobicContact CG2-CG 3.72Å; V451-L484 HydrophobicContact CB-CD1 4.46Å; V451-L484 HydrophobicContact CG1-CD1 4.41Å; V451-L484 HydrophobicContact CG2-CD1 3.77Å; V451-L484 HydrophobicContact CG2-CD2 4.42Å; V451-L493 HydrophobicContact CG2-CD2 4.04Å
452	S	96.9	Very high	95.5	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	146.5	178.1	-158.1	0	0	0	0	112.4	I411 H431 F460	I411-S452 VanDerWaalsContact CD1-CB 3.48Å; H431-S452 PolarHBondContact CD2-OG 2.89Å; S452-F460 PolarHBondContact N-O 2.9Å; S452-F460 PolarHBondContact O-N 2.83Å
453	G	94.6	Very high	95.3	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.081	C	C	.	.			trans	-80.6	173.6	169.1	0	0	0	0	0	110.8
454	S	94	Very high	95.3	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.086	C	C	.	.			trans	-147.6	150.8	-179.4	-167.8	0	0	0	0	111.7	R432 C456 G457 H458 V481	R432-S454 PolarHBondContact N-OG 2.83Å; R432-S454 CarbonylContact O-C 3.57Å; R432-S454 VanDerWaalsContact O-CA 3.32Å; R432-S454 WeakPolarHBondContact O-CA 3.46Å; R432-S454 PolarHBondContact O-OG 2.86Å; S454-C456 PolarHBondContact O-N 3.08Å; S454-C456 PolarHBondContact OG-N 2.9Å; S454-C456 PolarHBondContact OG-SG 3.49Å; S454-G457 PolarHBondContact O-N 2.87Å; S454-H458 VanDerWaalsContact CB-O 3.24Å; S454-H458 WeakPolarHBondContact CB-O 3.44Å; S454-H458 PolarHBondContact N-O 2.93Å; S454-H458 VanDerWaalsContact N-O 3.14Å; S454-V481 PolarHBondContact O-N 2.91Å
455	D	90.9	Very high	95.2	Very high	31 Å²	31	19.3 Å²	19.3	17%	0.166	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	2.8	167	-71.1	-38.1	0	0	0	113.2	R432 N434 A435 T436 K438 G479	R432-D455 HydrophobicContact CB-CB 4.25Å; R432-D455 HydrophobicContact CG-CB 4.12Å; R432-D455 PolarHBondContact O-N 3.19Å; N434-D455 PolarHBondContact N-OD2 3.29Å; A435-D455 PolarHBondContact N-OD2 3.09Å; T436-D455 PolarHBondContact OG1-OD1 3.15Å; K438-D455 WeakPolarHBondContact CE-OD1 3.46Å; K438-D455 IonicContact NZ-OD1 2.73Å; K438-D455 PolarHBondContact NZ-OD1 3.18Å; D455-G479 CarbonylContact C-O 3.53Å
456	C	90.8	Very high	95.2	Very high	21 Å²	21	19.7 Å²	19.7	14%	0.142	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	10.9	168	73.3	0	0	0	0	113.5	S454 H458 G479 V521 N525	S454-C456 PolarHBondContact O-N 3.08Å; S454-C456 PolarHBondContact OG-N 2.9Å; S454-C456 PolarHBondContact OG-SG 3.49Å; C456-H458 VanDerWaalsContact C-N 3.3Å; C456-H458 PolarHBondContact O-N 3.36Å; C456-H458 PolarHBondContact O-ND1 2.81Å; C456-G479 CarbonylContact C-O 3.59Å; C456-V521 HydrophobicContact CB-CG1 4.31Å; C456-N525 VanDerWaalsContact CB-OD1 3.27Å; C456-N525 WeakPolarHBondContact CB-OD1 3.13Å; C456-N525 PolarHBondContact SG-ND2 3.44Å; C456-N525 VanDerWaalsContact SG-ND2 3.44Å
457	G	91.8	Very high	95.2	Very high	3 Å²	3	16.3 Å²	16.3	3%	0.031	10%	0.096	C	C	.	.	S	Bend	trans	82.7	1.3	176.6	0	0	0	0	0	115	S454 G475 D476 G479 V481	S454-G457 PolarHBondContact O-N 2.87Å; G457-G475 WeakPolarHBondContact O-CA 3.34Å; G457-G475 PolarHBondContact O-N 2.87Å; G457-D476 PolarHBondContact O-N 2.86Å; G457-G479 VanDerWaalsContact CA-O 3.27Å; G457-G479 WeakPolarHBondContact CA-O 3.29Å; G457-G479 VanDerWaalsContact N-C 3.27Å; G457-G479 PolarHBondContact N-O 2.86Å; G457-V481 WeakPolarHBondContact O-CG2 3.41Å
458	H	95.1	Very high	95	Very high	34 Å²	34	17.2 Å²	17.2	16%	0.157	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	153.9	-172.9	-65.6	80.6	0	0	0	113.6	S454 C456 F460 F472 M473 E474	S454-H458 VanDerWaalsContact CB-O 3.24Å; S454-H458 WeakPolarHBondContact CB-O 3.44Å; S454-H458 PolarHBondContact N-O 2.93Å; S454-H458 VanDerWaalsContact N-O 3.14Å; C456-H458 VanDerWaalsContact C-N 3.3Å; C456-H458 PolarHBondContact O-N 3.36Å; C456-H458 PolarHBondContact O-ND1 2.81Å; H458-F460 HydrophobicContact CB-CE2 4.27Å; H458-F472 HydrophobicContact CB-CD2 4.02Å; H458-F472 HydrophobicContact CB-CE2 3.26Å; H458-F472 HydrophobicContact CB-CZ 3.57Å; H458-F472 AromaticContact CD2-CE1 3.26Å; H458-F472 WeakPolarHBondContact CD2-CE1 3.4Å; H458-F472 AromaticContact CD2-CE2 3.65Å; H458-F472 AromaticContact CD2-CZ 2.98Å; H458-F472 WeakPolarHBondContact CD2-CZ 3.47Å; H458-F472 AromaticContact CE1-CZ 4Å; H458-F472 AromaticContact CG-CE1 3.98Å; H458-F472 AromaticContact CG-CE2 3.52Å; H458-F472 AromaticContact CG-CZ 3.21Å; H458-F472 AromaticContact ND1-CZ 3.83Å; H458-F472 AromaticContact NE2-CE1 3.67Å; H458-F472 AromaticContact NE2-CZ 3.53Å; H458-M473 CarbonylContact C-O 3.11Å; H458-M473 WeakPolarHBondContact CA-O 3.26Å; H458-M473 WeakPolarHBondContact CB-O 3.25Å; H458-E474 VanDerWaalsContact CD2-CA 3.47Å; H458-E474 WeakPolarHBondContact CD2-CA 3.37Å
459	I	96.6	Very high	94.9	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	126.5	171.7	-55.1	151.7	0	0	0	107.5	V451 L461 F472 M473 V481 L484 L493 T495 W505	V451-I459 HydrophobicContact CG2-CG2 3.8Å; I459-L461 HydrophobicContact CG2-CD1 3.93Å; I459-F472 WeakPolarHBondContact O-CA 3.4Å; I459-M473 HydrophobicContact CB-CB 4.49Å; I459-M473 HydrophobicContact CB-CE 3.97Å; I459-M473 HydrophobicContact CD1-CE 3.98Å; I459-M473 HydrophobicContact CG2-CE 3.83Å; I459-M473 PolarHBondContact N-O 3.08Å; I459-M473 PolarHBondContact O-N 3.2Å; I459-V481 HydrophobicContact CG1-CG1 4.12Å; I459-V481 HydrophobicContact CG1-CG2 4.23Å; I459-L484 HydrophobicContact CG1-CD2 4.28Å; I459-L484 HydrophobicContact CG2-CD2 4.08Å; I459-L493 HydrophobicContact CG2-CD2 4.24Å; I459-T495 HydrophobicContact CD1-CG2 3.7Å; I459-T495 HydrophobicContact CG1-CG2 4.24Å; I459-W505 HydrophobicContact CD1-CD2 4.29Å; I459-W505 HydrophobicContact CD1-CH2 4.31Å; I459-W505 HydrophobicContact CD1-CZ2 3.65Å
460	F	96.9	Very high	94.8	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	137	175.4	-70.7	-103.7	0	0	0	109.9	G430 H431 V451 S452 H458 W462 I469 F472 L518 I522	G430-F460 WeakPolarHBondContact O-CZ 3.46Å; H431-F460 HydrophobicContact CB-CD2 3.88Å; H431-F460 HydrophobicContact CB-CE2 4Å; H431-F460 HydrophobicContact CB-CG 4.31Å; V451-F460 WeakPolarHBondContact CA-O 3.49Å; S452-F460 PolarHBondContact N-O 2.9Å; S452-F460 PolarHBondContact O-N 2.83Å; H458-F460 HydrophobicContact CB-CE2 4.27Å; F460-W462 HydrophobicContact CB-CD2 4.47Å; F460-W462 HydrophobicContact CB-CE3 4.16Å; F460-W462 HydrophobicContact CB-CH2 3.26Å; F460-W462 HydrophobicContact CB-CZ2 3.59Å; F460-W462 HydrophobicContact CB-CZ3 3.56Å; F460-W462 HydrophobicContact CD1-CZ2 4.1Å; F460-W462 HydrophobicContact CG-CH2 4Å; F460-W462 HydrophobicContact CG-CZ2 4.03Å; F460-W462 WeakPolarHBondContact O-CZ3 3.31Å; F460-I469 HydrophobicContact CD1-CD1 4Å; F460-I469 HydrophobicContact CE1-CD1 4.22Å; F460-F472 AromaticContact CD1-CD2 3.77Å; F460-F472 HydrophobicContact CD1-CD2 3.77Å; F460-F472 HydrophobicContact CD1-CE2 4.25Å; F460-F472 HydrophobicContact CD2-CD2 4.19Å; F460-F472 HydrophobicContact CD2-CE2 4.24Å; F460-F472 AromaticContact CE1-CD2 3.64Å; F460-F472 HydrophobicContact CE1-CD2 3.64Å; F460-F472 AromaticContact CE1-CE2 3.71Å; F460-F472 HydrophobicContact CE1-CE2 3.71Å; F460-F472 HydrophobicContact CE2-CD2 4.07Å; F460-F472 AromaticContact CE2-CE2 3.7Å; F460-F472 HydrophobicContact CE2-CE2 3.7Å; F460-F472 HydrophobicContact CG-CD2 4.05Å; F460-F472 HydrophobicContact CG-CE2 4.5Å; F460-F472 AromaticContact CZ-CD2 3.81Å; F460-F472 HydrophobicContact CZ-CD2 3.81Å; F460-F472 AromaticContact CZ-CE2 3.41Å; F460-F472 HydrophobicContact CZ-CE2 3.41Å; F460-F472 VanDerWaalsContact CZ-CE2 3.41Å; F460-L518 HydrophobicContact CE1-CD1 4Å; F460-I522 HydrophobicContact CE1-CG1 4.39Å
461	L	97.4	Very high	94.6	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	129.9	167.3	-62.6	94.2	0	0	0	111.1	V180 F183 V450 V451 I459 I470 Q471 M473	V180-L461 HydrophobicContact CG1-CB 4.17Å; V180-L461 HydrophobicContact CG1-CD2 3.84Å; V180-L461 HydrophobicContact CG1-CG 4.5Å; F183-L461 HydrophobicContact CD2-CD2 4.42Å; F183-L461 HydrophobicContact CE2-CD2 4.22Å; V450-L461 CarbonylContact O-C 3.51Å; V450-L461 VanDerWaalsContact O-CA 3.26Å; V450-L461 WeakPolarHBondContact O-CA 3.45Å; V451-L461 HydrophobicContact CB-CD2 3.98Å; V451-L461 HydrophobicContact CB-CG 3.93Å; V451-L461 HydrophobicContact CG2-CD1 4.21Å; V451-L461 HydrophobicContact CG2-CD2 3.97Å; V451-L461 HydrophobicContact CG2-CG 3.72Å; I459-L461 HydrophobicContact CG2-CD1 3.93Å; L461-I470 HydrophobicContact CB-CG1 4.38Å; L461-I470 WeakPolarHBondContact O-CG1 3.47Å; L461-I470 PolarHBondContact O-N 2.87Å; L461-Q471 HydrophobicContact CB-CB 4.21Å; L461-Q471 HydrophobicContact CD1-CB 4.12Å; L461-Q471 HydrophobicContact CD1-CG 4.07Å; L461-Q471 PolarHBondContact N-O 3.01Å; L461-Q471 PolarHBondContact O-N 2.86Å; L461-M473 HydrophobicContact CD1-CE 3.63Å
462	W	97.1	Very high	94.4	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	147.8	177.9	-55.3	-100.9	0	0	0	111	I411 Y428 K429 H431 F449 V450 F460 Q468 I469	I411-W462 HydrophobicContact CD1-CH2 3.71Å; I411-W462 HydrophobicContact CD1-CZ3 3.91Å; Y428-W462 HydrophobicContact CD1-CB 3.66Å; Y428-W462 HydrophobicContact CD1-CD2 4.35Å; Y428-W462 AromaticContact CD1-CG 3.81Å; Y428-W462 HydrophobicContact CD1-CG 3.81Å; Y428-W462 HydrophobicContact CE1-CB 4.18Å; Y428-W462 HydrophobicContact CG-CD2 4.47Å; Y428-W462 HydrophobicContact CG-CG 4.36Å; K429-W462 WeakPolarHBondContact O-CZ2 3.44Å; K429-W462 PolarHBondContact O-NE1 3.22Å; K429-W462 VanDerWaalsContact O-NE1 3.08Å; H431-W462 HydrophobicContact CB-CH2 4.03Å; H431-W462 HydrophobicContact CB-CZ2 4.26Å; F449-W462 CarbonylContact C-O 3.56Å; F449-W462 VanDerWaalsContact CA-O 3.25Å; F449-W462 WeakPolarHBondContact CA-O 3.49Å; F449-W462 WeakPolarHBondContact CB-O 3.26Å; V450-W462 HydrophobicContact CB-CE3 4.28Å; V450-W462 HydrophobicContact CG1-CE3 3.87Å; V450-W462 HydrophobicContact CG1-CZ3 4.22Å; V450-W462 PolarHBondContact N-O 2.91Å; V450-W462 PolarHBondContact O-N 3.44Å; F460-W462 HydrophobicContact CB-CD2 4.47Å; F460-W462 HydrophobicContact CB-CE3 4.16Å; F460-W462 HydrophobicContact CB-CH2 3.26Å; F460-W462 HydrophobicContact CB-CZ2 3.59Å; F460-W462 HydrophobicContact CB-CZ3 3.56Å; F460-W462 HydrophobicContact CD1-CZ2 4.1Å; F460-W462 HydrophobicContact CG-CH2 4Å; F460-W462 HydrophobicContact CG-CZ2 4.03Å; F460-W462 WeakPolarHBondContact O-CZ3 3.31Å; W462-Q468 CarbonylContact C-O 3.45Å; W462-Q468 WeakPolarHBondContact CA-O 3.43Å; W462-I469 HydrophobicContact CG-CG1 4.24Å
463	E	95.2	Very high	94.4	Very high	22 Å²	22	16.9 Å²	16.9	10%	0.103	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	120.5	167.6	-171.2	-166.7	-100.7	0	0	109.8	R177 F449 S465 S466 C467 Q468 I470	R177-E463 WeakPolarHBondContact CD-OE1 3.47Å; R177-E463 IonicContact CZ-OE1 3.75Å; R177-E463 IonicContact NE-OE1 3.76Å; R177-E463 IonicContact NH1-OE1 3.72Å; R177-E463 PolarHBondContact NH1-OE1 2.75Å; F449-E463 HydrophobicContact CD1-CB 4.34Å; F449-E463 HydrophobicContact CD1-CG 4.43Å; F449-E463 HydrophobicContact CE1-CB 4.41Å; F449-E463 HydrophobicContact CE1-CG 4.16Å; E463-S465 VanDerWaalsContact CG-OG 3.3Å; E463-S465 WeakPolarHBondContact CG-OG 3.41Å; E463-S465 PolarHBondContact O-N 3.01Å; E463-S465 VanDerWaalsContact O-N 3.13Å; E463-S465 PolarHBondContact OE2-OG 3.34Å; E463-S466 PolarHBondContact O-N 2.97Å; E463-S466 WeakPolarHBondContact OE2-CB 3.36Å; E463-S466 PolarHBondContact OE2-OG 2.73Å; E463-C467 WeakPolarHBondContact O-CA 3.3Å; E463-C467 PolarHBondContact O-N 2.72Å; E463-Q468 PolarHBondContact N-O 3.3Å; E463-I470 HydrophobicContact CB-CG2 3.8Å
464	K	95.5	Very high	94.3	Very high	30 Å²	30	23.4 Å²	23.4	13%	0.13	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-32.1	-174.3	-170.1	-177.2	67.4	-174.5	0	111.8	E401 L413 K426 Y428 F442 S447 E448	E401-K464 WeakPolarHBondContact OE2-CD 3.4Å; E401-K464 VanDerWaalsContact OE2-CE 3.31Å; E401-K464 WeakPolarHBondContact OE2-CE 3.13Å; E401-K464 IonicContact OE2-NZ 3.31Å; E401-K464 PolarHBondContact OE2-NZ 2.74Å; L413-K464 HydrophobicContact CD2-CD 4.39Å; L413-K464 HydrophobicContact CD2-CG 4.36Å; K426-K464 WeakPolarHBondContact CD-O 3.45Å; K426-K464 WeakPolarHBondContact CE-O 3.43Å; K426-K464 PolarHBondContact NZ-O 3.2Å; Y428-K464 WeakPolarHBondContact OH-CG 3.48Å; F442-K464 HydrophobicContact CD1-CD 4.47Å; F442-K464 HydrophobicContact CE1-CD 3.89Å; S447-K464 WeakPolarHBondContact O-CD 3.49Å; S447-K464 WeakPolarHBondContact O-CE 3.4Å; S447-K464 PolarHBondContact O-NZ 3.36Å; E448-K464 WeakPolarHBondContact O-CB 3.42Å; E448-K464 PolarHBondContact O-N 2.93Å
465	S	93.4	Very high	94.1	Very high	80 Å²	80	23.6 Å²	23.6	56%	0.559	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-51.7	179.8	28.9	0	0	0	0	113	K426 E463	K426-S465 PolarHBondContact NZ-O 3.31Å; E463-S465 VanDerWaalsContact CG-OG 3.3Å; E463-S465 WeakPolarHBondContact CG-OG 3.41Å; E463-S465 PolarHBondContact O-N 3.01Å; E463-S465 VanDerWaalsContact O-N 3.13Å; E463-S465 PolarHBondContact OE2-OG 3.34Å
466	S	92.2	Very high	93.8	Very high	41 Å²	41	22.3 Å²	22.3	29%	0.287	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-14.5	-169.1	51.2	0	0	0	0	114.2	E463 Q468	E463-S466 PolarHBondContact O-N 2.97Å; E463-S466 WeakPolarHBondContact OE2-CB 3.36Å; E463-S466 PolarHBondContact OE2-OG 2.73Å; S466-Q468 PolarHBondContact O-N 3.1Å
467	C	94.1	Very high	93	Very high	25 Å²	25	30.1 Å²	30.1	17%	0.169	16%	0.155	C	C	.	.			trans	67.2	1.6	-169.3	-42.2	0	0	0	0	115	Y428 E463	Y428-C467 HydrophobicContact CD1-CB 4.02Å; Y428-C467 HydrophobicContact CE1-CB 4.08Å; E463-C467 WeakPolarHBondContact O-CA 3.3Å; E463-C467 PolarHBondContact O-N 2.72Å
468	Q	92.9	Very high	92.1	Very high	23 Å²	23	31.1 Å²	31.1	11%	0.107	17%	0.165	C	C	.	.			trans	-75.6	144.8	-176.5	-67.7	-173.1	-90.3	0	0	112.6	S142 E143 S145 W462 E463 S466 I470	S142-Q468 PolarHBondContact O-NE2 3.22Å; S142-Q468 VanDerWaalsContact O-NE2 3.17Å; E143-Q468 WeakPolarHBondContact O-CB 3.45Å; E143-Q468 WeakPolarHBondContact O-CG 3.45Å; E143-Q468 PolarHBondContact O-NE2 2.97Å; S145-Q468 PolarHBondContact O-NE2 3.3Å; S145-Q468 PolarHBondContact OG-NE2 3.06Å; W462-Q468 CarbonylContact C-O 3.45Å; W462-Q468 WeakPolarHBondContact CA-O 3.43Å; E463-Q468 PolarHBondContact N-O 3.3Å; S466-Q468 PolarHBondContact O-N 3.1Å; Q468-I470 PolarHBondContact O-N 2.96Å
469	I	94.5	Very high	91.4	Very high	5 Å²	5	30.7 Å²	30.7	3%	0.026	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	122.4	173.1	-62.2	165.8	0	0	0	108.9	F460 W462 F472 L515 L518 I522	F460-I469 HydrophobicContact CD1-CD1 4Å; F460-I469 HydrophobicContact CE1-CD1 4.22Å; W462-I469 HydrophobicContact CG-CG1 4.24Å; I469-F472 HydrophobicContact CG2-CB 4.4Å; I469-L515 WeakPolarHBondContact O-CD1 3.22Å; I469-L518 HydrophobicContact CB-CD2 4.07Å; I469-L518 HydrophobicContact CD1-CD1 4.19Å; I469-L518 HydrophobicContact CD1-CD2 4.23Å; I469-L518 HydrophobicContact CG2-CD1 4.28Å; I469-L518 HydrophobicContact CG2-CD2 3.67Å; I469-I522 HydrophobicContact CD1-CD1 3.6Å
470	I	94.2	Very high	91	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.01	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	-17.7	-177.4	59.5	160.1	0	0	0	113.5	L147 R177 V180 F449 L461 E463 Q468 T513	L147-I470 HydrophobicContact CD1-CG2 3.42Å; L147-I470 VanDerWaalsContact CD1-CG2 3.42Å; R177-I470 HydrophobicContact CG-CD1 3.78Å; V180-I470 HydrophobicContact CB-CD1 4.01Å; V180-I470 HydrophobicContact CG1-CD1 3.52Å; V180-I470 HydrophobicContact CG1-CG1 4.12Å; F449-I470 HydrophobicContact CD1-CD1 3.24Å; F449-I470 HydrophobicContact CD1-CG1 4.46Å; F449-I470 HydrophobicContact CE1-CD1 3.37Å; F449-I470 HydrophobicContact CG-CD1 4.25Å; F449-I470 HydrophobicContact CZ-CD1 4.43Å; L461-I470 HydrophobicContact CB-CG1 4.38Å; L461-I470 WeakPolarHBondContact O-CG1 3.47Å; L461-I470 PolarHBondContact O-N 2.87Å; E463-I470 HydrophobicContact CB-CG2 3.8Å; Q468-I470 PolarHBondContact O-N 2.96Å; I470-T513 VanDerWaalsContact O-CG2 3.27Å; I470-T513 WeakPolarHBondContact O-CG2 3.45Å
471	Q	95.1	Very high	90.7	Very high	6 Å²	6	31.6 Å²	31.6	3%	0.028	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	144.3	175.3	179.4	65	-76.5	0	0	109.1	V180 Q181 F183 L461 M473 T513	V180-Q471 HydrophobicContact CG1-CB 3.96Å; V180-Q471 WeakPolarHBondContact O-CG 3.45Å; V180-Q471 PolarHBondContact O-NE2 3.13Å; Q181-Q471 VanDerWaalsContact C-NE2 3.29Å; Q181-Q471 PolarHBondContact O-NE2 3.3Å; Q181-Q471 VanDerWaalsContact O-NE2 3.1Å; F183-Q471 HydrophobicContact CB-CG 4.45Å; L461-Q471 HydrophobicContact CB-CB 4.21Å; L461-Q471 HydrophobicContact CD1-CB 4.12Å; L461-Q471 HydrophobicContact CD1-CG 4.07Å; L461-Q471 PolarHBondContact N-O 3.01Å; L461-Q471 PolarHBondContact O-N 2.86Å; Q471-M473 HydrophobicContact CG-CE 4.47Å; Q471-M473 HydrophobicContact CG-CG 3.83Å; Q471-M473 HydrophobicContact CG-SD 3.9Å; Q471-T513 PolarHBondContact OE1-OG1 3.23Å; Q471-T513 VanDerWaalsContact OE1-OG1 3.04Å
472	F	93.6	Very high	90.4	Very high	20 Å²	20	32.3 Å²	32.3	9%	0.088	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	127.7	-179.6	169.9	-99.5	0	0	0	108.2	H458 I459 F460 I469 L515 L518 V521	H458-F472 HydrophobicContact CB-CD2 4.02Å; H458-F472 HydrophobicContact CB-CE2 3.26Å; H458-F472 HydrophobicContact CB-CZ 3.57Å; H458-F472 AromaticContact CD2-CE1 3.26Å; H458-F472 WeakPolarHBondContact CD2-CE1 3.4Å; H458-F472 AromaticContact CD2-CE2 3.65Å; H458-F472 AromaticContact CD2-CZ 2.98Å; H458-F472 WeakPolarHBondContact CD2-CZ 3.47Å; H458-F472 AromaticContact CE1-CZ 4Å; H458-F472 AromaticContact CG-CE1 3.98Å; H458-F472 AromaticContact CG-CE2 3.52Å; H458-F472 AromaticContact CG-CZ 3.21Å; H458-F472 AromaticContact ND1-CZ 3.83Å; H458-F472 AromaticContact NE2-CE1 3.67Å; H458-F472 AromaticContact NE2-CZ 3.53Å; I459-F472 WeakPolarHBondContact O-CA 3.4Å; F460-F472 AromaticContact CD1-CD2 3.77Å; F460-F472 HydrophobicContact CD1-CD2 3.77Å; F460-F472 HydrophobicContact CD1-CE2 4.25Å; F460-F472 HydrophobicContact CD2-CD2 4.19Å; F460-F472 HydrophobicContact CD2-CE2 4.24Å; F460-F472 AromaticContact CE1-CD2 3.64Å; F460-F472 HydrophobicContact CE1-CD2 3.64Å; F460-F472 AromaticContact CE1-CE2 3.71Å; F460-F472 HydrophobicContact CE1-CE2 3.71Å; F460-F472 HydrophobicContact CE2-CD2 4.07Å; F460-F472 AromaticContact CE2-CE2 3.7Å; F460-F472 HydrophobicContact CE2-CE2 3.7Å; F460-F472 HydrophobicContact CG-CD2 4.05Å; F460-F472 HydrophobicContact CG-CE2 4.5Å; F460-F472 AromaticContact CZ-CD2 3.81Å; F460-F472 HydrophobicContact CZ-CD2 3.81Å; F460-F472 AromaticContact CZ-CE2 3.41Å; F460-F472 HydrophobicContact CZ-CE2 3.41Å; F460-F472 VanDerWaalsContact CZ-CE2 3.41Å; I469-F472 HydrophobicContact CG2-CB 4.4Å; F472-L515 HydrophobicContact CB-CD2 4.31Å; F472-L518 HydrophobicContact CB-CD1 3.91Å; F472-L518 HydrophobicContact CD1-CB 4.42Å; F472-L518 HydrophobicContact CD1-CD1 4.04Å; F472-L518 HydrophobicContact CD2-CD1 3.67Å; F472-L518 HydrophobicContact CE1-CD1 4.46Å; F472-L518 HydrophobicContact CE2-CD1 4.11Å; F472-L518 HydrophobicContact CG-CD1 3.61Å; F472-L518 HydrophobicContact CZ-CD1 4.47Å; F472-V521 HydrophobicContact CE1-CG2 4.29Å; F472-V521 HydrophobicContact CE2-CG1 4.12Å; F472-V521 HydrophobicContact CZ-CB 3.81Å; F472-V521 HydrophobicContact CZ-CG1 3.73Å; F472-V521 HydrophobicContact CZ-CG2 3.86Å
473	M	95.4	Very high	90.2	Very high	12 Å²	12	33.1 Å²	33.1	6%	0.059	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	137.4	-168.5	-56	174.3	-59.9	0	0	110.5	F183 H458 I459 L461 Q471 G475 L493 W505	F183-M473 HydrophobicContact CB-CE 4.4Å; F183-M473 HydrophobicContact CB-SD 3.47Å; F183-M473 WeakPolarHBondContact CB-SD 3.25Å; F183-M473 HydrophobicContact CG-SD 4.4Å; H458-M473 CarbonylContact C-O 3.11Å; H458-M473 WeakPolarHBondContact CA-O 3.26Å; H458-M473 WeakPolarHBondContact CB-O 3.25Å; I459-M473 HydrophobicContact CB-CB 4.49Å; I459-M473 HydrophobicContact CB-CE 3.97Å; I459-M473 HydrophobicContact CD1-CE 3.98Å; I459-M473 HydrophobicContact CG2-CE 3.83Å; I459-M473 PolarHBondContact N-O 3.08Å; I459-M473 PolarHBondContact O-N 3.2Å; L461-M473 HydrophobicContact CD1-CE 3.63Å; Q471-M473 HydrophobicContact CG-CE 4.47Å; Q471-M473 HydrophobicContact CG-CG 3.83Å; Q471-M473 HydrophobicContact CG-SD 3.9Å; M473-G475 PolarHBondContact O-N 3.21Å; M473-L493 HydrophobicContact CE-CD2 4.43Å; M473-W505 HydrophobicContact CB-CE3 4.4Å; M473-W505 HydrophobicContact CB-CH2 4.22Å; M473-W505 HydrophobicContact CB-CZ3 3.84Å; M473-W505 HydrophobicContact CE-CD2 4.24Å; M473-W505 HydrophobicContact CE-CE3 4.03Å; M473-W505 HydrophobicContact CG-CE3 4.48Å; M473-W505 HydrophobicContact CG-CZ3 4.27Å; M473-W505 HydrophobicContact SD-CD2 4.28Å; M473-W505 HydrophobicContact SD-CE3 3.5Å; M473-W505 VanDerWaalsContact SD-CE3 3.5Å; M473-W505 HydrophobicContact SD-CZ3 3.87Å
474	E	94	Very high	90.2	Very high	136 Å²	136	32.6 Å²	32.6	64%	0.636	18%	0.183	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-69.1	109	170.8	-173.1	-175.7	176.7	0	0	109.2	H458 W505	H458-E474 VanDerWaalsContact CD2-CA 3.47Å; H458-E474 WeakPolarHBondContact CD2-CA 3.37Å; E474-W505 VanDerWaalsContact O-CH2 3.23Å; E474-W505 WeakPolarHBondContact O-CH2 3.46Å
475	G	88.6	Confident	90.2	Very high	4 Å²	4	33 Å²	33	4%	0.041	19%	0.185	C	C	.	.			trans	-94.3	-44.5	-168.8	0	0	0	0	0	114.5	G457 M473 K503	G457-G475 WeakPolarHBondContact O-CA 3.34Å; G457-G475 PolarHBondContact O-N 2.87Å; M473-G475 PolarHBondContact O-N 3.21Å; G475-K503 WeakPolarHBondContact O-CD 3.35Å; G475-K503 WeakPolarHBondContact O-CE 3.45Å
476	D	84.4	Confident	90.4	Very high	5 Å²	5	30.2 Å²	30.2	3%	0.027	17%	0.166	C	C	.	.			trans	-142.8	132.3	-169.1	-171.8	-70.7	0	0	0	111.3	G457 G478 G479 V481 G497 L498 D499 K503	G457-D476 PolarHBondContact O-N 2.86Å; D476-G478 VanDerWaalsContact C-N 3.34Å; D476-G478 VanDerWaalsContact OD1-CA 3.3Å; D476-G478 WeakPolarHBondContact OD1-CA 3.27Å; D476-G478 PolarHBondContact OD1-N 2.76Å; D476-G479 PolarHBondContact O-N 2.95Å; D476-G479 VanDerWaalsContact O-N 3.1Å; D476-V481 HydrophobicContact CB-CG2 3.74Å; D476-G497 VanDerWaalsContact OD2-CA 3.22Å; D476-G497 WeakPolarHBondContact OD2-CA 3.37Å; D476-G497 PolarHBondContact OD2-N 3.33Å; D476-L498 PolarHBondContact OD2-N 3.4Å; D476-D499 VanDerWaalsContact CG-CG 3.48Å; D476-D499 VanDerWaalsContact CG-OD2 3.29Å; D476-D499 VanDerWaalsContact OD1-CG 3.28Å; D476-D499 PolarHBondContact OD1-N 3.04Å; D476-D499 VanDerWaalsContact OD2-CB 3.23Å; D476-D499 WeakPolarHBondContact OD2-CB 3.33Å; D476-D499 PolarHBondContact OD2-N 2.94Å; D476-K503 IonicContact OD2-NZ 3.83Å
477	K	76	Confident	90.7	Very high	184 Å²	184	28.9 Å²	28.9	80%	0.8	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-23.1	-174.5	-70.3	-178.4	179.8	175.6	0	112.7	G479 D499	K477-G479 PolarHBondContact O-N 3.4Å; K477-D499 PolarHBondContact N-OD2 2.9Å
478	G	71.8	Confident	90.7	Very high	24 Å²	24	30.8 Å²	30.8	25%	0.247	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-2.3	167.3	0	0	0	0	0	113.3	D476 V480 D499	D476-G478 VanDerWaalsContact C-N 3.34Å; D476-G478 VanDerWaalsContact OD1-CA 3.3Å; D476-G478 WeakPolarHBondContact OD1-CA 3.27Å; D476-G478 PolarHBondContact OD1-N 2.76Å; G478-V480 VanDerWaalsContact C-N 3.32Å; G478-D499 PolarHBondContact N-OD1 3.38Å
479	G	80.6	Confident	90.6	Very high	26 Å²	26	34.4 Å²	34.4	27%	0.268	18%	0.184	S	C	.	.	S	Bend	trans	79.3	12.6	176.1	0	0	0	0	0	113.6	D455 C456 G457 D476 K477	D455-G479 CarbonylContact C-O 3.53Å; C456-G479 CarbonylContact C-O 3.59Å; G457-G479 VanDerWaalsContact CA-O 3.27Å; G457-G479 WeakPolarHBondContact CA-O 3.29Å; G457-G479 VanDerWaalsContact N-C 3.27Å; G457-G479 PolarHBondContact N-O 2.86Å; D476-G479 PolarHBondContact O-N 2.95Å; D476-G479 VanDerWaalsContact O-N 3.1Å; K477-G479 PolarHBondContact O-N 3.4Å
480	V	87.8	Confident	90.6	Very high	17 Å²	17	37.6 Å²	37.6	10%	0.103	20%	0.2	C	C	.	.			trans	-145.7	109.3	-170.5	178.3	0	0	0	0	109.9	T436 G478 N482 G497 L498	T436-V480 HydrophobicContact CG2-CG1 4.1Å; G478-V480 VanDerWaalsContact C-N 3.32Å; V480-N482 VanDerWaalsContact CG1-OD1 3.28Å; V480-N482 WeakPolarHBondContact CG1-OD1 3.42Å; V480-G497 CarbonylContact O-C 3.52Å; V480-G497 WeakPolarHBondContact O-CA 3.29Å; V480-L498 HydrophobicContact CB-CB 4.38Å; V480-L498 HydrophobicContact CB-CD1 3.63Å; V480-L498 HydrophobicContact CB-CG 3.72Å; V480-L498 HydrophobicContact CG1-CD1 3.86Å; V480-L498 HydrophobicContact CG1-CG 3.76Å; V480-L498 HydrophobicContact CG2-CD1 3.66Å; V480-L498 HydrophobicContact CG2-CG 4.33Å; V480-L498 PolarHBondContact O-N 2.79Å; V480-L498 VanDerWaalsContact O-N 3.12Å
481	V	91.1	Very high	90.6	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.006	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	128.8	171.6	-178.9	0	0	0	0	108.9	K438 S454 G457 I459 D476 L484	K438-V481 WeakPolarHBondContact CD-O 3.29Å; K438-V481 WeakPolarHBondContact CE-O 3.36Å; K438-V481 PolarHBondContact NZ-O 2.79Å; S454-V481 PolarHBondContact O-N 2.91Å; G457-V481 WeakPolarHBondContact O-CG2 3.41Å; I459-V481 HydrophobicContact CG1-CG1 4.12Å; I459-V481 HydrophobicContact CG1-CG2 4.23Å; D476-V481 HydrophobicContact CB-CG2 3.74Å; V481-L484 HydrophobicContact CG1-CD2 3.91Å
482	N	90.4	Very high	90.7	Very high	16 Å²	16	38.7 Å²	38.7	9%	0.086	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	-38.1	-174.1	-69.1	-23.7	0	0	0	113.1	T436 K438 G439 V480 S496	T436-N482 PolarHBondContact OG1-OD1 2.76Å; T436-N482 VanDerWaalsContact OG1-OD1 3.1Å; K438-N482 PolarHBondContact NZ-OD1 3.1Å; G439-N482 WeakPolarHBondContact CA-O 3.23Å; G439-N482 PolarHBondContact N-O 3.32Å; V480-N482 VanDerWaalsContact CG1-OD1 3.28Å; V480-N482 WeakPolarHBondContact CG1-OD1 3.42Å; N482-S496 PolarHBondContact N-O 3.25Å
483	C	92.6	Very high	90.9	Very high	17 Å²	17	37.7 Å²	37.7	12%	0.115	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	138.6	-170.1	-49.4	0	0	0	0	110.8	N197 L199 T495 S496	N197-C483 PolarHBondContact O-SG 3.44Å; L199-C483 HydrophobicContact CD1-CB 4.31Å; L199-C483 HydrophobicContact CG-CB 4.35Å; C483-T495 VanDerWaalsContact O-CA 3.26Å; C483-T495 WeakPolarHBondContact O-CA 3.2Å; C483-S496 WeakPolarHBondContact CB-OG 3.27Å; C483-S496 PolarHBondContact N-O 3.3Å; C483-S496 PolarHBondContact O-N 2.83Å
484	L	95.1	Very high	91.1	Very high	11 Å²	11	37.1 Å²	37.1	6%	0.058	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	115.7	-177.6	-58.2	171.2	0	0	0	109.2	N441 V451 I459 V481 L493 T495	N441-L484 PolarHBondContact ND2-O 3.13Å; V451-L484 HydrophobicContact CB-CD1 4.46Å; V451-L484 HydrophobicContact CG1-CD1 4.41Å; V451-L484 HydrophobicContact CG2-CD1 3.77Å; V451-L484 HydrophobicContact CG2-CD2 4.42Å; I459-L484 HydrophobicContact CG1-CD2 4.28Å; I459-L484 HydrophobicContact CG2-CD2 4.08Å; V481-L484 HydrophobicContact CG1-CD2 3.91Å; L484-L493 HydrophobicContact CB-CD1 4.49Å; L484-T495 HydrophobicContact CD2-CG2 3.39Å
485	E	97.4	Very high	91.2	Very high	37 Å²	37	30.7 Å²	30.7	17%	0.173	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	107	179	-171.7	75.5	157.3	0	0	110.1	L199 H200 F201 A494	L199-E485 HydrophobicContact CB-CB 3.78Å; H200-E485 WeakPolarHBondContact CA-OE1 3.5Å; H200-E485 IonicContact CD2-OE1 3.65Å; H200-E485 PolarHBondContact CD2-OE1 2.93Å; H200-E485 VanDerWaalsContact CD2-OE1 3.31Å; H200-E485 IonicContact CG-OE1 2.89Å; F201-E485 HydrophobicContact CD2-CG 3.75Å; F201-E485 HydrophobicContact CE2-CG 4.3Å; F201-E485 WeakPolarHBondContact CE2-O 3.3Å; E485-A494 PolarHBondContact N-O 3.36Å; E485-A494 PolarHBondContact O-N 3.07Å
486	P	97.3	Very high	91.6	Very high	22 Å²	22	30.6 Å²	30.6	14%	0.143	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	141.1	168.4	-22	33.8	0	0	0	111.5	F201 N441 F442 Y443 L493	F201-P486 WeakPolarHBondContact CD2-O 3.31Å; N441-P486 HydrophobicContact CB-CG 4.37Å; N441-P486 WeakPolarHBondContact ND2-CD 3.48Å; F442-P486 WeakPolarHBondContact O-CG 3.14Å; Y443-P486 HydrophobicContact CD2-CB 3.9Å; Y443-P486 HydrophobicContact CD2-CG 4.21Å; Y443-P486 HydrophobicContact CE2-CB 4.48Å; P486-L493 HydrophobicContact CG-CD1 4.3Å
487	H	97.3	Very high	91.8	Very high	14 Å²	14	30.4 Å²	30.4	7%	0.065	17%	0.168	C	C	.	.			trans	-71.8	134.1	170.7	-178.5	-71.5	0	0	0	110.4	F201 G205 W222 H489 L490 V492	F201-H487 AromaticContact CD1-CD2 3.86Å; F201-H487 HydrophobicContact CD2-CB 4.18Å; F201-H487 AromaticContact CE1-CD2 3.67Å; F201-H487 HydrophobicContact CE2-CB 3.83Å; F201-H487 HydrophobicContact CZ-CB 4.02Å; G205-H487 VanDerWaalsContact CA-NE2 3.35Å; G205-H487 WeakPolarHBondContact CA-NE2 3.25Å; G205-H487 PolarHBondContact O-NE2 3.45Å; W222-H487 AromaticContact CE2-CD2 3.98Å; W222-H487 AromaticContact CZ2-CD2 3.59Å; W222-H487 AromaticContact CZ2-NE2 3.64Å; H487-H489 VanDerWaalsContact C-N 3.33Å; H487-H489 PolarHBondContact ND1-N 3.38Å; H487-H489 PolarHBondContact O-N 2.78Å; H487-L490 VanDerWaalsContact CE1-CG 3.46Å; H487-L490 WeakPolarHBondContact CE1-CG 3.46Å; H487-L490 WeakPolarHBondContact ND1-CB 3.01Å; H487-L490 PolarHBondContact ND1-N 3.27Å; H487-V492 HydrophobicContact CB-CB 3.73Å; H487-V492 HydrophobicContact CB-CG1 4.2Å; H487-V492 WeakPolarHBondContact CB-O 3.48Å; H487-V492 PolarHBondContact N-O 2.96Å
488	P	93.7	Very high	92.3	Very high	64 Å²	64	22.5 Å²	22.5	42%	0.416	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-31.9	-170.6	22.4	-33.9	0	0	0	114.7	F201	F201-P488 HydrophobicContact CB-CG 4.34Å
489	H	92	Very high	93	Very high	100 Å²	100	22.5 Å²	22.5	46%	0.463	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.8	3.9	-171	-50.5	-62.1	0	0	0	116.2	V170 Q203 H487	V170-H489 WeakPolarHBondContact CG1-O 3.21Å; Q203-H489 PolarHBondContact O-NE2 3.16Å; H487-H489 VanDerWaalsContact C-N 3.33Å; H487-H489 PolarHBondContact ND1-N 3.38Å; H487-H489 PolarHBondContact O-N 2.78Å
490	L	94.9	Very high	93.5	Very high	72 Å²	72	25.3 Å²	25.3	38%	0.377	14%	0.135	S	C	.	.	S	Bend	trans	-143	155.2	-170.9	-66.7	176.6	0	0	0	109.5	V170 W222 H487 V492	V170-L490 HydrophobicContact CG1-CD2 4.33Å; W222-L490 HydrophobicContact CH2-CD1 4.22Å; W222-L490 HydrophobicContact CZ2-CD1 4.17Å; H487-L490 VanDerWaalsContact CE1-CG 3.46Å; H487-L490 WeakPolarHBondContact CE1-CG 3.46Å; H487-L490 WeakPolarHBondContact ND1-CB 3.01Å; H487-L490 PolarHBondContact ND1-N 3.27Å; L490-V492 HydrophobicContact CB-CG2 4.32Å; L490-V492 PolarHBondContact O-N 3.05Å
491	P	94.5	Very high	93.7	Very high	20 Å²	20	25.5 Å²	25.5	13%	0.13	14%	0.135	C	C	.	.	S	Bend	trans	-78.1	68	178.3	33.6	-36	0	0	0	110.4	F179 Y443 P507	F179-P491 HydrophobicContact CD1-CB 3.78Å; F179-P491 HydrophobicContact CD1-CG 3.75Å; F179-P491 HydrophobicContact CE1-CG 4.08Å; Y443-P491 WeakPolarHBondContact OH-CA 3.14Å; P491-P507 HydrophobicContact CB-CG 4.13Å; P491-P507 HydrophobicContact CG-CG 4.02Å; P491-P507 WeakPolarHBondContact O-CD 3.47Å
492	V	96.9	Very high	94	Very high	10 Å²	10	25.5 Å²	25.5	6%	0.061	14%	0.135	C	C	.	.			trans	-133.5	142.6	-177.7	171.5	0	0	0	0	108.5	F201 W222 H487 L490 I504 W505 A506	F201-V492 HydrophobicContact CZ-CG1 4.46Å; W222-V492 HydrophobicContact CH2-CG1 4.34Å; W222-V492 HydrophobicContact CH2-CG2 3.98Å; W222-V492 HydrophobicContact CZ3-CG1 4.17Å; W222-V492 HydrophobicContact CZ3-CG2 4.22Å; H487-V492 HydrophobicContact CB-CB 3.73Å; H487-V492 HydrophobicContact CB-CG1 4.2Å; H487-V492 WeakPolarHBondContact CB-O 3.48Å; H487-V492 PolarHBondContact N-O 2.96Å; L490-V492 HydrophobicContact CB-CG2 4.32Å; L490-V492 PolarHBondContact O-N 3.05Å; V492-I504 HydrophobicContact CG1-CG2 3.92Å; V492-W505 VanDerWaalsContact CA-O 3.32Å; V492-W505 WeakPolarHBondContact CA-O 3.29Å; V492-A506 HydrophobicContact CG2-CB 4.42Å
493	L	97.9	Very high	94.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	135	172.8	174.4	71.4	0	0	0	107.8	F183 V451 I459 M473 L484 P486 T495 W505	F183-L493 HydrophobicContact CZ-CB 4.19Å; V451-L493 HydrophobicContact CG2-CD2 4.04Å; I459-L493 HydrophobicContact CG2-CD2 4.24Å; M473-L493 HydrophobicContact CE-CD2 4.43Å; L484-L493 HydrophobicContact CB-CD1 4.49Å; P486-L493 HydrophobicContact CG-CD1 4.3Å; L493-T495 HydrophobicContact CD1-CG2 4.45Å; L493-T495 HydrophobicContact CD2-CG2 3.82Å; L493-T495 HydrophobicContact CG-CG2 3.78Å; L493-W505 HydrophobicContact CB-CB 4.19Å; L493-W505 PolarHBondContact N-O 2.57Å; L493-W505 VanDerWaalsContact N-O 3.11Å; L493-W505 PolarHBondContact O-N 3.37Å
494	A	98.3	Very high	94.6	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	137	168.4	0	0	0	0	0	109.3	L199 F201 L208 E485 V502 K503 I504	L199-A494 HydrophobicContact CD1-CB 4.07Å; F201-A494 HydrophobicContact CE2-CB 3.9Å; F201-A494 HydrophobicContact CZ-CB 3.94Å; L208-A494 HydrophobicContact CD1-CB 4.3Å; L208-A494 HydrophobicContact CD2-CB 3.73Å; E485-A494 PolarHBondContact N-O 3.36Å; E485-A494 PolarHBondContact O-N 3.07Å; A494-V502 HydrophobicContact CB-CG1 4.44Å; A494-K503 WeakPolarHBondContact CA-O 3.43Å; A494-I504 HydrophobicContact CB-CD1 3.84Å
495	T	97.6	Very high	94.8	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.006	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	149.6	179.6	69.1	0	0	0	0	112.4	L199 I459 C483 L484 L493 K503 W505	L199-T495 VanDerWaalsContact CD1-C 3.43Å; I459-T495 HydrophobicContact CD1-CG2 3.7Å; I459-T495 HydrophobicContact CG1-CG2 4.24Å; C483-T495 VanDerWaalsContact O-CA 3.26Å; C483-T495 WeakPolarHBondContact O-CA 3.2Å; L484-T495 HydrophobicContact CD2-CG2 3.39Å; L493-T495 HydrophobicContact CD1-CG2 4.45Å; L493-T495 HydrophobicContact CD2-CG2 3.82Å; L493-T495 HydrophobicContact CG-CG2 3.78Å; T495-K503 PolarHBondContact N-O 3.44Å; T495-K503 PolarHBondContact O-N 2.67Å; T495-W505 PolarHBondContact OG1-NE1 3.18Å
496	S	95.1	Very high	94.7	Very high	2 Å²	2	23.5 Å²	23.5	1%	0.014	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	166.9	169.9	63.1	0	0	0	0	111.4	V196 N482 C483	V196-S496 WeakPolarHBondContact O-CB 3.5Å; V196-S496 PolarHBondContact O-OG 2.98Å; N482-S496 PolarHBondContact N-O 3.25Å; C483-S496 WeakPolarHBondContact CB-OG 3.27Å; C483-S496 PolarHBondContact N-O 3.3Å; C483-S496 PolarHBondContact O-N 2.83Å
497	G	88.9	Confident	94.7	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	-135.8	-171.4	0	0	0	0	0	112	D476 V480	D476-G497 VanDerWaalsContact OD2-CA 3.22Å; D476-G497 WeakPolarHBondContact OD2-CA 3.37Å; D476-G497 PolarHBondContact OD2-N 3.33Å; V480-G497 CarbonylContact O-C 3.52Å; V480-G497 WeakPolarHBondContact O-CA 3.29Å
498	L	86.8	Confident	94.6	Very high	19 Å²	19	26.1 Å²	26.1	10%	0.099	14%	0.142	C	C	.	.	S	Bend	trans	-82.7	-14.9	170.7	-66.3	-178.9	0	0	0	112.5	C195 D476 V480 R555	C195-L498 HydrophobicContact CB-CD2 4.39Å; C195-L498 PolarHBondContact SG-O 3.1Å; C195-L498 VanDerWaalsContact SG-O 3.41Å; D476-L498 PolarHBondContact OD2-N 3.4Å; V480-L498 HydrophobicContact CB-CB 4.38Å; V480-L498 HydrophobicContact CB-CD1 3.63Å; V480-L498 HydrophobicContact CB-CG 3.72Å; V480-L498 HydrophobicContact CG1-CD1 3.86Å; V480-L498 HydrophobicContact CG1-CG 3.76Å; V480-L498 HydrophobicContact CG2-CD1 3.66Å; V480-L498 HydrophobicContact CG2-CG 4.33Å; V480-L498 PolarHBondContact O-N 2.79Å; V480-L498 VanDerWaalsContact O-N 3.12Å; L498-R555 PolarHBondContact O-NH1 3.05Å; L498-R555 PolarHBondContact O-NH2 3.03Å
499	D	87.3	Confident	94.7	Very high	23 Å²	23	24.1 Å²	24.1	12%	0.123	13%	0.131	C	C	.	.	S	Bend	trans	-62.2	167.5	166.7	-70.1	-31.3	0	0	0	111.7	V196 D476 K477 G478 D501 K503	V196-D499 PolarHBondContact N-O 2.93Å; D476-D499 VanDerWaalsContact CG-CG 3.48Å; D476-D499 VanDerWaalsContact CG-OD2 3.29Å; D476-D499 VanDerWaalsContact OD1-CG 3.28Å; D476-D499 PolarHBondContact OD1-N 3.04Å; D476-D499 VanDerWaalsContact OD2-CB 3.23Å; D476-D499 WeakPolarHBondContact OD2-CB 3.33Å; D476-D499 PolarHBondContact OD2-N 2.94Å; K477-D499 PolarHBondContact N-OD2 2.9Å; G478-D499 PolarHBondContact N-OD1 3.38Å; D499-D501 WeakPolarHBondContact CB-OD1 3.42Å; D499-K503 IonicContact OD2-NZ 3.65Å; D499-K503 PolarHBondContact OD2-NZ 3.29Å
500	H	90.4	Very high	94.7	Very high	86 Å²	86	28.2 Å²	28.2	40%	0.398	15%	0.15	S	C	.	.	S	Bend	trans	-102.7	3.9	-176.5	59.3	-77.6	0	0	0	113	G194	G194-H500 WeakPolarHBondContact O-CA 3.17Å; G194-H500 WeakPolarHBondContact O-CB 3.31Å
501	D	93.3	Very high	94.6	Very high	21 Å²	21	28 Å²	28	11%	0.112	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	158.7	176.9	71.1	-42	0	0	0	111.7	L189 E190 D499 K503	L189-D501 VanDerWaalsContact O-CA 3.32Å; L189-D501 WeakPolarHBondContact O-CA 3.36Å; E190-D501 HydrophobicContact CG-CB 4.15Å; D499-D501 WeakPolarHBondContact CB-OD1 3.42Å; D501-K503 IonicContact OD1-NZ 2.79Å; D501-K503 PolarHBondContact OD1-NZ 3.43Å; D501-K503 VanDerWaalsContact OD2-CE 3.32Å; D501-K503 WeakPolarHBondContact OD2-CE 3.31Å; D501-K503 WeakPolarHBondContact OD2-CG 3.39Å; D501-K503 IonicContact OD2-NZ 2.76Å; D501-K503 PolarHBondContact OD2-NZ 2.98Å
502	V	96.9	Very high	94.4	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.006	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	124.6	169.9	-179	0	0	0	0	109.3	G188 L189 V196 L199 L208 A494 I504	G188-V502 CarbonylContact C-O 3.49Å; G188-V502 VanDerWaalsContact CA-O 3.31Å; G188-V502 WeakPolarHBondContact CA-O 3.34Å; L189-V502 HydrophobicContact CB-CB 4.16Å; L189-V502 HydrophobicContact CD1-CB 4.3Å; L189-V502 HydrophobicContact CD1-CG1 4.4Å; L189-V502 PolarHBondContact N-O 3.34Å; L189-V502 PolarHBondContact O-N 2.83Å; V196-V502 HydrophobicContact CG1-CG2 4.01Å; L199-V502 HydrophobicContact CD1-CG1 4.01Å; L199-V502 HydrophobicContact CD2-CB 4.18Å; L199-V502 HydrophobicContact CD2-CG1 3.43Å; L199-V502 VanDerWaalsContact CD2-CG1 3.43Å; L199-V502 HydrophobicContact CD2-CG2 3.65Å; L199-V502 HydrophobicContact CG-CG1 4.4Å; L208-V502 HydrophobicContact CD2-CG1 3.81Å; A494-V502 HydrophobicContact CB-CG1 4.44Å; V502-I504 HydrophobicContact CG1-CD1 4.41Å
503	K	97.3	Very high	94.2	Very high	14 Å²	14	30.8 Å²	30.8	6%	0.061	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	128.4	-172.9	-66.5	173	179.7	80.6	0	111.1	L185 G475 D476 A494 T495 D499 D501 W505	L185-K503 HydrophobicContact CD1-CB 3.77Å; L185-K503 HydrophobicContact CD1-CG 4.21Å; G475-K503 WeakPolarHBondContact O-CD 3.35Å; G475-K503 WeakPolarHBondContact O-CE 3.45Å; D476-K503 IonicContact OD2-NZ 3.83Å; A494-K503 WeakPolarHBondContact CA-O 3.43Å; T495-K503 PolarHBondContact N-O 3.44Å; T495-K503 PolarHBondContact O-N 2.67Å; D499-K503 IonicContact OD2-NZ 3.65Å; D499-K503 PolarHBondContact OD2-NZ 3.29Å; D501-K503 IonicContact OD1-NZ 2.79Å; D501-K503 PolarHBondContact OD1-NZ 3.43Å; D501-K503 VanDerWaalsContact OD2-CE 3.32Å; D501-K503 WeakPolarHBondContact OD2-CE 3.31Å; D501-K503 WeakPolarHBondContact OD2-CG 3.39Å; D501-K503 IonicContact OD2-NZ 2.76Å; D501-K503 PolarHBondContact OD2-NZ 2.98Å; K503-W505 HydrophobicContact CB-CZ2 4.4Å
504	I	98.1	Very high	93.7	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	124.5	-177.3	-56.5	-58.9	0	0	0	110.3	Q186 H187 L189 L208 W222 V492 A494 V502	Q186-I504 PolarHBondContact N-O 3.09Å; H187-I504 PolarHBondContact O-N 2.83Å; L189-I504 HydrophobicContact CD1-CD1 4.13Å; L189-I504 HydrophobicContact CD1-CG1 4.13Å; L189-I504 HydrophobicContact CG-CG1 4.22Å; L208-I504 HydrophobicContact CD2-CD1 3.87Å; W222-I504 HydrophobicContact CB-CD1 4.38Å; W222-I504 HydrophobicContact CE3-CG2 4.03Å; W222-I504 HydrophobicContact CZ3-CG2 4.3Å; V492-I504 HydrophobicContact CG1-CG2 3.92Å; A494-I504 HydrophobicContact CB-CD1 3.84Å; V502-I504 HydrophobicContact CG1-CD1 4.41Å
505	W	98.1	Very high	93.3	Very high	10 Å²	10	40.4 Å²	40.4	4%	0.038	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	135.5	-176	-55.1	82.7	0	0	0	110.6	F183 R184 L185 I459 M473 E474 V492 L493 T495 K503	F183-W505 HydrophobicContact CD1-CB 4.13Å; F183-W505 HydrophobicContact CE1-CB 4.46Å; R184-W505 WeakPolarHBondContact O-CA 3.29Å; L185-W505 HydrophobicContact CB-CE3 4.07Å; L185-W505 HydrophobicContact CB-CH2 3.79Å; L185-W505 HydrophobicContact CB-CZ2 4.34Å; L185-W505 HydrophobicContact CB-CZ3 3.68Å; L185-W505 HydrophobicContact CD1-CD2 4.47Å; L185-W505 HydrophobicContact CD1-CH2 4.29Å; L185-W505 HydrophobicContact CD1-CZ2 3.99Å; L185-W505 HydrophobicContact CG-CH2 4.48Å; L185-W505 VanDerWaalsContact N-CE3 3.26Å; I459-W505 HydrophobicContact CD1-CD2 4.29Å; I459-W505 HydrophobicContact CD1-CH2 4.31Å; I459-W505 HydrophobicContact CD1-CZ2 3.65Å; M473-W505 HydrophobicContact CB-CE3 4.4Å; M473-W505 HydrophobicContact CB-CH2 4.22Å; M473-W505 HydrophobicContact CB-CZ3 3.84Å; M473-W505 HydrophobicContact CE-CD2 4.24Å; M473-W505 HydrophobicContact CE-CE3 4.03Å; M473-W505 HydrophobicContact CG-CE3 4.48Å; M473-W505 HydrophobicContact CG-CZ3 4.27Å; M473-W505 HydrophobicContact SD-CD2 4.28Å; M473-W505 HydrophobicContact SD-CE3 3.5Å; M473-W505 VanDerWaalsContact SD-CE3 3.5Å; M473-W505 HydrophobicContact SD-CZ3 3.87Å; E474-W505 VanDerWaalsContact O-CH2 3.23Å; E474-W505 WeakPolarHBondContact O-CH2 3.46Å; V492-W505 VanDerWaalsContact CA-O 3.32Å; V492-W505 WeakPolarHBondContact CA-O 3.29Å; L493-W505 HydrophobicContact CB-CB 4.19Å; L493-W505 PolarHBondContact N-O 2.57Å; L493-W505 VanDerWaalsContact N-O 3.11Å; L493-W505 PolarHBondContact O-N 3.37Å; T495-W505 PolarHBondContact OG1-NE1 3.18Å; K503-W505 HydrophobicContact CB-CZ2 4.4Å
506	A	97.1	Very high	92.9	Very high	14 Å²	14	45.5 Å²	45.5	12%	0.116	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	156.9	178.6	0	0	0	0	0	111.1	F183 R184 Q186 V492 T508	F183-A506 WeakPolarHBondContact CA-O 3.48Å; R184-A506 PolarHBondContact N-O 3.11Å; R184-A506 PolarHBondContact O-N 2.87Å; Q186-A506 HydrophobicContact CG-CB 3.46Å; Q186-A506 VanDerWaalsContact CG-CB 3.46Å; Q186-A506 PolarHBondContact NE2-O 3.05Å; V492-A506 HydrophobicContact CG2-CB 4.42Å; A506-T508 HydrophobicContact CB-CG2 4.15Å; A506-T508 PolarHBondContact O-N 3.48Å
507	P	95.9	Very high	92.7	Very high	20 Å²	20	47.2 Å²	47.2	13%	0.13	27%	0.273	C	S	.	.	S	Bend	trans	-78.2	51.4	-171	35.1	-43.7	0	0	0	113.1	F179 R182 P491	F179-P507 HydrophobicContact CB-CB 4.06Å; F179-P507 HydrophobicContact CD1-CB 3.96Å; F179-P507 HydrophobicContact CD1-CG 3.63Å; F179-P507 HydrophobicContact CE1-CG 4.21Å; F179-P507 HydrophobicContact CG-CB 4.29Å; F179-P507 HydrophobicContact CG-CG 4.44Å; F179-P507 VanDerWaalsContact O-CB 3.29Å; F179-P507 WeakPolarHBondContact O-CB 3.43Å; R182-P507 HydrophobicContact CB-CB 4.37Å; R182-P507 CarbonylContact O-C 3.58Å; R182-P507 VanDerWaalsContact O-C 3.26Å; R182-P507 VanDerWaalsContact O-CA 3.29Å; R182-P507 WeakPolarHBondContact O-CA 3.49Å; P491-P507 HydrophobicContact CB-CG 4.13Å; P491-P507 HydrophobicContact CG-CG 4.02Å; P491-P507 WeakPolarHBondContact O-CD 3.47Å
508	T	96	Very high	92.8	Very high	71 Å²	71	47.2 Å²	47.2	44%	0.436	27%	0.273	S	S	.	.			trans	-103.1	0	-171.5	70.1	0	0	0	0	114.8	R182 Q186 A506	R182-T508 PolarHBondContact O-N 3.13Å; Q186-T508 VanDerWaalsContact CD-OG1 3.27Å; Q186-T508 PolarHBondContact NE2-OG1 3.29Å; Q186-T508 VanDerWaalsContact OE1-CG2 3.29Å; Q186-T508 PolarHBondContact OE1-OG1 2.83Å; A506-T508 HydrophobicContact CB-CG2 4.15Å; A506-T508 PolarHBondContact O-N 3.48Å
509	A	95.4	Very high	92.9	Very high	21 Å²	21	51 Å²	51	17%	0.174	29%	0.288	C	S	.	.			trans	-59.2	142.4	170	0	0	0	0	0	110.7	R182 R184	R182-A509 HydrophobicContact CB-CB 4.3Å; R182-A509 PolarHBondContact NE-O 3.29Å; R182-A509 PolarHBondContact NH2-O 3.45Å; R182-A509 VanDerWaalsContact O-CB 3.27Å; R182-A509 WeakPolarHBondContact O-CB 3.37Å; R182-A509 PolarHBondContact O-N 2.97Å; R184-A509 HydrophobicContact CB-CB 4.37Å
510	E	92.4	Very high	93.1	Very high	186 Å²	186	55.2 Å²	55.2	87%	0.869	31%	0.311	S	S	*	.	S	Bend	trans	-67.3	-48.4	-177.9	-65.3	-179.5	178.6	0	0	111.4
511	A	92	Very high	93.1	Very high	68 Å²	68	52.3 Å²	52.3	56%	0.562	30%	0.299	S	S	*	.	S	Bend	trans	-100.9	163	174.3	0	0	0	0	0	112.1
512	S	91.1	Very high	93.1	Very high	49 Å²	49	51.4 Å²	51.4	34%	0.343	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-66.6	150	164.5	-68.6	0	0	0	0	110.8	Q181	Q181-S512 CarbonylContact O-C 3.53Å; Q181-S512 WeakPolarHBondContact O-CA 3.28Å
513	T	91.4	Very high	92.7	Very high	40 Å²	40	53.4 Å²	53.4	25%	0.245	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-54.9	138.5	173.6	-171.6	0	0	0	0	112.6	Q181 I470 Q471 L515	Q181-T513 HydrophobicContact CB-CG2 4.24Å; Q181-T513 HydrophobicContact CG-CG2 4.42Å; Q181-T513 WeakPolarHBondContact O-CB 3.25Å; Q181-T513 PolarHBondContact O-N 2.69Å; I470-T513 VanDerWaalsContact O-CG2 3.27Å; I470-T513 WeakPolarHBondContact O-CG2 3.45Å; Q471-T513 PolarHBondContact OE1-OG1 3.23Å; Q471-T513 VanDerWaalsContact OE1-OG1 3.04Å; T513-L515 HydrophobicContact CG2-CD2 3.75Å; T513-L515 HydrophobicContact CG2-CG 4.24Å; T513-L515 PolarHBondContact OG1-N 3.25Å
514	E	88.1	Confident	92.4	Very high	168 Å²	168	57.1 Å²	57.1	79%	0.785	32%	0.319	S	S	*	.			trans	-95.5	1	172.3	-64	-176.6	168.9	0	0	112.1	T516	E514-T516 HydrophobicContact CB-CG2 4.12Å; E514-T516 PolarHBondContact O-N 3.12Å
515	L	90.6	Very high	92.1	Very high	33 Å²	33	57.2 Å²	57.2	17%	0.173	32%	0.32	C	S	.	.			trans	54.6	33.8	-177.1	-54.3	176.1	0	0	0	113.4	T144 I469 F472 T513 G517 L518	T144-L515 HydrophobicContact CG2-CD1 4.46Å; I469-L515 WeakPolarHBondContact O-CD1 3.22Å; F472-L515 HydrophobicContact CB-CD2 4.31Å; T513-L515 HydrophobicContact CG2-CD2 3.75Å; T513-L515 HydrophobicContact CG2-CG 4.24Å; T513-L515 PolarHBondContact OG1-N 3.25Å; L515-G517 PolarHBondContact O-N 3.25Å; L515-L518 HydrophobicContact CB-CB 4.13Å; L515-L518 HydrophobicContact CB-CD2 3.91Å; L515-L518 HydrophobicContact CD1-CD2 3.95Å; L515-L518 HydrophobicContact CD2-CD2 4.33Å; L515-L518 HydrophobicContact CG-CD2 4.29Å; L515-L518 WeakPolarHBondContact O-CB 3.31Å; L515-L518 PolarHBondContact O-N 2.95Å; L515-L518 VanDerWaalsContact O-N 3.15Å
516	T	89.7	Confident	91.6	Very high	109 Å²	109	59.3 Å²	59.3	67%	0.669	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	134.5	177	47.9	0	0	0	0	111.6	E514 L518	E514-T516 HydrophobicContact CB-CG2 4.12Å; E514-T516 PolarHBondContact O-N 3.12Å; T516-L518 PolarHBondContact O-N 2.93Å
517	G	89.8	Confident	91.2	Very high	37 Å²	37	64.5 Å²	64.5	38%	0.381	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.1	-8.9	-177.9	0	0	0	0	0	115.5	L515 K519 D520 V521	L515-G517 PolarHBondContact O-N 3.25Å; G517-K519 VanDerWaalsContact C-N 3.28Å; G517-K519 PolarHBondContact O-N 3.34Å; G517-D520 PolarHBondContact O-N 2.87Å; G517-V521 PolarHBondContact O-N 3.43Å; G517-V521 VanDerWaalsContact O-N 3.09Å
518	L	91.3	Very high	90.8	Very high	1 Å²	1	66.2 Å²	66.2	1%	0.005	35%	0.352	C	S	.	.	H	α-helix	trans	-57.5	-41.7	-179.6	177.8	63.1	0	0	0	112.1	T144 F460 I469 F472 L515 T516 D520 V521 I522	T144-L518 HydrophobicContact CG2-CD2 3.97Å; F460-L518 HydrophobicContact CE1-CD1 4Å; I469-L518 HydrophobicContact CB-CD2 4.07Å; I469-L518 HydrophobicContact CD1-CD1 4.19Å; I469-L518 HydrophobicContact CD1-CD2 4.23Å; I469-L518 HydrophobicContact CG2-CD1 4.28Å; I469-L518 HydrophobicContact CG2-CD2 3.67Å; F472-L518 HydrophobicContact CB-CD1 3.91Å; F472-L518 HydrophobicContact CD1-CB 4.42Å; F472-L518 HydrophobicContact CD1-CD1 4.04Å; F472-L518 HydrophobicContact CD2-CD1 3.67Å; F472-L518 HydrophobicContact CE1-CD1 4.46Å; F472-L518 HydrophobicContact CE2-CD1 4.11Å; F472-L518 HydrophobicContact CG-CD1 3.61Å; F472-L518 HydrophobicContact CZ-CD1 4.47Å; L515-L518 HydrophobicContact CB-CB 4.13Å; L515-L518 HydrophobicContact CB-CD2 3.91Å; L515-L518 HydrophobicContact CD1-CD2 3.95Å; L515-L518 HydrophobicContact CD2-CD2 4.33Å; L515-L518 HydrophobicContact CG-CD2 4.29Å; L515-L518 WeakPolarHBondContact O-CB 3.31Å; L515-L518 PolarHBondContact O-N 2.95Å; L515-L518 VanDerWaalsContact O-N 3.15Å; T516-L518 PolarHBondContact O-N 2.93Å; L518-D520 VanDerWaalsContact C-N 3.33Å; L518-D520 PolarHBondContact O-N 3.19Å; L518-V521 PolarHBondContact O-N 2.62Å; L518-I522 HydrophobicContact CD1-CD1 3.72Å; L518-I522 HydrophobicContact CD1-CG1 4.01Å; L518-I522 HydrophobicContact CD2-CD1 4.33Å; L518-I522 HydrophobicContact CG-CD1 3.73Å; L518-I522 HydrophobicContact CG-CG1 4.36Å; L518-I522 WeakPolarHBondContact O-CB 3.25Å; L518-I522 VanDerWaalsContact O-CG1 3.31Å; L518-I522 WeakPolarHBondContact O-CG1 3.42Å; L518-I522 PolarHBondContact O-N 3.1Å
519	K	88.8	Confident	90.3	Very high	97 Å²	97	64.4 Å²	64.4	42%	0.422	34%	0.337	S	S	.	.	H	α-helix	trans	-59.1	-46	179.7	-59.3	-152.2	174.3	-167	0	111	V140 S141 G517 I522 K523	V140-K519 HydrophobicContact CG1-CB 3.99Å; V140-K519 HydrophobicContact CG1-CD 3.66Å; V140-K519 HydrophobicContact CG1-CG 3.52Å; S141-K519 PolarHBondContact OG-NZ 2.94Å; G517-K519 VanDerWaalsContact C-N 3.28Å; G517-K519 PolarHBondContact O-N 3.34Å; K519-I522 PolarHBondContact O-N 2.82Å; K519-K523 WeakPolarHBondContact O-CB 3.17Å; K519-K523 WeakPolarHBondContact O-CG 3.33Å; K519-K523 PolarHBondContact O-N 3.22Å
520	D	90.5	Very high	89.8	Confident	112 Å²	112	66.7 Å²	66.7	60%	0.599	35%	0.347	S	S	*	.	H	α-helix	trans	-69	-40.1	-176.8	-51.8	-50.8	0	0	0	111.6	G517 L518 K523 K524	G517-D520 PolarHBondContact O-N 2.87Å; L518-D520 VanDerWaalsContact C-N 3.33Å; L518-D520 PolarHBondContact O-N 3.19Å; D520-K523 PolarHBondContact O-N 2.73Å; D520-K524 VanDerWaalsContact O-CB 3.29Å; D520-K524 WeakPolarHBondContact O-CB 3.49Å; D520-K524 PolarHBondContact O-N 3.43Å
521	V	92.4	Very high	89.4	Confident	25 Å²	25	62.3 Å²	62.3	15%	0.152	33%	0.326	C	S	.	.	H	α-helix	trans	-67.1	-39.3	175	177.8	0	0	0	0	111.6	C456 F472 G517 L518 K524 N525	C456-V521 HydrophobicContact CB-CG1 4.31Å; F472-V521 HydrophobicContact CE1-CG2 4.29Å; F472-V521 HydrophobicContact CE2-CG1 4.12Å; F472-V521 HydrophobicContact CZ-CB 3.81Å; F472-V521 HydrophobicContact CZ-CG1 3.73Å; F472-V521 HydrophobicContact CZ-CG2 3.86Å; G517-V521 PolarHBondContact O-N 3.43Å; G517-V521 VanDerWaalsContact O-N 3.09Å; L518-V521 PolarHBondContact O-N 2.62Å; V521-K524 PolarHBondContact O-N 3.1Å; V521-N525 WeakPolarHBondContact O-CB 3.26Å; V521-N525 PolarHBondContact O-N 2.73Å; V521-N525 PolarHBondContact O-OD1 2.79Å
522	I	91.5	Very high	88.7	Confident	2 Å²	2	61.7 Å²	61.7	1%	0.01	31%	0.313	C	S	.	.	H	α-helix	trans	-66.2	-44.8	174.4	-70.3	173.2	0	0	0	111.2	L136 W139 V140 F460 I469 L518 K519 K524 N525 K526	L136-I522 HydrophobicContact CD1-CG2 4.44Å; W139-I522 HydrophobicContact CE3-CG2 4.35Å; W139-I522 HydrophobicContact CH2-CG2 3.31Å; W139-I522 HydrophobicContact CZ2-CG2 4.43Å; W139-I522 HydrophobicContact CZ3-CG2 3.27Å; V140-I522 HydrophobicContact CG2-CB 4.29Å; V140-I522 HydrophobicContact CG2-CG2 3.65Å; F460-I522 HydrophobicContact CE1-CG1 4.39Å; I469-I522 HydrophobicContact CD1-CD1 3.6Å; L518-I522 HydrophobicContact CD1-CD1 3.72Å; L518-I522 HydrophobicContact CD1-CG1 4.01Å; L518-I522 HydrophobicContact CD2-CD1 4.33Å; L518-I522 HydrophobicContact CG-CD1 3.73Å; L518-I522 HydrophobicContact CG-CG1 4.36Å; L518-I522 WeakPolarHBondContact O-CB 3.25Å; L518-I522 VanDerWaalsContact O-CG1 3.31Å; L518-I522 WeakPolarHBondContact O-CG1 3.42Å; L518-I522 PolarHBondContact O-N 3.1Å; K519-I522 PolarHBondContact O-N 2.82Å; I522-K524 VanDerWaalsContact C-N 3.3Å; I522-K524 PolarHBondContact O-N 2.68Å; I522-N525 PolarHBondContact O-N 3.05Å; I522-K526 PolarHBondContact O-N 2.89Å
523	K	89.4	Confident	87.9	Confident	44 Å²	44	62.4 Å²	62.4	19%	0.191	32%	0.318	C	S	.	.	H	α-helix	trans	-57.9	-43.9	175.2	-75.2	-162.6	172	-171	0	111	E133 L136 E137 K519 D520 R527	E133-K523 IonicContact OE1-NZ 2.7Å; E133-K523 PolarHBondContact OE1-NZ 3.29Å; L136-K523 HydrophobicContact CD2-CB 4.2Å; L136-K523 HydrophobicContact CD2-CD 4.34Å; L136-K523 HydrophobicContact CD2-CG 3.73Å; L136-K523 HydrophobicContact CG-CG 4.02Å; E137-K523 IonicContact OE1-NZ 3.69Å; E137-K523 PolarHBondContact OE1-NZ 2.73Å; K519-K523 WeakPolarHBondContact O-CB 3.17Å; K519-K523 WeakPolarHBondContact O-CG 3.33Å; K519-K523 PolarHBondContact O-N 3.22Å; D520-K523 PolarHBondContact O-N 2.73Å; K523-R527 PolarHBondContact O-N 3.36Å; K523-R527 VanDerWaalsContact O-N 3.11Å
524	K	90.8	Very high	86.7	Confident	92 Å²	92	67.3 Å²	67.3	40%	0.4	34%	0.342	S	S	.	.	H	α-helix	trans	-59.9	-52.6	174.2	179.4	-177.5	173.9	-175	0	111.8	D520 V521 I522 K526 R527 E528	D520-K524 VanDerWaalsContact O-CB 3.29Å; D520-K524 WeakPolarHBondContact O-CB 3.49Å; D520-K524 PolarHBondContact O-N 3.43Å; V521-K524 PolarHBondContact O-N 3.1Å; I522-K524 VanDerWaalsContact C-N 3.3Å; I522-K524 PolarHBondContact O-N 2.68Å; K524-K526 VanDerWaalsContact C-N 3.32Å; K524-K526 PolarHBondContact O-N 3.13Å; K524-R527 PolarHBondContact O-N 3.29Å; K524-E528 VanDerWaalsContact CE-CD 3.47Å; K524-E528 WeakPolarHBondContact CE-OE1 3.46Å; K524-E528 HydrophobicContact CG-CG 4.42Å; K524-E528 WeakPolarHBondContact CG-OE1 3.2Å; K524-E528 IonicContact NZ-OE1 3.92Å; K524-E528 WeakPolarHBondContact O-CG 3.47Å; K524-E528 PolarHBondContact O-N 3.01Å
525	N	91.3	Very high	85.3	Confident	3 Å²	3	65.5 Å²	65.5	2%	0.016	33%	0.333	C	S	.	.	H	α-helix	trans	-61.9	-34.8	-178.3	-72.2	-2.4	0	0	0	113.1	G430 C456 V521 I522 R529	G430-N525 PolarHBondContact O-ND2 3.49Å; C456-N525 VanDerWaalsContact CB-OD1 3.27Å; C456-N525 WeakPolarHBondContact CB-OD1 3.13Å; C456-N525 PolarHBondContact SG-ND2 3.44Å; C456-N525 VanDerWaalsContact SG-ND2 3.44Å; V521-N525 WeakPolarHBondContact O-CB 3.26Å; V521-N525 PolarHBondContact O-N 2.73Å; V521-N525 PolarHBondContact O-OD1 2.79Å; I522-N525 PolarHBondContact O-N 3.05Å; N525-R529 WeakPolarHBondContact O-CB 3.47Å; N525-R529 PolarHBondContact O-N 2.71Å
526	K	88.9	Confident	83.6	Confident	53 Å²	53	69 Å²	69	23%	0.23	35%	0.349	C	S	.	.	H	α-helix	trans	-65.8	-54.1	172.5	-175.1	-168.5	166.7	-165.4	0	109.8	D132 L136 I522 K524 E528 R529 D530	D132-K526 IonicContact OD1-NZ 2.8Å; D132-K526 PolarHBondContact OD1-NZ 3.07Å; L136-K526 HydrophobicContact CD1-CB 4.38Å; L136-K526 HydrophobicContact CD1-CD 3.85Å; L136-K526 HydrophobicContact CD2-CD 4.04Å; L136-K526 HydrophobicContact CG-CD 4.36Å; I522-K526 PolarHBondContact O-N 2.89Å; K524-K526 VanDerWaalsContact C-N 3.32Å; K524-K526 PolarHBondContact O-N 3.13Å; K526-E528 VanDerWaalsContact C-N 3.32Å; K526-E528 PolarHBondContact O-N 2.86Å; K526-R529 WeakPolarHBondContact O-CA 3.3Å; K526-R529 WeakPolarHBondContact O-CB 3.4Å; K526-R529 PolarHBondContact O-N 3.22Å; K526-D530 VanDerWaalsContact CE-OD2 3.22Å; K526-D530 WeakPolarHBondContact CE-OD2 3.36Å; K526-D530 WeakPolarHBondContact CG-OD2 3.46Å; K526-D530 VanDerWaalsContact O-CG 3.29Å; K526-D530 PolarHBondContact O-N 2.89Å
527	R	87.8	Confident	81.9	Confident	123 Å²	123	67.7 Å²	67.7	46%	0.464	34%	0.342	S	S	.	.	H	α-helix	trans	-56.6	-44.7	-178.3	-172.6	-172.8	64.3	-107.4	-7.6	112.3	K523 K524 R529 D530 E531	K523-R527 PolarHBondContact O-N 3.36Å; K523-R527 VanDerWaalsContact O-N 3.11Å; K524-R527 PolarHBondContact O-N 3.29Å; R527-R529 VanDerWaalsContact C-N 3.31Å; R527-R529 PolarHBondContact O-N 2.94Å; R527-D530 PolarHBondContact O-N 3.36Å; R527-E531 WeakPolarHBondContact CD-OE1 3.49Å; R527-E531 HydrophobicContact CG-CG 4.39Å; R527-E531 VanDerWaalsContact CG-OE1 3.31Å; R527-E531 WeakPolarHBondContact CG-OE1 3.46Å; R527-E531 IonicContact NE-OE1 3.91Å; R527-E531 WeakPolarHBondContact O-CB 3.3Å; R527-E531 VanDerWaalsContact O-CG 3.3Å; R527-E531 WeakPolarHBondContact O-CG 3.44Å; R527-E531 PolarHBondContact O-N 3.25Å
528	E	86.8	Confident	80	Confident	57 Å²	57	72.1 Å²	72.1	27%	0.266	36%	0.357	S	S	.	.	H	α-helix	trans	-64.5	-33.5	177.1	-71.2	172.9	170.4	0	0	112.2	K524 K526 D532	K524-E528 VanDerWaalsContact CE-CD 3.47Å; K524-E528 WeakPolarHBondContact CE-OE1 3.46Å; K524-E528 HydrophobicContact CG-CG 4.42Å; K524-E528 WeakPolarHBondContact CG-OE1 3.2Å; K524-E528 IonicContact NZ-OE1 3.92Å; K524-E528 WeakPolarHBondContact O-CG 3.47Å; K524-E528 PolarHBondContact O-N 3.01Å; K526-E528 VanDerWaalsContact C-N 3.32Å; K526-E528 PolarHBondContact O-N 2.86Å; E528-D532 WeakPolarHBondContact O-CB 3.22Å; E528-D532 PolarHBondContact O-N 3.11Å
529	R	86.7	Confident	78.2	Confident	33 Å²	33	74.8 Å²	74.8	13%	0.125	37%	0.371	C	S	.	.	H	α-helix	trans	-66.5	-46.1	172.3	-173	-175.2	-58.6	-165.4	4	112.1	D408 D410 H431 N525 K526 R527 E531 D532 S533	D408-R529 VanDerWaalsContact O-CD 3.3Å; D408-R529 WeakPolarHBondContact O-CD 3.2Å; D408-R529 PolarHBondContact O-NE 2.83Å; D410-R529 IonicContact OD1-CZ 2.76Å; D410-R529 IonicContact OD1-NH1 3.94Å; D410-R529 PolarHBondContact OD1-NH1 3.1Å; D410-R529 IonicContact OD1-NH2 3.8Å; D410-R529 PolarHBondContact OD1-NH2 2.85Å; D410-R529 IonicContact OD2-NH1 2.72Å; H431-R529 PolarHBondContact O-NH2 3.12Å; H431-R529 VanDerWaalsContact O-NH2 3.1Å; N525-R529 WeakPolarHBondContact O-CB 3.47Å; N525-R529 PolarHBondContact O-N 2.71Å; K526-R529 WeakPolarHBondContact O-CA 3.3Å; K526-R529 WeakPolarHBondContact O-CB 3.4Å; K526-R529 PolarHBondContact O-N 3.22Å; R527-R529 VanDerWaalsContact C-N 3.31Å; R527-R529 PolarHBondContact O-N 2.94Å; R529-E531 VanDerWaalsContact C-N 3.33Å; R529-D532 PolarHBondContact O-N 3.26Å; R529-S533 VanDerWaalsContact O-CB 3.3Å; R529-S533 WeakPolarHBondContact O-CB 3.19Å; R529-S533 PolarHBondContact O-N 3.13Å; R529-S533 PolarHBondContact O-OG 3.46Å
530	D	84.6	Confident	76.6	Confident	69 Å²	69	70.7 Å²	70.7	37%	0.369	35%	0.353	S	S	.	.	H	α-helix	trans	-66.5	-37.7	-179.8	-57.6	-22.5	0	0	0	110.7	K526 R527 L534	K526-D530 VanDerWaalsContact CE-OD2 3.22Å; K526-D530 WeakPolarHBondContact CE-OD2 3.36Å; K526-D530 WeakPolarHBondContact CG-OD2 3.46Å; K526-D530 VanDerWaalsContact O-CG 3.29Å; K526-D530 PolarHBondContact O-N 2.89Å; R527-D530 PolarHBondContact O-N 3.36Å; D530-L534 WeakPolarHBondContact O-CD1 3.35Å; D530-L534 VanDerWaalsContact O-CG 3.31Å; D530-L534 WeakPolarHBondContact O-CG 3.32Å; D530-L534 PolarHBondContact O-N 3.21Å
531	E	83.2	Confident	74.8	Confident	93 Å²	93	68.2 Å²	68.2	44%	0.435	34%	0.34	S	S	.	.	H	α-helix	trans	-65.9	-49	173.6	-75.1	169.7	-175.7	0	0	112.2	R527 R529 S533 L534 H535	R527-E531 WeakPolarHBondContact CD-OE1 3.49Å; R527-E531 HydrophobicContact CG-CG 4.39Å; R527-E531 VanDerWaalsContact CG-OE1 3.31Å; R527-E531 WeakPolarHBondContact CG-OE1 3.46Å; R527-E531 IonicContact NE-OE1 3.91Å; R527-E531 WeakPolarHBondContact O-CB 3.3Å; R527-E531 VanDerWaalsContact O-CG 3.3Å; R527-E531 WeakPolarHBondContact O-CG 3.44Å; R527-E531 PolarHBondContact O-N 3.25Å; R529-E531 VanDerWaalsContact C-N 3.33Å; E531-S533 PolarHBondContact O-N 3.05Å; E531-L534 PolarHBondContact O-N 3.29Å; E531-H535 PolarHBondContact O-ND1 3.35Å
532	D	78.3	Confident	72.6	Confident	56 Å²	56	69.8 Å²	69.8	30%	0.299	35%	0.352	S	S	.	.	H	α-helix	trans	-59.6	-45.1	177.5	-77.5	-28.9	0	0	0	111.6	R432 N434 E528 R529 L534 H535 H536	R432-D532 IonicContact CZ-OD2 3.59Å; R432-D532 IonicContact NE-OD2 3.54Å; R432-D532 IonicContact NH2-OD2 3.61Å; R432-D532 PolarHBondContact NH2-OD2 2.76Å; N434-D532 PolarHBondContact ND2-OD2 2.78Å; E528-D532 WeakPolarHBondContact O-CB 3.22Å; E528-D532 PolarHBondContact O-N 3.11Å; R529-D532 PolarHBondContact O-N 3.26Å; D532-L534 PolarHBondContact O-N 2.91Å; D532-H535 PolarHBondContact O-N 3.08Å; D532-H535 VanDerWaalsContact O-N 3.11Å; D532-H536 PolarHBondContact O-N 2.71Å
533	S	73.8	Confident	70.7	Confident	63 Å²	63	72.5 Å²	72.5	44%	0.441	36%	0.364	S	S	.	.	H	α-helix	trans	-58.9	-32.5	-178.9	-64.3	0	0	0	0	113.2	R529 E531	R529-S533 VanDerWaalsContact O-CB 3.3Å; R529-S533 WeakPolarHBondContact O-CB 3.19Å; R529-S533 PolarHBondContact O-N 3.13Å; R529-S533 PolarHBondContact O-OG 3.46Å; E531-S533 PolarHBondContact O-N 3.05Å
534	L	67.6	Low	69	Low	144 Å²	144	72.1 Å²	72.1	75%	0.754	36%	0.364	S	S	*	.	H	α-helix	trans	-78.4	-22.9	179.8	-73.1	169.5	0	0	0	113.6	D530 E531 D532	D530-L534 WeakPolarHBondContact O-CD1 3.35Å; D530-L534 VanDerWaalsContact O-CG 3.31Å; D530-L534 WeakPolarHBondContact O-CG 3.32Å; D530-L534 PolarHBondContact O-N 3.21Å; E531-L534 PolarHBondContact O-N 3.29Å; D532-L534 PolarHBondContact O-N 2.91Å
535	H	58.3	Low	67	Low	130 Å²	130	71.5 Å²	71.5	60%	0.602	37%	0.365	S	S	*	.	H	α-helix	trans	-107	-36.8	-172	-65.2	85.8	0	0	0	113.3	E531 D532	E531-H535 PolarHBondContact O-ND1 3.35Å; D532-H535 PolarHBondContact O-N 3.08Å; D532-H535 VanDerWaalsContact O-N 3.11Å
536	H	55.3	Low	64.8	Low	106 Å²	106	78.1 Å²	78.1	49%	0.491	39%	0.389	S	S	.	.			trans	-146.2	75.1	-162.4	-66.7	-45	0	0	0	115.3	D532 D538 L539	D532-H536 PolarHBondContact O-N 2.71Å; H536-D538 VanDerWaalsContact C-N 3.34Å; H536-D538 PolarHBondContact O-N 2.91Å; H536-L539 HydrophobicContact CB-CD1 3.6Å; H536-L539 HydrophobicContact CB-CG 4.02Å
537	P	52.4	Low	63.1	Low	81 Å²	81	79.5 Å²	79.5	53%	0.526	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-10.9	-171.2	25.9	-35.3	0	0	0	117.5
538	D	51.1	Low	61.2	Low	130 Å²	130	75.5 Å²	75.5	70%	0.695	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.8	13.2	-165.9	-104.5	-30.4	0	0	0	115.4	H536 F540	H536-D538 VanDerWaalsContact C-N 3.34Å; H536-D538 PolarHBondContact O-N 2.91Å; D538-F540 PolarHBondContact O-N 3.29Å
539	L	53.6	Low	59.1	Low	58 Å²	58	78.2 Å²	78.2	30%	0.304	40%	0.397	S	S	.	.			trans	-85.4	-3.6	-165.1	-65.9	-174.4	0	0	0	117.5	H536 D541 S542 H543	H536-L539 HydrophobicContact CB-CD1 3.6Å; H536-L539 HydrophobicContact CB-CG 4.02Å; L539-D541 PolarHBondContact O-N 3.14Å; L539-D541 VanDerWaalsContact O-N 3.12Å; L539-S542 WeakPolarHBondContact CD2-OG 3.5Å; L539-S542 WeakPolarHBondContact O-CA 3.33Å; L539-S542 PolarHBondContact O-N 2.97Å; L539-S542 PolarHBondContact O-OG 3.04Å; L539-H543 HydrophobicContact CB-CB 4.48Å; L539-H543 VanDerWaalsContact CD1-NE2 3.3Å; L539-H543 WeakPolarHBondContact CD1-NE2 3.4Å; L539-H543 PolarHBondContact O-N 3.3Å
540	F	55.3	Low	57.1	Low	10 Å²	10	80 Å²	80	4%	0.044	41%	0.407	C	S	.	.	H	α-helix	trans	-43.6	-52.8	-168.4	-172.3	-105.9	0	0	0	115.2	Y335 T391 N407 N434 V437 D538 S542 M544	Y335-F540 HydrophobicContact CE2-CE1 4.03Å; T391-F540 HydrophobicContact CG2-CE2 4.38Å; T391-F540 HydrophobicContact CG2-CZ 3.94Å; N407-F540 HydrophobicContact CB-CD2 3.8Å; N407-F540 HydrophobicContact CB-CE2 3.58Å; N407-F540 HydrophobicContact CB-CZ 4.22Å; N407-F540 WeakPolarHBondContact ND2-CD2 3.46Å; N434-F540 VanDerWaalsContact O-CD2 3.27Å; N434-F540 WeakPolarHBondContact O-CD2 3.46Å; V437-F540 HydrophobicContact CG2-CZ 4.11Å; D538-F540 PolarHBondContact O-N 3.29Å; F540-S542 PolarHBondContact O-N 2.69Å; F540-M544 HydrophobicContact CD1-CE 3.91Å; F540-M544 HydrophobicContact CE1-CE 3.3Å; F540-M544 HydrophobicContact CZ-CE 3.67Å; F540-M544 VanDerWaalsContact O-CB 3.26Å; F540-M544 WeakPolarHBondContact O-CB 3.47Å; F540-M544 PolarHBondContact O-N 2.82Å
541	D	52.5	Low	55.5	Low	61 Å²	61	78.9 Å²	78.9	33%	0.326	40%	0.399	S	S	.	.	H	α-helix	trans	-63.3	-41.3	179.1	-69.5	1.3	0	0	0	113	Y335 R352 L539 L545	Y335-D541 PolarHBondContact OH-OD1 3.26Å; R352-D541 IonicContact CZ-OD2 2.71Å; R352-D541 IonicContact NH1-OD2 2.82Å; R352-D541 PolarHBondContact NH1-OD2 3.04Å; R352-D541 IonicContact NH2-OD2 2.66Å; R352-D541 PolarHBondContact NH2-OD2 3.17Å; L539-D541 PolarHBondContact O-N 3.14Å; L539-D541 VanDerWaalsContact O-N 3.12Å; D541-L545 PolarHBondContact O-N 3.29Å
542	S	45.3	Very low	53.8	Low	58 Å²	58	78.8 Å²	78.8	41%	0.406	40%	0.401	S	S	.	.	H	α-helix	trans	-75.5	-38	-176.5	70.1	0	0	0	0	112	L539 F540 W546	L539-S542 WeakPolarHBondContact CD2-OG 3.5Å; L539-S542 WeakPolarHBondContact O-CA 3.33Å; L539-S542 PolarHBondContact O-N 2.97Å; L539-S542 PolarHBondContact O-OG 3.04Å; F540-S542 PolarHBondContact O-N 2.69Å; S542-W546 VanDerWaalsContact O-CB 3.28Å; S542-W546 WeakPolarHBondContact O-CB 3.17Å; S542-W546 PolarHBondContact O-N 3.44Å
543	H	51.5	Low	52.1	Low	58 Å²	58	85.3 Å²	85.3	27%	0.269	42%	0.422	S	S	.	.	H	α-helix	trans	-71.7	-41.9	175.1	-88.9	-151.7	0	0	0	111.2	L539 L545 W546 F547	L539-H543 HydrophobicContact CB-CB 4.48Å; L539-H543 VanDerWaalsContact CD1-NE2 3.3Å; L539-H543 WeakPolarHBondContact CD1-NE2 3.4Å; L539-H543 PolarHBondContact O-N 3.3Å; H543-L545 VanDerWaalsContact C-N 3.27Å; H543-L545 PolarHBondContact O-N 3.34Å; H543-W546 PolarHBondContact O-N 3.35Å; H543-W546 VanDerWaalsContact O-N 3.16Å; H543-F547 HydrophobicContact CB-CD2 4.23Å; H543-F547 WeakPolarHBondContact O-CB 3.44Å; H543-F547 WeakPolarHBondContact O-CD2 3.33Å; H543-F547 PolarHBondContact O-N 2.98Å
544	M	54	Low	50.6	Low	37 Å²	37	87 Å²	87	18%	0.182	42%	0.423	C	S	.	.	H	α-helix	trans	-56.6	-43.4	174.8	-169.4	-164	-49.2	0	0	111.4	V437 F540 L548	V437-M544 HydrophobicContact CG2-CE 3.77Å; V437-M544 HydrophobicContact CG2-SD 4.32Å; F540-M544 HydrophobicContact CD1-CE 3.91Å; F540-M544 HydrophobicContact CE1-CE 3.3Å; F540-M544 HydrophobicContact CZ-CE 3.67Å; F540-M544 VanDerWaalsContact O-CB 3.26Å; F540-M544 WeakPolarHBondContact O-CB 3.47Å; F540-M544 PolarHBondContact O-N 2.82Å; M544-L548 WeakPolarHBondContact O-CD1 3.5Å; M544-L548 PolarHBondContact O-N 3.02Å
545	L	48.4	Very low	49.6	Very low	79 Å²	79	84 Å²	84	41%	0.414	40%	0.401	S	S	.	.	H	α-helix	trans	-66.8	-46.9	175.1	-173.1	68.1	0	0	0	112.1	D541 H543 L548 M549	D541-L545 PolarHBondContact O-N 3.29Å; H543-L545 VanDerWaalsContact C-N 3.27Å; H543-L545 PolarHBondContact O-N 3.34Å; L545-L548 PolarHBondContact O-N 2.9Å; L545-M549 HydrophobicContact CG-SD 4.47Å; L545-M549 WeakPolarHBondContact O-CB 3.47Å; L545-M549 WeakPolarHBondContact O-CG 3.44Å; L545-M549 PolarHBondContact O-N 3.24Å
546	W	45.6	Very low	48.5	Very low	142 Å²	142	87.5 Å²	87.5	54%	0.538	41%	0.409	S	S	.	.	H	α-helix	trans	-64.7	-44.1	-178.7	-175.8	92.6	0	0	0	112.3	S542 H543 M549 H550	S542-W546 VanDerWaalsContact O-CB 3.28Å; S542-W546 WeakPolarHBondContact O-CB 3.17Å; S542-W546 PolarHBondContact O-N 3.44Å; H543-W546 PolarHBondContact O-N 3.35Å; H543-W546 VanDerWaalsContact O-N 3.16Å; W546-M549 CarbonylContact O-C 3.56Å; W546-M549 PolarHBondContact O-N 3.39Å; W546-H550 HydrophobicContact CD2-CB 4.47Å; W546-H550 HydrophobicContact CE3-CB 4.33Å; W546-H550 HydrophobicContact CH2-CB 4.44Å; W546-H550 AromaticContact CH2-CD2 3.98Å; W546-H550 AromaticContact CZ2-CD2 3.99Å; W546-H550 HydrophobicContact CZ3-CB 4.32Å; W546-H550 WeakPolarHBondContact O-CB 3.15Å; W546-H550 PolarHBondContact O-N 2.85Å
547	F	52.8	Low	47.4	Very low	81 Å²	81	89 Å²	89	36%	0.355	42%	0.416	S	S	.	.	H	α-helix	trans	-61.6	-45.8	175.8	-90.9	-89.3	0	0	0	111.3	A435 H543 M549 H550 H551	A435-F547 HydrophobicContact CB-CD2 4.16Å; A435-F547 HydrophobicContact CB-CE2 4.17Å; A435-F547 HydrophobicContact CB-CG 4.34Å; A435-F547 HydrophobicContact CB-CZ 4.36Å; H543-F547 HydrophobicContact CB-CD2 4.23Å; H543-F547 WeakPolarHBondContact O-CB 3.44Å; H543-F547 WeakPolarHBondContact O-CD2 3.33Å; H543-F547 PolarHBondContact O-N 2.98Å; F547-M549 PolarHBondContact O-N 2.87Å; F547-H550 PolarHBondContact O-N 2.7Å; F547-H551 WeakPolarHBondContact O-CB 3.35Å; F547-H551 PolarHBondContact O-N 2.96Å
548	L	49.3	Very low	46.4	Very low	39 Å²	39	92.5 Å²	92.5	20%	0.204	43%	0.425	C	S	.	.	H	α-helix	trans	-57.1	-49.1	172.4	-108.9	102.9	0	0	0	111.3	M544 L545 H550 H551 L552	M544-L548 WeakPolarHBondContact O-CD1 3.5Å; M544-L548 PolarHBondContact O-N 3.02Å; L545-L548 PolarHBondContact O-N 2.9Å; L548-H550 PolarHBondContact O-N 2.66Å; L548-H551 PolarHBondContact O-N 2.87Å; L548-L552 WeakPolarHBondContact O-CB 3.47Å; L548-L552 WeakPolarHBondContact O-CD1 3.36Å; L548-L552 WeakPolarHBondContact O-CG 3.25Å; L548-L552 PolarHBondContact O-N 3.37Å
549	M	42.1	Very low	45.6	Very low	115 Å²	115	95.7 Å²	95.7	57%	0.567	43%	0.427	S	S	*	.	H	α-helix	trans	-68.4	-32.2	-178.5	-69.9	-161.7	83.5	0	0	113.4	L545 W546 F547 R553	L545-M549 HydrophobicContact CG-SD 4.47Å; L545-M549 WeakPolarHBondContact O-CB 3.47Å; L545-M549 WeakPolarHBondContact O-CG 3.44Å; L545-M549 PolarHBondContact O-N 3.24Å; W546-M549 CarbonylContact O-C 3.56Å; W546-M549 PolarHBondContact O-N 3.39Å; F547-M549 PolarHBondContact O-N 2.87Å; M549-R553 WeakPolarHBondContact O-CB 3.49Å; M549-R553 PolarHBondContact O-N 3.45Å
550	H	44	Very low	44.5	Very low	71 Å²	71	103.6 Å²	103.6	33%	0.329	45%	0.453	S	S	.	.	H	α-helix	trans	-68.9	-46.1	176.5	-175	-101.9	0	0	0	110.8	W546 F547 L548 L552 R553 Q554	W546-H550 HydrophobicContact CD2-CB 4.47Å; W546-H550 HydrophobicContact CE3-CB 4.33Å; W546-H550 HydrophobicContact CH2-CB 4.44Å; W546-H550 AromaticContact CH2-CD2 3.98Å; W546-H550 AromaticContact CZ2-CD2 3.99Å; W546-H550 HydrophobicContact CZ3-CB 4.32Å; W546-H550 WeakPolarHBondContact O-CB 3.15Å; W546-H550 PolarHBondContact O-N 2.85Å; F547-H550 PolarHBondContact O-N 2.7Å; L548-H550 PolarHBondContact O-N 2.66Å; H550-L552 PolarHBondContact O-N 2.97Å; H550-R553 WeakPolarHBondContact O-CB 3.38Å; H550-R553 PolarHBondContact O-N 3.15Å; H550-R553 VanDerWaalsContact O-N 3.14Å; H550-Q554 PolarHBondContact CE1-NE2 3.15Å; H550-Q554 VanDerWaalsContact CE1-NE2 3.26Å; H550-Q554 PolarHBondContact O-N 3.45Å
551	H	52	Low	43.3	Very low	44 Å²	44	113.9 Å²	113.9	20%	0.204	49%	0.492	C	S	.	.	H	α-helix	trans	-64.4	-38.9	175.2	-129.3	58.6	0	0	0	111.8	F547 L548 R553 Q554 R555	F547-H551 WeakPolarHBondContact O-CB 3.35Å; F547-H551 PolarHBondContact O-N 2.96Å; L548-H551 PolarHBondContact O-N 2.87Å; H551-R553 PolarHBondContact O-N 2.99Å; H551-Q554 PolarHBondContact O-N 2.95Å; H551-R555 WeakPolarHBondContact O-CG 3.44Å; H551-R555 PolarHBondContact O-N 3.36Å
552	L	46.2	Very low	42.2	Very low	91 Å²	91	121.8 Å²	121.8	48%	0.476	52%	0.517	S	S	.	.	H	α-helix	trans	-62.8	-37.7	171.3	-72.8	167	0	0	0	112.8	L548 H550 R556	L548-L552 WeakPolarHBondContact O-CB 3.47Å; L548-L552 WeakPolarHBondContact O-CD1 3.36Å; L548-L552 WeakPolarHBondContact O-CG 3.25Å; L548-L552 PolarHBondContact O-N 3.37Å; H550-L552 PolarHBondContact O-N 2.97Å; L552-R556 PolarHBondContact O-N 2.81Å
553	R	42.5	Very low	41.3	Very low	193 Å²	193	127.7 Å²	127.7	73%	0.728	54%	0.538	S	S	*	.	H	α-helix	trans	-66.7	-46	175.1	-92.7	-177.9	164	-177.6	-4.3	112.2	M549 H550 H551 R555 R556	M549-R553 WeakPolarHBondContact O-CB 3.49Å; M549-R553 PolarHBondContact O-N 3.45Å; H550-R553 WeakPolarHBondContact O-CB 3.38Å; H550-R553 PolarHBondContact O-N 3.15Å; H550-R553 VanDerWaalsContact O-N 3.14Å; H551-R553 PolarHBondContact O-N 2.99Å; R553-R555 VanDerWaalsContact C-N 3.28Å; R553-R555 PolarHBondContact O-N 3.38Å; R553-R556 PolarHBondContact O-N 3.49Å
554	Q	42.9	Very low	40.4	Very low	100 Å²	100	131.4 Å²	131.4	47%	0.467	57%	0.568	S	S	.	*	H	α-helix	trans	-61	-37	176.4	-71.3	-178.3	-31.2	0	0	111.8	H550 H551 R556 H557 H558	H550-Q554 PolarHBondContact CE1-NE2 3.15Å; H550-Q554 VanDerWaalsContact CE1-NE2 3.26Å; H550-Q554 PolarHBondContact O-N 3.45Å; H551-Q554 PolarHBondContact O-N 2.95Å; Q554-R556 PolarHBondContact O-N 2.87Å; Q554-H557 PolarHBondContact O-N 3.36Å; Q554-H558 PolarHBondContact O-N 2.71Å
555	R	46.7	Very low	39.2	Very low	79 Å²	79	133.2 Å²	133.2	30%	0.298	60%	0.596	S	S	.	*	H	α-helix	trans	-68.2	-29.8	175.5	-73.2	178.9	-179.1	-177.2	2.5	114.2	C195 L498 H551 R553 H557 H558 R559	C195-R555 PolarHBondContact SG-NH1 3.43Å; L498-R555 PolarHBondContact O-NH1 3.05Å; L498-R555 PolarHBondContact O-NH2 3.03Å; H551-R555 WeakPolarHBondContact O-CG 3.44Å; H551-R555 PolarHBondContact O-N 3.36Å; R553-R555 VanDerWaalsContact C-N 3.28Å; R553-R555 PolarHBondContact O-N 3.38Å; R555-H557 VanDerWaalsContact C-N 3.3Å; R555-H557 PolarHBondContact O-N 3.22Å; R555-H558 PolarHBondContact O-N 3.35Å; R555-R559 PolarHBondContact O-N 3.4Å
556	R	35.4	Very low	38.3	Very low	205 Å²	205	136.7 Å²	136.7	77%	0.774	62%	0.62	S	S	*	*	H	α-helix	trans	-64.1	-33.4	171.6	-76.3	-172.9	178.5	-172.2	-0.2	112.6	L552 R553 Q554	L552-R556 PolarHBondContact O-N 2.81Å; R553-R556 PolarHBondContact O-N 3.49Å; Q554-R556 PolarHBondContact O-N 2.87Å
557	H	32.3	Very low	37.5	Very low	137 Å²	137	133.5 Å²	133.5	63%	0.634	63%	0.631	S	S	*	*	H	α-helix	trans	-68.2	-44.5	172.6	-81.7	-92	0	0	0	111.7	Q554 R555 R559 R560	Q554-H557 PolarHBondContact O-N 3.36Å; R555-H557 VanDerWaalsContact C-N 3.3Å; R555-H557 PolarHBondContact O-N 3.22Å; H557-R559 PolarHBondContact O-N 3.33Å; H557-R560 PolarHBondContact O-N 3.03Å; H557-R560 VanDerWaalsContact O-N 3.15Å
558	H	32.1	Very low	36.4	Very low	155 Å²	155	134.7 Å²	134.7	72%	0.718	66%	0.656	S	S	*	*	H	α-helix	trans	-65.8	-33.9	178	-91.8	53.1	0	0	0	114.1	Q554 R555 R560 W561	Q554-H558 PolarHBondContact O-N 2.71Å; R555-H558 PolarHBondContact O-N 3.35Å; H558-R560 PolarHBondContact O-N 3.1Å; H558-W561 PolarHBondContact O-N 3.36Å
559	R	34.2	Very low	35.4	Very low	196 Å²	196	138.5 Å²	138.5	74%	0.74	68%	0.681	S	S	*	*	H	α-helix	trans	-62.9	-28.3	172.9	-108.2	-173.9	-176.6	176.9	4.1	113.1	R555 H557 W561	R555-R559 PolarHBondContact O-N 3.4Å; H557-R559 PolarHBondContact O-N 3.33Å; R559-W561 PolarHBondContact O-N 2.97Å
560	R	29.7	Very low	34.8	Very low	224 Å²	224	140.1 Å²	140.1	85%	0.845	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-6.4	179.5	-145.4	178.1	-171	-173.6	1.3	114	H557 H558	H557-R560 PolarHBondContact O-N 3.03Å; H557-R560 VanDerWaalsContact O-N 3.15Å; H558-R560 PolarHBondContact O-N 3.1Å
561	W	30.4	Very low	34.2	Very low	227 Å²	227	141.1 Å²	141.1	86%	0.86	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109	8.2	177.8	-78.6	86	0	0	0	113.5	H558 R559	H558-W561 PolarHBondContact O-N 3.36Å; R559-W561 PolarHBondContact O-N 2.97Å
562	R	30	Very low	33.1	Very low	227 Å²	227	146.4 Å²	146.4	86%	0.857	74%	0.742	S	S	*	*			trans	-135.9	64.9	175.7	-72.3	-166.3	177.9	-162.4	1.2	112.6
563	E	25.2	Very low	32.4	Very low	181 Å²	181	148 Å²	148	85%	0.846	76%	0.761	S	S	*	*			trans	-110.6	128.2	150.1	-74.6	-171	153.1	0	0	108.5	G565	E563-G565 PolarHBondContact O-N 2.88Å
564	P	32.4	Very low	31.8	Very low	137 Å²	137	146.3 Å²	146.3	89%	0.89	77%	0.767	S	S	*	*			trans	-86.3	105.5	-176.3	31.6	-31.9	0	0	0	112.1
565	G	29.3	Very low	31.3	Very low	75 Å²	75	150.4 Å²	150.4	77%	0.773	79%	0.785	S	S	*	*			trans	-97.4	124.6	171.2	0	0	0	0	0	112.6	E563 G567	E563-G565 PolarHBondContact O-N 2.88Å; G565-G567 PolarHBondContact O-N 3.5Å
566	V	30.2	Very low	30.3	Very low	152 Å²	152	151.9 Å²	151.9	92%	0.921	81%	0.808	S	S	*	*			trans	-47.3	115.7	-173.5	-178.1	0	0	0	0	116.4
567	G	27.6	Very low	30.7	Very low	74 Å²	74	147.4 Å²	147.4	76%	0.763	81%	0.806	S	S	*	*				60.1	111.3	128.7	0	0	0	0	0	122.3	G565	G565-G567 PolarHBondContact O-N 3.5Å
568	A	29.1	Very low	30.4	Very low	106 Å²	106	145.9 Å²	145.9	88%	0.876	81%	0.81	S	S	*	*			trans	-154.2	166.4	144.2	0	0	0	0	0	110
569	T	29.8	Very low	30.3	Very low	120 Å²	120	143.1 Å²	143.1	74%	0.736	81%	0.808	S	S	*	*			trans	-109.4	160.5	-158.9	57.4	0	0	0	0	116.2
570	D	29.7	Very low	30.1	Very low	149 Å²	149	138.8 Å²	138.8	80%	0.797	81%	0.808	S	S	*	*			trans	78	141.9	147.7	-58.3	-38.1	0	0	0	123.6
571	A	30.4	Very low	30	Very low	92 Å²	92	134.8 Å²	134.8	76%	0.76	80%	0.804	S	S	*	*			trans	84.3	113.9	146.4	0	0	0	0	0	121.5
572	D	29.6	Very low	30	Very low	154 Å²	154	129.7 Å²	129.7	82%	0.824	80%	0.798	S	S	*	*			trans	-10.1	136.8	147.8	-49.8	-41.2	0	0	0	118.5
573	S	30.7	Very low	29.9	Very low	125 Å²	125	123 Å²	123	87%	0.874	79%	0.785	S	S	*	*				177.7	159	105.2	37.2	0	0	0	0	113.2
574	D	31	Very low	30.3	Very low	158 Å²	158	120.4 Å²	120.4	85%	0.845	78%	0.777	S	S	*	*			trans	-73.2	174.9	178.8	-85.5	-56.6	0	0	0	114.4
575	E	30.7	Very low	30.2	Very low	185 Å²	185	122.1 Å²	122.1	86%	0.864	77%	0.774	S	S	*	*			trans	94.1	106.5	161.5	-52.8	-144.7	156	0	0	118.9
576	S	26.7	Very low	30.3	Very low	110 Å²	110	125.9 Å²	125.9	77%	0.769	77%	0.771	S	S	*	*			trans	-72.2	160.3	140.4	-59.3	0	0	0	0	109
577	P	43.8	Very low	30.3	Very low	112 Å²	112	127 Å²	127	73%	0.727	77%	0.766	S	S	*	*			cis	-152.3	-174.9	33	41.4	-19.7	0	0	0	118.5
578	S	26.6	Very low	30.4	Very low	104 Å²	104	126.9 Å²	126.9	73%	0.727	77%	0.765	S	S	*	*			trans	107.7	146.2	133	75.9	0	0	0	0	121.5
579	S	29.8	Very low	31	Very low	97 Å²	97	127.6 Å²	127.6	68%	0.678	76%	0.761	S	S	*	*			trans	57.5	100.6	157	52.2	0	0	0	0	120.8
580	S	28.8	Very low	31	Very low	106 Å²	106	129.4 Å²	129.4	74%	0.741	77%	0.766	S	S	*	*				21.7	122.4	115.2	59.7	0	0	0	0	120
581	D	28.5	Very low	31	Very low	140 Å²	140	133.1 Å²	133.1	75%	0.749	77%	0.769	S	S	*	*				-161.2	131.1	122.7	-110.8	-37.8	0	0	0	108
582	T	29.9	Very low	31	Very low	120 Å²	120	135.7 Å²	135.7	74%	0.736	78%	0.775	S	S	*	*				46.3	144.1	102.8	65.2	0	0	0	0	115.1
583	S	29.1	Very low	30.9	Very low	85 Å²	85	136.9 Å²	136.9	59%	0.594	78%	0.776	S	S	*	*			cis	-176	160.5	-25.2	57.1	0	0	0	0	104.4
584	D	32.1	Very low	30.8	Very low	127 Å²	127	137.2 Å²	137.2	68%	0.679	78%	0.776	S	S	*	*			trans	66.7	120.2	156	-46.9	-34.9	0	0	0	120.9
585	E	31.6	Very low	30.6	Very low	173 Å²	173	138 Å²	138	81%	0.808	78%	0.777	S	S	*	*			trans	75.6	149.3	133	-66.4	177.5	-175	0	0	118.4
586	E	31.2	Very low	31	Very low	154 Å²	154	134.9 Å²	134.9	72%	0.72	77%	0.773	S	S	*	*			cis	-152.7	179	9.3	-143.5	-176	178.5	0	0	111.5
587	E	30.1	Very low	31.3	Very low	176 Å²	176	138.9 Å²	138.9	82%	0.822	80%	0.801	S	S	*	*			trans	61.7	128.9	159.3	-62.1	-166.9	131.1	0	0	121.5
588	G	28.6	Very low	30.6	Very low	72 Å²	72	140.2 Å²	140.2	74%	0.742	80%	0.804	S	S	*	*			trans	-96.8	-133	162.8	0	0	0	0	0	110.5
589	P	41.3	Very low	30.8	Very low	121 Å²	121	142.1 Å²	142.1	79%	0.786	81%	0.808	S	S	*	*			cis	-116.6	166.7	-27.7	39.3	-28.1	0	0	0	111.2
590	D	30.4	Very low	30.9	Very low	157 Å²	157	144.6 Å²	144.6	84%	0.84	82%	0.815	S	S	*	*				-167.8	157.6	124.2	-124.1	-32.5	0	0	0	115.6
591	R	29.4	Very low	31	Very low	227 Å²	227	146.9 Å²	146.9	86%	0.857	82%	0.82	S	S	*	*			trans	-77.2	143.3	173.7	-67.1	159.8	151.2	174.7	-7.8	111.6
592	V	30.8	Very low	31.2	Very low	146 Å²	146	147.3 Å²	147.3	89%	0.885	82%	0.824	S	S	*	*				-145.9	132.3	125.4	175.7	0	0	0	0	109.4
593	Q	28.5	Very low	31.3	Very low	180 Å²	180	149.1 Å²	149.1	84%	0.841	83%	0.83	S	S	*	*			trans	-79.9	143.7	169	-63.2	163.8	-84.2	0	0	110.6
594	C	27.4	Very low	31.4	Very low	131 Å²	131	153.7 Å²	153.7	89%	0.885	85%	0.847	S	S	*	*			trans	-167.3	131.1	130.2	-111.8	0	0	0	0	111.8
595	M	27.9	Very low	31.4	Very low	174 Å²	174	155.8 Å²	155.8	86%	0.857	86%	0.86	S	S	*	*			trans	-97.7	-169.5	159.6	-54.7	-163.7	85	0	0	108.7
596	P	38	Very low	31.4	Very low	121 Å²	121	154.3 Å²	154.3	79%	0.786	86%	0.864	S	S	*	*				-120.1	179.2	-92.1	37.7	-21.7	0	0	0	112.1
597	S	32.8	Very low	31.4	Very low	193 Å²	193	154.4 Å²	154.4	100%	1.35	88%	0.877	S	S	*	*			trans	-150.1	0	161.2	60.4	0	0	0	0	109.9

Retrieved 597 of 597 residues in 158.3 ms (Link to these results)

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