A0A087XJP0_POEFO Loading...

Ubiquitin carboxyl-terminal hydrolase

AlphaFold DB , UniProt , Accession A0A087XJP0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 586 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.6	Very low	27.7	Very low	244 Å²	244	162.5 Å²	162.5	100%	1.202	84%	0.835	S	S	*	*				0	110.8	0	-78.5	175	159.9	0	0	108.7
2	S	24.8	Very low	28	Very low	126 Å²	126	157.4 Å²	157.4	88%	0.881	84%	0.836	S	S	*	*			trans	-163.4	129.4	177.1	23.9	0	0	0	0	111
3	R	29.1	Very low	27.7	Very low	247 Å²	247	149.4 Å²	149.4	93%	0.932	81%	0.814	S	S	*	*			trans	-98.1	127.5	172.7	-66.6	173.6	174	170.5	-3.3	109.3
4	V	26.1	Very low	27.5	Very low	144 Å²	144	146.9 Å²	146.9	87%	0.873	81%	0.812	S	S	*	*			trans	-144	123.5	144.5	-172.2	0	0	0	0	108.1
5	S	24.7	Very low	27.5	Very low	110 Å²	110	143.6 Å²	143.6	77%	0.769	80%	0.804	S	S	*	*			trans	-128.9	128.6	166.1	-178.6	0	0	0	0	107.7
6	S	24.9	Very low	27.4	Very low	112 Å²	112	149.7 Å²	149.7	78%	0.783	81%	0.813	S	S	*	*			trans	-116.4	78.7	-170.1	58.2	0	0	0	0	111.4
7	T	28.6	Very low	27.4	Very low	123 Å²	123	147.1 Å²	147.1	76%	0.755	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-73	128.7	173.7	41.9	0	0	0	0	111.5
8	P	26.5	Very low	27.5	Very low	107 Å²	107	144.6 Å²	144.6	70%	0.695	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-80	126.8	178.1	31.1	-32.9	0	0	0	111.7	R10	P8-R10 PolarHBondContact O-N 2.92Å
9	K	26.6	Very low	27.4	Very low	171 Å²	171	145.7 Å²	145.7	74%	0.743	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-56.8	133.3	170.7	-62.6	-177.5	177.6	-175	0	111.5
10	R	27.8	Very low	27.3	Very low	184 Å²	184	149.9 Å²	149.9	69%	0.694	80%	0.802	S	S	*	*			trans	-129.3	144.9	148.6	-75	-170.2	176	-168.9	1.2	107.6	P8 E490	P8-R10 PolarHBondContact O-N 2.92Å; R10-E490 IonicContact CZ-OE2 3.71Å; R10-E490 VanDerWaalsContact CZ-OE2 3.23Å; R10-E490 IonicContact NH1-OE2 2.79Å; R10-E490 PolarHBondContact NH1-OE2 3.08Å; R10-E490 PolarHBondContact NH2-O 3.48Å; R10-E490 IonicContact NH2-OE2 3.62Å; R10-E490 PolarHBondContact NH2-OE2 3.06Å
11	Y	27.4	Very low	27.2	Very low	219 Å²	219	147.5 Å²	147.5	86%	0.859	80%	0.797	S	S	*	*			trans	-86	158.2	-173.3	-100	-109.6	0	0	0	112.4
12	A	30.6	Very low	26.7	Very low	102 Å²	102	141 Å²	141	84%	0.843	78%	0.775	S	S	*	*			trans	-74.6	142.9	176.5	0	0	0	0	0	112.3
13	G	24.2	Very low	26.7	Very low	53 Å²	53	145.9 Å²	145.9	55%	0.546	78%	0.776	S	S	.	*			trans	-105.5	147.4	166.3	0	0	0	0	0	110.8
14	S	24.9	Very low	26.5	Very low	114 Å²	114	139.8 Å²	139.8	80%	0.797	77%	0.771	S	S	*	*			trans	-75.2	143.8	-172	-164.7	0	0	0	0	113.4
15	S	27.7	Very low	26.7	Very low	98 Å²	98	139 Å²	139	69%	0.685	77%	0.769	S	S	*	*			trans	-95.7	131.4	170.2	-62	0	0	0	0	109.8	T17	S15-T17 PolarHBondContact O-N 2.87Å
16	Y	26.1	Very low	26.7	Very low	241 Å²	241	138.9 Å²	138.9	95%	0.945	77%	0.768	S	S	*	*			trans	-69.1	100.4	-176.8	-154.3	-89.7	0	0	0	111.2
17	T	27.6	Very low	26.8	Very low	105 Å²	105	141.3 Å²	141.3	64%	0.644	77%	0.771	S	S	*	*			trans	-79.2	119.5	176.8	46.8	0	0	0	0	110.7	S15 H19	S15-T17 PolarHBondContact O-N 2.87Å; T17-H19 PolarHBondContact O-N 2.8Å
18	S	29.4	Very low	26.7	Very low	102 Å²	102	141.3 Å²	141.3	71%	0.713	77%	0.771	S	S	*	*			trans	-63.6	113.2	170	54.8	0	0	0	0	110.3	Y20	S18-Y20 PolarHBondContact O-N 3.28Å
19	H	25.8	Very low	27.4	Very low	166 Å²	166	142.2 Å²	142.2	77%	0.769	78%	0.777	S	S	*	*			trans	-65.3	114.5	173.5	-77.6	-101.8	0	0	0	110.4	T17	T17-H19 PolarHBondContact O-N 2.8Å
20	Y	24.9	Very low	27.3	Very low	230 Å²	230	137.1 Å²	137.1	90%	0.902	77%	0.773	S	S	*	*			trans	-91.9	97.9	159.8	-112.9	-90.5	0	0	0	107.7	S18	S18-Y20 PolarHBondContact O-N 3.28Å
21	S	25.7	Very low	27.2	Very low	100 Å²	100	136.3 Å²	136.3	70%	0.699	78%	0.782	S	S	*	*			trans	-90.8	126.3	169	-67.9	0	0	0	0	109.4
22	S	26.8	Very low	27.1	Very low	106 Å²	106	130.4 Å²	130.4	74%	0.741	77%	0.773	S	S	*	*			trans	-69.6	133.2	-179.5	50.5	0	0	0	0	112.6
23	Y	25.1	Very low	26.8	Very low	229 Å²	229	131.1 Å²	131.1	90%	0.898	77%	0.767	S	S	*	*			trans	-137.6	119.2	153	-98.7	-81.3	0	0	0	109.7
24	S	25.9	Very low	27	Very low	119 Å²	119	138.5 Å²	138.5	83%	0.832	78%	0.779	S	S	*	*			trans	-95.8	136.5	171.2	-56	0	0	0	0	109.6
25	P	29.2	Very low	27.1	Very low	129 Å²	129	138.1 Å²	138.1	84%	0.838	78%	0.776	S	S	*	*			trans	-107.2	128.2	160.2	33.6	-25.1	0	0	0	110.8
26	S	25.6	Very low	27.2	Very low	107 Å²	107	140.4 Å²	140.4	75%	0.748	78%	0.777	S	S	*	*			trans	-108.2	127.7	175.3	54	0	0	0	0	111.6
27	L	26.2	Very low	27.3	Very low	162 Å²	162	138.8 Å²	138.8	85%	0.848	77%	0.769	S	S	*	*			trans	58.6	115	151.3	-61.1	167.6	0	0	0	120
28	T	26.3	Very low	27.4	Very low	123 Å²	123	139.8 Å²	139.8	76%	0.755	77%	0.77	S	S	*	*			trans	-22.9	171.7	142.5	51	0	0	0	0	119.3
29	P	41.3	Very low	27.5	Very low	127 Å²	127	145.9 Å²	145.9	83%	0.825	78%	0.777	S	S	*	*			cis	-138.4	-175.7	-8.5	29.1	-6	0	0	0	115.7
30	G	24.3	Very low	27.6	Very low	63 Å²	63	145 Å²	145	65%	0.649	78%	0.777	S	S	*	*			trans	150.9	133.5	143.9	0	0	0	0	0	119.6
31	L	26.3	Very low	27.7	Very low	167 Å²	167	139.5 Å²	139.5	87%	0.874	77%	0.773	S	S	*	*			trans	56.2	116	157	-79.1	69.1	0	0	0	118.6
32	S	24.9	Very low	27.9	Very low	96 Å²	96	140.9 Å²	140.9	67%	0.671	78%	0.777	S	S	*	*				79.9	146.8	76.3	86.2	0	0	0	0	113.7
33	T	25.6	Very low	28	Very low	117 Å²	117	145.4 Å²	145.4	72%	0.718	78%	0.78	S	S	*	*			cis	-159.5	-176.2	22.5	-26.1	0	0	0	0	111.5
34	Y	26.8	Very low	28.1	Very low	208 Å²	208	146.6 Å²	146.6	82%	0.816	78%	0.782	S	S	*	*			trans	87.5	99.9	165.7	-79.7	-78.9	0	0	0	121.3
35	S	28.4	Very low	28.3	Very low	105 Å²	105	145.5 Å²	145.5	73%	0.734	77%	0.774	S	S	*	*				46	157.9	123.4	-55.4	0	0	0	0	123.7
36	E	29	Very low	29.4	Very low	147 Å²	147	144.2 Å²	144.2	69%	0.687	77%	0.766	S	S	*	*			cis	-178.9	132.3	-29.6	-174.3	-170.5	-114.3	0	0	107
37	R	28.6	Very low	29.6	Very low	206 Å²	206	146.6 Å²	146.6	78%	0.777	77%	0.771	S	S	*	*			trans	153.8	120.6	134.8	-84.2	179.2	-178.3	-167.2	-4.5	114.6
38	D	29.3	Very low	29.8	Very low	126 Å²	126	144.2 Å²	144.2	67%	0.674	77%	0.768	S	S	*	*			trans	19.4	128.4	141.6	-50.1	-53.9	0	0	0	120
39	R	30.8	Very low	29.8	Very low	230 Å²	230	144.6 Å²	144.6	87%	0.868	77%	0.77	S	S	*	*			cis	61.4	122.2	49.2	-65.5	-174.2	163.8	-169	-2.4	115.3
40	L	28.2	Very low	29.3	Very low	147 Å²	147	143.9 Å²	143.9	77%	0.77	77%	0.768	S	S	*	*				-157.3	159.3	111.3	-137.8	71.2	0	0	0	112.3
41	S	28.5	Very low	29.6	Very low	116 Å²	116	145.4 Å²	145.4	81%	0.811	77%	0.768	S	S	*	*			trans	-154.9	138.3	169.4	-54.2	0	0	0	0	107.3
42	T	28.8	Very low	29.8	Very low	128 Å²	128	143.2 Å²	143.2	79%	0.785	77%	0.767	S	S	*	*			trans	-127.5	133.8	-169.8	-47.6	0	0	0	0	112.9
43	Y	29.5	Very low	29.9	Very low	202 Å²	202	141.7 Å²	141.7	79%	0.792	77%	0.767	S	S	*	*			trans	-64.4	159	-173.8	-84.6	-106.8	0	0	0	116.5
44	R	27.5	Very low	30.2	Very low	254 Å²	254	146.9 Å²	146.9	96%	0.958	78%	0.775	S	S	*	*				-157.6	166.1	113.8	-106.2	171.4	-173	-147.8	0.1	113
45	S	30.2	Very low	30.3	Very low	95 Å²	95	142 Å²	142	66%	0.664	77%	0.771	S	S	*	*			trans	-122.7	-162.4	-161.6	-21.4	0	0	0	0	111
46	P	51.3	Low	30.4	Very low	103 Å²	103	141.9 Å²	141.9	67%	0.669	77%	0.77	S	S	*	*			cis	-134	177.2	-35.1	38.3	-22.4	0	0	0	114
47	N	30.5	Very low	30.6	Very low	157 Å²	157	138.9 Å²	138.9	84%	0.84	77%	0.766	S	S	*	*			trans	62.8	152.9	158.1	-59.5	-10.2	0	0	0	117.6
48	S	29.5	Very low	30.6	Very low	112 Å²	112	139.4 Å²	139.4	78%	0.783	77%	0.769	S	S	*	*			cis	-154.3	171.2	19.1	54.8	0	0	0	0	113.7
49	T	27.9	Very low	30.7	Very low	131 Å²	131	140.6 Å²	140.6	80%	0.804	78%	0.775	S	S	*	*			trans	-47.3	148.1	176.4	48.1	0	0	0	0	119.3
50	S	30.7	Very low	30.6	Very low	111 Å²	111	134 Å²	134	78%	0.776	76%	0.764	S	S	*	*				178.3	150	117.1	49.2	0	0	0	0	115.7
51	S	30.5	Very low	30.7	Very low	95 Å²	95	132.1 Å²	132.1	66%	0.664	76%	0.763	S	S	*	*			trans	30.8	120.7	148.8	53.5	0	0	0	0	121.2
52	S	30.4	Very low	30.9	Very low	121 Å²	121	132.2 Å²	132.2	85%	0.846	76%	0.764	S	S	*	*				55.6	132	74.4	76.1	0	0	0	0	115.7
53	G	26.7	Very low	31.1	Very low	65 Å²	65	131 Å²	131	67%	0.67	77%	0.767	S	S	*	*			cis	166.6	-178.9	0.2	0	0	0	0	0	111.5
54	Y	31.3	Very low	31.4	Very low	225 Å²	225	125.9 Å²	125.9	88%	0.882	77%	0.766	S	S	*	*			trans	66	127.7	176.5	-70.6	-89.4	0	0	0	116.1
55	S	28.6	Very low	31.6	Very low	106 Å²	106	126.2 Å²	126.2	74%	0.741	77%	0.767	S	S	*	*				68.1	140.7	81	-51.3	0	0	0	0	114.2
56	S	30	Very low	31.5	Very low	102 Å²	102	125.3 Å²	125.3	71%	0.713	77%	0.773	S	S	*	*			cis	-157.3	163	9.3	-164.3	0	0	0	0	113.8
57	S	33.8	Very low	30.7	Very low	85 Å²	85	131.5 Å²	131.5	59%	0.594	78%	0.783	S	S	*	*			trans	17.4	129.8	146.8	61.5	0	0	0	0	123.7
58	Y	29.8	Very low	31	Very low	216 Å²	216	129.6 Å²	129.6	85%	0.847	77%	0.773	S	S	*	*			trans	-155.5	138.8	133.1	-74.7	-65.7	0	0	0	107
59	L	29.8	Very low	31.1	Very low	151 Å²	151	134.2 Å²	134.2	79%	0.791	78%	0.775	S	S	*	*				60.5	129.1	59.7	-58.2	177.9	0	0	0	113
60	S	29.1	Very low	31.4	Very low	92 Å²	92	132.9 Å²	132.9	64%	0.643	77%	0.771	S	S	*	*			cis	-166.1	152.1	-3	-92.1	0	0	0	0	113.2
61	S	30.7	Very low	31.6	Very low	107 Å²	107	132 Å²	132	75%	0.748	77%	0.77	S	S	*	*			trans	66.9	159.1	141.8	73.7	0	0	0	0	123.8
62	S	32.2	Very low	31.8	Very low	118 Å²	118	133 Å²	133	83%	0.825	78%	0.777	S	S	*	*			trans	102.2	125.3	148.5	-55.8	0	0	0	0	120.6
63	A	33.5	Very low	31.9	Very low	103 Å²	103	132.9 Å²	132.9	85%	0.851	78%	0.777	S	S	*	*			trans	-90.5	171.3	-166.9	0	0	0	0	0	116.4
64	A	34.8	Very low	32.3	Very low	94 Å²	94	137.2 Å²	137.2	78%	0.777	78%	0.784	S	S	*	*			trans	133.6	120	131.2	0	0	0	0	0	118.2
65	R	32.7	Very low	33.6	Very low	261 Å²	261	132 Å²	132	99%	0.985	78%	0.778	S	S	*	*			trans	29.2	131.3	144.5	-64.3	179.4	172.4	177	-2.5	122.5
66	G	28.5	Very low	34	Very low	76 Å²	76	133.7 Å²	133.7	78%	0.784	78%	0.779	S	S	*	*			trans	-160.5	155.9	155.6	0	0	0	0	0	111.9
67	R	34.7	Very low	34.2	Very low	234 Å²	234	139.2 Å²	139.2	88%	0.883	78%	0.784	S	S	*	*			trans	-162.4	169.5	-174	-132	-170.6	-168.5	-164.3	3.8	114
68	N	35	Very low	34.2	Very low	117 Å²	117	141 Å²	141	63%	0.626	79%	0.787	S	S	*	*			trans	78.3	159.5	171.1	-52	-9.8	0	0	0	115
69	Y	32.7	Very low	34.4	Very low	208 Å²	208	141.5 Å²	141.5	82%	0.816	79%	0.787	S	S	*	*			cis	-123.1	168.5	15.4	-78.7	-110.8	0	0	0	111.4
70	S	34.3	Very low	34.4	Very low	103 Å²	103	138.3 Å²	138.3	72%	0.72	79%	0.79	S	S	*	*			cis	79.3	152.1	30.6	-38.4	0	0	0	0	113.8
71	A	34.3	Very low	34.5	Very low	93 Å²	93	144.6 Å²	144.6	77%	0.769	80%	0.8	S	S	*	*			cis	-155.4	-158.5	5.9	0	0	0	0	0	110.8
72	S	35.6	Very low	34.5	Very low	116 Å²	116	146.4 Å²	146.4	81%	0.811	81%	0.807	S	S	*	*				-164.3	146.6	-101.1	52.4	0	0	0	0	112.4
73	S	32.3	Very low	34.8	Very low	119 Å²	119	146.7 Å²	146.7	83%	0.832	80%	0.798	S	S	*	*			trans	-159.1	143	179.7	58.8	0	0	0	0	117.5
74	D	35.3	Very low	35.2	Very low	155 Å²	155	147.8 Å²	147.8	83%	0.829	80%	0.796	S	S	*	*			trans	-92.7	-158.4	177.7	-52.3	-87	0	0	0	112.6
75	P	58.8	Low	35.1	Very low	117 Å²	117	153.3 Å²	153.3	76%	0.76	80%	0.797	S	S	*	*			cis	-144.8	175.3	-5.4	44.7	-25.1	0	0	0	119.6
76	D	36.4	Very low	35	Very low	141 Å²	141	146.8 Å²	146.8	75%	0.754	79%	0.786	S	S	*	*			trans	75.3	144.5	141.1	-117.1	-19.7	0	0	0	127.5
77	R	34.9	Very low	35.2	Very low	218 Å²	218	147.9 Å²	147.9	82%	0.823	77%	0.774	S	S	*	*			trans	62.4	116.4	150.2	-84.8	174.5	-177.9	-149.5	-2.6	127.6
78	D	33.1	Very low	35.1	Very low	121 Å²	121	143.7 Å²	143.7	65%	0.647	77%	0.768	S	S	*	*				82.7	145.8	122.6	-156	28.3	0	0	0	122.9
79	R	33.3	Very low	35.1	Very low	228 Å²	228	146 Å²	146	86%	0.86	78%	0.779	S	S	*	*			trans	62.4	135.6	167.9	-70	157.4	-157.4	-142.7	-2.1	121.5
80	G	29.3	Very low	34.8	Very low	83 Å²	83	138.9 Å²	138.9	86%	0.856	77%	0.769	S	S	*	*			trans	162.6	117.7	157.4	0	0	0	0	0	114.1
81	R	31.1	Very low	34.6	Very low	224 Å²	224	139.8 Å²	139.8	85%	0.845	78%	0.776	S	S	*	*			trans	-143.8	126.3	-179.6	-179.5	-163.3	-170.1	-172.1	7.4	111.8
82	T	31.3	Very low	34.4	Very low	146 Å²	146	140.1 Å²	140.1	90%	0.896	77%	0.772	S	S	*	*			trans	-151.8	148.5	157.8	11.8	0	0	0	0	111.4
83	I	37.8	Very low	34.2	Very low	124 Å²	124	139.4 Å²	139.4	64%	0.636	77%	0.767	S	S	*	*			trans	-143.5	139.4	-179.7	-62.2	165.1	0	0	0	106.9
84	P	42.1	Very low	34.1	Very low	126 Å²	126	138.5 Å²	138.5	82%	0.818	76%	0.761	S	S	*	*			trans	-83.6	131.8	157	-12.8	30.5	0	0	0	111.3
85	R	32.9	Very low	33.9	Very low	209 Å²	209	136.5 Å²	136.5	79%	0.789	76%	0.759	S	S	*	*			trans	-64.4	172.6	169.7	-73.1	175.1	152.9	158.1	-10.7	110.8	D87	R85-D87 IonicContact NE-OD1 2.77Å
86	T	32.3	Very low	32.6	Very low	124 Å²	124	138.1 Å²	138.1	76%	0.761	76%	0.76	S	S	*	*			cis	-165.5	164.2	48.7	46.8	0	0	0	0	110.7
87	D	30.8	Very low	32.3	Very low	99 Å²	99	138.1 Å²	138.1	53%	0.529	76%	0.76	S	S	.	*			cis	-169.6	169.9	-20	-98.2	-18.8	0	0	0	109.1	R85	R85-D87 IonicContact NE-OD1 2.77Å
88	I	33.7	Very low	32	Very low	146 Å²	146	132.4 Å²	132.4	75%	0.749	75%	0.753	S	S	*	*			trans	57.4	126.8	143.6	-74.1	164.5	0	0	0	118.3
89	L	33.8	Very low	32	Very low	166 Å²	166	138.2 Å²	138.2	87%	0.869	77%	0.766	S	S	*	*			cis	-157.8	164.7	-0.8	-88	160.1	0	0	0	106.1
90	G	27.8	Very low	31.8	Very low	58 Å²	58	138.6 Å²	138.6	60%	0.598	77%	0.768	S	S	*	*			cis	163.4	142.8	-5.8	0	0	0	0	0	111.2
91	S	30.5	Very low	31.9	Very low	123 Å²	123	138.9 Å²	138.9	86%	0.86	76%	0.756	S	S	*	*			trans	54	149.4	157.4	-53.2	0	0	0	0	122.5
92	S	30.4	Very low	31.9	Very low	100 Å²	100	136.8 Å²	136.8	70%	0.699	76%	0.756	S	S	*	*			cis	-173.1	161.2	-27.3	53.1	0	0	0	0	111.7
93	S	31.2	Very low	31.9	Very low	100 Å²	100	134.3 Å²	134.3	70%	0.699	75%	0.745	S	S	*	*			trans	65.8	128.2	145.6	56.1	0	0	0	0	124.5
94	S	30.2	Very low	31.7	Very low	101 Å²	101	135.9 Å²	135.9	71%	0.706	75%	0.754	S	S	*	*			trans	66.5	106.1	136.6	61.9	0	0	0	0	124.1
95	S	30.6	Very low	31.2	Very low	113 Å²	113	134.2 Å²	134.2	79%	0.79	75%	0.745	S	S	*	*				48	144.6	113.1	-43.3	0	0	0	0	124.3
96	I	31.1	Very low	31.1	Very low	151 Å²	151	136.1 Å²	136.1	77%	0.774	75%	0.752	S	S	*	*			trans	108.8	122.7	151.4	-61.4	177.6	0	0	0	119.6
97	N	30	Very low	31.3	Very low	141 Å²	141	136 Å²	136	75%	0.754	75%	0.751	S	S	*	*			trans	67.7	114.2	153.3	-71.2	-11.5	0	0	0	126.1
98	S	28.8	Very low	32	Very low	97 Å²	97	137.4 Å²	137.4	68%	0.678	77%	0.766	S	S	*	*				60.9	117.3	115.8	-55.6	0	0	0	0	124.4
99	R	32.2	Very low	31.9	Very low	243 Å²	243	136 Å²	136	92%	0.917	76%	0.764	S	S	*	*			trans	177.1	134.7	132.4	-91.9	151.8	-166.3	-144	4.4	107.2
100	R	30.5	Very low	32.1	Very low	237 Å²	237	136.6 Å²	136.6	89%	0.894	76%	0.759	S	S	*	*				50.9	128.3	66	-82.8	-167	179.5	-170	0.1	112.8
101	S	31.6	Very low	32	Very low	89 Å²	89	139.1 Å²	139.1	62%	0.622	77%	0.768	S	S	*	*			cis	-150.7	168.8	19	-53.1	0	0	0	0	113.1
102	E	31.3	Very low	32.1	Very low	179 Å²	179	143.2 Å²	143.2	84%	0.836	77%	0.766	S	S	*	*				40.1	151.5	130	-67.5	170	137.3	0	0	121.8
103	S	30.9	Very low	32.1	Very low	95 Å²	95	142.2 Å²	142.2	66%	0.664	77%	0.771	S	S	*	*			cis	-168.3	160.6	13.7	21.4	0	0	0	0	113
104	L	32.7	Very low	32.1	Very low	156 Å²	156	142 Å²	142	82%	0.817	78%	0.776	S	S	*	*			trans	52	124.3	150.3	-57.9	162.2	0	0	0	119.2
105	S	32.1	Very low	32.2	Very low	91 Å²	91	143.3 Å²	143.3	64%	0.636	79%	0.785	S	S	*	*			cis	88.3	124.5	31.6	85.3	0	0	0	0	117
106	R	31.5	Very low	32.1	Very low	249 Å²	249	141.3 Å²	141.3	94%	0.94	78%	0.783	S	S	*	*				-176.9	160.7	124.5	-105	177.2	-177.1	-136.4	-0.1	114.8
107	T	35	Very low	32.1	Very low	121 Å²	121	141.9 Å²	141.9	74%	0.742	79%	0.786	S	S	*	*			trans	-111.3	171.3	175	52.9	0	0	0	0	111.5
108	P	46.8	Very low	32.1	Very low	129 Å²	129	140.7 Å²	140.7	84%	0.838	79%	0.789	S	S	*	*			trans	-130.2	160.4	141.5	37.7	-27.4	0	0	0	113.7
109	V	32	Very low	32.1	Very low	116 Å²	116	140.1 Å²	140.1	70%	0.703	80%	0.798	S	S	*	*			trans	-152	146.2	-172.6	168.9	0	0	0	0	111.9
110	K	36.4	Very low	31.9	Very low	179 Å²	179	132.2 Å²	132.2	78%	0.778	79%	0.793	S	S	*	*			trans	71.3	152.4	171.3	-78.1	163.2	-175.2	176.9	0	115.7
111	S	26.2	Very low	31.9	Very low	111 Å²	111	126.8 Å²	126.8	78%	0.776	79%	0.791	S	S	*	*			cis	-146.2	-163.8	42.4	-157.9	0	0	0	0	115.8
112	Y	33.1	Very low	31.7	Very low	209 Å²	209	126.7 Å²	126.7	82%	0.82	80%	0.796	S	S	*	*			trans	-92.2	164	-163.4	-60.6	-94.6	0	0	0	116.9
113	G	29.1	Very low	31.6	Very low	79 Å²	79	129.2 Å²	129.2	81%	0.814	80%	0.799	S	S	*	*			trans	-165	161.3	166.4	0	0	0	0	0	110.8
114	A	31.3	Very low	31.4	Very low	97 Å²	97	130 Å²	130	80%	0.802	81%	0.805	S	S	*	*			trans	-147.6	164.5	-165	0	0	0	0	0	117.2
115	S	33.4	Very low	31.1	Very low	128 Å²	128	126.2 Å²	126.2	90%	0.895	80%	0.803	S	S	*	*			trans	80.3	147.6	152.2	74.2	0	0	0	0	121.7
116	G	28.3	Very low	30.9	Very low	71 Å²	71	133 Å²	133	73%	0.732	82%	0.816	S	S	*	*			trans	93.2	150	168.1	0	0	0	0	0	116.6
117	L	31.8	Very low	30.6	Very low	163 Å²	163	125.3 Å²	125.3	85%	0.853	80%	0.801	S	S	*	*			cis	174.3	137.4	-46.2	-104.8	172.4	0	0	0	108.3
118	S	29.9	Very low	30.3	Very low	116 Å²	116	125.4 Å²	125.4	81%	0.811	81%	0.807	S	S	*	*			trans	69.2	143.4	151.5	-58	0	0	0	0	122.9
119	G	28	Very low	29.4	Very low	84 Å²	84	129.6 Å²	129.6	87%	0.866	81%	0.807	S	S	*	*			trans	93	147.3	163	0	0	0	0	0	115.8
120	G	28.6	Very low	29.1	Very low	78 Å²	78	132.2 Å²	132.2	80%	0.804	81%	0.812	S	S	*	*			cis	-175.9	158.1	-4.1	0	0	0	0	0	111.5
121	S	30.8	Very low	28.7	Very low	123 Å²	123	128.2 Å²	128.2	86%	0.86	81%	0.806	S	S	*	*			trans	-71.2	144.6	-168.4	-56.2	0	0	0	0	116.5
122	A	26.5	Very low	28.8	Very low	87 Å²	87	126.3 Å²	126.3	72%	0.719	79%	0.793	S	S	*	*			trans	42.4	140	138.1	0	0	0	0	0	122.2
123	Y	28.2	Very low	28.6	Very low	231 Å²	231	126.3 Å²	126.3	91%	0.906	79%	0.793	S	S	*	*				-161.1	178.2	108.4	-122.5	-94.6	0	0	0	112.5
124	S	27	Very low	28.5	Very low	113 Å²	113	130.1 Å²	130.1	79%	0.79	79%	0.794	S	S	*	*			trans	-88.7	161.2	-166.1	-55.3	0	0	0	0	115.1
125	G	27.1	Very low	28.2	Very low	75 Å²	75	128.9 Å²	128.9	77%	0.773	78%	0.783	S	S	*	*			trans	-141.1	133	170.4	0	0	0	0	0	113.3
126	Y	27.5	Very low	27.8	Very low	233 Å²	233	128.5 Å²	128.5	91%	0.914	78%	0.781	S	S	*	*			trans	-67.3	135	177.5	-99.9	-124.3	0	0	0	111.4
127	S	26.2	Very low	27.7	Very low	89 Å²	89	130.7 Å²	130.7	62%	0.622	79%	0.785	S	S	*	*				85.6	126.7	80.3	-173.4	0	0	0	0	115.4
128	S	28.5	Very low	27.9	Very low	123 Å²	123	128.5 Å²	128.5	86%	0.86	78%	0.78	S	S	*	*			trans	-168	160.8	145.8	31	0	0	0	0	110.6
129	Y	26.5	Very low	27.7	Very low	217 Å²	217	127.7 Å²	127.7	85%	0.851	78%	0.781	S	S	*	*			trans	-104.3	170.4	-164.8	-104.8	-108.8	0	0	0	114.4
130	Q	26.4	Very low	27.5	Very low	171 Å²	171	127.8 Å²	127.8	80%	0.799	77%	0.773	S	S	*	*			trans	-58.2	173.1	161.6	-55.1	163.2	-67.9	0	0	110.8
131	S	28.3	Very low	27.3	Very low	94 Å²	94	129.4 Å²	129.4	66%	0.657	77%	0.773	S	S	*	*			cis	-169.7	160.5	30.2	-169.6	0	0	0	0	113.2
132	S	28.3	Very low	27.1	Very low	72 Å²	72	129.1 Å²	129.1	50%	0.503	77%	0.77	S	S	.	*			trans	45.9	132.1	142.2	59.4	0	0	0	0	120.2
133	Y	28.8	Very low	26.9	Very low	209 Å²	209	132.3 Å²	132.3	82%	0.82	77%	0.774	S	S	*	*				-161	-179.9	53.5	-85.4	-69.3	0	0	0	109.5
134	L	27.3	Very low	26.8	Very low	159 Å²	159	126.3 Å²	126.3	83%	0.832	77%	0.765	S	S	*	*			cis	-156.4	-179.4	0.8	-121.6	168.1	0	0	0	104.3
135	A	24.5	Very low	26.6	Very low	70 Å²	70	128.6 Å²	128.6	58%	0.579	77%	0.768	S	S	*	*			cis	-157.2	-169.1	5.5	0	0	0	0	0	110.6
136	S	26.2	Very low	26.5	Very low	120 Å²	120	132.5 Å²	132.5	84%	0.839	77%	0.771	S	S	*	*			trans	76.9	131.7	154.7	-58.3	0	0	0	0	120
137	S	24.6	Very low	26.6	Very low	118 Å²	118	129.4 Å²	129.4	83%	0.825	76%	0.758	S	S	*	*			trans	-125	-179.7	-179.7	-71.8	0	0	0	0	108.7
138	P	36.8	Very low	27	Very low	116 Å²	116	136.2 Å²	136.2	75%	0.753	77%	0.77	S	S	*	*			cis	-139.6	174.4	11.4	43	-24.9	0	0	0	117.6
139	A	25.6	Very low	27.2	Very low	100 Å²	100	137.9 Å²	137.9	83%	0.826	76%	0.762	S	S	*	*			trans	43.9	145.4	147.1	0	0	0	0	0	121.3
140	A	23.9	Very low	27.3	Very low	85 Å²	85	130.9 Å²	130.9	70%	0.702	74%	0.744	S	S	*	*			cis	-160.9	167.4	28.5	0	0	0	0	0	114.8
141	S	25.1	Very low	27.5	Very low	113 Å²	113	127.7 Å²	127.7	79%	0.79	74%	0.736	S	S	*	*			trans	49.6	103.3	152.5	59.2	0	0	0	0	120.5
142	S	24.8	Very low	27.8	Very low	116 Å²	116	125.2 Å²	125.2	81%	0.811	72%	0.719	S	S	*	*			trans	-97.7	150.4	154.7	54	0	0	0	0	111.1
143	I	24.2	Very low	28.2	Very low	155 Å²	155	130.6 Å²	130.6	80%	0.795	74%	0.736	S	S	*	*			trans	-101.8	112.6	-171.7	-60.3	173.5	0	0	0	110.8	L145	I143-L145 PolarHBondContact O-N 2.87Å
144	S	24.2	Very low	28.5	Very low	104 Å²	104	123.6 Å²	123.6	73%	0.727	72%	0.718	S	S	*	*			trans	-86.6	106.3	178	-55.5	0	0	0	0	112.7	N146	S144-N146 PolarHBondContact O-N 2.98Å
145	L	24.8	Very low	28.7	Very low	162 Å²	162	119.4 Å²	119.4	85%	0.848	70%	0.696	S	S	*	*			trans	-80.9	93.9	179.4	-70.5	169.1	0	0	0	112.8	I143 R147	I143-L145 PolarHBondContact O-N 2.87Å; L145-R147 PolarHBondContact O-N 3.33Å; L145-R147 VanDerWaalsContact O-N 3.12Å
146	N	24.9	Very low	29.3	Very low	157 Å²	157	122.1 Å²	122.1	84%	0.84	70%	0.7	S	S	*	*			trans	-79.8	90.5	177.5	-89.3	-27.7	0	0	0	113.5	S144 R148	S144-N146 PolarHBondContact O-N 2.98Å; N146-R148 PolarHBondContact O-N 2.72Å
147	R	29.3	Very low	29.7	Very low	167 Å²	167	120.3 Å²	120.3	63%	0.63	69%	0.687	S	S	*	*			trans	-78.3	109.4	173	-165.8	-172.8	-149.7	-154.3	10	110.9	L145	L145-R147 PolarHBondContact O-N 3.33Å; L145-R147 VanDerWaalsContact O-N 3.12Å
148	R	34.2	Very low	30.2	Very low	233 Å²	233	123.2 Å²	123.2	88%	0.879	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-80.8	136.3	172.2	-70.3	-172.9	176.2	-173.8	-1.6	111.3	N146	N146-R148 PolarHBondContact O-N 2.72Å
149	K	31.5	Very low	29.9	Very low	158 Å²	158	124.4 Å²	124.4	69%	0.687	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-91.7	160.3	172.5	-67	177.1	178.3	173.5	0	111.1
150	S	29.7	Very low	30.2	Very low	70 Å²	70	125.7 Å²	125.7	49%	0.49	67%	0.673	S	S	.	*	P	Polyproline II helix	trans	-65.3	137.6	159.4	56.9	0	0	0	0	109.9
151	V	30.6	Very low	30.5	Very low	104 Å²	104	126.8 Å²	126.8	63%	0.63	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-91.9	131.4	-168.1	177.1	0	0	0	0	111.6	L156	V151-L156 HydrophobicContact CG1-CG 4.34Å
152	S	33.8	Very low	30.9	Very low	41 Å²	41	125.8 Å²	125.8	29%	0.287	67%	0.668	S	S	.	*	P	Polyproline II helix	trans	-98.9	156	161.5	81.1	0	0	0	0	110.5	S154 D155	S152-S154 PolarHBondContact O-N 3.28Å; S152-S154 PolarHBondContact OG-N 3.15Å; S152-S154 PolarHBondContact OG-OG 2.93Å; S152-D155 WeakPolarHBondContact CB-OD2 3.28Å; S152-D155 PolarHBondContact N-OD2 3.44Å; S152-D155 PolarHBondContact O-N 3.25Å; S152-D155 PolarHBondContact OG-N 2.95Å; S152-D155 PolarHBondContact OG-OD2 2.76Å
153	Q	38.3	Very low	31	Very low	186 Å²	186	128 Å²	128	87%	0.869	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	-25.3	176.1	-87.4	-165.6	-20.2	0	0	113.3
154	S	33.6	Very low	31.1	Very low	62 Å²	62	125.9 Å²	125.9	43%	0.434	67%	0.669	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.6	-28.9	178.1	29.2	0	0	0	0	113.8	S152 L156 S157	S152-S154 PolarHBondContact O-N 3.28Å; S152-S154 PolarHBondContact OG-N 3.15Å; S152-S154 PolarHBondContact OG-OG 2.93Å; S154-L156 VanDerWaalsContact C-N 3.33Å; S154-L156 PolarHBondContact O-N 2.88Å; S154-S157 PolarHBondContact O-N 2.85Å; S154-S157 PolarHBondContact O-OG 3.37Å
155	D	32.7	Very low	31.1	Very low	70 Å²	70	129.7 Å²	129.7	37%	0.374	68%	0.68	S	S	.	*	G	3₁₀ helix	trans	-71.8	-27	-177.3	-63.6	-59.9	0	0	0	112.8	S152 S157	S152-D155 WeakPolarHBondContact CB-OD2 3.28Å; S152-D155 PolarHBondContact N-OD2 3.44Å; S152-D155 PolarHBondContact O-N 3.25Å; S152-D155 PolarHBondContact OG-N 2.95Å; S152-D155 PolarHBondContact OG-OD2 2.76Å; D155-S157 PolarHBondContact O-N 2.82Å
156	L	37.1	Very low	31.2	Very low	127 Å²	127	127.3 Å²	127.3	67%	0.665	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-66.9	-6.1	179.1	-70.3	170.1	0	0	0	114.4	V151 S154	V151-L156 HydrophobicContact CG1-CG 4.34Å; S154-L156 VanDerWaalsContact C-N 3.33Å; S154-L156 PolarHBondContact O-N 2.88Å
157	S	34.2	Very low	31.2	Very low	82 Å²	82	127.3 Å²	127.3	57%	0.573	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-96.3	-11.2	-172.1	66.4	0	0	0	0	115.4	S154 D155	S154-S157 PolarHBondContact O-N 2.85Å; S154-S157 PolarHBondContact O-OG 3.37Å; D155-S157 PolarHBondContact O-N 2.82Å
158	R	35	Very low	31.1	Very low	179 Å²	179	123.5 Å²	123.5	68%	0.675	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	-36.6	-171.3	-79.8	-176	161.6	121.8	-3	115.3	L160	R158-L160 PolarHBondContact O-N 2.85Å
159	D	29.8	Very low	30.7	Very low	141 Å²	141	117.9 Å²	117.9	75%	0.754	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-5.1	-169.7	-65.2	-12.8	0	0	0	114.7
160	L	32.7	Very low	30.6	Very low	128 Å²	128	116.2 Å²	116.2	67%	0.67	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	6.1	178.4	-73.7	171.3	0	0	0	114.5	R158	R158-L160 PolarHBondContact O-N 2.85Å
161	S	30.2	Very low	30.4	Very low	107 Å²	107	119 Å²	119	75%	0.748	70%	0.7	S	S	*	*	S	Bend	trans	-101.2	2.6	-171.6	-53.9	0	0	0	0	115.3
162	S	32.5	Very low	30.2	Very low	92 Å²	92	119.1 Å²	119.1	64%	0.643	71%	0.706	S	S	*	*	S	Bend	trans	-121.2	-1.1	-163.5	52.3	0	0	0	0	116.5
163	L	28	Very low	29.8	Very low	163 Å²	163	123.2 Å²	123.2	85%	0.853	73%	0.729	S	S	*	*			trans	-138.5	78.7	-173.8	-70.3	176	0	0	0	113.8
164	S	25.2	Very low	29.3	Very low	110 Å²	110	119.4 Å²	119.4	77%	0.769	72%	0.723	S	S	*	*			trans	-169.4	88.4	156.5	56.3	0	0	0	0	112.4
165	L	26.1	Very low	29	Very low	184 Å²	184	120.4 Å²	120.4	96%	0.963	74%	0.736	S	S	*	*			trans	-144.7	72.6	163.5	-85.1	-173.3	0	0	0	112.1
166	S	25.2	Very low	28.8	Very low	113 Å²	113	125 Å²	125	79%	0.79	76%	0.759	S	S	*	*			trans	-156.2	149.2	149.5	54.9	0	0	0	0	106.5
167	D	26.7	Very low	28.3	Very low	156 Å²	156	130 Å²	130	83%	0.834	77%	0.769	S	S	*	*			cis	-151.6	-177.9	9.8	-150.5	-16.9	0	0	0	111.6
168	A	26.1	Very low	27.9	Very low	88 Å²	88	130.8 Å²	130.8	73%	0.727	78%	0.775	S	S	*	*			trans	65.5	119.9	154.1	0	0	0	0	0	119.5
169	S	26.1	Very low	27.4	Very low	115 Å²	115	132.2 Å²	132.2	80%	0.804	78%	0.782	S	S	*	*			trans	-77.5	150.1	169.6	49.8	0	0	0	0	113.2
170	S	28.3	Very low	27.2	Very low	123 Å²	123	134.3 Å²	134.3	86%	0.86	79%	0.787	S	S	*	*			trans	-146.5	144.3	145.9	55.4	0	0	0	0	109.6
171	T	25.5	Very low	26.9	Very low	127 Å²	127	133.3 Å²	133.3	78%	0.779	79%	0.79	S	S	*	*			trans	-127.8	125.6	-163.9	-50.4	0	0	0	0	110.9
172	S	26.8	Very low	26.6	Very low	107 Å²	107	138.9 Å²	138.9	75%	0.748	80%	0.795	S	S	*	*			trans	-169.3	116.4	154.6	-84.8	0	0	0	0	112.9
173	T	26	Very low	26.3	Very low	127 Å²	127	139.8 Å²	139.8	78%	0.779	80%	0.797	S	S	*	*				22.7	145.7	127.4	51.4	0	0	0	0	121.4
174	S	28	Very low	26.3	Very low	106 Å²	106	141 Å²	141	74%	0.741	80%	0.795	S	S	*	*			cis	-174.2	165.2	-5.3	48.6	0	0	0	0	113.1
175	A	27.1	Very low	26.4	Very low	84 Å²	84	142.3 Å²	142.3	69%	0.694	79%	0.793	S	S	*	*			trans	63.5	110.6	146.4	0	0	0	0	0	122.4
176	L	28	Very low	26.5	Very low	167 Å²	167	139.7 Å²	139.7	87%	0.874	79%	0.785	S	S	*	*				43.9	127.1	120.7	-63.2	167	0	0	0	121
177	R	26.6	Very low	27.7	Very low	232 Å²	232	139.7 Å²	139.7	88%	0.875	78%	0.782	S	S	*	*				-152.2	139.1	122.2	-112.1	167.8	-165.5	-158.7	1.8	112.3
178	S	25.5	Very low	27.8	Very low	98 Å²	98	140.6 Å²	140.6	69%	0.685	78%	0.782	S	S	*	*			trans	-107.7	151.8	170.6	176.2	0	0	0	0	109
179	Y	24.7	Very low	28	Very low	209 Å²	209	140.1 Å²	140.1	82%	0.82	77%	0.773	S	S	*	*			trans	-143	140.7	161.2	-100.7	-76.7	0	0	0	111.8
180	H	26	Very low	28.3	Very low	185 Å²	185	143.6 Å²	143.6	86%	0.856	77%	0.769	S	S	*	*			trans	-138.3	125.6	-171.8	-127.4	6.9	0	0	0	109.1
181	S	26	Very low	28.4	Very low	107 Å²	107	143.8 Å²	143.8	75%	0.748	76%	0.761	S	S	*	*			trans	-167.8	138.6	158.5	-154.1	0	0	0	0	107.3
182	R	25	Very low	28.7	Very low	223 Å²	223	145.3 Å²	145.3	84%	0.842	76%	0.763	S	S	*	*			cis	65.8	135.5	39.3	-69.2	-160.7	164.8	-169.9	-3.4	113
183	T	26	Very low	28.8	Very low	112 Å²	112	143.2 Å²	143.2	69%	0.687	76%	0.758	S	S	*	*			cis	-166.8	179.1	-3.7	12.6	0	0	0	0	110
184	K	26.9	Very low	28.9	Very low	187 Å²	187	142.9 Å²	142.9	81%	0.813	76%	0.761	S	S	*	*			trans	84.3	150.9	168.3	-55.5	-179.5	178.7	-178.7	0	114.8
185	N	27.6	Very low	29	Very low	138 Å²	138	149.5 Å²	149.5	74%	0.738	77%	0.77	S	S	*	*			cis	174.1	129.4	-23.3	-94	5.3	0	0	0	102.4
186	V	28.7	Very low	29.7	Very low	130 Å²	130	151.5 Å²	151.5	79%	0.788	78%	0.776	S	S	*	*				66.4	136	78.2	171.2	0	0	0	0	112.3
187	P	49.3	Very low	29.6	Very low	113 Å²	113	147.1 Å²	147.1	73%	0.734	77%	0.77	S	S	*	*			cis	-128.8	174.7	13.3	42.6	-28.6	0	0	0	116.6
188	E	29.1	Very low	29.8	Very low	175 Å²	175	141.7 Å²	141.7	82%	0.818	77%	0.768	S	S	*	*				-159.1	152.6	113.6	-125.7	171.2	-166.6	0	0	111
189	S	30.8	Very low	30	Very low	78 Å²	78	142.5 Å²	142.5	55%	0.545	77%	0.774	S	S	.	*			trans	-95.1	-174.3	179.8	37.8	0	0	0	0	110.5
190	Y	33	Very low	30.1	Very low	187 Å²	187	137.1 Å²	137.1	73%	0.733	77%	0.767	S	S	*	*			cis	-158.6	166.3	26.3	-31.1	-109.6	0	0	0	107.6
191	D	29.2	Very low	30.1	Very low	128 Å²	128	135.7 Å²	135.7	68%	0.684	77%	0.765	S	S	*	*			cis	-158.2	168.5	-10.3	-132.1	-30.1	0	0	0	112.3
192	I	32.3	Very low	30.1	Very low	159 Å²	159	137.5 Å²	137.5	82%	0.815	77%	0.765	S	S	*	*			trans	23.5	132.9	155	-67.3	150.9	0	0	0	120.9
193	G	28.3	Very low	30.2	Very low	63 Å²	63	137.7 Å²	137.7	65%	0.649	77%	0.766	S	S	*	*			cis	169.9	176.8	-2.7	0	0	0	0	0	116
194	S	29.4	Very low	30.2	Very low	120 Å²	120	136.9 Å²	136.9	84%	0.839	77%	0.765	S	S	*	*			trans	45.8	121	157.1	-55.8	0	0	0	0	120.5
195	R	30.1	Very low	30.3	Very low	244 Å²	244	132.9 Å²	132.9	92%	0.921	76%	0.761	S	S	*	*			cis	62.8	150.8	24.6	-85.5	-171.7	173.8	-150	-0.9	115.7
196	P	40.7	Very low	30.4	Very low	127 Å²	127	133 Å²	133	83%	0.825	77%	0.766	S	S	*	*			cis	-110.4	-167.9	16.1	30.1	-10	0	0	0	113.3
197	G	27.3	Very low	30.4	Very low	74 Å²	74	135.6 Å²	135.6	76%	0.763	77%	0.77	S	S	*	*			cis	105.7	144.6	7.1	0	0	0	0	0	112.8
198	S	29.6	Very low	29.4	Very low	118 Å²	118	137.8 Å²	137.8	83%	0.825	77%	0.77	S	S	*	*			cis	168.1	100.3	-10.1	160.1	0	0	0	0	108.3
199	S	29.3	Very low	29.3	Very low	115 Å²	115	133.7 Å²	133.7	80%	0.804	77%	0.766	S	S	*	*			trans	179	161.9	168.6	46.8	0	0	0	0	109.7
200	S	26.5	Very low	29.1	Very low	97 Å²	97	138.4 Å²	138.4	68%	0.678	78%	0.777	S	S	*	*			cis	169.9	148.1	-37.6	56.1	0	0	0	0	107.1
201	L	27.3	Very low	28.8	Very low	154 Å²	154	135.4 Å²	135.4	81%	0.806	78%	0.784	S	S	*	*			trans	90.3	134.8	164.6	-55.2	173.7	0	0	0	121.3
202	L	26.6	Very low	28.8	Very low	146 Å²	146	134.2 Å²	134.2	76%	0.764	79%	0.785	S	S	*	*			trans	63.8	100.1	139.2	-66.4	167.7	0	0	0	123.7
203	R	26.3	Very low	28.7	Very low	226 Å²	226	132 Å²	132	85%	0.853	79%	0.785	S	S	*	*				61.7	121.1	108.4	-155.4	-166.2	-172.3	-166.4	3.1	121.3
204	S	26.8	Very low	28.8	Very low	96 Å²	96	134 Å²	134	67%	0.671	79%	0.788	S	S	*	*			trans	101.5	123.6	137.7	-114.1	0	0	0	0	122.7
205	S	27	Very low	28.8	Very low	103 Å²	103	133.3 Å²	133.3	72%	0.72	78%	0.783	S	S	*	*				70.7	105.1	126.8	-56.6	0	0	0	0	123
206	T	29.9	Very low	28.8	Very low	139 Å²	139	126.9 Å²	126.9	85%	0.853	78%	0.776	S	S	*	*			trans	-166.4	133.5	137.8	14.3	0	0	0	0	104.5
207	Q	29.3	Very low	28.3	Very low	185 Å²	185	125.3 Å²	125.3	86%	0.864	77%	0.768	S	S	*	*			cis	56.1	91.7	43.9	-72.7	-161	8.1	0	0	114.1
208	E	28.4	Very low	28.5	Very low	159 Å²	159	133.4 Å²	133.4	74%	0.743	78%	0.775	S	S	*	*				-155.3	148.4	113.9	-64.2	-151	133.9	0	0	107.1	F210	E208-F210 HydrophobicContact CB-CE2 4.19Å; E208-F210 WeakPolarHBondContact OE2-CE2 3.4Å
209	A	27.2	Very low	28.5	Very low	89 Å²	89	132.2 Å²	132.2	74%	0.736	77%	0.773	S	S	*	*			cis	91.9	72.5	13.5	0	0	0	0	0	116.9
210	F	27.1	Very low	28.4	Very low	177 Å²	177	135.9 Å²	135.9	78%	0.776	77%	0.771	S	S	*	*			trans	-133.6	126.8	165.1	-79	-77.3	0	0	0	113.3	E208	E208-F210 HydrophobicContact CB-CE2 4.19Å; E208-F210 WeakPolarHBondContact OE2-CE2 3.4Å
211	S	26.4	Very low	28.5	Very low	124 Å²	124	136.8 Å²	136.8	87%	0.867	78%	0.777	S	S	*	*			trans	-150.7	112	176.5	-71.6	0	0	0	0	111.4
212	S	29.3	Very low	28.6	Very low	103 Å²	103	133.2 Å²	133.2	72%	0.72	77%	0.765	S	S	*	*			trans	-167.4	130.2	165.2	0	0	0	0	0	106.5
213	S	29	Very low	28.8	Very low	114 Å²	114	132.1 Å²	132.1	80%	0.797	77%	0.769	S	S	*	*				68.1	135.9	53.9	83.5	0	0	0	0	112.5
214	S	31.1	Very low	28.9	Very low	103 Å²	103	125.5 Å²	125.5	72%	0.72	76%	0.763	S	S	*	*			cis	-157.3	154	16.5	50.8	0	0	0	0	115.6
215	S	30.1	Very low	28.9	Very low	106 Å²	106	133.5 Å²	133.5	74%	0.741	78%	0.778	S	S	*	*			trans	33.4	135.4	137.2	-47.6	0	0	0	0	123.7
216	S	29.1	Very low	28.9	Very low	109 Å²	109	137.2 Å²	137.2	76%	0.762	78%	0.784	S	S	*	*				170.5	118	102.2	-72.7	0	0	0	0	117.7
217	S	30.6	Very low	29.6	Very low	94 Å²	94	135.7 Å²	135.7	66%	0.657	78%	0.777	S	S	*	*			trans	42.6	135.2	136.3	69.5	0	0	0	0	126.1
218	R	32.3	Very low	29.5	Very low	244 Å²	244	133.1 Å²	133.1	92%	0.921	78%	0.779	S	S	*	*			trans	68.3	152.8	146.6	-68.1	167.8	-178.4	172.1	-0.1	117.5
219	A	29.6	Very low	29.7	Very low	94 Å²	94	130.3 Å²	130.3	78%	0.777	78%	0.777	S	S	*	*			cis	-165.4	-162.5	-23.3	0	0	0	0	0	106.1
220	Y	26.7	Very low	30	Very low	192 Å²	192	133.9 Å²	133.9	75%	0.753	78%	0.784	S	S	*	*			cis	-162.2	146.3	0.5	165.8	-93.2	0	0	0	107.7	S222	Y220-S222 VanDerWaalsContact OH-CB 3.28Å; Y220-S222 WeakPolarHBondContact OH-CB 3.37Å; Y220-S222 PolarHBondContact OH-OG 3.18Å
221	S	28.8	Very low	30.1	Very low	116 Å²	116	129.2 Å²	129.2	81%	0.811	79%	0.786	S	S	*	*			trans	-163.1	161	152.8	-155.8	0	0	0	0	112.5
222	S	29.6	Very low	30.4	Very low	79 Å²	79	132.1 Å²	132.1	55%	0.552	79%	0.788	S	S	*	*			trans	-149.2	149.1	-165.3	56.4	0	0	0	0	115	Y220	Y220-S222 VanDerWaalsContact OH-CB 3.28Å; Y220-S222 WeakPolarHBondContact OH-CB 3.37Å; Y220-S222 PolarHBondContact OH-OG 3.18Å
223	S	29.9	Very low	30.8	Very low	123 Å²	123	132.8 Å²	132.8	86%	0.86	79%	0.792	S	S	*	*			trans	-158.4	115	154.1	55.7	0	0	0	0	109.5
224	A	28.4	Very low	30.9	Very low	86 Å²	86	134.9 Å²	134.9	71%	0.711	80%	0.795	S	S	*	*			trans	-90.7	174.6	168.4	0	0	0	0	0	110.4
225	W	27.6	Very low	31.1	Very low	264 Å²	264	135.9 Å²	135.9	100%	1	80%	0.796	S	S	*	*			trans	-162.4	150.1	134.6	-92.1	11.5	0	0	0	107.6
226	E	26.9	Very low	31.5	Very low	181 Å²	181	136.9 Å²	136.9	85%	0.846	80%	0.801	S	S	*	*			trans	-125.5	-175.3	-178.1	-74.2	-163	140.9	0	0	109.5
227	P	44.5	Very low	31.6	Very low	108 Å²	108	136.7 Å²	136.7	70%	0.701	80%	0.799	S	S	*	*				-127.5	175.7	-57.2	36.4	-22.6	0	0	0	111.6
228	S	27.8	Very low	31.8	Very low	130 Å²	130	143.5 Å²	143.5	91%	0.909	81%	0.811	S	S	*	*			trans	-158	163.5	157.9	-85.8	0	0	0	0	111.6
229	S	32.3	Very low	31.8	Very low	100 Å²	100	138.7 Å²	138.7	70%	0.699	80%	0.803	S	S	*	*			trans	-114.4	166.2	-150.4	54.9	0	0	0	0	116.5
230	N	32.1	Very low	32.2	Very low	164 Å²	164	139.4 Å²	139.4	88%	0.877	80%	0.802	S	S	*	*			trans	65.6	115.2	162.5	-63.4	-7.6	0	0	0	118.7
231	G	29.3	Very low	32.7	Very low	79 Å²	79	136 Å²	136	81%	0.814	80%	0.802	S	S	*	*			trans	-167.4	128.3	164.8	0	0	0	0	0	109.7
232	M	32.6	Very low	33.2	Very low	186 Å²	186	138 Å²	138	92%	0.916	80%	0.803	S	S	*	*			trans	-65.5	157.1	-169.4	-73.1	119.1	67.8	0	0	114.4
233	S	39	Very low	33.7	Very low	116 Å²	116	139.4 Å²	139.4	81%	0.811	81%	0.813	S	S	*	*			trans	-55.4	131.7	169.2	52.6	0	0	0	0	113.2
234	D	31.4	Very low	34.7	Very low	158 Å²	158	143 Å²	143	85%	0.845	81%	0.813	S	S	*	*			trans	-149.8	117.1	145.2	-128.2	-24.2	0	0	0	110.3
235	T	34.8	Very low	36.2	Very low	124 Å²	124	143.2 Å²	143.2	76%	0.761	81%	0.809	S	S	*	*			trans	-85.4	122.8	172.5	41.3	0	0	0	0	108.4	S237	T235-S237 PolarHBondContact O-N 2.93Å
236	P	37.7	Very low	38.2	Very low	128 Å²	128	132.7 Å²	132.7	83%	0.831	78%	0.779	S	S	*	*			trans	-64.4	106.2	-177.9	24.7	-33	0	0	0	109.8	R238	P236-R238 PolarHBondContact O-N 2.86Å
237	S	31	Very low	41	Very low	104 Å²	104	129 Å²	129	73%	0.727	76%	0.762	S	S	*	*			trans	-54	127.9	-179.1	-176.9	0	0	0	0	110.3	T235 N239	T235-S237 PolarHBondContact O-N 2.93Å; S237-N239 VanDerWaalsContact C-N 3.28Å; S237-N239 PolarHBondContact O-N 2.74Å
238	R	35.9	Very low	43.1	Very low	238 Å²	238	124 Å²	124	90%	0.898	73%	0.729	S	S	*	*			trans	-68.3	86.4	179.8	-179.4	179.7	173.8	-176.2	-1.9	108.9	P236 S240	P236-R238 PolarHBondContact O-N 2.86Å; R238-S240 PolarHBondContact O-N 3.45Å
239	N	31.5	Very low	46.3	Very low	143 Å²	143	119.8 Å²	119.8	77%	0.765	70%	0.696	S	S	*	*			trans	-47.3	109.1	-172.2	-104.1	-22.8	0	0	0	111.8	S237 T241	S237-N239 VanDerWaalsContact C-N 3.28Å; S237-N239 PolarHBondContact O-N 2.74Å; N239-T241 PolarHBondContact O-N 3.26Å
240	S	38.5	Very low	49.3	Very low	109 Å²	109	115.3 Å²	115.3	76%	0.762	66%	0.664	S	S	*	*			trans	-79.6	63.2	-177.1	-178	0	0	0	0	111	R238 N242	R238-S240 PolarHBondContact O-N 3.45Å; S240-N242 PolarHBondContact O-N 2.91Å
241	T	37.1	Very low	52.3	Low	120 Å²	120	107.5 Å²	107.5	74%	0.736	62%	0.623	S	S	*	*			trans	-56.9	128.7	158.9	52.1	0	0	0	0	108	N239 S243	N239-T241 PolarHBondContact O-N 3.26Å; T241-S243 VanDerWaalsContact C-N 3.26Å; T241-S243 PolarHBondContact O-N 3.14Å
242	N	39.4	Very low	55.6	Low	159 Å²	159	103.8 Å²	103.8	85%	0.85	58%	0.584	S	S	*	*			trans	-67.5	81.2	-173.2	-111.4	-33.7	0	0	0	111.7	S240 K244	S240-N242 PolarHBondContact O-N 2.91Å; N242-K244 VanDerWaalsContact C-N 3.29Å; N242-K244 PolarHBondContact O-N 3.08Å
243	S	40.9	Very low	58.7	Low	107 Å²	107	99.1 Å²	99.1	75%	0.748	56%	0.559	S	S	*	*			trans	-64.7	90.1	168.4	171.1	0	0	0	0	108.4	T241 S245	T241-S243 VanDerWaalsContact C-N 3.26Å; T241-S243 PolarHBondContact O-N 3.14Å; S243-S245 PolarHBondContact O-N 3.2Å
244	K	50.4	Low	61.5	Low	198 Å²	198	96.4 Å²	96.4	86%	0.861	54%	0.536	S	S	*	.			trans	-52.9	108.2	165.1	-68	-178.7	-179.5	178.4	0	107.3	N242 A246	N242-K244 VanDerWaalsContact C-N 3.29Å; N242-K244 PolarHBondContact O-N 3.08Å; K244-A246 PolarHBondContact O-N 3.19Å
245	S	59.4	Low	64.6	Low	91 Å²	91	91 Å²	91	64%	0.636	51%	0.507	S	S	*	.			trans	-53.9	124.9	175.7	50.1	0	0	0	0	108.5	S243 Q247	S243-S245 PolarHBondContact O-N 3.2Å; S245-Q247 PolarHBondContact O-N 3.46Å
246	A	68.8	Low	67.5	Low	43 Å²	43	86.6 Å²	86.6	36%	0.355	49%	0.486	S	S	.	.			trans	-67.8	97.2	-172.2	0	0	0	0	0	110.5	K244 L249	K244-A246 PolarHBondContact O-N 3.19Å; A246-L249 HydrophobicContact CB-CD1 3.47Å; A246-L249 VanDerWaalsContact CB-CD1 3.47Å; A246-L249 HydrophobicContact CB-CG 4.04Å; A246-L249 WeakPolarHBondContact O-CG 3.3Å
247	Q	86.4	Confident	70.3	Confident	105 Å²	105	83.7 Å²	83.7	49%	0.491	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	153.1	178.3	-69.7	171.3	-28	0	0	111.1	S245 L249 W309 N546	S245-Q247 PolarHBondContact O-N 3.46Å; Q247-L249 VanDerWaalsContact C-N 3.3Å; Q247-L249 PolarHBondContact O-N 2.97Å; Q247-W309 HydrophobicContact CB-CE3 3.8Å; Q247-W309 HydrophobicContact CB-CZ3 4.17Å; Q247-W309 WeakPolarHBondContact O-CZ3 3.06Å; Q247-N546 PolarHBondContact O-ND2 2.97Å
248	G	89.4	Confident	73.5	Confident	1 Å²	1	78.9 Å²	78.9	1%	0.01	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.4	-2.7	-178.9	0	0	0	0	0	115	V250 M308 F555	G248-V250 PolarHBondContact O-N 2.79Å; G248-M308 WeakPolarHBondContact CA-O 3.44Å; G248-M308 PolarHBondContact N-O 2.82Å; G248-F555 WeakPolarHBondContact O-CE1 3.37Å
249	L	93.9	Very high	76.4	Confident	42 Å²	42	67.7 Å²	67.7	22%	0.22	39%	0.387	C	S	.	.			trans	-84.8	44.5	179.1	-59.3	-170.9	0	0	0	113.3	A246 Q247 N546 Y553 F555 V560	A246-L249 HydrophobicContact CB-CD1 3.47Å; A246-L249 VanDerWaalsContact CB-CD1 3.47Å; A246-L249 HydrophobicContact CB-CG 4.04Å; A246-L249 WeakPolarHBondContact O-CG 3.3Å; Q247-L249 VanDerWaalsContact C-N 3.3Å; Q247-L249 PolarHBondContact O-N 2.97Å; L249-N546 HydrophobicContact CD2-CB 4.49Å; L249-Y553 HydrophobicContact CD1-CD1 3.98Å; L249-Y553 HydrophobicContact CD1-CE1 3.42Å; L249-Y553 VanDerWaalsContact CD1-CE1 3.42Å; L249-Y553 HydrophobicContact CD1-CE2 4.23Å; L249-Y553 HydrophobicContact CD2-CD1 3.72Å; L249-Y553 HydrophobicContact CD2-CD2 3.58Å; L249-Y553 HydrophobicContact CD2-CE1 3.92Å; L249-Y553 HydrophobicContact CD2-CE2 3.77Å; L249-Y553 HydrophobicContact CD2-CG 3.56Å; L249-Y553 HydrophobicContact CG-CD1 4.48Å; L249-Y553 HydrophobicContact CG-CE1 4.33Å; L249-F555 HydrophobicContact CD2-CZ 4.1Å; L249-V560 HydrophobicContact CB-CG1 4.3Å; L249-V560 HydrophobicContact CD2-CG1 4.42Å
250	V	94.8	Very high	79.6	Confident	6 Å²	6	61.4 Å²	61.4	4%	0.036	35%	0.353	C	S	.	.			trans	-109.2	128.6	-173.3	178.6	0	0	0	0	110.5	G248 Q266 M308 V317	G248-V250 PolarHBondContact O-N 2.79Å; V250-Q266 PolarHBondContact O-NE2 3.44Å; V250-M308 WeakPolarHBondContact CG2-O 3.24Å; V250-V317 HydrophobicContact CG1-CB 4.33Å; V250-V317 HydrophobicContact CG1-CG2 3.53Å
251	G	96.9	Very high	82.5	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.01	32%	0.318	C	S	.	.			trans	-75.7	162.7	177.8	0	0	0	0	0	113.2	A316 V317 D557	G251-A316 CarbonylContact O-C 2.86Å; G251-A316 VanDerWaalsContact O-CA 3.26Å; G251-A316 WeakPolarHBondContact O-CA 3.29Å; G251-V317 PolarHBondContact O-N 2.81Å; G251-D557 CarbonylContact C-O 3.56Å; G251-D557 WeakPolarHBondContact CA-O 3.4Å
252	L	98.4	Very high	85.4	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-116.6	129.3	174.7	-67.5	175.6	0	0	0	110.8	N254 N262 L265 Q266 L304 M308 V317 D557 S558	L252-N254 PolarHBondContact O-N 3.09Å; L252-N262 HydrophobicContact CB-CB 4.11Å; L252-N262 HydrophobicContact CD1-CB 4.22Å; L252-L265 HydrophobicContact CD1-CB 3.77Å; L252-L265 HydrophobicContact CD1-CD1 3.98Å; L252-Q266 HydrophobicContact CD1-CG 4.33Å; L252-L304 HydrophobicContact CD2-CD1 4.02Å; L252-M308 HydrophobicContact CD1-CE 4.32Å; L252-M308 HydrophobicContact CD2-CE 4.42Å; L252-M308 HydrophobicContact CD2-SD 4.14Å; L252-M308 HydrophobicContact CG-CE 4.36Å; L252-V317 CarbonylContact C-O 3.49Å; L252-V317 WeakPolarHBondContact CA-O 3.22Å; L252-V317 HydrophobicContact CD2-CB 4.24Å; L252-D557 PolarHBondContact N-O 2.87Å; L252-D557 CarbonylContact O-C 3.57Å; L252-D557 VanDerWaalsContact O-CA 3.24Å; L252-D557 WeakPolarHBondContact O-CA 3.47Å; L252-D557 WeakPolarHBondContact O-CB 3.4Å; L252-S558 PolarHBondContact O-N 2.68Å; L252-S558 PolarHBondContact O-OG 2.86Å
253	K	98.2	Very high	88.2	Confident	89 Å²	89	43.4 Å²	43.4	39%	0.387	24%	0.244	S	C	.	.			trans	-64.9	132.2	177.1	-74.8	166.9	169.5	142.6	0	110	L255 N262 A316 V317 S558	K253-L255 HydrophobicContact CB-CD2 4.44Å; K253-L255 PolarHBondContact O-N 3.35Å; K253-N262 PolarHBondContact O-ND2 2.84Å; K253-A316 WeakPolarHBondContact CD-O 3.19Å; K253-A316 WeakPolarHBondContact CE-O 3.49Å; K253-A316 HydrophobicContact CG-CB 3.96Å; K253-A316 PolarHBondContact NZ-O 2.96Å; K253-V317 PolarHBondContact N-O 2.98Å; K253-S558 WeakPolarHBondContact CA-OG 3.39Å
254	N	97.6	Very high	91	Very high	59 Å²	59	38.3 Å²	38.3	32%	0.316	21%	0.208	S	C	.	.			trans	-77.9	120.2	173.2	-165.4	-33	0	0	0	108.9	L252 G256 N257 T258 D557	L252-N254 PolarHBondContact O-N 3.09Å; N254-G256 VanDerWaalsContact C-N 3.29Å; N254-G256 PolarHBondContact O-N 3.12Å; N254-G256 PolarHBondContact OD1-N 2.63Å; N254-G256 VanDerWaalsContact OD1-N 3.07Å; N254-N257 PolarHBondContact OD1-N 2.81Å; N254-N257 VanDerWaalsContact OD1-N 3.16Å; N254-T258 WeakPolarHBondContact CA-OG1 3.29Å; N254-T258 PolarHBondContact OD1-N 3.15Å; N254-T258 PolarHBondContact OD1-OG1 2.94Å; N254-D557 HydrophobicContact CB-CB 4.18Å; N254-D557 WeakPolarHBondContact CB-OD2 3.42Å; N254-D557 PolarHBondContact ND2-OD2 3.42Å
255	L	96.6	Very high	93.3	Very high	45 Å²	45	28.9 Å²	28.9	24%	0.236	17%	0.168	C	C	.	.			trans	-94.1	22.6	-176.9	-51.3	179.1	0	0	0	112.6	K253 T258 P319 K323 Y336	K253-L255 HydrophobicContact CB-CD2 4.44Å; K253-L255 PolarHBondContact O-N 3.35Å; L255-T258 HydrophobicContact CB-CG2 3.92Å; L255-T258 PolarHBondContact N-OG1 2.96Å; L255-P319 HydrophobicContact CD1-CG 3.96Å; L255-P319 HydrophobicContact CG-CG 4.34Å; L255-K323 HydrophobicContact CB-CD 4.45Å; L255-K323 HydrophobicContact CD1-CB 4.26Å; L255-K323 HydrophobicContact CD1-CD 4.15Å; L255-Y336 WeakPolarHBondContact O-CD1 3.39Å; L255-Y336 VanDerWaalsContact O-CE1 3.25Å; L255-Y336 WeakPolarHBondContact O-CE1 3.21Å
256	G	94.9	Very high	95.2	Very high	31 Å²	31	24.7 Å²	24.7	32%	0.32	14%	0.138	S	C	.	.	S	Bend	trans	97.7	100.2	-173.5	0	0	0	0	0	111.6	N254 T258	N254-G256 VanDerWaalsContact C-N 3.29Å; N254-G256 PolarHBondContact O-N 3.12Å; N254-G256 PolarHBondContact OD1-N 2.63Å; N254-G256 VanDerWaalsContact OD1-N 3.07Å; G256-T258 WeakPolarHBondContact O-CG2 3.27Å; G256-T258 PolarHBondContact O-N 2.83Å; G256-T258 VanDerWaalsContact O-N 3.11Å
257	N	96.7	Very high	96.6	Very high	67 Å²	67	22.7 Å²	22.7	36%	0.358	12%	0.121	S	C	.	.	S	Bend	trans	57.8	15.2	-177.9	-74.6	-47.6	0	0	0	116.1	N254 C259 F260 Y336 Q338	N254-N257 PolarHBondContact OD1-N 2.81Å; N254-N257 VanDerWaalsContact OD1-N 3.16Å; N257-C259 VanDerWaalsContact C-N 3.28Å; N257-C259 PolarHBondContact O-N 2.94Å; N257-F260 WeakPolarHBondContact O-CD1 3.49Å; N257-F260 VanDerWaalsContact O-CE1 3.31Å; N257-F260 WeakPolarHBondContact O-CE1 3.33Å; N257-Y336 WeakPolarHBondContact CB-O 3.5Å; N257-Y336 PolarHBondContact ND2-O 2.85Å; N257-Q338 HydrophobicContact CB-CG 3.71Å; N257-Q338 VanDerWaalsContact CG-CG 3.48Å; N257-Q338 VanDerWaalsContact OD1-CG 3.29Å; N257-Q338 WeakPolarHBondContact OD1-CG 3.42Å; N257-Q338 PolarHBondContact OD1-NE2 3.02Å
258	T	97.6	Very high	97.2	Very high	2 Å²	2	17.7 Å²	17.7	1%	0.012	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	13	-174.2	60	0	0	0	0	115.4	N254 L255 G256 F260 M261 N262 K323	N254-T258 WeakPolarHBondContact CA-OG1 3.29Å; N254-T258 PolarHBondContact OD1-N 3.15Å; N254-T258 PolarHBondContact OD1-OG1 2.94Å; L255-T258 HydrophobicContact CB-CG2 3.92Å; L255-T258 PolarHBondContact N-OG1 2.96Å; G256-T258 WeakPolarHBondContact O-CG2 3.27Å; G256-T258 PolarHBondContact O-N 2.83Å; G256-T258 VanDerWaalsContact O-N 3.11Å; T258-F260 PolarHBondContact O-N 2.91Å; T258-M261 HydrophobicContact CG2-CE 4.33Å; T258-M261 WeakPolarHBondContact O-CB 3.33Å; T258-M261 PolarHBondContact O-N 3.23Å; T258-N262 PolarHBondContact O-N 2.77Å; T258-K323 HydrophobicContact CG2-CD 4.25Å
259	C	98.1	Very high	97.6	Very high	3 Å²	3	17.6 Å²	17.6	2%	0.02	10%	0.097	C	C	.	.	H	α-helix	trans	-61.3	-30.1	-178.2	53.6	0	0	0	0	113.1	N257 M261 N262 S263 H539 Y540 D557	N257-C259 VanDerWaalsContact C-N 3.28Å; N257-C259 PolarHBondContact O-N 2.94Å; C259-M261 VanDerWaalsContact C-N 3.34Å; C259-M261 PolarHBondContact O-N 3.2Å; C259-N262 PolarHBondContact O-N 2.87Å; C259-S263 WeakPolarHBondContact O-CB 3.34Å; C259-S263 PolarHBondContact O-N 2.81Å; C259-H539 WeakPolarHBondContact CB-CE1 3.12Å; C259-H539 WeakPolarHBondContact CB-ND1 3.14Å; C259-H539 PolarHBondContact SG-ND1 2.79Å; C259-Y540 WeakPolarHBondContact O-CB 3.26Å; C259-Y540 PolarHBondContact SG-N 3.26Å; C259-D557 WeakPolarHBondContact CA-OD1 3.31Å
260	F	98.2	Very high	97.7	Very high	12 Å²	12	15.7 Å²	15.7	5%	0.053	9%	0.087	C	C	.	.	H	α-helix	trans	-59.5	-44.1	172.5	69.5	-88.3	0	0	0	111.7	N257 T258 I264 F333 Q339 A341 F344 Y540	N257-F260 WeakPolarHBondContact O-CD1 3.49Å; N257-F260 VanDerWaalsContact O-CE1 3.31Å; N257-F260 WeakPolarHBondContact O-CE1 3.33Å; T258-F260 PolarHBondContact O-N 2.91Å; F260-I264 WeakPolarHBondContact O-CG1 3.28Å; F260-I264 PolarHBondContact O-N 2.81Å; F260-F333 HydrophobicContact CE2-CD1 4.29Å; F260-Q339 HydrophobicContact CD1-CB 3.93Å; F260-Q339 HydrophobicContact CD1-CG 4.41Å; F260-Q339 HydrophobicContact CD2-CB 3.89Å; F260-Q339 HydrophobicContact CE1-CB 3.77Å; F260-Q339 HydrophobicContact CE1-CG 3.76Å; F260-Q339 HydrophobicContact CE2-CB 3.73Å; F260-Q339 HydrophobicContact CE2-CG 4.07Å; F260-Q339 HydrophobicContact CG-CB 4.01Å; F260-Q339 HydrophobicContact CZ-CB 3.69Å; F260-Q339 HydrophobicContact CZ-CG 3.58Å; F260-A341 HydrophobicContact CB-CB 4.2Å; F260-F344 HydrophobicContact CD2-CB 3.76Å; F260-F344 HydrophobicContact CD2-CD1 4.43Å; F260-F344 HydrophobicContact CD2-CD2 4.18Å; F260-F344 AromaticContact CD2-CG 3.84Å; F260-F344 HydrophobicContact CD2-CG 3.84Å; F260-F344 HydrophobicContact CE2-CB 3.98Å; F260-F344 AromaticContact CE2-CD2 3.68Å; F260-F344 HydrophobicContact CE2-CD2 3.68Å; F260-F344 HydrophobicContact CE2-CE2 4.41Å; F260-F344 AromaticContact CE2-CG 3.84Å; F260-F344 HydrophobicContact CE2-CG 3.84Å; F260-Y540 HydrophobicContact CB-CD2 3.56Å; F260-Y540 HydrophobicContact CB-CE2 3.65Å; F260-Y540 HydrophobicContact CB-CG 4.12Å
261	M	98.6	Very high	97.9	Very high	3 Å²	3	15.4 Å²	15.4	2%	0.015	9%	0.085	C	C	.	.	H	α-helix	trans	-67.7	-47.2	177.3	171.3	179.7	90.8	0	0	110.2	T258 C259 S263 I264 L265 P319 F322 K323 F344	T258-M261 HydrophobicContact CG2-CE 4.33Å; T258-M261 WeakPolarHBondContact O-CB 3.33Å; T258-M261 PolarHBondContact O-N 3.23Å; C259-M261 VanDerWaalsContact C-N 3.34Å; C259-M261 PolarHBondContact O-N 3.2Å; M261-S263 PolarHBondContact O-N 3.31Å; M261-I264 PolarHBondContact O-N 2.97Å; M261-L265 HydrophobicContact CE-CD1 4.47Å; M261-L265 HydrophobicContact CG-CD1 3.66Å; M261-L265 HydrophobicContact CG-CG 4.26Å; M261-L265 WeakPolarHBondContact O-CB 3.13Å; M261-L265 VanDerWaalsContact O-CG 3.25Å; M261-L265 WeakPolarHBondContact O-CG 3.36Å; M261-L265 PolarHBondContact O-N 2.85Å; M261-P319 HydrophobicContact CE-CB 3.91Å; M261-P319 HydrophobicContact CE-CG 3.6Å; M261-F322 HydrophobicContact CG-CE1 4Å; M261-F322 HydrophobicContact SD-CD1 3.97Å; M261-F322 HydrophobicContact SD-CE1 3.78Å; M261-K323 HydrophobicContact CE-CB 4.2Å; M261-K323 HydrophobicContact CE-CG 4.44Å; M261-K323 HydrophobicContact SD-CB 4.25Å; M261-K323 HydrophobicContact SD-CG 4.26Å; M261-F344 HydrophobicContact CB-CE1 4.13Å; M261-F344 HydrophobicContact CB-CE2 4.19Å; M261-F344 HydrophobicContact CB-CZ 3.96Å; M261-F344 HydrophobicContact CG-CE1 4Å; M261-F344 HydrophobicContact CG-CE2 4.01Å; M261-F344 HydrophobicContact CG-CZ 3.53Å; M261-F344 HydrophobicContact SD-CE2 4.46Å; M261-F344 HydrophobicContact SD-CZ 4.37Å
262	N	98.7	Very high	97.8	Very high	4 Å²	4	18.6 Å²	18.6	2%	0.021	10%	0.1	C	C	.	.	H	α-helix	trans	-60.5	-43.1	179.6	-68.7	-14.2	0	0	0	111.9	L252 K253 T258 C259 L265 Q266 D557	L252-N262 HydrophobicContact CB-CB 4.11Å; L252-N262 HydrophobicContact CD1-CB 4.22Å; K253-N262 PolarHBondContact O-ND2 2.84Å; T258-N262 PolarHBondContact O-N 2.77Å; C259-N262 PolarHBondContact O-N 2.87Å; N262-L265 PolarHBondContact O-N 2.87Å; N262-Q266 VanDerWaalsContact O-CG 3.24Å; N262-Q266 WeakPolarHBondContact O-CG 3.47Å; N262-Q266 PolarHBondContact O-N 3.48Å; N262-D557 PolarHBondContact ND2-OD1 2.86Å
263	S	98.8	Very high	97.7	Very high	3 Å²	3	20.5 Å²	20.5	2%	0.021	11%	0.113	C	C	.	.	H	α-helix	trans	-59.2	-48.7	176.5	-179.2	0	0	0	0	112.4	C259 M261 Q266 C267 S529 T541 A542	C259-S263 WeakPolarHBondContact O-CB 3.34Å; C259-S263 PolarHBondContact O-N 2.81Å; M261-S263 PolarHBondContact O-N 3.31Å; S263-Q266 PolarHBondContact O-N 3.07Å; S263-C267 PolarHBondContact O-N 3.43Å; S263-C267 VanDerWaalsContact O-N 3.11Å; S263-C267 PolarHBondContact O-SG 2.81Å; S263-S529 WeakPolarHBondContact OG-CB 3.2Å; S263-S529 PolarHBondContact OG-OG 3.06Å; S263-T541 PolarHBondContact OG-O 3.46Å; S263-T541 VanDerWaalsContact OG-O 3.05Å; S263-A542 WeakPolarHBondContact O-CB 3.41Å
264	I	98.8	Very high	97.6	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-67.3	-40.3	179.3	-67.2	-61.1	0	0	0	112	F260 M261 Q266 C267 L268 A341 F344 L345 L348 F577	F260-I264 WeakPolarHBondContact O-CG1 3.28Å; F260-I264 PolarHBondContact O-N 2.81Å; M261-I264 PolarHBondContact O-N 2.97Å; I264-Q266 VanDerWaalsContact C-N 3.3Å; I264-Q266 PolarHBondContact O-N 3.44Å; I264-C267 PolarHBondContact O-N 3.42Å; I264-L268 HydrophobicContact CG2-CD1 3.91Å; I264-L268 HydrophobicContact CG2-CG 4.29Å; I264-L268 WeakPolarHBondContact O-CB 3.43Å; I264-L268 WeakPolarHBondContact O-CG 3.38Å; I264-L268 PolarHBondContact O-N 2.86Å; I264-A341 HydrophobicContact CD1-CB 4.13Å; I264-A341 HydrophobicContact CG1-CB 3.91Å; I264-A341 WeakPolarHBondContact CG1-O 3.36Å; I264-F344 HydrophobicContact CB-CD1 3.83Å; I264-F344 HydrophobicContact CB-CE1 3.98Å; I264-F344 HydrophobicContact CG1-CD1 4.09Å; I264-F344 HydrophobicContact CG2-CD1 3.85Å; I264-F344 HydrophobicContact CG2-CE1 3.86Å; I264-L345 HydrophobicContact CD1-CB 4.1Å; I264-L345 HydrophobicContact CD1-CD2 4.45Å; I264-L345 HydrophobicContact CG1-CB 4.39Å; I264-L345 HydrophobicContact CG2-CB 4.02Å; I264-L345 HydrophobicContact CG2-CD1 3.74Å; I264-L345 HydrophobicContact CG2-CG 4.45Å; I264-L348 HydrophobicContact CG2-CD2 4.48Å; I264-F577 HydrophobicContact CD1-CE2 4.38Å; I264-F577 HydrophobicContact CD1-CZ 4.1Å
265	L	98.8	Very high	97.6	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-59.6	-40.2	175	-74.7	171.1	0	0	0	111.9	L252 M261 N262 L268 S269 F301 L304 P319 F322 L348	L252-L265 HydrophobicContact CD1-CB 3.77Å; L252-L265 HydrophobicContact CD1-CD1 3.98Å; M261-L265 HydrophobicContact CE-CD1 4.47Å; M261-L265 HydrophobicContact CG-CD1 3.66Å; M261-L265 HydrophobicContact CG-CG 4.26Å; M261-L265 WeakPolarHBondContact O-CB 3.13Å; M261-L265 VanDerWaalsContact O-CG 3.25Å; M261-L265 WeakPolarHBondContact O-CG 3.36Å; M261-L265 PolarHBondContact O-N 2.85Å; N262-L265 PolarHBondContact O-N 2.87Å; L265-L268 PolarHBondContact O-N 2.83Å; L265-S269 WeakPolarHBondContact O-CB 3.47Å; L265-S269 PolarHBondContact O-N 3.23Å; L265-F301 HydrophobicContact CD2-CD2 3.95Å; L265-F301 HydrophobicContact CD2-CE2 3.89Å; L265-L304 HydrophobicContact CD1-CD2 3.88Å; L265-L304 HydrophobicContact CD2-CD2 4.27Å; L265-P319 HydrophobicContact CD1-CB 4.31Å; L265-F322 HydrophobicContact CD1-CD1 3.93Å; L265-F322 HydrophobicContact CD1-CE1 3.83Å; L265-F322 HydrophobicContact CD2-CD1 4.33Å; L265-F322 HydrophobicContact CD2-CE1 3.83Å; L265-F322 HydrophobicContact CD2-CE2 4.29Å; L265-F322 HydrophobicContact CD2-CZ 3.81Å; L265-F322 HydrophobicContact CG-CE1 4.2Å; L265-L348 HydrophobicContact CD2-CD2 4.32Å
266	Q	98.6	Very high	97.6	Very high	3 Å²	3	14.9 Å²	14.9	1%	0.014	9%	0.086	C	C	.	.	H	α-helix	trans	-66.9	-41	176.3	-67.5	-71.6	6.9	0	0	112.4	V250 L252 N262 S263 I264 S269 N270 M308 A542 F555	V250-Q266 PolarHBondContact O-NE2 3.44Å; L252-Q266 HydrophobicContact CD1-CG 4.33Å; N262-Q266 VanDerWaalsContact O-CG 3.24Å; N262-Q266 WeakPolarHBondContact O-CG 3.47Å; N262-Q266 PolarHBondContact O-N 3.48Å; S263-Q266 PolarHBondContact O-N 3.07Å; I264-Q266 VanDerWaalsContact C-N 3.3Å; I264-Q266 PolarHBondContact O-N 3.44Å; Q266-S269 PolarHBondContact O-N 3.38Å; Q266-N270 PolarHBondContact O-N 2.78Å; Q266-N270 VanDerWaalsContact O-N 3.11Å; Q266-N270 PolarHBondContact O-ND2 3.29Å; Q266-M308 VanDerWaalsContact CD-CE 3.41Å; Q266-M308 HydrophobicContact CG-CE 4.48Å; Q266-A542 HydrophobicContact CB-CB 3.78Å; Q266-F555 HydrophobicContact CB-CB 4.25Å; Q266-F555 HydrophobicContact CB-CG 4.27Å; Q266-F555 HydrophobicContact CG-CB 3.78Å; Q266-F555 HydrophobicContact CG-CD1 4.03Å; Q266-F555 HydrophobicContact CG-CG 3.98Å; Q266-F555 VanDerWaalsContact NE2-CD1 3.33Å; Q266-F555 VanDerWaalsContact OE1-CD1 3.31Å
267	C	98.8	Very high	97.7	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-62.6	-45.1	174.7	-62	0	0	0	0	111.8	S263 I264 N270 T271 A527 F577	S263-C267 PolarHBondContact O-N 3.43Å; S263-C267 VanDerWaalsContact O-N 3.11Å; S263-C267 PolarHBondContact O-SG 2.81Å; I264-C267 PolarHBondContact O-N 3.42Å; C267-N270 PolarHBondContact O-N 3.43Å; C267-T271 PolarHBondContact O-N 2.89Å; C267-T271 PolarHBondContact O-OG1 3.23Å; C267-A527 HydrophobicContact CB-CB 3.92Å; C267-F577 HydrophobicContact CB-CD1 4.34Å; C267-F577 HydrophobicContact CB-CD2 3.77Å; C267-F577 HydrophobicContact CB-CE1 4.09Å; C267-F577 HydrophobicContact CB-CE2 3.48Å; C267-F577 VanDerWaalsContact CB-CE2 3.48Å; C267-F577 HydrophobicContact CB-CG 4.2Å; C267-F577 HydrophobicContact CB-CZ 3.65Å
268	L	98.6	Very high	97.7	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-67.8	-35.9	176.4	-68.1	177.3	0	0	0	112.3	I264 L265 N270 T271 L274 F301 L345 L348 L349 F398 F577	I264-L268 HydrophobicContact CG2-CD1 3.91Å; I264-L268 HydrophobicContact CG2-CG 4.29Å; I264-L268 WeakPolarHBondContact O-CB 3.43Å; I264-L268 WeakPolarHBondContact O-CG 3.38Å; I264-L268 PolarHBondContact O-N 2.86Å; L265-L268 PolarHBondContact O-N 2.83Å; L268-N270 VanDerWaalsContact C-N 3.32Å; L268-N270 PolarHBondContact O-N 2.84Å; L268-T271 WeakPolarHBondContact CA-OG1 3.37Å; L268-T271 WeakPolarHBondContact O-CB 3.43Å; L268-T271 PolarHBondContact O-N 2.83Å; L268-T271 PolarHBondContact O-OG1 2.82Å; L268-L274 HydrophobicContact CB-CD2 4.18Å; L268-L274 HydrophobicContact CD2-CD2 4.02Å; L268-F301 HydrophobicContact CB-CE2 4.35Å; L268-F301 HydrophobicContact CB-CZ 4.15Å; L268-F301 HydrophobicContact CD1-CE2 4.32Å; L268-L345 HydrophobicContact CD1-CD1 4.04Å; L268-L345 HydrophobicContact CD2-CD1 4.03Å; L268-L345 HydrophobicContact CG-CD1 4.25Å; L268-L348 HydrophobicContact CD1-CD2 3.57Å; L268-L348 HydrophobicContact CD1-CG 4.35Å; L268-L349 HydrophobicContact CD2-CD2 4.17Å; L268-F398 HydrophobicContact CD2-CE1 4.17Å; L268-F398 HydrophobicContact CD2-CZ 3.68Å; L268-F577 HydrophobicContact CD2-CE1 4.31Å
269	S	97.9	Very high	97.6	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-64	-33.8	176.6	-172.6	0	0	0	0	113.1	L265 Q266 T271 W309	L265-S269 WeakPolarHBondContact O-CB 3.47Å; L265-S269 PolarHBondContact O-N 3.23Å; Q266-S269 PolarHBondContact O-N 3.38Å; S269-T271 VanDerWaalsContact C-N 3.31Å; S269-W309 PolarHBondContact O-NE1 3.42Å; S269-W309 VanDerWaalsContact O-NE1 3.1Å; S269-W309 PolarHBondContact OG-NE1 3.26Å
270	N	97.4	Very high	97.5	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.005	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-1.2	173.4	-71.6	-87.2	0	0	0	113.2	Q266 C267 L268 Q272 Y526 C544	Q266-N270 PolarHBondContact O-N 2.78Å; Q266-N270 VanDerWaalsContact O-N 3.11Å; Q266-N270 PolarHBondContact O-ND2 3.29Å; C267-N270 PolarHBondContact O-N 3.43Å; L268-N270 VanDerWaalsContact C-N 3.32Å; L268-N270 PolarHBondContact O-N 2.84Å; N270-Q272 PolarHBondContact O-N 3.16Å; N270-Q272 VanDerWaalsContact O-N 3.09Å; N270-Y526 HydrophobicContact CB-CD2 4.47Å; N270-C544 HydrophobicContact CB-CB 4Å; N270-C544 WeakPolarHBondContact ND2-CB 3.2Å
271	T	97.8	Very high	97.4	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.112	C	C	.	.			trans	-78.7	93	176.7	-55.1	0	0	0	0	110.1	C267 L268 S269 S273 L274 R275 F398 I480 Y526	C267-T271 PolarHBondContact O-N 2.89Å; C267-T271 PolarHBondContact O-OG1 3.23Å; L268-T271 WeakPolarHBondContact CA-OG1 3.37Å; L268-T271 WeakPolarHBondContact O-CB 3.43Å; L268-T271 PolarHBondContact O-N 2.83Å; L268-T271 PolarHBondContact O-OG1 2.82Å; S269-T271 VanDerWaalsContact C-N 3.31Å; T271-S273 PolarHBondContact O-N 2.88Å; T271-L274 HydrophobicContact CG2-CB 4.11Å; T271-L274 WeakPolarHBondContact O-CA 3.09Å; T271-L274 WeakPolarHBondContact O-CB 3.32Å; T271-L274 PolarHBondContact O-N 3.44Å; T271-R275 PolarHBondContact O-N 2.87Å; T271-F398 HydrophobicContact CG2-CZ 4.04Å; T271-I480 HydrophobicContact CG2-CD1 3.97Å; T271-I480 HydrophobicContact CG2-CG1 3.78Å; T271-I480 HydrophobicContact CG2-CG2 4.41Å; T271-Y526 WeakPolarHBondContact CB-OH 3.46Å; T271-Y526 WeakPolarHBondContact CG2-OH 3.18Å; T271-Y526 WeakPolarHBondContact OG1-CE2 3.11Å; T271-Y526 PolarHBondContact OG1-OH 3.49Å
272	Q	95.3	Very high	97.2	Very high	68 Å²	68	23.5 Å²	23.5	32%	0.318	12%	0.121	S	C	.	.	H	α-helix	trans	-44.2	-55.6	-168.1	-53.6	-170.6	68.7	0	0	114.2	N270 L274 R275 D276 P547 E579	N270-Q272 PolarHBondContact O-N 3.16Å; N270-Q272 VanDerWaalsContact O-N 3.09Å; Q272-L274 PolarHBondContact O-N 3.05Å; Q272-L274 VanDerWaalsContact O-N 3.15Å; Q272-R275 PolarHBondContact O-N 3.03Å; Q272-D276 WeakPolarHBondContact O-CB 3.17Å; Q272-D276 PolarHBondContact O-N 3Å; Q272-P547 HydrophobicContact CG-CB 3.94Å; Q272-P547 HydrophobicContact CG-CG 3.78Å; Q272-E579 PolarHBondContact NE2-OE2 2.85Å
273	S	95.2	Very high	96.9	Very high	40 Å²	40	23.5 Å²	23.5	28%	0.28	12%	0.121	S	C	.	.	H	α-helix	trans	-67.1	-15.9	-177.9	178.7	0	0	0	0	114.9	T271 K393	T271-S273 PolarHBondContact O-N 2.88Å; S273-K393 WeakPolarHBondContact O-CE 3.28Å; S273-K393 VanDerWaalsContact OG-CE 3.28Å; S273-K393 WeakPolarHBondContact OG-CE 3.48Å; S273-K393 PolarHBondContact OG-NZ 3.23Å
274	L	97.1	Very high	96.6	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-92.6	-45.2	173.1	179.1	62.6	0	0	0	110.3	L268 T271 Q272 D276 Y277 C278 F301 I394 F398	L268-L274 HydrophobicContact CB-CD2 4.18Å; L268-L274 HydrophobicContact CD2-CD2 4.02Å; T271-L274 HydrophobicContact CG2-CB 4.11Å; T271-L274 WeakPolarHBondContact O-CA 3.09Å; T271-L274 WeakPolarHBondContact O-CB 3.32Å; T271-L274 PolarHBondContact O-N 3.44Å; Q272-L274 PolarHBondContact O-N 3.05Å; Q272-L274 VanDerWaalsContact O-N 3.15Å; L274-D276 VanDerWaalsContact C-N 3.35Å; L274-D276 PolarHBondContact O-N 3.49Å; L274-Y277 HydrophobicContact CD1-CD1 4.48Å; L274-Y277 WeakPolarHBondContact O-CB 3.31Å; L274-Y277 PolarHBondContact O-N 2.75Å; L274-C278 PolarHBondContact O-N 2.67Å; L274-C278 VanDerWaalsContact O-N 3.17Å; L274-C278 PolarHBondContact O-SG 2.71Å; L274-F301 HydrophobicContact CD1-CE1 4.25Å; L274-F301 HydrophobicContact CD2-CE1 4.03Å; L274-F301 HydrophobicContact CD2-CZ 3.87Å; L274-F301 HydrophobicContact CG-CE1 4.09Å; L274-F301 HydrophobicContact CG-CZ 4.34Å; L274-I394 HydrophobicContact CD1-CD1 3.74Å; L274-F398 HydrophobicContact CD2-CE2 4.16Å; L274-F398 HydrophobicContact CD2-CZ 4.22Å
275	R	96.8	Very high	96.3	Very high	23 Å²	23	40.2 Å²	40.2	9%	0.087	18%	0.184	C	C	.	.	H	α-helix	trans	-50.4	-54.3	172.5	-179.1	-162	65.1	-163.5	-7.6	110.9	T271 Q272 Y277 C278 L279 I305 W309	T271-R275 PolarHBondContact O-N 2.87Å; Q272-R275 PolarHBondContact O-N 3.03Å; R275-Y277 PolarHBondContact O-N 3.27Å; R275-C278 WeakPolarHBondContact O-CA 3.46Å; R275-C278 WeakPolarHBondContact O-CB 3.46Å; R275-C278 PolarHBondContact O-N 2.86Å; R275-L279 HydrophobicContact CG-CD1 3.85Å; R275-L279 HydrophobicContact CG-CG 4.17Å; R275-L279 WeakPolarHBondContact O-CG 3.34Å; R275-L279 PolarHBondContact O-N 3.49Å; R275-I305 HydrophobicContact CB-CG2 4.47Å; R275-I305 HydrophobicContact CG-CG2 4.07Å; R275-W309 HydrophobicContact CG-CD2 4.27Å; R275-W309 HydrophobicContact CG-CG 4.22Å
276	D	96.4	Very high	95.9	Very high	51 Å²	51	41.5 Å²	41.5	27%	0.273	19%	0.191	S	C	.	.	H	α-helix	trans	-67.3	-26.4	-173.8	-60.3	-15.7	0	0	0	112.1	Q272 L274 H280	Q272-D276 WeakPolarHBondContact O-CB 3.17Å; Q272-D276 PolarHBondContact O-N 3Å; L274-D276 VanDerWaalsContact C-N 3.35Å; L274-D276 PolarHBondContact O-N 3.49Å; D276-H280 WeakPolarHBondContact O-CB 3.45Å; D276-H280 PolarHBondContact O-N 3.38Å; D276-H280 PolarHBondContact O-ND1 2.82Å
277	Y	97.3	Very high	95.4	Very high	14 Å²	14	42.3 Å²	42.3	6%	0.055	20%	0.195	C	C	.	.	H	α-helix	trans	-73	-30.4	173.3	172.8	-109.7	0	0	0	112.9	L274 R275 S282 H283 D286 M298 K393	L274-Y277 HydrophobicContact CD1-CD1 4.48Å; L274-Y277 WeakPolarHBondContact O-CB 3.31Å; L274-Y277 PolarHBondContact O-N 2.75Å; R275-Y277 PolarHBondContact O-N 3.27Å; Y277-S282 PolarHBondContact O-N 2.82Å; Y277-S282 VanDerWaalsContact O-N 3.14Å; Y277-H283 HydrophobicContact CD1-CB 3.99Å; Y277-H283 HydrophobicContact CE1-CB 3.48Å; Y277-H283 VanDerWaalsContact CE1-CB 3.48Å; Y277-H283 HydrophobicContact CE2-CB 4.21Å; Y277-H283 PolarHBondContact O-N 3.02Å; Y277-H283 PolarHBondContact O-ND1 2.78Å; Y277-D286 WeakPolarHBondContact OH-CB 3.5Å; Y277-M298 HydrophobicContact CD1-CE 4.24Å; Y277-M298 HydrophobicContact CE1-CE 4.06Å; Y277-M298 HydrophobicContact CE1-SD 4.43Å; Y277-K393 HydrophobicContact CD1-CB 4.18Å; Y277-K393 HydrophobicContact CD1-CG 3.73Å; Y277-K393 HydrophobicContact CD2-CB 4.11Å; Y277-K393 HydrophobicContact CD2-CD 4.17Å; Y277-K393 HydrophobicContact CD2-CG 3.63Å; Y277-K393 HydrophobicContact CE1-CB 3.69Å; Y277-K393 HydrophobicContact CE1-CG 3.79Å; Y277-K393 HydrophobicContact CE2-CB 3.62Å; Y277-K393 HydrophobicContact CE2-CD 4.42Å; Y277-K393 HydrophobicContact CE2-CG 3.7Å; Y277-K393 HydrophobicContact CG-CB 4.34Å; Y277-K393 HydrophobicContact CG-CD 4.41Å; Y277-K393 HydrophobicContact CG-CG 3.62Å
278	C	97.3	Very high	94.4	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-72.7	-50.4	168.1	-62.5	0	0	0	0	111.3	L274 R275 N281 A302 I305 Q306	L274-C278 PolarHBondContact O-N 2.67Å; L274-C278 VanDerWaalsContact O-N 3.17Å; L274-C278 PolarHBondContact O-SG 2.71Å; R275-C278 WeakPolarHBondContact O-CA 3.46Å; R275-C278 WeakPolarHBondContact O-CB 3.46Å; R275-C278 PolarHBondContact O-N 2.86Å; C278-N281 PolarHBondContact O-N 2.77Å; C278-N281 VanDerWaalsContact O-N 3.11Å; C278-A302 HydrophobicContact CB-CB 3.99Å; C278-I305 HydrophobicContact CB-CB 3.96Å; C278-I305 HydrophobicContact CB-CG2 3.8Å; C278-Q306 PolarHBondContact O-NE2 3.07Å
279	L	95.9	Very high	92.9	Very high	50 Å²	50	50.6 Å²	50.6	26%	0.262	24%	0.239	S	C	.	.	H	α-helix	trans	-62.9	-46.8	-176.1	-62.8	-176.2	0	0	0	113	R275 N281 I305 Q306 W309	R275-L279 HydrophobicContact CG-CD1 3.85Å; R275-L279 HydrophobicContact CG-CG 4.17Å; R275-L279 WeakPolarHBondContact O-CG 3.34Å; R275-L279 PolarHBondContact O-N 3.49Å; L279-N281 PolarHBondContact O-N 2.84Å; L279-N281 PolarHBondContact O-ND2 3.47Å; L279-I305 HydrophobicContact CD2-CG2 4.46Å; L279-Q306 HydrophobicContact CD2-CB 4.4Å; L279-Q306 HydrophobicContact CD2-CG 4.01Å; L279-W309 HydrophobicContact CD1-CB 4.17Å; L279-W309 HydrophobicContact CD1-CG 4.47Å; L279-W309 HydrophobicContact CD2-CB 4.02Å
280	H	96.4	Very high	90.9	Very high	139 Å²	139	57.3 Å²	57.3	64%	0.644	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	12.8	176.5	-59	109.9	0	0	0	113.6	D276 S282	D276-H280 WeakPolarHBondContact O-CB 3.45Å; D276-H280 PolarHBondContact O-N 3.38Å; D276-H280 PolarHBondContact O-ND1 2.82Å; H280-S282 PolarHBondContact O-N 3.37Å
281	N	95.2	Very high	88.8	Confident	67 Å²	67	59 Å²	59	36%	0.358	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	19.1	-177.5	-75.6	-79.9	0	0	0	115.1	C278 L279 H283 R284 Q306	C278-N281 PolarHBondContact O-N 2.77Å; C278-N281 VanDerWaalsContact O-N 3.11Å; L279-N281 PolarHBondContact O-N 2.84Å; L279-N281 PolarHBondContact O-ND2 3.47Å; N281-H283 PolarHBondContact O-N 3.02Å; N281-R284 HydrophobicContact CB-CG 4.39Å; N281-R284 WeakPolarHBondContact O-CB 3.36Å; N281-R284 WeakPolarHBondContact O-CG 3.31Å; N281-R284 PolarHBondContact O-N 3.18Å; N281-Q306 PolarHBondContact ND2-NE2 2.93Å; N281-Q306 PolarHBondContact OD1-NE2 2.88Å
282	S	94.9	Very high	86.5	Confident	29 Å²	29	70.5 Å²	70.5	20%	0.203	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-30.5	-171.6	-73.1	0	0	0	0	112.5	Y277 H280 R284 R285	Y277-S282 PolarHBondContact O-N 2.82Å; Y277-S282 VanDerWaalsContact O-N 3.14Å; H280-S282 PolarHBondContact O-N 3.37Å; S282-R284 PolarHBondContact O-N 2.9Å; S282-R284 VanDerWaalsContact O-N 3.15Å; S282-R285 PolarHBondContact O-N 3.19Å; S282-R285 VanDerWaalsContact O-N 3.15Å
283	H	93	Very high	84.4	Confident	5 Å²	5	73 Å²	73	2%	0.023	35%	0.351	C	S	.	.	H	α-helix	trans	-51.5	-32	172.4	64.1	-85.1	0	0	0	113.9	Y277 N281 R285 D286 L287 M298 A302	Y277-H283 HydrophobicContact CD1-CB 3.99Å; Y277-H283 HydrophobicContact CE1-CB 3.48Å; Y277-H283 VanDerWaalsContact CE1-CB 3.48Å; Y277-H283 HydrophobicContact CE2-CB 4.21Å; Y277-H283 PolarHBondContact O-N 3.02Å; Y277-H283 PolarHBondContact O-ND1 2.78Å; N281-H283 PolarHBondContact O-N 3.02Å; H283-R285 PolarHBondContact O-N 3.46Å; H283-R285 VanDerWaalsContact O-N 3.09Å; H283-D286 PolarHBondContact O-N 3.24Å; H283-L287 WeakPolarHBondContact O-CG 3.41Å; H283-L287 PolarHBondContact O-N 2.96Å; H283-L287 VanDerWaalsContact O-N 3.08Å; H283-M298 HydrophobicContact CB-CE 3.87Å; H283-M298 HydrophobicContact CB-CG 4.22Å; H283-A302 WeakPolarHBondContact CE1-CB 3.35Å; H283-A302 WeakPolarHBondContact NE2-CB 3.26Å
284	R	92.4	Very high	82.6	Confident	158 Å²	158	74.4 Å²	74.4	60%	0.596	36%	0.355	S	S	*	.	H	α-helix	trans	-64.4	-15.1	-178.5	-59.3	-174.9	67.2	122.2	7.6	114.2	N281 S282	N281-R284 HydrophobicContact CB-CG 4.39Å; N281-R284 WeakPolarHBondContact O-CB 3.36Å; N281-R284 WeakPolarHBondContact O-CG 3.31Å; N281-R284 PolarHBondContact O-N 3.18Å; S282-R284 PolarHBondContact O-N 2.9Å; S282-R284 VanDerWaalsContact O-N 3.15Å
285	R	91	Very high	81	Confident	196 Å²	196	75.9 Å²	75.9	74%	0.74	36%	0.364	S	S	*	.	H	α-helix	trans	-89.6	-29.7	174.9	-57.5	-178.5	-57.8	-174.9	3.8	112.7	S282 H283	S282-R285 PolarHBondContact O-N 3.19Å; S282-R285 VanDerWaalsContact O-N 3.15Å; H283-R285 PolarHBondContact O-N 3.46Å; H283-R285 VanDerWaalsContact O-N 3.09Å
286	D	90	Very high	80.4	Confident	27 Å²	27	76.2 Å²	76.2	14%	0.144	37%	0.372	C	S	.	.	H	α-helix	trans	-90.6	-8.1	-179.1	-61.9	44.6	0	0	0	111.2	Y277 H283 V356 R358	Y277-D286 WeakPolarHBondContact OH-CB 3.5Å; H283-D286 PolarHBondContact O-N 3.24Å; D286-V356 HydrophobicContact CB-CB 3.96Å; D286-V356 HydrophobicContact CB-CG1 4.33Å; D286-V356 WeakPolarHBondContact O-CA 3.15Å; D286-R358 IonicContact OD2-CZ 2.65Å; D286-R358 IonicContact OD2-NE 2.7Å; D286-R358 PolarHBondContact OD2-NE 3.35Å; D286-R358 IonicContact OD2-NH2 3.88Å; D286-R358 PolarHBondContact OD2-NH2 2.91Å; D286-R358 VanDerWaalsContact OD2-NH2 3.1Å
287	L	89.5	Confident	80.3	Confident	19 Å²	19	73.9 Å²	73.9	10%	0.099	36%	0.359	C	S	.	.	S	Bend	trans	-64.4	130.9	179.9	-83.3	179.2	0	0	0	113.6	H283 N289 M298 E299 V356	H283-L287 WeakPolarHBondContact O-CG 3.41Å; H283-L287 PolarHBondContact O-N 2.96Å; H283-L287 VanDerWaalsContact O-N 3.08Å; L287-N289 PolarHBondContact O-N 2.86Å; L287-M298 HydrophobicContact CD2-CB 4.03Å; L287-M298 HydrophobicContact CD2-CG 4.12Å; L287-E299 HydrophobicContact CD1-CG 3.95Å; L287-V356 HydrophobicContact CD2-CG1 3.93Å; L287-V356 HydrophobicContact CG-CG1 4.43Å
288	N	77.6	Confident	80.3	Confident	30 Å²	30	73.2 Å²	73.2	16%	0.16	36%	0.357	C	S	.	.			trans	-78	82.3	-179	-83	-45.1	0	0	0	114.2	N290 S291 T295 N354 E355 N357 T360	N288-N290 PolarHBondContact O-N 2.84Å; N288-S291 PolarHBondContact O-N 3.04Å; N288-T295 WeakPolarHBondContact O-CG2 3.44Å; N288-N354 PolarHBondContact ND2-O 2.69Å; N288-E355 PolarHBondContact N-O 3.36Å; N288-N357 PolarHBondContact ND2-N 2.9Å; N288-N357 PolarHBondContact ND2-O 3.47Å; N288-N357 PolarHBondContact OD1-O 2.8Å; N288-T360 WeakPolarHBondContact OD1-CG2 3.48Å
289	N	65.7	Low	80.1	Confident	144 Å²	144	75.8 Å²	75.8	77%	0.77	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.9	-21.8	175.7	-80.8	-24.4	0	0	0	115.8	L287 S291	L287-N289 PolarHBondContact O-N 2.86Å; N289-S291 PolarHBondContact O-N 3.09Å
290	N	56.1	Low	80.2	Confident	142 Å²	142	75.2 Å²	75.2	76%	0.759	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-17.7	175.8	-73.4	-18.8	0	0	0	113.6	N288	N288-N290 PolarHBondContact O-N 2.84Å
291	S	54.5	Low	80.2	Confident	36 Å²	36	68.6 Å²	68.6	25%	0.252	33%	0.334	S	S	.	.			trans	-106.8	78.5	177.4	-149.1	0	0	0	0	112.7	N288 N289 T293 N294	N288-S291 PolarHBondContact O-N 3.04Å; N289-S291 PolarHBondContact O-N 3.09Å; S291-T293 PolarHBondContact O-N 2.88Å; S291-N294 PolarHBondContact O-N 3.07Å; S291-N294 WeakPolarHBondContact OG-CB 3.5Å; S291-N294 PolarHBondContact OG-ND2 2.84Å
292	R	49.5	Very low	80.4	Confident	241 Å²	241	65.4 Å²	65.4	91%	0.909	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	1.8	172.6	-73.7	-179.5	169.8	160.5	-3.6	115.5
293	T	51.3	Low	80.5	Confident	122 Å²	122	67.7 Å²	67.7	75%	0.748	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.6	-4.4	178.3	50.1	0	0	0	0	114.2	S291	S291-T293 PolarHBondContact O-N 2.88Å
294	N	57.2	Low	80.7	Confident	68 Å²	68	67.8 Å²	67.8	36%	0.364	32%	0.324	S	S	.	.	S	Bend	trans	-143.8	58.2	-177.5	-48.3	-98.6	0	0	0	112.2	S291 E355	S291-N294 PolarHBondContact O-N 3.07Å; S291-N294 WeakPolarHBondContact OG-CB 3.5Å; S291-N294 PolarHBondContact OG-ND2 2.84Å; N294-E355 VanDerWaalsContact C-OE1 3.25Å; N294-E355 WeakPolarHBondContact O-CG 3.49Å
295	T	63.4	Low	80.9	Confident	33 Å²	33	60.3 Å²	60.3	20%	0.202	30%	0.296	C	S	.	.			trans	-125.5	11.1	164.5	55.7	0	0	0	0	111.9	N288 E299 E355	N288-T295 WeakPolarHBondContact O-CG2 3.44Å; T295-E299 WeakPolarHBondContact O-CG 3.5Å; T295-E355 VanDerWaalsContact CA-CD 3.45Å; T295-E355 WeakPolarHBondContact CA-OE2 3.24Å; T295-E355 PolarHBondContact N-OE1 2.88Å
296	A	84.5	Confident	81.2	Confident	30 Å²	30	53.1 Å²	53.1	25%	0.248	27%	0.271	C	S	.	.	H	α-helix	trans	-86	-24.2	-169.2	0	0	0	0	0	112.8	E300 Q325 E355	A296-E300 WeakPolarHBondContact O-CB 3.19Å; A296-E300 WeakPolarHBondContact O-CG 3.34Å; A296-E300 PolarHBondContact O-N 3.47Å; A296-Q325 HydrophobicContact CB-CG 3.95Å; A296-E355 PolarHBondContact N-OE1 3.09Å; A296-E355 PolarHBondContact N-OE2 3Å
297	L	94.3	Very high	81.4	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-72	-44.6	-176.6	177.3	60.8	0	0	0	111.4	F301 F322 Q325 I326 Y329 L348 L352 E355	L297-F301 WeakPolarHBondContact O-CB 3.46Å; L297-F301 PolarHBondContact O-N 3.11Å; L297-F322 HydrophobicContact CD1-CD2 4.13Å; L297-F322 HydrophobicContact CD1-CE2 3.64Å; L297-F322 HydrophobicContact CD1-CZ 4.35Å; L297-Q325 HydrophobicContact CB-CB 4.28Å; L297-Q325 HydrophobicContact CD1-CB 4.19Å; L297-I326 HydrophobicContact CD1-CB 3.81Å; L297-I326 HydrophobicContact CD1-CD1 4.04Å; L297-I326 HydrophobicContact CD1-CG1 4.44Å; L297-I326 HydrophobicContact CD2-CD1 3.77Å; L297-Y329 HydrophobicContact CD2-CD1 4.46Å; L297-Y329 HydrophobicContact CD2-CD2 4.47Å; L297-Y329 HydrophobicContact CD2-CG 4.09Å; L297-L348 HydrophobicContact CD1-CD1 4.2Å; L297-L348 HydrophobicContact CD2-CD1 4.44Å; L297-L348 HydrophobicContact CG-CD1 4.48Å; L297-L352 HydrophobicContact CG-CD2 4.18Å; L297-E355 WeakPolarHBondContact CB-OE1 3.34Å; L297-E355 PolarHBondContact N-OE1 2.61Å; L297-E355 PolarHBondContact N-OE2 2.91Å
298	M	95.6	Very high	81.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-67.9	-37.7	175.5	-177.5	75.3	-128.8	0	0	111.3	Y277 H283 L287 F301 A302 L352 E355 V356	Y277-M298 HydrophobicContact CD1-CE 4.24Å; Y277-M298 HydrophobicContact CE1-CE 4.06Å; Y277-M298 HydrophobicContact CE1-SD 4.43Å; H283-M298 HydrophobicContact CB-CE 3.87Å; H283-M298 HydrophobicContact CB-CG 4.22Å; L287-M298 HydrophobicContact CD2-CB 4.03Å; L287-M298 HydrophobicContact CD2-CG 4.12Å; M298-F301 HydrophobicContact CE-CD1 3.95Å; M298-A302 HydrophobicContact CE-CB 4.25Å; M298-A302 WeakPolarHBondContact O-CB 3.36Å; M298-A302 PolarHBondContact O-N 3.3Å; M298-L352 HydrophobicContact CB-CD2 4.15Å; M298-L352 HydrophobicContact SD-CB 4.17Å; M298-L352 HydrophobicContact SD-CD2 3.78Å; M298-L352 HydrophobicContact SD-CG 4.48Å; M298-E355 HydrophobicContact CB-CB 4.16Å; M298-E355 WeakPolarHBondContact CB-OE2 3.4Å; M298-E355 PolarHBondContact N-OE2 2.92Å; M298-V356 HydrophobicContact CB-CG1 4.41Å; M298-V356 HydrophobicContact CG-CG1 3.65Å; M298-V356 HydrophobicContact SD-CG1 4.04Å; M298-V356 HydrophobicContact SD-CG2 4.47Å
299	E	94.9	Very high	82.4	Confident	53 Å²	53	53.4 Å²	53.4	25%	0.248	27%	0.271	C	S	.	.	H	α-helix	trans	-65.4	-49.8	174.5	-77.1	-162.8	164.3	0	0	112.4	L287 T295 F301 A302 K303	L287-E299 HydrophobicContact CD1-CG 3.95Å; T295-E299 WeakPolarHBondContact O-CG 3.5Å; E299-F301 VanDerWaalsContact C-N 3.34Å; E299-F301 PolarHBondContact O-N 3.11Å; E299-A302 PolarHBondContact O-N 2.95Å; E299-K303 WeakPolarHBondContact O-CB 3.5Å; E299-K303 WeakPolarHBondContact O-CD 3.32Å; E299-K303 VanDerWaalsContact O-CG 3.23Å; E299-K303 WeakPolarHBondContact O-CG 3.26Å; E299-K303 PolarHBondContact O-N 3.18Å; E299-K303 IonicContact OE2-NZ 3.52Å; E299-K303 PolarHBondContact OE2-NZ 3.36Å
300	E	96.5	Very high	83.7	Confident	38 Å²	38	51.2 Å²	51.2	18%	0.178	26%	0.263	C	S	.	.	H	α-helix	trans	-68.1	-32.8	178.3	-68.2	-49.4	135.5	0	0	112.7	A296 K303 L304 E321 F322 Q325	A296-E300 WeakPolarHBondContact O-CB 3.19Å; A296-E300 WeakPolarHBondContact O-CG 3.34Å; A296-E300 PolarHBondContact O-N 3.47Å; E300-K303 VanDerWaalsContact OE1-CD 3.28Å; E300-K303 WeakPolarHBondContact OE1-CD 3.46Å; E300-K303 WeakPolarHBondContact OE1-CE 3.11Å; E300-K303 IonicContact OE1-NZ 2.96Å; E300-K303 PolarHBondContact OE1-NZ 3.34Å; E300-K303 WeakPolarHBondContact OE2-CD 3.05Å; E300-L304 VanDerWaalsContact O-CB 3.31Å; E300-L304 WeakPolarHBondContact O-CB 3.48Å; E300-L304 PolarHBondContact O-N 2.83Å; E300-E321 HydrophobicContact CG-CB 4.27Å; E300-E321 WeakPolarHBondContact OE2-CB 3.34Å; E300-F322 HydrophobicContact CB-CB 4.39Å; E300-Q325 HydrophobicContact CB-CG 4.05Å; E300-Q325 HydrophobicContact CG-CG 3.61Å
301	F	98	Very high	85	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.7	-49.4	168.9	178.4	-100.4	0	0	0	111	L265 L268 L274 L297 M298 E299 K303 L304 I305 F322 L352	L265-F301 HydrophobicContact CD2-CD2 3.95Å; L265-F301 HydrophobicContact CD2-CE2 3.89Å; L268-F301 HydrophobicContact CB-CE2 4.35Å; L268-F301 HydrophobicContact CB-CZ 4.15Å; L268-F301 HydrophobicContact CD1-CE2 4.32Å; L274-F301 HydrophobicContact CD1-CE1 4.25Å; L274-F301 HydrophobicContact CD2-CE1 4.03Å; L274-F301 HydrophobicContact CD2-CZ 3.87Å; L274-F301 HydrophobicContact CG-CE1 4.09Å; L274-F301 HydrophobicContact CG-CZ 4.34Å; L297-F301 WeakPolarHBondContact O-CB 3.46Å; L297-F301 PolarHBondContact O-N 3.11Å; M298-F301 HydrophobicContact CE-CD1 3.95Å; E299-F301 VanDerWaalsContact C-N 3.34Å; E299-F301 PolarHBondContact O-N 3.11Å; F301-K303 PolarHBondContact O-N 3.42Å; F301-L304 PolarHBondContact O-N 2.89Å; F301-I305 HydrophobicContact CD1-CG1 4.26Å; F301-I305 HydrophobicContact CE1-CG1 3.84Å; F301-I305 HydrophobicContact CE2-CD1 4.1Å; F301-I305 HydrophobicContact CE2-CG1 4.12Å; F301-I305 HydrophobicContact CZ-CD1 3.99Å; F301-I305 HydrophobicContact CZ-CG1 3.76Å; F301-I305 WeakPolarHBondContact O-CG1 3.43Å; F301-I305 PolarHBondContact O-N 3.11Å; F301-F322 HydrophobicContact CB-CD2 4.09Å; F301-F322 HydrophobicContact CB-CE2 4.05Å; F301-F322 HydrophobicContact CD2-CE2 4.02Å; F301-L352 HydrophobicContact CB-CD2 3.68Å; F301-L352 HydrophobicContact CD1-CD1 3.92Å; F301-L352 HydrophobicContact CD1-CD2 3.9Å; F301-L352 HydrophobicContact CD2-CD1 4.3Å; F301-L352 HydrophobicContact CE1-CD1 3.99Å; F301-L352 HydrophobicContact CE2-CD1 4.36Å; F301-L352 HydrophobicContact CG-CD1 4.09Å; F301-L352 HydrophobicContact CG-CD2 3.79Å; F301-L352 HydrophobicContact CZ-CD1 4.22Å
302	A	97.8	Very high	86.1	Confident	1 Å²	1	52 Å²	52	1%	0.008	27%	0.274	C	S	.	.	H	α-helix	trans	-64.2	-40.4	180	0	0	0	0	0	112.7	C278 H283 M298 E299 I305 Q306	C278-A302 HydrophobicContact CB-CB 3.99Å; H283-A302 WeakPolarHBondContact CE1-CB 3.35Å; H283-A302 WeakPolarHBondContact NE2-CB 3.26Å; M298-A302 HydrophobicContact CE-CB 4.25Å; M298-A302 WeakPolarHBondContact O-CB 3.36Å; M298-A302 PolarHBondContact O-N 3.3Å; E299-A302 PolarHBondContact O-N 2.95Å; A302-I305 PolarHBondContact O-N 3.1Å; A302-Q306 WeakPolarHBondContact O-CB 3.39Å; A302-Q306 WeakPolarHBondContact O-CG 3.48Å; A302-Q306 PolarHBondContact O-N 3.21Å
303	K	96.8	Very high	87.4	Confident	76 Å²	76	43.1 Å²	43.1	33%	0.33	25%	0.249	S	C	.	.	H	α-helix	trans	-57.8	-47.2	171.6	-73.5	158	179.3	155.6	0	110.9	E299 E300 F301 Q306 I307	E299-K303 WeakPolarHBondContact O-CB 3.5Å; E299-K303 WeakPolarHBondContact O-CD 3.32Å; E299-K303 VanDerWaalsContact O-CG 3.23Å; E299-K303 WeakPolarHBondContact O-CG 3.26Å; E299-K303 PolarHBondContact O-N 3.18Å; E299-K303 IonicContact OE2-NZ 3.52Å; E299-K303 PolarHBondContact OE2-NZ 3.36Å; E300-K303 VanDerWaalsContact OE1-CD 3.28Å; E300-K303 WeakPolarHBondContact OE1-CD 3.46Å; E300-K303 WeakPolarHBondContact OE1-CE 3.11Å; E300-K303 IonicContact OE1-NZ 2.96Å; E300-K303 PolarHBondContact OE1-NZ 3.34Å; E300-K303 WeakPolarHBondContact OE2-CD 3.05Å; F301-K303 PolarHBondContact O-N 3.42Å; K303-Q306 WeakPolarHBondContact O-CB 3.47Å; K303-Q306 PolarHBondContact O-N 3.28Å; K303-I307 VanDerWaalsContact O-CG1 3.25Å; K303-I307 WeakPolarHBondContact O-CG1 3.46Å; K303-I307 PolarHBondContact O-N 3.34Å
304	L	97.6	Very high	88.6	Confident	8 Å²	8	42.8 Å²	42.8	4%	0.042	25%	0.251	C	S	.	.	H	α-helix	trans	-62.2	-45.7	178.2	-177.2	59.7	0	0	0	112	L252 L265 E300 F301 Q306 I307 M308 V317 P319 F322	L252-L304 HydrophobicContact CD2-CD1 4.02Å; L265-L304 HydrophobicContact CD1-CD2 3.88Å; L265-L304 HydrophobicContact CD2-CD2 4.27Å; E300-L304 VanDerWaalsContact O-CB 3.31Å; E300-L304 WeakPolarHBondContact O-CB 3.48Å; E300-L304 PolarHBondContact O-N 2.83Å; F301-L304 PolarHBondContact O-N 2.89Å; L304-Q306 PolarHBondContact O-N 3.42Å; L304-I307 PolarHBondContact O-N 3.43Å; L304-M308 HydrophobicContact CD1-CG 4.43Å; L304-M308 HydrophobicContact CD1-SD 4.39Å; L304-M308 HydrophobicContact CG-SD 4.1Å; L304-M308 VanDerWaalsContact O-CG 3.25Å; L304-M308 WeakPolarHBondContact O-CG 3.43Å; L304-M308 PolarHBondContact O-N 2.84Å; L304-V317 HydrophobicContact CD1-CG1 3.61Å; L304-P319 HydrophobicContact CD2-CB 3.87Å; L304-F322 HydrophobicContact CD2-CB 4.17Å; L304-F322 HydrophobicContact CD2-CD1 4.5Å; L304-F322 HydrophobicContact CD2-CG 4.24Å
305	I	97.3	Very high	90.2	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-61.2	-42.8	174.6	-63.6	-48.4	0	0	0	111.3	R275 C278 L279 F301 A302 M308 W309	R275-I305 HydrophobicContact CB-CG2 4.47Å; R275-I305 HydrophobicContact CG-CG2 4.07Å; C278-I305 HydrophobicContact CB-CB 3.96Å; C278-I305 HydrophobicContact CB-CG2 3.8Å; L279-I305 HydrophobicContact CD2-CG2 4.46Å; F301-I305 HydrophobicContact CD1-CG1 4.26Å; F301-I305 HydrophobicContact CE1-CG1 3.84Å; F301-I305 HydrophobicContact CE2-CD1 4.1Å; F301-I305 HydrophobicContact CE2-CG1 4.12Å; F301-I305 HydrophobicContact CZ-CD1 3.99Å; F301-I305 HydrophobicContact CZ-CG1 3.76Å; F301-I305 WeakPolarHBondContact O-CG1 3.43Å; F301-I305 PolarHBondContact O-N 3.11Å; A302-I305 PolarHBondContact O-N 3.1Å; I305-M308 HydrophobicContact CD1-SD 4.35Å; I305-M308 PolarHBondContact O-N 2.85Å; I305-W309 VanDerWaalsContact O-CD1 3.31Å; I305-W309 PolarHBondContact O-N 2.84Å
306	Q	96.4	Very high	91.6	Very high	44 Å²	44	45.2 Å²	45.2	21%	0.206	26%	0.26	C	S	.	.	H	α-helix	trans	-57.7	-52.6	175.3	-74.3	165.9	4.9	0	0	110.7	C278 L279 N281 A302 K303 L304 M308 W309 T310	C278-Q306 PolarHBondContact O-NE2 3.07Å; L279-Q306 HydrophobicContact CD2-CB 4.4Å; L279-Q306 HydrophobicContact CD2-CG 4.01Å; N281-Q306 PolarHBondContact ND2-NE2 2.93Å; N281-Q306 PolarHBondContact OD1-NE2 2.88Å; A302-Q306 WeakPolarHBondContact O-CB 3.39Å; A302-Q306 WeakPolarHBondContact O-CG 3.48Å; A302-Q306 PolarHBondContact O-N 3.21Å; K303-Q306 WeakPolarHBondContact O-CB 3.47Å; K303-Q306 PolarHBondContact O-N 3.28Å; L304-Q306 PolarHBondContact O-N 3.42Å; Q306-M308 VanDerWaalsContact C-N 3.34Å; Q306-M308 PolarHBondContact O-N 3.15Å; Q306-W309 PolarHBondContact O-N 3.1Å; Q306-W309 VanDerWaalsContact O-N 3.15Å; Q306-T310 WeakPolarHBondContact O-CG2 3.38Å; Q306-T310 PolarHBondContact O-N 3.11Å; Q306-T310 PolarHBondContact O-OG1 3.35Å
307	I	95.2	Very high	92.2	Very high	74 Å²	74	44.9 Å²	44.9	38%	0.379	26%	0.255	S	S	.	.	H	α-helix	trans	-57.1	-44.8	178.5	-64.5	162.1	0	0	0	111.2	K303 L304 W309 S311 V317	K303-I307 VanDerWaalsContact O-CG1 3.25Å; K303-I307 WeakPolarHBondContact O-CG1 3.46Å; K303-I307 PolarHBondContact O-N 3.34Å; L304-I307 PolarHBondContact O-N 3.43Å; I307-W309 VanDerWaalsContact C-N 3.27Å; I307-W309 PolarHBondContact O-N 3.24Å; I307-S311 WeakPolarHBondContact O-CB 3.48Å; I307-S311 PolarHBondContact O-N 3.41Å; I307-S311 VanDerWaalsContact O-N 3.07Å; I307-S311 PolarHBondContact O-OG 3.33Å; I307-V317 HydrophobicContact CG2-CG1 4.01Å; I307-V317 HydrophobicContact CG2-CG2 3.65Å
308	M	94.6	Very high	92.3	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-63.2	-27.6	-179.6	-70.5	171.8	76.7	0	0	114.1	G248 V250 L252 Q266 L304 I305 Q306	G248-M308 WeakPolarHBondContact CA-O 3.44Å; G248-M308 PolarHBondContact N-O 2.82Å; V250-M308 WeakPolarHBondContact CG2-O 3.24Å; L252-M308 HydrophobicContact CD1-CE 4.32Å; L252-M308 HydrophobicContact CD2-CE 4.42Å; L252-M308 HydrophobicContact CD2-SD 4.14Å; L252-M308 HydrophobicContact CG-CE 4.36Å; Q266-M308 VanDerWaalsContact CD-CE 3.41Å; Q266-M308 HydrophobicContact CG-CE 4.48Å; L304-M308 HydrophobicContact CD1-CG 4.43Å; L304-M308 HydrophobicContact CD1-SD 4.39Å; L304-M308 HydrophobicContact CG-SD 4.1Å; L304-M308 VanDerWaalsContact O-CG 3.25Å; L304-M308 WeakPolarHBondContact O-CG 3.43Å; L304-M308 PolarHBondContact O-N 2.84Å; I305-M308 HydrophobicContact CD1-SD 4.35Å; I305-M308 PolarHBondContact O-N 2.85Å; Q306-M308 VanDerWaalsContact C-N 3.34Å; Q306-M308 PolarHBondContact O-N 3.15Å
309	W	94.3	Very high	92.4	Very high	7 Å²	7	47.3 Å²	47.3	3%	0.027	27%	0.272	C	S	.	.	H	α-helix	trans	-105.4	-19.3	-176.9	-74.7	89.6	0	0	0	114.6	Q247 S269 R275 L279 I305 Q306 I307	Q247-W309 HydrophobicContact CB-CE3 3.8Å; Q247-W309 HydrophobicContact CB-CZ3 4.17Å; Q247-W309 WeakPolarHBondContact O-CZ3 3.06Å; S269-W309 PolarHBondContact O-NE1 3.42Å; S269-W309 VanDerWaalsContact O-NE1 3.1Å; S269-W309 PolarHBondContact OG-NE1 3.26Å; R275-W309 HydrophobicContact CG-CD2 4.27Å; R275-W309 HydrophobicContact CG-CG 4.22Å; L279-W309 HydrophobicContact CD1-CB 4.17Å; L279-W309 HydrophobicContact CD1-CG 4.47Å; L279-W309 HydrophobicContact CD2-CB 4.02Å; I305-W309 VanDerWaalsContact O-CD1 3.31Å; I305-W309 PolarHBondContact O-N 2.84Å; Q306-W309 PolarHBondContact O-N 3.1Å; Q306-W309 VanDerWaalsContact O-N 3.15Å; I307-W309 VanDerWaalsContact C-N 3.27Å; I307-W309 PolarHBondContact O-N 3.24Å
310	T	91.2	Very high	92.5	Very high	98 Å²	98	46.6 Å²	46.6	60%	0.601	27%	0.273	S	S	*	.	H	α-helix	trans	-103.8	-14.6	177.8	66.7	0	0	0	0	114.4	Q306 T312	Q306-T310 WeakPolarHBondContact O-CG2 3.38Å; Q306-T310 PolarHBondContact O-N 3.11Å; Q306-T310 PolarHBondContact O-OG1 3.35Å; T310-T312 PolarHBondContact O-N 3.02Å
311	S	83.4	Confident	92.5	Very high	46 Å²	46	49.7 Å²	49.7	32%	0.322	29%	0.288	S	S	.	.			trans	-62	130	177.3	-68.1	0	0	0	0	112	I307	I307-S311 WeakPolarHBondContact O-CB 3.48Å; I307-S311 PolarHBondContact O-N 3.41Å; I307-S311 VanDerWaalsContact O-N 3.07Å; I307-S311 PolarHBondContact O-OG 3.33Å
312	T	77.6	Confident	92.5	Very high	149 Å²	149	49.9 Å²	49.9	91%	0.914	29%	0.289	S	S	*	.			trans	-83.5	-14.5	168.4	50.9	0	0	0	0	112.7	T310	T310-T312 PolarHBondContact O-N 3.02Å
313	S	77.4	Confident	92.5	Very high	55 Å²	55	50.8 Å²	50.8	39%	0.385	29%	0.292	S	S	.	.			trans	-80.7	142.4	175.1	-175.8	0	0	0	0	111.6	E315	S313-E315 VanDerWaalsContact C-N 3.31Å; S313-E315 WeakPolarHBondContact OG-CB 3.48Å; S313-E315 WeakPolarHBondContact OG-CG 3.28Å; S313-E315 PolarHBondContact OG-N 2.64Å; S313-E315 VanDerWaalsContact OG-N 3.12Å
314	S	77.5	Confident	92.4	Very high	115 Å²	115	49 Å²	49	80%	0.804	29%	0.288	S	S	*	.			trans	-86.2	2.9	169.7	56.5	0	0	0	0	113.5
315	E	89.2	Confident	92.3	Very high	139 Å²	139	49.9 Å²	49.9	65%	0.65	29%	0.292	S	S	*	.	S	Bend	trans	-70.1	147.4	178	-71.1	-171.7	-176.6	0	0	113.1	S313	S313-E315 VanDerWaalsContact C-N 3.31Å; S313-E315 WeakPolarHBondContact OG-CB 3.48Å; S313-E315 WeakPolarHBondContact OG-CG 3.28Å; S313-E315 PolarHBondContact OG-N 2.64Å; S313-E315 VanDerWaalsContact OG-N 3.12Å
316	A	94.4	Very high	92.2	Very high	13 Å²	13	49.9 Å²	49.9	11%	0.107	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-72.2	132.7	177.8	0	0	0	0	0	112.8	G251 K253 S558	G251-A316 CarbonylContact O-C 2.86Å; G251-A316 VanDerWaalsContact O-CA 3.26Å; G251-A316 WeakPolarHBondContact O-CA 3.29Å; K253-A316 WeakPolarHBondContact CD-O 3.19Å; K253-A316 WeakPolarHBondContact CE-O 3.49Å; K253-A316 HydrophobicContact CG-CB 3.96Å; K253-A316 PolarHBondContact NZ-O 2.96Å; A316-S558 VanDerWaalsContact CB-CB 3.45Å
317	V	96.5	Very high	92.1	Very high	23 Å²	23	50 Å²	50	14%	0.139	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-83	148.1	-178.1	173.4	0	0	0	0	110.7	V250 G251 L252 K253 L304 I307 P319	V250-V317 HydrophobicContact CG1-CB 4.33Å; V250-V317 HydrophobicContact CG1-CG2 3.53Å; G251-V317 PolarHBondContact O-N 2.81Å; L252-V317 CarbonylContact C-O 3.49Å; L252-V317 WeakPolarHBondContact CA-O 3.22Å; L252-V317 HydrophobicContact CD2-CB 4.24Å; K253-V317 PolarHBondContact N-O 2.98Å; L304-V317 HydrophobicContact CD1-CG1 3.61Å; I307-V317 HydrophobicContact CG2-CG1 4.01Å; I307-V317 HydrophobicContact CG2-CG2 3.65Å; V317-P319 WeakPolarHBondContact O-CD 3.47Å
318	S	97.1	Very high	92	Very high	51 Å²	51	54.5 Å²	54.5	36%	0.357	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-91	116.1	173.6	-178.4	0	0	0	0	110.9	S320	S318-S320 PolarHBondContact O-N 2.86Å; S318-S320 VanDerWaalsContact O-N 3.1Å; S318-S320 WeakPolarHBondContact OG-CB 3.15Å; S318-S320 PolarHBondContact OG-OG 2.84Å; S318-S320 VanDerWaalsContact OG-OG 3.12Å
319	P	97.3	Very high	91.9	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.006	31%	0.311	C	S	.	.			trans	-82.2	33.6	174.4	35	-35.8	0	0	0	112.5	L255 M261 L265 L304 V317 K323	L255-P319 HydrophobicContact CD1-CG 3.96Å; L255-P319 HydrophobicContact CG-CG 4.34Å; M261-P319 HydrophobicContact CE-CB 3.91Å; M261-P319 HydrophobicContact CE-CG 3.6Å; L265-P319 HydrophobicContact CD1-CB 4.31Å; L304-P319 HydrophobicContact CD2-CB 3.87Å; V317-P319 WeakPolarHBondContact O-CD 3.47Å; P319-K323 WeakPolarHBondContact O-CB 3.43Å; P319-K323 PolarHBondContact O-N 3.42Å
320	S	97	Very high	91.8	Very high	39 Å²	39	56 Å²	56	27%	0.273	31%	0.311	S	S	.	.	H	α-helix	trans	-69.2	-42.4	-170.8	49.5	0	0	0	0	113.8	S318 K323 T324	S318-S320 PolarHBondContact O-N 2.86Å; S318-S320 VanDerWaalsContact O-N 3.1Å; S318-S320 WeakPolarHBondContact OG-CB 3.15Å; S318-S320 PolarHBondContact OG-OG 2.84Å; S318-S320 VanDerWaalsContact OG-OG 3.12Å; S320-K323 PolarHBondContact O-N 2.8Å; S320-T324 PolarHBondContact O-N 3.27Å; S320-T324 PolarHBondContact O-OG1 3.31Å
321	E	96.5	Very high	91.9	Very high	103 Å²	103	55.8 Å²	55.8	48%	0.481	31%	0.311	S	S	.	.	H	α-helix	trans	-68.7	-42.9	177.8	-56.1	-39	113.3	0	0	110.8	E300 K323 T324 Q325	E300-E321 HydrophobicContact CG-CB 4.27Å; E300-E321 WeakPolarHBondContact OE2-CB 3.34Å; E321-K323 PolarHBondContact O-N 3.28Å; E321-T324 WeakPolarHBondContact O-CA 3.46Å; E321-T324 WeakPolarHBondContact O-CB 3.26Å; E321-T324 PolarHBondContact O-N 3.42Å; E321-T324 VanDerWaalsContact O-N 3.1Å; E321-Q325 WeakPolarHBondContact O-CG 3.36Å; E321-Q325 PolarHBondContact O-N 2.98Å
322	F	97.6	Very high	92.4	Very high	4 Å²	4	59.4 Å²	59.4	2%	0.018	32%	0.318	C	S	.	.	H	α-helix	trans	-58.2	-47.4	171.6	171.9	-93.3	0	0	0	112.2	M261 L265 L297 E300 F301 L304 T324 Q325 I326 F344 L348	M261-F322 HydrophobicContact CG-CE1 4Å; M261-F322 HydrophobicContact SD-CD1 3.97Å; M261-F322 HydrophobicContact SD-CE1 3.78Å; L265-F322 HydrophobicContact CD1-CD1 3.93Å; L265-F322 HydrophobicContact CD1-CE1 3.83Å; L265-F322 HydrophobicContact CD2-CD1 4.33Å; L265-F322 HydrophobicContact CD2-CE1 3.83Å; L265-F322 HydrophobicContact CD2-CE2 4.29Å; L265-F322 HydrophobicContact CD2-CZ 3.81Å; L265-F322 HydrophobicContact CG-CE1 4.2Å; L297-F322 HydrophobicContact CD1-CD2 4.13Å; L297-F322 HydrophobicContact CD1-CE2 3.64Å; L297-F322 HydrophobicContact CD1-CZ 4.35Å; E300-F322 HydrophobicContact CB-CB 4.39Å; F301-F322 HydrophobicContact CB-CD2 4.09Å; F301-F322 HydrophobicContact CB-CE2 4.05Å; F301-F322 HydrophobicContact CD2-CE2 4.02Å; L304-F322 HydrophobicContact CD2-CB 4.17Å; L304-F322 HydrophobicContact CD2-CD1 4.5Å; L304-F322 HydrophobicContact CD2-CG 4.24Å; F322-T324 PolarHBondContact O-N 2.88Å; F322-Q325 PolarHBondContact O-N 3.22Å; F322-Q325 VanDerWaalsContact O-N 3.09Å; F322-I326 HydrophobicContact CD1-CG2 4.47Å; F322-I326 HydrophobicContact CE1-CB 4.39Å; F322-I326 HydrophobicContact CE1-CG2 3.98Å; F322-I326 HydrophobicContact CZ-CB 4.17Å; F322-I326 HydrophobicContact CZ-CG2 4.26Å; F322-I326 WeakPolarHBondContact O-CG2 3.24Å; F322-I326 PolarHBondContact O-N 3.37Å; F322-F344 AromaticContact CE1-CZ 3.94Å; F322-F344 HydrophobicContact CE1-CZ 3.94Å; F322-F344 HydrophobicContact CZ-CZ 4.04Å; F322-L348 HydrophobicContact CE2-CD1 3.75Å; F322-L348 HydrophobicContact CZ-CD1 3.64Å; F322-L348 HydrophobicContact CZ-CD2 4.01Å; F322-L348 HydrophobicContact CZ-CG 4.48Å
323	K	96.8	Very high	93.1	Very high	19 Å²	19	52.7 Å²	52.7	8%	0.083	28%	0.276	C	S	.	.	H	α-helix	trans	-55.7	-40.3	174.6	-167.6	-167.9	-174.2	-57.4	0	110.7	L255 T258 M261 P319 S320 E321 Q325 Q327 F333 G335	L255-K323 HydrophobicContact CB-CD 4.45Å; L255-K323 HydrophobicContact CD1-CB 4.26Å; L255-K323 HydrophobicContact CD1-CD 4.15Å; T258-K323 HydrophobicContact CG2-CD 4.25Å; M261-K323 HydrophobicContact CE-CB 4.2Å; M261-K323 HydrophobicContact CE-CG 4.44Å; M261-K323 HydrophobicContact SD-CB 4.25Å; M261-K323 HydrophobicContact SD-CG 4.26Å; P319-K323 WeakPolarHBondContact O-CB 3.43Å; P319-K323 PolarHBondContact O-N 3.42Å; S320-K323 PolarHBondContact O-N 2.8Å; E321-K323 PolarHBondContact O-N 3.28Å; K323-Q325 PolarHBondContact O-N 3.48Å; K323-Q327 WeakPolarHBondContact O-CB 3.25Å; K323-Q327 WeakPolarHBondContact O-CG 3.37Å; K323-Q327 PolarHBondContact O-N 3.46Å; K323-F333 PolarHBondContact NZ-O 3.4Å; K323-G335 WeakPolarHBondContact CE-O 3.39Å; K323-G335 PolarHBondContact NZ-O 3.35Å
324	T	95.9	Very high	93.8	Very high	40 Å²	40	54 Å²	54	25%	0.245	28%	0.281	C	S	.	.	H	α-helix	trans	-64.7	-35.9	179.1	-61.3	0	0	0	0	112.6	S320 E321 F322 R328	S320-T324 PolarHBondContact O-N 3.27Å; S320-T324 PolarHBondContact O-OG1 3.31Å; E321-T324 WeakPolarHBondContact O-CA 3.46Å; E321-T324 WeakPolarHBondContact O-CB 3.26Å; E321-T324 PolarHBondContact O-N 3.42Å; E321-T324 VanDerWaalsContact O-N 3.1Å; F322-T324 PolarHBondContact O-N 2.88Å; T324-R328 VanDerWaalsContact O-CD 3.31Å; T324-R328 WeakPolarHBondContact O-CD 3.44Å; T324-R328 VanDerWaalsContact O-CG 3.24Å; T324-R328 WeakPolarHBondContact O-CG 3.48Å; T324-R328 PolarHBondContact O-N 3.39Å
325	Q	95.8	Very high	94.6	Very high	25 Å²	25	49.8 Å²	49.8	12%	0.117	26%	0.257	C	S	.	.	H	α-helix	trans	-79.2	-43.4	175.2	-46.2	-43.6	-30.3	0	0	113	A296 L297 E300 E321 F322 K323 Q327 R328 Y329	A296-Q325 HydrophobicContact CB-CG 3.95Å; L297-Q325 HydrophobicContact CB-CB 4.28Å; L297-Q325 HydrophobicContact CD1-CB 4.19Å; E300-Q325 HydrophobicContact CB-CG 4.05Å; E300-Q325 HydrophobicContact CG-CG 3.61Å; E321-Q325 WeakPolarHBondContact O-CG 3.36Å; E321-Q325 PolarHBondContact O-N 2.98Å; F322-Q325 PolarHBondContact O-N 3.22Å; F322-Q325 VanDerWaalsContact O-N 3.09Å; K323-Q325 PolarHBondContact O-N 3.48Å; Q325-Q327 VanDerWaalsContact C-N 3.3Å; Q325-Q327 PolarHBondContact O-N 3.26Å; Q325-R328 WeakPolarHBondContact O-CB 3.12Å; Q325-R328 PolarHBondContact O-N 3.02Å; Q325-Y329 PolarHBondContact O-N 3.12Å
326	I	94.9	Very high	94.8	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-66.6	-32.2	-178.6	-168.9	56.2	0	0	0	112.2	L297 F322 R328 Y329 A330 F333 F344 L348	L297-I326 HydrophobicContact CD1-CB 3.81Å; L297-I326 HydrophobicContact CD1-CD1 4.04Å; L297-I326 HydrophobicContact CD1-CG1 4.44Å; L297-I326 HydrophobicContact CD2-CD1 3.77Å; F322-I326 HydrophobicContact CD1-CG2 4.47Å; F322-I326 HydrophobicContact CE1-CB 4.39Å; F322-I326 HydrophobicContact CE1-CG2 3.98Å; F322-I326 HydrophobicContact CZ-CB 4.17Å; F322-I326 HydrophobicContact CZ-CG2 4.26Å; F322-I326 WeakPolarHBondContact O-CG2 3.24Å; F322-I326 PolarHBondContact O-N 3.37Å; I326-R328 VanDerWaalsContact C-N 3.33Å; I326-Y329 HydrophobicContact CD1-CD1 4.49Å; I326-Y329 PolarHBondContact O-N 3.1Å; I326-A330 PolarHBondContact O-N 3.5Å; I326-F333 HydrophobicContact CG1-CD2 4.24Å; I326-F344 HydrophobicContact CG1-CE2 3.78Å; I326-F344 HydrophobicContact CG1-CZ 4.43Å; I326-F344 HydrophobicContact CG2-CE2 4.21Å; I326-L348 HydrophobicContact CD1-CB 4.44Å; I326-L348 HydrophobicContact CD1-CD1 4.17Å
327	Q	94.8	Very high	94.8	Very high	47 Å²	47	55.5 Å²	55.5	22%	0.22	28%	0.279	C	S	.	.	H	α-helix	trans	-75.5	-18.7	173.4	80.6	-168.5	-1.2	0	0	113.5	K323 Q325 P331 F333 V334	K323-Q327 WeakPolarHBondContact O-CB 3.25Å; K323-Q327 WeakPolarHBondContact O-CG 3.37Å; K323-Q327 PolarHBondContact O-N 3.46Å; Q325-Q327 VanDerWaalsContact C-N 3.3Å; Q325-Q327 PolarHBondContact O-N 3.26Å; Q327-P331 WeakPolarHBondContact O-CA 3.38Å; Q327-F333 HydrophobicContact CB-CB 4.48Å; Q327-V334 HydrophobicContact CB-CG2 3.9Å; Q327-V334 HydrophobicContact CG-CG2 4.2Å
328	R	92.4	Very high	94.7	Very high	169 Å²	169	57.7 Å²	57.7	64%	0.638	29%	0.288	S	S	*	.	H	α-helix	trans	-76	-44.3	167.4	-73.8	164.7	174.4	-179.8	-5.7	110.9	T324 Q325 I326	T324-R328 VanDerWaalsContact O-CD 3.31Å; T324-R328 WeakPolarHBondContact O-CD 3.44Å; T324-R328 VanDerWaalsContact O-CG 3.24Å; T324-R328 WeakPolarHBondContact O-CG 3.48Å; T324-R328 PolarHBondContact O-N 3.39Å; Q325-R328 WeakPolarHBondContact O-CB 3.12Å; Q325-R328 PolarHBondContact O-N 3.02Å; I326-R328 VanDerWaalsContact C-N 3.33Å
329	Y	91.9	Very high	94.6	Very high	34 Å²	34	57 Å²	57	13%	0.133	28%	0.279	C	S	.	.	H	α-helix	trans	-65.9	-44.8	178.1	-175.1	-90.9	0	0	0	112.4	L297 Q325 I326 D350 N354	L297-Y329 HydrophobicContact CD2-CD1 4.46Å; L297-Y329 HydrophobicContact CD2-CD2 4.47Å; L297-Y329 HydrophobicContact CD2-CG 4.09Å; Q325-Y329 PolarHBondContact O-N 3.12Å; I326-Y329 HydrophobicContact CD1-CD1 4.49Å; I326-Y329 PolarHBondContact O-N 3.1Å; Y329-D350 PolarHBondContact OH-OD2 3.42Å; Y329-N354 PolarHBondContact OH-ND2 2.86Å
330	A	93.5	Very high	94.5	Very high	4 Å²	4	58.7 Å²	58.7	3%	0.033	29%	0.288	C	S	.	.	S	Bend	trans	-127.7	89.1	-179.5	0	0	0	0	0	110.7	I326 R332 F333 F347	I326-A330 PolarHBondContact O-N 3.5Å; A330-R332 PolarHBondContact O-N 3.28Å; A330-F333 HydrophobicContact CB-CD2 3.69Å; A330-F333 HydrophobicContact CB-CE2 3.64Å; A330-F333 WeakPolarHBondContact O-CD2 3.35Å; A330-F333 PolarHBondContact O-N 3.11Å; A330-F333 VanDerWaalsContact O-N 3.07Å; A330-F347 HydrophobicContact CB-CB 4.16Å; A330-F347 HydrophobicContact CB-CD1 3.77Å; A330-F347 HydrophobicContact CB-CE1 4.41Å; A330-F347 HydrophobicContact CB-CG 4.03Å
331	P	92.8	Very high	94.5	Very high	94 Å²	94	56.8 Å²	56.8	61%	0.61	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-56.9	-10.3	-176.6	-30.6	37.6	0	0	0	117.1	Q327 F333 V334	Q327-P331 WeakPolarHBondContact O-CA 3.38Å; P331-F333 PolarHBondContact O-N 2.94Å; P331-V334 HydrophobicContact CB-CG2 4.45Å; P331-V334 WeakPolarHBondContact O-CB 3.44Å; P331-V334 WeakPolarHBondContact O-CG2 3.36Å; P331-V334 PolarHBondContact O-N 3.16Å
332	R	92.8	Very high	94.6	Very high	122 Å²	122	53.1 Å²	53.1	46%	0.46	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-59.3	-28.9	170.7	-172.5	179.9	-65.1	-155.5	13.5	112.5	A330 V334 Q339 E343	A330-R332 PolarHBondContact O-N 3.28Å; R332-V334 VanDerWaalsContact C-N 3.34Å; R332-Q339 PolarHBondContact O-NE2 3.07Å; R332-Q339 VanDerWaalsContact O-NE2 3.11Å; R332-E343 WeakPolarHBondContact CD-OE2 3.39Å; R332-E343 IonicContact CZ-OE1 2.75Å; R332-E343 IonicContact CZ-OE2 3.18Å; R332-E343 IonicContact NE-OE1 2.91Å; R332-E343 IonicContact NE-OE2 3.8Å; R332-E343 IonicContact NH1-OE1 3.9Å; R332-E343 PolarHBondContact NH1-OE1 2.66Å; R332-E343 IonicContact NH1-OE2 2.67Å; R332-E343 PolarHBondContact NH1-OE2 3.35Å; R332-E343 IonicContact NH2-OE1 3.1Å; R332-E343 PolarHBondContact NH2-OE1 2.97Å
333	F	93.6	Very high	94.5	Very high	9 Å²	9	55 Å²	55	4%	0.039	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-91.9	10.9	-177.7	-49.2	-55.1	0	0	0	114.2	F260 K323 I326 Q327 A330 P331 Q339 F344 F347	F260-F333 HydrophobicContact CE2-CD1 4.29Å; K323-F333 PolarHBondContact NZ-O 3.4Å; I326-F333 HydrophobicContact CG1-CD2 4.24Å; Q327-F333 HydrophobicContact CB-CB 4.48Å; A330-F333 HydrophobicContact CB-CD2 3.69Å; A330-F333 HydrophobicContact CB-CE2 3.64Å; A330-F333 WeakPolarHBondContact O-CD2 3.35Å; A330-F333 PolarHBondContact O-N 3.11Å; A330-F333 VanDerWaalsContact O-N 3.07Å; P331-F333 PolarHBondContact O-N 2.94Å; F333-Q339 HydrophobicContact CD1-CB 4.47Å; F333-Q339 HydrophobicContact CD1-CG 4.03Å; F333-Q339 HydrophobicContact CE1-CB 4.47Å; F333-Q339 HydrophobicContact CE1-CG 4.46Å; F333-F344 HydrophobicContact CD1-CD2 4.36Å; F333-F344 HydrophobicContact CD2-CD2 4.21Å; F333-F344 HydrophobicContact CE1-CB 4.21Å; F333-F344 HydrophobicContact CE1-CD2 4.23Å; F333-F344 HydrophobicContact CE2-CD2 4.06Å; F333-F344 HydrophobicContact CG-CD2 4.36Å; F333-F344 HydrophobicContact CZ-CB 4.15Å; F333-F344 HydrophobicContact CZ-CD2 4.09Å; F333-F347 HydrophobicContact CE2-CB 3.67Å; F333-F347 HydrophobicContact CE2-CD2 4.05Å; F333-F347 AromaticContact CE2-CG 4Å; F333-F347 HydrophobicContact CE2-CG 4Å; F333-F347 HydrophobicContact CZ-CB 4.1Å; F333-F347 AromaticContact CZ-CD2 3.81Å; F333-F347 HydrophobicContact CZ-CD2 3.81Å; F333-F347 HydrophobicContact CZ-CG 4.22Å
334	V	92.6	Very high	94.6	Very high	81 Å²	81	54.2 Å²	54.2	49%	0.491	26%	0.263	S	S	.	.			trans	-67.4	144.9	170.5	173.3	0	0	0	0	110	Q327 P331 R332	Q327-V334 HydrophobicContact CB-CG2 3.9Å; Q327-V334 HydrophobicContact CG-CG2 4.2Å; P331-V334 HydrophobicContact CB-CG2 4.45Å; P331-V334 WeakPolarHBondContact O-CB 3.44Å; P331-V334 WeakPolarHBondContact O-CG2 3.36Å; P331-V334 PolarHBondContact O-N 3.16Å; R332-V334 VanDerWaalsContact C-N 3.34Å
335	G	93.1	Very high	94.7	Very high	28 Å²	28	52.4 Å²	52.4	29%	0.289	25%	0.252	S	S	.	.	S	Bend	trans	80.2	-151.9	-177.9	0	0	0	0	0	113.5	K323	K323-G335 WeakPolarHBondContact CE-O 3.39Å; K323-G335 PolarHBondContact NZ-O 3.35Å
336	Y	94.3	Very high	94.8	Very high	153 Å²	153	55.2 Å²	55.2	60%	0.6	26%	0.262	S	S	*	.	S	Bend	trans	-135.6	31.7	-164.6	-52.5	-73.5	0	0	0	112.6	L255 N257	L255-Y336 WeakPolarHBondContact O-CD1 3.39Å; L255-Y336 VanDerWaalsContact O-CE1 3.25Å; L255-Y336 WeakPolarHBondContact O-CE1 3.21Å; N257-Y336 WeakPolarHBondContact CB-O 3.5Å; N257-Y336 PolarHBondContact ND2-O 2.85Å
337	N	94.3	Very high	95	Very high	118 Å²	118	57.5 Å²	57.5	63%	0.631	27%	0.272	S	S	*	.			trans	-83.2	153.1	175.2	-66.7	-20.4	0	0	0	110.5
338	Q	93.5	Very high	95.1	Very high	69 Å²	69	55.3 Å²	55.3	32%	0.322	26%	0.261	S	S	.	.			trans	-69.4	150	166.3	-64	-165.2	-4.1	0	0	110.4	N257 G538	N257-Q338 HydrophobicContact CB-CG 3.71Å; N257-Q338 VanDerWaalsContact CG-CG 3.48Å; N257-Q338 VanDerWaalsContact OD1-CG 3.29Å; N257-Q338 WeakPolarHBondContact OD1-CG 3.42Å; N257-Q338 PolarHBondContact OD1-NE2 3.02Å; Q338-G538 PolarHBondContact NE2-O 2.98Å; Q338-G538 PolarHBondContact OE1-O 2.96Å
339	Q	94.9	Very high	95.4	Very high	37 Å²	37	47.4 Å²	47.4	17%	0.173	23%	0.232	C	C	.	.			trans	-143	166.4	-172.4	-58.4	-73.5	-8.4	0	0	110.2	F260 R332 F333 Y540	F260-Q339 HydrophobicContact CD1-CB 3.93Å; F260-Q339 HydrophobicContact CD1-CG 4.41Å; F260-Q339 HydrophobicContact CD2-CB 3.89Å; F260-Q339 HydrophobicContact CE1-CB 3.77Å; F260-Q339 HydrophobicContact CE1-CG 3.76Å; F260-Q339 HydrophobicContact CE2-CB 3.73Å; F260-Q339 HydrophobicContact CE2-CG 4.07Å; F260-Q339 HydrophobicContact CG-CB 4.01Å; F260-Q339 HydrophobicContact CZ-CB 3.69Å; F260-Q339 HydrophobicContact CZ-CG 3.58Å; R332-Q339 PolarHBondContact O-NE2 3.07Å; R332-Q339 VanDerWaalsContact O-NE2 3.11Å; F333-Q339 HydrophobicContact CD1-CB 4.47Å; F333-Q339 HydrophobicContact CD1-CG 4.03Å; F333-Q339 HydrophobicContact CE1-CB 4.47Å; F333-Q339 HydrophobicContact CE1-CG 4.46Å; Q339-Y540 WeakPolarHBondContact O-CE2 3.46Å; Q339-Y540 PolarHBondContact O-OH 2.84Å
340	D	95.7	Very high	95.6	Very high	36 Å²	36	47.4 Å²	47.4	19%	0.193	23%	0.234	C	C	.	.			trans	-79.5	130.4	173.5	-170.6	-76.1	0	0	0	111.7	Q342 E343 F344 F488 Y574	D340-Q342 WeakPolarHBondContact OD1-CA 3.47Å; D340-Q342 WeakPolarHBondContact OD1-CB 3.38Å; D340-Q342 PolarHBondContact OD1-N 3.01Å; D340-E343 HydrophobicContact CB-CB 4.05Å; D340-E343 PolarHBondContact OD1-N 3.02Å; D340-F344 WeakPolarHBondContact O-CB 3.43Å; D340-F344 PolarHBondContact O-N 2.85Å; D340-F488 WeakPolarHBondContact OD2-CD2 3.3Å; D340-F488 WeakPolarHBondContact OD2-CE2 3.4Å; D340-Y574 PolarHBondContact OD1-OH 2.88Å; D340-Y574 PolarHBondContact OD2-OH 3.47Å
341	A	97.5	Very high	95.7	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-71.1	-30.2	-178.9	0	0	0	0	0	113.9	F260 I264 L345 Y540	F260-A341 HydrophobicContact CB-CB 4.2Å; I264-A341 HydrophobicContact CD1-CB 4.13Å; I264-A341 HydrophobicContact CG1-CB 3.91Å; I264-A341 WeakPolarHBondContact CG1-O 3.36Å; A341-L345 WeakPolarHBondContact O-CB 3.42Å; A341-L345 PolarHBondContact O-N 3.13Å; A341-Y540 HydrophobicContact CB-CD1 3.76Å; A341-Y540 HydrophobicContact CB-CE1 3.3Å; A341-Y540 PolarHBondContact N-OH 3.3Å
342	Q	97.4	Very high	95.9	Very high	25 Å²	25	42.8 Å²	42.8	12%	0.117	20%	0.204	C	C	.	.	H	α-helix	trans	-75.2	-38.3	175.4	-174.6	-95.2	10.4	0	0	111.1	D340 L345 R346 D423 S425 H484 Y574 V575	D340-Q342 WeakPolarHBondContact OD1-CA 3.47Å; D340-Q342 WeakPolarHBondContact OD1-CB 3.38Å; D340-Q342 PolarHBondContact OD1-N 3.01Å; Q342-L345 PolarHBondContact O-N 3Å; Q342-R346 WeakPolarHBondContact O-CG 3.31Å; Q342-R346 PolarHBondContact O-N 2.88Å; Q342-D423 PolarHBondContact NE2-OD2 3.07Å; Q342-S425 PolarHBondContact NE2-OG 3.49Å; Q342-S425 VanDerWaalsContact NE2-OG 3.15Å; Q342-H484 HydrophobicContact CG-CB 3.88Å; Q342-Y574 HydrophobicContact CB-CE1 4.37Å; Q342-V575 HydrophobicContact CB-CG2 4.06Å
343	E	96.8	Very high	96	Very high	45 Å²	45	37.1 Å²	37.1	21%	0.21	18%	0.183	C	C	.	.	H	α-helix	trans	-62.1	-45.9	171.7	-178.7	166.1	-117.2	0	0	110.9	R332 D340 L345 R346 F347	R332-E343 WeakPolarHBondContact CD-OE2 3.39Å; R332-E343 IonicContact CZ-OE1 2.75Å; R332-E343 IonicContact CZ-OE2 3.18Å; R332-E343 IonicContact NE-OE1 2.91Å; R332-E343 IonicContact NE-OE2 3.8Å; R332-E343 IonicContact NH1-OE1 3.9Å; R332-E343 PolarHBondContact NH1-OE1 2.66Å; R332-E343 IonicContact NH1-OE2 2.67Å; R332-E343 PolarHBondContact NH1-OE2 3.35Å; R332-E343 IonicContact NH2-OE1 3.1Å; R332-E343 PolarHBondContact NH2-OE1 2.97Å; D340-E343 HydrophobicContact CB-CB 4.05Å; D340-E343 PolarHBondContact OD1-N 3.02Å; E343-L345 PolarHBondContact O-N 3.21Å; E343-R346 PolarHBondContact O-N 2.97Å; E343-F347 HydrophobicContact CG-CD2 3.72Å; E343-F347 HydrophobicContact CG-CE2 3.73Å; E343-F347 WeakPolarHBondContact O-CD2 3.41Å; E343-F347 PolarHBondContact O-N 2.96Å
344	F	98.4	Very high	96	Very high	1 Å²	1	38.4 Å²	38.4	0%	0.004	19%	0.19	C	C	.	.	H	α-helix	trans	-57.7	-46.3	174.3	175.4	-97.4	0	0	0	112.5	F260 M261 I264 F322 I326 F333 D340 R346 F347 L348	F260-F344 HydrophobicContact CD2-CB 3.76Å; F260-F344 HydrophobicContact CD2-CD1 4.43Å; F260-F344 HydrophobicContact CD2-CD2 4.18Å; F260-F344 AromaticContact CD2-CG 3.84Å; F260-F344 HydrophobicContact CD2-CG 3.84Å; F260-F344 HydrophobicContact CE2-CB 3.98Å; F260-F344 AromaticContact CE2-CD2 3.68Å; F260-F344 HydrophobicContact CE2-CD2 3.68Å; F260-F344 HydrophobicContact CE2-CE2 4.41Å; F260-F344 AromaticContact CE2-CG 3.84Å; F260-F344 HydrophobicContact CE2-CG 3.84Å; M261-F344 HydrophobicContact CB-CE1 4.13Å; M261-F344 HydrophobicContact CB-CE2 4.19Å; M261-F344 HydrophobicContact CB-CZ 3.96Å; M261-F344 HydrophobicContact CG-CE1 4Å; M261-F344 HydrophobicContact CG-CE2 4.01Å; M261-F344 HydrophobicContact CG-CZ 3.53Å; M261-F344 HydrophobicContact SD-CE2 4.46Å; M261-F344 HydrophobicContact SD-CZ 4.37Å; I264-F344 HydrophobicContact CB-CD1 3.83Å; I264-F344 HydrophobicContact CB-CE1 3.98Å; I264-F344 HydrophobicContact CG1-CD1 4.09Å; I264-F344 HydrophobicContact CG2-CD1 3.85Å; I264-F344 HydrophobicContact CG2-CE1 3.86Å; F322-F344 AromaticContact CE1-CZ 3.94Å; F322-F344 HydrophobicContact CE1-CZ 3.94Å; F322-F344 HydrophobicContact CZ-CZ 4.04Å; I326-F344 HydrophobicContact CG1-CE2 3.78Å; I326-F344 HydrophobicContact CG1-CZ 4.43Å; I326-F344 HydrophobicContact CG2-CE2 4.21Å; F333-F344 HydrophobicContact CD1-CD2 4.36Å; F333-F344 HydrophobicContact CD2-CD2 4.21Å; F333-F344 HydrophobicContact CE1-CB 4.21Å; F333-F344 HydrophobicContact CE1-CD2 4.23Å; F333-F344 HydrophobicContact CE2-CD2 4.06Å; F333-F344 HydrophobicContact CG-CD2 4.36Å; F333-F344 HydrophobicContact CZ-CB 4.15Å; F333-F344 HydrophobicContact CZ-CD2 4.09Å; D340-F344 WeakPolarHBondContact O-CB 3.43Å; D340-F344 PolarHBondContact O-N 2.85Å; F344-R346 VanDerWaalsContact C-N 3.33Å; F344-R346 PolarHBondContact O-N 2.95Å; F344-F347 PolarHBondContact O-N 2.96Å; F344-L348 HydrophobicContact CE1-CB 4.46Å; F344-L348 HydrophobicContact CE1-CD2 3.8Å; F344-L348 HydrophobicContact CZ-CB 4.45Å; F344-L348 HydrophobicContact CZ-CD2 3.96Å; F344-L348 VanDerWaalsContact O-CB 3.31Å; F344-L348 WeakPolarHBondContact O-CB 3.22Å; F344-L348 PolarHBondContact O-N 2.65Å
345	L	98.6	Very high	96.1	Very high	2 Å²	2	35 Å²	35	1%	0.01	17%	0.169	C	C	.	.	H	α-helix	trans	-56.8	-45.5	175.9	175.1	64.2	0	0	0	111.8	I264 L268 A341 Q342 E343 L348 L349 V482 V575 F577	I264-L345 HydrophobicContact CD1-CB 4.1Å; I264-L345 HydrophobicContact CD1-CD2 4.45Å; I264-L345 HydrophobicContact CG1-CB 4.39Å; I264-L345 HydrophobicContact CG2-CB 4.02Å; I264-L345 HydrophobicContact CG2-CD1 3.74Å; I264-L345 HydrophobicContact CG2-CG 4.45Å; L268-L345 HydrophobicContact CD1-CD1 4.04Å; L268-L345 HydrophobicContact CD2-CD1 4.03Å; L268-L345 HydrophobicContact CG-CD1 4.25Å; A341-L345 WeakPolarHBondContact O-CB 3.42Å; A341-L345 PolarHBondContact O-N 3.13Å; Q342-L345 PolarHBondContact O-N 3Å; E343-L345 PolarHBondContact O-N 3.21Å; L345-L348 PolarHBondContact O-N 2.82Å; L345-L349 HydrophobicContact CD1-CD1 3.85Å; L345-L349 HydrophobicContact CD1-CD2 4.43Å; L345-L349 HydrophobicContact CD1-CG 3.89Å; L345-L349 HydrophobicContact CG-CD1 4.11Å; L345-L349 HydrophobicContact CG-CG 4.42Å; L345-L349 WeakPolarHBondContact O-CG 3.44Å; L345-L349 PolarHBondContact O-N 2.67Å; L345-V482 HydrophobicContact CD2-CG1 3.73Å; L345-V575 HydrophobicContact CD2-CG1 4.31Å; L345-F577 HydrophobicContact CD1-CE1 4.32Å; L345-F577 HydrophobicContact CD1-CZ 4.31Å; L345-F577 HydrophobicContact CD2-CE1 4.1Å; L345-F577 HydrophobicContact CD2-CZ 3.79Å
346	R	97.6	Very high	96.1	Very high	84 Å²	84	33.7 Å²	33.7	32%	0.317	16%	0.155	S	C	.	.	H	α-helix	trans	-65.3	-45.3	-179.2	-74.2	-173.1	62.6	97.4	4.3	112.5	Q342 E343 F344 L348 L349 D350 D423	Q342-R346 WeakPolarHBondContact O-CG 3.31Å; Q342-R346 PolarHBondContact O-N 2.88Å; E343-R346 PolarHBondContact O-N 2.97Å; F344-R346 VanDerWaalsContact C-N 3.33Å; F344-R346 PolarHBondContact O-N 2.95Å; R346-L348 VanDerWaalsContact C-N 3.32Å; R346-L348 PolarHBondContact O-N 3.19Å; R346-L349 PolarHBondContact O-N 2.85Å; R346-D350 VanDerWaalsContact O-CB 3.32Å; R346-D350 WeakPolarHBondContact O-CB 3.29Å; R346-D350 PolarHBondContact O-N 3.27Å; R346-D423 WeakPolarHBondContact CD-OD1 3.48Å; R346-D423 IonicContact CZ-OD1 2.86Å; R346-D423 IonicContact NE-OD1 3.45Å; R346-D423 IonicContact NH1-OD1 3.75Å; R346-D423 PolarHBondContact NH1-OD1 3.29Å
347	F	97.9	Very high	96.1	Very high	50 Å²	50	26.6 Å²	26.6	22%	0.219	13%	0.128	C	C	.	.	H	α-helix	trans	-65.5	-34.2	175.3	-84.7	-72.8	0	0	0	112.7	A330 F333 E343 F344 G351	A330-F347 HydrophobicContact CB-CB 4.16Å; A330-F347 HydrophobicContact CB-CD1 3.77Å; A330-F347 HydrophobicContact CB-CE1 4.41Å; A330-F347 HydrophobicContact CB-CG 4.03Å; F333-F347 HydrophobicContact CE2-CB 3.67Å; F333-F347 HydrophobicContact CE2-CD2 4.05Å; F333-F347 AromaticContact CE2-CG 4Å; F333-F347 HydrophobicContact CE2-CG 4Å; F333-F347 HydrophobicContact CZ-CB 4.1Å; F333-F347 AromaticContact CZ-CD2 3.81Å; F333-F347 HydrophobicContact CZ-CD2 3.81Å; F333-F347 HydrophobicContact CZ-CG 4.22Å; E343-F347 HydrophobicContact CG-CD2 3.72Å; E343-F347 HydrophobicContact CG-CE2 3.73Å; E343-F347 WeakPolarHBondContact O-CD2 3.41Å; E343-F347 PolarHBondContact O-N 2.96Å; F344-F347 PolarHBondContact O-N 2.96Å; F347-G351 PolarHBondContact O-N 2.92Å
348	L	98.3	Very high	96.1	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-68.4	-48.8	175.4	178.6	56.2	0	0	0	111.6	I264 L265 L268 L297 F322 I326 F344 L345 R346 D350 G351 L352	I264-L348 HydrophobicContact CG2-CD2 4.48Å; L265-L348 HydrophobicContact CD2-CD2 4.32Å; L268-L348 HydrophobicContact CD1-CD2 3.57Å; L268-L348 HydrophobicContact CD1-CG 4.35Å; L297-L348 HydrophobicContact CD1-CD1 4.2Å; L297-L348 HydrophobicContact CD2-CD1 4.44Å; L297-L348 HydrophobicContact CG-CD1 4.48Å; F322-L348 HydrophobicContact CE2-CD1 3.75Å; F322-L348 HydrophobicContact CZ-CD1 3.64Å; F322-L348 HydrophobicContact CZ-CD2 4.01Å; F322-L348 HydrophobicContact CZ-CG 4.48Å; I326-L348 HydrophobicContact CD1-CB 4.44Å; I326-L348 HydrophobicContact CD1-CD1 4.17Å; F344-L348 HydrophobicContact CE1-CB 4.46Å; F344-L348 HydrophobicContact CE1-CD2 3.8Å; F344-L348 HydrophobicContact CZ-CB 4.45Å; F344-L348 HydrophobicContact CZ-CD2 3.96Å; F344-L348 VanDerWaalsContact O-CB 3.31Å; F344-L348 WeakPolarHBondContact O-CB 3.22Å; F344-L348 PolarHBondContact O-N 2.65Å; L345-L348 PolarHBondContact O-N 2.82Å; R346-L348 VanDerWaalsContact C-N 3.32Å; R346-L348 PolarHBondContact O-N 3.19Å; L348-D350 PolarHBondContact O-N 2.88Å; L348-G351 PolarHBondContact O-N 3.37Å; L348-L352 HydrophobicContact CD1-CD1 3.92Å; L348-L352 HydrophobicContact CD1-CD2 4.24Å; L348-L352 HydrophobicContact CD1-CG 3.86Å; L348-L352 HydrophobicContact CG-CD1 4.01Å; L348-L352 HydrophobicContact CG-CG 4.36Å; L348-L352 VanDerWaalsContact O-CG 3.3Å; L348-L352 WeakPolarHBondContact O-CG 3.25Å; L348-L352 PolarHBondContact O-N 3.15Å
349	L	98.1	Very high	96	Very high	4 Å²	4	23.7 Å²	23.7	2%	0.021	11%	0.108	C	C	.	.	H	α-helix	trans	-63.9	-39.9	179.2	-68.6	-179.3	0	0	0	112.3	L268 L345 R346 H353 I394 F398 W422	L268-L349 HydrophobicContact CD2-CD2 4.17Å; L345-L349 HydrophobicContact CD1-CD1 3.85Å; L345-L349 HydrophobicContact CD1-CD2 4.43Å; L345-L349 HydrophobicContact CD1-CG 3.89Å; L345-L349 HydrophobicContact CG-CD1 4.11Å; L345-L349 HydrophobicContact CG-CG 4.42Å; L345-L349 WeakPolarHBondContact O-CG 3.44Å; L345-L349 PolarHBondContact O-N 2.67Å; R346-L349 PolarHBondContact O-N 2.85Å; L349-H353 WeakPolarHBondContact O-CB 3.35Å; L349-H353 PolarHBondContact O-N 3.27Å; L349-I394 HydrophobicContact CB-CG2 4.32Å; L349-I394 HydrophobicContact CD2-CG2 3.88Å; L349-F398 HydrophobicContact CD1-CD1 4.23Å; L349-F398 HydrophobicContact CD1-CD2 4.45Å; L349-F398 HydrophobicContact CD1-CG 4.18Å; L349-F398 HydrophobicContact CD2-CD2 4.03Å; L349-F398 HydrophobicContact CD2-CE2 3.8Å; L349-F398 HydrophobicContact CD2-CZ 4.11Å; L349-W422 HydrophobicContact CB-CE3 3.85Å; L349-W422 HydrophobicContact CB-CZ3 3.94Å; L349-W422 HydrophobicContact CD1-CE3 4.34Å
350	D	96.2	Very high	95.5	Very high	34 Å²	34	26.2 Å²	26.2	18%	0.182	13%	0.126	C	C	.	.	H	α-helix	trans	-62	-42.9	171.7	-179.5	55.2	0	0	0	111.5	Y329 R346 L348 H353 N354	Y329-D350 PolarHBondContact OH-OD2 3.42Å; R346-D350 VanDerWaalsContact O-CB 3.32Å; R346-D350 WeakPolarHBondContact O-CB 3.29Å; R346-D350 PolarHBondContact O-N 3.27Å; L348-D350 PolarHBondContact O-N 2.88Å; D350-H353 PolarHBondContact O-N 2.86Å; D350-N354 PolarHBondContact O-N 2.9Å; D350-N354 PolarHBondContact O-ND2 3.38Å; D350-N354 PolarHBondContact OD1-ND2 3.32Å
351	G	95.4	Very high	95	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60.6	-56.6	175.5	0	0	0	0	0	113.4	F347 L348 H353 N354 E355	F347-G351 PolarHBondContact O-N 2.92Å; L348-G351 PolarHBondContact O-N 3.37Å; G351-H353 VanDerWaalsContact C-N 3.25Å; G351-H353 PolarHBondContact O-N 3.46Å; G351-N354 PolarHBondContact O-N 2.95Å; G351-E355 PolarHBondContact O-N 3.03Å
352	L	96.4	Very high	94.5	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-56.9	-41.8	177.1	-62.3	174.2	0	0	0	111.1	L297 M298 F301 L348 E355 V356 I394	L297-L352 HydrophobicContact CG-CD2 4.18Å; M298-L352 HydrophobicContact CB-CD2 4.15Å; M298-L352 HydrophobicContact SD-CB 4.17Å; M298-L352 HydrophobicContact SD-CD2 3.78Å; M298-L352 HydrophobicContact SD-CG 4.48Å; F301-L352 HydrophobicContact CB-CD2 3.68Å; F301-L352 HydrophobicContact CD1-CD1 3.92Å; F301-L352 HydrophobicContact CD1-CD2 3.9Å; F301-L352 HydrophobicContact CD2-CD1 4.3Å; F301-L352 HydrophobicContact CE1-CD1 3.99Å; F301-L352 HydrophobicContact CE2-CD1 4.36Å; F301-L352 HydrophobicContact CG-CD1 4.09Å; F301-L352 HydrophobicContact CG-CD2 3.79Å; F301-L352 HydrophobicContact CZ-CD1 4.22Å; L348-L352 HydrophobicContact CD1-CD1 3.92Å; L348-L352 HydrophobicContact CD1-CD2 4.24Å; L348-L352 HydrophobicContact CD1-CG 3.86Å; L348-L352 HydrophobicContact CG-CD1 4.01Å; L348-L352 HydrophobicContact CG-CG 4.36Å; L348-L352 VanDerWaalsContact O-CG 3.3Å; L348-L352 WeakPolarHBondContact O-CG 3.25Å; L348-L352 PolarHBondContact O-N 3.15Å; L352-E355 PolarHBondContact O-N 3.48Å; L352-V356 WeakPolarHBondContact O-CG2 3.44Å; L352-V356 PolarHBondContact O-N 3.49Å; L352-I394 HydrophobicContact CB-CD1 4.11Å; L352-I394 HydrophobicContact CB-CG1 4.15Å
353	H	96.1	Very high	93.9	Very high	4 Å²	4	36.4 Å²	36.4	2%	0.019	18%	0.18	C	C	.	.	H	α-helix	trans	-59.9	-52.9	177.3	165.2	46.6	0	0	0	112.8	L349 D350 G351 E355 V356 N357 E390 S392 I394 W422	L349-H353 WeakPolarHBondContact O-CB 3.35Å; L349-H353 PolarHBondContact O-N 3.27Å; D350-H353 PolarHBondContact O-N 2.86Å; G351-H353 VanDerWaalsContact C-N 3.25Å; G351-H353 PolarHBondContact O-N 3.46Å; H353-E355 VanDerWaalsContact C-N 3.26Å; H353-E355 PolarHBondContact O-N 2.9Å; H353-V356 CarbonylContact O-C 3.51Å; H353-V356 VanDerWaalsContact O-C 3.29Å; H353-V356 PolarHBondContact O-N 2.75Å; H353-V356 VanDerWaalsContact O-N 3.13Å; H353-N357 WeakPolarHBondContact O-CB 3.13Å; H353-N357 PolarHBondContact O-N 2.92Å; H353-E390 IonicContact CE1-OE2 2.66Å; H353-E390 IonicContact NE2-OE2 3.39Å; H353-E390 PolarHBondContact NE2-OE2 3.03Å; H353-S392 WeakPolarHBondContact ND1-CB 3.47Å; H353-S392 PolarHBondContact ND1-OG 2.96Å; H353-I394 HydrophobicContact CB-CB 4.17Å; H353-I394 HydrophobicContact CB-CG1 4.23Å; H353-W422 HydrophobicContact CB-CH2 3.62Å; H353-W422 HydrophobicContact CB-CZ3 4.1Å; H353-W422 AromaticContact CD2-CH2 3.66Å; H353-W422 AromaticContact CD2-CZ2 3.97Å; H353-W422 AromaticContact CG-CH2 3.55Å
354	N	93.8	Very high	93	Very high	35 Å²	35	45.6 Å²	45.6	19%	0.187	21%	0.213	C	C	.	.	H	α-helix	trans	-64.7	-30.9	-176	-75.5	-79.6	0	0	0	112	N288 Y329 D350 G351 R362	N288-N354 PolarHBondContact ND2-O 2.69Å; Y329-N354 PolarHBondContact OH-ND2 2.86Å; D350-N354 PolarHBondContact O-N 2.9Å; D350-N354 PolarHBondContact O-ND2 3.38Å; D350-N354 PolarHBondContact OD1-ND2 3.32Å; G351-N354 PolarHBondContact O-N 2.95Å; N354-R362 PolarHBondContact OD1-NH2 3.21Å
355	E	92.9	Very high	91.8	Very high	11 Å²	11	48.5 Å²	48.5	5%	0.051	24%	0.244	C	C	.	.	H	α-helix	trans	-73.3	-27.1	175.3	-63.3	-162.6	166.5	0	0	113.4	N288 N294 T295 A296 L297 M298 G351 L352 H353	N288-E355 PolarHBondContact N-O 3.36Å; N294-E355 VanDerWaalsContact C-OE1 3.25Å; N294-E355 WeakPolarHBondContact O-CG 3.49Å; T295-E355 VanDerWaalsContact CA-CD 3.45Å; T295-E355 WeakPolarHBondContact CA-OE2 3.24Å; T295-E355 PolarHBondContact N-OE1 2.88Å; A296-E355 PolarHBondContact N-OE1 3.09Å; A296-E355 PolarHBondContact N-OE2 3Å; L297-E355 WeakPolarHBondContact CB-OE1 3.34Å; L297-E355 PolarHBondContact N-OE1 2.61Å; L297-E355 PolarHBondContact N-OE2 2.91Å; M298-E355 HydrophobicContact CB-CB 4.16Å; M298-E355 WeakPolarHBondContact CB-OE2 3.4Å; M298-E355 PolarHBondContact N-OE2 2.92Å; G351-E355 PolarHBondContact O-N 3.03Å; L352-E355 PolarHBondContact O-N 3.48Å; H353-E355 VanDerWaalsContact C-N 3.26Å; H353-E355 PolarHBondContact O-N 2.9Å
356	V	94.3	Very high	90.7	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	30.2	175.6	-60	0	0	0	0	114.6	D286 L287 M298 L352 H353 R358 S392 I394	D286-V356 HydrophobicContact CB-CB 3.96Å; D286-V356 HydrophobicContact CB-CG1 4.33Å; D286-V356 WeakPolarHBondContact O-CA 3.15Å; L287-V356 HydrophobicContact CD2-CG1 3.93Å; L287-V356 HydrophobicContact CG-CG1 4.43Å; M298-V356 HydrophobicContact CB-CG1 4.41Å; M298-V356 HydrophobicContact CG-CG1 3.65Å; M298-V356 HydrophobicContact SD-CG1 4.04Å; M298-V356 HydrophobicContact SD-CG2 4.47Å; L352-V356 WeakPolarHBondContact O-CG2 3.44Å; L352-V356 PolarHBondContact O-N 3.49Å; H353-V356 CarbonylContact O-C 3.51Å; H353-V356 VanDerWaalsContact O-C 3.29Å; H353-V356 PolarHBondContact O-N 2.75Å; H353-V356 VanDerWaalsContact O-N 3.13Å; V356-R358 PolarHBondContact O-N 3.38Å; V356-S392 WeakPolarHBondContact O-CB 3.41Å; V356-I394 HydrophobicContact CG2-CG1 4.15Å
357	N	94.8	Very high	89.5	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.021	30%	0.297	C	S	.	.			trans	-81.7	115.6	176.8	-173	-6.6	0	0	0	110	N288 H353 V359 R389 E390 D391	N288-N357 PolarHBondContact ND2-N 2.9Å; N288-N357 PolarHBondContact ND2-O 3.47Å; N288-N357 PolarHBondContact OD1-O 2.8Å; H353-N357 WeakPolarHBondContact O-CB 3.13Å; H353-N357 PolarHBondContact O-N 2.92Å; N357-V359 PolarHBondContact O-N 3.27Å; N357-V359 WeakPolarHBondContact OD1-CB 3.34Å; N357-V359 PolarHBondContact OD1-N 2.93Å; N357-R389 PolarHBondContact ND2-O 2.87Å; N357-E390 PolarHBondContact ND2-OE2 3.48Å; N357-D391 CarbonylContact C-O 3.58Å; N357-D391 WeakPolarHBondContact CA-O 3.5Å; N357-D391 PolarHBondContact OD1-N 2.85Å; N357-D391 VanDerWaalsContact OD1-N 3.14Å; N357-D391 PolarHBondContact OD1-O 3.4Å
358	R	93.2	Very high	88.6	Confident	95 Å²	95	57.8 Å²	57.8	36%	0.358	31%	0.307	S	S	.	.	S	Bend	trans	-63.6	-24.4	180	-61.1	158.9	-171.9	150.5	-0.3	111.7	D286 V356 T360 D391 K393 D396	D286-R358 IonicContact OD2-CZ 2.65Å; D286-R358 IonicContact OD2-NE 2.7Å; D286-R358 PolarHBondContact OD2-NE 3.35Å; D286-R358 IonicContact OD2-NH2 3.88Å; D286-R358 PolarHBondContact OD2-NH2 2.91Å; D286-R358 VanDerWaalsContact OD2-NH2 3.1Å; V356-R358 PolarHBondContact O-N 3.38Å; R358-T360 PolarHBondContact O-N 2.85Å; R358-T360 VanDerWaalsContact O-N 3.16Å; R358-D391 HydrophobicContact CB-CB 4.39Å; R358-D391 WeakPolarHBondContact CD-OD2 3.28Å; R358-D391 IonicContact CZ-OD1 3.45Å; R358-D391 PolarHBondContact N-O 3.45Å; R358-D391 IonicContact NH1-OD1 3.71Å; R358-D391 PolarHBondContact NH1-OD1 3.48Å; R358-D391 IonicContact NH1-OD2 2.96Å; R358-K393 VanDerWaalsContact NH2-N 3.19Å; R358-D396 IonicContact CZ-OD2 2.59Å; R358-D396 IonicContact NH1-OD1 2.88Å; R358-D396 IonicContact NH1-OD2 3.19Å; R358-D396 PolarHBondContact NH1-OD2 2.84Å; R358-D396 IonicContact NH2-OD2 3.89Å; R358-D396 PolarHBondContact NH2-OD2 3.49Å
359	V	90.9	Very high	87.7	Confident	30 Å²	30	63.3 Å²	63.3	18%	0.182	34%	0.337	C	S	.	.			trans	-80	90.6	170.9	-175.4	0	0	0	0	110.1	N357 V361 R362 L387 E388 D391	N357-V359 PolarHBondContact O-N 3.27Å; N357-V359 WeakPolarHBondContact OD1-CB 3.34Å; N357-V359 PolarHBondContact OD1-N 2.93Å; V359-V361 VanDerWaalsContact C-N 3.33Å; V359-R362 HydrophobicContact CG1-CG 4.12Å; V359-L387 WeakPolarHBondContact CG2-O 3.41Å; V359-E388 WeakPolarHBondContact CG1-O 3.33Å; V359-D391 HydrophobicContact CG2-CB 4.14Å
360	T	85.1	Confident	87.1	Confident	91 Å²	91	64 Å²	64	56%	0.558	34%	0.339	S	S	*	.	S	Bend	trans	-69.6	-27.4	175.5	54.5	0	0	0	0	113.5	N288 R358	N288-T360 WeakPolarHBondContact OD1-CG2 3.48Å; R358-T360 PolarHBondContact O-N 2.85Å; R358-T360 VanDerWaalsContact O-N 3.16Å
361	V	85.9	Confident	86.4	Confident	118 Å²	118	66.2 Å²	66.2	72%	0.715	35%	0.352	S	S	*	.	S	Bend	trans	-131.9	99.9	-178.8	-177.7	0	0	0	0	109.3	V359	V359-V361 VanDerWaalsContact C-N 3.33Å
362	R	86.3	Confident	85.9	Confident	103 Å²	103	72.8 Å²	72.8	39%	0.389	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-67.7	127.2	178.4	-65.4	-176.9	177.3	141.3	3	110.4	N354 V359 R389 E390	N354-R362 PolarHBondContact OD1-NH2 3.21Å; V359-R362 HydrophobicContact CG1-CG 4.12Å; R362-R389 HydrophobicContact CG-CB 4.34Å; R362-R389 PolarHBondContact NE-O 2.93Å; R362-E390 IonicContact CZ-OE1 3.14Å; R362-E390 IonicContact CZ-OE2 2.68Å; R362-E390 IonicContact NE-OE1 3.07Å; R362-E390 PolarHBondContact NE-OE1 3.47Å; R362-E390 IonicContact NE-OE2 3.77Å; R362-E390 PolarHBondContact NE-OE2 3.27Å; R362-E390 VanDerWaalsContact NE-OE2 3.07Å; R362-E390 IonicContact NH1-OE1 3.02Å; R362-E390 IonicContact NH2-OE1 2.64Å; R362-E390 PolarHBondContact NH2-OE1 3.17Å; R362-E390 IonicContact NH2-OE2 3.97Å; R362-E390 PolarHBondContact NH2-OE2 2.99Å
363	P	84	Confident	85.6	Confident	53 Å²	53	74.2 Å²	74.2	34%	0.344	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-65.1	153.3	-176.7	23.5	-32	0	0	0	112.5	E388 R389	P363-E388 WeakPolarHBondContact CD-O 3.45Å; P363-E388 HydrophobicContact CG-CB 4.27Å; P363-R389 VanDerWaalsContact O-CZ 3.25Å; P363-R389 PolarHBondContact O-NH1 3.11Å; P363-R389 PolarHBondContact O-NH2 2.9Å
364	R	79.8	Confident	85.3	Confident	238 Å²	238	80.2 Å²	80.2	90%	0.898	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-64	146.8	172.4	-61.2	-172.8	-173.2	-164.5	3.5	109.6	T366	R364-T366 PolarHBondContact O-N 2.98Å
365	G	73.4	Confident	85.2	Confident	63 Å²	63	81 Å²	81	65%	0.649	43%	0.425	S	S	*	.			trans	-77.1	105.4	-173.7	0	0	0	0	0	112.5
366	T	74.3	Confident	85.1	Confident	82 Å²	82	84.8 Å²	84.8	50%	0.503	44%	0.443	S	S	.	.			trans	-71.2	128.2	160.1	45.3	0	0	0	0	109.5	R364 E368 K385	R364-T366 PolarHBondContact O-N 2.98Å; T366-E368 VanDerWaalsContact CB-OE1 3.25Å; T366-E368 WeakPolarHBondContact CB-OE1 3.33Å; T366-E368 PolarHBondContact O-N 2.7Å; T366-E368 PolarHBondContact OG1-OE1 3.17Å; T366-K385 PolarHBondContact O-NZ 3.22Å; T366-K385 PolarHBondContact OG1-NZ 2.99Å; T366-K385 VanDerWaalsContact OG1-NZ 3.12Å
367	V	73.2	Confident	85	Confident	154 Å²	154	89.2 Å²	89.2	93%	0.933	46%	0.463	S	S	*	.			trans	-85.2	108.3	166	-178.4	0	0	0	0	106.7
368	E	78	Confident	84.9	Confident	95 Å²	95	89.7 Å²	89.7	44%	0.444	47%	0.465	S	S	.	.			trans	-114.2	131.6	175.4	-75.6	153.9	-112	0	0	107.8	T366 F370 K385	T366-E368 VanDerWaalsContact CB-OE1 3.25Å; T366-E368 WeakPolarHBondContact CB-OE1 3.33Å; T366-E368 PolarHBondContact O-N 2.7Å; T366-E368 PolarHBondContact OG1-OE1 3.17Å; E368-F370 HydrophobicContact CB-CD1 4.39Å; E368-F370 HydrophobicContact CB-CE1 3.7Å; E368-F370 HydrophobicContact CB-CE2 4.38Å; E368-F370 HydrophobicContact CB-CZ 3.7Å; E368-F370 WeakPolarHBondContact OE2-CE1 3.44Å; E368-F370 VanDerWaalsContact OE2-CZ 3.29Å; E368-F370 WeakPolarHBondContact OE2-CZ 3.45Å; E368-K385 IonicContact OE1-NZ 2.72Å; E368-K385 PolarHBondContact OE1-NZ 3.07Å; E368-K385 IonicContact OE2-NZ 2.67Å
369	D	80.6	Confident	85	Confident	115 Å²	115	85.1 Å²	85.1	62%	0.615	45%	0.448	S	S	*	.			trans	-85.1	127.4	172.3	-173.5	1	0	0	0	109.6	D371 H372	D369-D371 WeakPolarHBondContact OD1-CB 3.34Å; D369-D371 PolarHBondContact OD1-N 2.86Å; D369-H372 PolarHBondContact O-CE1 2.89Å; D369-H372 PolarHBondContact O-ND1 2.94Å; D369-H372 VanDerWaalsContact O-ND1 3.16Å
370	F	84	Confident	85.1	Confident	18 Å²	18	89.3 Å²	89.3	8%	0.079	46%	0.464	C	S	.	.			trans	-116.9	7.3	179.2	-60.5	-42.3	0	0	0	112.7	E368 H372 L373 K378 K381 M382 K385	E368-F370 HydrophobicContact CB-CD1 4.39Å; E368-F370 HydrophobicContact CB-CE1 3.7Å; E368-F370 HydrophobicContact CB-CE2 4.38Å; E368-F370 HydrophobicContact CB-CZ 3.7Å; E368-F370 WeakPolarHBondContact OE2-CE1 3.44Å; E368-F370 VanDerWaalsContact OE2-CZ 3.29Å; E368-F370 WeakPolarHBondContact OE2-CZ 3.45Å; F370-H372 PolarHBondContact O-N 2.74Å; F370-H372 VanDerWaalsContact O-N 3.11Å; F370-L373 HydrophobicContact CB-CD1 4Å; F370-L373 HydrophobicContact CD1-CD1 3.86Å; F370-L373 HydrophobicContact CG-CD1 4.2Å; F370-L373 WeakPolarHBondContact O-CB 3.33Å; F370-L373 PolarHBondContact O-N 2.64Å; F370-K378 HydrophobicContact CB-CD 4.22Å; F370-K378 HydrophobicContact CB-CG 3.86Å; F370-K381 HydrophobicContact CD1-CD 4.25Å; F370-K381 HydrophobicContact CE1-CD 4Å; F370-K381 HydrophobicContact CE2-CB 4.42Å; F370-K381 HydrophobicContact CZ-CB 4.32Å; F370-K381 HydrophobicContact CZ-CD 4.49Å; F370-M382 HydrophobicContact CD2-CG 4.25Å; F370-M382 HydrophobicContact CD2-SD 3.83Å; F370-M382 HydrophobicContact CE2-CG 4.5Å; F370-M382 HydrophobicContact CE2-SD 3.85Å; F370-K385 HydrophobicContact CE2-CD 4.36Å; F370-K385 HydrophobicContact CZ-CD 4.46Å
371	D	81.3	Confident	85.6	Confident	82 Å²	82	89.4 Å²	89.4	44%	0.439	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-3.9	178.4	-82.3	11.3	0	0	0	113.4	D369 K378	D369-D371 WeakPolarHBondContact OD1-CB 3.34Å; D369-D371 PolarHBondContact OD1-N 2.86Å; D371-K378 IonicContact OD1-NZ 3.81Å; D371-K378 PolarHBondContact OD1-NZ 2.91Å
372	H	85.6	Confident	86	Confident	138 Å²	138	86.8 Å²	86.8	64%	0.639	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-7.8	169.9	67.9	-92.9	0	0	0	114.1	D369 F370	D369-H372 PolarHBondContact O-CE1 2.89Å; D369-H372 PolarHBondContact O-ND1 2.94Å; D369-H372 VanDerWaalsContact O-ND1 3.16Å; F370-H372 PolarHBondContact O-N 2.74Å; F370-H372 VanDerWaalsContact O-N 3.11Å
373	L	89.4	Confident	86.4	Confident	30 Å²	30	83.8 Å²	83.8	16%	0.157	43%	0.426	C	S	.	.	S	Bend	trans	-99.9	157.9	-176.9	-58.9	173	0	0	0	111.8	F370 E377 K378 K381	F370-L373 HydrophobicContact CB-CD1 4Å; F370-L373 HydrophobicContact CD1-CD1 3.86Å; F370-L373 HydrophobicContact CG-CD1 4.2Å; F370-L373 WeakPolarHBondContact O-CB 3.33Å; F370-L373 PolarHBondContact O-N 2.64Å; L373-E377 HydrophobicContact CB-CB 4.35Å; L373-K378 HydrophobicContact CB-CB 4.32Å; L373-K381 HydrophobicContact CD1-CD 3.54Å; L373-K381 VanDerWaalsContact CD1-NZ 3.27Å
374	L	91.3	Very high	86.9	Confident	130 Å²	130	84.3 Å²	84.3	68%	0.681	43%	0.431	S	S	*	.			trans	-67.6	149.6	167.5	-63.4	177.1	0	0	0	110.5	E376 E377 K378	L374-E376 VanDerWaalsContact C-N 3.26Å; L374-E376 PolarHBondContact O-N 3.01Å; L374-E377 HydrophobicContact CB-CG 4.46Å; L374-E377 PolarHBondContact O-N 2.85Å; L374-K378 WeakPolarHBondContact O-CB 3.29Å; L374-K378 PolarHBondContact O-N 3.36Å
375	D	91.4	Very high	87.6	Confident	51 Å²	51	74.5 Å²	74.5	27%	0.273	40%	0.395	S	S	.	.	H	α-helix	trans	-55.7	-37	-175.7	-88.7	-32.9	0	0	0	113.7	G379 K403 T416 F418	D375-G379 PolarHBondContact O-N 3.05Å; D375-K403 VanDerWaalsContact CG-CE 3.49Å; D375-K403 WeakPolarHBondContact OD2-CE 3.36Å; D375-K403 IonicContact OD2-NZ 3.8Å; D375-K403 PolarHBondContact OD2-NZ 3.34Å; D375-T416 WeakPolarHBondContact OD1-CB 3.25Å; D375-T416 VanDerWaalsContact OD1-CG2 3.27Å; D375-T416 WeakPolarHBondContact OD1-CG2 3.38Å; D375-T416 PolarHBondContact OD1-OG1 3.48Å; D375-F418 HydrophobicContact CB-CZ 4.05Å; D375-F418 WeakPolarHBondContact O-CZ 3.41Å
376	E	90.1	Very high	88.7	Confident	91 Å²	91	73.1 Å²	73.1	43%	0.425	37%	0.37	S	S	.	.	H	α-helix	trans	-63.9	-45.2	177.5	-170.1	-166.4	168.1	0	0	111.3	L374 K380	L374-E376 VanDerWaalsContact C-N 3.26Å; L374-E376 PolarHBondContact O-N 3.01Å; E376-K380 VanDerWaalsContact CD-NZ 3.28Å; E376-K380 HydrophobicContact CG-CD 4.49Å; E376-K380 VanDerWaalsContact O-CG 3.26Å; E376-K380 WeakPolarHBondContact O-CG 3.33Å; E376-K380 PolarHBondContact O-N 2.93Å; E376-K380 VanDerWaalsContact OE1-CE 3.32Å; E376-K380 WeakPolarHBondContact OE1-CE 3.25Å; E376-K380 IonicContact OE1-NZ 3.07Å; E376-K380 PolarHBondContact OE1-NZ 3.36Å
377	E	92.7	Very high	89.7	Confident	92 Å²	92	71.9 Å²	71.9	43%	0.43	36%	0.36	S	S	.	.	H	α-helix	trans	-68.8	-41.2	177.6	-58.6	-173	130.5	0	0	111.9	L373 L374 K380 K381	L373-E377 HydrophobicContact CB-CB 4.35Å; L374-E377 HydrophobicContact CB-CG 4.46Å; L374-E377 PolarHBondContact O-N 2.85Å; E377-K380 PolarHBondContact O-N 2.99Å; E377-K381 PolarHBondContact O-N 3.5Å
378	K	93.4	Very high	90.7	Very high	14 Å²	14	69 Å²	69	6%	0.061	34%	0.337	C	S	.	.	H	α-helix	trans	-61.2	-45	175.4	-174.2	173.2	-179.7	-167.4	0	110.8	F370 D371 L373 L374 K381 M382 T416 F418	F370-K378 HydrophobicContact CB-CD 4.22Å; F370-K378 HydrophobicContact CB-CG 3.86Å; D371-K378 IonicContact OD1-NZ 3.81Å; D371-K378 PolarHBondContact OD1-NZ 2.91Å; L373-K378 HydrophobicContact CB-CB 4.32Å; L374-K378 WeakPolarHBondContact O-CB 3.29Å; L374-K378 PolarHBondContact O-N 3.36Å; K378-K381 PolarHBondContact O-N 3.25Å; K378-M382 VanDerWaalsContact O-CB 3.32Å; K378-M382 WeakPolarHBondContact O-CB 3.5Å; K378-M382 WeakPolarHBondContact O-CG 3.46Å; K378-M382 PolarHBondContact O-N 3.38Å; K378-T416 WeakPolarHBondContact CE-O 3.5Å; K378-T416 PolarHBondContact NZ-O 3.11Å; K378-T416 PolarHBondContact NZ-OG1 3.26Å; K378-F418 HydrophobicContact CB-CE2 4.03Å; K378-F418 HydrophobicContact CD-CD2 4.49Å; K378-F418 HydrophobicContact CD-CE2 3.95Å; K378-F418 HydrophobicContact CG-CD2 4.05Å; K378-F418 HydrophobicContact CG-CE2 3.77Å
379	G	93.6	Very high	91.4	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-59.7	-46	173.3	0	0	0	0	0	112.5	D375 M382 W383 Q401	D375-G379 PolarHBondContact O-N 3.05Å; G379-M382 PolarHBondContact O-N 3.18Å; G379-W383 WeakPolarHBondContact O-CB 3.49Å; G379-W383 PolarHBondContact O-N 2.83Å; G379-Q401 PolarHBondContact O-NE2 3.25Å; G379-Q401 PolarHBondContact O-OE1 3.41Å
380	K	94.3	Very high	92.2	Very high	118 Å²	118	63.5 Å²	63.5	51%	0.513	31%	0.305	S	S	.	.	H	α-helix	trans	-60.5	-48.5	175	-72.2	165.9	-174.6	169.7	0	112.5	E376 E377 W383 S384	E376-K380 VanDerWaalsContact CD-NZ 3.28Å; E376-K380 HydrophobicContact CG-CD 4.49Å; E376-K380 VanDerWaalsContact O-CG 3.26Å; E376-K380 WeakPolarHBondContact O-CG 3.33Å; E376-K380 PolarHBondContact O-N 2.93Å; E376-K380 VanDerWaalsContact OE1-CE 3.32Å; E376-K380 WeakPolarHBondContact OE1-CE 3.25Å; E376-K380 IonicContact OE1-NZ 3.07Å; E376-K380 PolarHBondContact OE1-NZ 3.36Å; E377-K380 PolarHBondContact O-N 2.99Å; K380-W383 WeakPolarHBondContact O-CB 3.49Å; K380-W383 PolarHBondContact O-N 2.87Å; K380-S384 PolarHBondContact O-N 3.37Å; K380-S384 PolarHBondContact O-OG 3.27Å
381	K	94.3	Very high	92.7	Very high	92 Å²	92	64.9 Å²	64.9	40%	0.4	31%	0.313	S	S	.	.	H	α-helix	trans	-63.9	-42.5	177.7	-71.6	-171.4	-169.5	173	0	112.1	F370 L373 E377 K378 W383 S384 K385	F370-K381 HydrophobicContact CD1-CD 4.25Å; F370-K381 HydrophobicContact CE1-CD 4Å; F370-K381 HydrophobicContact CE2-CB 4.42Å; F370-K381 HydrophobicContact CZ-CB 4.32Å; F370-K381 HydrophobicContact CZ-CD 4.49Å; L373-K381 HydrophobicContact CD1-CD 3.54Å; L373-K381 VanDerWaalsContact CD1-NZ 3.27Å; E377-K381 PolarHBondContact O-N 3.5Å; K378-K381 PolarHBondContact O-N 3.25Å; K381-W383 VanDerWaalsContact C-N 3.26Å; K381-W383 PolarHBondContact O-N 3.21Å; K381-S384 PolarHBondContact O-N 2.89Å; K381-K385 WeakPolarHBondContact O-CB 3.35Å; K381-K385 PolarHBondContact O-N 3.16Å
382	M	94.1	Very high	93.5	Very high	63 Å²	63	61 Å²	61	31%	0.31	29%	0.292	S	S	.	.	H	α-helix	trans	-63.2	-32.3	174.6	-71.8	-65.5	-67.4	0	0	112.4	F370 K378 G379 Y386 F418	F370-M382 HydrophobicContact CD2-CG 4.25Å; F370-M382 HydrophobicContact CD2-SD 3.83Å; F370-M382 HydrophobicContact CE2-CG 4.5Å; F370-M382 HydrophobicContact CE2-SD 3.85Å; K378-M382 VanDerWaalsContact O-CB 3.32Å; K378-M382 WeakPolarHBondContact O-CB 3.5Å; K378-M382 WeakPolarHBondContact O-CG 3.46Å; K378-M382 PolarHBondContact O-N 3.38Å; G379-M382 PolarHBondContact O-N 3.18Å; M382-Y386 PolarHBondContact O-N 3Å; M382-Y386 VanDerWaalsContact O-N 3.16Å; M382-F418 HydrophobicContact CB-CB 3.93Å; M382-F418 HydrophobicContact CG-CB 4.27Å
383	W	95.6	Very high	94	Very high	40 Å²	40	56.6 Å²	56.6	15%	0.152	27%	0.271	C	S	.	.	H	α-helix	trans	-69.9	-45.1	173.2	-176.5	-100.1	0	0	0	112.2	G379 K380 K381 K385 Y386 L387 V399 Q401 K476	G379-W383 WeakPolarHBondContact O-CB 3.49Å; G379-W383 PolarHBondContact O-N 2.83Å; K380-W383 WeakPolarHBondContact O-CB 3.49Å; K380-W383 PolarHBondContact O-N 2.87Å; K381-W383 VanDerWaalsContact C-N 3.26Å; K381-W383 PolarHBondContact O-N 3.21Å; W383-K385 VanDerWaalsContact C-N 3.34Å; W383-K385 PolarHBondContact O-N 2.65Å; W383-Y386 HydrophobicContact CE3-CD1 4.23Å; W383-Y386 HydrophobicContact CH2-CD1 4.23Å; W383-Y386 HydrophobicContact CH2-CE1 4.23Å; W383-Y386 AromaticContact CZ3-CD1 3.97Å; W383-Y386 HydrophobicContact CZ3-CD1 3.97Å; W383-Y386 HydrophobicContact CZ3-CE1 4.23Å; W383-Y386 WeakPolarHBondContact O-CB 3.19Å; W383-Y386 PolarHBondContact O-N 2.89Å; W383-Y386 VanDerWaalsContact O-N 3.17Å; W383-L387 HydrophobicContact CZ2-CD2 4.11Å; W383-L387 HydrophobicContact CZ2-CG 4.45Å; W383-L387 PolarHBondContact O-N 3.06Å; W383-V399 HydrophobicContact CH2-CB 4.21Å; W383-V399 HydrophobicContact CH2-CG1 3.78Å; W383-V399 HydrophobicContact CZ3-CG1 3.95Å; W383-Q401 HydrophobicContact CE3-CB 4.03Å; W383-Q401 HydrophobicContact CE3-CG 4.34Å; W383-Q401 HydrophobicContact CZ3-CB 4.27Å; W383-K476 HydrophobicContact CD2-CD 3.88Å; W383-K476 HydrophobicContact CE3-CD 4.04Å; W383-K476 HydrophobicContact CH2-CD 4.01Å; W383-K476 HydrophobicContact CZ2-CD 3.85Å; W383-K476 HydrophobicContact CZ3-CD 4.1Å
384	S	95.3	Very high	94.4	Very high	65 Å²	65	55.1 Å²	55.1	46%	0.455	26%	0.264	S	S	.	.	H	α-helix	trans	-58.3	-45.8	173.4	-60.3	0	0	0	0	111.7	K380 K381 Y386 L387 E388	K380-S384 PolarHBondContact O-N 3.37Å; K380-S384 PolarHBondContact O-OG 3.27Å; K381-S384 PolarHBondContact O-N 2.89Å; S384-Y386 PolarHBondContact O-N 2.91Å; S384-L387 PolarHBondContact O-N 2.77Å; S384-E388 WeakPolarHBondContact O-CG 3.19Å; S384-E388 PolarHBondContact O-N 3.24Å
385	K	93.8	Very high	94.7	Very high	32 Å²	32	49.2 Å²	49.2	14%	0.139	23%	0.233	C	C	.	.	H	α-helix	trans	-66.6	-16.5	178.8	-165.3	159.3	-174.7	164.4	0	114.4	T366 E368 F370 K381 W383	T366-K385 PolarHBondContact O-NZ 3.22Å; T366-K385 PolarHBondContact OG1-NZ 2.99Å; T366-K385 VanDerWaalsContact OG1-NZ 3.12Å; E368-K385 IonicContact OE1-NZ 2.72Å; E368-K385 PolarHBondContact OE1-NZ 3.07Å; E368-K385 IonicContact OE2-NZ 2.67Å; F370-K385 HydrophobicContact CE2-CD 4.36Å; F370-K385 HydrophobicContact CZ-CD 4.46Å; K381-K385 WeakPolarHBondContact O-CB 3.35Å; K381-K385 PolarHBondContact O-N 3.16Å; W383-K385 VanDerWaalsContact C-N 3.34Å; W383-K385 PolarHBondContact O-N 2.65Å
386	Y	95.5	Very high	95	Very high	33 Å²	33	49.5 Å²	49.5	13%	0.129	23%	0.234	C	C	.	.	H	α-helix	trans	-82	-47.2	167.5	172.5	-110.5	0	0	0	111.4	M382 W383 S384 E388 R389 E390 V395 V399 P420 W422	M382-Y386 PolarHBondContact O-N 3Å; M382-Y386 VanDerWaalsContact O-N 3.16Å; W383-Y386 HydrophobicContact CE3-CD1 4.23Å; W383-Y386 HydrophobicContact CH2-CD1 4.23Å; W383-Y386 HydrophobicContact CH2-CE1 4.23Å; W383-Y386 AromaticContact CZ3-CD1 3.97Å; W383-Y386 HydrophobicContact CZ3-CD1 3.97Å; W383-Y386 HydrophobicContact CZ3-CE1 4.23Å; W383-Y386 WeakPolarHBondContact O-CB 3.19Å; W383-Y386 PolarHBondContact O-N 2.89Å; W383-Y386 VanDerWaalsContact O-N 3.17Å; S384-Y386 PolarHBondContact O-N 2.91Å; Y386-E388 VanDerWaalsContact C-N 3.28Å; Y386-E388 PolarHBondContact O-N 3.11Å; Y386-R389 WeakPolarHBondContact O-CB 3.5Å; Y386-R389 PolarHBondContact O-N 2.88Å; Y386-E390 HydrophobicContact CD2-CB 4.27Å; Y386-E390 HydrophobicContact CD2-CG 4.02Å; Y386-E390 HydrophobicContact CE1-CB 4.34Å; Y386-E390 HydrophobicContact CE2-CB 3.66Å; Y386-E390 HydrophobicContact CE2-CG 3.48Å; Y386-E390 VanDerWaalsContact CE2-CG 3.48Å; Y386-E390 PolarHBondContact O-N 3.4Å; Y386-V395 HydrophobicContact CE1-CG1 4.03Å; Y386-V399 HydrophobicContact CE1-CG1 3.84Å; Y386-P420 HydrophobicContact CD1-CB 4.15Å; Y386-P420 HydrophobicContact CD2-CB 4.14Å; Y386-P420 HydrophobicContact CD2-CG 3.74Å; Y386-P420 HydrophobicContact CE1-CB 3.98Å; Y386-P420 HydrophobicContact CE2-CB 3.97Å; Y386-P420 HydrophobicContact CE2-CG 3.72Å; Y386-P420 HydrophobicContact CG-CB 4.23Å; Y386-P420 HydrophobicContact CG-CG 4.2Å; Y386-W422 WeakPolarHBondContact OH-CZ2 3.49Å
387	L	96.2	Very high	95.4	Very high	56 Å²	56	45.2 Å²	45.2	29%	0.293	21%	0.214	S	C	.	.	H	α-helix	trans	-64.2	-28.3	176.7	-66.3	-176.5	0	0	0	113.5	V359 W383 S384 R389 V395	V359-L387 WeakPolarHBondContact CG2-O 3.41Å; W383-L387 HydrophobicContact CZ2-CD2 4.11Å; W383-L387 HydrophobicContact CZ2-CG 4.45Å; W383-L387 PolarHBondContact O-N 3.06Å; S384-L387 PolarHBondContact O-N 2.77Å; L387-R389 PolarHBondContact O-N 3.1Å; L387-V395 HydrophobicContact CD2-CG1 3.79Å
388	E	94.4	Very high	95.6	Very high	95 Å²	95	40.9 Å²	40.9	44%	0.444	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-12.3	167.7	-79	169.1	-149.2	0	0	114.2	V359 P363 S384 Y386	V359-E388 WeakPolarHBondContact CG1-O 3.33Å; P363-E388 WeakPolarHBondContact CD-O 3.45Å; P363-E388 HydrophobicContact CG-CB 4.27Å; S384-E388 WeakPolarHBondContact O-CG 3.19Å; S384-E388 PolarHBondContact O-N 3.24Å; Y386-E388 VanDerWaalsContact C-N 3.28Å; Y386-E388 PolarHBondContact O-N 3.11Å
389	R	93.3	Very high	95.9	Very high	60 Å²	60	40.4 Å²	40.4	23%	0.226	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.2	-39.6	-176.2	-61	174.1	-179.3	-69.8	-20.4	112.3	N357 R362 P363 Y386 L387	N357-R389 PolarHBondContact ND2-O 2.87Å; R362-R389 HydrophobicContact CG-CB 4.34Å; R362-R389 PolarHBondContact NE-O 2.93Å; P363-R389 VanDerWaalsContact O-CZ 3.25Å; P363-R389 PolarHBondContact O-NH1 3.11Å; P363-R389 PolarHBondContact O-NH2 2.9Å; Y386-R389 WeakPolarHBondContact O-CB 3.5Å; Y386-R389 PolarHBondContact O-N 2.88Å; L387-R389 PolarHBondContact O-N 3.1Å
390	E	95.6	Very high	96.1	Very high	33 Å²	33	40.4 Å²	40.4	15%	0.154	19%	0.192	C	C	.	.			trans	-131.5	82.3	-168.7	-44.6	-49.8	169	0	0	110.3	H353 N357 R362 Y386	H353-E390 IonicContact CE1-OE2 2.66Å; H353-E390 IonicContact NE2-OE2 3.39Å; H353-E390 PolarHBondContact NE2-OE2 3.03Å; N357-E390 PolarHBondContact ND2-OE2 3.48Å; R362-E390 IonicContact CZ-OE1 3.14Å; R362-E390 IonicContact CZ-OE2 2.68Å; R362-E390 IonicContact NE-OE1 3.07Å; R362-E390 PolarHBondContact NE-OE1 3.47Å; R362-E390 IonicContact NE-OE2 3.77Å; R362-E390 PolarHBondContact NE-OE2 3.27Å; R362-E390 VanDerWaalsContact NE-OE2 3.07Å; R362-E390 IonicContact NH1-OE1 3.02Å; R362-E390 IonicContact NH2-OE1 2.64Å; R362-E390 PolarHBondContact NH2-OE1 3.17Å; R362-E390 IonicContact NH2-OE2 3.97Å; R362-E390 PolarHBondContact NH2-OE2 2.99Å; Y386-E390 HydrophobicContact CD2-CB 4.27Å; Y386-E390 HydrophobicContact CD2-CG 4.02Å; Y386-E390 HydrophobicContact CE1-CB 4.34Å; Y386-E390 HydrophobicContact CE2-CB 3.66Å; Y386-E390 HydrophobicContact CE2-CG 3.48Å; Y386-E390 VanDerWaalsContact CE2-CG 3.48Å; Y386-E390 PolarHBondContact O-N 3.4Å
391	D	96.3	Very high	96.2	Very high	47 Å²	47	35.1 Å²	35.1	25%	0.251	17%	0.17	S	C	.	.			trans	-119.8	121.6	175.9	176	21.2	0	0	0	110.1	N357 R358 V359	N357-D391 CarbonylContact C-O 3.58Å; N357-D391 WeakPolarHBondContact CA-O 3.5Å; N357-D391 PolarHBondContact OD1-N 2.85Å; N357-D391 VanDerWaalsContact OD1-N 3.14Å; N357-D391 PolarHBondContact OD1-O 3.4Å; R358-D391 HydrophobicContact CB-CB 4.39Å; R358-D391 WeakPolarHBondContact CD-OD2 3.28Å; R358-D391 IonicContact CZ-OD1 3.45Å; R358-D391 PolarHBondContact N-O 3.45Å; R358-D391 IonicContact NH1-OD1 3.71Å; R358-D391 PolarHBondContact NH1-OD1 3.48Å; R358-D391 IonicContact NH1-OD2 2.96Å; V359-D391 HydrophobicContact CG2-CB 4.14Å
392	S	97.1	Very high	96.4	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.154	C	C	.	.	S	Bend	trans	-165.6	167.6	-179.7	65.7	0	0	0	0	111.5	H353 V356 I394 V395 D396	H353-S392 WeakPolarHBondContact ND1-CB 3.47Å; H353-S392 PolarHBondContact ND1-OG 2.96Å; V356-S392 WeakPolarHBondContact O-CB 3.41Å; S392-I394 PolarHBondContact O-N 2.78Å; S392-I394 VanDerWaalsContact O-N 3.13Å; S392-I394 PolarHBondContact OG-N 2.82Å; S392-V395 PolarHBondContact O-N 2.87Å; S392-V395 VanDerWaalsContact O-N 3.09Å; S392-V395 WeakPolarHBondContact OG-CG2 3.39Å; S392-V395 PolarHBondContact OG-N 2.7Å; S392-D396 PolarHBondContact O-N 3.47Å
393	K	96.8	Very high	96.5	Very high	46 Å²	46	29.8 Å²	29.8	20%	0.2	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-24.5	171.3	-174.8	63.3	-177.2	-177.2	0	114	S273 Y277 R358 D396 V397	S273-K393 WeakPolarHBondContact O-CE 3.28Å; S273-K393 VanDerWaalsContact OG-CE 3.28Å; S273-K393 WeakPolarHBondContact OG-CE 3.48Å; S273-K393 PolarHBondContact OG-NZ 3.23Å; Y277-K393 HydrophobicContact CD1-CB 4.18Å; Y277-K393 HydrophobicContact CD1-CG 3.73Å; Y277-K393 HydrophobicContact CD2-CB 4.11Å; Y277-K393 HydrophobicContact CD2-CD 4.17Å; Y277-K393 HydrophobicContact CD2-CG 3.63Å; Y277-K393 HydrophobicContact CE1-CB 3.69Å; Y277-K393 HydrophobicContact CE1-CG 3.79Å; Y277-K393 HydrophobicContact CE2-CB 3.62Å; Y277-K393 HydrophobicContact CE2-CD 4.42Å; Y277-K393 HydrophobicContact CE2-CG 3.7Å; Y277-K393 HydrophobicContact CG-CB 4.34Å; Y277-K393 HydrophobicContact CG-CD 4.41Å; Y277-K393 HydrophobicContact CG-CG 3.62Å; R358-K393 VanDerWaalsContact NH2-N 3.19Å; K393-D396 WeakPolarHBondContact CA-OD2 3.5Å; K393-D396 HydrophobicContact CD-CB 4.37Å; K393-V397 HydrophobicContact CD-CG2 4.44Å; K393-V397 WeakPolarHBondContact O-CG2 3.37Å
394	I	97.9	Very high	96.5	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-41.5	177.5	-41.9	-56.1	0	0	0	109.9	L274 L349 L352 H353 V356 S392 V397 F398 W422	L274-I394 HydrophobicContact CD1-CD1 3.74Å; L349-I394 HydrophobicContact CB-CG2 4.32Å; L349-I394 HydrophobicContact CD2-CG2 3.88Å; L352-I394 HydrophobicContact CB-CD1 4.11Å; L352-I394 HydrophobicContact CB-CG1 4.15Å; H353-I394 HydrophobicContact CB-CB 4.17Å; H353-I394 HydrophobicContact CB-CG1 4.23Å; V356-I394 HydrophobicContact CG2-CG1 4.15Å; S392-I394 PolarHBondContact O-N 2.78Å; S392-I394 VanDerWaalsContact O-N 3.13Å; S392-I394 PolarHBondContact OG-N 2.82Å; I394-V397 PolarHBondContact O-N 3.15Å; I394-F398 HydrophobicContact CG2-CD2 3.74Å; I394-F398 HydrophobicContact CG2-CE2 4.25Å; I394-F398 PolarHBondContact O-N 2.99Å; I394-W422 HydrophobicContact CB-CZ3 4.32Å; I394-W422 HydrophobicContact CG2-CE3 4.47Å; I394-W422 HydrophobicContact CG2-CH2 4.38Å; I394-W422 HydrophobicContact CG2-CZ3 3.63Å
395	V	98	Very high	96.6	Very high	5 Å²	5	26.4 Å²	26.4	3%	0.03	13%	0.128	C	C	.	.	H	α-helix	trans	-62.7	-42.5	172.8	174.2	0	0	0	0	111.2	Y386 L387 S392 V397 V399 W422	Y386-V395 HydrophobicContact CE1-CG1 4.03Å; L387-V395 HydrophobicContact CD2-CG1 3.79Å; S392-V395 PolarHBondContact O-N 2.87Å; S392-V395 VanDerWaalsContact O-N 3.09Å; S392-V395 WeakPolarHBondContact OG-CG2 3.39Å; S392-V395 PolarHBondContact OG-N 2.7Å; V395-V397 PolarHBondContact O-N 2.86Å; V395-V399 HydrophobicContact CB-CG2 4.3Å; V395-V399 HydrophobicContact CG1-CB 4.16Å; V395-V399 HydrophobicContact CG1-CG2 4.3Å; V395-V399 HydrophobicContact CG2-CG2 4.19Å; V395-V399 PolarHBondContact O-N 3.25Å; V395-W422 HydrophobicContact CG2-CH2 3.94Å; V395-W422 HydrophobicContact CG2-CZ2 3.97Å
396	D	97.1	Very high	96.7	Very high	58 Å²	58	27.3 Å²	27.3	31%	0.31	13%	0.134	S	C	.	.	H	α-helix	trans	-54	-22.9	174.7	-75.6	-44.5	0	0	0	114.1	R358 S392 K393 K479	R358-D396 IonicContact CZ-OD2 2.59Å; R358-D396 IonicContact NH1-OD1 2.88Å; R358-D396 IonicContact NH1-OD2 3.19Å; R358-D396 PolarHBondContact NH1-OD2 2.84Å; R358-D396 IonicContact NH2-OD2 3.89Å; R358-D396 PolarHBondContact NH2-OD2 3.49Å; S392-D396 PolarHBondContact O-N 3.47Å; K393-D396 WeakPolarHBondContact CA-OD2 3.5Å; K393-D396 HydrophobicContact CD-CB 4.37Å; D396-K479 WeakPolarHBondContact O-CD 3.24Å; D396-K479 PolarHBondContact O-NZ 2.75Å
397	V	97.7	Very high	96.8	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.006	14%	0.142	C	C	.	.	H	α-helix	trans	-111	-53.9	-168.3	172.5	0	0	0	0	111.4	K393 I394 V395 K479 I480	K393-V397 HydrophobicContact CD-CG2 4.44Å; K393-V397 WeakPolarHBondContact O-CG2 3.37Å; I394-V397 PolarHBondContact O-N 3.15Å; V395-V397 PolarHBondContact O-N 2.86Å; V397-K479 PolarHBondContact O-N 3.1Å; V397-I480 HydrophobicContact CG1-CB 3.93Å; V397-I480 HydrophobicContact CG1-CG1 3.43Å; V397-I480 VanDerWaalsContact CG1-CG1 3.43Å; V397-I480 PolarHBondContact O-N 2.91Å
398	F	98.4	Very high	96.9	Very high	1 Å²	1	25.6 Å²	25.6	0%	0.004	13%	0.129	C	C	.	.	H	α-helix	trans	-99.3	-17	-167.8	-65.5	-83	0	0	0	115	L268 T271 L274 L349 I394 P478 I480 V482	L268-F398 HydrophobicContact CD2-CE1 4.17Å; L268-F398 HydrophobicContact CD2-CZ 3.68Å; T271-F398 HydrophobicContact CG2-CZ 4.04Å; L274-F398 HydrophobicContact CD2-CE2 4.16Å; L274-F398 HydrophobicContact CD2-CZ 4.22Å; L349-F398 HydrophobicContact CD1-CD1 4.23Å; L349-F398 HydrophobicContact CD1-CD2 4.45Å; L349-F398 HydrophobicContact CD1-CG 4.18Å; L349-F398 HydrophobicContact CD2-CD2 4.03Å; L349-F398 HydrophobicContact CD2-CE2 3.8Å; L349-F398 HydrophobicContact CD2-CZ 4.11Å; I394-F398 HydrophobicContact CG2-CD2 3.74Å; I394-F398 HydrophobicContact CG2-CE2 4.25Å; I394-F398 PolarHBondContact O-N 2.99Å; F398-P478 VanDerWaalsContact O-CB 3.3Å; F398-P478 WeakPolarHBondContact O-CB 3.2Å; F398-I480 HydrophobicContact CD1-CB 3.99Å; F398-I480 HydrophobicContact CD1-CG2 3.77Å; F398-I480 HydrophobicContact CE1-CB 4.02Å; F398-I480 HydrophobicContact CE1-CG2 3.51Å; F398-I480 HydrophobicContact CZ-CG2 4.44Å; F398-V482 HydrophobicContact CD1-CG2 3.95Å; F398-V482 HydrophobicContact CE1-CG2 4.21Å
399	V	98.4	Very high	97	Very high	3 Å²	3	24.5 Å²	24.5	2%	0.018	13%	0.132	C	C	.	.			trans	-95.2	121.9	-166.7	-174	0	0	0	0	113	W383 Y386 V395 P420 F421 W422	W383-V399 HydrophobicContact CH2-CB 4.21Å; W383-V399 HydrophobicContact CH2-CG1 3.78Å; W383-V399 HydrophobicContact CZ3-CG1 3.95Å; Y386-V399 HydrophobicContact CE1-CG1 3.84Å; V395-V399 HydrophobicContact CB-CG2 4.3Å; V395-V399 HydrophobicContact CG1-CB 4.16Å; V395-V399 HydrophobicContact CG1-CG2 4.3Å; V395-V399 HydrophobicContact CG2-CG2 4.19Å; V395-V399 PolarHBondContact O-N 3.25Å; V399-P420 HydrophobicContact CG1-CB 4Å; V399-F421 VanDerWaalsContact CA-O 3.29Å; V399-F421 WeakPolarHBondContact CA-O 3.38Å; V399-W422 HydrophobicContact CG2-CD2 3.56Å; V399-W422 HydrophobicContact CG2-CE3 4.06Å; V399-W422 HydrophobicContact CG2-CG 3.92Å; V399-W422 HydrophobicContact CG2-CH2 4.14Å; V399-W422 HydrophobicContact CG2-CZ2 3.69Å; V399-W422 HydrophobicContact CG2-CZ3 4.34Å
400	G	97.2	Very high	97.2	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	-174.5	168.5	0	0	0	0	0	112	P420 F421 K476	G400-P420 CarbonylContact O-C 3.48Å; G400-P420 WeakPolarHBondContact O-CA 3.31Å; G400-F421 VanDerWaalsContact C-CE1 3.43Å; G400-F421 PolarHBondContact N-O 2.68Å; G400-F421 PolarHBondContact O-N 3.27Å; G400-K476 CarbonylContact C-O 3.57Å; G400-K476 WeakPolarHBondContact CA-O 3.46Å
401	Q	97.5	Very high	97.3	Very high	8 Å²	8	28.2 Å²	28.2	4%	0.037	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	127.5	176.7	-164.8	-174.5	42.5	0	0	110.1	G379 W383 F418 D419 F421 Q475 K476	G379-Q401 PolarHBondContact O-NE2 3.25Å; G379-Q401 PolarHBondContact O-OE1 3.41Å; W383-Q401 HydrophobicContact CE3-CB 4.03Å; W383-Q401 HydrophobicContact CE3-CG 4.34Å; W383-Q401 HydrophobicContact CZ3-CB 4.27Å; Q401-F418 HydrophobicContact CG-CB 4.23Å; Q401-D419 CarbonylContact C-O 3.6Å; Q401-D419 WeakPolarHBondContact CA-O 3.25Å; Q401-F421 VanDerWaalsContact N-CE1 3.28Å; Q401-Q475 HydrophobicContact CB-CB 4.38Å; Q401-Q475 HydrophobicContact CG-CB 4.49Å; Q401-Q475 PolarHBondContact O-N 2.81Å; Q401-K476 HydrophobicContact CB-CB 3.71Å; Q401-K476 PolarHBondContact N-O 2.86Å; Q401-K476 PolarHBondContact O-N 2.92Å
402	L	97.5	Very high	97.3	Very high	15 Å²	15	28.6 Å²	28.6	8%	0.079	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	146.7	169.3	-74.4	167.4	0	0	0	109.8	F418 D419 F421 L424 F445 F472 T473 I474	L402-F418 CarbonylContact O-C 3.47Å; L402-F418 VanDerWaalsContact O-CA 3.28Å; L402-F418 WeakPolarHBondContact O-CA 3.49Å; L402-D419 PolarHBondContact N-O 2.72Å; L402-D419 PolarHBondContact O-N 2.77Å; L402-F421 HydrophobicContact CB-CD1 4.45Å; L402-F421 HydrophobicContact CD1-CB 4.39Å; L402-F421 HydrophobicContact CD1-CD1 4.28Å; L402-F421 HydrophobicContact CD2-CD1 4.46Å; L402-F421 HydrophobicContact CD2-CE1 4.42Å; L402-F421 HydrophobicContact CG-CD1 3.66Å; L402-F421 HydrophobicContact CG-CE1 4.07Å; L402-F421 HydrophobicContact CG-CG 4.35Å; L402-L424 HydrophobicContact CD1-CD2 4.03Å; L402-L424 HydrophobicContact CD2-CD2 4.27Å; L402-L424 HydrophobicContact CG-CD2 4.38Å; L402-F445 HydrophobicContact CD1-CE1 4.38Å; L402-F445 HydrophobicContact CD1-CZ 3.98Å; L402-F445 HydrophobicContact CD2-CE1 3.99Å; L402-F445 HydrophobicContact CD2-CZ 4.41Å; L402-F472 HydrophobicContact CD1-CD1 4.49Å; L402-T473 WeakPolarHBondContact CA-O 3.48Å; L402-I474 HydrophobicContact CD2-CG1 3.95Å
403	K	96.5	Very high	97.2	Very high	27 Å²	27	30 Å²	30	12%	0.117	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	116	163.6	177	-178.5	-178.5	178.6	0	108	D375 V417 F418 F472 T473 Q475	D375-K403 VanDerWaalsContact CG-CE 3.49Å; D375-K403 WeakPolarHBondContact OD2-CE 3.36Å; D375-K403 IonicContact OD2-NZ 3.8Å; D375-K403 PolarHBondContact OD2-NZ 3.34Å; K403-V417 WeakPolarHBondContact CA-O 3.38Å; K403-F418 HydrophobicContact CB-CD1 4.05Å; K403-F418 HydrophobicContact CB-CE1 3.78Å; K403-F418 HydrophobicContact CD-CE1 3.91Å; K403-F418 HydrophobicContact CD-CZ 4.05Å; K403-F418 HydrophobicContact CG-CD1 4.32Å; K403-F418 HydrophobicContact CG-CE1 3.69Å; K403-F418 HydrophobicContact CG-CZ 3.94Å; K403-F472 WeakPolarHBondContact O-CA 3.47Å; K403-T473 PolarHBondContact N-O 2.71Å; K403-T473 PolarHBondContact O-N 2.74Å; K403-Q475 HydrophobicContact CB-CB 4.39Å
404	S	96.6	Very high	97	Very high	13 Å²	13	30.3 Å²	30.3	9%	0.091	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	112.7	171	171.6	0	0	0	0	108.8	T416 V417 K470	S404-T416 WeakPolarHBondContact O-CA 3.35Å; S404-V417 PolarHBondContact N-O 3.46Å; S404-V417 PolarHBondContact O-N 3.1Å; S404-K470 VanDerWaalsContact OG-CE 3.29Å; S404-K470 WeakPolarHBondContact OG-CE 3.27Å
405	S	95.8	Very high	96.8	Very high	21 Å²	21	32.2 Å²	32.2	15%	0.147	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	132.7	176.6	-53	0	0	0	0	110	K470 K471	S405-K470 VanDerWaalsContact O-CA 3.32Å; S405-K470 WeakPolarHBondContact O-CA 3.4Å; S405-K471 PolarHBondContact N-O 2.67Å; S405-K471 PolarHBondContact O-N 2.87Å
406	L	97	Very high	96.7	Very high	52 Å²	52	32.5 Å²	32.5	27%	0.272	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	105.6	178.7	-178.3	69.1	0	0	0	110.6	C414 S415 L451 P457 C468 T469 K470	L406-C414 WeakPolarHBondContact O-CA 3.37Å; L406-S415 PolarHBondContact N-O 3.05Å; L406-S415 PolarHBondContact O-N 3.35Å; L406-L451 HydrophobicContact CD1-CD1 3.94Å; L406-P457 HydrophobicContact CD1-CG 4.4Å; L406-P457 HydrophobicContact CD2-CG 4.33Å; L406-C468 HydrophobicContact CD1-CB 3.72Å; L406-C468 HydrophobicContact CG-CB 4.28Å; L406-T469 CarbonylContact C-O 3.49Å; L406-T469 WeakPolarHBondContact CA-O 3.28Å; L406-K470 HydrophobicContact CD1-CB 4.01Å
407	T	97.5	Very high	96.5	Very high	49 Å²	49	32.9 Å²	32.9	30%	0.301	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	124.5	-172.7	-52.7	0	0	0	0	111.8	S409 C414 C468 T469	T407-S409 PolarHBondContact O-N 2.89Å; T407-C414 HydrophobicContact CG2-CB 4.49Å; T407-C414 PolarHBondContact OG1-SG 3.09Å; T407-C468 CarbonylContact O-C 3.25Å; T407-C468 WeakPolarHBondContact O-CA 3.31Å; T407-C468 VanDerWaalsContact O-CB 3.29Å; T407-C468 WeakPolarHBondContact O-CB 3.38Å; T407-T469 PolarHBondContact N-O 3.35Å; T407-T469 PolarHBondContact O-N 2.91Å
408	C	97.9	Very high	96.5	Very high	3 Å²	3	33 Å²	33	2%	0.02	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	116.2	176.4	-179.2	0	0	0	0	111.9	H410 C411 G412 F413 C459	C408-H410 PolarHBondContact O-N 2.92Å; C408-C411 PolarHBondContact O-N 2.89Å; C408-G412 WeakPolarHBondContact O-CA 3.36Å; C408-G412 PolarHBondContact O-N 3.42Å; C408-F413 PolarHBondContact N-O 3.48Å; C408-C459 HydrophobicContact CB-CB 4.24Å
409	S	97.4	Very high	96.3	Very high	72 Å²	72	36.4 Å²	36.4	50%	0.503	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-3.2	-178.5	66.8	0	0	0	0	115.3	T407 R467	T407-S409 PolarHBondContact O-N 2.89Å; S409-R467 WeakPolarHBondContact CB-O 3.39Å; S409-R467 PolarHBondContact N-O 2.66Å; S409-R467 WeakPolarHBondContact OG-CB 3.36Å; S409-R467 PolarHBondContact OG-O 3.42Å
410	H	97.3	Very high	96.3	Very high	118 Å²	118	38.9 Å²	38.9	55%	0.546	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-31.2	178.2	-178.6	-53.7	0	0	0	113.3	C408 R466	C408-H410 PolarHBondContact O-N 2.92Å; H410-R466 HydrophobicContact CB-CG 4.32Å; H410-R466 VanDerWaalsContact CD2-CZ 3.47Å; H410-R466 PolarHBondContact CD2-NE 3.47Å; H410-R466 PolarHBondContact CD2-NH2 2.56Å; H410-R466 VanDerWaalsContact CD2-NH2 3.34Å; H410-R466 PolarHBondContact NE2-NH2 3.47Å
411	C	96.9	Very high	96.4	Very high	53 Å²	53	39.5 Å²	39.5	36%	0.358	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-129.8	8.1	-174.6	68.3	0	0	0	0	114.1	C408 F413 C459 C462	C408-C411 PolarHBondContact O-N 2.89Å; C411-F413 PolarHBondContact O-N 2.96Å; C411-C459 VanDerWaalsContact SG-SG 3.66Å; C411-C462 PolarHBondContact SG-SG 3.39Å
412	G	96.1	Very high	96.4	Very high	56 Å²	56	41 Å²	41	58%	0.577	25%	0.248	S	C	*	.			trans	68.2	-10.5	179.5	0	0	0	0	0	115.4	C408 C414	C408-G412 WeakPolarHBondContact O-CA 3.36Å; C408-G412 PolarHBondContact O-N 3.42Å; G412-C414 PolarHBondContact O-N 2.66Å; G412-C414 VanDerWaalsContact O-N 3.08Å
413	F	94.7	Very high	96.4	Very high	28 Å²	28	40.9 Å²	40.9	12%	0.123	25%	0.247	C	C	.	.			trans	-61.6	115	-176.9	-179.1	-120.4	0	0	0	111.4	C408 C411 Y460 R461	C408-F413 PolarHBondContact N-O 3.48Å; C411-F413 PolarHBondContact O-N 2.96Å; F413-Y460 HydrophobicContact CE1-CD1 4.49Å; F413-R461 HydrophobicContact CB-CG 4.19Å; F413-R461 HydrophobicContact CD1-CG 3.9Å; F413-R461 HydrophobicContact CD2-CG 4.27Å; F413-R461 VanDerWaalsContact CD2-CZ 3.48Å; F413-R461 HydrophobicContact CE1-CG 4.35Å; F413-R461 HydrophobicContact CG-CG 3.85Å
414	C	94	Very high	96.5	Very high	53 Å²	53	39.7 Å²	39.7	36%	0.358	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	123.6	167.9	-174.3	0	0	0	0	109.1	L406 T407 G412	L406-C414 WeakPolarHBondContact O-CA 3.37Å; T407-C414 HydrophobicContact CG2-CB 4.49Å; T407-C414 PolarHBondContact OG1-SG 3.09Å; G412-C414 PolarHBondContact O-N 2.66Å; G412-C414 VanDerWaalsContact O-N 3.08Å
415	S	93.4	Very high	96.6	Very high	40 Å²	40	40.2 Å²	40.2	28%	0.28	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	133	168	-176.4	0	0	0	0	108.9	L406	L406-S415 PolarHBondContact N-O 3.05Å; L406-S415 PolarHBondContact O-N 3.35Å
416	T	94.9	Very high	96.7	Very high	11 Å²	11	39.2 Å²	39.2	7%	0.067	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	134.6	-176.3	54.7	0	0	0	0	111.7	D375 K378 S404	D375-T416 WeakPolarHBondContact OD1-CB 3.25Å; D375-T416 VanDerWaalsContact OD1-CG2 3.27Å; D375-T416 WeakPolarHBondContact OD1-CG2 3.38Å; D375-T416 PolarHBondContact OD1-OG1 3.48Å; K378-T416 WeakPolarHBondContact CE-O 3.5Å; K378-T416 PolarHBondContact NZ-O 3.11Å; K378-T416 PolarHBondContact NZ-OG1 3.26Å; S404-T416 WeakPolarHBondContact O-CA 3.35Å
417	V	94.7	Very high	96.6	Very high	66 Å²	66	38.6 Å²	38.6	40%	0.4	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	143.5	179.2	-177.6	0	0	0	0	108.7	K403 S404	K403-V417 WeakPolarHBondContact CA-O 3.38Å; S404-V417 PolarHBondContact N-O 3.46Å; S404-V417 PolarHBondContact O-N 3.1Å
418	F	96.1	Very high	96.5	Very high	5 Å²	5	36.9 Å²	36.9	2%	0.022	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	102.6	-174.4	-67.3	-91.1	0	0	0	110.7	D375 K378 M382 Q401 L402 K403 Q475	D375-F418 HydrophobicContact CB-CZ 4.05Å; D375-F418 WeakPolarHBondContact O-CZ 3.41Å; K378-F418 HydrophobicContact CB-CE2 4.03Å; K378-F418 HydrophobicContact CD-CD2 4.49Å; K378-F418 HydrophobicContact CD-CE2 3.95Å; K378-F418 HydrophobicContact CG-CD2 4.05Å; K378-F418 HydrophobicContact CG-CE2 3.77Å; M382-F418 HydrophobicContact CB-CB 3.93Å; M382-F418 HydrophobicContact CG-CB 4.27Å; Q401-F418 HydrophobicContact CG-CB 4.23Å; L402-F418 CarbonylContact O-C 3.47Å; L402-F418 VanDerWaalsContact O-CA 3.28Å; L402-F418 WeakPolarHBondContact O-CA 3.49Å; K403-F418 HydrophobicContact CB-CD1 4.05Å; K403-F418 HydrophobicContact CB-CE1 3.78Å; K403-F418 HydrophobicContact CD-CE1 3.91Å; K403-F418 HydrophobicContact CD-CZ 4.05Å; K403-F418 HydrophobicContact CG-CD1 4.32Å; K403-F418 HydrophobicContact CG-CE1 3.69Å; K403-F418 HydrophobicContact CG-CZ 3.94Å; F418-Q475 HydrophobicContact CD1-CB 4.24Å; F418-Q475 HydrophobicContact CD1-CG 4.05Å; F418-Q475 HydrophobicContact CE1-CB 4.36Å; F418-Q475 HydrophobicContact CE1-CG 3.91Å
419	D	95.8	Very high	95.8	Very high	72 Å²	72	38.4 Å²	38.4	39%	0.385	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	129.3	-169.4	-64.2	-50.3	0	0	0	111.3	Q401 L402	Q401-D419 CarbonylContact C-O 3.6Å; Q401-D419 WeakPolarHBondContact CA-O 3.25Å; L402-D419 PolarHBondContact N-O 2.72Å; L402-D419 PolarHBondContact O-N 2.77Å
420	P	97.8	Very high	94.9	Very high	55 Å²	55	43.6 Å²	43.6	36%	0.357	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	139.3	174.1	30.3	-34.2	0	0	0	111.2	Y386 V399 G400	Y386-P420 HydrophobicContact CD1-CB 4.15Å; Y386-P420 HydrophobicContact CD2-CB 4.14Å; Y386-P420 HydrophobicContact CD2-CG 3.74Å; Y386-P420 HydrophobicContact CE1-CB 3.98Å; Y386-P420 HydrophobicContact CE2-CB 3.97Å; Y386-P420 HydrophobicContact CE2-CG 3.72Å; Y386-P420 HydrophobicContact CG-CB 4.23Å; Y386-P420 HydrophobicContact CG-CG 4.2Å; V399-P420 HydrophobicContact CG1-CB 4Å; G400-P420 CarbonylContact O-C 3.48Å; G400-P420 WeakPolarHBondContact O-CA 3.31Å
421	F	98.1	Very high	93.7	Very high	13 Å²	13	42.1 Å²	42.1	6%	0.057	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	146.9	178.2	74.9	-90.9	0	0	0	112.4	V399 G400 Q401 L402 L424 I474 P478 L481	V399-F421 VanDerWaalsContact CA-O 3.29Å; V399-F421 WeakPolarHBondContact CA-O 3.38Å; G400-F421 VanDerWaalsContact C-CE1 3.43Å; G400-F421 PolarHBondContact N-O 2.68Å; G400-F421 PolarHBondContact O-N 3.27Å; Q401-F421 VanDerWaalsContact N-CE1 3.28Å; L402-F421 HydrophobicContact CB-CD1 4.45Å; L402-F421 HydrophobicContact CD1-CB 4.39Å; L402-F421 HydrophobicContact CD1-CD1 4.28Å; L402-F421 HydrophobicContact CD2-CD1 4.46Å; L402-F421 HydrophobicContact CD2-CE1 4.42Å; L402-F421 HydrophobicContact CG-CD1 3.66Å; L402-F421 HydrophobicContact CG-CE1 4.07Å; L402-F421 HydrophobicContact CG-CG 4.35Å; F421-L424 HydrophobicContact CB-CD2 4.35Å; F421-L424 HydrophobicContact CD1-CD2 4.28Å; F421-L424 HydrophobicContact CD2-CD2 3.44Å; F421-L424 VanDerWaalsContact CD2-CD2 3.44Å; F421-L424 HydrophobicContact CD2-CG 3.79Å; F421-L424 HydrophobicContact CE1-CD2 4.43Å; F421-L424 HydrophobicContact CE2-CD1 4.07Å; F421-L424 HydrophobicContact CE2-CD2 3.66Å; F421-L424 HydrophobicContact CE2-CG 3.63Å; F421-L424 HydrophobicContact CG-CD2 3.78Å; F421-L424 HydrophobicContact CZ-CD1 4.32Å; F421-L424 HydrophobicContact CZ-CD2 4.14Å; F421-L424 HydrophobicContact CZ-CG 4.29Å; F421-I474 HydrophobicContact CE1-CG2 4.25Å; F421-I474 HydrophobicContact CZ-CG2 4.32Å; F421-P478 HydrophobicContact CE2-CG 4.31Å; F421-P478 HydrophobicContact CZ-CG 4.49Å; F421-L481 HydrophobicContact CE2-CD1 3.9Å; F421-L481 HydrophobicContact CZ-CD1 4.47Å
422	W	97.9	Very high	92	Very high	40 Å²	40	43 Å²	43	15%	0.152	26%	0.259	C	S	.	.	S	Bend	trans	-110.8	-25.8	-176.8	-65.5	59.4	0	0	0	112	L349 H353 Y386 I394 V395 V399	L349-W422 HydrophobicContact CB-CE3 3.85Å; L349-W422 HydrophobicContact CB-CZ3 3.94Å; L349-W422 HydrophobicContact CD1-CE3 4.34Å; H353-W422 HydrophobicContact CB-CH2 3.62Å; H353-W422 HydrophobicContact CB-CZ3 4.1Å; H353-W422 AromaticContact CD2-CH2 3.66Å; H353-W422 AromaticContact CD2-CZ2 3.97Å; H353-W422 AromaticContact CG-CH2 3.55Å; Y386-W422 WeakPolarHBondContact OH-CZ2 3.49Å; I394-W422 HydrophobicContact CB-CZ3 4.32Å; I394-W422 HydrophobicContact CG2-CE3 4.47Å; I394-W422 HydrophobicContact CG2-CH2 4.38Å; I394-W422 HydrophobicContact CG2-CZ3 3.63Å; V395-W422 HydrophobicContact CG2-CH2 3.94Å; V395-W422 HydrophobicContact CG2-CZ2 3.97Å; V399-W422 HydrophobicContact CG2-CD2 3.56Å; V399-W422 HydrophobicContact CG2-CE3 4.06Å; V399-W422 HydrophobicContact CG2-CG 3.92Å; V399-W422 HydrophobicContact CG2-CH2 4.14Å; V399-W422 HydrophobicContact CG2-CZ2 3.69Å; V399-W422 HydrophobicContact CG2-CZ3 4.34Å
423	D	98.4	Very high	90.3	Very high	11 Å²	11	50.9 Å²	50.9	6%	0.059	27%	0.273	C	S	.	.			trans	-147.3	158.5	170.3	74.6	-70.4	0	0	0	108.6	Q342 R346 S425 V482	Q342-D423 PolarHBondContact NE2-OD2 3.07Å; R346-D423 WeakPolarHBondContact CD-OD1 3.48Å; R346-D423 IonicContact CZ-OD1 2.86Å; R346-D423 IonicContact NE-OD1 3.45Å; R346-D423 IonicContact NH1-OD1 3.75Å; R346-D423 PolarHBondContact NH1-OD1 3.29Å; D423-S425 PolarHBondContact OD2-OG 3.29Å; D423-V482 CarbonylContact C-O 3.53Å; D423-V482 WeakPolarHBondContact CA-O 3.43Å; D423-V482 HydrophobicContact CB-CB 3.83Å; D423-V482 HydrophobicContact CB-CG1 3.78Å
424	L	98.5	Very high	89.3	Confident	3 Å²	3	52.8 Å²	52.8	2%	0.016	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	114.8	167.8	-60.1	178.8	0	0	0	109.5	L402 F421 L426 M442 F445 I474 L481 V482 L483 H484	L402-L424 HydrophobicContact CD1-CD2 4.03Å; L402-L424 HydrophobicContact CD2-CD2 4.27Å; L402-L424 HydrophobicContact CG-CD2 4.38Å; F421-L424 HydrophobicContact CB-CD2 4.35Å; F421-L424 HydrophobicContact CD1-CD2 4.28Å; F421-L424 HydrophobicContact CD2-CD2 3.44Å; F421-L424 VanDerWaalsContact CD2-CD2 3.44Å; F421-L424 HydrophobicContact CD2-CG 3.79Å; F421-L424 HydrophobicContact CE1-CD2 4.43Å; F421-L424 HydrophobicContact CE2-CD1 4.07Å; F421-L424 HydrophobicContact CE2-CD2 3.66Å; F421-L424 HydrophobicContact CE2-CG 3.63Å; F421-L424 HydrophobicContact CG-CD2 3.78Å; F421-L424 HydrophobicContact CZ-CD1 4.32Å; F421-L424 HydrophobicContact CZ-CD2 4.14Å; F421-L424 HydrophobicContact CZ-CG 4.29Å; L424-L426 HydrophobicContact CB-CD2 3.89Å; L424-L426 PolarHBondContact O-N 2.77Å; L424-M442 HydrophobicContact CD1-CE 4.19Å; L424-F445 HydrophobicContact CD2-CE1 4.04Å; L424-F445 HydrophobicContact CD2-CZ 3.96Å; L424-I474 HydrophobicContact CD1-CD1 4Å; L424-L481 HydrophobicContact CD1-CD1 4.23Å; L424-L481 HydrophobicContact CG-CD1 4.43Å; L424-V482 PolarHBondContact N-O 2.86Å; L424-L483 HydrophobicContact CB-CD2 3.83Å; L424-L483 HydrophobicContact CD1-CD2 4.11Å; L424-L483 HydrophobicContact CG-CD2 4.32Å; L424-H484 PolarHBondContact O-N 2.89Å
425	S	98.2	Very high	89	Confident	24 Å²	24	55.2 Å²	55.2	17%	0.168	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	92.4	178	-66.2	0	0	0	0	110.6	Q342 D423 H484 K486	Q342-S425 PolarHBondContact NE2-OG 3.49Å; Q342-S425 VanDerWaalsContact NE2-OG 3.15Å; D423-S425 PolarHBondContact OD2-OG 3.29Å; S425-H484 CarbonylContact C-O 3.49Å; S425-H484 WeakPolarHBondContact CA-O 3.07Å; S425-H484 WeakPolarHBondContact CB-ND1 3.41Å; S425-H484 PolarHBondContact OG-ND1 2.81Å; S425-K486 WeakPolarHBondContact O-CD 3.44Å; S425-K486 WeakPolarHBondContact O-CE 3.43Å; S425-K486 PolarHBondContact O-NZ 3.07Å
426	L	97.8	Very high	89	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	134.7	-169.1	-51.8	-178.7	0	0	0	112.9	L424 L438 C441 M442 F445 L483 H484 L485 K486	L424-L426 HydrophobicContact CB-CD2 3.89Å; L424-L426 PolarHBondContact O-N 2.77Å; L426-L438 HydrophobicContact CD1-CD1 3.71Å; L426-C441 HydrophobicContact CB-CB 4.15Å; L426-C441 HydrophobicContact CD1-CB 4.23Å; L426-M442 HydrophobicContact CD1-CG 4.06Å; L426-M442 HydrophobicContact CD1-SD 3.57Å; L426-M442 VanDerWaalsContact CD1-SD 3.57Å; L426-M442 HydrophobicContact CD2-SD 3.5Å; L426-M442 WeakPolarHBondContact CD2-SD 3.36Å; L426-M442 HydrophobicContact CG-SD 4.18Å; L426-F445 HydrophobicContact CD2-CB 3.89Å; L426-F445 HydrophobicContact CD2-CD1 4.33Å; L426-F445 HydrophobicContact CD2-CD2 4.24Å; L426-F445 HydrophobicContact CD2-CG 3.89Å; L426-L483 HydrophobicContact CD1-CB 4.32Å; L426-L483 HydrophobicContact CD1-CD2 4.37Å; L426-H484 PolarHBondContact N-O 2.94Å; L426-L485 HydrophobicContact CD1-CD2 4.48Å; L426-K486 VanDerWaalsContact O-CB 3.28Å; L426-K486 WeakPolarHBondContact O-CB 3.47Å; L426-K486 WeakPolarHBondContact O-CG 3.25Å; L426-K486 PolarHBondContact O-N 2.91Å
427	P	95.8	Very high	89.1	Confident	38 Å²	38	54.7 Å²	54.7	25%	0.247	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-72.4	136.6	169.8	32	-33.1	0	0	0	110.9	C441 L444	P427-C441 WeakPolarHBondContact O-CB 3.07Å; P427-L444 HydrophobicContact CB-CD2 3.96Å; P427-L444 HydrophobicContact CB-CG 4.31Å; P427-L444 HydrophobicContact CG-CB 4.12Å; P427-L444 HydrophobicContact CG-CD2 3.86Å; P427-L444 HydrophobicContact CG-CG 3.69Å
428	I	93.8	Very high	89.2	Confident	14 Å²	14	51.6 Å²	51.6	7%	0.072	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-84.2	123.1	174.5	-56.1	177.1	0	0	0	108.9	V436 L485 R487 L497 T499 V501	I428-V436 HydrophobicContact CG2-CG1 4.45Å; I428-L485 HydrophobicContact CD1-CB 4.2Å; I428-L485 HydrophobicContact CG1-CB 4.42Å; I428-R487 HydrophobicContact CD1-CG 3.64Å; I428-L497 HydrophobicContact CB-CD1 4.16Å; I428-L497 HydrophobicContact CD1-CB 4.23Å; I428-L497 HydrophobicContact CD1-CD1 4.26Å; I428-T499 HydrophobicContact CG2-CG2 3.95Å; I428-V501 HydrophobicContact CD1-CG2 4.5Å; I428-V501 HydrophobicContact CG2-CG2 4.16Å
429	T	84.9	Confident	89.3	Confident	34 Å²	34	53 Å²	53	21%	0.209	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-69.7	147.6	177	-176	0	0	0	0	112.1	K431 V436 D440	T429-K431 HydrophobicContact CG2-CG 4.16Å; T429-V436 HydrophobicContact CG2-CB 4.38Å; T429-V436 HydrophobicContact CG2-CG1 3.62Å; T429-V436 HydrophobicContact CG2-CG2 3.96Å; T429-D440 HydrophobicContact CG2-CB 3.69Å
430	K	77.8	Confident	89.3	Confident	182 Å²	182	51.2 Å²	51.2	79%	0.791	28%	0.282	S	S	*	.			trans	-102.4	74.2	176.9	-65.1	-177.9	-178.7	179.2	0	109.8
431	K	71.4	Confident	89.3	Confident	87 Å²	87	48.6 Å²	48.6	38%	0.378	27%	0.265	S	S	.	.			trans	-68.7	136.4	170.3	-71.8	-174.8	-177.7	175.9	0	109.9	T429 E435 V436 D440	T429-K431 HydrophobicContact CG2-CG 4.16Å; K431-E435 WeakPolarHBondContact CD-O 3.15Å; K431-E435 PolarHBondContact NZ-O 2.8Å; K431-V436 HydrophobicContact CB-CG2 4.21Å; K431-V436 HydrophobicContact CD-CG2 4.21Å; K431-V436 HydrophobicContact CG-CG2 4.22Å; K431-D440 VanDerWaalsContact CE-CG 3.43Å; K431-D440 WeakPolarHBondContact CE-OD1 3.47Å; K431-D440 WeakPolarHBondContact CE-OD2 3.47Å; K431-D440 IonicContact NZ-OD1 2.87Å; K431-D440 PolarHBondContact NZ-OD1 2.71Å; K431-D440 IonicContact NZ-OD2 2.77Å; K431-D440 PolarHBondContact NZ-OD2 2.84Å
432	G	60.9	Low	89.2	Confident	71 Å²	71	48 Å²	48	73%	0.732	26%	0.263	S	S	*	.	S	Bend	trans	-83.3	-22.3	170.9	0	0	0	0	0	113.5
433	Y	61.7	Low	89.2	Confident	221 Å²	221	51.8 Å²	51.8	87%	0.867	28%	0.277	S	S	*	.	S	Bend	trans	-143.9	147.7	178.5	-60	-78.4	0	0	0	109.9
434	G	73.5	Confident	89.1	Confident	68 Å²	68	54.2 Å²	54.2	70%	0.701	29%	0.289	S	S	*	.	S	Bend	trans	78.7	162.2	-179.1	0	0	0	0	0	114.3
435	E	87.3	Confident	89	Confident	104 Å²	104	55.6 Å²	55.6	49%	0.486	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-71.1	148.8	-179.5	-166.3	179.3	-131.3	0	0	112	K431 F500 N502	K431-E435 WeakPolarHBondContact CD-O 3.15Å; K431-E435 PolarHBondContact NZ-O 2.8Å; E435-F500 HydrophobicContact CG-CD1 4.32Å; E435-F500 WeakPolarHBondContact OE1-CD1 3.2Å; E435-F500 VanDerWaalsContact OE1-CE1 3.22Å; E435-F500 WeakPolarHBondContact OE1-CE1 3.39Å; E435-N502 VanDerWaalsContact CD-CB 3.49Å; E435-N502 HydrophobicContact CG-CB 4.18Å; E435-N502 VanDerWaalsContact OE2-CB 3.29Å; E435-N502 WeakPolarHBondContact OE2-CB 3.39Å; E435-N502 PolarHBondContact OE2-ND2 2.74Å
436	V	94.5	Very high	88.9	Confident	8 Å²	8	55.2 Å²	55.2	5%	0.048	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	120.9	170.2	176.5	0	0	0	0	108.7	I428 T429 K431 T499 V501 N502	I428-V436 HydrophobicContact CG2-CG1 4.45Å; T429-V436 HydrophobicContact CG2-CB 4.38Å; T429-V436 HydrophobicContact CG2-CG1 3.62Å; T429-V436 HydrophobicContact CG2-CG2 3.96Å; K431-V436 HydrophobicContact CB-CG2 4.21Å; K431-V436 HydrophobicContact CD-CG2 4.21Å; K431-V436 HydrophobicContact CG-CG2 4.22Å; V436-T499 HydrophobicContact CB-CG2 4.26Å; V436-T499 HydrophobicContact CG2-CG2 3.96Å; V436-V501 HydrophobicContact CG1-CG2 4.2Å; V436-V501 CarbonylContact O-C 3.53Å; V436-V501 VanDerWaalsContact O-CA 3.31Å; V436-V501 WeakPolarHBondContact O-CA 3.26Å; V436-N502 PolarHBondContact O-N 3.22Å
437	S	96.1	Very high	88.9	Confident	33 Å²	33	60.2 Å²	60.2	23%	0.231	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	160.5	173.7	71.3	0	0	0	0	111.7	M439 D440 C441 N502	S437-M439 PolarHBondContact O-N 3.01Å; S437-M439 PolarHBondContact OG-N 2.86Å; S437-D440 WeakPolarHBondContact CB-OD2 3.5Å; S437-D440 PolarHBondContact N-OD2 3.01Å; S437-D440 WeakPolarHBondContact O-CB 3.21Å; S437-D440 PolarHBondContact O-N 2.89Å; S437-D440 VanDerWaalsContact O-N 3.11Å; S437-D440 VanDerWaalsContact OG-CG 3.28Å; S437-D440 PolarHBondContact OG-N 3.15Å; S437-D440 VanDerWaalsContact OG-N 3.11Å; S437-D440 PolarHBondContact OG-OD2 3.14Å; S437-C441 PolarHBondContact O-N 3.02Å; S437-N502 CarbonylContact C-O 3.54Å; S437-N502 WeakPolarHBondContact CA-O 3.4Å
438	L	97.4	Very high	88.9	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-57.8	-34.2	169.7	-177.2	61.6	0	0	0	111.9	L426 D440 C441 M442 L483 L485 V501 N502 F503 L508 L576 Y578	L426-L438 HydrophobicContact CD1-CD1 3.71Å; L438-D440 VanDerWaalsContact C-N 3.33Å; L438-D440 PolarHBondContact O-N 3.15Å; L438-C441 WeakPolarHBondContact O-CB 3.49Å; L438-C441 PolarHBondContact O-N 2.88Å; L438-M442 WeakPolarHBondContact O-CG 3.41Å; L438-M442 PolarHBondContact O-N 3.4Å; L438-L483 HydrophobicContact CD1-CD1 4.17Å; L438-L483 HydrophobicContact CD2-CD1 3.87Å; L438-L483 HydrophobicContact CG-CD1 4.4Å; L438-L485 HydrophobicContact CD1-CD2 4.13Å; L438-V501 HydrophobicContact CB-CG1 4.47Å; L438-N502 PolarHBondContact N-O 2.93Å; L438-F503 HydrophobicContact CB-CB 3.96Å; L438-F503 HydrophobicContact CD2-CB 3.84Å; L438-F503 HydrophobicContact CG-CB 4.44Å; L438-L508 HydrophobicContact CD2-CD1 4.15Å; L438-L508 HydrophobicContact CD2-CD2 3.74Å; L438-L576 HydrophobicContact CD1-CD1 4.11Å; L438-L576 HydrophobicContact CD2-CD1 4.08Å; L438-Y578 HydrophobicContact CD2-CE2 4.03Å
439	M	96.8	Very high	89	Confident	36 Å²	36	66.1 Å²	66.1	18%	0.177	34%	0.34	C	S	.	.	H	α-helix	trans	-66	-32.8	176.7	-62.9	-60.4	-82	0	0	112.2	S437 M442 R443 L508 D509 L510 E512 F513	S437-M439 PolarHBondContact O-N 3.01Å; S437-M439 PolarHBondContact OG-N 2.86Å; M439-M442 PolarHBondContact O-N 3.2Å; M439-R443 WeakPolarHBondContact O-CB 3.43Å; M439-R443 WeakPolarHBondContact O-CG 3.36Å; M439-R443 PolarHBondContact O-N 3.49Å; M439-L508 HydrophobicContact SD-CD1 3.85Å; M439-D509 VanDerWaalsContact CE-O 3.24Å; M439-D509 WeakPolarHBondContact CE-O 3.39Å; M439-L510 HydrophobicContact SD-CD2 4.17Å; M439-E512 HydrophobicContact CE-CG 4.01Å; M439-E512 WeakPolarHBondContact CE-OE2 3.49Å; M439-F513 HydrophobicContact CE-CE2 3.58Å; M439-F513 HydrophobicContact CE-CZ 3.86Å; M439-F513 HydrophobicContact SD-CE2 3.81Å; M439-F513 HydrophobicContact SD-CZ 4.23Å
440	D	96.3	Very high	89.6	Confident	34 Å²	34	67.8 Å²	67.8	18%	0.182	35%	0.35	C	S	.	.	H	α-helix	trans	-65.4	-39.8	171.7	-61.5	-76.2	0	0	0	111.8	T429 K431 S437 L438 R443 L444	T429-D440 HydrophobicContact CG2-CB 3.69Å; K431-D440 VanDerWaalsContact CE-CG 3.43Å; K431-D440 WeakPolarHBondContact CE-OD1 3.47Å; K431-D440 WeakPolarHBondContact CE-OD2 3.47Å; K431-D440 IonicContact NZ-OD1 2.87Å; K431-D440 PolarHBondContact NZ-OD1 2.71Å; K431-D440 IonicContact NZ-OD2 2.77Å; K431-D440 PolarHBondContact NZ-OD2 2.84Å; S437-D440 WeakPolarHBondContact CB-OD2 3.5Å; S437-D440 PolarHBondContact N-OD2 3.01Å; S437-D440 WeakPolarHBondContact O-CB 3.21Å; S437-D440 PolarHBondContact O-N 2.89Å; S437-D440 VanDerWaalsContact O-N 3.11Å; S437-D440 VanDerWaalsContact OG-CG 3.28Å; S437-D440 PolarHBondContact OG-N 3.15Å; S437-D440 VanDerWaalsContact OG-N 3.11Å; S437-D440 PolarHBondContact OG-OD2 3.14Å; L438-D440 VanDerWaalsContact C-N 3.33Å; L438-D440 PolarHBondContact O-N 3.15Å; D440-R443 PolarHBondContact O-N 2.91Å; D440-L444 WeakPolarHBondContact O-CB 3.28Å; D440-L444 PolarHBondContact O-N 2.96Å
441	C	97.4	Very high	90.5	Very high	0 Å²	0	61 Å²	61	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-67.9	-37.6	177.4	-59.9	0	0	0	0	111.7	L426 P427 S437 L438 L444 F445	L426-C441 HydrophobicContact CB-CB 4.15Å; L426-C441 HydrophobicContact CD1-CB 4.23Å; P427-C441 WeakPolarHBondContact O-CB 3.07Å; S437-C441 PolarHBondContact O-N 3.02Å; L438-C441 WeakPolarHBondContact O-CB 3.49Å; L438-C441 PolarHBondContact O-N 2.88Å; C441-L444 PolarHBondContact O-N 3.18Å; C441-F445 WeakPolarHBondContact O-CB 3.45Å; C441-F445 PolarHBondContact O-N 2.86Å
442	M	97.6	Very high	91.6	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-68.1	-44.6	172.6	-71.1	-65.3	-64.3	0	0	112.4	L424 L426 L438 M439 L444 F445 T446 I474 L483 L510 F513	L424-M442 HydrophobicContact CD1-CE 4.19Å; L426-M442 HydrophobicContact CD1-CG 4.06Å; L426-M442 HydrophobicContact CD1-SD 3.57Å; L426-M442 VanDerWaalsContact CD1-SD 3.57Å; L426-M442 HydrophobicContact CD2-SD 3.5Å; L426-M442 WeakPolarHBondContact CD2-SD 3.36Å; L426-M442 HydrophobicContact CG-SD 4.18Å; L438-M442 WeakPolarHBondContact O-CG 3.41Å; L438-M442 PolarHBondContact O-N 3.4Å; M439-M442 PolarHBondContact O-N 3.2Å; M442-L444 VanDerWaalsContact C-N 3.27Å; M442-L444 PolarHBondContact O-N 3.09Å; M442-F445 WeakPolarHBondContact O-CB 3.49Å; M442-F445 PolarHBondContact O-N 3.31Å; M442-F445 VanDerWaalsContact O-N 3.11Å; M442-T446 PolarHBondContact O-N 3.13Å; M442-T446 PolarHBondContact O-OG1 3.23Å; M442-I474 HydrophobicContact CE-CD1 4.06Å; M442-L483 HydrophobicContact SD-CD2 4.3Å; M442-L510 HydrophobicContact CE-CD2 4.29Å; M442-L510 HydrophobicContact CG-CD2 4.43Å; M442-F513 HydrophobicContact CB-CD1 4.3Å; M442-F513 HydrophobicContact CB-CD2 3.99Å; M442-F513 HydrophobicContact CB-CE1 3.73Å; M442-F513 HydrophobicContact CB-CE2 3.37Å; M442-F513 HydrophobicContact CB-CG 4.42Å; M442-F513 HydrophobicContact CB-CZ 3.24Å; M442-F513 HydrophobicContact CE-CB 4.41Å; M442-F513 HydrophobicContact CE-CD2 3.72Å; M442-F513 HydrophobicContact CE-CE2 4.22Å; M442-F513 HydrophobicContact CE-CG 4.04Å; M442-F513 HydrophobicContact CG-CD2 4.42Å; M442-F513 HydrophobicContact CG-CE2 3.95Å; M442-F513 HydrophobicContact CG-CZ 4.29Å
443	R	96.8	Very high	93.3	Very high	120 Å²	120	58 Å²	58	45%	0.453	30%	0.303	S	S	.	.	H	α-helix	trans	-59.7	-35.9	172.7	-78.4	-173.9	-117.5	-92.4	3.8	112.3	M439 D440 K447 E512 F513	M439-R443 WeakPolarHBondContact O-CB 3.43Å; M439-R443 WeakPolarHBondContact O-CG 3.36Å; M439-R443 PolarHBondContact O-N 3.49Å; D440-R443 PolarHBondContact O-N 2.91Å; R443-K447 WeakPolarHBondContact O-CB 3.36Å; R443-K447 PolarHBondContact O-N 3.06Å; R443-K447 VanDerWaalsContact O-N 3.1Å; R443-E512 WeakPolarHBondContact CG-OE1 3.37Å; R443-E512 IonicContact CZ-OE1 2.67Å; R443-E512 IonicContact CZ-OE2 2.68Å; R443-E512 IonicContact NE-OE1 3.36Å; R443-E512 IonicContact NH1-OE1 3.79Å; R443-E512 PolarHBondContact NH1-OE1 3.01Å; R443-E512 IonicContact NH1-OE2 3.34Å; R443-E512 PolarHBondContact NH1-OE2 3.3Å; R443-E512 IonicContact NH2-OE2 3.56Å; R443-F513 HydrophobicContact CB-CE1 4.39Å; R443-F513 HydrophobicContact CG-CE1 3.77Å; R443-F513 HydrophobicContact CG-CZ 4.08Å
444	L	96	Very high	94.9	Very high	61 Å²	61	55 Å²	55	32%	0.319	30%	0.302	S	S	.	.	H	α-helix	trans	-73.5	-29.3	175.3	-173.8	60	0	0	0	112.6	P427 D440 C441 M442 K447	P427-L444 HydrophobicContact CB-CD2 3.96Å; P427-L444 HydrophobicContact CB-CG 4.31Å; P427-L444 HydrophobicContact CG-CB 4.12Å; P427-L444 HydrophobicContact CG-CD2 3.86Å; P427-L444 HydrophobicContact CG-CG 3.69Å; D440-L444 WeakPolarHBondContact O-CB 3.28Å; D440-L444 PolarHBondContact O-N 2.96Å; C441-L444 PolarHBondContact O-N 3.18Å; M442-L444 VanDerWaalsContact C-N 3.27Å; M442-L444 PolarHBondContact O-N 3.09Å; L444-K447 HydrophobicContact CD1-CD 4.28Å
445	F	97	Very high	95.9	Very high	33 Å²	33	58.4 Å²	58.4	15%	0.145	30%	0.3	C	S	.	.	H	α-helix	trans	-74.9	-37.2	174.1	177.7	-98.4	0	0	0	113.3	L402 L424 L426 C441 M442 F472	L402-F445 HydrophobicContact CD1-CE1 4.38Å; L402-F445 HydrophobicContact CD1-CZ 3.98Å; L402-F445 HydrophobicContact CD2-CE1 3.99Å; L402-F445 HydrophobicContact CD2-CZ 4.41Å; L424-F445 HydrophobicContact CD2-CE1 4.04Å; L424-F445 HydrophobicContact CD2-CZ 3.96Å; L426-F445 HydrophobicContact CD2-CB 3.89Å; L426-F445 HydrophobicContact CD2-CD1 4.33Å; L426-F445 HydrophobicContact CD2-CD2 4.24Å; L426-F445 HydrophobicContact CD2-CG 3.89Å; C441-F445 WeakPolarHBondContact O-CB 3.45Å; C441-F445 PolarHBondContact O-N 2.86Å; M442-F445 WeakPolarHBondContact O-CB 3.49Å; M442-F445 PolarHBondContact O-N 3.31Å; M442-F445 VanDerWaalsContact O-N 3.11Å; F445-F472 HydrophobicContact CE1-CB 4.47Å
446	T	96.7	Very high	96.4	Very high	15 Å²	15	56.3 Å²	56.3	9%	0.092	29%	0.289	C	S	.	.	S	Bend	trans	-94.6	8.1	-179.8	55.5	0	0	0	0	113.8	M442 F472 F513	M442-T446 PolarHBondContact O-N 3.13Å; M442-T446 PolarHBondContact O-OG1 3.23Å; T446-F472 WeakPolarHBondContact CB-O 3.33Å; T446-F513 HydrophobicContact CG2-CB 4.08Å; T446-F513 HydrophobicContact CG2-CD1 3.82Å; T446-F513 HydrophobicContact CG2-CG 4.23Å; T446-F513 VanDerWaalsContact OG1-CD1 3.26Å; T446-F513 WeakPolarHBondContact OG1-CD1 3.38Å
447	K	96.6	Very high	96.5	Very high	105 Å²	105	57.5 Å²	57.5	46%	0.457	30%	0.297	S	S	.	.			trans	-60.6	150.5	179.4	-163.3	-169.7	153.2	-130.3	0	110.7	R443 L444 D449	R443-K447 WeakPolarHBondContact O-CB 3.36Å; R443-K447 PolarHBondContact O-N 3.06Å; R443-K447 VanDerWaalsContact O-N 3.1Å; L444-K447 HydrophobicContact CD1-CD 4.28Å; K447-D449 IonicContact NZ-OD1 2.92Å; K447-D449 PolarHBondContact NZ-OD1 3.44Å; K447-D449 PolarHBondContact O-N 2.83Å
448	E	96.6	Very high	96.5	Very high	100 Å²	100	60.5 Å²	60.5	47%	0.467	31%	0.314	S	S	.	.			trans	-78.3	115.2	163	-170.8	168.7	154.8	0	0	110.1	T469 K470	E448-T469 HydrophobicContact CG-CG2 4.41Å; E448-T469 WeakPolarHBondContact OE1-CB 3.15Å; E448-T469 WeakPolarHBondContact OE1-CG2 3.48Å; E448-T469 PolarHBondContact OE1-OG1 2.93Å; E448-K470 WeakPolarHBondContact CA-O 3.41Å
449	D	94.9	Very high	96.5	Very high	77 Å²	77	60.9 Å²	60.9	41%	0.412	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	134.2	177.9	-76.6	-32	0	0	0	111	K447 T469 K470	K447-D449 IonicContact NZ-OD1 2.92Å; K447-D449 PolarHBondContact NZ-OD1 3.44Å; K447-D449 PolarHBondContact O-N 2.83Å; D449-T469 CarbonylContact O-C 3.29Å; D449-T469 WeakPolarHBondContact O-CA 3.45Å; D449-K470 PolarHBondContact N-O 3.45Å; D449-K470 PolarHBondContact O-N 3.32Å
450	V	97.4	Very high	96.2	Very high	69 Å²	69	67.2 Å²	67.2	42%	0.418	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	111	-174.6	-175.3	0	0	0	0	109.5	D452 R467 T469	V450-D452 HydrophobicContact CG1-CB 4.38Å; V450-D452 PolarHBondContact O-N 3.22Å; V450-R467 HydrophobicContact CG1-CG 4.13Å; V450-T469 HydrophobicContact CG1-CG2 4.46Å; V450-T469 HydrophobicContact CG2-CG2 4.08Å
451	L	96.6	Very high	96.1	Very high	39 Å²	39	73.5 Å²	73.5	20%	0.204	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	98.7	176.2	-56.3	179.7	0	0	0	109.1	L406 E455 P457 R467 C468 K470	L406-L451 HydrophobicContact CD1-CD1 3.94Å; L451-E455 HydrophobicContact CD2-CB 4.36Å; L451-P457 HydrophobicContact CD1-CG 4.3Å; L451-R467 WeakPolarHBondContact O-CA 3.31Å; L451-C468 PolarHBondContact N-O 3.04Å; L451-C468 PolarHBondContact O-N 3.42Å; L451-C468 VanDerWaalsContact O-N 3.09Å; L451-K470 HydrophobicContact CD1-CB 4.23Å
452	D	96.1	Very high	96.1	Very high	55 Å²	55	75.1 Å²	75.1	29%	0.294	37%	0.372	S	S	.	.			trans	-129.7	-179.8	-178.9	-148.5	-36.2	0	0	0	110.3	V450 D454 E455 K456 R467	V450-D452 HydrophobicContact CG1-CB 4.38Å; V450-D452 PolarHBondContact O-N 3.22Å; D452-D454 PolarHBondContact O-N 3.5Å; D452-E455 PolarHBondContact O-N 3.38Å; D452-K456 WeakPolarHBondContact OD1-CE 3.39Å; D452-K456 IonicContact OD1-NZ 3.38Å; D452-K456 PolarHBondContact OD1-NZ 3.06Å; D452-R467 HydrophobicContact CB-CG 4.27Å; D452-R467 WeakPolarHBondContact OD2-CD 3.5Å; D452-R467 WeakPolarHBondContact OD2-CG 3.41Å; D452-R467 IonicContact OD2-CZ 3.98Å; D452-R467 IonicContact OD2-NE 3.42Å; D452-R467 IonicContact OD2-NH1 2.66Å; D452-R467 PolarHBondContact OD2-NH1 2.85Å
453	G	95.4	Very high	96	Very high	40 Å²	40	82 Å²	82	41%	0.412	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	54.4	-122.4	-178.4	0	0	0	0	0	113.4	E455 K456	G453-E455 VanDerWaalsContact C-N 3.32Å; G453-K456 WeakPolarHBondContact O-CD 3.21Å; G453-K456 VanDerWaalsContact O-CG 3.31Å; G453-K456 WeakPolarHBondContact O-CG 3.38Å
454	D	95.2	Very high	96.1	Very high	157 Å²	157	77.6 Å²	77.6	84%	0.84	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-73.6	-21.2	179.6	-61	-33.5	0	0	0	113.1	D452 K456 R465	D452-D454 PolarHBondContact O-N 3.5Å; D454-K456 VanDerWaalsContact C-N 3.34Å; D454-R465 VanDerWaalsContact C-NH2 3.35Å; D454-R465 PolarHBondContact O-NH2 3.34Å
455	E	95.8	Very high	96.2	Very high	140 Å²	140	81 Å²	81	65%	0.654	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-86.7	-2.8	-177.9	-59.3	-170.6	131.9	0	0	113.4	L451 D452 G453 P457	L451-E455 HydrophobicContact CD2-CB 4.36Å; D452-E455 PolarHBondContact O-N 3.38Å; G453-E455 VanDerWaalsContact C-N 3.32Å; E455-P457 VanDerWaalsContact O-CD 3.26Å; E455-P457 WeakPolarHBondContact O-CD 3.44Å; E455-P457 VanDerWaalsContact O-N 3.14Å
456	K	97	Very high	96.2	Very high	61 Å²	61	83.1 Å²	83.1	27%	0.265	41%	0.407	S	S	.	.			trans	-51.3	113.1	178.5	-76.7	176.1	175	148.9	0	112.8	D452 G453 D454 R465 R466	D452-K456 WeakPolarHBondContact OD1-CE 3.39Å; D452-K456 IonicContact OD1-NZ 3.38Å; D452-K456 PolarHBondContact OD1-NZ 3.06Å; G453-K456 WeakPolarHBondContact O-CD 3.21Å; G453-K456 VanDerWaalsContact O-CG 3.31Å; G453-K456 WeakPolarHBondContact O-CG 3.38Å; D454-K456 VanDerWaalsContact C-N 3.34Å; K456-R465 HydrophobicContact CB-CB 4.21Å; K456-R465 PolarHBondContact O-NH1 3.02Å; K456-R465 PolarHBondContact O-NH2 3.49Å; K456-R466 WeakPolarHBondContact CB-O 3.41Å; K456-R466 WeakPolarHBondContact CG-O 3.48Å
457	P	96.6	Very high	96.3	Very high	32 Å²	32	87.8 Å²	87.8	21%	0.208	42%	0.423	C	S	.	.			trans	-72.6	157.9	171.5	32	-35.8	0	0	0	111.1	L406 L451 E455 C459 R465 R466 C468	L406-P457 HydrophobicContact CD1-CG 4.4Å; L406-P457 HydrophobicContact CD2-CG 4.33Å; L451-P457 HydrophobicContact CD1-CG 4.3Å; E455-P457 VanDerWaalsContact O-CD 3.26Å; E455-P457 WeakPolarHBondContact O-CD 3.44Å; E455-P457 VanDerWaalsContact O-N 3.14Å; P457-C459 PolarHBondContact O-N 3.2Å; P457-R465 WeakPolarHBondContact O-CA 3.37Å; P457-R466 PolarHBondContact O-N 2.82Å; P457-C468 HydrophobicContact CG-CB 3.76Å
458	T	97.1	Very high	96.3	Very high	96 Å²	96	83 Å²	83	59%	0.589	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.2	114.1	170	-58.9	0	0	0	0	109.2	Y460 A464	T458-Y460 PolarHBondContact O-N 3.48Å; T458-A464 WeakPolarHBondContact CA-O 3.23Å
459	C	96.4	Very high	96.4	Very high	8 Å²	8	79.3 Å²	79.3	5%	0.054	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	125.5	178.7	171.2	0	0	0	0	110.6	C408 C411 P457 R461 C462 K463 A464 R466	C408-C459 HydrophobicContact CB-CB 4.24Å; C411-C459 VanDerWaalsContact SG-SG 3.66Å; P457-C459 PolarHBondContact O-N 3.2Å; C459-R461 VanDerWaalsContact C-N 3.31Å; C459-R461 PolarHBondContact O-N 2.75Å; C459-C462 HydrophobicContact CB-CB 4.01Å; C459-C462 PolarHBondContact O-N 3Å; C459-K463 PolarHBondContact O-N 3.19Å; C459-A464 PolarHBondContact N-O 2.96Å; C459-R466 HydrophobicContact CB-CB 4.2Å; C459-R466 HydrophobicContact CB-CG 4.12Å
460	Y	91.4	Very high	96.5	Very high	169 Å²	169	79 Å²	79	66%	0.663	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-37.1	-178.5	177.8	-92.5	0	0	0	114	F413 T458 K463	F413-Y460 HydrophobicContact CE1-CD1 4.49Å; T458-Y460 PolarHBondContact O-N 3.48Å; Y460-K463 VanDerWaalsContact O-CD 3.26Å; Y460-K463 WeakPolarHBondContact O-CD 3.49Å; Y460-K463 WeakPolarHBondContact O-CE 3.14Å; Y460-K463 PolarHBondContact O-NZ 2.88Å
461	R	94.5	Very high	96.5	Very high	167 Å²	167	80.1 Å²	80.1	63%	0.63	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-38.5	177.4	-67.8	-161.9	-172.9	-176.3	-0.6	113.2	F413 C459 K463	F413-R461 HydrophobicContact CB-CG 4.19Å; F413-R461 HydrophobicContact CD1-CG 3.9Å; F413-R461 HydrophobicContact CD2-CG 4.27Å; F413-R461 VanDerWaalsContact CD2-CZ 3.48Å; F413-R461 HydrophobicContact CE1-CG 4.35Å; F413-R461 HydrophobicContact CG-CG 3.85Å; C459-R461 VanDerWaalsContact C-N 3.31Å; C459-R461 PolarHBondContact O-N 2.75Å; R461-K463 VanDerWaalsContact C-N 3.33Å
462	C	95.8	Very high	96.5	Very high	34 Å²	34	80.8 Å²	80.8	23%	0.23	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-12.8	178.7	-61.8	0	0	0	0	114.3	C411 C459 A464 R466	C411-C462 PolarHBondContact SG-SG 3.39Å; C459-C462 HydrophobicContact CB-CB 4.01Å; C459-C462 PolarHBondContact O-N 3Å; C462-A464 HydrophobicContact CB-CB 4.46Å; C462-A464 PolarHBondContact O-N 3.43Å; C462-R466 HydrophobicContact CB-CG 4.02Å
463	K	97.2	Very high	96.5	Very high	143 Å²	143	79.1 Å²	79.1	62%	0.622	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	25.2	-171.7	-52.8	-60.4	179.8	-161.2	0	114.2	C459 Y460 R461	C459-K463 PolarHBondContact O-N 3.19Å; Y460-K463 VanDerWaalsContact O-CD 3.26Å; Y460-K463 WeakPolarHBondContact O-CD 3.49Å; Y460-K463 WeakPolarHBondContact O-CE 3.14Å; Y460-K463 PolarHBondContact O-NZ 2.88Å; R461-K463 VanDerWaalsContact C-N 3.33Å
464	A	97.4	Very high	96.6	Very high	29 Å²	29	77.3 Å²	77.3	24%	0.24	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	155.2	-173.2	0	0	0	0	0	111.2	T458 C459 C462 R466	T458-A464 WeakPolarHBondContact CA-O 3.23Å; C459-A464 PolarHBondContact N-O 2.96Å; C462-A464 HydrophobicContact CB-CB 4.46Å; C462-A464 PolarHBondContact O-N 3.43Å; A464-R466 PolarHBondContact O-N 3.22Å
465	R	97.8	Very high	96.6	Very high	131 Å²	131	71.4 Å²	71.4	49%	0.494	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	123	169	-74.4	175	61.5	91	-1.5	109.4	D454 K456 P457	D454-R465 VanDerWaalsContact C-NH2 3.35Å; D454-R465 PolarHBondContact O-NH2 3.34Å; K456-R465 HydrophobicContact CB-CB 4.21Å; K456-R465 PolarHBondContact O-NH1 3.02Å; K456-R465 PolarHBondContact O-NH2 3.49Å; P457-R465 WeakPolarHBondContact O-CA 3.37Å
466	R	97.9	Very high	96.6	Very high	79 Å²	79	68.5 Å²	68.5	30%	0.298	31%	0.308	S	S	.	.			trans	-132.8	155.8	-178.1	-69.7	-60	-169.6	-127.8	15.2	109.9	H410 K456 P457 C459 C462 A464 C468	H410-R466 HydrophobicContact CB-CG 4.32Å; H410-R466 VanDerWaalsContact CD2-CZ 3.47Å; H410-R466 PolarHBondContact CD2-NE 3.47Å; H410-R466 PolarHBondContact CD2-NH2 2.56Å; H410-R466 VanDerWaalsContact CD2-NH2 3.34Å; H410-R466 PolarHBondContact NE2-NH2 3.47Å; K456-R466 WeakPolarHBondContact CB-O 3.41Å; K456-R466 WeakPolarHBondContact CG-O 3.48Å; P457-R466 PolarHBondContact O-N 2.82Å; C459-R466 HydrophobicContact CB-CB 4.2Å; C459-R466 HydrophobicContact CB-CG 4.12Å; C462-R466 HydrophobicContact CB-CG 4.02Å; A464-R466 PolarHBondContact O-N 3.22Å; R466-C468 PolarHBondContact O-N 2.96Å
467	R	98	Very high	96.6	Very high	113 Å²	113	66.4 Å²	66.4	43%	0.426	30%	0.298	S	S	.	.			trans	-65.6	128.4	164.3	172.7	-166.6	177	125.7	-15.4	107.9	S409 V450 L451 D452	S409-R467 WeakPolarHBondContact CB-O 3.39Å; S409-R467 PolarHBondContact N-O 2.66Å; S409-R467 WeakPolarHBondContact OG-CB 3.36Å; S409-R467 PolarHBondContact OG-O 3.42Å; V450-R467 HydrophobicContact CG1-CG 4.13Å; L451-R467 WeakPolarHBondContact O-CA 3.31Å; D452-R467 HydrophobicContact CB-CG 4.27Å; D452-R467 WeakPolarHBondContact OD2-CD 3.5Å; D452-R467 WeakPolarHBondContact OD2-CG 3.41Å; D452-R467 IonicContact OD2-CZ 3.98Å; D452-R467 IonicContact OD2-NE 3.42Å; D452-R467 IonicContact OD2-NH1 2.66Å; D452-R467 PolarHBondContact OD2-NH1 2.85Å
468	C	98	Very high	96.6	Very high	3 Å²	3	65.1 Å²	65.1	2%	0.02	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	161.2	174.2	-65.6	0	0	0	0	109.8	L406 T407 L451 P457 R466	L406-C468 HydrophobicContact CD1-CB 3.72Å; L406-C468 HydrophobicContact CG-CB 4.28Å; T407-C468 CarbonylContact O-C 3.25Å; T407-C468 WeakPolarHBondContact O-CA 3.31Å; T407-C468 VanDerWaalsContact O-CB 3.29Å; T407-C468 WeakPolarHBondContact O-CB 3.38Å; L451-C468 PolarHBondContact N-O 3.04Å; L451-C468 PolarHBondContact O-N 3.42Å; L451-C468 VanDerWaalsContact O-N 3.09Å; P457-C468 HydrophobicContact CG-CB 3.76Å; R466-C468 PolarHBondContact O-N 2.96Å
469	T	97.9	Very high	96.6	Very high	23 Å²	23	66 Å²	66	14%	0.141	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	138.7	165.9	64.5	0	0	0	0	109.7	L406 T407 E448 D449 V450	L406-T469 CarbonylContact C-O 3.49Å; L406-T469 WeakPolarHBondContact CA-O 3.28Å; T407-T469 PolarHBondContact N-O 3.35Å; T407-T469 PolarHBondContact O-N 2.91Å; E448-T469 HydrophobicContact CG-CG2 4.41Å; E448-T469 WeakPolarHBondContact OE1-CB 3.15Å; E448-T469 WeakPolarHBondContact OE1-CG2 3.48Å; E448-T469 PolarHBondContact OE1-OG1 2.93Å; D449-T469 CarbonylContact O-C 3.29Å; D449-T469 WeakPolarHBondContact O-CA 3.45Å; V450-T469 HydrophobicContact CG1-CG2 4.46Å; V450-T469 HydrophobicContact CG2-CG2 4.08Å
470	K	97.2	Very high	96.7	Very high	72 Å²	72	66 Å²	66	31%	0.313	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	134.4	179.8	-175.6	179.1	177.9	175.9	0	109.2	S404 S405 L406 E448 D449 L451	S404-K470 VanDerWaalsContact OG-CE 3.29Å; S404-K470 WeakPolarHBondContact OG-CE 3.27Å; S405-K470 VanDerWaalsContact O-CA 3.32Å; S405-K470 WeakPolarHBondContact O-CA 3.4Å; L406-K470 HydrophobicContact CD1-CB 4.01Å; E448-K470 WeakPolarHBondContact CA-O 3.41Å; D449-K470 PolarHBondContact N-O 3.45Å; D449-K470 PolarHBondContact O-N 3.32Å; L451-K470 HydrophobicContact CD1-CB 4.23Å
471	K	96.8	Very high	97	Very high	92 Å²	92	58 Å²	58	40%	0.4	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	143.1	176.5	-172.2	177.7	178.3	-178.4	0	111.1	S405	S405-K471 PolarHBondContact N-O 2.67Å; S405-K471 PolarHBondContact O-N 2.87Å
472	F	97.1	Very high	97.2	Very high	52 Å²	52	50 Å²	50	23%	0.228	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	137.9	168.9	-70.8	-71.6	0	0	0	111.1	L402 K403 F445 T446	L402-F472 HydrophobicContact CD1-CD1 4.49Å; K403-F472 WeakPolarHBondContact O-CA 3.47Å; F445-F472 HydrophobicContact CE1-CB 4.47Å; T446-F472 WeakPolarHBondContact CB-O 3.33Å
473	T	96.7	Very high	97.4	Very high	21 Å²	21	48.4 Å²	48.4	13%	0.129	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	160	164.2	53.1	0	0	0	0	109.9	L402 K403 F513 S515	L402-T473 WeakPolarHBondContact CA-O 3.48Å; K403-T473 PolarHBondContact N-O 2.71Å; K403-T473 PolarHBondContact O-N 2.74Å; T473-F513 WeakPolarHBondContact CA-O 3.43Å; T473-S515 PolarHBondContact OG1-OG 3.5Å
474	I	96.8	Very high	97.4	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	111.6	178.3	-58.8	171.4	0	0	0	108.6	L402 F421 L424 M442 F477 F513 A514 S515	L402-I474 HydrophobicContact CD2-CG1 3.95Å; F421-I474 HydrophobicContact CE1-CG2 4.25Å; F421-I474 HydrophobicContact CZ-CG2 4.32Å; L424-I474 HydrophobicContact CD1-CD1 4Å; M442-I474 HydrophobicContact CE-CD1 4.06Å; I474-F477 HydrophobicContact CB-CE1 4.25Å; I474-F477 HydrophobicContact CB-CE2 3.92Å; I474-F477 HydrophobicContact CB-CZ 3.79Å; I474-F477 HydrophobicContact CD1-CD1 4.41Å; I474-F477 HydrophobicContact CD1-CE1 3.56Å; I474-F477 HydrophobicContact CD1-CZ 3.73Å; I474-F477 HydrophobicContact CG1-CZ 4.34Å; I474-F477 HydrophobicContact CG2-CD1 3.94Å; I474-F477 HydrophobicContact CG2-CD2 3.71Å; I474-F477 HydrophobicContact CG2-CE1 3.86Å; I474-F477 HydrophobicContact CG2-CE2 3.63Å; I474-F477 HydrophobicContact CG2-CG 3.88Å; I474-F477 HydrophobicContact CG2-CZ 3.71Å; I474-F513 HydrophobicContact CD1-CB 4.24Å; I474-F513 PolarHBondContact N-O 3.2Å; I474-A514 CarbonylContact O-C 3.52Å; I474-A514 WeakPolarHBondContact O-CA 3.35Å; I474-S515 PolarHBondContact O-N 3.08Å
475	Q	95.6	Very high	97.5	Very high	34 Å²	34	41 Å²	41	16%	0.159	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-40.3	175.9	-167	66.9	34.2	0	0	111.2	Q401 K403 F418 S515 E516	Q401-Q475 HydrophobicContact CB-CB 4.38Å; Q401-Q475 HydrophobicContact CG-CB 4.49Å; Q401-Q475 PolarHBondContact O-N 2.81Å; K403-Q475 HydrophobicContact CB-CB 4.39Å; F418-Q475 HydrophobicContact CD1-CB 4.24Å; F418-Q475 HydrophobicContact CD1-CG 4.05Å; F418-Q475 HydrophobicContact CE1-CB 4.36Å; F418-Q475 HydrophobicContact CE1-CG 3.91Å; Q475-S515 PolarHBondContact OE1-OG 3.49Å; Q475-E516 PolarHBondContact NE2-OE1 3.06Å
476	K	95.1	Very high	97.4	Very high	79 Å²	79	39.2 Å²	39.2	34%	0.343	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	125.2	179.7	176.8	175.5	164.4	49.2	0	110.7	W383 G400 Q401	W383-K476 HydrophobicContact CD2-CD 3.88Å; W383-K476 HydrophobicContact CE3-CD 4.04Å; W383-K476 HydrophobicContact CH2-CD 4.01Å; W383-K476 HydrophobicContact CZ2-CD 3.85Å; W383-K476 HydrophobicContact CZ3-CD 4.1Å; G400-K476 CarbonylContact C-O 3.57Å; G400-K476 WeakPolarHBondContact CA-O 3.46Å; Q401-K476 HydrophobicContact CB-CB 3.71Å; Q401-K476 PolarHBondContact N-O 2.86Å; Q401-K476 PolarHBondContact O-N 2.92Å
477	F	96.7	Very high	97.2	Very high	16 Å²	16	35.4 Å²	35.4	7%	0.07	16%	0.157	C	C	.	.			trans	-83.7	139.7	173.3	-78.8	-84.6	0	0	0	111.4	I474 L510 A514 N520 A521 Y523	I474-F477 HydrophobicContact CB-CE1 4.25Å; I474-F477 HydrophobicContact CB-CE2 3.92Å; I474-F477 HydrophobicContact CB-CZ 3.79Å; I474-F477 HydrophobicContact CD1-CD1 4.41Å; I474-F477 HydrophobicContact CD1-CE1 3.56Å; I474-F477 HydrophobicContact CD1-CZ 3.73Å; I474-F477 HydrophobicContact CG1-CZ 4.34Å; I474-F477 HydrophobicContact CG2-CD1 3.94Å; I474-F477 HydrophobicContact CG2-CD2 3.71Å; I474-F477 HydrophobicContact CG2-CE1 3.86Å; I474-F477 HydrophobicContact CG2-CE2 3.63Å; I474-F477 HydrophobicContact CG2-CG 3.88Å; I474-F477 HydrophobicContact CG2-CZ 3.71Å; F477-L510 HydrophobicContact CE1-CB 3.66Å; F477-L510 HydrophobicContact CE1-CD1 3.93Å; F477-L510 HydrophobicContact CE1-CG 4.46Å; F477-L510 HydrophobicContact CZ-CB 3.9Å; F477-A514 HydrophobicContact CE2-CB 3.86Å; F477-A514 HydrophobicContact CZ-CB 4.42Å; F477-N520 WeakPolarHBondContact CB-O 3.32Å; F477-N520 WeakPolarHBondContact CG-O 3.47Å; F477-A521 HydrophobicContact CD2-CB 4.07Å; F477-A521 HydrophobicContact CE1-CB 4.27Å; F477-A521 HydrophobicContact CE2-CB 3.79Å; F477-A521 HydrophobicContact CG-CB 4.43Å; F477-A521 HydrophobicContact CZ-CB 3.89Å; F477-Y523 WeakPolarHBondContact CB-OH 3.33Å; F477-Y523 AromaticContact CD1-CE2 3.75Å; F477-Y523 HydrophobicContact CD1-CE2 3.75Å; F477-Y523 WeakPolarHBondContact CD1-OH 3.09Å; F477-Y523 HydrophobicContact CE1-CE2 4.31Å
478	P	97.1	Very high	96.6	Very high	5 Å²	5	32.9 Å²	32.9	3%	0.032	15%	0.149	C	C	.	.			trans	-81.1	164.7	173.5	34.2	-36.3	0	0	0	111.9	F398 F421 I480 L481 Y523	F398-P478 VanDerWaalsContact O-CB 3.3Å; F398-P478 WeakPolarHBondContact O-CB 3.2Å; F421-P478 HydrophobicContact CE2-CG 4.31Å; F421-P478 HydrophobicContact CZ-CG 4.49Å; P478-I480 WeakPolarHBondContact CB-O 3.39Å; P478-I480 WeakPolarHBondContact CG-O 3.31Å; P478-L481 HydrophobicContact CG-CB 4.01Å; P478-L481 HydrophobicContact CG-CD1 3.86Å; P478-Y523 WeakPolarHBondContact CD-OH 3.33Å; P478-Y523 PolarHBondContact O-OH 3.16Å
479	K	97.1	Very high	95.3	Very high	114 Å²	114	35.8 Å²	35.8	50%	0.496	17%	0.169	S	C	.	.	S	Bend	trans	-72.5	-35.5	175	-59.5	-171.5	-176.3	108.2	0	111.8	D396 V397 L580	D396-K479 WeakPolarHBondContact O-CD 3.24Å; D396-K479 PolarHBondContact O-NZ 2.75Å; V397-K479 PolarHBondContact O-N 3.1Å; K479-L580 PolarHBondContact O-N 3.26Å
480	I	98.3	Very high	93.4	Very high	9 Å²	9	40.9 Å²	40.9	5%	0.046	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	116.9	171.4	-59.8	-63.3	0	0	0	107.6	T271 V397 F398 P478 Y526 Y578 E579	T271-I480 HydrophobicContact CG2-CD1 3.97Å; T271-I480 HydrophobicContact CG2-CG1 3.78Å; T271-I480 HydrophobicContact CG2-CG2 4.41Å; V397-I480 HydrophobicContact CG1-CB 3.93Å; V397-I480 HydrophobicContact CG1-CG1 3.43Å; V397-I480 VanDerWaalsContact CG1-CG1 3.43Å; V397-I480 PolarHBondContact O-N 2.91Å; F398-I480 HydrophobicContact CD1-CB 3.99Å; F398-I480 HydrophobicContact CD1-CG2 3.77Å; F398-I480 HydrophobicContact CE1-CB 4.02Å; F398-I480 HydrophobicContact CE1-CG2 3.51Å; F398-I480 HydrophobicContact CZ-CG2 4.44Å; P478-I480 WeakPolarHBondContact CB-O 3.39Å; P478-I480 WeakPolarHBondContact CG-O 3.31Å; I480-Y526 HydrophobicContact CD1-CE1 3.92Å; I480-Y526 HydrophobicContact CG2-CE1 4.13Å; I480-Y526 VanDerWaalsContact CG2-OH 3.25Å; I480-Y526 WeakPolarHBondContact CG2-OH 3.34Å; I480-Y578 CarbonylContact C-O 3.51Å; I480-Y578 VanDerWaalsContact CA-O 3.29Å; I480-Y578 WeakPolarHBondContact CA-O 3.16Å; I480-E579 HydrophobicContact CD1-CB 3.67Å
481	L	98.6	Very high	91.6	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	117	178.6	178.9	61.7	0	0	0	109.6	F421 L424 P478 L483 L510 Y523 Y578	F421-L481 HydrophobicContact CE2-CD1 3.9Å; F421-L481 HydrophobicContact CZ-CD1 4.47Å; L424-L481 HydrophobicContact CD1-CD1 4.23Å; L424-L481 HydrophobicContact CG-CD1 4.43Å; P478-L481 HydrophobicContact CG-CB 4.01Å; P478-L481 HydrophobicContact CG-CD1 3.86Å; L481-L483 HydrophobicContact CD1-CD2 3.9Å; L481-L483 HydrophobicContact CD2-CD1 4.37Å; L481-L483 HydrophobicContact CD2-CD2 3.98Å; L481-L483 HydrophobicContact CD2-CG 4.3Å; L481-L483 HydrophobicContact CG-CD2 3.75Å; L481-L483 HydrophobicContact CG-CG 4.02Å; L481-L510 HydrophobicContact CD2-CD1 3.26Å; L481-Y523 HydrophobicContact CB-CD1 4.03Å; L481-Y523 HydrophobicContact CB-CE1 3.56Å; L481-Y523 HydrophobicContact CD2-CD2 4.25Å; L481-Y523 HydrophobicContact CD2-CE1 4.43Å; L481-Y523 HydrophobicContact CD2-CE2 3.95Å; L481-Y578 PolarHBondContact N-O 3.27Å; L481-Y578 PolarHBondContact O-N 2.67Å
482	V	98.8	Very high	89.7	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.006	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	122.1	174.2	-178.3	0	0	0	0	109	L345 F398 D423 L424 V575 L576 F577	L345-V482 HydrophobicContact CD2-CG1 3.73Å; F398-V482 HydrophobicContact CD1-CG2 3.95Å; F398-V482 HydrophobicContact CE1-CG2 4.21Å; D423-V482 CarbonylContact C-O 3.53Å; D423-V482 WeakPolarHBondContact CA-O 3.43Å; D423-V482 HydrophobicContact CB-CB 3.83Å; D423-V482 HydrophobicContact CB-CG1 3.78Å; L424-V482 PolarHBondContact N-O 2.86Å; V482-V575 HydrophobicContact CG1-CG1 3.45Å; V482-V575 VanDerWaalsContact CG1-CG1 3.45Å; V482-L576 WeakPolarHBondContact CA-O 3.25Å; V482-F577 HydrophobicContact CG1-CE1 4.49Å; V482-F577 HydrophobicContact CG2-CD1 3.9Å; V482-F577 HydrophobicContact CG2-CE1 3.96Å
483	L	98.8	Very high	87.9	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	110.9	177.8	-57.3	179.4	0	0	0	109.8	L424 L426 L438 M442 L481 L508 L576 Y578	L424-L483 HydrophobicContact CB-CD2 3.83Å; L424-L483 HydrophobicContact CD1-CD2 4.11Å; L424-L483 HydrophobicContact CG-CD2 4.32Å; L426-L483 HydrophobicContact CD1-CB 4.32Å; L426-L483 HydrophobicContact CD1-CD2 4.37Å; L438-L483 HydrophobicContact CD1-CD1 4.17Å; L438-L483 HydrophobicContact CD2-CD1 3.87Å; L438-L483 HydrophobicContact CG-CD1 4.4Å; M442-L483 HydrophobicContact SD-CD2 4.3Å; L481-L483 HydrophobicContact CD1-CD2 3.9Å; L481-L483 HydrophobicContact CD2-CD1 4.37Å; L481-L483 HydrophobicContact CD2-CD2 3.98Å; L481-L483 HydrophobicContact CD2-CG 4.3Å; L481-L483 HydrophobicContact CG-CD2 3.75Å; L481-L483 HydrophobicContact CG-CG 4.02Å; L483-L508 HydrophobicContact CD1-CD2 4.23Å; L483-L576 HydrophobicContact CB-CB 4.33Å; L483-L576 PolarHBondContact N-O 2.58Å; L483-L576 PolarHBondContact O-N 2.84Å; L483-Y578 HydrophobicContact CD1-CD2 4Å; L483-Y578 HydrophobicContact CD1-CE2 3.98Å; L483-Y578 HydrophobicContact CG-CD2 4.42Å
484	H	98.6	Very high	86.5	Confident	15 Å²	15	56.6 Å²	56.6	7%	0.069	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	125.2	175.3	156.4	-142.5	0	0	0	109.6	Q342 L424 S425 L426 Y574 V575	Q342-H484 HydrophobicContact CG-CB 3.88Å; L424-H484 PolarHBondContact O-N 2.89Å; S425-H484 CarbonylContact C-O 3.49Å; S425-H484 WeakPolarHBondContact CA-O 3.07Å; S425-H484 WeakPolarHBondContact CB-ND1 3.41Å; S425-H484 PolarHBondContact OG-ND1 2.81Å; L426-H484 PolarHBondContact N-O 2.94Å; H484-Y574 AromaticContact CD2-CE2 3.39Å; H484-Y574 WeakPolarHBondContact CD2-CE2 3.37Å; H484-Y574 AromaticContact CD2-CZ 3.66Å; H484-Y574 AromaticContact NE2-CE2 3.31Å; H484-Y574 VanDerWaalsContact NE2-CE2 3.31Å; H484-Y574 WeakPolarHBondContact NE2-CE2 3.49Å; H484-Y574 AromaticContact NE2-CZ 3.48Å; H484-Y574 PolarHBondContact NE2-OH 2.83Å; H484-V575 HydrophobicContact CB-CG2 4.43Å
485	L	97.9	Very high	85.7	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	113.8	173.3	-61.8	177.4	0	0	0	109.3	L426 I428 L438 R487 V501 Y574	L426-L485 HydrophobicContact CD1-CD2 4.48Å; I428-L485 HydrophobicContact CD1-CB 4.2Å; I428-L485 HydrophobicContact CG1-CB 4.42Å; L438-L485 HydrophobicContact CD1-CD2 4.13Å; L485-R487 HydrophobicContact CB-CG 4.43Å; L485-R487 PolarHBondContact O-N 2.93Å; L485-V501 HydrophobicContact CD1-CB 3.99Å; L485-V501 HydrophobicContact CD1-CG1 4.19Å; L485-V501 HydrophobicContact CD1-CG2 4.14Å; L485-V501 HydrophobicContact CD2-CG1 4.29Å; L485-Y574 PolarHBondContact N-O 2.93Å; L485-Y574 WeakPolarHBondContact O-CD2 3.29Å; L485-Y574 VanDerWaalsContact O-CE2 3.27Å; L485-Y574 WeakPolarHBondContact O-CE2 3.47Å
486	K	95.7	Very high	85.3	Confident	94 Å²	94	59.9 Å²	59.9	41%	0.409	28%	0.283	S	S	.	.			trans	-65.8	75.8	-179.4	-74.3	171.5	161.1	147	0	112.1	S425 L426	S425-K486 WeakPolarHBondContact O-CD 3.44Å; S425-K486 WeakPolarHBondContact O-CE 3.43Å; S425-K486 PolarHBondContact O-NZ 3.07Å; L426-K486 VanDerWaalsContact O-CB 3.28Å; L426-K486 WeakPolarHBondContact O-CB 3.47Å; L426-K486 WeakPolarHBondContact O-CG 3.25Å; L426-K486 PolarHBondContact O-N 2.91Å
487	R	93.8	Very high	85.1	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.278	C	S	.	.			trans	-79.9	-21.8	179.6	-70.6	-172.4	-176.9	-72.3	-0.6	113.2	I428 L485 K496 L497 T499 S571 A573 Y574	I428-R487 HydrophobicContact CD1-CG 3.64Å; L485-R487 HydrophobicContact CB-CG 4.43Å; L485-R487 PolarHBondContact O-N 2.93Å; R487-K496 HydrophobicContact CB-CG 4.31Å; R487-K496 CarbonylContact O-C 3.58Å; R487-K496 WeakPolarHBondContact O-CA 3.15Å; R487-L497 PolarHBondContact NH1-O 3.32Å; R487-L497 PolarHBondContact O-N 3.13Å; R487-T499 PolarHBondContact NH1-O 2.97Å; R487-T499 PolarHBondContact NH2-O 3.01Å; R487-S571 PolarHBondContact NH1-O 3.48Å; R487-S571 PolarHBondContact NH2-O 3.12Å; R487-S571 VanDerWaalsContact NH2-O 3.16Å; R487-A573 VanDerWaalsContact CZ-O 3.27Å; R487-A573 PolarHBondContact NE-O 3.16Å; R487-A573 PolarHBondContact NH2-O 2.86Å; R487-Y574 HydrophobicContact CB-CD2 4.22Å; R487-Y574 HydrophobicContact CB-CE2 4.29Å; R487-Y574 HydrophobicContact CG-CD2 4.21Å
488	F	86.1	Confident	84.8	Confident	59 Å²	59	61.6 Å²	61.6	26%	0.259	30%	0.303	S	S	.	.	B	Isolated β-bridge	trans	-102.5	136.8	-179.9	-50.7	-51.3	0	0	0	110.6	D340 K496 H531 T535 Y574	D340-F488 WeakPolarHBondContact OD2-CD2 3.3Å; D340-F488 WeakPolarHBondContact OD2-CE2 3.4Å; F488-K496 HydrophobicContact CD1-CB 4.2Å; F488-K496 HydrophobicContact CD1-CG 4.32Å; F488-K496 HydrophobicContact CE1-CB 4.05Å; F488-K496 HydrophobicContact CE1-CD 4.39Å; F488-K496 HydrophobicContact CE1-CG 3.91Å; F488-H531 AromaticContact CZ-CE1 3.9Å; F488-H531 AromaticContact CZ-ND1 3.57Å; F488-T535 HydrophobicContact CB-CG2 4.35Å; F488-T535 HydrophobicContact CD1-CG2 3.53Å; F488-T535 HydrophobicContact CE1-CG2 4.22Å; F488-T535 HydrophobicContact CG-CG2 4.27Å; F488-Y574 HydrophobicContact CD2-CE2 4.1Å; F488-Y574 AromaticContact CD2-CZ 3.87Å; F488-Y574 WeakPolarHBondContact CD2-OH 3.42Å; F488-Y574 HydrophobicContact CE2-CE1 4.05Å; F488-Y574 AromaticContact CE2-CE2 3.87Å; F488-Y574 HydrophobicContact CE2-CE2 3.87Å; F488-Y574 AromaticContact CE2-CZ 3.53Å; F488-Y574 WeakPolarHBondContact CE2-OH 3.41Å
489	S	71.5	Confident	84.6	Confident	64 Å²	64	63.8 Å²	63.8	45%	0.448	32%	0.316	S	S	.	.			trans	-124.4	133.8	-177.2	-176	0	0	0	0	111.4	A491	S489-A491 PolarHBondContact O-N 3.09Å
490	E	57.1	Low	84.5	Confident	131 Å²	131	61.8 Å²	61.8	61%	0.612	31%	0.308	S	S	*	.			trans	-71.3	24.2	174.5	-53.3	-178.3	179.8	0	0	114.6	R10	R10-E490 IonicContact CZ-OE2 3.71Å; R10-E490 VanDerWaalsContact CZ-OE2 3.23Å; R10-E490 IonicContact NH1-OE2 2.79Å; R10-E490 PolarHBondContact NH1-OE2 3.08Å; R10-E490 PolarHBondContact NH2-O 3.48Å; R10-E490 IonicContact NH2-OE2 3.62Å; R10-E490 PolarHBondContact NH2-OE2 3.06Å
491	A	60.8	Low	84.4	Confident	50 Å²	50	61.4 Å²	61.4	41%	0.413	31%	0.306	S	S	.	.	S	Bend	trans	-67.3	156.1	176.2	0	0	0	0	0	110	S489 R493 T494	S489-A491 PolarHBondContact O-N 3.09Å; A491-R493 CarbonylContact O-C 3.57Å; A491-R493 VanDerWaalsContact O-C 3.25Å; A491-R493 PolarHBondContact O-N 2.79Å; A491-T494 PolarHBondContact O-N 2.81Å
492	R	55.2	Low	84.3	Confident	229 Å²	229	63.2 Å²	63.2	86%	0.864	32%	0.315	S	S	*	.	S	Bend	trans	-57.6	-12	-179.3	-64.9	-172.9	-177.4	-170.3	0.3	114.7
493	R	60.8	Low	84.3	Confident	222 Å²	222	63.1 Å²	63.1	84%	0.838	32%	0.315	S	S	*	.	S	Bend	trans	-125.7	109	158.5	-67.9	178.8	177.6	163.2	-1.6	106.6	A491	A491-R493 CarbonylContact O-C 3.57Å; A491-R493 VanDerWaalsContact O-C 3.25Å; A491-R493 PolarHBondContact O-N 2.79Å
494	T	65.6	Low	84.2	Confident	66 Å²	66	65.4 Å²	65.4	41%	0.405	33%	0.33	S	S	.	.			trans	-72.4	131.8	178.7	62	0	0	0	0	108.9	A491 T535	A491-T494 PolarHBondContact O-N 2.81Å; T494-T535 PolarHBondContact O-OG1 3.35Å; T494-T535 PolarHBondContact OG1-OG1 2.98Å
495	S	80.1	Confident	84.1	Confident	69 Å²	69	66.5 Å²	66.5	48%	0.483	34%	0.335	S	S	.	.			trans	-142.3	150.3	176.9	50.2	0	0	0	0	110
496	K	88.8	Confident	84	Confident	35 Å²	35	73.2 Å²	73.2	15%	0.152	36%	0.364	C	S	.	.	B	Isolated β-bridge	trans	-84.4	128.1	175.5	179.3	-169.1	168.6	-170.7	0	108.9	R487 F488 S498 H531 G533 D572	R487-K496 HydrophobicContact CB-CG 4.31Å; R487-K496 CarbonylContact O-C 3.58Å; R487-K496 WeakPolarHBondContact O-CA 3.15Å; F488-K496 HydrophobicContact CD1-CB 4.2Å; F488-K496 HydrophobicContact CD1-CG 4.32Å; F488-K496 HydrophobicContact CE1-CB 4.05Å; F488-K496 HydrophobicContact CE1-CD 4.39Å; F488-K496 HydrophobicContact CE1-CG 3.91Å; K496-S498 PolarHBondContact O-N 3.22Å; K496-H531 PolarHBondContact NZ-O 3.18Å; K496-G533 WeakPolarHBondContact CD-O 3.29Å; K496-G533 PolarHBondContact NZ-O 2.91Å; K496-D572 IonicContact NZ-OD1 2.67Å; K496-D572 PolarHBondContact NZ-OD1 3.46Å
497	L	89.4	Confident	84	Confident	45 Å²	45	73.8 Å²	73.8	24%	0.236	37%	0.372	C	S	.	.			trans	-73.4	106.2	167	-58.4	179.1	0	0	0	109.2	I428 R487 T499	I428-L497 HydrophobicContact CB-CD1 4.16Å; I428-L497 HydrophobicContact CD1-CB 4.23Å; I428-L497 HydrophobicContact CD1-CD1 4.26Å; R487-L497 PolarHBondContact NH1-O 3.32Å; R487-L497 PolarHBondContact O-N 3.13Å; L497-T499 PolarHBondContact O-N 3.3Å
498	S	90.8	Very high	84.2	Confident	86 Å²	86	73.9 Å²	73.9	60%	0.601	37%	0.373	S	S	*	.			trans	-80.2	4.9	173.9	51.8	0	0	0	0	113.7	K496 F500 S571	K496-S498 PolarHBondContact O-N 3.22Å; S498-F500 PolarHBondContact O-N 2.88Å; S498-S571 WeakPolarHBondContact O-CB 3.44Å
499	T	93.1	Very high	84.7	Confident	50 Å²	50	73.6 Å²	73.6	31%	0.307	37%	0.374	S	S	.	.			trans	-49.6	123	178.8	-47.5	0	0	0	0	111.3	I428 V436 R487 L497 V501	I428-T499 HydrophobicContact CG2-CG2 3.95Å; V436-T499 HydrophobicContact CB-CG2 4.26Å; V436-T499 HydrophobicContact CG2-CG2 3.96Å; R487-T499 PolarHBondContact NH1-O 2.97Å; R487-T499 PolarHBondContact NH2-O 3.01Å; L497-T499 PolarHBondContact O-N 3.3Å; T499-V501 PolarHBondContact O-N 3Å
500	F	95	Very high	85.9	Confident	73 Å²	73	70.6 Å²	70.6	32%	0.32	35%	0.353	S	S	.	.			trans	-64.1	131.7	168.8	-172.5	-96.8	0	0	0	109.1	E435 S498 N502 R569	E435-F500 HydrophobicContact CG-CD1 4.32Å; E435-F500 WeakPolarHBondContact OE1-CD1 3.2Å; E435-F500 VanDerWaalsContact OE1-CE1 3.22Å; E435-F500 WeakPolarHBondContact OE1-CE1 3.39Å; S498-F500 PolarHBondContact O-N 2.88Å; F500-N502 HydrophobicContact CD1-CB 4.44Å; F500-N502 HydrophobicContact CE1-CB 3.89Å; F500-R569 HydrophobicContact CZ-CB 4.1Å
501	V	96.4	Very high	87.7	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	112	176.6	178.7	0	0	0	0	106.6	I428 V436 L438 L485 T499 F503	I428-V501 HydrophobicContact CD1-CG2 4.5Å; I428-V501 HydrophobicContact CG2-CG2 4.16Å; V436-V501 HydrophobicContact CG1-CG2 4.2Å; V436-V501 CarbonylContact O-C 3.53Å; V436-V501 VanDerWaalsContact O-CA 3.31Å; V436-V501 WeakPolarHBondContact O-CA 3.26Å; L438-V501 HydrophobicContact CB-CG1 4.47Å; L485-V501 HydrophobicContact CD1-CB 3.99Å; L485-V501 HydrophobicContact CD1-CG1 4.19Å; L485-V501 HydrophobicContact CD1-CG2 4.14Å; L485-V501 HydrophobicContact CD2-CG1 4.29Å; T499-V501 PolarHBondContact O-N 3Å; V501-F503 WeakPolarHBondContact O-CD1 3.36Å; V501-F503 PolarHBondContact O-N 3.24Å
502	N	96.8	Very high	89.3	Confident	38 Å²	38	73.4 Å²	73.4	20%	0.203	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	111.4	179.3	-169.3	1.4	0	0	0	109.6	E435 V436 S437 L438 F500 R569	E435-N502 VanDerWaalsContact CD-CB 3.49Å; E435-N502 HydrophobicContact CG-CB 4.18Å; E435-N502 VanDerWaalsContact OE2-CB 3.29Å; E435-N502 WeakPolarHBondContact OE2-CB 3.39Å; E435-N502 PolarHBondContact OE2-ND2 2.74Å; V436-N502 PolarHBondContact O-N 3.22Å; S437-N502 CarbonylContact C-O 3.54Å; S437-N502 WeakPolarHBondContact CA-O 3.4Å; L438-N502 PolarHBondContact N-O 2.93Å; F500-N502 HydrophobicContact CD1-CB 4.44Å; F500-N502 HydrophobicContact CE1-CB 3.89Å; N502-R569 PolarHBondContact OD1-NH1 3.4Å
503	F	97.8	Very high	91.2	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.311	C	S	.	.			trans	-113.3	132.3	178.6	53.1	-96.7	0	0	0	110.4	L438 V501 L525 V528 R569 A573 L576	L438-F503 HydrophobicContact CB-CB 3.96Å; L438-F503 HydrophobicContact CD2-CB 3.84Å; L438-F503 HydrophobicContact CG-CB 4.44Å; V501-F503 WeakPolarHBondContact O-CD1 3.36Å; V501-F503 PolarHBondContact O-N 3.24Å; F503-L525 HydrophobicContact CD2-CD2 3.88Å; F503-L525 HydrophobicContact CE2-CD2 3.58Å; F503-V528 HydrophobicContact CE2-CG2 4.15Å; F503-V528 HydrophobicContact CZ-CG2 4.26Å; F503-R569 HydrophobicContact CD2-CG 4.13Å; F503-R569 HydrophobicContact CE2-CG 3.79Å; F503-R569 HydrophobicContact CZ-CB 4.3Å; F503-R569 HydrophobicContact CZ-CG 4.01Å; F503-R569 WeakPolarHBondContact O-CD 3.35Å; F503-A573 HydrophobicContact CE1-CB 3.53Å; F503-A573 HydrophobicContact CZ-CB 3.82Å; F503-L576 HydrophobicContact CB-CD1 3.81Å; F503-L576 HydrophobicContact CD1-CD1 3.93Å; F503-L576 HydrophobicContact CD1-CD2 3.95Å; F503-L576 HydrophobicContact CD2-CD1 4.29Å; F503-L576 HydrophobicContact CD2-CD2 4.1Å; F503-L576 HydrophobicContact CE1-CD2 3.81Å; F503-L576 HydrophobicContact CE2-CD2 3.94Å; F503-L576 HydrophobicContact CG-CD1 3.76Å; F503-L576 HydrophobicContact CG-CD2 4.11Å; F503-L576 HydrophobicContact CZ-CD2 3.78Å
504	P	97.1	Very high	92.8	Very high	47 Å²	47	52.9 Å²	52.9	31%	0.305	28%	0.277	S	S	.	.			trans	-72.9	136.6	-179.1	31.2	-35.3	0	0	0	110.9	L508 Y578	P504-L508 HydrophobicContact CG-CB 3.93Å; P504-L508 HydrophobicContact CG-CD1 3.66Å; P504-L508 HydrophobicContact CG-CG 4.32Å; P504-Y578 WeakPolarHBondContact O-CE1 3.1Å; P504-Y578 PolarHBondContact O-OH 3Å
505	M	96.7	Very high	93.9	Very high	38 Å²	38	51.2 Å²	51.2	19%	0.187	27%	0.269	C	S	.	.	S	Bend	trans	-81.5	-17.4	-178.5	-64.1	178.9	68.4	0	0	113.5	L525 W552 S565 V568 R569	M505-L525 HydrophobicContact CG-CD2 4.17Å; M505-L525 WeakPolarHBondContact O-CB 3.3Å; M505-L525 PolarHBondContact O-N 3.5Å; M505-W552 HydrophobicContact CE-CD2 4.29Å; M505-W552 VanDerWaalsContact CE-CE2 3.47Å; M505-W552 HydrophobicContact CE-CH2 4.43Å; M505-W552 HydrophobicContact CE-CZ2 3.56Å; M505-S565 VanDerWaalsContact SD-O 3.34Å; M505-V568 HydrophobicContact CE-CB 3.7Å; M505-V568 HydrophobicContact CE-CG1 3.94Å; M505-V568 HydrophobicContact CE-CG2 3.77Å; M505-V568 HydrophobicContact SD-CB 4.19Å; M505-R569 HydrophobicContact CG-CG 4.43Å
506	K	96.3	Very high	93.8	Very high	141 Å²	141	52 Å²	52	61%	0.613	27%	0.265	S	S	*	.	S	Bend	trans	-137.4	160.8	174.2	-67.6	-172.1	177.6	-176.9	0	109.9	L508 N524	K506-L508 PolarHBondContact O-N 3.24Å; K506-L508 VanDerWaalsContact O-N 3.15Å; K506-N524 WeakPolarHBondContact CA-OD1 3.41Å; K506-N524 WeakPolarHBondContact CB-OD1 3.47Å
507	D	95.8	Very high	92.7	Very high	106 Å²	106	58.4 Å²	58.4	57%	0.567	30%	0.301	S	S	*	.			trans	54	38	166	-49.5	-56.4	0	0	0	113.8	D509 V522 Y523 N524	D507-D509 PolarHBondContact O-N 3.06Å; D507-V522 HydrophobicContact CB-CG1 4.4Å; D507-Y523 PolarHBondContact N-O 3.38Å; D507-Y523 VanDerWaalsContact N-O 3.09Å; D507-N524 PolarHBondContact N-OD1 3.04Å
508	L	97.3	Very high	91.8	Very high	3 Å²	3	57.8 Å²	57.8	2%	0.016	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	95.9	170.7	175.1	60.8	0	0	0	109	L438 M439 L483 P504 K506 L510 V522 Y523 Y578	L438-L508 HydrophobicContact CD2-CD1 4.15Å; L438-L508 HydrophobicContact CD2-CD2 3.74Å; M439-L508 HydrophobicContact SD-CD1 3.85Å; L483-L508 HydrophobicContact CD1-CD2 4.23Å; P504-L508 HydrophobicContact CG-CB 3.93Å; P504-L508 HydrophobicContact CG-CD1 3.66Å; P504-L508 HydrophobicContact CG-CG 4.32Å; K506-L508 PolarHBondContact O-N 3.24Å; K506-L508 VanDerWaalsContact O-N 3.15Å; L508-L510 HydrophobicContact CD1-CD2 3.77Å; L508-L510 HydrophobicContact CD2-CD1 4.39Å; L508-L510 HydrophobicContact CD2-CD2 4.15Å; L508-L510 HydrophobicContact CD2-CG 4.43Å; L508-L510 HydrophobicContact CG-CD1 4.48Å; L508-L510 HydrophobicContact CG-CD2 3.77Å; L508-L510 HydrophobicContact CG-CG 4.02Å; L508-V522 CarbonylContact O-C 3.6Å; L508-V522 WeakPolarHBondContact O-CA 3.32Å; L508-Y523 WeakPolarHBondContact CB-O 3.28Å; L508-Y523 PolarHBondContact N-O 3.34Å; L508-Y523 PolarHBondContact O-N 2.75Å; L508-Y578 HydrophobicContact CB-CD1 4.3Å; L508-Y578 HydrophobicContact CB-CE1 3.9Å; L508-Y578 HydrophobicContact CD2-CD1 3.82Å; L508-Y578 HydrophobicContact CD2-CD2 4.14Å; L508-Y578 HydrophobicContact CD2-CE1 3.5Å; L508-Y578 HydrophobicContact CD2-CE2 3.83Å; L508-Y578 HydrophobicContact CD2-CG 4.13Å; L508-Y578 HydrophobicContact CG-CE1 4.34Å
509	D	96.2	Very high	90.8	Very high	53 Å²	53	59.2 Å²	59.2	28%	0.283	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	116.3	177.1	-174.3	2.6	0	0	0	111.4	M439 D507 R511 V522	M439-D509 VanDerWaalsContact CE-O 3.24Å; M439-D509 WeakPolarHBondContact CE-O 3.39Å; D507-D509 PolarHBondContact O-N 3.06Å; D509-R511 VanDerWaalsContact CG-NE 3.33Å; D509-R511 VanDerWaalsContact OD1-CB 3.25Å; D509-R511 WeakPolarHBondContact OD1-CB 3.45Å; D509-R511 WeakPolarHBondContact OD1-CG 3.39Å; D509-R511 IonicContact OD1-CZ 3.22Å; D509-R511 PolarHBondContact OD1-N 3.49Å; D509-R511 IonicContact OD1-NE 2.97Å; D509-R511 PolarHBondContact OD1-NE 3.46Å; D509-R511 IonicContact OD2-CZ 3.38Å; D509-R511 VanDerWaalsContact OD2-CZ 3.22Å; D509-R511 IonicContact OD2-NE 2.66Å; D509-R511 PolarHBondContact OD2-NE 2.59Å; D509-R511 IonicContact OD2-NH2 3.92Å; D509-R511 PolarHBondContact OD2-NH2 3.18Å; D509-V522 HydrophobicContact CB-CG2 4.43Å
510	L	96.6	Very high	90	Very high	0 Å²	0	61 Å²	61	0%	0	31%	0.313	C	S	.	.			trans	-107.8	13.3	179.8	-57.9	-179.1	0	0	0	113	M439 M442 F477 L481 L508 E512 F513 A521 Y523	M439-L510 HydrophobicContact SD-CD2 4.17Å; M442-L510 HydrophobicContact CE-CD2 4.29Å; M442-L510 HydrophobicContact CG-CD2 4.43Å; F477-L510 HydrophobicContact CE1-CB 3.66Å; F477-L510 HydrophobicContact CE1-CD1 3.93Å; F477-L510 HydrophobicContact CE1-CG 4.46Å; F477-L510 HydrophobicContact CZ-CB 3.9Å; L481-L510 HydrophobicContact CD2-CD1 3.26Å; L508-L510 HydrophobicContact CD1-CD2 3.77Å; L508-L510 HydrophobicContact CD2-CD1 4.39Å; L508-L510 HydrophobicContact CD2-CD2 4.15Å; L508-L510 HydrophobicContact CD2-CG 4.43Å; L508-L510 HydrophobicContact CG-CD1 4.48Å; L508-L510 HydrophobicContact CG-CD2 3.77Å; L508-L510 HydrophobicContact CG-CG 4.02Å; L510-E512 PolarHBondContact O-N 2.83Å; L510-F513 HydrophobicContact CB-CD2 4.02Å; L510-F513 HydrophobicContact CD2-CD2 3.78Å; L510-F513 HydrophobicContact CD2-CE2 3.8Å; L510-F513 HydrophobicContact CG-CD2 4.5Å; L510-F513 PolarHBondContact O-N 3.06Å; L510-A521 WeakPolarHBondContact CB-O 3.42Å; L510-A521 PolarHBondContact N-O 2.91Å; L510-Y523 HydrophobicContact CD1-CD2 3.91Å; L510-Y523 HydrophobicContact CD1-CE2 4.01Å; L510-Y523 HydrophobicContact CG-CD2 4.43Å
511	R	94.4	Very high	89.7	Confident	138 Å²	138	57.5 Å²	57.5	52%	0.521	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-56.9	-32.9	-178.8	-74.2	178.4	-68	178.3	1	113.6	D509 F513 A514 A521	D509-R511 VanDerWaalsContact CG-NE 3.33Å; D509-R511 VanDerWaalsContact OD1-CB 3.25Å; D509-R511 WeakPolarHBondContact OD1-CB 3.45Å; D509-R511 WeakPolarHBondContact OD1-CG 3.39Å; D509-R511 IonicContact OD1-CZ 3.22Å; D509-R511 PolarHBondContact OD1-N 3.49Å; D509-R511 IonicContact OD1-NE 2.97Å; D509-R511 PolarHBondContact OD1-NE 3.46Å; D509-R511 IonicContact OD2-CZ 3.38Å; D509-R511 VanDerWaalsContact OD2-CZ 3.22Å; D509-R511 IonicContact OD2-NE 2.66Å; D509-R511 PolarHBondContact OD2-NE 2.59Å; D509-R511 IonicContact OD2-NH2 3.92Å; D509-R511 PolarHBondContact OD2-NH2 3.18Å; R511-F513 PolarHBondContact O-N 2.98Å; R511-F513 VanDerWaalsContact O-N 3.16Å; R511-A514 WeakPolarHBondContact O-CB 3.39Å; R511-A514 PolarHBondContact O-N 3.34Å; R511-A521 HydrophobicContact CG-CB 3.87Å
512	E	94.4	Very high	89.7	Confident	103 Å²	103	59.4 Å²	59.4	48%	0.481	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-65.6	-13.6	176.6	66.5	164.9	-96.6	0	0	114.6	M439 R443 L510	M439-E512 HydrophobicContact CE-CG 4.01Å; M439-E512 WeakPolarHBondContact CE-OE2 3.49Å; R443-E512 WeakPolarHBondContact CG-OE1 3.37Å; R443-E512 IonicContact CZ-OE1 2.67Å; R443-E512 IonicContact CZ-OE2 2.68Å; R443-E512 IonicContact NE-OE1 3.36Å; R443-E512 IonicContact NH1-OE1 3.79Å; R443-E512 PolarHBondContact NH1-OE1 3.01Å; R443-E512 IonicContact NH1-OE2 3.34Å; R443-E512 PolarHBondContact NH1-OE2 3.3Å; R443-E512 IonicContact NH2-OE2 3.56Å; L510-E512 PolarHBondContact O-N 2.83Å
513	F	95.6	Very high	89.7	Confident	3 Å²	3	57.6 Å²	57.6	1%	0.013	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-103.2	-4.6	180	-53.4	-55.4	0	0	0	113.7	M439 M442 R443 T446 T473 I474 L510 R511	M439-F513 HydrophobicContact CE-CE2 3.58Å; M439-F513 HydrophobicContact CE-CZ 3.86Å; M439-F513 HydrophobicContact SD-CE2 3.81Å; M439-F513 HydrophobicContact SD-CZ 4.23Å; M442-F513 HydrophobicContact CB-CD1 4.3Å; M442-F513 HydrophobicContact CB-CD2 3.99Å; M442-F513 HydrophobicContact CB-CE1 3.73Å; M442-F513 HydrophobicContact CB-CE2 3.37Å; M442-F513 HydrophobicContact CB-CG 4.42Å; M442-F513 HydrophobicContact CB-CZ 3.24Å; M442-F513 HydrophobicContact CE-CB 4.41Å; M442-F513 HydrophobicContact CE-CD2 3.72Å; M442-F513 HydrophobicContact CE-CE2 4.22Å; M442-F513 HydrophobicContact CE-CG 4.04Å; M442-F513 HydrophobicContact CG-CD2 4.42Å; M442-F513 HydrophobicContact CG-CE2 3.95Å; M442-F513 HydrophobicContact CG-CZ 4.29Å; R443-F513 HydrophobicContact CB-CE1 4.39Å; R443-F513 HydrophobicContact CG-CE1 3.77Å; R443-F513 HydrophobicContact CG-CZ 4.08Å; T446-F513 HydrophobicContact CG2-CB 4.08Å; T446-F513 HydrophobicContact CG2-CD1 3.82Å; T446-F513 HydrophobicContact CG2-CG 4.23Å; T446-F513 VanDerWaalsContact OG1-CD1 3.26Å; T446-F513 WeakPolarHBondContact OG1-CD1 3.38Å; T473-F513 WeakPolarHBondContact CA-O 3.43Å; I474-F513 HydrophobicContact CD1-CB 4.24Å; I474-F513 PolarHBondContact N-O 3.2Å; L510-F513 HydrophobicContact CB-CD2 4.02Å; L510-F513 HydrophobicContact CD2-CD2 3.78Å; L510-F513 HydrophobicContact CD2-CE2 3.8Å; L510-F513 HydrophobicContact CG-CD2 4.5Å; L510-F513 PolarHBondContact O-N 3.06Å; R511-F513 PolarHBondContact O-N 2.98Å; R511-F513 VanDerWaalsContact O-N 3.16Å
514	A	94.6	Very high	89.7	Confident	16 Å²	16	59.2 Å²	59.2	13%	0.132	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-74.2	153	-178.1	0	0	0	0	0	111.7	I474 F477 R511 E516	I474-A514 CarbonylContact O-C 3.52Å; I474-A514 WeakPolarHBondContact O-CA 3.35Å; F477-A514 HydrophobicContact CE2-CB 3.86Å; F477-A514 HydrophobicContact CZ-CB 4.42Å; R511-A514 WeakPolarHBondContact O-CB 3.39Å; R511-A514 PolarHBondContact O-N 3.34Å; A514-E516 VanDerWaalsContact C-N 3.29Å; A514-E516 WeakPolarHBondContact CB-O 3.01Å
515	S	88.9	Confident	89.8	Confident	32 Å²	32	57.1 Å²	57.1	22%	0.224	29%	0.294	C	S	.	.	S	Bend	trans	-68.3	-31.8	170	-63.6	0	0	0	0	112.7	T473 I474 Q475	T473-S515 PolarHBondContact OG1-OG 3.5Å; I474-S515 PolarHBondContact O-N 3.08Å; Q475-S515 PolarHBondContact OE1-OG 3.49Å
516	E	77.6	Confident	89.9	Confident	85 Å²	85	55.5 Å²	55.5	40%	0.397	29%	0.286	S	S	.	.	S	Bend	trans	-145	165.5	-172.7	-74	143.1	-132.5	0	0	108.3	Q475 A514 S518	Q475-E516 PolarHBondContact NE2-OE1 3.06Å; A514-E516 VanDerWaalsContact C-N 3.29Å; A514-E516 WeakPolarHBondContact CB-O 3.01Å; E516-S518 VanDerWaalsContact C-N 3.34Å; E516-S518 PolarHBondContact O-N 2.61Å
517	N	65.8	Low	90	Very high	169 Å²	169	48.8 Å²	48.8	90%	0.904	26%	0.257	S	S	*	.			trans	-66.4	84.4	-179.4	-80.8	-20.1	0	0	0	112.8
518	S	70.2	Confident	90.1	Very high	33 Å²	33	43.7 Å²	43.7	23%	0.231	23%	0.23	C	C	.	.			trans	-81.7	126.8	177.1	-175.4	0	0	0	0	112	E516 N520	E516-S518 VanDerWaalsContact C-N 3.34Å; E516-S518 PolarHBondContact O-N 2.61Å; S518-N520 VanDerWaalsContact C-N 3.29Å; S518-N520 PolarHBondContact OG-N 3.46Å
519	T	69.9	Low	90.2	Very high	116 Å²	116	43.6 Å²	43.6	71%	0.712	23%	0.229	S	C	*	.	S	Bend	trans	-72.9	-22.2	169.7	49.8	0	0	0	0	112.8	A521	T519-A521 PolarHBondContact O-N 2.97Å
520	N	77.3	Confident	90.3	Very high	87 Å²	87	41.2 Å²	41.2	47%	0.465	22%	0.217	S	C	.	.	S	Bend	trans	-99.1	55.7	-176.1	-63	-69.1	0	0	0	111.3	F477 S518 L580	F477-N520 WeakPolarHBondContact CB-O 3.32Å; F477-N520 WeakPolarHBondContact CG-O 3.47Å; S518-N520 VanDerWaalsContact C-N 3.29Å; S518-N520 PolarHBondContact OG-N 3.46Å; N520-L580 HydrophobicContact CB-CD1 4.19Å; N520-L580 HydrophobicContact CB-CD2 4.17Å
521	A	88.1	Confident	90.4	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.218	C	C	.	.			trans	-131.8	8.6	-174.9	0	0	0	0	0	114.4	F477 L510 R511 T519	F477-A521 HydrophobicContact CD2-CB 4.07Å; F477-A521 HydrophobicContact CE1-CB 4.27Å; F477-A521 HydrophobicContact CE2-CB 3.79Å; F477-A521 HydrophobicContact CG-CB 4.43Å; F477-A521 HydrophobicContact CZ-CB 3.89Å; L510-A521 WeakPolarHBondContact CB-O 3.42Å; L510-A521 PolarHBondContact N-O 2.91Å; R511-A521 HydrophobicContact CG-CB 3.87Å; T519-A521 PolarHBondContact O-N 2.97Å
522	V	95.6	Very high	90.4	Very high	40 Å²	40	37.9 Å²	37.9	24%	0.242	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	134.5	176.2	-175.6	0	0	0	0	109.6	D507 L508 D509 L580 A581	D507-V522 HydrophobicContact CB-CG1 4.4Å; L508-V522 CarbonylContact O-C 3.6Å; L508-V522 WeakPolarHBondContact O-CA 3.32Å; D509-V522 HydrophobicContact CB-CG2 4.43Å; V522-L580 WeakPolarHBondContact O-CD1 3.36Å; V522-A581 HydrophobicContact CB-CB 4.3Å; V522-A581 HydrophobicContact CG1-CB 4.04Å; V522-A581 WeakPolarHBondContact O-CB 3.26Å; V522-A581 PolarHBondContact O-N 3.28Å
523	Y	97.8	Very high	90.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	150.8	-170.2	-73.9	-92.8	0	0	0	114.6	F477 P478 L481 D507 L508 L510 E579 L580	F477-Y523 WeakPolarHBondContact CB-OH 3.33Å; F477-Y523 AromaticContact CD1-CE2 3.75Å; F477-Y523 HydrophobicContact CD1-CE2 3.75Å; F477-Y523 WeakPolarHBondContact CD1-OH 3.09Å; F477-Y523 HydrophobicContact CE1-CE2 4.31Å; P478-Y523 WeakPolarHBondContact CD-OH 3.33Å; P478-Y523 PolarHBondContact O-OH 3.16Å; L481-Y523 HydrophobicContact CB-CD1 4.03Å; L481-Y523 HydrophobicContact CB-CE1 3.56Å; L481-Y523 HydrophobicContact CD2-CD2 4.25Å; L481-Y523 HydrophobicContact CD2-CE1 4.43Å; L481-Y523 HydrophobicContact CD2-CE2 3.95Å; D507-Y523 PolarHBondContact N-O 3.38Å; D507-Y523 VanDerWaalsContact N-O 3.09Å; L508-Y523 WeakPolarHBondContact CB-O 3.28Å; L508-Y523 PolarHBondContact N-O 3.34Å; L508-Y523 PolarHBondContact O-N 2.75Å; L510-Y523 HydrophobicContact CD1-CD2 3.91Å; L510-Y523 HydrophobicContact CD1-CE2 4.01Å; L510-Y523 HydrophobicContact CG-CD2 4.43Å; Y523-E579 WeakPolarHBondContact CA-O 3.29Å; Y523-E579 VanDerWaalsContact CD1-C 3.5Å; Y523-L580 HydrophobicContact CD1-CB 4.35Å; Y523-L580 HydrophobicContact CE1-CB 4.07Å; Y523-L580 HydrophobicContact CE1-CD1 4.15Å; Y523-L580 HydrophobicContact CE2-CD1 4.25Å
524	N	97.8	Very high	90.1	Very high	33 Å²	33	38.4 Å²	38.4	18%	0.176	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	141.3	172	-67.8	-47	0	0	0	111	K506 D507 Y578 E579	K506-N524 WeakPolarHBondContact CA-OD1 3.41Å; K506-N524 WeakPolarHBondContact CB-OD1 3.47Å; D507-N524 PolarHBondContact N-OD1 3.04Å; N524-Y578 VanDerWaalsContact C-CD1 3.48Å; N524-Y578 CarbonylContact O-C 3.47Å; N524-Y578 VanDerWaalsContact O-CA 3.29Å; N524-Y578 WeakPolarHBondContact O-CA 3.47Å; N524-E579 HydrophobicContact CB-CG 4.48Å; N524-E579 PolarHBondContact N-O 3.44Å; N524-E579 PolarHBondContact O-N 3.17Å
525	L	98.6	Very high	89.5	Confident	3 Å²	3	39.5 Å²	39.5	2%	0.016	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	129.8	177.8	-173.1	81.3	0	0	0	109.9	F503 M505 V528 W552 V568 L576 Y578	F503-L525 HydrophobicContact CD2-CD2 3.88Å; F503-L525 HydrophobicContact CE2-CD2 3.58Å; M505-L525 HydrophobicContact CG-CD2 4.17Å; M505-L525 WeakPolarHBondContact O-CB 3.3Å; M505-L525 PolarHBondContact O-N 3.5Å; L525-V528 HydrophobicContact CD1-CG2 4.13Å; L525-V528 HydrophobicContact CD2-CG2 3.79Å; L525-V528 HydrophobicContact CG-CG2 4.3Å; L525-W552 HydrophobicContact CD2-CH2 3.85Å; L525-W552 HydrophobicContact CD2-CZ2 4.35Å; L525-W552 HydrophobicContact CG-CH2 4.01Å; L525-W552 WeakPolarHBondContact O-CZ2 3.35Å; L525-V568 HydrophobicContact CD2-CG1 4.02Å; L525-L576 HydrophobicContact CD1-CB 4.02Å; L525-L576 HydrophobicContact CD1-CD2 4.47Å; L525-Y578 HydrophobicContact CB-CD1 4.1Å; L525-Y578 HydrophobicContact CB-CE1 3.7Å; L525-Y578 HydrophobicContact CD1-CD1 4.33Å; L525-Y578 HydrophobicContact CD1-CD2 3.98Å; L525-Y578 HydrophobicContact CD1-CE1 3.96Å; L525-Y578 HydrophobicContact CD1-CE2 3.58Å; L525-Y578 HydrophobicContact CD1-CG 4.34Å; L525-Y578 HydrophobicContact CG-CE1 4.45Å
526	Y	98.5	Very high	89.1	Confident	4 Å²	4	45.6 Å²	45.6	2%	0.016	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	-20.5	175.4	75	-85.3	0	0	0	113.9	N270 T271 I480 C544 R545 F577 E579	N270-Y526 HydrophobicContact CB-CD2 4.47Å; T271-Y526 WeakPolarHBondContact CB-OH 3.46Å; T271-Y526 WeakPolarHBondContact CG2-OH 3.18Å; T271-Y526 WeakPolarHBondContact OG1-CE2 3.11Å; T271-Y526 PolarHBondContact OG1-OH 3.49Å; I480-Y526 HydrophobicContact CD1-CE1 3.92Å; I480-Y526 HydrophobicContact CG2-CE1 4.13Å; I480-Y526 VanDerWaalsContact CG2-OH 3.25Å; I480-Y526 WeakPolarHBondContact CG2-OH 3.34Å; Y526-C544 WeakPolarHBondContact O-CA 3.41Å; Y526-R545 WeakPolarHBondContact O-CB 3.47Å; Y526-R545 PolarHBondContact O-N 3.07Å; Y526-F577 HydrophobicContact CD1-CB 4.38Å; Y526-F577 VanDerWaalsContact CD1-O 3.28Å; Y526-F577 WeakPolarHBondContact CD1-O 3.44Å; Y526-F577 HydrophobicContact CE1-CB 3.72Å; Y526-F577 HydrophobicContact CE2-CB 4.2Å; Y526-F577 PolarHBondContact N-O 3.04Å; Y526-F577 VanDerWaalsContact N-O 3.07Å; Y526-E579 HydrophobicContact CD1-CB 3.76Å; Y526-E579 HydrophobicContact CD1-CG 3.89Å; Y526-E579 HydrophobicContact CE1-CB 4.04Å; Y526-E579 HydrophobicContact CG-CG 4.48Å
527	A	98.8	Very high	89.4	Confident	0 Å²	0	43 Å²	43	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	155.4	172.2	0	0	0	0	0	114	C267 Y543 C544 F577	C267-A527 HydrophobicContact CB-CB 3.92Å; A527-Y543 CarbonylContact C-O 3.59Å; A527-Y543 VanDerWaalsContact CA-O 3.26Å; A527-Y543 WeakPolarHBondContact CA-O 3.33Å; A527-C544 HydrophobicContact CB-CB 4.27Å; A527-F577 HydrophobicContact CB-CB 4.01Å; A527-F577 HydrophobicContact CB-CD2 4.32Å; A527-F577 HydrophobicContact CB-CG 4.36Å; A527-F577 PolarHBondContact N-O 3.03Å; A527-F577 PolarHBondContact O-N 2.89Å
528	V	98.9	Very high	90.7	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	123.3	176.4	178.9	0	0	0	0	108.9	F503 L525 N530 A542 Y543 V568 A573 V575 L576	F503-V528 HydrophobicContact CE2-CG2 4.15Å; F503-V528 HydrophobicContact CZ-CG2 4.26Å; L525-V528 HydrophobicContact CD1-CG2 4.13Å; L525-V528 HydrophobicContact CD2-CG2 3.79Å; L525-V528 HydrophobicContact CG-CG2 4.3Å; V528-N530 WeakPolarHBondContact CG1-OD1 2.81Å; V528-A542 CarbonylContact O-C 3.56Å; V528-A542 VanDerWaalsContact O-CA 3.32Å; V528-A542 WeakPolarHBondContact O-CA 3.46Å; V528-Y543 PolarHBondContact N-O 3.02Å; V528-Y543 PolarHBondContact O-N 3.38Å; V528-V568 HydrophobicContact CG2-CG1 4.09Å; V528-A573 HydrophobicContact CG1-CB 3.66Å; V528-V575 WeakPolarHBondContact CA-O 3.48Å; V528-L576 HydrophobicContact CB-CD2 4.48Å; V528-L576 HydrophobicContact CG1-CD2 3.99Å; V528-L576 HydrophobicContact CG2-CD2 3.87Å
529	S	98.8	Very high	92	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	117.7	160.2	-178.4	0	0	0	0	108.3	S263 Y574 V575	S263-S529 WeakPolarHBondContact OG-CB 3.2Å; S263-S529 PolarHBondContact OG-OG 3.06Å; S529-Y574 PolarHBondContact O-N 3.11Å; S529-V575 PolarHBondContact N-O 3.12Å; S529-V575 PolarHBondContact O-N 2.67Å; S529-V575 VanDerWaalsContact O-N 3.1Å
530	N	98.6	Very high	93.4	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.021	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	146.2	174.3	-54.1	-86.7	0	0	0	109.9	V528 Y540 T541 Y543 S570 D572 A573	V528-N530 WeakPolarHBondContact CG1-OD1 2.81Å; N530-Y540 VanDerWaalsContact O-CA 3.26Å; N530-Y540 WeakPolarHBondContact O-CA 3.43Å; N530-Y540 WeakPolarHBondContact O-CD1 3.43Å; N530-T541 PolarHBondContact N-O 3.09Å; N530-T541 PolarHBondContact O-N 2.69Å; N530-Y543 WeakPolarHBondContact ND2-CD2 3.18Å; N530-Y543 VanDerWaalsContact ND2-CE2 3.27Å; N530-Y543 WeakPolarHBondContact ND2-CE2 3.41Å; N530-Y543 VanDerWaalsContact ND2-CG 3.28Å; N530-S570 PolarHBondContact OD1-OG 3.32Å; N530-D572 CarbonylContact C-O 3.55Å; N530-D572 WeakPolarHBondContact CA-O 3.05Å; N530-D572 HydrophobicContact CB-CB 4.36Å; N530-A573 WeakPolarHBondContact OD1-CA 3.41Å; N530-A573 PolarHBondContact OD1-N 2.96Å
531	H	98	Very high	94.4	Very high	7 Å²	7	29.2 Å²	29.2	3%	0.032	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	118.5	172.4	178.4	-110.8	0	0	0	110.7	F488 K496 T534 H539 Y540 D572	F488-H531 AromaticContact CZ-CE1 3.9Å; F488-H531 AromaticContact CZ-ND1 3.57Å; K496-H531 PolarHBondContact NZ-O 3.18Å; H531-T534 PolarHBondContact CE1-O 3.38Å; H531-H539 WeakPolarHBondContact CA-O 3.26Å; H531-H539 PolarHBondContact CD2-O 2.97Å; H531-Y540 HydrophobicContact CB-CD1 3.74Å; H531-Y540 HydrophobicContact CB-CE1 3.54Å; H531-Y540 HydrophobicContact CB-CG 4.48Å; H531-Y540 AromaticContact CD2-CD1 3.93Å; H531-Y540 AromaticContact CD2-CD2 3.66Å; H531-Y540 AromaticContact CD2-CE1 3.7Å; H531-Y540 AromaticContact CD2-CE2 3.42Å; H531-Y540 VanDerWaalsContact CD2-CE2 3.42Å; H531-Y540 WeakPolarHBondContact CD2-CE2 3.36Å; H531-Y540 AromaticContact CD2-CG 3.92Å; H531-Y540 AromaticContact CD2-CZ 3.45Å; H531-Y540 VanDerWaalsContact CD2-CZ 3.45Å; H531-Y540 AromaticContact CG-CE1 3.79Å; H531-Y540 AromaticContact CG-CZ 3.86Å; H531-D572 PolarHBondContact N-O 3.25Å; H531-D572 WeakPolarHBondContact O-CB 3.45Å; H531-D572 VanDerWaalsContact O-CG 3.23Å
532	S	95.8	Very high	94.9	Very high	61 Å²	61	29.2 Å²	29.2	43%	0.427	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	152.9	172	-149.5	0	0	0	0	111.1	G538 H539 D572	S532-G538 CarbonylContact O-C 3.53Å; S532-G538 WeakPolarHBondContact O-CA 3.32Å; S532-H539 PolarHBondContact N-O 2.89Å; S532-H539 PolarHBondContact O-N 2.91Å; S532-D572 VanDerWaalsContact CA-OD2 3.32Å; S532-D572 WeakPolarHBondContact CA-OD2 3.43Å; S532-D572 WeakPolarHBondContact CB-OD2 3.49Å; S532-D572 PolarHBondContact OG-OD2 3.06Å
533	G	92.6	Very high	95.1	Very high	38 Å²	38	29.4 Å²	29.4	39%	0.392	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	95.4	-149.2	-173.9	0	0	0	0	0	114.7	K496	K496-G533 WeakPolarHBondContact CD-O 3.29Å; K496-G533 PolarHBondContact NZ-O 2.91Å
534	T	89.6	Confident	95.1	Very high	79 Å²	79	29.4 Å²	29.4	49%	0.485	18%	0.179	S	C	.	.			trans	-116.9	177.8	-161.3	75	0	0	0	0	113.8	H531 M536 G537	H531-T534 PolarHBondContact CE1-O 3.38Å; T534-M536 PolarHBondContact O-N 2.92Å; T534-M536 PolarHBondContact OG1-N 2.87Å; T534-G537 PolarHBondContact N-O 2.93Å; T534-G537 PolarHBondContact OG1-N 2.94Å; T534-G537 PolarHBondContact OG1-O 3.14Å
535	T	82.2	Confident	95.1	Very high	39 Å²	39	31.9 Å²	31.9	24%	0.239	19%	0.185	C	C	.	.	S	Bend	trans	-64.4	-21.1	172.2	33.9	0	0	0	0	114.8	F488 T494	F488-T535 HydrophobicContact CB-CG2 4.35Å; F488-T535 HydrophobicContact CD1-CG2 3.53Å; F488-T535 HydrophobicContact CE1-CG2 4.22Å; F488-T535 HydrophobicContact CG-CG2 4.27Å; T494-T535 PolarHBondContact O-OG1 3.35Å; T494-T535 PolarHBondContact OG1-OG1 2.98Å
536	M	81.3	Confident	94.8	Very high	159 Å²	159	31.8 Å²	31.8	78%	0.783	19%	0.185	S	C	*	.	S	Bend	trans	-111.9	-6.8	-174.1	-56.1	-78.7	79.2	0	0	113.3	T534	T534-M536 PolarHBondContact O-N 2.92Å; T534-M536 PolarHBondContact OG1-N 2.87Å
537	G	83.3	Confident	94.3	Very high	30 Å²	30	33.6 Å²	33.6	31%	0.309	20%	0.197	S	C	.	.	S	Bend	trans	178.4	133.5	-175.7	0	0	0	0	0	111.3	T534	T534-G537 PolarHBondContact N-O 2.93Å; T534-G537 PolarHBondContact OG1-N 2.94Å; T534-G537 PolarHBondContact OG1-O 3.14Å
538	G	93.1	Very high	93.7	Very high	20 Å²	20	37.7 Å²	37.7	21%	0.206	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.8	-157.5	-175.9	0	0	0	0	0	112.5	Q338 S532	Q338-G538 PolarHBondContact NE2-O 2.98Å; Q338-G538 PolarHBondContact OE1-O 2.96Å; S532-G538 CarbonylContact O-C 3.53Å; S532-G538 WeakPolarHBondContact O-CA 3.32Å
539	H	97.9	Very high	93.2	Very high	64 Å²	64	40.4 Å²	40.4	30%	0.296	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	142.5	179.1	-172.6	58.5	0	0	0	110.9	C259 H531 S532 N556 D557	C259-H539 WeakPolarHBondContact CB-CE1 3.12Å; C259-H539 WeakPolarHBondContact CB-ND1 3.14Å; C259-H539 PolarHBondContact SG-ND1 2.79Å; H531-H539 WeakPolarHBondContact CA-O 3.26Å; H531-H539 PolarHBondContact CD2-O 2.97Å; S532-H539 PolarHBondContact N-O 2.89Å; S532-H539 PolarHBondContact O-N 2.91Å; H539-N556 PolarHBondContact NE2-OD1 3.21Å; H539-D557 IonicContact CE1-OD2 3.23Å; H539-D557 PolarHBondContact CE1-OD2 2.92Å
540	Y	98.6	Very high	92.8	Very high	10 Å²	10	41.1 Å²	41.1	4%	0.039	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	144	178.8	-71.1	-93.5	0	0	0	111.9	C259 F260 Q339 A341 N530 H531 Y574	C259-Y540 WeakPolarHBondContact O-CB 3.26Å; C259-Y540 PolarHBondContact SG-N 3.26Å; F260-Y540 HydrophobicContact CB-CD2 3.56Å; F260-Y540 HydrophobicContact CB-CE2 3.65Å; F260-Y540 HydrophobicContact CB-CG 4.12Å; Q339-Y540 WeakPolarHBondContact O-CE2 3.46Å; Q339-Y540 PolarHBondContact O-OH 2.84Å; A341-Y540 HydrophobicContact CB-CD1 3.76Å; A341-Y540 HydrophobicContact CB-CE1 3.3Å; A341-Y540 PolarHBondContact N-OH 3.3Å; N530-Y540 VanDerWaalsContact O-CA 3.26Å; N530-Y540 WeakPolarHBondContact O-CA 3.43Å; N530-Y540 WeakPolarHBondContact O-CD1 3.43Å; H531-Y540 HydrophobicContact CB-CD1 3.74Å; H531-Y540 HydrophobicContact CB-CE1 3.54Å; H531-Y540 HydrophobicContact CB-CG 4.48Å; H531-Y540 AromaticContact CD2-CD1 3.93Å; H531-Y540 AromaticContact CD2-CD2 3.66Å; H531-Y540 AromaticContact CD2-CE1 3.7Å; H531-Y540 AromaticContact CD2-CE2 3.42Å; H531-Y540 VanDerWaalsContact CD2-CE2 3.42Å; H531-Y540 WeakPolarHBondContact CD2-CE2 3.36Å; H531-Y540 AromaticContact CD2-CG 3.92Å; H531-Y540 AromaticContact CD2-CZ 3.45Å; H531-Y540 VanDerWaalsContact CD2-CZ 3.45Å; H531-Y540 AromaticContact CG-CE1 3.79Å; H531-Y540 AromaticContact CG-CZ 3.86Å; Y540-Y574 AromaticContact CE1-CD1 3.95Å; Y540-Y574 HydrophobicContact CE1-CD1 3.95Å; Y540-Y574 HydrophobicContact CE1-CE1 4.35Å
541	T	98.8	Very high	92.7	Very high	22 Å²	22	46.2 Å²	46.2	14%	0.135	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	157	170.6	60.5	0	0	0	0	109.6	S263 N530 N556	S263-T541 PolarHBondContact OG-O 3.46Å; S263-T541 VanDerWaalsContact OG-O 3.05Å; N530-T541 PolarHBondContact N-O 3.09Å; N530-T541 PolarHBondContact O-N 2.69Å; T541-N556 HydrophobicContact CG2-CB 3.91Å
542	A	98.8	Very high	92.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	136.5	171.4	0	0	0	0	0	110.9	S263 Q266 V528 F555	S263-A542 WeakPolarHBondContact O-CB 3.41Å; Q266-A542 HydrophobicContact CB-CB 3.78Å; V528-A542 CarbonylContact O-C 3.56Å; V528-A542 VanDerWaalsContact O-CA 3.32Å; V528-A542 WeakPolarHBondContact O-CA 3.46Å; A542-F555 HydrophobicContact CB-CB 4.35Å; A542-F555 PolarHBondContact N-O 2.78Å; A542-F555 PolarHBondContact O-N 3.3Å
543	Y	98.7	Very high	92.8	Very high	45 Å²	45	45.2 Å²	45.2	18%	0.176	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	121.3	160.9	-56.9	-24.6	0	0	0	106.9	A527 V528 N530 Y553 T554 M563 V568	A527-Y543 CarbonylContact C-O 3.59Å; A527-Y543 VanDerWaalsContact CA-O 3.26Å; A527-Y543 WeakPolarHBondContact CA-O 3.33Å; V528-Y543 PolarHBondContact N-O 3.02Å; V528-Y543 PolarHBondContact O-N 3.38Å; N530-Y543 WeakPolarHBondContact ND2-CD2 3.18Å; N530-Y543 VanDerWaalsContact ND2-CE2 3.27Å; N530-Y543 WeakPolarHBondContact ND2-CE2 3.41Å; N530-Y543 VanDerWaalsContact ND2-CG 3.28Å; Y543-Y553 WeakPolarHBondContact CA-O 3.32Å; Y543-T554 HydrophobicContact CD1-CG2 4.17Å; Y543-T554 WeakPolarHBondContact CD1-OG1 3.27Å; Y543-T554 HydrophobicContact CE1-CG2 3.92Å; Y543-T554 VanDerWaalsContact CE1-OG1 3.28Å; Y543-T554 WeakPolarHBondContact CE1-OG1 3.32Å; Y543-M563 HydrophobicContact CD1-CE 3.86Å; Y543-M563 HydrophobicContact CD1-SD 3.54Å; Y543-M563 VanDerWaalsContact CD1-SD 3.54Å; Y543-M563 HydrophobicContact CD2-CE 3.73Å; Y543-M563 HydrophobicContact CD2-SD 4.25Å; Y543-M563 HydrophobicContact CE1-CE 4.02Å; Y543-M563 HydrophobicContact CE1-SD 4.15Å; Y543-M563 HydrophobicContact CE2-CE 3.87Å; Y543-M563 HydrophobicContact CG-CE 3.72Å; Y543-M563 HydrophobicContact CG-SD 3.61Å; Y543-V568 HydrophobicContact CD2-CG1 4.37Å
544	C	98.4	Very high	93.1	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	140.5	177.4	-53.6	0	0	0	0	110.8	N270 Y526 A527 W552 Y553 F555	N270-C544 HydrophobicContact CB-CB 4Å; N270-C544 WeakPolarHBondContact ND2-CB 3.2Å; Y526-C544 WeakPolarHBondContact O-CA 3.41Å; A527-C544 HydrophobicContact CB-CB 4.27Å; C544-W552 VanDerWaalsContact C-CE3 3.5Å; C544-Y553 PolarHBondContact N-O 2.64Å; C544-Y553 PolarHBondContact O-N 3.46Å; C544-F555 HydrophobicContact CB-CD2 4.24Å; C544-F555 HydrophobicContact CB-CE2 3.79Å
545	R	97.1	Very high	93.5	Very high	85 Å²	85	41 Å²	41	32%	0.321	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	117.6	168.8	-167.6	179.5	176.4	-124.8	-8.9	108.3	Y526 P547 G550 E551 W552	Y526-R545 WeakPolarHBondContact O-CB 3.47Å; Y526-R545 PolarHBondContact O-N 3.07Å; R545-P547 VanDerWaalsContact O-CD 3.31Å; R545-P547 WeakPolarHBondContact O-CD 3.12Å; R545-G550 VanDerWaalsContact CG-O 3.3Å; R545-G550 WeakPolarHBondContact CG-O 3.48Å; R545-G550 PolarHBondContact NE-O 2.89Å; R545-E551 CarbonylContact C-O 3.54Å; R545-E551 WeakPolarHBondContact CA-O 3.43Å; R545-W552 HydrophobicContact CB-CD2 3.91Å; R545-W552 HydrophobicContact CB-CE3 4.17Å; R545-W552 HydrophobicContact CB-CH2 4.03Å; R545-W552 HydrophobicContact CB-CZ2 3.78Å; R545-W552 HydrophobicContact CB-CZ3 4.23Å; R545-W552 HydrophobicContact CG-CD2 4.41Å; R545-W552 HydrophobicContact CG-CZ2 4.34Å
546	N	93.5	Very high	94.2	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	23%	0.233	C	C	.	.			trans	-67.8	121.9	176.3	-175	-76.7	0	0	0	109.1	Q247 L249 S548 S549 G550 E551 Y553	Q247-N546 PolarHBondContact O-ND2 2.97Å; L249-N546 HydrophobicContact CD2-CB 4.49Å; N546-S548 PolarHBondContact O-N 3.24Å; N546-S548 WeakPolarHBondContact OD1-CA 3.42Å; N546-S548 WeakPolarHBondContact OD1-CB 3.29Å; N546-S548 PolarHBondContact OD1-N 2.99Å; N546-S549 PolarHBondContact OD1-N 2.93Å; N546-G550 VanDerWaalsContact O-CA 3.28Å; N546-G550 WeakPolarHBondContact O-CA 3.48Å; N546-G550 PolarHBondContact O-N 2.97Å; N546-E551 PolarHBondContact N-O 2.96Å; N546-Y553 HydrophobicContact CB-CD2 3.95Å; N546-Y553 HydrophobicContact CB-CE2 3.76Å
547	P	87.1	Confident	95.1	Very high	41 Å²	41	35.6 Å²	35.6	27%	0.266	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-20.3	-176.6	-25.2	36.8	0	0	0	114.7	Q272 R545	Q272-P547 HydrophobicContact CG-CB 3.94Å; Q272-P547 HydrophobicContact CG-CG 3.78Å; R545-P547 VanDerWaalsContact O-CD 3.31Å; R545-P547 WeakPolarHBondContact O-CD 3.12Å
548	S	86.1	Confident	95.7	Very high	86 Å²	86	37.1 Å²	37.1	60%	0.601	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-33.4	-175.3	-55.5	0	0	0	0	113.6	N546	N546-S548 PolarHBondContact O-N 3.24Å; N546-S548 WeakPolarHBondContact OD1-CA 3.42Å; N546-S548 WeakPolarHBondContact OD1-CB 3.29Å; N546-S548 PolarHBondContact OD1-N 2.99Å
549	S	89.4	Confident	95.9	Very high	57 Å²	57	44.6 Å²	44.6	40%	0.399	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101	-23.1	173.8	61.5	0	0	0	0	113.5	N546 E551	N546-S549 PolarHBondContact OD1-N 2.93Å; S549-E551 PolarHBondContact O-N 3.3Å; S549-E551 PolarHBondContact OG-N 2.99Å
550	G	91	Very high	95.9	Very high	15 Å²	15	43.3 Å²	43.3	16%	0.155	23%	0.226	C	C	.	.			trans	79.2	-2.5	-172	0	0	0	0	0	114.6	R545 N546	R545-G550 VanDerWaalsContact CG-O 3.3Å; R545-G550 WeakPolarHBondContact CG-O 3.48Å; R545-G550 PolarHBondContact NE-O 2.89Å; N546-G550 VanDerWaalsContact O-CA 3.28Å; N546-G550 WeakPolarHBondContact O-CA 3.48Å; N546-G550 PolarHBondContact O-N 2.97Å
551	E	95.1	Very high	95.8	Very high	111 Å²	111	45.6 Å²	45.6	52%	0.519	24%	0.241	S	C	.	.			trans	-86	158.6	-177.5	-68.7	-54.2	137.8	0	0	113.4	R545 N546 S549 Y553	R545-E551 CarbonylContact C-O 3.54Å; R545-E551 WeakPolarHBondContact CA-O 3.43Å; N546-E551 PolarHBondContact N-O 2.96Å; S549-E551 PolarHBondContact O-N 3.3Å; S549-E551 PolarHBondContact OG-N 2.99Å; E551-Y553 HydrophobicContact CB-CE2 3.87Å
552	W	97.9	Very high	95.7	Very high	13 Å²	13	49.2 Å²	49.2	5%	0.049	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	140.3	-179.2	-73.2	85	0	0	0	112.7	M505 L525 C544 R545 M563 V568	M505-W552 HydrophobicContact CE-CD2 4.29Å; M505-W552 VanDerWaalsContact CE-CE2 3.47Å; M505-W552 HydrophobicContact CE-CH2 4.43Å; M505-W552 HydrophobicContact CE-CZ2 3.56Å; L525-W552 HydrophobicContact CD2-CH2 3.85Å; L525-W552 HydrophobicContact CD2-CZ2 4.35Å; L525-W552 HydrophobicContact CG-CH2 4.01Å; L525-W552 WeakPolarHBondContact O-CZ2 3.35Å; C544-W552 VanDerWaalsContact C-CE3 3.5Å; R545-W552 HydrophobicContact CB-CD2 3.91Å; R545-W552 HydrophobicContact CB-CE3 4.17Å; R545-W552 HydrophobicContact CB-CH2 4.03Å; R545-W552 HydrophobicContact CB-CZ2 3.78Å; R545-W552 HydrophobicContact CB-CZ3 4.23Å; R545-W552 HydrophobicContact CG-CD2 4.41Å; R545-W552 HydrophobicContact CG-CZ2 4.34Å; W552-M563 HydrophobicContact CB-CG 3.68Å; W552-M563 HydrophobicContact CB-SD 4.34Å; W552-M563 WeakPolarHBondContact O-CG 3.46Å; W552-M563 PolarHBondContact O-N 2.88Å; W552-V568 HydrophobicContact CB-CG2 4.19Å; W552-V568 HydrophobicContact CD2-CG1 4.42Å; W552-V568 HydrophobicContact CD2-CG2 3.53Å; W552-V568 HydrophobicContact CE3-CB 4.48Å; W552-V568 HydrophobicContact CE3-CG1 3.97Å; W552-V568 HydrophobicContact CE3-CG2 3.6Å; W552-V568 HydrophobicContact CG-CG2 3.79Å; W552-V568 HydrophobicContact CH2-CG1 3.93Å; W552-V568 HydrophobicContact CZ2-CG1 4.36Å; W552-V568 HydrophobicContact CZ3-CG1 3.7Å; W552-V568 HydrophobicContact CZ3-CG2 4.22Å
553	Y	98	Very high	95.6	Very high	34 Å²	34	50.1 Å²	50.1	13%	0.133	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	138.7	177.8	-62.7	-96.3	0	0	0	110.8	L249 Y543 C544 N546 E551 F555 V560 T561 P562	L249-Y553 HydrophobicContact CD1-CD1 3.98Å; L249-Y553 HydrophobicContact CD1-CE1 3.42Å; L249-Y553 VanDerWaalsContact CD1-CE1 3.42Å; L249-Y553 HydrophobicContact CD1-CE2 4.23Å; L249-Y553 HydrophobicContact CD2-CD1 3.72Å; L249-Y553 HydrophobicContact CD2-CD2 3.58Å; L249-Y553 HydrophobicContact CD2-CE1 3.92Å; L249-Y553 HydrophobicContact CD2-CE2 3.77Å; L249-Y553 HydrophobicContact CD2-CG 3.56Å; L249-Y553 HydrophobicContact CG-CD1 4.48Å; L249-Y553 HydrophobicContact CG-CE1 4.33Å; Y543-Y553 WeakPolarHBondContact CA-O 3.32Å; C544-Y553 PolarHBondContact N-O 2.64Å; C544-Y553 PolarHBondContact O-N 3.46Å; N546-Y553 HydrophobicContact CB-CD2 3.95Å; N546-Y553 HydrophobicContact CB-CE2 3.76Å; E551-Y553 HydrophobicContact CB-CE2 3.87Å; Y553-F555 WeakPolarHBondContact O-CD2 3.43Å; Y553-V560 HydrophobicContact CD1-CG1 4.34Å; Y553-T561 CarbonylContact C-O 3.55Å; Y553-T561 WeakPolarHBondContact CA-O 3.38Å; Y553-P562 HydrophobicContact CD1-CB 4.08Å; Y553-P562 HydrophobicContact CE1-CB 3.9Å
554	T	98.3	Very high	95.4	Very high	24 Å²	24	50.6 Å²	50.6	15%	0.147	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	127.2	166	-67.4	0	0	0	0	109.4	Y543 N556 V560 T561 M563	Y543-T554 HydrophobicContact CD1-CG2 4.17Å; Y543-T554 WeakPolarHBondContact CD1-OG1 3.27Å; Y543-T554 HydrophobicContact CE1-CG2 3.92Å; Y543-T554 VanDerWaalsContact CE1-OG1 3.28Å; Y543-T554 WeakPolarHBondContact CE1-OG1 3.32Å; T554-N556 HydrophobicContact CG2-CB 4.29Å; T554-V560 WeakPolarHBondContact O-CA 3.4Å; T554-T561 PolarHBondContact N-O 2.93Å; T554-T561 PolarHBondContact O-N 3.03Å; T554-M563 PolarHBondContact OG1-SD 3.2Å
555	F	98.4	Very high	95.2	Very high	5 Å²	5	53.6 Å²	53.6	2%	0.022	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	107.4	170.7	-60.2	-101.1	0	0	0	108.1	G248 L249 Q266 A542 C544 Y553 V560	G248-F555 WeakPolarHBondContact O-CE1 3.37Å; L249-F555 HydrophobicContact CD2-CZ 4.1Å; Q266-F555 HydrophobicContact CB-CB 4.25Å; Q266-F555 HydrophobicContact CB-CG 4.27Å; Q266-F555 HydrophobicContact CG-CB 3.78Å; Q266-F555 HydrophobicContact CG-CD1 4.03Å; Q266-F555 HydrophobicContact CG-CG 3.98Å; Q266-F555 VanDerWaalsContact NE2-CD1 3.33Å; Q266-F555 VanDerWaalsContact OE1-CD1 3.31Å; A542-F555 HydrophobicContact CB-CB 4.35Å; A542-F555 PolarHBondContact N-O 2.78Å; A542-F555 PolarHBondContact O-N 3.3Å; C544-F555 HydrophobicContact CB-CD2 4.24Å; C544-F555 HydrophobicContact CB-CE2 3.79Å; Y553-F555 WeakPolarHBondContact O-CD2 3.43Å; F555-V560 HydrophobicContact CD1-CB 4.29Å; F555-V560 HydrophobicContact CD1-CG1 3.85Å; F555-V560 HydrophobicContact CD1-CG2 3.5Å; F555-V560 VanDerWaalsContact CD1-CG2 3.5Å; F555-V560 HydrophobicContact CE1-CB 4.42Å; F555-V560 HydrophobicContact CE1-CG1 3.66Å; F555-V560 HydrophobicContact CE1-CG2 3.81Å; F555-V560 HydrophobicContact CG-CG1 4.4Å; F555-V560 HydrophobicContact CG-CG2 4.4Å; F555-V560 HydrophobicContact CZ-CG1 4.02Å
556	N	98.4	Very high	95.1	Very high	63 Å²	63	53.5 Å²	53.5	34%	0.337	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	87.5	-179.9	-176.2	3.2	0	0	0	108.5	H539 T541 T554 S558 R559	H539-N556 PolarHBondContact NE2-OD1 3.21Å; T541-N556 HydrophobicContact CG2-CB 3.91Å; T554-N556 HydrophobicContact CG2-CB 4.29Å; N556-S558 PolarHBondContact O-N 2.73Å; N556-S558 VanDerWaalsContact O-N 3.09Å; N556-R559 PolarHBondContact N-O 3.01Å; N556-R559 PolarHBondContact O-N 2.79Å
557	D	98.3	Very high	95.1	Very high	22 Å²	22	59 Å²	59	12%	0.118	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	44.8	-112.8	-166.2	-68.4	-40	0	0	0	111.5	G251 L252 N254 C259 N262 H539 R559	G251-D557 CarbonylContact C-O 3.56Å; G251-D557 WeakPolarHBondContact CA-O 3.4Å; L252-D557 PolarHBondContact N-O 2.87Å; L252-D557 CarbonylContact O-C 3.57Å; L252-D557 VanDerWaalsContact O-CA 3.24Å; L252-D557 WeakPolarHBondContact O-CA 3.47Å; L252-D557 WeakPolarHBondContact O-CB 3.4Å; N254-D557 HydrophobicContact CB-CB 4.18Å; N254-D557 WeakPolarHBondContact CB-OD2 3.42Å; N254-D557 PolarHBondContact ND2-OD2 3.42Å; C259-D557 WeakPolarHBondContact CA-OD1 3.31Å; N262-D557 PolarHBondContact ND2-OD1 2.86Å; H539-D557 IonicContact CE1-OD2 3.23Å; H539-D557 PolarHBondContact CE1-OD2 2.92Å; D557-R559 VanDerWaalsContact C-N 3.25Å; D557-R559 PolarHBondContact O-N 2.91Å
558	S	97.8	Very high	95.5	Very high	61 Å²	61	57 Å²	57	43%	0.427	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-10.5	-175.4	-57.2	0	0	0	0	114	L252 K253 A316 N556	L252-S558 PolarHBondContact O-N 2.68Å; L252-S558 PolarHBondContact O-OG 2.86Å; K253-S558 WeakPolarHBondContact CA-OG 3.39Å; A316-S558 VanDerWaalsContact CB-CB 3.45Å; N556-S558 PolarHBondContact O-N 2.73Å; N556-S558 VanDerWaalsContact O-N 3.09Å
559	R	97.3	Very high	96	Very high	177 Å²	177	57.9 Å²	57.9	67%	0.668	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.7	121.3	-175.8	-171.9	-175.5	-60.8	-105.5	0.2	110.2	N556 D557 T561	N556-R559 PolarHBondContact N-O 3.01Å; N556-R559 PolarHBondContact O-N 2.79Å; D557-R559 VanDerWaalsContact C-N 3.25Å; D557-R559 PolarHBondContact O-N 2.91Å; R559-T561 HydrophobicContact CG-CG2 4.13Å
560	V	97.1	Very high	96.3	Very high	37 Å²	37	56.2 Å²	56.2	22%	0.224	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	131.2	168.9	-171	0	0	0	0	108.6	L249 Y553 T554 F555	L249-V560 HydrophobicContact CB-CG1 4.3Å; L249-V560 HydrophobicContact CD2-CG1 4.42Å; Y553-V560 HydrophobicContact CD1-CG1 4.34Å; T554-V560 WeakPolarHBondContact O-CA 3.4Å; F555-V560 HydrophobicContact CD1-CB 4.29Å; F555-V560 HydrophobicContact CD1-CG1 3.85Å; F555-V560 HydrophobicContact CD1-CG2 3.5Å; F555-V560 VanDerWaalsContact CD1-CG2 3.5Å; F555-V560 HydrophobicContact CE1-CB 4.42Å; F555-V560 HydrophobicContact CE1-CG1 3.66Å; F555-V560 HydrophobicContact CE1-CG2 3.81Å; F555-V560 HydrophobicContact CG-CG1 4.4Å; F555-V560 HydrophobicContact CG-CG2 4.4Å; F555-V560 HydrophobicContact CZ-CG1 4.02Å
561	T	96.3	Very high	96.4	Very high	58 Å²	58	57.7 Å²	57.7	36%	0.356	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	140.8	176.8	50.7	0	0	0	0	110.7	Y553 T554 R559	Y553-T561 CarbonylContact C-O 3.55Å; Y553-T561 WeakPolarHBondContact CA-O 3.38Å; T554-T561 PolarHBondContact N-O 2.93Å; T554-T561 PolarHBondContact O-N 3.03Å; R559-T561 HydrophobicContact CG-CG2 4.13Å
562	P	96.3	Very high	96.5	Very high	99 Å²	99	54.2 Å²	54.2	64%	0.643	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.6	151	168.6	28.9	-35	0	0	0	110.3	Y553	Y553-P562 HydrophobicContact CD1-CB 4.08Å; Y553-P562 HydrophobicContact CE1-CB 3.9Å
563	M	96.4	Very high	96.5	Very high	19 Å²	19	53.6 Å²	53.6	9%	0.094	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	153.5	177.8	65.5	-179.8	-62	0	0	111	Y543 W552 T554 Q567 V568	Y543-M563 HydrophobicContact CD1-CE 3.86Å; Y543-M563 HydrophobicContact CD1-SD 3.54Å; Y543-M563 VanDerWaalsContact CD1-SD 3.54Å; Y543-M563 HydrophobicContact CD2-CE 3.73Å; Y543-M563 HydrophobicContact CD2-SD 4.25Å; Y543-M563 HydrophobicContact CE1-CE 4.02Å; Y543-M563 HydrophobicContact CE1-SD 4.15Å; Y543-M563 HydrophobicContact CE2-CE 3.87Å; Y543-M563 HydrophobicContact CG-CE 3.72Å; Y543-M563 HydrophobicContact CG-SD 3.61Å; W552-M563 HydrophobicContact CB-CG 3.68Å; W552-M563 HydrophobicContact CB-SD 4.34Å; W552-M563 WeakPolarHBondContact O-CG 3.46Å; W552-M563 PolarHBondContact O-N 2.88Å; T554-M563 PolarHBondContact OG1-SD 3.2Å; M563-Q567 HydrophobicContact CE-CB 3.8Å; M563-V568 HydrophobicContact CE-CB 4.45Å; M563-V568 HydrophobicContact CE-CG2 3.73Å; M563-V568 HydrophobicContact SD-CG2 4.27Å
564	S	96.1	Very high	96.6	Very high	54 Å²	54	52.2 Å²	52.2	38%	0.378	29%	0.289	S	S	.	.			trans	-70	141.3	172.7	-178.5	0	0	0	0	110.5	S566 Q567	S564-S566 WeakPolarHBondContact CB-OG 3.2Å; S564-S566 PolarHBondContact O-N 3.05Å; S564-S566 VanDerWaalsContact O-N 3.15Å; S564-S566 PolarHBondContact OG-N 3.48Å; S564-S566 PolarHBondContact OG-OG 3.16Å; S564-Q567 WeakPolarHBondContact O-CB 3.48Å; S564-Q567 PolarHBondContact O-N 2.93Å
565	S	94.1	Very high	96.6	Very high	64 Å²	64	51 Å²	51	45%	0.448	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-53.8	-30.9	169.4	56.2	0	0	0	0	112.6	M505 Q567 V568	M505-S565 VanDerWaalsContact SD-O 3.34Å; S565-Q567 PolarHBondContact O-N 3.34Å; S565-V568 WeakPolarHBondContact O-CG2 3.38Å; S565-V568 PolarHBondContact O-N 3.07Å
566	S	93.7	Very high	96.6	Very high	83 Å²	83	50.8 Å²	50.8	58%	0.58	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-60.4	-27.4	174.9	64.6	0	0	0	0	113.9	S564	S564-S566 WeakPolarHBondContact CB-OG 3.2Å; S564-S566 PolarHBondContact O-N 3.05Å; S564-S566 VanDerWaalsContact O-N 3.15Å; S564-S566 PolarHBondContact OG-N 3.48Å; S564-S566 PolarHBondContact OG-OG 3.16Å
567	Q	93.8	Very high	96.6	Very high	115 Å²	115	47.8 Å²	47.8	54%	0.537	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-87.7	-8.3	-177.1	-61.8	170.8	-65.4	0	0	113.4	M563 S564 S565 R569	M563-Q567 HydrophobicContact CE-CB 3.8Å; S564-Q567 WeakPolarHBondContact O-CB 3.48Å; S564-Q567 PolarHBondContact O-N 2.93Å; S565-Q567 PolarHBondContact O-N 3.34Å; Q567-R569 VanDerWaalsContact C-N 3.32Å; Q567-R569 PolarHBondContact O-N 3.45Å
568	V	96.3	Very high	96.6	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.259	C	S	.	.	S	Bend	trans	-70	-30.1	-175.4	178.4	0	0	0	0	112.1	M505 L525 V528 Y543 W552 M563 S565 S570	M505-V568 HydrophobicContact CE-CB 3.7Å; M505-V568 HydrophobicContact CE-CG1 3.94Å; M505-V568 HydrophobicContact CE-CG2 3.77Å; M505-V568 HydrophobicContact SD-CB 4.19Å; L525-V568 HydrophobicContact CD2-CG1 4.02Å; V528-V568 HydrophobicContact CG2-CG1 4.09Å; Y543-V568 HydrophobicContact CD2-CG1 4.37Å; W552-V568 HydrophobicContact CB-CG2 4.19Å; W552-V568 HydrophobicContact CD2-CG1 4.42Å; W552-V568 HydrophobicContact CD2-CG2 3.53Å; W552-V568 HydrophobicContact CE3-CB 4.48Å; W552-V568 HydrophobicContact CE3-CG1 3.97Å; W552-V568 HydrophobicContact CE3-CG2 3.6Å; W552-V568 HydrophobicContact CG-CG2 3.79Å; W552-V568 HydrophobicContact CH2-CG1 3.93Å; W552-V568 HydrophobicContact CZ2-CG1 4.36Å; W552-V568 HydrophobicContact CZ3-CG1 3.7Å; W552-V568 HydrophobicContact CZ3-CG2 4.22Å; M563-V568 HydrophobicContact CE-CB 4.45Å; M563-V568 HydrophobicContact CE-CG2 3.73Å; M563-V568 HydrophobicContact SD-CG2 4.27Å; S565-V568 WeakPolarHBondContact O-CG2 3.38Å; S565-V568 PolarHBondContact O-N 3.07Å; V568-S570 PolarHBondContact O-N 2.91Å
569	R	96.8	Very high	96.6	Very high	104 Å²	104	45.5 Å²	45.5	39%	0.392	25%	0.247	S	C	.	.			trans	-84.5	109.5	176.4	-68	-178.8	-65.8	158	-1.5	109.9	F500 N502 F503 M505 Q567	F500-R569 HydrophobicContact CZ-CB 4.1Å; N502-R569 PolarHBondContact OD1-NH1 3.4Å; F503-R569 HydrophobicContact CD2-CG 4.13Å; F503-R569 HydrophobicContact CE2-CG 3.79Å; F503-R569 HydrophobicContact CZ-CB 4.3Å; F503-R569 HydrophobicContact CZ-CG 4.01Å; F503-R569 WeakPolarHBondContact O-CD 3.35Å; M505-R569 HydrophobicContact CG-CG 4.43Å; Q567-R569 VanDerWaalsContact C-N 3.32Å; Q567-R569 PolarHBondContact O-N 3.45Å
570	S	94.9	Very high	96.6	Very high	22 Å²	22	39.5 Å²	39.5	15%	0.154	23%	0.228	C	C	.	.			trans	-134.2	161.9	-178.2	82.4	0	0	0	0	112	N530 V568 D572 A573	N530-S570 PolarHBondContact OD1-OG 3.32Å; V568-S570 PolarHBondContact O-N 2.91Å; S570-D572 PolarHBondContact O-N 2.75Å; S570-D572 PolarHBondContact OG-N 3.03Å; S570-A573 PolarHBondContact OG-N 3Å; S570-A573 VanDerWaalsContact OG-N 3.08Å
571	S	94.5	Very high	96.3	Very high	47 Å²	47	38.6 Å²	38.6	33%	0.329	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-15.9	169.4	48.5	0	0	0	0	113.7	R487 S498	R487-S571 PolarHBondContact NH1-O 3.48Å; R487-S571 PolarHBondContact NH2-O 3.12Å; R487-S571 VanDerWaalsContact NH2-O 3.16Å; S498-S571 WeakPolarHBondContact O-CB 3.44Å
572	D	96.7	Very high	95.5	Very high	38 Å²	38	42 Å²	42	20%	0.203	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-12	179.9	-81.2	-13	0	0	0	113	K496 N530 H531 S532 S570 Y574	K496-D572 IonicContact NZ-OD1 2.67Å; K496-D572 PolarHBondContact NZ-OD1 3.46Å; N530-D572 CarbonylContact C-O 3.55Å; N530-D572 WeakPolarHBondContact CA-O 3.05Å; N530-D572 HydrophobicContact CB-CB 4.36Å; H531-D572 PolarHBondContact N-O 3.25Å; H531-D572 WeakPolarHBondContact O-CB 3.45Å; H531-D572 VanDerWaalsContact O-CG 3.23Å; S532-D572 VanDerWaalsContact CA-OD2 3.32Å; S532-D572 WeakPolarHBondContact CA-OD2 3.43Å; S532-D572 WeakPolarHBondContact CB-OD2 3.49Å; S532-D572 PolarHBondContact OG-OD2 3.06Å; S570-D572 PolarHBondContact O-N 2.75Å; S570-D572 PolarHBondContact OG-N 3.03Å; D572-Y574 PolarHBondContact O-N 3.04Å
573	A	98.2	Very high	93.6	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.3	123.4	172.8	0	0	0	0	0	111.1	R487 F503 V528 N530 S570 L576	R487-A573 VanDerWaalsContact CZ-O 3.27Å; R487-A573 PolarHBondContact NE-O 3.16Å; R487-A573 PolarHBondContact NH2-O 2.86Å; F503-A573 HydrophobicContact CE1-CB 3.53Å; F503-A573 HydrophobicContact CZ-CB 3.82Å; V528-A573 HydrophobicContact CG1-CB 3.66Å; N530-A573 WeakPolarHBondContact OD1-CA 3.41Å; N530-A573 PolarHBondContact OD1-N 2.96Å; S570-A573 PolarHBondContact OG-N 3Å; S570-A573 VanDerWaalsContact OG-N 3.08Å; A573-L576 HydrophobicContact CB-CD2 4.2Å
574	Y	98.4	Very high	90.9	Very high	4 Å²	4	46.7 Å²	46.7	2%	0.016	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	-46.3	-168.6	179	-128.7	0	0	0	113.2	D340 Q342 H484 L485 R487 F488 S529 Y540 D572	D340-Y574 PolarHBondContact OD1-OH 2.88Å; D340-Y574 PolarHBondContact OD2-OH 3.47Å; Q342-Y574 HydrophobicContact CB-CE1 4.37Å; H484-Y574 AromaticContact CD2-CE2 3.39Å; H484-Y574 WeakPolarHBondContact CD2-CE2 3.37Å; H484-Y574 AromaticContact CD2-CZ 3.66Å; H484-Y574 AromaticContact NE2-CE2 3.31Å; H484-Y574 VanDerWaalsContact NE2-CE2 3.31Å; H484-Y574 WeakPolarHBondContact NE2-CE2 3.49Å; H484-Y574 AromaticContact NE2-CZ 3.48Å; H484-Y574 PolarHBondContact NE2-OH 2.83Å; L485-Y574 PolarHBondContact N-O 2.93Å; L485-Y574 WeakPolarHBondContact O-CD2 3.29Å; L485-Y574 VanDerWaalsContact O-CE2 3.27Å; L485-Y574 WeakPolarHBondContact O-CE2 3.47Å; R487-Y574 HydrophobicContact CB-CD2 4.22Å; R487-Y574 HydrophobicContact CB-CE2 4.29Å; R487-Y574 HydrophobicContact CG-CD2 4.21Å; F488-Y574 HydrophobicContact CD2-CE2 4.1Å; F488-Y574 AromaticContact CD2-CZ 3.87Å; F488-Y574 WeakPolarHBondContact CD2-OH 3.42Å; F488-Y574 HydrophobicContact CE2-CE1 4.05Å; F488-Y574 AromaticContact CE2-CE2 3.87Å; F488-Y574 HydrophobicContact CE2-CE2 3.87Å; F488-Y574 AromaticContact CE2-CZ 3.53Å; F488-Y574 WeakPolarHBondContact CE2-OH 3.41Å; S529-Y574 PolarHBondContact O-N 3.11Å; Y540-Y574 AromaticContact CE1-CD1 3.95Å; Y540-Y574 HydrophobicContact CE1-CD1 3.95Å; Y540-Y574 HydrophobicContact CE1-CE1 4.35Å; D572-Y574 PolarHBondContact O-N 3.04Å
575	V	98.8	Very high	87.8	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	121.3	172.2	-172	0	0	0	0	109	Q342 L345 V482 H484 V528 S529 F577	Q342-V575 HydrophobicContact CB-CG2 4.06Å; L345-V575 HydrophobicContact CD2-CG1 4.31Å; V482-V575 HydrophobicContact CG1-CG1 3.45Å; V482-V575 VanDerWaalsContact CG1-CG1 3.45Å; H484-V575 HydrophobicContact CB-CG2 4.43Å; V528-V575 WeakPolarHBondContact CA-O 3.48Å; S529-V575 PolarHBondContact N-O 3.12Å; S529-V575 PolarHBondContact O-N 2.67Å; S529-V575 VanDerWaalsContact O-N 3.1Å; V575-F577 HydrophobicContact CB-CE2 4.2Å; V575-F577 HydrophobicContact CG1-CD2 4.32Å; V575-F577 HydrophobicContact CG1-CE2 3.75Å; V575-F577 HydrophobicContact CG1-CZ 4.14Å
576	L	98.9	Very high	84.7	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	136.2	178.7	-49.9	175.9	0	0	0	109.5	L438 V482 L483 F503 L525 V528 A573 Y578	L438-L576 HydrophobicContact CD1-CD1 4.11Å; L438-L576 HydrophobicContact CD2-CD1 4.08Å; V482-L576 WeakPolarHBondContact CA-O 3.25Å; L483-L576 HydrophobicContact CB-CB 4.33Å; L483-L576 PolarHBondContact N-O 2.58Å; L483-L576 PolarHBondContact O-N 2.84Å; F503-L576 HydrophobicContact CB-CD1 3.81Å; F503-L576 HydrophobicContact CD1-CD1 3.93Å; F503-L576 HydrophobicContact CD1-CD2 3.95Å; F503-L576 HydrophobicContact CD2-CD1 4.29Å; F503-L576 HydrophobicContact CD2-CD2 4.1Å; F503-L576 HydrophobicContact CE1-CD2 3.81Å; F503-L576 HydrophobicContact CE2-CD2 3.94Å; F503-L576 HydrophobicContact CG-CD1 3.76Å; F503-L576 HydrophobicContact CG-CD2 4.11Å; F503-L576 HydrophobicContact CZ-CD2 3.78Å; L525-L576 HydrophobicContact CD1-CB 4.02Å; L525-L576 HydrophobicContact CD1-CD2 4.47Å; V528-L576 HydrophobicContact CB-CD2 4.48Å; V528-L576 HydrophobicContact CG1-CD2 3.99Å; V528-L576 HydrophobicContact CG2-CD2 3.87Å; A573-L576 HydrophobicContact CB-CD2 4.2Å; L576-Y578 HydrophobicContact CB-CD2 4.09Å; L576-Y578 HydrophobicContact CB-CE2 3.68Å; L576-Y578 HydrophobicContact CD1-CE2 3.98Å; L576-Y578 HydrophobicContact CG-CE2 4.46Å
577	F	98.8	Very high	84.2	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	116.6	177.3	-66.9	-104.6	0	0	0	109.6	I264 C267 L268 L345 V482 Y526 A527 V575	I264-F577 HydrophobicContact CD1-CE2 4.38Å; I264-F577 HydrophobicContact CD1-CZ 4.1Å; C267-F577 HydrophobicContact CB-CD1 4.34Å; C267-F577 HydrophobicContact CB-CD2 3.77Å; C267-F577 HydrophobicContact CB-CE1 4.09Å; C267-F577 HydrophobicContact CB-CE2 3.48Å; C267-F577 VanDerWaalsContact CB-CE2 3.48Å; C267-F577 HydrophobicContact CB-CG 4.2Å; C267-F577 HydrophobicContact CB-CZ 3.65Å; L268-F577 HydrophobicContact CD2-CE1 4.31Å; L345-F577 HydrophobicContact CD1-CE1 4.32Å; L345-F577 HydrophobicContact CD1-CZ 4.31Å; L345-F577 HydrophobicContact CD2-CE1 4.1Å; L345-F577 HydrophobicContact CD2-CZ 3.79Å; V482-F577 HydrophobicContact CG1-CE1 4.49Å; V482-F577 HydrophobicContact CG2-CD1 3.9Å; V482-F577 HydrophobicContact CG2-CE1 3.96Å; Y526-F577 HydrophobicContact CD1-CB 4.38Å; Y526-F577 VanDerWaalsContact CD1-O 3.28Å; Y526-F577 WeakPolarHBondContact CD1-O 3.44Å; Y526-F577 HydrophobicContact CE1-CB 3.72Å; Y526-F577 HydrophobicContact CE2-CB 4.2Å; Y526-F577 PolarHBondContact N-O 3.04Å; Y526-F577 VanDerWaalsContact N-O 3.07Å; A527-F577 HydrophobicContact CB-CB 4.01Å; A527-F577 HydrophobicContact CB-CD2 4.32Å; A527-F577 HydrophobicContact CB-CG 4.36Å; A527-F577 PolarHBondContact N-O 3.03Å; A527-F577 PolarHBondContact O-N 2.89Å; V575-F577 HydrophobicContact CB-CE2 4.2Å; V575-F577 HydrophobicContact CG1-CD2 4.32Å; V575-F577 HydrophobicContact CG1-CE2 3.75Å; V575-F577 HydrophobicContact CG1-CZ 4.14Å
578	Y	98.7	Very high	83.7	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	133.9	-177.7	-81	-86.2	0	0	0	110.9	L438 I480 L481 L483 P504 L508 N524 L525 L576	L438-Y578 HydrophobicContact CD2-CE2 4.03Å; I480-Y578 CarbonylContact C-O 3.51Å; I480-Y578 VanDerWaalsContact CA-O 3.29Å; I480-Y578 WeakPolarHBondContact CA-O 3.16Å; L481-Y578 PolarHBondContact N-O 3.27Å; L481-Y578 PolarHBondContact O-N 2.67Å; L483-Y578 HydrophobicContact CD1-CD2 4Å; L483-Y578 HydrophobicContact CD1-CE2 3.98Å; L483-Y578 HydrophobicContact CG-CD2 4.42Å; P504-Y578 WeakPolarHBondContact O-CE1 3.1Å; P504-Y578 PolarHBondContact O-OH 3Å; L508-Y578 HydrophobicContact CB-CD1 4.3Å; L508-Y578 HydrophobicContact CB-CE1 3.9Å; L508-Y578 HydrophobicContact CD2-CD1 3.82Å; L508-Y578 HydrophobicContact CD2-CD2 4.14Å; L508-Y578 HydrophobicContact CD2-CE1 3.5Å; L508-Y578 HydrophobicContact CD2-CE2 3.83Å; L508-Y578 HydrophobicContact CD2-CG 4.13Å; L508-Y578 HydrophobicContact CG-CE1 4.34Å; N524-Y578 VanDerWaalsContact C-CD1 3.48Å; N524-Y578 CarbonylContact O-C 3.47Å; N524-Y578 VanDerWaalsContact O-CA 3.29Å; N524-Y578 WeakPolarHBondContact O-CA 3.47Å; L525-Y578 HydrophobicContact CB-CD1 4.1Å; L525-Y578 HydrophobicContact CB-CE1 3.7Å; L525-Y578 HydrophobicContact CD1-CD1 4.33Å; L525-Y578 HydrophobicContact CD1-CD2 3.98Å; L525-Y578 HydrophobicContact CD1-CE1 3.96Å; L525-Y578 HydrophobicContact CD1-CE2 3.58Å; L525-Y578 HydrophobicContact CD1-CG 4.34Å; L525-Y578 HydrophobicContact CG-CE1 4.45Å; L576-Y578 HydrophobicContact CB-CD2 4.09Å; L576-Y578 HydrophobicContact CB-CE2 3.68Å; L576-Y578 HydrophobicContact CD1-CE2 3.98Å; L576-Y578 HydrophobicContact CG-CE2 4.46Å
579	E	97.3	Very high	83	Confident	35 Å²	35	65.1 Å²	65.1	16%	0.164	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	139.5	170.7	63	-175.8	172.7	0	0	109.9	Q272 I480 Y523 N524 Y526 A581	Q272-E579 PolarHBondContact NE2-OE2 2.85Å; I480-E579 HydrophobicContact CD1-CB 3.67Å; Y523-E579 WeakPolarHBondContact CA-O 3.29Å; Y523-E579 VanDerWaalsContact CD1-C 3.5Å; N524-E579 HydrophobicContact CB-CG 4.48Å; N524-E579 PolarHBondContact N-O 3.44Å; N524-E579 PolarHBondContact O-N 3.17Å; Y526-E579 HydrophobicContact CD1-CB 3.76Å; Y526-E579 HydrophobicContact CD1-CG 3.89Å; Y526-E579 HydrophobicContact CE1-CB 4.04Å; Y526-E579 HydrophobicContact CG-CG 4.48Å; E579-A581 PolarHBondContact O-N 2.8Å
580	L	95.9	Very high	82.2	Confident	50 Å²	50	62.8 Å²	62.8	26%	0.262	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	127.4	179	-176.2	74.1	0	0	0	109.4	K479 N520 V522 Y523 T582	K479-L580 PolarHBondContact O-N 3.26Å; N520-L580 HydrophobicContact CB-CD1 4.19Å; N520-L580 HydrophobicContact CB-CD2 4.17Å; V522-L580 WeakPolarHBondContact O-CD1 3.36Å; Y523-L580 HydrophobicContact CD1-CB 4.35Å; Y523-L580 HydrophobicContact CE1-CB 4.07Å; Y523-L580 HydrophobicContact CE1-CD1 4.15Å; Y523-L580 HydrophobicContact CE2-CD1 4.25Å; L580-T582 PolarHBondContact O-N 2.92Å
581	A	91.3	Very high	81.4	Confident	19 Å²	19	65.3 Å²	65.3	16%	0.157	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-62.6	122.7	179.9	0	0	0	0	0	109.7	V522 E579 S583	V522-A581 HydrophobicContact CB-CB 4.3Å; V522-A581 HydrophobicContact CG1-CB 4.04Å; V522-A581 WeakPolarHBondContact O-CB 3.26Å; V522-A581 PolarHBondContact O-N 3.28Å; E579-A581 PolarHBondContact O-N 2.8Å; A581-S583 PolarHBondContact O-N 3.22Å
582	T	79.5	Confident	80.5	Confident	130 Å²	130	66.5 Å²	66.5	80%	0.798	35%	0.354	S	S	*	.			trans	-63.6	107.7	170.9	41.2	0	0	0	0	108.5	L580 S584	L580-T582 PolarHBondContact O-N 2.92Å; T582-S584 PolarHBondContact O-N 3.47Å
583	S	56.6	Low	79.4	Confident	104 Å²	104	68.6 Å²	68.6	73%	0.727	37%	0.365	S	S	*	.			trans	-54.3	116.7	168.8	-68.3	0	0	0	0	108.1	A581 R585	A581-S583 PolarHBondContact O-N 3.22Å; S583-R585 PolarHBondContact O-N 3.2Å; S583-R585 VanDerWaalsContact O-N 3.13Å
584	S	39.2	Very low	77.9	Confident	112 Å²	112	73.8 Å²	73.8	78%	0.783	39%	0.393	S	S	*	.			trans	-57.7	119.5	170.3	-63.3	0	0	0	0	106.9	T582 M586	T582-S584 PolarHBondContact O-N 3.47Å; S584-M586 PolarHBondContact O-N 3.17Å
585	R	31.4	Very low	76.2	Confident	250 Å²	250	79.7 Å²	79.7	94%	0.943	43%	0.425	S	S	*	.			trans	-67.3	104.3	167	-76.3	-176.2	173.2	-177.7	-3.6	106.9	S583	S583-R585 PolarHBondContact O-N 3.2Å; S583-R585 VanDerWaalsContact O-N 3.13Å
586	M	28.3	Very low	74.2	Confident	256 Å²	256	86.9 Å²	86.9	100%	1.261	46%	0.463	S	S	*	.			trans	-65.2	0	152.6	-69.9	179.2	162.6	0	0	109.1	S584	S584-M586 PolarHBondContact O-N 3.17Å

Retrieved 586 of 586 residues in 366.9 ms (Link to these results)

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