A0A096M629_POEFO Loading...

Sorbin and SH3 domain containing 3

AlphaFold DB , UniProt , Accession A0A096M629, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 700 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	33.1	Very low	37.4	Very low	225 Å²	225	136.5 Å²	136.5	100%	1.108	80%	0.796	S	S	*	*				0	118	0	-67.5	162.6	177.6	0	0	105.8
2	Q	40.4	Very low	37.2	Very low	175 Å²	175	140.8 Å²	140.8	82%	0.818	80%	0.802	S	S	*	*				64	130.4	74.7	-82.2	169.7	-39	0	0	111.1
3	T	40.4	Very low	38.7	Very low	105 Å²	105	137.8 Å²	137.8	64%	0.644	79%	0.791	S	S	*	*			cis	-151.6	139	22.6	-0	0	0	0	0	110.3
4	Q	44	Very low	38.1	Very low	155 Å²	155	139.3 Å²	139.3	72%	0.724	80%	0.796	S	S	*	*				67	142.8	103.3	-84.3	-179.8	-22.1	0	0	116.7
5	Q	45.2	Very low	37.4	Very low	149 Å²	149	134.3 Å²	134.3	70%	0.696	79%	0.787	S	S	*	*			cis	-167.5	169	-4.7	-142.9	164	-10.2	0	0	112.8
6	S	40.8	Very low	37	Very low	109 Å²	109	133.1 Å²	133.1	76%	0.762	79%	0.788	S	S	*	*			trans	70.3	150.6	154	-57.8	0	0	0	0	119.2
7	A	36.9	Very low	36.7	Very low	86 Å²	86	136.2 Å²	136.2	71%	0.711	79%	0.793	S	S	*	*			cis	-161.1	133.2	-17.9	0	0	0	0	0	107.2
8	E	31.6	Very low	36.4	Very low	192 Å²	192	134.1 Å²	134.1	90%	0.897	79%	0.786	S	S	*	*				81.2	157.2	88.4	-156.8	170.3	130.6	0	0	115.6
9	V	34.7	Very low	36.1	Very low	129 Å²	129	137.8 Å²	137.8	78%	0.782	79%	0.787	S	S	*	*			trans	81.6	89.5	-170.9	-171.4	0	0	0	0	112.8
10	A	33.5	Very low	35.8	Very low	101 Å²	101	139 Å²	139	84%	0.835	79%	0.79	S	S	*	*				77.1	133.9	67.3	0	0	0	0	0	113.9
11	G	30.3	Very low	35.5	Very low	76 Å²	76	137.9 Å²	137.9	78%	0.784	79%	0.791	S	S	*	*			cis	-144.9	-173.3	14	0	0	0	0	0	117.1
12	H	35.7	Very low	35.2	Very low	187 Å²	187	130.3 Å²	130.3	87%	0.866	77%	0.771	S	S	*	*			trans	-118.8	-171	-168.2	-81.7	-65	0	0	0	110.5
13	P	56.3	Low	34.9	Very low	102 Å²	102	131.8 Å²	131.8	66%	0.662	78%	0.775	S	S	*	*				-135.8	-145.2	-52.7	40.9	-22.7	0	0	0	111.3
14	N	29.8	Very low	35.1	Very low	159 Å²	159	131.6 Å²	131.6	85%	0.85	78%	0.776	S	S	*	*			trans	74	156	166.8	-68.4	-9.1	0	0	0	117.9
15	G	28.7	Very low	34.3	Very low	64 Å²	64	130.4 Å²	130.4	66%	0.66	77%	0.774	S	S	*	*			cis	143.2	126.1	-12.1	0	0	0	0	0	115.6
16	S	30.4	Very low	33.6	Very low	115 Å²	115	130.3 Å²	130.3	80%	0.804	78%	0.777	S	S	*	*			trans	50.5	106.1	150.9	-56.2	0	0	0	0	122.3
17	Q	32.8	Very low	32.9	Very low	187 Å²	187	130.7 Å²	130.7	87%	0.874	78%	0.78	S	S	*	*			trans	62.9	160	133	-77.1	-171.4	-21.9	0	0	123.3
18	S	30.8	Very low	32.4	Very low	97 Å²	97	131.1 Å²	131.1	68%	0.678	78%	0.777	S	S	*	*			trans	84.8	153.5	158.4	89.9	0	0	0	0	117.1
19	Y	30.1	Very low	32.2	Very low	205 Å²	205	126.3 Å²	126.3	80%	0.804	77%	0.765	S	S	*	*			cis	-154.5	154.6	4.8	-110.2	-50.5	0	0	0	111.8
20	L	29.9	Very low	32	Very low	161 Å²	161	128.1 Å²	128.1	84%	0.843	77%	0.765	S	S	*	*			trans	62.5	161.2	154.1	-63.8	162.8	0	0	0	117.3
21	S	29.6	Very low	31.8	Very low	116 Å²	116	131.7 Å²	131.7	81%	0.811	76%	0.764	S	S	*	*			cis	-149.1	161.8	-5.2	-155.4	0	0	0	0	107.6
22	G	27.6	Very low	31.6	Very low	67 Å²	67	135.8 Å²	135.8	69%	0.691	77%	0.766	S	S	*	*			cis	-177.6	-167.7	3.8	0	0	0	0	0	112.3
23	K	33	Very low	31.3	Very low	205 Å²	205	133.8 Å²	133.8	89%	0.891	76%	0.761	S	S	*	*			trans	-111.6	174.4	168.7	-88.3	-172	179	-174.3	0	108.7
24	P	45.8	Very low	29.9	Very low	102 Å²	102	135.4 Å²	135.4	66%	0.662	77%	0.769	S	S	*	*			cis	-109.6	-153.2	9.5	46.9	-37.4	0	0	0	111.7
25	D	26.9	Very low	30.1	Very low	129 Å²	129	132.9 Å²	132.9	69%	0.69	76%	0.764	S	S	*	*			cis	-132	176.5	3.8	-95.4	-44.2	0	0	0	109
26	I	29.6	Very low	31.3	Very low	148 Å²	148	134.8 Å²	134.8	76%	0.759	76%	0.764	S	S	*	*			cis	87.6	131.3	23.6	-50.8	179.7	0	0	0	115.8
27	S	26.8	Very low	31.4	Very low	117 Å²	117	136.9 Å²	136.9	82%	0.818	76%	0.762	S	S	*	*			trans	71.8	155	172.6	-133.1	0	0	0	0	117.9
28	S	27.6	Very low	31.5	Very low	94 Å²	94	136.2 Å²	136.2	66%	0.657	76%	0.758	S	S	*	*			cis	-174.7	162.5	-41.7	-177	0	0	0	0	108.3
29	S	27.5	Very low	31.6	Very low	91 Å²	91	137.5 Å²	137.5	64%	0.636	76%	0.762	S	S	*	*			trans	76.5	133.3	150.7	-58.7	0	0	0	0	121.4
30	Q	29.8	Very low	31.7	Very low	168 Å²	168	133.8 Å²	133.8	79%	0.785	76%	0.76	S	S	*	*			trans	73.9	112.7	148.3	-67.6	163.7	13.7	0	0	118
31	H	29	Very low	31.8	Very low	176 Å²	176	131.7 Å²	131.7	82%	0.815	75%	0.754	S	S	*	*				84.5	121.7	59.4	-84.1	-80.1	0	0	0	112.9
32	I	27.1	Very low	31.9	Very low	161 Å²	161	133.6 Å²	133.6	83%	0.826	75%	0.753	S	S	*	*				169.6	143.9	129.8	-88.5	158.9	0	0	0	111.8
33	L	28.4	Very low	32.3	Very low	146 Å²	146	135.1 Å²	135.1	76%	0.764	75%	0.753	S	S	*	*			trans	-43.2	155.8	174.2	-58.6	93.5	0	0	0	115
34	T	27.8	Very low	32.8	Very low	135 Å²	135	131.5 Å²	131.5	83%	0.828	75%	0.751	S	S	*	*				-176.9	163.6	68	-50.2	0	0	0	0	111.3
35	S	32.7	Very low	32.2	Very low	106 Å²	106	130.2 Å²	130.2	74%	0.741	76%	0.756	S	S	*	*			trans	-79.8	-169	168.9	-136.7	0	0	0	0	111.3
36	P	53.3	Low	32.5	Very low	104 Å²	104	132 Å²	132	68%	0.675	76%	0.764	S	S	*	*			cis	-137.8	171.7	-4.7	35	-13.1	0	0	0	116.7
37	E	32.8	Very low	33.2	Very low	160 Å²	160	130.7 Å²	130.7	75%	0.748	77%	0.766	S	S	*	*				162	133.7	112.6	-79.9	-125.6	134.6	0	0	115.5
38	H	34.9	Very low	33.9	Very low	172 Å²	172	131.4 Å²	131.4	80%	0.796	77%	0.765	S	S	*	*			trans	71.7	152.4	146.9	-87.3	-138	0	0	0	123.5
39	V	34.4	Very low	34.4	Very low	124 Å²	124	132.5 Å²	132.5	75%	0.752	77%	0.77	S	S	*	*			trans	-148.2	135.4	-162.8	171.2	0	0	0	0	109.8
40	V	32	Very low	35	Very low	128 Å²	128	134.1 Å²	134.1	78%	0.776	78%	0.779	S	S	*	*			trans	-143.4	132.7	146.2	-179.7	0	0	0	0	108.3	I42	V40-I42 HydrophobicContact CG1-CD1 4.38Å; V40-I42 HydrophobicContact CG1-CG1 4.15Å
41	V	31.2	Very low	35.1	Very low	117 Å²	117	135.5 Å²	135.5	71%	0.709	79%	0.785	S	S	*	*			trans	-129.2	133.6	169.7	175.7	0	0	0	0	108
42	I	32.7	Very low	35.2	Very low	155 Å²	155	132.1 Å²	132.1	80%	0.795	78%	0.781	S	S	*	*			trans	-136.1	132.7	171.6	-58.1	179	0	0	0	108	V40	V40-I42 HydrophobicContact CG1-CD1 4.38Å; V40-I42 HydrophobicContact CG1-CG1 4.15Å
43	S	34.2	Very low	35.8	Very low	99 Å²	99	129.5 Å²	129.5	69%	0.692	78%	0.775	S	S	*	*			trans	-138.3	135.3	-176	-51.5	0	0	0	0	111.7
44	P	44.6	Very low	35.9	Very low	130 Å²	130	132.8 Å²	132.8	84%	0.844	78%	0.783	S	S	*	*			trans	-101.5	158.1	151.6	36.1	-28.5	0	0	0	110.3
45	G	32.8	Very low	36.2	Very low	74 Å²	74	134.4 Å²	134.4	76%	0.763	78%	0.781	S	S	*	*			cis	155	103.4	-3.3	0	0	0	0	0	110.2
46	L	34.1	Very low	36.2	Very low	166 Å²	166	134 Å²	134	87%	0.869	78%	0.778	S	S	*	*			trans	-98.6	150.4	-178.3	-119.1	77	0	0	0	112
47	P	44.3	Very low	35.2	Very low	122 Å²	122	135.4 Å²	135.4	79%	0.792	79%	0.785	S	S	*	*			trans	-91.7	156.3	-179.9	36	-33.9	0	0	0	114.2
48	T	40.1	Very low	35	Very low	132 Å²	132	131.1 Å²	131.1	81%	0.81	78%	0.783	S	S	*	*			trans	-139.5	143.9	-177.6	-55.7	0	0	0	0	109.3
49	P	39.5	Very low	34.9	Very low	116 Å²	116	130.6 Å²	130.6	75%	0.753	79%	0.786	S	S	*	*			trans	-77.4	163.9	-171	30.6	-37.4	0	0	0	115.1
50	P	39.6	Very low	34.6	Very low	126 Å²	126	130.7 Å²	130.7	82%	0.818	79%	0.787	S	S	*	*			trans	-86.5	150.9	-172.1	34.3	-36.4	0	0	0	115
51	Q	31.3	Very low	34.4	Very low	197 Å²	197	131 Å²	131	92%	0.921	79%	0.794	S	S	*	*			trans	-136.1	165.2	156.3	-84.1	-155.3	-8	0	0	111.7
52	S	30.8	Very low	34.2	Very low	105 Å²	105	129 Å²	129	73%	0.734	80%	0.798	S	S	*	*			trans	-73	150.4	-168.6	50	0	0	0	0	115.2
53	P	40.6	Very low	33.9	Very low	106 Å²	106	127 Å²	127	69%	0.688	80%	0.798	S	S	*	*			trans	-91.3	122.7	-177.2	34.5	-33	0	0	0	113.9
54	F	30.6	Very low	33.6	Very low	214 Å²	214	128.4 Å²	128.4	94%	0.939	80%	0.802	S	S	*	*			trans	-146.3	132.3	146.1	-87.3	-69.7	0	0	0	108.7
55	H	34.1	Very low	32.8	Very low	170 Å²	170	131.9 Å²	131.9	79%	0.787	80%	0.804	S	S	*	*			trans	-132	136.6	-167.7	-108.2	-71.5	0	0	0	112.8
56	S	33.1	Very low	32.6	Very low	96 Å²	96	135.8 Å²	135.8	67%	0.671	80%	0.802	S	S	*	*			trans	69.9	148.4	143.4	-57.1	0	0	0	0	118
57	T	31.6	Very low	32.8	Very low	134 Å²	134	133.9 Å²	133.9	82%	0.822	80%	0.8	S	S	*	*			cis	-155.9	149.8	-6	8.2	0	0	0	0	107.4
58	G	29.3	Very low	31.9	Very low	70 Å²	70	135.7 Å²	135.7	72%	0.722	80%	0.798	S	S	*	*				78.6	140.2	88	0	0	0	0	0	113.2
59	L	31.7	Very low	31.5	Very low	162 Å²	162	137 Å²	137	85%	0.848	80%	0.799	S	S	*	*			cis	-166.3	168.2	2.4	-115.8	173.5	0	0	0	111.3
60	T	28	Very low	31	Very low	125 Å²	125	139.2 Å²	139.2	77%	0.767	80%	0.804	S	S	*	*			trans	67.3	120.3	161.8	57.5	0	0	0	0	124
61	S	28.2	Very low	30.4	Very low	134 Å²	134	137 Å²	137	94%	0.937	80%	0.804	S	S	*	*				49.8	134.1	128	-152.6	0	0	0	0	123.8
62	G	26.7	Very low	30.3	Very low	77 Å²	77	131.8 Å²	131.8	79%	0.794	80%	0.804	S	S	*	*			trans	175.4	121.2	164.2	0	0	0	0	0	115.5
63	S	27.1	Very low	30.1	Very low	112 Å²	112	130.4 Å²	130.4	78%	0.783	81%	0.806	S	S	*	*			trans	-95.4	133.4	-170.4	142.1	0	0	0	0	115.4
64	V	27.7	Very low	30.5	Very low	128 Å²	128	131.4 Å²	131.4	78%	0.776	81%	0.812	S	S	*	*			trans	49.4	117.7	140.6	-173.1	0	0	0	0	119.8
65	K	28.6	Very low	30.6	Very low	204 Å²	204	128.1 Å²	128.1	89%	0.887	81%	0.81	S	S	*	*				-165.9	154.7	115.4	-111.4	-171.8	179.8	-171.4	0	115.6
66	E	27	Very low	30.7	Very low	155 Å²	155	126 Å²	126	72%	0.724	81%	0.808	S	S	*	*			trans	-92	164.6	177.3	-162	173.5	-170.2	0	0	111
67	P	38.2	Very low	31	Very low	126 Å²	126	127.8 Å²	127.8	82%	0.818	82%	0.818	S	S	*	*				-138	150.7	116.1	38.3	-28.5	0	0	0	114.9
68	E	27	Very low	30.9	Very low	161 Å²	161	126.7 Å²	126.7	75%	0.752	82%	0.816	S	S	*	*			trans	-71.1	151.5	178.9	-56.6	170.2	86.3	0	0	113.8
69	L	31.5	Very low	30.8	Very low	158 Å²	158	133.7 Å²	133.7	83%	0.827	83%	0.827	S	S	*	*			trans	-160.1	106.3	134.2	51.6	118.7	0	0	0	113.9
70	N	28.4	Very low	30.6	Very low	163 Å²	163	129 Å²	129	87%	0.872	82%	0.817	S	S	*	*			trans	29.6	120.9	147.2	-67.2	-58.7	0	0	0	121.8
71	G	27	Very low	30.6	Very low	80 Å²	80	128.5 Å²	128.5	83%	0.825	82%	0.819	S	S	*	*				121.6	127.6	107.9	0	0	0	0	0	119.3
72	G	28.1	Very low	30.6	Very low	88 Å²	88	131.2 Å²	131.2	91%	0.907	81%	0.81	S	S	*	*			trans	109.4	108.4	148	0	0	0	0	0	118.4
73	G	27.7	Very low	30.9	Very low	75 Å²	75	137.2 Å²	137.2	77%	0.773	81%	0.81	S	S	*	*			trans	-138.1	-162.9	145.6	0	0	0	0	0	107.8
74	P	49.8	Very low	31	Very low	127 Å²	127	134.7 Å²	134.7	83%	0.825	80%	0.802	S	S	*	*			cis	-129.4	166.9	-12.1	40.7	-27	0	0	0	113.1
75	V	31.8	Very low	32.1	Very low	146 Å²	146	134.4 Å²	134.4	89%	0.885	80%	0.802	S	S	*	*			trans	-142.4	131.2	162.7	179.7	0	0	0	0	110.7
76	T	35.8	Very low	32.1	Very low	124 Å²	124	129.9 Å²	129.9	76%	0.761	80%	0.797	S	S	*	*			trans	-103	167.3	165.6	55	0	0	0	0	110.2
77	P	40.6	Very low	32.3	Very low	134 Å²	134	131.2 Å²	131.2	87%	0.87	80%	0.803	S	S	*	*				-138	163.4	115.7	37.1	-27.3	0	0	0	114.2
78	S	27.8	Very low	31.9	Very low	111 Å²	111	130.2 Å²	130.2	78%	0.776	80%	0.799	S	S	*	*			trans	-133.3	123.7	172.7	174.5	0	0	0	0	109.4
79	F	27.9	Very low	32	Very low	217 Å²	217	132.4 Å²	132.4	95%	0.952	81%	0.809	S	S	*	*			trans	-172.9	150.7	161.7	-129.7	-103.1	0	0	0	107.1
80	G	27.2	Very low	31.9	Very low	63 Å²	63	128.1 Å²	128.1	65%	0.649	80%	0.803	S	S	*	*			cis	179.5	143.5	-7.5	0	0	0	0	0	108.4
81	S	29.3	Very low	31.8	Very low	115 Å²	115	128.8 Å²	128.8	80%	0.804	80%	0.801	S	S	*	*			trans	-81	144.4	-178.7	-177.9	0	0	0	0	111.8
82	Y	28.3	Very low	32	Very low	192 Å²	192	131.7 Å²	131.7	75%	0.753	80%	0.797	S	S	*	*			trans	-172.5	150.8	138.5	-110.2	-68.4	0	0	0	114.3
83	Y	32.5	Very low	32.1	Very low	203 Å²	203	133.2 Å²	133.2	80%	0.796	79%	0.793	S	S	*	*			trans	55.6	115.4	162.4	-67.4	-64.5	0	0	0	122.1
84	G	28.6	Very low	32.1	Very low	59 Å²	59	137.9 Å²	137.9	61%	0.608	80%	0.8	S	S	*	*				-100.8	-159.9	127	0	0	0	0	0	109.6
85	P	50.8	Low	31.2	Very low	121 Å²	121	135.5 Å²	135.5	79%	0.786	80%	0.799	S	S	*	*			cis	-114.9	-165.4	0.5	41.2	-26.9	0	0	0	111.8
86	S	29.2	Very low	31.1	Very low	110 Å²	110	135.4 Å²	135.4	77%	0.769	80%	0.799	S	S	*	*				-175.6	162.3	92	-66.7	0	0	0	0	111.8
87	Q	30.1	Very low	30.9	Very low	183 Å²	183	138.6 Å²	138.6	86%	0.855	81%	0.805	S	S	*	*			trans	-110.1	174.5	176.3	-63.8	-173.6	8.9	0	0	112.7
88	S	31.2	Very low	30.2	Very low	104 Å²	104	135.8 Å²	135.8	73%	0.727	80%	0.8	S	S	*	*			trans	65.3	96.4	143.7	64.8	0	0	0	0	120.7
89	Q	28.9	Very low	30.1	Very low	208 Å²	208	136.1 Å²	136.1	97%	0.972	80%	0.803	S	S	*	*				-177.1	161.9	127.9	-99.3	169.7	-8.3	0	0	107.1
90	G	28.3	Very low	30.1	Very low	67 Å²	67	130.6 Å²	130.6	69%	0.691	79%	0.791	S	S	*	*			cis	176	126	-4.9	0	0	0	0	0	109.8
91	E	26.8	Very low	30.2	Very low	177 Å²	177	133.4 Å²	133.4	83%	0.827	80%	0.796	S	S	*	*			trans	34.7	131.6	154.6	-74.9	-172.8	93.8	0	0	124.9
92	L	32.3	Very low	30.2	Very low	142 Å²	142	135.8 Å²	135.8	74%	0.743	80%	0.799	S	S	*	*			trans	60.4	118.2	137.1	-57.8	172.8	0	0	0	121.3
93	S	28.7	Very low	30.3	Very low	120 Å²	120	132.2 Å²	132.2	84%	0.839	80%	0.799	S	S	*	*				166.9	162.9	108.2	-77.8	0	0	0	0	115.2
94	N	29.2	Very low	30	Very low	172 Å²	172	130.2 Å²	130.2	92%	0.92	80%	0.796	S	S	*	*			trans	-63.5	150.5	-179.4	-60.8	-38.3	0	0	0	114.7
95	G	29.5	Very low	29.9	Very low	78 Å²	78	132.9 Å²	132.9	80%	0.804	81%	0.806	S	S	*	*			trans	-172.6	118.3	162.4	0	0	0	0	0	112.8
96	V	30.9	Very low	28.8	Very low	143 Å²	143	137.7 Å²	137.7	87%	0.867	81%	0.808	S	S	*	*			trans	-114.4	118.6	175.1	172.7	0	0	0	0	109.1
97	Q	30.4	Very low	29.1	Very low	192 Å²	192	136.7 Å²	136.7	90%	0.897	80%	0.797	S	S	*	*			trans	-177.9	133.8	140.7	-105	169.2	18.8	0	0	113.7
98	G	26.9	Very low	29.3	Very low	74 Å²	74	134.4 Å²	134.4	76%	0.763	80%	0.798	S	S	*	*				65.6	105.4	124.1	0	0	0	0	0	122.6
99	S	25.5	Very low	29.1	Very low	119 Å²	119	135.6 Å²	135.6	83%	0.832	80%	0.796	S	S	*	*			trans	82.1	134.9	131.9	-145.5	0	0	0	0	121.7
100	S	26.7	Very low	29.2	Very low	101 Å²	101	131.4 Å²	131.4	71%	0.706	78%	0.781	S	S	*	*			trans	42.1	138.5	145.8	-111.4	0	0	0	0	121.9
101	T	29.3	Very low	29.6	Very low	122 Å²	122	135.8 Å²	135.8	75%	0.748	78%	0.783	S	S	*	*			cis	-163.2	150.4	-7.4	-7.3	0	0	0	0	108.1
102	L	29.3	Very low	30.3	Very low	165 Å²	165	131.2 Å²	131.2	86%	0.864	78%	0.783	S	S	*	*			trans	-124	145.1	166.1	-82.2	174.3	0	0	0	111.1
103	P	31.8	Very low	30.6	Very low	116 Å²	116	135.2 Å²	135.2	75%	0.753	79%	0.789	S	S	*	*			trans	-84.3	125.4	-176.1	32.4	-33.7	0	0	0	113.3
104	H	26	Very low	31.1	Very low	162 Å²	162	137.1 Å²	137.1	75%	0.75	79%	0.789	S	S	*	*				43.1	105.2	127.5	-156.2	81.4	0	0	0	119.3
105	S	26.5	Very low	31.7	Very low	115 Å²	115	134.4 Å²	134.4	80%	0.804	77%	0.773	S	S	*	*			trans	-131.3	144.3	136.4	67.4	0	0	0	0	109.4
106	W	26.8	Very low	32.3	Very low	222 Å²	222	139.9 Å²	139.9	84%	0.841	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-99.8	151.4	-170.2	176.5	-81.1	0	0	0	112.2
107	V	36.3	Very low	33	Very low	89 Å²	89	136.6 Å²	136.6	54%	0.539	75%	0.749	S	S	.	*	P	Polyproline II helix	trans	-102.1	132.5	-169.2	172.3	0	0	0	0	112	N109	V107-N109 HydrophobicContact CG1-CB 4.25Å; V107-N109 PolarHBondContact O-N 3.49Å
108	P	33.4	Very low	33.3	Very low	135 Å²	135	133.2 Å²	133.2	88%	0.877	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-72.9	116	153.7	-15	31.4	0	0	0	109
109	N	28.1	Very low	34.4	Very low	128 Å²	128	133.4 Å²	133.4	68%	0.684	75%	0.748	S	S	*	*			trans	-108.3	178.4	-161.1	-168.8	32.5	0	0	0	113.2	V107	V107-N109 HydrophobicContact CG1-CB 4.25Å; V107-N109 PolarHBondContact O-N 3.49Å
110	N	31.2	Very low	35.6	Very low	121 Å²	121	130.2 Å²	130.2	65%	0.647	72%	0.721	S	S	*	*			trans	98.8	121.9	162.3	-52.8	6.6	0	0	0	115.9
111	E	36.4	Very low	36.8	Very low	159 Å²	159	127.2 Å²	127.2	74%	0.743	71%	0.706	S	S	*	*			cis	-156.3	66.1	-24.8	43.7	-164.8	130.1	0	0	110.8	R113	E111-R113 PolarHBondContact O-N 3.34Å
112	G	40.2	Very low	38	Very low	80 Å²	80	126.3 Å²	126.3	83%	0.825	70%	0.702	S	S	*	*			trans	-70	68.1	175.1	0	0	0	0	0	113.6	L114	G112-L114 PolarHBondContact O-N 2.83Å
113	R	38.9	Very low	39.3	Very low	227 Å²	227	120.8 Å²	120.8	86%	0.857	68%	0.676	S	S	*	*			trans	-77.5	60.5	179.2	-160.9	179.2	-173.5	173.7	2.7	112.2	E111 I115	E111-R113 PolarHBondContact O-N 3.34Å; R113-I115 PolarHBondContact O-N 2.75Å
114	L	40.5	Very low	40.6	Very low	160 Å²	160	118.1 Å²	118.1	84%	0.838	66%	0.655	S	S	*	*			trans	-57.9	105.5	169.7	-75	170.7	0	0	0	109.8	G112 K116	G112-L114 PolarHBondContact O-N 2.83Å; L114-K116 VanDerWaalsContact C-N 3.33Å; L114-K116 PolarHBondContact O-N 2.89Å
115	I	42	Very low	42	Very low	114 Å²	114	120 Å²	120	59%	0.585	66%	0.664	S	S	*	*			trans	-71.3	93.9	173.8	-54.2	178.4	0	0	0	107.5	R113 F117	R113-I115 PolarHBondContact O-N 2.75Å; I115-F117 VanDerWaalsContact C-N 3.29Å; I115-F117 HydrophobicContact CB-CD2 4.37Å; I115-F117 HydrophobicContact CB-CE1 4.44Å; I115-F117 HydrophobicContact CB-CE2 3.85Å; I115-F117 HydrophobicContact CB-CZ 3.89Å; I115-F117 HydrophobicContact CD1-CZ 4.42Å; I115-F117 HydrophobicContact CG2-CD1 3.91Å; I115-F117 HydrophobicContact CG2-CD2 4.17Å; I115-F117 HydrophobicContact CG2-CE1 3.52Å; I115-F117 HydrophobicContact CG2-CE2 3.8Å; I115-F117 HydrophobicContact CG2-CG 4.22Å; I115-F117 HydrophobicContact CG2-CZ 3.46Å; I115-F117 VanDerWaalsContact CG2-CZ 3.46Å; I115-F117 WeakPolarHBondContact O-CD2 3.16Å; I115-F117 PolarHBondContact O-N 2.88Å
116	K	41.4	Very low	43.6	Very low	194 Å²	194	119.4 Å²	119.4	84%	0.843	66%	0.656	S	S	*	*			trans	-73.8	80.5	-177.2	-168	171.9	-177	175.1	0	110.5	L114 S118	L114-K116 VanDerWaalsContact C-N 3.33Å; L114-K116 PolarHBondContact O-N 2.89Å; K116-S118 PolarHBondContact O-N 3.12Å
117	F	45.4	Very low	45	Very low	74 Å²	74	111.1 Å²	111.1	33%	0.325	64%	0.639	S	S	.	*			trans	-65.8	90.7	-179.5	-63.4	-76	0	0	0	112.1	I115 G119 I120 Q149	I115-F117 VanDerWaalsContact C-N 3.29Å; I115-F117 HydrophobicContact CB-CD2 4.37Å; I115-F117 HydrophobicContact CB-CE1 4.44Å; I115-F117 HydrophobicContact CB-CE2 3.85Å; I115-F117 HydrophobicContact CB-CZ 3.89Å; I115-F117 HydrophobicContact CD1-CZ 4.42Å; I115-F117 HydrophobicContact CG2-CD1 3.91Å; I115-F117 HydrophobicContact CG2-CD2 4.17Å; I115-F117 HydrophobicContact CG2-CE1 3.52Å; I115-F117 HydrophobicContact CG2-CE2 3.8Å; I115-F117 HydrophobicContact CG2-CG 4.22Å; I115-F117 HydrophobicContact CG2-CZ 3.46Å; I115-F117 VanDerWaalsContact CG2-CZ 3.46Å; I115-F117 WeakPolarHBondContact O-CD2 3.16Å; I115-F117 PolarHBondContact O-N 2.88Å; F117-G119 PolarHBondContact O-N 2.92Å; F117-G119 VanDerWaalsContact O-N 3.12Å; F117-I120 HydrophobicContact CB-CB 4.39Å; F117-I120 HydrophobicContact CB-CD1 3.85Å; F117-I120 PolarHBondContact O-N 2.86Å; F117-I120 VanDerWaalsContact O-N 3.14Å; F117-Q149 HydrophobicContact CE1-CG 4.13Å
118	S	36	Very low	45.7	Very low	120 Å²	120	112.4 Å²	112.4	84%	0.839	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.4	116.2	176.3	-66.2	0	0	0	0	112.2	K116	K116-S118 PolarHBondContact O-N 3.12Å
119	G	50.2	Low	46.9	Very low	79 Å²	79	108.1 Å²	108.1	81%	0.814	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	101.2	-5.4	177.2	0	0	0	0	0	115.4	F117	F117-G119 PolarHBondContact O-N 2.92Å; F117-G119 VanDerWaalsContact O-N 3.12Å
120	I	50.9	Low	48.2	Very low	52 Å²	52	107.1 Å²	107.1	27%	0.267	61%	0.607	S	S	.	*	S	Bend	trans	-99.4	143.1	162	-61.5	96.8	0	0	0	108.1	F117 V123 P129 W142	F117-I120 HydrophobicContact CB-CB 4.39Å; F117-I120 HydrophobicContact CB-CD1 3.85Å; F117-I120 PolarHBondContact O-N 2.86Å; F117-I120 VanDerWaalsContact O-N 3.14Å; I120-V123 HydrophobicContact CG2-CG2 4.14Å; I120-P129 HydrophobicContact CG2-CB 4Å; I120-W142 HydrophobicContact CG2-CZ2 4.48Å
121	G	53.2	Low	49.4	Very low	38 Å²	38	102.9 Å²	102.9	39%	0.392	59%	0.588	S	S	.	*			trans	-70.4	-166.9	175.7	0	0	0	0	0	112.4	V123	G121-V123 WeakPolarHBondContact O-CG2 3.17Å; G121-V123 PolarHBondContact O-N 2.9Å
122	P	53	Low	50.1	Low	102 Å²	102	99.3 Å²	99.3	66%	0.662	58%	0.581	S	S	*	*			trans	-48.3	138.2	176.1	-29.5	36.9	0	0	0	113.2	I130	P122-I130 HydrophobicContact CB-CD1 4.04Å; P122-I130 WeakPolarHBondContact O-CB 3.31Å; P122-I130 PolarHBondContact O-N 2.86Å
123	V	57.6	Low	50.6	Low	50 Å²	50	104.9 Å²	104.9	30%	0.303	58%	0.577	S	S	.	*	B	Isolated β-bridge	trans	-125.2	142	-178.4	-174.6	0	0	0	0	106.3	I120 G121 G127 M128	I120-V123 HydrophobicContact CG2-CG2 4.14Å; G121-V123 WeakPolarHBondContact O-CG2 3.17Å; G121-V123 PolarHBondContact O-N 2.9Å; V123-G127 VanDerWaalsContact CG1-O 3.29Å; V123-G127 WeakPolarHBondContact CG1-O 3.25Å; V123-M128 WeakPolarHBondContact CA-O 3.38Å; V123-M128 VanDerWaalsContact CG1-O 3.3Å; V123-M128 WeakPolarHBondContact CG1-O 3.47Å
124	D	58.9	Low	51.2	Low	59 Å²	59	99.6 Å²	99.6	32%	0.316	58%	0.575	S	S	.	*			trans	-78.4	177	178.2	67.6	31.7	0	0	0	112.8	T126 G127 M128 I130	D124-T126 PolarHBondContact O-N 3.29Å; D124-T126 WeakPolarHBondContact OD1-CA 3.42Å; D124-T126 WeakPolarHBondContact OD1-CB 3.32Å; D124-T126 PolarHBondContact OD1-N 3.42Å; D124-T126 PolarHBondContact OD1-OG1 2.71Å; D124-G127 PolarHBondContact O-N 2.96Å; D124-G127 PolarHBondContact OD1-N 3.47Å; D124-G127 VanDerWaalsContact OD1-N 3.14Å; D124-M128 PolarHBondContact N-O 2.79Å; D124-M128 PolarHBondContact OD1-N 3.24Å; D124-M128 WeakPolarHBondContact OD2-CB 3.36Å; D124-I130 HydrophobicContact CB-CD1 4.21Å; D124-I130 HydrophobicContact CB-CG1 4.17Å
125	E	55.7	Low	51.8	Low	202 Å²	202	95.6 Å²	95.6	94%	0.944	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-13.6	-179.5	65.3	-163.8	146.9	0	0	114.4
126	T	59.2	Low	52.4	Low	103 Å²	103	92.1 Å²	92.1	63%	0.632	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-4.5	172.8	70.8	0	0	0	0	113	D124 M128	D124-T126 PolarHBondContact O-N 3.29Å; D124-T126 WeakPolarHBondContact OD1-CA 3.42Å; D124-T126 WeakPolarHBondContact OD1-CB 3.32Å; D124-T126 PolarHBondContact OD1-N 3.42Å; D124-T126 PolarHBondContact OD1-OG1 2.71Å; T126-M128 WeakPolarHBondContact OG1-CE 3.47Å
127	G	56.7	Low	52.7	Low	48 Å²	48	90.5 Å²	90.5	50%	0.495	54%	0.544	S	S	.	.	S	Bend	trans	87.1	8.9	-176.7	0	0	0	0	0	114.3	V123 D124	V123-G127 VanDerWaalsContact CG1-O 3.29Å; V123-G127 WeakPolarHBondContact CG1-O 3.25Å; D124-G127 PolarHBondContact O-N 2.96Å; D124-G127 PolarHBondContact OD1-N 3.47Å; D124-G127 VanDerWaalsContact OD1-N 3.14Å
128	M	51.7	Low	53.3	Low	115 Å²	115	94.2 Å²	94.2	57%	0.567	56%	0.56	S	S	*	*			trans	-85.9	135.2	176.9	-63.4	-167.5	-66.6	0	0	111.6	V123 D124 T126 I130	V123-M128 WeakPolarHBondContact CA-O 3.38Å; V123-M128 VanDerWaalsContact CG1-O 3.3Å; V123-M128 WeakPolarHBondContact CG1-O 3.47Å; D124-M128 PolarHBondContact N-O 2.79Å; D124-M128 PolarHBondContact OD1-N 3.24Å; D124-M128 WeakPolarHBondContact OD2-CB 3.36Å; T126-M128 WeakPolarHBondContact OG1-CE 3.47Å; M128-I130 PolarHBondContact O-N 2.83Å
129	P	57.2	Low	54.5	Low	45 Å²	45	91.6 Å²	91.6	29%	0.292	54%	0.541	S	S	.	.	B	Isolated β-bridge	trans	-74.8	123.3	-177.6	28.5	-33.6	0	0	0	111.7	I120 A131 W142	I120-P129 HydrophobicContact CG2-CB 4Å; P129-A131 PolarHBondContact O-N 2.87Å; P129-W142 HydrophobicContact CB-CH2 4.16Å; P129-W142 HydrophobicContact CB-CZ2 3.9Å; P129-W142 HydrophobicContact CG-CH2 3.6Å; P129-W142 HydrophobicContact CG-CZ2 3.8Å
130	I	56.8	Low	54.7	Low	108 Å²	108	98 Å²	98	55%	0.554	54%	0.54	S	S	*	.			trans	-71.7	-12	-176.4	-56.1	168.5	0	0	0	111.7	P122 D124 M128 S132	P122-I130 HydrophobicContact CB-CD1 4.04Å; P122-I130 WeakPolarHBondContact O-CB 3.31Å; P122-I130 PolarHBondContact O-N 2.86Å; D124-I130 HydrophobicContact CB-CD1 4.21Å; D124-I130 HydrophobicContact CB-CG1 4.17Å; M128-I130 PolarHBondContact O-N 2.83Å; I130-S132 PolarHBondContact O-N 2.93Å
131	A	55.9	Low	55.1	Low	31 Å²	31	99.5 Å²	99.5	26%	0.256	55%	0.549	S	S	.	.	S	Bend	trans	-77.8	111.8	-176.3	0	0	0	0	0	113.3	P129	P129-A131 PolarHBondContact O-N 2.87Å
132	S	50.9	Low	55.6	Low	84 Å²	84	99.7 Å²	99.7	59%	0.587	54%	0.538	S	S	*	.			trans	-54.6	142.9	176	-42.6	0	0	0	0	112.8	I130 S134 S135	I130-S132 PolarHBondContact O-N 2.93Å; S132-S134 PolarHBondContact O-N 3.26Å; S132-S135 WeakPolarHBondContact O-CB 3.45Å; S132-S135 PolarHBondContact O-N 3.06Å; S132-S135 PolarHBondContact O-OG 3.05Å
133	R	51.4	Low	56.1	Low	198 Å²	198	100.6 Å²	100.6	75%	0.747	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-19.4	-172.1	-60.6	172.2	80.5	-179.5	8.3	115.4
134	S	51.6	Low	56.3	Low	116 Å²	116	106.2 Å²	106.2	81%	0.811	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-17.7	177	48.7	0	0	0	0	114.6	S132	S132-S134 PolarHBondContact O-N 3.26Å
135	S	51.6	Low	56.5	Low	75 Å²	75	106.1 Å²	106.1	52%	0.524	55%	0.549	S	S	.	.	S	Bend	trans	-78.9	-17.1	-174	63.4	0	0	0	0	114.7	S132	S132-S135 WeakPolarHBondContact O-CB 3.45Å; S132-S135 PolarHBondContact O-N 3.06Å; S132-S135 PolarHBondContact O-OG 3.05Å
136	V	55.2	Low	57.3	Low	42 Å²	42	98.6 Å²	98.6	26%	0.255	51%	0.514	S	S	.	.	S	Bend	trans	-104.6	121.2	-172	-173	0	0	0	0	111.5	K138 P139 W142	V136-K138 PolarHBondContact O-N 3.03Å; V136-P139 WeakPolarHBondContact O-CD 3.15Å; V136-W142 HydrophobicContact CG1-CB 3.77Å; V136-W142 HydrophobicContact CG1-CG 3.93Å; V136-W142 HydrophobicContact CG2-CD2 4.45Å; V136-W142 HydrophobicContact CG2-CG 4.32Å
137	N	47.6	Very low	57.6	Low	159 Å²	159	98.5 Å²	98.5	85%	0.85	51%	0.505	S	S	*	.	S	Bend	trans	-63.2	116.5	168.9	-72.5	-59.5	0	0	0	109.7
138	K	57.5	Low	58	Low	152 Å²	152	104 Å²	104	66%	0.661	51%	0.511	S	S	*	.	S	Bend	trans	70.8	68.8	-171.4	-48.1	-179	-174.1	178.2	0	114.3	V136 R140 D141 W142	V136-K138 PolarHBondContact O-N 3.03Å; K138-R140 VanDerWaalsContact C-N 3.26Å; K138-R140 PolarHBondContact O-N 3.2Å; K138-D141 HydrophobicContact CB-CB 4.25Å; K138-D141 WeakPolarHBondContact CB-OD2 3.41Å; K138-D141 VanDerWaalsContact CD-OD2 3.26Å; K138-D141 WeakPolarHBondContact CD-OD2 3.33Å; K138-D141 PolarHBondContact O-N 2.93Å; K138-D141 VanDerWaalsContact O-N 3.1Å; K138-W142 PolarHBondContact O-N 2.81Å
139	P	60.8	Low	58.4	Low	66 Å²	66	103.3 Å²	103.3	43%	0.429	51%	0.506	S	S	.	.	H	α-helix	trans	-64.4	-25.5	-176.6	26.8	-34.9	0	0	0	114	V136 Y143	V136-P139 WeakPolarHBondContact O-CD 3.15Å; P139-Y143 WeakPolarHBondContact O-CB 3.34Å; P139-Y143 PolarHBondContact O-N 2.84Å
140	R	55.3	Low	58.7	Low	212 Å²	212	106.5 Å²	106.5	80%	0.8	52%	0.52	S	S	*	.	H	α-helix	trans	-64.6	-39.3	173.6	-80	-178.9	171.1	152.9	-3.4	112.6	K138 R144	K138-R140 VanDerWaalsContact C-N 3.26Å; K138-R140 PolarHBondContact O-N 3.2Å; R140-R144 WeakPolarHBondContact O-CB 3.5Å; R140-R144 WeakPolarHBondContact O-CG 3.26Å; R140-R144 PolarHBondContact O-N 2.82Å
141	D	60.4	Low	58.9	Low	85 Å²	85	107.3 Å²	107.3	46%	0.455	52%	0.521	S	S	.	.	H	α-helix	trans	-76.2	-38.3	-178	-61.4	-28.6	0	0	0	110.8	K138 R144 S145	K138-D141 HydrophobicContact CB-CB 4.25Å; K138-D141 WeakPolarHBondContact CB-OD2 3.41Å; K138-D141 VanDerWaalsContact CD-OD2 3.26Å; K138-D141 WeakPolarHBondContact CD-OD2 3.33Å; K138-D141 PolarHBondContact O-N 2.93Å; K138-D141 VanDerWaalsContact O-N 3.1Å; D141-R144 PolarHBondContact O-N 3.14Å; D141-S145 WeakPolarHBondContact O-CB 3.06Å; D141-S145 PolarHBondContact O-N 2.84Å
142	W	63.7	Low	59.1	Low	42 Å²	42	113.5 Å²	113.5	16%	0.159	54%	0.542	C	S	.	.	H	α-helix	trans	-59.7	-47.7	170.4	178.8	86.7	0	0	0	112	I120 P129 V136 K138 R144 S145 M146	I120-W142 HydrophobicContact CG2-CZ2 4.48Å; P129-W142 HydrophobicContact CB-CH2 4.16Å; P129-W142 HydrophobicContact CB-CZ2 3.9Å; P129-W142 HydrophobicContact CG-CH2 3.6Å; P129-W142 HydrophobicContact CG-CZ2 3.8Å; V136-W142 HydrophobicContact CG1-CB 3.77Å; V136-W142 HydrophobicContact CG1-CG 3.93Å; V136-W142 HydrophobicContact CG2-CD2 4.45Å; V136-W142 HydrophobicContact CG2-CG 4.32Å; K138-W142 PolarHBondContact O-N 2.81Å; W142-R144 PolarHBondContact O-N 3.44Å; W142-S145 WeakPolarHBondContact O-CA 3.49Å; W142-S145 WeakPolarHBondContact O-CB 3.44Å; W142-S145 PolarHBondContact O-N 2.85Å; W142-M146 PolarHBondContact O-N 3.27Å
143	Y	62.5	Low	58.6	Low	120 Å²	120	118.3 Å²	118.3	47%	0.471	55%	0.552	S	S	.	*	H	α-helix	trans	-63.7	-40.2	178.1	-151.6	-86	0	0	0	111.7	P139 S145 M146 F147	P139-Y143 WeakPolarHBondContact O-CB 3.34Å; P139-Y143 PolarHBondContact O-N 2.84Å; Y143-S145 VanDerWaalsContact C-N 3.29Å; Y143-S145 PolarHBondContact O-N 3.37Å; Y143-M146 HydrophobicContact CD1-CE 4.44Å; Y143-M146 HydrophobicContact CD2-CE 4.03Å; Y143-M146 HydrophobicContact CE1-CE 4.24Å; Y143-M146 HydrophobicContact CE2-CE 3.82Å; Y143-M146 HydrophobicContact CG-CE 4.35Å; Y143-F147 WeakPolarHBondContact O-CB 3.45Å; Y143-F147 PolarHBondContact O-N 3.15Å
144	R	60.8	Low	58.4	Low	169 Å²	169	114.8 Å²	114.8	64%	0.638	56%	0.555	S	S	*	*	H	α-helix	trans	-63.1	-33	171.3	-75.4	178.7	-179.5	-79.9	3.8	112.5	R140 D141 W142 R148	R140-R144 WeakPolarHBondContact O-CB 3.5Å; R140-R144 WeakPolarHBondContact O-CG 3.26Å; R140-R144 PolarHBondContact O-N 2.82Å; D141-R144 PolarHBondContact O-N 3.14Å; W142-R144 PolarHBondContact O-N 3.44Å; R144-R148 WeakPolarHBondContact O-CB 3.5Å; R144-R148 VanDerWaalsContact O-CG 3.28Å; R144-R148 WeakPolarHBondContact O-CG 3.47Å; R144-R148 PolarHBondContact O-N 2.79Å; R144-R148 PolarHBondContact O-NE 2.88Å
145	S	63.7	Low	57.7	Low	57 Å²	57	117.8 Å²	117.8	40%	0.399	56%	0.556	S	S	.	*	H	α-helix	trans	-71.8	-50.2	176.2	-151.9	0	0	0	0	111.6	D141 W142 Y143 R148 Q149	D141-S145 WeakPolarHBondContact O-CB 3.06Å; D141-S145 PolarHBondContact O-N 2.84Å; W142-S145 WeakPolarHBondContact O-CA 3.49Å; W142-S145 WeakPolarHBondContact O-CB 3.44Å; W142-S145 PolarHBondContact O-N 2.85Å; Y143-S145 VanDerWaalsContact C-N 3.29Å; Y143-S145 PolarHBondContact O-N 3.37Å; S145-R148 PolarHBondContact O-N 3.15Å; S145-Q149 WeakPolarHBondContact O-CB 2.95Å; S145-Q149 PolarHBondContact O-N 2.98Å; S145-Q149 VanDerWaalsContact O-N 3.15Å
146	M	71.9	Confident	57.2	Low	44 Å²	44	123.1 Å²	123.1	22%	0.217	57%	0.573	C	S	.	*	H	α-helix	trans	-56.9	-51.9	176.4	178.6	-83.3	-76.1	0	0	111	W142 Y143 R148 Q149 I150	W142-M146 PolarHBondContact O-N 3.27Å; Y143-M146 HydrophobicContact CD1-CE 4.44Å; Y143-M146 HydrophobicContact CD2-CE 4.03Å; Y143-M146 HydrophobicContact CE1-CE 4.24Å; Y143-M146 HydrophobicContact CE2-CE 3.82Å; Y143-M146 HydrophobicContact CG-CE 4.35Å; M146-R148 PolarHBondContact O-N 3.29Å; M146-Q149 WeakPolarHBondContact O-CA 3.39Å; M146-Q149 WeakPolarHBondContact O-CB 3.36Å; M146-Q149 PolarHBondContact O-N 3.48Å; M146-I150 WeakPolarHBondContact O-CG1 3.28Å; M146-I150 PolarHBondContact O-N 3.49Å; M146-I150 HydrophobicContact SD-CD1 3.88Å; M146-I150 HydrophobicContact SD-CG1 4.04Å; M146-I150 HydrophobicContact SD-CG2 4.39Å
147	F	66.1	Low	56.2	Low	101 Å²	101	128.6 Å²	128.6	44%	0.443	60%	0.6	S	S	.	*	H	α-helix	trans	-59	-42.3	-179.6	-172	-98	0	0	0	112.9	Y143 Q149 I150 H151	Y143-F147 WeakPolarHBondContact O-CB 3.45Å; Y143-F147 PolarHBondContact O-N 3.15Å; F147-Q149 PolarHBondContact O-N 3.11Å; F147-I150 HydrophobicContact CD2-CD1 4.42Å; F147-I150 WeakPolarHBondContact O-CG1 3.26Å; F147-H151 AromaticContact CE1-ND1 3.87Å; F147-H151 AromaticContact CE2-CE1 3.45Å; F147-H151 VanDerWaalsContact CE2-CE1 3.45Å; F147-H151 WeakPolarHBondContact CE2-CE1 3.12Å; F147-H151 AromaticContact CE2-ND1 3.84Å; F147-H151 AromaticContact CE2-NE2 3.78Å; F147-H151 AromaticContact CZ-CE1 3.41Å; F147-H151 VanDerWaalsContact CZ-CE1 3.41Å; F147-H151 WeakPolarHBondContact CZ-CE1 3.41Å; F147-H151 AromaticContact CZ-ND1 3.43Å; F147-H151 WeakPolarHBondContact CZ-ND1 3.34Å; F147-H151 WeakPolarHBondContact O-CB 3.41Å; F147-H151 PolarHBondContact O-N 2.69Å
148	R	66.4	Low	55.8	Low	163 Å²	163	129.5 Å²	129.5	62%	0.615	60%	0.599	S	S	*	*	H	α-helix	trans	-67	-19.2	174.4	-76.6	177.7	-63.5	-174.8	4.4	113.6	R144 S145 M146 K152	R144-R148 WeakPolarHBondContact O-CB 3.5Å; R144-R148 VanDerWaalsContact O-CG 3.28Å; R144-R148 WeakPolarHBondContact O-CG 3.47Å; R144-R148 PolarHBondContact O-N 2.79Å; R144-R148 PolarHBondContact O-NE 2.88Å; S145-R148 PolarHBondContact O-N 3.15Å; M146-R148 PolarHBondContact O-N 3.29Å; R148-K152 WeakPolarHBondContact O-CB 3.41Å; R148-K152 PolarHBondContact O-N 2.85Å
149	Q	60	Low	54.5	Low	101 Å²	101	130 Å²	130	47%	0.472	61%	0.609	S	S	.	*	H	α-helix	trans	-92.7	-36.9	-179.6	-167.9	151.3	4.8	0	0	112.2	F117 S145 M146 F147	F117-Q149 HydrophobicContact CE1-CG 4.13Å; S145-Q149 WeakPolarHBondContact O-CB 2.95Å; S145-Q149 PolarHBondContact O-N 2.98Å; S145-Q149 VanDerWaalsContact O-N 3.15Å; M146-Q149 WeakPolarHBondContact O-CA 3.39Å; M146-Q149 WeakPolarHBondContact O-CB 3.36Å; M146-Q149 PolarHBondContact O-N 3.48Å; F147-Q149 PolarHBondContact O-N 3.11Å
150	I	63.3	Low	53	Low	112 Å²	112	132 Å²	132	57%	0.574	63%	0.625	S	S	*	*	H	α-helix	trans	-72.4	-29.6	171.1	55.6	158.3	0	0	0	112.9	M146 F147	M146-I150 WeakPolarHBondContact O-CG1 3.28Å; M146-I150 PolarHBondContact O-N 3.49Å; M146-I150 HydrophobicContact SD-CD1 3.88Å; M146-I150 HydrophobicContact SD-CG1 4.04Å; M146-I150 HydrophobicContact SD-CG2 4.39Å; F147-I150 HydrophobicContact CD2-CD1 4.42Å; F147-I150 WeakPolarHBondContact O-CG1 3.26Å
151	H	59.6	Low	51.9	Low	124 Å²	124	128.9 Å²	128.9	57%	0.574	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	12.2	177.3	-71	-153.4	0	0	0	113.3	F147 K153	F147-H151 AromaticContact CE1-ND1 3.87Å; F147-H151 AromaticContact CE2-CE1 3.45Å; F147-H151 VanDerWaalsContact CE2-CE1 3.45Å; F147-H151 WeakPolarHBondContact CE2-CE1 3.12Å; F147-H151 AromaticContact CE2-ND1 3.84Å; F147-H151 AromaticContact CE2-NE2 3.78Å; F147-H151 AromaticContact CZ-CE1 3.41Å; F147-H151 VanDerWaalsContact CZ-CE1 3.41Å; F147-H151 WeakPolarHBondContact CZ-CE1 3.41Å; F147-H151 AromaticContact CZ-ND1 3.43Å; F147-H151 WeakPolarHBondContact CZ-ND1 3.34Å; F147-H151 WeakPolarHBondContact O-CB 3.41Å; F147-H151 PolarHBondContact O-N 2.69Å; H151-K153 PolarHBondContact O-N 3.18Å; H151-K153 VanDerWaalsContact O-N 3.15Å
152	K	61.6	Low	50.3	Low	161 Å²	161	133.7 Å²	133.7	70%	0.7	63%	0.631	S	S	*	*			trans	-77.5	100.8	173.4	-152.3	-171.7	-178.2	-154.7	0	108.8	R148	R148-K152 WeakPolarHBondContact O-CB 3.41Å; R148-K152 PolarHBondContact O-N 2.85Å
153	K	39.3	Very low	48.3	Very low	186 Å²	186	143 Å²	143	81%	0.809	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-52.6	140.9	172	-71.3	-170.5	175.4	-171.9	0	109.9	H151 E155	H151-K153 PolarHBondContact O-N 3.18Å; H151-K153 VanDerWaalsContact O-N 3.15Å; K153-E155 PolarHBondContact O-N 2.85Å
154	P	47.1	Very low	46.6	Very low	124 Å²	124	142.4 Å²	142.4	81%	0.805	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-61.1	136.8	163.2	28.7	-33	0	0	0	108.6
155	E	37.7	Very low	45.9	Very low	178 Å²	178	140 Å²	140	83%	0.832	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-75.5	138.9	177.8	-152.5	160.4	157.5	0	0	108.6	K153 L157	K153-E155 PolarHBondContact O-N 2.85Å; E155-L157 PolarHBondContact O-N 2.91Å
156	E	40	Very low	44.2	Very low	187 Å²	187	144.2 Å²	144.2	87%	0.874	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-67.6	121.5	-175.2	-70.7	168.9	130.4	0	0	110
157	L	34.6	Very low	42.1	Very low	158 Å²	158	151 Å²	151	83%	0.827	72%	0.723	S	S	*	*			trans	-97.7	96	168.5	-152.1	170.8	0	0	0	106.4	E155 D159	E155-L157 PolarHBondContact O-N 2.91Å; L157-D159 PolarHBondContact O-N 3.31Å
158	E	38.6	Very low	40.4	Very low	177 Å²	177	152.2 Å²	152.2	83%	0.827	73%	0.733	S	S	*	*			trans	-61.2	129.4	171.5	-68.3	-160.7	138.6	0	0	109.8
159	D	31	Very low	38.7	Very low	163 Å²	163	152.5 Å²	152.5	87%	0.872	74%	0.741	S	S	*	*			trans	-141.4	141.7	144.9	-126.3	-30.7	0	0	0	108.4	L157	L157-D159 PolarHBondContact O-N 3.31Å
160	S	30.6	Very low	37.2	Very low	109 Å²	109	152.2 Å²	152.2	76%	0.762	75%	0.751	S	S	*	*			trans	-112.7	-176.5	-158.1	-162.4	0	0	0	0	113.2
161	E	30.9	Very low	35.4	Very low	145 Å²	145	152.3 Å²	152.3	68%	0.678	76%	0.761	S	S	*	*			trans	71	106.1	174.2	-58.8	-138.9	105.1	0	0	115.9
162	R	27.7	Very low	34	Very low	186 Å²	186	151 Å²	151	70%	0.702	77%	0.771	S	S	*	*				93.7	102.9	61.3	174.6	-160.8	-128.6	178.2	-5.3	111.9
163	W	21.9	Very low	32.6	Very low	237 Å²	237	150 Å²	150	90%	0.898	77%	0.769	S	S	*	*				-169.3	148.2	125.6	-104.5	-61.1	0	0	0	113.3
164	S	25.3	Very low	32.1	Very low	108 Å²	108	150 Å²	150	76%	0.755	76%	0.764	S	S	*	*			trans	-173.5	169.6	175.6	-70.7	0	0	0	0	106.9
165	P	47.2	Very low	31.3	Very low	118 Å²	118	151.4 Å²	151.4	77%	0.766	76%	0.76	S	S	*	*			cis	-127.7	-142.2	-7.8	36.8	-16.5	0	0	0	112.3
166	E	27.7	Very low	30.8	Very low	146 Å²	146	152 Å²	152	68%	0.682	76%	0.76	S	S	*	*			trans	96.8	138.8	162.7	-53.7	-133.7	93.3	0	0	117.8
167	R	27.5	Very low	30.2	Very low	187 Å²	187	150.3 Å²	150.3	71%	0.706	76%	0.755	S	S	*	*			cis	-170.9	138	-6.2	161.9	-174.7	-75.6	-129.4	3.8	113.2
168	L	31.2	Very low	30	Very low	127 Å²	127	148.6 Å²	148.6	67%	0.665	75%	0.751	S	S	*	*			trans	67.3	125.1	162.6	-61	166.1	0	0	0	120
169	Q	30.8	Very low	29.6	Very low	169 Å²	169	148.4 Å²	148.4	79%	0.79	75%	0.75	S	S	*	*				95.7	153.4	91.7	-81.6	-179.3	-19.1	0	0	114.9
170	S	27.2	Very low	29.6	Very low	95 Å²	95	146 Å²	146	66%	0.664	74%	0.737	S	S	*	*			cis	-166.2	160.9	-0.7	44.1	0	0	0	0	113.7
171	S	27	Very low	29.9	Very low	114 Å²	114	148.5 Å²	148.5	80%	0.797	73%	0.734	S	S	*	*			trans	67.7	128.6	157.6	-57.2	0	0	0	0	119.4
172	A	30.3	Very low	30.1	Very low	95 Å²	95	149.4 Å²	149.4	79%	0.785	74%	0.744	S	S	*	*				78.7	144.2	68	0	0	0	0	0	113.1
173	E	30.3	Very low	30.8	Very low	142 Å²	142	147 Å²	147	66%	0.664	75%	0.745	S	S	*	*			cis	-173.8	148.6	38.5	163.8	171.1	-171.1	0	0	112.9
174	R	29.5	Very low	31.5	Very low	185 Å²	185	145.2 Å²	145.2	70%	0.698	74%	0.743	S	S	*	*			trans	67.6	152.3	148.4	-171.2	-179.5	-60.1	-109.7	14.8	120.4
175	E	29.7	Very low	32.1	Very low	154 Å²	154	151.4 Å²	151.4	72%	0.72	75%	0.75	S	S	*	*			cis	-143.9	177.4	-1	-138	140.8	-134.3	0	0	114.9
176	K	28.2	Very low	31.8	Very low	191 Å²	191	151.4 Å²	151.4	83%	0.83	74%	0.743	S	S	*	*			trans	-60.1	177.1	170.6	-95.8	173.6	169.1	178.8	0	114.9
177	I	27.7	Very low	32.4	Very low	151 Å²	151	148.5 Å²	148.5	77%	0.774	74%	0.735	S	S	*	*			cis	-144.1	160.4	13.7	-25.9	158.7	0	0	0	107.6
178	V	29.5	Very low	33.2	Very low	121 Å²	121	145.5 Å²	145.5	73%	0.733	74%	0.74	S	S	*	*				-178.1	162.7	79.8	173.8	0	0	0	0	108.5
179	E	30.8	Very low	33.7	Very low	174 Å²	174	149.4 Å²	149.4	81%	0.813	75%	0.747	S	S	*	*			trans	-55.7	167.5	171.6	-63.1	148.4	160.2	0	0	113.2
180	D	31.1	Very low	34.4	Very low	113 Å²	113	144.8 Å²	144.8	60%	0.604	75%	0.746	S	S	*	*			cis	-166.6	168.8	40.2	-164.6	3.6	0	0	0	112.7
181	K	36.5	Very low	35.4	Very low	160 Å²	160	143.9 Å²	143.9	70%	0.696	74%	0.739	S	S	*	*			trans	15.9	118.3	168.6	-69.3	138	-158.8	145.1	0	119.7
182	N	36.2	Very low	36	Very low	164 Å²	164	145.5 Å²	145.5	88%	0.877	74%	0.738	S	S	*	*				-164.2	119	111	-102.7	-66.3	0	0	0	111.3
183	L	40.3	Very low	36.7	Very low	137 Å²	137	145.2 Å²	145.2	72%	0.717	73%	0.728	S	S	*	*			trans	-78.6	164.2	166.7	-155.6	67.8	0	0	0	109.1
184	F	38.2	Very low	37.3	Very low	198 Å²	198	144.8 Å²	144.8	87%	0.868	73%	0.731	S	S	*	*			trans	68.6	74.6	-179.4	-45.9	-73.2	0	0	0	116.2
185	R	36.3	Very low	37.9	Very low	238 Å²	238	147.4 Å²	147.4	90%	0.898	74%	0.741	S	S	*	*			trans	-137	121.4	153.8	-173.5	171.8	178.7	173	1.3	111.1
186	L	41.1	Very low	38.7	Very low	118 Å²	118	144.3 Å²	144.3	62%	0.618	74%	0.736	S	S	*	*			trans	-67.6	148.5	171.9	-67.4	167.4	0	0	0	110.8
187	T	42	Very low	39.2	Very low	85 Å²	85	144.1 Å²	144.1	52%	0.521	74%	0.738	S	S	.	*			trans	-75.5	159.9	175.3	61.1	0	0	0	0	111.1	Y189 G190	T187-Y189 PolarHBondContact O-N 2.84Å; T187-G190 PolarHBondContact O-N 3.24Å
188	P	42.5	Very low	39.8	Very low	124 Å²	124	144.2 Å²	144.2	81%	0.805	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	2	-174.6	-23.4	35.5	0	0	0	116.6
189	Y	41.4	Very low	40.4	Very low	209 Å²	209	145 Å²	145	82%	0.82	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.1	24.6	-176	-64.8	-75.4	0	0	0	113.4	T187 S191	T187-Y189 PolarHBondContact O-N 2.84Å; Y189-S191 PolarHBondContact O-N 3.28Å
190	G	45.8	Very low	40.9	Very low	73 Å²	73	144 Å²	144	75%	0.753	75%	0.745	S	S	*	*			trans	70.9	2.2	163	0	0	0	0	0	117.2	T187	T187-G190 PolarHBondContact O-N 3.24Å
191	S	48.2	Very low	41.3	Very low	76 Å²	76	147.7 Å²	147.7	53%	0.531	76%	0.756	S	S	.	*	P	Polyproline II helix	trans	-91.5	141.8	-178.7	-59.3	0	0	0	0	113.1	Y189	Y189-S191 PolarHBondContact O-N 3.28Å
192	L	40.6	Very low	41.1	Very low	148 Å²	148	148.1 Å²	148.1	78%	0.775	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-69.8	147	168.3	-146.3	71.8	0	0	0	109.9
193	P	44	Very low	41.1	Very low	89 Å²	89	146.1 Å²	146.1	58%	0.578	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-62.6	138.1	170.3	-21.9	34.1	0	0	0	111.6
194	D	43.3	Very low	40.7	Very low	133 Å²	133	147 Å²	147	71%	0.711	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-71.1	141.7	169	-163.1	-22	0	0	0	109.6	S196	D194-S196 VanDerWaalsContact OD1-CB 3.26Å; D194-S196 WeakPolarHBondContact OD1-CB 3.38Å; D194-S196 PolarHBondContact OD1-N 3.27Å; D194-S196 VanDerWaalsContact OD1-N 3.16Å; D194-S196 PolarHBondContact OD1-OG 3.08Å
195	W	43.2	Very low	41	Very low	240 Å²	240	143.2 Å²	143.2	91%	0.909	76%	0.764	S	S	*	*			trans	-113.5	23.1	-175.5	-92.4	81.7	0	0	0	112.4
196	S	44.8	Very low	40.7	Very low	88 Å²	88	135.4 Å²	135.4	62%	0.615	76%	0.757	S	S	*	*			trans	-102.7	-2.9	-169.6	-49.4	0	0	0	0	115.8	D194	D194-S196 VanDerWaalsContact OD1-CB 3.26Å; D194-S196 WeakPolarHBondContact OD1-CB 3.38Å; D194-S196 PolarHBondContact OD1-N 3.27Å; D194-S196 VanDerWaalsContact OD1-N 3.16Å; D194-S196 PolarHBondContact OD1-OG 3.08Å
197	E	39.9	Very low	40.5	Very low	188 Å²	188	139.1 Å²	139.1	88%	0.879	77%	0.769	S	S	*	*	S	Bend	trans	-128.2	49.8	-171.6	-64.8	-164.3	144	0	0	115.2
198	D	40.4	Very low	39.9	Very low	152 Å²	152	143.6 Å²	143.6	81%	0.813	78%	0.784	S	S	*	*	S	Bend	trans	-155.2	35	164.1	-134	-8.8	0	0	0	115.5
199	V	42.2	Very low	39.2	Very low	139 Å²	139	145.7 Å²	145.7	84%	0.842	78%	0.783	S	S	*	*	S	Bend	trans	-111	22.4	-178.1	-64.1	0	0	0	0	114.7
200	D	41.4	Very low	39.1	Very low	152 Å²	152	141.7 Å²	141.7	81%	0.813	78%	0.782	S	S	*	*	S	Bend	trans	-140.8	44.1	-174.9	-137.2	-23.3	0	0	0	114.5
201	K	39.6	Very low	38.5	Very low	191 Å²	191	146.7 Å²	146.7	83%	0.83	79%	0.786	S	S	*	*			trans	-164.8	81.5	170	-110.3	157.4	-159.8	-57.8	0	114.3
202	L	32.6	Very low	38	Very low	168 Å²	168	149.4 Å²	149.4	88%	0.88	80%	0.802	S	S	*	*			trans	-165.5	98.9	152	-110.9	162.1	0	0	0	111.8
203	S	34.6	Very low	38.3	Very low	122 Å²	122	151.6 Å²	151.6	85%	0.853	81%	0.805	S	S	*	*			trans	-138.4	90.2	172.3	-65.8	0	0	0	0	110.1
204	D	33.5	Very low	38.4	Very low	157 Å²	157	151.8 Å²	151.8	84%	0.84	81%	0.808	S	S	*	*			trans	-170	165.7	130.8	-118.7	11	0	0	0	110.8
205	P	43.5	Very low	38.5	Very low	118 Å²	118	152.9 Å²	152.9	77%	0.766	81%	0.813	S	S	*	*			trans	-108.9	143.6	-149.2	38.6	-35	0	0	0	115.8
206	G	30.9	Very low	38.7	Very low	73 Å²	73	150 Å²	150	75%	0.753	81%	0.807	S	S	*	*			trans	-168.4	97.8	173.5	0	0	0	0	0	117.1
207	K	35.5	Very low	38.7	Very low	197 Å²	197	152.8 Å²	152.8	86%	0.857	82%	0.815	S	S	*	*			trans	57.4	118.1	154.2	-58.6	177.1	-180	176.8	0	119.6
208	Q	29.6	Very low	38.5	Very low	178 Å²	178	152.9 Å²	152.9	83%	0.832	81%	0.813	S	S	*	*			trans	55.8	133.9	135.2	-62.2	-177.6	-14.9	0	0	119.1
209	Q	28.9	Very low	38.8	Very low	168 Å²	168	154.6 Å²	154.6	79%	0.785	82%	0.816	S	S	*	*			cis	-138.2	164.2	17.7	-72.2	-171	-8.4	0	0	111.6
210	P	37.6	Very low	38.6	Very low	126 Å²	126	153.3 Å²	153.3	82%	0.818	81%	0.81	S	S	*	*			trans	-74.1	135.6	172.8	30.9	-35	0	0	0	112.5
211	Q	33.6	Very low	38	Very low	177 Å²	177	151.8 Å²	151.8	83%	0.827	80%	0.802	S	S	*	*			trans	-120.3	146.5	158.5	-70.3	-173.2	-6	0	0	108.7
212	P	37.3	Very low	37.7	Very low	133 Å²	133	153.1 Å²	153.1	86%	0.864	80%	0.802	S	S	*	*			trans	-71.2	154	-170	28.5	-35.1	0	0	0	113
213	K	46.9	Very low	37.5	Very low	195 Å²	195	150.3 Å²	150.3	85%	0.848	80%	0.797	S	S	*	*			trans	-99.9	155.2	170.9	-62.6	179.3	179.6	-178.6	0	109.5
214	S	46	Very low	37.2	Very low	92 Å²	92	150 Å²	150	64%	0.643	80%	0.795	S	S	*	*			trans	72.7	151.1	175.5	-158.1	0	0	0	0	115.7
215	I	46.3	Very low	37	Very low	156 Å²	156	146.4 Å²	146.4	80%	0.8	79%	0.787	S	S	*	*	S	Bend	trans	-104.5	3.1	-179.5	-167.7	163	0	0	0	112.1
216	F	47.1	Very low	36.2	Very low	181 Å²	181	145.7 Å²	145.7	79%	0.794	78%	0.784	S	S	*	*			trans	-92.3	-7.2	-168.4	-85.2	-82.3	0	0	0	115.8
217	D	45.3	Very low	36.1	Very low	146 Å²	146	148.5 Å²	148.5	78%	0.781	79%	0.787	S	S	*	*			trans	-109.6	67.8	-177.7	-62	-58.1	0	0	0	111.6
218	F	35.4	Very low	35.8	Very low	189 Å²	189	144.1 Å²	144.1	83%	0.829	78%	0.781	S	S	*	*			trans	-141.4	90.5	172.6	-141.3	-88.4	0	0	0	113.1
219	E	46.2	Very low	35.6	Very low	188 Å²	188	142.9 Å²	142.9	88%	0.879	78%	0.78	S	S	*	*			trans	-95.9	130	171.9	-171.2	171.8	-137.5	0	0	109.9
220	P	38.3	Very low	35.7	Very low	112 Å²	112	139 Å²	139	73%	0.727	77%	0.772	S	S	*	*			trans	-102	90.1	-164.4	37.3	-35.1	0	0	0	115.1
221	D	30.1	Very low	35.4	Very low	121 Å²	121	141.3 Å²	141.3	65%	0.647	77%	0.771	S	S	*	*			trans	-154.9	158	153.8	-158.5	11.6	0	0	0	114.2
222	R	33.2	Very low	35.2	Very low	219 Å²	219	138.3 Å²	138.3	83%	0.826	77%	0.765	S	S	*	*			trans	74.8	121.4	161.1	-47.1	-156.4	176.5	-146.7	-15.8	120.5
223	S	27	Very low	34.9	Very low	109 Å²	109	139.2 Å²	139.2	76%	0.762	76%	0.757	S	S	*	*			trans	-101.2	156.8	168.5	53.6	0	0	0	0	112.6
224	S	28.8	Very low	34.1	Very low	116 Å²	116	136.7 Å²	136.7	81%	0.811	75%	0.752	S	S	*	*			trans	93.8	149	151.1	82.3	0	0	0	0	121.5
225	A	28.6	Very low	33.2	Very low	81 Å²	81	137.2 Å²	137.2	67%	0.669	76%	0.756	S	S	*	*			trans	77.4	81	151.7	0	0	0	0	0	121.7
226	S	27.9	Very low	32.7	Very low	103 Å²	103	139.1 Å²	139.1	72%	0.72	76%	0.761	S	S	*	*				64.5	131.3	111.4	69.2	0	0	0	0	123.8
227	V	29.2	Very low	31.7	Very low	132 Å²	132	140.2 Å²	140.2	80%	0.8	77%	0.766	S	S	*	*			trans	91.3	122.5	131.2	163.6	0	0	0	0	121.1
228	S	27.8	Very low	31.2	Very low	105 Å²	105	144.8 Å²	144.8	73%	0.734	77%	0.772	S	S	*	*			trans	76.1	102.5	149	-77.4	0	0	0	0	123.9
229	N	26.1	Very low	30.8	Very low	151 Å²	151	143.8 Å²	143.8	81%	0.807	77%	0.77	S	S	*	*				98.2	159.9	106.2	-158.7	25.9	0	0	0	120.1
230	S	30.3	Very low	30.4	Very low	88 Å²	88	140 Å²	140	62%	0.615	76%	0.762	S	S	*	*			trans	74.8	88.9	165.2	42	0	0	0	0	121.4
231	Q	33.1	Very low	30.2	Very low	174 Å²	174	144.1 Å²	144.1	81%	0.813	77%	0.771	S	S	*	*				85.1	123.4	105.8	-112.9	178.3	-39.3	0	0	123.8
232	V	29.5	Very low	30.3	Very low	114 Å²	114	147.4 Å²	147.4	69%	0.691	78%	0.78	S	S	*	*			trans	70.4	136.9	142.6	-79.2	0	0	0	0	126.7
233	H	29.5	Very low	30.7	Very low	152 Å²	152	142.7 Å²	142.7	70%	0.704	78%	0.778	S	S	*	*			trans	91.1	90.9	138.7	-89.7	78.2	0	0	0	122.8
234	L	30.3	Very low	31.4	Very low	142 Å²	142	144 Å²	144	74%	0.743	78%	0.781	S	S	*	*				59.6	130.7	114.2	-99.4	72	0	0	0	123.3
235	S	28.1	Very low	32.2	Very low	102 Å²	102	143 Å²	143	71%	0.713	78%	0.775	S	S	*	*			trans	104	94.1	132.7	-65.5	0	0	0	0	121.2
236	Q	35.2	Very low	33.5	Very low	196 Å²	196	143.7 Å²	143.7	92%	0.916	77%	0.772	S	S	*	*			trans	10.5	134.6	138.7	-62.5	179.9	-25.9	0	0	120.7
237	K	25.5	Very low	35.6	Very low	205 Å²	205	142.3 Å²	142.3	89%	0.891	76%	0.762	S	S	*	*			trans	-143.2	114.6	143.9	-168	176.5	-176.8	-179.4	0	110.6
238	R	34.3	Very low	37.9	Very low	241 Å²	241	142.5 Å²	142.5	91%	0.909	76%	0.757	S	S	*	*			trans	-86	144.6	168.5	-84.6	-175.1	171.5	-175.3	-2.9	110.3
239	Q	28	Very low	40.3	Very low	168 Å²	168	143.4 Å²	143.4	79%	0.785	75%	0.75	S	S	*	*			trans	173.8	154.9	156	-98.1	-64.5	-15.9	0	0	107.9
240	P	37.2	Very low	42.7	Very low	109 Å²	109	138.2 Å²	138.2	71%	0.708	73%	0.728	S	S	*	*				-97.4	178.9	-77.7	35.2	-23	0	0	0	112.8
241	E	34	Very low	45.4	Very low	199 Å²	199	137 Å²	137	93%	0.93	72%	0.719	S	S	*	*			trans	-71.8	143.9	174.6	-63.7	-169.9	148.6	0	0	112.7
242	K	34	Very low	47.9	Very low	189 Å²	189	133.1 Å²	133.1	82%	0.822	70%	0.704	S	S	*	*			trans	-108	137	172.9	-173.7	-179.3	-178.6	-175.7	0	107.2	T244	K242-T244 PolarHBondContact O-N 3.37Å
243	P	40.5	Very low	50.6	Low	121 Å²	121	133.1 Å²	133.1	79%	0.786	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-56.8	135.2	-175.2	22.4	-34.1	0	0	0	111.3	S245	P243-S245 PolarHBondContact O-N 3.32Å
244	T	40.8	Very low	53.5	Low	135 Å²	135	129.6 Å²	129.6	83%	0.828	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-52.3	128.3	-179.9	-42.2	0	0	0	0	110	K242	K242-T244 PolarHBondContact O-N 3.37Å
245	S	46.8	Very low	56.4	Low	97 Å²	97	127.3 Å²	127.3	68%	0.678	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-54.8	141.8	168.9	47	0	0	0	0	109.6	P243 S247	P243-S245 PolarHBondContact O-N 3.32Å; S245-S247 PolarHBondContact O-N 3.18Å
246	P	56.5	Low	59.5	Low	94 Å²	94	128.2 Å²	128.2	61%	0.61	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-53.7	144	173.8	24.7	-34	0	0	0	109.6	A250	P246-A250 HydrophobicContact CB-CB 4.31Å
247	S	71.7	Confident	62	Low	74 Å²	74	122.3 Å²	122.3	52%	0.517	65%	0.651	S	S	.	*	P	Polyproline II helix	trans	-51.9	146.2	174.8	-178.3	0	0	0	0	109.8	S245 E249 A250 S251	S245-S247 PolarHBondContact O-N 3.18Å; S247-E249 PolarHBondContact O-N 2.87Å; S247-E249 VanDerWaalsContact O-N 3.14Å; S247-A250 WeakPolarHBondContact O-CA 3.43Å; S247-A250 WeakPolarHBondContact O-CB 3.39Å; S247-A250 PolarHBondContact O-N 2.76Å; S247-S251 PolarHBondContact O-N 3.08Å
248	I	76.2	Confident	65.3	Low	136 Å²	136	118.6 Å²	118.6	70%	0.697	64%	0.637	S	S	*	*	H	α-helix	trans	-52.9	-38.9	177.7	-62.4	170.7	0	0	0	109.9	S251 L252	I248-S251 WeakPolarHBondContact O-CB 3.18Å; I248-S251 PolarHBondContact O-N 3.18Å; I248-L252 HydrophobicContact CG2-CD1 4.01Å; I248-L252 HydrophobicContact CG2-CG 4.47Å; I248-L252 VanDerWaalsContact O-CG 3.31Å; I248-L252 WeakPolarHBondContact O-CG 3.5Å; I248-L252 PolarHBondContact O-N 2.7Å
249	E	78.3	Confident	68.1	Low	125 Å²	125	111.9 Å²	111.9	58%	0.584	61%	0.614	S	S	*	*	H	α-helix	trans	-58	-45.6	172.6	-177.6	179.2	-168.7	0	0	113.4	S247 S251 L252 Q253	S247-E249 PolarHBondContact O-N 2.87Å; S247-E249 VanDerWaalsContact O-N 3.14Å; E249-S251 VanDerWaalsContact C-N 3.34Å; E249-L252 PolarHBondContact O-N 2.83Å; E249-Q253 WeakPolarHBondContact O-CB 3.33Å; E249-Q253 VanDerWaalsContact O-CG 3.28Å; E249-Q253 WeakPolarHBondContact O-CG 3.48Å; E249-Q253 PolarHBondContact O-N 3.27Å; E249-Q253 PolarHBondContact OE1-NE2 3.19Å
250	A	76.7	Confident	71	Confident	42 Å²	42	110.3 Å²	110.3	35%	0.347	61%	0.607	S	S	.	*	H	α-helix	trans	-69.7	-31.7	178.2	0	0	0	0	0	112.2	P246 S247 S254	P246-A250 HydrophobicContact CB-CB 4.31Å; S247-A250 WeakPolarHBondContact O-CA 3.43Å; S247-A250 WeakPolarHBondContact O-CB 3.39Å; S247-A250 PolarHBondContact O-N 2.76Å; A250-S254 WeakPolarHBondContact O-CB 3.48Å; A250-S254 PolarHBondContact O-N 3.1Å
251	S	86.9	Confident	73.5	Confident	62 Å²	62	107.8 Å²	107.8	43%	0.434	60%	0.595	S	S	.	*	H	α-helix	trans	-65	-47.9	171.1	-163.7	0	0	0	0	110.9	S247 I248 E249 S254 E255	S247-S251 PolarHBondContact O-N 3.08Å; I248-S251 WeakPolarHBondContact O-CB 3.18Å; I248-S251 PolarHBondContact O-N 3.18Å; E249-S251 VanDerWaalsContact C-N 3.34Å; S251-S254 PolarHBondContact O-N 3.02Å; S251-E255 WeakPolarHBondContact O-CB 3.39Å; S251-E255 PolarHBondContact O-N 3.44Å
252	L	85.1	Confident	76.4	Confident	92 Å²	92	104 Å²	104	48%	0.482	58%	0.577	S	S	.	*	H	α-helix	trans	-64.3	-39	177.8	-69.8	168.5	0	0	0	112.3	I248 E249 E255 L256	I248-L252 HydrophobicContact CG2-CD1 4.01Å; I248-L252 HydrophobicContact CG2-CG 4.47Å; I248-L252 VanDerWaalsContact O-CG 3.31Å; I248-L252 WeakPolarHBondContact O-CG 3.5Å; I248-L252 PolarHBondContact O-N 2.7Å; E249-L252 PolarHBondContact O-N 2.83Å; L252-E255 PolarHBondContact O-N 3.4Å; L252-L256 WeakPolarHBondContact O-CB 3.4Å; L252-L256 VanDerWaalsContact O-CG 3.28Å; L252-L256 WeakPolarHBondContact O-CG 3.28Å; L252-L256 PolarHBondContact O-N 3.02Å
253	Q	86.6	Confident	79.2	Confident	115 Å²	115	99.7 Å²	99.7	54%	0.537	56%	0.563	S	S	.	*	H	α-helix	trans	-64.5	-40	173.8	-74.6	173.2	6	0	0	111.9	E249 S257	E249-Q253 WeakPolarHBondContact O-CB 3.33Å; E249-Q253 VanDerWaalsContact O-CG 3.28Å; E249-Q253 WeakPolarHBondContact O-CG 3.48Å; E249-Q253 PolarHBondContact O-N 3.27Å; E249-Q253 PolarHBondContact OE1-NE2 3.19Å; Q253-S257 WeakPolarHBondContact O-CB 3.44Å; Q253-S257 PolarHBondContact O-N 2.91Å
254	S	89.9	Confident	81.6	Confident	77 Å²	77	98.5 Å²	98.5	54%	0.538	55%	0.55	S	S	.	.	H	α-helix	trans	-65.6	-38.5	174.2	-169.4	0	0	0	0	112.3	A250 S251 Q258	A250-S254 WeakPolarHBondContact O-CB 3.48Å; A250-S254 PolarHBondContact O-N 3.1Å; S251-S254 PolarHBondContact O-N 3.02Å; S254-Q258 WeakPolarHBondContact O-CB 3.44Å; S254-Q258 PolarHBondContact O-N 2.93Å
255	E	92	Very high	84.1	Confident	94 Å²	94	95.8 Å²	95.8	44%	0.439	54%	0.537	S	S	.	.	H	α-helix	trans	-69.7	-43.3	178.5	-161.7	-179.1	163.1	0	0	111.5	S251 L252 S257 Q258 F259	S251-E255 WeakPolarHBondContact O-CB 3.39Å; S251-E255 PolarHBondContact O-N 3.44Å; L252-E255 PolarHBondContact O-N 3.4Å; E255-S257 PolarHBondContact O-N 2.97Å; E255-Q258 WeakPolarHBondContact O-CB 3.21Å; E255-Q258 PolarHBondContact O-N 2.86Å; E255-F259 HydrophobicContact CG-CD2 4.21Å; E255-F259 HydrophobicContact CG-CE2 3.72Å; E255-F259 HydrophobicContact CG-CZ 4.5Å; E255-F259 WeakPolarHBondContact O-CD2 3.29Å; E255-F259 PolarHBondContact O-N 2.9Å
256	L	92.4	Very high	86.4	Confident	122 Å²	122	96.8 Å²	96.8	64%	0.639	53%	0.531	S	S	*	.	H	α-helix	trans	-59.7	-44.7	171.9	-74.3	168.7	0	0	0	112	L252 Q258 F259 E260	L252-L256 WeakPolarHBondContact O-CB 3.4Å; L252-L256 VanDerWaalsContact O-CG 3.28Å; L252-L256 WeakPolarHBondContact O-CG 3.28Å; L252-L256 PolarHBondContact O-N 3.02Å; L256-Q258 VanDerWaalsContact C-N 3.31Å; L256-Q258 PolarHBondContact O-N 2.88Å; L256-F259 PolarHBondContact O-N 3.43Å; L256-E260 PolarHBondContact O-N 3.27Å
257	S	89.2	Confident	88.2	Confident	72 Å²	72	96.3 Å²	96.3	50%	0.503	52%	0.522	S	S	.	.	H	α-helix	trans	-65.6	-34.8	177.7	-170.2	0	0	0	0	112.2	Q253 E255 E260 A261	Q253-S257 WeakPolarHBondContact O-CB 3.44Å; Q253-S257 PolarHBondContact O-N 2.91Å; E255-S257 PolarHBondContact O-N 2.97Å; S257-E260 PolarHBondContact O-N 2.94Å; S257-A261 PolarHBondContact O-N 3.34Å; S257-A261 VanDerWaalsContact O-N 3.09Å
258	Q	93.3	Very high	89.2	Confident	127 Å²	127	97 Å²	97	59%	0.593	52%	0.517	S	S	*	.	H	α-helix	trans	-64.5	-45.5	173	-180	175.9	-22.6	0	0	111.6	S254 E255 L256 A261 E262	S254-Q258 WeakPolarHBondContact O-CB 3.44Å; S254-Q258 PolarHBondContact O-N 2.93Å; E255-Q258 WeakPolarHBondContact O-CB 3.21Å; E255-Q258 PolarHBondContact O-N 2.86Å; L256-Q258 VanDerWaalsContact C-N 3.31Å; L256-Q258 PolarHBondContact O-N 2.88Å; Q258-A261 PolarHBondContact O-N 2.9Å; Q258-E262 PolarHBondContact O-N 3.02Å
259	F	93.5	Very high	90.1	Very high	99 Å²	99	91.9 Å²	91.9	43%	0.434	50%	0.497	S	S	.	.	H	α-helix	trans	-65.6	-36.2	176.6	-73.4	-53.5	0	0	0	113.1	E255 L256 E262 L263	E255-F259 HydrophobicContact CG-CD2 4.21Å; E255-F259 HydrophobicContact CG-CE2 3.72Å; E255-F259 HydrophobicContact CG-CZ 4.5Å; E255-F259 WeakPolarHBondContact O-CD2 3.29Å; E255-F259 PolarHBondContact O-N 2.9Å; L256-F259 PolarHBondContact O-N 3.43Å; F259-E262 PolarHBondContact O-N 3.14Å; F259-L263 WeakPolarHBondContact O-CB 3.4Å; F259-L263 VanDerWaalsContact O-CG 3.28Å; F259-L263 WeakPolarHBondContact O-CG 3.43Å; F259-L263 PolarHBondContact O-N 3.06Å
260	E	88.6	Confident	90.6	Very high	135 Å²	135	90.4 Å²	90.4	63%	0.631	49%	0.493	S	S	*	.	H	α-helix	trans	-62.2	-46	174.2	-172.3	169.2	-138.9	0	0	111.3	L256 S257 E262 L263 D264	L256-E260 PolarHBondContact O-N 3.27Å; S257-E260 PolarHBondContact O-N 2.94Å; E260-E262 PolarHBondContact O-N 3.21Å; E260-L263 PolarHBondContact O-N 3.5Å; E260-D264 PolarHBondContact O-N 2.65Å
261	A	91.4	Very high	91.2	Very high	57 Å²	57	94.1 Å²	94.1	47%	0.471	50%	0.503	S	S	.	.	H	α-helix	trans	-66.8	-32.7	176.6	0	0	0	0	0	113.7	S257 Q258 S265	S257-A261 PolarHBondContact O-N 3.34Å; S257-A261 VanDerWaalsContact O-N 3.09Å; Q258-A261 PolarHBondContact O-N 2.9Å; A261-S265 WeakPolarHBondContact O-CB 3.36Å; A261-S265 PolarHBondContact O-N 2.84Å; A261-S265 VanDerWaalsContact O-N 3.13Å; A261-S265 PolarHBondContact O-OG 2.95Å
262	E	93.8	Very high	91.3	Very high	118 Å²	118	97.9 Å²	97.9	55%	0.551	51%	0.508	S	S	*	.	H	α-helix	trans	-68.8	-44.8	173.6	-174.6	170.2	-165	0	0	111.4	Q258 F259 E260 S265 E266	Q258-E262 PolarHBondContact O-N 3.02Å; F259-E262 PolarHBondContact O-N 3.14Å; E260-E262 PolarHBondContact O-N 3.21Å; E262-S265 WeakPolarHBondContact O-CB 3.1Å; E262-S265 PolarHBondContact O-N 2.82Å; E262-E266 PolarHBondContact O-N 2.99Å
263	L	92.3	Very high	91.4	Very high	100 Å²	100	97.6 Å²	97.6	52%	0.524	51%	0.51	S	S	.	.	H	α-helix	trans	-62.9	-43.9	177.1	-74.4	168.3	0	0	0	112.3	F259 E260 S265 E266 I267	F259-L263 WeakPolarHBondContact O-CB 3.4Å; F259-L263 VanDerWaalsContact O-CG 3.28Å; F259-L263 WeakPolarHBondContact O-CG 3.43Å; F259-L263 PolarHBondContact O-N 3.06Å; E260-L263 PolarHBondContact O-N 3.5Å; L263-S265 VanDerWaalsContact C-N 3.27Å; L263-S265 PolarHBondContact O-N 3.3Å; L263-E266 PolarHBondContact O-N 2.7Å; L263-I267 WeakPolarHBondContact O-CB 3Å; L263-I267 WeakPolarHBondContact O-CD1 3.35Å; L263-I267 WeakPolarHBondContact O-CG1 3.46Å; L263-I267 PolarHBondContact O-N 2.7Å
264	D	91.9	Very high	91.2	Very high	95 Å²	95	97.8 Å²	97.8	51%	0.508	51%	0.514	S	S	.	.	H	α-helix	trans	-62.8	-35.7	174.4	-100.6	3.3	0	0	0	112	E260 Q268	E260-D264 PolarHBondContact O-N 2.65Å; D264-Q268 WeakPolarHBondContact O-CG 3.08Å; D264-Q268 PolarHBondContact O-N 2.84Å
265	S	93.8	Very high	90.7	Very high	79 Å²	79	97.7 Å²	97.7	55%	0.552	51%	0.513	S	S	*	.	H	α-helix	trans	-66.9	-42.2	174.8	-62.5	0	0	0	0	112.1	A261 E262 L263 G269	A261-S265 WeakPolarHBondContact O-CB 3.36Å; A261-S265 PolarHBondContact O-N 2.84Å; A261-S265 VanDerWaalsContact O-N 3.13Å; A261-S265 PolarHBondContact O-OG 2.95Å; E262-S265 WeakPolarHBondContact O-CB 3.1Å; E262-S265 PolarHBondContact O-N 2.82Å; L263-S265 VanDerWaalsContact C-N 3.27Å; L263-S265 PolarHBondContact O-N 3.3Å; S265-G269 PolarHBondContact O-N 3.38Å
266	E	94.1	Very high	90	Very high	117 Å²	117	99.4 Å²	99.4	55%	0.547	52%	0.522	S	S	.	.	H	α-helix	trans	-65.1	-45.1	174.1	-171.1	-178.9	-159.5	0	0	111.1	E262 L263 Q268 G269 L270	E262-E266 PolarHBondContact O-N 2.99Å; L263-E266 PolarHBondContact O-N 2.7Å; E266-Q268 PolarHBondContact O-N 3.02Å; E266-G269 CarbonylContact O-C 3.54Å; E266-G269 WeakPolarHBondContact O-CA 3.44Å; E266-G269 PolarHBondContact O-N 2.75Å; E266-L270 HydrophobicContact CG-CD1 4.07Å; E266-L270 HydrophobicContact CG-CG 4.31Å; E266-L270 WeakPolarHBondContact O-CG 3.28Å; E266-L270 PolarHBondContact O-N 3.41Å
267	I	93.9	Very high	89.3	Confident	84 Å²	84	101 Å²	101	43%	0.431	52%	0.523	S	S	.	.	H	α-helix	trans	-56.9	-50.7	177.4	-71.8	163.9	0	0	0	110.3	L263 G269 L270 E271	L263-I267 WeakPolarHBondContact O-CB 3Å; L263-I267 WeakPolarHBondContact O-CD1 3.35Å; L263-I267 WeakPolarHBondContact O-CG1 3.46Å; L263-I267 PolarHBondContact O-N 2.7Å; I267-G269 VanDerWaalsContact C-N 3.29Å; I267-G269 PolarHBondContact O-N 3.21Å; I267-L270 PolarHBondContact O-N 2.93Å; I267-E271 WeakPolarHBondContact O-CG 3.21Å; I267-E271 PolarHBondContact O-N 3.25Å
268	Q	93.4	Very high	88.7	Confident	90 Å²	90	105.9 Å²	105.9	42%	0.421	54%	0.535	S	S	.	.	H	α-helix	trans	-64.2	-33.7	176	-66.5	-179.1	24.1	0	0	112.5	D264 E266 E271 R272	D264-Q268 WeakPolarHBondContact O-CG 3.08Å; D264-Q268 PolarHBondContact O-N 2.84Å; E266-Q268 PolarHBondContact O-N 3.02Å; Q268-E271 PolarHBondContact O-N 3.13Å; Q268-R272 VanDerWaalsContact CB-NH1 3.27Å; Q268-R272 WeakPolarHBondContact O-CB 3.47Å; Q268-R272 WeakPolarHBondContact O-CD 3.25Å; Q268-R272 WeakPolarHBondContact O-CG 3.36Å; Q268-R272 PolarHBondContact O-N 2.99Å
269	G	94	Very high	87.4	Confident	27 Å²	27	106.9 Å²	106.9	28%	0.278	54%	0.54	S	S	.	.	H	α-helix	trans	-62.1	-43.6	172.7	0	0	0	0	0	112.8	S265 E266 I267 T273	S265-G269 PolarHBondContact O-N 3.38Å; E266-G269 CarbonylContact O-C 3.54Å; E266-G269 WeakPolarHBondContact O-CA 3.44Å; E266-G269 PolarHBondContact O-N 2.75Å; I267-G269 VanDerWaalsContact C-N 3.29Å; I267-G269 PolarHBondContact O-N 3.21Å; G269-T273 WeakPolarHBondContact O-CB 3.44Å; G269-T273 PolarHBondContact O-N 3Å; G269-T273 PolarHBondContact O-OG1 2.85Å
270	L	89	Confident	85.9	Confident	94 Å²	94	111.9 Å²	111.9	49%	0.492	56%	0.556	S	S	.	*	H	α-helix	trans	-67.3	-40.4	175.5	-70	171.4	0	0	0	111.6	E266 I267 T273 L274	E266-L270 HydrophobicContact CG-CD1 4.07Å; E266-L270 HydrophobicContact CG-CG 4.31Å; E266-L270 WeakPolarHBondContact O-CG 3.28Å; E266-L270 PolarHBondContact O-N 3.41Å; I267-L270 PolarHBondContact O-N 2.93Å; L270-T273 PolarHBondContact O-N 2.81Å; L270-L274 WeakPolarHBondContact O-CB 3.23Å; L270-L274 PolarHBondContact O-N 3.36Å
271	E	89.6	Confident	84.2	Confident	121 Å²	121	116.7 Å²	116.7	57%	0.565	57%	0.568	S	S	*	*	H	α-helix	trans	-66	-41.4	175.5	-72.9	-167.1	148.5	0	0	112.9	I267 Q268 T273 L274 S275	I267-E271 WeakPolarHBondContact O-CG 3.21Å; I267-E271 PolarHBondContact O-N 3.25Å; Q268-E271 PolarHBondContact O-N 3.13Å; E271-T273 VanDerWaalsContact C-N 3.32Å; E271-T273 PolarHBondContact O-N 3.37Å; E271-L274 PolarHBondContact O-N 3.06Å; E271-S275 VanDerWaalsContact O-CB 3.3Å; E271-S275 WeakPolarHBondContact O-CB 3.08Å; E271-S275 PolarHBondContact O-N 3.3Å; E271-S275 PolarHBondContact O-OG 2.85Å
272	R	89.3	Confident	82.2	Confident	141 Å²	141	117.4 Å²	117.4	53%	0.532	58%	0.581	S	S	.	*	H	α-helix	trans	-59.2	-44.7	170.9	-72.4	164.4	-174.3	125.4	9	110.8	Q268 S275 Q276	Q268-R272 VanDerWaalsContact CB-NH1 3.27Å; Q268-R272 WeakPolarHBondContact O-CB 3.47Å; Q268-R272 WeakPolarHBondContact O-CD 3.25Å; Q268-R272 WeakPolarHBondContact O-CG 3.36Å; Q268-R272 PolarHBondContact O-N 2.99Å; R272-S275 PolarHBondContact O-N 2.86Å; R272-Q276 WeakPolarHBondContact O-CG 3.32Å; R272-Q276 PolarHBondContact O-N 3.42Å
273	T	86.9	Confident	79.9	Confident	85 Å²	85	122.7 Å²	122.7	52%	0.521	60%	0.596	S	S	.	*	H	α-helix	trans	-65.4	-43.5	178.5	-58.6	0	0	0	0	112	G269 L270 E271 S275 Q276 K277	G269-T273 WeakPolarHBondContact O-CB 3.44Å; G269-T273 PolarHBondContact O-N 3Å; G269-T273 PolarHBondContact O-OG1 2.85Å; L270-T273 PolarHBondContact O-N 2.81Å; E271-T273 VanDerWaalsContact C-N 3.32Å; E271-T273 PolarHBondContact O-N 3.37Å; T273-S275 VanDerWaalsContact C-N 3.34Å; T273-S275 PolarHBondContact O-N 2.82Å; T273-Q276 PolarHBondContact O-N 3.24Å; T273-K277 VanDerWaalsContact O-CB 3.23Å; T273-K277 WeakPolarHBondContact O-CB 3.43Å; T273-K277 PolarHBondContact O-N 2.91Å
274	L	82.9	Confident	77.4	Confident	120 Å²	120	121.3 Å²	121.3	63%	0.628	61%	0.606	S	S	*	*	H	α-helix	trans	-61.7	-41.3	173.9	-101.8	156.4	0	0	0	111.8	L270 E271 K277 K278	L270-L274 WeakPolarHBondContact O-CB 3.23Å; L270-L274 PolarHBondContact O-N 3.36Å; E271-L274 PolarHBondContact O-N 3.06Å; L274-K277 PolarHBondContact O-N 2.91Å; L274-K278 VanDerWaalsContact O-CB 3.31Å; L274-K278 WeakPolarHBondContact O-CB 3.31Å; L274-K278 PolarHBondContact O-N 3Å
275	S	79.1	Confident	75.1	Confident	74 Å²	74	125.9 Å²	125.9	52%	0.517	63%	0.625	S	S	.	*	H	α-helix	trans	-65.2	-48.2	177.9	-60.7	0	0	0	0	111.6	E271 R272 T273 K277 K278 Q279	E271-S275 VanDerWaalsContact O-CB 3.3Å; E271-S275 WeakPolarHBondContact O-CB 3.08Å; E271-S275 PolarHBondContact O-N 3.3Å; E271-S275 PolarHBondContact O-OG 2.85Å; R272-S275 PolarHBondContact O-N 2.86Å; T273-S275 VanDerWaalsContact C-N 3.34Å; T273-S275 PolarHBondContact O-N 2.82Å; S275-K277 VanDerWaalsContact C-N 3.35Å; S275-K277 PolarHBondContact O-N 2.9Å; S275-K278 PolarHBondContact O-N 2.92Å; S275-Q279 WeakPolarHBondContact O-CB 3.33Å; S275-Q279 PolarHBondContact O-N 2.96Å
276	Q	76.9	Confident	72.6	Confident	131 Å²	131	131.4 Å²	131.4	61%	0.612	64%	0.641	S	S	*	*	H	α-helix	trans	-62	-39.8	173.7	-72	-171.1	10.3	0	0	112.4	R272 T273 Q279 R280	R272-Q276 WeakPolarHBondContact O-CG 3.32Å; R272-Q276 PolarHBondContact O-N 3.42Å; T273-Q276 PolarHBondContact O-N 3.24Å; Q276-Q279 PolarHBondContact O-N 2.78Å; Q276-R280 WeakPolarHBondContact O-CB 3.44Å; Q276-R280 PolarHBondContact O-N 3.01Å
277	K	79.3	Confident	69.8	Low	156 Å²	156	130.4 Å²	130.4	68%	0.678	65%	0.653	S	S	*	*	H	α-helix	trans	-66.1	-38.5	177.5	-168.8	170	-174.3	172.1	0	111.8	T273 L274 S275 R281	T273-K277 VanDerWaalsContact O-CB 3.23Å; T273-K277 WeakPolarHBondContact O-CB 3.43Å; T273-K277 PolarHBondContact O-N 2.91Å; L274-K277 PolarHBondContact O-N 2.91Å; S275-K277 VanDerWaalsContact C-N 3.35Å; S275-K277 PolarHBondContact O-N 2.9Å; K277-R281 WeakPolarHBondContact O-CB 3.37Å; K277-R281 PolarHBondContact O-N 3.36Å
278	K	75.8	Confident	67	Low	174 Å²	174	133.4 Å²	133.4	76%	0.757	68%	0.676	S	S	*	*	H	α-helix	trans	-64.8	-43.2	172.6	-172.1	179.5	-179.7	-175.4	0	111.4	L274 S275 R281 G282	L274-K278 VanDerWaalsContact O-CB 3.31Å; L274-K278 WeakPolarHBondContact O-CB 3.31Å; L274-K278 PolarHBondContact O-N 3Å; S275-K278 PolarHBondContact O-N 2.92Å; K278-R281 PolarHBondContact O-N 3.18Å; K278-G282 PolarHBondContact O-N 3.42Å
279	Q	66.3	Low	64	Low	147 Å²	147	132.2 Å²	132.2	69%	0.687	69%	0.688	S	S	*	*	H	α-helix	trans	-68	-40.8	178.6	-168.8	173.3	-2.1	0	0	112.5	S275 Q276 G282	S275-Q279 WeakPolarHBondContact O-CB 3.33Å; S275-Q279 PolarHBondContact O-N 2.96Å; Q276-Q279 PolarHBondContact O-N 2.78Å; Q279-G282 PolarHBondContact O-N 2.98Å
280	R	60.9	Low	61.1	Low	205 Å²	205	143.2 Å²	143.2	77%	0.774	72%	0.721	S	S	*	*	H	α-helix	trans	-64.5	-36.3	172.5	-79	-171.1	170.6	-136	-0.4	112.7	Q276 G282 R283	Q276-R280 WeakPolarHBondContact O-CB 3.44Å; Q276-R280 PolarHBondContact O-N 3.01Å; R280-G282 PolarHBondContact O-N 2.77Å; R280-R283 PolarHBondContact O-N 2.62Å
281	R	52.5	Low	58.4	Low	236 Å²	236	146.4 Å²	146.4	89%	0.891	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-10.8	175.2	-158.2	173.3	-169.4	-115.7	-0	113.7	K277 K278	K277-R281 WeakPolarHBondContact O-CB 3.37Å; K277-R281 PolarHBondContact O-N 3.36Å; K278-R281 PolarHBondContact O-N 3.18Å
282	G	50.9	Low	56.8	Low	72 Å²	72	145.6 Å²	145.6	74%	0.742	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	7.5	173.3	0	0	0	0	0	114.9	K278 Q279 R280	K278-G282 PolarHBondContact O-N 3.42Å; Q279-G282 PolarHBondContact O-N 2.98Å; R280-G282 PolarHBondContact O-N 2.77Å
283	R	45.1	Very low	54	Low	228 Å²	228	146.9 Å²	146.9	86%	0.86	76%	0.761	S	S	*	*	S	Bend	trans	-148.2	68.7	-176.6	-167.2	178.5	-174	-92.9	2.7	110.7	R280	R280-R283 PolarHBondContact O-N 2.62Å
284	G	39.9	Very low	51.3	Low	71 Å²	71	147.6 Å²	147.6	73%	0.732	78%	0.775	S	S	*	*			trans	-156.1	20.6	-168.8	0	0	0	0	0	117
285	E	43.4	Very low	48.7	Very low	192 Å²	192	146.3 Å²	146.3	90%	0.897	78%	0.782	S	S	*	*			trans	-135.8	75.9	171.7	-72.8	-171.6	113.5	0	0	110.6
286	E	41	Very low	47.4	Very low	194 Å²	194	148 Å²	148	91%	0.907	79%	0.791	S	S	*	*			trans	-172.1	153.5	150.8	-112.1	-178.6	144.8	0	0	111.1
287	A	36.3	Very low	45.3	Very low	96 Å²	96	151.1 Å²	151.1	79%	0.793	80%	0.802	S	S	*	*			trans	61.2	133.7	-168.9	0	0	0	0	0	114.6
288	T	34	Very low	42.8	Very low	147 Å²	147	148 Å²	148	90%	0.902	81%	0.806	S	S	*	*			cis	-152	143.9	40.8	-57.3	0	0	0	0	111.9
289	G	30	Very low	40.6	Very low	66 Å²	66	145.7 Å²	145.7	68%	0.68	81%	0.806	S	S	*	*			trans	143.1	81.2	150	0	0	0	0	0	119.3
290	R	33.4	Very low	38.8	Very low	257 Å²	257	144 Å²	144	97%	0.97	81%	0.806	S	S	*	*				177	165.6	117.3	-94.2	167.9	-167.1	-116.6	1.2	112.4
291	D	32.4	Very low	37.2	Very low	161 Å²	161	139.5 Å²	139.5	86%	0.861	80%	0.801	S	S	*	*			trans	-89.9	175	-164.2	-100.1	-37.7	0	0	0	114.9
292	P	57.6	Low	36.1	Very low	105 Å²	105	134.5 Å²	134.5	68%	0.682	79%	0.792	S	S	*	*			trans	-105.4	163	-147.5	39.9	-38.6	0	0	0	116.1
293	L	29.8	Very low	35	Very low	168 Å²	168	138.8 Å²	138.8	88%	0.88	79%	0.793	S	S	*	*			trans	-161.3	144.1	140.4	-138.6	70.8	0	0	0	113.2
294	A	29.3	Very low	34.2	Very low	100 Å²	100	133.3 Å²	133.3	83%	0.826	79%	0.789	S	S	*	*			trans	59.9	142.8	160.5	0	0	0	0	0	121
295	A	29	Very low	33.8	Very low	93 Å²	93	137.7 Å²	137.7	77%	0.769	80%	0.796	S	S	*	*			trans	-130.1	-168.2	171.8	0	0	0	0	0	107.9
296	P	52.8	Low	33.2	Very low	109 Å²	109	136.4 Å²	136.4	71%	0.708	79%	0.794	S	S	*	*			cis	-135.8	168.9	-9.4	41.5	-26.3	0	0	0	115.1
297	K	31.7	Very low	32.9	Very low	197 Å²	197	135 Å²	135	86%	0.857	79%	0.792	S	S	*	*			trans	167	126.2	141.1	-91.4	153.3	-170.9	178.3	0	108.5
298	A	27.7	Very low	32.4	Very low	91 Å²	91	133.9 Å²	133.9	75%	0.752	78%	0.783	S	S	*	*				71.8	135.7	81.2	0	0	0	0	0	112.3
299	V	28.1	Very low	32.1	Very low	125 Å²	125	136.6 Å²	136.6	76%	0.758	78%	0.778	S	S	*	*			cis	-162.4	169.3	3.2	89.5	0	0	0	0	111.4
300	T	29.9	Very low	32.1	Very low	111 Å²	111	141.9 Å²	141.9	68%	0.681	78%	0.782	S	S	*	*			trans	57.7	111.9	164.1	46.7	0	0	0	0	122.1
301	T	27.2	Very low	31.8	Very low	111 Å²	111	138.2 Å²	138.2	68%	0.681	78%	0.776	S	S	*	*				37.7	152.7	118.5	57.1	0	0	0	0	123.8
302	N	29.6	Very low	32.4	Very low	130 Å²	130	135.3 Å²	135.3	70%	0.695	77%	0.766	S	S	*	*			trans	83	145.4	160.8	-55.7	-24.8	0	0	0	116.3
303	H	26.4	Very low	30.8	Very low	163 Å²	163	136.8 Å²	136.8	76%	0.755	77%	0.767	S	S	*	*			cis	161.9	172.8	-24.4	-91.5	-22.2	0	0	0	105.3
304	S	29.2	Very low	30.7	Very low	112 Å²	112	135.7 Å²	135.7	78%	0.783	76%	0.757	S	S	*	*			trans	56.7	96	170.7	45.4	0	0	0	0	117.5
305	N	31.9	Very low	30.4	Very low	164 Å²	164	141.2 Å²	141.2	88%	0.877	76%	0.757	S	S	*	*			trans	-58	142.1	139.1	-96.8	-75.1	0	0	0	109.1
306	L	30.8	Very low	30.3	Very low	165 Å²	165	142.6 Å²	142.6	86%	0.864	76%	0.761	S	S	*	*			trans	-146.9	134.3	152.9	-115.7	169.4	0	0	0	110.2
307	L	33.2	Very low	29	Very low	163 Å²	163	141.1 Å²	141.1	85%	0.853	77%	0.765	S	S	*	*			trans	-80.2	152.1	-179	-66.4	152.3	0	0	0	110.2
308	A	26.8	Very low	28.7	Very low	74 Å²	74	135.6 Å²	135.6	61%	0.612	76%	0.764	S	S	*	*				158.2	173.6	94.6	0	0	0	0	0	113.9
309	Y	27.9	Very low	29.1	Very low	203 Å²	203	139.2 Å²	139.2	80%	0.796	77%	0.77	S	S	*	*			trans	61.7	103.1	166.8	-59.9	-74.6	0	0	0	117.2
310	K	29.9	Very low	30	Very low	177 Å²	177	138.6 Å²	138.6	77%	0.77	77%	0.769	S	S	*	*				82.7	94.7	73	-81.4	-158.7	-171.4	-177.7	0	114.5
311	Q	26.2	Very low	29.9	Very low	180 Å²	180	137.7 Å²	137.7	84%	0.841	77%	0.767	S	S	*	*				59.9	177.3	128.3	-70.2	-148.3	-10.2	0	0	119.7
312	P	44.8	Very low	29.9	Very low	100 Å²	100	138.7 Å²	138.7	65%	0.649	77%	0.773	S	S	*	*			cis	-126.8	-151.3	-23.7	18.8	7	0	0	0	111.4
313	I	25.7	Very low	29.9	Very low	137 Å²	137	138.4 Å²	138.4	70%	0.703	78%	0.781	S	S	*	*			trans	103.5	90.1	148	-60	170	0	0	0	118.9
314	Q	25.8	Very low	30	Very low	144 Å²	144	135.1 Å²	135.1	67%	0.673	78%	0.782	S	S	*	*				69.9	131.7	122.9	-63.4	-160.4	47.3	0	0	124.7
315	R	24	Very low	30.8	Very low	216 Å²	216	135.8 Å²	135.8	82%	0.815	78%	0.784	S	S	*	*			trans	72	104.4	132.8	-74.2	-176.7	-172.5	-143.9	-2.2	121.4
316	S	26.1	Very low	30.7	Very low	122 Å²	122	132.7 Å²	132.7	85%	0.853	78%	0.781	S	S	*	*				84.1	121.3	103.5	-171	0	0	0	0	121
317	G	25.3	Very low	30.8	Very low	78 Å²	78	133.8 Å²	133.8	80%	0.804	78%	0.782	S	S	*	*			trans	116.4	141.8	143.2	0	0	0	0	0	115.9
318	G	25.4	Very low	30.9	Very low	81 Å²	81	132.2 Å²	132.2	84%	0.835	78%	0.779	S	S	*	*			trans	115.2	59.5	161.7	0	0	0	0	0	118.7
319	L	37.3	Very low	31	Very low	168 Å²	168	132.5 Å²	132.5	88%	0.88	79%	0.788	S	S	*	*			trans	-75	163.6	138.4	-82.7	161.3	0	0	0	108
320	P	46	Very low	31.1	Very low	112 Å²	112	133.7 Å²	133.7	73%	0.727	79%	0.791	S	S	*	*			cis	-131.5	-162.3	28.5	27.7	0.4	0	0	0	111.8
321	S	28.1	Very low	31.1	Very low	91 Å²	91	131.7 Å²	131.7	64%	0.636	79%	0.788	S	S	*	*			cis	-163.5	143	36.2	-61.6	0	0	0	0	116.6
322	T	27.6	Very low	31.2	Very low	132 Å²	132	127.6 Å²	127.6	81%	0.81	78%	0.78	S	S	*	*			trans	44.8	118.8	137.9	63.7	0	0	0	0	121.1
323	S	29.1	Very low	30.6	Very low	125 Å²	125	129.5 Å²	129.5	87%	0.874	79%	0.789	S	S	*	*				-165.3	150.5	101.8	62.3	0	0	0	0	112.5
324	A	29.6	Very low	30.8	Very low	94 Å²	94	127.8 Å²	127.8	78%	0.777	80%	0.796	S	S	*	*			trans	-152.4	156.6	168.3	0	0	0	0	0	106.4
325	P	46.3	Very low	31.1	Very low	126 Å²	126	128.7 Å²	128.7	82%	0.818	81%	0.806	S	S	*	*				-150.5	165.5	71	39.3	-19.4	0	0	0	118.1
326	A	28.8	Very low	31.6	Very low	99 Å²	99	127.5 Å²	127.5	82%	0.818	81%	0.809	S	S	*	*			trans	15	131.1	150.9	0	0	0	0	0	123.2
327	H	32.3	Very low	31.8	Very low	188 Å²	188	127.2 Å²	127.2	87%	0.87	81%	0.807	S	S	*	*			trans	-136.6	149.3	131.6	-164.8	-75.5	0	0	0	109.5
328	V	35.3	Very low	32.4	Very low	130 Å²	130	132.2 Å²	132.2	79%	0.788	81%	0.811	S	S	*	*			trans	-96	145.6	-178.8	-74.7	0	0	0	0	112.3
329	G	29.6	Very low	32.5	Very low	79 Å²	79	135.1 Å²	135.1	81%	0.814	80%	0.803	S	S	*	*			trans	-161.5	30.4	-166.2	0	0	0	0	0	119.2
330	R	29.4	Very low	32.5	Very low	228 Å²	228	131.5 Å²	131.5	86%	0.86	79%	0.79	S	S	*	*			trans	16.8	124	156.9	-173.8	167.8	-160.6	-122.4	5	120.9
331	L	30.6	Very low	32	Very low	135 Å²	135	132.5 Å²	132.5	71%	0.707	80%	0.8	S	S	*	*			trans	101.6	110.3	156.4	-73.5	158.3	0	0	0	120.9
332	S	28.7	Very low	32.4	Very low	94 Å²	94	133.1 Å²	133.1	66%	0.657	80%	0.804	S	S	*	*				71.1	107.1	129.1	-58.3	0	0	0	0	123.6
333	T	32.3	Very low	32.6	Very low	140 Å²	140	134.8 Å²	134.8	86%	0.859	80%	0.8	S	S	*	*				63.8	96.1	126	-40.6	0	0	0	0	119.4
334	A	28.5	Very low	32.9	Very low	101 Å²	101	138.4 Å²	138.4	84%	0.835	80%	0.8	S	S	*	*			trans	-135.8	166.6	151.8	0	0	0	0	0	109.8
335	N	33.8	Very low	33.2	Very low	164 Å²	164	142.2 Å²	142.2	88%	0.877	80%	0.802	S	S	*	*			trans	-74.6	173.4	-169.4	-86.1	-16.2	0	0	0	115.4
336	E	34.2	Very low	32.9	Very low	191 Å²	191	142.8 Å²	142.8	89%	0.893	79%	0.793	S	S	*	*			trans	99.9	91.8	142.8	-154.6	164.9	117.2	0	0	118.4
337	S	28.9	Very low	34	Very low	115 Å²	115	146.5 Å²	146.5	80%	0.804	79%	0.791	S	S	*	*			trans	-157.3	117.4	143.8	-167.9	0	0	0	0	111.9
338	M	39.6	Very low	35.3	Very low	183 Å²	183	141.8 Å²	141.8	90%	0.901	77%	0.768	S	S	*	*			trans	41.5	105.4	146.1	-147.1	71.5	153.7	0	0	120.3
339	E	26.1	Very low	37.2	Very low	142 Å²	142	140.7 Å²	140.7	66%	0.664	76%	0.756	S	S	*	*			trans	-138.6	131.5	159.6	-128.1	-91.1	118	0	0	109.5	K343	E339-K343 IonicContact OE2-NZ 2.66Å; E339-K343 PolarHBondContact OE2-NZ 2.89Å
340	P	37.6	Very low	39.9	Very low	92 Å²	92	141.1 Å²	141.1	60%	0.597	74%	0.735	S	S	*	*			trans	-77.8	146.7	-166.7	28.6	-36.6	0	0	0	115.9	S342	P340-S342 PolarHBondContact O-N 2.99Å
341	S	36.4	Very low	42.7	Very low	133 Å²	133	131.6 Å²	131.6	93%	0.93	71%	0.705	S	S	*	*	S	Bend	trans	-78.6	66.4	-176.6	50.5	0	0	0	0	114.5
342	S	36	Very low	45.6	Very low	104 Å²	104	125.2 Å²	125.2	73%	0.727	67%	0.672	S	S	*	*			trans	-150.4	49.4	172.3	70.3	0	0	0	0	115.6	P340 K344	P340-S342 PolarHBondContact O-N 2.99Å; S342-K344 PolarHBondContact O-N 2.91Å
343	K	30.9	Very low	48.7	Very low	168 Å²	168	126.4 Å²	126.4	73%	0.73	66%	0.662	S	S	*	*			trans	-76.5	101.7	164.5	-80	168.8	-177.4	138.5	0	109.3	E339 E345	E339-K343 IonicContact OE2-NZ 2.66Å; E339-K343 PolarHBondContact OE2-NZ 2.89Å; K343-E345 PolarHBondContact O-N 2.96Å
344	K	36	Very low	51.6	Low	201 Å²	201	119.9 Å²	119.9	87%	0.874	62%	0.622	S	S	*	*			trans	-56.7	104.1	166.1	179.4	-173.8	-177.7	-174	0	107.3	S342 E346	S342-K344 PolarHBondContact O-N 2.91Å; K344-E346 VanDerWaalsContact C-N 3.33Å; K344-E346 PolarHBondContact O-N 3.12Å
345	E	35.6	Very low	54.5	Low	173 Å²	173	119.5 Å²	119.5	81%	0.808	60%	0.601	S	S	*	*			trans	-64.9	98	177.5	-169.3	174.2	-170.5	0	0	108.7	K343 K347	K343-E345 PolarHBondContact O-N 2.96Å; E345-K347 PolarHBondContact O-N 3.21Å; E345-K347 VanDerWaalsContact O-N 3.13Å
346	E	40.3	Very low	57.1	Low	138 Å²	138	116.4 Å²	116.4	65%	0.645	58%	0.58	S	S	*	*			trans	-51.2	115.2	165.4	178.8	177.3	-120.5	0	0	107.2	K344 K348	K344-E346 VanDerWaalsContact C-N 3.33Å; K344-E346 PolarHBondContact O-N 3.12Å; E346-K348 HydrophobicContact CG-CG 4.22Å; E346-K348 PolarHBondContact O-N 2.82Å; E346-K348 WeakPolarHBondContact OE2-CE 3.36Å
347	K	51.7	Low	59.8	Low	178 Å²	178	111.7 Å²	111.7	77%	0.774	56%	0.561	S	S	*	*			trans	-68.8	73.3	-179.7	-75.5	-169.3	171.2	-166.4	0	110.2	E345 M349	E345-K347 PolarHBondContact O-N 3.21Å; E345-K347 VanDerWaalsContact O-N 3.13Å; K347-M349 VanDerWaalsContact C-N 3.26Å; K347-M349 PolarHBondContact O-N 2.9Å
348	K	59.9	Low	62.7	Low	88 Å²	88	107.1 Å²	107.1	38%	0.383	53%	0.527	S	S	.	.			trans	-65.1	87.7	168.1	-67.8	175.2	175.3	172.4	0	107.2	E346 K350 E408	E346-K348 HydrophobicContact CG-CG 4.22Å; E346-K348 PolarHBondContact O-N 2.82Å; E346-K348 WeakPolarHBondContact OE2-CE 3.36Å; K348-K350 PolarHBondContact O-N 3.16Å; K348-K350 VanDerWaalsContact O-N 3.16Å; K348-E408 IonicContact NZ-OE1 3.25Å; K348-E408 PolarHBondContact NZ-OE1 2.92Å; K348-E408 IonicContact NZ-OE2 3.03Å; K348-E408 PolarHBondContact NZ-OE2 2.84Å
349	M	75	Confident	65.1	Low	107 Å²	107	104 Å²	104	53%	0.527	51%	0.51	S	S	.	.			trans	-46.4	122.8	171.6	-81.8	103.1	147.7	0	0	108.5	K347 A351 Y375 I376 H377	K347-M349 VanDerWaalsContact C-N 3.26Å; K347-M349 PolarHBondContact O-N 2.9Å; M349-A351 PolarHBondContact O-N 2.71Å; M349-Y375 HydrophobicContact CB-CD1 4.28Å; M349-I376 WeakPolarHBondContact CA-O 3.45Å; M349-H377 WeakPolarHBondContact CE-NE2 3.48Å; M349-H377 VanDerWaalsContact CG-CD2 3.47Å; M349-H377 WeakPolarHBondContact CG-CD2 3.3Å
350	K	86.1	Confident	68.1	Low	88 Å²	88	99 Å²	99	38%	0.383	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	110.4	-178.6	-52.5	-173.4	-168.9	-63.5	0	107.4	K348 A352 I376 V403 P406	K348-K350 PolarHBondContact O-N 3.16Å; K348-K350 VanDerWaalsContact O-N 3.16Å; K350-A352 PolarHBondContact O-N 3.25Å; K350-I376 HydrophobicContact CB-CB 4.27Å; K350-I376 PolarHBondContact N-O 2.95Å; K350-I376 WeakPolarHBondContact O-CB 3.47Å; K350-I376 PolarHBondContact O-N 2.88Å; K350-V403 HydrophobicContact CB-CG1 4.03Å; K350-V403 HydrophobicContact CD-CG1 4.09Å; K350-P406 HydrophobicContact CD-CG 4.19Å; K350-P406 HydrophobicContact CG-CG 4.09Å
351	A	89.5	Confident	70.3	Confident	29 Å²	29	103 Å²	103	24%	0.24	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	135.9	168.8	0	0	0	0	0	108.9	M349 I373 V374 Y375 L404	M349-A351 PolarHBondContact O-N 2.71Å; A351-I373 HydrophobicContact CB-CG2 4.1Å; A351-V374 CarbonylContact C-O 3.43Å; A351-V374 WeakPolarHBondContact CA-O 3.44Å; A351-Y375 HydrophobicContact CB-CD1 4.44Å; A351-Y375 HydrophobicContact CB-CE1 4.29Å; A351-L404 HydrophobicContact CB-CD1 4.25Å; A351-L404 VanDerWaalsContact O-CB 3.27Å; A351-L404 WeakPolarHBondContact O-CB 3.44Å; A351-L404 PolarHBondContact O-N 2.91Å
352	A	91.5	Very high	72.7	Confident	0 Å²	0	98.6 Å²	98.6	0%	0	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	140.8	172.3	0	0	0	0	0	109.3	K350 I373 V374 I376 V401 E402	K350-A352 PolarHBondContact O-N 3.25Å; A352-I373 WeakPolarHBondContact O-CA 3.37Å; A352-V374 HydrophobicContact CB-CG2 3.91Å; A352-V374 PolarHBondContact N-O 2.76Å; A352-V374 PolarHBondContact O-N 2.93Å; A352-I376 HydrophobicContact CB-CD1 3.6Å; A352-I376 HydrophobicContact CB-CG1 4.14Å; A352-V401 HydrophobicContact CB-CB 4.03Å; A352-V401 HydrophobicContact CB-CG2 4.18Å; A352-E402 CarbonylContact C-O 3.45Å; A352-E402 WeakPolarHBondContact CA-O 3.38Å; A352-E402 WeakPolarHBondContact CB-O 3.4Å
353	R	92	Very high	74.9	Confident	120 Å²	120	100.3 Å²	100.3	45%	0.453	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	129.6	175.9	176.1	171.8	60.9	173.6	-0.8	109.5	K355 D372 I373 V401 E402 L404	R353-K355 PolarHBondContact O-N 2.9Å; R353-D372 CarbonylContact C-O 3.5Å; R353-D372 WeakPolarHBondContact CA-O 3.36Å; R353-I373 HydrophobicContact CB-CD1 3.91Å; R353-I373 HydrophobicContact CG-CD1 4.2Å; R353-V401 CarbonylContact O-C 3.53Å; R353-V401 WeakPolarHBondContact O-CA 3.03Å; R353-E402 HydrophobicContact CB-CB 4.5Å; R353-E402 IonicContact CZ-OE2 3.27Å; R353-E402 VanDerWaalsContact CZ-OE2 3.25Å; R353-E402 PolarHBondContact N-O 2.82Å; R353-E402 IonicContact NE-OE2 3.22Å; R353-E402 PolarHBondContact NE-OE2 2.89Å; R353-E402 IonicContact NH2-OE1 2.86Å; R353-E402 IonicContact NH2-OE2 3.32Å; R353-E402 PolarHBondContact NH2-OE2 2.87Å; R353-E402 PolarHBondContact O-N 3.43Å; R353-L404 HydrophobicContact CB-CD2 4.13Å; R353-L404 HydrophobicContact CB-CG 4.49Å
354	V	94.3	Very high	77.6	Confident	2 Å²	2	101.9 Å²	101.9	1%	0.012	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	120.6	177.5	-177.4	0	0	0	0	109.1	F356 L368 Q369 G371 D372 V374 V401	V354-F356 WeakPolarHBondContact CG1-O 3.45Å; V354-L368 HydrophobicContact CG1-CB 3.75Å; V354-L368 HydrophobicContact CG1-CD1 4.3Å; V354-L368 HydrophobicContact CG2-CB 3.99Å; V354-L368 HydrophobicContact CG2-CD1 3.92Å; V354-L368 HydrophobicContact CG2-CG 4.43Å; V354-Q369 VanDerWaalsContact CB-O 3.28Å; V354-Q369 WeakPolarHBondContact CB-O 3.49Å; V354-Q369 WeakPolarHBondContact CG1-O 3.5Å; V354-G371 PolarHBondContact O-N 3.17Å; V354-D372 HydrophobicContact CB-CB 4.22Å; V354-D372 HydrophobicContact CG2-CB 3.85Å; V354-D372 WeakPolarHBondContact CG2-O 3.49Å; V354-D372 PolarHBondContact N-O 2.95Å; V354-V374 HydrophobicContact CG2-CG1 3.71Å; V354-V374 HydrophobicContact CG2-CG2 4.42Å; V354-V401 HydrophobicContact CG2-CG1 4.34Å
355	K	89.9	Confident	80.3	Confident	94 Å²	94	93.8 Å²	93.8	41%	0.409	45%	0.448	S	S	.	.	S	Bend	trans	-87.9	-31.8	-176.4	-60.5	178.7	69.6	176.8	0	112.6	R353 K370 Y400 E402	R353-K355 PolarHBondContact O-N 2.9Å; K355-K370 WeakPolarHBondContact O-CG 3.41Å; K355-Y400 WeakPolarHBondContact CB-O 3.43Å; K355-Y400 PolarHBondContact N-O 2.83Å; K355-E402 HydrophobicContact CD-CB 3.94Å; K355-E402 HydrophobicContact CG-CB 3.84Å
356	F	88.7	Confident	82.8	Confident	98 Å²	98	85.9 Å²	85.9	43%	0.43	41%	0.412	S	S	.	.	S	Bend	trans	-140.5	142.6	-178.6	-51.4	-77.9	0	0	0	107.3	V354 Y400	V354-F356 WeakPolarHBondContact CG1-O 3.45Å; F356-Y400 HydrophobicContact CB-CD1 3.76Å; F356-Y400 HydrophobicContact CB-CE1 4.01Å
357	D	89.2	Confident	85.2	Confident	92 Å²	92	82.3 Å²	82.3	49%	0.492	40%	0.399	S	S	.	.			trans	-59.2	147	168.8	54.2	-64.6	0	0	0	110.5	L368 Y400	D357-L368 VanDerWaalsContact CA-O 3.31Å; D357-L368 WeakPolarHBondContact CA-O 3.29Å; D357-Y400 WeakPolarHBondContact O-CE1 3.27Å
358	F	90.1	Very high	87	Confident	20 Å²	20	73.8 Å²	73.8	9%	0.088	36%	0.362	C	S	.	.	B	Isolated β-bridge	trans	-141.9	123.1	-177.4	178.2	-113.7	0	0	0	107.5	E365 L366 T367 L368 W384 F396 P397 Y400	F358-E365 HydrophobicContact CE1-CB 4.18Å; F358-E365 HydrophobicContact CE1-CG 4.3Å; F358-E365 HydrophobicContact CZ-CG 4.36Å; F358-L366 VanDerWaalsContact CD1-O 3.27Å; F358-L366 WeakPolarHBondContact CD1-O 3.38Å; F358-T367 CarbonylContact O-C 3.49Å; F358-T367 VanDerWaalsContact O-CA 3.23Å; F358-T367 WeakPolarHBondContact O-CA 3.16Å; F358-L368 HydrophobicContact CB-CB 4.31Å; F358-L368 HydrophobicContact CB-CG 4.49Å; F358-L368 PolarHBondContact N-O 2.88Å; F358-L368 PolarHBondContact O-N 2.82Å; F358-W384 HydrophobicContact CE1-CZ3 4.48Å; F358-W384 HydrophobicContact CZ-CH2 4.15Å; F358-W384 HydrophobicContact CZ-CZ3 4.19Å; F358-F396 HydrophobicContact CD1-CB 4.28Å; F358-F396 HydrophobicContact CE1-CB 4.42Å; F358-P397 HydrophobicContact CD2-CG 4.26Å; F358-P397 HydrophobicContact CE2-CG 3.87Å; F358-P397 HydrophobicContact CZ-CG 4.03Å; F358-Y400 HydrophobicContact CB-CD1 3.84Å; F358-Y400 HydrophobicContact CB-CE1 4.36Å; F358-Y400 HydrophobicContact CD2-CD1 4.13Å; F358-Y400 HydrophobicContact CD2-CE1 4.15Å; F358-Y400 HydrophobicContact CG-CD1 4.32Å
359	Q	90.4	Very high	88.5	Confident	117 Å²	117	75.7 Å²	75.7	55%	0.547	37%	0.372	S	S	.	.			trans	-97.4	124.3	176.2	-62.4	-60.9	-21.6	0	0	109.1	Q361 T367	Q359-Q361 PolarHBondContact O-N 3.26Å; Q359-T367 PolarHBondContact OE1-OG1 2.73Å
360	A	89	Confident	89.2	Confident	37 Å²	37	76.9 Å²	76.9	31%	0.306	38%	0.375	S	S	.	.			trans	-62.5	122	177.7	0	0	0	0	0	111	E365 T367	A360-E365 HydrophobicContact CB-CB 3.6Å; A360-T367 PolarHBondContact N-OG1 2.89Å; A360-T367 VanDerWaalsContact N-OG1 3.12Å
361	Q	84.4	Confident	89.1	Confident	176 Å²	176	74.9 Å²	74.9	82%	0.822	38%	0.378	S	S	*	.	S	Bend	trans	-89	-23.4	176.4	-57.4	-174.5	8.6	0	0	111.7	Q359 E365	Q359-Q361 PolarHBondContact O-N 3.26Å; Q361-E365 PolarHBondContact N-OE2 3.5Å
362	S	85.4	Confident	89.1	Confident	40 Å²	40	75.1 Å²	75.1	28%	0.28	38%	0.376	S	S	.	.	S	Bend	trans	-125	156.4	174.3	78.4	0	0	0	0	112	R364 E365	S362-R364 PolarHBondContact O-N 3.44Å; S362-R364 PolarHBondContact OG-N 3.38Å; S362-E365 WeakPolarHBondContact CB-OE1 3.43Å; S362-E365 PolarHBondContact N-OE1 3.48Å; S362-E365 PolarHBondContact O-N 3.32Å; S362-E365 PolarHBondContact OG-OE1 2.93Å
363	P	83.6	Confident	89.1	Confident	140 Å²	140	78.8 Å²	78.8	91%	0.909	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	2.7	175.7	29.9	-37.1	0	0	0	114.1
364	R	87.1	Confident	89.1	Confident	201 Å²	201	73 Å²	73	76%	0.758	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-15.2	169.4	-71.3	-177.9	172.8	172.7	-0.9	112.6	S362 G394 I395	S362-R364 PolarHBondContact O-N 3.44Å; S362-R364 PolarHBondContact OG-N 3.38Å; R364-G394 CarbonylContact O-C 3.59Å; R364-G394 WeakPolarHBondContact O-CA 3.48Å; R364-I395 PolarHBondContact O-N 3.01Å
365	E	92.1	Very high	89.1	Confident	31 Å²	31	78.9 Å²	78.9	15%	0.145	40%	0.396	C	S	.	.	B	Isolated β-bridge	trans	-89.2	159.8	177.7	-73.9	150	-117.2	0	0	112	F358 A360 Q361 S362 W384 I395	F358-E365 HydrophobicContact CE1-CB 4.18Å; F358-E365 HydrophobicContact CE1-CG 4.3Å; F358-E365 HydrophobicContact CZ-CG 4.36Å; A360-E365 HydrophobicContact CB-CB 3.6Å; Q361-E365 PolarHBondContact N-OE2 3.5Å; S362-E365 WeakPolarHBondContact CB-OE1 3.43Å; S362-E365 PolarHBondContact N-OE1 3.48Å; S362-E365 PolarHBondContact O-N 3.32Å; S362-E365 PolarHBondContact OG-OE1 2.93Å; E365-W384 HydrophobicContact CG-CH2 4.19Å; E365-W384 HydrophobicContact CG-CZ3 4.01Å; E365-I395 CarbonylContact C-O 3.51Å; E365-I395 VanDerWaalsContact CA-O 3.25Å; E365-I395 WeakPolarHBondContact CA-O 3.21Å; E365-I395 HydrophobicContact CG-CD1 4.32Å; E365-I395 HydrophobicContact CG-CG1 3.76Å
366	L	88.9	Confident	89.3	Confident	8 Å²	8	74.7 Å²	74.7	4%	0.042	38%	0.378	C	S	.	.			trans	-107.1	128.2	172.4	-69.4	176.1	0	0	0	111.4	F358 L368 G387 H389 R392 I395 F396	F358-L366 VanDerWaalsContact CD1-O 3.27Å; F358-L366 WeakPolarHBondContact CD1-O 3.38Å; L366-L368 HydrophobicContact CB-CD2 3.76Å; L366-L368 WeakPolarHBondContact O-CG 3.1Å; L366-L368 PolarHBondContact O-N 3.33Å; L366-G387 WeakPolarHBondContact CD1-O 3.38Å; L366-H389 HydrophobicContact CD1-CB 3.95Å; L366-R392 HydrophobicContact CD2-CB 3.62Å; L366-R392 VanDerWaalsContact CD2-O 3.31Å; L366-R392 WeakPolarHBondContact CD2-O 3.36Å; L366-I395 PolarHBondContact N-O 2.85Å; L366-F396 HydrophobicContact CB-CD1 4.36Å; L366-F396 HydrophobicContact CD1-CD1 4.03Å; L366-F396 HydrophobicContact CD1-CE1 4.07Å
367	T	90	Very high	89.2	Confident	62 Å²	62	72.8 Å²	72.8	38%	0.38	37%	0.37	S	S	.	.			trans	-69.3	127.6	163.6	-69.1	0	0	0	0	109.4	F358 Q359 A360 H389	F358-T367 CarbonylContact O-C 3.49Å; F358-T367 VanDerWaalsContact O-CA 3.23Å; F358-T367 WeakPolarHBondContact O-CA 3.16Å; Q359-T367 PolarHBondContact OE1-OG1 2.73Å; A360-T367 PolarHBondContact N-OG1 2.89Å; A360-T367 VanDerWaalsContact N-OG1 3.12Å; T367-H389 PolarHBondContact O-ND1 3.05Å
368	L	90.8	Very high	89.2	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	37%	0.372	C	S	.	.	B	Isolated β-bridge	trans	-125.2	143.8	-178	-49.7	-173.9	0	0	0	109.8	V354 D357 F358 L366 V374 H389 F396 V401	V354-L368 HydrophobicContact CG1-CB 3.75Å; V354-L368 HydrophobicContact CG1-CD1 4.3Å; V354-L368 HydrophobicContact CG2-CB 3.99Å; V354-L368 HydrophobicContact CG2-CD1 3.92Å; V354-L368 HydrophobicContact CG2-CG 4.43Å; D357-L368 VanDerWaalsContact CA-O 3.31Å; D357-L368 WeakPolarHBondContact CA-O 3.29Å; F358-L368 HydrophobicContact CB-CB 4.31Å; F358-L368 HydrophobicContact CB-CG 4.49Å; F358-L368 PolarHBondContact N-O 2.88Å; F358-L368 PolarHBondContact O-N 2.82Å; L366-L368 HydrophobicContact CB-CD2 3.76Å; L366-L368 WeakPolarHBondContact O-CG 3.1Å; L366-L368 PolarHBondContact O-N 3.33Å; L368-V374 HydrophobicContact CD1-CG1 4.18Å; L368-V374 HydrophobicContact CD2-CG1 3.56Å; L368-V374 HydrophobicContact CG-CG1 4.44Å; L368-H389 HydrophobicContact CD2-CB 3.8Å; L368-H389 WeakPolarHBondContact CD2-ND1 3.36Å; L368-F396 HydrophobicContact CD1-CB 3.67Å; L368-F396 HydrophobicContact CD1-CD1 4.17Å; L368-F396 HydrophobicContact CD1-CD2 4.17Å; L368-F396 HydrophobicContact CD1-CG 3.76Å; L368-F396 HydrophobicContact CD2-CD1 4.49Å; L368-F396 HydrophobicContact CG-CB 4.45Å; L368-V401 HydrophobicContact CD1-CG1 4.03Å
369	Q	91.1	Very high	89.1	Confident	127 Å²	127	79.4 Å²	79.4	59%	0.593	39%	0.392	S	S	*	.			trans	-108.1	145.5	171.4	-43.6	-165.8	-77.5	0	0	110.8	V354 G371 D372	V354-Q369 VanDerWaalsContact CB-O 3.28Å; V354-Q369 WeakPolarHBondContact CB-O 3.49Å; V354-Q369 WeakPolarHBondContact CG1-O 3.5Å; Q369-G371 PolarHBondContact O-N 2.79Å; Q369-D372 VanDerWaalsContact CA-OD2 3.28Å; Q369-D372 WeakPolarHBondContact CA-OD2 3.37Å; Q369-D372 WeakPolarHBondContact CB-OD2 3.5Å; Q369-D372 PolarHBondContact N-OD2 3.48Å; Q369-D372 VanDerWaalsContact O-CB 3.25Å; Q369-D372 WeakPolarHBondContact O-CB 3.5Å; Q369-D372 VanDerWaalsContact O-CG 3.26Å; Q369-D372 PolarHBondContact O-N 3.42Å
370	K	89.1	Confident	89	Confident	133 Å²	133	76.8 Å²	76.8	58%	0.578	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	118.5	-179.7	177.4	170.1	174.3	-173.2	0	111.3	K355	K355-K370 WeakPolarHBondContact O-CG 3.41Å
371	G	85	Confident	89	Confident	45 Å²	45	78.6 Å²	78.6	46%	0.464	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.6	-16.2	-176.4	0	0	0	0	0	114.8	V354 Q369	V354-G371 PolarHBondContact O-N 3.17Å; Q369-G371 PolarHBondContact O-N 2.79Å
372	D	89.1	Confident	89.1	Confident	35 Å²	35	73.8 Å²	73.8	19%	0.187	38%	0.379	C	S	.	.			trans	-61.2	161.8	177.4	-71.1	-25.8	0	0	0	112.5	R353 V354 Q369 H389	R353-D372 CarbonylContact C-O 3.5Å; R353-D372 WeakPolarHBondContact CA-O 3.36Å; V354-D372 HydrophobicContact CB-CB 4.22Å; V354-D372 HydrophobicContact CG2-CB 3.85Å; V354-D372 WeakPolarHBondContact CG2-O 3.49Å; V354-D372 PolarHBondContact N-O 2.95Å; Q369-D372 VanDerWaalsContact CA-OD2 3.28Å; Q369-D372 WeakPolarHBondContact CA-OD2 3.37Å; Q369-D372 WeakPolarHBondContact CB-OD2 3.5Å; Q369-D372 PolarHBondContact N-OD2 3.48Å; Q369-D372 VanDerWaalsContact O-CB 3.25Å; Q369-D372 WeakPolarHBondContact O-CB 3.5Å; Q369-D372 VanDerWaalsContact O-CG 3.26Å; Q369-D372 PolarHBondContact O-N 3.42Å; D372-H389 WeakPolarHBondContact CB-NE2 3.23Å; D372-H389 IonicContact OD2-CE1 2.78Å; D372-H389 PolarHBondContact OD2-CE1 2.89Å; D372-H389 IonicContact OD2-NE2 2.71Å; D372-H389 PolarHBondContact OD2-NE2 3.02Å; D372-H389 VanDerWaalsContact OD2-NE2 3.11Å
373	I	91.6	Very high	89.3	Confident	76 Å²	76	77.2 Å²	77.2	39%	0.39	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	120.5	172.3	-54	-60.3	0	0	0	109.4	A351 A352 R353 L404	A351-I373 HydrophobicContact CB-CG2 4.1Å; A352-I373 WeakPolarHBondContact O-CA 3.37Å; R353-I373 HydrophobicContact CB-CD1 3.91Å; R353-I373 HydrophobicContact CG-CD1 4.2Å; I373-L404 HydrophobicContact CD1-CD1 4.36Å
374	V	92.5	Very high	89.8	Confident	0 Å²	0	74 Å²	74	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	150.2	176	-59.6	0	0	0	0	110.8	A351 A352 V354 L368 H389 F396 V401	A351-V374 CarbonylContact C-O 3.43Å; A351-V374 WeakPolarHBondContact CA-O 3.44Å; A352-V374 HydrophobicContact CB-CG2 3.91Å; A352-V374 PolarHBondContact N-O 2.76Å; A352-V374 PolarHBondContact O-N 2.93Å; V354-V374 HydrophobicContact CG2-CG1 3.71Å; V354-V374 HydrophobicContact CG2-CG2 4.42Å; L368-V374 HydrophobicContact CD1-CG1 4.18Å; L368-V374 HydrophobicContact CD2-CG1 3.56Å; L368-V374 HydrophobicContact CG-CG1 4.44Å; V374-H389 HydrophobicContact CG1-CB 3.91Å; V374-F396 HydrophobicContact CB-CE1 4.25Å; V374-F396 HydrophobicContact CB-CZ 4Å; V374-F396 HydrophobicContact CG2-CE1 4.16Å; V374-F396 HydrophobicContact CG2-CE2 3.74Å; V374-F396 HydrophobicContact CG2-CZ 3.48Å; V374-F396 VanDerWaalsContact CG2-CZ 3.48Å; V374-V401 HydrophobicContact CG2-CG1 4.11Å
375	Y	93.1	Very high	90.1	Very high	125 Å²	125	65.1 Å²	65.1	49%	0.49	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	102	179.1	-68.8	-82	0	0	0	110.6	M349 A351 H377 G387 E388	M349-Y375 HydrophobicContact CB-CD1 4.28Å; A351-Y375 HydrophobicContact CB-CD1 4.44Å; A351-Y375 HydrophobicContact CB-CE1 4.29Å; Y375-H377 PolarHBondContact O-CD2 2.9Å; Y375-H377 VanDerWaalsContact O-CD2 3.32Å; Y375-H377 PolarHBondContact O-N 2.92Å; Y375-G387 CarbonylContact O-C 3.58Å; Y375-G387 WeakPolarHBondContact O-CA 3.3Å; Y375-E388 PolarHBondContact N-O 3.41Å; Y375-E388 PolarHBondContact O-N 3.39Å
376	I	93.4	Very high	90.1	Very high	6 Å²	6	66.1 Å²	66.1	3%	0.031	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	121	177	-61.7	166.9	0	0	0	109.4	M349 K350 A352 R378 F385 F396 V403	M349-I376 WeakPolarHBondContact CA-O 3.45Å; K350-I376 HydrophobicContact CB-CB 4.27Å; K350-I376 PolarHBondContact N-O 2.95Å; K350-I376 WeakPolarHBondContact O-CB 3.47Å; K350-I376 PolarHBondContact O-N 2.88Å; A352-I376 HydrophobicContact CB-CD1 3.6Å; A352-I376 HydrophobicContact CB-CG1 4.14Å; I376-R378 WeakPolarHBondContact CG2-O 3.47Å; I376-F385 HydrophobicContact CD1-CB 4.23Å; I376-F385 HydrophobicContact CD1-CD1 3.9Å; I376-F385 HydrophobicContact CD1-CD2 3.61Å; I376-F385 HydrophobicContact CD1-CE1 4.15Å; I376-F385 HydrophobicContact CD1-CE2 3.85Å; I376-F385 HydrophobicContact CD1-CG 3.65Å; I376-F385 HydrophobicContact CD1-CZ 4.14Å; I376-F385 HydrophobicContact CG1-CB 4.07Å; I376-F385 HydrophobicContact CG1-CD1 4.4Å; I376-F385 HydrophobicContact CG1-CD2 4.34Å; I376-F385 HydrophobicContact CG1-CG 4.04Å; I376-F385 HydrophobicContact CG2-CB 4.09Å; I376-F385 HydrophobicContact CG2-CD1 3.74Å; I376-F385 HydrophobicContact CG2-CE1 4.5Å; I376-F385 HydrophobicContact CG2-CG 4.09Å; I376-F396 HydrophobicContact CD1-CE2 4.43Å; I376-F396 HydrophobicContact CG1-CE2 3.93Å; I376-F396 HydrophobicContact CG1-CZ 3.79Å; I376-V403 HydrophobicContact CD1-CG1 4.32Å; I376-V403 HydrophobicContact CD1-CG2 3.77Å
377	H	87.3	Confident	90.3	Very high	58 Å²	58	65.7 Å²	65.7	27%	0.269	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-37.7	175.5	-69.5	177.6	0	0	0	111.8	M349 Y375 E386 E388	M349-H377 WeakPolarHBondContact CE-NE2 3.48Å; M349-H377 VanDerWaalsContact CG-CD2 3.47Å; M349-H377 WeakPolarHBondContact CG-CD2 3.3Å; Y375-H377 PolarHBondContact O-CD2 2.9Å; Y375-H377 VanDerWaalsContact O-CD2 3.32Å; Y375-H377 PolarHBondContact O-N 2.92Å; H377-E386 PolarHBondContact N-O 3.4Å; H377-E388 IonicContact CE1-OE2 3.69Å; H377-E388 IonicContact NE2-OE2 3.21Å
378	R	88.6	Confident	90.4	Very high	143 Å²	143	66.3 Å²	66.3	54%	0.54	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	160.4	173	59.8	178.3	179	134.4	1.7	111.1	I376 E386	I376-R378 WeakPolarHBondContact CG2-O 3.47Å; R378-E386 HydrophobicContact CG-CB 3.92Å; R378-E386 IonicContact CZ-OE2 2.71Å; R378-E386 PolarHBondContact N-O 3.38Å; R378-E386 VanDerWaalsContact N-O 3.15Å; R378-E386 VanDerWaalsContact NE-CD 3.33Å; R378-E386 IonicContact NE-OE1 2.71Å; R378-E386 PolarHBondContact NE-OE1 2.95Å; R378-E386 IonicContact NE-OE2 2.89Å; R378-E386 PolarHBondContact NE-OE2 3.34Å; R378-E386 IonicContact NH2-OE2 3.41Å; R378-E386 PolarHBondContact NH2-OE2 3.29Å; R378-E386 PolarHBondContact O-N 2.98Å; R378-E386 VanDerWaalsContact O-O 3.1Å
379	Q	89.1	Confident	90.4	Very high	107 Å²	107	67 Å²	67	50%	0.5	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	136.3	160.2	-170.6	162.5	2.1	0	0	109	D381 F385	Q379-D381 WeakPolarHBondContact CG-O 3.49Å; Q379-D381 PolarHBondContact NE2-O 3.02Å; Q379-F385 HydrophobicContact CB-CD1 3.86Å; Q379-F385 HydrophobicContact CB-CE1 3.93Å; Q379-F385 HydrophobicContact CG-CD1 3.91Å; Q379-F385 HydrophobicContact CG-CE1 3.83Å
380	V	87.6	Confident	89.9	Confident	63 Å²	63	68.3 Å²	68.3	38%	0.382	34%	0.341	S	S	.	.			trans	-91.3	-48.6	178.6	-179.6	0	0	0	0	109.2	W384 E386 I395	V380-W384 HydrophobicContact CB-CB 4.23Å; V380-W384 PolarHBondContact N-O 3.15Å; V380-E386 HydrophobicContact CG2-CB 3.66Å; V380-I395 HydrophobicContact CG2-CG2 4.16Å
381	D	90.1	Very high	89.6	Confident	74 Å²	74	65 Å²	65	40%	0.396	35%	0.345	S	S	.	.	S	Bend	trans	-151.9	-171.4	173.8	61	48.7	0	0	0	110.4	Q379 N383 W384	Q379-D381 WeakPolarHBondContact CG-O 3.49Å; Q379-D381 PolarHBondContact NE2-O 3.02Å; D381-N383 PolarHBondContact O-N 2.81Å; D381-N383 VanDerWaalsContact O-N 3.17Å; D381-N383 WeakPolarHBondContact OD1-CA 3.43Å; D381-N383 WeakPolarHBondContact OD1-CB 3.38Å; D381-N383 PolarHBondContact OD1-N 2.78Å; D381-W384 PolarHBondContact N-O 3.49Å; D381-W384 PolarHBondContact OD1-N 3.3Å
382	A	85.3	Confident	89.6	Confident	76 Å²	76	72 Å²	72	63%	0.628	36%	0.357	S	S	*	.	S	Bend	trans	-60.6	-23.9	-179.5	0	0	0	0	0	114
383	N	91.1	Very high	89.6	Confident	111 Å²	111	73.8 Å²	73.8	59%	0.594	38%	0.376	S	S	*	.	S	Bend	trans	-110.6	-16.4	-171.1	-66.5	87	0	0	0	113.6	D381 P397 T398	D381-N383 PolarHBondContact O-N 2.81Å; D381-N383 VanDerWaalsContact O-N 3.17Å; D381-N383 WeakPolarHBondContact OD1-CA 3.43Å; D381-N383 WeakPolarHBondContact OD1-CB 3.38Å; D381-N383 PolarHBondContact OD1-N 2.78Å; N383-P397 CarbonylContact O-C 3.32Å; N383-P397 VanDerWaalsContact O-CA 3.3Å; N383-P397 WeakPolarHBondContact O-CA 3.47Å; N383-T398 VanDerWaalsContact C-OG1 3.25Å; N383-T398 PolarHBondContact O-N 3.36Å; N383-T398 PolarHBondContact O-OG1 3.39Å
384	W	92.4	Very high	89.6	Confident	72 Å²	72	70.6 Å²	70.6	27%	0.273	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	135.3	-176.9	-67.3	93.3	0	0	0	114.4	F358 E365 V380 D381 I395 P397 T398	F358-W384 HydrophobicContact CE1-CZ3 4.48Å; F358-W384 HydrophobicContact CZ-CH2 4.15Å; F358-W384 HydrophobicContact CZ-CZ3 4.19Å; E365-W384 HydrophobicContact CG-CH2 4.19Å; E365-W384 HydrophobicContact CG-CZ3 4.01Å; V380-W384 HydrophobicContact CB-CB 4.23Å; V380-W384 PolarHBondContact N-O 3.15Å; D381-W384 PolarHBondContact N-O 3.49Å; D381-W384 PolarHBondContact OD1-N 3.3Å; W384-I395 HydrophobicContact CD2-CD1 4.14Å; W384-I395 HydrophobicContact CE3-CB 3.92Å; W384-I395 HydrophobicContact CE3-CD1 3.73Å; W384-I395 HydrophobicContact CE3-CG1 3.74Å; W384-I395 HydrophobicContact CH2-CD1 4.48Å; W384-I395 HydrophobicContact CZ3-CB 4.4Å; W384-I395 HydrophobicContact CZ3-CD1 3.92Å; W384-I395 HydrophobicContact CZ3-CG1 3.81Å; W384-P397 HydrophobicContact CE3-CG 4.28Å; W384-P397 HydrophobicContact CH2-CG 4.03Å; W384-P397 HydrophobicContact CZ3-CG 3.89Å; W384-T398 PolarHBondContact N-OG1 3.05Å
385	F	93.6	Very high	89.7	Confident	15 Å²	15	72.7 Å²	72.7	7%	0.066	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	152.1	163.1	-67	-60.1	0	0	0	110.9	I376 Q379 I395 F396 T398 V401 V403	I376-F385 HydrophobicContact CD1-CB 4.23Å; I376-F385 HydrophobicContact CD1-CD1 3.9Å; I376-F385 HydrophobicContact CD1-CD2 3.61Å; I376-F385 HydrophobicContact CD1-CE1 4.15Å; I376-F385 HydrophobicContact CD1-CE2 3.85Å; I376-F385 HydrophobicContact CD1-CG 3.65Å; I376-F385 HydrophobicContact CD1-CZ 4.14Å; I376-F385 HydrophobicContact CG1-CB 4.07Å; I376-F385 HydrophobicContact CG1-CD1 4.4Å; I376-F385 HydrophobicContact CG1-CD2 4.34Å; I376-F385 HydrophobicContact CG1-CG 4.04Å; I376-F385 HydrophobicContact CG2-CB 4.09Å; I376-F385 HydrophobicContact CG2-CD1 3.74Å; I376-F385 HydrophobicContact CG2-CE1 4.5Å; I376-F385 HydrophobicContact CG2-CG 4.09Å; Q379-F385 HydrophobicContact CB-CD1 3.86Å; Q379-F385 HydrophobicContact CB-CE1 3.93Å; Q379-F385 HydrophobicContact CG-CD1 3.91Å; Q379-F385 HydrophobicContact CG-CE1 3.83Å; F385-I395 CarbonylContact O-C 3.45Å; F385-I395 WeakPolarHBondContact O-CA 3.34Å; F385-I395 WeakPolarHBondContact O-CB 3.28Å; F385-F396 HydrophobicContact CB-CD2 4.01Å; F385-F396 HydrophobicContact CB-CE2 3.58Å; F385-F396 HydrophobicContact CB-CZ 4.08Å; F385-F396 HydrophobicContact CD2-CD2 4.48Å; F385-F396 HydrophobicContact CD2-CE2 4.12Å; F385-F396 HydrophobicContact CG-CE2 4.28Å; F385-F396 PolarHBondContact N-O 3.4Å; F385-F396 PolarHBondContact O-N 3.26Å; F385-T398 HydrophobicContact CD2-CG2 4.47Å; F385-T398 HydrophobicContact CE2-CG2 3.64Å; F385-T398 HydrophobicContact CZ-CG2 3.82Å; F385-V401 HydrophobicContact CD2-CG2 3.57Å; F385-V401 HydrophobicContact CE2-CG2 3.72Å; F385-V403 HydrophobicContact CE1-CG2 4.33Å; F385-V403 HydrophobicContact CE2-CG2 3.51Å; F385-V403 HydrophobicContact CZ-CG2 3.4Å
386	E	93.1	Very high	89.7	Confident	52 Å²	52	66.7 Å²	66.7	24%	0.243	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	133.1	162.8	178.6	-169.8	113.1	0	0	108.1	H377 R378 V380 G394 I395	H377-E386 PolarHBondContact N-O 3.4Å; R378-E386 HydrophobicContact CG-CB 3.92Å; R378-E386 IonicContact CZ-OE2 2.71Å; R378-E386 PolarHBondContact N-O 3.38Å; R378-E386 VanDerWaalsContact N-O 3.15Å; R378-E386 VanDerWaalsContact NE-CD 3.33Å; R378-E386 IonicContact NE-OE1 2.71Å; R378-E386 PolarHBondContact NE-OE1 2.95Å; R378-E386 IonicContact NE-OE2 2.89Å; R378-E386 PolarHBondContact NE-OE2 3.34Å; R378-E386 IonicContact NH2-OE2 3.41Å; R378-E386 PolarHBondContact NH2-OE2 3.29Å; R378-E386 PolarHBondContact O-N 2.98Å; R378-E386 VanDerWaalsContact O-O 3.1Å; V380-E386 HydrophobicContact CG2-CB 3.66Å; E386-G394 WeakPolarHBondContact CA-O 3.37Å; E386-I395 HydrophobicContact CB-CG2 4.2Å
387	G	92.1	Very high	89.7	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	-164.2	179.7	0	0	0	0	0	113.2	L366 Y375 A393 G394	L366-G387 WeakPolarHBondContact CD1-O 3.38Å; Y375-G387 CarbonylContact O-C 3.58Å; Y375-G387 WeakPolarHBondContact O-CA 3.3Å; G387-A393 VanDerWaalsContact O-CA 3.32Å; G387-A393 WeakPolarHBondContact O-CA 3.16Å; G387-G394 PolarHBondContact N-O 2.76Å; G387-G394 PolarHBondContact O-N 3.44Å
388	E	92.1	Very high	89.8	Confident	74 Å²	74	66.2 Å²	66.2	35%	0.346	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	137.2	179.9	-160.3	177.8	122.9	0	0	111.5	Y375 H377 R392 A393	Y375-E388 PolarHBondContact N-O 3.41Å; Y375-E388 PolarHBondContact O-N 3.39Å; H377-E388 IonicContact CE1-OE2 3.69Å; H377-E388 IonicContact NE2-OE2 3.21Å; E388-R392 CarbonylContact C-O 3.53Å; E388-R392 VanDerWaalsContact CA-O 3.3Å; E388-R392 WeakPolarHBondContact CA-O 3.39Å; E388-R392 WeakPolarHBondContact CG-O 3.4Å; E388-A393 HydrophobicContact CG-CB 4.44Å
389	H	90.9	Very high	89.9	Confident	14 Å²	14	63.1 Å²	63.1	7%	0.065	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	122.6	176.7	-172.1	-140.3	0	0	0	109.5	L366 T367 L368 D372 V374 G391 R392	L366-H389 HydrophobicContact CD1-CB 3.95Å; T367-H389 PolarHBondContact O-ND1 3.05Å; L368-H389 HydrophobicContact CD2-CB 3.8Å; L368-H389 WeakPolarHBondContact CD2-ND1 3.36Å; D372-H389 WeakPolarHBondContact CB-NE2 3.23Å; D372-H389 IonicContact OD2-CE1 2.78Å; D372-H389 PolarHBondContact OD2-CE1 2.89Å; D372-H389 IonicContact OD2-NE2 2.71Å; D372-H389 PolarHBondContact OD2-NE2 3.02Å; D372-H389 VanDerWaalsContact OD2-NE2 3.11Å; V374-H389 HydrophobicContact CG1-CB 3.91Å; H389-G391 PolarHBondContact O-N 2.8Å; H389-G391 VanDerWaalsContact O-N 3.12Å; H389-R392 PolarHBondContact N-O 3.21Å; H389-R392 WeakPolarHBondContact O-CB 3.37Å; H389-R392 PolarHBondContact O-N 3.37Å
390	H	80.4	Confident	90	Very high	156 Å²	156	62.3 Å²	62.3	72%	0.722	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.4	43.5	-179.3	-68	112.2	0	0	0	114.5	R392	H390-R392 VanDerWaalsContact C-N 3.28Å; H390-R392 PolarHBondContact O-N 2.96Å
391	G	82.6	Confident	90.1	Very high	64 Å²	64	59.7 Å²	59.7	66%	0.66	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.5	4.5	179.7	0	0	0	0	0	115.6	H389	H389-G391 PolarHBondContact O-N 2.8Å; H389-G391 VanDerWaalsContact O-N 3.12Å
392	R	86.6	Confident	90.2	Very high	192 Å²	192	59.8 Å²	59.8	73%	0.725	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.1	133.3	172.4	-56.9	-177.1	-174.7	-168.6	1.6	109.1	L366 E388 H389 H390	L366-R392 HydrophobicContact CD2-CB 3.62Å; L366-R392 VanDerWaalsContact CD2-O 3.31Å; L366-R392 WeakPolarHBondContact CD2-O 3.36Å; E388-R392 CarbonylContact C-O 3.53Å; E388-R392 VanDerWaalsContact CA-O 3.3Å; E388-R392 WeakPolarHBondContact CA-O 3.39Å; E388-R392 WeakPolarHBondContact CG-O 3.4Å; H389-R392 PolarHBondContact N-O 3.21Å; H389-R392 WeakPolarHBondContact O-CB 3.37Å; H389-R392 PolarHBondContact O-N 3.37Å; H390-R392 VanDerWaalsContact C-N 3.28Å; H390-R392 PolarHBondContact O-N 2.96Å
393	A	89.2	Confident	90.4	Very high	71 Å²	71	58.9 Å²	58.9	59%	0.587	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.6	142.3	178	0	0	0	0	0	111.6	G387 E388	G387-A393 VanDerWaalsContact O-CA 3.32Å; G387-A393 WeakPolarHBondContact O-CA 3.16Å; E388-A393 HydrophobicContact CG-CB 4.44Å
394	G	91.5	Very high	90.1	Very high	10 Å²	10	56.3 Å²	56.3	10%	0.103	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.5	-169.1	-176.9	0	0	0	0	0	112.7	R364 E386 G387	R364-G394 CarbonylContact O-C 3.59Å; R364-G394 WeakPolarHBondContact O-CA 3.48Å; E386-G394 WeakPolarHBondContact CA-O 3.37Å; G387-G394 PolarHBondContact N-O 2.76Å; G387-G394 PolarHBondContact O-N 3.44Å
395	I	93.3	Very high	89.3	Confident	43 Å²	43	57.8 Å²	57.8	22%	0.221	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	152.6	-175.3	68.4	174.8	0	0	0	113.5	R364 E365 L366 V380 W384 F385 E386	R364-I395 PolarHBondContact O-N 3.01Å; E365-I395 CarbonylContact C-O 3.51Å; E365-I395 VanDerWaalsContact CA-O 3.25Å; E365-I395 WeakPolarHBondContact CA-O 3.21Å; E365-I395 HydrophobicContact CG-CD1 4.32Å; E365-I395 HydrophobicContact CG-CG1 3.76Å; L366-I395 PolarHBondContact N-O 2.85Å; V380-I395 HydrophobicContact CG2-CG2 4.16Å; W384-I395 HydrophobicContact CD2-CD1 4.14Å; W384-I395 HydrophobicContact CE3-CB 3.92Å; W384-I395 HydrophobicContact CE3-CD1 3.73Å; W384-I395 HydrophobicContact CE3-CG1 3.74Å; W384-I395 HydrophobicContact CH2-CD1 4.48Å; W384-I395 HydrophobicContact CZ3-CB 4.4Å; W384-I395 HydrophobicContact CZ3-CD1 3.92Å; W384-I395 HydrophobicContact CZ3-CG1 3.81Å; F385-I395 CarbonylContact O-C 3.45Å; F385-I395 WeakPolarHBondContact O-CA 3.34Å; F385-I395 WeakPolarHBondContact O-CB 3.28Å; E386-I395 HydrophobicContact CB-CG2 4.2Å
396	F	93.9	Very high	87.9	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	153	173.6	45.1	-94.9	0	0	0	111.4	F358 L366 L368 V374 I376 F385 V401	F358-F396 HydrophobicContact CD1-CB 4.28Å; F358-F396 HydrophobicContact CE1-CB 4.42Å; L366-F396 HydrophobicContact CB-CD1 4.36Å; L366-F396 HydrophobicContact CD1-CD1 4.03Å; L366-F396 HydrophobicContact CD1-CE1 4.07Å; L368-F396 HydrophobicContact CD1-CB 3.67Å; L368-F396 HydrophobicContact CD1-CD1 4.17Å; L368-F396 HydrophobicContact CD1-CD2 4.17Å; L368-F396 HydrophobicContact CD1-CG 3.76Å; L368-F396 HydrophobicContact CD2-CD1 4.49Å; L368-F396 HydrophobicContact CG-CB 4.45Å; V374-F396 HydrophobicContact CB-CE1 4.25Å; V374-F396 HydrophobicContact CB-CZ 4Å; V374-F396 HydrophobicContact CG2-CE1 4.16Å; V374-F396 HydrophobicContact CG2-CE2 3.74Å; V374-F396 HydrophobicContact CG2-CZ 3.48Å; V374-F396 VanDerWaalsContact CG2-CZ 3.48Å; I376-F396 HydrophobicContact CD1-CE2 4.43Å; I376-F396 HydrophobicContact CG1-CE2 3.93Å; I376-F396 HydrophobicContact CG1-CZ 3.79Å; F385-F396 HydrophobicContact CB-CD2 4.01Å; F385-F396 HydrophobicContact CB-CE2 3.58Å; F385-F396 HydrophobicContact CB-CZ 4.08Å; F385-F396 HydrophobicContact CD2-CD2 4.48Å; F385-F396 HydrophobicContact CD2-CE2 4.12Å; F385-F396 HydrophobicContact CG-CE2 4.28Å; F385-F396 PolarHBondContact N-O 3.4Å; F385-F396 PolarHBondContact O-N 3.26Å; F396-V401 HydrophobicContact CD2-CG1 3.63Å; F396-V401 HydrophobicContact CD2-CG2 4.12Å; F396-V401 HydrophobicContact CE2-CB 4.46Å; F396-V401 HydrophobicContact CE2-CG1 3.81Å; F396-V401 HydrophobicContact CE2-CG2 3.97Å
397	P	92.6	Very high	85.8	Confident	15 Å²	15	63.7 Å²	63.7	10%	0.097	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	137.6	-176.3	-21.1	33.2	0	0	0	113.4	F358 N383 W384 S399 Y400	F358-P397 HydrophobicContact CD2-CG 4.26Å; F358-P397 HydrophobicContact CE2-CG 3.87Å; F358-P397 HydrophobicContact CZ-CG 4.03Å; N383-P397 CarbonylContact O-C 3.32Å; N383-P397 VanDerWaalsContact O-CA 3.3Å; N383-P397 WeakPolarHBondContact O-CA 3.47Å; W384-P397 HydrophobicContact CE3-CG 4.28Å; W384-P397 HydrophobicContact CH2-CG 4.03Å; W384-P397 HydrophobicContact CZ3-CG 3.89Å; P397-S399 PolarHBondContact O-N 2.9Å; P397-Y400 HydrophobicContact CB-CD2 3.79Å; P397-Y400 HydrophobicContact CB-CG 4.37Å; P397-Y400 HydrophobicContact CG-CD2 4.04Å; P397-Y400 HydrophobicContact CG-CG 4.44Å; P397-Y400 PolarHBondContact O-N 2.82Å
398	T	90.8	Very high	83.5	Confident	38 Å²	38	69.5 Å²	69.5	23%	0.233	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-32	175.4	-65	0	0	0	0	113.1	N383 W384 F385 V401	N383-T398 VanDerWaalsContact C-OG1 3.25Å; N383-T398 PolarHBondContact O-N 3.36Å; N383-T398 PolarHBondContact O-OG1 3.39Å; W384-T398 PolarHBondContact N-OG1 3.05Å; F385-T398 HydrophobicContact CD2-CG2 4.47Å; F385-T398 HydrophobicContact CE2-CG2 3.64Å; F385-T398 HydrophobicContact CZ-CG2 3.82Å; T398-V401 VanDerWaalsContact O-O 3.11Å
399	S	90.6	Very high	81.2	Confident	79 Å²	79	73.6 Å²	73.6	55%	0.552	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-22.7	178.5	47.8	0	0	0	0	114.2	P397 V401	P397-S399 PolarHBondContact O-N 2.9Å; S399-V401 VanDerWaalsContact C-N 3.34Å
400	Y	90.1	Very high	78.9	Confident	90 Å²	90	78.7 Å²	78.7	35%	0.353	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-11.2	-178.4	-83.1	-112.8	0	0	0	112.8	K355 F356 D357 F358 P397	K355-Y400 WeakPolarHBondContact CB-O 3.43Å; K355-Y400 PolarHBondContact N-O 2.83Å; F356-Y400 HydrophobicContact CB-CD1 3.76Å; F356-Y400 HydrophobicContact CB-CE1 4.01Å; D357-Y400 WeakPolarHBondContact O-CE1 3.27Å; F358-Y400 HydrophobicContact CB-CD1 3.84Å; F358-Y400 HydrophobicContact CB-CE1 4.36Å; F358-Y400 HydrophobicContact CD2-CD1 4.13Å; F358-Y400 HydrophobicContact CD2-CE1 4.15Å; F358-Y400 HydrophobicContact CG-CD1 4.32Å; P397-Y400 HydrophobicContact CB-CD2 3.79Å; P397-Y400 HydrophobicContact CB-CG 4.37Å; P397-Y400 HydrophobicContact CG-CD2 4.04Å; P397-Y400 HydrophobicContact CG-CG 4.44Å; P397-Y400 PolarHBondContact O-N 2.82Å
401	V	90.6	Very high	77.3	Confident	8 Å²	8	76.4 Å²	76.4	5%	0.048	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	155.7	178.5	-57.8	0	0	0	0	112.1	A352 R353 V354 L368 V374 F385 F396 T398 S399	A352-V401 HydrophobicContact CB-CB 4.03Å; A352-V401 HydrophobicContact CB-CG2 4.18Å; R353-V401 CarbonylContact O-C 3.53Å; R353-V401 WeakPolarHBondContact O-CA 3.03Å; V354-V401 HydrophobicContact CG2-CG1 4.34Å; L368-V401 HydrophobicContact CD1-CG1 4.03Å; V374-V401 HydrophobicContact CG2-CG1 4.11Å; F385-V401 HydrophobicContact CD2-CG2 3.57Å; F385-V401 HydrophobicContact CE2-CG2 3.72Å; F396-V401 HydrophobicContact CD2-CG1 3.63Å; F396-V401 HydrophobicContact CD2-CG2 4.12Å; F396-V401 HydrophobicContact CE2-CB 4.46Å; F396-V401 HydrophobicContact CE2-CG1 3.81Å; F396-V401 HydrophobicContact CE2-CG2 3.97Å; T398-V401 VanDerWaalsContact O-O 3.11Å; S399-V401 VanDerWaalsContact C-N 3.34Å
402	E	91.9	Very high	75.2	Confident	76 Å²	76	78.9 Å²	78.9	36%	0.355	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	103.9	172	-174.8	174.7	-140.8	0	0	107.7	A352 R353 K355 L404	A352-E402 CarbonylContact C-O 3.45Å; A352-E402 WeakPolarHBondContact CA-O 3.38Å; A352-E402 WeakPolarHBondContact CB-O 3.4Å; R353-E402 HydrophobicContact CB-CB 4.5Å; R353-E402 IonicContact CZ-OE2 3.27Å; R353-E402 VanDerWaalsContact CZ-OE2 3.25Å; R353-E402 PolarHBondContact N-O 2.82Å; R353-E402 IonicContact NE-OE2 3.22Å; R353-E402 PolarHBondContact NE-OE2 2.89Å; R353-E402 IonicContact NH2-OE1 2.86Å; R353-E402 IonicContact NH2-OE2 3.32Å; R353-E402 PolarHBondContact NH2-OE2 2.87Å; R353-E402 PolarHBondContact O-N 3.43Å; K355-E402 HydrophobicContact CD-CB 3.94Å; K355-E402 HydrophobicContact CG-CB 3.84Å; E402-L404 PolarHBondContact O-N 3.32Å
403	V	89.5	Confident	73.2	Confident	57 Å²	57	77 Å²	77	35%	0.345	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	112.6	177.1	-171.3	0	0	0	0	108.4	K350 I376 F385	K350-V403 HydrophobicContact CB-CG1 4.03Å; K350-V403 HydrophobicContact CD-CG1 4.09Å; I376-V403 HydrophobicContact CD1-CG1 4.32Å; I376-V403 HydrophobicContact CD1-CG2 3.77Å; F385-V403 HydrophobicContact CE1-CG2 4.33Å; F385-V403 HydrophobicContact CE2-CG2 3.51Å; F385-V403 HydrophobicContact CZ-CG2 3.4Å
404	L	84	Confident	71.2	Confident	56 Å²	56	82.7 Å²	82.7	29%	0.293	46%	0.455	S	S	.	.			trans	-71.2	138.6	176.9	-55.4	178	0	0	0	107.9	A351 R353 I373 E402	A351-L404 HydrophobicContact CB-CD1 4.25Å; A351-L404 VanDerWaalsContact O-CB 3.27Å; A351-L404 WeakPolarHBondContact O-CB 3.44Å; A351-L404 PolarHBondContact O-N 2.91Å; R353-L404 HydrophobicContact CB-CD2 4.13Å; R353-L404 HydrophobicContact CB-CG 4.49Å; I373-L404 HydrophobicContact CD1-CD1 4.36Å; E402-L404 PolarHBondContact O-N 3.32Å
405	P	76	Confident	68.9	Low	104 Å²	104	86.2 Å²	86.2	68%	0.675	48%	0.478	S	S	*	.			trans	-58	129.3	179.1	23.3	-33	0	0	0	109.2	T407	P405-T407 PolarHBondContact O-N 2.66Å; P405-T407 PolarHBondContact O-OG1 2.99Å
406	P	63.3	Low	66.4	Low	64 Å²	64	88 Å²	88	42%	0.416	49%	0.492	S	S	.	.			trans	-62.9	106	178.5	-21.6	33.1	0	0	0	109.4	K350 E408	K350-P406 HydrophobicContact CD-CG 4.19Å; K350-P406 HydrophobicContact CG-CG 4.09Å; P406-E408 PolarHBondContact O-N 2.96Å
407	T	49.9	Very low	64.2	Low	127 Å²	127	93.6 Å²	93.6	78%	0.779	53%	0.526	S	S	*	.			trans	-69.2	88.7	-168.9	-40.5	0	0	0	0	111.5	P405 K409	P405-T407 PolarHBondContact O-N 2.66Å; P405-T407 PolarHBondContact O-OG1 2.99Å; T407-K409 PolarHBondContact O-N 3.37Å
408	E	43.7	Very low	62.2	Low	121 Å²	121	95.5 Å²	95.5	57%	0.565	54%	0.535	S	S	*	.			trans	-72.5	77	179.4	-168.3	84	-124.1	0	0	111.1	K348 P406	K348-E408 IonicContact NZ-OE1 3.25Å; K348-E408 PolarHBondContact NZ-OE1 2.92Å; K348-E408 IonicContact NZ-OE2 3.03Å; K348-E408 PolarHBondContact NZ-OE2 2.84Å; P406-E408 PolarHBondContact O-N 2.96Å
409	K	43.6	Very low	60.4	Low	160 Å²	160	98.2 Å²	98.2	70%	0.696	55%	0.546	S	S	*	.	S	Bend	trans	78.7	154.9	165.6	-58.8	176.3	-172.7	175.6	0	114.8	T407	T407-K409 PolarHBondContact O-N 3.37Å
410	P	43.5	Very low	59.1	Low	121 Å²	121	96 Å²	96	79%	0.786	53%	0.528	S	S	*	.				-105	126.7	-129.3	35.6	-34.8	0	0	0	115.9
411	T	45.6	Very low	57.7	Low	108 Å²	108	97 Å²	97	66%	0.663	54%	0.54	S	S	*	.			trans	-119.2	124.3	147.9	48	0	0	0	0	108.2	I413	T411-I413 PolarHBondContact O-N 2.87Å
412	P	38.8	Very low	56.9	Low	116 Å²	116	99.4 Å²	99.4	75%	0.753	55%	0.55	S	S	*	*			trans	-77.8	91.2	-175.6	29.9	-34	0	0	0	111.4	K414	P412-K414 VanDerWaalsContact C-N 3.33Å
413	I	46	Very low	56.3	Low	153 Å²	153	101.3 Å²	101.3	79%	0.785	56%	0.555	S	S	*	*			trans	-102.2	44.8	169.5	-39.3	-175.5	0	0	0	111	T411	T411-I413 PolarHBondContact O-N 2.87Å
414	K	46.5	Very low	56	Low	190 Å²	190	98.7 Å²	98.7	83%	0.826	54%	0.539	S	S	*	.	S	Bend		-113.5	116.2	124.7	-68.4	-175.4	-178.8	-178.1	0	105.5	P412 P416	P412-K414 VanDerWaalsContact C-N 3.33Å; K414-P416 WeakPolarHBondContact O-CD 2.97Å
415	S	42	Very low	56.3	Low	85 Å²	85	99.9 Å²	99.9	59%	0.594	54%	0.544	S	S	*	.			trans	-58.8	121.9	161.4	47.3	0	0	0	0	107	T417	S415-T417 PolarHBondContact O-N 2.74Å
416	P	41.2	Very low	57	Low	79 Å²	79	95 Å²	95	51%	0.513	51%	0.511	S	S	.	.			trans	-60.3	138.4	174.6	26.6	-33.8	0	0	0	108.4	K414 L418 Q419	K414-P416 WeakPolarHBondContact O-CD 2.97Å; P416-L418 WeakPolarHBondContact CG-O 3.48Å; P416-L418 CarbonylContact O-C 3.57Å; P416-L418 PolarHBondContact O-N 3.13Å; P416-Q419 HydrophobicContact CG-CG 4.37Å; P416-Q419 PolarHBondContact O-N 3.18Å
417	T	47.3	Very low	58.4	Low	118 Å²	118	94.8 Å²	94.8	72%	0.724	51%	0.507	S	S	*	.	S	Bend	trans	-57.1	-18.3	-179.5	-39.7	0	0	0	0	112.5	S415	S415-T417 PolarHBondContact O-N 2.74Å
418	L	51	Low	60.5	Low	55 Å²	55	89 Å²	89	29%	0.288	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	102.3	162	-60.3	174.8	0	0	0	109.1	P416 V420 T485 Y487	P416-L418 WeakPolarHBondContact CG-O 3.48Å; P416-L418 CarbonylContact O-C 3.57Å; P416-L418 PolarHBondContact O-N 3.13Å; L418-V420 PolarHBondContact O-N 3.36Å; L418-T485 HydrophobicContact CB-CG2 4.22Å; L418-T485 HydrophobicContact CD2-CG2 4.45Å; L418-Y487 HydrophobicContact CD2-CD1 3.61Å; L418-Y487 HydrophobicContact CD2-CE1 3.53Å; L418-Y487 HydrophobicContact CD2-CE2 4.44Å; L418-Y487 HydrophobicContact CD2-CG 4.12Å
419	Q	53.7	Low	62.7	Low	96 Å²	96	86.3 Å²	86.3	45%	0.449	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	107.1	159.6	-76.1	-169.6	3.6	0	0	108	P416 L421 T485 K486	P416-Q419 HydrophobicContact CG-CG 4.37Å; P416-Q419 PolarHBondContact O-N 3.18Å; Q419-L421 PolarHBondContact O-N 2.95Å; Q419-T485 WeakPolarHBondContact O-CA 3.33Å; Q419-K486 PolarHBondContact O-N 3Å; Q419-K486 VanDerWaalsContact O-N 3.12Å
420	V	62.6	Low	65	Low	31 Å²	31	84.9 Å²	84.9	19%	0.188	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	83.7	165.4	-171.5	0	0	0	0	107.1	L418 E422 Y423 T451 P483 T485	L418-V420 PolarHBondContact O-N 3.36Å; V420-E422 PolarHBondContact O-N 3.47Å; V420-Y423 HydrophobicContact CB-CD1 4.35Å; V420-Y423 HydrophobicContact CB-CE1 3.99Å; V420-Y423 HydrophobicContact CG1-CD1 3.51Å; V420-Y423 HydrophobicContact CG1-CE1 3.65Å; V420-Y423 HydrophobicContact CG1-CG 4.18Å; V420-Y423 HydrophobicContact CG2-CE1 4.46Å; V420-T451 VanDerWaalsContact CG1-O 3.29Å; V420-T451 WeakPolarHBondContact CG1-O 3.3Å; V420-T451 HydrophobicContact CG2-CG2 3.95Å; V420-T451 WeakPolarHBondContact CG2-O 3.41Å; V420-P483 HydrophobicContact CG1-CB 4.5Å; V420-T485 HydrophobicContact CG2-CG2 4.07Å
421	L	60.7	Low	67.3	Low	113 Å²	113	84.1 Å²	84.1	59%	0.592	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.3	-26.2	-175.3	-154.3	74.6	0	0	0	111.3	Q419 R484	Q419-L421 PolarHBondContact O-N 2.95Å; L421-R484 PolarHBondContact N-O 3.14Å
422	E	73.6	Confident	69.5	Low	58 Å²	58	80.1 Å²	80.1	27%	0.271	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	116	178.2	-175.1	167.2	-142	0	0	108.5	V420 K481 P483 R484	V420-E422 PolarHBondContact O-N 3.47Å; E422-K481 VanDerWaalsContact CD-NZ 3.3Å; E422-K481 VanDerWaalsContact CG-CE 3.49Å; E422-K481 VanDerWaalsContact CG-NZ 3.28Å; E422-K481 WeakPolarHBondContact OE1-CE 3.4Å; E422-K481 IonicContact OE1-NZ 3.26Å; E422-K481 PolarHBondContact OE1-NZ 3.28Å; E422-P483 CarbonylContact O-C 3.39Å; E422-P483 VanDerWaalsContact O-CA 3.28Å; E422-P483 WeakPolarHBondContact O-CA 3.32Å; E422-R484 HydrophobicContact CB-CB 4.05Å; E422-R484 HydrophobicContact CB-CG 4.46Å; E422-R484 PolarHBondContact N-O 3.4Å; E422-R484 PolarHBondContact O-N 2.96Å; E422-R484 WeakPolarHBondContact OE2-CD 3.31Å; E422-R484 IonicContact OE2-CZ 2.66Å; E422-R484 IonicContact OE2-NE 3.89Å; E422-R484 IonicContact OE2-NH1 2.75Å; E422-R484 PolarHBondContact OE2-NH1 3.47Å
423	Y	79.1	Confident	72	Confident	115 Å²	115	80.8 Å²	80.8	45%	0.451	41%	0.412	S	S	.	.			trans	-66.4	139	171.9	-70.9	-64.9	0	0	0	110.1	V420 R462	V420-Y423 HydrophobicContact CB-CD1 4.35Å; V420-Y423 HydrophobicContact CB-CE1 3.99Å; V420-Y423 HydrophobicContact CG1-CD1 3.51Å; V420-Y423 HydrophobicContact CG1-CE1 3.65Å; V420-Y423 HydrophobicContact CG1-CG 4.18Å; V420-Y423 HydrophobicContact CG2-CE1 4.46Å; Y423-R462 VanDerWaalsContact CE2-NH2 3.28Å; Y423-R462 VanDerWaalsContact CZ-NH2 3.26Å
424	G	84.1	Confident	74.1	Confident	2 Å²	2	74.9 Å²	74.9	2%	0.021	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	166.8	169.7	0	0	0	0	0	111.6	C449 I450 K481	G424-C449 CarbonylContact O-C 3.56Å; G424-C449 WeakPolarHBondContact O-CA 3.35Å; G424-I450 PolarHBondContact N-O 3.37Å; G424-I450 PolarHBondContact O-N 3.09Å; G424-K481 CarbonylContact C-O 3.55Å; G424-K481 WeakPolarHBondContact CA-O 3.45Å
425	E	90.3	Very high	76.1	Confident	82 Å²	82	72.9 Å²	72.9	38%	0.383	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	126.9	178	-171.9	-177	172.2	0	0	109.1	V447 N480 K481	E425-V447 HydrophobicContact CG-CG1 3.91Å; E425-N480 HydrophobicContact CB-CB 4.43Å; E425-N480 PolarHBondContact O-N 2.95Å; E425-K481 HydrophobicContact CB-CB 4.15Å; E425-K481 PolarHBondContact N-O 3.49Å; E425-K481 PolarHBondContact O-N 2.96Å; E425-K481 VanDerWaalsContact O-N 3.11Å
426	A	90.9	Very high	78.2	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	138.6	176.4	0	0	0	0	0	110.4	I448 I450 V477 Q478	A426-I448 HydrophobicContact CB-CB 4.27Å; A426-I448 PolarHBondContact N-O 2.9Å; A426-I448 PolarHBondContact O-N 2.93Å; A426-I450 HydrophobicContact CB-CD1 3.86Å; A426-I450 HydrophobicContact CB-CG1 3.8Å; A426-V477 HydrophobicContact CB-CB 3.94Å; A426-V477 HydrophobicContact CB-CG1 4.28Å; A426-V477 HydrophobicContact CB-CG2 3.94Å; A426-Q478 CarbonylContact C-O 3.57Å; A426-Q478 VanDerWaalsContact CA-O 3.28Å; A426-Q478 WeakPolarHBondContact CA-O 3.38Å
427	L	92.8	Very high	80.2	Confident	61 Å²	61	76.3 Å²	76.3	32%	0.319	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	125.3	169.8	-77.8	168.2	0	0	0	109.7	L429 V447 V477 Q478 N480	L427-L429 PolarHBondContact O-N 3.39Å; L427-V447 HydrophobicContact CD2-CG2 3.78Å; L427-V477 CarbonylContact O-C 3.5Å; L427-V477 VanDerWaalsContact O-CA 3.25Å; L427-V477 WeakPolarHBondContact O-CA 3.42Å; L427-Q478 PolarHBondContact N-O 2.63Å; L427-Q478 PolarHBondContact O-N 3.16Å; L427-N480 WeakPolarHBondContact CD1-ND2 3.46Å
428	A	93.1	Very high	82.2	Confident	4 Å²	4	74.6 Å²	74.6	3%	0.033	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	116.2	173.7	0	0	0	0	0	111.8	F442 R443 K444 G445 E446 I448	A428-F442 HydrophobicContact CB-CD2 3.34Å; A428-F442 HydrophobicContact CB-CE2 3.6Å; A428-F442 HydrophobicContact CB-CG 4.19Å; A428-R443 WeakPolarHBondContact CB-O 3.45Å; A428-K444 WeakPolarHBondContact O-CA 3.28Å; A428-G445 PolarHBondContact O-N 2.89Å; A428-E446 PolarHBondContact N-O 2.96Å; A428-I448 HydrophobicContact CB-CD1 4.5Å
429	L	91.3	Very high	84.2	Confident	65 Å²	65	73.4 Å²	73.4	34%	0.34	38%	0.381	S	S	.	.	S	Bend	trans	-82.4	-23	176.7	-69.2	176.3	0	0	0	112.5	L427 K444 Y476 Q478	L427-L429 PolarHBondContact O-N 3.39Å; L429-K444 WeakPolarHBondContact O-CD 3.25Å; L429-K444 WeakPolarHBondContact O-CE 3.42Å; L429-K444 WeakPolarHBondContact O-CG 3.18Å; L429-K444 PolarHBondContact O-NZ 3.37Å; L429-Y476 PolarHBondContact N-O 2.86Å; L429-Q478 HydrophobicContact CD1-CB 4.12Å; L429-Q478 HydrophobicContact CD2-CB 4.04Å; L429-Q478 HydrophobicContact CG-CB 4.07Å
430	Y	91.6	Very high	86.1	Confident	131 Å²	131	69 Å²	69	51%	0.514	36%	0.36	S	S	.	.	S	Bend	trans	-138.4	169.3	-176.6	-55.4	-81.9	0	0	0	110.4	F442 K444	Y430-F442 WeakPolarHBondContact O-CE2 3.26Å; Y430-K444 PolarHBondContact O-N 2.76Å
431	N	90.7	Very high	87.5	Confident	104 Å²	104	69 Å²	69	56%	0.556	36%	0.362	S	S	*	.			trans	-78.7	137.8	165.3	-58.6	-30.1	0	0	0	108.5	R443 K444	N431-R443 WeakPolarHBondContact OD1-CA 3.43Å; N431-K444 PolarHBondContact OD1-N 2.83Å
432	F	92.3	Very high	89	Confident	25 Å²	25	63.8 Å²	63.8	11%	0.11	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	-128.9	118.4	172.9	179.9	-104.5	0	0	0	108.6	E439 L440 S441 F442 F472 P473 Y476	F432-E439 HydrophobicContact CE1-CB 4.23Å; F432-L440 WeakPolarHBondContact CD1-O 3.46Å; F432-S441 CarbonylContact O-C 3.46Å; F432-S441 WeakPolarHBondContact O-CA 3.4Å; F432-S441 WeakPolarHBondContact O-CB 3.43Å; F432-F442 HydrophobicContact CB-CD1 4.38Å; F432-F442 HydrophobicContact CB-CD2 3.98Å; F432-F442 HydrophobicContact CB-CE1 4.02Å; F432-F442 HydrophobicContact CB-CE2 3.57Å; F432-F442 HydrophobicContact CB-CG 4.38Å; F432-F442 HydrophobicContact CB-CZ 3.6Å; F432-F442 HydrophobicContact CD1-CE1 4.13Å; F432-F442 HydrophobicContact CD1-CZ 4.44Å; F432-F442 HydrophobicContact CG-CE1 4.38Å; F432-F442 HydrophobicContact CG-CZ 4.23Å; F432-F442 PolarHBondContact N-O 3.17Å; F432-F442 PolarHBondContact O-N 3.36Å; F432-F442 VanDerWaalsContact O-O 3.1Å; F432-F472 HydrophobicContact CD1-CB 4.49Å; F432-F472 HydrophobicContact CE1-CB 4.45Å; F432-P473 HydrophobicContact CD2-CG 4.31Å; F432-P473 HydrophobicContact CE2-CG 3.81Å; F432-P473 HydrophobicContact CZ-CG 4.19Å; F432-Y476 HydrophobicContact CB-CD1 3.98Å; F432-Y476 HydrophobicContact CD2-CD1 4.02Å; F432-Y476 HydrophobicContact CD2-CE1 4.17Å; F432-Y476 HydrophobicContact CD2-CG 4.42Å; F432-Y476 HydrophobicContact CG-CD1 4.42Å
433	N	92.3	Very high	89.9	Confident	129 Å²	129	69 Å²	69	69%	0.69	35%	0.351	S	S	*	.			trans	-91.6	141.4	169.2	-65.8	-29.8	0	0	0	107.8
434	A	90.1	Very high	90.5	Very high	29 Å²	29	70 Å²	70	24%	0.24	36%	0.358	C	S	.	.			trans	-94.6	121.3	179.6	0	0	0	0	0	107.6	E439 S441	A434-E439 HydrophobicContact CB-CB 3.54Å; A434-E439 WeakPolarHBondContact CB-O 3.18Å; A434-S441 WeakPolarHBondContact CB-OG 3.46Å
435	D	87	Confident	90.7	Very high	149 Å²	149	72.4 Å²	72.4	80%	0.797	38%	0.383	S	S	*	.	S	Bend	trans	-90.5	-22.8	176.3	-65.7	-32.9	0	0	0	110.3	E439	D435-E439 PolarHBondContact N-OE2 2.84Å
436	L	87.3	Confident	90.8	Very high	97 Å²	97	70.4 Å²	70.4	51%	0.508	37%	0.374	S	S	.	.	S	Bend	trans	-108.3	145.4	176.5	-58.4	177.4	0	0	0	112.7	V438 E439	L436-V438 HydrophobicContact CB-CG1 4.05Å; L436-V438 PolarHBondContact O-N 2.66Å; L436-E439 HydrophobicContact CB-CG 4.06Å; L436-E439 PolarHBondContact N-OE2 2.74Å; L436-E439 WeakPolarHBondContact O-CB 3.43Å; L436-E439 PolarHBondContact O-N 3.03Å
437	P	82	Confident	90.9	Very high	139 Å²	139	73 Å²	73	90%	0.903	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-12.3	176.6	-25.2	35	0	0	0	115.9
438	V	90.4	Very high	90.9	Very high	81 Å²	81	70.1 Å²	70.1	49%	0.491	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-11.6	175.8	70	0	0	0	0	112.5	L436 G470 I471	L436-V438 HydrophobicContact CB-CG1 4.05Å; L436-V438 PolarHBondContact O-N 2.66Å; V438-G470 CarbonylContact O-C 3.51Å; V438-G470 WeakPolarHBondContact O-CA 3.23Å; V438-I471 HydrophobicContact CG1-CD1 4.16Å; V438-I471 HydrophobicContact CG1-CG1 4.31Å; V438-I471 PolarHBondContact O-N 3.25Å
439	E	93.1	Very high	90.8	Very high	31 Å²	31	71.1 Å²	71.1	15%	0.145	38%	0.381	C	S	.	.	B	Isolated β-bridge	trans	-92.1	144.9	-175.2	-72.3	172.3	159.8	0	0	112.7	F432 A434 D435 L436 W458 I471	F432-E439 HydrophobicContact CE1-CB 4.23Å; A434-E439 HydrophobicContact CB-CB 3.54Å; A434-E439 WeakPolarHBondContact CB-O 3.18Å; D435-E439 PolarHBondContact N-OE2 2.84Å; L436-E439 HydrophobicContact CB-CG 4.06Å; L436-E439 PolarHBondContact N-OE2 2.74Å; L436-E439 WeakPolarHBondContact O-CB 3.43Å; L436-E439 PolarHBondContact O-N 3.03Å; E439-W458 HydrophobicContact CG-CZ3 4.35Å; E439-W458 WeakPolarHBondContact OE1-CH2 3.3Å; E439-I471 CarbonylContact C-O 3.49Å; E439-I471 VanDerWaalsContact CA-O 3.23Å; E439-I471 WeakPolarHBondContact CA-O 3.41Å; E439-I471 HydrophobicContact CG-CG1 4Å
440	L	91.9	Very high	90.9	Very high	2 Å²	2	68 Å²	68	1%	0.01	37%	0.365	C	S	.	.			trans	-96	98	-179.5	-178.3	58.7	0	0	0	111.2	F432 F442 I448 I463 R468 I471 F472	F432-L440 WeakPolarHBondContact CD1-O 3.46Å; L440-F442 HydrophobicContact CG-CD1 4.45Å; L440-F442 WeakPolarHBondContact O-CD1 3.32Å; L440-I448 HydrophobicContact CD2-CG2 3.71Å; L440-I463 HydrophobicContact CD1-CD1 3.76Å; L440-I463 HydrophobicContact CD1-CG1 4.06Å; L440-I463 HydrophobicContact CD2-CG1 4.21Å; L440-I463 HydrophobicContact CG-CD1 4.19Å; L440-I463 HydrophobicContact CG-CG1 4.31Å; L440-R468 HydrophobicContact CD1-CB 3.99Å; L440-R468 WeakPolarHBondContact CD1-O 3.2Å; L440-I471 PolarHBondContact N-O 3.02Å; L440-F472 HydrophobicContact CB-CD1 4.03Å; L440-F472 HydrophobicContact CD2-CD1 3.86Å; L440-F472 HydrophobicContact CD2-CE1 3.97Å; L440-F472 HydrophobicContact CG-CD1 4.47Å
441	S	92.7	Very high	90.7	Very high	32 Å²	32	63.2 Å²	63.2	22%	0.224	35%	0.349	C	S	.	.			trans	-70.7	134.8	173.3	20.9	0	0	0	0	112.3	F432 A434 I463 R468	F432-S441 CarbonylContact O-C 3.46Å; F432-S441 WeakPolarHBondContact O-CA 3.4Å; F432-S441 WeakPolarHBondContact O-CB 3.43Å; A434-S441 WeakPolarHBondContact CB-OG 3.46Å; S441-I463 WeakPolarHBondContact O-CD1 3.28Å; S441-R468 PolarHBondContact O-NH1 2.97Å; S441-R468 PolarHBondContact O-NH2 3.37Å; S441-R468 PolarHBondContact OG-NH2 3.35Å
442	F	93.3	Very high	90.6	Very high	4 Å²	4	61.6 Å²	61.6	2%	0.018	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-148	164.5	178.5	51.9	-104.8	0	0	0	112.1	A428 Y430 F432 L440 E446 I448 I463 F472 V477	A428-F442 HydrophobicContact CB-CD2 3.34Å; A428-F442 HydrophobicContact CB-CE2 3.6Å; A428-F442 HydrophobicContact CB-CG 4.19Å; Y430-F442 WeakPolarHBondContact O-CE2 3.26Å; F432-F442 HydrophobicContact CB-CD1 4.38Å; F432-F442 HydrophobicContact CB-CD2 3.98Å; F432-F442 HydrophobicContact CB-CE1 4.02Å; F432-F442 HydrophobicContact CB-CE2 3.57Å; F432-F442 HydrophobicContact CB-CG 4.38Å; F432-F442 HydrophobicContact CB-CZ 3.6Å; F432-F442 HydrophobicContact CD1-CE1 4.13Å; F432-F442 HydrophobicContact CD1-CZ 4.44Å; F432-F442 HydrophobicContact CG-CE1 4.38Å; F432-F442 HydrophobicContact CG-CZ 4.23Å; F432-F442 PolarHBondContact N-O 3.17Å; F432-F442 PolarHBondContact O-N 3.36Å; F432-F442 VanDerWaalsContact O-O 3.1Å; L440-F442 HydrophobicContact CG-CD1 4.45Å; L440-F442 WeakPolarHBondContact O-CD1 3.32Å; F442-E446 VanDerWaalsContact CA-OE2 3.31Å; F442-E446 WeakPolarHBondContact CA-OE2 3.48Å; F442-E446 HydrophobicContact CB-CB 4.47Å; F442-E446 WeakPolarHBondContact CB-OE2 3.49Å; F442-I448 HydrophobicContact CB-CD1 4.39Å; F442-I448 HydrophobicContact CD1-CD1 3.4Å; F442-I448 VanDerWaalsContact CD1-CD1 3.4Å; F442-I448 HydrophobicContact CD1-CG1 4.37Å; F442-I448 HydrophobicContact CD2-CD1 4.29Å; F442-I448 HydrophobicContact CE1-CD1 3.55Å; F442-I448 HydrophobicContact CE2-CD1 4.42Å; F442-I448 HydrophobicContact CG-CD1 3.79Å; F442-I448 HydrophobicContact CZ-CD1 4.08Å; F442-I463 HydrophobicContact CB-CD1 3.97Å; F442-F472 HydrophobicContact CE1-CB 3.63Å; F442-F472 AromaticContact CE1-CD2 3.92Å; F442-F472 HydrophobicContact CE1-CD2 3.92Å; F442-F472 AromaticContact CE1-CG 3.79Å; F442-F472 HydrophobicContact CE1-CG 3.79Å; F442-F472 HydrophobicContact CZ-CB 4.38Å; F442-F472 HydrophobicContact CZ-CD2 4.34Å; F442-V477 HydrophobicContact CE1-CG1 4.34Å; F442-V477 HydrophobicContact CE2-CG1 4.31Å; F442-V477 HydrophobicContact CZ-CG1 3.77Å
443	R	92.1	Very high	90.4	Very high	166 Å²	166	63.8 Å²	63.8	63%	0.626	35%	0.346	S	S	*	.			trans	-104.1	156.1	169.6	-67.8	170.9	-63.4	-150.2	-2.2	111.7	A428 N431 G445 E446	A428-R443 WeakPolarHBondContact CB-O 3.45Å; N431-R443 WeakPolarHBondContact OD1-CA 3.43Å; R443-G445 PolarHBondContact O-N 3.31Å; R443-E446 HydrophobicContact CB-CG 4.32Å; R443-E446 IonicContact CZ-OE1 3.99Å; R443-E446 VanDerWaalsContact CZ-OE1 3.26Å; R443-E446 PolarHBondContact N-OE2 2.82Å; R443-E446 IonicContact NE-OE1 3.12Å; R443-E446 PolarHBondContact NE-OE1 3.03Å; R443-E446 IonicContact NH2-OE1 3.54Å; R443-E446 PolarHBondContact NH2-OE1 2.98Å; R443-E446 VanDerWaalsContact O-CB 3.32Å; R443-E446 WeakPolarHBondContact O-CB 3.25Å; R443-E446 WeakPolarHBondContact O-CG 3.16Å; R443-E446 PolarHBondContact O-N 2.94Å
444	K	91.6	Very high	90.1	Very high	137 Å²	137	60.4 Å²	60.4	60%	0.596	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	129.5	172.5	179.8	170.5	-172.8	135.5	0	110.8	A428 L429 Y430 N431	A428-K444 WeakPolarHBondContact O-CA 3.28Å; L429-K444 WeakPolarHBondContact O-CD 3.25Å; L429-K444 WeakPolarHBondContact O-CE 3.42Å; L429-K444 WeakPolarHBondContact O-CG 3.18Å; L429-K444 PolarHBondContact O-NZ 3.37Å; Y430-K444 PolarHBondContact O-N 2.76Å; N431-K444 PolarHBondContact OD1-N 2.83Å
445	G	88.6	Confident	89.9	Confident	53 Å²	53	62.5 Å²	62.5	55%	0.546	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.3	-6.4	-177.5	0	0	0	0	0	115.4	A428 R443	A428-G445 PolarHBondContact O-N 2.89Å; R443-G445 PolarHBondContact O-N 3.31Å
446	E	92.4	Very high	89.9	Confident	39 Å²	39	62.3 Å²	62.3	18%	0.182	34%	0.336	C	S	.	.			trans	-73.1	138.1	173	-67.2	176.6	173.5	0	0	110.8	A428 F442 R443	A428-E446 PolarHBondContact N-O 2.96Å; F442-E446 VanDerWaalsContact CA-OE2 3.31Å; F442-E446 WeakPolarHBondContact CA-OE2 3.48Å; F442-E446 HydrophobicContact CB-CB 4.47Å; F442-E446 WeakPolarHBondContact CB-OE2 3.49Å; R443-E446 HydrophobicContact CB-CG 4.32Å; R443-E446 IonicContact CZ-OE1 3.99Å; R443-E446 VanDerWaalsContact CZ-OE1 3.26Å; R443-E446 PolarHBondContact N-OE2 2.82Å; R443-E446 IonicContact NE-OE1 3.12Å; R443-E446 PolarHBondContact NE-OE1 3.03Å; R443-E446 IonicContact NH2-OE1 3.54Å; R443-E446 PolarHBondContact NH2-OE1 2.98Å; R443-E446 VanDerWaalsContact O-CB 3.32Å; R443-E446 WeakPolarHBondContact O-CB 3.25Å; R443-E446 WeakPolarHBondContact O-CG 3.16Å; R443-E446 PolarHBondContact O-N 2.94Å
447	V	92.1	Very high	90.1	Very high	56 Å²	56	65.1 Å²	65.1	34%	0.339	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	123.2	179.9	-175.3	0	0	0	0	109.8	E425 L427	E425-V447 HydrophobicContact CG-CG1 3.91Å; L427-V447 HydrophobicContact CD2-CG2 3.78Å
448	I	92.8	Very high	90.6	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	120.6	-176.8	-54.7	158.4	0	0	0	108.7	A426 A428 L440 F442 I450 I463 F472 V477	A426-I448 HydrophobicContact CB-CB 4.27Å; A426-I448 PolarHBondContact N-O 2.9Å; A426-I448 PolarHBondContact O-N 2.93Å; A428-I448 HydrophobicContact CB-CD1 4.5Å; L440-I448 HydrophobicContact CD2-CG2 3.71Å; F442-I448 HydrophobicContact CB-CD1 4.39Å; F442-I448 HydrophobicContact CD1-CD1 3.4Å; F442-I448 VanDerWaalsContact CD1-CD1 3.4Å; F442-I448 HydrophobicContact CD1-CG1 4.37Å; F442-I448 HydrophobicContact CD2-CD1 4.29Å; F442-I448 HydrophobicContact CE1-CD1 3.55Å; F442-I448 HydrophobicContact CE2-CD1 4.42Å; F442-I448 HydrophobicContact CG-CD1 3.79Å; F442-I448 HydrophobicContact CZ-CD1 4.08Å; I448-I450 PolarHBondContact O-N 3.12Å; I448-I463 HydrophobicContact CG1-CG1 4.17Å; I448-F472 HydrophobicContact CB-CZ 4.38Å; I448-F472 HydrophobicContact CD1-CE2 4.29Å; I448-F472 HydrophobicContact CD1-CZ 4.37Å; I448-F472 HydrophobicContact CG2-CE1 3.58Å; I448-F472 HydrophobicContact CG2-CZ 3.58Å; I448-V477 HydrophobicContact CD1-CG1 3.83Å
449	C	92.3	Very high	90.6	Very high	25 Å²	25	58.2 Å²	58.2	17%	0.169	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	109.3	169.9	-70.5	0	0	0	0	108.9	G424 T451 G461 R462 S464	G424-C449 CarbonylContact O-C 3.56Å; G424-C449 WeakPolarHBondContact O-CA 3.35Å; C449-T451 PolarHBondContact O-N 3.28Å; C449-G461 CarbonylContact O-C 3.44Å; C449-G461 WeakPolarHBondContact O-CA 3.2Å; C449-R462 HydrophobicContact CB-CG 4.22Å; C449-R462 PolarHBondContact N-O 3Å; C449-R462 PolarHBondContact O-N 3.44Å; C449-S464 PolarHBondContact SG-OG 3.03Å
450	I	92.1	Very high	90.6	Very high	0 Å²	0	59 Å²	59	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	123.3	177.9	-38.5	172.1	0	0	0	108.2	G424 A426 I448 L459 E460 V479 P483	G424-I450 PolarHBondContact N-O 3.37Å; G424-I450 PolarHBondContact O-N 3.09Å; A426-I450 HydrophobicContact CB-CD1 3.86Å; A426-I450 HydrophobicContact CB-CG1 3.8Å; I448-I450 PolarHBondContact O-N 3.12Å; I450-L459 HydrophobicContact CD1-CD1 4.33Å; I450-L459 HydrophobicContact CG2-CB 4.16Å; I450-L459 HydrophobicContact CG2-CD2 4.41Å; I450-E460 CarbonylContact C-O 3.55Å; I450-E460 WeakPolarHBondContact CG2-O 3.5Å; I450-V479 HydrophobicContact CD1-CB 4.48Å; I450-V479 HydrophobicContact CD1-CG1 3.89Å; I450-V479 HydrophobicContact CD1-CG2 3.98Å; I450-P483 HydrophobicContact CB-CG 4.11Å; I450-P483 HydrophobicContact CG2-CG 3.73Å
451	T	88.9	Confident	90.6	Very high	29 Å²	29	59 Å²	59	18%	0.178	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-48.2	176.1	-58	0	0	0	0	110.2	V420 C449 E460 R462	V420-T451 VanDerWaalsContact CG1-O 3.29Å; V420-T451 WeakPolarHBondContact CG1-O 3.3Å; V420-T451 HydrophobicContact CG2-CG2 3.95Å; V420-T451 WeakPolarHBondContact CG2-O 3.41Å; C449-T451 PolarHBondContact O-N 3.28Å; T451-E460 PolarHBondContact N-O 3.18Å; T451-R462 PolarHBondContact OG1-NH1 3.11Å
452	R	87.6	Confident	90.6	Very high	71 Å²	71	61.1 Å²	61.1	27%	0.268	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	159.5	178	60.7	174	-177.6	110	4.6	111.4	E460 T485	R452-E460 HydrophobicContact CG-CB 3.74Å; R452-E460 IonicContact CZ-OE2 3.11Å; R452-E460 PolarHBondContact N-O 2.83Å; R452-E460 IonicContact NE-OE1 2.8Å; R452-E460 IonicContact NE-OE2 3.84Å; R452-E460 PolarHBondContact NE-OE2 2.87Å; R452-E460 IonicContact NH2-OE2 3.03Å; R452-E460 PolarHBondContact NH2-OE2 3.19Å; R452-E460 PolarHBondContact O-N 2.98Å; R452-T485 HydrophobicContact CB-CG2 4.32Å
453	Q	88	Confident	90.5	Very high	71 Å²	71	61.5 Å²	61.5	33%	0.332	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	143	157.3	-166.2	170.1	-2.6	0	0	108.9	D455 D456 L459 M482	Q453-D455 WeakPolarHBondContact CG-O 3.48Å; Q453-D455 VanDerWaalsContact NE2-C 3.34Å; Q453-D455 PolarHBondContact NE2-O 3.45Å; Q453-D456 PolarHBondContact NE2-OD1 3.49Å; Q453-L459 HydrophobicContact CB-CD2 4.37Å; Q453-L459 HydrophobicContact CG-CD2 4.09Å; Q453-M482 HydrophobicContact CB-CE 3.84Å; Q453-M482 HydrophobicContact CG-CE 3.86Å
454	V	85.8	Confident	89.9	Confident	58 Å²	58	57.1 Å²	57.1	35%	0.352	30%	0.295	S	S	.	.			trans	-99.3	-50.9	169.8	-171.9	0	0	0	0	108.8	W458 E460 I471	V454-W458 WeakPolarHBondContact CA-O 3.28Å; V454-W458 HydrophobicContact CB-CB 3.99Å; V454-W458 WeakPolarHBondContact CB-O 3.43Å; V454-W458 HydrophobicContact CG2-CB 4.46Å; V454-W458 PolarHBondContact N-O 2.89Å; V454-E460 HydrophobicContact CG2-CB 3.95Å; V454-I471 HydrophobicContact CG2-CG2 3.96Å
455	D	87.2	Confident	89.2	Confident	72 Å²	72	54.9 Å²	54.9	39%	0.385	31%	0.311	S	S	.	.	S	Bend	trans	-153.7	-170.5	170.1	60.6	49.4	0	0	0	109.4	Q453 K457 W458	Q453-D455 WeakPolarHBondContact CG-O 3.48Å; Q453-D455 VanDerWaalsContact NE2-C 3.34Å; Q453-D455 PolarHBondContact NE2-O 3.45Å; D455-K457 PolarHBondContact O-N 3.26Å; D455-K457 VanDerWaalsContact OD1-CA 3.28Å; D455-K457 WeakPolarHBondContact OD1-CA 3.37Å; D455-K457 WeakPolarHBondContact OD1-CB 3.4Å; D455-K457 PolarHBondContact OD1-N 2.97Å; D455-W458 PolarHBondContact N-O 3.48Å; D455-W458 VanDerWaalsContact N-O 3.17Å; D455-W458 VanDerWaalsContact O-O 3.09Å; D455-W458 PolarHBondContact OD1-N 2.98Å
456	D	87	Confident	88.9	Confident	146 Å²	146	55.1 Å²	55.1	78%	0.781	30%	0.301	S	S	*	.	S	Bend	trans	-68	-14.6	-180	-61.2	-41.9	0	0	0	114.7	Q453	Q453-D456 PolarHBondContact NE2-OD1 3.49Å
457	K	90.6	Very high	88.4	Confident	156 Å²	156	61.7 Å²	61.7	68%	0.678	34%	0.338	S	S	*	.	S	Bend	trans	-108.4	-22.3	-178.2	-58.7	172.4	-175	171.1	0	112.2	D455 P473 A474	D455-K457 PolarHBondContact O-N 3.26Å; D455-K457 VanDerWaalsContact OD1-CA 3.28Å; D455-K457 WeakPolarHBondContact OD1-CA 3.37Å; D455-K457 WeakPolarHBondContact OD1-CB 3.4Å; D455-K457 PolarHBondContact OD1-N 2.97Å; K457-P473 CarbonylContact O-C 3.53Å; K457-P473 VanDerWaalsContact O-CA 3.32Å; K457-P473 WeakPolarHBondContact O-CA 3.41Å; K457-A474 PolarHBondContact O-N 2.93Å
458	W	91.8	Very high	88.1	Confident	71 Å²	71	63.8 Å²	63.8	27%	0.269	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	131.2	-174.6	-69.4	96	0	0	0	113.5	E439 V454 D455 I471 F472 P473	E439-W458 HydrophobicContact CG-CZ3 4.35Å; E439-W458 WeakPolarHBondContact OE1-CH2 3.3Å; V454-W458 WeakPolarHBondContact CA-O 3.28Å; V454-W458 HydrophobicContact CB-CB 3.99Å; V454-W458 WeakPolarHBondContact CB-O 3.43Å; V454-W458 HydrophobicContact CG2-CB 4.46Å; V454-W458 PolarHBondContact N-O 2.89Å; D455-W458 PolarHBondContact N-O 3.48Å; D455-W458 VanDerWaalsContact N-O 3.17Å; D455-W458 VanDerWaalsContact O-O 3.09Å; D455-W458 PolarHBondContact OD1-N 2.98Å; W458-I471 HydrophobicContact CD2-CD1 4.47Å; W458-I471 HydrophobicContact CE3-CB 4.05Å; W458-I471 HydrophobicContact CE3-CD1 3.93Å; W458-I471 HydrophobicContact CE3-CG1 3.9Å; W458-I471 HydrophobicContact CZ3-CD1 4.08Å; W458-I471 HydrophobicContact CZ3-CG1 3.95Å; W458-F472 WeakPolarHBondContact CA-O 3.28Å; W458-P473 HydrophobicContact CE3-CG 4.44Å; W458-P473 HydrophobicContact CH2-CG 4.03Å; W458-P473 HydrophobicContact CZ2-CG 4.5Å; W458-P473 HydrophobicContact CZ3-CG 4Å
459	L	90.9	Very high	88.1	Confident	3 Å²	3	67.7 Å²	67.7	2%	0.016	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	144.6	175	-60.6	174.4	0	0	0	109	I450 Q453 I471 F472 A474 V477 V479 M482	I450-L459 HydrophobicContact CD1-CD1 4.33Å; I450-L459 HydrophobicContact CG2-CB 4.16Å; I450-L459 HydrophobicContact CG2-CD2 4.41Å; Q453-L459 HydrophobicContact CB-CD2 4.37Å; Q453-L459 HydrophobicContact CG-CD2 4.09Å; L459-I471 CarbonylContact O-C 3.58Å; L459-I471 VanDerWaalsContact O-CA 3.25Å; L459-I471 WeakPolarHBondContact O-CA 3.48Å; L459-F472 HydrophobicContact CB-CD2 4.21Å; L459-F472 HydrophobicContact CB-CE1 4.19Å; L459-F472 HydrophobicContact CB-CE2 3.66Å; L459-F472 HydrophobicContact CB-CZ 3.65Å; L459-F472 HydrophobicContact CD1-CE2 3.89Å; L459-F472 HydrophobicContact CD1-CZ 4.36Å; L459-F472 HydrophobicContact CG-CE2 4.36Å; L459-F472 PolarHBondContact N-O 2.78Å; L459-F472 WeakPolarHBondContact O-CD1 3.46Å; L459-F472 PolarHBondContact O-N 3.03Å; L459-A474 HydrophobicContact CD1-CB 4.03Å; L459-A474 HydrophobicContact CG-CB 4Å; L459-V477 HydrophobicContact CD1-CG2 3.87Å; L459-V479 HydrophobicContact CD1-CG2 3.64Å; L459-M482 HydrophobicContact CD2-CE 3.79Å
460	E	92.5	Very high	88	Confident	49 Å²	49	67 Å²	67	23%	0.229	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	137.4	169.9	-170	-162	94.2	0	0	109.4	I450 T451 R452 V454 G470 I471	I450-E460 CarbonylContact C-O 3.55Å; I450-E460 WeakPolarHBondContact CG2-O 3.5Å; T451-E460 PolarHBondContact N-O 3.18Å; R452-E460 HydrophobicContact CG-CB 3.74Å; R452-E460 IonicContact CZ-OE2 3.11Å; R452-E460 PolarHBondContact N-O 2.83Å; R452-E460 IonicContact NE-OE1 2.8Å; R452-E460 IonicContact NE-OE2 3.84Å; R452-E460 PolarHBondContact NE-OE2 2.87Å; R452-E460 IonicContact NH2-OE2 3.03Å; R452-E460 PolarHBondContact NH2-OE2 3.19Å; R452-E460 PolarHBondContact O-N 2.98Å; V454-E460 HydrophobicContact CG2-CB 3.95Å; E460-G470 WeakPolarHBondContact CA-O 3.27Å; E460-I471 HydrophobicContact CB-CG2 4.19Å; E460-I471 HydrophobicContact CG-CG2 4.22Å
461	G	91.7	Very high	88.1	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	-167.3	179.8	0	0	0	0	0	113.9	C449 S469 G470	C449-G461 CarbonylContact O-C 3.44Å; C449-G461 WeakPolarHBondContact O-CA 3.2Å; G461-S469 CarbonylContact O-C 3.59Å; G461-S469 WeakPolarHBondContact O-CA 3.02Å; G461-S469 WeakPolarHBondContact O-CB 3.19Å; G461-G470 PolarHBondContact N-O 2.93Å; G461-G470 PolarHBondContact O-N 2.82Å
462	R	93.2	Very high	88.4	Confident	78 Å²	78	67.2 Å²	67.2	29%	0.294	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	147.2	176.9	66.5	-170	-179.1	-74.9	-2	111.1	Y423 C449 T451 R468	Y423-R462 VanDerWaalsContact CE2-NH2 3.28Å; Y423-R462 VanDerWaalsContact CZ-NH2 3.26Å; C449-R462 HydrophobicContact CB-CG 4.22Å; C449-R462 PolarHBondContact N-O 3Å; C449-R462 PolarHBondContact O-N 3.44Å; T451-R462 PolarHBondContact OG1-NH1 3.11Å; R462-R468 VanDerWaalsContact CA-O 3.26Å; R462-R468 WeakPolarHBondContact CA-O 3.28Å; R462-R468 WeakPolarHBondContact CB-O 3.31Å
463	I	91.2	Very high	88.7	Confident	12 Å²	12	64.6 Å²	64.6	6%	0.062	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	122.1	177.9	-63.2	157	0	0	0	109	L440 S441 F442 I448 G465 T466 R468	L440-I463 HydrophobicContact CD1-CD1 3.76Å; L440-I463 HydrophobicContact CD1-CG1 4.06Å; L440-I463 HydrophobicContact CD2-CG1 4.21Å; L440-I463 HydrophobicContact CG-CD1 4.19Å; L440-I463 HydrophobicContact CG-CG1 4.31Å; S441-I463 WeakPolarHBondContact O-CD1 3.28Å; F442-I463 HydrophobicContact CB-CD1 3.97Å; I448-I463 HydrophobicContact CG1-CG1 4.17Å; I463-G465 PolarHBondContact O-N 2.93Å; I463-T466 HydrophobicContact CG2-CG2 4.19Å; I463-T466 PolarHBondContact O-N 2.57Å; I463-T466 PolarHBondContact O-OG1 2.81Å; I463-R468 PolarHBondContact N-O 2.86Å; I463-R468 VanDerWaalsContact N-O 3.08Å
464	S	80.1	Confident	88.9	Confident	74 Å²	74	62.4 Å²	62.4	52%	0.517	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	135.6	179.3	-83.5	0	0	0	0	112.1	C449 T466	C449-S464 PolarHBondContact SG-OG 3.03Å; S464-T466 VanDerWaalsContact C-N 3.31Å
465	G	76.5	Confident	89.2	Confident	90 Å²	90	64 Å²	64	93%	0.928	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	81	2	-175.2	0	0	0	0	0	115.1	I463	I463-G465 PolarHBondContact O-N 2.93Å
466	T	83.1	Confident	89.4	Confident	57 Å²	57	65 Å²	65	35%	0.35	36%	0.362	S	S	.	.	S	Bend	trans	-130.9	156.9	175.5	77.4	0	0	0	0	111.8	I463 S464 R468	I463-T466 HydrophobicContact CG2-CG2 4.19Å; I463-T466 PolarHBondContact O-N 2.57Å; I463-T466 PolarHBondContact O-OG1 2.81Å; S464-T466 VanDerWaalsContact C-N 3.31Å; T466-R468 PolarHBondContact O-N 3.21Å; T466-R468 WeakPolarHBondContact OG1-CB 3.17Å; T466-R468 PolarHBondContact OG1-N 3.46Å
467	N	80.9	Confident	89.7	Confident	177 Å²	177	58.5 Å²	58.5	95%	0.947	33%	0.328	S	S	*	.	S	Bend	trans	-84.9	26.1	170.3	-62.9	-35.4	0	0	0	112.3
468	R	86.6	Confident	89.7	Confident	101 Å²	101	55.9 Å²	55.9	38%	0.381	32%	0.318	S	S	.	.			trans	-99.7	118	-176.8	-58.5	171.9	70.9	-119.7	-3.3	109	L440 S441 R462 I463 T466	L440-R468 HydrophobicContact CD1-CB 3.99Å; L440-R468 WeakPolarHBondContact CD1-O 3.2Å; S441-R468 PolarHBondContact O-NH1 2.97Å; S441-R468 PolarHBondContact O-NH2 3.37Å; S441-R468 PolarHBondContact OG-NH2 3.35Å; R462-R468 VanDerWaalsContact CA-O 3.26Å; R462-R468 WeakPolarHBondContact CA-O 3.28Å; R462-R468 WeakPolarHBondContact CB-O 3.31Å; I463-R468 PolarHBondContact N-O 2.86Å; I463-R468 VanDerWaalsContact N-O 3.08Å; T466-R468 PolarHBondContact O-N 3.21Å; T466-R468 WeakPolarHBondContact OG1-CB 3.17Å; T466-R468 PolarHBondContact OG1-N 3.46Å
469	S	91.5	Very high	89.6	Confident	82 Å²	82	54.5 Å²	54.5	57%	0.573	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.3	147.5	-177.9	56.2	0	0	0	0	110.8	G461	G461-S469 CarbonylContact O-C 3.59Å; G461-S469 WeakPolarHBondContact O-CA 3.02Å; G461-S469 WeakPolarHBondContact O-CB 3.19Å
470	G	91.9	Very high	89.3	Confident	10 Å²	10	58.4 Å²	58.4	10%	0.103	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.3	-175.5	-178.7	0	0	0	0	0	112.5	V438 E460 G461	V438-G470 CarbonylContact O-C 3.51Å; V438-G470 WeakPolarHBondContact O-CA 3.23Å; E460-G470 WeakPolarHBondContact CA-O 3.27Å; G461-G470 PolarHBondContact N-O 2.93Å; G461-G470 PolarHBondContact O-N 2.82Å
471	I	94.1	Very high	88.9	Confident	33 Å²	33	60.1 Å²	60.1	17%	0.169	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	151.8	173.9	67.1	174.6	0	0	0	111.6	V438 E439 L440 V454 W458 L459 E460	V438-I471 HydrophobicContact CG1-CD1 4.16Å; V438-I471 HydrophobicContact CG1-CG1 4.31Å; V438-I471 PolarHBondContact O-N 3.25Å; E439-I471 CarbonylContact C-O 3.49Å; E439-I471 VanDerWaalsContact CA-O 3.23Å; E439-I471 WeakPolarHBondContact CA-O 3.41Å; E439-I471 HydrophobicContact CG-CG1 4Å; L440-I471 PolarHBondContact N-O 3.02Å; V454-I471 HydrophobicContact CG2-CG2 3.96Å; W458-I471 HydrophobicContact CD2-CD1 4.47Å; W458-I471 HydrophobicContact CE3-CB 4.05Å; W458-I471 HydrophobicContact CE3-CD1 3.93Å; W458-I471 HydrophobicContact CE3-CG1 3.9Å; W458-I471 HydrophobicContact CZ3-CD1 4.08Å; W458-I471 HydrophobicContact CZ3-CG1 3.95Å; L459-I471 CarbonylContact O-C 3.58Å; L459-I471 VanDerWaalsContact O-CA 3.25Å; L459-I471 WeakPolarHBondContact O-CA 3.48Å; E460-I471 HydrophobicContact CB-CG2 4.19Å; E460-I471 HydrophobicContact CG-CG2 4.22Å
472	F	94.5	Very high	88.5	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	155.9	175.9	54.8	-85.9	0	0	0	112.2	F432 L440 F442 I448 W458 L459 A474 V477	F432-F472 HydrophobicContact CD1-CB 4.49Å; F432-F472 HydrophobicContact CE1-CB 4.45Å; L440-F472 HydrophobicContact CB-CD1 4.03Å; L440-F472 HydrophobicContact CD2-CD1 3.86Å; L440-F472 HydrophobicContact CD2-CE1 3.97Å; L440-F472 HydrophobicContact CG-CD1 4.47Å; F442-F472 HydrophobicContact CE1-CB 3.63Å; F442-F472 AromaticContact CE1-CD2 3.92Å; F442-F472 HydrophobicContact CE1-CD2 3.92Å; F442-F472 AromaticContact CE1-CG 3.79Å; F442-F472 HydrophobicContact CE1-CG 3.79Å; F442-F472 HydrophobicContact CZ-CB 4.38Å; F442-F472 HydrophobicContact CZ-CD2 4.34Å; I448-F472 HydrophobicContact CB-CZ 4.38Å; I448-F472 HydrophobicContact CD1-CE2 4.29Å; I448-F472 HydrophobicContact CD1-CZ 4.37Å; I448-F472 HydrophobicContact CG2-CE1 3.58Å; I448-F472 HydrophobicContact CG2-CZ 3.58Å; W458-F472 WeakPolarHBondContact CA-O 3.28Å; L459-F472 HydrophobicContact CB-CD2 4.21Å; L459-F472 HydrophobicContact CB-CE1 4.19Å; L459-F472 HydrophobicContact CB-CE2 3.66Å; L459-F472 HydrophobicContact CB-CZ 3.65Å; L459-F472 HydrophobicContact CD1-CE2 3.89Å; L459-F472 HydrophobicContact CD1-CZ 4.36Å; L459-F472 HydrophobicContact CG-CE2 4.36Å; L459-F472 PolarHBondContact N-O 2.78Å; L459-F472 WeakPolarHBondContact O-CD1 3.46Å; L459-F472 PolarHBondContact O-N 3.03Å; F472-A474 PolarHBondContact O-N 2.85Å; F472-V477 HydrophobicContact CD2-CG1 3.81Å; F472-V477 HydrophobicContact CD2-CG2 4.41Å; F472-V477 HydrophobicContact CE2-CB 4.41Å; F472-V477 HydrophobicContact CE2-CG1 3.66Å; F472-V477 HydrophobicContact CE2-CG2 3.88Å
473	P	93.1	Very high	87.8	Confident	17 Å²	17	60.7 Å²	60.7	11%	0.11	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	129.8	179	-21.9	34	0	0	0	112.5	F432 K457 W458 S475 Y476	F432-P473 HydrophobicContact CD2-CG 4.31Å; F432-P473 HydrophobicContact CE2-CG 3.81Å; F432-P473 HydrophobicContact CZ-CG 4.19Å; K457-P473 CarbonylContact O-C 3.53Å; K457-P473 VanDerWaalsContact O-CA 3.32Å; K457-P473 WeakPolarHBondContact O-CA 3.41Å; W458-P473 HydrophobicContact CE3-CG 4.44Å; W458-P473 HydrophobicContact CH2-CG 4.03Å; W458-P473 HydrophobicContact CZ2-CG 4.5Å; W458-P473 HydrophobicContact CZ3-CG 4Å; P473-S475 PolarHBondContact O-N 2.86Å; P473-Y476 HydrophobicContact CB-CD2 3.83Å; P473-Y476 HydrophobicContact CB-CG 4.44Å; P473-Y476 HydrophobicContact CG-CD2 4.21Å; P473-Y476 PolarHBondContact O-N 3.12Å; P473-Y476 VanDerWaalsContact O-N 3.08Å
474	A	92.1	Very high	86.9	Confident	25 Å²	25	67.9 Å²	67.9	21%	0.207	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-58.4	-31.7	175.6	0	0	0	0	0	112.4	K457 L459 F472 Y476 V477	K457-A474 PolarHBondContact O-N 2.93Å; L459-A474 HydrophobicContact CD1-CB 4.03Å; L459-A474 HydrophobicContact CG-CB 4Å; F472-A474 PolarHBondContact O-N 2.85Å; A474-Y476 VanDerWaalsContact C-N 3.27Å; A474-Y476 PolarHBondContact O-N 3.33Å; A474-V477 WeakPolarHBondContact O-CG2 3.31Å; A474-V477 PolarHBondContact O-N 3.3Å; A474-V477 VanDerWaalsContact O-O 3.04Å
475	S	93.4	Very high	86.1	Confident	90 Å²	90	66 Å²	66	63%	0.629	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-71.4	-15.1	177.7	53.5	0	0	0	0	114.7	P473 V477	P473-S475 PolarHBondContact O-N 2.86Å; S475-V477 VanDerWaalsContact C-N 3.34Å
476	Y	91.7	Very high	84.9	Confident	94 Å²	94	68.6 Å²	68.6	37%	0.369	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-89	-4.1	177.8	-84.4	-115.5	0	0	0	112.8	L429 F432 P473 A474	L429-Y476 PolarHBondContact N-O 2.86Å; F432-Y476 HydrophobicContact CB-CD1 3.98Å; F432-Y476 HydrophobicContact CD2-CD1 4.02Å; F432-Y476 HydrophobicContact CD2-CE1 4.17Å; F432-Y476 HydrophobicContact CD2-CG 4.42Å; F432-Y476 HydrophobicContact CG-CD1 4.42Å; P473-Y476 HydrophobicContact CB-CD2 3.83Å; P473-Y476 HydrophobicContact CB-CG 4.44Å; P473-Y476 HydrophobicContact CG-CD2 4.21Å; P473-Y476 PolarHBondContact O-N 3.12Å; P473-Y476 VanDerWaalsContact O-N 3.08Å; A474-Y476 VanDerWaalsContact C-N 3.27Å; A474-Y476 PolarHBondContact O-N 3.33Å
477	V	91.4	Very high	83	Confident	9 Å²	9	73.2 Å²	73.2	6%	0.055	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	154.6	-178.7	-57.8	0	0	0	0	112.2	A426 L427 F442 I448 L459 F472 A474 S475 V479	A426-V477 HydrophobicContact CB-CB 3.94Å; A426-V477 HydrophobicContact CB-CG1 4.28Å; A426-V477 HydrophobicContact CB-CG2 3.94Å; L427-V477 CarbonylContact O-C 3.5Å; L427-V477 VanDerWaalsContact O-CA 3.25Å; L427-V477 WeakPolarHBondContact O-CA 3.42Å; F442-V477 HydrophobicContact CE1-CG1 4.34Å; F442-V477 HydrophobicContact CE2-CG1 4.31Å; F442-V477 HydrophobicContact CZ-CG1 3.77Å; I448-V477 HydrophobicContact CD1-CG1 3.83Å; L459-V477 HydrophobicContact CD1-CG2 3.87Å; F472-V477 HydrophobicContact CD2-CG1 3.81Å; F472-V477 HydrophobicContact CD2-CG2 4.41Å; F472-V477 HydrophobicContact CE2-CB 4.41Å; F472-V477 HydrophobicContact CE2-CG1 3.66Å; F472-V477 HydrophobicContact CE2-CG2 3.88Å; A474-V477 WeakPolarHBondContact O-CG2 3.31Å; A474-V477 PolarHBondContact O-N 3.3Å; A474-V477 VanDerWaalsContact O-O 3.04Å; S475-V477 VanDerWaalsContact C-N 3.34Å; V477-V479 HydrophobicContact CG2-CG2 4.21Å
478	Q	91.7	Very high	80.8	Confident	102 Å²	102	69.8 Å²	69.8	48%	0.477	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	114.4	158.1	179.8	58.2	60.1	0	0	107.6	A426 L427 L429 N480	A426-Q478 CarbonylContact C-O 3.57Å; A426-Q478 VanDerWaalsContact CA-O 3.28Å; A426-Q478 WeakPolarHBondContact CA-O 3.38Å; L427-Q478 PolarHBondContact N-O 2.63Å; L427-Q478 PolarHBondContact O-N 3.16Å; L429-Q478 HydrophobicContact CD1-CB 4.12Å; L429-Q478 HydrophobicContact CD2-CB 4.04Å; L429-Q478 HydrophobicContact CG-CB 4.07Å; Q478-N480 PolarHBondContact O-N 3.39Å
479	V	89.4	Confident	78.7	Confident	42 Å²	42	70.4 Å²	70.4	26%	0.255	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	115	167	178.2	0	0	0	0	107.8	I450 L459 V477 K481 M482	I450-V479 HydrophobicContact CD1-CB 4.48Å; I450-V479 HydrophobicContact CD1-CG1 3.89Å; I450-V479 HydrophobicContact CD1-CG2 3.98Å; L459-V479 HydrophobicContact CD1-CG2 3.64Å; V477-V479 HydrophobicContact CG2-CG2 4.21Å; V479-K481 WeakPolarHBondContact CG1-O 3.45Å; V479-M482 HydrophobicContact CG1-SD 3.89Å
480	N	84.4	Confident	76.1	Confident	84 Å²	84	73.6 Å²	73.6	45%	0.449	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	-33.1	169.9	-65.7	-9.8	0	0	0	110.3	E425 L427 Q478	E425-N480 HydrophobicContact CB-CB 4.43Å; E425-N480 PolarHBondContact O-N 2.95Å; L427-N480 WeakPolarHBondContact CD1-ND2 3.46Å; Q478-N480 PolarHBondContact O-N 3.39Å
481	K	85.1	Confident	73.6	Confident	85 Å²	85	80.8 Å²	80.8	37%	0.37	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	125.5	-173.9	-173.4	-176.1	-174	-172.8	0	110.3	E422 G424 E425 V479	E422-K481 VanDerWaalsContact CD-NZ 3.3Å; E422-K481 VanDerWaalsContact CG-CE 3.49Å; E422-K481 VanDerWaalsContact CG-NZ 3.28Å; E422-K481 WeakPolarHBondContact OE1-CE 3.4Å; E422-K481 IonicContact OE1-NZ 3.26Å; E422-K481 PolarHBondContact OE1-NZ 3.28Å; G424-K481 CarbonylContact C-O 3.55Å; G424-K481 WeakPolarHBondContact CA-O 3.45Å; E425-K481 HydrophobicContact CB-CB 4.15Å; E425-K481 PolarHBondContact N-O 3.49Å; E425-K481 PolarHBondContact O-N 2.96Å; E425-K481 VanDerWaalsContact O-N 3.11Å; V479-K481 WeakPolarHBondContact CG1-O 3.45Å
482	M	82.9	Confident	70.9	Confident	76 Å²	76	88.3 Å²	88.3	37%	0.374	45%	0.446	S	S	.	.			trans	-80.6	140.5	178.6	-152.4	61.2	-175.3	0	0	111	Q453 L459 V479	Q453-M482 HydrophobicContact CB-CE 3.84Å; Q453-M482 HydrophobicContact CG-CE 3.86Å; L459-M482 HydrophobicContact CD2-CE 3.79Å; V479-M482 HydrophobicContact CG1-SD 3.89Å
483	P	79	Confident	68.4	Low	14 Å²	14	93.5 Å²	93.5	9%	0.091	48%	0.483	C	S	.	.			trans	-67.2	141.5	174.9	28.9	-35.6	0	0	0	110.8	V420 E422 I450	V420-P483 HydrophobicContact CG1-CB 4.5Å; E422-P483 CarbonylContact O-C 3.39Å; E422-P483 VanDerWaalsContact O-CA 3.28Å; E422-P483 WeakPolarHBondContact O-CA 3.32Å; I450-P483 HydrophobicContact CB-CG 4.11Å; I450-P483 HydrophobicContact CG2-CG 3.73Å
484	R	72.4	Confident	66.1	Low	163 Å²	163	98.7 Å²	98.7	62%	0.615	52%	0.516	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.8	104.4	170.3	-65.9	-171.2	163.8	107.4	-4.4	110.3	L421 E422	L421-R484 PolarHBondContact N-O 3.14Å; E422-R484 HydrophobicContact CB-CB 4.05Å; E422-R484 HydrophobicContact CB-CG 4.46Å; E422-R484 PolarHBondContact N-O 3.4Å; E422-R484 PolarHBondContact O-N 2.96Å; E422-R484 WeakPolarHBondContact OE2-CD 3.31Å; E422-R484 IonicContact OE2-CZ 2.66Å; E422-R484 IonicContact OE2-NE 3.89Å; E422-R484 IonicContact OE2-NH1 2.75Å; E422-R484 PolarHBondContact OE2-NH1 3.47Å
485	T	61.8	Low	63.4	Low	34 Å²	34	100.5 Å²	100.5	21%	0.209	54%	0.537	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	140.3	166.6	42.7	0	0	0	0	110.4	L418 Q419 V420 R452 Y487	L418-T485 HydrophobicContact CB-CG2 4.22Å; L418-T485 HydrophobicContact CD2-CG2 4.45Å; Q419-T485 WeakPolarHBondContact O-CA 3.33Å; V420-T485 HydrophobicContact CG2-CG2 4.07Å; R452-T485 HydrophobicContact CB-CG2 4.32Å; T485-Y487 WeakPolarHBondContact OG1-CE2 3.46Å
486	K	52.5	Low	61	Low	145 Å²	145	102 Å²	102	63%	0.63	55%	0.545	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	121.3	156.9	-73.3	-152.5	173.8	-164.4	0	109.1	Q419	Q419-K486 PolarHBondContact O-N 3Å; Q419-K486 VanDerWaalsContact O-N 3.12Å
487	Y	42.5	Very low	58.2	Low	155 Å²	155	106.4 Å²	106.4	61%	0.608	57%	0.571	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-79.2	133.4	167.9	-66.1	-99	0	0	0	108.1	L418 T485 T489	L418-Y487 HydrophobicContact CD2-CD1 3.61Å; L418-Y487 HydrophobicContact CD2-CE1 3.53Å; L418-Y487 HydrophobicContact CD2-CE2 4.44Å; L418-Y487 HydrophobicContact CD2-CG 4.12Å; T485-Y487 WeakPolarHBondContact OG1-CE2 3.46Å; Y487-T489 VanDerWaalsContact C-N 3.31Å; Y487-T489 PolarHBondContact O-N 3.48Å
488	S	34.7	Very low	55.5	Low	104 Å²	104	111.8 Å²	111.8	73%	0.727	61%	0.609	S	S	*	*	S	Bend	trans	-96.7	43.1	-177.4	-170.6	0	0	0	0	112.7
489	T	41.7	Very low	53.1	Low	115 Å²	115	113 Å²	113	71%	0.706	63%	0.626	S	S	*	*			trans	-137.7	102.8	173	-60.8	0	0	0	0	107.8	Y487	Y487-T489 VanDerWaalsContact C-N 3.31Å; Y487-T489 PolarHBondContact O-N 3.48Å
490	D	38.1	Very low	50.3	Low	148 Å²	148	114.3 Å²	114.3	79%	0.791	65%	0.647	S	S	*	*			trans	177.8	99.5	146.9	-93.6	-27.9	0	0	0	108.4	F492	D490-F492 VanDerWaalsContact C-N 3.3Å
491	D	39	Very low	48.2	Very low	161 Å²	161	116.9 Å²	116.9	86%	0.861	67%	0.669	S	S	*	*			trans	-99.2	48.7	171.1	-163.5	16.8	0	0	0	110.3
492	F	37.8	Very low	45.9	Very low	192 Å²	192	121.7 Å²	121.7	84%	0.842	69%	0.692	S	S	*	*			trans	-142	115.2	171.1	-84.7	-72.7	0	0	0	110.1	D490	D490-F492 VanDerWaalsContact C-N 3.3Å
493	S	41.2	Very low	43.5	Very low	109 Å²	109	123.5 Å²	123.5	76%	0.762	71%	0.713	S	S	*	*			trans	-84.7	151.2	171.6	-162.2	0	0	0	0	110.4	G495	S493-G495 PolarHBondContact OG-N 3.11Å
494	P	45.7	Very low	42.2	Very low	126 Å²	126	129 Å²	129	82%	0.818	75%	0.749	S	S	*	*				-130.2	152.3	96.1	36.8	-30	0	0	0	113.6
495	G	34.7	Very low	40.1	Very low	62 Å²	62	125.2 Å²	125.2	64%	0.639	76%	0.76	S	S	*	*			trans	-74.3	170.8	175.3	0	0	0	0	0	113.6	S493	S493-G495 PolarHBondContact OG-N 3.11Å
496	P	44	Very low	38.9	Very low	122 Å²	122	135 Å²	135	79%	0.792	79%	0.793	S	S	*	*				-143.2	157.3	108.5	38	-25.8	0	0	0	116.2
497	M	32.2	Very low	39.1	Very low	186 Å²	186	132.4 Å²	132.4	92%	0.916	79%	0.791	S	S	*	*			trans	59.1	115.6	153.3	-66.7	175.6	-177	0	0	120.4
498	S	35.4	Very low	38.4	Very low	123 Å²	123	131.6 Å²	131.6	86%	0.86	80%	0.797	S	S	*	*			trans	-99.2	132.5	162.5	-56.5	0	0	0	0	111.8
499	P	40.2	Very low	38.2	Very low	128 Å²	128	137.2 Å²	137.2	83%	0.831	80%	0.803	S	S	*	*			trans	-81.1	147.7	157	-10.8	28.7	0	0	0	111.3
500	G	30.5	Very low	37.6	Very low	68 Å²	68	136.6 Å²	136.6	70%	0.701	80%	0.804	S	S	*	*			trans	-81.3	174.5	-177.2	0	0	0	0	0	115.9
501	P	41.5	Very low	38	Very low	138 Å²	138	135.1 Å²	135.1	90%	0.896	80%	0.802	S	S	*	*			trans	-76.9	160.7	-175.3	31.9	-36.3	0	0	0	114.6
502	Q	36.1	Very low	37.7	Very low	186 Å²	186	132.5 Å²	132.5	87%	0.869	80%	0.797	S	S	*	*			trans	-94.8	150.5	-176.8	-60	177.4	-19.2	0	0	113.8
503	S	32.8	Very low	38.4	Very low	115 Å²	115	128.5 Å²	128.5	80%	0.804	79%	0.79	S	S	*	*			trans	161.4	163.8	138.5	-79.2	0	0	0	0	111.8
504	P	52	Low	38	Very low	130 Å²	130	134.9 Å²	134.9	84%	0.844	80%	0.798	S	S	*	*			cis	-134.9	160.1	-43.6	38.1	-23	0	0	0	113.3
505	G	28.8	Very low	37.2	Very low	83 Å²	83	134.3 Å²	134.3	86%	0.856	80%	0.797	S	S	*	*			trans	-178.3	139.8	171.9	0	0	0	0	0	115.7
506	R	34.8	Very low	38.3	Very low	239 Å²	239	136.7 Å²	136.7	90%	0.902	80%	0.801	S	S	*	*			trans	-140.6	173.4	180	-112.4	-175.1	179.4	-113.6	3.8	108.2
507	P	57.3	Low	37.7	Very low	91 Å²	91	138.7 Å²	138.7	59%	0.591	80%	0.804	S	S	*	*			cis	-121	-168.9	-19.8	25.8	-2.3	0	0	0	111.2
508	L	28.7	Very low	37.7	Very low	138 Å²	138	137.1 Å²	137.1	72%	0.723	80%	0.797	S	S	*	*				178.9	137.1	80.7	-84.5	168.3	0	0	0	112.9
509	Y	30.5	Very low	38.3	Very low	221 Å²	221	135.9 Å²	135.9	87%	0.867	79%	0.787	S	S	*	*			trans	65.5	160.7	153.3	-77.5	-101	0	0	0	123.4
510	S	27.9	Very low	37.9	Very low	103 Å²	103	139 Å²	139	72%	0.72	79%	0.787	S	S	*	*			trans	-138.2	175.2	-173.1	-158.7	0	0	0	0	106.5
511	P	46.4	Very low	38	Very low	116 Å²	116	142.1 Å²	142.1	75%	0.753	79%	0.793	S	S	*	*			cis	-142.3	-170	12.4	43.1	-21.6	0	0	0	117.1
512	S	33.3	Very low	38.9	Very low	107 Å²	107	140.9 Å²	140.9	75%	0.748	79%	0.785	S	S	*	*			trans	-71.3	-169.1	170.1	-35.2	0	0	0	0	113.2
513	P	53.7	Low	39.2	Very low	108 Å²	108	138 Å²	138	70%	0.701	78%	0.782	S	S	*	*			cis	-147.3	-166.9	5.9	43.6	-21.9	0	0	0	118.4
514	R	30.9	Very low	39	Very low	243 Å²	243	137.3 Å²	137.3	92%	0.917	78%	0.778	S	S	*	*			trans	90.5	147.2	152.5	-76	175.7	177	-175.1	-1.3	122.2
515	S	29.9	Very low	38	Very low	114 Å²	114	138.9 Å²	138.9	80%	0.797	78%	0.778	S	S	*	*			trans	-101	-165.4	178.2	-29.4	0	0	0	0	111.1
516	P	57.8	Low	38.2	Very low	112 Å²	112	139.9 Å²	139.9	73%	0.727	77%	0.772	S	S	*	*			cis	-139.6	-159.8	-2.8	37.1	-13.5	0	0	0	115.1
517	L	30.3	Very low	38.9	Very low	163 Å²	163	133.9 Å²	133.9	85%	0.853	76%	0.764	S	S	*	*			trans	122.1	157.4	153.6	-73.1	146.3	0	0	0	119
518	I	34.2	Very low	37.6	Very low	153 Å²	153	138.4 Å²	138.4	79%	0.785	78%	0.775	S	S	*	*			trans	-136.7	145.2	-165.2	-49.9	162.4	0	0	0	107.8
519	P	47.4	Very low	37.9	Very low	98 Å²	98	137.4 Å²	137.4	64%	0.636	77%	0.769	S	S	*	*				-159.3	171.5	109	35.8	-13.5	0	0	0	119.4
520	F	31.1	Very low	37.9	Very low	192 Å²	192	132.9 Å²	132.9	84%	0.842	76%	0.756	S	S	*	*			trans	92.4	158.3	157.7	-58.6	-58.2	0	0	0	122.4
521	T	31.9	Very low	38.1	Very low	134 Å²	134	135.8 Å²	135.8	82%	0.822	76%	0.758	S	S	*	*			trans	-142	-155.7	-156.5	50.4	0	0	0	0	113.2
522	P	60.7	Low	37.4	Very low	113 Å²	113	135.8 Å²	135.8	73%	0.734	76%	0.76	S	S	*	*				-106	-172.7	-109.2	42.1	-25.5	0	0	0	114.9
523	P	43.3	Very low	38.6	Very low	124 Å²	124	135.5 Å²	135.5	81%	0.805	76%	0.756	S	S	*	*				-154.2	164.7	95.7	40.2	-21.3	0	0	0	119.2
524	S	27.7	Very low	37.6	Very low	101 Å²	101	138.6 Å²	138.6	71%	0.706	77%	0.766	S	S	*	*			trans	-15.1	143.1	159.5	-164.6	0	0	0	0	122.2
525	L	31	Very low	37.5	Very low	163 Å²	163	136.3 Å²	136.3	85%	0.853	76%	0.763	S	S	*	*				177.8	150.3	107.4	-92.8	170.6	0	0	0	114.3
526	S	32.7	Very low	38.4	Very low	105 Å²	105	135.7 Å²	135.7	73%	0.734	76%	0.756	S	S	*	*			trans	-121.5	165	170.4	-48.6	0	0	0	0	110.1
527	P	50.9	Low	37.1	Very low	113 Å²	113	135.1 Å²	135.1	73%	0.734	76%	0.755	S	S	*	*				-159.6	149.6	103.6	37.7	-18	0	0	0	119.2
528	K	29.9	Very low	37.1	Very low	186 Å²	186	132.8 Å²	132.8	81%	0.809	75%	0.752	S	S	*	*			trans	63.7	153.7	137.4	-66.9	-173.1	138.2	-153.3	0	120
529	L	33.8	Very low	38	Very low	116 Å²	116	131.4 Å²	131.4	61%	0.607	75%	0.753	S	S	*	*			cis	-159.5	-154	-7.6	-113.5	168.7	0	0	0	108.2
530	E	30.7	Very low	37.1	Very low	126 Å²	126	133 Å²	133	59%	0.589	76%	0.76	S	S	*	*			cis	-160.3	177	7.3	-130.6	-35.7	126	0	0	109.8
531	H	31.9	Very low	38.1	Very low	165 Å²	165	128.5 Å²	128.5	76%	0.764	75%	0.75	S	S	*	*			trans	85.5	137.9	151	-65.1	-13	0	0	0	122.6
532	S	31.8	Very low	38	Very low	115 Å²	115	133 Å²	133	80%	0.804	75%	0.754	S	S	*	*			trans	-162.2	-164	-178.3	-149	0	0	0	0	105.4
533	P	60.1	Low	36.4	Very low	102 Å²	102	131.6 Å²	131.6	66%	0.662	76%	0.76	S	S	*	*			cis	-133.7	-165.1	-12.3	42.3	-24	0	0	0	113
534	L	31.5	Very low	35.6	Very low	172 Å²	172	129.3 Å²	129.3	90%	0.901	76%	0.758	S	S	*	*				179.4	177.5	124.4	-93.6	168.6	0	0	0	113.6
535	K	28.7	Very low	36.5	Very low	196 Å²	196	131.2 Å²	131.2	85%	0.852	77%	0.769	S	S	*	*			trans	-158	-173.2	-163.6	-130.7	-177.9	179	-179.7	0	108.5
536	P	50.2	Low	36.3	Very low	100 Å²	100	127.1 Å²	127.1	65%	0.649	77%	0.765	S	S	*	*			cis	-144.2	-169.7	-7.4	41.8	-20.4	0	0	0	117.9
537	S	30.3	Very low	36.1	Very low	101 Å²	101	127.7 Å²	127.7	71%	0.706	77%	0.769	S	S	*	*			trans	85.8	110.6	142.8	-64.5	0	0	0	0	124.8
538	S	29.6	Very low	35	Very low	113 Å²	113	130.9 Å²	130.9	79%	0.79	78%	0.775	S	S	*	*				43	163.1	111	-45.2	0	0	0	0	123.2
539	P	52.3	Low	34.9	Very low	124 Å²	124	127.4 Å²	127.4	81%	0.805	77%	0.774	S	S	*	*			cis	-137	-168.2	4.1	39.5	-17.5	0	0	0	117.5
540	V	29.7	Very low	34.6	Very low	131 Å²	131	133.6 Å²	133.6	79%	0.794	79%	0.789	S	S	*	*			trans	-77.3	-168.3	173	-109.3	0	0	0	0	113.5
541	P	52.6	Low	34.6	Very low	98 Å²	98	133 Å²	133	64%	0.636	80%	0.798	S	S	*	*			cis	-142.1	-167.6	3.2	20.3	9.7	0	0	0	117.9
542	Y	28.9	Very low	35.4	Very low	230 Å²	230	131.2 Å²	131.2	90%	0.902	80%	0.801	S	S	*	*			trans	89	139.3	152.8	-78.1	-74.3	0	0	0	122.7
543	G	27.7	Very low	35.1	Very low	82 Å²	82	132 Å²	132	85%	0.845	80%	0.797	S	S	*	*			trans	137.9	105.6	149.3	0	0	0	0	0	118.4
544	G	25.6	Very low	33.6	Very low	76 Å²	76	134.3 Å²	134.3	78%	0.784	80%	0.799	S	S	*	*			trans	-145.7	-176.4	154.9	0	0	0	0	0	108.5
545	P	46.9	Very low	33.3	Very low	142 Å²	142	131.4 Å²	131.4	92%	0.922	79%	0.788	S	S	*	*			cis	-126.8	-169.2	1.9	42.9	-27.6	0	0	0	113.2
546	G	26.7	Very low	33.2	Very low	76 Å²	76	129.3 Å²	129.3	78%	0.784	79%	0.785	S	S	*	*			trans	159.6	123.1	161.2	0	0	0	0	0	117.3
547	S	29.6	Very low	32.1	Very low	117 Å²	117	128.9 Å²	128.9	82%	0.818	79%	0.785	S	S	*	*			trans	-61.3	160.9	174.6	-45.9	0	0	0	0	113.2
548	Q	27.6	Very low	32.1	Very low	181 Å²	181	133.1 Å²	133.1	85%	0.846	79%	0.793	S	S	*	*			cis	-162.4	167.2	47.1	-62.5	-176.6	6.1	0	0	115.2
549	S	26.9	Very low	32.2	Very low	112 Å²	112	135.6 Å²	135.6	78%	0.783	79%	0.792	S	S	*	*			trans	113.1	138.9	135.4	82	0	0	0	0	120.6
550	R	27.9	Very low	30.8	Very low	247 Å²	247	141.1 Å²	141.1	93%	0.932	80%	0.797	S	S	*	*			trans	57.7	100.7	162.4	-91.1	-178.2	169.3	175.6	-3.1	121.9
551	S	30.3	Very low	30.8	Very low	112 Å²	112	141.7 Å²	141.7	78%	0.783	80%	0.795	S	S	*	*			trans	-98.1	-177.2	143.8	-51.7	0	0	0	0	108.7
552	P	49.5	Very low	30.6	Very low	128 Å²	128	142.1 Å²	142.1	83%	0.831	80%	0.798	S	S	*	*			cis	-134	-157	7.3	44.3	-24.9	0	0	0	114.8
553	N	25.8	Very low	30.7	Very low	131 Å²	131	139 Å²	139	70%	0.701	79%	0.791	S	S	*	*			trans	-142	161.8	-162.9	-167.4	12.8	0	0	0	110.7
554	Q	27.5	Very low	30.8	Very low	151 Å²	151	144.8 Å²	144.8	71%	0.706	79%	0.787	S	S	*	*			trans	62.6	113.6	158.1	-78.4	-177.5	89.8	0	0	123.1
555	T	26.2	Very low	31.1	Very low	111 Å²	111	145.9 Å²	145.9	68%	0.681	78%	0.779	S	S	*	*				80	141.2	113	-41	0	0	0	0	123.4
556	L	25.8	Very low	31.3	Very low	152 Å²	152	145.2 Å²	145.2	80%	0.796	78%	0.775	S	S	*	*			trans	97.6	127.2	143.8	-106.4	158.5	0	0	0	123.5
557	S	27.7	Very low	31.6	Very low	92 Å²	92	146.3 Å²	146.3	64%	0.643	77%	0.77	S	S	*	*			trans	87.1	149.7	145.3	78.6	0	0	0	0	121.5
558	H	29.5	Very low	31.5	Very low	189 Å²	189	146.9 Å²	146.9	88%	0.875	77%	0.769	S	S	*	*			trans	-152.3	147.5	-177.4	-108	-48.5	0	0	0	114
559	H	31	Very low	32.5	Very low	166 Å²	166	144.2 Å²	144.2	77%	0.769	77%	0.767	S	S	*	*			trans	-174	160.9	166.3	32	-90.2	0	0	0	108.3
560	R	24.3	Very low	32.5	Very low	240 Å²	240	144.1 Å²	144.1	91%	0.906	77%	0.767	S	S	*	*			cis	-155.6	168.3	-8.7	160.4	177.5	-78.2	-159.2	-2.6	108.6
561	L	30	Very low	33.2	Very low	143 Å²	143	137.7 Å²	137.7	75%	0.749	76%	0.757	S	S	*	*			trans	-49.3	169.8	168	-103.9	75.2	0	0	0	115.4
562	P	46.8	Very low	33.1	Very low	107 Å²	107	138.1 Å²	138.1	70%	0.695	76%	0.755	S	S	*	*			cis	-152.1	155.9	36.5	39.2	-16.9	0	0	0	122.3
563	Q	31.2	Very low	32.2	Very low	163 Å²	163	139.5 Å²	139.5	76%	0.762	76%	0.755	S	S	*	*			trans	53.2	169.1	143.1	-57.7	-166.5	13.2	0	0	121.7
564	R	30.7	Very low	32.4	Very low	205 Å²	205	141.5 Å²	141.5	77%	0.774	76%	0.761	S	S	*	*			cis	-161.9	153.4	10.5	-145.2	-179	158.1	-127.9	-3.3	115.4
565	T	31.8	Very low	32.4	Very low	99 Å²	99	141.9 Å²	141.9	61%	0.607	77%	0.767	S	S	*	*			trans	6	155.8	151.6	63.1	0	0	0	0	124
566	P	50.8	Low	32.6	Very low	128 Å²	128	142.2 Å²	142.2	83%	0.831	77%	0.774	S	S	*	*				-145.7	-147.9	62	40.7	-17.1	0	0	0	119.1
567	S	32.8	Very low	32.9	Very low	98 Å²	98	142.5 Å²	142.5	69%	0.685	78%	0.777	S	S	*	*			trans	-164.4	-178.5	-132.5	58.1	0	0	0	0	117.4
568	T	28.5	Very low	32.9	Very low	130 Å²	130	146.5 Å²	146.5	80%	0.798	79%	0.79	S	S	*	*			trans	75.2	158.7	155	39.5	0	0	0	0	120.4
569	P	47.4	Very low	33.2	Very low	124 Å²	124	144 Å²	144	81%	0.805	79%	0.787	S	S	*	*			cis	-131.6	-175.3	9.8	43	-25.7	0	0	0	117.9
570	S	26.5	Very low	33	Very low	111 Å²	111	140.9 Å²	140.9	78%	0.776	79%	0.791	S	S	*	*			trans	-97.5	-165.9	178.9	-31.8	0	0	0	0	112.6
571	P	43.3	Very low	33.4	Very low	112 Å²	112	134 Å²	134	73%	0.727	79%	0.785	S	S	*	*			cis	-156.5	-172	39.1	46.2	-23	0	0	0	120.3
572	T	27.3	Very low	34.4	Very low	121 Å²	121	132.6 Å²	132.6	74%	0.742	78%	0.784	S	S	*	*			trans	87.6	138	147.7	-58	0	0	0	0	121	Q574	T572-Q574 HydrophobicContact CG2-CG 4.41Å
573	N	31.4	Very low	33.7	Very low	156 Å²	156	132.4 Å²	132.4	83%	0.834	79%	0.786	S	S	*	*			trans	-124.8	149.4	178.9	-167.8	-10.3	0	0	0	108.7
574	Q	30.2	Very low	33.7	Very low	174 Å²	174	130 Å²	130	81%	0.813	78%	0.783	S	S	*	*			trans	-143.5	144.2	177.9	-75.7	-160.4	53.4	0	0	114.1	T572	T572-Q574 HydrophobicContact CG2-CG 4.41Å
575	N	27.7	Very low	33.8	Very low	158 Å²	158	130.4 Å²	130.4	85%	0.845	79%	0.79	S	S	*	*			trans	-79.5	154.2	175.9	-74.3	-41.9	0	0	0	112.6
576	S	29.1	Very low	33.7	Very low	119 Å²	119	136.6 Å²	136.6	83%	0.832	80%	0.802	S	S	*	*				-176.1	139.9	112.1	38.2	0	0	0	0	113.3
577	N	32.5	Very low	32.6	Very low	158 Å²	158	134.7 Å²	134.7	85%	0.845	80%	0.797	S	S	*	*			trans	-80.1	156.6	161.5	-62.3	-52.2	0	0	0	109.6
578	L	28.7	Very low	32.5	Very low	175 Å²	175	136.1 Å²	136.1	92%	0.916	80%	0.802	S	S	*	*			trans	-152.9	161	143.5	-112.5	174.9	0	0	0	111.7
579	V	35	Very low	32.8	Very low	136 Å²	136	135.3 Å²	135.3	82%	0.824	80%	0.801	S	S	*	*			trans	-117.8	135.3	-166.7	173.4	0	0	0	0	110.7
580	A	26.7	Very low	32.9	Very low	102 Å²	102	135.7 Å²	135.7	84%	0.843	80%	0.804	S	S	*	*			trans	-157.5	139.4	158.6	0	0	0	0	0	113.6
581	A	33.3	Very low	33.1	Very low	95 Å²	95	135.7 Å²	135.7	79%	0.785	80%	0.804	S	S	*	*			trans	-144.4	178.4	157.7	0	0	0	0	0	105.8
582	P	51.5	Low	32.5	Very low	113 Å²	113	134.9 Å²	134.9	73%	0.734	80%	0.801	S	S	*	*			cis	-129.8	-172	-4.7	42.2	-26.7	0	0	0	112.9
583	S	30.5	Very low	32.8	Very low	103 Å²	103	137.7 Å²	137.7	72%	0.72	81%	0.806	S	S	*	*				169.5	128.6	121.1	-75.3	0	0	0	0	115.7
584	T	32.7	Very low	32.7	Very low	114 Å²	114	135.3 Å²	135.3	70%	0.699	80%	0.801	S	S	*	*			trans	13.8	139.3	148.1	58.8	0	0	0	0	122.8
585	F	32	Very low	32.8	Very low	213 Å²	213	133 Å²	133	93%	0.934	80%	0.804	S	S	*	*				-154.4	178	111.5	-99.2	-61.3	0	0	0	112.1
586	R	29.5	Very low	33.2	Very low	228 Å²	228	129.4 Å²	129.4	86%	0.86	80%	0.797	S	S	*	*			trans	-151	124.4	-152.8	171	-160.7	-179	-147.5	5.2	114.1
587	A	27.5	Very low	34	Very low	88 Å²	88	129.9 Å²	129.9	73%	0.727	80%	0.797	S	S	*	*			trans	-166.6	114.8	156.8	0	0	0	0	0	109.4
588	V	31.9	Very low	34.2	Very low	129 Å²	129	127.7 Å²	127.7	78%	0.782	79%	0.789	S	S	*	*				65.5	125.3	77.3	-51.8	0	0	0	0	117
589	S	34	Very low	34.8	Very low	112 Å²	112	126.9 Å²	126.9	78%	0.783	78%	0.78	S	S	*	*			trans	-89.9	171.7	171.1	-44	0	0	0	0	111.8
590	P	49.6	Very low	34.5	Very low	132 Å²	132	131 Å²	131	86%	0.857	78%	0.781	S	S	*	*				-145.9	-179.9	105.3	38.9	-23.5	0	0	0	115.5
591	S	30	Very low	34.7	Very low	112 Å²	112	130.7 Å²	130.7	78%	0.783	78%	0.778	S	S	*	*			trans	-101.9	161.1	-171.3	-28.9	0	0	0	0	114.2
592	S	32	Very low	34.5	Very low	95 Å²	95	131.2 Å²	131.2	66%	0.664	78%	0.783	S	S	*	*				169.6	138.6	126.4	-84	0	0	0	0	115.5
593	Q	32.5	Very low	33.5	Very low	179 Å²	179	130.3 Å²	130.3	84%	0.836	79%	0.785	S	S	*	*			trans	50.1	146.4	135	-59.8	172.6	81	0	0	120.5
594	S	29.7	Very low	34.7	Very low	106 Å²	106	131.1 Å²	131.1	74%	0.741	79%	0.788	S	S	*	*			cis	138.3	126	-3.2	174	0	0	0	0	107.2
595	S	32.2	Very low	34.5	Very low	126 Å²	126	131.6 Å²	131.6	88%	0.881	80%	0.796	S	S	*	*			trans	-176.9	155.3	152.4	-85.6	0	0	0	0	112.3
596	A	36.3	Very low	34.6	Very low	83 Å²	83	127.9 Å²	127.9	69%	0.686	79%	0.79	S	S	*	*			trans	-119.1	177.9	174.2	0	0	0	0	0	111
597	P	46.2	Very low	34.5	Very low	129 Å²	129	122.7 Å²	122.7	84%	0.838	79%	0.789	S	S	*	*				-140	171.9	127.8	38.4	-26.4	0	0	0	114.1
598	V	37.4	Very low	34.8	Very low	111 Å²	111	124.8 Å²	124.8	67%	0.673	79%	0.793	S	S	*	*			trans	-148.3	161.4	-174.5	-155.9	0	0	0	0	111
599	H	39.7	Very low	35.4	Very low	158 Å²	158	124.3 Å²	124.3	73%	0.731	79%	0.792	S	S	*	*			trans	78.1	152.6	164.7	-57.8	-49.3	0	0	0	117.5
600	R	28.8	Very low	35.1	Very low	223 Å²	223	130 Å²	130	84%	0.842	80%	0.796	S	S	*	*			cis	-160.5	161.8	-10.4	151.1	178.3	-90	144.7	-8.4	109.5
601	A	31.7	Very low	34.1	Very low	95 Å²	95	133.8 Å²	133.8	79%	0.785	80%	0.795	S	S	*	*			trans	-91.3	164.7	-173	0	0	0	0	0	116.5
602	A	28.8	Very low	34.1	Very low	106 Å²	106	135.5 Å²	135.5	88%	0.876	80%	0.801	S	S	*	*			trans	-161.4	158.4	156.3	0	0	0	0	0	112.9
603	A	31.1	Very low	33.7	Very low	95 Å²	95	134.1 Å²	134.1	79%	0.785	80%	0.802	S	S	*	*			trans	-157.9	-175	172	0	0	0	0	0	107.3
604	P	55.9	Low	34.7	Very low	119 Å²	119	131.9 Å²	131.9	77%	0.773	80%	0.803	S	S	*	*			cis	-132	-168.1	-6.4	43.6	-26.8	0	0	0	113.5
605	S	28.6	Very low	34.7	Very low	124 Å²	124	132.8 Å²	132.8	87%	0.867	81%	0.809	S	S	*	*			trans	-163.6	164.2	157.4	-86.2	0	0	0	0	112.7
606	V	33.4	Very low	34.6	Very low	136 Å²	136	136.4 Å²	136.4	82%	0.824	81%	0.812	S	S	*	*			trans	-131.4	144.1	-165.9	170.5	0	0	0	0	112.3
607	S	28.3	Very low	34.2	Very low	118 Å²	118	136.1 Å²	136.1	83%	0.825	82%	0.817	S	S	*	*			trans	-171.9	152.3	148.6	-86.4	0	0	0	0	114.3
608	T	32.8	Very low	33.3	Very low	133 Å²	133	134.8 Å²	134.8	82%	0.816	82%	0.817	S	S	*	*			trans	-141.3	158.2	163	58.4	0	0	0	0	108.4
609	P	44.1	Very low	33	Very low	118 Å²	118	136.9 Å²	136.9	77%	0.766	82%	0.823	S	S	*	*				-158.2	150.8	104.8	38.8	-19.3	0	0	0	119
610	R	28.2	Very low	32.8	Very low	231 Å²	231	135.5 Å²	135.5	87%	0.872	83%	0.828	S	S	*	*			trans	45.7	124.2	136.5	-68.8	-174.3	178	169.7	0.4	124.9
611	Y	28.6	Very low	33	Very low	213 Å²	213	130 Å²	130	84%	0.835	82%	0.823	S	S	*	*				56.1	124.6	127.8	-93.9	-98.8	0	0	0	123
612	T	29.8	Very low	32.7	Very low	147 Å²	147	132.7 Å²	132.7	90%	0.902	82%	0.824	S	S	*	*				-173.5	160.7	119.8	18.2	0	0	0	0	112.5
613	G	24.4	Very low	32.7	Very low	66 Å²	66	137.8 Å²	137.8	68%	0.68	82%	0.822	S	S	*	*			trans	-155.3	-161.5	162.6	0	0	0	0	0	107.4
614	P	53.1	Low	32.5	Very low	133 Å²	133	137.4 Å²	137.4	86%	0.864	82%	0.819	S	S	*	*			cis	-131	-179.5	-13.5	42.8	-28.2	0	0	0	113.3
615	S	29	Very low	31.2	Very low	125 Å²	125	138 Å²	138	87%	0.874	82%	0.823	S	S	*	*			trans	-165.2	159.2	150.8	53.2	0	0	0	0	115.2
616	Q	30.4	Very low	31.2	Very low	202 Å²	202	138 Å²	138	94%	0.944	82%	0.822	S	S	*	*			trans	-81.8	166.5	-164.5	-58.9	163.2	-12.3	0	0	115.4
617	G	27.7	Very low	31	Very low	76 Å²	76	137.7 Å²	137.7	78%	0.784	82%	0.816	S	S	*	*			trans	-172.1	36	178.3	0	0	0	0	0	122
618	A	27.9	Very low	30.9	Very low	101 Å²	101	137.3 Å²	137.3	84%	0.835	82%	0.82	S	S	*	*			trans	57.1	155.6	157.3	0	0	0	0	0	122.6
619	I	31.7	Very low	30.8	Very low	156 Å²	156	137 Å²	137	80%	0.8	81%	0.809	S	S	*	*			trans	-138.3	135	173.4	-73	-70	0	0	0	108.4
620	P	33.8	Very low	30	Very low	129 Å²	129	138.3 Å²	138.3	84%	0.838	81%	0.814	S	S	*	*				-128.8	151.3	119.8	4.2	17.5	0	0	0	113
621	S	33.3	Very low	30	Very low	107 Å²	107	131.6 Å²	131.6	75%	0.748	80%	0.796	S	S	*	*			trans	-96.5	137.5	-177.1	175.8	0	0	0	0	113
622	L	26.8	Very low	29.9	Very low	152 Å²	152	127.5 Å²	127.5	80%	0.796	80%	0.799	S	S	*	*			trans	-144.2	116.1	160.3	-77	-179.1	0	0	0	112.1
623	Y	27.8	Very low	29.8	Very low	213 Å²	213	128.2 Å²	128.2	84%	0.835	79%	0.792	S	S	*	*			trans	63.8	116.4	154.6	-72.7	-83.4	0	0	0	123.5
624	A	26.8	Very low	30.1	Very low	87 Å²	87	129.9 Å²	129.9	72%	0.719	79%	0.793	S	S	*	*			trans	68.3	124.5	145.8	0	0	0	0	0	119.4
625	P	29.8	Very low	28.7	Very low	131 Å²	131	130.2 Å²	130.2	85%	0.851	79%	0.787	S	S	*	*				-111.6	163.7	94.1	33.7	-37.1	0	0	0	114
626	S	27.3	Very low	29.2	Very low	123 Å²	123	130.7 Å²	130.7	86%	0.86	79%	0.787	S	S	*	*			trans	-79.1	126.3	-175.6	-54.5	0	0	0	0	113.2
627	N	30	Very low	29.3	Very low	131 Å²	131	123 Å²	123	70%	0.701	76%	0.763	S	S	*	*			trans	-75.8	138.1	169.3	-82	-24.1	0	0	0	111.9
628	A	26.6	Very low	29.7	Very low	109 Å²	109	125.2 Å²	125.2	90%	0.901	77%	0.766	S	S	*	*			trans	-104.2	86.7	149.8	0	0	0	0	0	108.1
629	H	29.7	Very low	30.3	Very low	128 Å²	128	127.9 Å²	127.9	59%	0.593	77%	0.765	S	S	*	*			trans	-82.8	132.3	179.3	-107.4	-38.3	0	0	0	111.6
630	V	27.8	Very low	30.6	Very low	144 Å²	144	129.3 Å²	129.3	87%	0.873	77%	0.77	S	S	*	*				-144.4	83.5	126.2	-165.4	0	0	0	0	106.5
631	N	27.4	Very low	31	Very low	91 Å²	91	126 Å²	126	49%	0.487	76%	0.76	S	S	.	*				62.2	111.1	78.4	-171.6	24	0	0	0	115.1	Q633	N631-Q633 PolarHBondContact OD1-N 3.31Å
632	S	26.8	Very low	31.8	Very low	127 Å²	127	127.6 Å²	127.6	89%	0.888	76%	0.755	S	S	*	*			trans	-152.7	91.4	136.4	-81.4	0	0	0	0	108.9
633	Q	27.6	Very low	33.6	Very low	162 Å²	162	128.9 Å²	128.9	76%	0.757	75%	0.749	S	S	*	*			trans	-71.3	132.5	180	-99.6	176.6	-60	0	0	113.4	N631	N631-Q633 PolarHBondContact OD1-N 3.31Å
634	S	30	Very low	35.6	Very low	100 Å²	100	125.8 Å²	125.8	70%	0.699	74%	0.736	S	S	*	*			trans	19.2	104.3	145.5	58.7	0	0	0	0	118.3
635	N	25.3	Very low	38.6	Very low	141 Å²	141	124.1 Å²	124.1	75%	0.754	72%	0.718	S	S	*	*			trans	-98.4	114.6	149.3	-158.2	6.9	0	0	0	107.6	G637	N635-G637 PolarHBondContact O-N 3.34Å
636	P	38.9	Very low	41.6	Very low	134 Å²	134	118.9 Å²	118.9	87%	0.87	68%	0.682	S	S	*	*	S	Bend	trans	-78.9	54.8	-176.8	33.3	-35.7	0	0	0	111.6
637	G	32.4	Very low	44.7	Very low	42 Å²	42	117.8 Å²	117.8	43%	0.433	66%	0.661	S	S	.	*	S	Bend	trans	-178.7	147.3	-177.8	0	0	0	0	0	111	N635	N635-G637 PolarHBondContact O-N 3.34Å
638	S	35.6	Very low	47.7	Very low	122 Å²	122	111.6 Å²	111.6	85%	0.853	63%	0.628	S	S	*	*	S	Bend	trans	70.9	33.6	173.9	-159.2	0	0	0	0	118.7
639	I	39.9	Very low	50.8	Low	156 Å²	156	108.5 Å²	108.5	80%	0.8	60%	0.598	S	S	*	*			trans	-125	56.7	146.3	-42.6	-178.4	0	0	0	110.7	G641	I639-G641 PolarHBondContact O-N 3.12Å
640	M	39.6	Very low	53.6	Low	186 Å²	186	109 Å²	109	92%	0.916	60%	0.596	S	S	*	*			trans	-84.3	48.5	150.8	-76.2	-169.4	172	0	0	109.7	Q642	M640-Q642 PolarHBondContact O-N 2.88Å
641	G	40.9	Very low	56.6	Low	60 Å²	60	106.8 Å²	106.8	62%	0.619	58%	0.579	S	S	*	*			trans	-72.8	71.1	-179.7	0	0	0	0	0	111.7	I639 R643	I639-G641 PolarHBondContact O-N 3.12Å; G641-R643 PolarHBondContact O-N 2.78Å
642	Q	50.6	Low	59.5	Low	141 Å²	141	103.3 Å²	103.3	66%	0.659	56%	0.559	S	S	*	*			trans	42.7	63	168.3	-66.6	-65	-36.1	0	0	113.9	M640 R644	M640-Q642 PolarHBondContact O-N 2.88Å; Q642-R644 PolarHBondContact O-N 3.18Å
643	R	63.7	Low	62.5	Low	178 Å²	178	105.5 Å²	105.5	67%	0.672	55%	0.553	S	S	*	*			trans	-58.4	86	163.5	-84.2	-171.2	-174.7	-155	1.6	109.3	G641 Q669	G641-R643 PolarHBondContact O-N 2.78Å; R643-Q669 VanDerWaalsContact CA-NE2 3.3Å; R643-Q669 VanDerWaalsContact CB-CD 3.5Å; R643-Q669 HydrophobicContact CB-CG 4.24Å; R643-Q669 HydrophobicContact CG-CG 4.12Å; R643-Q669 PolarHBondContact O-OE1 3.41Å
644	R	71.8	Confident	65.5	Low	149 Å²	149	100.7 Å²	100.7	56%	0.562	54%	0.535	S	S	*	.			trans	-84.5	122.4	177.6	-73	170.6	-174.8	-104.2	2.3	108.3	Q642 Y646 Q669	Q642-R644 PolarHBondContact O-N 3.18Å; R644-Y646 HydrophobicContact CB-CE2 3.83Å; R644-Y646 VanDerWaalsContact O-CD2 3.24Å; R644-Y646 WeakPolarHBondContact O-CD2 3.37Å; R644-Y646 WeakPolarHBondContact O-CE2 3.42Å; R644-Q669 PolarHBondContact O-NE2 3.14Å
645	P	88.9	Confident	68.1	Low	51 Å²	51	103.6 Å²	103.6	33%	0.331	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	143.5	171.9	26.6	-32.1	0	0	0	110.2	I667 V700	P645-I667 HydrophobicContact CB-CG2 3.73Å; P645-V700 HydrophobicContact CB-CG2 4.35Å; P645-V700 HydrophobicContact CG-CB 4.22Å; P645-V700 PolarHBondContact O-N 3.18Å
646	Y	92.4	Very high	71.1	Confident	22 Å²	22	101.4 Å²	101.4	9%	0.086	53%	0.526	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	137.3	170.1	-71.6	-110.2	0	0	0	108.3	R644 I667 V668 V670 K673 F679 V697 T698 P699	R644-Y646 HydrophobicContact CB-CE2 3.83Å; R644-Y646 VanDerWaalsContact O-CD2 3.24Å; R644-Y646 WeakPolarHBondContact O-CD2 3.37Å; R644-Y646 WeakPolarHBondContact O-CE2 3.42Å; Y646-I667 CarbonylContact O-C 3.6Å; Y646-I667 WeakPolarHBondContact O-CA 3.46Å; Y646-V668 PolarHBondContact N-O 3.08Å; Y646-V668 PolarHBondContact O-N 3.28Å; Y646-V670 HydrophobicContact CD1-CG2 4.4Å; Y646-V670 HydrophobicContact CD2-CB 3.67Å; Y646-V670 HydrophobicContact CD2-CG2 3.29Å; Y646-V670 HydrophobicContact CE2-CB 3.77Å; Y646-V670 HydrophobicContact CE2-CG1 4.39Å; Y646-V670 HydrophobicContact CE2-CG2 3.77Å; Y646-V670 HydrophobicContact CG-CG2 3.69Å; Y646-K673 VanDerWaalsContact OH-CE 3.3Å; Y646-K673 WeakPolarHBondContact OH-CE 3.46Å; Y646-K673 PolarHBondContact OH-NZ 3.45Å; Y646-F679 HydrophobicContact CE1-CE2 4.37Å; Y646-V697 HydrophobicContact CD1-CG2 3.83Å; Y646-V697 HydrophobicContact CG-CG2 4.11Å; Y646-T698 CarbonylContact C-O 3.42Å; Y646-T698 VanDerWaalsContact CA-O 3.22Å; Y646-T698 WeakPolarHBondContact CA-O 3.47Å; Y646-T698 VanDerWaalsContact CD1-C 3.47Å; Y646-P699 HydrophobicContact CD1-CB 4.09Å; Y646-P699 VanDerWaalsContact CD1-N 3.28Å; Y646-P699 HydrophobicContact CE1-CB 3.77Å; Y646-P699 HydrophobicContact CE1-CG 4.27Å
647	K	93.2	Very high	73.2	Confident	100 Å²	100	100.4 Å²	100.4	44%	0.435	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	128.9	173.4	-178.1	176.9	-177.6	-175.9	0	109.4	V649 D666 I667 V697 T698 V700	K647-V649 PolarHBondContact O-N 2.84Å; K647-D666 CarbonylContact C-O 3.56Å; K647-D666 WeakPolarHBondContact CA-O 3.17Å; K647-I667 HydrophobicContact CB-CD1 3.84Å; K647-I667 HydrophobicContact CG-CD1 4.02Å; K647-V697 CarbonylContact O-C 3.54Å; K647-V697 VanDerWaalsContact O-CA 3.3Å; K647-V697 WeakPolarHBondContact O-CA 3.4Å; K647-T698 PolarHBondContact N-O 2.85Å; K647-T698 PolarHBondContact O-N 3.4Å; K647-T698 PolarHBondContact O-OG1 2.84Å; K647-V700 HydrophobicContact CB-CG2 3.77Å
648	A	93	Very high	75.8	Confident	0 Å²	0	102.9 Å²	102.9	0%	0	53%	0.533	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	124.5	169.8	0	0	0	0	0	110.3	L662 R663 G665 D666 Y696 V697	A648-L662 HydrophobicContact CB-CB 4.05Å; A648-L662 HydrophobicContact CB-CD1 4.5Å; A648-R663 VanDerWaalsContact CB-O 3.25Å; A648-R663 WeakPolarHBondContact CB-O 3.27Å; A648-G665 PolarHBondContact O-N 3.43Å; A648-D666 HydrophobicContact CB-CB 4.21Å; A648-D666 PolarHBondContact N-O 3.27Å; A648-Y696 CarbonylContact C-O 3.54Å; A648-Y696 WeakPolarHBondContact CA-O 3.36Å; A648-V697 HydrophobicContact CB-CG1 4.29Å
649	V	91.5	Very high	78.5	Confident	45 Å²	45	98.1 Å²	98.1	27%	0.273	50%	0.497	S	S	.	.			trans	-99.1	-12.2	177.6	-71.5	0	0	0	0	112.6	K647 Y696 T698	K647-V649 PolarHBondContact O-N 2.84Å; V649-Y696 WeakPolarHBondContact CG2-O 3.4Å; V649-Y696 PolarHBondContact N-O 3.01Å; V649-T698 HydrophobicContact CG1-CG2 3.72Å; V649-T698 WeakPolarHBondContact CG1-OG1 3.38Å; V649-T698 HydrophobicContact CG2-CG2 4.14Å
650	Y	87.8	Confident	80.9	Confident	139 Å²	139	90.9 Å²	90.9	55%	0.545	46%	0.46	S	S	.	.	S	Bend	trans	-138.5	154	175.3	-57.4	-58.2	0	0	0	110.6	Y696	Y650-Y696 VanDerWaalsContact CB-CD1 3.49Å; Y650-Y696 HydrophobicContact CD2-CG 4.49Å; Y650-Y696 PolarHBondContact N-O 2.85Å
651	N	90.8	Very high	83.5	Confident	96 Å²	96	84.8 Å²	84.8	51%	0.513	43%	0.429	S	S	.	.			trans	-78.6	123.8	175.3	-59.8	-81.9	0	0	0	110.1	L662 R663 E664 Y696	N651-L662 CarbonylContact C-O 3.48Å; N651-L662 WeakPolarHBondContact CA-O 3.3Å; N651-R663 VanDerWaalsContact OD1-CA 3.3Å; N651-R663 WeakPolarHBondContact OD1-CA 3.22Å; N651-E664 PolarHBondContact OD1-N 2.96Å; N651-Y696 WeakPolarHBondContact O-CE1 3.36Å
652	Y	89.4	Confident	85.9	Confident	18 Å²	18	82 Å²	82	7%	0.071	40%	0.4	C	S	.	.	B	Isolated β-bridge	trans	-114.7	131.7	175.2	-169.6	-106.3	0	0	0	110.9	E659 L662 W678 P693 Y696	Y652-E659 HydrophobicContact CE1-CB 4.49Å; Y652-E659 PolarHBondContact OH-OE2 2.9Å; Y652-L662 PolarHBondContact N-O 2.86Å; Y652-L662 PolarHBondContact O-N 2.88Å; Y652-L662 VanDerWaalsContact O-N 3.08Å; Y652-L662 VanDerWaalsContact O-O 3.09Å; Y652-W678 HydrophobicContact CE1-CZ3 4.41Å; Y652-W678 WeakPolarHBondContact OH-CH2 3.3Å; Y652-P693 HydrophobicContact CD2-CG 3.77Å; Y652-P693 HydrophobicContact CE1-CG 4.3Å; Y652-P693 HydrophobicContact CE2-CG 3.5Å; Y652-P693 VanDerWaalsContact CE2-CG 3.5Å; Y652-P693 HydrophobicContact CG-CG 4.28Å; Y652-Y696 HydrophobicContact CD2-CD1 4.02Å; Y652-Y696 AromaticContact CD2-CE1 3.8Å; Y652-Y696 HydrophobicContact CD2-CE1 3.8Å; Y652-Y696 HydrophobicContact CG-CD1 4.33Å; Y652-Y696 HydrophobicContact CG-CE1 4.49Å
653	K	90.2	Very high	87.7	Confident	174 Å²	174	81 Å²	81	76%	0.757	39%	0.39	S	S	*	.			trans	-106.6	126.1	172.9	-68.2	-175.7	179.2	-178.7	0	108.6	Q655	K653-Q655 PolarHBondContact O-N 3.28Å
654	P	89.9	Confident	89	Confident	60 Å²	60	78.8 Å²	78.8	39%	0.39	39%	0.387	S	S	.	.			trans	-65.4	135.5	178.3	28.7	-34.5	0	0	0	110.4	E659 E661	P654-E659 VanDerWaalsContact CA-OE2 3.29Å; P654-E659 WeakPolarHBondContact CA-OE2 3.47Å; P654-E659 HydrophobicContact CB-CB 3.5Å; P654-E659 VanDerWaalsContact CB-CB 3.5Å; P654-E659 WeakPolarHBondContact CB-O 3.24Å; P654-E661 HydrophobicContact CG-CB 4.48Å
655	Q	84.9	Confident	89.7	Confident	162 Å²	162	73.5 Å²	73.5	76%	0.757	38%	0.379	S	S	*	.	S	Bend	trans	-95.5	-35.8	173	-54.2	-172	24.1	0	0	110.5	K653 E659	K653-Q655 PolarHBondContact O-N 3.28Å; Q655-E659 PolarHBondContact N-OE2 3.37Å
656	N	87.2	Confident	89.9	Confident	95 Å²	95	71.9 Å²	71.9	51%	0.508	37%	0.368	S	S	.	.	S	Bend	trans	-108.1	166.5	177	-60.5	-71.6	0	0	0	112	D658 E659	N656-D658 VanDerWaalsContact CB-OD1 3.22Å; N656-D658 WeakPolarHBondContact CB-OD1 3.48Å; N656-E659 HydrophobicContact CB-CG 4.15Å; N656-E659 PolarHBondContact N-OE2 2.78Å; N656-E659 PolarHBondContact ND2-OE1 3.26Å; N656-E659 PolarHBondContact O-N 2.86Å
657	A	82.8	Confident	89.9	Confident	113 Å²	113	73.2 Å²	73.2	93%	0.934	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-15.3	-172.9	0	0	0	0	0	114.3
658	D	88.1	Confident	89.9	Confident	94 Å²	94	68.4 Å²	68.4	50%	0.503	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-10	172.6	61	-66.7	0	0	0	113.2	N656 G690 T691	N656-D658 VanDerWaalsContact CB-OD1 3.22Å; N656-D658 WeakPolarHBondContact CB-OD1 3.48Å; D658-G690 CarbonylContact O-C 3.59Å; D658-G690 WeakPolarHBondContact O-CA 3.49Å; D658-T691 PolarHBondContact O-N 2.82Å; D658-T691 PolarHBondContact O-OG1 2.85Å; D658-T691 PolarHBondContact OD2-OG1 3.43Å
659	E	91.7	Very high	89.9	Confident	22 Å²	22	70.2 Å²	70.2	10%	0.103	36%	0.363	C	S	.	.	B	Isolated β-bridge	trans	-85.2	147	-175.4	-70.4	173	-158.9	0	0	113.4	Y652 P654 Q655 N656 W678 T691	Y652-E659 HydrophobicContact CE1-CB 4.49Å; Y652-E659 PolarHBondContact OH-OE2 2.9Å; P654-E659 VanDerWaalsContact CA-OE2 3.29Å; P654-E659 WeakPolarHBondContact CA-OE2 3.47Å; P654-E659 HydrophobicContact CB-CB 3.5Å; P654-E659 VanDerWaalsContact CB-CB 3.5Å; P654-E659 WeakPolarHBondContact CB-O 3.24Å; Q655-E659 PolarHBondContact N-OE2 3.37Å; N656-E659 HydrophobicContact CB-CG 4.15Å; N656-E659 PolarHBondContact N-OE2 2.78Å; N656-E659 PolarHBondContact ND2-OE1 3.26Å; N656-E659 PolarHBondContact O-N 2.86Å; E659-W678 HydrophobicContact CG-CH2 4.26Å; E659-W678 HydrophobicContact CG-CZ3 3.93Å; E659-T691 CarbonylContact C-O 3.53Å; E659-T691 VanDerWaalsContact CA-O 3.23Å; E659-T691 WeakPolarHBondContact CA-O 3.3Å; E659-T691 WeakPolarHBondContact CA-OG1 3.4Å; E659-T691 WeakPolarHBondContact CG-OG1 3.06Å
660	L	91.5	Very high	89.9	Confident	4 Å²	4	68.7 Å²	68.7	2%	0.021	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-98.9	125.3	-176.6	-175.7	61.2	0	0	0	112.2	L662 V668 A688 T691 F692	L660-L662 HydrophobicContact CD2-CD2 4.42Å; L660-L662 HydrophobicContact CG-CD2 4.47Å; L660-L662 PolarHBondContact O-N 2.91Å; L660-V668 HydrophobicContact CD2-CG1 4.34Å; L660-A688 HydrophobicContact CD1-CB 3.68Å; L660-A688 VanDerWaalsContact CD1-O 3.29Å; L660-A688 WeakPolarHBondContact CD1-O 3.33Å; L660-T691 PolarHBondContact N-O 3.09Å; L660-F692 HydrophobicContact CB-CB 4.35Å; L660-F692 HydrophobicContact CB-CD1 3.96Å; L660-F692 HydrophobicContact CD2-CD1 3.65Å; L660-F692 HydrophobicContact CD2-CE1 3.79Å; L660-F692 HydrophobicContact CG-CD1 4.35Å
661	E	92.1	Very high	90	Very high	57 Å²	57	66.4 Å²	66.4	27%	0.266	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-62.7	121.1	169.2	-171.7	-154.9	-149.5	0	0	110.9	P654 R663 R685	P654-E661 HydrophobicContact CG-CB 4.48Å; E661-R663 VanDerWaalsContact CD-NE 3.34Å; E661-R663 IonicContact OE1-CZ 2.69Å; E661-R663 IonicContact OE1-NE 2.65Å; E661-R663 PolarHBondContact OE1-NE 2.77Å; E661-R663 IonicContact OE1-NH2 3.9Å; E661-R663 PolarHBondContact OE1-NH2 3.3Å; E661-R663 IonicContact OE2-CZ 2.7Å; E661-R663 IonicContact OE2-NE 2.84Å; E661-R663 PolarHBondContact OE2-NE 2.93Å; E661-R663 IonicContact OE2-NH2 3.67Å; E661-R663 PolarHBondContact OE2-NH2 2.79Å; E661-R685 IonicContact OE2-CZ 2.71Å; E661-R685 VanDerWaalsContact OE2-CZ 3.27Å; E661-R685 IonicContact OE2-NH1 2.81Å; E661-R685 PolarHBondContact OE2-NH1 2.86Å; E661-R685 IonicContact OE2-NH2 3.73Å; E661-R685 PolarHBondContact OE2-NH2 2.9Å
662	L	92.3	Very high	89.8	Confident	2 Å²	2	67.5 Å²	67.5	1%	0.01	35%	0.352	C	S	.	.	B	Isolated β-bridge	trans	-104.8	140	168.7	-52.3	179.5	0	0	0	109.8	A648 N651 Y652 L660 V668 F692 V697	A648-L662 HydrophobicContact CB-CB 4.05Å; A648-L662 HydrophobicContact CB-CD1 4.5Å; N651-L662 CarbonylContact C-O 3.48Å; N651-L662 WeakPolarHBondContact CA-O 3.3Å; Y652-L662 PolarHBondContact N-O 2.86Å; Y652-L662 PolarHBondContact O-N 2.88Å; Y652-L662 VanDerWaalsContact O-N 3.08Å; Y652-L662 VanDerWaalsContact O-O 3.09Å; L660-L662 HydrophobicContact CD2-CD2 4.42Å; L660-L662 HydrophobicContact CG-CD2 4.47Å; L660-L662 PolarHBondContact O-N 2.91Å; L662-V668 HydrophobicContact CD2-CG1 3.51Å; L662-V668 HydrophobicContact CD2-CG2 4.44Å; L662-F692 HydrophobicContact CD1-CB 3.97Å; L662-F692 HydrophobicContact CD1-CD2 3.9Å; L662-F692 HydrophobicContact CD1-CG 4.17Å; L662-F692 HydrophobicContact CD2-CB 4.22Å; L662-F692 HydrophobicContact CD2-CD1 4.41Å; L662-F692 HydrophobicContact CD2-CD2 4.17Å; L662-F692 HydrophobicContact CD2-CG 4.02Å; L662-F692 HydrophobicContact CG-CB 4.12Å; L662-F692 HydrophobicContact CG-CG 4.39Å; L662-V697 HydrophobicContact CD1-CG1 3.71Å
663	R	88.9	Confident	89.6	Confident	119 Å²	119	71.5 Å²	71.5	45%	0.449	37%	0.37	S	S	.	.			trans	-118.7	145.9	164	-63.3	178.8	-173.7	-175.3	3	109.8	A648 N651 E661 G665 D666	A648-R663 VanDerWaalsContact CB-O 3.25Å; A648-R663 WeakPolarHBondContact CB-O 3.27Å; N651-R663 VanDerWaalsContact OD1-CA 3.3Å; N651-R663 WeakPolarHBondContact OD1-CA 3.22Å; E661-R663 VanDerWaalsContact CD-NE 3.34Å; E661-R663 IonicContact OE1-CZ 2.69Å; E661-R663 IonicContact OE1-NE 2.65Å; E661-R663 PolarHBondContact OE1-NE 2.77Å; E661-R663 IonicContact OE1-NH2 3.9Å; E661-R663 PolarHBondContact OE1-NH2 3.3Å; E661-R663 IonicContact OE2-CZ 2.7Å; E661-R663 IonicContact OE2-NE 2.84Å; E661-R663 PolarHBondContact OE2-NE 2.93Å; E661-R663 IonicContact OE2-NH2 3.67Å; E661-R663 PolarHBondContact OE2-NH2 2.79Å; R663-G665 PolarHBondContact O-N 2.89Å; R663-G665 VanDerWaalsContact O-N 3.12Å; R663-D666 WeakPolarHBondContact CB-OD2 3.07Å; R663-D666 PolarHBondContact N-OD2 2.8Å; R663-D666 VanDerWaalsContact O-CB 3.25Å; R663-D666 WeakPolarHBondContact O-CB 3.33Å; R663-D666 PolarHBondContact O-N 2.77Å
664	E	90.8	Very high	89.3	Confident	133 Å²	133	65.2 Å²	65.2	62%	0.621	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	119.1	177.1	-178	-177.5	163.2	0	0	109.9	N651	N651-E664 PolarHBondContact OD1-N 2.96Å
665	G	87	Confident	88.2	Confident	37 Å²	37	70 Å²	70	38%	0.381	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.5	-21.6	-172.3	0	0	0	0	0	115.6	A648 R663	A648-G665 PolarHBondContact O-N 3.43Å; R663-G665 PolarHBondContact O-N 2.89Å; R663-G665 VanDerWaalsContact O-N 3.12Å
666	D	91.8	Very high	87.7	Confident	18 Å²	18	67.6 Å²	67.6	10%	0.096	36%	0.362	C	S	.	.			trans	-59.5	140.4	178.2	-77.4	-14.8	0	0	0	111.2	K647 A648 R663 R685	K647-D666 CarbonylContact C-O 3.56Å; K647-D666 WeakPolarHBondContact CA-O 3.17Å; A648-D666 HydrophobicContact CB-CB 4.21Å; A648-D666 PolarHBondContact N-O 3.27Å; R663-D666 WeakPolarHBondContact CB-OD2 3.07Å; R663-D666 PolarHBondContact N-OD2 2.8Å; R663-D666 VanDerWaalsContact O-CB 3.25Å; R663-D666 WeakPolarHBondContact O-CB 3.33Å; R663-D666 PolarHBondContact O-N 2.77Å; D666-R685 WeakPolarHBondContact OD1-CD 3.29Å; D666-R685 IonicContact OD1-CZ 2.85Å; D666-R685 IonicContact OD1-NE 2.89Å; D666-R685 PolarHBondContact OD1-NE 2.83Å; D666-R685 IonicContact OD2-CZ 3.15Å; D666-R685 IonicContact OD2-NE 3.36Å; D666-R685 PolarHBondContact OD2-NE 3.48Å; D666-R685 IonicContact OD2-NH2 2.76Å; D666-R685 PolarHBondContact OD2-NH2 2.91Å
667	I	92.7	Very high	87.6	Confident	49 Å²	49	64.8 Å²	64.8	25%	0.251	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	133.3	164.3	-51.6	-53.5	0	0	0	108.6	P645 Y646 K647 E684 V700	P645-I667 HydrophobicContact CB-CG2 3.73Å; Y646-I667 CarbonylContact O-C 3.6Å; Y646-I667 WeakPolarHBondContact O-CA 3.46Å; K647-I667 HydrophobicContact CB-CD1 3.84Å; K647-I667 HydrophobicContact CG-CD1 4.02Å; I667-E684 HydrophobicContact CB-CB 4.15Å; I667-E684 WeakPolarHBondContact CB-OE2 3.3Å; I667-E684 VanDerWaalsContact CG2-OE2 3.27Å; I667-E684 WeakPolarHBondContact CG2-OE2 3.25Å; I667-E684 WeakPolarHBondContact O-CB 3.14Å; I667-E684 PolarHBondContact O-N 2.78Å; I667-V700 HydrophobicContact CD1-CG2 4.24Å
668	V	93.8	Very high	88	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	134.5	172.9	-57.3	0	0	0	0	110.4	Y646 L660 L662 V670 F692 V697	Y646-V668 PolarHBondContact N-O 3.08Å; Y646-V668 PolarHBondContact O-N 3.28Å; L660-V668 HydrophobicContact CD2-CG1 4.34Å; L662-V668 HydrophobicContact CD2-CG1 3.51Å; L662-V668 HydrophobicContact CD2-CG2 4.44Å; V668-V670 PolarHBondContact O-N 3.27Å; V668-F692 HydrophobicContact CB-CE1 4.44Å; V668-F692 HydrophobicContact CB-CZ 4.09Å; V668-F692 HydrophobicContact CG2-CE1 4.26Å; V668-F692 HydrophobicContact CG2-CE2 3.72Å; V668-F692 HydrophobicContact CG2-CZ 3.46Å; V668-F692 VanDerWaalsContact CG2-CZ 3.46Å; V668-V697 HydrophobicContact CG2-CG1 3.88Å
669	Q	92.3	Very high	88.2	Confident	38 Å²	38	59.8 Å²	59.8	18%	0.178	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	94.9	177	-174.2	49.3	77.1	0	0	109.3	R643 R644 I671 G681 T682	R643-Q669 VanDerWaalsContact CA-NE2 3.3Å; R643-Q669 VanDerWaalsContact CB-CD 3.5Å; R643-Q669 HydrophobicContact CB-CG 4.24Å; R643-Q669 HydrophobicContact CG-CG 4.12Å; R643-Q669 PolarHBondContact O-OE1 3.41Å; R644-Q669 PolarHBondContact O-NE2 3.14Å; Q669-I671 PolarHBondContact O-N 3.5Å; Q669-G681 CarbonylContact O-C 3.44Å; Q669-G681 WeakPolarHBondContact O-CA 3.33Å; Q669-T682 PolarHBondContact N-O 2.82Å; Q669-T682 PolarHBondContact O-N 3.41Å
670	V	91.7	Very high	88.2	Confident	12 Å²	12	59.8 Å²	59.8	7%	0.073	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	131.1	170.2	175.7	0	0	0	0	108.9	Y646 V668 E672 K673 F679 F692	Y646-V670 HydrophobicContact CD1-CG2 4.4Å; Y646-V670 HydrophobicContact CD2-CB 3.67Å; Y646-V670 HydrophobicContact CD2-CG2 3.29Å; Y646-V670 HydrophobicContact CE2-CB 3.77Å; Y646-V670 HydrophobicContact CE2-CG1 4.39Å; Y646-V670 HydrophobicContact CE2-CG2 3.77Å; Y646-V670 HydrophobicContact CG-CG2 3.69Å; V668-V670 PolarHBondContact O-N 3.27Å; V670-E672 WeakPolarHBondContact CG1-O 3.25Å; V670-K673 HydrophobicContact CG1-CG 3.87Å; V670-F679 HydrophobicContact CG1-CB 4.3Å; V670-F679 HydrophobicContact CG1-CD2 4.4Å; V670-F679 HydrophobicContact CG1-CG 4.42Å; V670-F679 HydrophobicContact CG2-CB 4.24Å; V670-F679 HydrophobicContact CG2-CD2 3.79Å; V670-F679 HydrophobicContact CG2-CG 4.39Å; V670-F692 HydrophobicContact CG2-CE2 4.23Å; V670-F692 HydrophobicContact CG2-CZ 3.83Å
671	I	89.8	Confident	88.2	Confident	91 Å²	91	59.6 Å²	59.6	47%	0.467	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	-43.9	176.9	-64.8	166.6	0	0	0	108.8	Q669 V680 F689	Q669-I671 PolarHBondContact O-N 3.5Å; I671-V680 PolarHBondContact N-O 2.74Å; I671-F689 HydrophobicContact CD1-CD2 4.14Å; I671-F689 HydrophobicContact CD1-CE2 4.05Å
672	E	86.1	Confident	88.2	Confident	119 Å²	119	58.6 Å²	58.6	56%	0.556	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.4	155.4	-178.7	-174.5	169	-174	0	0	110.7	V670 F679 V680	V670-E672 WeakPolarHBondContact CG1-O 3.25Å; E672-F679 WeakPolarHBondContact O-CA 3.47Å; E672-V680 HydrophobicContact CB-CB 4.16Å; E672-V680 HydrophobicContact CB-CG2 4.45Å; E672-V680 PolarHBondContact N-O 2.8Å; E672-V680 VanDerWaalsContact N-O 3.14Å; E672-V680 PolarHBondContact O-N 2.71Å
673	K	87.1	Confident	88.2	Confident	103 Å²	103	58.5 Å²	58.5	45%	0.448	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	111.3	174.5	-61.9	-169	171.8	-168.1	0	108.4	Y646 V670 F679	Y646-K673 VanDerWaalsContact OH-CE 3.3Å; Y646-K673 WeakPolarHBondContact OH-CE 3.46Å; Y646-K673 PolarHBondContact OH-NZ 3.45Å; V670-K673 HydrophobicContact CG1-CG 3.87Å; K673-F679 HydrophobicContact CB-CD1 3.74Å; K673-F679 HydrophobicContact CB-CE1 3.91Å; K673-F679 HydrophobicContact CD-CD1 3.94Å; K673-F679 HydrophobicContact CD-CE1 3.54Å; K673-F679 HydrophobicContact CD-CE2 4.23Å; K673-F679 HydrophobicContact CD-CG 4.48Å; K673-F679 HydrophobicContact CD-CZ 3.72Å; K673-F679 HydrophobicContact CG-CD1 3.52Å; K673-F679 HydrophobicContact CG-CD2 4.45Å; K673-F679 HydrophobicContact CG-CE1 3.67Å; K673-F679 HydrophobicContact CG-CG 3.97Å; K673-F679 HydrophobicContact CG-CZ 4.23Å
674	C	83.7	Confident	88.2	Confident	42 Å²	42	58.8 Å²	58.8	28%	0.284	31%	0.31	S	S	.	.			trans	-73.9	153.5	175.2	-56.2	0	0	0	0	109.8	D676 G677 W678	C674-D676 VanDerWaalsContact C-N 3.33Å; C674-D676 WeakPolarHBondContact CB-OD1 3.46Å; C674-G677 PolarHBondContact O-N 2.87Å; C674-W678 WeakPolarHBondContact CB-O 3.5Å; C674-W678 PolarHBondContact N-O 2.92Å
675	D	66	Low	88	Confident	161 Å²	161	56.9 Å²	56.9	86%	0.861	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-22.7	-175.4	56	-31.6	0	0	0	113.2	G677	D675-G677 PolarHBondContact O-N 3.03Å
676	D	74.5	Confident	88	Confident	111 Å²	111	58 Å²	58	59%	0.594	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-13.6	166.9	68.8	-1.5	0	0	0	114.4	C674 W678	C674-D676 VanDerWaalsContact C-N 3.33Å; C674-D676 WeakPolarHBondContact CB-OD1 3.46Å; D676-W678 PolarHBondContact OD1-N 2.8Å
677	G	84.4	Confident	87.7	Confident	36 Å²	36	64.2 Å²	64.2	37%	0.371	33%	0.325	S	S	.	.	S	Bend	trans	96.8	1.7	-179.7	0	0	0	0	0	115.5	C674 D675 G694	C674-G677 PolarHBondContact O-N 2.87Å; D675-G677 PolarHBondContact O-N 3.03Å; G677-G694 WeakPolarHBondContact O-CA 3.29Å; G677-G694 PolarHBondContact O-N 2.91Å
678	W	91.9	Very high	87.4	Confident	77 Å²	77	64 Å²	64	29%	0.292	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	142.3	168.2	-69.6	82.1	0	0	0	110.8	Y652 E659 C674 D676 P693	Y652-W678 HydrophobicContact CE1-CZ3 4.41Å; Y652-W678 WeakPolarHBondContact OH-CH2 3.3Å; E659-W678 HydrophobicContact CG-CH2 4.26Å; E659-W678 HydrophobicContact CG-CZ3 3.93Å; C674-W678 WeakPolarHBondContact CB-O 3.5Å; C674-W678 PolarHBondContact N-O 2.92Å; D676-W678 PolarHBondContact OD1-N 2.8Å; W678-P693 HydrophobicContact CE3-CG 4.26Å; W678-P693 HydrophobicContact CH2-CG 4.15Å; W678-P693 HydrophobicContact CZ3-CG 3.95Å
679	F	91.9	Very high	87.3	Confident	25 Å²	25	70.3 Å²	70.3	11%	0.11	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	141.6	172.8	-63.1	-7	0	0	0	109	Y646 V670 E672 K673 T691 F692 G694 V697	Y646-F679 HydrophobicContact CE1-CE2 4.37Å; V670-F679 HydrophobicContact CG1-CB 4.3Å; V670-F679 HydrophobicContact CG1-CD2 4.4Å; V670-F679 HydrophobicContact CG1-CG 4.42Å; V670-F679 HydrophobicContact CG2-CB 4.24Å; V670-F679 HydrophobicContact CG2-CD2 3.79Å; V670-F679 HydrophobicContact CG2-CG 4.39Å; E672-F679 WeakPolarHBondContact O-CA 3.47Å; K673-F679 HydrophobicContact CB-CD1 3.74Å; K673-F679 HydrophobicContact CB-CE1 3.91Å; K673-F679 HydrophobicContact CD-CD1 3.94Å; K673-F679 HydrophobicContact CD-CE1 3.54Å; K673-F679 HydrophobicContact CD-CE2 4.23Å; K673-F679 HydrophobicContact CD-CG 4.48Å; K673-F679 HydrophobicContact CD-CZ 3.72Å; K673-F679 HydrophobicContact CG-CD1 3.52Å; K673-F679 HydrophobicContact CG-CD2 4.45Å; K673-F679 HydrophobicContact CG-CE1 3.67Å; K673-F679 HydrophobicContact CG-CG 3.97Å; K673-F679 HydrophobicContact CG-CZ 4.23Å; F679-T691 CarbonylContact O-C 3.55Å; F679-F692 HydrophobicContact CB-CD2 4.21Å; F679-F692 HydrophobicContact CB-CE2 3.73Å; F679-F692 HydrophobicContact CB-CZ 3.97Å; F679-F692 HydrophobicContact CD2-CE2 4.2Å; F679-F692 HydrophobicContact CG-CE2 4.47Å; F679-F692 PolarHBondContact N-O 3.42Å; F679-F692 WeakPolarHBondContact O-CD1 3.42Å; F679-F692 PolarHBondContact O-N 3.2Å; F679-G694 VanDerWaalsContact CD2-CA 3.49Å; F679-G694 VanDerWaalsContact CE2-CA 3.43Å; F679-G694 WeakPolarHBondContact CE2-O 3.39Å; F679-V697 HydrophobicContact CD2-CG2 3.74Å; F679-V697 HydrophobicContact CE2-CG2 3.8Å
680	V	92.1	Very high	87.3	Confident	21 Å²	21	68.6 Å²	68.6	13%	0.127	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	132.4	173.4	-173.7	0	0	0	0	107.9	I671 E672 F689 T691	I671-V680 PolarHBondContact N-O 2.74Å; E672-V680 HydrophobicContact CB-CB 4.16Å; E672-V680 HydrophobicContact CB-CG2 4.45Å; E672-V680 PolarHBondContact N-O 2.8Å; E672-V680 VanDerWaalsContact N-O 3.14Å; E672-V680 PolarHBondContact O-N 2.71Å; V680-F689 HydrophobicContact CG1-CE1 4.17Å; V680-F689 HydrophobicContact CG1-CE2 3.51Å; V680-F689 HydrophobicContact CG1-CZ 3.29Å; V680-T691 HydrophobicContact CG2-CG2 4.33Å
681	G	91.8	Very high	87.3	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.4	-173	-178.4	0	0	0	0	0	114.8	Q669 F689 G690	Q669-G681 CarbonylContact O-C 3.44Å; Q669-G681 WeakPolarHBondContact O-CA 3.33Å; G681-F689 VanDerWaalsContact O-CA 3.3Å; G681-F689 WeakPolarHBondContact O-CA 3.23Å; G681-G690 PolarHBondContact N-O 3.24Å; G681-G690 VanDerWaalsContact N-O 3.09Å; G681-G690 PolarHBondContact O-N 2.71Å
682	T	92.1	Very high	87.4	Confident	36 Å²	36	65.2 Å²	65.2	22%	0.221	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	129.3	-179.3	-51.2	0	0	0	0	110.3	Q669 A688	Q669-T682 PolarHBondContact N-O 2.82Å; Q669-T682 PolarHBondContact O-N 3.41Å; T682-A688 CarbonylContact C-O 3.52Å; T682-A688 VanDerWaalsContact CA-O 3.3Å; T682-A688 WeakPolarHBondContact CA-O 3.47Å; T682-A688 WeakPolarHBondContact CG2-O 3.22Å
683	S	92.1	Very high	87.6	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	134.8	175.4	174.9	0	0	0	0	111.1	R685 T686 H687 A688	S683-R685 VanDerWaalsContact C-N 3.31Å; S683-R685 PolarHBondContact OG-N 2.89Å; S683-T686 WeakPolarHBondContact CB-OG1 3.33Å; S683-T686 PolarHBondContact OG-N 2.71Å; S683-H687 WeakPolarHBondContact O-CA 3.35Å; S683-H687 PolarHBondContact O-N 3.32Å; S683-A688 PolarHBondContact N-O 2.86Å
684	E	88.5	Confident	87.7	Confident	126 Å²	126	55.7 Å²	55.7	59%	0.589	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-26.9	174.1	-164	172.5	174.8	0	0	111.5	I667 H687	I667-E684 HydrophobicContact CB-CB 4.15Å; I667-E684 WeakPolarHBondContact CB-OE2 3.3Å; I667-E684 VanDerWaalsContact CG2-OE2 3.27Å; I667-E684 WeakPolarHBondContact CG2-OE2 3.25Å; I667-E684 WeakPolarHBondContact O-CB 3.14Å; I667-E684 PolarHBondContact O-N 2.78Å; E684-H687 PolarHBondContact O-CE1 2.85Å
685	R	87.8	Confident	88	Confident	93 Å²	93	59.2 Å²	59.2	35%	0.351	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-40.8	177.5	175	177.9	54.7	86	4.1	113.2	E661 D666 S683	E661-R685 IonicContact OE2-CZ 2.71Å; E661-R685 VanDerWaalsContact OE2-CZ 3.27Å; E661-R685 IonicContact OE2-NH1 2.81Å; E661-R685 PolarHBondContact OE2-NH1 2.86Å; E661-R685 IonicContact OE2-NH2 3.73Å; E661-R685 PolarHBondContact OE2-NH2 2.9Å; D666-R685 WeakPolarHBondContact OD1-CD 3.29Å; D666-R685 IonicContact OD1-CZ 2.85Å; D666-R685 IonicContact OD1-NE 2.89Å; D666-R685 PolarHBondContact OD1-NE 2.83Å; D666-R685 IonicContact OD2-CZ 3.15Å; D666-R685 IonicContact OD2-NE 3.36Å; D666-R685 PolarHBondContact OD2-NE 3.48Å; D666-R685 IonicContact OD2-NH2 2.76Å; D666-R685 PolarHBondContact OD2-NH2 2.91Å; S683-R685 VanDerWaalsContact C-N 3.31Å; S683-R685 PolarHBondContact OG-N 2.89Å
686	T	85.6	Confident	89.2	Confident	61 Å²	61	54.9 Å²	54.9	37%	0.374	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	-12.9	-171.8	60.5	0	0	0	0	113.9	S683 A688	S683-T686 WeakPolarHBondContact CB-OG1 3.33Å; S683-T686 PolarHBondContact OG-N 2.71Å; T686-A688 PolarHBondContact O-N 2.98Å; T686-A688 WeakPolarHBondContact OG1-CB 3.3Å; T686-A688 PolarHBondContact OG1-N 2.98Å
687	H	86.9	Confident	89.9	Confident	147 Å²	147	50.1 Å²	50.1	68%	0.681	26%	0.258	S	S	*	.			trans	53.7	11.7	-166.3	-57.5	-44.4	0	0	0	114.8	S683 E684	S683-H687 WeakPolarHBondContact O-CA 3.35Å; S683-H687 PolarHBondContact O-N 3.32Å; E684-H687 PolarHBondContact O-CE1 2.85Å
688	A	86.6	Confident	90.2	Very high	45 Å²	45	51.3 Å²	51.3	37%	0.372	26%	0.258	S	S	.	.			trans	-71.8	141.5	171.3	0	0	0	0	0	109.9	L660 T682 S683 T686	L660-A688 HydrophobicContact CD1-CB 3.68Å; L660-A688 VanDerWaalsContact CD1-O 3.29Å; L660-A688 WeakPolarHBondContact CD1-O 3.33Å; T682-A688 CarbonylContact C-O 3.52Å; T682-A688 VanDerWaalsContact CA-O 3.3Å; T682-A688 WeakPolarHBondContact CA-O 3.47Å; T682-A688 WeakPolarHBondContact CG2-O 3.22Å; S683-A688 PolarHBondContact N-O 2.86Å; T686-A688 PolarHBondContact O-N 2.98Å; T686-A688 WeakPolarHBondContact OG1-CB 3.3Å; T686-A688 PolarHBondContact OG1-N 2.98Å
689	F	91.3	Very high	90.1	Very high	132 Å²	132	51.8 Å²	51.8	58%	0.579	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	143.3	173	167.5	-85.3	0	0	0	109.2	I671 V680 G681	I671-F689 HydrophobicContact CD1-CD2 4.14Å; I671-F689 HydrophobicContact CD1-CE2 4.05Å; V680-F689 HydrophobicContact CG1-CE1 4.17Å; V680-F689 HydrophobicContact CG1-CE2 3.51Å; V680-F689 HydrophobicContact CG1-CZ 3.29Å; G681-F689 VanDerWaalsContact O-CA 3.3Å; G681-F689 WeakPolarHBondContact O-CA 3.23Å
690	G	90.7	Very high	89.6	Confident	2 Å²	2	57.2 Å²	57.2	2%	0.021	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.3	179.5	174.4	0	0	0	0	0	114.5	D658 G681	D658-G690 CarbonylContact O-C 3.59Å; D658-G690 WeakPolarHBondContact O-CA 3.49Å; G681-G690 PolarHBondContact N-O 3.24Å; G681-G690 VanDerWaalsContact N-O 3.09Å; G681-G690 PolarHBondContact O-N 2.71Å
691	T	92.5	Very high	89.5	Confident	32 Å²	32	59.1 Å²	59.1	20%	0.196	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	140.2	171.8	47.5	0	0	0	0	110.5	D658 E659 L660 F679 V680	D658-T691 PolarHBondContact O-N 2.82Å; D658-T691 PolarHBondContact O-OG1 2.85Å; D658-T691 PolarHBondContact OD2-OG1 3.43Å; E659-T691 CarbonylContact C-O 3.53Å; E659-T691 VanDerWaalsContact CA-O 3.23Å; E659-T691 WeakPolarHBondContact CA-O 3.3Å; E659-T691 WeakPolarHBondContact CA-OG1 3.4Å; E659-T691 WeakPolarHBondContact CG-OG1 3.06Å; L660-T691 PolarHBondContact N-O 3.09Å; F679-T691 CarbonylContact O-C 3.55Å; V680-T691 HydrophobicContact CG2-CG2 4.33Å
692	F	93	Very high	89.3	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	154.5	171.6	54.7	-90.1	0	0	0	112.1	L660 L662 V668 V670 F679 G694 V697	L660-F692 HydrophobicContact CB-CB 4.35Å; L660-F692 HydrophobicContact CB-CD1 3.96Å; L660-F692 HydrophobicContact CD2-CD1 3.65Å; L660-F692 HydrophobicContact CD2-CE1 3.79Å; L660-F692 HydrophobicContact CG-CD1 4.35Å; L662-F692 HydrophobicContact CD1-CB 3.97Å; L662-F692 HydrophobicContact CD1-CD2 3.9Å; L662-F692 HydrophobicContact CD1-CG 4.17Å; L662-F692 HydrophobicContact CD2-CB 4.22Å; L662-F692 HydrophobicContact CD2-CD1 4.41Å; L662-F692 HydrophobicContact CD2-CD2 4.17Å; L662-F692 HydrophobicContact CD2-CG 4.02Å; L662-F692 HydrophobicContact CG-CB 4.12Å; L662-F692 HydrophobicContact CG-CG 4.39Å; V668-F692 HydrophobicContact CB-CE1 4.44Å; V668-F692 HydrophobicContact CB-CZ 4.09Å; V668-F692 HydrophobicContact CG2-CE1 4.26Å; V668-F692 HydrophobicContact CG2-CE2 3.72Å; V668-F692 HydrophobicContact CG2-CZ 3.46Å; V668-F692 VanDerWaalsContact CG2-CZ 3.46Å; V670-F692 HydrophobicContact CG2-CE2 4.23Å; V670-F692 HydrophobicContact CG2-CZ 3.83Å; F679-F692 HydrophobicContact CB-CD2 4.21Å; F679-F692 HydrophobicContact CB-CE2 3.73Å; F679-F692 HydrophobicContact CB-CZ 3.97Å; F679-F692 HydrophobicContact CD2-CE2 4.2Å; F679-F692 HydrophobicContact CG-CE2 4.47Å; F679-F692 PolarHBondContact N-O 3.42Å; F679-F692 WeakPolarHBondContact O-CD1 3.42Å; F679-F692 PolarHBondContact O-N 3.2Å; F692-G694 PolarHBondContact O-N 2.85Å; F692-V697 HydrophobicContact CD2-CG1 3.93Å; F692-V697 HydrophobicContact CE2-CG1 3.71Å; F692-V697 HydrophobicContact CE2-CG2 3.96Å
693	P	90.1	Very high	89.2	Confident	13 Å²	13	63.6 Å²	63.6	8%	0.084	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	124.8	-176.4	-20.3	33	0	0	0	111.7	Y652 W678 N695 Y696	Y652-P693 HydrophobicContact CD2-CG 3.77Å; Y652-P693 HydrophobicContact CE1-CG 4.3Å; Y652-P693 HydrophobicContact CE2-CG 3.5Å; Y652-P693 VanDerWaalsContact CE2-CG 3.5Å; Y652-P693 HydrophobicContact CG-CG 4.28Å; W678-P693 HydrophobicContact CE3-CG 4.26Å; W678-P693 HydrophobicContact CH2-CG 4.15Å; W678-P693 HydrophobicContact CZ3-CG 3.95Å; P693-N695 WeakPolarHBondContact CB-OD1 2.97Å; P693-N695 PolarHBondContact O-N 3.37Å; P693-N695 VanDerWaalsContact O-N 3.11Å; P693-Y696 HydrophobicContact CB-CD2 3.71Å; P693-Y696 HydrophobicContact CB-CE2 4.23Å; P693-Y696 HydrophobicContact CB-CG 4.38Å; P693-Y696 HydrophobicContact CG-CD2 4.18Å; P693-Y696 HydrophobicContact CG-CE2 4.44Å; P693-Y696 WeakPolarHBondContact O-CB 3.22Å; P693-Y696 PolarHBondContact O-N 3.29Å
694	G	87.8	Confident	89	Confident	10 Å²	10	67.4 Å²	67.4	10%	0.103	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-65.6	-16.9	-175.2	0	0	0	0	0	114.7	G677 F679 F692	G677-G694 WeakPolarHBondContact O-CA 3.29Å; G677-G694 PolarHBondContact O-N 2.91Å; F679-G694 VanDerWaalsContact CD2-CA 3.49Å; F679-G694 VanDerWaalsContact CE2-CA 3.43Å; F679-G694 WeakPolarHBondContact CE2-O 3.39Å; F692-G694 PolarHBondContact O-N 2.85Å
695	N	90.8	Very high	89.1	Confident	115 Å²	115	63.7 Å²	63.7	62%	0.615	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-82.5	-6.9	173.1	63.3	-36.9	0	0	0	114.2	P693 V697	P693-N695 WeakPolarHBondContact CB-OD1 2.97Å; P693-N695 PolarHBondContact O-N 3.37Å; P693-N695 VanDerWaalsContact O-N 3.11Å; N695-V697 VanDerWaalsContact C-N 3.33Å
696	Y	90.1	Very high	89.1	Confident	71 Å²	71	61.7 Å²	61.7	28%	0.278	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-88.8	-2.3	174.2	-80.1	-122.8	0	0	0	112.5	A648 V649 Y650 N651 Y652 P693	A648-Y696 CarbonylContact C-O 3.54Å; A648-Y696 WeakPolarHBondContact CA-O 3.36Å; V649-Y696 WeakPolarHBondContact CG2-O 3.4Å; V649-Y696 PolarHBondContact N-O 3.01Å; Y650-Y696 VanDerWaalsContact CB-CD1 3.49Å; Y650-Y696 HydrophobicContact CD2-CG 4.49Å; Y650-Y696 PolarHBondContact N-O 2.85Å; N651-Y696 WeakPolarHBondContact O-CE1 3.36Å; Y652-Y696 HydrophobicContact CD2-CD1 4.02Å; Y652-Y696 AromaticContact CD2-CE1 3.8Å; Y652-Y696 HydrophobicContact CD2-CE1 3.8Å; Y652-Y696 HydrophobicContact CG-CD1 4.33Å; Y652-Y696 HydrophobicContact CG-CE1 4.49Å; P693-Y696 HydrophobicContact CB-CD2 3.71Å; P693-Y696 HydrophobicContact CB-CE2 4.23Å; P693-Y696 HydrophobicContact CB-CG 4.38Å; P693-Y696 HydrophobicContact CG-CD2 4.18Å; P693-Y696 HydrophobicContact CG-CE2 4.44Å; P693-Y696 WeakPolarHBondContact O-CB 3.22Å; P693-Y696 PolarHBondContact O-N 3.29Å
697	V	90.7	Very high	89.4	Confident	10 Å²	10	61.8 Å²	61.8	6%	0.061	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	150.8	-177.4	-49.6	0	0	0	0	112.7	Y646 K647 A648 L662 V668 F679 F692 N695	Y646-V697 HydrophobicContact CD1-CG2 3.83Å; Y646-V697 HydrophobicContact CG-CG2 4.11Å; K647-V697 CarbonylContact O-C 3.54Å; K647-V697 VanDerWaalsContact O-CA 3.3Å; K647-V697 WeakPolarHBondContact O-CA 3.4Å; A648-V697 HydrophobicContact CB-CG1 4.29Å; L662-V697 HydrophobicContact CD1-CG1 3.71Å; V668-V697 HydrophobicContact CG2-CG1 3.88Å; F679-V697 HydrophobicContact CD2-CG2 3.74Å; F679-V697 HydrophobicContact CE2-CG2 3.8Å; F692-V697 HydrophobicContact CD2-CG1 3.93Å; F692-V697 HydrophobicContact CE2-CG1 3.71Å; F692-V697 HydrophobicContact CE2-CG2 3.96Å; N695-V697 VanDerWaalsContact C-N 3.33Å
698	T	90.1	Very high	89.6	Confident	61 Å²	61	55.2 Å²	55.2	37%	0.374	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	144.3	174.2	54.4	0	0	0	0	110.5	Y646 K647 V649	Y646-T698 CarbonylContact C-O 3.42Å; Y646-T698 VanDerWaalsContact CA-O 3.22Å; Y646-T698 WeakPolarHBondContact CA-O 3.47Å; Y646-T698 VanDerWaalsContact CD1-C 3.47Å; K647-T698 PolarHBondContact N-O 2.85Å; K647-T698 PolarHBondContact O-N 3.4Å; K647-T698 PolarHBondContact O-OG1 2.84Å; V649-T698 HydrophobicContact CG1-CG2 3.72Å; V649-T698 WeakPolarHBondContact CG1-OG1 3.38Å; V649-T698 HydrophobicContact CG2-CG2 4.14Å
699	P	89.1	Confident	89.8	Confident	88 Å²	88	56.1 Å²	56.1	57%	0.571	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.2	147.6	174.3	27.9	-34.6	0	0	0	110.6	Y646	Y646-P699 HydrophobicContact CD1-CB 4.09Å; Y646-P699 VanDerWaalsContact CD1-N 3.28Å; Y646-P699 HydrophobicContact CE1-CB 3.77Å; Y646-P699 HydrophobicContact CE1-CG 4.27Å
700	V	81.9	Confident	89.7	Confident	139 Å²	139	49.2 Å²	49.2	84%	0.842	29%	0.286	S	S	*	.			trans	-96.4	0	175.3	-169.4	0	0	0	0	110.5	P645 K647 I667	P645-V700 HydrophobicContact CB-CG2 4.35Å; P645-V700 HydrophobicContact CG-CB 4.22Å; P645-V700 PolarHBondContact O-N 3.18Å; K647-V700 HydrophobicContact CB-CG2 3.77Å; I667-V700 HydrophobicContact CD1-CG2 4.24Å

Retrieved 700 of 700 residues in 131.6 ms (Link to these results)

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