A0A077ZEJ7_TRITR Loading...

Protein transport protein Sec24C

AlphaFold DB , UniProt , Accession A0A077ZEJ7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 741 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	32.8	Very low	30.6	Very low	243 Å²	243	143.6 Å²	143.6	100%	1.197	86%	0.855	S	S	*	*				0	137.2	0	-71.3	-167.4	169	0	0	108.4
2	P	35.5	Very low	30.3	Very low	123 Å²	123	139.4 Å²	139.4	80%	0.799	85%	0.848	S	S	*	*				-106.2	133.5	-62.9	29.8	-15	0	0	0	110.7
3	A	29.7	Very low	29.9	Very low	98 Å²	98	146.8 Å²	146.8	81%	0.81	85%	0.851	S	S	*	*				62.4	107.6	90.3	0	0	0	0	0	115.6
4	V	38	Very low	29.8	Very low	153 Å²	153	144.4 Å²	144.4	93%	0.927	84%	0.843	S	S	*	*			trans	-141.2	135.3	150.7	-178	0	0	0	0	110.1
5	N	31.3	Very low	29.7	Very low	132 Å²	132	141.6 Å²	141.6	71%	0.706	83%	0.831	S	S	*	*			trans	-70.8	144.9	-165.4	-86.3	-32	0	0	0	118
6	Q	28.7	Very low	29.6	Very low	166 Å²	166	144 Å²	144	78%	0.776	83%	0.831	S	S	*	*				89	163.2	114.2	-81.3	-179.1	10.3	0	0	116.6
7	P	32.8	Very low	29.4	Very low	111 Å²	111	144 Å²	144	72%	0.721	83%	0.827	S	S	*	*			cis	-134.1	171.2	-13.1	26.2	-3	0	0	0	115.4
8	T	24.1	Very low	29.2	Very low	141 Å²	141	142.4 Å²	142.4	87%	0.865	82%	0.823	S	S	*	*			trans	-57.2	136.8	162.9	40.4	0	0	0	0	114.4
9	A	29.7	Very low	29	Very low	104 Å²	104	140.1 Å²	140.1	86%	0.86	82%	0.816	S	S	*	*			trans	-145.2	105.2	155.1	0	0	0	0	0	110.6
10	T	24.2	Very low	28.9	Very low	138 Å²	138	138.1 Å²	138.1	85%	0.847	82%	0.816	S	S	*	*			trans	-70.9	128.3	161.5	36.1	0	0	0	0	109.9
11	L	29.8	Very low	28.8	Very low	171 Å²	171	138.8 Å²	138.8	90%	0.895	82%	0.821	S	S	*	*			trans	-156.5	111.9	154	-100.9	167.1	0	0	0	111.4
12	A	27.4	Very low	28.4	Very low	93 Å²	93	130 Å²	130	77%	0.769	79%	0.793	S	S	*	*			trans	26.9	124.5	146.8	0	0	0	0	0	121.7
13	R	24.7	Very low	28.1	Very low	235 Å²	235	129.5 Å²	129.5	89%	0.887	79%	0.788	S	S	*	*			trans	-67.5	153.9	163.8	-147.7	-179.7	-168.7	-166.7	3.2	111.7
14	P	28.8	Very low	27.9	Very low	114 Å²	114	127.9 Å²	127.9	74%	0.74	77%	0.774	S	S	*	*			trans	-126.3	165.3	134.6	26.8	-9.6	0	0	0	112.6
15	P	28.5	Very low	27.3	Very low	102 Å²	102	129.1 Å²	129.1	66%	0.662	77%	0.77	S	S	*	*			trans	-96.7	159.7	-152.9	36.7	-32.6	0	0	0	115
16	H	27.9	Very low	27.3	Very low	180 Å²	180	127.2 Å²	127.2	83%	0.833	76%	0.756	S	S	*	*			trans	42.4	114.6	150.8	-79.8	-81.5	0	0	0	120.5
17	D	26.1	Very low	27.1	Very low	144 Å²	144	129.2 Å²	129.2	77%	0.77	76%	0.762	S	S	*	*				-158.2	129.9	122.9	-144.1	-6.9	0	0	0	110.2
18	P	25.9	Very low	26.9	Very low	116 Å²	116	130.7 Å²	130.7	75%	0.753	76%	0.759	S	S	*	*			trans	-97.5	100.2	177.6	33.4	-21.3	0	0	0	109.8
19	S	25.2	Very low	27	Very low	98 Å²	98	132 Å²	132	69%	0.685	76%	0.761	S	S	*	*			trans	-152.9	130.5	169.3	58.2	0	0	0	0	112.6
20	A	26.6	Very low	26.8	Very low	100 Å²	100	134.4 Å²	134.4	83%	0.826	76%	0.759	S	S	*	*			trans	75.5	90.2	159.1	0	0	0	0	0	118.2
21	V	27	Very low	26.9	Very low	152 Å²	152	130.8 Å²	130.8	92%	0.921	75%	0.749	S	S	*	*			trans	-85.5	102.7	151.2	-178.7	0	0	0	0	106.9
22	G	25.5	Very low	26.7	Very low	58 Å²	58	128 Å²	128	60%	0.598	74%	0.744	S	S	*	*			trans	-78.3	120.8	-178	0	0	0	0	0	111.9
23	V	28.4	Very low	26.8	Very low	114 Å²	114	134 Å²	134	69%	0.691	75%	0.748	S	S	*	*			trans	-68.2	129.9	161.2	179.7	0	0	0	0	107.5	Q25	V23-Q25 VanDerWaalsContact C-N 3.34Å; V23-Q25 PolarHBondContact O-N 3.46Å
24	A	25.5	Very low	27	Very low	64 Å²	64	128.8 Å²	128.8	53%	0.529	75%	0.745	S	S	.	*			trans	-56.2	94.6	175.2	0	0	0	0	0	110.5	F26	A24-F26 PolarHBondContact O-N 3.04Å
25	Q	26.2	Very low	26.9	Very low	178 Å²	178	133.1 Å²	133.1	83%	0.832	76%	0.755	S	S	*	*			trans	-66.7	127.2	175.2	-77.7	-179.6	-30.2	0	0	109.2	V23 K27	V23-Q25 VanDerWaalsContact C-N 3.34Å; V23-Q25 PolarHBondContact O-N 3.46Å; Q25-K27 PolarHBondContact O-N 3.47Å
26	F	30.2	Very low	26.9	Very low	93 Å²	93	131.4 Å²	131.4	41%	0.408	76%	0.756	S	S	.	*			trans	-49.9	111	150.9	-85.4	-82.7	0	0	0	107.1	A24 Q28 Y262	A24-F26 PolarHBondContact O-N 3.04Å; F26-Q28 PolarHBondContact O-N 2.65Å; F26-Y262 HydrophobicContact CE1-CE1 4.19Å; F26-Y262 HydrophobicContact CZ-CD1 4.32Å; F26-Y262 HydrophobicContact CZ-CE1 4.18Å
27	K	25	Very low	27.1	Very low	207 Å²	207	129 Å²	129	90%	0.9	76%	0.756	S	S	*	*			trans	-49.3	101.3	173.5	-80.7	-177.8	174.2	178.1	0	109.2	Q25	Q25-K27 PolarHBondContact O-N 3.47Å
28	Q	28	Very low	27	Very low	143 Å²	143	133.3 Å²	133.3	67%	0.668	76%	0.764	S	S	*	*			trans	-80	128.4	164.9	-81.4	-176.4	-0.4	0	0	107.1	F26 D30	F26-Q28 PolarHBondContact O-N 2.65Å; Q28-D30 PolarHBondContact O-N 3.09Å
29	N	26.3	Very low	27.1	Very low	169 Å²	169	135 Å²	135	90%	0.904	77%	0.767	S	S	*	*			trans	-83.7	109.2	167.7	-147.5	22.4	0	0	0	105.8	G31	N29-G31 PolarHBondContact O-N 3.17Å; N29-G31 VanDerWaalsContact O-N 3.14Å
30	D	25.4	Very low	27.3	Very low	154 Å²	154	134.5 Å²	134.5	82%	0.824	76%	0.763	S	S	*	*			trans	-62.1	108.1	177.2	-81.5	-39.9	0	0	0	110.5	Q28	Q28-D30 PolarHBondContact O-N 3.09Å
31	G	27.3	Very low	27.5	Very low	62 Å²	62	138.4 Å²	138.4	64%	0.639	76%	0.764	S	S	*	*			trans	-107.8	95.9	161.1	0	0	0	0	0	108.2	N29	N29-G31 PolarHBondContact O-N 3.17Å; N29-G31 VanDerWaalsContact O-N 3.14Å
32	S	25.7	Very low	27.6	Very low	113 Å²	113	142.4 Å²	142.4	79%	0.79	76%	0.764	S	S	*	*			trans	-61.1	129.5	177	44.3	0	0	0	0	111.6
33	Y	28.5	Very low	27.9	Very low	218 Å²	218	144.5 Å²	144.5	86%	0.855	78%	0.776	S	S	*	*			trans	-127.9	134.6	158.5	-73.7	-78.3	0	0	0	109.7
34	P	29.8	Very low	28	Very low	126 Å²	126	143.5 Å²	143.5	82%	0.818	78%	0.779	S	S	*	*			trans	-83.2	140.5	-166.3	2.4	16.5	0	0	0	111.8
35	Q	25.4	Very low	28.5	Very low	204 Å²	204	146 Å²	146	95%	0.953	79%	0.791	S	S	*	*			trans	-69.3	127.5	164.9	-72.5	-178.5	-18.4	0	0	110.1
36	G	29.5	Very low	29	Very low	66 Å²	66	143 Å²	143	68%	0.68	79%	0.786	S	S	*	*			trans	-128	136.9	167.7	0	0	0	0	0	110.2
37	P	31.2	Very low	29.1	Very low	129 Å²	129	145 Å²	145	84%	0.838	81%	0.806	S	S	*	*			trans	-84.6	147.5	-168.8	32.9	-32.4	0	0	0	113.2	N39	P37-N39 PolarHBondContact O-N 2.69Å
38	Y	25.6	Very low	29.7	Very low	236 Å²	236	142.1 Å²	142.1	93%	0.925	81%	0.806	S	S	*	*			trans	-57.7	123.6	167.3	-98.8	-105.5	0	0	0	111.6
39	N	26.7	Very low	29.8	Very low	152 Å²	152	140.8 Å²	140.8	81%	0.813	81%	0.812	S	S	*	*				-169.4	153.7	126.1	-134.7	-13.4	0	0	0	114.4	P37	P37-N39 PolarHBondContact O-N 2.69Å
40	S	28.7	Very low	30.3	Very low	87 Å²	87	137.5 Å²	137.5	61%	0.608	81%	0.808	S	S	*	*			trans	79.9	114.2	153.1	44.6	0	0	0	0	122.9
41	Q	31.4	Very low	30.7	Very low	182 Å²	182	136 Å²	136	85%	0.85	81%	0.807	S	S	*	*				87.9	112.5	122.2	-71.3	171.2	-8.6	0	0	121.3
42	Y	28.3	Very low	31.1	Very low	236 Å²	236	140.4 Å²	140.4	93%	0.925	82%	0.821	S	S	*	*			trans	-7	128.4	151.3	-70.9	-92.6	0	0	0	119.5
43	A	31.8	Very low	31.3	Very low	101 Å²	101	146.8 Å²	146.8	84%	0.835	83%	0.828	S	S	*	*			trans	-170.9	127.3	131.1	0	0	0	0	0	111.3
44	A	30.7	Very low	31.4	Very low	93 Å²	93	139.8 Å²	139.8	77%	0.769	82%	0.822	S	S	*	*			trans	-84.8	163.9	157.9	0	0	0	0	0	108.5
45	P	36.3	Very low	31.4	Very low	118 Å²	118	142.8 Å²	142.8	77%	0.766	82%	0.823	S	S	*	*				-157.8	-147.6	56	40.9	-15.6	0	0	0	112.7
46	P	37.8	Very low	31.3	Very low	113 Å²	113	140.7 Å²	140.7	73%	0.734	82%	0.817	S	S	*	*			cis	-121.1	176.3	-40.4	22.6	-0.1	0	0	0	114
47	T	31	Very low	31.4	Very low	135 Å²	135	147.6 Å²	147.6	83%	0.828	82%	0.824	S	S	*	*			trans	-57.9	144.2	175.9	50.2	0	0	0	0	117
48	V	37.6	Very low	31.2	Very low	148 Å²	148	145.4 Å²	145.4	90%	0.897	82%	0.817	S	S	*	*			trans	-136.9	127.1	152.3	-173.1	0	0	0	0	109.8
49	S	31.2	Very low	31.6	Very low	115 Å²	115	144.1 Å²	144.1	80%	0.804	82%	0.817	S	S	*	*			trans	-93.8	142	178.8	48.8	0	0	0	0	112.3
50	A	37	Very low	31.8	Very low	99 Å²	99	142.2 Å²	142.2	82%	0.818	82%	0.816	S	S	*	*			trans	-152.7	133.8	154.3	0	0	0	0	0	110.7
51	P	32.9	Very low	32.2	Very low	124 Å²	124	142.7 Å²	142.7	81%	0.805	82%	0.824	S	S	*	*			trans	-106.7	143.9	179.9	36.9	-27.6	0	0	0	112.6
52	V	35.2	Very low	32.5	Very low	154 Å²	154	144 Å²	144	93%	0.933	83%	0.828	S	S	*	*			trans	-143.8	137.9	159.8	-174.1	0	0	0	0	111
53	R	30.6	Very low	33.7	Very low	246 Å²	246	138.4 Å²	138.4	93%	0.928	82%	0.82	S	S	*	*			trans	-85.2	160.7	-172.3	-74.7	169	158.6	175.2	-6.3	114.6
54	G	29.8	Very low	34.3	Very low	72 Å²	72	139.5 Å²	139.5	74%	0.742	82%	0.819	S	S	*	*			trans	99.2	133.9	150.5	0	0	0	0	0	113.7
55	F	31.2	Very low	35.1	Very low	189 Å²	189	139.9 Å²	139.9	83%	0.829	82%	0.822	S	S	*	*			cis	-158.1	149.1	30.7	-123.3	-99.8	0	0	0	110.1	Y57	F55-Y57 HydrophobicContact CD1-CE2 4.22Å
56	L	23.9	Very low	35.9	Very low	160 Å²	160	144.1 Å²	144.1	84%	0.838	83%	0.829	S	S	*	*			trans	-95.3	146.1	172.3	-76.3	163.1	0	0	0	110.6
57	Y	30.8	Very low	36.3	Very low	210 Å²	210	144.3 Å²	144.3	82%	0.824	83%	0.83	S	S	*	*			trans	-136.8	128.4	148.8	-84.7	-79.6	0	0	0	109.5	F55	F55-Y57 HydrophobicContact CD1-CE2 4.22Å
58	A	27.5	Very low	37.2	Very low	84 Å²	84	143.7 Å²	143.7	69%	0.694	83%	0.831	S	S	*	*			trans	-113.2	148.9	178.1	0	0	0	0	0	109.3
59	F	33	Very low	37.9	Very low	209 Å²	209	142.8 Å²	142.8	92%	0.917	83%	0.829	S	S	*	*			trans	-141.7	128.2	151.1	-87.5	-76.3	0	0	0	110.8
60	S	31.8	Very low	38.6	Very low	112 Å²	112	146.5 Å²	146.5	78%	0.783	84%	0.836	S	S	*	*			trans	-105	152.4	-179.8	51.5	0	0	0	0	110.8
61	A	37.4	Very low	39.5	Very low	96 Å²	96	145.1 Å²	145.1	79%	0.793	83%	0.83	S	S	*	*			trans	-171.3	116.2	140.2	0	0	0	0	0	112
62	F	37.8	Very low	40.8	Very low	210 Å²	210	145.2 Å²	145.2	92%	0.921	83%	0.831	S	S	*	*			trans	-130.7	145.6	152.1	-92.8	-80.8	0	0	0	107.7
63	P	52.6	Low	41.6	Very low	118 Å²	118	144 Å²	144	77%	0.766	83%	0.827	S	S	*	*			trans	-90.7	160.4	-177.3	32.8	-27.2	0	0	0	113.6
64	P	43.4	Very low	42.8	Very low	125 Å²	125	136.9 Å²	136.9	81%	0.812	82%	0.82	S	S	*	*			trans	-100.3	157.2	-161.2	37.9	-32	0	0	0	114.7
65	A	49	Very low	44	Very low	100 Å²	100	139.3 Å²	139.3	83%	0.826	82%	0.823	S	S	*	*			trans	-112.7	139.5	167	0	0	0	0	0	110.9
66	F	53.3	Low	44.6	Very low	207 Å²	207	136.3 Å²	136.3	91%	0.908	82%	0.822	S	S	*	*			trans	-70.5	145.2	-176.1	-75.8	-97.3	0	0	0	113.7
67	P	44.4	Very low	45.7	Very low	118 Å²	118	137.9 Å²	137.9	77%	0.766	83%	0.828	S	S	*	*			trans	-101.8	158.5	169.2	36.4	-27.9	0	0	0	112.7
68	S	50.7	Low	46.2	Very low	121 Å²	121	135.7 Å²	135.7	85%	0.846	83%	0.83	S	S	*	*			trans	-137.2	153.3	167.5	-77.6	0	0	0	0	110.6
69	P	53.3	Low	46.7	Very low	130 Å²	130	137.1 Å²	137.1	84%	0.844	84%	0.835	S	S	*	*			trans	-103.6	167.7	-141.6	10.5	10.2	0	0	0	116.2
70	M	45.3	Very low	47.3	Very low	193 Å²	193	135.9 Å²	135.9	95%	0.951	83%	0.834	S	S	*	*			trans	-55.4	148.9	-176	-66.4	-173.3	171.3	0	0	117.3
71	G	55	Low	47.7	Very low	69 Å²	69	136.6 Å²	136.6	71%	0.711	84%	0.84	S	S	*	*			trans	-112.1	153.8	151.7	0	0	0	0	0	111.2
72	P	61.4	Low	47.7	Very low	127 Å²	127	135.5 Å²	135.5	83%	0.825	84%	0.837	S	S	*	*			trans	-88.5	165	-158.2	35.4	-34.6	0	0	0	115
73	P	50.9	Low	47.5	Very low	129 Å²	129	129.3 Å²	129.3	84%	0.838	83%	0.833	S	S	*	*			trans	-92	152.8	-166.2	36.3	-32.7	0	0	0	113.9
74	A	56.4	Low	46.7	Very low	95 Å²	95	130.6 Å²	130.6	79%	0.785	84%	0.838	S	S	*	*			trans	-108.5	150.1	168.5	0	0	0	0	0	110.9
75	P	55.2	Low	46.1	Very low	123 Å²	123	128.2 Å²	128.2	80%	0.799	84%	0.836	S	S	*	*			trans	-89	165.3	-163.1	35.8	-34	0	0	0	114.5
76	P	44.2	Very low	45.4	Very low	127 Å²	127	128.5 Å²	128.5	83%	0.825	84%	0.839	S	S	*	*			trans	-92.8	149.5	-163.5	35.9	-32	0	0	0	114.1
77	M	45.7	Very low	44.6	Very low	193 Å²	193	121.7 Å²	121.7	95%	0.951	83%	0.827	S	S	*	*			trans	-128.6	125.1	160.3	-83.2	-164.2	-164.7	0	0	110.1
78	D	41	Very low	44.3	Very low	163 Å²	163	125.2 Å²	125.2	87%	0.872	83%	0.833	S	S	*	*			trans	-68.9	139	165.9	-73	-51.7	0	0	0	111.2
79	S	39.6	Very low	44.2	Very low	115 Å²	115	129.5 Å²	129.5	80%	0.804	84%	0.837	S	S	*	*				176.1	116.4	128.7	39.2	0	0	0	0	112.7
80	M	44.3	Very low	44.2	Very low	182 Å²	182	134.6 Å²	134.6	90%	0.897	84%	0.839	S	S	*	*			trans	38.2	134.3	137.9	-67.8	-152	149.1	0	0	122.7
81	S	41.2	Very low	45	Very low	128 Å²	128	129 Å²	129	90%	0.895	81%	0.813	S	S	*	*			trans	97	130.6	141.2	79.5	0	0	0	0	117.7
82	G	36.7	Very low	45.5	Very low	72 Å²	72	129.8 Å²	129.8	74%	0.742	80%	0.801	S	S	*	*			trans	138.5	84.3	167.7	0	0	0	0	0	113
83	G	33.1	Very low	45.6	Very low	81 Å²	81	128.1 Å²	128.1	84%	0.835	79%	0.79	S	S	*	*			trans	-65.3	146.1	172.4	0	0	0	0	0	112.3
84	V	36.9	Very low	46.3	Very low	144 Å²	144	128.9 Å²	128.9	87%	0.873	79%	0.787	S	S	*	*			trans	-142.4	120.7	161.9	-155.8	0	0	0	0	107.6
85	G	31.7	Very low	47.2	Very low	75 Å²	75	131.6 Å²	131.6	77%	0.773	79%	0.785	S	S	*	*			trans	-60.4	134	-176.6	0	0	0	0	0	112.5	G87	G85-G87 VanDerWaalsContact C-N 3.3Å; G85-G87 PolarHBondContact O-N 3.21Å
86	A	33.9	Very low	48.3	Very low	106 Å²	106	127.4 Å²	127.4	88%	0.876	76%	0.755	S	S	*	*			trans	-72.5	89.8	164.9	0	0	0	0	0	108.4	Q88	A86-Q88 PolarHBondContact O-N 3.38Å
87	G	35	Very low	50.3	Low	64 Å²	64	122.6 Å²	122.6	66%	0.66	72%	0.724	S	S	*	*			trans	-54.2	131.6	167.4	0	0	0	0	0	109.8	G85 K89	G85-G87 VanDerWaalsContact C-N 3.3Å; G85-G87 PolarHBondContact O-N 3.21Å; G87-K89 PolarHBondContact O-N 2.96Å
88	Q	39.4	Very low	52.3	Low	193 Å²	193	115.4 Å²	115.4	90%	0.902	69%	0.692	S	S	*	*			trans	-51.3	106.4	171.1	-80.1	172.1	-27.1	0	0	108.9	A86 R90	A86-Q88 PolarHBondContact O-N 3.38Å; Q88-R90 PolarHBondContact O-N 3.12Å
89	K	48.4	Very low	54.6	Low	210 Å²	210	110.2 Å²	110.2	91%	0.913	66%	0.664	S	S	*	*			trans	-60	108.4	166.7	-82.3	-175.9	174.8	-177.2	0	107	G87	G87-K89 PolarHBondContact O-N 2.96Å
90	R	54	Low	56.9	Low	238 Å²	238	109 Å²	109	90%	0.898	65%	0.648	S	S	*	*			trans	-53.4	140.6	168.7	-78.2	-179.5	171.4	-177.5	-3.5	108.4	Q88 D92	Q88-R90 PolarHBondContact O-N 3.12Å; R90-D92 PolarHBondContact O-N 3.27Å
91	L	62.2	Low	59	Low	76 Å²	76	105.3 Å²	105.3	40%	0.398	63%	0.629	S	S	.	*			trans	-53.9	127.5	169.8	-79.6	132.5	0	0	0	108.7	P93 C730	L91-P93 VanDerWaalsContact O-CD 3.26Å; L91-P93 WeakPolarHBondContact O-CD 3.49Å; L91-C730 WeakPolarHBondContact CD1-SG 3.39Å
92	D	65.6	Low	61.4	Low	85 Å²	85	100.3 Å²	100.3	46%	0.455	59%	0.592	S	S	.	*			trans	-72.7	114.1	172.2	-175.3	-9.5	0	0	0	108.1	R90 N94 M95	R90-D92 PolarHBondContact O-N 3.27Å; D92-N94 PolarHBondContact O-N 2.91Å; D92-N94 VanDerWaalsContact O-N 3.14Å; D92-N94 WeakPolarHBondContact OD1-CB 3.08Å; D92-N94 PolarHBondContact OD1-N 3.04Å; D92-N94 PolarHBondContact OD1-ND2 2.77Å; D92-M95 HydrophobicContact CB-CB 4.44Å; D92-M95 HydrophobicContact CB-CG 4Å; D92-M95 PolarHBondContact O-N 2.83Å
93	P	62	Low	63.9	Low	91 Å²	91	97.6 Å²	97.6	59%	0.591	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-57	-28.5	-179.9	-24	35.4	0	0	0	112.9	L91 M95 M96	L91-P93 VanDerWaalsContact O-CD 3.26Å; L91-P93 WeakPolarHBondContact O-CD 3.49Å; P93-M95 PolarHBondContact O-N 3.32Å; P93-M96 WeakPolarHBondContact O-CB 3.15Å; P93-M96 PolarHBondContact O-N 3.25Å; P93-M96 VanDerWaalsContact O-N 3.15Å
94	N	66.3	Low	66.6	Low	145 Å²	145	97.8 Å²	97.8	78%	0.775	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-70.5	-14.6	-179.7	-59.4	-46.6	0	0	0	113.2	D92	D92-N94 PolarHBondContact O-N 2.91Å; D92-N94 VanDerWaalsContact O-N 3.14Å; D92-N94 WeakPolarHBondContact OD1-CB 3.08Å; D92-N94 PolarHBondContact OD1-N 3.04Å; D92-N94 PolarHBondContact OD1-ND2 2.77Å
95	M	74.4	Confident	69.3	Low	153 Å²	153	94.3 Å²	94.3	75%	0.754	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-96.4	0.6	177.3	-61.4	-62.3	-64	0	0	112.3	D92 P93	D92-M95 HydrophobicContact CB-CB 4.44Å; D92-M95 HydrophobicContact CB-CG 4Å; D92-M95 PolarHBondContact O-N 2.83Å; P93-M95 PolarHBondContact O-N 3.32Å
96	M	79.7	Confident	72.2	Confident	34 Å²	34	92 Å²	92	17%	0.167	49%	0.487	C	S	.	.	S	Bend	trans	-78.3	136.3	179.8	-70.2	179.4	46.2	0	0	111.1	P93 S98 Y725 V726 L729	P93-M96 WeakPolarHBondContact O-CB 3.15Å; P93-M96 PolarHBondContact O-N 3.25Å; P93-M96 VanDerWaalsContact O-N 3.15Å; M96-S98 PolarHBondContact O-N 2.92Å; M96-S98 VanDerWaalsContact O-N 3.16Å; M96-Y725 HydrophobicContact CE-CD1 3.37Å; M96-Y725 HydrophobicContact CE-CE1 3.4Å; M96-Y725 VanDerWaalsContact CE-CE1 3.4Å; M96-Y725 HydrophobicContact CE-CG 4.12Å; M96-V726 HydrophobicContact CE-CG2 3.74Å; M96-V726 HydrophobicContact SD-CG2 3.82Å; M96-L729 HydrophobicContact CE-CD1 3.61Å; M96-L729 HydrophobicContact CG-CD1 4.26Å; M96-L729 HydrophobicContact SD-CD1 4.22Å
97	P	84.8	Confident	75	Confident	26 Å²	26	92.8 Å²	92.8	17%	0.169	47%	0.467	C	S	.	.	P	Polyproline II helix	trans	-60.4	120.3	174.2	-23.5	34.1	0	0	0	111.1	L619 K624 L625 Y725	P97-L619 HydrophobicContact CG-CD1 4.02Å; P97-K624 HydrophobicContact CB-CB 4.06Å; P97-K624 HydrophobicContact CB-CD 4.18Å; P97-K624 HydrophobicContact CB-CG 3.88Å; P97-K624 HydrophobicContact CG-CB 3.88Å; P97-K624 HydrophobicContact CG-CD 4.49Å; P97-K624 HydrophobicContact CG-CG 4.24Å; P97-K624 WeakPolarHBondContact CG-O 3.49Å; P97-L625 HydrophobicContact CB-CD2 3.93Å; P97-Y725 PolarHBondContact O-OH 3.19Å
98	S	88.1	Confident	77.9	Confident	42 Å²	42	97.1 Å²	97.1	29%	0.294	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-95.6	129.1	173.6	171.9	0	0	0	0	110.4	M96 I100 Q101 V102	M96-S98 PolarHBondContact O-N 2.92Å; M96-S98 VanDerWaalsContact O-N 3.16Å; S98-I100 VanDerWaalsContact C-N 3.29Å; S98-I100 PolarHBondContact O-N 2.97Å; S98-I100 PolarHBondContact OG-N 3.2Å; S98-Q101 PolarHBondContact O-N 3.01Å; S98-Q101 PolarHBondContact OG-N 2.95Å; S98-V102 WeakPolarHBondContact O-CG2 3.07Å; S98-V102 PolarHBondContact O-N 3.25Å; S98-V102 VanDerWaalsContact O-N 3.09Å
99	L	88.7	Confident	80.6	Confident	54 Å²	54	92 Å²	92	28%	0.283	46%	0.459	S	S	.	.	H	α-helix	trans	-57.9	-44	174.3	173.8	63.3	0	0	0	111.1	Q101 V102 V103 F577 L625 L628 F629	L99-Q101 VanDerWaalsContact C-N 3.35Å; L99-Q101 PolarHBondContact O-N 2.83Å; L99-V102 PolarHBondContact O-N 2.87Å; L99-V103 HydrophobicContact CD1-CG2 3.95Å; L99-V103 HydrophobicContact CG-CG2 4.41Å; L99-V103 VanDerWaalsContact O-CG2 3.3Å; L99-V103 WeakPolarHBondContact O-CG2 3.19Å; L99-V103 PolarHBondContact O-N 3.48Å; L99-F577 HydrophobicContact CD1-CZ 4.09Å; L99-L625 HydrophobicContact CB-CD1 4.43Å; L99-L625 HydrophobicContact CB-CD2 4.36Å; L99-L625 HydrophobicContact CD1-CD1 3.62Å; L99-L628 HydrophobicContact CB-CD2 3.95Å; L99-F629 HydrophobicContact CD1-CE1 3.96Å; L99-F629 HydrophobicContact CD1-CZ 3.82Å; L99-F629 HydrophobicContact CD2-CE1 4.33Å
100	I	88.6	Confident	82.8	Confident	89 Å²	89	85.9 Å²	85.9	46%	0.456	43%	0.43	S	S	.	.	H	α-helix	trans	-60.6	-47.7	-178.6	-60.8	174.2	0	0	0	109.9	S98 V102 V103 E104	S98-I100 VanDerWaalsContact C-N 3.29Å; S98-I100 PolarHBondContact O-N 2.97Å; S98-I100 PolarHBondContact OG-N 3.2Å; I100-V102 PolarHBondContact O-N 2.82Å; I100-V103 PolarHBondContact O-N 3.49Å; I100-E104 HydrophobicContact CG2-CG 4.35Å; I100-E104 WeakPolarHBondContact O-CB 3.41Å; I100-E104 WeakPolarHBondContact O-CG 3.35Å; I100-E104 PolarHBondContact O-N 3.11Å
101	Q	89.5	Confident	84.6	Confident	106 Å²	106	76.5 Å²	76.5	50%	0.495	41%	0.407	S	S	.	.	H	α-helix	trans	-61.4	-44.1	179.2	-174.2	177.2	-0.3	0	0	111.8	S98 L99 V103 E104 D105	S98-Q101 PolarHBondContact O-N 3.01Å; S98-Q101 PolarHBondContact OG-N 2.95Å; L99-Q101 VanDerWaalsContact C-N 3.35Å; L99-Q101 PolarHBondContact O-N 2.83Å; Q101-V103 VanDerWaalsContact C-N 3.35Å; Q101-V103 PolarHBondContact O-N 3.41Å; Q101-E104 PolarHBondContact O-N 2.9Å; Q101-D105 WeakPolarHBondContact CG-OD2 3.49Å; Q101-D105 VanDerWaalsContact O-CB 3.29Å; Q101-D105 WeakPolarHBondContact O-CB 3.14Å; Q101-D105 PolarHBondContact O-N 2.96Å
102	V	89.7	Confident	86.1	Confident	22 Å²	22	74.1 Å²	74.1	13%	0.133	40%	0.401	C	S	.	.	H	α-helix	trans	-59.7	-46.1	177.6	172	0	0	0	0	112.1	S98 L99 I100 D106 L126 K624 L625	S98-V102 WeakPolarHBondContact O-CG2 3.07Å; S98-V102 PolarHBondContact O-N 3.25Å; S98-V102 VanDerWaalsContact O-N 3.09Å; L99-V102 PolarHBondContact O-N 2.87Å; I100-V102 PolarHBondContact O-N 2.82Å; V102-D106 WeakPolarHBondContact O-CB 3.34Å; V102-D106 PolarHBondContact O-N 3.1Å; V102-L126 HydrophobicContact CG1-CD1 3.78Å; V102-K624 HydrophobicContact CG2-CD 4.33Å; V102-K624 HydrophobicContact CG2-CG 4.5Å; V102-L625 HydrophobicContact CB-CD1 3.85Å; V102-L625 HydrophobicContact CG1-CD1 3.84Å; V102-L625 HydrophobicContact CG2-CD1 3.88Å; V102-L625 HydrophobicContact CG2-CD2 4.28Å; V102-L625 HydrophobicContact CG2-CG 4.12Å
103	V	89.3	Confident	87.6	Confident	15 Å²	15	74.7 Å²	74.7	9%	0.091	40%	0.403	C	S	.	.	H	α-helix	trans	-65.6	-43.6	179.8	169.7	0	0	0	0	110.7	L99 I100 Q101 R107 T128	L99-V103 HydrophobicContact CD1-CG2 3.95Å; L99-V103 HydrophobicContact CG-CG2 4.41Å; L99-V103 VanDerWaalsContact O-CG2 3.3Å; L99-V103 WeakPolarHBondContact O-CG2 3.19Å; L99-V103 PolarHBondContact O-N 3.48Å; I100-V103 PolarHBondContact O-N 3.49Å; Q101-V103 VanDerWaalsContact C-N 3.35Å; Q101-V103 PolarHBondContact O-N 3.41Å; V103-R107 HydrophobicContact CG1-CG 4.46Å; V103-R107 VanDerWaalsContact O-CB 3.31Å; V103-R107 WeakPolarHBondContact O-CB 3.31Å; V103-R107 WeakPolarHBondContact O-CG 3.46Å; V103-R107 PolarHBondContact O-N 2.86Å; V103-T128 HydrophobicContact CG1-CG2 4.43Å; V103-T128 HydrophobicContact CG2-CG2 4.06Å
104	E	91.4	Very high	89.2	Confident	86 Å²	86	71.1 Å²	71.1	40%	0.402	38%	0.379	S	S	.	.	H	α-helix	trans	-66.6	-41.6	178.4	-75.6	-173.9	-170.9	0	0	113.1	I100 Q101 R107 K108	I100-E104 HydrophobicContact CG2-CG 4.35Å; I100-E104 WeakPolarHBondContact O-CB 3.41Å; I100-E104 WeakPolarHBondContact O-CG 3.35Å; I100-E104 PolarHBondContact O-N 3.11Å; Q101-E104 PolarHBondContact O-N 2.9Å; E104-R107 PolarHBondContact O-N 3Å; E104-K108 WeakPolarHBondContact O-CB 3.48Å; E104-K108 VanDerWaalsContact O-CG 3.25Å; E104-K108 WeakPolarHBondContact O-CG 3.49Å; E104-K108 PolarHBondContact O-N 3.28Å; E104-K108 IonicContact OE2-NZ 2.62Å
105	D	93.2	Very high	90.7	Very high	70 Å²	70	68.6 Å²	68.6	37%	0.374	36%	0.362	S	S	.	.	H	α-helix	trans	-66.1	-43.4	179.4	-70.5	-15.7	0	0	0	110.5	Q101 K108 A109	Q101-D105 WeakPolarHBondContact CG-OD2 3.49Å; Q101-D105 VanDerWaalsContact O-CB 3.29Å; Q101-D105 WeakPolarHBondContact O-CB 3.14Å; Q101-D105 PolarHBondContact O-N 2.96Å; D105-K108 PolarHBondContact O-N 2.93Å; D105-A109 VanDerWaalsContact O-CB 3.29Å; D105-A109 WeakPolarHBondContact O-CB 3.48Å; D105-A109 PolarHBondContact O-N 3.42Å
106	D	92.3	Very high	91.8	Very high	26 Å²	26	61.4 Å²	61.4	14%	0.139	33%	0.327	C	S	.	.	H	α-helix	trans	-65	-42.1	174.8	-168.5	76.6	0	0	0	111.8	V102 K108 A109 R110 L126 T129	V102-D106 WeakPolarHBondContact O-CB 3.34Å; V102-D106 PolarHBondContact O-N 3.1Å; D106-K108 PolarHBondContact O-N 3.2Å; D106-A109 PolarHBondContact O-N 3.08Å; D106-R110 WeakPolarHBondContact O-CA 3.24Å; D106-R110 VanDerWaalsContact O-CB 3.32Å; D106-R110 WeakPolarHBondContact O-CB 3.33Å; D106-R110 PolarHBondContact O-N 3.07Å; D106-R110 WeakPolarHBondContact OD1-CD 3.4Å; D106-L126 HydrophobicContact CB-CB 4.5Å; D106-L126 HydrophobicContact CB-CD1 3.63Å; D106-L126 HydrophobicContact CB-CG 3.94Å; D106-L126 VanDerWaalsContact CG-CG 3.49Å; D106-L126 WeakPolarHBondContact OD2-CB 3.46Å; D106-L126 WeakPolarHBondContact OD2-CG 3.32Å; D106-L126 PolarHBondContact OD2-N 2.64Å; D106-T129 WeakPolarHBondContact OD2-CB 3.12Å; D106-T129 PolarHBondContact OD2-OG1 3.32Å
107	R	92.6	Very high	92.6	Very high	124 Å²	124	60 Å²	60	47%	0.468	32%	0.321	S	S	.	.	H	α-helix	trans	-58.5	-44.8	175.1	-80.1	171.9	176	-179.9	-2.1	112.6	V103 E104 G111 T128 T129	V103-R107 HydrophobicContact CG1-CG 4.46Å; V103-R107 VanDerWaalsContact O-CB 3.31Å; V103-R107 WeakPolarHBondContact O-CB 3.31Å; V103-R107 WeakPolarHBondContact O-CG 3.46Å; V103-R107 PolarHBondContact O-N 2.86Å; E104-R107 PolarHBondContact O-N 3Å; R107-G111 PolarHBondContact O-N 3.05Å; R107-G111 VanDerWaalsContact O-N 3.17Å; R107-T128 VanDerWaalsContact CZ-O 3.27Å; R107-T128 PolarHBondContact NE-O 2.92Å; R107-T128 PolarHBondContact NH2-O 3.05Å; R107-T129 HydrophobicContact CG-CG2 4.28Å
108	K	95.1	Very high	93	Very high	155 Å²	155	63.6 Å²	63.6	67%	0.674	33%	0.334	S	S	*	.	H	α-helix	trans	-66.4	-39.3	178.5	-72.9	166.9	-168.3	157.5	0	111.7	E104 D105 D106	E104-K108 WeakPolarHBondContact O-CB 3.48Å; E104-K108 VanDerWaalsContact O-CG 3.25Å; E104-K108 WeakPolarHBondContact O-CG 3.49Å; E104-K108 PolarHBondContact O-N 3.28Å; E104-K108 IonicContact OE2-NZ 2.62Å; D105-K108 PolarHBondContact O-N 2.93Å; D106-K108 PolarHBondContact O-N 3.2Å
109	A	96	Very high	93.3	Very high	85 Å²	85	65 Å²	65	70%	0.702	34%	0.339	S	S	*	.	H	α-helix	trans	-85.2	-29.9	-174.3	0	0	0	0	0	113.9	D105 D106	D105-A109 VanDerWaalsContact O-CB 3.29Å; D105-A109 WeakPolarHBondContact O-CB 3.48Å; D105-A109 PolarHBondContact O-N 3.42Å; D106-A109 PolarHBondContact O-N 3.08Å
110	R	94.9	Very high	93.6	Very high	81 Å²	81	65.7 Å²	65.7	31%	0.306	34%	0.34	S	S	.	.	H	α-helix	trans	-133.2	7.5	-163.6	-50.7	-161.2	67.5	-164.6	-7.3	115.3	D106 Q123 P124 P125	D106-R110 WeakPolarHBondContact O-CA 3.24Å; D106-R110 VanDerWaalsContact O-CB 3.32Å; D106-R110 WeakPolarHBondContact O-CB 3.33Å; D106-R110 PolarHBondContact O-N 3.07Å; D106-R110 WeakPolarHBondContact OD1-CD 3.4Å; R110-Q123 PolarHBondContact NH1-O 2.67Å; R110-Q123 PolarHBondContact NH2-O 3.47Å; R110-P124 VanDerWaalsContact NH1-C 3.28Å; R110-P124 PolarHBondContact NH1-O 3.04Å; R110-P125 HydrophobicContact CB-CB 4.01Å; R110-P125 HydrophobicContact CB-CG 4.11Å; R110-P125 WeakPolarHBondContact O-CG 3.41Å
111	G	92.3	Very high	94	Very high	41 Å²	41	61.9 Å²	61.9	42%	0.423	32%	0.322	S	S	.	.			trans	-68.6	152.5	171.3	0	0	0	0	0	112.7	R107 E130	R107-G111 PolarHBondContact O-N 3.05Å; R107-G111 VanDerWaalsContact O-N 3.17Å; G111-E130 WeakPolarHBondContact CA-O 3.4Å
112	G	93.9	Very high	94.4	Very high	26 Å²	26	61.9 Å²	61.9	27%	0.268	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	97.6	-137.5	177.9	0	0	0	0	0	114.3	F114 E130 F131 F132	G112-F114 PolarHBondContact O-N 3.36Å; G112-E130 PolarHBondContact N-O 2.71Å; G112-E130 VanDerWaalsContact N-O 3.13Å; G112-F131 CarbonylContact O-C 3.49Å; G112-F131 WeakPolarHBondContact O-CA 3.46Å; G112-F131 WeakPolarHBondContact O-CB 3.43Å; G112-F132 PolarHBondContact O-N 2.96Å
113	L	96.3	Very high	94.6	Very high	97 Å²	97	64 Å²	64	51%	0.508	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	125.2	-176.3	176.3	63.3	0	0	0	111	F132 E134	L113-F132 WeakPolarHBondContact CA-O 3.42Å; L113-F132 HydrophobicContact CB-CD2 4.31Å; L113-F132 HydrophobicContact CB-CE2 3.59Å; L113-F132 HydrophobicContact CB-CZ 3.79Å; L113-F132 HydrophobicContact CD1-CD2 3.82Å; L113-F132 HydrophobicContact CD1-CE2 3.6Å; L113-F132 HydrophobicContact CG-CE2 4.15Å; L113-E134 HydrophobicContact CD1-CB 3.78Å
114	F	97	Very high	94.9	Very high	16 Å²	16	63.6 Å²	63.6	7%	0.07	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	125	170.8	173.7	-109.5	0	0	0	110.6	G112 T116 E122 P124 P125 F131 F132 A133 E134 P141	G112-F114 PolarHBondContact O-N 3.36Å; F114-T116 HydrophobicContact CD1-CG2 4.42Å; F114-T116 HydrophobicContact CE1-CG2 4.15Å; F114-E122 HydrophobicContact CE2-CB 3.97Å; F114-E122 HydrophobicContact CZ-CB 3.92Å; F114-P124 HydrophobicContact CE1-CB 4.16Å; F114-P124 HydrophobicContact CZ-CB 4.04Å; F114-P125 HydrophobicContact CB-CG 4.39Å; F114-P125 HydrophobicContact CD2-CG 4.19Å; F114-P125 HydrophobicContact CG-CG 4.36Å; F114-F131 HydrophobicContact CB-CB 4.48Å; F114-F131 HydrophobicContact CB-CD2 3.92Å; F114-F131 HydrophobicContact CB-CG 4.42Å; F114-F132 PolarHBondContact N-O 3.4Å; F114-A133 HydrophobicContact CD1-CB 4.08Å; F114-A133 CarbonylContact O-C 3.6Å; F114-A133 WeakPolarHBondContact O-CA 3.47Å; F114-E134 PolarHBondContact O-N 3.46Å; F114-P141 HydrophobicContact CD1-CG 3.93Å; F114-P141 HydrophobicContact CE1-CG 3.76Å
115	Q	97.3	Very high	95.1	Very high	93 Å²	93	59.6 Å²	59.6	44%	0.435	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	126.9	175.3	-69	-173.3	-40.7	0	0	109.5	G117 E134 Q136	Q115-G117 VanDerWaalsContact C-N 3.25Å; Q115-G117 PolarHBondContact O-N 2.97Å; Q115-E134 PolarHBondContact NE2-OE2 2.65Å; Q115-Q136 VanDerWaalsContact CD-NE2 3.29Å; Q115-Q136 VanDerWaalsContact NE2-NE2 3.11Å
116	T	97.3	Very high	95	Very high	2 Å²	2	57.7 Å²	57.7	1%	0.012	30%	0.299	C	S	.	.			trans	-72.5	-17.6	-172.2	62	0	0	0	0	114.1	F114 A121 E122 A133 E134 Q136 N138	F114-T116 HydrophobicContact CD1-CG2 4.42Å; F114-T116 HydrophobicContact CE1-CG2 4.15Å; T116-A121 VanDerWaalsContact O-CA 3.32Å; T116-A121 WeakPolarHBondContact O-CA 3.23Å; T116-E122 PolarHBondContact O-N 3.37Å; T116-A133 HydrophobicContact CG2-CB 4.17Å; T116-E134 PolarHBondContact N-O 3.48Å; T116-E134 VanDerWaalsContact N-O 3.13Å; T116-E134 PolarHBondContact OG1-O 3.38Å; T116-Q136 PolarHBondContact OG1-N 3.08Å; T116-N138 WeakPolarHBondContact CB-O 3.43Å; T116-N138 WeakPolarHBondContact CG2-O 3.44Å; T116-N138 PolarHBondContact OG1-O 3.44Å
117	G	96	Very high	94.8	Very high	4 Å²	4	57.9 Å²	57.9	4%	0.041	30%	0.302	C	S	.	.			trans	85.5	157.4	176.4	0	0	0	0	0	114.7	Q115 H120 N138	Q115-G117 VanDerWaalsContact C-N 3.25Å; Q115-G117 PolarHBondContact O-N 2.97Å; G117-H120 CarbonylContact C-O 3.59Å; G117-H120 VanDerWaalsContact C-O 3.3Å; G117-N138 PolarHBondContact O-ND2 2.86Å
118	F	94.4	Very high	94.5	Very high	102 Å²	102	53.8 Å²	53.8	45%	0.447	29%	0.291	S	S	.	.	S	Bend	trans	-156.3	138.5	173.7	-170.9	-90.8	0	0	0	109	H120 Q136 P204 F205	F118-H120 PolarHBondContact N-O 3.06Å; F118-Q136 WeakPolarHBondContact CB-O 3.49Å; F118-P204 HydrophobicContact CE2-CB 3.99Å; F118-F205 HydrophobicContact CD2-CE1 4.1Å; F118-F205 AromaticContact CE2-CD1 3.93Å; F118-F205 HydrophobicContact CE2-CD1 3.93Å; F118-F205 AromaticContact CE2-CE1 3.83Å; F118-F205 HydrophobicContact CE2-CE1 3.83Å
119	D	92.7	Very high	94.2	Very high	72 Å²	72	46.6 Å²	46.6	39%	0.385	26%	0.26	S	S	.	.	S	Bend	cis	-86.6	0.4	8.5	69.6	-13.6	0	0	0	115.1	N536 S560	D119-N536 PolarHBondContact OD1-ND2 3.43Å; D119-N536 PolarHBondContact OD2-ND2 3.16Å; D119-S560 WeakPolarHBondContact O-CB 3.24Å; D119-S560 PolarHBondContact O-OG 3.41Å
120	H	96	Very high	94	Very high	67 Å²	67	50.1 Å²	50.1	31%	0.31	26%	0.262	S	S	.	.	S	Bend	trans	-129.4	159.7	173.9	57.1	-80.3	0	0	0	110.3	G117 F118 N138 S560 A562	G117-H120 CarbonylContact C-O 3.59Å; G117-H120 VanDerWaalsContact C-O 3.3Å; F118-H120 PolarHBondContact N-O 3.06Å; H120-N138 PolarHBondContact O-ND2 2.87Å; H120-S560 CarbonylContact C-O 3.51Å; H120-S560 WeakPolarHBondContact CA-O 3.37Å; H120-A562 HydrophobicContact CB-CB 4.35Å
121	A	97.7	Very high	93.9	Very high	9 Å²	9	47.1 Å²	47.1	7%	0.074	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-74.8	135.3	-174.6	0	0	0	0	0	111.2	T116 N138 Y149 L559 S560 L561	T116-A121 VanDerWaalsContact O-CA 3.32Å; T116-A121 WeakPolarHBondContact O-CA 3.23Å; A121-N138 HydrophobicContact CB-CB 4.12Å; A121-N138 PolarHBondContact N-ND2 3.04Å; A121-Y149 HydrophobicContact CB-CD1 4.09Å; A121-Y149 HydrophobicContact CB-CE1 4.15Å; A121-L559 HydrophobicContact CB-CD1 3.56Å; A121-S560 WeakPolarHBondContact CB-O 3.35Å; A121-S560 PolarHBondContact N-O 3.28Å; A121-L561 HydrophobicContact CB-CD2 4.25Å
122	E	96.5	Very high	94	Very high	106 Å²	106	48.4 Å²	48.4	50%	0.495	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-69.8	147.3	165.8	-71.3	-63.8	160	0	0	110	F114 T116	F114-E122 HydrophobicContact CE2-CB 3.97Å; F114-E122 HydrophobicContact CZ-CB 3.92Å; T116-E122 PolarHBondContact O-N 3.37Å
123	Q	95.5	Very high	94.1	Very high	67 Å²	67	47.7 Å²	47.7	31%	0.313	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-65.8	124.2	174.6	-176.1	176	16.5	0	0	108.8	R110 Y149 R572 A574	R110-Q123 PolarHBondContact NH1-O 2.67Å; R110-Q123 PolarHBondContact NH2-O 3.47Å; Q123-Y149 HydrophobicContact CB-CG 4.41Å; Q123-Y149 HydrophobicContact CG-CD2 4.34Å; Q123-R572 PolarHBondContact NE2-O 3.35Å; Q123-R572 PolarHBondContact OE1-O 3.49Å; Q123-A574 PolarHBondContact NE2-O 3.33Å
124	P	95.8	Very high	94.1	Very high	7 Å²	7	47.5 Å²	47.5	5%	0.045	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-74.7	162.8	-175.3	33.2	-39.6	0	0	0	112.3	R110 F114 P141 Y149	R110-P124 VanDerWaalsContact NH1-C 3.28Å; R110-P124 PolarHBondContact NH1-O 3.04Å; F114-P124 HydrophobicContact CE1-CB 4.16Å; F114-P124 HydrophobicContact CZ-CB 4.04Å; P124-P141 HydrophobicContact CB-CB 3.62Å; P124-P141 HydrophobicContact CB-CG 3.79Å; P124-P141 HydrophobicContact CG-CB 4.07Å; P124-Y149 VanDerWaalsContact CD-CE1 3.46Å; P124-Y149 WeakPolarHBondContact CD-OH 3.49Å; P124-Y149 HydrophobicContact CG-CE1 4.31Å; P124-Y149 HydrophobicContact CG-CE2 3.85Å; P124-Y149 WeakPolarHBondContact CG-OH 3.35Å
125	P	94.9	Very high	94.1	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.013	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-57.6	162.9	165.4	-20.7	33.1	0	0	0	111.4	R110 F114 T129 F131 R145	R110-P125 HydrophobicContact CB-CB 4.01Å; R110-P125 HydrophobicContact CB-CG 4.11Å; R110-P125 WeakPolarHBondContact O-CG 3.41Å; F114-P125 HydrophobicContact CB-CG 4.39Å; F114-P125 HydrophobicContact CD2-CG 4.19Å; F114-P125 HydrophobicContact CG-CG 4.36Å; P125-T129 HydrophobicContact CB-CG2 3.93Å; P125-F131 HydrophobicContact CB-CD1 3.94Å; P125-F131 HydrophobicContact CB-CE1 4.48Å; P125-F131 HydrophobicContact CG-CB 4.23Å; P125-F131 HydrophobicContact CG-CD1 3.93Å; P125-F131 HydrophobicContact CG-CG 4.04Å; P125-R145 PolarHBondContact O-NH1 2.69Å; P125-R145 PolarHBondContact O-NH2 2.98Å
126	L	91.6	Very high	94	Very high	30 Å²	30	47.5 Å²	47.5	16%	0.157	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-59.3	152.9	172.8	-62.6	-179.1	0	0	0	110.4	V102 D106 T128 T129 F577	V102-L126 HydrophobicContact CG1-CD1 3.78Å; D106-L126 HydrophobicContact CB-CB 4.5Å; D106-L126 HydrophobicContact CB-CD1 3.63Å; D106-L126 HydrophobicContact CB-CG 3.94Å; D106-L126 VanDerWaalsContact CG-CG 3.49Å; D106-L126 WeakPolarHBondContact OD2-CB 3.46Å; D106-L126 WeakPolarHBondContact OD2-CG 3.32Å; D106-L126 PolarHBondContact OD2-N 2.64Å; L126-T128 PolarHBondContact O-N 3.3Å; L126-T129 WeakPolarHBondContact O-CB 3.38Å; L126-T129 PolarHBondContact O-N 3.16Å; L126-F577 HydrophobicContact CD1-CE2 3.95Å; L126-F577 HydrophobicContact CD1-CZ 4.37Å; L126-F577 HydrophobicContact CD2-CD2 3.76Å; L126-F577 HydrophobicContact CD2-CE2 3.75Å; L126-F577 HydrophobicContact CG-CE2 4.32Å
127	C	86.9	Confident	93.9	Very high	30 Å²	30	47.4 Å²	47.4	20%	0.203	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-16.9	177	55.8	0	0	0	0	114.2	T129 F577 N663	C127-T129 VanDerWaalsContact C-N 3.27Å; C127-F577 WeakPolarHBondContact SG-CD1 3.13Å; C127-N663 WeakPolarHBondContact CB-ND2 3.44Å; C127-N663 WeakPolarHBondContact CB-OD1 3.02Å; C127-N663 PolarHBondContact SG-OD1 2.9Å
128	T	86.3	Confident	94	Very high	38 Å²	38	47.2 Å²	47.2	23%	0.233	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-8	173.9	52.4	0	0	0	0	113.1	V103 R107 L126 F577	V103-T128 HydrophobicContact CG1-CG2 4.43Å; V103-T128 HydrophobicContact CG2-CG2 4.06Å; R107-T128 VanDerWaalsContact CZ-O 3.27Å; R107-T128 PolarHBondContact NE-O 2.92Å; R107-T128 PolarHBondContact NH2-O 3.05Å; L126-T128 PolarHBondContact O-N 3.3Å; T128-F577 HydrophobicContact CG2-CE1 3.98Å; T128-F577 HydrophobicContact CG2-CZ 4.47Å
129	T	89.9	Confident	94.2	Very high	4 Å²	4	42.6 Å²	42.6	3%	0.025	21%	0.213	C	C	.	.	S	Bend	trans	-96.5	127.2	-177.3	-63.6	0	0	0	0	109.3	D106 R107 P125 L126 C127 F131	D106-T129 WeakPolarHBondContact OD2-CB 3.12Å; D106-T129 PolarHBondContact OD2-OG1 3.32Å; R107-T129 HydrophobicContact CG-CG2 4.28Å; P125-T129 HydrophobicContact CB-CG2 3.93Å; L126-T129 WeakPolarHBondContact O-CB 3.38Å; L126-T129 PolarHBondContact O-N 3.16Å; C127-T129 VanDerWaalsContact C-N 3.27Å; T129-F131 VanDerWaalsContact O-CD1 3.24Å; T129-F131 WeakPolarHBondContact O-CD1 3.29Å; T129-F131 PolarHBondContact O-N 2.88Å
130	E	90.6	Very high	94.4	Very high	159 Å²	159	39.6 Å²	39.6	74%	0.743	20%	0.197	S	C	*	.			trans	-73.7	118.5	175.6	-68	-60.2	143.3	0	0	109.8	G111 G112	G111-E130 WeakPolarHBondContact CA-O 3.4Å; G112-E130 PolarHBondContact N-O 2.71Å; G112-E130 VanDerWaalsContact N-O 3.13Å
131	F	93	Very high	94.4	Very high	17 Å²	17	36.7 Å²	36.7	8%	0.075	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	159.8	177.5	72	-92.2	0	0	0	111.2	G112 F114 P125 T129 A133 P141 K142	G112-F131 CarbonylContact O-C 3.49Å; G112-F131 WeakPolarHBondContact O-CA 3.46Å; G112-F131 WeakPolarHBondContact O-CB 3.43Å; F114-F131 HydrophobicContact CB-CB 4.48Å; F114-F131 HydrophobicContact CB-CD2 3.92Å; F114-F131 HydrophobicContact CB-CG 4.42Å; P125-F131 HydrophobicContact CB-CD1 3.94Å; P125-F131 HydrophobicContact CB-CE1 4.48Å; P125-F131 HydrophobicContact CG-CB 4.23Å; P125-F131 HydrophobicContact CG-CD1 3.93Å; P125-F131 HydrophobicContact CG-CG 4.04Å; T129-F131 VanDerWaalsContact O-CD1 3.24Å; T129-F131 WeakPolarHBondContact O-CD1 3.29Å; T129-F131 PolarHBondContact O-N 2.88Å; F131-A133 HydrophobicContact CD2-CB 4.46Å; F131-A133 HydrophobicContact CE2-CB 4.28Å; F131-P141 HydrophobicContact CE2-CG 3.67Å; F131-P141 HydrophobicContact CZ-CG 3.71Å; F131-K142 HydrophobicContact CE2-CG 4.42Å; F131-K142 HydrophobicContact CZ-CG 4.2Å; F131-K142 PolarHBondContact O-NZ 3.33Å
132	F	94.9	Very high	94.2	Very high	68 Å²	68	38.6 Å²	38.6	30%	0.298	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	132.8	167.8	55	-89.4	0	0	0	108.6	G112 L113 F114 S176 E178 E179	G112-F132 PolarHBondContact O-N 2.96Å; L113-F132 WeakPolarHBondContact CA-O 3.42Å; L113-F132 HydrophobicContact CB-CD2 4.31Å; L113-F132 HydrophobicContact CB-CE2 3.59Å; L113-F132 HydrophobicContact CB-CZ 3.79Å; L113-F132 HydrophobicContact CD1-CD2 3.82Å; L113-F132 HydrophobicContact CD1-CE2 3.6Å; L113-F132 HydrophobicContact CG-CE2 4.15Å; F114-F132 PolarHBondContact N-O 3.4Å; F132-S176 WeakPolarHBondContact CB-OG 3.12Å; F132-E178 HydrophobicContact CB-CB 4.16Å; F132-E178 HydrophobicContact CD1-CB 4.42Å; F132-E178 HydrophobicContact CD1-CG 4.43Å; F132-E178 HydrophobicContact CD2-CB 4.11Å; F132-E178 HydrophobicContact CG-CB 4Å; F132-E178 HydrophobicContact CG-CG 4.5Å; F132-E179 HydrophobicContact CB-CG 3.76Å
133	A	95.7	Very high	94.2	Very high	12 Å²	12	33.8 Å²	33.8	10%	0.099	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	137.8	-174.4	0	0	0	0	0	112.4	F114 T116 F131 N140 E179	F114-A133 HydrophobicContact CD1-CB 4.08Å; F114-A133 CarbonylContact O-C 3.6Å; F114-A133 WeakPolarHBondContact O-CA 3.47Å; T116-A133 HydrophobicContact CG2-CB 4.17Å; F131-A133 HydrophobicContact CD2-CB 4.46Å; F131-A133 HydrophobicContact CE2-CB 4.28Å; A133-N140 HydrophobicContact CB-CB 4.31Å; A133-E179 PolarHBondContact N-OE1 3.04Å
134	E	96.4	Very high	94.3	Very high	92 Å²	92	30.7 Å²	30.7	43%	0.43	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	114.9	165.7	179.3	177.2	-137.9	0	0	108.9	L113 F114 Q115 T116 Q136	L113-E134 HydrophobicContact CD1-CB 3.78Å; F114-E134 PolarHBondContact O-N 3.46Å; Q115-E134 PolarHBondContact NE2-OE2 2.65Å; T116-E134 PolarHBondContact N-O 3.48Å; T116-E134 VanDerWaalsContact N-O 3.13Å; T116-E134 PolarHBondContact OG1-O 3.38Å; E134-Q136 HydrophobicContact CG-CG 4.45Å; E134-Q136 PolarHBondContact O-N 3.09Å
135	D	96.6	Very high	94.3	Very high	38 Å²	38	30.8 Å²	30.8	20%	0.203	15%	0.153	C	C	.	.			trans	-73.9	114.5	179.1	-171	-31.5	0	0	0	110.3	G137 N138 L251 G252 S253	D135-G137 PolarHBondContact OD1-N 3.3Å; D135-N138 VanDerWaalsContact OD1-O 3.1Å; D135-L251 HydrophobicContact CB-CD2 4.22Å; D135-G252 VanDerWaalsContact CG-N 3.25Å; D135-G252 PolarHBondContact OD1-N 3.13Å; D135-G252 WeakPolarHBondContact OD2-CA 3.48Å; D135-G252 PolarHBondContact OD2-N 3.18Å; D135-S253 PolarHBondContact OD2-N 2.96Å
136	Q	95.2	Very high	94.4	Very high	71 Å²	71	30.7 Å²	30.7	33%	0.332	15%	0.152	S	C	.	.	S	Bend	trans	-109	13.3	178.8	-64.9	-176.9	-31.4	0	0	113.2	Q115 T116 F118 E134	Q115-Q136 VanDerWaalsContact CD-NE2 3.29Å; Q115-Q136 VanDerWaalsContact NE2-NE2 3.11Å; T116-Q136 PolarHBondContact OG1-N 3.08Å; F118-Q136 WeakPolarHBondContact CB-O 3.49Å; E134-Q136 HydrophobicContact CG-CG 4.45Å; E134-Q136 PolarHBondContact O-N 3.09Å
137	G	96	Very high	94.7	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.145	C	C	.	.	S	Bend	trans	125.7	-22.3	-178.5	0	0	0	0	0	113.5	D135 F205 H250 G252	D135-G137 PolarHBondContact OD1-N 3.3Å; G137-F205 WeakPolarHBondContact O-CZ 3.46Å; G137-H250 WeakPolarHBondContact CA-O 3.49Å; G137-H250 PolarHBondContact N-O 2.76Å; G137-G252 WeakPolarHBondContact O-CA 3.37Å; G137-G252 PolarHBondContact O-N 2.88Å
138	N	98.4	Very high	95.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.135	C	C	.	.	S	Bend	trans	-97.1	141.2	165.3	-78.4	-75.5	0	0	0	110.6	T116 G117 H120 A121 D135 F205 L559 S560	T116-N138 WeakPolarHBondContact CB-O 3.43Å; T116-N138 WeakPolarHBondContact CG2-O 3.44Å; T116-N138 PolarHBondContact OG1-O 3.44Å; G117-N138 PolarHBondContact O-ND2 2.86Å; H120-N138 PolarHBondContact O-ND2 2.87Å; A121-N138 HydrophobicContact CB-CB 4.12Å; A121-N138 PolarHBondContact N-ND2 3.04Å; D135-N138 VanDerWaalsContact OD1-O 3.1Å; N138-F205 WeakPolarHBondContact OD1-CZ 3.22Å; N138-L559 WeakPolarHBondContact OD1-CA 3.34Å; N138-S560 PolarHBondContact OD1-N 3.43Å
139	C	98	Very high	95.7	Very high	5 Å²	5	26.4 Å²	26.4	3%	0.034	13%	0.126	C	C	.	.	P	Polyproline II helix	trans	-62.4	153.7	-178.2	61.9	0	0	0	0	112.8	S253 H557 N558	C139-S253 WeakPolarHBondContact CA-OG 3.42Å; C139-S253 WeakPolarHBondContact CB-OG 3.34Å; C139-H557 HydrophobicContact CB-CB 3.94Å; C139-N558 WeakPolarHBondContact CB-O 3.29Å; C139-N558 PolarHBondContact N-O 3.16Å; C139-N558 PolarHBondContact SG-O 3.45Å
140	N	96.8	Very high	96	Very high	9 Å²	9	28.1 Å²	28.1	5%	0.048	14%	0.135	C	C	.	.	P	Polyproline II helix	trans	-58.5	131	174.7	-174.1	-30.7	0	0	0	110.4	A133 K142 F143 V144 E179	A133-N140 HydrophobicContact CB-CB 4.31Å; N140-K142 PolarHBondContact O-N 3.02Å; N140-K142 WeakPolarHBondContact OD1-CB 3.44Å; N140-K142 WeakPolarHBondContact OD1-CG 3.2Å; N140-K142 PolarHBondContact OD1-N 2.9Å; N140-F143 HydrophobicContact CB-CD2 3.74Å; N140-F143 HydrophobicContact CB-CE2 3.96Å; N140-F143 PolarHBondContact O-N 3.35Å; N140-V144 PolarHBondContact O-N 3.18Å; N140-E179 PolarHBondContact ND2-OE1 3.29Å
141	P	95.6	Very high	96.4	Very high	6 Å²	6	20.5 Å²	20.5	4%	0.039	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-10.5	178.2	27.3	-37.9	0	0	0	114.3	F114 P124 F131 F143 V144 R145	F114-P141 HydrophobicContact CD1-CG 3.93Å; F114-P141 HydrophobicContact CE1-CG 3.76Å; P124-P141 HydrophobicContact CB-CB 3.62Å; P124-P141 HydrophobicContact CB-CG 3.79Å; P124-P141 HydrophobicContact CG-CB 4.07Å; F131-P141 HydrophobicContact CE2-CG 3.67Å; F131-P141 HydrophobicContact CZ-CG 3.71Å; P141-F143 VanDerWaalsContact C-N 3.29Å; P141-V144 WeakPolarHBondContact CA-O 3.41Å; P141-R145 HydrophobicContact CB-CG 4.29Å; P141-R145 WeakPolarHBondContact O-CG 3.28Å
142	K	94.5	Very high	96.5	Very high	49 Å²	49	19.7 Å²	19.7	21%	0.213	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-31.5	167.2	-66.3	177.2	-175.9	175.1	0	111.9	F131 N140 A173 L175 E179	F131-K142 HydrophobicContact CE2-CG 4.42Å; F131-K142 HydrophobicContact CZ-CG 4.2Å; F131-K142 PolarHBondContact O-NZ 3.33Å; N140-K142 PolarHBondContact O-N 3.02Å; N140-K142 WeakPolarHBondContact OD1-CB 3.44Å; N140-K142 WeakPolarHBondContact OD1-CG 3.2Å; N140-K142 PolarHBondContact OD1-N 2.9Å; K142-A173 HydrophobicContact CB-CB 4.05Å; K142-A173 WeakPolarHBondContact O-CB 3.34Å; K142-L175 HydrophobicContact CD-CD2 4.41Å; K142-E179 VanDerWaalsContact NZ-CD 3.27Å; K142-E179 IonicContact NZ-OE1 3.13Å; K142-E179 PolarHBondContact NZ-OE1 3.33Å; K142-E179 IonicContact NZ-OE2 3.5Å; K142-E179 PolarHBondContact NZ-OE2 3.45Å
143	F	96.2	Very high	96.6	Very high	5 Å²	5	19.4 Å²	19.4	2%	0.022	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-44.8	178.1	-58.9	-51.5	0	0	0	113.1	N140 P141 I169 T170 A173 L175 L182 H557	N140-F143 HydrophobicContact CB-CD2 3.74Å; N140-F143 HydrophobicContact CB-CE2 3.96Å; N140-F143 PolarHBondContact O-N 3.35Å; P141-F143 VanDerWaalsContact C-N 3.29Å; F143-I169 CarbonylContact O-C 3.59Å; F143-I169 WeakPolarHBondContact O-CA 3.39Å; F143-T170 PolarHBondContact O-N 3.32Å; F143-A173 HydrophobicContact CD1-CB 3.97Å; F143-A173 HydrophobicContact CE1-CB 4.23Å; F143-L175 HydrophobicContact CE1-CD2 4.27Å; F143-L175 HydrophobicContact CE2-CD2 4.07Å; F143-L175 HydrophobicContact CZ-CD1 4.11Å; F143-L175 HydrophobicContact CZ-CD2 3.61Å; F143-L175 HydrophobicContact CZ-CG 4.03Å; F143-L182 HydrophobicContact CE2-CD1 4.44Å; F143-L182 HydrophobicContact CE2-CD2 3.9Å; F143-L182 HydrophobicContact CE2-CG 4.49Å; F143-L182 HydrophobicContact CZ-CD1 4.18Å; F143-L182 HydrophobicContact CZ-CD2 4.18Å; F143-L182 HydrophobicContact CZ-CG 4.29Å; F143-H557 AromaticContact CD1-CE1 3.79Å; F143-H557 AromaticContact CD2-CE1 3.45Å; F143-H557 VanDerWaalsContact CD2-CE1 3.45Å; F143-H557 WeakPolarHBondContact CD2-CE1 3.27Å; F143-H557 AromaticContact CD2-ND1 3.59Å; F143-H557 AromaticContact CE2-CE1 3.97Å; F143-H557 AromaticContact CG-CE1 3.36Å; F143-H557 WeakPolarHBondContact CG-CE1 3.33Å; F143-H557 AromaticContact CG-ND1 3.75Å; F143-H557 AromaticContact CG-NE2 3.97Å
144	V	96.8	Very high	96.6	Very high	2 Å²	2	19.7 Å²	19.7	1%	0.012	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	121.4	-177.4	-173.5	0	0	0	0	110.2	N140 P141 L167 S168 I169 V541 H557 L559	N140-V144 PolarHBondContact O-N 3.18Å; P141-V144 WeakPolarHBondContact CA-O 3.41Å; V144-L167 HydrophobicContact CG1-CB 4.22Å; V144-L167 HydrophobicContact CG1-CD1 4.18Å; V144-L167 HydrophobicContact CG1-CD2 4.4Å; V144-S168 WeakPolarHBondContact CA-O 3.3Å; V144-I169 HydrophobicContact CG1-CG1 4.38Å; V144-I169 HydrophobicContact CG2-CG2 4.34Å; V144-V541 HydrophobicContact CG2-CG2 4.07Å; V144-H557 HydrophobicContact CG2-CB 3.91Å; V144-L559 HydrophobicContact CG1-CD2 4.06Å
145	R	96.6	Very high	96.5	Very high	9 Å²	9	17.9 Å²	17.9	3%	0.034	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	143	166.1	-66.6	-167.8	166.4	-124.7	-1.8	111.2	P125 P141 Y149 L167 S168 D575 T578	P125-R145 PolarHBondContact O-NH1 2.69Å; P125-R145 PolarHBondContact O-NH2 2.98Å; P141-R145 HydrophobicContact CB-CG 4.29Å; P141-R145 WeakPolarHBondContact O-CG 3.28Å; R145-Y149 WeakPolarHBondContact CA-OH 2.98Å; R145-L167 CarbonylContact O-C 3.53Å; R145-L167 WeakPolarHBondContact O-CA 3.41Å; R145-S168 PolarHBondContact N-O 2.81Å; R145-S168 PolarHBondContact O-N 3.41Å; R145-D575 IonicContact NH1-OD2 3.19Å; R145-D575 PolarHBondContact NH1-OD2 3.16Å; R145-T578 HydrophobicContact CB-CG2 3.88Å; R145-T578 WeakPolarHBondContact CB-OG1 3.45Å; R145-T578 WeakPolarHBondContact CD-OG1 3.27Å
146	A	97	Very high	96.4	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	148.6	169.5	0	0	0	0	0	110.7	Y149 L167 L559 L561	A146-Y149 HydrophobicContact CB-CD2 4.37Å; A146-Y149 HydrophobicContact CB-CE2 4.11Å; A146-Y149 PolarHBondContact N-OH 2.81Å; A146-Y149 VanDerWaalsContact O-CE2 3.27Å; A146-Y149 WeakPolarHBondContact O-CE2 3.2Å; A146-L167 HydrophobicContact CB-CD2 3.68Å; A146-L559 HydrophobicContact CB-CD2 4.21Å; A146-L561 HydrophobicContact CB-CD1 3.83Å; A146-L561 HydrophobicContact CB-CD2 4.33Å
147	T	96.5	Very high	96.3	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.095	C	C	.	.	S	Bend	trans	-68.3	-29.6	169.6	56.7	0	0	0	0	112.3	P164 F165 G166 A574 D575 T578 M579 I582	T147-P164 WeakPolarHBondContact CB-O 2.8Å; T147-P164 PolarHBondContact OG1-O 3.45Å; T147-F165 WeakPolarHBondContact OG1-CA 3.44Å; T147-G166 PolarHBondContact N-O 3.1Å; T147-G166 PolarHBondContact OG1-N 3.18Å; T147-G166 PolarHBondContact OG1-O 2.75Å; T147-A574 WeakPolarHBondContact O-CA 3.47Å; T147-D575 PolarHBondContact O-N 3.09Å; T147-T578 HydrophobicContact CG2-CG2 4.07Å; T147-M579 HydrophobicContact CG2-CB 4.42Å; T147-M579 HydrophobicContact CG2-CG 3.8Å; T147-M579 WeakPolarHBondContact O-CE 3.36Å; T147-I582 HydrophobicContact CG2-CD1 3.4Å
148	L	97.4	Very high	96.3	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.099	C	C	.	.	B	Isolated β-bridge	trans	-134.4	117.7	-178.2	-60.3	169.6	0	0	0	107.3	N150 P152 L158 L163 F165 L561 L570 A574 M579	L148-N150 PolarHBondContact O-N 3.3Å; L148-P152 HydrophobicContact CD1-CG 4.16Å; L148-L158 HydrophobicContact CD1-CD1 4.46Å; L148-L163 HydrophobicContact CD1-CB 4.39Å; L148-L163 HydrophobicContact CD2-CB 4.46Å; L148-L163 HydrophobicContact CD2-CD1 3.87Å; L148-F165 HydrophobicContact CB-CD2 4.04Å; L148-F165 HydrophobicContact CB-CE2 4.29Å; L148-F165 HydrophobicContact CD1-CB 4.13Å; L148-F165 HydrophobicContact CD1-CD2 3.88Å; L148-F165 HydrophobicContact CD1-CG 4.31Å; L148-F165 HydrophobicContact CG-CD2 4.28Å; L148-L561 WeakPolarHBondContact O-CD1 3.42Å; L148-L570 HydrophobicContact CD1-CD1 3.91Å; L148-L570 HydrophobicContact CD1-CG 4.48Å; L148-L570 HydrophobicContact CD2-CD1 4.34Å; L148-L570 HydrophobicContact CD2-CG 4.39Å; L148-A574 HydrophobicContact CD2-CB 4.15Å; L148-M579 HydrophobicContact CD2-CE 3.33Å; L148-M579 HydrophobicContact CG-CE 4.02Å
149	Y	97.4	Very high	96.1	Very high	8 Å²	8	25.8 Å²	25.8	3%	0.031	13%	0.128	C	C	.	.	S	Bend	trans	-80.2	-7.6	176	-80.8	-96.8	0	0	0	113	A121 Q123 P124 R145 A146 L561 S573 D575	A121-Y149 HydrophobicContact CB-CD1 4.09Å; A121-Y149 HydrophobicContact CB-CE1 4.15Å; Q123-Y149 HydrophobicContact CB-CG 4.41Å; Q123-Y149 HydrophobicContact CG-CD2 4.34Å; P124-Y149 VanDerWaalsContact CD-CE1 3.46Å; P124-Y149 WeakPolarHBondContact CD-OH 3.49Å; P124-Y149 HydrophobicContact CG-CE1 4.31Å; P124-Y149 HydrophobicContact CG-CE2 3.85Å; P124-Y149 WeakPolarHBondContact CG-OH 3.35Å; R145-Y149 WeakPolarHBondContact CA-OH 2.98Å; A146-Y149 HydrophobicContact CB-CD2 4.37Å; A146-Y149 HydrophobicContact CB-CE2 4.11Å; A146-Y149 PolarHBondContact N-OH 2.81Å; A146-Y149 VanDerWaalsContact O-CE2 3.27Å; A146-Y149 WeakPolarHBondContact O-CE2 3.2Å; Y149-L561 HydrophobicContact CD1-CD2 3.98Å; Y149-L561 HydrophobicContact CE1-CD2 4.44Å; Y149-S573 PolarHBondContact N-O 3.44Å; Y149-D575 HydrophobicContact CE2-CB 4.35Å
150	N	97.3	Very high	96	Very high	40 Å²	40	30 Å²	30	21%	0.214	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	118.7	160.6	-62.7	33.1	0	0	0	110.3	L148 A562 A564 L570 S573	L148-N150 PolarHBondContact O-N 3.3Å; N150-A562 CarbonylContact C-O 3.58Å; N150-A562 WeakPolarHBondContact CA-O 3.34Å; N150-A564 HydrophobicContact CB-CB 3.8Å; N150-L570 WeakPolarHBondContact O-CD1 3.36Å; N150-S573 WeakPolarHBondContact CB-OG 3.4Å; N150-S573 PolarHBondContact N-OG 3.14Å; N150-S573 VanDerWaalsContact OD1-CB 3.26Å; N150-S573 WeakPolarHBondContact OD1-CB 3.14Å
151	A	97.4	Very high	95.8	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	133	-178.7	0	0	0	0	0	111.2	F165 L532 A537 L561 A562 T563 A564	A151-F165 HydrophobicContact CB-CZ 3.88Å; A151-L532 HydrophobicContact CB-CD1 4.23Å; A151-A537 HydrophobicContact CB-CB 3.64Å; A151-L561 HydrophobicContact CB-CB 4.28Å; A151-A562 PolarHBondContact N-O 3.31Å; A151-T563 CarbonylContact O-C 3.18Å; A151-T563 WeakPolarHBondContact O-CA 3.24Å; A151-A564 PolarHBondContact O-N 2.99Å
152	P	97	Very high	95.7	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.149	C	C	.	.			trans	-65.4	138.9	175.3	5.9	0.5	0	0	0	110.5	L148 S154 F157 L158 F165 H528 L532 L570	L148-P152 HydrophobicContact CD1-CG 4.16Å; P152-S154 VanDerWaalsContact C-N 3.33Å; P152-S154 PolarHBondContact O-N 3.13Å; P152-F157 HydrophobicContact CB-CD1 3.74Å; P152-F157 HydrophobicContact CB-CE1 4.29Å; P152-L158 HydrophobicContact CB-CB 4.1Å; P152-L158 HydrophobicContact CG-CB 4.13Å; P152-L158 HydrophobicContact CG-CD1 3.81Å; P152-L158 HydrophobicContact CG-CD2 4.49Å; P152-L158 HydrophobicContact CG-CG 4.37Å; P152-F165 HydrophobicContact CG-CB 4.41Å; P152-F165 HydrophobicContact CG-CD1 4.18Å; P152-F165 HydrophobicContact CG-CG 4.16Å; P152-H528 PolarHBondContact O-CE1 3.08Å; P152-H528 VanDerWaalsContact O-CE1 3.32Å; P152-H528 PolarHBondContact O-NE2 3.21Å; P152-L532 WeakPolarHBondContact O-CD1 3.38Å; P152-L570 HydrophobicContact CB-CD1 4.26Å; P152-L570 HydrophobicContact CG-CD1 4.3Å
153	I	95.5	Very high	95.7	Very high	62 Å²	62	27.8 Å²	27.8	32%	0.318	14%	0.139	S	C	.	.	S	Bend	trans	-74.3	-17.1	-176.5	56.8	169	0	0	0	114.9	F157 K531 L532 T563	I153-F157 HydrophobicContact CG1-CB 4.43Å; I153-F157 HydrophobicContact CG1-CD1 4.02Å; I153-F157 HydrophobicContact CG1-CG 4.35Å; I153-K531 WeakPolarHBondContact O-CA 3.16Å; I153-L532 PolarHBondContact O-N 2.87Å; I153-T563 HydrophobicContact CG2-CG2 4.47Å
154	S	95.2	Very high	95.5	Very high	17 Å²	17	27.7 Å²	27.7	12%	0.119	14%	0.139	C	C	.	.	S	Bend	trans	-158.5	161.8	-178.5	66.5	0	0	0	0	112.3	P152 D156 F157 L158	P152-S154 VanDerWaalsContact C-N 3.33Å; P152-S154 PolarHBondContact O-N 3.13Å; S154-D156 VanDerWaalsContact C-N 3.31Å; S154-D156 PolarHBondContact O-N 2.9Å; S154-F157 PolarHBondContact O-N 2.8Å; S154-F157 WeakPolarHBondContact OG-CB 3.36Å; S154-F157 PolarHBondContact OG-N 2.8Å; S154-L158 PolarHBondContact O-N 3.09Å; S154-L158 VanDerWaalsContact O-N 3.07Å
155	N	94.7	Very high	95.5	Very high	55 Å²	55	27.7 Å²	27.7	29%	0.294	14%	0.139	S	C	.	.	H	α-helix	trans	-59	-40.7	175.5	-161.7	12.3	0	0	0	112.4	F157 L158 K159 H528	N155-F157 VanDerWaalsContact C-N 3.31Å; N155-F157 PolarHBondContact O-N 3Å; N155-L158 PolarHBondContact O-N 2.88Å; N155-K159 WeakPolarHBondContact ND2-CE 3.47Å; N155-K159 PolarHBondContact ND2-NZ 3.47Å; N155-K159 WeakPolarHBondContact O-CB 3.47Å; N155-K159 WeakPolarHBondContact O-CG 3.48Å; N155-K159 PolarHBondContact O-N 3.36Å; N155-K159 WeakPolarHBondContact OD1-CE 3.33Å; N155-H528 HydrophobicContact CB-CB 3.88Å
156	D	94.9	Very high	95.5	Very high	99 Å²	99	27.3 Å²	27.3	53%	0.529	14%	0.137	S	C	.	.	H	α-helix	trans	-66.5	-38	-179	-65.4	-25.3	0	0	0	111.4	S154 K159 Q160	S154-D156 VanDerWaalsContact C-N 3.31Å; S154-D156 PolarHBondContact O-N 2.9Å; D156-K159 PolarHBondContact O-N 3.42Å; D156-Q160 WeakPolarHBondContact O-CB 3.45Å; D156-Q160 VanDerWaalsContact O-CG 3.24Å; D156-Q160 WeakPolarHBondContact O-CG 3.4Å; D156-Q160 PolarHBondContact O-N 3.06Å
157	F	94	Very high	95.4	Very high	21 Å²	21	27.3 Å²	27.3	9%	0.092	14%	0.137	C	C	.	.	H	α-helix	trans	-65.3	-41.8	175.8	-175.6	-123.9	0	0	0	111.7	P152 I153 S154 N155 S161 A564 F567 L570	P152-F157 HydrophobicContact CB-CD1 3.74Å; P152-F157 HydrophobicContact CB-CE1 4.29Å; I153-F157 HydrophobicContact CG1-CB 4.43Å; I153-F157 HydrophobicContact CG1-CD1 4.02Å; I153-F157 HydrophobicContact CG1-CG 4.35Å; S154-F157 PolarHBondContact O-N 2.8Å; S154-F157 WeakPolarHBondContact OG-CB 3.36Å; S154-F157 PolarHBondContact OG-N 2.8Å; N155-F157 VanDerWaalsContact C-N 3.31Å; N155-F157 PolarHBondContact O-N 3Å; F157-S161 PolarHBondContact O-N 3.15Å; F157-A564 HydrophobicContact CE1-CB 3.94Å; F157-F567 HydrophobicContact CD2-CD1 4.29Å; F157-F567 HydrophobicContact CD2-CD2 4.4Å; F157-F567 AromaticContact CD2-CE1 3.76Å; F157-F567 HydrophobicContact CD2-CE1 3.76Å; F157-F567 AromaticContact CD2-CE2 3.88Å; F157-F567 HydrophobicContact CD2-CE2 3.88Å; F157-F567 AromaticContact CD2-CZ 3.54Å; F157-F567 HydrophobicContact CD2-CZ 3.54Å; F157-F567 HydrophobicContact CE2-CB 4.49Å; F157-F567 AromaticContact CE2-CD1 3.61Å; F157-F567 HydrophobicContact CE2-CD1 3.61Å; F157-F567 AromaticContact CE2-CD2 3.64Å; F157-F567 HydrophobicContact CE2-CD2 3.64Å; F157-F567 AromaticContact CE2-CE1 3.57Å; F157-F567 HydrophobicContact CE2-CE1 3.57Å; F157-F567 AromaticContact CE2-CE2 3.58Å; F157-F567 HydrophobicContact CE2-CE2 3.58Å; F157-F567 AromaticContact CE2-CG 3.65Å; F157-F567 HydrophobicContact CE2-CG 3.65Å; F157-F567 AromaticContact CE2-CZ 3.55Å; F157-F567 HydrophobicContact CE2-CZ 3.55Å; F157-F567 HydrophobicContact CZ-CD1 4.21Å; F157-F567 HydrophobicContact CZ-CE1 4.47Å; F157-F567 HydrophobicContact CZ-CG 4.27Å; F157-L570 HydrophobicContact CE1-CB 4.46Å; F157-L570 HydrophobicContact CE1-CD1 4.33Å; F157-L570 HydrophobicContact CE1-CD2 3.9Å; F157-L570 HydrophobicContact CE1-CG 4.48Å; F157-L570 HydrophobicContact CZ-CB 4.33Å; F157-L570 HydrophobicContact CZ-CD2 4.06Å
158	L	95	Very high	95.3	Very high	17 Å²	17	27.4 Å²	27.4	9%	0.089	14%	0.138	C	C	.	.	H	α-helix	trans	-65.2	-46.2	173.8	179.9	60.4	0	0	0	112.4	L148 P152 S154 N155 Q160 S161 A162 L163 F165	L148-L158 HydrophobicContact CD1-CD1 4.46Å; P152-L158 HydrophobicContact CB-CB 4.1Å; P152-L158 HydrophobicContact CG-CB 4.13Å; P152-L158 HydrophobicContact CG-CD1 3.81Å; P152-L158 HydrophobicContact CG-CD2 4.49Å; P152-L158 HydrophobicContact CG-CG 4.37Å; S154-L158 PolarHBondContact O-N 3.09Å; S154-L158 VanDerWaalsContact O-N 3.07Å; N155-L158 PolarHBondContact O-N 2.88Å; L158-Q160 VanDerWaalsContact C-N 3.34Å; L158-Q160 PolarHBondContact O-N 3.07Å; L158-S161 PolarHBondContact O-N 3.04Å; L158-S161 PolarHBondContact O-OG 3.47Å; L158-A162 PolarHBondContact O-N 2.92Å; L158-A162 VanDerWaalsContact O-N 3.15Å; L158-L163 WeakPolarHBondContact CD1-O 3.34Å; L158-F165 HydrophobicContact CD1-CB 3.82Å; L158-F165 HydrophobicContact CD2-CB 3.88Å
159	K	94.5	Very high	95.2	Very high	137 Å²	137	27.4 Å²	27.4	60%	0.596	14%	0.138	S	C	*	.	H	α-helix	trans	-61.3	-41.7	178.1	-76.9	174.4	177.8	173.4	0	112.1	N155 D156 A162	N155-K159 WeakPolarHBondContact ND2-CE 3.47Å; N155-K159 PolarHBondContact ND2-NZ 3.47Å; N155-K159 WeakPolarHBondContact O-CB 3.47Å; N155-K159 WeakPolarHBondContact O-CG 3.48Å; N155-K159 PolarHBondContact O-N 3.36Å; N155-K159 WeakPolarHBondContact OD1-CE 3.33Å; D156-K159 PolarHBondContact O-N 3.42Å; K159-A162 PolarHBondContact O-N 3.36Å
160	Q	94.8	Very high	95.1	Very high	95 Å²	95	27.5 Å²	27.5	44%	0.444	14%	0.14	S	C	.	.	H	α-helix	trans	-64.7	-38.4	178	-76.1	176.5	47.4	0	0	112.3	D156 L158 A162 F567 T603	D156-Q160 WeakPolarHBondContact O-CB 3.45Å; D156-Q160 VanDerWaalsContact O-CG 3.24Å; D156-Q160 WeakPolarHBondContact O-CG 3.4Å; D156-Q160 PolarHBondContact O-N 3.06Å; L158-Q160 VanDerWaalsContact C-N 3.34Å; L158-Q160 PolarHBondContact O-N 3.07Å; Q160-A162 PolarHBondContact O-N 3.5Å; Q160-F567 HydrophobicContact CB-CE1 4.08Å; Q160-F567 HydrophobicContact CB-CZ 3.86Å; Q160-T603 WeakPolarHBondContact O-CB 3.35Å; Q160-T603 VanDerWaalsContact O-CG2 3.25Å; Q160-T603 WeakPolarHBondContact O-CG2 3.45Å; Q160-T603 PolarHBondContact O-OG1 3.1Å
161	S	94.5	Very high	95	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-70.8	-21.3	176.5	74.5	0	0	0	0	113.1	F157 L158 L163 Y571 T600	F157-S161 PolarHBondContact O-N 3.15Å; L158-S161 PolarHBondContact O-N 3.04Å; L158-S161 PolarHBondContact O-OG 3.47Å; S161-L163 PolarHBondContact O-N 3.48Å; S161-L163 PolarHBondContact OG-N 3.1Å; S161-Y571 PolarHBondContact O-OH 3.37Å; S161-Y571 VanDerWaalsContact O-OH 3.09Å; S161-T600 PolarHBondContact O-OG1 3.43Å
162	A	92.7	Very high	94.8	Very high	14 Å²	14	26.2 Å²	26.2	12%	0.116	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	10.7	-173.4	0	0	0	0	0	114.4	L158 K159 Q160 R596 Q599 T600	L158-A162 PolarHBondContact O-N 2.92Å; L158-A162 VanDerWaalsContact O-N 3.15Å; K159-A162 PolarHBondContact O-N 3.36Å; Q160-A162 PolarHBondContact O-N 3.5Å; A162-R596 HydrophobicContact CB-CG 4.44Å; A162-R596 PolarHBondContact O-NE 3.18Å; A162-Q599 HydrophobicContact CB-CB 4.1Å; A162-Q599 HydrophobicContact CB-CG 3.77Å; A162-T600 WeakPolarHBondContact CB-OG1 3.2Å; A162-T600 PolarHBondContact O-OG1 3Å
163	L	94.1	Very high	94.6	Very high	3 Å²	3	26.9 Å²	26.9	2%	0.016	14%	0.138	C	C	.	.			trans	-75.4	142.8	176.5	-63.1	172.3	0	0	0	110.2	L148 L158 S161 L570 Y571 M579 T600 M623	L148-L163 HydrophobicContact CD1-CB 4.39Å; L148-L163 HydrophobicContact CD2-CB 4.46Å; L148-L163 HydrophobicContact CD2-CD1 3.87Å; L158-L163 WeakPolarHBondContact CD1-O 3.34Å; S161-L163 PolarHBondContact O-N 3.48Å; S161-L163 PolarHBondContact OG-N 3.1Å; L163-L570 HydrophobicContact CD1-CD2 3.98Å; L163-L570 HydrophobicContact CD1-CG 4.01Å; L163-Y571 HydrophobicContact CD1-CD1 4.04Å; L163-Y571 HydrophobicContact CD1-CE1 3.92Å; L163-Y571 HydrophobicContact CD2-CD1 4.49Å; L163-Y571 HydrophobicContact CD2-CE1 4.08Å; L163-Y571 HydrophobicContact CG-CE1 4.2Å; L163-M579 HydrophobicContact CD2-CE 4.16Å; L163-M579 HydrophobicContact CD2-SD 4.21Å; L163-T600 HydrophobicContact CD2-CG2 3.45Å; L163-T600 VanDerWaalsContact CD2-CG2 3.45Å; L163-T600 HydrophobicContact CG-CG2 4.28Å; L163-M623 HydrophobicContact CD2-CE 3.39Å; L163-M623 HydrophobicContact CD2-SD 3.52Å; L163-M623 VanDerWaalsContact CD2-SD 3.52Å
164	P	92.9	Very high	94.4	Very high	3 Å²	3	28 Å²	28	2%	0.019	15%	0.145	C	C	.	.			trans	-74.9	135.1	166.9	30.4	-32.3	0	0	0	110.2	T147 M579 I582 L583	T147-P164 WeakPolarHBondContact CB-O 2.8Å; T147-P164 PolarHBondContact OG1-O 3.45Å; P164-M579 HydrophobicContact CG-CB 4.09Å; P164-M579 HydrophobicContact CG-CG 3.89Å; P164-M579 HydrophobicContact CG-SD 4.15Å; P164-I582 HydrophobicContact CB-CG2 4.16Å; P164-L583 HydrophobicContact CB-CD2 4.45Å; P164-L583 HydrophobicContact CG-CD1 4.35Å; P164-L583 HydrophobicContact CG-CD2 4.06Å; P164-L583 HydrophobicContact CG-CG 4.08Å
165	F	96	Very high	94.2	Very high	2 Å²	2	30 Å²	30	1%	0.009	15%	0.154	C	C	.	.			trans	-108.5	120.4	170.4	-174.3	-139.2	0	0	0	109.8	T147 L148 A151 P152 L158 L494 I526 F539 L561	T147-F165 WeakPolarHBondContact OG1-CA 3.44Å; L148-F165 HydrophobicContact CB-CD2 4.04Å; L148-F165 HydrophobicContact CB-CE2 4.29Å; L148-F165 HydrophobicContact CD1-CB 4.13Å; L148-F165 HydrophobicContact CD1-CD2 3.88Å; L148-F165 HydrophobicContact CD1-CG 4.31Å; L148-F165 HydrophobicContact CG-CD2 4.28Å; A151-F165 HydrophobicContact CB-CZ 3.88Å; P152-F165 HydrophobicContact CG-CB 4.41Å; P152-F165 HydrophobicContact CG-CD1 4.18Å; P152-F165 HydrophobicContact CG-CG 4.16Å; L158-F165 HydrophobicContact CD1-CB 3.82Å; L158-F165 HydrophobicContact CD2-CB 3.88Å; F165-L494 HydrophobicContact CE1-CD1 4.24Å; F165-L494 HydrophobicContact CE1-CD2 4.03Å; F165-I526 HydrophobicContact CD1-CB 3.75Å; F165-I526 HydrophobicContact CD1-CG2 3.71Å; F165-I526 HydrophobicContact CE1-CB 4.05Å; F165-I526 HydrophobicContact CE1-CD1 4.25Å; F165-I526 HydrophobicContact CE1-CG2 3.66Å; F165-I526 HydrophobicContact CG-CB 4.37Å; F165-I526 HydrophobicContact CZ-CD1 4.31Å; F165-I526 PolarHBondContact O-N 3.21Å; F165-F539 HydrophobicContact CE1-CZ 4.13Å; F165-F539 HydrophobicContact CZ-CE2 4.24Å; F165-F539 AromaticContact CZ-CZ 3.7Å; F165-F539 HydrophobicContact CZ-CZ 3.7Å; F165-L561 HydrophobicContact CE2-CD1 4.18Å; F165-L561 HydrophobicContact CZ-CD1 4.38Å
166	G	96	Very high	93.9	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.1	175.9	-172.6	0	0	0	0	0	113.4	T147 I524	T147-G166 PolarHBondContact N-O 3.1Å; T147-G166 PolarHBondContact OG1-N 3.18Å; T147-G166 PolarHBondContact OG1-O 2.75Å; G166-I524 CarbonylContact C-O 3.32Å; G166-I524 WeakPolarHBondContact CA-O 3.49Å
167	L	96.3	Very high	93.7	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	149.6	175.7	-49	174	0	0	0	110.4	V144 R145 A146 I169 S523 I524 I526 F539 L559	V144-L167 HydrophobicContact CG1-CB 4.22Å; V144-L167 HydrophobicContact CG1-CD1 4.18Å; V144-L167 HydrophobicContact CG1-CD2 4.4Å; R145-L167 CarbonylContact O-C 3.53Å; R145-L167 WeakPolarHBondContact O-CA 3.41Å; A146-L167 HydrophobicContact CB-CD2 3.68Å; L167-I169 HydrophobicContact CB-CD1 4.45Å; L167-I169 HydrophobicContact CB-CG1 4.1Å; L167-S523 CarbonylContact O-C 3.34Å; L167-S523 VanDerWaalsContact O-CA 3.3Å; L167-S523 WeakPolarHBondContact O-CA 3.43Å; L167-I524 HydrophobicContact CB-CD1 3.97Å; L167-I524 HydrophobicContact CB-CG1 3.74Å; L167-I524 HydrophobicContact CD1-CD1 3.81Å; L167-I524 HydrophobicContact CD1-CG1 4.49Å; L167-I524 HydrophobicContact CG-CD1 4Å; L167-I524 HydrophobicContact CG-CG1 4.16Å; L167-I524 PolarHBondContact N-O 3.07Å; L167-I524 PolarHBondContact O-N 3.49Å; L167-I526 HydrophobicContact CD1-CD1 4.29Å; L167-I526 HydrophobicContact CD2-CD1 4.23Å; L167-I526 HydrophobicContact CG-CD1 3.79Å; L167-F539 HydrophobicContact CD1-CB 4.08Å; L167-F539 HydrophobicContact CD1-CD1 3.95Å; L167-F539 HydrophobicContact CD1-CG 3.97Å; L167-L559 HydrophobicContact CD2-CD2 3.93Å
168	S	94.5	Very high	93.6	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.014	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	117	168.4	-168.1	0	0	0	0	107.8	V144 R145 C521 N581 H661	V144-S168 WeakPolarHBondContact CA-O 3.3Å; R145-S168 PolarHBondContact N-O 2.81Å; R145-S168 PolarHBondContact O-N 3.41Å; S168-C521 PolarHBondContact OG-SG 3.26Å; S168-N581 PolarHBondContact OG-ND2 2.92Å; S168-H661 PolarHBondContact OG-NE2 2.95Å
169	I	95.7	Very high	93.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	119.6	-166.6	-54.1	173.3	0	0	0	109.2	F143 V144 L167 P171 M486 V488 C521 I522 I524 V541	F143-I169 CarbonylContact O-C 3.59Å; F143-I169 WeakPolarHBondContact O-CA 3.39Å; V144-I169 HydrophobicContact CG1-CG1 4.38Å; V144-I169 HydrophobicContact CG2-CG2 4.34Å; L167-I169 HydrophobicContact CB-CD1 4.45Å; L167-I169 HydrophobicContact CB-CG1 4.1Å; I169-P171 HydrophobicContact CG2-CG 3.73Å; I169-M486 HydrophobicContact CD1-CE 4.37Å; I169-M486 HydrophobicContact CD1-SD 4.35Å; I169-M486 HydrophobicContact CG2-SD 3.99Å; I169-V488 HydrophobicContact CD1-CG2 3.79Å; I169-C521 CarbonylContact O-C 3.55Å; I169-C521 WeakPolarHBondContact O-CA 3.37Å; I169-I522 WeakPolarHBondContact CB-O 3.39Å; I169-I522 PolarHBondContact N-O 3.38Å; I169-I522 PolarHBondContact O-N 3.07Å; I169-I524 HydrophobicContact CD1-CD1 4.09Å; I169-I524 HydrophobicContact CD1-CG1 4.48Å; I169-I524 HydrophobicContact CD1-CG2 4.31Å; I169-V541 HydrophobicContact CD1-CG1 4.36Å; I169-V541 HydrophobicContact CD1-CG2 3.75Å; I169-V541 HydrophobicContact CG1-CG2 4.33Å; I169-V541 HydrophobicContact CG2-CG1 3.91Å; I169-V541 HydrophobicContact CG2-CG2 4.36Å
170	T	94.6	Very high	93.2	Very high	10 Å²	10	36 Å²	36	6%	0.061	19%	0.193	C	C	.	.			trans	-125.3	78.4	175	-51.7	0	0	0	0	108.5	F143 M172 A173 S518 K520	F143-T170 PolarHBondContact O-N 3.32Å; T170-M172 PolarHBondContact O-N 2.89Å; T170-A173 HydrophobicContact CG2-CB 3.76Å; T170-A173 WeakPolarHBondContact O-CB 3.36Å; T170-A173 PolarHBondContact O-N 3.23Å; T170-S518 VanDerWaalsContact CG2-O 3.25Å; T170-S518 WeakPolarHBondContact CG2-O 3.44Å; T170-K520 WeakPolarHBondContact CG2-O 3.32Å
171	P	94.9	Very high	93.1	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-25.8	-167	-24.8	35.4	0	0	0	114.7	I169 M486 L516 V543 R555	I169-P171 HydrophobicContact CG2-CG 3.73Å; P171-M486 HydrophobicContact CG-SD 4.36Å; P171-L516 HydrophobicContact CB-CD2 3.94Å; P171-L516 HydrophobicContact CG-CD2 3.76Å; P171-V543 HydrophobicContact CB-CG2 3.86Å; P171-V543 HydrophobicContact CG-CG2 3.89Å; P171-R555 VanDerWaalsContact O-CD 3.3Å; P171-R555 WeakPolarHBondContact O-CD 3.34Å; P171-R555 PolarHBondContact O-NH1 3.3Å
172	M	93.5	Very high	93.1	Very high	13 Å²	13	37.7 Å²	37.7	6%	0.064	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	15.4	-178	-60.8	-55.2	-58.2	0	0	113	T170 N174 P479 I481 L516 S518 R555	T170-M172 PolarHBondContact O-N 2.89Å; M172-N174 PolarHBondContact O-N 2.91Å; M172-P479 HydrophobicContact CE-CB 4.21Å; M172-I481 HydrophobicContact CE-CG2 3.57Å; M172-I481 HydrophobicContact CG-CD1 4.04Å; M172-I481 HydrophobicContact CG-CG1 4.11Å; M172-I481 HydrophobicContact CG-CG2 4.47Å; M172-I481 HydrophobicContact SD-CD1 3.77Å; M172-I481 HydrophobicContact SD-CG1 4.11Å; M172-I481 HydrophobicContact SD-CG2 3.63Å; M172-L516 HydrophobicContact CG-CD2 4.25Å; M172-L516 HydrophobicContact CG-CG 4.11Å; M172-S518 WeakPolarHBondContact O-CA 3.45Å; M172-S518 WeakPolarHBondContact O-CB 3.42Å; M172-R555 PolarHBondContact SD-NH1 3.4Å
173	A	92.7	Very high	93.3	Very high	15 Å²	15	38 Å²	38	12%	0.124	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-50.1	139.6	-177.5	0	0	0	0	0	112.4	K142 F143 T170 L175	K142-A173 HydrophobicContact CB-CB 4.05Å; K142-A173 WeakPolarHBondContact O-CB 3.34Å; F143-A173 HydrophobicContact CD1-CB 3.97Å; F143-A173 HydrophobicContact CE1-CB 4.23Å; T170-A173 HydrophobicContact CG2-CB 3.76Å; T170-A173 WeakPolarHBondContact O-CB 3.36Å; T170-A173 PolarHBondContact O-N 3.23Å; A173-L175 PolarHBondContact O-N 3.34Å
174	N	90.3	Very high	93.4	Very high	86 Å²	86	40.5 Å²	40.5	46%	0.46	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-65.7	133.3	177.4	-70.5	-48.1	0	0	0	110.4	M172 P479 S518	M172-N174 PolarHBondContact O-N 2.91Å; N174-P479 WeakPolarHBondContact OD1-CD 3.45Å; N174-P479 WeakPolarHBondContact OD1-CG 3.48Å; N174-S518 PolarHBondContact ND2-OG 3.45Å
175	L	91.2	Very high	93.6	Very high	57 Å²	57	41 Å²	41	30%	0.298	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-92.2	148.7	172.4	-64.2	-178	0	0	0	109.6	K142 F143 A173 E179	K142-L175 HydrophobicContact CD-CD2 4.41Å; F143-L175 HydrophobicContact CE1-CD2 4.27Å; F143-L175 HydrophobicContact CE2-CD2 4.07Å; F143-L175 HydrophobicContact CZ-CD1 4.11Å; F143-L175 HydrophobicContact CZ-CD2 3.61Å; F143-L175 HydrophobicContact CZ-CG 4.03Å; A173-L175 PolarHBondContact O-N 3.34Å; L175-E179 VanDerWaalsContact CA-OE2 3.27Å; L175-E179 WeakPolarHBondContact CA-OE2 3.41Å; L175-E179 HydrophobicContact CB-CB 4.03Å; L175-E179 HydrophobicContact CD2-CB 4.49Å; L175-E179 WeakPolarHBondContact CD2-OE2 3.38Å
176	S	89.5	Confident	93.5	Very high	31 Å²	31	46 Å²	46	22%	0.217	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-72.9	163.4	171.5	78	0	0	0	0	110.3	F132 E178 E179	F132-S176 WeakPolarHBondContact CB-OG 3.12Å; S176-E178 WeakPolarHBondContact CB-OE2 3.28Å; S176-E178 PolarHBondContact O-N 3.45Å; S176-E178 PolarHBondContact OG-OE2 2.93Å; S176-E179 PolarHBondContact N-OE2 2.92Å; S176-E179 PolarHBondContact O-N 3.17Å
177	A	89.3	Confident	93.5	Very high	105 Å²	105	47.6 Å²	47.6	87%	0.868	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-25.1	-176.7	0	0	0	0	0	113	E179	A177-E179 VanDerWaalsContact C-N 3.34Å
178	E	92	Very high	93.4	Very high	131 Å²	131	49.7 Å²	49.7	61%	0.612	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-20.6	176.9	-54.7	77.6	-169.4	0	0	112.7	F132 S176	F132-E178 HydrophobicContact CB-CB 4.16Å; F132-E178 HydrophobicContact CD1-CB 4.42Å; F132-E178 HydrophobicContact CD1-CG 4.43Å; F132-E178 HydrophobicContact CD2-CB 4.11Å; F132-E178 HydrophobicContact CG-CB 4Å; F132-E178 HydrophobicContact CG-CG 4.5Å; S176-E178 WeakPolarHBondContact CB-OE2 3.28Å; S176-E178 PolarHBondContact O-N 3.45Å; S176-E178 PolarHBondContact OG-OE2 2.93Å
179	E	93.5	Very high	93.3	Very high	13 Å²	13	59 Å²	59	6%	0.061	33%	0.328	C	S	.	.	S	Bend	trans	-85.5	136.2	-178.4	-67.9	173.8	137	0	0	111	F132 A133 N140 K142 L175 S176 A177	F132-E179 HydrophobicContact CB-CG 3.76Å; A133-E179 PolarHBondContact N-OE1 3.04Å; N140-E179 PolarHBondContact ND2-OE1 3.29Å; K142-E179 VanDerWaalsContact NZ-CD 3.27Å; K142-E179 IonicContact NZ-OE1 3.13Å; K142-E179 PolarHBondContact NZ-OE1 3.33Å; K142-E179 IonicContact NZ-OE2 3.5Å; K142-E179 PolarHBondContact NZ-OE2 3.45Å; L175-E179 VanDerWaalsContact CA-OE2 3.27Å; L175-E179 WeakPolarHBondContact CA-OE2 3.41Å; L175-E179 HydrophobicContact CB-CB 4.03Å; L175-E179 HydrophobicContact CD2-CB 4.49Å; L175-E179 WeakPolarHBondContact CD2-OE2 3.38Å; S176-E179 PolarHBondContact N-OE2 2.92Å; S176-E179 PolarHBondContact O-N 3.17Å; A177-E179 VanDerWaalsContact C-N 3.34Å
180	R	88.2	Confident	93.2	Very high	177 Å²	177	61.7 Å²	61.7	67%	0.668	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-69.2	132.3	178.2	-172	-174	171.6	173	-1.1	110.3
181	P	92.4	Very high	93.2	Very high	99 Å²	99	61.3 Å²	61.3	64%	0.643	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-56.8	150	168.4	-24	33.7	0	0	0	112
182	L	95.2	Very high	93.3	Very high	31 Å²	31	61.8 Å²	61.8	16%	0.162	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-60.3	129	-179	-63.4	-176.4	0	0	0	111.2	F143 S253 E255 R555	F143-L182 HydrophobicContact CE2-CD1 4.44Å; F143-L182 HydrophobicContact CE2-CD2 3.9Å; F143-L182 HydrophobicContact CE2-CG 4.49Å; F143-L182 HydrophobicContact CZ-CD1 4.18Å; F143-L182 HydrophobicContact CZ-CD2 4.18Å; F143-L182 HydrophobicContact CZ-CG 4.29Å; L182-S253 VanDerWaalsContact CD2-CB 3.44Å; L182-E255 HydrophobicContact CB-CG 4.34Å; L182-E255 HydrophobicContact CD1-CG 4.39Å; L182-R555 HydrophobicContact CD1-CG 4.05Å
183	P	96.3	Very high	93.5	Very high	19 Å²	19	61.7 Å²	61.7	12%	0.123	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-71	139.3	175.3	27.9	-31.4	0	0	0	110.5	P247 L251 E255	P183-P247 HydrophobicContact CB-CB 4.07Å; P183-P247 HydrophobicContact CB-CG 3.86Å; P183-P247 HydrophobicContact CG-CB 3.54Å; P183-P247 HydrophobicContact CG-CG 3.89Å; P183-L251 HydrophobicContact CG-CD1 3.65Å; P183-E255 PolarHBondContact O-N 3.4Å
184	V	96	Very high	93.8	Very high	56 Å²	56	63 Å²	63	34%	0.339	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	116.4	174.9	-175.4	0	0	0	0	108.8	E255 V257	V184-E255 HydrophobicContact CG2-CB 4.29Å; V184-V257 HydrophobicContact CG1-CG2 3.7Å
185	V	96.7	Very high	94.2	Very high	14 Å²	14	58.9 Å²	58.9	9%	0.085	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	123.3	-179.8	-174.9	0	0	0	0	109.1	M187 P247 E255 Y256 V257	V185-M187 HydrophobicContact CG1-CE 3.56Å; V185-M187 HydrophobicContact CG1-CG 4.37Å; V185-M187 HydrophobicContact CG1-SD 4.35Å; V185-P247 HydrophobicContact CG2-CB 3.97Å; V185-P247 HydrophobicContact CG2-CG 4.05Å; V185-E255 WeakPolarHBondContact CB-O 3.46Å; V185-E255 PolarHBondContact N-O 2.81Å; V185-Y256 HydrophobicContact CB-CD1 3.73Å; V185-Y256 HydrophobicContact CB-CE1 3.84Å; V185-Y256 HydrophobicContact CG1-CD1 3.87Å; V185-Y256 HydrophobicContact CG1-CE1 3.6Å; V185-Y256 CarbonylContact O-C 3.48Å; V185-Y256 VanDerWaalsContact O-CA 3.28Å; V185-Y256 WeakPolarHBondContact O-CA 3.38Å; V185-V257 PolarHBondContact O-N 3.18Å
186	N	95.5	Very high	94.5	Very high	108 Å²	108	60.9 Å²	60.9	58%	0.578	33%	0.331	S	S	*	.			trans	-113.9	114.4	177.7	-170.3	-12.9	0	0	0	110.2	G188 V257	N186-G188 PolarHBondContact OD1-N 3.42Å; N186-V257 HydrophobicContact CB-CB 4.27Å; N186-V257 HydrophobicContact CB-CG2 3.81Å
187	M	94.7	Very high	94.9	Very high	33 Å²	33	67.3 Å²	67.3	16%	0.163	35%	0.35	C	S	.	.			trans	-99	7.2	179.3	-64.6	-63.1	-175.9	0	0	113	V185 L190 G191 Y230 E248 Y256	V185-M187 HydrophobicContact CG1-CE 3.56Å; V185-M187 HydrophobicContact CG1-CG 4.37Å; V185-M187 HydrophobicContact CG1-SD 4.35Å; M187-L190 PolarHBondContact O-N 3.06Å; M187-G191 WeakPolarHBondContact CB-O 3.22Å; M187-Y230 HydrophobicContact CE-CD2 4.03Å; M187-Y230 HydrophobicContact CE-CE2 3.45Å; M187-Y230 VanDerWaalsContact CE-CE2 3.45Å; M187-Y230 HydrophobicContact SD-CD2 4.27Å; M187-Y230 HydrophobicContact SD-CE2 4.27Å; M187-E248 WeakPolarHBondContact CE-OE1 3.23Å; M187-Y256 HydrophobicContact CE-CE1 4.02Å; M187-Y256 HydrophobicContact CG-CD1 4.28Å; M187-Y256 HydrophobicContact CG-CE1 3.98Å
188	G	93.8	Very high	95.2	Very high	43 Å²	43	64 Å²	64	44%	0.443	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	60.4	-138.7	-176.9	0	0	0	0	0	112.4	N186 L190 G191 T259	N186-G188 PolarHBondContact OD1-N 3.42Å; G188-L190 VanDerWaalsContact C-N 3.28Å; G188-L190 PolarHBondContact O-N 2.63Å; G188-G191 PolarHBondContact O-N 3.11Å; G188-T259 WeakPolarHBondContact O-CG2 3.15Å
189	E	92.4	Very high	95.5	Very high	198 Å²	198	62.6 Å²	62.6	93%	0.925	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-68	-24.2	-177.1	-62.5	-173.5	166.7	0	0	113.9	G191	E189-G191 PolarHBondContact O-N 3.36Å
190	L	94.8	Very high	95.7	Very high	57 Å²	57	62 Å²	62	30%	0.298	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-60.2	-34.8	175.4	178.4	64.3	0	0	0	111.1	M187 G188 V193 P227 Q229	M187-L190 PolarHBondContact O-N 3.06Å; G188-L190 VanDerWaalsContact C-N 3.28Å; G188-L190 PolarHBondContact O-N 2.63Å; L190-V193 HydrophobicContact CD2-CG2 4.08Å; L190-P227 HydrophobicContact CD1-CB 3.91Å; L190-P227 HydrophobicContact CD1-CG 4.16Å; L190-P227 HydrophobicContact CD2-CB 4.4Å; L190-Q229 HydrophobicContact CD2-CB 4.38Å
191	G	95	Very high	96.2	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.01	28%	0.278	C	S	.	.			trans	63.4	-169.8	-170.2	0	0	0	0	0	112.7	M187 G188 E189 V193 T259	M187-G191 WeakPolarHBondContact CB-O 3.22Å; G188-G191 PolarHBondContact O-N 3.11Å; E189-G191 PolarHBondContact O-N 3.36Å; G191-V193 PolarHBondContact O-N 3.32Å; G191-T259 VanDerWaalsContact CA-CG2 3.45Å
192	P	97.2	Very high	96.5	Very high	11 Å²	11	49 Å²	49	7%	0.071	25%	0.248	C	C	.	.	S	Bend	trans	-71.9	130.6	-176.9	29.9	-35.6	0	0	0	111.6	R194 Y201 Y256 Y262 L554	P192-R194 WeakPolarHBondContact O-CG 3.46Å; P192-Y201 HydrophobicContact CB-CD1 3.87Å; P192-Y201 HydrophobicContact CB-CE1 4.12Å; P192-Y201 HydrophobicContact CG-CD1 4.11Å; P192-Y201 HydrophobicContact CG-CE1 3.82Å; P192-Y256 HydrophobicContact CB-CD1 4.1Å; P192-Y256 HydrophobicContact CB-CD2 3.64Å; P192-Y256 HydrophobicContact CB-CE1 4.21Å; P192-Y256 HydrophobicContact CB-CE2 3.72Å; P192-Y256 HydrophobicContact CB-CG 3.83Å; P192-Y262 HydrophobicContact CG-CE2 4.2Å; P192-L554 HydrophobicContact CG-CD1 3.92Å
193	V	97.6	Very high	96.6	Very high	10 Å²	10	47.6 Å²	47.6	6%	0.061	24%	0.24	C	C	.	.			trans	-68.8	134.3	175	-179.7	0	0	0	0	110.1	L190 G191 M202 F215 P227 Y230	L190-V193 HydrophobicContact CD2-CG2 4.08Å; G191-V193 PolarHBondContact O-N 3.32Å; V193-M202 HydrophobicContact CB-CB 4.37Å; V193-M202 HydrophobicContact CB-CE 4.34Å; V193-M202 HydrophobicContact CG1-CE 3.74Å; V193-M202 PolarHBondContact O-N 3.27Å; V193-F215 HydrophobicContact CG1-CE1 4.13Å; V193-F215 HydrophobicContact CG1-CZ 4.33Å; V193-P227 HydrophobicContact CG1-CG 4.47Å; V193-P227 HydrophobicContact CG2-CG 4.24Å; V193-Y230 HydrophobicContact CB-CD1 4.47Å; V193-Y230 HydrophobicContact CG1-CD1 4.48Å; V193-Y230 HydrophobicContact CG2-CD1 3.87Å; V193-Y230 HydrophobicContact CG2-CD2 4.23Å; V193-Y230 HydrophobicContact CG2-CE1 4.33Å; V193-Y230 HydrophobicContact CG2-CG 3.82Å
194	R	97.9	Very high	96.7	Very high	42 Å²	42	47.5 Å²	47.5	16%	0.158	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-137.1	153.6	-174.6	-62.9	173.2	75	176.4	5.7	111.8	P192 H196 K199 A200 Y201 Y262	P192-R194 WeakPolarHBondContact O-CG 3.46Å; R194-H196 PolarHBondContact O-N 3.29Å; R194-K199 VanDerWaalsContact CZ-O 3.25Å; R194-K199 PolarHBondContact NE-O 2.84Å; R194-K199 PolarHBondContact NH2-O 3.09Å; R194-A200 CarbonylContact C-O 3.51Å; R194-A200 WeakPolarHBondContact CA-O 3.29Å; R194-A200 WeakPolarHBondContact CB-O 3.41Å; R194-Y201 HydrophobicContact CG-CD1 3.69Å; R194-Y201 HydrophobicContact CG-CE1 4.01Å; R194-Y201 HydrophobicContact CG-CG 4.32Å; R194-Y262 PolarHBondContact NH1-OH 3.13Å; R194-Y262 VanDerWaalsContact NH1-OH 3.11Å
195	C	98.4	Very high	96.7	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.226	C	C	.	.			trans	-60.7	133.7	167.5	177	0	0	0	0	110.4	R197 K199 A200 C217 C220	C195-R197 VanDerWaalsContact C-N 3.29Å; C195-R197 PolarHBondContact O-N 2.95Å; C195-K199 WeakPolarHBondContact O-CA 3.33Å; C195-K199 PolarHBondContact O-N 3.23Å; C195-K199 VanDerWaalsContact O-N 3.13Å; C195-A200 PolarHBondContact N-O 3.46Å; C195-C217 HydrophobicContact CB-CB 3.97Å; C195-C220 VanDerWaalsContact SG-SG 3.62Å
196	H	97.4	Very high	96.8	Very high	99 Å²	99	45.2 Å²	45.2	46%	0.458	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-27.2	-177.5	68.8	77.6	0	0	0	113.7	R194 K199 V222 S223 T224	R194-H196 PolarHBondContact O-N 3.29Å; H196-K199 WeakPolarHBondContact O-CE 2.99Å; H196-K199 PolarHBondContact O-NZ 3.32Å; H196-V222 WeakPolarHBondContact CE1-CG1 3.21Å; H196-V222 WeakPolarHBondContact NE2-CG1 3.32Å; H196-S223 PolarHBondContact NE2-O 3.23Å; H196-T224 HydrophobicContact CB-CG2 4.39Å; H196-T224 PolarHBondContact CD2-OG1 3.45Å; H196-T224 PolarHBondContact N-OG1 3.2Å
197	R	97.9	Very high	96.8	Very high	167 Å²	167	44.4 Å²	44.4	63%	0.63	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86	-73.3	179.8	-173.5	-176.9	-70.6	174.5	1.8	112.7	C195 K199 V222	C195-R197 VanDerWaalsContact C-N 3.29Å; C195-R197 PolarHBondContact O-N 2.95Å; R197-K199 VanDerWaalsContact C-N 3.28Å; R197-K199 PolarHBondContact O-N 3.48Å; R197-V222 HydrophobicContact CB-CB 4.37Å; R197-V222 HydrophobicContact CB-CG1 4.29Å; R197-V222 HydrophobicContact CB-CG2 3.93Å; R197-V222 VanDerWaalsContact CD-CG2 3.5Å; R197-V222 HydrophobicContact CG-CG2 4.3Å; R197-V222 VanDerWaalsContact NH1-CG2 3.31Å
198	C	97.2	Very high	97	Very high	36 Å²	36	44 Å²	44	24%	0.243	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-6.9	-173.6	70.2	0	0	0	0	114	A200 C217 C220 R489	C198-A200 PolarHBondContact O-N 3.32Å; C198-A200 VanDerWaalsContact SG-CB 3.58Å; C198-C217 PolarHBondContact SG-SG 2.78Å; C198-C220 HydrophobicContact CB-CB 4.04Å; C198-C220 VanDerWaalsContact SG-SG 3.6Å; C198-R489 PolarHBondContact O-NE 3.33Å
199	K	97.5	Very high	97.1	Very high	100 Å²	100	45 Å²	45	44%	0.435	21%	0.213	S	C	.	.			trans	59.2	23.8	-178.3	-46.3	-60.7	-168.1	-171.4	0	114.2	R194 C195 H196 R197 R489	R194-K199 VanDerWaalsContact CZ-O 3.25Å; R194-K199 PolarHBondContact NE-O 2.84Å; R194-K199 PolarHBondContact NH2-O 3.09Å; C195-K199 WeakPolarHBondContact O-CA 3.33Å; C195-K199 PolarHBondContact O-N 3.23Å; C195-K199 VanDerWaalsContact O-N 3.13Å; H196-K199 WeakPolarHBondContact O-CE 2.99Å; H196-K199 PolarHBondContact O-NZ 3.32Å; R197-K199 VanDerWaalsContact C-N 3.28Å; R197-K199 PolarHBondContact O-N 3.48Å; K199-R489 PolarHBondContact O-NE 3.12Å
200	A	98.3	Very high	97.3	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-63.5	139.9	168.2	0	0	0	0	0	110.2	R194 C195 C198 M206 F219	R194-A200 CarbonylContact C-O 3.51Å; R194-A200 WeakPolarHBondContact CA-O 3.29Å; R194-A200 WeakPolarHBondContact CB-O 3.41Å; C195-A200 PolarHBondContact N-O 3.46Å; C198-A200 PolarHBondContact O-N 3.32Å; C198-A200 VanDerWaalsContact SG-CB 3.58Å; A200-M206 HydrophobicContact CB-CE 4.32Å; A200-F219 HydrophobicContact CB-CD2 3.41Å; A200-F219 VanDerWaalsContact CB-CD2 3.41Å; A200-F219 HydrophobicContact CB-CE2 3.76Å; A200-F219 HydrophobicContact CB-CG 4.12Å
201	Y	98.4	Very high	97.3	Very high	5 Å²	5	39.2 Å²	39.2	2%	0.02	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-71.3	150.2	175.9	-62.3	-84.9	0	0	0	110.5	P192 R194 C203 M206 Q540 A542 L554 I556	P192-Y201 HydrophobicContact CB-CD1 3.87Å; P192-Y201 HydrophobicContact CB-CE1 4.12Å; P192-Y201 HydrophobicContact CG-CD1 4.11Å; P192-Y201 HydrophobicContact CG-CE1 3.82Å; R194-Y201 HydrophobicContact CG-CD1 3.69Å; R194-Y201 HydrophobicContact CG-CE1 4.01Å; R194-Y201 HydrophobicContact CG-CG 4.32Å; Y201-C203 PolarHBondContact O-N 2.9Å; Y201-M206 WeakPolarHBondContact O-CE 2.87Å; Y201-Q540 PolarHBondContact O-NE2 3.33Å; Y201-A542 HydrophobicContact CD2-CB 3.89Å; Y201-A542 HydrophobicContact CE2-CB 3.48Å; Y201-A542 VanDerWaalsContact CE2-CB 3.48Å; Y201-L554 HydrophobicContact CE1-CD1 3.79Å; Y201-L554 WeakPolarHBondContact OH-CD2 3.47Å; Y201-I556 HydrophobicContact CD1-CD1 4.31Å; Y201-I556 HydrophobicContact CD2-CD1 3.52Å; Y201-I556 HydrophobicContact CE2-CD1 3.9Å; Y201-I556 HydrophobicContact CG-CD1 3.76Å; Y201-I556 HydrophobicContact CG-CG1 4.44Å
202	M	98.4	Very high	97.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-50	134.8	169.4	-172.6	56.4	58.7	0	0	109.5	V193 M206 F208 F215 Y230 E248 L249 Y254	V193-M202 HydrophobicContact CB-CB 4.37Å; V193-M202 HydrophobicContact CB-CE 4.34Å; V193-M202 HydrophobicContact CG1-CE 3.74Å; V193-M202 PolarHBondContact O-N 3.27Å; M202-M206 HydrophobicContact CE-CG 4.43Å; M202-M206 HydrophobicContact SD-CB 3.76Å; M202-M206 HydrophobicContact SD-CG 3.58Å; M202-M206 VanDerWaalsContact SD-CG 3.58Å; M202-F208 HydrophobicContact CE-CE1 4.44Å; M202-F208 HydrophobicContact CE-CZ 3.95Å; M202-F208 HydrophobicContact SD-CE2 4.14Å; M202-F208 HydrophobicContact SD-CZ 3.62Å; M202-F215 HydrophobicContact CE-CD1 3.93Å; M202-F215 HydrophobicContact CE-CD2 4.17Å; M202-F215 HydrophobicContact CE-CE1 3.8Å; M202-F215 HydrophobicContact CE-CE2 4.06Å; M202-F215 HydrophobicContact CE-CG 4.09Å; M202-F215 HydrophobicContact CE-CZ 3.85Å; M202-Y230 HydrophobicContact CE-CE1 4.1Å; M202-Y230 HydrophobicContact CG-CE1 4.18Å; M202-Y230 HydrophobicContact SD-CE1 4.48Å; M202-E248 HydrophobicContact CB-CG 4.45Å; M202-E248 HydrophobicContact CG-CG 4.04Å; M202-L249 HydrophobicContact CG-CD2 3.75Å; M202-L249 HydrophobicContact SD-CD2 3.87Å; M202-Y254 PolarHBondContact O-OH 3.05Å
203	C	97.9	Very high	97.4	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.007	22%	0.223	C	C	.	.			trans	-154.8	168.6	-175.8	64.5	0	0	0	0	109.9	Y201 F205 M206 E248 Y254 N558	Y201-C203 PolarHBondContact O-N 2.9Å; C203-F205 PolarHBondContact O-N 2.99Å; C203-M206 WeakPolarHBondContact O-CG 3.37Å; C203-M206 PolarHBondContact O-N 3.01Å; C203-M206 VanDerWaalsContact O-N 3.15Å; C203-E248 CarbonylContact C-O 3.52Å; C203-E248 WeakPolarHBondContact CA-O 3.29Å; C203-Y254 WeakPolarHBondContact CA-OH 3.05Å; C203-Y254 WeakPolarHBondContact CB-OH 3.46Å; C203-N558 HydrophobicContact CB-CB 4.43Å; C203-N558 VanDerWaalsContact CB-OD1 3.22Å; C203-N558 WeakPolarHBondContact CB-OD1 3.25Å
204	P	97.4	Very high	97.4	Very high	16 Å²	16	50.8 Å²	50.8	10%	0.104	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-19.6	-177.8	-26.1	35.3	0	0	0	115.1	F118 M206 E248 L249 L251	F118-P204 HydrophobicContact CE2-CB 3.99Å; P204-M206 VanDerWaalsContact C-N 3.34Å; P204-E248 WeakPolarHBondContact CD-O 3.41Å; P204-L249 WeakPolarHBondContact CA-O 3.34Å; P204-L251 WeakPolarHBondContact CD-O 3.42Å; P204-L251 WeakPolarHBondContact CG-O 3.39Å
205	F	97.2	Very high	97.4	Very high	12 Å²	12	48.8 Å²	48.8	5%	0.053	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	0.1	-176.6	-49.9	-44.9	0	0	0	113.8	F118 G137 N138 C203 P218 Y538 N558 S560	F118-F205 HydrophobicContact CD2-CE1 4.1Å; F118-F205 AromaticContact CE2-CD1 3.93Å; F118-F205 HydrophobicContact CE2-CD1 3.93Å; F118-F205 AromaticContact CE2-CE1 3.83Å; F118-F205 HydrophobicContact CE2-CE1 3.83Å; G137-F205 WeakPolarHBondContact O-CZ 3.46Å; N138-F205 WeakPolarHBondContact OD1-CZ 3.22Å; C203-F205 PolarHBondContact O-N 2.99Å; F205-P218 HydrophobicContact CB-CB 4.21Å; F205-P218 HydrophobicContact CB-CG 3.79Å; F205-Y538 HydrophobicContact CB-CD1 3.93Å; F205-Y538 HydrophobicContact CB-CE1 3.75Å; F205-Y538 HydrophobicContact CD1-CD1 4.37Å; F205-Y538 HydrophobicContact CD1-CE1 4.03Å; F205-Y538 AromaticContact CD2-CD1 3.56Å; F205-Y538 HydrophobicContact CD2-CD1 3.56Å; F205-Y538 HydrophobicContact CD2-CE1 4.04Å; F205-Y538 HydrophobicContact CE2-CD1 4.15Å; F205-Y538 AromaticContact CG-CD1 3.7Å; F205-Y538 HydrophobicContact CG-CD1 3.7Å; F205-Y538 AromaticContact CG-CE1 3.67Å; F205-Y538 HydrophobicContact CG-CE1 3.67Å; F205-N558 HydrophobicContact CD2-CB 4.31Å; F205-N558 HydrophobicContact CE2-CB 3.72Å; F205-S560 VanDerWaalsContact CZ-CB 3.48Å
206	M	97.4	Very high	97.4	Very high	10 Å²	10	54.5 Å²	54.5	5%	0.049	25%	0.253	C	S	.	.			trans	-75.2	124.4	176.9	-63.3	-73.3	-176.1	0	0	110.4	A200 Y201 M202 C203 P204 F208 F215 C217 P218	A200-M206 HydrophobicContact CB-CE 4.32Å; Y201-M206 WeakPolarHBondContact O-CE 2.87Å; M202-M206 HydrophobicContact CE-CG 4.43Å; M202-M206 HydrophobicContact SD-CB 3.76Å; M202-M206 HydrophobicContact SD-CG 3.58Å; M202-M206 VanDerWaalsContact SD-CG 3.58Å; C203-M206 WeakPolarHBondContact O-CG 3.37Å; C203-M206 PolarHBondContact O-N 3.01Å; C203-M206 VanDerWaalsContact O-N 3.15Å; P204-M206 VanDerWaalsContact C-N 3.34Å; M206-F208 HydrophobicContact CB-CE2 4.24Å; M206-F215 HydrophobicContact CB-CD2 4.3Å; M206-F215 HydrophobicContact CE-CE2 4.36Å; M206-F215 HydrophobicContact CG-CD2 4.3Å; M206-F215 HydrophobicContact SD-CD2 3.64Å; M206-F215 HydrophobicContact SD-CE2 3.76Å; M206-C217 HydrophobicContact SD-CB 4.29Å; M206-P218 WeakPolarHBondContact SD-CD 3.45Å; M206-P218 HydrophobicContact SD-CG 4.44Å
207	T	96.7	Very high	97.4	Very high	91 Å²	91	49.8 Å²	49.8	56%	0.558	23%	0.232	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-91.9	112.6	179.6	-46.3	0	0	0	0	110.7	F215 R216	T207-F215 CarbonylContact O-C 3.58Å; T207-F215 VanDerWaalsContact O-CA 3.26Å; T207-F215 WeakPolarHBondContact O-CA 3.47Å; T207-R216 PolarHBondContact N-O 3.18Å; T207-R216 PolarHBondContact O-N 2.96Å
208	F	97.8	Very high	97.4	Very high	24 Å²	24	42.9 Å²	42.9	11%	0.105	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	146.5	176.4	-66.6	-96	0	0	0	111.8	M202 M206 R214 F215 V226 L234 R240 L249	M202-F208 HydrophobicContact CE-CE1 4.44Å; M202-F208 HydrophobicContact CE-CZ 3.95Å; M202-F208 HydrophobicContact SD-CE2 4.14Å; M202-F208 HydrophobicContact SD-CZ 3.62Å; M206-F208 HydrophobicContact CB-CE2 4.24Å; F208-R214 CarbonylContact C-O 3.56Å; F208-R214 WeakPolarHBondContact CA-O 3.22Å; F208-F215 HydrophobicContact CD1-CB 3.83Å; F208-F215 HydrophobicContact CE1-CB 3.91Å; F208-F215 HydrophobicContact CG-CB 4.22Å; F208-F215 HydrophobicContact CZ-CB 4.35Å; F208-V226 HydrophobicContact CD1-CG2 4.08Å; F208-V226 HydrophobicContact CE1-CG2 3.87Å; F208-L234 HydrophobicContact CB-CD1 4.34Å; F208-L234 HydrophobicContact CB-CD2 3.6Å; F208-L234 HydrophobicContact CG-CD2 4.46Å; F208-R240 HydrophobicContact CB-CG 4.36Å; F208-R240 HydrophobicContact CD1-CG 4.2Å; F208-R240 HydrophobicContact CD2-CG 3.95Å; F208-R240 VanDerWaalsContact CE2-CD 3.49Å; F208-R240 HydrophobicContact CE2-CG 4.29Å; F208-R240 HydrophobicContact CG-CG 3.91Å; F208-R240 VanDerWaalsContact CZ-CD 3.43Å; F208-L249 HydrophobicContact CE2-CD2 3.98Å; F208-L249 HydrophobicContact CZ-CD2 4.07Å
209	F	96.6	Very high	97.4	Very high	66 Å²	66	41.4 Å²	41.4	29%	0.289	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	-177.3	177.5	66.2	-82.2	0	0	0	110.6	G211 G212 R213 R214 R216 S223	F209-G211 VanDerWaalsContact C-N 3.33Å; F209-G211 PolarHBondContact O-N 2.73Å; F209-G212 PolarHBondContact O-N 2.93Å; F209-R213 PolarHBondContact O-N 2.9Å; F209-R214 HydrophobicContact CD1-CB 4.24Å; F209-R214 HydrophobicContact CD2-CB 4.28Å; F209-R214 HydrophobicContact CE1-CB 3.79Å; F209-R214 HydrophobicContact CE2-CB 3.84Å; F209-R214 HydrophobicContact CG-CB 4.47Å; F209-R214 HydrophobicContact CZ-CB 3.59Å; F209-R214 PolarHBondContact N-O 2.72Å; F209-R214 PolarHBondContact O-N 2.85Å; F209-R216 HydrophobicContact CE1-CB 4.19Å; F209-S223 VanDerWaalsContact CZ-OG 3.3Å; F209-S223 WeakPolarHBondContact CZ-OG 3.35Å
210	D	96.1	Very high	97.3	Very high	91 Å²	91	37.4 Å²	37.4	49%	0.487	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	55.4	48	-177.8	-166.8	23	0	0	0	112	G212 R213	D210-G212 PolarHBondContact O-N 2.85Å; D210-G212 VanDerWaalsContact O-N 3.12Å; D210-R213 WeakPolarHBondContact O-CB 3.36Å; D210-R213 WeakPolarHBondContact O-CG 3.25Å; D210-R213 PolarHBondContact O-N 2.88Å; D210-R213 VanDerWaalsContact O-N 3.15Å
211	G	95.1	Very high	97.2	Very high	42 Å²	42	40.5 Å²	40.5	43%	0.433	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	65.5	12.8	-177.1	0	0	0	0	0	115.2	F209	F209-G211 VanDerWaalsContact C-N 3.33Å; F209-G211 PolarHBondContact O-N 2.73Å
212	G	96.5	Very high	97.2	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	101.4	1.9	-178.5	0	0	0	0	0	113.6	F209 D210 R214 V226	F209-G212 PolarHBondContact O-N 2.93Å; D210-G212 PolarHBondContact O-N 2.85Å; D210-G212 VanDerWaalsContact O-N 3.12Å; G212-R214 VanDerWaalsContact C-N 3.32Å; G212-V226 WeakPolarHBondContact O-CG2 3.4Å
213	R	97.4	Very high	97.2	Very high	156 Å²	156	42.7 Å²	42.7	59%	0.589	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-17.5	-178.7	-63.3	176.9	178.7	-169.5	-1.5	113.4	F209 D210 V226 F231	F209-R213 PolarHBondContact O-N 2.9Å; D210-R213 WeakPolarHBondContact O-CB 3.36Å; D210-R213 WeakPolarHBondContact O-CG 3.25Å; D210-R213 PolarHBondContact O-N 2.88Å; D210-R213 VanDerWaalsContact O-N 3.15Å; R213-V226 WeakPolarHBondContact O-CB 3.49Å; R213-V226 PolarHBondContact O-N 2.84Å; R213-F231 HydrophobicContact CG-CD2 4.18Å; R213-F231 HydrophobicContact CG-CE2 3.67Å; R213-F231 HydrophobicContact CG-CZ 4.48Å
214	R	98.1	Very high	97.2	Very high	108 Å²	108	43.1 Å²	43.1	41%	0.408	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	151.7	-179.3	-68.9	-178.1	162.5	-177.6	-2.6	110.8	F208 F209 G212 T224	F208-R214 CarbonylContact C-O 3.56Å; F208-R214 WeakPolarHBondContact CA-O 3.22Å; F209-R214 HydrophobicContact CD1-CB 4.24Å; F209-R214 HydrophobicContact CD2-CB 4.28Å; F209-R214 HydrophobicContact CE1-CB 3.79Å; F209-R214 HydrophobicContact CE2-CB 3.84Å; F209-R214 HydrophobicContact CG-CB 4.47Å; F209-R214 HydrophobicContact CZ-CB 3.59Å; F209-R214 PolarHBondContact N-O 2.72Å; F209-R214 PolarHBondContact O-N 2.85Å; G212-R214 VanDerWaalsContact C-N 3.32Å; R214-T224 CarbonylContact C-O 3.56Å; R214-T224 VanDerWaalsContact CA-O 3.31Å; R214-T224 WeakPolarHBondContact CA-O 3.38Å
215	F	98	Very high	97.2	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	147.7	170	69.1	-87.5	0	0	0	111.4	V193 M202 M206 T207 F208 S223 T224 V226	V193-F215 HydrophobicContact CG1-CE1 4.13Å; V193-F215 HydrophobicContact CG1-CZ 4.33Å; M202-F215 HydrophobicContact CE-CD1 3.93Å; M202-F215 HydrophobicContact CE-CD2 4.17Å; M202-F215 HydrophobicContact CE-CE1 3.8Å; M202-F215 HydrophobicContact CE-CE2 4.06Å; M202-F215 HydrophobicContact CE-CG 4.09Å; M202-F215 HydrophobicContact CE-CZ 3.85Å; M206-F215 HydrophobicContact CB-CD2 4.3Å; M206-F215 HydrophobicContact CE-CE2 4.36Å; M206-F215 HydrophobicContact CG-CD2 4.3Å; M206-F215 HydrophobicContact SD-CD2 3.64Å; M206-F215 HydrophobicContact SD-CE2 3.76Å; T207-F215 CarbonylContact O-C 3.58Å; T207-F215 VanDerWaalsContact O-CA 3.26Å; T207-F215 WeakPolarHBondContact O-CA 3.47Å; F208-F215 HydrophobicContact CD1-CB 3.83Å; F208-F215 HydrophobicContact CE1-CB 3.91Å; F208-F215 HydrophobicContact CG-CB 4.22Å; F208-F215 HydrophobicContact CZ-CB 4.35Å; F215-S223 CarbonylContact O-C 3.6Å; F215-S223 WeakPolarHBondContact O-CA 3.38Å; F215-T224 HydrophobicContact CD1-CG2 4.44Å; F215-T224 WeakPolarHBondContact CD1-O 3.09Å; F215-T224 VanDerWaalsContact CE1-CB 3.49Å; F215-T224 HydrophobicContact CE1-CG2 3.5Å; F215-T224 VanDerWaalsContact CE1-CG2 3.5Å; F215-T224 HydrophobicContact CE2-CG2 4.35Å; F215-T224 HydrophobicContact CZ-CG2 3.45Å; F215-T224 VanDerWaalsContact CZ-CG2 3.45Å; F215-T224 PolarHBondContact N-O 3.31Å; F215-T224 PolarHBondContact O-N 3.5Å; F215-V226 HydrophobicContact CD1-CG2 3.79Å
216	R	98.1	Very high	97.3	Very high	120 Å²	120	49 Å²	49	45%	0.453	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	127	173.1	-173.9	176.1	-62.9	-90.2	5.6	109.2	T207 F209 S221	T207-R216 PolarHBondContact N-O 3.18Å; T207-R216 PolarHBondContact O-N 2.96Å; F209-R216 HydrophobicContact CE1-CB 4.19Å; R216-S221 PolarHBondContact NH1-O 2.96Å
217	C	98.3	Very high	97.3	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.26	C	S	.	.			trans	-77.7	127.2	178.8	-177.8	0	0	0	0	111.2	C195 C198 M206 F219 S221 V222	C195-C217 HydrophobicContact CB-CB 3.97Å; C198-C217 PolarHBondContact SG-SG 2.78Å; M206-C217 HydrophobicContact SD-CB 4.29Å; C217-F219 PolarHBondContact O-N 3.19Å; C217-S221 WeakPolarHBondContact O-CA 3.32Å; C217-S221 PolarHBondContact O-N 3.44Å; C217-V222 PolarHBondContact N-O 2.77Å
218	P	96.8	Very high	97.2	Very high	22 Å²	22	55 Å²	55	14%	0.143	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-18.8	-179.4	30.8	-36.4	0	0	0	112.9	F205 M206 Y538	F205-P218 HydrophobicContact CB-CB 4.21Å; F205-P218 HydrophobicContact CB-CG 3.79Å; M206-P218 WeakPolarHBondContact SD-CD 3.45Å; M206-P218 HydrophobicContact SD-CG 4.44Å; P218-Y538 HydrophobicContact CB-CD1 4.33Å; P218-Y538 HydrophobicContact CB-CD2 3.61Å; P218-Y538 HydrophobicContact CB-CE1 4.32Å; P218-Y538 HydrophobicContact CB-CE2 3.62Å; P218-Y538 HydrophobicContact CB-CG 3.98Å; P218-Y538 HydrophobicContact CG-CG 4.5Å
219	F	97.2	Very high	97.1	Very high	6 Å²	6	61 Å²	61	3%	0.026	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-33.3	-178.6	-58.4	-85.1	0	0	0	113.4	A200 C217 S491 Q492 Q540	A200-F219 HydrophobicContact CB-CD2 3.41Å; A200-F219 VanDerWaalsContact CB-CD2 3.41Å; A200-F219 HydrophobicContact CB-CE2 3.76Å; A200-F219 HydrophobicContact CB-CG 4.12Å; C217-F219 PolarHBondContact O-N 3.19Å; F219-S491 CarbonylContact O-C 3.5Å; F219-Q492 PolarHBondContact O-N 3.29Å; F219-Q540 HydrophobicContact CE1-CB 3.89Å; F219-Q540 HydrophobicContact CE2-CB 4.38Å; F219-Q540 HydrophobicContact CZ-CB 3.56Å
220	C	96.4	Very high	97.1	Very high	16 Å²	16	58 Å²	58	11%	0.108	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-137.1	6.2	-173.9	69.9	0	0	0	0	114.5	C195 C198 V222	C195-C220 VanDerWaalsContact SG-SG 3.62Å; C198-C220 HydrophobicContact CB-CB 4.04Å; C198-C220 VanDerWaalsContact SG-SG 3.6Å; C220-V222 PolarHBondContact O-N 2.85Å
221	S	95.7	Very high	97.1	Very high	65 Å²	65	56.9 Å²	56.9	46%	0.455	28%	0.28	S	S	.	.			trans	61.2	7.5	177.5	-58.6	0	0	0	0	116.4	R216 C217	R216-S221 PolarHBondContact NH1-O 2.96Å; C217-S221 WeakPolarHBondContact O-CA 3.32Å; C217-S221 PolarHBondContact O-N 3.44Å
222	V	97.6	Very high	97.2	Very high	12 Å²	12	55.6 Å²	55.6	7%	0.073	26%	0.264	C	S	.	.			trans	-75.9	137.9	-179.8	172.2	0	0	0	0	112.3	H196 R197 C217 C220	H196-V222 WeakPolarHBondContact CE1-CG1 3.21Å; H196-V222 WeakPolarHBondContact NE2-CG1 3.32Å; R197-V222 HydrophobicContact CB-CB 4.37Å; R197-V222 HydrophobicContact CB-CG1 4.29Å; R197-V222 HydrophobicContact CB-CG2 3.93Å; R197-V222 VanDerWaalsContact CD-CG2 3.5Å; R197-V222 HydrophobicContact CG-CG2 4.3Å; R197-V222 VanDerWaalsContact NH1-CG2 3.31Å; C217-V222 PolarHBondContact N-O 2.77Å; C220-V222 PolarHBondContact O-N 2.85Å
223	S	98.2	Very high	97.2	Very high	38 Å²	38	61.1 Å²	61.1	27%	0.266	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	128.3	166.5	174.4	0	0	0	0	111.2	H196 F209 F215	H196-S223 PolarHBondContact NE2-O 3.23Å; F209-S223 VanDerWaalsContact CZ-OG 3.3Å; F209-S223 WeakPolarHBondContact CZ-OG 3.35Å; F215-S223 CarbonylContact O-C 3.6Å; F215-S223 WeakPolarHBondContact O-CA 3.38Å
224	T	98.4	Very high	97.2	Very high	11 Å²	11	55.5 Å²	55.5	7%	0.067	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	138.6	173.5	-54.7	0	0	0	0	109.4	H196 R214 F215	H196-T224 HydrophobicContact CB-CG2 4.39Å; H196-T224 PolarHBondContact CD2-OG1 3.45Å; H196-T224 PolarHBondContact N-OG1 3.2Å; R214-T224 CarbonylContact C-O 3.56Å; R214-T224 VanDerWaalsContact CA-O 3.31Å; R214-T224 WeakPolarHBondContact CA-O 3.38Å; F215-T224 HydrophobicContact CD1-CG2 4.44Å; F215-T224 WeakPolarHBondContact CD1-O 3.09Å; F215-T224 VanDerWaalsContact CE1-CB 3.49Å; F215-T224 HydrophobicContact CE1-CG2 3.5Å; F215-T224 VanDerWaalsContact CE1-CG2 3.5Å; F215-T224 HydrophobicContact CE2-CG2 4.35Å; F215-T224 HydrophobicContact CZ-CG2 3.45Å; F215-T224 VanDerWaalsContact CZ-CG2 3.45Å; F215-T224 PolarHBondContact N-O 3.31Å; F215-T224 PolarHBondContact O-N 3.5Å
225	E	98.3	Very high	97	Very high	142 Å²	142	53 Å²	53	66%	0.664	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	139.2	174.6	-172.8	168.3	-174.9	0	0	110.7
226	V	98.1	Very high	96.7	Very high	10 Å²	10	61.8 Å²	61.8	6%	0.061	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-81.8	126	179.3	174.8	0	0	0	0	108.8	F208 G212 R213 F215 Y230 F231	F208-V226 HydrophobicContact CD1-CG2 4.08Å; F208-V226 HydrophobicContact CE1-CG2 3.87Å; G212-V226 WeakPolarHBondContact O-CG2 3.4Å; R213-V226 WeakPolarHBondContact O-CB 3.49Å; R213-V226 PolarHBondContact O-N 2.84Å; F215-V226 HydrophobicContact CD1-CG2 3.79Å; V226-Y230 HydrophobicContact CG1-CD1 4.06Å; V226-F231 HydrophobicContact CG1-CB 4.26Å
227	P	97.3	Very high	96.3	Very high	42 Å²	42	60.1 Å²	60.1	27%	0.273	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-56.1	141	173.7	-25	34.5	0	0	0	111.7	L190 V193 Q229 Y230 F231	L190-P227 HydrophobicContact CD1-CB 3.91Å; L190-P227 HydrophobicContact CD1-CG 4.16Å; L190-P227 HydrophobicContact CD2-CB 4.4Å; V193-P227 HydrophobicContact CG1-CG 4.47Å; V193-P227 HydrophobicContact CG2-CG 4.24Å; P227-Q229 PolarHBondContact O-N 3.28Å; P227-Y230 CarbonylContact O-C 3.48Å; P227-Y230 WeakPolarHBondContact O-CA 3.41Å; P227-Y230 PolarHBondContact O-N 2.97Å; P227-F231 PolarHBondContact O-N 2.81Å; P227-F231 VanDerWaalsContact O-N 3.09Å
228	E	95.6	Very high	95.9	Very high	184 Å²	184	61.8 Å²	61.8	86%	0.86	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-53.9	-40.7	-176.2	-173.3	175.9	-172.4	0	0	112.6	Y230 F231	E228-Y230 PolarHBondContact O-N 2.97Å; E228-F231 WeakPolarHBondContact O-CB 3.24Å; E228-F231 PolarHBondContact O-N 3.31Å
229	Q	94.9	Very high	95.6	Very high	151 Å²	151	68.3 Å²	68.3	71%	0.706	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-67.5	-19.5	178.5	-62.4	148.1	3.7	0	0	113.7	L190 P227	L190-Q229 HydrophobicContact CD2-CB 4.38Å; P227-Q229 PolarHBondContact O-N 3.28Å
230	Y	96.7	Very high	95.5	Very high	1 Å²	1	68.5 Å²	68.5	0%	0.004	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-104.8	-7.6	-179.5	-167.4	-113.3	0	0	0	112.9	M187 V193 M202 V226 P227 E228 R240 R246 E248 L249	M187-Y230 HydrophobicContact CE-CD2 4.03Å; M187-Y230 HydrophobicContact CE-CE2 3.45Å; M187-Y230 VanDerWaalsContact CE-CE2 3.45Å; M187-Y230 HydrophobicContact SD-CD2 4.27Å; M187-Y230 HydrophobicContact SD-CE2 4.27Å; V193-Y230 HydrophobicContact CB-CD1 4.47Å; V193-Y230 HydrophobicContact CG1-CD1 4.48Å; V193-Y230 HydrophobicContact CG2-CD1 3.87Å; V193-Y230 HydrophobicContact CG2-CD2 4.23Å; V193-Y230 HydrophobicContact CG2-CE1 4.33Å; V193-Y230 HydrophobicContact CG2-CG 3.82Å; M202-Y230 HydrophobicContact CE-CE1 4.1Å; M202-Y230 HydrophobicContact CG-CE1 4.18Å; M202-Y230 HydrophobicContact SD-CE1 4.48Å; V226-Y230 HydrophobicContact CG1-CD1 4.06Å; P227-Y230 CarbonylContact O-C 3.48Å; P227-Y230 WeakPolarHBondContact O-CA 3.41Å; P227-Y230 PolarHBondContact O-N 2.97Å; E228-Y230 PolarHBondContact O-N 2.97Å; Y230-R240 VanDerWaalsContact CD1-NH1 3.34Å; Y230-R240 PolarHBondContact O-NH1 3.23Å; Y230-R240 PolarHBondContact O-NH2 3.41Å; Y230-R246 VanDerWaalsContact CD2-CZ 3.42Å; Y230-R246 VanDerWaalsContact CD2-NH2 3.33Å; Y230-R246 PolarHBondContact O-NH1 3.06Å; Y230-E248 VanDerWaalsContact CE2-OE1 3.29Å; Y230-E248 WeakPolarHBondContact CE2-OE1 3.48Å; Y230-E248 WeakPolarHBondContact OH-CG 3.43Å; Y230-E248 PolarHBondContact OH-OE1 3.25Å; Y230-L249 WeakPolarHBondContact OH-CD2 3.24Å
231	F	97.2	Very high	95.5	Very high	69 Å²	69	73 Å²	73	30%	0.303	37%	0.372	S	S	.	.			trans	-61.5	143	-176	172.4	-102	0	0	0	112.3	R213 V226 P227 E228 H233	R213-F231 HydrophobicContact CG-CD2 4.18Å; R213-F231 HydrophobicContact CG-CE2 3.67Å; R213-F231 HydrophobicContact CG-CZ 4.48Å; V226-F231 HydrophobicContact CG1-CB 4.26Å; P227-F231 PolarHBondContact O-N 2.81Å; P227-F231 VanDerWaalsContact O-N 3.09Å; E228-F231 WeakPolarHBondContact O-CB 3.24Å; E228-F231 PolarHBondContact O-N 3.31Å; F231-H233 AromaticContact CE1-CE1 3.79Å; F231-H233 AromaticContact CE1-NE2 3.78Å; F231-H233 AromaticContact CZ-CE1 3.71Å; F231-H233 AromaticContact CZ-ND1 3.73Å
232	S	96.8	Very high	95.5	Very high	14 Å²	14	70.8 Å²	70.8	10%	0.098	36%	0.355	C	S	.	.			trans	-154.2	150.4	172	-178.6	0	0	0	0	109	R240 I241 D242	S232-R240 VanDerWaalsContact CB-NH2 3.25Å; S232-I241 VanDerWaalsContact OG-CG1 3.23Å; S232-I241 WeakPolarHBondContact OG-CG1 3.33Å; S232-D242 WeakPolarHBondContact CB-OD1 3.46Å; S232-D242 VanDerWaalsContact OG-CG 3.25Å; S232-D242 PolarHBondContact OG-OD1 3.08Å
233	H	97.1	Very high	95.4	Very high	116 Å²	116	71.2 Å²	71.2	54%	0.537	36%	0.36	S	S	.	.			trans	-72.2	154.7	-179.2	-69.1	-76.5	0	0	0	112	F231 I241	F231-H233 AromaticContact CE1-CE1 3.79Å; F231-H233 AromaticContact CE1-NE2 3.78Å; F231-H233 AromaticContact CZ-CE1 3.71Å; F231-H233 AromaticContact CZ-ND1 3.73Å; H233-I241 HydrophobicContact CB-CD1 4.32Å; H233-I241 PolarHBondContact O-N 2.85Å
234	L	97	Very high	95.2	Very high	39 Å²	39	76.6 Å²	76.6	20%	0.204	38%	0.382	C	S	.	.	B	Isolated β-bridge	trans	-87.5	145.1	168.8	-53.3	179.9	0	0	0	110.5	F208 R239 R240	F208-L234 HydrophobicContact CB-CD1 4.34Å; F208-L234 HydrophobicContact CB-CD2 3.6Å; F208-L234 HydrophobicContact CG-CD2 4.46Å; L234-R239 CarbonylContact C-O 3.47Å; L234-R239 VanDerWaalsContact CA-O 3.25Å; L234-R239 WeakPolarHBondContact CA-O 3.18Å; L234-R240 HydrophobicContact CD2-CB 4.41Å; L234-R240 HydrophobicContact CD2-CG 3.62Å
235	D	93.4	Very high	95	Very high	54 Å²	54	83.9 Å²	83.9	29%	0.289	42%	0.416	S	S	.	.			trans	-76.9	-178.9	166.8	70.6	17.3	0	0	0	111.5	T237 G238 R239 I241	D235-T237 VanDerWaalsContact CG-OG1 3.32Å; D235-T237 PolarHBondContact O-N 2.69Å; D235-T237 VanDerWaalsContact O-N 3.17Å; D235-T237 VanDerWaalsContact OD1-CA 3.26Å; D235-T237 WeakPolarHBondContact OD1-CA 3.47Å; D235-T237 WeakPolarHBondContact OD1-CB 3.45Å; D235-T237 PolarHBondContact OD1-N 2.95Å; D235-T237 PolarHBondContact OD1-OG1 2.68Å; D235-T237 PolarHBondContact OD2-OG1 2.69Å; D235-G238 PolarHBondContact O-N 2.98Å; D235-G238 VanDerWaalsContact O-N 3.09Å; D235-G238 PolarHBondContact OD1-N 3.37Å; D235-R239 VanDerWaalsContact CG-O 3.31Å; D235-R239 PolarHBondContact N-O 3.18Å; D235-R239 PolarHBondContact OD1-N 3.3Å; D235-I241 HydrophobicContact CB-CG2 4.16Å
236	H	91	Very high	95	Very high	185 Å²	185	79.7 Å²	79.7	86%	0.856	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-13.3	179	64	-80.7	0	0	0	114
237	T	90.9	Very high	94.9	Very high	85 Å²	85	80.4 Å²	80.4	52%	0.521	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-1.9	175.9	75.1	0	0	0	0	112.9	D235 R239	D235-T237 VanDerWaalsContact CG-OG1 3.32Å; D235-T237 PolarHBondContact O-N 2.69Å; D235-T237 VanDerWaalsContact O-N 3.17Å; D235-T237 VanDerWaalsContact OD1-CA 3.26Å; D235-T237 WeakPolarHBondContact OD1-CA 3.47Å; D235-T237 WeakPolarHBondContact OD1-CB 3.45Å; D235-T237 PolarHBondContact OD1-N 2.95Å; D235-T237 PolarHBondContact OD1-OG1 2.68Å; D235-T237 PolarHBondContact OD2-OG1 2.69Å; T237-R239 VanDerWaalsContact C-N 3.3Å
238	G	89.2	Confident	94.9	Very high	36 Å²	36	78.4 Å²	78.4	37%	0.371	39%	0.386	S	S	.	.	S	Bend	trans	80.8	8.6	-176.4	0	0	0	0	0	113.9	D235	D235-G238 PolarHBondContact O-N 2.98Å; D235-G238 VanDerWaalsContact O-N 3.09Å; D235-G238 PolarHBondContact OD1-N 3.37Å
239	R	91.2	Very high	95	Very high	159 Å²	159	70.5 Å²	70.5	60%	0.6	35%	0.349	S	S	*	.			trans	-89.4	149.5	173.4	-68.5	-177.1	175.8	-168.2	-1.6	109.7	L234 D235 T237	L234-R239 CarbonylContact C-O 3.47Å; L234-R239 VanDerWaalsContact CA-O 3.25Å; L234-R239 WeakPolarHBondContact CA-O 3.18Å; D235-R239 VanDerWaalsContact CG-O 3.31Å; D235-R239 PolarHBondContact N-O 3.18Å; D235-R239 PolarHBondContact OD1-N 3.3Å; T237-R239 VanDerWaalsContact C-N 3.3Å
240	R	94.2	Very high	95.1	Very high	10 Å²	10	65.4 Å²	65.4	4%	0.038	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-66.8	137	172.8	-77.1	-179.5	57.7	151.1	7.2	110.7	F208 Y230 S232 L234 D242 A243	F208-R240 HydrophobicContact CB-CG 4.36Å; F208-R240 HydrophobicContact CD1-CG 4.2Å; F208-R240 HydrophobicContact CD2-CG 3.95Å; F208-R240 VanDerWaalsContact CE2-CD 3.49Å; F208-R240 HydrophobicContact CE2-CG 4.29Å; F208-R240 HydrophobicContact CG-CG 3.91Å; F208-R240 VanDerWaalsContact CZ-CD 3.43Å; Y230-R240 VanDerWaalsContact CD1-NH1 3.34Å; Y230-R240 PolarHBondContact O-NH1 3.23Å; Y230-R240 PolarHBondContact O-NH2 3.41Å; S232-R240 VanDerWaalsContact CB-NH2 3.25Å; L234-R240 HydrophobicContact CD2-CB 4.41Å; L234-R240 HydrophobicContact CD2-CG 3.62Å; R240-D242 WeakPolarHBondContact CB-OD1 3.15Å; R240-D242 IonicContact CZ-OD1 3.5Å; R240-D242 IonicContact CZ-OD2 3.68Å; R240-D242 IonicContact NE-OD1 2.95Å; R240-D242 PolarHBondContact NE-OD1 2.88Å; R240-D242 IonicContact NE-OD2 3.88Å; R240-D242 IonicContact NH2-OD1 3.21Å; R240-D242 PolarHBondContact NH2-OD1 2.95Å; R240-D242 IonicContact NH2-OD2 2.75Å; R240-D242 PolarHBondContact NH2-OD2 2.95Å; R240-D242 PolarHBondContact O-N 2.86Å; R240-A243 HydrophobicContact CB-CB 4.36Å; R240-A243 VanDerWaalsContact O-CB 3.22Å; R240-A243 WeakPolarHBondContact O-CB 3.42Å; R240-A243 PolarHBondContact O-N 3.45Å; R240-A243 VanDerWaalsContact O-N 3.13Å
241	I	96	Very high	95.1	Very high	110 Å²	110	66.2 Å²	66.2	56%	0.564	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-27.5	-179.6	60.1	173.2	0	0	0	113.2	S232 H233 D235	S232-I241 VanDerWaalsContact OG-CG1 3.23Å; S232-I241 WeakPolarHBondContact OG-CG1 3.33Å; H233-I241 HydrophobicContact CB-CD1 4.32Å; H233-I241 PolarHBondContact O-N 2.85Å; D235-I241 HydrophobicContact CB-CG2 4.16Å
242	D	95.9	Very high	95.2	Very high	18 Å²	18	63 Å²	63	10%	0.096	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	10.6	-179.5	64.1	-34.3	0	0	0	113	S232 R240 M244 E245 R246	S232-D242 WeakPolarHBondContact CB-OD1 3.46Å; S232-D242 VanDerWaalsContact OG-CG 3.25Å; S232-D242 PolarHBondContact OG-OD1 3.08Å; R240-D242 WeakPolarHBondContact CB-OD1 3.15Å; R240-D242 IonicContact CZ-OD1 3.5Å; R240-D242 IonicContact CZ-OD2 3.68Å; R240-D242 IonicContact NE-OD1 2.95Å; R240-D242 PolarHBondContact NE-OD1 2.88Å; R240-D242 IonicContact NE-OD2 3.88Å; R240-D242 IonicContact NH2-OD1 3.21Å; R240-D242 PolarHBondContact NH2-OD1 2.95Å; R240-D242 IonicContact NH2-OD2 2.75Å; R240-D242 PolarHBondContact NH2-OD2 2.95Å; R240-D242 PolarHBondContact O-N 2.86Å; D242-M244 VanDerWaalsContact C-N 3.27Å; D242-M244 PolarHBondContact O-N 2.66Å; D242-E245 PolarHBondContact O-N 3.43Å; D242-E245 VanDerWaalsContact O-N 3.08Å; D242-R246 PolarHBondContact O-N 3.22Å; D242-R246 WeakPolarHBondContact OD2-CD 3.27Å; D242-R246 IonicContact OD2-CZ 2.81Å; D242-R246 IonicContact OD2-NE 2.72Å; D242-R246 IonicContact OD2-NH1 3.24Å; D242-R246 PolarHBondContact OD2-NH1 2.94Å
243	A	94.9	Very high	95.3	Very high	22 Å²	22	62.3 Å²	62.3	18%	0.182	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-35.8	-173.5	0	0	0	0	0	113.4	R240 L249 H250	R240-A243 HydrophobicContact CB-CB 4.36Å; R240-A243 VanDerWaalsContact O-CB 3.22Å; R240-A243 WeakPolarHBondContact O-CB 3.42Å; R240-A243 PolarHBondContact O-N 3.45Å; R240-A243 VanDerWaalsContact O-N 3.13Å; A243-L249 HydrophobicContact CB-CB 4.39Å; A243-H250 PolarHBondContact O-CD2 3.4Å
244	M	94.6	Very high	95.3	Very high	150 Å²	150	56.8 Å²	56.8	74%	0.739	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-12.1	180	-62.7	-59.1	-67.5	0	0	113.7	D242 H250	D242-M244 VanDerWaalsContact C-N 3.27Å; D242-M244 PolarHBondContact O-N 2.66Å; M244-H250 HydrophobicContact SD-CB 4.16Å
245	E	95.4	Very high	95.4	Very high	164 Å²	164	55.2 Å²	55.2	77%	0.766	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-18.7	176.9	-61.9	179.7	-175.7	0	0	111.7	D242	D242-E245 PolarHBondContact O-N 3.43Å; D242-E245 VanDerWaalsContact O-N 3.08Å
246	R	96.6	Very high	95.6	Very high	55 Å²	55	52.7 Å²	52.7	21%	0.208	26%	0.264	C	S	.	.			trans	-112.1	106.3	-173.4	-78	-169.5	144.5	144.2	-5.6	111.4	Y230 D242 E248 L249 H250	Y230-R246 VanDerWaalsContact CD2-CZ 3.42Å; Y230-R246 VanDerWaalsContact CD2-NH2 3.33Å; Y230-R246 PolarHBondContact O-NH1 3.06Å; D242-R246 PolarHBondContact O-N 3.22Å; D242-R246 WeakPolarHBondContact OD2-CD 3.27Å; D242-R246 IonicContact OD2-CZ 2.81Å; D242-R246 IonicContact OD2-NE 2.72Å; D242-R246 IonicContact OD2-NH1 3.24Å; D242-R246 PolarHBondContact OD2-NH1 2.94Å; R246-E248 WeakPolarHBondContact CD-OE1 3.28Å; R246-E248 IonicContact NE-OE1 3.87Å; R246-E248 PolarHBondContact O-N 2.75Å; R246-E248 VanDerWaalsContact O-N 3.08Å; R246-L249 HydrophobicContact CB-CB 4.26Å; R246-L249 HydrophobicContact CB-CD1 3.89Å; R246-L249 HydrophobicContact CB-CG 3.97Å; R246-L249 HydrophobicContact CG-CD1 4.48Å; R246-L249 PolarHBondContact O-N 2.81Å; R246-H250 PolarHBondContact O-CD2 3.34Å
247	P	97.3	Very high	95.9	Very high	24 Å²	24	45 Å²	45	16%	0.156	23%	0.229	C	C	.	.	H	α-helix	trans	-51.2	-37.5	-177.4	-29.6	36.3	0	0	0	114.4	P183 V185 L249 H250 L251	P183-P247 HydrophobicContact CB-CB 4.07Å; P183-P247 HydrophobicContact CB-CG 3.86Å; P183-P247 HydrophobicContact CG-CB 3.54Å; P183-P247 HydrophobicContact CG-CG 3.89Å; V185-P247 HydrophobicContact CG2-CB 3.97Å; V185-P247 HydrophobicContact CG2-CG 4.05Å; P247-L249 PolarHBondContact O-N 3.41Å; P247-H250 PolarHBondContact O-N 3.44Å; P247-L251 HydrophobicContact CB-CD1 4.04Å; P247-L251 WeakPolarHBondContact O-CB 3.46Å; P247-L251 PolarHBondContact O-N 3.14Å
248	E	97.7	Very high	96.1	Very high	1 Å²	1	41 Å²	41	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-68.1	-13.2	-179.6	75	-81.5	-168.1	0	0	114.5	M187 M202 C203 P204 Y230 R246 Y254 Y256	M187-E248 WeakPolarHBondContact CE-OE1 3.23Å; M202-E248 HydrophobicContact CB-CG 4.45Å; M202-E248 HydrophobicContact CG-CG 4.04Å; C203-E248 CarbonylContact C-O 3.52Å; C203-E248 WeakPolarHBondContact CA-O 3.29Å; P204-E248 WeakPolarHBondContact CD-O 3.41Å; Y230-E248 VanDerWaalsContact CE2-OE1 3.29Å; Y230-E248 WeakPolarHBondContact CE2-OE1 3.48Å; Y230-E248 WeakPolarHBondContact OH-CG 3.43Å; Y230-E248 PolarHBondContact OH-OE1 3.25Å; R246-E248 WeakPolarHBondContact CD-OE1 3.28Å; R246-E248 IonicContact NE-OE1 3.87Å; R246-E248 PolarHBondContact O-N 2.75Å; R246-E248 VanDerWaalsContact O-N 3.08Å; E248-Y254 HydrophobicContact CB-CD1 4.46Å; E248-Y254 HydrophobicContact CB-CD2 3.93Å; E248-Y254 HydrophobicContact CB-CE1 4.21Å; E248-Y254 HydrophobicContact CB-CE2 3.59Å; E248-Y254 HydrophobicContact CB-CG 4.37Å; E248-Y256 WeakPolarHBondContact CB-OH 3.34Å; E248-Y256 WeakPolarHBondContact CG-OH 3.43Å
249	L	97.3	Very high	96.4	Very high	18 Å²	18	40.2 Å²	40.2	9%	0.094	19%	0.193	C	C	.	.	H	α-helix	trans	-100.3	-13.5	-179.7	-63	-176.5	0	0	0	113.1	M202 P204 F208 Y230 A243 R246 P247	M202-L249 HydrophobicContact CG-CD2 3.75Å; M202-L249 HydrophobicContact SD-CD2 3.87Å; P204-L249 WeakPolarHBondContact CA-O 3.34Å; F208-L249 HydrophobicContact CE2-CD2 3.98Å; F208-L249 HydrophobicContact CZ-CD2 4.07Å; Y230-L249 WeakPolarHBondContact OH-CD2 3.24Å; A243-L249 HydrophobicContact CB-CB 4.39Å; R246-L249 HydrophobicContact CB-CB 4.26Å; R246-L249 HydrophobicContact CB-CD1 3.89Å; R246-L249 HydrophobicContact CB-CG 3.97Å; R246-L249 HydrophobicContact CG-CD1 4.48Å; R246-L249 PolarHBondContact O-N 2.81Å; P247-L249 PolarHBondContact O-N 3.41Å
250	H	96.2	Very high	96.6	Very high	43 Å²	43	38.2 Å²	38.2	20%	0.199	19%	0.189	C	C	.	.	H	α-helix	trans	-136.5	-9.5	-176.4	77.7	81	0	0	0	115.5	G137 A243 M244 R246 P247	G137-H250 WeakPolarHBondContact CA-O 3.49Å; G137-H250 PolarHBondContact N-O 2.76Å; A243-H250 PolarHBondContact O-CD2 3.4Å; M244-H250 HydrophobicContact SD-CB 4.16Å; R246-H250 PolarHBondContact O-CD2 3.34Å; P247-H250 PolarHBondContact O-N 3.44Å
251	L	97.9	Very high	96.6	Very high	19 Å²	19	44.8 Å²	44.8	10%	0.099	22%	0.22	C	C	.	.			trans	-110.2	145.4	174.7	-57.2	-179.7	0	0	0	111.3	D135 P183 P204 P247 Y254	D135-L251 HydrophobicContact CB-CD2 4.22Å; P183-L251 HydrophobicContact CG-CD1 3.65Å; P204-L251 WeakPolarHBondContact CD-O 3.42Å; P204-L251 WeakPolarHBondContact CG-O 3.39Å; P247-L251 HydrophobicContact CB-CD1 4.04Å; P247-L251 WeakPolarHBondContact O-CB 3.46Å; P247-L251 PolarHBondContact O-N 3.14Å; L251-Y254 HydrophobicContact CB-CD1 4.47Å; L251-Y254 WeakPolarHBondContact O-CD1 3.4Å; L251-Y254 VanDerWaalsContact O-CE1 3.24Å; L251-Y254 WeakPolarHBondContact O-CE1 3.34Å
252	G	97.9	Very high	96.5	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.196	C	C	.	.	S	Bend	trans	-75.4	-27.7	173.3	0	0	0	0	0	113	D135 G137 H557 N558	D135-G252 VanDerWaalsContact CG-N 3.25Å; D135-G252 PolarHBondContact OD1-N 3.13Å; D135-G252 WeakPolarHBondContact OD2-CA 3.48Å; D135-G252 PolarHBondContact OD2-N 3.18Å; G137-G252 WeakPolarHBondContact O-CA 3.37Å; G137-G252 PolarHBondContact O-N 2.88Å; G252-H557 CarbonylContact O-C 3.56Å; G252-H557 WeakPolarHBondContact O-CA 3.47Å; G252-N558 PolarHBondContact O-N 3.32Å; G252-N558 PolarHBondContact O-ND2 3.42Å
253	S	98.5	Very high	96.3	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.007	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	131.5	176.9	-51.5	0	0	0	0	113.8	D135 C139 L182 I556 H557	D135-S253 PolarHBondContact OD2-N 2.96Å; C139-S253 WeakPolarHBondContact CA-OG 3.42Å; C139-S253 WeakPolarHBondContact CB-OG 3.34Å; L182-S253 VanDerWaalsContact CD2-CB 3.44Å; S253-I556 VanDerWaalsContact CA-O 3.29Å; S253-I556 WeakPolarHBondContact CA-O 3.26Å; S253-H557 WeakPolarHBondContact CB-ND1 3.32Å; S253-H557 PolarHBondContact OG-ND1 3.14Å
254	Y	98.3	Very high	96	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	166.6	177.7	46.6	-86.3	0	0	0	110.2	M202 C203 E248 L251 Y256 I556 N558	M202-Y254 PolarHBondContact O-OH 3.05Å; C203-Y254 WeakPolarHBondContact CA-OH 3.05Å; C203-Y254 WeakPolarHBondContact CB-OH 3.46Å; E248-Y254 HydrophobicContact CB-CD1 4.46Å; E248-Y254 HydrophobicContact CB-CD2 3.93Å; E248-Y254 HydrophobicContact CB-CE1 4.21Å; E248-Y254 HydrophobicContact CB-CE2 3.59Å; E248-Y254 HydrophobicContact CB-CG 4.37Å; L251-Y254 HydrophobicContact CB-CD1 4.47Å; L251-Y254 WeakPolarHBondContact O-CD1 3.4Å; L251-Y254 VanDerWaalsContact O-CE1 3.24Å; L251-Y254 WeakPolarHBondContact O-CE1 3.34Å; Y254-Y256 HydrophobicContact CD2-CD2 4.46Å; Y254-Y256 HydrophobicContact CD2-CE2 4.17Å; Y254-Y256 HydrophobicContact CE2-CD2 4.3Å; Y254-Y256 AromaticContact CE2-CE2 3.68Å; Y254-Y256 HydrophobicContact CE2-CE2 3.68Å; Y254-I556 HydrophobicContact CD2-CB 4.22Å; Y254-I556 HydrophobicContact CD2-CG1 4.35Å; Y254-I556 HydrophobicContact CE2-CB 3.77Å; Y254-I556 HydrophobicContact CE2-CG1 3.89Å; Y254-I556 HydrophobicContact CE2-CG2 4.14Å; Y254-I556 PolarHBondContact N-O 2.84Å; Y254-I556 PolarHBondContact O-N 3.17Å; Y254-N558 VanDerWaalsContact CE1-ND2 3.3Å; Y254-N558 WeakPolarHBondContact CE1-ND2 3.31Å; Y254-N558 PolarHBondContact OH-ND2 3.38Å
255	E	98.1	Very high	95.8	Very high	6 Å²	6	43.6 Å²	43.6	3%	0.028	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	150	172.2	-57.9	-164.8	154	0	0	111.4	L182 P183 V184 V185 F545 R553 L554 R555	L182-E255 HydrophobicContact CB-CG 4.34Å; L182-E255 HydrophobicContact CD1-CG 4.39Å; P183-E255 PolarHBondContact O-N 3.4Å; V184-E255 HydrophobicContact CG2-CB 4.29Å; V185-E255 WeakPolarHBondContact CB-O 3.46Å; V185-E255 PolarHBondContact N-O 2.81Å; E255-F545 WeakPolarHBondContact OE1-CZ 3.22Å; E255-R553 VanDerWaalsContact OE2-CD 3.23Å; E255-R553 WeakPolarHBondContact OE2-CD 3.47Å; E255-R553 IonicContact OE2-CZ 2.8Å; E255-R553 IonicContact OE2-NE 3.6Å; E255-R553 IonicContact OE2-NH1 2.79Å; E255-R553 PolarHBondContact OE2-NH1 2.81Å; E255-L554 CarbonylContact C-O 3.54Å; E255-L554 WeakPolarHBondContact CA-O 3.24Å; E255-R555 HydrophobicContact CG-CB 4.15Å; E255-R555 HydrophobicContact CG-CG 4.33Å; E255-R555 IonicContact OE1-CZ 2.7Å; E255-R555 IonicContact OE1-NE 3.36Å; E255-R555 PolarHBondContact OE1-NE 2.98Å; E255-R555 IonicContact OE1-NH2 2.7Å; E255-R555 PolarHBondContact OE1-NH2 3.33Å
256	Y	98	Very high	95.6	Very high	1 Å²	1	37.5 Å²	37.5	0%	0.004	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	144.1	163	-75.3	-71	0	0	0	110.9	V185 M187 P192 E248 Y254 A258 R553 L554 I556	V185-Y256 HydrophobicContact CB-CD1 3.73Å; V185-Y256 HydrophobicContact CB-CE1 3.84Å; V185-Y256 HydrophobicContact CG1-CD1 3.87Å; V185-Y256 HydrophobicContact CG1-CE1 3.6Å; V185-Y256 CarbonylContact O-C 3.48Å; V185-Y256 VanDerWaalsContact O-CA 3.28Å; V185-Y256 WeakPolarHBondContact O-CA 3.38Å; M187-Y256 HydrophobicContact CE-CE1 4.02Å; M187-Y256 HydrophobicContact CG-CD1 4.28Å; M187-Y256 HydrophobicContact CG-CE1 3.98Å; P192-Y256 HydrophobicContact CB-CD1 4.1Å; P192-Y256 HydrophobicContact CB-CD2 3.64Å; P192-Y256 HydrophobicContact CB-CE1 4.21Å; P192-Y256 HydrophobicContact CB-CE2 3.72Å; P192-Y256 HydrophobicContact CB-CG 3.83Å; E248-Y256 WeakPolarHBondContact CB-OH 3.34Å; E248-Y256 WeakPolarHBondContact CG-OH 3.43Å; Y254-Y256 HydrophobicContact CD2-CD2 4.46Å; Y254-Y256 HydrophobicContact CD2-CE2 4.17Å; Y254-Y256 HydrophobicContact CE2-CD2 4.3Å; Y254-Y256 AromaticContact CE2-CE2 3.68Å; Y254-Y256 HydrophobicContact CE2-CE2 3.68Å; Y256-A258 PolarHBondContact O-N 2.87Å; Y256-R553 CarbonylContact O-C 3.3Å; Y256-R553 VanDerWaalsContact O-CA 3.3Å; Y256-R553 WeakPolarHBondContact O-CA 3.45Å; Y256-L554 PolarHBondContact N-O 3.45Å; Y256-L554 PolarHBondContact O-N 3.01Å; Y256-I556 HydrophobicContact CD2-CG1 4.2Å; Y256-I556 HydrophobicContact CE2-CG1 4.46Å
257	V	96.9	Very high	95.4	Very high	23 Å²	23	40.5 Å²	40.5	14%	0.139	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	121.6	156.3	-178	0	0	0	0	107.9	V184 V185 N186 E551	V184-V257 HydrophobicContact CG1-CG2 3.7Å; V185-V257 PolarHBondContact O-N 3.18Å; N186-V257 HydrophobicContact CB-CB 4.27Å; N186-V257 HydrophobicContact CB-CG2 3.81Å; V257-E551 WeakPolarHBondContact CG1-OE1 3.46Å; V257-E551 WeakPolarHBondContact CG2-OE1 3.38Å
258	A	96.4	Very high	95.3	Very high	1 Å²	1	45 Å²	45	1%	0.008	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-82.6	144.7	-178.6	0	0	0	0	0	110.8	Y256 Y262 W268 L544 R552 L554	Y256-A258 PolarHBondContact O-N 2.87Å; A258-Y262 HydrophobicContact CB-CD2 4.1Å; A258-Y262 HydrophobicContact CB-CG 4.06Å; A258-W268 VanDerWaalsContact O-CH2 3.31Å; A258-W268 WeakPolarHBondContact O-CH2 3.36Å; A258-W268 WeakPolarHBondContact O-CZ3 3.49Å; A258-L544 HydrophobicContact CB-CD1 4.19Å; A258-R552 HydrophobicContact CB-CB 4.17Å; A258-R552 HydrophobicContact CB-CG 3.92Å; A258-R552 WeakPolarHBondContact CB-O 3.38Å; A258-R552 PolarHBondContact N-O 3.14Å; A258-L554 HydrophobicContact CB-CD1 4.28Å; A258-L554 HydrophobicContact CB-CG 4.36Å
259	T	96	Very high	95.1	Very high	20 Å²	20	46.4 Å²	46.4	12%	0.123	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-77.2	166.5	174.7	46.4	0	0	0	0	111.5	G188 G191 E261 Y262	G188-T259 WeakPolarHBondContact O-CG2 3.15Å; G191-T259 VanDerWaalsContact CA-CG2 3.45Å; T259-E261 PolarHBondContact O-N 3.21Å; T259-E261 VanDerWaalsContact O-N 3.09Å; T259-E261 WeakPolarHBondContact OG1-CG 3.47Å; T259-E261 PolarHBondContact OG1-OE1 3.23Å; T259-Y262 WeakPolarHBondContact O-CB 3.42Å; T259-Y262 PolarHBondContact O-N 2.97Å; T259-Y262 VanDerWaalsContact OG1-CD2 3.27Å; T259-Y262 WeakPolarHBondContact OG1-CD2 3.39Å; T259-Y262 WeakPolarHBondContact OG1-CE2 3.49Å
260	K	93.7	Very high	94.9	Very high	116 Å²	116	50.7 Å²	50.7	50%	0.504	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-55.6	-28.1	-179.8	-74.7	-172.7	176.1	178.5	0	114.1	Y262 C263 W268	K260-Y262 PolarHBondContact O-N 3.4Å; K260-C263 WeakPolarHBondContact O-CB 3.44Å; K260-C263 PolarHBondContact O-N 3.24Å; K260-W268 HydrophobicContact CB-CZ2 4.45Å; K260-W268 HydrophobicContact CD-CZ2 4.28Å; K260-W268 HydrophobicContact CG-CD2 4.11Å; K260-W268 VanDerWaalsContact CG-CE2 3.46Å; K260-W268 HydrophobicContact CG-CH2 3.85Å; K260-W268 HydrophobicContact CG-CZ2 3.32Å; K260-W268 HydrophobicContact CG-CZ3 4.43Å
261	E	94	Very high	94.8	Very high	148 Å²	148	50 Å²	50	69%	0.692	25%	0.25	S	S	*	.	G	3₁₀ helix	trans	-63.7	-19.1	175.9	53.6	168.5	-158.6	0	0	113.8	T259 C263	T259-E261 PolarHBondContact O-N 3.21Å; T259-E261 VanDerWaalsContact O-N 3.09Å; T259-E261 WeakPolarHBondContact OG1-CG 3.47Å; T259-E261 PolarHBondContact OG1-OE1 3.23Å; E261-C263 VanDerWaalsContact C-N 3.33Å
262	Y	93.8	Very high	94.7	Very high	19 Å²	19	49 Å²	49	8%	0.075	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-89.5	1.2	173.6	-67.8	-87.2	0	0	0	113.3	F26 P192 R194 A258 T259 K260 L544 R552 L554	F26-Y262 HydrophobicContact CE1-CE1 4.19Å; F26-Y262 HydrophobicContact CZ-CD1 4.32Å; F26-Y262 HydrophobicContact CZ-CE1 4.18Å; P192-Y262 HydrophobicContact CG-CE2 4.2Å; R194-Y262 PolarHBondContact NH1-OH 3.13Å; R194-Y262 VanDerWaalsContact NH1-OH 3.11Å; A258-Y262 HydrophobicContact CB-CD2 4.1Å; A258-Y262 HydrophobicContact CB-CG 4.06Å; T259-Y262 WeakPolarHBondContact O-CB 3.42Å; T259-Y262 PolarHBondContact O-N 2.97Å; T259-Y262 VanDerWaalsContact OG1-CD2 3.27Å; T259-Y262 WeakPolarHBondContact OG1-CD2 3.39Å; T259-Y262 WeakPolarHBondContact OG1-CE2 3.49Å; K260-Y262 PolarHBondContact O-N 3.4Å; Y262-L544 HydrophobicContact CD1-CD1 3.96Å; Y262-L544 HydrophobicContact CD1-CD2 4.13Å; Y262-L544 HydrophobicContact CG-CD1 4.19Å; Y262-R552 PolarHBondContact O-NE 2.79Å; Y262-L554 HydrophobicContact CD1-CD1 4.16Å; Y262-L554 HydrophobicContact CE1-CD1 3.89Å; Y262-L554 HydrophobicContact CE2-CD1 4.37Å
263	C	93.5	Very high	94.5	Very high	7 Å²	7	49 Å²	49	5%	0.047	25%	0.245	C	C	.	.	S	Bend	trans	-101.6	145.2	179.9	-56.2	0	0	0	0	110.5	K260 E261 D265 G266 I267 W268	K260-C263 WeakPolarHBondContact O-CB 3.44Å; K260-C263 PolarHBondContact O-N 3.24Å; E261-C263 VanDerWaalsContact C-N 3.33Å; C263-D265 PolarHBondContact O-N 3.33Å; C263-G266 PolarHBondContact O-N 2.93Å; C263-G266 VanDerWaalsContact O-N 3.1Å; C263-I267 WeakPolarHBondContact CB-O 3.42Å; C263-W268 VanDerWaalsContact SG-CZ3 3.54Å
264	K	88.4	Confident	94.4	Very high	117 Å²	117	49 Å²	49	51%	0.509	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-59.4	126.9	177	-67.4	178	179.5	166.7	0	109.1	G266 I267 D483	K264-G266 PolarHBondContact O-N 2.88Å; K264-I267 PolarHBondContact O-N 3.08Å; K264-D483 WeakPolarHBondContact CE-OD1 3.36Å; K264-D483 WeakPolarHBondContact CE-OD2 3.3Å; K264-D483 IonicContact NZ-OD1 3.89Å; K264-D483 PolarHBondContact NZ-OD1 2.86Å; K264-D483 IonicContact NZ-OD2 3.45Å; K264-D483 PolarHBondContact NZ-OD2 2.85Å
265	D	89.7	Confident	94.2	Very high	132 Å²	132	49 Å²	49	71%	0.706	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	54.6	20.7	-177.5	-51.5	-44.1	0	0	0	115.1	C263 I267	C263-D265 PolarHBondContact O-N 3.33Å; D265-I267 HydrophobicContact CB-CD1 4.2Å; D265-I267 HydrophobicContact CB-CG1 4.36Å; D265-I267 PolarHBondContact O-N 3.49Å
266	G	90.8	Very high	94.1	Very high	36 Å²	36	48.8 Å²	48.8	37%	0.371	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	69.9	13.8	-175.8	0	0	0	0	0	114.4	C263 K264	C263-G266 PolarHBondContact O-N 2.93Å; C263-G266 VanDerWaalsContact O-N 3.1Å; K264-G266 PolarHBondContact O-N 2.88Å
267	I	92.9	Very high	93.9	Very high	119 Å²	119	48.8 Å²	48.8	61%	0.61	24%	0.244	S	C	*	.	P	Polyproline II helix	trans	-98.8	126.8	-177.7	-59.1	173.1	0	0	0	109.2	C263 K264 D265	C263-I267 WeakPolarHBondContact CB-O 3.42Å; K264-I267 PolarHBondContact O-N 3.08Å; D265-I267 HydrophobicContact CB-CD1 4.2Å; D265-I267 HydrophobicContact CB-CG1 4.36Å; D265-I267 PolarHBondContact O-N 3.49Å
268	W	94.5	Very high	93.8	Very high	117 Å²	117	47.8 Å²	47.8	44%	0.443	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-60.4	134.1	176	-69.6	127	0	0	0	111.3	A258 K260 C263 R552	A258-W268 VanDerWaalsContact O-CH2 3.31Å; A258-W268 WeakPolarHBondContact O-CH2 3.36Å; A258-W268 WeakPolarHBondContact O-CZ3 3.49Å; K260-W268 HydrophobicContact CB-CZ2 4.45Å; K260-W268 HydrophobicContact CD-CZ2 4.28Å; K260-W268 HydrophobicContact CG-CD2 4.11Å; K260-W268 VanDerWaalsContact CG-CE2 3.46Å; K260-W268 HydrophobicContact CG-CH2 3.85Å; K260-W268 HydrophobicContact CG-CZ2 3.32Å; K260-W268 HydrophobicContact CG-CZ3 4.43Å; C263-W268 VanDerWaalsContact SG-CZ3 3.54Å; W268-R552 HydrophobicContact CZ3-CB 4.38Å
269	P	94.5	Very high	93.7	Very high	31 Å²	31	47.8 Å²	47.8	20%	0.201	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-65.2	155.8	177.1	27.1	-30.2	0	0	0	110.6	T546 G550 R552	P269-T546 HydrophobicContact CB-CG2 3.66Å; P269-T546 HydrophobicContact CG-CG2 3.86Å; P269-G550 VanDerWaalsContact O-O 3.11Å; P269-R552 HydrophobicContact CG-CB 4.06Å
270	Q	93.5	Very high	93.7	Very high	109 Å²	109	46.9 Å²	46.9	51%	0.509	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-96.9	161.2	170.1	-65	-61.9	-50.4	0	0	109.5
271	P	93.9	Very high	93.8	Very high	27 Å²	27	41.3 Å²	41.3	18%	0.175	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-51.4	148.8	172.4	-25.9	34.1	0	0	0	111.9	A313 R398	P271-A313 HydrophobicContact CB-CB 4.04Å; P271-A313 VanDerWaalsContact CB-O 3.3Å; P271-A313 WeakPolarHBondContact CB-O 3.42Å; P271-A313 HydrophobicContact CG-CB 4.21Å; P271-R398 PolarHBondContact O-NE 2.91Å; P271-R398 PolarHBondContact O-NH2 2.64Å
272	P	95.1	Very high	93.8	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-72.8	169	-178.4	31.7	-35.2	0	0	0	112.5	I314 E315 A399 F482 V548	P272-I314 HydrophobicContact CG-CD1 4.13Å; P272-I314 HydrophobicContact CG-CG1 3.98Å; P272-E315 PolarHBondContact O-N 2.95Å; P272-A399 CarbonylContact C-O 3.44Å; P272-A399 WeakPolarHBondContact CA-O 3.48Å; P272-F482 HydrophobicContact CB-CD1 4.11Å; P272-F482 HydrophobicContact CB-CD2 3.51Å; P272-F482 HydrophobicContact CB-CE1 4.23Å; P272-F482 HydrophobicContact CB-CE2 3.68Å; P272-F482 HydrophobicContact CB-CG 3.78Å; P272-F482 HydrophobicContact CB-CZ 4.07Å; P272-F482 HydrophobicContact CG-CD2 3.51Å; P272-F482 HydrophobicContact CG-CE2 3.45Å; P272-F482 VanDerWaalsContact CG-CE2 3.45Å; P272-F482 HydrophobicContact CG-CG 4.29Å; P272-F482 HydrophobicContact CG-CZ 4.19Å; P272-V548 WeakPolarHBondContact CD-O 3.34Å
273	V	94.9	Very high	93.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	137	177.3	-178.9	0	0	0	0	110.8	I275 E315 A317 F352 L393 R398 A399 G400 K401	V273-I275 HydrophobicContact CG1-CG1 4.02Å; V273-E315 CarbonylContact C-O 3.57Å; V273-E315 WeakPolarHBondContact CA-O 3.26Å; V273-E315 WeakPolarHBondContact CG1-O 3.23Å; V273-A317 HydrophobicContact CG1-CB 4.32Å; V273-F352 HydrophobicContact CG1-CD1 3.75Å; V273-F352 HydrophobicContact CG1-CE1 3.83Å; V273-F352 HydrophobicContact CG1-CG 4.17Å; V273-F352 HydrophobicContact CG1-CZ 4.32Å; V273-F352 HydrophobicContact CG2-CD1 4.42Å; V273-F352 HydrophobicContact CG2-CD2 3.85Å; V273-F352 HydrophobicContact CG2-CE1 4.43Å; V273-F352 HydrophobicContact CG2-CE2 3.87Å; V273-F352 HydrophobicContact CG2-CG 4.15Å; V273-F352 HydrophobicContact CG2-CZ 4.16Å; V273-L393 HydrophobicContact CB-CD2 4.03Å; V273-R398 HydrophobicContact CG2-CB 4Å; V273-R398 HydrophobicContact CG2-CG 4.02Å; V273-A399 PolarHBondContact N-O 2.93Å; V273-G400 CarbonylContact O-C 3.58Å; V273-G400 WeakPolarHBondContact O-CA 3.06Å; V273-K401 PolarHBondContact O-N 2.76Å
274	F	95.1	Very high	93.6	Very high	1 Å²	1	40.5 Å²	40.5	0%	0.004	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	119.3	168.5	-74.3	-2.2	0	0	0	110.2	L304 I314 E315 V316 A317 K401 F403 L476 I480 F482	F274-L304 HydrophobicContact CD2-CD2 3.46Å; F274-L304 VanDerWaalsContact CD2-CD2 3.46Å; F274-L304 HydrophobicContact CE2-CD2 3.65Å; F274-I314 HydrophobicContact CB-CG2 4.21Å; F274-I314 HydrophobicContact CD1-CG2 3.84Å; F274-I314 HydrophobicContact CD2-CG2 4.03Å; F274-I314 HydrophobicContact CE1-CD1 4.08Å; F274-I314 HydrophobicContact CE1-CG2 4.24Å; F274-I314 HydrophobicContact CE2-CD1 4.17Å; F274-I314 HydrophobicContact CE2-CG2 4.39Å; F274-I314 HydrophobicContact CG-CG2 3.73Å; F274-I314 HydrophobicContact CZ-CD1 3.79Å; F274-I314 HydrophobicContact CZ-CG2 4.5Å; F274-E315 PolarHBondContact N-O 2.97Å; F274-V316 CarbonylContact O-C 3.51Å; F274-V316 VanDerWaalsContact O-CA 3.3Å; F274-V316 WeakPolarHBondContact O-CA 3.17Å; F274-A317 PolarHBondContact O-N 3.07Å; F274-K401 WeakPolarHBondContact CA-O 3.46Å; F274-K401 HydrophobicContact CD1-CB 3.85Å; F274-K401 HydrophobicContact CE1-CB 3.79Å; F274-K401 HydrophobicContact CE1-CD 4.43Å; F274-F403 HydrophobicContact CB-CD2 4.25Å; F274-F403 HydrophobicContact CB-CE2 3.94Å; F274-F403 AromaticContact CD1-CE2 3.85Å; F274-F403 HydrophobicContact CD1-CE2 3.85Å; F274-F403 AromaticContact CD2-CE2 3.53Å; F274-F403 HydrophobicContact CD2-CE2 3.53Å; F274-F403 AromaticContact CD2-CZ 3.9Å; F274-F403 HydrophobicContact CD2-CZ 3.9Å; F274-F403 HydrophobicContact CE1-CE2 4.15Å; F274-F403 AromaticContact CE2-CE2 3.9Å; F274-F403 HydrophobicContact CE2-CE2 3.9Å; F274-F403 AromaticContact CE2-CZ 3.88Å; F274-F403 HydrophobicContact CE2-CZ 3.88Å; F274-F403 HydrophobicContact CG-CD2 4.3Å; F274-F403 AromaticContact CG-CE2 3.51Å; F274-F403 HydrophobicContact CG-CE2 3.51Å; F274-F403 HydrophobicContact CG-CZ 4.33Å; F274-F403 HydrophobicContact CZ-CE2 4.2Å; F274-F403 HydrophobicContact CZ-CZ 4.26Å; F274-L476 HydrophobicContact CD2-CD2 3.82Å; F274-L476 HydrophobicContact CE2-CD2 3.89Å; F274-I480 HydrophobicContact CZ-CG2 4.46Å; F274-F482 HydrophobicContact CE1-CE1 4.12Å; F274-F482 AromaticContact CE1-CZ 3.59Å; F274-F482 HydrophobicContact CE1-CZ 3.59Å; F274-F482 HydrophobicContact CZ-CZ 4.26Å
275	I	95	Very high	93.8	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	110.6	178.8	-50.8	-173.3	0	0	0	108.2	V273 M277 A317 V319 T392 L393 K401 L402 F403	V273-I275 HydrophobicContact CG1-CG1 4.02Å; I275-M277 HydrophobicContact CG2-CG 3.9Å; I275-M277 PolarHBondContact O-N 3.33Å; I275-A317 CarbonylContact C-O 3.56Å; I275-A317 WeakPolarHBondContact CA-O 3.41Å; I275-A317 HydrophobicContact CB-CB 4.44Å; I275-A317 HydrophobicContact CG1-CB 4.07Å; I275-A317 HydrophobicContact CG2-CB 4.26Å; I275-V319 HydrophobicContact CG2-CB 4.46Å; I275-V319 HydrophobicContact CG2-CG2 3.83Å; I275-T392 HydrophobicContact CD1-CG2 4.07Å; I275-L393 HydrophobicContact CD1-CD2 3.88Å; I275-L393 HydrophobicContact CD1-CG 3.89Å; I275-L393 HydrophobicContact CG1-CD2 4.41Å; I275-K401 PolarHBondContact N-O 3.32Å; I275-L402 HydrophobicContact CB-CD2 3.72Å; I275-L402 HydrophobicContact CD1-CD2 3.79Å; I275-L402 HydrophobicContact CG1-CD2 4.01Å; I275-L402 HydrophobicContact CG2-CD2 4.35Å; I275-F403 PolarHBondContact O-N 3.43Å
276	F	94.7	Very high	94	Very high	1 Å²	1	39 Å²	39	0%	0.004	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	113.5	173.4	-63.2	-73.9	0	0	0	109.5	F293 V316 A317 F318 V319 F403 F405 L476	F276-F293 HydrophobicContact CB-CZ 4.11Å; F276-F293 AromaticContact CD1-CE2 3.98Å; F276-F293 HydrophobicContact CD1-CE2 3.98Å; F276-F293 AromaticContact CD1-CZ 3.65Å; F276-F293 HydrophobicContact CD1-CZ 3.65Å; F276-F293 HydrophobicContact CD2-CZ 4.29Å; F276-F293 HydrophobicContact CE1-CE2 4.11Å; F276-F293 HydrophobicContact CE1-CZ 4.13Å; F276-F293 AromaticContact CG-CZ 3.76Å; F276-F293 HydrophobicContact CG-CZ 3.76Å; F276-V316 HydrophobicContact CD2-CG1 3.38Å; F276-V316 HydrophobicContact CE2-CB 4.37Å; F276-V316 HydrophobicContact CE2-CG1 3.36Å; F276-V316 HydrophobicContact CE2-CG2 4.08Å; F276-A317 PolarHBondContact N-O 3.49Å; F276-F318 HydrophobicContact CB-CD1 3.94Å; F276-F318 HydrophobicContact CB-CE1 4.04Å; F276-F318 HydrophobicContact CD2-CD1 4.45Å; F276-F318 AromaticContact CD2-CE1 3.91Å; F276-F318 HydrophobicContact CD2-CE1 3.91Å; F276-F318 HydrophobicContact CD2-CZ 4.01Å; F276-F318 HydrophobicContact CG-CE1 4.27Å; F276-F318 WeakPolarHBondContact O-CA 3.48Å; F276-V319 PolarHBondContact O-N 3.48Å; F276-V319 VanDerWaalsContact O-O 3.09Å; F276-F403 HydrophobicContact CD1-CB 3.56Å; F276-F403 HydrophobicContact CD1-CD2 4.29Å; F276-F403 AromaticContact CD1-CG 3.91Å; F276-F403 HydrophobicContact CD1-CG 3.91Å; F276-F403 HydrophobicContact CE1-CB 3.96Å; F276-F403 HydrophobicContact CE1-CD1 4.12Å; F276-F403 HydrophobicContact CE1-CD2 4.03Å; F276-F403 AromaticContact CE1-CG 3.78Å; F276-F403 HydrophobicContact CE1-CG 3.78Å; F276-F403 HydrophobicContact CG-CB 4.48Å; F276-F405 HydrophobicContact CD1-CE2 4.06Å; F276-F405 HydrophobicContact CD1-CZ 4.41Å; F276-L476 HydrophobicContact CE1-CD2 4.14Å; F276-L476 HydrophobicContact CZ-CD2 3.91Å
277	M	94.6	Very high	93.9	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	102.8	-175.8	-53.1	-161.6	71.3	0	0	109.9	I275 V319 Y321 A385 L402 F403 V404 F405	I275-M277 HydrophobicContact CG2-CG 3.9Å; I275-M277 PolarHBondContact O-N 3.33Å; M277-V319 CarbonylContact C-O 3.54Å; M277-V319 VanDerWaalsContact CA-O 3.22Å; M277-V319 WeakPolarHBondContact CA-O 3.15Å; M277-V319 HydrophobicContact CE-CB 4.02Å; M277-V319 HydrophobicContact CE-CG1 3.78Å; M277-V319 HydrophobicContact CG-CB 4.42Å; M277-Y321 HydrophobicContact CB-CE1 4.24Å; M277-A385 VanDerWaalsContact CE-C 3.45Å; M277-A385 HydrophobicContact CE-CB 4.05Å; M277-A385 WeakPolarHBondContact CE-O 3.49Å; M277-L402 HydrophobicContact SD-CB 4.13Å; M277-L402 HydrophobicContact SD-CD1 4.01Å; M277-L402 HydrophobicContact SD-CD2 4.18Å; M277-L402 HydrophobicContact SD-CG 4.32Å; M277-F403 PolarHBondContact N-O 3.19Å; M277-V404 HydrophobicContact CB-CG2 4.23Å; M277-V404 HydrophobicContact CG-CG2 4.46Å; M277-V404 HydrophobicContact SD-CG2 4.25Å; M277-F405 PolarHBondContact O-N 3.29Å
278	L	95	Very high	93.9	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	119.2	-171.3	-50.6	176.8	0	0	0	111.4	V280 F293 V319 T320 Y321 F405	L278-V280 HydrophobicContact CB-CG1 4.31Å; L278-V280 PolarHBondContact O-N 3.34Å; L278-F293 HydrophobicContact CD1-CD1 4.17Å; L278-F293 HydrophobicContact CD1-CE1 4.03Å; L278-F293 HydrophobicContact CD2-CD1 3.88Å; L278-F293 HydrophobicContact CD2-CE1 3.82Å; L278-F293 HydrophobicContact CG-CE1 4.49Å; L278-V319 PolarHBondContact N-O 2.98Å; L278-T320 HydrophobicContact CB-CG2 4.16Å; L278-T320 HydrophobicContact CD1-CG2 4.41Å; L278-T320 CarbonylContact O-C 3.51Å; L278-T320 VanDerWaalsContact O-CA 3.23Å; L278-T320 WeakPolarHBondContact O-CA 3.47Å; L278-Y321 VanDerWaalsContact C-CE1 3.46Å; L278-Y321 WeakPolarHBondContact O-CD1 3.27Å; L278-Y321 PolarHBondContact O-N 3.31Å; L278-F405 HydrophobicContact CD2-CB 4.23Å; L278-F405 HydrophobicContact CD2-CD2 3.37Å; L278-F405 HydrophobicContact CD2-CE2 3.8Å; L278-F405 HydrophobicContact CD2-CG 3.84Å
279	D	94.5	Very high	93.6	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	120.5	160	178.1	-5.3	0	0	0	108.4	S281 A284 Y321 F405 H406 T407	D279-S281 WeakPolarHBondContact OD1-CB 3.38Å; D279-S281 PolarHBondContact OD1-N 3.26Å; D279-S281 PolarHBondContact OD1-OG 3.2Å; D279-A284 HydrophobicContact CB-CB 3.91Å; D279-A284 VanDerWaalsContact CG-CB 3.48Å; D279-A284 WeakPolarHBondContact O-CB 3.44Å; D279-A284 WeakPolarHBondContact OD1-CB 3.48Å; D279-Y321 WeakPolarHBondContact CA-O 2.99Å; D279-Y321 HydrophobicContact CB-CE1 4.39Å; D279-Y321 HydrophobicContact CB-CE2 4.14Å; D279-F405 WeakPolarHBondContact CB-O 3.39Å; D279-F405 PolarHBondContact N-O 2.98Å; D279-H406 IonicContact OD2-ND1 2.83Å; D279-T407 PolarHBondContact OD2-N 3.2Å; D279-T407 PolarHBondContact OD2-OG1 2.99Å
280	V	96.1	Very high	93.5	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.006	14%	0.135	C	C	.	.			trans	-117.2	21.3	179.2	-67.2	0	0	0	0	111.9	L278 T320 Y321 D322 I368 F372 N375	L278-V280 HydrophobicContact CB-CG1 4.31Å; L278-V280 PolarHBondContact O-N 3.34Å; V280-T320 HydrophobicContact CG1-CG2 3.78Å; V280-Y321 WeakPolarHBondContact CG2-O 3.3Å; V280-Y321 PolarHBondContact N-O 3.35Å; V280-D322 HydrophobicContact CG2-CB 4.45Å; V280-I368 HydrophobicContact CG1-CG2 4.44Å; V280-F372 HydrophobicContact CB-CB 4.11Å; V280-F372 HydrophobicContact CB-CD1 3.91Å; V280-F372 HydrophobicContact CB-CD2 3.93Å; V280-F372 HydrophobicContact CB-CE1 4.29Å; V280-F372 HydrophobicContact CB-CE2 4.32Å; V280-F372 HydrophobicContact CB-CG 3.71Å; V280-F372 HydrophobicContact CB-CZ 4.49Å; V280-F372 HydrophobicContact CG1-CD2 3.93Å; V280-F372 HydrophobicContact CG1-CE2 4.3Å; V280-F372 HydrophobicContact CG1-CG 4.19Å; V280-F372 HydrophobicContact CG2-CD1 3.7Å; V280-F372 HydrophobicContact CG2-CD2 4.08Å; V280-F372 HydrophobicContact CG2-CE1 3.59Å; V280-F372 HydrophobicContact CG2-CE2 3.98Å; V280-F372 HydrophobicContact CG2-CG 3.95Å; V280-F372 HydrophobicContact CG2-CZ 3.74Å; V280-N375 PolarHBondContact O-ND2 3.39Å
281	S	94.9	Very high	93.5	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.131	C	C	.	.	S	Bend	trans	-62.2	165.1	169	67.7	0	0	0	0	111.8	D279 N283 A284 V285 V377 V380	D279-S281 WeakPolarHBondContact OD1-CB 3.38Å; D279-S281 PolarHBondContact OD1-N 3.26Å; D279-S281 PolarHBondContact OD1-OG 3.2Å; S281-N283 PolarHBondContact O-N 3.05Å; S281-A284 PolarHBondContact O-N 3.35Å; S281-A284 VanDerWaalsContact O-N 3.08Å; S281-V285 WeakPolarHBondContact O-CG2 3.45Å; S281-V285 PolarHBondContact O-N 2.94Å; S281-V377 WeakPolarHBondContact CA-O 3.47Å; S281-V377 WeakPolarHBondContact CB-O 3.41Å; S281-V380 VanDerWaalsContact CB-CG1 3.49Å
282	Y	94.5	Very high	93.5	Very high	87 Å²	87	27.9 Å²	27.9	34%	0.341	14%	0.135	S	C	.	.	H	α-helix	trans	-49.3	-45.2	175.9	175.8	-95.3	0	0	0	111.9	R286 N375 V377 T378	Y282-R286 HydrophobicContact CD1-CG 4.2Å; Y282-R286 HydrophobicContact CD2-CG 4.16Å; Y282-R286 HydrophobicContact CE1-CG 3.89Å; Y282-R286 HydrophobicContact CE2-CG 3.87Å; Y282-R286 HydrophobicContact CG-CG 4.33Å; Y282-R286 WeakPolarHBondContact O-CB 3.17Å; Y282-R286 WeakPolarHBondContact O-CG 3.46Å; Y282-R286 PolarHBondContact O-N 3.3Å; Y282-R286 PolarHBondContact OH-NE 3.2Å; Y282-N375 WeakPolarHBondContact CD2-O 3.44Å; Y282-V377 WeakPolarHBondContact CB-O 3.49Å; Y282-V377 PolarHBondContact N-O 3.37Å; Y282-T378 HydrophobicContact CD1-CG2 4.4Å; Y282-T378 HydrophobicContact CG-CG2 4.49Å
283	N	91.5	Very high	93.4	Very high	69 Å²	69	27.9 Å²	27.9	37%	0.369	14%	0.135	S	C	.	.	H	α-helix	trans	-66.3	-41.4	-179.1	-69.4	-23.6	0	0	0	111.7	S281 R286 S287 S408	S281-N283 PolarHBondContact O-N 3.05Å; N283-R286 PolarHBondContact O-N 3.05Å; N283-S287 PolarHBondContact O-N 2.7Å; N283-S408 PolarHBondContact ND2-OG 3.08Å
284	A	92	Very high	93.4	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.008	14%	0.136	C	C	.	.	H	α-helix	trans	-66.3	-45.5	178.9	0	0	0	0	0	113	D279 S281 S287 V290 T407	D279-A284 HydrophobicContact CB-CB 3.91Å; D279-A284 VanDerWaalsContact CG-CB 3.48Å; D279-A284 WeakPolarHBondContact O-CB 3.44Å; D279-A284 WeakPolarHBondContact OD1-CB 3.48Å; S281-A284 PolarHBondContact O-N 3.35Å; S281-A284 VanDerWaalsContact O-N 3.08Å; A284-S287 PolarHBondContact O-N 3.4Å; A284-S287 PolarHBondContact O-OG 2.9Å; A284-V290 HydrophobicContact CB-CG2 4.28Å; A284-T407 HydrophobicContact CB-CG2 3.61Å
285	V	93	Very high	93.3	Very high	39 Å²	39	32.9 Å²	32.9	24%	0.236	16%	0.162	C	C	.	.	H	α-helix	trans	-63.5	-43.8	176.2	176.8	0	0	0	0	110.5	S281 S287 G288 F372	S281-V285 WeakPolarHBondContact O-CG2 3.45Å; S281-V285 PolarHBondContact O-N 2.94Å; V285-S287 VanDerWaalsContact C-N 3.32Å; V285-S287 PolarHBondContact O-N 3.32Å; V285-G288 PolarHBondContact O-N 3.45Å; V285-F372 HydrophobicContact CG2-CB 4.17Å
286	R	92.9	Very high	93.3	Very high	178 Å²	178	35.3 Å²	35.3	67%	0.672	18%	0.175	S	C	*	.	H	α-helix	trans	-67.4	-27.4	179.4	-72.6	-75.5	179.5	174	-2.1	114.1	Y282 N283 G288	Y282-R286 HydrophobicContact CD1-CG 4.2Å; Y282-R286 HydrophobicContact CD2-CG 4.16Å; Y282-R286 HydrophobicContact CE1-CG 3.89Å; Y282-R286 HydrophobicContact CE2-CG 3.87Å; Y282-R286 HydrophobicContact CG-CG 4.33Å; Y282-R286 WeakPolarHBondContact O-CB 3.17Å; Y282-R286 WeakPolarHBondContact O-CG 3.46Å; Y282-R286 PolarHBondContact O-N 3.3Å; Y282-R286 PolarHBondContact OH-NE 3.2Å; N283-R286 PolarHBondContact O-N 3.05Å; R286-G288 PolarHBondContact O-N 3.46Å
287	S	89.1	Confident	93.3	Very high	17 Å²	17	35.3 Å²	35.3	12%	0.119	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-22.8	175.4	77.2	0	0	0	0	112.9	N283 A284 V285 L289 A461	N283-S287 PolarHBondContact O-N 2.7Å; A284-S287 PolarHBondContact O-N 3.4Å; A284-S287 PolarHBondContact O-OG 2.9Å; V285-S287 VanDerWaalsContact C-N 3.32Å; V285-S287 PolarHBondContact O-N 3.32Å; S287-L289 PolarHBondContact O-N 2.77Å; S287-L289 PolarHBondContact OG-N 2.95Å; S287-L289 VanDerWaalsContact OG-N 3.17Å; S287-A461 WeakPolarHBondContact O-CB 3.49Å; S287-A461 PolarHBondContact O-N 3.36Å
288	G	92.4	Very high	93.2	Very high	19 Å²	19	41 Å²	41	20%	0.196	20%	0.199	C	C	.	.	S	Bend	trans	76.2	-6.2	-174.6	0	0	0	0	0	114.6	V285 R286 N291 K292 A461	V285-G288 PolarHBondContact O-N 3.45Å; R286-G288 PolarHBondContact O-N 3.46Å; G288-N291 PolarHBondContact O-N 2.94Å; G288-K292 PolarHBondContact O-N 3.07Å; G288-A461 VanDerWaalsContact C-CB 3.44Å
289	L	89.1	Confident	93	Very high	20 Å²	20	46.1 Å²	46.1	11%	0.105	22%	0.222	C	C	.	.	H	α-helix	trans	-69.3	-39	-176.8	-68.2	170.3	0	0	0	112.1	S287 N291 K292 F293 A461 F468	S287-L289 PolarHBondContact O-N 2.77Å; S287-L289 PolarHBondContact OG-N 2.95Å; S287-L289 VanDerWaalsContact OG-N 3.17Å; L289-N291 VanDerWaalsContact C-N 3.32Å; L289-N291 PolarHBondContact O-N 3Å; L289-K292 PolarHBondContact O-N 3.49Å; L289-F293 WeakPolarHBondContact O-CB 3.49Å; L289-F293 PolarHBondContact O-N 3.31Å; L289-A461 HydrophobicContact CD2-CB 4.05Å; L289-A461 HydrophobicContact CG-CB 4.38Å; L289-F468 HydrophobicContact CD2-CB 4.16Å; L289-F468 HydrophobicContact CD2-CD1 4.01Å; L289-F468 HydrophobicContact CD2-CD2 4.48Å; L289-F468 HydrophobicContact CD2-CG 3.96Å
290	V	92.1	Very high	92.9	Very high	13 Å²	13	46.1 Å²	46.1	8%	0.079	22%	0.222	C	C	.	.	H	α-helix	trans	-59.3	-45.3	173.6	-178.8	0	0	0	0	110.4	A284 F293 C294 L369	A284-V290 HydrophobicContact CB-CG2 4.28Å; V290-F293 PolarHBondContact O-N 3.16Å; V290-C294 WeakPolarHBondContact O-CB 3.02Å; V290-C294 PolarHBondContact O-N 2.88Å; V290-C294 PolarHBondContact O-SG 3.35Å; V290-C294 VanDerWaalsContact O-SG 3.34Å; V290-L369 HydrophobicContact CG1-CD2 4.13Å
291	N	93.3	Very high	92.7	Very high	78 Å²	78	46.5 Å²	46.5	42%	0.417	22%	0.224	S	C	.	.	H	α-helix	trans	-62.7	-44	175.9	-174	47.8	0	0	0	111.9	G288 L289 F293 C294 N295 L369	G288-N291 PolarHBondContact O-N 2.94Å; L289-N291 VanDerWaalsContact C-N 3.32Å; L289-N291 PolarHBondContact O-N 3Å; N291-F293 PolarHBondContact O-N 3.16Å; N291-C294 PolarHBondContact O-N 2.87Å; N291-N295 VanDerWaalsContact CG-ND2 3.32Å; N291-N295 PolarHBondContact ND2-ND2 3.05Å; N291-N295 WeakPolarHBondContact O-CB 3.38Å; N291-N295 PolarHBondContact O-N 3.03Å; N291-N295 PolarHBondContact O-ND2 3.31Å; N291-N295 PolarHBondContact OD1-ND2 2.78Å; N291-L369 HydrophobicContact CB-CD2 4.13Å; N291-L369 WeakPolarHBondContact OD1-CD1 3.01Å
292	K	93	Very high	92.5	Very high	59 Å²	59	53.2 Å²	53.2	26%	0.257	26%	0.255	S	S	.	.	H	α-helix	trans	-60.8	-43.8	176.4	-168.9	82.6	175.6	-159.3	0	111.1	G288 L289 N296 D466 L469	G288-K292 PolarHBondContact O-N 3.07Å; L289-K292 PolarHBondContact O-N 3.49Å; K292-N296 WeakPolarHBondContact O-CB 3.29Å; K292-N296 PolarHBondContact O-N 2.89Å; K292-N296 PolarHBondContact O-ND2 2.97Å; K292-D466 IonicContact NZ-OD1 2.78Å; K292-D466 PolarHBondContact NZ-OD1 3.01Å; K292-L469 HydrophobicContact CD-CD1 4.19Å; K292-L469 HydrophobicContact CG-CD1 3.97Å; K292-L469 HydrophobicContact CG-CD2 4.34Å; K292-L469 HydrophobicContact CG-CG 4.06Å
293	F	94.1	Very high	92.2	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-60	-56.5	175.4	169.9	-106.1	0	0	0	111.9	F276 L278 L289 V290 N291 N295 N296 I297 L300 F318 F405 F468 L472	F276-F293 HydrophobicContact CB-CZ 4.11Å; F276-F293 AromaticContact CD1-CE2 3.98Å; F276-F293 HydrophobicContact CD1-CE2 3.98Å; F276-F293 AromaticContact CD1-CZ 3.65Å; F276-F293 HydrophobicContact CD1-CZ 3.65Å; F276-F293 HydrophobicContact CD2-CZ 4.29Å; F276-F293 HydrophobicContact CE1-CE2 4.11Å; F276-F293 HydrophobicContact CE1-CZ 4.13Å; F276-F293 AromaticContact CG-CZ 3.76Å; F276-F293 HydrophobicContact CG-CZ 3.76Å; L278-F293 HydrophobicContact CD1-CD1 4.17Å; L278-F293 HydrophobicContact CD1-CE1 4.03Å; L278-F293 HydrophobicContact CD2-CD1 3.88Å; L278-F293 HydrophobicContact CD2-CE1 3.82Å; L278-F293 HydrophobicContact CG-CE1 4.49Å; L289-F293 WeakPolarHBondContact O-CB 3.49Å; L289-F293 PolarHBondContact O-N 3.31Å; V290-F293 PolarHBondContact O-N 3.16Å; N291-F293 PolarHBondContact O-N 3.16Å; F293-N295 VanDerWaalsContact C-N 3.34Å; F293-N295 PolarHBondContact O-N 3.16Å; F293-N296 CarbonylContact O-C 3.5Å; F293-N296 PolarHBondContact O-N 3.23Å; F293-I297 HydrophobicContact CE1-CD1 4.31Å; F293-I297 HydrophobicContact CE2-CD1 3.94Å; F293-I297 HydrophobicContact CZ-CD1 3.63Å; F293-I297 PolarHBondContact O-N 2.71Å; F293-L300 HydrophobicContact CD2-CD1 3.78Å; F293-L300 HydrophobicContact CE2-CD1 3.9Å; F293-F318 HydrophobicContact CE1-CE1 4.11Å; F293-F318 HydrophobicContact CZ-CE1 4.26Å; F293-F405 HydrophobicContact CD2-CE1 4.31Å; F293-F405 HydrophobicContact CD2-CZ 4.03Å; F293-F405 HydrophobicContact CE2-CZ 4.01Å; F293-F468 HydrophobicContact CB-CE1 4.05Å; F293-F468 HydrophobicContact CB-CZ 4.12Å; F293-L472 HydrophobicContact CD2-CD2 3.54Å; F293-L472 HydrophobicContact CE2-CD2 3.84Å
294	C	94.4	Very high	92.3	Very high	5 Å²	5	47.5 Å²	47.5	3%	0.034	23%	0.23	C	C	.	.	H	α-helix	trans	-58	-43.9	-178.4	-70.7	0	0	0	0	112.1	V290 N291 N296 I297 L369	V290-C294 WeakPolarHBondContact O-CB 3.02Å; V290-C294 PolarHBondContact O-N 2.88Å; V290-C294 PolarHBondContact O-SG 3.35Å; V290-C294 VanDerWaalsContact O-SG 3.34Å; N291-C294 PolarHBondContact O-N 2.87Å; C294-N296 PolarHBondContact O-N 3.07Å; C294-I297 WeakPolarHBondContact O-CG2 3.47Å; C294-I297 PolarHBondContact O-N 3.03Å; C294-L369 HydrophobicContact CB-CD1 3.59Å; C294-L369 HydrophobicContact CB-CD2 3.92Å; C294-L369 HydrophobicContact CB-CG 3.76Å
295	N	94.1	Very high	92.3	Very high	100 Å²	100	47.9 Å²	47.9	54%	0.535	23%	0.233	S	C	.	.	H	α-helix	trans	-67	-18.6	178.4	-69.1	-33.7	0	0	0	113.9	N291 F293	N291-N295 VanDerWaalsContact CG-ND2 3.32Å; N291-N295 PolarHBondContact ND2-ND2 3.05Å; N291-N295 WeakPolarHBondContact O-CB 3.38Å; N291-N295 PolarHBondContact O-N 3.03Å; N291-N295 PolarHBondContact O-ND2 3.31Å; N291-N295 PolarHBondContact OD1-ND2 2.78Å; F293-N295 VanDerWaalsContact C-N 3.34Å; F293-N295 PolarHBondContact O-N 3.16Å
296	N	94.3	Very high	92.1	Very high	51 Å²	51	50 Å²	50	27%	0.273	25%	0.246	S	C	.	.	H	α-helix	trans	-108.2	3.6	179.4	-72	-89.3	0	0	0	113.2	K292 F293 C294 K298 F299 L300 L469	K292-N296 WeakPolarHBondContact O-CB 3.29Å; K292-N296 PolarHBondContact O-N 2.89Å; K292-N296 PolarHBondContact O-ND2 2.97Å; F293-N296 CarbonylContact O-C 3.5Å; F293-N296 PolarHBondContact O-N 3.23Å; C294-N296 PolarHBondContact O-N 3.07Å; N296-K298 PolarHBondContact O-N 2.98Å; N296-K298 VanDerWaalsContact O-N 3.17Å; N296-F299 WeakPolarHBondContact O-CB 3.46Å; N296-F299 PolarHBondContact O-N 2.75Å; N296-L300 WeakPolarHBondContact O-CG 3.44Å; N296-L300 PolarHBondContact O-N 2.92Å; N296-L300 VanDerWaalsContact O-N 3.09Å; N296-L469 HydrophobicContact CB-CD1 4.22Å; N296-L469 HydrophobicContact CB-CD2 3.83Å
297	I	93.7	Very high	91.6	Very high	2 Å²	2	43 Å²	43	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-55.8	-40.3	-174	-168.6	56.4	0	0	0	112.5	F293 C294 F299 L300 L301 F318 I361 I362 T365	F293-I297 HydrophobicContact CE1-CD1 4.31Å; F293-I297 HydrophobicContact CE2-CD1 3.94Å; F293-I297 HydrophobicContact CZ-CD1 3.63Å; F293-I297 PolarHBondContact O-N 2.71Å; C294-I297 WeakPolarHBondContact O-CG2 3.47Å; C294-I297 PolarHBondContact O-N 3.03Å; I297-F299 VanDerWaalsContact C-N 3.32Å; I297-F299 PolarHBondContact O-N 3.43Å; I297-L300 PolarHBondContact O-N 3.31Å; I297-L300 VanDerWaalsContact O-N 3.16Å; I297-L301 HydrophobicContact CD1-CG 4.34Å; I297-L301 HydrophobicContact CG1-CD1 4.26Å; I297-L301 HydrophobicContact CG1-CG 4.23Å; I297-L301 VanDerWaalsContact O-CG 3.29Å; I297-L301 WeakPolarHBondContact O-CG 3.33Å; I297-L301 PolarHBondContact O-N 3.36Å; I297-F318 HydrophobicContact CD1-CE1 4.41Å; I297-F318 HydrophobicContact CD1-CZ 4.17Å; I297-F318 HydrophobicContact CG1-CZ 4.26Å; I297-I361 HydrophobicContact CG1-CG2 3.88Å; I297-I362 HydrophobicContact CG2-CG1 4.16Å; I297-T365 HydrophobicContact CB-CG2 4.32Å; I297-T365 HydrophobicContact CG1-CG2 4.2Å; I297-T365 HydrophobicContact CG2-CG2 4.12Å
298	K	92.3	Very high	90.9	Very high	120 Å²	120	48.7 Å²	48.7	52%	0.522	25%	0.245	S	C	.	.	H	α-helix	trans	-57.6	-45.5	178.9	-175.4	179.5	-179.3	177.2	0	111.8	N296 H302 I362	N296-K298 PolarHBondContact O-N 2.98Å; N296-K298 VanDerWaalsContact O-N 3.17Å; K298-H302 PolarHBondContact O-CD2 2.83Å; K298-I362 HydrophobicContact CB-CD1 4.02Å; K298-I362 HydrophobicContact CB-CG1 4.38Å; K298-I362 HydrophobicContact CD-CD1 3.97Å; K298-I362 HydrophobicContact CG-CD1 4.1Å
299	F	91.8	Very high	89.9	Confident	109 Å²	109	51.7 Å²	51.7	48%	0.478	28%	0.276	S	S	.	.	H	α-helix	trans	-64.8	-45.9	177.5	174.9	-97.8	0	0	0	110.6	N296 I297 L301 H302 N303 K473	N296-F299 WeakPolarHBondContact O-CB 3.46Å; N296-F299 PolarHBondContact O-N 2.75Å; I297-F299 VanDerWaalsContact C-N 3.32Å; I297-F299 PolarHBondContact O-N 3.43Å; F299-L301 VanDerWaalsContact C-N 3.33Å; F299-L301 PolarHBondContact O-N 2.96Å; F299-H302 WeakPolarHBondContact O-CB 3.43Å; F299-H302 PolarHBondContact O-N 3.38Å; F299-H302 VanDerWaalsContact O-N 3.15Å; F299-N303 PolarHBondContact O-OD1 3.09Å; F299-N303 VanDerWaalsContact O-OD1 3.06Å; F299-K473 HydrophobicContact CE1-CD 3.89Å; F299-K473 HydrophobicContact CE1-CG 4.11Å; F299-K473 HydrophobicContact CZ-CD 4.12Å
300	L	92.3	Very high	89.4	Confident	1 Å²	1	58 Å²	58	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-61.7	-36.6	-179.6	-63.9	171.2	0	0	0	113.1	F293 N296 I297 H302 N303 L469 L472 K473 L476	F293-L300 HydrophobicContact CD2-CD1 3.78Å; F293-L300 HydrophobicContact CE2-CD1 3.9Å; N296-L300 WeakPolarHBondContact O-CG 3.44Å; N296-L300 PolarHBondContact O-N 2.92Å; N296-L300 VanDerWaalsContact O-N 3.09Å; I297-L300 PolarHBondContact O-N 3.31Å; I297-L300 VanDerWaalsContact O-N 3.16Å; L300-H302 VanDerWaalsContact C-N 3.3Å; L300-H302 PolarHBondContact O-N 3.11Å; L300-N303 WeakPolarHBondContact O-CB 3.03Å; L300-N303 PolarHBondContact O-N 3.1Å; L300-N303 VanDerWaalsContact O-N 3.13Å; L300-L469 HydrophobicContact CD1-CD2 4.47Å; L300-L472 HydrophobicContact CD1-CD2 3.57Å; L300-L472 HydrophobicContact CD1-CG 4.32Å; L300-L472 HydrophobicContact CD2-CD2 4.28Å; L300-L472 HydrophobicContact CD2-CG 4.21Å; L300-K473 HydrophobicContact CD2-CB 4.34Å; L300-L476 HydrophobicContact CB-CD1 3.77Å; L300-L476 HydrophobicContact CD2-CD1 4.02Å; L300-L476 HydrophobicContact CG-CD1 4.36Å
301	L	92.1	Very high	89.1	Confident	9 Å²	9	65 Å²	65	5%	0.047	33%	0.334	C	S	.	.	H	α-helix	trans	-64.8	-31.9	177	-70.5	173.4	0	0	0	113	I297 F299 N303 L304 V316 A358 I361	I297-L301 HydrophobicContact CD1-CG 4.34Å; I297-L301 HydrophobicContact CG1-CD1 4.26Å; I297-L301 HydrophobicContact CG1-CG 4.23Å; I297-L301 VanDerWaalsContact O-CG 3.29Å; I297-L301 WeakPolarHBondContact O-CG 3.33Å; I297-L301 PolarHBondContact O-N 3.36Å; F299-L301 VanDerWaalsContact C-N 3.33Å; F299-L301 PolarHBondContact O-N 2.96Å; L301-N303 PolarHBondContact O-N 2.86Å; L301-L304 HydrophobicContact CD2-CD1 4.08Å; L301-L304 WeakPolarHBondContact O-CG 3.47Å; L301-L304 PolarHBondContact O-N 3.09Å; L301-V316 HydrophobicContact CD2-CG2 3.84Å; L301-A358 HydrophobicContact CD1-CB 4.31Å; L301-I361 HydrophobicContact CD1-CB 4.18Å; L301-I361 HydrophobicContact CD1-CD1 3.73Å; L301-I361 HydrophobicContact CD1-CG2 3.89Å; L301-I361 HydrophobicContact CD2-CD1 4.19Å
302	H	89.8	Confident	89	Confident	141 Å²	141	62.2 Å²	62.2	65%	0.653	32%	0.321	S	S	*	.	H	α-helix	trans	-70.3	-19.5	175.7	-71.1	-64.4	0	0	0	112.8	K298 F299 L300	K298-H302 PolarHBondContact O-CD2 2.83Å; F299-H302 WeakPolarHBondContact O-CB 3.43Å; F299-H302 PolarHBondContact O-N 3.38Å; F299-H302 VanDerWaalsContact O-N 3.15Å; L300-H302 VanDerWaalsContact C-N 3.3Å; L300-H302 PolarHBondContact O-N 3.11Å
303	N	89.6	Confident	88.9	Confident	29 Å²	29	61.5 Å²	61.5	16%	0.155	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	3.2	178.9	-73.1	100.8	0	0	0	113.4	F299 L300 L301 K473 L476 E477	F299-N303 PolarHBondContact O-OD1 3.09Å; F299-N303 VanDerWaalsContact O-OD1 3.06Å; L300-N303 WeakPolarHBondContact O-CB 3.03Å; L300-N303 PolarHBondContact O-N 3.1Å; L300-N303 VanDerWaalsContact O-N 3.13Å; L301-N303 PolarHBondContact O-N 2.86Å; N303-K473 HydrophobicContact CB-CG 4.36Å; N303-K473 WeakPolarHBondContact ND2-CE 3.48Å; N303-L476 CarbonylContact O-C 3.59Å; N303-E477 HydrophobicContact CB-CB 4.27Å; N303-E477 PolarHBondContact ND2-OE2 3.23Å; N303-E477 WeakPolarHBondContact O-CA 3.23Å; N303-E477 WeakPolarHBondContact O-CB 3.5Å
304	L	92.7	Very high	88.9	Confident	6 Å²	6	61.5 Å²	61.5	3%	0.031	33%	0.326	C	S	.	.	S	Bend	trans	-61.7	145.5	178.4	-69.8	173.3	0	0	0	111.7	F274 L301 T306 V316 P355 L476	F274-L304 HydrophobicContact CD2-CD2 3.46Å; F274-L304 VanDerWaalsContact CD2-CD2 3.46Å; F274-L304 HydrophobicContact CE2-CD2 3.65Å; L301-L304 HydrophobicContact CD2-CD1 4.08Å; L301-L304 WeakPolarHBondContact O-CG 3.47Å; L301-L304 PolarHBondContact O-N 3.09Å; L304-T306 PolarHBondContact O-N 3.43Å; L304-V316 HydrophobicContact CD1-CG2 4.09Å; L304-P355 HydrophobicContact CD1-CB 3.98Å; L304-P355 HydrophobicContact CD1-CG 3.35Å; L304-L476 HydrophobicContact CD2-CD2 3.85Å
305	P	91.5	Very high	88.9	Confident	10 Å²	10	62.7 Å²	62.7	7%	0.065	33%	0.331	C	S	.	.			trans	-59.9	138.6	-178	-21.7	34.5	0	0	0	111.1	S312 I314 L476 I480 V548	P305-S312 VanDerWaalsContact O-CB 3.31Å; P305-S312 WeakPolarHBondContact O-CB 3.46Å; P305-S312 PolarHBondContact O-OG 3.23Å; P305-I314 HydrophobicContact CB-CD1 4.37Å; P305-I314 HydrophobicContact CG-CD1 4.12Å; P305-L476 WeakPolarHBondContact CD-O 3.36Å; P305-L476 WeakPolarHBondContact CG-O 3.21Å; P305-I480 HydrophobicContact CB-CG2 4.48Å; P305-I480 HydrophobicContact CG-CG2 3.91Å; P305-V548 HydrophobicContact CB-CG1 4.02Å
306	T	89.1	Confident	88.9	Confident	83 Å²	83	57.9 Å²	57.9	51%	0.509	31%	0.306	S	S	.	.			trans	-124.5	162	178.6	58.9	0	0	0	0	110.7	L304 K310	L304-T306 PolarHBondContact O-N 3.43Å; T306-K310 WeakPolarHBondContact CB-O 3.48Å; T306-K310 VanDerWaalsContact CG2-O 3.23Å; T306-K310 WeakPolarHBondContact CG2-O 3.35Å
307	E	84	Confident	88.9	Confident	32 Å²	32	55.7 Å²	55.7	15%	0.15	30%	0.295	C	S	.	.	S	Bend	trans	-128.8	134.3	176.7	-154.7	179.3	-178.6	0	0	110.8	G309 K310 V548 S549 R553	E307-G309 PolarHBondContact O-N 3.35Å; E307-K310 WeakPolarHBondContact O-CB 3.39Å; E307-K310 PolarHBondContact O-N 3.45Å; E307-K310 VanDerWaalsContact O-N 3.13Å; E307-V548 HydrophobicContact CB-CG2 4.03Å; E307-S549 VanDerWaalsContact OE2-CB 3.23Å; E307-S549 WeakPolarHBondContact OE2-CB 3.46Å; E307-S549 PolarHBondContact OE2-OG 3.33Å; E307-R553 IonicContact OE1-CZ 3.67Å; E307-R553 IonicContact OE1-NH1 3.37Å; E307-R553 PolarHBondContact OE1-NH1 2.85Å; E307-R553 IonicContact OE1-NH2 3.92Å; E307-R553 PolarHBondContact OE1-NH2 2.91Å; E307-R553 IonicContact OE2-NH2 3.64Å
308	H	73.6	Confident	88.9	Confident	136 Å²	136	56 Å²	56	63%	0.63	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	34	178.9	-52.7	-64.2	0	0	0	114.8	K310	H308-K310 PolarHBondContact O-N 3.49Å
309	G	70.5	Confident	89	Confident	82 Å²	82	50.4 Å²	50.4	85%	0.845	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.4	14.8	178.8	0	0	0	0	0	114.7	E307	E307-G309 PolarHBondContact O-N 3.35Å
310	K	79.2	Confident	89.3	Confident	151 Å²	151	45.2 Å²	45.2	66%	0.657	25%	0.249	S	C	*	.	P	Polyproline II helix	trans	-87.2	162.5	173.8	-61.5	-179.1	-179.3	176.8	0	110.6	T306 E307 H308	T306-K310 WeakPolarHBondContact CB-O 3.48Å; T306-K310 VanDerWaalsContact CG2-O 3.23Å; T306-K310 WeakPolarHBondContact CG2-O 3.35Å; E307-K310 WeakPolarHBondContact O-CB 3.39Å; E307-K310 PolarHBondContact O-N 3.45Å; E307-K310 VanDerWaalsContact O-N 3.13Å; H308-K310 PolarHBondContact O-N 3.49Å
311	E	85.2	Confident	89.4	Confident	160 Å²	160	45.1 Å²	45.1	75%	0.748	25%	0.249	S	C	*	.	P	Polyproline II helix	trans	-57.9	152.1	169.2	-66	-175	169.6	0	0	111.3	A313	E311-A313 PolarHBondContact O-N 2.83Å
312	S	91	Very high	89.5	Confident	21 Å²	21	45 Å²	45	15%	0.147	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-64.3	127.2	-179.5	-169.5	0	0	0	0	110.3	P305 I314	P305-S312 VanDerWaalsContact O-CB 3.31Å; P305-S312 WeakPolarHBondContact O-CB 3.46Å; P305-S312 PolarHBondContact O-OG 3.23Å; S312-I314 WeakPolarHBondContact OG-CG1 3.5Å; S312-I314 PolarHBondContact OG-N 2.62Å
313	A	92.8	Very high	89.7	Confident	43 Å²	43	42.4 Å²	42.4	36%	0.355	24%	0.236	S	C	.	.			trans	-81.8	-2.8	172.3	0	0	0	0	0	112.5	P271 E311 E315	P271-A313 HydrophobicContact CB-CB 4.04Å; P271-A313 VanDerWaalsContact CB-O 3.3Å; P271-A313 WeakPolarHBondContact CB-O 3.42Å; P271-A313 HydrophobicContact CG-CB 4.21Å; E311-A313 PolarHBondContact O-N 2.83Å; A313-E315 PolarHBondContact O-N 2.86Å
314	I	94.1	Very high	90	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.23	C	C	.	.			trans	-73.2	122	178	-53.6	-165.5	0	0	0	108.9	P272 F274 P305 S312 P355 V548	P272-I314 HydrophobicContact CG-CD1 4.13Å; P272-I314 HydrophobicContact CG-CG1 3.98Å; F274-I314 HydrophobicContact CB-CG2 4.21Å; F274-I314 HydrophobicContact CD1-CG2 3.84Å; F274-I314 HydrophobicContact CD2-CG2 4.03Å; F274-I314 HydrophobicContact CE1-CD1 4.08Å; F274-I314 HydrophobicContact CE1-CG2 4.24Å; F274-I314 HydrophobicContact CE2-CD1 4.17Å; F274-I314 HydrophobicContact CE2-CG2 4.39Å; F274-I314 HydrophobicContact CG-CG2 3.73Å; F274-I314 HydrophobicContact CZ-CD1 3.79Å; F274-I314 HydrophobicContact CZ-CG2 4.5Å; P305-I314 HydrophobicContact CB-CD1 4.37Å; P305-I314 HydrophobicContact CG-CD1 4.12Å; S312-I314 WeakPolarHBondContact OG-CG1 3.5Å; S312-I314 PolarHBondContact OG-N 2.62Å; I314-P355 WeakPolarHBondContact O-CD 3.12Å; I314-P355 VanDerWaalsContact O-CG 3.23Å; I314-P355 WeakPolarHBondContact O-CG 3.43Å; I314-V548 HydrophobicContact CD1-CB 4.1Å; I314-V548 HydrophobicContact CD1-CG1 3.97Å; I314-V548 HydrophobicContact CG1-CB 4.2Å
315	E	93.5	Very high	90.1	Very high	30 Å²	30	40.9 Å²	40.9	14%	0.14	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	155.5	172.4	-66.3	170.3	146.6	0	0	110.3	P272 V273 F274 A313 F352 R354 R398	P272-E315 PolarHBondContact O-N 2.95Å; V273-E315 CarbonylContact C-O 3.57Å; V273-E315 WeakPolarHBondContact CA-O 3.26Å; V273-E315 WeakPolarHBondContact CG1-O 3.23Å; F274-E315 PolarHBondContact N-O 2.97Å; A313-E315 PolarHBondContact O-N 2.86Å; E315-F352 HydrophobicContact CB-CB 3.94Å; E315-R354 HydrophobicContact CG-CG 3.88Å; E315-R354 IonicContact OE1-NE 2.76Å; E315-R398 IonicContact OE2-CZ 3.07Å; E315-R398 VanDerWaalsContact OE2-CZ 3.24Å; E315-R398 IonicContact OE2-NH1 3.93Å; E315-R398 PolarHBondContact OE2-NH1 3.21Å; E315-R398 IonicContact OE2-NH2 3.88Å; E315-R398 PolarHBondContact OE2-NH2 2.64Å
316	V	94.4	Very high	90.2	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	141.4	-177.3	175.2	0	0	0	0	110.4	F274 F276 L301 L304 F318 V353	F274-V316 CarbonylContact O-C 3.51Å; F274-V316 VanDerWaalsContact O-CA 3.3Å; F274-V316 WeakPolarHBondContact O-CA 3.17Å; F276-V316 HydrophobicContact CD2-CG1 3.38Å; F276-V316 HydrophobicContact CE2-CB 4.37Å; F276-V316 HydrophobicContact CE2-CG1 3.36Å; F276-V316 HydrophobicContact CE2-CG2 4.08Å; L301-V316 HydrophobicContact CD2-CG2 3.84Å; L304-V316 HydrophobicContact CD1-CG2 4.09Å; V316-F318 HydrophobicContact CG1-CD2 4.19Å; V316-F318 HydrophobicContact CG1-CE2 3.52Å; V316-F318 HydrophobicContact CG1-CZ 3.84Å; V316-V353 PolarHBondContact N-O 3.04Å; V316-V353 PolarHBondContact O-N 3.09Å
317	A	94.1	Very high	90.5	Very high	5 Å²	5	37 Å²	37	4%	0.041	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	154.7	170.5	0	0	0	0	0	110.3	V273 F274 I275 F276 F352	V273-A317 HydrophobicContact CG1-CB 4.32Å; F274-A317 PolarHBondContact O-N 3.07Å; I275-A317 CarbonylContact C-O 3.56Å; I275-A317 WeakPolarHBondContact CA-O 3.41Å; I275-A317 HydrophobicContact CB-CB 4.44Å; I275-A317 HydrophobicContact CG1-CB 4.07Å; I275-A317 HydrophobicContact CG2-CB 4.26Å; F276-A317 PolarHBondContact N-O 3.49Å; A317-F352 HydrophobicContact CB-CD1 3.78Å; A317-F352 HydrophobicContact CB-CE1 4.08Å
318	F	94	Very high	90.8	Very high	7 Å²	7	35.7 Å²	35.7	3%	0.031	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	136	174.7	-66.1	-94.4	0	0	0	109.9	F276 F293 I297 V316 Y328 I361 L364 T365	F276-F318 HydrophobicContact CB-CD1 3.94Å; F276-F318 HydrophobicContact CB-CE1 4.04Å; F276-F318 HydrophobicContact CD2-CD1 4.45Å; F276-F318 AromaticContact CD2-CE1 3.91Å; F276-F318 HydrophobicContact CD2-CE1 3.91Å; F276-F318 HydrophobicContact CD2-CZ 4.01Å; F276-F318 HydrophobicContact CG-CE1 4.27Å; F276-F318 WeakPolarHBondContact O-CA 3.48Å; F293-F318 HydrophobicContact CE1-CE1 4.11Å; F293-F318 HydrophobicContact CZ-CE1 4.26Å; I297-F318 HydrophobicContact CD1-CE1 4.41Å; I297-F318 HydrophobicContact CD1-CZ 4.17Å; I297-F318 HydrophobicContact CG1-CZ 4.26Å; V316-F318 HydrophobicContact CG1-CD2 4.19Å; V316-F318 HydrophobicContact CG1-CE2 3.52Å; V316-F318 HydrophobicContact CG1-CZ 3.84Å; F318-Y328 HydrophobicContact CB-CD2 4.11Å; F318-Y328 WeakPolarHBondContact O-CD2 3.29Å; F318-I361 HydrophobicContact CE2-CB 4.48Å; F318-I361 HydrophobicContact CE2-CG1 4.42Å; F318-I361 HydrophobicContact CE2-CG2 3.54Å; F318-I361 HydrophobicContact CZ-CG2 3.5Å; F318-I361 VanDerWaalsContact CZ-CG2 3.5Å; F318-L364 HydrophobicContact CB-CD2 4.05Å; F318-L364 HydrophobicContact CD2-CD2 3.58Å; F318-L364 HydrophobicContact CE2-CD2 4.31Å; F318-L364 HydrophobicContact CG-CD2 3.96Å; F318-T365 HydrophobicContact CE1-CG2 3.92Å; F318-T365 HydrophobicContact CZ-CG2 4.14Å
319	V	94.7	Very high	91.4	Very high	3 Å²	3	30.4 Å²	30.4	2%	0.018	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	132.5	169.2	177.8	0	0	0	0	106.4	I275 F276 M277 L278 V325 H326 F327	I275-V319 HydrophobicContact CG2-CB 4.46Å; I275-V319 HydrophobicContact CG2-CG2 3.83Å; F276-V319 PolarHBondContact O-N 3.48Å; F276-V319 VanDerWaalsContact O-O 3.09Å; M277-V319 CarbonylContact C-O 3.54Å; M277-V319 VanDerWaalsContact CA-O 3.22Å; M277-V319 WeakPolarHBondContact CA-O 3.15Å; M277-V319 HydrophobicContact CE-CB 4.02Å; M277-V319 HydrophobicContact CE-CG1 3.78Å; M277-V319 HydrophobicContact CG-CB 4.42Å; L278-V319 PolarHBondContact N-O 2.98Å; V319-V325 HydrophobicContact CG1-CG1 3.61Å; V319-H326 WeakPolarHBondContact CA-O 3.35Å; V319-F327 HydrophobicContact CG2-CD1 3.89Å; V319-F327 HydrophobicContact CG2-CE1 4.03Å
320	T	96.2	Very high	91.5	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	156.5	169.3	67.7	0	0	0	0	109	L278 V280 H326 Y328 I368 F372	L278-T320 HydrophobicContact CB-CG2 4.16Å; L278-T320 HydrophobicContact CD1-CG2 4.41Å; L278-T320 CarbonylContact O-C 3.51Å; L278-T320 VanDerWaalsContact O-CA 3.23Å; L278-T320 WeakPolarHBondContact O-CA 3.47Å; V280-T320 HydrophobicContact CG1-CG2 3.78Å; T320-H326 PolarHBondContact N-O 3.28Å; T320-H326 PolarHBondContact O-N 3.49Å; T320-H326 PolarHBondContact O-ND1 3.39Å; T320-H326 WeakPolarHBondContact OG1-CB 3.28Å; T320-H326 PolarHBondContact OG1-ND1 3.06Å; T320-Y328 HydrophobicContact CG2-CE2 3.57Å; T320-Y328 VanDerWaalsContact CG2-OH 3.28Å; T320-Y328 WeakPolarHBondContact CG2-OH 3.34Å; T320-Y328 PolarHBondContact OG1-OH 2.9Å; T320-I368 HydrophobicContact CG2-CD1 4.07Å; T320-I368 HydrophobicContact CG2-CG1 4.34Å; T320-I368 HydrophobicContact CG2-CG2 3.93Å; T320-F372 HydrophobicContact CG2-CE2 4.48Å
321	Y	96.2	Very high	91.4	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	148.6	177.5	63.9	-80.1	0	0	0	112.3	M277 L278 D279 V280 S324 V381 A385 F405 H406	M277-Y321 HydrophobicContact CB-CE1 4.24Å; L278-Y321 VanDerWaalsContact C-CE1 3.46Å; L278-Y321 WeakPolarHBondContact O-CD1 3.27Å; L278-Y321 PolarHBondContact O-N 3.31Å; D279-Y321 WeakPolarHBondContact CA-O 2.99Å; D279-Y321 HydrophobicContact CB-CE1 4.39Å; D279-Y321 HydrophobicContact CB-CE2 4.14Å; V280-Y321 WeakPolarHBondContact CG2-O 3.3Å; V280-Y321 PolarHBondContact N-O 3.35Å; Y321-S324 VanDerWaalsContact CA-O 3.22Å; Y321-S324 WeakPolarHBondContact CA-O 3.48Å; Y321-V381 WeakPolarHBondContact CD2-O 3.4Å; Y321-A385 HydrophobicContact CD1-CB 3.78Å; Y321-A385 HydrophobicContact CD2-CB 3.82Å; Y321-A385 HydrophobicContact CE1-CB 4.18Å; Y321-A385 HydrophobicContact CE2-CB 4.19Å; Y321-A385 HydrophobicContact CG-CB 3.61Å; Y321-F405 PolarHBondContact OH-O 3.42Å; Y321-H406 AromaticContact CE2-CE1 3.88Å; Y321-H406 AromaticContact CE2-ND1 3.46Å; Y321-H406 WeakPolarHBondContact CE2-ND1 3.32Å; Y321-H406 AromaticContact CZ-ND1 3.62Å; Y321-H406 WeakPolarHBondContact OH-CB 2.83Å; Y321-H406 PolarHBondContact OH-ND1 2.88Å
322	D	94.5	Very high	91.2	Very high	5 Å²	5	19.9 Å²	19.9	3%	0.027	11%	0.111	C	C	.	.	S	Bend	trans	-136.1	-106.3	165.7	58	11.5	0	0	0	108.1	V280 S324 H326 N375 V377 E379 V380 V381	V280-D322 HydrophobicContact CG2-CB 4.45Å; D322-S324 PolarHBondContact N-O 3.09Å; D322-S324 PolarHBondContact OD1-N 3.46Å; D322-S324 VanDerWaalsContact OD1-N 3.11Å; D322-S324 PolarHBondContact OD1-OG 2.9Å; D322-H326 IonicContact OD1-CE1 2.65Å; D322-N375 PolarHBondContact OD2-ND2 2.69Å; D322-V377 HydrophobicContact CB-CB 4.37Å; D322-V377 HydrophobicContact CB-CG1 3.94Å; D322-E379 CarbonylContact C-O 3.52Å; D322-V380 CarbonylContact O-C 3.57Å; D322-V380 VanDerWaalsContact O-CA 3.24Å; D322-V380 WeakPolarHBondContact O-CA 3.5Å; D322-V381 VanDerWaalsContact O-CG2 3.24Å; D322-V381 WeakPolarHBondContact O-CG2 3.48Å; D322-V381 PolarHBondContact O-N 3.23Å
323	H	93.6	Very high	90.9	Very high	87 Å²	87	24.5 Å²	24.5	40%	0.403	13%	0.129	S	C	.	.	S	Bend	trans	-79.6	-17.6	165.5	73.8	-56.4	0	0	0	113.5	V377 E379 L412	H323-V377 HydrophobicContact CB-CG1 4.06Å; H323-E379 PolarHBondContact N-O 3.21Å; H323-L412 HydrophobicContact CB-CD2 3.96Å
324	S	94.1	Very high	90.8	Very high	4 Å²	4	25 Å²	25	3%	0.028	12%	0.124	C	C	.	.	S	Bend	trans	-125.5	166	172.7	49.1	0	0	0	0	111.2	Y321 D322 H326 N338	Y321-S324 VanDerWaalsContact CA-O 3.22Å; Y321-S324 WeakPolarHBondContact CA-O 3.48Å; D322-S324 PolarHBondContact N-O 3.09Å; D322-S324 PolarHBondContact OD1-N 3.46Å; D322-S324 VanDerWaalsContact OD1-N 3.11Å; D322-S324 PolarHBondContact OD1-OG 2.9Å; S324-H326 PolarHBondContact OG-NE2 3.12Å; S324-N338 VanDerWaalsContact CB-OD1 3.23Å; S324-N338 WeakPolarHBondContact CB-OD1 3.36Å
325	V	95.2	Very high	90.7	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	134.3	177.5	-178.5	0	0	0	0	109.7	V319 F327 V337 M343 V381 A385 A388	V319-V325 HydrophobicContact CG1-CG1 3.61Å; V325-F327 HydrophobicContact CG1-CD2 4.44Å; V325-F327 HydrophobicContact CG1-CE2 3.92Å; V325-F327 HydrophobicContact CG1-CZ 4.32Å; V325-V337 PolarHBondContact N-O 2.71Å; V325-V337 VanDerWaalsContact N-O 3.09Å; V325-V337 PolarHBondContact O-N 3.37Å; V325-M343 HydrophobicContact CB-SD 4.27Å; V325-M343 HydrophobicContact CG2-SD 3.78Å; V325-V381 HydrophobicContact CG2-CG2 4.38Å; V325-A385 HydrophobicContact CG2-CB 4.47Å; V325-A388 HydrophobicContact CG1-CB 3.96Å
326	H	94.9	Very high	90.7	Very high	10 Å²	10	29.4 Å²	29.4	5%	0.046	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	124.8	-177	-36.3	102.4	0	0	0	111.2	V319 T320 D322 S324 Y328 M334 L335 F372	V319-H326 WeakPolarHBondContact CA-O 3.35Å; T320-H326 PolarHBondContact N-O 3.28Å; T320-H326 PolarHBondContact O-N 3.49Å; T320-H326 PolarHBondContact O-ND1 3.39Å; T320-H326 WeakPolarHBondContact OG1-CB 3.28Å; T320-H326 PolarHBondContact OG1-ND1 3.06Å; D322-H326 IonicContact OD1-CE1 2.65Å; S324-H326 PolarHBondContact OG-NE2 3.12Å; H326-Y328 HydrophobicContact CB-CE2 4.33Å; H326-M334 HydrophobicContact CB-CG 3.93Å; H326-M334 HydrophobicContact CB-SD 4.25Å; H326-L335 WeakPolarHBondContact CA-O 3.33Å; H326-F372 AromaticContact CE1-CZ 3.98Å; H326-F372 AromaticContact ND1-CZ 3.79Å
327	F	93.8	Very high	90.6	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.009	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	154.6	174.6	-64.4	-95.2	0	0	0	110.9	V319 V325 M334 L335 V337 V345 P346 L351 A388 T392	V319-F327 HydrophobicContact CG2-CD1 3.89Å; V319-F327 HydrophobicContact CG2-CE1 4.03Å; V325-F327 HydrophobicContact CG1-CD2 4.44Å; V325-F327 HydrophobicContact CG1-CE2 3.92Å; V325-F327 HydrophobicContact CG1-CZ 4.32Å; F327-M334 CarbonylContact O-C 3.44Å; F327-M334 WeakPolarHBondContact O-CA 2.98Å; F327-L335 HydrophobicContact CB-CB 4.33Å; F327-L335 PolarHBondContact N-O 2.96Å; F327-L335 PolarHBondContact O-N 2.97Å; F327-V337 HydrophobicContact CD2-CG2 3.95Å; F327-V337 HydrophobicContact CE2-CB 4.49Å; F327-V337 HydrophobicContact CE2-CG2 3.75Å; F327-V345 HydrophobicContact CE1-CG1 4.39Å; F327-P346 HydrophobicContact CB-CG 4.11Å; F327-P346 HydrophobicContact CD2-CG 3.63Å; F327-P346 HydrophobicContact CE2-CG 4.16Å; F327-P346 HydrophobicContact CG-CG 3.92Å; F327-L351 HydrophobicContact CB-CD2 4.37Å; F327-A388 HydrophobicContact CE2-CB 4.5Å; F327-A388 HydrophobicContact CZ-CB 3.78Å; F327-T392 WeakPolarHBondContact CE1-OG1 3.34Å
328	Y	91.6	Very high	90.5	Very high	3 Å²	3	34.8 Å²	34.8	1%	0.012	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	138	179.8	-56.9	-87.7	0	0	0	111.3	F318 T320 H326 K333 M334 L351 L364 I368 M371 F372	F318-Y328 HydrophobicContact CB-CD2 4.11Å; F318-Y328 WeakPolarHBondContact O-CD2 3.29Å; T320-Y328 HydrophobicContact CG2-CE2 3.57Å; T320-Y328 VanDerWaalsContact CG2-OH 3.28Å; T320-Y328 WeakPolarHBondContact CG2-OH 3.34Å; T320-Y328 PolarHBondContact OG1-OH 2.9Å; H326-Y328 HydrophobicContact CB-CE2 4.33Å; Y328-K333 WeakPolarHBondContact CA-O 3.32Å; Y328-M334 HydrophobicContact CD1-CB 4.23Å; Y328-M334 HydrophobicContact CD1-CG 4.49Å; Y328-M334 HydrophobicContact CE1-CB 3.96Å; Y328-M334 HydrophobicContact CE1-CE 3.8Å; Y328-M334 HydrophobicContact CE1-CG 3.91Å; Y328-M334 WeakPolarHBondContact OH-CE 3.04Å; Y328-L351 VanDerWaalsContact O-CD2 3.23Å; Y328-L351 WeakPolarHBondContact O-CD2 3.47Å; Y328-L364 HydrophobicContact CD1-CD1 3.45Å; Y328-L364 VanDerWaalsContact CD1-CD1 3.45Å; Y328-L364 HydrophobicContact CE1-CD1 4.18Å; Y328-L364 HydrophobicContact CG-CD1 3.64Å; Y328-L364 HydrophobicContact CG-CD2 4.44Å; Y328-I368 HydrophobicContact CD2-CD1 4.45Å; Y328-I368 HydrophobicContact CE1-CD1 4.46Å; Y328-I368 HydrophobicContact CE1-CG1 4.02Å; Y328-I368 HydrophobicContact CE2-CD1 4.13Å; Y328-I368 HydrophobicContact CE2-CG1 4.39Å; Y328-M371 HydrophobicContact CE1-CE 4.06Å; Y328-F372 WeakPolarHBondContact OH-CE2 3.46Å
329	D	85	Confident	90.4	Very high	25 Å²	25	38.3 Å²	38.3	13%	0.134	20%	0.198	C	C	.	.			trans	-97.7	177.1	167.2	69.4	24.4	0	0	0	112.2	T331 K333 N350	D329-T331 PolarHBondContact O-N 2.9Å; D329-T331 VanDerWaalsContact O-N 3.16Å; D329-T331 WeakPolarHBondContact OD1-CA 3.5Å; D329-T331 PolarHBondContact OD1-N 3.1Å; D329-T331 PolarHBondContact OD1-OG1 3.19Å; D329-K333 PolarHBondContact N-O 3.44Å; D329-K333 VanDerWaalsContact OD1-CB 3.25Å; D329-K333 WeakPolarHBondContact OD1-CB 3.32Å; D329-K333 PolarHBondContact OD1-N 3.11Å; D329-K333 WeakPolarHBondContact OD2-CB 3.48Å; D329-N350 WeakPolarHBondContact CA-O 3.43Å
330	E	73.5	Confident	90.2	Very high	79 Å²	79	39 Å²	39	37%	0.369	20%	0.203	S	C	.	.	S	Bend	trans	-59.2	-18.1	177.9	72.7	-173.8	175.7	0	0	115	P332 N350 V353	E330-P332 VanDerWaalsContact C-N 3.3Å; E330-P332 WeakPolarHBondContact O-CD 3.48Å; E330-N350 HydrophobicContact CB-CB 4.2Å; E330-N350 VanDerWaalsContact CD-CB 3.41Å; E330-N350 HydrophobicContact CG-CB 3.85Å; E330-N350 PolarHBondContact N-O 3.31Å; E330-N350 VanDerWaalsContact N-O 3.16Å; E330-N350 PolarHBondContact OE1-ND2 3.36Å; E330-N350 WeakPolarHBondContact OE2-CB 3.3Å; E330-N350 PolarHBondContact OE2-ND2 2.8Å; E330-V353 HydrophobicContact CB-CG2 4.36Å
331	T	77.4	Confident	89.9	Confident	89 Å²	89	44.6 Å²	44.6	55%	0.546	23%	0.229	S	C	.	.	S	Bend	trans	-97	32.5	179.5	66	0	0	0	0	112.5	D329 K333	D329-T331 PolarHBondContact O-N 2.9Å; D329-T331 VanDerWaalsContact O-N 3.16Å; D329-T331 WeakPolarHBondContact OD1-CA 3.5Å; D329-T331 PolarHBondContact OD1-N 3.1Å; D329-T331 PolarHBondContact OD1-OG1 3.19Å; T331-K333 PolarHBondContact O-N 3.36Å
332	P	80.4	Confident	89.5	Confident	4 Å²	4	51.7 Å²	51.7	3%	0.026	26%	0.262	C	S	.	.			trans	22.5	39.5	-154.8	0.1	-23.9	0	0	0	117.8	E330 E363 L364 K367	E330-P332 VanDerWaalsContact C-N 3.3Å; E330-P332 WeakPolarHBondContact O-CD 3.48Å; P332-E363 HydrophobicContact CG-CG 4.24Å; P332-L364 HydrophobicContact CB-CB 4.28Å; P332-L364 HydrophobicContact CB-CD1 3.85Å; P332-K367 HydrophobicContact CB-CD 3.69Å; P332-K367 HydrophobicContact CG-CD 4.49Å; P332-K367 PolarHBondContact O-NZ 3.27Å
333	K	85.6	Confident	89.2	Confident	119 Å²	119	52.4 Å²	52.4	52%	0.517	27%	0.265	S	S	.	.			trans	-81	126.9	178.6	-173.7	-175	174.4	-175.8	0	109.8	Y328 D329 T331	Y328-K333 WeakPolarHBondContact CA-O 3.32Å; D329-K333 PolarHBondContact N-O 3.44Å; D329-K333 VanDerWaalsContact OD1-CB 3.25Å; D329-K333 WeakPolarHBondContact OD1-CB 3.32Å; D329-K333 PolarHBondContact OD1-N 3.11Å; D329-K333 WeakPolarHBondContact OD2-CB 3.48Å; T331-K333 PolarHBondContact O-N 3.36Å
334	M	90.8	Very high	89	Confident	54 Å²	54	53.4 Å²	53.4	27%	0.266	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	129.5	178.2	-173.8	-167.5	-79.6	0	0	110.9	H326 F327 Y328 V336 M371 F372	H326-M334 HydrophobicContact CB-CG 3.93Å; H326-M334 HydrophobicContact CB-SD 4.25Å; F327-M334 CarbonylContact O-C 3.44Å; F327-M334 WeakPolarHBondContact O-CA 2.98Å; Y328-M334 HydrophobicContact CD1-CB 4.23Å; Y328-M334 HydrophobicContact CD1-CG 4.49Å; Y328-M334 HydrophobicContact CE1-CB 3.96Å; Y328-M334 HydrophobicContact CE1-CE 3.8Å; Y328-M334 HydrophobicContact CE1-CG 3.91Å; Y328-M334 WeakPolarHBondContact OH-CE 3.04Å; M334-V336 HydrophobicContact CG-CG2 4.21Å; M334-V336 HydrophobicContact SD-CG2 4Å; M334-M371 HydrophobicContact CE-CE 3.78Å; M334-M371 HydrophobicContact CE-SD 3.44Å; M334-M371 WeakPolarHBondContact CE-SD 3.28Å; M334-F372 HydrophobicContact CE-CE2 3.73Å; M334-F372 HydrophobicContact CE-CZ 3.64Å
335	L	91.5	Very high	88.6	Confident	44 Å²	44	54.1 Å²	54.1	23%	0.23	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	116.1	173	-58.4	172.1	0	0	0	108.8	H326 F327 P346	H326-L335 WeakPolarHBondContact CA-O 3.33Å; F327-L335 HydrophobicContact CB-CB 4.33Å; F327-L335 PolarHBondContact N-O 2.96Å; F327-L335 PolarHBondContact O-N 2.97Å; L335-P346 HydrophobicContact CB-CB 4.35Å; L335-P346 HydrophobicContact CB-CG 3.95Å; L335-P346 HydrophobicContact CD1-CB 4Å; L335-P346 HydrophobicContact CD1-CG 3.96Å
336	V	93.2	Very high	88	Confident	77 Å²	77	55.3 Å²	55.3	47%	0.467	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	126.9	-173.6	-175.5	0	0	0	0	110.5	M334 N338	M334-V336 HydrophobicContact CG-CG2 4.21Å; M334-V336 HydrophobicContact SD-CG2 4Å; V336-N338 VanDerWaalsContact CG1-OD1 3.27Å; V336-N338 WeakPolarHBondContact CG1-OD1 3.48Å
337	V	93.2	Very high	86.7	Confident	4 Å²	4	63.3 Å²	63.3	2%	0.024	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	109.1	174.3	-175.6	0	0	0	0	109	V325 F327 M343 F344 P346	V325-V337 PolarHBondContact N-O 2.71Å; V325-V337 VanDerWaalsContact N-O 3.09Å; V325-V337 PolarHBondContact O-N 3.37Å; F327-V337 HydrophobicContact CD2-CG2 3.95Å; F327-V337 HydrophobicContact CE2-CB 4.49Å; F327-V337 HydrophobicContact CE2-CG2 3.75Å; V337-M343 HydrophobicContact CG1-CE 3.56Å; V337-F344 HydrophobicContact CG1-CD1 4.2Å; V337-F344 HydrophobicContact CG1-CE1 3.75Å; V337-F344 HydrophobicContact CG1-CZ 4.03Å; V337-F344 HydrophobicContact CG2-CE2 4.39Å; V337-F344 HydrophobicContact CG2-CZ 4.31Å; V337-P346 HydrophobicContact CG2-CG 4.26Å
338	N	91.6	Very high	85.3	Confident	114 Å²	114	64 Å²	64	61%	0.61	33%	0.328	S	S	*	.			trans	-94	-15	-178.6	-69.3	-24	0	0	0	113.5	S324 V336 V340	S324-N338 VanDerWaalsContact CB-OD1 3.23Å; S324-N338 WeakPolarHBondContact CB-OD1 3.36Å; V336-N338 VanDerWaalsContact CG1-OD1 3.27Å; V336-N338 WeakPolarHBondContact CG1-OD1 3.48Å; N338-V340 VanDerWaalsContact C-N 3.29Å; N338-V340 PolarHBondContact O-N 3.21Å
339	D	92	Very high	84	Confident	81 Å²	81	72.9 Å²	72.9	43%	0.433	37%	0.367	S	S	.	.			trans	-81	74.2	-178.1	-171.7	-2.8	0	0	0	111.5	Q341 E342 M343	D339-Q341 PolarHBondContact O-N 3.31Å; D339-Q341 VanDerWaalsContact O-N 3.1Å; D339-Q341 PolarHBondContact OD1-N 2.88Å; D339-E342 CarbonylContact O-C 3.46Å; D339-E342 PolarHBondContact O-N 3.28Å; D339-M343 VanDerWaalsContact C-CE 3.44Å; D339-M343 WeakPolarHBondContact O-CE 3.34Å
340	V	89.9	Confident	83.7	Confident	19 Å²	19	75.2 Å²	75.2	12%	0.115	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-5.7	-175.6	-62.4	0	0	0	0	114.9	N338 V381 P384 A414 P415	N338-V340 VanDerWaalsContact C-N 3.29Å; N338-V340 PolarHBondContact O-N 3.21Å; V340-V381 HydrophobicContact CG1-CG1 4.26Å; V340-V381 HydrophobicContact CG1-CG2 4.16Å; V340-P384 HydrophobicContact CB-CB 4.18Å; V340-P384 HydrophobicContact CB-CG 3.98Å; V340-P384 VanDerWaalsContact O-CG 3.28Å; V340-P384 WeakPolarHBondContact O-CG 3.41Å; V340-A414 HydrophobicContact CB-CB 4.25Å; V340-A414 HydrophobicContact CG2-CB 3.97Å; V340-P415 WeakPolarHBondContact O-CD 3.43Å
341	Q	89	Confident	84.3	Confident	117 Å²	117	71.8 Å²	71.8	55%	0.547	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-36.1	177.9	-62.3	-63.2	-31.4	0	0	111.7	D339 E413	D339-Q341 PolarHBondContact O-N 3.31Å; D339-Q341 VanDerWaalsContact O-N 3.1Å; D339-Q341 PolarHBondContact OD1-N 2.88Å; Q341-E413 PolarHBondContact NE2-O 2.94Å
342	E	88.7	Confident	85	Confident	148 Å²	148	68.9 Å²	68.9	69%	0.692	34%	0.343	S	S	*	.	S	Bend	trans	-132.8	90.4	-179.8	-167.7	173.2	175.5	0	0	110.2	D339 F344	D339-E342 CarbonylContact O-C 3.46Å; D339-E342 PolarHBondContact O-N 3.28Å; E342-F344 PolarHBondContact O-N 3.31Å
343	M	89.3	Confident	85.4	Confident	20 Å²	20	69.1 Å²	69.1	10%	0.099	35%	0.345	C	S	.	.			trans	-68.2	132.8	-178.9	-71.5	-75.7	84.9	0	0	112.5	V325 V337 D339 P384 Q387 A388	V325-M343 HydrophobicContact CB-SD 4.27Å; V325-M343 HydrophobicContact CG2-SD 3.78Å; V337-M343 HydrophobicContact CG1-CE 3.56Å; D339-M343 VanDerWaalsContact C-CE 3.44Å; D339-M343 WeakPolarHBondContact O-CE 3.34Å; M343-P384 HydrophobicContact CG-CB 3.8Å; M343-P384 VanDerWaalsContact CG-O 3.27Å; M343-P384 WeakPolarHBondContact CG-O 3.09Å; M343-P384 HydrophobicContact SD-CB 3.8Å; M343-Q387 HydrophobicContact CB-CB 4.27Å; M343-Q387 HydrophobicContact CB-CG 4.04Å; M343-Q387 HydrophobicContact CG-CB 4.24Å; M343-Q387 HydrophobicContact CG-CG 4.48Å; M343-A388 HydrophobicContact CG-CB 4.4Å; M343-A388 HydrophobicContact SD-CB 4.02Å
344	F	88	Confident	85.6	Confident	109 Å²	109	70.4 Å²	70.4	48%	0.478	35%	0.346	S	S	.	.			trans	-130.2	158	170.4	66.7	-88.4	0	0	0	110.3	V337 E342	V337-F344 HydrophobicContact CG1-CD1 4.2Å; V337-F344 HydrophobicContact CG1-CE1 3.75Å; V337-F344 HydrophobicContact CG1-CZ 4.03Å; V337-F344 HydrophobicContact CG2-CE2 4.39Å; V337-F344 HydrophobicContact CG2-CZ 4.31Å; E342-F344 PolarHBondContact O-N 3.31Å
345	V	86.5	Confident	85.4	Confident	18 Å²	18	69 Å²	69	11%	0.109	34%	0.341	C	S	.	.			trans	-93.6	120	175.7	-172.2	0	0	0	0	108	F327 M347 L351 E391 T392 A395 Y396	F327-V345 HydrophobicContact CE1-CG1 4.39Å; V345-M347 PolarHBondContact O-N 3.24Å; V345-L351 HydrophobicContact CG1-CD1 3.98Å; V345-E391 HydrophobicContact CG2-CB 3.81Å; V345-T392 HydrophobicContact CG1-CG2 4.46Å; V345-T392 VanDerWaalsContact CG2-N 3.31Å; V345-T392 WeakPolarHBondContact CG2-OG1 3.27Å; V345-A395 HydrophobicContact CG2-CB 4.46Å; V345-Y396 HydrophobicContact CG1-CE2 4.34Å
346	P	83.1	Confident	85.1	Confident	25 Å²	25	70.6 Å²	70.6	16%	0.162	36%	0.356	C	S	.	.			trans	-68.6	103.1	173.8	28.9	-32.1	0	0	0	107.7	F327 L335 V337 G348	F327-P346 HydrophobicContact CB-CG 4.11Å; F327-P346 HydrophobicContact CD2-CG 3.63Å; F327-P346 HydrophobicContact CE2-CG 4.16Å; F327-P346 HydrophobicContact CG-CG 3.92Å; L335-P346 HydrophobicContact CB-CB 4.35Å; L335-P346 HydrophobicContact CB-CG 3.95Å; L335-P346 HydrophobicContact CD1-CB 4Å; L335-P346 HydrophobicContact CD1-CG 3.96Å; V337-P346 HydrophobicContact CG2-CG 4.26Å; P346-G348 PolarHBondContact O-N 2.98Å
347	M	67.2	Low	84.7	Confident	178 Å²	178	71.1 Å²	71.1	88%	0.877	35%	0.354	S	S	*	.			trans	-58.1	111.6	-173.7	-62.9	-157.5	-36.9	0	0	110.7	V345	V345-M347 PolarHBondContact O-N 3.24Å
348	G	64.8	Low	84.3	Confident	18 Å²	18	71.9 Å²	71.9	19%	0.186	36%	0.361	C	S	.	.			trans	-119.2	139.5	174.1	0	0	0	0	0	110.1	P346 N350 Y396	P346-G348 PolarHBondContact O-N 2.98Å; G348-N350 PolarHBondContact O-N 2.87Å; G348-Y396 PolarHBondContact O-OH 3.46Å
349	K	62.9	Low	84.2	Confident	189 Å²	189	69 Å²	69	82%	0.822	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	124.6	157.5	-64.5	-178.9	179.9	-178.5	0	104.8
350	N	78.5	Confident	84	Confident	73 Å²	73	66.5 Å²	66.5	39%	0.39	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.1	43.2	168	-38.1	-26.6	0	0	0	116.9	D329 E330 G348	D329-N350 WeakPolarHBondContact CA-O 3.43Å; E330-N350 HydrophobicContact CB-CB 4.2Å; E330-N350 VanDerWaalsContact CD-CB 3.41Å; E330-N350 HydrophobicContact CG-CB 3.85Å; E330-N350 PolarHBondContact N-O 3.31Å; E330-N350 VanDerWaalsContact N-O 3.16Å; E330-N350 PolarHBondContact OE1-ND2 3.36Å; E330-N350 WeakPolarHBondContact OE2-CB 3.3Å; E330-N350 PolarHBondContact OE2-ND2 2.8Å; G348-N350 PolarHBondContact O-N 2.87Å
351	L	87.6	Confident	84.1	Confident	8 Å²	8	65.6 Å²	65.6	4%	0.042	34%	0.343	C	S	.	.			trans	-75.1	-23.4	165.5	-70.2	177.7	0	0	0	113.4	F327 Y328 V345 T392 Y396	F327-L351 HydrophobicContact CB-CD2 4.37Å; Y328-L351 VanDerWaalsContact O-CD2 3.23Å; Y328-L351 WeakPolarHBondContact O-CD2 3.47Å; V345-L351 HydrophobicContact CG1-CD1 3.98Å; L351-T392 HydrophobicContact CD1-CG2 4.46Å; L351-Y396 HydrophobicContact CD1-CE2 4.01Å
352	F	91.1	Very high	84.2	Confident	27 Å²	27	62 Å²	62	12%	0.118	33%	0.327	C	S	.	.			trans	-105.2	124.4	-176.5	-56.2	-24.5	0	0	0	109.1	V273 E315 A317 T392 Y396 R398	V273-F352 HydrophobicContact CG1-CD1 3.75Å; V273-F352 HydrophobicContact CG1-CE1 3.83Å; V273-F352 HydrophobicContact CG1-CG 4.17Å; V273-F352 HydrophobicContact CG1-CZ 4.32Å; V273-F352 HydrophobicContact CG2-CD1 4.42Å; V273-F352 HydrophobicContact CG2-CD2 3.85Å; V273-F352 HydrophobicContact CG2-CE1 4.43Å; V273-F352 HydrophobicContact CG2-CE2 3.87Å; V273-F352 HydrophobicContact CG2-CG 4.15Å; V273-F352 HydrophobicContact CG2-CZ 4.16Å; E315-F352 HydrophobicContact CB-CB 3.94Å; A317-F352 HydrophobicContact CB-CD1 3.78Å; A317-F352 HydrophobicContact CB-CE1 4.08Å; F352-T392 HydrophobicContact CE1-CG2 3.75Å; F352-T392 HydrophobicContact CZ-CG2 3.91Å; F352-Y396 AromaticContact CE2-CD1 3.9Å; F352-Y396 HydrophobicContact CE2-CD1 3.9Å; F352-Y396 HydrophobicContact CE2-CD2 4.29Å; F352-Y396 AromaticContact CE2-CG 3.7Å; F352-Y396 HydrophobicContact CE2-CG 3.7Å; F352-Y396 HydrophobicContact CZ-CD1 4.43Å; F352-Y396 HydrophobicContact CZ-CD2 4.04Å; F352-Y396 AromaticContact CZ-CG 3.91Å; F352-Y396 HydrophobicContact CZ-CG 3.91Å; F352-R398 HydrophobicContact CE2-CG 3.81Å
353	V	89.9	Confident	84.4	Confident	10 Å²	10	60.5 Å²	60.5	6%	0.061	32%	0.32	C	S	.	.	B	Isolated β-bridge	trans	-115.5	136.8	-176.8	-174.6	0	0	0	0	109	V316 E330 E357 I361	V316-V353 PolarHBondContact N-O 3.04Å; V316-V353 PolarHBondContact O-N 3.09Å; E330-V353 HydrophobicContact CB-CG2 4.36Å; V353-E357 HydrophobicContact CG1-CB 3.84Å; V353-I361 HydrophobicContact CB-CD1 4.29Å; V353-I361 HydrophobicContact CB-CG1 4.11Å; V353-I361 HydrophobicContact CG1-CD1 3.96Å; V353-I361 HydrophobicContact CG1-CG1 3.7Å
354	R	88.9	Confident	84.6	Confident	145 Å²	145	60 Å²	60	55%	0.547	32%	0.317	S	S	.	.			trans	-75.4	147	177.4	-73.7	-178	178.2	-175.2	-0	111.2	E315 S356 E357	E315-R354 HydrophobicContact CG-CG 3.88Å; E315-R354 IonicContact OE1-NE 2.76Å; R354-S356 WeakPolarHBondContact CB-OG 3.46Å; R354-S356 PolarHBondContact O-N 3.17Å; R354-S356 VanDerWaalsContact O-N 3.14Å; R354-E357 WeakPolarHBondContact O-CA 3.27Å; R354-E357 WeakPolarHBondContact O-CB 3.3Å; R354-E357 PolarHBondContact O-N 3.02Å
355	P	86.5	Confident	84.8	Confident	24 Å²	24	54.9 Å²	54.9	16%	0.156	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-59.2	-27.1	174.9	-24.6	35.1	0	0	0	113.4	L304 I314 E357 A358	L304-P355 HydrophobicContact CD1-CB 3.98Å; L304-P355 HydrophobicContact CD1-CG 3.35Å; I314-P355 WeakPolarHBondContact O-CD 3.12Å; I314-P355 VanDerWaalsContact O-CG 3.23Å; I314-P355 WeakPolarHBondContact O-CG 3.43Å; P355-E357 PolarHBondContact O-N 3.01Å; P355-A358 WeakPolarHBondContact O-CB 3.37Å; P355-A358 PolarHBondContact O-N 3.4Å
356	S	85.1	Confident	85.1	Confident	78 Å²	78	59.4 Å²	59.4	55%	0.545	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-60.2	-24	172.8	56.1	0	0	0	0	113.1	R354 A358	R354-S356 WeakPolarHBondContact CB-OG 3.46Å; R354-S356 PolarHBondContact O-N 3.17Å; R354-S356 VanDerWaalsContact O-N 3.14Å; S356-A358 VanDerWaalsContact C-N 3.27Å; S356-A358 PolarHBondContact O-N 3.48Å
357	E	85.6	Confident	85.6	Confident	88 Å²	88	62.1 Å²	62.1	41%	0.411	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-95.8	36.5	177.2	-63	171	-152.2	0	0	111.3	V353 R354 P355 G359 A360 I361	V353-E357 HydrophobicContact CG1-CB 3.84Å; R354-E357 WeakPolarHBondContact O-CA 3.27Å; R354-E357 WeakPolarHBondContact O-CB 3.3Å; R354-E357 PolarHBondContact O-N 3.02Å; P355-E357 PolarHBondContact O-N 3.01Å; E357-G359 PolarHBondContact O-N 2.93Å; E357-A360 PolarHBondContact O-N 3.46Å; E357-I361 PolarHBondContact O-N 3.16Å
358	A	83.5	Confident	86.9	Confident	21 Å²	21	53.7 Å²	53.7	17%	0.174	28%	0.283	C	S	.	.	H	α-helix	trans	-50.5	-28.7	-177.4	0	0	0	0	0	113.8	L301 P355 S356 I361 I362	L301-A358 HydrophobicContact CD1-CB 4.31Å; P355-A358 WeakPolarHBondContact O-CB 3.37Å; P355-A358 PolarHBondContact O-N 3.4Å; S356-A358 VanDerWaalsContact C-N 3.27Å; S356-A358 PolarHBondContact O-N 3.48Å; A358-I361 PolarHBondContact O-N 3.37Å; A358-I362 WeakPolarHBondContact O-CB 3.07Å; A358-I362 WeakPolarHBondContact O-CD1 3.34Å; A358-I362 WeakPolarHBondContact O-CG1 3.46Å; A358-I362 PolarHBondContact O-N 3.13Å
359	G	89.1	Confident	88.2	Confident	53 Å²	53	54.7 Å²	54.7	55%	0.546	28%	0.284	S	S	.	.	H	α-helix	trans	-59.2	-47.5	175.5	0	0	0	0	0	113.5	E357 I361 I362 E363	E357-G359 PolarHBondContact O-N 2.93Å; G359-I361 VanDerWaalsContact C-N 3.32Å; G359-I361 PolarHBondContact O-N 3.13Å; G359-I362 PolarHBondContact O-N 3.13Å; G359-E363 PolarHBondContact O-N 3.45Å
360	A	88.7	Confident	89.7	Confident	28 Å²	28	50.6 Å²	50.6	23%	0.231	27%	0.274	C	S	.	.	H	α-helix	trans	-65.8	-37.1	178.3	0	0	0	0	0	111.5	E357 L364	E357-A360 PolarHBondContact O-N 3.46Å; A360-L364 WeakPolarHBondContact O-CB 3.32Å; A360-L364 PolarHBondContact O-N 3.08Å
361	I	91.2	Very high	90.4	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-66	-44.3	176.5	-62.1	171.3	0	0	0	111.1	I297 L301 F318 V353 E357 A358 G359 L364 T365	I297-I361 HydrophobicContact CG1-CG2 3.88Å; L301-I361 HydrophobicContact CD1-CB 4.18Å; L301-I361 HydrophobicContact CD1-CD1 3.73Å; L301-I361 HydrophobicContact CD1-CG2 3.89Å; L301-I361 HydrophobicContact CD2-CD1 4.19Å; F318-I361 HydrophobicContact CE2-CB 4.48Å; F318-I361 HydrophobicContact CE2-CG1 4.42Å; F318-I361 HydrophobicContact CE2-CG2 3.54Å; F318-I361 HydrophobicContact CZ-CG2 3.5Å; F318-I361 VanDerWaalsContact CZ-CG2 3.5Å; V353-I361 HydrophobicContact CB-CD1 4.29Å; V353-I361 HydrophobicContact CB-CG1 4.11Å; V353-I361 HydrophobicContact CG1-CD1 3.96Å; V353-I361 HydrophobicContact CG1-CG1 3.7Å; E357-I361 PolarHBondContact O-N 3.16Å; A358-I361 PolarHBondContact O-N 3.37Å; G359-I361 VanDerWaalsContact C-N 3.32Å; G359-I361 PolarHBondContact O-N 3.13Å; I361-L364 PolarHBondContact O-N 2.61Å; I361-T365 WeakPolarHBondContact O-CG2 3.35Å; I361-T365 PolarHBondContact O-N 2.69Å; I361-T365 PolarHBondContact O-OG1 3.37Å
362	I	92.2	Very high	90.8	Very high	43 Å²	43	51 Å²	51	22%	0.221	28%	0.275	C	S	.	.	H	α-helix	trans	-61.8	-50.3	178.1	-68.9	161	0	0	0	110	I297 K298 A358 G359 L364 T365 E366	I297-I362 HydrophobicContact CG2-CG1 4.16Å; K298-I362 HydrophobicContact CB-CD1 4.02Å; K298-I362 HydrophobicContact CB-CG1 4.38Å; K298-I362 HydrophobicContact CD-CD1 3.97Å; K298-I362 HydrophobicContact CG-CD1 4.1Å; A358-I362 WeakPolarHBondContact O-CB 3.07Å; A358-I362 WeakPolarHBondContact O-CD1 3.34Å; A358-I362 WeakPolarHBondContact O-CG1 3.46Å; A358-I362 PolarHBondContact O-N 3.13Å; G359-I362 PolarHBondContact O-N 3.13Å; I362-L364 VanDerWaalsContact C-N 3.28Å; I362-L364 PolarHBondContact O-N 2.93Å; I362-T365 WeakPolarHBondContact CA-OG1 3.36Å; I362-T365 PolarHBondContact O-N 3.35Å; I362-T365 VanDerWaalsContact O-N 3.07Å; I362-T365 PolarHBondContact O-OG1 3.49Å; I362-E366 HydrophobicContact CG2-CG 4.4Å; I362-E366 WeakPolarHBondContact O-CG 3.47Å; I362-E366 PolarHBondContact O-N 3Å
363	E	92.7	Very high	90.8	Very high	116 Å²	116	53.2 Å²	53.2	54%	0.542	29%	0.293	S	S	.	.	H	α-helix	trans	-56	-43.5	177.5	-174	-177.1	165.3	0	0	111.5	P332 G359 E366 K367	P332-E363 HydrophobicContact CG-CG 4.24Å; G359-E363 PolarHBondContact O-N 3.45Å; E363-E366 PolarHBondContact O-N 3.48Å; E363-K367 WeakPolarHBondContact O-CB 3.41Å; E363-K367 PolarHBondContact O-N 3.23Å
364	L	92.5	Very high	90.9	Very high	8 Å²	8	60.8 Å²	60.8	4%	0.042	33%	0.328	C	S	.	.	H	α-helix	trans	-60	-47.4	175.3	172.4	59.9	0	0	0	112	F318 Y328 P332 A360 I361 I362 K367 I368	F318-L364 HydrophobicContact CB-CD2 4.05Å; F318-L364 HydrophobicContact CD2-CD2 3.58Å; F318-L364 HydrophobicContact CE2-CD2 4.31Å; F318-L364 HydrophobicContact CG-CD2 3.96Å; Y328-L364 HydrophobicContact CD1-CD1 3.45Å; Y328-L364 VanDerWaalsContact CD1-CD1 3.45Å; Y328-L364 HydrophobicContact CE1-CD1 4.18Å; Y328-L364 HydrophobicContact CG-CD1 3.64Å; Y328-L364 HydrophobicContact CG-CD2 4.44Å; P332-L364 HydrophobicContact CB-CB 4.28Å; P332-L364 HydrophobicContact CB-CD1 3.85Å; A360-L364 WeakPolarHBondContact O-CB 3.32Å; A360-L364 PolarHBondContact O-N 3.08Å; I361-L364 PolarHBondContact O-N 2.61Å; I362-L364 VanDerWaalsContact C-N 3.28Å; I362-L364 PolarHBondContact O-N 2.93Å; L364-K367 PolarHBondContact O-N 3.41Å; L364-I368 HydrophobicContact CD1-CD1 4.03Å; L364-I368 HydrophobicContact CD1-CG1 4.19Å; L364-I368 HydrophobicContact CG-CD1 4.06Å; L364-I368 WeakPolarHBondContact O-CG1 3.48Å; L364-I368 PolarHBondContact O-N 2.89Å
365	T	93.2	Very high	91.1	Very high	2 Å²	2	55.3 Å²	55.3	1%	0.012	31%	0.309	C	S	.	.	H	α-helix	trans	-65.1	-39.6	179.7	56.1	0	0	0	0	113	I297 F318 I361 I362 K367 I368 L369	I297-T365 HydrophobicContact CB-CG2 4.32Å; I297-T365 HydrophobicContact CG1-CG2 4.2Å; I297-T365 HydrophobicContact CG2-CG2 4.12Å; F318-T365 HydrophobicContact CE1-CG2 3.92Å; F318-T365 HydrophobicContact CZ-CG2 4.14Å; I361-T365 WeakPolarHBondContact O-CG2 3.35Å; I361-T365 PolarHBondContact O-N 2.69Å; I361-T365 PolarHBondContact O-OG1 3.37Å; I362-T365 WeakPolarHBondContact CA-OG1 3.36Å; I362-T365 PolarHBondContact O-N 3.35Å; I362-T365 VanDerWaalsContact O-N 3.07Å; I362-T365 PolarHBondContact O-OG1 3.49Å; T365-K367 VanDerWaalsContact C-N 3.31Å; T365-K367 PolarHBondContact O-N 2.9Å; T365-I368 PolarHBondContact O-N 3.46Å; T365-L369 WeakPolarHBondContact O-CG 3.27Å; T365-L369 PolarHBondContact O-N 2.94Å; T365-L369 VanDerWaalsContact O-N 3.09Å
366	E	93.9	Very high	91.5	Very high	113 Å²	113	62.6 Å²	62.6	53%	0.528	34%	0.339	S	S	.	.	H	α-helix	trans	-62.7	-39.8	174.3	-70.6	177.8	171.7	0	0	111.4	I362 E363 L369 T370	I362-E366 HydrophobicContact CG2-CG 4.4Å; I362-E366 WeakPolarHBondContact O-CG 3.47Å; I362-E366 PolarHBondContact O-N 3Å; E363-E366 PolarHBondContact O-N 3.48Å; E366-L369 PolarHBondContact O-N 3.5Å; E366-T370 PolarHBondContact O-N 2.85Å; E366-T370 PolarHBondContact O-OG1 3.09Å
367	K	93	Very high	91.9	Very high	83 Å²	83	60.7 Å²	60.7	36%	0.361	32%	0.324	S	S	.	.	H	α-helix	trans	-67.9	-39.7	176.4	-156.7	-168.7	173.2	173.3	0	112.1	P332 E363 L364 T365 T370 M371	P332-K367 HydrophobicContact CB-CD 3.69Å; P332-K367 HydrophobicContact CG-CD 4.49Å; P332-K367 PolarHBondContact O-NZ 3.27Å; E363-K367 WeakPolarHBondContact O-CB 3.41Å; E363-K367 PolarHBondContact O-N 3.23Å; L364-K367 PolarHBondContact O-N 3.41Å; T365-K367 VanDerWaalsContact C-N 3.31Å; T365-K367 PolarHBondContact O-N 2.9Å; K367-T370 PolarHBondContact O-N 3.08Å; K367-M371 HydrophobicContact CB-CE 4.11Å; K367-M371 HydrophobicContact CD-CE 3.73Å; K367-M371 HydrophobicContact CG-CE 3.61Å; K367-M371 HydrophobicContact CG-SD 4.49Å; K367-M371 WeakPolarHBondContact O-CB 3.49Å; K367-M371 VanDerWaalsContact O-CG 3.29Å; K367-M371 WeakPolarHBondContact O-CG 3.21Å; K367-M371 PolarHBondContact O-N 3.2Å
368	I	93.1	Very high	92.2	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.005	33%	0.328	C	S	.	.	H	α-helix	trans	-58	-48.3	173.7	-72	167.7	0	0	0	110.2	V280 T320 Y328 L364 T365 T370 M371 F372	V280-I368 HydrophobicContact CG1-CG2 4.44Å; T320-I368 HydrophobicContact CG2-CD1 4.07Å; T320-I368 HydrophobicContact CG2-CG1 4.34Å; T320-I368 HydrophobicContact CG2-CG2 3.93Å; Y328-I368 HydrophobicContact CD2-CD1 4.45Å; Y328-I368 HydrophobicContact CE1-CD1 4.46Å; Y328-I368 HydrophobicContact CE1-CG1 4.02Å; Y328-I368 HydrophobicContact CE2-CD1 4.13Å; Y328-I368 HydrophobicContact CE2-CG1 4.39Å; L364-I368 HydrophobicContact CD1-CD1 4.03Å; L364-I368 HydrophobicContact CD1-CG1 4.19Å; L364-I368 HydrophobicContact CG-CD1 4.06Å; L364-I368 WeakPolarHBondContact O-CG1 3.48Å; L364-I368 PolarHBondContact O-N 2.89Å; T365-I368 PolarHBondContact O-N 3.46Å; I368-T370 VanDerWaalsContact C-N 3.32Å; I368-T370 PolarHBondContact O-N 3.25Å; I368-M371 PolarHBondContact O-N 2.83Å; I368-F372 HydrophobicContact CG2-CD2 4.18Å; I368-F372 WeakPolarHBondContact O-CD2 3.19Å; I368-F372 PolarHBondContact O-N 2.85Å; I368-F372 VanDerWaalsContact O-N 3.16Å
369	L	93.6	Very high	92.5	Very high	39 Å²	39	63.8 Å²	63.8	20%	0.204	34%	0.34	C	S	.	.	H	α-helix	trans	-59.1	-44	177.4	-67.4	178.7	0	0	0	112	V290 N291 C294 T365 E366 S373	V290-L369 HydrophobicContact CG1-CD2 4.13Å; N291-L369 HydrophobicContact CB-CD2 4.13Å; N291-L369 WeakPolarHBondContact OD1-CD1 3.01Å; C294-L369 HydrophobicContact CB-CD1 3.59Å; C294-L369 HydrophobicContact CB-CD2 3.92Å; C294-L369 HydrophobicContact CB-CG 3.76Å; T365-L369 WeakPolarHBondContact O-CG 3.27Å; T365-L369 PolarHBondContact O-N 2.94Å; T365-L369 VanDerWaalsContact O-N 3.09Å; E366-L369 PolarHBondContact O-N 3.5Å; L369-S373 WeakPolarHBondContact O-CB 3.4Å; L369-S373 PolarHBondContact O-N 3.25Å
370	T	94.2	Very high	92.6	Very high	102 Å²	102	61.4 Å²	61.4	63%	0.626	32%	0.315	S	S	*	.	H	α-helix	trans	-63.7	-47.1	179.1	-56	0	0	0	0	111.3	E366 K367 I368 F372 S373	E366-T370 PolarHBondContact O-N 2.85Å; E366-T370 PolarHBondContact O-OG1 3.09Å; K367-T370 PolarHBondContact O-N 3.08Å; I368-T370 VanDerWaalsContact C-N 3.32Å; I368-T370 PolarHBondContact O-N 3.25Å; T370-F372 PolarHBondContact O-N 3.1Å; T370-S373 PolarHBondContact O-OG 3.18Å
371	M	93.3	Very high	92.7	Very high	72 Å²	72	60.2 Å²	60.2	36%	0.355	31%	0.305	S	S	.	.	H	α-helix	trans	-63	-37.7	-176.4	-76.7	-171	-83.1	0	0	113.5	Y328 M334 K367 I368	Y328-M371 HydrophobicContact CE1-CE 4.06Å; M334-M371 HydrophobicContact CE-CE 3.78Å; M334-M371 HydrophobicContact CE-SD 3.44Å; M334-M371 WeakPolarHBondContact CE-SD 3.28Å; K367-M371 HydrophobicContact CB-CE 4.11Å; K367-M371 HydrophobicContact CD-CE 3.73Å; K367-M371 HydrophobicContact CG-CE 3.61Å; K367-M371 HydrophobicContact CG-SD 4.49Å; K367-M371 WeakPolarHBondContact O-CB 3.49Å; K367-M371 VanDerWaalsContact O-CG 3.29Å; K367-M371 WeakPolarHBondContact O-CG 3.21Å; K367-M371 PolarHBondContact O-N 3.2Å; I368-M371 PolarHBondContact O-N 2.83Å
372	F	94.7	Very high	92.7	Very high	19 Å²	19	61 Å²	61	8%	0.083	31%	0.309	C	S	.	.	H	α-helix	trans	-104.5	2.1	-175.8	-63.2	-77.2	0	0	0	114.5	V280 V285 T320 H326 Y328 M334 I368 T370 E374 N375	V280-F372 HydrophobicContact CB-CB 4.11Å; V280-F372 HydrophobicContact CB-CD1 3.91Å; V280-F372 HydrophobicContact CB-CD2 3.93Å; V280-F372 HydrophobicContact CB-CE1 4.29Å; V280-F372 HydrophobicContact CB-CE2 4.32Å; V280-F372 HydrophobicContact CB-CG 3.71Å; V280-F372 HydrophobicContact CB-CZ 4.49Å; V280-F372 HydrophobicContact CG1-CD2 3.93Å; V280-F372 HydrophobicContact CG1-CE2 4.3Å; V280-F372 HydrophobicContact CG1-CG 4.19Å; V280-F372 HydrophobicContact CG2-CD1 3.7Å; V280-F372 HydrophobicContact CG2-CD2 4.08Å; V280-F372 HydrophobicContact CG2-CE1 3.59Å; V280-F372 HydrophobicContact CG2-CE2 3.98Å; V280-F372 HydrophobicContact CG2-CG 3.95Å; V280-F372 HydrophobicContact CG2-CZ 3.74Å; V285-F372 HydrophobicContact CG2-CB 4.17Å; T320-F372 HydrophobicContact CG2-CE2 4.48Å; H326-F372 AromaticContact CE1-CZ 3.98Å; H326-F372 AromaticContact ND1-CZ 3.79Å; Y328-F372 WeakPolarHBondContact OH-CE2 3.46Å; M334-F372 HydrophobicContact CE-CE2 3.73Å; M334-F372 HydrophobicContact CE-CZ 3.64Å; I368-F372 HydrophobicContact CG2-CD2 4.18Å; I368-F372 WeakPolarHBondContact O-CD2 3.19Å; I368-F372 PolarHBondContact O-N 2.85Å; I368-F372 VanDerWaalsContact O-N 3.16Å; T370-F372 PolarHBondContact O-N 3.1Å; F372-E374 PolarHBondContact O-N 2.95Å; F372-E374 VanDerWaalsContact O-N 3.12Å; F372-N375 HydrophobicContact CB-CB 4.26Å; F372-N375 HydrophobicContact CD1-CB 4.19Å; F372-N375 WeakPolarHBondContact O-CB 3.18Å; F372-N375 PolarHBondContact O-N 2.85Å
373	S	92.4	Very high	92.5	Very high	72 Å²	72	59 Å²	59	50%	0.503	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-35.1	180	58.1	0	0	0	0	114	L369 T370	L369-S373 WeakPolarHBondContact O-CB 3.4Å; L369-S373 PolarHBondContact O-N 3.25Å; T370-S373 PolarHBondContact O-OG 3.18Å
374	E	92	Very high	92.5	Very high	170 Å²	170	53.6 Å²	53.6	79%	0.794	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	15.3	178.4	-59.4	-169.4	168.1	0	0	113.6	F372 K376	F372-E374 PolarHBondContact O-N 2.95Å; F372-E374 VanDerWaalsContact O-N 3.12Å; E374-K376 PolarHBondContact O-N 2.85Å
375	N	92.6	Very high	92.5	Very high	29 Å²	29	53.3 Å²	53.3	16%	0.155	27%	0.272	C	S	.	.			trans	-61.6	131.6	-179.1	-166.6	3.9	0	0	0	111	V280 Y282 D322 F372 V377	V280-N375 PolarHBondContact O-ND2 3.39Å; Y282-N375 WeakPolarHBondContact CD2-O 3.44Å; D322-N375 PolarHBondContact OD2-ND2 2.69Å; F372-N375 HydrophobicContact CB-CB 4.26Å; F372-N375 HydrophobicContact CD1-CB 4.19Å; F372-N375 WeakPolarHBondContact O-CB 3.18Å; F372-N375 PolarHBondContact O-N 2.85Å; N375-V377 WeakPolarHBondContact OD1-CB 3.35Å; N375-V377 WeakPolarHBondContact OD1-CG2 3.48Å; N375-V377 PolarHBondContact OD1-N 3.18Å
376	K	94.4	Very high	92.5	Very high	178 Å²	178	53.3 Å²	53.3	77%	0.774	27%	0.272	S	S	*	.			trans	-110.2	-0	-179.5	-62.1	-178.3	-176.3	173.8	0	113.1	E374 T378	E374-K376 PolarHBondContact O-N 2.85Å; K376-T378 PolarHBondContact O-N 3.38Å
377	V	94.1	Very high	92.3	Very high	38 Å²	38	50 Å²	50	23%	0.23	26%	0.257	C	S	.	.			trans	-67.7	128.4	177.2	177.7	0	0	0	0	109.5	S281 Y282 D322 H323 N375 E379	S281-V377 WeakPolarHBondContact CA-O 3.47Å; S281-V377 WeakPolarHBondContact CB-O 3.41Å; Y282-V377 WeakPolarHBondContact CB-O 3.49Å; Y282-V377 PolarHBondContact N-O 3.37Å; D322-V377 HydrophobicContact CB-CB 4.37Å; D322-V377 HydrophobicContact CB-CG1 3.94Å; H323-V377 HydrophobicContact CB-CG1 4.06Å; N375-V377 WeakPolarHBondContact OD1-CB 3.35Å; N375-V377 WeakPolarHBondContact OD1-CG2 3.48Å; N375-V377 PolarHBondContact OD1-N 3.18Å; V377-E379 WeakPolarHBondContact CG1-O 3.42Å
378	T	91.9	Very high	92.3	Very high	80 Å²	80	46.1 Å²	46.1	49%	0.491	24%	0.24	S	C	.	.			trans	-111.5	-21.1	-179.1	49.5	0	0	0	0	113.2	Y282 K376	Y282-T378 HydrophobicContact CD1-CG2 4.4Å; Y282-T378 HydrophobicContact CG-CG2 4.49Å; K376-T378 PolarHBondContact O-N 3.38Å
379	E	89.3	Confident	92.2	Very high	94 Å²	94	46 Å²	46	44%	0.439	24%	0.24	S	C	.	.			trans	-83.1	143.7	176	-60.6	-170.1	106.5	0	0	110.6	D322 H323 V377 L412	D322-E379 CarbonylContact C-O 3.52Å; H323-E379 PolarHBondContact N-O 3.21Å; V377-E379 WeakPolarHBondContact CG1-O 3.42Å; E379-L412 HydrophobicContact CB-CB 4.39Å; E379-L412 HydrophobicContact CB-CD1 4.14Å
380	V	91.4	Very high	92.1	Very high	2 Å²	2	45 Å²	45	1%	0.012	23%	0.234	C	C	.	.			trans	-132.9	147.3	-175.5	-64.1	0	0	0	0	113.2	S281 D322 H406 S408 P410	S281-V380 VanDerWaalsContact CB-CG1 3.49Å; D322-V380 CarbonylContact O-C 3.57Å; D322-V380 VanDerWaalsContact O-CA 3.24Å; D322-V380 WeakPolarHBondContact O-CA 3.5Å; V380-H406 VanDerWaalsContact CG2-CE1 3.49Å; V380-H406 WeakPolarHBondContact CG2-CE1 3.48Å; V380-S408 WeakPolarHBondContact CG2-O 3.34Å; V380-P410 HydrophobicContact CG2-CB 4.34Å; V380-P410 WeakPolarHBondContact O-CA 3.41Å
381	V	91.8	Very high	92	Very high	3 Å²	3	42.7 Å²	42.7	2%	0.018	22%	0.216	C	C	.	.			trans	-111.7	99	175.1	-69.9	0	0	0	0	112.7	Y321 D322 V325 V340 P384 A385 L412 A414	Y321-V381 WeakPolarHBondContact CD2-O 3.4Å; D322-V381 VanDerWaalsContact O-CG2 3.24Å; D322-V381 WeakPolarHBondContact O-CG2 3.48Å; D322-V381 PolarHBondContact O-N 3.23Å; V325-V381 HydrophobicContact CG2-CG2 4.38Å; V340-V381 HydrophobicContact CG1-CG1 4.26Å; V340-V381 HydrophobicContact CG1-CG2 4.16Å; V381-P384 HydrophobicContact CB-CB 4.31Å; V381-P384 HydrophobicContact CB-CG 3.92Å; V381-P384 HydrophobicContact CG1-CG 4.39Å; V381-P384 HydrophobicContact CG2-CB 4.39Å; V381-P384 HydrophobicContact CG2-CG 4.49Å; V381-A385 WeakPolarHBondContact O-CB 3.29Å; V381-L412 HydrophobicContact CG1-CB 3.98Å; V381-L412 HydrophobicContact CG1-CD2 3.35Å; V381-L412 HydrophobicContact CG1-CG 4.16Å; V381-A414 HydrophobicContact CG1-CB 3.9Å
382	L	90.6	Very high	91.9	Very high	18 Å²	18	39.4 Å²	39.4	9%	0.094	20%	0.2	C	C	.	.	H	α-helix	trans	-81.2	-49	178.1	-177.5	58	0	0	0	113.3	A385 L386 V404 P410 I442	L382-A385 PolarHBondContact O-N 2.95Å; L382-L386 HydrophobicContact CD1-CD1 4.22Å; L382-L386 HydrophobicContact CD1-CD2 4.49Å; L382-L386 HydrophobicContact CD1-CG 4.1Å; L382-L386 HydrophobicContact CG-CD1 4.09Å; L382-L386 HydrophobicContact CG-CG 4.39Å; L382-L386 WeakPolarHBondContact O-CG 3.45Å; L382-L386 PolarHBondContact O-N 3.11Å; L382-V404 HydrophobicContact CD1-CG1 3.9Å; L382-P410 HydrophobicContact CB-CB 3.91Å; L382-P410 HydrophobicContact CB-CG 3.95Å; L382-P410 HydrophobicContact CD2-CG 4.44Å; L382-I442 HydrophobicContact CD2-CD1 3.58Å; L382-I442 HydrophobicContact CG-CD1 4.39Å
383	G	88.7	Confident	91.8	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-56.9	-51.1	-178	0	0	0	0	0	113.4	A385 L386 Q387	G383-A385 PolarHBondContact O-N 2.65Å; G383-L386 PolarHBondContact O-N 3.44Å; G383-Q387 PolarHBondContact O-N 3.35Å
384	P	92.4	Very high	91.7	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.013	20%	0.2	C	C	.	.	H	α-helix	trans	-60.4	-40.6	174.9	-25.4	36.4	0	0	0	112.9	V340 M343 V381 L386 Q387 A388 A414 P415	V340-P384 HydrophobicContact CB-CB 4.18Å; V340-P384 HydrophobicContact CB-CG 3.98Å; V340-P384 VanDerWaalsContact O-CG 3.28Å; V340-P384 WeakPolarHBondContact O-CG 3.41Å; M343-P384 HydrophobicContact CG-CB 3.8Å; M343-P384 VanDerWaalsContact CG-O 3.27Å; M343-P384 WeakPolarHBondContact CG-O 3.09Å; M343-P384 HydrophobicContact SD-CB 3.8Å; V381-P384 HydrophobicContact CB-CB 4.31Å; V381-P384 HydrophobicContact CB-CG 3.92Å; V381-P384 HydrophobicContact CG1-CG 4.39Å; V381-P384 HydrophobicContact CG2-CB 4.39Å; V381-P384 HydrophobicContact CG2-CG 4.49Å; P384-L386 PolarHBondContact O-N 2.8Å; P384-Q387 PolarHBondContact O-N 3.01Å; P384-A388 WeakPolarHBondContact O-CB 3.22Å; P384-A388 PolarHBondContact O-N 3.28Å; P384-A414 HydrophobicContact CG-CB 3.77Å; P384-P415 WeakPolarHBondContact CD-O 3.33Å
385	A	92.8	Very high	91.6	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.008	19%	0.189	C	C	.	.	H	α-helix	trans	-59.4	-50.2	175.6	0	0	0	0	0	111.1	M277 Y321 V325 V381 L382 G383 Q387 A388 G389	M277-A385 VanDerWaalsContact CE-C 3.45Å; M277-A385 HydrophobicContact CE-CB 4.05Å; M277-A385 WeakPolarHBondContact CE-O 3.49Å; Y321-A385 HydrophobicContact CD1-CB 3.78Å; Y321-A385 HydrophobicContact CD2-CB 3.82Å; Y321-A385 HydrophobicContact CE1-CB 4.18Å; Y321-A385 HydrophobicContact CE2-CB 4.19Å; Y321-A385 HydrophobicContact CG-CB 3.61Å; V325-A385 HydrophobicContact CG2-CB 4.47Å; V381-A385 WeakPolarHBondContact O-CB 3.29Å; L382-A385 PolarHBondContact O-N 2.95Å; G383-A385 PolarHBondContact O-N 2.65Å; A385-Q387 VanDerWaalsContact C-N 3.33Å; A385-Q387 PolarHBondContact O-N 3.49Å; A385-A388 WeakPolarHBondContact O-CB 3.21Å; A385-A388 PolarHBondContact O-N 2.88Å; A385-G389 PolarHBondContact O-N 2.66Å; A385-G389 VanDerWaalsContact O-N 3.08Å
386	L	91.4	Very high	91.5	Very high	3 Å²	3	38.6 Å²	38.6	2%	0.016	20%	0.196	C	C	.	.	H	α-helix	trans	-58	-45	176.8	-67	175.3	0	0	0	112.1	L382 G383 P384 A388 G389 I390 L402 V404 I442 L446 L449	L382-L386 HydrophobicContact CD1-CD1 4.22Å; L382-L386 HydrophobicContact CD1-CD2 4.49Å; L382-L386 HydrophobicContact CD1-CG 4.1Å; L382-L386 HydrophobicContact CG-CD1 4.09Å; L382-L386 HydrophobicContact CG-CG 4.39Å; L382-L386 WeakPolarHBondContact O-CG 3.45Å; L382-L386 PolarHBondContact O-N 3.11Å; G383-L386 PolarHBondContact O-N 3.44Å; P384-L386 PolarHBondContact O-N 2.8Å; L386-A388 VanDerWaalsContact C-N 3.33Å; L386-A388 PolarHBondContact O-N 2.76Å; L386-G389 PolarHBondContact O-N 2.73Å; L386-I390 WeakPolarHBondContact O-CG1 3.5Å; L386-I390 PolarHBondContact O-N 3.4Å; L386-L402 HydrophobicContact CD2-CD1 4.47Å; L386-V404 HydrophobicContact CD2-CG1 4.41Å; L386-V404 HydrophobicContact CD2-CG2 3.61Å; L386-I442 HydrophobicContact CD1-CG2 3.75Å; L386-L446 HydrophobicContact CD1-CD2 4.41Å; L386-L449 HydrophobicContact CB-CD1 4.35Å; L386-L449 HydrophobicContact CD1-CD1 4.19Å; L386-L449 HydrophobicContact CD2-CD1 4.36Å
387	Q	90.7	Very high	91.3	Very high	44 Å²	44	32.9 Å²	32.9	21%	0.206	19%	0.187	C	C	.	.	H	α-helix	trans	-60.5	-43.3	177.6	-171.6	65.2	30.9	0	0	111.5	M343 G383 P384 A385 G389 I390 E391 M445	M343-Q387 HydrophobicContact CB-CB 4.27Å; M343-Q387 HydrophobicContact CB-CG 4.04Å; M343-Q387 HydrophobicContact CG-CB 4.24Å; M343-Q387 HydrophobicContact CG-CG 4.48Å; G383-Q387 PolarHBondContact O-N 3.35Å; P384-Q387 PolarHBondContact O-N 3.01Å; A385-Q387 VanDerWaalsContact C-N 3.33Å; A385-Q387 PolarHBondContact O-N 3.49Å; Q387-G389 VanDerWaalsContact C-N 3.32Å; Q387-G389 PolarHBondContact O-N 3.22Å; Q387-I390 PolarHBondContact O-N 3.37Å; Q387-E391 HydrophobicContact CG-CG 4.29Å; Q387-E391 PolarHBondContact NE2-OE1 2.98Å; Q387-E391 WeakPolarHBondContact O-CB 3.4Å; Q387-E391 WeakPolarHBondContact O-CG 3.47Å; Q387-E391 PolarHBondContact O-N 2.97Å; Q387-M445 HydrophobicContact CB-CE 4.37Å
388	A	93	Very high	91.2	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-58.5	-42.4	176.1	0	0	0	0	0	112.4	V325 F327 M343 P384 A385 L386 T392	V325-A388 HydrophobicContact CG1-CB 3.96Å; F327-A388 HydrophobicContact CE2-CB 4.5Å; F327-A388 HydrophobicContact CZ-CB 3.78Å; M343-A388 HydrophobicContact CG-CB 4.4Å; M343-A388 HydrophobicContact SD-CB 4.02Å; P384-A388 WeakPolarHBondContact O-CB 3.22Å; P384-A388 PolarHBondContact O-N 3.28Å; A385-A388 WeakPolarHBondContact O-CB 3.21Å; A385-A388 PolarHBondContact O-N 2.88Å; L386-A388 VanDerWaalsContact C-N 3.33Å; L386-A388 PolarHBondContact O-N 2.76Å; A388-T392 WeakPolarHBondContact O-CB 3.39Å; A388-T392 PolarHBondContact O-N 2.81Å; A388-T392 PolarHBondContact O-OG1 3.4Å
389	G	92	Very high	91.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.4	-45.7	174.6	0	0	0	0	0	112.6	A385 L386 Q387 T392 L393	A385-G389 PolarHBondContact O-N 2.66Å; A385-G389 VanDerWaalsContact O-N 3.08Å; L386-G389 PolarHBondContact O-N 2.73Å; Q387-G389 VanDerWaalsContact C-N 3.32Å; Q387-G389 PolarHBondContact O-N 3.22Å; G389-T392 WeakPolarHBondContact O-CB 3.19Å; G389-T392 PolarHBondContact O-N 3.32Å; G389-L393 PolarHBondContact O-N 2.71Å; G389-L393 VanDerWaalsContact O-N 3.16Å
390	I	90.4	Very high	91.4	Very high	17 Å²	17	26.3 Å²	26.3	9%	0.087	16%	0.155	C	C	.	.	H	α-helix	trans	-62.5	-47.6	177.5	-66.4	168.2	0	0	0	111.1	L386 Q387 T392 L393 K394 L402 L449	L386-I390 WeakPolarHBondContact O-CG1 3.5Å; L386-I390 PolarHBondContact O-N 3.4Å; Q387-I390 PolarHBondContact O-N 3.37Å; I390-T392 PolarHBondContact O-N 3.35Å; I390-L393 PolarHBondContact O-N 3.28Å; I390-K394 HydrophobicContact CG2-CD 4.09Å; I390-K394 VanDerWaalsContact CG2-CE 3.43Å; I390-K394 HydrophobicContact CG2-CG 4.42Å; I390-K394 WeakPolarHBondContact O-CG 3.3Å; I390-K394 PolarHBondContact O-N 2.79Å; I390-L402 HydrophobicContact CG1-CD1 4.25Å; I390-L449 HydrophobicContact CD1-CD1 4.06Å; I390-L449 HydrophobicContact CD1-CD2 3.83Å; I390-L449 HydrophobicContact CD1-CG 3.89Å; I390-L449 HydrophobicContact CG1-CD2 3.99Å
391	E	91.2	Very high	91.4	Very high	53 Å²	53	27.6 Å²	27.6	25%	0.248	16%	0.16	C	C	.	.	H	α-helix	trans	-65.1	-30.7	179.6	-68.7	-51.7	136	0	0	111.7	V345 Q387 K394 A395	V345-E391 HydrophobicContact CG2-CB 3.81Å; Q387-E391 HydrophobicContact CG-CG 4.29Å; Q387-E391 PolarHBondContact NE2-OE1 2.98Å; Q387-E391 WeakPolarHBondContact O-CB 3.4Å; Q387-E391 WeakPolarHBondContact O-CG 3.47Å; Q387-E391 PolarHBondContact O-N 2.97Å; E391-K394 PolarHBondContact O-N 3.35Å; E391-K394 IonicContact OE1-NZ 3.97Å; E391-K394 PolarHBondContact OE1-NZ 3.13Å; E391-A395 WeakPolarHBondContact O-CB 3.33Å; E391-A395 PolarHBondContact O-N 3.19Å
392	T	92.6	Very high	91.5	Very high	3 Å²	3	28.9 Å²	28.9	2%	0.018	17%	0.167	C	C	.	.	H	α-helix	trans	-63.2	-46.1	172.3	-59.1	0	0	0	0	111.3	I275 F327 V345 L351 F352 A388 G389 I390 Y396	I275-T392 HydrophobicContact CD1-CG2 4.07Å; F327-T392 WeakPolarHBondContact CE1-OG1 3.34Å; V345-T392 HydrophobicContact CG1-CG2 4.46Å; V345-T392 VanDerWaalsContact CG2-N 3.31Å; V345-T392 WeakPolarHBondContact CG2-OG1 3.27Å; L351-T392 HydrophobicContact CD1-CG2 4.46Å; F352-T392 HydrophobicContact CE1-CG2 3.75Å; F352-T392 HydrophobicContact CZ-CG2 3.91Å; A388-T392 WeakPolarHBondContact O-CB 3.39Å; A388-T392 PolarHBondContact O-N 2.81Å; A388-T392 PolarHBondContact O-OG1 3.4Å; G389-T392 WeakPolarHBondContact O-CB 3.19Å; G389-T392 PolarHBondContact O-N 3.32Å; I390-T392 PolarHBondContact O-N 3.35Å; T392-Y396 VanDerWaalsContact O-CD2 3.28Å; T392-Y396 WeakPolarHBondContact O-CD2 3.39Å; T392-Y396 PolarHBondContact O-N 3.42Å
393	L	92.3	Very high	91.5	Very high	21 Å²	21	28.5 Å²	28.5	11%	0.11	17%	0.165	C	C	.	.	H	α-helix	trans	-63.4	-44.2	176.6	-67.7	176.6	0	0	0	111.6	V273 I275 G389 I390 G397 R398 L402	V273-L393 HydrophobicContact CB-CD2 4.03Å; I275-L393 HydrophobicContact CD1-CD2 3.88Å; I275-L393 HydrophobicContact CD1-CG 3.89Å; I275-L393 HydrophobicContact CG1-CD2 4.41Å; G389-L393 PolarHBondContact O-N 2.71Å; G389-L393 VanDerWaalsContact O-N 3.16Å; I390-L393 PolarHBondContact O-N 3.28Å; L393-G397 PolarHBondContact O-N 2.81Å; L393-G397 VanDerWaalsContact O-N 3.11Å; L393-R398 WeakPolarHBondContact CB-O 3.45Å; L393-R398 HydrophobicContact CD2-CB 4.32Å; L393-R398 PolarHBondContact O-N 3.25Å; L393-L402 HydrophobicContact CD1-CD2 4.19Å
394	K	90.5	Very high	91.6	Very high	107 Å²	107	30.8 Å²	30.8	47%	0.465	18%	0.178	S	C	.	.	H	α-helix	trans	-62.6	-49.2	177.9	-71.9	177	-174	164	0	112.5	I390 E391 Y396 G397	I390-K394 HydrophobicContact CG2-CD 4.09Å; I390-K394 VanDerWaalsContact CG2-CE 3.43Å; I390-K394 HydrophobicContact CG2-CG 4.42Å; I390-K394 WeakPolarHBondContact O-CG 3.3Å; I390-K394 PolarHBondContact O-N 2.79Å; E391-K394 PolarHBondContact O-N 3.35Å; E391-K394 IonicContact OE1-NZ 3.97Å; E391-K394 PolarHBondContact OE1-NZ 3.13Å; K394-Y396 PolarHBondContact O-N 3.42Å; K394-G397 PolarHBondContact O-N 2.89Å
395	A	90.5	Very high	91.6	Very high	69 Å²	69	32.3 Å²	32.3	57%	0.57	19%	0.185	S	C	*	.	H	α-helix	trans	-60	-31.9	-176.2	0	0	0	0	0	112.7	V345 E391	V345-A395 HydrophobicContact CG2-CB 4.46Å; E391-A395 WeakPolarHBondContact O-CB 3.33Å; E391-A395 PolarHBondContact O-N 3.19Å
396	Y	90.3	Very high	91.4	Very high	77 Å²	77	35.2 Å²	35.2	30%	0.302	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	2.7	178.4	-70.5	-100.6	0	0	0	113.5	V345 G348 L351 F352 T392 K394 R398	V345-Y396 HydrophobicContact CG1-CE2 4.34Å; G348-Y396 PolarHBondContact O-OH 3.46Å; L351-Y396 HydrophobicContact CD1-CE2 4.01Å; F352-Y396 AromaticContact CE2-CD1 3.9Å; F352-Y396 HydrophobicContact CE2-CD1 3.9Å; F352-Y396 HydrophobicContact CE2-CD2 4.29Å; F352-Y396 AromaticContact CE2-CG 3.7Å; F352-Y396 HydrophobicContact CE2-CG 3.7Å; F352-Y396 HydrophobicContact CZ-CD1 4.43Å; F352-Y396 HydrophobicContact CZ-CD2 4.04Å; F352-Y396 AromaticContact CZ-CG 3.91Å; F352-Y396 HydrophobicContact CZ-CG 3.91Å; T392-Y396 VanDerWaalsContact O-CD2 3.28Å; T392-Y396 WeakPolarHBondContact O-CD2 3.39Å; T392-Y396 PolarHBondContact O-N 3.42Å; K394-Y396 PolarHBondContact O-N 3.42Å; Y396-R398 PolarHBondContact O-N 3.4Å
397	G	90	Very high	91.1	Very high	58 Å²	58	38 Å²	38	60%	0.598	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.9	33	-179	0	0	0	0	0	113.4	L393 K394	L393-G397 PolarHBondContact O-N 2.81Å; L393-G397 VanDerWaalsContact O-N 3.11Å; K394-G397 PolarHBondContact O-N 2.89Å
398	R	91.4	Very high	90.6	Very high	36 Å²	36	37.1 Å²	37.1	14%	0.136	21%	0.214	C	C	.	.			trans	-105.6	142.6	-178.3	-55.4	-63.6	-74.3	-87.2	-8.3	110.1	P271 V273 E315 F352 L393 Y396	P271-R398 PolarHBondContact O-NE 2.91Å; P271-R398 PolarHBondContact O-NH2 2.64Å; V273-R398 HydrophobicContact CG2-CB 4Å; V273-R398 HydrophobicContact CG2-CG 4.02Å; E315-R398 IonicContact OE2-CZ 3.07Å; E315-R398 VanDerWaalsContact OE2-CZ 3.24Å; E315-R398 IonicContact OE2-NH1 3.93Å; E315-R398 PolarHBondContact OE2-NH1 3.21Å; E315-R398 IonicContact OE2-NH2 3.88Å; E315-R398 PolarHBondContact OE2-NH2 2.64Å; F352-R398 HydrophobicContact CE2-CG 3.81Å; L393-R398 WeakPolarHBondContact CB-O 3.45Å; L393-R398 HydrophobicContact CD2-CB 4.32Å; L393-R398 PolarHBondContact O-N 3.25Å; Y396-R398 PolarHBondContact O-N 3.4Å
399	A	93	Very high	90.2	Very high	25 Å²	25	40.9 Å²	40.9	21%	0.207	23%	0.233	C	C	.	.			trans	-79.8	162.6	159	0	0	0	0	0	109.4	P272 V273 F482 D483	P272-A399 CarbonylContact C-O 3.44Å; P272-A399 WeakPolarHBondContact CA-O 3.48Å; V273-A399 PolarHBondContact N-O 2.93Å; A399-F482 HydrophobicContact CB-CB 3.73Å; A399-F482 HydrophobicContact CB-CG 4.37Å; A399-D483 HydrophobicContact CB-CB 4.41Å
400	G	92.4	Very high	90	Very high	13 Å²	13	41.2 Å²	41.2	13%	0.134	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179	-178.2	-179.3	0	0	0	0	0	114.9	V273	V273-G400 CarbonylContact O-C 3.58Å; V273-G400 WeakPolarHBondContact O-CA 3.06Å
401	K	92.3	Very high	89.8	Confident	28 Å²	28	43 Å²	43	12%	0.122	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	134.3	176	-178.7	173.1	172	-174.5	0	109.4	V273 F274 I275 F403 D475 I480 F482	V273-K401 PolarHBondContact O-N 2.76Å; F274-K401 WeakPolarHBondContact CA-O 3.46Å; F274-K401 HydrophobicContact CD1-CB 3.85Å; F274-K401 HydrophobicContact CE1-CB 3.79Å; F274-K401 HydrophobicContact CE1-CD 4.43Å; I275-K401 PolarHBondContact N-O 3.32Å; K401-F403 HydrophobicContact CB-CE2 4.06Å; K401-F403 HydrophobicContact CD-CD2 4.49Å; K401-F403 HydrophobicContact CD-CE1 4.47Å; K401-F403 HydrophobicContact CD-CE2 3.7Å; K401-F403 HydrophobicContact CD-CZ 3.69Å; K401-F403 HydrophobicContact CG-CD2 4.15Å; K401-F403 HydrophobicContact CG-CE2 3.74Å; K401-F403 HydrophobicContact CG-CZ 4.24Å; K401-D475 WeakPolarHBondContact CE-OD2 3.22Å; K401-D475 PolarHBondContact NZ-O 3.39Å; K401-D475 IonicContact NZ-OD1 3.79Å; K401-D475 PolarHBondContact NZ-OD1 2.88Å; K401-D475 IonicContact NZ-OD2 3.74Å; K401-D475 PolarHBondContact NZ-OD2 2.92Å; K401-I480 HydrophobicContact CD-CD1 3.93Å; K401-F482 HydrophobicContact CB-CE1 4.07Å
402	L	92.7	Very high	89.7	Confident	31 Å²	31	42.2 Å²	42.2	16%	0.162	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	122.5	173	-50.7	-176.8	0	0	0	108.6	I275 M277 L386 I390 L393 V404 L449	I275-L402 HydrophobicContact CB-CD2 3.72Å; I275-L402 HydrophobicContact CD1-CD2 3.79Å; I275-L402 HydrophobicContact CG1-CD2 4.01Å; I275-L402 HydrophobicContact CG2-CD2 4.35Å; M277-L402 HydrophobicContact SD-CB 4.13Å; M277-L402 HydrophobicContact SD-CD1 4.01Å; M277-L402 HydrophobicContact SD-CD2 4.18Å; M277-L402 HydrophobicContact SD-CG 4.32Å; L386-L402 HydrophobicContact CD2-CD1 4.47Å; I390-L402 HydrophobicContact CG1-CD1 4.25Å; L393-L402 HydrophobicContact CD1-CD2 4.19Å; L402-V404 HydrophobicContact CB-CG2 4.05Å; L402-L449 HydrophobicContact CD1-CD2 4.31Å
403	F	91.9	Very high	89.6	Confident	10 Å²	10	48.6 Å²	48.6	4%	0.044	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	100	172.7	-72.6	-101.3	0	0	0	108.1	F274 I275 F276 M277 K401 F405 L472 D475 L476	F274-F403 HydrophobicContact CB-CD2 4.25Å; F274-F403 HydrophobicContact CB-CE2 3.94Å; F274-F403 AromaticContact CD1-CE2 3.85Å; F274-F403 HydrophobicContact CD1-CE2 3.85Å; F274-F403 AromaticContact CD2-CE2 3.53Å; F274-F403 HydrophobicContact CD2-CE2 3.53Å; F274-F403 AromaticContact CD2-CZ 3.9Å; F274-F403 HydrophobicContact CD2-CZ 3.9Å; F274-F403 HydrophobicContact CE1-CE2 4.15Å; F274-F403 AromaticContact CE2-CE2 3.9Å; F274-F403 HydrophobicContact CE2-CE2 3.9Å; F274-F403 AromaticContact CE2-CZ 3.88Å; F274-F403 HydrophobicContact CE2-CZ 3.88Å; F274-F403 HydrophobicContact CG-CD2 4.3Å; F274-F403 AromaticContact CG-CE2 3.51Å; F274-F403 HydrophobicContact CG-CE2 3.51Å; F274-F403 HydrophobicContact CG-CZ 4.33Å; F274-F403 HydrophobicContact CZ-CE2 4.2Å; F274-F403 HydrophobicContact CZ-CZ 4.26Å; I275-F403 PolarHBondContact O-N 3.43Å; F276-F403 HydrophobicContact CD1-CB 3.56Å; F276-F403 HydrophobicContact CD1-CD2 4.29Å; F276-F403 AromaticContact CD1-CG 3.91Å; F276-F403 HydrophobicContact CD1-CG 3.91Å; F276-F403 HydrophobicContact CE1-CB 3.96Å; F276-F403 HydrophobicContact CE1-CD1 4.12Å; F276-F403 HydrophobicContact CE1-CD2 4.03Å; F276-F403 AromaticContact CE1-CG 3.78Å; F276-F403 HydrophobicContact CE1-CG 3.78Å; F276-F403 HydrophobicContact CG-CB 4.48Å; M277-F403 PolarHBondContact N-O 3.19Å; K401-F403 HydrophobicContact CB-CE2 4.06Å; K401-F403 HydrophobicContact CD-CD2 4.49Å; K401-F403 HydrophobicContact CD-CE1 4.47Å; K401-F403 HydrophobicContact CD-CE2 3.7Å; K401-F403 HydrophobicContact CD-CZ 3.69Å; K401-F403 HydrophobicContact CG-CD2 4.15Å; K401-F403 HydrophobicContact CG-CE2 3.74Å; K401-F403 HydrophobicContact CG-CZ 4.24Å; F403-F405 HydrophobicContact CB-CE2 3.92Å; F403-F405 HydrophobicContact CB-CZ 4.49Å; F403-F405 WeakPolarHBondContact O-CD2 3.5Å; F403-F405 WeakPolarHBondContact O-CE2 3.27Å; F403-L472 HydrophobicContact CD1-CD1 3.92Å; F403-L472 HydrophobicContact CE1-CD1 4.18Å; F403-D475 HydrophobicContact CE1-CB 4.44Å; F403-D475 WeakPolarHBondContact CE1-OD2 3.5Å; F403-L476 HydrophobicContact CD1-CD2 4.48Å; F403-L476 HydrophobicContact CE1-CD2 3.64Å; F403-L476 HydrophobicContact CE1-CG 4.12Å; F403-L476 HydrophobicContact CE2-CD2 4.15Å; F403-L476 HydrophobicContact CZ-CD2 3.46Å; F403-L476 VanDerWaalsContact CZ-CD2 3.46Å; F403-L476 HydrophobicContact CZ-CG 4.33Å
404	V	90.9	Very high	89.4	Confident	48 Å²	48	48.1 Å²	48.1	29%	0.291	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	116.7	-169.6	-174.1	0	0	0	0	110.1	M277 L382 L386 L402 H406	M277-V404 HydrophobicContact CB-CG2 4.23Å; M277-V404 HydrophobicContact CG-CG2 4.46Å; M277-V404 HydrophobicContact SD-CG2 4.25Å; L382-V404 HydrophobicContact CD1-CG1 3.9Å; L386-V404 HydrophobicContact CD2-CG1 4.41Å; L386-V404 HydrophobicContact CD2-CG2 3.61Å; L402-V404 HydrophobicContact CB-CG2 4.05Å; V404-H406 HydrophobicContact CG1-CB 4.47Å
405	F	91.1	Very high	89.2	Confident	35 Å²	35	45.1 Å²	45.1	15%	0.154	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	116.2	174.7	-55.1	-103.2	0	0	0	106.4	F276 M277 L278 D279 F293 Y321 F403 F468 L472	F276-F405 HydrophobicContact CD1-CE2 4.06Å; F276-F405 HydrophobicContact CD1-CZ 4.41Å; M277-F405 PolarHBondContact O-N 3.29Å; L278-F405 HydrophobicContact CD2-CB 4.23Å; L278-F405 HydrophobicContact CD2-CD2 3.37Å; L278-F405 HydrophobicContact CD2-CE2 3.8Å; L278-F405 HydrophobicContact CD2-CG 3.84Å; D279-F405 WeakPolarHBondContact CB-O 3.39Å; D279-F405 PolarHBondContact N-O 2.98Å; F293-F405 HydrophobicContact CD2-CE1 4.31Å; F293-F405 HydrophobicContact CD2-CZ 4.03Å; F293-F405 HydrophobicContact CE2-CZ 4.01Å; Y321-F405 PolarHBondContact OH-O 3.42Å; F403-F405 HydrophobicContact CB-CE2 3.92Å; F403-F405 HydrophobicContact CB-CZ 4.49Å; F403-F405 WeakPolarHBondContact O-CD2 3.5Å; F403-F405 WeakPolarHBondContact O-CE2 3.27Å; F405-F468 AromaticContact CD1-CE2 3.69Å; F405-F468 HydrophobicContact CD1-CE2 3.69Å; F405-F468 AromaticContact CD1-CZ 3.73Å; F405-F468 HydrophobicContact CD1-CZ 3.73Å; F405-F468 AromaticContact CE1-CE2 3.47Å; F405-F468 HydrophobicContact CE1-CE2 3.47Å; F405-F468 VanDerWaalsContact CE1-CE2 3.47Å; F405-F468 AromaticContact CE1-CZ 3.39Å; F405-F468 HydrophobicContact CE1-CZ 3.39Å; F405-L472 HydrophobicContact CE1-CD2 4.15Å; F405-L472 HydrophobicContact CZ-CD1 4.13Å; F405-L472 HydrophobicContact CZ-CD2 4.05Å
406	H	89.1	Confident	88.8	Confident	61 Å²	61	42.7 Å²	42.7	28%	0.282	25%	0.247	S	C	.	.			trans	-138.9	141.2	-173.3	-163	63.7	0	0	0	110.4	D279 Y321 V380 V404 S408	D279-H406 IonicContact OD2-ND1 2.83Å; Y321-H406 AromaticContact CE2-CE1 3.88Å; Y321-H406 AromaticContact CE2-ND1 3.46Å; Y321-H406 WeakPolarHBondContact CE2-ND1 3.32Å; Y321-H406 AromaticContact CZ-ND1 3.62Å; Y321-H406 WeakPolarHBondContact OH-CB 2.83Å; Y321-H406 PolarHBondContact OH-ND1 2.88Å; V380-H406 VanDerWaalsContact CG2-CE1 3.49Å; V380-H406 WeakPolarHBondContact CG2-CE1 3.48Å; V404-H406 HydrophobicContact CG1-CB 4.47Å; H406-S408 PolarHBondContact CD2-O 2.9Å; H406-S408 PolarHBondContact NE2-O 3.16Å
407	T	84.9	Confident	88.5	Confident	63 Å²	63	42.4 Å²	42.4	39%	0.387	25%	0.247	S	C	.	.			trans	-115.2	-44.5	-174.7	61.6	0	0	0	0	115.2	D279 A284	D279-T407 PolarHBondContact OD2-N 3.2Å; D279-T407 PolarHBondContact OD2-OG1 2.99Å; A284-T407 HydrophobicContact CB-CG2 3.61Å
408	S	81	Confident	88.1	Confident	24 Å²	24	40.9 Å²	40.9	17%	0.168	23%	0.225	C	C	.	.	S	Bend	trans	-117.4	151.6	-164.5	-57	0	0	0	0	111.1	N283 V380 H406 P410	N283-S408 PolarHBondContact ND2-OG 3.08Å; V380-S408 WeakPolarHBondContact CG2-O 3.34Å; H406-S408 PolarHBondContact CD2-O 2.9Å; H406-S408 PolarHBondContact NE2-O 3.16Å; S408-P410 WeakPolarHBondContact O-CD 3.23Å
409	L	83.6	Confident	87.4	Confident	79 Å²	79	45.9 Å²	45.9	41%	0.414	25%	0.248	S	C	.	.			trans	-55.5	125.4	175	-171.8	74.2	0	0	0	110.2	T411 L418	L409-T411 HydrophobicContact CB-CG2 4.5Å; L409-T411 HydrophobicContact CD2-CG2 4.17Å; L409-T411 HydrophobicContact CG-CG2 4.36Å; L409-T411 PolarHBondContact O-N 3.47Å; L409-L418 HydrophobicContact CD1-CB 3.67Å; L409-L418 HydrophobicContact CD1-CD1 3.83Å; L409-L418 HydrophobicContact CD1-CG 4.39Å; L409-L418 HydrophobicContact CG-CB 3.99Å
410	P	87.3	Confident	86.5	Confident	7 Å²	7	49.4 Å²	49.4	5%	0.045	27%	0.271	C	S	.	.			trans	-73.2	94.3	-178.5	28.5	-35.5	0	0	0	111.2	V380 L382 S408 L418	V380-P410 HydrophobicContact CG2-CB 4.34Å; V380-P410 WeakPolarHBondContact O-CA 3.41Å; L382-P410 HydrophobicContact CB-CB 3.91Å; L382-P410 HydrophobicContact CB-CG 3.95Å; L382-P410 HydrophobicContact CD2-CG 4.44Å; S408-P410 WeakPolarHBondContact O-CD 3.23Å; P410-L418 HydrophobicContact CG-CB 4.27Å; P410-L418 HydrophobicContact CG-CD1 3.89Å; P410-L418 HydrophobicContact CG-CG 3.92Å; P410-L418 PolarHBondContact O-N 3.4Å
411	T	86.9	Confident	85.1	Confident	56 Å²	56	55 Å²	55	34%	0.344	29%	0.288	S	S	.	.			trans	-96.4	-13.4	-175.1	52.4	0	0	0	0	114.8	L409 K417	L409-T411 HydrophobicContact CB-CG2 4.5Å; L409-T411 HydrophobicContact CD2-CG2 4.17Å; L409-T411 HydrophobicContact CG-CG2 4.36Å; L409-T411 PolarHBondContact O-N 3.47Å; T411-K417 WeakPolarHBondContact O-CD 3.16Å; T411-K417 WeakPolarHBondContact O-CE 3.47Å; T411-K417 PolarHBondContact O-NZ 3.05Å; T411-K417 VanDerWaalsContact O-NZ 3.09Å
412	L	89.6	Confident	83.7	Confident	36 Å²	36	60.9 Å²	60.9	19%	0.188	32%	0.316	C	S	.	.	S	Bend	trans	-62.3	148.1	-178.1	-166.5	69.1	0	0	0	110.7	H323 E379 V381 A414 K417	H323-L412 HydrophobicContact CB-CD2 3.96Å; E379-L412 HydrophobicContact CB-CB 4.39Å; E379-L412 HydrophobicContact CB-CD1 4.14Å; V381-L412 HydrophobicContact CG1-CB 3.98Å; V381-L412 HydrophobicContact CG1-CD2 3.35Å; V381-L412 HydrophobicContact CG1-CG 4.16Å; L412-A414 VanDerWaalsContact C-N 3.32Å; L412-A414 PolarHBondContact O-N 3.25Å; L412-K417 WeakPolarHBondContact O-CB 2.98Å; L412-K417 WeakPolarHBondContact O-CD 3.44Å
413	E	90.7	Very high	82.3	Confident	136 Å²	136	62.2 Å²	62.2	64%	0.636	32%	0.323	S	S	*	.	S	Bend	trans	-70.4	85	177	-161.4	69.5	-167.7	0	0	111.6	Q341 K417	Q341-E413 PolarHBondContact NE2-O 2.94Å; E413-K417 WeakPolarHBondContact OE2-CD 3.17Å; E413-K417 WeakPolarHBondContact OE2-CE 3.46Å; E413-K417 IonicContact OE2-NZ 2.65Å; E413-K417 PolarHBondContact OE2-NZ 2.87Å
414	A	88.5	Confident	81	Confident	12 Å²	12	69.3 Å²	69.3	10%	0.099	35%	0.35	C	S	.	.	S	Bend	trans	-148.1	163.4	177.3	0	0	0	0	0	110.6	V340 V381 P384 L412 G416 K417	V340-A414 HydrophobicContact CB-CB 4.25Å; V340-A414 HydrophobicContact CG2-CB 3.97Å; V381-A414 HydrophobicContact CG1-CB 3.9Å; P384-A414 HydrophobicContact CG-CB 3.77Å; L412-A414 VanDerWaalsContact C-N 3.32Å; L412-A414 PolarHBondContact O-N 3.25Å; A414-G416 PolarHBondContact O-N 3.1Å; A414-K417 WeakPolarHBondContact O-CB 3.19Å; A414-K417 PolarHBondContact O-N 3.35Å
415	P	86	Confident	79.8	Confident	43 Å²	43	75.7 Å²	75.7	28%	0.279	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	129.3	172.4	-27	36.7	0	0	0	111.2	V340 P384 M445	V340-P415 WeakPolarHBondContact O-CD 3.43Å; P384-P415 WeakPolarHBondContact CD-O 3.33Å; P415-M445 HydrophobicContact CB-CE 3.62Å
416	G	81.2	Confident	78.5	Confident	19 Å²	19	75.4 Å²	75.4	20%	0.196	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.8	8	-175.1	0	0	0	0	0	115.5	A414 L418	A414-G416 PolarHBondContact O-N 3.1Å; G416-L418 PolarHBondContact O-N 3.31Å
417	K	84.2	Confident	77.2	Confident	71 Å²	71	74.1 Å²	74.1	31%	0.309	37%	0.368	S	S	.	.			trans	-49.5	132.4	171	174.7	172.9	179.8	150.3	0	112.3	T411 L412 E413 A414	T411-K417 WeakPolarHBondContact O-CD 3.16Å; T411-K417 WeakPolarHBondContact O-CE 3.47Å; T411-K417 PolarHBondContact O-NZ 3.05Å; T411-K417 VanDerWaalsContact O-NZ 3.09Å; L412-K417 WeakPolarHBondContact O-CB 2.98Å; L412-K417 WeakPolarHBondContact O-CD 3.44Å; E413-K417 WeakPolarHBondContact OE2-CD 3.17Å; E413-K417 WeakPolarHBondContact OE2-CE 3.46Å; E413-K417 IonicContact OE2-NZ 2.65Å; E413-K417 PolarHBondContact OE2-NZ 2.87Å; A414-K417 WeakPolarHBondContact O-CB 3.19Å; A414-K417 PolarHBondContact O-N 3.35Å
418	L	81.1	Confident	75.9	Confident	25 Å²	25	73.4 Å²	73.4	13%	0.131	37%	0.374	C	S	.	.			trans	-109.1	151.3	174	-59.7	-176.2	0	0	0	111.3	L409 P410 G416 C441	L409-L418 HydrophobicContact CD1-CB 3.67Å; L409-L418 HydrophobicContact CD1-CD1 3.83Å; L409-L418 HydrophobicContact CD1-CG 4.39Å; L409-L418 HydrophobicContact CG-CB 3.99Å; P410-L418 HydrophobicContact CG-CB 4.27Å; P410-L418 HydrophobicContact CG-CD1 3.89Å; P410-L418 HydrophobicContact CG-CG 3.92Å; P410-L418 PolarHBondContact O-N 3.4Å; G416-L418 PolarHBondContact O-N 3.31Å; L418-C441 HydrophobicContact CD2-CB 3.19Å
419	K	77.9	Confident	75.1	Confident	141 Å²	141	74.7 Å²	74.7	61%	0.613	38%	0.38	S	S	*	.			trans	-118.4	137.3	172.1	-67.2	-177.5	179.4	-179.4	0	107.9	R421	K419-R421 HydrophobicContact CB-CG 4.49Å; K419-R421 WeakPolarHBondContact O-CG 3.5Å; K419-R421 PolarHBondContact O-N 3.12Å
420	S	72.7	Confident	74	Confident	99 Å²	99	76 Å²	76	69%	0.692	39%	0.388	S	S	*	.			trans	-58.9	123.6	173.7	179.4	0	0	0	0	109.5
421	R	63.9	Low	72.9	Confident	131 Å²	131	82.8 Å²	82.8	49%	0.494	42%	0.417	S	S	.	.			trans	-146	66.9	-169.9	-82.3	-174.3	177.3	-173.5	2.1	110.5	K419 D423	K419-R421 HydrophobicContact CB-CG 4.49Å; K419-R421 WeakPolarHBondContact O-CG 3.5Å; K419-R421 PolarHBondContact O-N 3.12Å; R421-D423 PolarHBondContact O-N 3.47Å
422	E	62.7	Low	71.6	Confident	152 Å²	152	80.7 Å²	80.7	71%	0.71	40%	0.403	S	S	*	.			trans	-82.9	93.9	168.2	-68.6	-172.9	-175.1	0	0	110.3
423	D	63.8	Low	70.1	Confident	58 Å²	58	83.3 Å²	83.3	31%	0.31	41%	0.413	S	S	.	.			trans	-108.9	83.9	166.3	-166.3	-6	0	0	0	109.4	R421 K425 L426	R421-D423 PolarHBondContact O-N 3.47Å; D423-K425 PolarHBondContact O-N 3.31Å; D423-K425 VanDerWaalsContact OD1-CB 3.31Å; D423-K425 WeakPolarHBondContact OD1-CB 3.44Å; D423-K425 PolarHBondContact OD1-N 3.16Å; D423-L426 HydrophobicContact CB-CD1 3.89Å; D423-L426 HydrophobicContact CB-CG 4.13Å; D423-L426 PolarHBondContact O-N 3.06Å
424	R	64.4	Low	68.2	Low	160 Å²	160	81.1 Å²	81.1	60%	0.604	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-56.2	-22.2	179.4	-68.2	178.8	77.1	-174.3	4.7	112.5	L426 L427 S643	R424-L426 PolarHBondContact O-N 2.94Å; R424-L427 HydrophobicContact CB-CD1 4.45Å; R424-L427 HydrophobicContact CG-CD1 4.5Å; R424-L427 PolarHBondContact O-N 3.49Å; R424-S643 PolarHBondContact NH2-O 2.93Å
425	K	65.4	Low	66.3	Low	181 Å²	181	84.2 Å²	84.2	79%	0.787	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-68	-17.1	178.2	-57.4	179.2	179.3	177.8	0	113.1	D423	D423-K425 PolarHBondContact O-N 3.31Å; D423-K425 VanDerWaalsContact OD1-CB 3.31Å; D423-K425 WeakPolarHBondContact OD1-CB 3.44Å; D423-K425 PolarHBondContact OD1-N 3.16Å
426	L	63.6	Low	64.4	Low	30 Å²	30	84.3 Å²	84.3	16%	0.157	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-88.8	-19.3	179.9	-61.5	175.4	0	0	0	112.8	D423 R424 G428 T429 K431 E432 R435	D423-L426 HydrophobicContact CB-CD1 3.89Å; D423-L426 HydrophobicContact CB-CG 4.13Å; D423-L426 PolarHBondContact O-N 3.06Å; R424-L426 PolarHBondContact O-N 2.94Å; L426-G428 PolarHBondContact O-N 3.35Å; L426-T429 WeakPolarHBondContact O-CB 3.26Å; L426-T429 PolarHBondContact O-N 3.01Å; L426-T429 VanDerWaalsContact O-N 3.09Å; L426-T429 PolarHBondContact O-OG1 3.35Å; L426-K431 HydrophobicContact CD2-CB 3.91Å; L426-K431 HydrophobicContact CD2-CD 4.27Å; L426-E432 WeakPolarHBondContact O-CB 3.38Å; L426-R435 HydrophobicContact CD1-CG 4.17Å
427	L	61	Low	62.3	Low	33 Å²	33	88.5 Å²	88.5	17%	0.173	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	126.9	179.3	-70.6	169.3	0	0	0	110.2	R424 T429 V647	R424-L427 HydrophobicContact CB-CD1 4.45Å; R424-L427 HydrophobicContact CG-CD1 4.5Å; R424-L427 PolarHBondContact O-N 3.49Å; L427-T429 VanDerWaalsContact C-N 3.28Å; L427-T429 PolarHBondContact O-N 3.15Å; L427-V647 HydrophobicContact CD2-CG2 3.93Å; L427-V647 HydrophobicContact CG-CG2 4.32Å
428	G	58	Low	60.1	Low	48 Å²	48	89.4 Å²	89.4	50%	0.495	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	87	-8.5	178.8	0	0	0	0	0	114	L426 E432	L426-G428 PolarHBondContact O-N 3.35Å; G428-E432 WeakPolarHBondContact CA-OE2 3.48Å; G428-E432 PolarHBondContact N-OE2 3.35Å
429	T	64.4	Low	58.1	Low	51 Å²	51	90.9 Å²	90.9	31%	0.313	44%	0.444	S	S	.	.	S	Bend	trans	-89.8	160.3	-179.2	73.4	0	0	0	0	112.1	L426 L427 K431 E432	L426-T429 WeakPolarHBondContact O-CB 3.26Å; L426-T429 PolarHBondContact O-N 3.01Å; L426-T429 VanDerWaalsContact O-N 3.09Å; L426-T429 PolarHBondContact O-OG1 3.35Å; L427-T429 VanDerWaalsContact C-N 3.28Å; L427-T429 PolarHBondContact O-N 3.15Å; T429-K431 PolarHBondContact O-N 2.89Å; T429-K431 PolarHBondContact OG1-N 3.1Å; T429-E432 WeakPolarHBondContact O-CB 3.39Å; T429-E432 PolarHBondContact O-N 3.47Å; T429-E432 PolarHBondContact OG1-N 3.04Å
430	D	61.6	Low	56.3	Low	108 Å²	108	87 Å²	87	58%	0.578	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-27.4	171.2	-81.8	-46.3	0	0	0	113.3	E432 K433 R590	D430-E432 PolarHBondContact O-N 2.89Å; D430-K433 WeakPolarHBondContact O-CB 3.36Å; D430-K433 PolarHBondContact O-N 3.38Å; D430-K433 IonicContact OD1-NZ 2.73Å; D430-K433 PolarHBondContact OD1-NZ 2.75Å; D430-R590 IonicContact OD1-NH1 3.69Å
431	K	62.6	Low	54.5	Low	149 Å²	149	85.6 Å²	85.6	65%	0.648	42%	0.418	S	S	*	.	H	α-helix	trans	-69.2	-18.9	176.5	-66	-175.5	179.9	179.5	0	112.9	L426 T429 K433 V434 R435	L426-K431 HydrophobicContact CD2-CB 3.91Å; L426-K431 HydrophobicContact CD2-CD 4.27Å; T429-K431 PolarHBondContact O-N 2.89Å; T429-K431 PolarHBondContact OG1-N 3.1Å; K431-K433 PolarHBondContact O-N 3.37Å; K431-V434 PolarHBondContact O-N 3.03Å; K431-R435 PolarHBondContact O-N 3.19Å
432	E	61.3	Low	53.8	Low	12 Å²	12	80.3 Å²	80.3	6%	0.056	40%	0.399	C	S	.	.	H	α-helix	trans	-58.7	-35.8	171.8	-161.4	-170.2	148.4	0	0	111.3	L426 G428 T429 D430 V434 R435 R436 R650	L426-E432 WeakPolarHBondContact O-CB 3.38Å; G428-E432 WeakPolarHBondContact CA-OE2 3.48Å; G428-E432 PolarHBondContact N-OE2 3.35Å; T429-E432 WeakPolarHBondContact O-CB 3.39Å; T429-E432 PolarHBondContact O-N 3.47Å; T429-E432 PolarHBondContact OG1-N 3.04Å; D430-E432 PolarHBondContact O-N 2.89Å; E432-V434 VanDerWaalsContact C-N 3.26Å; E432-V434 PolarHBondContact O-N 3.43Å; E432-R435 PolarHBondContact O-N 2.92Å; E432-R435 VanDerWaalsContact O-N 3.1Å; E432-R436 HydrophobicContact CG-CG 4.39Å; E432-R436 PolarHBondContact O-N 3.45Å; E432-R436 IonicContact OE1-CZ 3.11Å; E432-R436 VanDerWaalsContact OE1-CZ 3.23Å; E432-R436 IonicContact OE1-NE 3.23Å; E432-R436 PolarHBondContact OE1-NE 2.76Å; E432-R436 IonicContact OE1-NH2 3.56Å; E432-R436 PolarHBondContact OE1-NH2 3.5Å; E432-R650 IonicContact OE1-CZ 2.75Å; E432-R650 IonicContact OE1-NE 2.63Å; E432-R650 IonicContact OE1-NH1 3.61Å; E432-R650 PolarHBondContact OE1-NH1 3.28Å; E432-R650 VanDerWaalsContact OE1-NH1 3.11Å; E432-R650 IonicContact OE2-CZ 3.88Å; E432-R650 VanDerWaalsContact OE2-CZ 3.3Å; E432-R650 IonicContact OE2-NH1 3.37Å; E432-R650 PolarHBondContact OE2-NH1 2.96Å; E432-R650 IonicContact OE2-NH2 3.3Å
433	K	57.2	Low	52.6	Low	90 Å²	90	77 Å²	77	39%	0.391	38%	0.38	S	S	.	.	H	α-helix	trans	-56.2	-43.2	177.4	-65.3	169.9	178	153.4	0	110.7	D430 K431 R435 F437 R590	D430-K433 WeakPolarHBondContact O-CB 3.36Å; D430-K433 PolarHBondContact O-N 3.38Å; D430-K433 IonicContact OD1-NZ 2.73Å; D430-K433 PolarHBondContact OD1-NZ 2.75Å; K431-K433 PolarHBondContact O-N 3.37Å; K433-R435 VanDerWaalsContact C-N 3.3Å; K433-R435 PolarHBondContact O-N 3.35Å; K433-F437 WeakPolarHBondContact O-CD2 3.37Å; K433-R590 VanDerWaalsContact CE-NH1 3.3Å
434	V	51	Low	51.2	Low	90 Å²	90	77 Å²	77	55%	0.545	39%	0.394	S	S	.	.	H	α-helix	trans	-67.4	-33.4	-178.3	-176.4	0	0	0	0	111.3	K431 E432	K431-V434 PolarHBondContact O-N 3.03Å; E432-V434 VanDerWaalsContact C-N 3.26Å; E432-V434 PolarHBondContact O-N 3.43Å
435	R	47.8	Very low	50.1	Low	77 Å²	77	71.3 Å²	71.3	29%	0.291	38%	0.375	S	S	.	.	H	α-helix	trans	-87.6	-29.8	179.9	-80.5	-149.5	-179.9	-168.8	3.9	115.3	L426 K431 E432 K433 F437 Q438 S439	L426-R435 HydrophobicContact CD1-CG 4.17Å; K431-R435 PolarHBondContact O-N 3.19Å; E432-R435 PolarHBondContact O-N 2.92Å; E432-R435 VanDerWaalsContact O-N 3.1Å; K433-R435 VanDerWaalsContact C-N 3.3Å; K433-R435 PolarHBondContact O-N 3.35Å; R435-F437 PolarHBondContact O-N 3.07Å; R435-F437 VanDerWaalsContact O-N 3.13Å; R435-Q438 CarbonylContact O-C 3.36Å; R435-Q438 PolarHBondContact O-N 3.47Å; R435-S439 PolarHBondContact O-N 3.03Å
436	R	47.5	Very low	49.1	Very low	46 Å²	46	63.3 Å²	63.3	17%	0.174	34%	0.34	C	S	.	.	H	α-helix	trans	-52	-36.8	168.8	-76	-174.8	-171.4	-170.4	-1.3	110.3	E432 M440 R650 V654	E432-R436 HydrophobicContact CG-CG 4.39Å; E432-R436 PolarHBondContact O-N 3.45Å; E432-R436 IonicContact OE1-CZ 3.11Å; E432-R436 VanDerWaalsContact OE1-CZ 3.23Å; E432-R436 IonicContact OE1-NE 3.23Å; E432-R436 PolarHBondContact OE1-NE 2.76Å; E432-R436 IonicContact OE1-NH2 3.56Å; E432-R436 PolarHBondContact OE1-NH2 3.5Å; R436-M440 VanDerWaalsContact O-CG 3.29Å; R436-M440 WeakPolarHBondContact O-CG 3.38Å; R436-M440 PolarHBondContact O-N 2.82Å; R436-R650 VanDerWaalsContact NH2-NE 3.19Å; R436-V654 VanDerWaalsContact NH1-CG2 3.3Å
437	F	36.7	Very low	47.7	Very low	106 Å²	106	67 Å²	67	47%	0.465	36%	0.357	S	S	.	.	H	α-helix	trans	-74.7	-24	177	-76.7	-118	0	0	0	114.1	K433 R435	K433-F437 WeakPolarHBondContact O-CD2 3.37Å; R435-F437 PolarHBondContact O-N 3.07Å; R435-F437 VanDerWaalsContact O-N 3.13Å
438	Q	37.3	Very low	46.6	Very low	90 Å²	90	70.9 Å²	70.9	42%	0.421	37%	0.374	S	S	.	.	H	α-helix	trans	-98.2	-28.3	-179.3	-71.5	-177	-13.6	0	0	114.4	R435 M440 C441	R435-Q438 CarbonylContact O-C 3.36Å; R435-Q438 PolarHBondContact O-N 3.47Å; Q438-M440 VanDerWaalsContact C-N 3.27Å; Q438-C441 WeakPolarHBondContact O-CA 3.36Å; Q438-C441 WeakPolarHBondContact O-CB 3.23Å; Q438-C441 PolarHBondContact O-N 3.3Å; Q438-C441 PolarHBondContact O-SG 3.29Å; Q438-C441 VanDerWaalsContact O-SG 3.42Å
439	S	38.4	Very low	46.2	Very low	57 Å²	57	70.3 Å²	70.3	40%	0.399	36%	0.359	S	S	.	.	H	α-helix	trans	-69.2	-33.1	169	-107.2	0	0	0	0	110.5	R435 C441	R435-S439 PolarHBondContact O-N 3.03Å; S439-C441 PolarHBondContact O-N 3.13Å
440	M	41.8	Very low	45.5	Very low	59 Å²	59	69.5 Å²	69.5	29%	0.291	35%	0.353	S	S	.	.	S	Bend	trans	-69.9	49.5	155.9	-63.3	176.1	72	0	0	110.2	R436 Q438 I442 R443 L446	R436-M440 VanDerWaalsContact O-CG 3.29Å; R436-M440 WeakPolarHBondContact O-CG 3.38Å; R436-M440 PolarHBondContact O-N 2.82Å; Q438-M440 VanDerWaalsContact C-N 3.27Å; M440-I442 PolarHBondContact O-N 2.94Å; M440-R443 HydrophobicContact CB-CB 4.11Å; M440-R443 HydrophobicContact CE-CG 4.1Å; M440-R443 WeakPolarHBondContact O-CA 3.3Å; M440-R443 WeakPolarHBondContact O-CB 3.23Å; M440-R443 PolarHBondContact O-N 3.42Å; M440-L446 HydrophobicContact CE-CD1 3.89Å
441	C	34.8	Very low	44.9	Very low	70 Å²	70	67.4 Å²	67.4	47%	0.473	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-12	177.4	-125.7	0	0	0	0	111.8	L418 Q438 S439 R443	L418-C441 HydrophobicContact CD2-CB 3.19Å; Q438-C441 WeakPolarHBondContact O-CA 3.36Å; Q438-C441 WeakPolarHBondContact O-CB 3.23Å; Q438-C441 PolarHBondContact O-N 3.3Å; Q438-C441 PolarHBondContact O-SG 3.29Å; Q438-C441 VanDerWaalsContact O-SG 3.42Å; S439-C441 PolarHBondContact O-N 3.13Å; C441-R443 PolarHBondContact O-N 3.41Å
442	I	48.2	Very low	44.1	Very low	19 Å²	19	61 Å²	61	10%	0.097	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-19.7	165.4	-34	172.6	0	0	0	111.1	L382 L386 M440 G444 M445 L446	L382-I442 HydrophobicContact CD2-CD1 3.58Å; L382-I442 HydrophobicContact CG-CD1 4.39Å; L386-I442 HydrophobicContact CD1-CG2 3.75Å; M440-I442 PolarHBondContact O-N 2.94Å; I442-G444 VanDerWaalsContact C-N 3.27Å; I442-G444 PolarHBondContact O-N 3.42Å; I442-M445 HydrophobicContact CG2-CB 4.05Å; I442-M445 CarbonylContact O-C 3.55Å; I442-M445 WeakPolarHBondContact O-CA 3.22Å; I442-M445 VanDerWaalsContact O-CB 3.32Å; I442-M445 WeakPolarHBondContact O-CB 3.32Å; I442-M445 PolarHBondContact O-N 3.36Å; I442-L446 VanDerWaalsContact C-CG 3.42Å; I442-L446 HydrophobicContact CB-CD1 3.53Å; I442-L446 HydrophobicContact CB-CD2 3.75Å; I442-L446 HydrophobicContact CB-CG 3.44Å; I442-L446 VanDerWaalsContact CB-CG 3.44Å; I442-L446 HydrophobicContact CG2-CD1 4.09Å; I442-L446 HydrophobicContact CG2-CD2 3.21Å; I442-L446 HydrophobicContact CG2-CG 3.44Å; I442-L446 VanDerWaalsContact CG2-CG 3.44Å; I442-L446 VanDerWaalsContact O-CG 3.32Å; I442-L446 WeakPolarHBondContact O-CG 3.23Å; I442-L446 PolarHBondContact O-N 3.19Å
443	R	37	Very low	43.2	Very low	82 Å²	82	61.2 Å²	61.2	31%	0.309	32%	0.316	S	S	.	.	H	α-helix	trans	-51.8	-31.7	-167.9	-152	168.3	-170.3	-91.5	1.1	115.5	M440 C441 L446 E447	M440-R443 HydrophobicContact CB-CB 4.11Å; M440-R443 HydrophobicContact CE-CG 4.1Å; M440-R443 WeakPolarHBondContact O-CA 3.3Å; M440-R443 WeakPolarHBondContact O-CB 3.23Å; M440-R443 PolarHBondContact O-N 3.42Å; C441-R443 PolarHBondContact O-N 3.41Å; R443-L446 CarbonylContact O-C 3.57Å; R443-L446 PolarHBondContact O-N 3.23Å; R443-E447 WeakPolarHBondContact O-CB 3.49Å; R443-E447 VanDerWaalsContact O-CG 3.22Å; R443-E447 WeakPolarHBondContact O-CG 3.37Å; R443-E447 PolarHBondContact O-N 2.83Å
444	G	34.4	Very low	43	Very low	59 Å²	59	58.9 Å²	58.9	61%	0.608	31%	0.311	S	S	*	.	H	α-helix	trans	-69.6	-33.6	170.6	0	0	0	0	0	113.9	I442	I442-G444 VanDerWaalsContact C-N 3.27Å; I442-G444 PolarHBondContact O-N 3.42Å
445	M	42	Very low	43.1	Very low	41 Å²	41	58.6 Å²	58.6	20%	0.202	30%	0.303	C	S	.	.	H	α-helix	trans	-81.6	-26.5	167.3	-67.4	172.9	145.7	0	0	112.4	Q387 P415 I442	Q387-M445 HydrophobicContact CB-CE 4.37Å; P415-M445 HydrophobicContact CB-CE 3.62Å; I442-M445 HydrophobicContact CG2-CB 4.05Å; I442-M445 CarbonylContact O-C 3.55Å; I442-M445 WeakPolarHBondContact O-CA 3.22Å; I442-M445 VanDerWaalsContact O-CB 3.32Å; I442-M445 WeakPolarHBondContact O-CB 3.32Å; I442-M445 PolarHBondContact O-N 3.36Å
446	L	44.8	Very low	43.7	Very low	12 Å²	12	57.7 Å²	57.7	6%	0.063	30%	0.303	C	S	.	.	H	α-helix	trans	-86	-15.1	-179.7	-53.8	173.8	0	0	0	114.5	L386 M440 I442 R443 Q448 L449 W451	L386-L446 HydrophobicContact CD1-CD2 4.41Å; M440-L446 HydrophobicContact CE-CD1 3.89Å; I442-L446 VanDerWaalsContact C-CG 3.42Å; I442-L446 HydrophobicContact CB-CD1 3.53Å; I442-L446 HydrophobicContact CB-CD2 3.75Å; I442-L446 HydrophobicContact CB-CG 3.44Å; I442-L446 VanDerWaalsContact CB-CG 3.44Å; I442-L446 HydrophobicContact CG2-CD1 4.09Å; I442-L446 HydrophobicContact CG2-CD2 3.21Å; I442-L446 HydrophobicContact CG2-CG 3.44Å; I442-L446 VanDerWaalsContact CG2-CG 3.44Å; I442-L446 VanDerWaalsContact O-CG 3.32Å; I442-L446 WeakPolarHBondContact O-CG 3.23Å; I442-L446 PolarHBondContact O-N 3.19Å; R443-L446 CarbonylContact O-C 3.57Å; R443-L446 PolarHBondContact O-N 3.23Å; L446-Q448 PolarHBondContact O-N 2.84Å; L446-Q448 VanDerWaalsContact O-N 3.07Å; L446-L449 HydrophobicContact CD2-CB 4.24Å; L446-L449 HydrophobicContact CD2-CD1 3.75Å; L446-L449 PolarHBondContact O-N 3.11Å; L446-L449 VanDerWaalsContact O-O 3.11Å; L446-W451 HydrophobicContact CD1-CZ2 3.79Å; L446-W451 VanDerWaalsContact CD1-NE1 3.28Å; L446-W451 HydrophobicContact CD2-CH2 4.09Å; L446-W451 HydrophobicContact CD2-CZ2 3.08Å; L446-W451 HydrophobicContact CG-CZ2 3.93Å
447	E	34.2	Very low	44.2	Very low	109 Å²	109	60.8 Å²	60.8	51%	0.509	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-18.1	171.2	-86	165.8	-165.6	0	0	111	R443	R443-E447 WeakPolarHBondContact O-CB 3.49Å; R443-E447 VanDerWaalsContact O-CG 3.22Å; R443-E447 WeakPolarHBondContact O-CG 3.37Å; R443-E447 PolarHBondContact O-N 2.83Å
448	Q	37.7	Very low	45.8	Very low	113 Å²	113	57.9 Å²	57.9	53%	0.528	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-8	171.4	-60.4	-176	12.9	0	0	114.5	L446	L446-Q448 PolarHBondContact O-N 2.84Å; L446-Q448 VanDerWaalsContact O-N 3.07Å
449	L	48.8	Very low	47.1	Very low	36 Å²	36	57 Å²	57	19%	0.188	32%	0.317	C	S	.	.			trans	-113	111	-173.9	-70.6	170	0	0	0	110.9	L386 I390 L402 L446 W451	L386-L449 HydrophobicContact CB-CD1 4.35Å; L386-L449 HydrophobicContact CD1-CD1 4.19Å; L386-L449 HydrophobicContact CD2-CD1 4.36Å; I390-L449 HydrophobicContact CD1-CD1 4.06Å; I390-L449 HydrophobicContact CD1-CD2 3.83Å; I390-L449 HydrophobicContact CD1-CG 3.89Å; I390-L449 HydrophobicContact CG1-CD2 3.99Å; L402-L449 HydrophobicContact CD1-CD2 4.31Å; L446-L449 HydrophobicContact CD2-CB 4.24Å; L446-L449 HydrophobicContact CD2-CD1 3.75Å; L446-L449 PolarHBondContact O-N 3.11Å; L446-L449 VanDerWaalsContact O-O 3.11Å; L449-W451 PolarHBondContact O-N 3.27Å
450	D	50.8	Low	48.8	Very low	34 Å²	34	59.4 Å²	59.4	18%	0.182	32%	0.322	C	S	.	.			trans	-75	101.9	170.6	-167.1	7.1	0	0	0	109	G452 M513 A514	D450-G452 PolarHBondContact O-N 3.38Å; D450-M513 WeakPolarHBondContact OD2-CA 3.4Å; D450-M513 WeakPolarHBondContact OD2-CB 3.46Å; D450-A514 HydrophobicContact CB-CB 3.75Å; D450-A514 PolarHBondContact OD2-N 2.85Å
451	W	49.6	Very low	50.4	Low	65 Å²	65	57.7 Å²	57.7	25%	0.246	32%	0.317	C	S	.	.			trans	-71.1	116.3	179.8	-67.8	103.4	0	0	0	110.1	L446 L449 F455 N502	L446-W451 HydrophobicContact CD1-CZ2 3.79Å; L446-W451 VanDerWaalsContact CD1-NE1 3.28Å; L446-W451 HydrophobicContact CD2-CH2 4.09Å; L446-W451 HydrophobicContact CD2-CZ2 3.08Å; L446-W451 HydrophobicContact CG-CZ2 3.93Å; L449-W451 PolarHBondContact O-N 3.27Å; W451-F455 HydrophobicContact CB-CE2 4.31Å; W451-F455 AromaticContact CD2-CE2 3.48Å; W451-F455 HydrophobicContact CD2-CE2 3.48Å; W451-F455 VanDerWaalsContact CD2-CE2 3.48Å; W451-F455 AromaticContact CD2-CZ 3.97Å; W451-F455 HydrophobicContact CD2-CZ 3.97Å; W451-F455 HydrophobicContact CE3-CD2 4.25Å; W451-F455 AromaticContact CE3-CE2 3.25Å; W451-F455 HydrophobicContact CE3-CE2 3.25Å; W451-F455 AromaticContact CE3-CZ 3.61Å; W451-F455 HydrophobicContact CE3-CZ 3.61Å; W451-F455 AromaticContact CG-CE2 4Å; W451-F455 HydrophobicContact CG-CE2 4Å; W451-F455 HydrophobicContact CH2-CE2 4.08Å; W451-F455 AromaticContact CH2-CZ 3.54Å; W451-F455 HydrophobicContact CH2-CZ 3.54Å; W451-F455 HydrophobicContact CZ2-CE2 4.21Å; W451-F455 AromaticContact CZ2-CZ 3.83Å; W451-F455 HydrophobicContact CZ2-CZ 3.83Å; W451-F455 HydrophobicContact CZ3-CE1 4.43Å; W451-F455 AromaticContact CZ3-CE2 3.62Å; W451-F455 HydrophobicContact CZ3-CE2 3.62Å; W451-F455 AromaticContact CZ3-CZ 3.43Å; W451-F455 HydrophobicContact CZ3-CZ 3.43Å; W451-F455 VanDerWaalsContact CZ3-CZ 3.43Å; W451-N502 PolarHBondContact O-ND2 3.27Å; W451-N502 VanDerWaalsContact O-ND2 3.09Å
452	G	45.2	Very low	52.4	Low	14 Å²	14	62.8 Å²	62.8	14%	0.144	33%	0.333	C	S	.	.			trans	-54.9	151.9	161.4	0	0	0	0	0	110.9	D450 S454	D450-G452 PolarHBondContact O-N 3.38Å; G452-S454 PolarHBondContact O-N 3.35Å
453	P	42.6	Very low	53.5	Low	17 Å²	17	65.8 Å²	65.8	11%	0.11	35%	0.353	C	S	.	.	S	Bend	trans	-62.9	3.2	171.7	25	-33.1	0	0	0	114.8	F455 K520 C660	P453-F455 VanDerWaalsContact C-N 3.25Å; P453-F455 PolarHBondContact O-N 2.86Å; P453-F455 VanDerWaalsContact O-N 3.13Å; P453-K520 HydrophobicContact CG-CG 4.21Å; P453-C660 WeakPolarHBondContact CB-SG 3.45Å
454	S	52.8	Low	55.3	Low	40 Å²	40	63.5 Å²	63.5	28%	0.28	35%	0.347	S	S	.	.			trans	-87.7	40.4	-173.3	-33.3	0	0	0	0	113	G452 D456 D475 R478	G452-S454 PolarHBondContact O-N 3.35Å; S454-D456 PolarHBondContact O-N 3.13Å; S454-D475 WeakPolarHBondContact CB-OD1 3.19Å; S454-D475 PolarHBondContact OG-OD1 3.35Å; S454-R478 PolarHBondContact OG-NH1 3.11Å; S454-R478 PolarHBondContact OG-NH2 2.96Å; S454-R478 VanDerWaalsContact OG-NH2 3.08Å
455	F	53.3	Low	57.4	Low	85 Å²	85	60.8 Å²	60.8	37%	0.373	32%	0.318	S	S	.	.			trans	-81.4	106	163.8	-96.4	-84.4	0	0	0	107.3	W451 P453 W652	W451-F455 HydrophobicContact CB-CE2 4.31Å; W451-F455 AromaticContact CD2-CE2 3.48Å; W451-F455 HydrophobicContact CD2-CE2 3.48Å; W451-F455 VanDerWaalsContact CD2-CE2 3.48Å; W451-F455 AromaticContact CD2-CZ 3.97Å; W451-F455 HydrophobicContact CD2-CZ 3.97Å; W451-F455 HydrophobicContact CE3-CD2 4.25Å; W451-F455 AromaticContact CE3-CE2 3.25Å; W451-F455 HydrophobicContact CE3-CE2 3.25Å; W451-F455 AromaticContact CE3-CZ 3.61Å; W451-F455 HydrophobicContact CE3-CZ 3.61Å; W451-F455 AromaticContact CG-CE2 4Å; W451-F455 HydrophobicContact CG-CE2 4Å; W451-F455 HydrophobicContact CH2-CE2 4.08Å; W451-F455 AromaticContact CH2-CZ 3.54Å; W451-F455 HydrophobicContact CH2-CZ 3.54Å; W451-F455 HydrophobicContact CZ2-CE2 4.21Å; W451-F455 AromaticContact CZ2-CZ 3.83Å; W451-F455 HydrophobicContact CZ2-CZ 3.83Å; W451-F455 HydrophobicContact CZ3-CE1 4.43Å; W451-F455 AromaticContact CZ3-CE2 3.62Å; W451-F455 HydrophobicContact CZ3-CE2 3.62Å; W451-F455 AromaticContact CZ3-CZ 3.43Å; W451-F455 HydrophobicContact CZ3-CZ 3.43Å; W451-F455 VanDerWaalsContact CZ3-CZ 3.43Å; P453-F455 VanDerWaalsContact C-N 3.25Å; P453-F455 PolarHBondContact O-N 2.86Å; P453-F455 VanDerWaalsContact O-N 3.13Å; F455-W652 PolarHBondContact O-NE1 3.3Å
456	D	59.1	Low	59.3	Low	57 Å²	57	64.4 Å²	64.4	31%	0.305	34%	0.339	S	S	.	.			trans	-121	140.7	174.9	-67	-56.8	0	0	0	109.8	S454 Y458	S454-D456 PolarHBondContact O-N 3.13Å; D456-Y458 HydrophobicContact CB-CD2 4.28Å; D456-Y458 HydrophobicContact CB-CE1 4.09Å; D456-Y458 HydrophobicContact CB-CE2 3.33Å; D456-Y458 WeakPolarHBondContact CB-OH 3.36Å; D456-Y458 PolarHBondContact OD2-OH 2.7Å
457	I	59.5	Low	60.8	Low	112 Å²	112	70.1 Å²	70.1	57%	0.574	36%	0.359	S	S	*	.			trans	-105.1	120.9	179.4	-58.3	174.5	0	0	0	107.8
458	Y	68.6	Low	63	Low	45 Å²	45	65.2 Å²	65.2	18%	0.176	34%	0.336	C	S	.	.			trans	-122.9	132.7	176.7	-49.1	-78.9	0	0	0	108.3	D456 D464 R467 F468 D471	D456-Y458 HydrophobicContact CB-CD2 4.28Å; D456-Y458 HydrophobicContact CB-CE1 4.09Å; D456-Y458 HydrophobicContact CB-CE2 3.33Å; D456-Y458 WeakPolarHBondContact CB-OH 3.36Å; D456-Y458 PolarHBondContact OD2-OH 2.7Å; Y458-D464 HydrophobicContact CD1-CB 4.14Å; Y458-R467 HydrophobicContact CE1-CG 4.23Å; Y458-F468 HydrophobicContact CD1-CB 3.75Å; Y458-F468 HydrophobicContact CD2-CB 4.46Å; Y458-F468 AromaticContact CD2-CD2 3.74Å; Y458-F468 HydrophobicContact CD2-CD2 3.74Å; Y458-F468 HydrophobicContact CE1-CB 3.78Å; Y458-F468 HydrophobicContact CE1-CD2 4.42Å; Y458-F468 HydrophobicContact CE2-CB 4.49Å; Y458-F468 AromaticContact CE2-CD2 3.64Å; Y458-F468 HydrophobicContact CE2-CD2 3.64Å; Y458-F468 HydrophobicContact CE2-CE2 4.44Å; Y458-F468 HydrophobicContact CG-CB 4.09Å; Y458-F468 HydrophobicContact CG-CD2 4.17Å; Y458-F468 AromaticContact CZ-CD2 3.98Å; Y458-D471 WeakPolarHBondContact OH-CB 3.45Å; Y458-D471 PolarHBondContact OH-OD2 2.81Å
459	A	65.5	Low	65.4	Low	72 Å²	72	61 Å²	61	60%	0.595	32%	0.317	S	S	*	.			trans	-89.3	-54.9	-177.6	0	0	0	0	0	111.5	D464	A459-D464 WeakPolarHBondContact CB-OD2 3.15Å; A459-D464 PolarHBondContact N-OD2 2.99Å
460	Q	73.9	Confident	67.1	Low	107 Å²	107	61.3 Å²	61.3	50%	0.5	33%	0.325	S	S	.	.			trans	-147.8	142.8	-173.4	-66.8	-176.8	-19.7	0	0	111.3	E462 V463 D464	Q460-E462 PolarHBondContact O-N 2.9Å; Q460-V463 PolarHBondContact O-N 3.14Å; Q460-V463 VanDerWaalsContact O-N 3.1Å; Q460-D464 PolarHBondContact N-OD2 2.88Å; Q460-D464 PolarHBondContact O-N 2.77Å
461	A	75.7	Confident	68.5	Low	22 Å²	22	60.8 Å²	60.8	18%	0.182	32%	0.322	C	S	.	.	H	α-helix	trans	-61.7	-28.4	-179.7	0	0	0	0	0	113.9	S287 G288 L289 V463 G465	S287-A461 WeakPolarHBondContact O-CB 3.49Å; S287-A461 PolarHBondContact O-N 3.36Å; G288-A461 VanDerWaalsContact C-CB 3.44Å; L289-A461 HydrophobicContact CD2-CB 4.05Å; L289-A461 HydrophobicContact CG-CB 4.38Å; A461-V463 VanDerWaalsContact C-N 3.29Å; A461-V463 PolarHBondContact O-N 3.37Å; A461-G465 VanDerWaalsContact O-CA 3.24Å; A461-G465 WeakPolarHBondContact O-CA 3.44Å; A461-G465 PolarHBondContact O-N 2.7Å
462	E	75.9	Confident	70.3	Confident	177 Å²	177	58.3 Å²	58.3	83%	0.827	31%	0.313	S	S	*	.	H	α-helix	trans	-66.2	-30.8	177	-65.3	-176.8	-179.4	0	0	112.9	Q460	Q460-E462 PolarHBondContact O-N 2.9Å
463	V	73	Confident	72.4	Confident	83 Å²	83	60.8 Å²	60.8	50%	0.503	32%	0.32	S	S	.	.	H	α-helix	trans	-100.2	-46.5	-176.8	-176.9	0	0	0	0	111	Q460 A461	Q460-V463 PolarHBondContact O-N 3.14Å; Q460-V463 VanDerWaalsContact O-N 3.1Å; A461-V463 VanDerWaalsContact C-N 3.29Å; A461-V463 PolarHBondContact O-N 3.37Å
464	D	73.9	Confident	74.5	Confident	34 Å²	34	61.7 Å²	61.7	18%	0.182	32%	0.323	C	S	.	.	H	α-helix	trans	-110.2	-3.4	-167.2	-55.4	-50.8	0	0	0	113.4	Y458 A459 Q460 D466 R467 F468	Y458-D464 HydrophobicContact CD1-CB 4.14Å; A459-D464 WeakPolarHBondContact CB-OD2 3.15Å; A459-D464 PolarHBondContact N-OD2 2.99Å; Q460-D464 PolarHBondContact N-OD2 2.88Å; Q460-D464 PolarHBondContact O-N 2.77Å; D464-D466 VanDerWaalsContact C-N 3.29Å; D464-D466 PolarHBondContact O-N 3.41Å; D464-R467 PolarHBondContact O-N 2.83Å; D464-R467 VanDerWaalsContact O-N 3.14Å; D464-F468 WeakPolarHBondContact O-CB 3.44Å; D464-F468 PolarHBondContact O-N 2.78Å
465	G	78.4	Confident	76	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.01	31%	0.313	C	S	.	.	H	α-helix	trans	-60.6	-32.3	-168.2	0	0	0	0	0	114.9	A461 L469	A461-G465 VanDerWaalsContact O-CA 3.24Å; A461-G465 WeakPolarHBondContact O-CA 3.44Å; A461-G465 PolarHBondContact O-N 2.7Å; G465-L469 WeakPolarHBondContact O-CG 3.04Å; G465-L469 PolarHBondContact O-N 3.43Å
466	D	82.5	Confident	77.8	Confident	118 Å²	118	56.5 Å²	56.5	63%	0.631	30%	0.296	S	S	*	.	H	α-helix	trans	-79	-36.9	178.4	-62.8	-23.7	0	0	0	111.7	K292 D464 L469 A470	K292-D466 IonicContact NZ-OD1 2.78Å; K292-D466 PolarHBondContact NZ-OD1 3.01Å; D464-D466 VanDerWaalsContact C-N 3.29Å; D464-D466 PolarHBondContact O-N 3.41Å; D466-L469 PolarHBondContact O-N 2.95Å; D466-A470 WeakPolarHBondContact O-CB 3.12Å; D466-A470 PolarHBondContact O-N 3.21Å
467	R	75.7	Confident	79.3	Confident	131 Å²	131	57.4 Å²	57.4	49%	0.494	30%	0.298	S	S	.	.	H	α-helix	trans	-62	-48.1	171.6	-179.6	-175.8	168.8	-173.7	-1.9	110.6	Y458 D464 L469 A470 D471	Y458-R467 HydrophobicContact CE1-CG 4.23Å; D464-R467 PolarHBondContact O-N 2.83Å; D464-R467 VanDerWaalsContact O-N 3.14Å; R467-L469 VanDerWaalsContact C-N 3.29Å; R467-L469 PolarHBondContact O-N 2.85Å; R467-A470 PolarHBondContact O-N 2.84Å; R467-D471 WeakPolarHBondContact CG-OD2 3.37Å; R467-D471 IonicContact NE-OD2 2.66Å; R467-D471 PolarHBondContact NE-OD2 2.83Å; R467-D471 PolarHBondContact O-N 2.7Å
468	F	81.2	Confident	80.6	Confident	7 Å²	7	52.5 Å²	52.5	3%	0.031	27%	0.273	C	S	.	.	H	α-helix	trans	-51.3	-46.9	174.5	165.7	-108	0	0	0	112.6	L289 F293 F405 Y458 D464 L472	L289-F468 HydrophobicContact CD2-CB 4.16Å; L289-F468 HydrophobicContact CD2-CD1 4.01Å; L289-F468 HydrophobicContact CD2-CD2 4.48Å; L289-F468 HydrophobicContact CD2-CG 3.96Å; F293-F468 HydrophobicContact CB-CE1 4.05Å; F293-F468 HydrophobicContact CB-CZ 4.12Å; F405-F468 AromaticContact CD1-CE2 3.69Å; F405-F468 HydrophobicContact CD1-CE2 3.69Å; F405-F468 AromaticContact CD1-CZ 3.73Å; F405-F468 HydrophobicContact CD1-CZ 3.73Å; F405-F468 AromaticContact CE1-CE2 3.47Å; F405-F468 HydrophobicContact CE1-CE2 3.47Å; F405-F468 VanDerWaalsContact CE1-CE2 3.47Å; F405-F468 AromaticContact CE1-CZ 3.39Å; F405-F468 HydrophobicContact CE1-CZ 3.39Å; Y458-F468 HydrophobicContact CD1-CB 3.75Å; Y458-F468 HydrophobicContact CD2-CB 4.46Å; Y458-F468 AromaticContact CD2-CD2 3.74Å; Y458-F468 HydrophobicContact CD2-CD2 3.74Å; Y458-F468 HydrophobicContact CE1-CB 3.78Å; Y458-F468 HydrophobicContact CE1-CD2 4.42Å; Y458-F468 HydrophobicContact CE2-CB 4.49Å; Y458-F468 AromaticContact CE2-CD2 3.64Å; Y458-F468 HydrophobicContact CE2-CD2 3.64Å; Y458-F468 HydrophobicContact CE2-CE2 4.44Å; Y458-F468 HydrophobicContact CG-CB 4.09Å; Y458-F468 HydrophobicContact CG-CD2 4.17Å; Y458-F468 AromaticContact CZ-CD2 3.98Å; D464-F468 WeakPolarHBondContact O-CB 3.44Å; D464-F468 PolarHBondContact O-N 2.78Å; F468-L472 HydrophobicContact CZ-CD2 4.3Å; F468-L472 VanDerWaalsContact O-CB 3.26Å; F468-L472 WeakPolarHBondContact O-CB 3.48Å; F468-L472 PolarHBondContact O-N 2.7Å
469	L	87.7	Confident	81.7	Confident	25 Å²	25	52.8 Å²	52.8	13%	0.131	28%	0.28	C	S	.	.	H	α-helix	trans	-67.9	-38.3	177	-72.7	-179	0	0	0	112.8	K292 N296 L300 G465 D466 R467 K473	K292-L469 HydrophobicContact CD-CD1 4.19Å; K292-L469 HydrophobicContact CG-CD1 3.97Å; K292-L469 HydrophobicContact CG-CD2 4.34Å; K292-L469 HydrophobicContact CG-CG 4.06Å; N296-L469 HydrophobicContact CB-CD1 4.22Å; N296-L469 HydrophobicContact CB-CD2 3.83Å; L300-L469 HydrophobicContact CD1-CD2 4.47Å; G465-L469 WeakPolarHBondContact O-CG 3.04Å; G465-L469 PolarHBondContact O-N 3.43Å; D466-L469 PolarHBondContact O-N 2.95Å; R467-L469 VanDerWaalsContact C-N 3.29Å; R467-L469 PolarHBondContact O-N 2.85Å; L469-K473 WeakPolarHBondContact O-CB 3.49Å; L469-K473 PolarHBondContact O-N 3.45Å
470	A	83.5	Confident	83	Confident	41 Å²	41	49.6 Å²	49.6	34%	0.339	25%	0.253	S	S	.	.	H	α-helix	trans	-66.6	-39.6	179.1	0	0	0	0	0	112.5	D466 R467 H474 R668	D466-A470 WeakPolarHBondContact O-CB 3.12Å; D466-A470 PolarHBondContact O-N 3.21Å; R467-A470 PolarHBondContact O-N 2.84Å; A470-H474 PolarHBondContact O-N 3.46Å; A470-H474 VanDerWaalsContact O-N 3.12Å; A470-R668 PolarHBondContact O-NH1 2.76Å
471	D	80.3	Confident	84	Confident	24 Å²	24	44.7 Å²	44.7	13%	0.128	23%	0.23	C	C	.	.	H	α-helix	trans	-73.1	-42.1	178	-70	-21.9	0	0	0	110.6	Y458 R467 K473 H474 D475 R668	Y458-D471 WeakPolarHBondContact OH-CB 3.45Å; Y458-D471 PolarHBondContact OH-OD2 2.81Å; R467-D471 WeakPolarHBondContact CG-OD2 3.37Å; R467-D471 IonicContact NE-OD2 2.66Å; R467-D471 PolarHBondContact NE-OD2 2.83Å; R467-D471 PolarHBondContact O-N 2.7Å; D471-K473 PolarHBondContact O-N 2.83Å; D471-H474 WeakPolarHBondContact O-CB 3.25Å; D471-H474 PolarHBondContact O-N 2.65Å; D471-D475 WeakPolarHBondContact O-CB 3.38Å; D471-D475 PolarHBondContact O-N 2.91Å; D471-R668 IonicContact OD1-NH1 3.84Å; D471-R668 PolarHBondContact OD1-NH1 2.74Å
472	L	87.4	Confident	84.9	Confident	12 Å²	12	43.7 Å²	43.7	6%	0.063	22%	0.221	C	C	.	.	H	α-helix	trans	-63.5	-41.7	173.6	-179	59.5	0	0	0	112.6	F293 L300 F403 F405 F468 H474 D475 L476	F293-L472 HydrophobicContact CD2-CD2 3.54Å; F293-L472 HydrophobicContact CE2-CD2 3.84Å; L300-L472 HydrophobicContact CD1-CD2 3.57Å; L300-L472 HydrophobicContact CD1-CG 4.32Å; L300-L472 HydrophobicContact CD2-CD2 4.28Å; L300-L472 HydrophobicContact CD2-CG 4.21Å; F403-L472 HydrophobicContact CD1-CD1 3.92Å; F403-L472 HydrophobicContact CE1-CD1 4.18Å; F405-L472 HydrophobicContact CE1-CD2 4.15Å; F405-L472 HydrophobicContact CZ-CD1 4.13Å; F405-L472 HydrophobicContact CZ-CD2 4.05Å; F468-L472 HydrophobicContact CZ-CD2 4.3Å; F468-L472 VanDerWaalsContact O-CB 3.26Å; F468-L472 WeakPolarHBondContact O-CB 3.48Å; F468-L472 PolarHBondContact O-N 2.7Å; L472-H474 VanDerWaalsContact C-N 3.33Å; L472-H474 PolarHBondContact O-N 2.83Å; L472-D475 PolarHBondContact O-N 3.02Å; L472-L476 HydrophobicContact CD1-CD1 4.2Å; L472-L476 HydrophobicContact CD1-CG 4.29Å; L472-L476 HydrophobicContact CG-CD1 4.08Å; L472-L476 VanDerWaalsContact O-CG 3.3Å; L472-L476 WeakPolarHBondContact O-CG 3.16Å; L472-L476 PolarHBondContact O-N 3.32Å
473	K	90.1	Very high	85.8	Confident	66 Å²	66	37.2 Å²	37.2	29%	0.287	19%	0.193	S	C	.	.	H	α-helix	trans	-58.8	-46.4	175.6	-175.9	-159.5	176	-155.3	0	110.8	F299 L300 N303 L469 D471 L476 E477	F299-K473 HydrophobicContact CE1-CD 3.89Å; F299-K473 HydrophobicContact CE1-CG 4.11Å; F299-K473 HydrophobicContact CZ-CD 4.12Å; L300-K473 HydrophobicContact CD2-CB 4.34Å; N303-K473 HydrophobicContact CB-CG 4.36Å; N303-K473 WeakPolarHBondContact ND2-CE 3.48Å; L469-K473 WeakPolarHBondContact O-CB 3.49Å; L469-K473 PolarHBondContact O-N 3.45Å; D471-K473 PolarHBondContact O-N 2.83Å; K473-L476 PolarHBondContact O-N 2.72Å; K473-E477 VanDerWaalsContact CE-OE2 3.3Å; K473-E477 WeakPolarHBondContact CE-OE2 3.31Å; K473-E477 IonicContact NZ-OE2 3.7Å; K473-E477 WeakPolarHBondContact O-CB 3.45Å; K473-E477 WeakPolarHBondContact O-CG 3.35Å; K473-E477 PolarHBondContact O-N 2.78Å
474	H	86.2	Confident	86.8	Confident	36 Å²	36	33.3 Å²	33.3	17%	0.167	17%	0.169	C	C	.	.	H	α-helix	trans	-60.2	-45.3	176.3	178.8	67.8	0	0	0	112.4	A470 D471 L472 L476 E477 R478 D519 R668	A470-H474 PolarHBondContact O-N 3.46Å; A470-H474 VanDerWaalsContact O-N 3.12Å; D471-H474 WeakPolarHBondContact O-CB 3.25Å; D471-H474 PolarHBondContact O-N 2.65Å; L472-H474 VanDerWaalsContact C-N 3.33Å; L472-H474 PolarHBondContact O-N 2.83Å; H474-L476 PolarHBondContact O-N 3.15Å; H474-E477 PolarHBondContact O-N 3.3Å; H474-R478 WeakPolarHBondContact O-CB 3.36Å; H474-R478 WeakPolarHBondContact O-CG 2.95Å; H474-R478 PolarHBondContact O-N 3.44Å; H474-R478 VanDerWaalsContact O-N 3.08Å; H474-D519 IonicContact CD2-OD2 3.39Å; H474-D519 IonicContact CE1-OD2 2.82Å; H474-D519 IonicContact NE2-OD1 3.65Å; H474-D519 IonicContact NE2-OD2 3.95Å; H474-D519 PolarHBondContact NE2-OD2 3.31Å; H474-R668 PolarHBondContact ND1-NH2 3.19Å
475	D	85.8	Confident	87.9	Confident	15 Å²	15	33.8 Å²	33.8	8%	0.08	17%	0.171	C	C	.	.	H	α-helix	trans	-64.6	-27.4	-178.9	-164.9	53.5	0	0	0	113	K401 F403 S454 D471 L472 R478	K401-D475 WeakPolarHBondContact CE-OD2 3.22Å; K401-D475 PolarHBondContact NZ-O 3.39Å; K401-D475 IonicContact NZ-OD1 3.79Å; K401-D475 PolarHBondContact NZ-OD1 2.88Å; K401-D475 IonicContact NZ-OD2 3.74Å; K401-D475 PolarHBondContact NZ-OD2 2.92Å; F403-D475 HydrophobicContact CE1-CB 4.44Å; F403-D475 WeakPolarHBondContact CE1-OD2 3.5Å; S454-D475 WeakPolarHBondContact CB-OD1 3.19Å; S454-D475 PolarHBondContact OG-OD1 3.35Å; D471-D475 WeakPolarHBondContact O-CB 3.38Å; D471-D475 PolarHBondContact O-N 2.91Å; L472-D475 PolarHBondContact O-N 3.02Å; D475-R478 IonicContact OD1-CZ 3.64Å; D475-R478 IonicContact OD1-NE 3.74Å; D475-R478 PolarHBondContact OD1-NE 2.78Å; D475-R478 IonicContact OD1-NH1 2.92Å; D475-R478 PolarHBondContact OD1-NH1 3.18Å; D475-R478 IonicContact OD1-NH2 3.62Å; D475-R478 PolarHBondContact OD1-NH2 3.47Å
476	L	91	Very high	88.8	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-82.8	-40.1	173.6	-69.6	168.7	0	0	0	112.8	F274 F276 L300 N303 L304 P305 F403 L472 K473 H474	F274-L476 HydrophobicContact CD2-CD2 3.82Å; F274-L476 HydrophobicContact CE2-CD2 3.89Å; F276-L476 HydrophobicContact CE1-CD2 4.14Å; F276-L476 HydrophobicContact CZ-CD2 3.91Å; L300-L476 HydrophobicContact CB-CD1 3.77Å; L300-L476 HydrophobicContact CD2-CD1 4.02Å; L300-L476 HydrophobicContact CG-CD1 4.36Å; N303-L476 CarbonylContact O-C 3.59Å; L304-L476 HydrophobicContact CD2-CD2 3.85Å; P305-L476 WeakPolarHBondContact CD-O 3.36Å; P305-L476 WeakPolarHBondContact CG-O 3.21Å; F403-L476 HydrophobicContact CD1-CD2 4.48Å; F403-L476 HydrophobicContact CE1-CD2 3.64Å; F403-L476 HydrophobicContact CE1-CG 4.12Å; F403-L476 HydrophobicContact CE2-CD2 4.15Å; F403-L476 HydrophobicContact CZ-CD2 3.46Å; F403-L476 VanDerWaalsContact CZ-CD2 3.46Å; F403-L476 HydrophobicContact CZ-CG 4.33Å; L472-L476 HydrophobicContact CD1-CD1 4.2Å; L472-L476 HydrophobicContact CD1-CG 4.29Å; L472-L476 HydrophobicContact CG-CD1 4.08Å; L472-L476 VanDerWaalsContact O-CG 3.3Å; L472-L476 WeakPolarHBondContact O-CG 3.16Å; L472-L476 PolarHBondContact O-N 3.32Å; K473-L476 PolarHBondContact O-N 2.72Å; H474-L476 PolarHBondContact O-N 3.15Å
477	E	89.7	Confident	89.5	Confident	77 Å²	77	31.3 Å²	31.3	36%	0.36	15%	0.152	S	C	.	.	H	α-helix	trans	-84.9	-22	-171.8	77	-167.3	166	0	0	114.7	N303 K473 H474	N303-E477 HydrophobicContact CB-CB 4.27Å; N303-E477 PolarHBondContact ND2-OE2 3.23Å; N303-E477 WeakPolarHBondContact O-CA 3.23Å; N303-E477 WeakPolarHBondContact O-CB 3.5Å; K473-E477 VanDerWaalsContact CE-OE2 3.3Å; K473-E477 WeakPolarHBondContact CE-OE2 3.31Å; K473-E477 IonicContact NZ-OE2 3.7Å; K473-E477 WeakPolarHBondContact O-CB 3.45Å; K473-E477 WeakPolarHBondContact O-CG 3.35Å; K473-E477 PolarHBondContact O-N 2.78Å; H474-E477 PolarHBondContact O-N 3.3Å
478	R	87.5	Confident	90.5	Very high	9 Å²	9	25.6 Å²	25.6	3%	0.034	13%	0.132	C	C	.	.	S	Bend	trans	-62.9	144	-175.7	67.5	-175.4	-174.5	-165.2	-1.3	112.5	S454 H474 D475 I480 D517 D519	S454-R478 PolarHBondContact OG-NH1 3.11Å; S454-R478 PolarHBondContact OG-NH2 2.96Å; S454-R478 VanDerWaalsContact OG-NH2 3.08Å; H474-R478 WeakPolarHBondContact O-CB 3.36Å; H474-R478 WeakPolarHBondContact O-CG 2.95Å; H474-R478 PolarHBondContact O-N 3.44Å; H474-R478 VanDerWaalsContact O-N 3.08Å; D475-R478 IonicContact OD1-CZ 3.64Å; D475-R478 IonicContact OD1-NE 3.74Å; D475-R478 PolarHBondContact OD1-NE 2.78Å; D475-R478 IonicContact OD1-NH1 2.92Å; D475-R478 PolarHBondContact OD1-NH1 3.18Å; D475-R478 IonicContact OD1-NH2 3.62Å; D475-R478 PolarHBondContact OD1-NH2 3.47Å; R478-I480 PolarHBondContact O-N 3.2Å; R478-D517 HydrophobicContact CG-CB 4.12Å; R478-D517 IonicContact CZ-OD1 3.31Å; R478-D517 IonicContact CZ-OD2 2.65Å; R478-D517 IonicContact NE-OD1 3.84Å; R478-D517 IonicContact NE-OD2 3.25Å; R478-D517 PolarHBondContact NE-OD2 2.75Å; R478-D517 IonicContact NH1-OD1 3.73Å; R478-D517 IonicContact NH1-OD2 2.81Å; R478-D517 IonicContact NH2-OD1 2.69Å; R478-D517 IonicContact NH2-OD2 2.69Å; R478-D517 PolarHBondContact NH2-OD2 3.36Å; R478-D519 IonicContact CZ-OD2 3.03Å; R478-D519 IonicContact NH1-OD2 3.87Å; R478-D519 PolarHBondContact NH1-OD2 3.06Å; R478-D519 VanDerWaalsContact NH1-OD2 3.07Å
479	P	90.9	Very high	91.3	Very high	50 Å²	50	26.2 Å²	26.2	33%	0.325	13%	0.134	S	C	.	.			trans	-55	129.3	172.1	-25.4	34.7	0	0	0	111.2	M172 N174 D517 S518	M172-P479 HydrophobicContact CE-CB 4.21Å; N174-P479 WeakPolarHBondContact OD1-CD 3.45Å; N174-P479 WeakPolarHBondContact OD1-CG 3.48Å; P479-D517 CarbonylContact O-C 3.56Å; P479-D517 WeakPolarHBondContact O-CA 3.35Å; P479-D517 WeakPolarHBondContact O-CB 3.06Å; P479-S518 PolarHBondContact O-N 3.27Å
480	I	92.9	Very high	91.8	Very high	6 Å²	6	25.9 Å²	25.9	3%	0.031	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	145.5	-176.2	-169.5	167.5	0	0	0	110.8	F274 P305 K401 R478 F482 A515 L516 D517 V548	F274-I480 HydrophobicContact CZ-CG2 4.46Å; P305-I480 HydrophobicContact CB-CG2 4.48Å; P305-I480 HydrophobicContact CG-CG2 3.91Å; K401-I480 HydrophobicContact CD-CD1 3.93Å; R478-I480 PolarHBondContact O-N 3.2Å; I480-F482 HydrophobicContact CD1-CE1 4.26Å; I480-F482 HydrophobicContact CD1-CZ 3.89Å; I480-F482 HydrophobicContact CG1-CE1 4.49Å; I480-F482 HydrophobicContact CG1-CE2 4.29Å; I480-F482 HydrophobicContact CG1-CZ 3.92Å; I480-F482 HydrophobicContact CG2-CE2 3.92Å; I480-F482 HydrophobicContact CG2-CZ 3.9Å; I480-A515 HydrophobicContact CD1-CB 4.06Å; I480-A515 HydrophobicContact CG1-CB 4.32Å; I480-L516 CarbonylContact C-O 3.49Å; I480-L516 WeakPolarHBondContact CA-O 3.3Å; I480-D517 HydrophobicContact CB-CB 4.25Å; I480-D517 HydrophobicContact CD1-CB 4.41Å; I480-D517 HydrophobicContact CG1-CB 4.14Å; I480-V548 HydrophobicContact CG2-CG1 4.13Å; I480-V548 VanDerWaalsContact O-CG1 3.3Å; I480-V548 WeakPolarHBondContact O-CG1 3.45Å
481	I	95.2	Very high	92.4	Very high	4 Å²	4	24.3 Å²	24.3	2%	0.021	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	156.3	175.7	61.7	173.9	0	0	0	109.8	M172 A484 A515 L516 V543 F545	M172-I481 HydrophobicContact CE-CG2 3.57Å; M172-I481 HydrophobicContact CG-CD1 4.04Å; M172-I481 HydrophobicContact CG-CG1 4.11Å; M172-I481 HydrophobicContact CG-CG2 4.47Å; M172-I481 HydrophobicContact SD-CD1 3.77Å; M172-I481 HydrophobicContact SD-CG1 4.11Å; M172-I481 HydrophobicContact SD-CG2 3.63Å; I481-A484 HydrophobicContact CD1-CB 4.12Å; I481-A484 HydrophobicContact CG1-CB 4.36Å; I481-A515 CarbonylContact O-C 3.42Å; I481-A515 VanDerWaalsContact O-CA 3.23Å; I481-A515 WeakPolarHBondContact O-CA 3.3Å; I481-L516 HydrophobicContact CD1-CB 4.07Å; I481-L516 HydrophobicContact CD1-CD2 3.87Å; I481-L516 HydrophobicContact CD1-CG 4.33Å; I481-L516 HydrophobicContact CG1-CB 3.74Å; I481-L516 HydrophobicContact CG1-CD2 4.43Å; I481-L516 HydrophobicContact CG1-CG 4.36Å; I481-L516 WeakPolarHBondContact CG1-O 3.18Å; I481-L516 PolarHBondContact N-O 2.81Å; I481-L516 PolarHBondContact O-N 3.09Å; I481-V543 HydrophobicContact CD1-CG1 3.82Å; I481-F545 HydrophobicContact CB-CB 3.95Å; I481-F545 HydrophobicContact CB-CD2 3.47Å; I481-F545 VanDerWaalsContact CB-CD2 3.47Å; I481-F545 HydrophobicContact CB-CE2 4.15Å; I481-F545 HydrophobicContact CB-CG 3.85Å; I481-F545 HydrophobicContact CD1-CB 3.6Å; I481-F545 HydrophobicContact CD1-CD1 3.93Å; I481-F545 HydrophobicContact CD1-CD2 4.12Å; I481-F545 HydrophobicContact CD1-CG 3.62Å; I481-F545 HydrophobicContact CG1-CB 4.11Å; I481-F545 HydrophobicContact CG1-CD2 4.35Å; I481-F545 HydrophobicContact CG1-CG 4.25Å; I481-F545 HydrophobicContact CG2-CD2 3.32Å; I481-F545 HydrophobicContact CG2-CE2 3.45Å; I481-F545 VanDerWaalsContact CG2-CE2 3.45Å; I481-F545 HydrophobicContact CG2-CG 3.99Å; I481-F545 HydrophobicContact CG2-CZ 4.2Å
482	F	95.1	Very high	93.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	158.3	-173.7	-61.8	-88.1	0	0	0	112.7	P272 F274 A399 K401 I480 A484 A514 A515 T546 V548	P272-F482 HydrophobicContact CB-CD1 4.11Å; P272-F482 HydrophobicContact CB-CD2 3.51Å; P272-F482 HydrophobicContact CB-CE1 4.23Å; P272-F482 HydrophobicContact CB-CE2 3.68Å; P272-F482 HydrophobicContact CB-CG 3.78Å; P272-F482 HydrophobicContact CB-CZ 4.07Å; P272-F482 HydrophobicContact CG-CD2 3.51Å; P272-F482 HydrophobicContact CG-CE2 3.45Å; P272-F482 VanDerWaalsContact CG-CE2 3.45Å; P272-F482 HydrophobicContact CG-CG 4.29Å; P272-F482 HydrophobicContact CG-CZ 4.19Å; F274-F482 HydrophobicContact CE1-CE1 4.12Å; F274-F482 AromaticContact CE1-CZ 3.59Å; F274-F482 HydrophobicContact CE1-CZ 3.59Å; F274-F482 HydrophobicContact CZ-CZ 4.26Å; A399-F482 HydrophobicContact CB-CB 3.73Å; A399-F482 HydrophobicContact CB-CG 4.37Å; K401-F482 HydrophobicContact CB-CE1 4.07Å; I480-F482 HydrophobicContact CD1-CE1 4.26Å; I480-F482 HydrophobicContact CD1-CZ 3.89Å; I480-F482 HydrophobicContact CG1-CE1 4.49Å; I480-F482 HydrophobicContact CG1-CE2 4.29Å; I480-F482 HydrophobicContact CG1-CZ 3.92Å; I480-F482 HydrophobicContact CG2-CE2 3.92Å; I480-F482 HydrophobicContact CG2-CZ 3.9Å; F482-A484 PolarHBondContact O-N 3.34Å; F482-A514 WeakPolarHBondContact CA-O 3.39Å; F482-A515 HydrophobicContact CD1-CB 4.04Å; F482-A515 HydrophobicContact CE1-CB 4.02Å; F482-T546 PolarHBondContact N-O 2.91Å; F482-T546 PolarHBondContact O-N 3.12Å; F482-V548 HydrophobicContact CE2-CG1 4.23Å
483	D	93.3	Very high	93.4	Very high	42 Å²	42	29.1 Å²	29.1	23%	0.225	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	49.3	49.1	175.2	-168.2	31.3	0	0	0	111.6	K264 A399 A514 R552	K264-D483 WeakPolarHBondContact CE-OD1 3.36Å; K264-D483 WeakPolarHBondContact CE-OD2 3.3Å; K264-D483 IonicContact NZ-OD1 3.89Å; K264-D483 PolarHBondContact NZ-OD1 2.86Å; K264-D483 IonicContact NZ-OD2 3.45Å; K264-D483 PolarHBondContact NZ-OD2 2.85Å; A399-D483 HydrophobicContact CB-CB 4.41Å; D483-A514 PolarHBondContact N-O 3.18Å; D483-R552 PolarHBondContact O-NH1 3.22Å; D483-R552 PolarHBondContact O-NH2 2.96Å; D483-R552 IonicContact OD2-NH1 2.96Å
484	A	94.9	Very high	93.8	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.008	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	136.9	-168.2	0	0	0	0	0	111	I481 F482 M513 L516 V543 L544 F545	I481-A484 HydrophobicContact CD1-CB 4.12Å; I481-A484 HydrophobicContact CG1-CB 4.36Å; F482-A484 PolarHBondContact O-N 3.34Å; A484-M513 HydrophobicContact CB-CB 4.27Å; A484-M513 HydrophobicContact CB-CE 4.44Å; A484-M513 PolarHBondContact N-O 3.24Å; A484-M513 PolarHBondContact O-N 2.83Å; A484-L516 HydrophobicContact CB-CB 4.49Å; A484-V543 HydrophobicContact CB-CG1 4.31Å; A484-L544 CarbonylContact C-O 3.59Å; A484-L544 WeakPolarHBondContact CA-O 3.33Å; A484-F545 HydrophobicContact CB-CB 4.02Å
485	I	95.8	Very high	94.2	Very high	44 Å²	44	30.6 Å²	30.6	23%	0.226	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	116.3	172.8	-55.3	176.3	0	0	0	107.2	D510 V511 E512 V543 L544	I485-D510 HydrophobicContact CG2-CB 4.03Å; I485-V511 CarbonylContact C-O 3.6Å; I485-V511 WeakPolarHBondContact CA-O 3.35Å; I485-E512 HydrophobicContact CG1-CG 4.48Å; I485-V543 WeakPolarHBondContact O-CA 3.23Å; I485-L544 PolarHBondContact N-O 3.43Å; I485-L544 PolarHBondContact O-N 2.85Å
486	M	97.7	Very high	94.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	135.5	175.2	-179.9	-178.1	78.4	0	0	110.6	I169 P171 V488 V511 M513 I522 V541 A542 V543	I169-M486 HydrophobicContact CD1-CE 4.37Å; I169-M486 HydrophobicContact CD1-SD 4.35Å; I169-M486 HydrophobicContact CG2-SD 3.99Å; P171-M486 HydrophobicContact CG-SD 4.36Å; M486-V488 HydrophobicContact CE-CG2 4.3Å; M486-V511 HydrophobicContact CB-CB 4.24Å; M486-V511 HydrophobicContact CE-CB 4.16Å; M486-V511 HydrophobicContact CE-CG1 4.33Å; M486-V511 HydrophobicContact CE-CG2 4.08Å; M486-V511 PolarHBondContact N-O 3.12Å; M486-V511 PolarHBondContact O-N 3.28Å; M486-M513 HydrophobicContact CB-CE 3.6Å; M486-I522 HydrophobicContact CE-CB 4.02Å; M486-I522 HydrophobicContact CE-CD1 3.45Å; M486-I522 VanDerWaalsContact CE-CD1 3.45Å; M486-I522 HydrophobicContact CE-CG1 4.34Å; M486-I522 HydrophobicContact CE-CG2 3.75Å; M486-I522 HydrophobicContact SD-CD1 4.03Å; M486-V541 HydrophobicContact CG-CG1 3.87Å; M486-V541 HydrophobicContact SD-CG1 3.77Å; M486-A542 CarbonylContact C-O 3.39Å; M486-A542 WeakPolarHBondContact CA-O 3.3Å; M486-V543 HydrophobicContact CB-CG2 4.13Å; M486-V543 HydrophobicContact CG-CG2 3.96Å; M486-V543 HydrophobicContact SD-CG2 4.45Å
487	R	97.3	Very high	94.8	Very high	66 Å²	66	32.6 Å²	32.6	25%	0.249	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	129.6	171.3	-177.1	168.1	179.4	156.7	0.6	110.6	D510 A542	R487-D510 WeakPolarHBondContact CD-OD1 3.41Å; R487-D510 IonicContact NH1-OD1 2.72Å; R487-A542 PolarHBondContact N-O 2.83Å; R487-A542 PolarHBondContact O-N 3.02Å
488	V	98	Very high	94.8	Very high	12 Å²	12	31 Å²	31	7%	0.073	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	123.7	175.3	-172.9	0	0	0	0	109.4	I169 M486 P496 F499 I524 V541	I169-V488 HydrophobicContact CD1-CG2 3.79Å; M486-V488 HydrophobicContact CE-CG2 4.3Å; V488-P496 HydrophobicContact CB-CB 4.45Å; V488-P496 HydrophobicContact CB-CG 4.01Å; V488-P496 HydrophobicContact CG1-CG 3.82Å; V488-F499 HydrophobicContact CG2-CE1 4.25Å; V488-I524 HydrophobicContact CB-CD1 4.25Å; V488-I524 HydrophobicContact CG1-CD1 3.74Å; V488-I524 HydrophobicContact CG2-CD1 4.07Å; V488-V541 HydrophobicContact CG1-CG2 4.49Å; V488-V541 HydrophobicContact CG2-CG2 4.35Å
489	R	97.8	Very high	94.9	Very high	19 Å²	19	31.7 Å²	31.7	7%	0.072	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	146	170.7	-65.1	179.1	-177.4	73.5	6.3	109.2	C198 K199 F539 Q540	C198-R489 PolarHBondContact O-NE 3.33Å; K199-R489 PolarHBondContact O-NE 3.12Å; R489-F539 CarbonylContact O-C 3.6Å; R489-F539 VanDerWaalsContact O-CA 3.31Å; R489-F539 WeakPolarHBondContact O-CA 3.17Å; R489-Q540 HydrophobicContact CB-CB 4.42Å; R489-Q540 PolarHBondContact N-O 2.71Å; R489-Q540 PolarHBondContact O-N 3.28Å
490	A	97.7	Very high	94.7	Very high	18 Å²	18	30.8 Å²	30.8	15%	0.149	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	163.9	176	0	0	0	0	0	110.3	L494 Y538 F539	A490-L494 HydrophobicContact CB-CB 3.86Å; A490-Y538 CarbonylContact C-O 3.48Å; A490-Y538 VanDerWaalsContact CA-O 3.26Å; A490-Y538 WeakPolarHBondContact CA-O 3.32Å; A490-F539 HydrophobicContact CB-CD1 3.82Å; A490-F539 HydrophobicContact CB-CE1 3.82Å
491	S	96.5	Very high	94	Very high	9 Å²	9	31.5 Å²	31.5	6%	0.063	16%	0.159	C	C	.	.			trans	-57.8	153.3	170.8	-72.9	0	0	0	0	112.8	F219 G493 L494 Y538	F219-S491 CarbonylContact O-C 3.5Å; S491-G493 PolarHBondContact O-N 3.03Å; S491-L494 PolarHBondContact O-N 2.92Å; S491-Y538 PolarHBondContact N-O 3.33Å; S491-Y538 WeakPolarHBondContact OG-CB 3.46Å; S491-Y538 WeakPolarHBondContact OG-CD2 3.31Å; S491-Y538 PolarHBondContact OG-N 3.07Å
492	Q	94.5	Very high	93.1	Very high	129 Å²	129	32.5 Å²	32.5	60%	0.603	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.6	134.4	169.2	-176.2	173.8	-5.1	0	0	110.6	F219 L532	F219-Q492 PolarHBondContact O-N 3.29Å; Q492-L532 WeakPolarHBondContact O-CD2 3.23Å
493	G	94	Very high	92.6	Very high	8 Å²	8	34.8 Å²	34.8	8%	0.082	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.6	-14.1	-173.2	0	0	0	0	0	113.9	S491 H528 D529 D530	S491-G493 PolarHBondContact O-N 3.03Å; G493-H528 CarbonylContact O-C 3.53Å; G493-H528 VanDerWaalsContact O-CA 3.24Å; G493-H528 WeakPolarHBondContact O-CA 3.42Å; G493-D529 PolarHBondContact O-N 3.42Å; G493-D530 PolarHBondContact O-N 3.1Å
494	L	97.1	Very high	92.2	Very high	13 Å²	13	37.6 Å²	37.6	7%	0.068	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	146.2	176.3	-63.5	174.9	0	0	0	112.3	F165 A490 S491 I526 K527 H528 L532 A537 F539	F165-L494 HydrophobicContact CE1-CD1 4.24Å; F165-L494 HydrophobicContact CE1-CD2 4.03Å; A490-L494 HydrophobicContact CB-CB 3.86Å; S491-L494 PolarHBondContact O-N 2.92Å; L494-I526 HydrophobicContact CB-CG2 4.08Å; L494-I526 HydrophobicContact CD2-CG2 3.99Å; L494-I526 HydrophobicContact CG-CG2 4.44Å; L494-K527 WeakPolarHBondContact CA-O 3.05Å; L494-H528 WeakPolarHBondContact CD2-NE2 3.38Å; L494-L532 HydrophobicContact CD1-CD1 4.05Å; L494-L532 HydrophobicContact CD1-CD2 4.19Å; L494-L532 HydrophobicContact CD2-CD1 4.19Å; L494-L532 HydrophobicContact CD2-CD2 4.44Å; L494-L532 HydrophobicContact CD2-CG 4.46Å; L494-L532 HydrophobicContact CG-CD1 4.21Å; L494-L532 HydrophobicContact CG-CD2 3.88Å; L494-L532 HydrophobicContact CG-CG 4.39Å; L494-A537 HydrophobicContact CD1-CB 3.84Å; L494-F539 HydrophobicContact CD1-CE1 4.16Å; L494-F539 HydrophobicContact CD1-CZ 3.7Å
495	R	95.4	Very high	91.8	Very high	119 Å²	119	40 Å²	40	45%	0.449	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	123.7	179.1	-177.9	174.1	172.4	-176.2	-0.2	111.6	T497 I526 K527 D529	R495-T497 HydrophobicContact CB-CG2 4.36Å; R495-T497 HydrophobicContact CG-CG2 3.91Å; R495-T497 PolarHBondContact O-N 3.14Å; R495-I526 WeakPolarHBondContact O-CA 3.45Å; R495-K527 PolarHBondContact N-O 3.19Å; R495-K527 PolarHBondContact O-N 3.35Å; R495-D529 WeakPolarHBondContact CB-OD2 3.21Å; R495-D529 VanDerWaalsContact CD-OD2 3.32Å; R495-D529 WeakPolarHBondContact CD-OD2 3.37Å
496	P	96.6	Very high	91.3	Very high	17 Å²	17	42.3 Å²	42.3	11%	0.11	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	128.1	162.2	-19.3	33.1	0	0	0	109.7	V488 F499 I524	V488-P496 HydrophobicContact CB-CB 4.45Å; V488-P496 HydrophobicContact CB-CG 4.01Å; V488-P496 HydrophobicContact CG1-CG 3.82Å; P496-F499 HydrophobicContact CB-CE2 4.27Å; P496-F499 HydrophobicContact CB-CZ 3.83Å; P496-I524 HydrophobicContact CB-CD1 4.29Å
497	T	92.9	Very high	91	Very high	41 Å²	41	45.5 Å²	45.5	25%	0.252	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	-59.2	-171.3	50.6	0	0	0	0	113.5	R495 E525 K527	R495-T497 HydrophobicContact CB-CG2 4.36Å; R495-T497 HydrophobicContact CG-CG2 3.91Å; R495-T497 PolarHBondContact O-N 3.14Å; T497-E525 PolarHBondContact N-O 3.11Å; T497-E525 PolarHBondContact OG1-O 3.35Å; T497-K527 HydrophobicContact CG2-CB 4.07Å; T497-K527 HydrophobicContact CG2-CD 4.05Å; T497-K527 HydrophobicContact CG2-CG 4.25Å; T497-K527 WeakPolarHBondContact OG1-CD 3.38Å; T497-K527 WeakPolarHBondContact OG1-CE 3.19Å; T497-K527 WeakPolarHBondContact OG1-CG 3.39Å
498	D	90.1	Very high	90.7	Very high	43 Å²	43	45.3 Å²	45.3	23%	0.23	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	123.1	-179.1	-69.5	-81	0	0	0	109.2	F500 I524 E525 K527 K587	D498-F500 HydrophobicContact CB-CE1 4.11Å; D498-F500 HydrophobicContact CB-CE2 4.13Å; D498-F500 HydrophobicContact CB-CZ 3.6Å; D498-I524 CarbonylContact O-C 3.57Å; D498-I524 VanDerWaalsContact O-CA 3.31Å; D498-I524 WeakPolarHBondContact O-CA 3.25Å; D498-E525 HydrophobicContact CB-CB 4.07Å; D498-E525 PolarHBondContact O-N 2.92Å; D498-K527 IonicContact OD2-NZ 2.67Å; D498-K527 PolarHBondContact OD2-NZ 3.2Å; D498-K587 IonicContact OD1-NZ 2.81Å
499	F	90	Very high	90.4	Very high	24 Å²	24	47.2 Å²	47.2	11%	0.105	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	142.2	178.4	-65.8	-105.7	0	0	0	109.3	V488 P496 F503 M505 V511 I522 S523 I524	V488-F499 HydrophobicContact CG2-CE1 4.25Å; P496-F499 HydrophobicContact CB-CE2 4.27Å; P496-F499 HydrophobicContact CB-CZ 3.83Å; F499-F503 HydrophobicContact CB-CE1 3.83Å; F499-F503 HydrophobicContact CB-CE2 4.11Å; F499-F503 HydrophobicContact CB-CZ 3.29Å; F499-M505 HydrophobicContact CB-SD 3.95Å; F499-M505 HydrophobicContact CD2-CE 3.73Å; F499-M505 HydrophobicContact CD2-SD 3.93Å; F499-M505 HydrophobicContact CE2-CE 3.84Å; F499-M505 HydrophobicContact CG-CE 4.17Å; F499-M505 HydrophobicContact CG-SD 3.96Å; F499-M505 HydrophobicContact CZ-CE 4.36Å; F499-V511 HydrophobicContact CD1-CG2 3.46Å; F499-V511 VanDerWaalsContact CD1-CG2 3.46Å; F499-V511 HydrophobicContact CE1-CG2 3.63Å; F499-V511 HydrophobicContact CG-CG2 4.14Å; F499-V511 HydrophobicContact CZ-CG2 4.4Å; F499-I522 HydrophobicContact CD1-CG2 4.46Å; F499-S523 CarbonylContact C-O 3.55Å; F499-I524 HydrophobicContact CD1-CB 4.36Å; F499-I524 HydrophobicContact CD1-CG2 3.34Å; F499-I524 HydrophobicContact CE1-CG2 3.64Å; F499-I524 HydrophobicContact CG-CG2 4.1Å
500	F	85.1	Confident	90.3	Very high	32 Å²	32	47.3 Å²	47.3	14%	0.14	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	127.5	-177.2	-46.4	-65.1	0	0	0	109.8	D498 I522 S523 E525 I582 N585	D498-F500 HydrophobicContact CB-CE1 4.11Å; D498-F500 HydrophobicContact CB-CE2 4.13Å; D498-F500 HydrophobicContact CB-CZ 3.6Å; F500-I522 CarbonylContact O-C 3.56Å; F500-I522 WeakPolarHBondContact O-CA 3.45Å; F500-S523 WeakPolarHBondContact CD2-O 3.44Å; F500-S523 PolarHBondContact N-O 2.66Å; F500-S523 PolarHBondContact O-N 2.82Å; F500-E525 HydrophobicContact CE2-CB 4.34Å; F500-I582 HydrophobicContact CE2-CG2 4.42Å; F500-N585 WeakPolarHBondContact CD1-ND2 3.45Å; F500-N585 HydrophobicContact CE1-CB 4.44Å; F500-N585 VanDerWaalsContact CE1-ND2 3.27Å; F500-N585 WeakPolarHBondContact CE1-ND2 3.39Å; F500-N585 VanDerWaalsContact CG-ND2 3.32Å; F500-N585 WeakPolarHBondContact CG-ND2 3.46Å
501	G	79.3	Confident	90	Very high	20 Å²	20	46.4 Å²	46.4	21%	0.206	24%	0.243	C	C	.	.	S	Bend	trans	158.6	179.4	-171.8	0	0	0	0	0	111.1	R658	G501-R658 WeakPolarHBondContact CA-O 3.46Å
502	N	76.7	Confident	89.8	Confident	25 Å²	25	48.5 Å²	48.5	13%	0.134	25%	0.252	C	S	.	.	S	Bend	trans	-92	101.6	166.7	-65.2	-11.2	0	0	0	107.6	W451	W451-N502 PolarHBondContact O-ND2 3.27Å; W451-N502 VanDerWaalsContact O-ND2 3.09Å
503	F	84.1	Confident	89.6	Confident	48 Å²	48	42.6 Å²	42.6	21%	0.211	22%	0.224	C	C	.	.			trans	-161.7	173.1	178.9	58.8	-107.1	0	0	0	109.6	F499 M505 V511 M513 I522	F499-F503 HydrophobicContact CB-CE1 3.83Å; F499-F503 HydrophobicContact CB-CE2 4.11Å; F499-F503 HydrophobicContact CB-CZ 3.29Å; F503-M505 HydrophobicContact CD2-CG 3.64Å; F503-M505 HydrophobicContact CD2-SD 4.13Å; F503-M505 HydrophobicContact CE2-CB 4.45Å; F503-M505 HydrophobicContact CE2-CG 3.52Å; F503-M505 HydrophobicContact CE2-SD 3.43Å; F503-M505 WeakPolarHBondContact CE2-SD 3.49Å; F503-M505 HydrophobicContact CZ-SD 4.1Å; F503-V511 HydrophobicContact CB-CG1 3.39Å; F503-V511 HydrophobicContact CD1-CG1 3.74Å; F503-V511 HydrophobicContact CD2-CG1 3.7Å; F503-V511 HydrophobicContact CE1-CG1 4.44Å; F503-V511 HydrophobicContact CE2-CG1 4.44Å; F503-V511 HydrophobicContact CG-CG1 3.32Å; F503-M513 HydrophobicContact CB-CG 3.88Å; F503-I522 HydrophobicContact CD1-CD1 4.45Å; F503-I522 HydrophobicContact CD1-CG1 4.28Å; F503-I522 HydrophobicContact CD1-CG2 4.21Å; F503-I522 HydrophobicContact CE1-CG2 4.02Å
504	Y	84.4	Confident	89.4	Confident	101 Å²	101	44.5 Å²	44.5	40%	0.396	24%	0.239	S	C	.	.	B	Isolated β-bridge	trans	-116.6	147.2	171.1	-176.8	-112	0	0	0	111	N506 E512	Y504-N506 HydrophobicContact CE1-CB 4.39Å; Y504-N506 VanDerWaalsContact CE1-ND2 3.32Å; Y504-N506 WeakPolarHBondContact CE1-ND2 3.4Å; Y504-N506 WeakPolarHBondContact CE1-OD1 3.08Å; Y504-N506 PolarHBondContact OH-OD1 3.04Å; Y504-E512 HydrophobicContact CD1-CB 4.44Å; Y504-E512 PolarHBondContact N-O 3.43Å; Y504-E512 WeakPolarHBondContact O-CB 3.45Å; Y504-E512 PolarHBondContact O-N 3.48Å
505	M	86.6	Confident	89	Confident	51 Å²	51	44.3 Å²	44.3	25%	0.251	24%	0.24	S	C	.	.			trans	-140.2	108.5	178.1	-75.9	-175.3	89.1	0	0	109.3	F499 F503 N507 D510 V511	F499-M505 HydrophobicContact CB-SD 3.95Å; F499-M505 HydrophobicContact CD2-CE 3.73Å; F499-M505 HydrophobicContact CD2-SD 3.93Å; F499-M505 HydrophobicContact CE2-CE 3.84Å; F499-M505 HydrophobicContact CG-CE 4.17Å; F499-M505 HydrophobicContact CG-SD 3.96Å; F499-M505 HydrophobicContact CZ-CE 4.36Å; F503-M505 HydrophobicContact CD2-CG 3.64Å; F503-M505 HydrophobicContact CD2-SD 4.13Å; F503-M505 HydrophobicContact CE2-CB 4.45Å; F503-M505 HydrophobicContact CE2-CG 3.52Å; F503-M505 HydrophobicContact CE2-SD 3.43Å; F503-M505 WeakPolarHBondContact CE2-SD 3.49Å; F503-M505 HydrophobicContact CZ-SD 4.1Å; M505-N507 VanDerWaalsContact C-N 3.31Å; M505-N507 WeakPolarHBondContact CE-O 3.4Å; M505-D510 WeakPolarHBondContact CG-O 3.5Å; M505-V511 HydrophobicContact CE-CG2 3.93Å; M505-V511 HydrophobicContact CG-CG2 4.22Å; M505-V511 HydrophobicContact SD-CG2 3.99Å
506	N	86.2	Confident	88.8	Confident	94 Å²	94	38.7 Å²	38.7	50%	0.503	22%	0.218	S	C	.	.	S	Bend	trans	-76.6	-21.3	170.8	-80.3	-48	0	0	0	113	Y504 E512	Y504-N506 HydrophobicContact CE1-CB 4.39Å; Y504-N506 VanDerWaalsContact CE1-ND2 3.32Å; Y504-N506 WeakPolarHBondContact CE1-ND2 3.4Å; Y504-N506 WeakPolarHBondContact CE1-OD1 3.08Å; Y504-N506 PolarHBondContact OH-OD1 3.04Å; N506-E512 PolarHBondContact ND2-OE1 2.98Å; N506-E512 PolarHBondContact ND2-OE2 3.47Å
507	N	91.4	Very high	88.5	Confident	66 Å²	66	37.9 Å²	37.9	35%	0.353	21%	0.213	S	C	.	.	S	Bend	trans	-137.8	178.1	-177.8	68.9	53.8	0	0	0	109.6	M505 T509 D510	M505-N507 VanDerWaalsContact C-N 3.31Å; M505-N507 WeakPolarHBondContact CE-O 3.4Å; N507-T509 VanDerWaalsContact C-N 3.3Å; N507-T509 PolarHBondContact O-N 3.38Å; N507-T509 WeakPolarHBondContact OD1-CA 3.2Å; N507-T509 PolarHBondContact OD1-N 3.05Å; N507-T509 PolarHBondContact OD1-OG1 3.13Å; N507-D510 PolarHBondContact ND2-OD2 3.38Å; N507-D510 PolarHBondContact OD1-N 2.81Å
508	A	90	Very high	88.4	Confident	63 Å²	63	36.3 Å²	36.3	52%	0.521	20%	0.203	S	C	.	.	S	Bend	trans	-84.2	4.6	-175.1	0	0	0	0	0	114.7
509	T	93	Very high	88	Confident	52 Å²	52	35.4 Å²	35.4	32%	0.319	20%	0.199	S	C	.	.	S	Bend	trans	-130.1	-33.8	-168.9	54.5	0	0	0	0	115.5	N507	N507-T509 VanDerWaalsContact C-N 3.3Å; N507-T509 PolarHBondContact O-N 3.38Å; N507-T509 WeakPolarHBondContact OD1-CA 3.2Å; N507-T509 PolarHBondContact OD1-N 3.05Å; N507-T509 PolarHBondContact OD1-OG1 3.13Å
510	D	93.8	Very high	87.6	Confident	20 Å²	20	34.7 Å²	34.7	11%	0.107	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	123	-174.4	-55.6	-41.4	0	0	0	109.1	I485 R487 M505 N507	I485-D510 HydrophobicContact CG2-CB 4.03Å; R487-D510 WeakPolarHBondContact CD-OD1 3.41Å; R487-D510 IonicContact NH1-OD1 2.72Å; M505-D510 WeakPolarHBondContact CG-O 3.5Å; N507-D510 PolarHBondContact ND2-OD2 3.38Å; N507-D510 PolarHBondContact OD1-N 2.81Å
511	V	93	Very high	87.7	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	109.5	179.3	-178.3	0	0	0	0	108.2	I485 M486 F499 F503 M505 M513 I522	I485-V511 CarbonylContact C-O 3.6Å; I485-V511 WeakPolarHBondContact CA-O 3.35Å; M486-V511 HydrophobicContact CB-CB 4.24Å; M486-V511 HydrophobicContact CE-CB 4.16Å; M486-V511 HydrophobicContact CE-CG1 4.33Å; M486-V511 HydrophobicContact CE-CG2 4.08Å; M486-V511 PolarHBondContact N-O 3.12Å; M486-V511 PolarHBondContact O-N 3.28Å; F499-V511 HydrophobicContact CD1-CG2 3.46Å; F499-V511 VanDerWaalsContact CD1-CG2 3.46Å; F499-V511 HydrophobicContact CE1-CG2 3.63Å; F499-V511 HydrophobicContact CG-CG2 4.14Å; F499-V511 HydrophobicContact CZ-CG2 4.4Å; F503-V511 HydrophobicContact CB-CG1 3.39Å; F503-V511 HydrophobicContact CD1-CG1 3.74Å; F503-V511 HydrophobicContact CD2-CG1 3.7Å; F503-V511 HydrophobicContact CE1-CG1 4.44Å; F503-V511 HydrophobicContact CE2-CG1 4.44Å; F503-V511 HydrophobicContact CG-CG1 3.32Å; M505-V511 HydrophobicContact CE-CG2 3.93Å; M505-V511 HydrophobicContact CG-CG2 4.22Å; M505-V511 HydrophobicContact SD-CG2 3.99Å; V511-M513 HydrophobicContact CG1-CE 4.32Å; V511-I522 HydrophobicContact CG1-CD1 4.06Å
512	E	91.9	Very high	88.2	Confident	53 Å²	53	32.6 Å²	32.6	25%	0.248	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	132.2	-177.7	-60.8	177.7	-148.3	0	0	110.3	I485 Y504 N506	I485-E512 HydrophobicContact CG1-CG 4.48Å; Y504-E512 HydrophobicContact CD1-CB 4.44Å; Y504-E512 PolarHBondContact N-O 3.43Å; Y504-E512 WeakPolarHBondContact O-CB 3.45Å; Y504-E512 PolarHBondContact O-N 3.48Å; N506-E512 PolarHBondContact ND2-OE1 2.98Å; N506-E512 PolarHBondContact ND2-OE2 3.47Å
513	M	90	Very high	88.9	Confident	5 Å²	5	32 Å²	32	3%	0.025	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	123.5	179.5	-69.7	162.4	-77.2	0	0	109.1	D450 A484 M486 F503 V511 A515 L516 I522	D450-M513 WeakPolarHBondContact OD2-CA 3.4Å; D450-M513 WeakPolarHBondContact OD2-CB 3.46Å; A484-M513 HydrophobicContact CB-CB 4.27Å; A484-M513 HydrophobicContact CB-CE 4.44Å; A484-M513 PolarHBondContact N-O 3.24Å; A484-M513 PolarHBondContact O-N 2.83Å; M486-M513 HydrophobicContact CB-CE 3.6Å; F503-M513 HydrophobicContact CB-CG 3.88Å; V511-M513 HydrophobicContact CG1-CE 4.32Å; M513-A515 VanDerWaalsContact C-N 3.28Å; M513-A515 PolarHBondContact O-N 3.04Å; M513-L516 HydrophobicContact CE-CD2 4.17Å; M513-L516 HydrophobicContact SD-CB 4.05Å; M513-L516 HydrophobicContact SD-CD1 3.76Å; M513-L516 HydrophobicContact SD-CD2 4.03Å; M513-L516 HydrophobicContact SD-CG 4.16Å; M513-I522 HydrophobicContact CE-CD1 3.96Å; M513-I522 HydrophobicContact SD-CD1 3.52Å; M513-I522 VanDerWaalsContact SD-CD1 3.52Å
514	A	89.4	Confident	89.4	Confident	48 Å²	48	29.7 Å²	29.7	40%	0.397	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	-37.4	178.6	0	0	0	0	0	110.9	D450 F482 D483	D450-A514 HydrophobicContact CB-CB 3.75Å; D450-A514 PolarHBondContact OD2-N 2.85Å; F482-A514 WeakPolarHBondContact CA-O 3.39Å; D483-A514 PolarHBondContact N-O 3.18Å
515	A	90.1	Very high	89.8	Confident	9 Å²	9	26.8 Å²	26.8	7%	0.074	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	129.7	172.5	0	0	0	0	0	111.5	I480 I481 F482 M513 K520	I480-A515 HydrophobicContact CD1-CB 4.06Å; I480-A515 HydrophobicContact CG1-CB 4.32Å; I481-A515 CarbonylContact O-C 3.42Å; I481-A515 VanDerWaalsContact O-CA 3.23Å; I481-A515 WeakPolarHBondContact O-CA 3.3Å; F482-A515 HydrophobicContact CD1-CB 4.04Å; F482-A515 HydrophobicContact CE1-CB 4.02Å; M513-A515 VanDerWaalsContact C-N 3.28Å; M513-A515 PolarHBondContact O-N 3.04Å; A515-K520 WeakPolarHBondContact O-CE 3.08Å; A515-K520 PolarHBondContact O-NZ 2.86Å
516	L	90.2	Very high	90.2	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.005	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	127	177.4	174.6	67.9	0	0	0	109.3	P171 M172 I480 I481 A484 M513 K520 V543	P171-L516 HydrophobicContact CB-CD2 3.94Å; P171-L516 HydrophobicContact CG-CD2 3.76Å; M172-L516 HydrophobicContact CG-CD2 4.25Å; M172-L516 HydrophobicContact CG-CG 4.11Å; I480-L516 CarbonylContact C-O 3.49Å; I480-L516 WeakPolarHBondContact CA-O 3.3Å; I481-L516 HydrophobicContact CD1-CB 4.07Å; I481-L516 HydrophobicContact CD1-CD2 3.87Å; I481-L516 HydrophobicContact CD1-CG 4.33Å; I481-L516 HydrophobicContact CG1-CB 3.74Å; I481-L516 HydrophobicContact CG1-CD2 4.43Å; I481-L516 HydrophobicContact CG1-CG 4.36Å; I481-L516 WeakPolarHBondContact CG1-O 3.18Å; I481-L516 PolarHBondContact N-O 2.81Å; I481-L516 PolarHBondContact O-N 3.09Å; A484-L516 HydrophobicContact CB-CB 4.49Å; M513-L516 HydrophobicContact CE-CD2 4.17Å; M513-L516 HydrophobicContact SD-CB 4.05Å; M513-L516 HydrophobicContact SD-CD1 3.76Å; M513-L516 HydrophobicContact SD-CD2 4.03Å; M513-L516 HydrophobicContact SD-CG 4.16Å; L516-K520 HydrophobicContact CD1-CB 3.61Å; L516-K520 HydrophobicContact CD1-CD 4.09Å; L516-K520 HydrophobicContact CD1-CG 4.48Å; L516-V543 HydrophobicContact CD2-CG1 4.4Å
517	D	90.1	Very high	90.7	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	175	-180	57.3	62.1	0	0	0	111.6	R478 P479 I480 D519 K520	R478-D517 HydrophobicContact CG-CB 4.12Å; R478-D517 IonicContact CZ-OD1 3.31Å; R478-D517 IonicContact CZ-OD2 2.65Å; R478-D517 IonicContact NE-OD1 3.84Å; R478-D517 IonicContact NE-OD2 3.25Å; R478-D517 PolarHBondContact NE-OD2 2.75Å; R478-D517 IonicContact NH1-OD1 3.73Å; R478-D517 IonicContact NH1-OD2 2.81Å; R478-D517 IonicContact NH2-OD1 2.69Å; R478-D517 IonicContact NH2-OD2 2.69Å; R478-D517 PolarHBondContact NH2-OD2 3.36Å; P479-D517 CarbonylContact O-C 3.56Å; P479-D517 WeakPolarHBondContact O-CA 3.35Å; P479-D517 WeakPolarHBondContact O-CB 3.06Å; I480-D517 HydrophobicContact CB-CB 4.25Å; I480-D517 HydrophobicContact CD1-CB 4.41Å; I480-D517 HydrophobicContact CG1-CB 4.14Å; D517-D519 PolarHBondContact O-N 3.38Å; D517-D519 VanDerWaalsContact O-N 3.16Å; D517-D519 PolarHBondContact OD1-N 3.37Å; D517-K520 PolarHBondContact O-N 2.88Å; D517-K520 PolarHBondContact OD1-N 3.13Å; D517-K520 IonicContact OD2-NZ 3Å; D517-K520 PolarHBondContact OD2-NZ 3.08Å
518	S	90.3	Very high	90.9	Very high	7 Å²	7	21.1 Å²	21.1	5%	0.049	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-18.5	-176.5	61.9	0	0	0	0	115.4	T170 M172 N174 P479	T170-S518 VanDerWaalsContact CG2-O 3.25Å; T170-S518 WeakPolarHBondContact CG2-O 3.44Å; M172-S518 WeakPolarHBondContact O-CA 3.45Å; M172-S518 WeakPolarHBondContact O-CB 3.42Å; N174-S518 PolarHBondContact ND2-OG 3.45Å; P479-S518 PolarHBondContact O-N 3.27Å
519	D	82.4	Confident	91	Very high	24 Å²	24	23.3 Å²	23.3	13%	0.128	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-20.2	-172.4	-55.3	-22.4	0	0	0	112.3	H474 R478 D517 S664	H474-D519 IonicContact CD2-OD2 3.39Å; H474-D519 IonicContact CE1-OD2 2.82Å; H474-D519 IonicContact NE2-OD1 3.65Å; H474-D519 IonicContact NE2-OD2 3.95Å; H474-D519 PolarHBondContact NE2-OD2 3.31Å; R478-D519 IonicContact CZ-OD2 3.03Å; R478-D519 IonicContact NH1-OD2 3.87Å; R478-D519 PolarHBondContact NH1-OD2 3.06Å; R478-D519 VanDerWaalsContact NH1-OD2 3.07Å; D517-D519 PolarHBondContact O-N 3.38Å; D517-D519 VanDerWaalsContact O-N 3.16Å; D517-D519 PolarHBondContact OD1-N 3.37Å; D519-S664 PolarHBondContact O-OG 3.49Å
520	K	82.6	Confident	91.1	Very high	9 Å²	9	25.8 Å²	25.8	4%	0.039	14%	0.14	C	C	.	.	B	Isolated β-bridge	trans	-74	130.2	179.3	-77.7	-168.2	-174.1	93.5	0	111.3	T170 P453 A515 L516 D517 G659	T170-K520 WeakPolarHBondContact CG2-O 3.32Å; P453-K520 HydrophobicContact CG-CG 4.21Å; A515-K520 WeakPolarHBondContact O-CE 3.08Å; A515-K520 PolarHBondContact O-NZ 2.86Å; L516-K520 HydrophobicContact CD1-CB 3.61Å; L516-K520 HydrophobicContact CD1-CD 4.09Å; L516-K520 HydrophobicContact CD1-CG 4.48Å; D517-K520 PolarHBondContact O-N 2.88Å; D517-K520 PolarHBondContact OD1-N 3.13Å; D517-K520 IonicContact OD2-NZ 3Å; D517-K520 PolarHBondContact OD2-NZ 3.08Å; K520-G659 WeakPolarHBondContact CA-O 3.43Å
521	C	86.2	Confident	91.1	Very high	6 Å²	6	32 Å²	32	4%	0.041	17%	0.166	C	C	.	.			trans	-124.3	142.1	177.2	177.3	0	0	0	0	110.8	S168 I169 G659 H661	S168-C521 PolarHBondContact OG-SG 3.26Å; I169-C521 CarbonylContact O-C 3.55Å; I169-C521 WeakPolarHBondContact O-CA 3.37Å; C521-G659 PolarHBondContact N-O 3.13Å; C521-G659 VanDerWaalsContact N-O 3.13Å; C521-H661 HydrophobicContact CB-CB 3.75Å
522	I	90.2	Very high	91.2	Very high	3 Å²	3	33 Å²	33	2%	0.015	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	118.1	174.1	-58.9	166.6	0	0	0	108	I169 M486 F499 F500 F503 V511 M513 I524	I169-I522 WeakPolarHBondContact CB-O 3.39Å; I169-I522 PolarHBondContact N-O 3.38Å; I169-I522 PolarHBondContact O-N 3.07Å; M486-I522 HydrophobicContact CE-CB 4.02Å; M486-I522 HydrophobicContact CE-CD1 3.45Å; M486-I522 VanDerWaalsContact CE-CD1 3.45Å; M486-I522 HydrophobicContact CE-CG1 4.34Å; M486-I522 HydrophobicContact CE-CG2 3.75Å; M486-I522 HydrophobicContact SD-CD1 4.03Å; F499-I522 HydrophobicContact CD1-CG2 4.46Å; F500-I522 CarbonylContact O-C 3.56Å; F500-I522 WeakPolarHBondContact O-CA 3.45Å; F503-I522 HydrophobicContact CD1-CD1 4.45Å; F503-I522 HydrophobicContact CD1-CG1 4.28Å; F503-I522 HydrophobicContact CD1-CG2 4.21Å; F503-I522 HydrophobicContact CE1-CG2 4.02Å; V511-I522 HydrophobicContact CG1-CD1 4.06Å; M513-I522 HydrophobicContact CE-CD1 3.96Å; M513-I522 HydrophobicContact SD-CD1 3.52Å; M513-I522 VanDerWaalsContact SD-CD1 3.52Å; I522-I524 HydrophobicContact CG2-CG2 4.17Å
523	S	91.4	Very high	91.1	Very high	12 Å²	12	38.3 Å²	38.3	8%	0.084	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	139.5	172.5	-57.8	0	0	0	0	110.1	L167 F499 F500	L167-S523 CarbonylContact O-C 3.34Å; L167-S523 VanDerWaalsContact O-CA 3.3Å; L167-S523 WeakPolarHBondContact O-CA 3.43Å; F499-S523 CarbonylContact C-O 3.55Å; F500-S523 WeakPolarHBondContact CD2-O 3.44Å; F500-S523 PolarHBondContact N-O 2.66Å; F500-S523 PolarHBondContact O-N 2.82Å
524	I	93.3	Very high	91.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	142.6	179.4	69.4	172.4	0	0	0	110.4	G166 L167 I169 V488 P496 D498 F499 I522 I526	G166-I524 CarbonylContact C-O 3.32Å; G166-I524 WeakPolarHBondContact CA-O 3.49Å; L167-I524 HydrophobicContact CB-CD1 3.97Å; L167-I524 HydrophobicContact CB-CG1 3.74Å; L167-I524 HydrophobicContact CD1-CD1 3.81Å; L167-I524 HydrophobicContact CD1-CG1 4.49Å; L167-I524 HydrophobicContact CG-CD1 4Å; L167-I524 HydrophobicContact CG-CG1 4.16Å; L167-I524 PolarHBondContact N-O 3.07Å; L167-I524 PolarHBondContact O-N 3.49Å; I169-I524 HydrophobicContact CD1-CD1 4.09Å; I169-I524 HydrophobicContact CD1-CG1 4.48Å; I169-I524 HydrophobicContact CD1-CG2 4.31Å; V488-I524 HydrophobicContact CB-CD1 4.25Å; V488-I524 HydrophobicContact CG1-CD1 3.74Å; V488-I524 HydrophobicContact CG2-CD1 4.07Å; P496-I524 HydrophobicContact CB-CD1 4.29Å; D498-I524 CarbonylContact O-C 3.57Å; D498-I524 VanDerWaalsContact O-CA 3.31Å; D498-I524 WeakPolarHBondContact O-CA 3.25Å; F499-I524 HydrophobicContact CD1-CB 4.36Å; F499-I524 HydrophobicContact CD1-CG2 3.34Å; F499-I524 HydrophobicContact CE1-CG2 3.64Å; F499-I524 HydrophobicContact CG-CG2 4.1Å; I522-I524 HydrophobicContact CG2-CG2 4.17Å; I524-I526 HydrophobicContact CD1-CG1 4.39Å
525	E	93.7	Very high	91.3	Very high	39 Å²	39	43.4 Å²	43.4	18%	0.182	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	133.7	167.7	-166.7	178.5	-155.5	0	0	110.3	T497 D498 F500 K527	T497-E525 PolarHBondContact N-O 3.11Å; T497-E525 PolarHBondContact OG1-O 3.35Å; D498-E525 HydrophobicContact CB-CB 4.07Å; D498-E525 PolarHBondContact O-N 2.92Å; F500-E525 HydrophobicContact CE2-CB 4.34Å; E525-K527 IonicContact OE2-NZ 2.68Å
526	I	96	Very high	91.6	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	130.2	179.8	-62	158.7	0	0	0	108.9	F165 L167 L494 R495 I524 F539	F165-I526 HydrophobicContact CD1-CB 3.75Å; F165-I526 HydrophobicContact CD1-CG2 3.71Å; F165-I526 HydrophobicContact CE1-CB 4.05Å; F165-I526 HydrophobicContact CE1-CD1 4.25Å; F165-I526 HydrophobicContact CE1-CG2 3.66Å; F165-I526 HydrophobicContact CG-CB 4.37Å; F165-I526 HydrophobicContact CZ-CD1 4.31Å; F165-I526 PolarHBondContact O-N 3.21Å; L167-I526 HydrophobicContact CD1-CD1 4.29Å; L167-I526 HydrophobicContact CD2-CD1 4.23Å; L167-I526 HydrophobicContact CG-CD1 3.79Å; L494-I526 HydrophobicContact CB-CG2 4.08Å; L494-I526 HydrophobicContact CD2-CG2 3.99Å; L494-I526 HydrophobicContact CG-CG2 4.44Å; R495-I526 WeakPolarHBondContact O-CA 3.45Å; I524-I526 HydrophobicContact CD1-CG1 4.39Å; I526-F539 HydrophobicContact CD1-CD1 4.02Å; I526-F539 HydrophobicContact CD1-CE1 3.25Å; I526-F539 HydrophobicContact CD1-CZ 3.64Å; I526-F539 HydrophobicContact CG1-CE1 4.09Å; I526-F539 HydrophobicContact CG2-CE1 4.28Å
527	K	94.9	Very high	92	Very high	78 Å²	78	44.4 Å²	44.4	34%	0.339	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	159	175.1	-67.3	178.4	-172.7	152.2	0	110.7	L494 R495 T497 D498 E525	L494-K527 WeakPolarHBondContact CA-O 3.05Å; R495-K527 PolarHBondContact N-O 3.19Å; R495-K527 PolarHBondContact O-N 3.35Å; T497-K527 HydrophobicContact CG2-CB 4.07Å; T497-K527 HydrophobicContact CG2-CD 4.05Å; T497-K527 HydrophobicContact CG2-CG 4.25Å; T497-K527 WeakPolarHBondContact OG1-CD 3.38Å; T497-K527 WeakPolarHBondContact OG1-CE 3.19Å; T497-K527 WeakPolarHBondContact OG1-CG 3.39Å; D498-K527 IonicContact OD2-NZ 2.67Å; D498-K527 PolarHBondContact OD2-NZ 3.2Å; E525-K527 IonicContact OE2-NZ 2.68Å
528	H	96	Very high	92.4	Very high	14 Å²	14	46.3 Å²	46.3	7%	0.065	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	123.3	173.9	-70.3	73.9	0	0	0	110.7	P152 N155 G493 L494	P152-H528 PolarHBondContact O-CE1 3.08Å; P152-H528 VanDerWaalsContact O-CE1 3.32Å; P152-H528 PolarHBondContact O-NE2 3.21Å; N155-H528 HydrophobicContact CB-CB 3.88Å; G493-H528 CarbonylContact O-C 3.53Å; G493-H528 VanDerWaalsContact O-CA 3.24Å; G493-H528 WeakPolarHBondContact O-CA 3.42Å; L494-H528 WeakPolarHBondContact CD2-NE2 3.38Å
529	D	93.2	Very high	92.7	Very high	109 Å²	109	46.1 Å²	46.1	58%	0.583	24%	0.242	S	C	*	.	S	Bend	trans	-89	-26.1	166	-73.9	-17.6	0	0	0	111	G493 R495	G493-D529 PolarHBondContact O-N 3.42Å; R495-D529 WeakPolarHBondContact CB-OD2 3.21Å; R495-D529 VanDerWaalsContact CD-OD2 3.32Å; R495-D529 WeakPolarHBondContact CD-OD2 3.37Å
530	D	94.4	Very high	93.5	Very high	103 Å²	103	45 Å²	45	55%	0.551	24%	0.236	S	C	*	.	S	Bend	trans	-150.2	174.4	176.6	-155.7	-9.2	0	0	0	110.6	G493	G493-D530 PolarHBondContact O-N 3.1Å
531	K	94	Very high	94.3	Very high	152 Å²	152	44.6 Å²	44.6	66%	0.661	23%	0.234	S	C	*	.	P	Polyproline II helix	trans	-71.1	141.5	171.6	-64.3	-175.7	-179.8	178.1	0	110.4	I153	I153-K531 WeakPolarHBondContact O-CA 3.16Å
532	L	94.4	Very high	94.9	Very high	20 Å²	20	44.5 Å²	44.5	11%	0.105	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-81.4	140.7	170.9	-66.8	179.2	0	0	0	110.4	A151 P152 I153 Q492 L494 A537 T563	A151-L532 HydrophobicContact CB-CD1 4.23Å; P152-L532 WeakPolarHBondContact O-CD1 3.38Å; I153-L532 PolarHBondContact O-N 2.87Å; Q492-L532 WeakPolarHBondContact O-CD2 3.23Å; L494-L532 HydrophobicContact CD1-CD1 4.05Å; L494-L532 HydrophobicContact CD1-CD2 4.19Å; L494-L532 HydrophobicContact CD2-CD1 4.19Å; L494-L532 HydrophobicContact CD2-CD2 4.44Å; L494-L532 HydrophobicContact CD2-CG 4.46Å; L494-L532 HydrophobicContact CG-CD1 4.21Å; L494-L532 HydrophobicContact CG-CD2 3.88Å; L494-L532 HydrophobicContact CG-CG 4.39Å; L532-A537 HydrophobicContact CD1-CB 4.1Å; L532-T563 HydrophobicContact CB-CG2 4.27Å; L532-T563 HydrophobicContact CD1-CG2 4.24Å
533	E	90	Very high	95.3	Very high	164 Å²	164	44.3 Å²	44.3	77%	0.766	23%	0.233	S	C	*	.	P	Polyproline II helix	trans	-71	149.9	166.2	-64.2	-171.4	163.4	0	0	110.2	G535	E533-G535 PolarHBondContact O-N 3.06Å
534	P	90.4	Very high	95.6	Very high	122 Å²	122	44.3 Å²	44.3	79%	0.792	23%	0.232	S	C	*	.	S	Bend	trans	-56.5	134	171.7	-22.5	33.2	0	0	0	111.3
535	G	93.8	Very high	95.8	Very high	38 Å²	38	44.5 Å²	44.5	39%	0.392	23%	0.233	S	C	.	.	S	Bend	trans	142.8	-125.7	-178	0	0	0	0	0	110.7	E533 T563	E533-G535 PolarHBondContact O-N 3.06Å; G535-T563 PolarHBondContact N-OG1 3.43Å; G535-T563 PolarHBondContact O-N 2.97Å; G535-T563 PolarHBondContact O-OG1 3.16Å; G535-T563 VanDerWaalsContact O-OG1 3.11Å
536	N	96.7	Very high	95.9	Very high	32 Å²	32	42.7 Å²	42.7	17%	0.171	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	143.5	-178.6	-64.7	-30.3	0	0	0	111.8	D119 Y538 S560 L561 A562	D119-N536 PolarHBondContact OD1-ND2 3.43Å; D119-N536 PolarHBondContact OD2-ND2 3.16Å; N536-Y538 HydrophobicContact CB-CE1 4Å; N536-Y538 HydrophobicContact CB-CE2 4.03Å; N536-Y538 WeakPolarHBondContact O-CE2 3.38Å; N536-S560 WeakPolarHBondContact CB-OG 3.18Å; N536-L561 CarbonylContact C-O 3.56Å; N536-L561 WeakPolarHBondContact CA-O 3.18Å; N536-A562 WeakPolarHBondContact OD1-CA 3.4Å
537	A	97.4	Very high	95.9	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	129.1	167.3	0	0	0	0	0	109.4	A151 L494 L532 F539 S560 L561	A151-A537 HydrophobicContact CB-CB 3.64Å; L494-A537 HydrophobicContact CD1-CB 3.84Å; L532-A537 HydrophobicContact CD1-CB 4.1Å; A537-F539 HydrophobicContact CB-CE2 4.38Å; A537-S560 CarbonylContact O-C 3.57Å; A537-S560 WeakPolarHBondContact O-CA 3.33Å; A537-L561 PolarHBondContact N-O 2.89Å; A537-L561 PolarHBondContact O-N 3.46Å
538	Y	98.3	Very high	95.8	Very high	40 Å²	40	39.8 Å²	39.8	16%	0.157	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	143.1	-173.5	-55.4	-83.2	0	0	0	111.2	F205 P218 A490 S491 N536 L559 S560	F205-Y538 HydrophobicContact CB-CD1 3.93Å; F205-Y538 HydrophobicContact CB-CE1 3.75Å; F205-Y538 HydrophobicContact CD1-CD1 4.37Å; F205-Y538 HydrophobicContact CD1-CE1 4.03Å; F205-Y538 AromaticContact CD2-CD1 3.56Å; F205-Y538 HydrophobicContact CD2-CD1 3.56Å; F205-Y538 HydrophobicContact CD2-CE1 4.04Å; F205-Y538 HydrophobicContact CE2-CD1 4.15Å; F205-Y538 AromaticContact CG-CD1 3.7Å; F205-Y538 HydrophobicContact CG-CD1 3.7Å; F205-Y538 AromaticContact CG-CE1 3.67Å; F205-Y538 HydrophobicContact CG-CE1 3.67Å; P218-Y538 HydrophobicContact CB-CD1 4.33Å; P218-Y538 HydrophobicContact CB-CD2 3.61Å; P218-Y538 HydrophobicContact CB-CE1 4.32Å; P218-Y538 HydrophobicContact CB-CE2 3.62Å; P218-Y538 HydrophobicContact CB-CG 3.98Å; P218-Y538 HydrophobicContact CG-CG 4.5Å; A490-Y538 CarbonylContact C-O 3.48Å; A490-Y538 VanDerWaalsContact CA-O 3.26Å; A490-Y538 WeakPolarHBondContact CA-O 3.32Å; S491-Y538 PolarHBondContact N-O 3.33Å; S491-Y538 WeakPolarHBondContact OG-CB 3.46Å; S491-Y538 WeakPolarHBondContact OG-CD2 3.31Å; S491-Y538 PolarHBondContact OG-N 3.07Å; N536-Y538 HydrophobicContact CB-CE1 4Å; N536-Y538 HydrophobicContact CB-CE2 4.03Å; N536-Y538 WeakPolarHBondContact O-CE2 3.38Å; Y538-L559 CarbonylContact C-O 3.46Å; Y538-L559 WeakPolarHBondContact CA-O 3.41Å; Y538-S560 WeakPolarHBondContact CE1-OG 3.37Å
539	F	98.5	Very high	95.7	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.009	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	139.9	173.3	-57.6	-85.8	0	0	0	109.7	F165 L167 R489 A490 L494 I526 A537 N558 L559 L561	F165-F539 HydrophobicContact CE1-CZ 4.13Å; F165-F539 HydrophobicContact CZ-CE2 4.24Å; F165-F539 AromaticContact CZ-CZ 3.7Å; F165-F539 HydrophobicContact CZ-CZ 3.7Å; L167-F539 HydrophobicContact CD1-CB 4.08Å; L167-F539 HydrophobicContact CD1-CD1 3.95Å; L167-F539 HydrophobicContact CD1-CG 3.97Å; R489-F539 CarbonylContact O-C 3.6Å; R489-F539 VanDerWaalsContact O-CA 3.31Å; R489-F539 WeakPolarHBondContact O-CA 3.17Å; A490-F539 HydrophobicContact CB-CD1 3.82Å; A490-F539 HydrophobicContact CB-CE1 3.82Å; L494-F539 HydrophobicContact CD1-CE1 4.16Å; L494-F539 HydrophobicContact CD1-CZ 3.7Å; I526-F539 HydrophobicContact CD1-CD1 4.02Å; I526-F539 HydrophobicContact CD1-CE1 3.25Å; I526-F539 HydrophobicContact CD1-CZ 3.64Å; I526-F539 HydrophobicContact CG1-CE1 4.09Å; I526-F539 HydrophobicContact CG2-CE1 4.28Å; A537-F539 HydrophobicContact CB-CE2 4.38Å; F539-N558 WeakPolarHBondContact O-CA 3.42Å; F539-L559 HydrophobicContact CB-CB 4.35Å; F539-L559 PolarHBondContact N-O 3.43Å; F539-L559 PolarHBondContact O-N 3.37Å; F539-L561 HydrophobicContact CD2-CD1 4.2Å; F539-L561 HydrophobicContact CD2-CG 4.36Å; F539-L561 HydrophobicContact CE2-CD1 3.64Å; F539-L561 HydrophobicContact CE2-CG 4.1Å
540	Q	98.7	Very high	95.7	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	112.9	173.2	179.9	177.9	86.8	0	0	109.5	Y201 F219 R489 I556 H557 N558	Y201-Q540 PolarHBondContact O-NE2 3.33Å; F219-Q540 HydrophobicContact CE1-CB 3.89Å; F219-Q540 HydrophobicContact CE2-CB 4.38Å; F219-Q540 HydrophobicContact CZ-CB 3.56Å; R489-Q540 HydrophobicContact CB-CB 4.42Å; R489-Q540 PolarHBondContact N-O 2.71Å; R489-Q540 PolarHBondContact O-N 3.28Å; Q540-I556 HydrophobicContact CG-CG2 3.87Å; Q540-H557 CarbonylContact C-O 3.53Å; Q540-H557 WeakPolarHBondContact CA-O 3.43Å; Q540-N558 WeakPolarHBondContact CG-OD1 3.46Å; Q540-N558 PolarHBondContact NE2-OD1 3.09Å
541	V	98.6	Very high	95.7	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	122.4	170.7	-175	0	0	0	0	107.4	V144 I169 M486 V488 V543 I556 H557	V144-V541 HydrophobicContact CG2-CG2 4.07Å; I169-V541 HydrophobicContact CD1-CG1 4.36Å; I169-V541 HydrophobicContact CD1-CG2 3.75Å; I169-V541 HydrophobicContact CG1-CG2 4.33Å; I169-V541 HydrophobicContact CG2-CG1 3.91Å; I169-V541 HydrophobicContact CG2-CG2 4.36Å; M486-V541 HydrophobicContact CG-CG1 3.87Å; M486-V541 HydrophobicContact SD-CG1 3.77Å; V488-V541 HydrophobicContact CG1-CG2 4.49Å; V488-V541 HydrophobicContact CG2-CG2 4.35Å; V541-V543 HydrophobicContact CG1-CG2 4.28Å; V541-I556 WeakPolarHBondContact O-CA 3.42Å; V541-H557 HydrophobicContact CB-CB 4.27Å; V541-H557 PolarHBondContact N-O 3.03Å; V541-H557 PolarHBondContact O-N 3.02Å
542	A	98.5	Very high	95.9	Very high	4 Å²	4	27.9 Å²	27.9	3%	0.033	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	122.7	174.6	0	0	0	0	0	109.4	Y201 M486 R487 R555 I556	Y201-A542 HydrophobicContact CD2-CB 3.89Å; Y201-A542 HydrophobicContact CE2-CB 3.48Å; Y201-A542 VanDerWaalsContact CE2-CB 3.48Å; M486-A542 CarbonylContact C-O 3.39Å; M486-A542 WeakPolarHBondContact CA-O 3.3Å; R487-A542 PolarHBondContact N-O 2.83Å; R487-A542 PolarHBondContact O-N 3.02Å; A542-R555 WeakPolarHBondContact CA-O 3.3Å; A542-I556 HydrophobicContact CB-CD1 3.66Å
543	V	98.4	Very high	96	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	111.1	176.8	-172.8	0	0	0	0	108.4	P171 I481 A484 I485 M486 L516 V541 F545 L554 R555	P171-V543 HydrophobicContact CB-CG2 3.86Å; P171-V543 HydrophobicContact CG-CG2 3.89Å; I481-V543 HydrophobicContact CD1-CG1 3.82Å; A484-V543 HydrophobicContact CB-CG1 4.31Å; I485-V543 WeakPolarHBondContact O-CA 3.23Å; M486-V543 HydrophobicContact CB-CG2 4.13Å; M486-V543 HydrophobicContact CG-CG2 3.96Å; M486-V543 HydrophobicContact SD-CG2 4.45Å; L516-V543 HydrophobicContact CD2-CG1 4.4Å; V541-V543 HydrophobicContact CG1-CG2 4.28Å; V543-F545 HydrophobicContact CG1-CD1 4.28Å; V543-F545 WeakPolarHBondContact O-CD1 3.24Å; V543-L554 CarbonylContact O-C 3.47Å; V543-L554 VanDerWaalsContact O-CA 3.31Å; V543-L554 WeakPolarHBondContact O-CA 3.41Å; V543-R555 HydrophobicContact CB-CB 4.43Å; V543-R555 PolarHBondContact N-O 2.83Å; V543-R555 PolarHBondContact O-N 2.83Å
544	L	98.1	Very high	96.4	Very high	12 Å²	12	19.7 Å²	19.7	6%	0.063	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	125.1	170.5	177.4	68.4	0	0	0	108.4	A258 Y262 A484 I485 R552 R553 L554	A258-L544 HydrophobicContact CB-CD1 4.19Å; Y262-L544 HydrophobicContact CD1-CD1 3.96Å; Y262-L544 HydrophobicContact CD1-CD2 4.13Å; Y262-L544 HydrophobicContact CG-CD1 4.19Å; A484-L544 CarbonylContact C-O 3.59Å; A484-L544 WeakPolarHBondContact CA-O 3.33Å; I485-L544 PolarHBondContact N-O 3.43Å; I485-L544 PolarHBondContact O-N 2.85Å; L544-R552 HydrophobicContact CD1-CG 4.07Å; L544-R553 WeakPolarHBondContact CA-O 3.47Å; L544-L554 HydrophobicContact CB-CD2 3.64Å; L544-L554 HydrophobicContact CD1-CD1 4.49Å; L544-L554 HydrophobicContact CD1-CD2 3.62Å; L544-L554 HydrophobicContact CD1-CG 3.69Å; L544-L554 HydrophobicContact CG-CD2 4.19Å
545	F	97.4	Very high	96.7	Very high	3 Å²	3	15.3 Å²	15.3	1%	0.013	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	169.6	-174.7	67.9	-87.1	0	0	0	112.7	E255 I481 A484 V543 R552 R553 R555	E255-F545 WeakPolarHBondContact OE1-CZ 3.22Å; I481-F545 HydrophobicContact CB-CB 3.95Å; I481-F545 HydrophobicContact CB-CD2 3.47Å; I481-F545 VanDerWaalsContact CB-CD2 3.47Å; I481-F545 HydrophobicContact CB-CE2 4.15Å; I481-F545 HydrophobicContact CB-CG 3.85Å; I481-F545 HydrophobicContact CD1-CB 3.6Å; I481-F545 HydrophobicContact CD1-CD1 3.93Å; I481-F545 HydrophobicContact CD1-CD2 4.12Å; I481-F545 HydrophobicContact CD1-CG 3.62Å; I481-F545 HydrophobicContact CG1-CB 4.11Å; I481-F545 HydrophobicContact CG1-CD2 4.35Å; I481-F545 HydrophobicContact CG1-CG 4.25Å; I481-F545 HydrophobicContact CG2-CD2 3.32Å; I481-F545 HydrophobicContact CG2-CE2 3.45Å; I481-F545 VanDerWaalsContact CG2-CE2 3.45Å; I481-F545 HydrophobicContact CG2-CG 3.99Å; I481-F545 HydrophobicContact CG2-CZ 4.2Å; A484-F545 HydrophobicContact CB-CB 4.02Å; V543-F545 HydrophobicContact CG1-CD1 4.28Å; V543-F545 WeakPolarHBondContact O-CD1 3.24Å; F545-R552 WeakPolarHBondContact O-CA 3.35Å; F545-R552 WeakPolarHBondContact O-CD 3.31Å; F545-R553 HydrophobicContact CD1-CB 4.39Å; F545-R553 HydrophobicContact CE1-CB 3.74Å; F545-R553 HydrophobicContact CE2-CB 3.9Å; F545-R553 HydrophobicContact CZ-CB 3.49Å; F545-R553 VanDerWaalsContact CZ-CB 3.49Å; F545-R553 HydrophobicContact CZ-CG 4.39Å; F545-R553 PolarHBondContact N-O 2.92Å; F545-R553 PolarHBondContact O-N 3.21Å; F545-R555 HydrophobicContact CD1-CB 4.49Å; F545-R555 HydrophobicContact CE1-CB 3.78Å
546	T	96.4	Very high	97	Very high	1 Å²	1	13.5 Å²	13.5	1%	0.006	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	122.2	169	-59.7	0	0	0	0	108.8	P269 F482 E551 R552	P269-T546 HydrophobicContact CB-CG2 3.66Å; P269-T546 HydrophobicContact CG-CG2 3.86Å; F482-T546 PolarHBondContact N-O 2.91Å; F482-T546 PolarHBondContact O-N 3.12Å; T546-E551 WeakPolarHBondContact CA-O 3.45Å; T546-R552 PolarHBondContact OG1-NH1 2.84Å
547	S	95.1	Very high	97.1	Very high	4 Å²	4	12 Å²	12	3%	0.028	6%	0.064	C	C	.	.			trans	-70.5	168.7	179	71.4	0	0	0	0	111.8	S549 G550 E551	S547-S549 PolarHBondContact O-N 2.95Å; S547-S549 PolarHBondContact OG-N 2.8Å; S547-S549 PolarHBondContact OG-OG 3.48Å; S547-G550 PolarHBondContact O-N 2.8Å; S547-G550 PolarHBondContact OG-N 3.24Å; S547-E551 PolarHBondContact N-O 2.8Å; S547-E551 PolarHBondContact OG-N 2.8Å; S547-E551 PolarHBondContact OG-O 2.86Å
548	V	94.6	Very high	97.1	Very high	14 Å²	14	12 Å²	12	9%	0.085	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-19.6	173.4	-60.8	0	0	0	0	113.2	P272 P305 E307 I314 I480 F482	P272-V548 WeakPolarHBondContact CD-O 3.34Å; P305-V548 HydrophobicContact CB-CG1 4.02Å; E307-V548 HydrophobicContact CB-CG2 4.03Å; I314-V548 HydrophobicContact CD1-CB 4.1Å; I314-V548 HydrophobicContact CD1-CG1 3.97Å; I314-V548 HydrophobicContact CG1-CB 4.2Å; I480-V548 HydrophobicContact CG2-CG1 4.13Å; I480-V548 VanDerWaalsContact O-CG1 3.3Å; I480-V548 WeakPolarHBondContact O-CG1 3.45Å; F482-V548 HydrophobicContact CE2-CG1 4.23Å
549	S	93.1	Very high	97.2	Very high	49 Å²	49	10.4 Å²	10.4	34%	0.343	6%	0.058	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-1.8	173.4	59.3	0	0	0	0	113.9	E307 S547	E307-S549 VanDerWaalsContact OE2-CB 3.23Å; E307-S549 WeakPolarHBondContact OE2-CB 3.46Å; E307-S549 PolarHBondContact OE2-OG 3.33Å; S547-S549 PolarHBondContact O-N 2.95Å; S547-S549 PolarHBondContact OG-N 2.8Å; S547-S549 PolarHBondContact OG-OG 3.48Å
550	G	93.4	Very high	97.1	Very high	12 Å²	12	10.3 Å²	10.3	12%	0.124	6%	0.057	C	C	.	.	S	Bend	trans	82.3	17.7	-177.9	0	0	0	0	0	114.2	P269 S547	P269-G550 VanDerWaalsContact O-O 3.11Å; S547-G550 PolarHBondContact O-N 2.8Å; S547-G550 PolarHBondContact OG-N 3.24Å
551	E	94.2	Very high	97.1	Very high	60 Å²	60	10.3 Å²	10.3	28%	0.28	6%	0.057	S	C	.	.			trans	-90.8	135.6	175.4	-169.7	176.7	-163.3	0	0	110.8	V257 T546 S547 R553	V257-E551 WeakPolarHBondContact CG1-OE1 3.46Å; V257-E551 WeakPolarHBondContact CG2-OE1 3.38Å; T546-E551 WeakPolarHBondContact CA-O 3.45Å; S547-E551 PolarHBondContact N-O 2.8Å; S547-E551 PolarHBondContact OG-N 2.8Å; S547-E551 PolarHBondContact OG-O 2.86Å; E551-R553 HydrophobicContact CB-CG 4.43Å; E551-R553 HydrophobicContact CG-CG 4.06Å; E551-R553 IonicContact OE2-CZ 3.58Å; E551-R553 IonicContact OE2-NE 2.7Å; E551-R553 PolarHBondContact OE2-NE 2.97Å; E551-R553 IonicContact OE2-NH2 3.73Å; E551-R553 PolarHBondContact OE2-NH2 2.99Å
552	R	97.1	Very high	97.1	Very high	7 Å²	7	11 Å²	11	3%	0.026	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	121.5	172	-162.8	73.7	176.7	156.1	-1.3	109.4	A258 Y262 W268 P269 D483 L544 F545 T546	A258-R552 HydrophobicContact CB-CB 4.17Å; A258-R552 HydrophobicContact CB-CG 3.92Å; A258-R552 WeakPolarHBondContact CB-O 3.38Å; A258-R552 PolarHBondContact N-O 3.14Å; Y262-R552 PolarHBondContact O-NE 2.79Å; W268-R552 HydrophobicContact CZ3-CB 4.38Å; P269-R552 HydrophobicContact CG-CB 4.06Å; D483-R552 PolarHBondContact O-NH1 3.22Å; D483-R552 PolarHBondContact O-NH2 2.96Å; D483-R552 IonicContact OD2-NH1 2.96Å; L544-R552 HydrophobicContact CD1-CG 4.07Å; F545-R552 WeakPolarHBondContact O-CA 3.35Å; F545-R552 WeakPolarHBondContact O-CD 3.31Å; T546-R552 PolarHBondContact OG1-NH1 2.84Å
553	R	96.9	Very high	97	Very high	12 Å²	12	11.8 Å²	11.8	5%	0.045	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	159.8	-176.1	-68.1	-165.5	-175.6	161.5	11.3	113.1	E255 Y256 E307 L544 F545 E551	E255-R553 VanDerWaalsContact OE2-CD 3.23Å; E255-R553 WeakPolarHBondContact OE2-CD 3.47Å; E255-R553 IonicContact OE2-CZ 2.8Å; E255-R553 IonicContact OE2-NE 3.6Å; E255-R553 IonicContact OE2-NH1 2.79Å; E255-R553 PolarHBondContact OE2-NH1 2.81Å; Y256-R553 CarbonylContact O-C 3.3Å; Y256-R553 VanDerWaalsContact O-CA 3.3Å; Y256-R553 WeakPolarHBondContact O-CA 3.45Å; E307-R553 IonicContact OE1-CZ 3.67Å; E307-R553 IonicContact OE1-NH1 3.37Å; E307-R553 PolarHBondContact OE1-NH1 2.85Å; E307-R553 IonicContact OE1-NH2 3.92Å; E307-R553 PolarHBondContact OE1-NH2 2.91Å; E307-R553 IonicContact OE2-NH2 3.64Å; L544-R553 WeakPolarHBondContact CA-O 3.47Å; F545-R553 HydrophobicContact CD1-CB 4.39Å; F545-R553 HydrophobicContact CE1-CB 3.74Å; F545-R553 HydrophobicContact CE2-CB 3.9Å; F545-R553 HydrophobicContact CZ-CB 3.49Å; F545-R553 VanDerWaalsContact CZ-CB 3.49Å; F545-R553 HydrophobicContact CZ-CG 4.39Å; F545-R553 PolarHBondContact N-O 2.92Å; F545-R553 PolarHBondContact O-N 3.21Å; E551-R553 HydrophobicContact CB-CG 4.43Å; E551-R553 HydrophobicContact CG-CG 4.06Å; E551-R553 IonicContact OE2-CZ 3.58Å; E551-R553 IonicContact OE2-NE 2.7Å; E551-R553 PolarHBondContact OE2-NE 2.97Å; E551-R553 IonicContact OE2-NH2 3.73Å; E551-R553 PolarHBondContact OE2-NH2 2.99Å
554	L	98.1	Very high	96.9	Very high	1 Å²	1	11.8 Å²	11.8	1%	0.005	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	109.1	175.6	-80.8	162.4	0	0	0	109.2	P192 Y201 E255 Y256 A258 Y262 V543 L544 I556	P192-L554 HydrophobicContact CG-CD1 3.92Å; Y201-L554 HydrophobicContact CE1-CD1 3.79Å; Y201-L554 WeakPolarHBondContact OH-CD2 3.47Å; E255-L554 CarbonylContact C-O 3.54Å; E255-L554 WeakPolarHBondContact CA-O 3.24Å; Y256-L554 PolarHBondContact N-O 3.45Å; Y256-L554 PolarHBondContact O-N 3.01Å; A258-L554 HydrophobicContact CB-CD1 4.28Å; A258-L554 HydrophobicContact CB-CG 4.36Å; Y262-L554 HydrophobicContact CD1-CD1 4.16Å; Y262-L554 HydrophobicContact CE1-CD1 3.89Å; Y262-L554 HydrophobicContact CE2-CD1 4.37Å; V543-L554 CarbonylContact O-C 3.47Å; V543-L554 VanDerWaalsContact O-CA 3.31Å; V543-L554 WeakPolarHBondContact O-CA 3.41Å; L544-L554 HydrophobicContact CB-CD2 3.64Å; L544-L554 HydrophobicContact CD1-CD1 4.49Å; L544-L554 HydrophobicContact CD1-CD2 3.62Å; L544-L554 HydrophobicContact CD1-CG 3.69Å; L544-L554 HydrophobicContact CG-CD2 4.19Å; L554-I556 HydrophobicContact CB-CD1 4.45Å
555	R	98.4	Very high	96.6	Very high	30 Å²	30	16.1 Å²	16.1	11%	0.113	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	126.8	171.8	180	173.6	-66	-159.5	-1.5	109.8	P171 M172 L182 E255 A542 V543 F545 H557	P171-R555 VanDerWaalsContact O-CD 3.3Å; P171-R555 WeakPolarHBondContact O-CD 3.34Å; P171-R555 PolarHBondContact O-NH1 3.3Å; M172-R555 PolarHBondContact SD-NH1 3.4Å; L182-R555 HydrophobicContact CD1-CG 4.05Å; E255-R555 HydrophobicContact CG-CB 4.15Å; E255-R555 HydrophobicContact CG-CG 4.33Å; E255-R555 IonicContact OE1-CZ 2.7Å; E255-R555 IonicContact OE1-NE 3.36Å; E255-R555 PolarHBondContact OE1-NE 2.98Å; E255-R555 IonicContact OE1-NH2 2.7Å; E255-R555 PolarHBondContact OE1-NH2 3.33Å; A542-R555 WeakPolarHBondContact CA-O 3.3Å; V543-R555 HydrophobicContact CB-CB 4.43Å; V543-R555 PolarHBondContact N-O 2.83Å; V543-R555 PolarHBondContact O-N 2.83Å; F545-R555 HydrophobicContact CD1-CB 4.49Å; F545-R555 HydrophobicContact CE1-CB 3.78Å; R555-H557 WeakPolarHBondContact CD-NE2 3.34Å; R555-H557 WeakPolarHBondContact CG-NE2 3.47Å
556	I	98.7	Very high	96.5	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	131.4	-177.1	-50	-58.7	0	0	0	108.9	Y201 S253 Y254 Y256 Q540 V541 A542 L554	Y201-I556 HydrophobicContact CD1-CD1 4.31Å; Y201-I556 HydrophobicContact CD2-CD1 3.52Å; Y201-I556 HydrophobicContact CE2-CD1 3.9Å; Y201-I556 HydrophobicContact CG-CD1 3.76Å; Y201-I556 HydrophobicContact CG-CG1 4.44Å; S253-I556 VanDerWaalsContact CA-O 3.29Å; S253-I556 WeakPolarHBondContact CA-O 3.26Å; Y254-I556 HydrophobicContact CD2-CB 4.22Å; Y254-I556 HydrophobicContact CD2-CG1 4.35Å; Y254-I556 HydrophobicContact CE2-CB 3.77Å; Y254-I556 HydrophobicContact CE2-CG1 3.89Å; Y254-I556 HydrophobicContact CE2-CG2 4.14Å; Y254-I556 PolarHBondContact N-O 2.84Å; Y254-I556 PolarHBondContact O-N 3.17Å; Y256-I556 HydrophobicContact CD2-CG1 4.2Å; Y256-I556 HydrophobicContact CE2-CG1 4.46Å; Q540-I556 HydrophobicContact CG-CG2 3.87Å; V541-I556 WeakPolarHBondContact O-CA 3.42Å; A542-I556 HydrophobicContact CB-CD1 3.66Å; L554-I556 HydrophobicContact CB-CD1 4.45Å
557	H	98.7	Very high	96.5	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.005	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	124.9	169.1	-55.4	-67.9	0	0	0	109.4	C139 F143 V144 G252 S253 Q540 V541 R555	C139-H557 HydrophobicContact CB-CB 3.94Å; F143-H557 AromaticContact CD1-CE1 3.79Å; F143-H557 AromaticContact CD2-CE1 3.45Å; F143-H557 VanDerWaalsContact CD2-CE1 3.45Å; F143-H557 WeakPolarHBondContact CD2-CE1 3.27Å; F143-H557 AromaticContact CD2-ND1 3.59Å; F143-H557 AromaticContact CE2-CE1 3.97Å; F143-H557 AromaticContact CG-CE1 3.36Å; F143-H557 WeakPolarHBondContact CG-CE1 3.33Å; F143-H557 AromaticContact CG-ND1 3.75Å; F143-H557 AromaticContact CG-NE2 3.97Å; V144-H557 HydrophobicContact CG2-CB 3.91Å; G252-H557 CarbonylContact O-C 3.56Å; G252-H557 WeakPolarHBondContact O-CA 3.47Å; S253-H557 WeakPolarHBondContact CB-ND1 3.32Å; S253-H557 PolarHBondContact OG-ND1 3.14Å; Q540-H557 CarbonylContact C-O 3.53Å; Q540-H557 WeakPolarHBondContact CA-O 3.43Å; V541-H557 HydrophobicContact CB-CB 4.27Å; V541-H557 PolarHBondContact N-O 3.03Å; V541-H557 PolarHBondContact O-N 3.02Å; R555-H557 WeakPolarHBondContact CD-NE2 3.34Å; R555-H557 WeakPolarHBondContact CG-NE2 3.47Å
558	N	98.7	Very high	96.5	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	134.8	-179.1	-52.4	-79.6	0	0	0	109.9	C139 C203 F205 G252 Y254 F539 Q540	C139-N558 WeakPolarHBondContact CB-O 3.29Å; C139-N558 PolarHBondContact N-O 3.16Å; C139-N558 PolarHBondContact SG-O 3.45Å; C203-N558 HydrophobicContact CB-CB 4.43Å; C203-N558 VanDerWaalsContact CB-OD1 3.22Å; C203-N558 WeakPolarHBondContact CB-OD1 3.25Å; F205-N558 HydrophobicContact CD2-CB 4.31Å; F205-N558 HydrophobicContact CE2-CB 3.72Å; G252-N558 PolarHBondContact O-N 3.32Å; G252-N558 PolarHBondContact O-ND2 3.42Å; Y254-N558 VanDerWaalsContact CE1-ND2 3.3Å; Y254-N558 WeakPolarHBondContact CE1-ND2 3.31Å; Y254-N558 PolarHBondContact OH-ND2 3.38Å; F539-N558 WeakPolarHBondContact O-CA 3.42Å; Q540-N558 WeakPolarHBondContact CG-OD1 3.46Å; Q540-N558 PolarHBondContact NE2-OD1 3.09Å
559	L	98.6	Very high	96.5	Very high	5 Å²	5	21.6 Å²	21.6	3%	0.026	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	131.1	178.7	-178.5	70.6	0	0	0	109.3	A121 N138 V144 A146 L167 Y538 F539 L561	A121-L559 HydrophobicContact CB-CD1 3.56Å; N138-L559 WeakPolarHBondContact OD1-CA 3.34Å; V144-L559 HydrophobicContact CG1-CD2 4.06Å; A146-L559 HydrophobicContact CB-CD2 4.21Å; L167-L559 HydrophobicContact CD2-CD2 3.93Å; Y538-L559 CarbonylContact C-O 3.46Å; Y538-L559 WeakPolarHBondContact CA-O 3.41Å; F539-L559 HydrophobicContact CB-CB 4.35Å; F539-L559 PolarHBondContact N-O 3.43Å; F539-L559 PolarHBondContact O-N 3.37Å; L559-L561 HydrophobicContact CD1-CD2 4.08Å; L559-L561 HydrophobicContact CD2-CD1 4.44Å; L559-L561 HydrophobicContact CD2-CD2 3.97Å; L559-L561 HydrophobicContact CD2-CG 4.28Å; L559-L561 HydrophobicContact CG-CD2 3.86Å; L559-L561 HydrophobicContact CG-CG 4.24Å
560	S	98.4	Very high	96.6	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	126.9	176.4	174.8	0	0	0	0	108.6	D119 H120 A121 N138 F205 N536 A537 Y538	D119-S560 WeakPolarHBondContact O-CB 3.24Å; D119-S560 PolarHBondContact O-OG 3.41Å; H120-S560 CarbonylContact C-O 3.51Å; H120-S560 WeakPolarHBondContact CA-O 3.37Å; A121-S560 WeakPolarHBondContact CB-O 3.35Å; A121-S560 PolarHBondContact N-O 3.28Å; N138-S560 PolarHBondContact OD1-N 3.43Å; F205-S560 VanDerWaalsContact CZ-CB 3.48Å; N536-S560 WeakPolarHBondContact CB-OG 3.18Å; A537-S560 CarbonylContact O-C 3.57Å; A537-S560 WeakPolarHBondContact O-CA 3.33Å; Y538-S560 WeakPolarHBondContact CE1-OG 3.37Å
561	L	98.2	Very high	96.8	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	129.6	-178.8	-57.1	-177.2	0	0	0	109.2	A121 A146 L148 Y149 A151 F165 N536 A537 F539 L559	A121-L561 HydrophobicContact CB-CD2 4.25Å; A146-L561 HydrophobicContact CB-CD1 3.83Å; A146-L561 HydrophobicContact CB-CD2 4.33Å; L148-L561 WeakPolarHBondContact O-CD1 3.42Å; Y149-L561 HydrophobicContact CD1-CD2 3.98Å; Y149-L561 HydrophobicContact CE1-CD2 4.44Å; A151-L561 HydrophobicContact CB-CB 4.28Å; F165-L561 HydrophobicContact CE2-CD1 4.18Å; F165-L561 HydrophobicContact CZ-CD1 4.38Å; N536-L561 CarbonylContact C-O 3.56Å; N536-L561 WeakPolarHBondContact CA-O 3.18Å; A537-L561 PolarHBondContact N-O 2.89Å; A537-L561 PolarHBondContact O-N 3.46Å; F539-L561 HydrophobicContact CD2-CD1 4.2Å; F539-L561 HydrophobicContact CD2-CG 4.36Å; F539-L561 HydrophobicContact CE2-CD1 3.64Å; F539-L561 HydrophobicContact CE2-CG 4.1Å; L559-L561 HydrophobicContact CD1-CD2 4.08Å; L559-L561 HydrophobicContact CD2-CD1 4.44Å; L559-L561 HydrophobicContact CD2-CD2 3.97Å; L559-L561 HydrophobicContact CD2-CG 4.28Å; L559-L561 HydrophobicContact CG-CD2 3.86Å; L559-L561 HydrophobicContact CG-CG 4.24Å
562	A	97.3	Very high	96.9	Very high	17 Å²	17	23.5 Å²	23.5	14%	0.14	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	143.3	175.4	0	0	0	0	0	110.6	H120 N150 A151 N536	H120-A562 HydrophobicContact CB-CB 4.35Å; N150-A562 CarbonylContact C-O 3.58Å; N150-A562 WeakPolarHBondContact CA-O 3.34Å; A151-A562 PolarHBondContact N-O 3.31Å; N536-A562 WeakPolarHBondContact OD1-CA 3.4Å
563	T	96.8	Very high	96.8	Very high	20 Å²	20	23.4 Å²	23.4	12%	0.123	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	135.7	173.6	56	0	0	0	0	110.9	A151 I153 L532 G535 P565	A151-T563 CarbonylContact O-C 3.18Å; A151-T563 WeakPolarHBondContact O-CA 3.24Å; I153-T563 HydrophobicContact CG2-CG2 4.47Å; L532-T563 HydrophobicContact CB-CG2 4.27Å; L532-T563 HydrophobicContact CD1-CG2 4.24Å; G535-T563 PolarHBondContact N-OG1 3.43Å; G535-T563 PolarHBondContact O-N 2.97Å; G535-T563 PolarHBondContact O-OG1 3.16Å; G535-T563 VanDerWaalsContact O-OG1 3.11Å; T563-P565 WeakPolarHBondContact O-CD 3.4Å
564	A	95.9	Very high	96.8	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.121	C	C	.	.	P	Polyproline II helix	trans	-72.2	120.4	-179.7	0	0	0	0	0	111.3	N150 A151 F157 L570	N150-A564 HydrophobicContact CB-CB 3.8Å; A151-A564 PolarHBondContact O-N 2.99Å; F157-A564 HydrophobicContact CE1-CB 3.94Å; A564-L570 HydrophobicContact CB-CB 4.24Å; A564-L570 HydrophobicContact CB-CD1 3.88Å
565	P	93.2	Very high	96.6	Very high	103 Å²	103	23.3 Å²	23.3	67%	0.669	12%	0.123	S	C	*	.	S	Bend	trans	-75	-27.6	178.4	29.7	-36	0	0	0	113.1	T563 A569	T563-P565 WeakPolarHBondContact O-CD 3.4Å; P565-A569 HydrophobicContact CG-CB 4.06Å
566	D	94.6	Very high	96.4	Very high	74 Å²	74	22.2 Å²	22.2	40%	0.396	12%	0.119	S	C	.	.	S	Bend	trans	-153.3	172.9	-177.4	63.7	30.6	0	0	0	111.9	A568 A569 L570	D566-A568 VanDerWaalsContact C-N 3.26Å; D566-A568 PolarHBondContact O-N 2.73Å; D566-A568 WeakPolarHBondContact OD1-CA 3.45Å; D566-A568 WeakPolarHBondContact OD1-CB 3.48Å; D566-A568 PolarHBondContact OD1-N 2.89Å; D566-A569 WeakPolarHBondContact OD1-CB 3.24Å; D566-A569 PolarHBondContact OD1-N 2.88Å; D566-L570 PolarHBondContact O-N 3.14Å
567	F	95.9	Very high	95.9	Very high	30 Å²	30	23.8 Å²	23.8	13%	0.132	13%	0.126	C	C	.	.	H	α-helix	trans	-61.4	-35.2	177.3	-75.4	-79.5	0	0	0	111.8	F157 Q160 A569 L570 Y571 T603 K607	F157-F567 HydrophobicContact CD2-CD1 4.29Å; F157-F567 HydrophobicContact CD2-CD2 4.4Å; F157-F567 AromaticContact CD2-CE1 3.76Å; F157-F567 HydrophobicContact CD2-CE1 3.76Å; F157-F567 AromaticContact CD2-CE2 3.88Å; F157-F567 HydrophobicContact CD2-CE2 3.88Å; F157-F567 AromaticContact CD2-CZ 3.54Å; F157-F567 HydrophobicContact CD2-CZ 3.54Å; F157-F567 HydrophobicContact CE2-CB 4.49Å; F157-F567 AromaticContact CE2-CD1 3.61Å; F157-F567 HydrophobicContact CE2-CD1 3.61Å; F157-F567 AromaticContact CE2-CD2 3.64Å; F157-F567 HydrophobicContact CE2-CD2 3.64Å; F157-F567 AromaticContact CE2-CE1 3.57Å; F157-F567 HydrophobicContact CE2-CE1 3.57Å; F157-F567 AromaticContact CE2-CE2 3.58Å; F157-F567 HydrophobicContact CE2-CE2 3.58Å; F157-F567 AromaticContact CE2-CG 3.65Å; F157-F567 HydrophobicContact CE2-CG 3.65Å; F157-F567 AromaticContact CE2-CZ 3.55Å; F157-F567 HydrophobicContact CE2-CZ 3.55Å; F157-F567 HydrophobicContact CZ-CD1 4.21Å; F157-F567 HydrophobicContact CZ-CE1 4.47Å; F157-F567 HydrophobicContact CZ-CG 4.27Å; Q160-F567 HydrophobicContact CB-CE1 4.08Å; Q160-F567 HydrophobicContact CB-CZ 3.86Å; F567-A569 PolarHBondContact O-N 2.88Å; F567-L570 WeakPolarHBondContact O-CB 3.34Å; F567-L570 PolarHBondContact O-N 3.14Å; F567-Y571 HydrophobicContact CB-CD2 4.31Å; F567-Y571 HydrophobicContact CB-CE2 4.31Å; F567-Y571 HydrophobicContact CD1-CE2 4.16Å; F567-Y571 WeakPolarHBondContact O-CD2 3.27Å; F567-Y571 PolarHBondContact O-N 3.14Å; F567-T603 HydrophobicContact CD1-CG2 4.27Å; F567-T603 HydrophobicContact CE1-CG2 4.1Å; F567-K607 HydrophobicContact CB-CB 4.06Å; F567-K607 HydrophobicContact CD2-CB 3.96Å; F567-K607 HydrophobicContact CD2-CD 4.15Å; F567-K607 HydrophobicContact CD2-CG 3.87Å; F567-K607 HydrophobicContact CE2-CD 4.11Å; F567-K607 HydrophobicContact CE2-CG 4.08Å; F567-K607 HydrophobicContact CG-CB 4.02Å; F567-K607 HydrophobicContact CG-CG 4.16Å
568	A	95.4	Very high	95.5	Very high	25 Å²	25	23.8 Å²	23.8	21%	0.207	13%	0.126	C	C	.	.	H	α-helix	trans	-65.4	-41.7	-175.6	0	0	0	0	0	111.7	D566 R572	D566-A568 VanDerWaalsContact C-N 3.26Å; D566-A568 PolarHBondContact O-N 2.73Å; D566-A568 WeakPolarHBondContact OD1-CA 3.45Å; D566-A568 WeakPolarHBondContact OD1-CB 3.48Å; D566-A568 PolarHBondContact OD1-N 2.89Å; A568-R572 WeakPolarHBondContact O-CB 3.38Å; A568-R572 WeakPolarHBondContact O-CG 3.37Å; A568-R572 PolarHBondContact O-N 3.27Å
569	A	95.1	Very high	95.2	Very high	8 Å²	8	23.8 Å²	23.8	7%	0.066	13%	0.126	C	C	.	.	H	α-helix	trans	-64.3	-40.2	172.9	0	0	0	0	0	112	P565 D566 F567 R572 S573	P565-A569 HydrophobicContact CG-CB 4.06Å; D566-A569 WeakPolarHBondContact OD1-CB 3.24Å; D566-A569 PolarHBondContact OD1-N 2.88Å; F567-A569 PolarHBondContact O-N 2.88Å; A569-R572 PolarHBondContact O-N 3.02Å; A569-S573 WeakPolarHBondContact O-CB 3.35Å; A569-S573 PolarHBondContact O-N 2.93Å; A569-S573 VanDerWaalsContact O-N 3.09Å; A569-S573 PolarHBondContact O-OG 3.41Å
570	L	95.8	Very high	94.6	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-60.8	-48.2	176.7	-165.6	71.4	0	0	0	111.9	L148 N150 P152 F157 L163 A564 D566 F567 S573	L148-L570 HydrophobicContact CD1-CD1 3.91Å; L148-L570 HydrophobicContact CD1-CG 4.48Å; L148-L570 HydrophobicContact CD2-CD1 4.34Å; L148-L570 HydrophobicContact CD2-CG 4.39Å; N150-L570 WeakPolarHBondContact O-CD1 3.36Å; P152-L570 HydrophobicContact CB-CD1 4.26Å; P152-L570 HydrophobicContact CG-CD1 4.3Å; F157-L570 HydrophobicContact CE1-CB 4.46Å; F157-L570 HydrophobicContact CE1-CD1 4.33Å; F157-L570 HydrophobicContact CE1-CD2 3.9Å; F157-L570 HydrophobicContact CE1-CG 4.48Å; F157-L570 HydrophobicContact CZ-CB 4.33Å; F157-L570 HydrophobicContact CZ-CD2 4.06Å; L163-L570 HydrophobicContact CD1-CD2 3.98Å; L163-L570 HydrophobicContact CD1-CG 4.01Å; A564-L570 HydrophobicContact CB-CB 4.24Å; A564-L570 HydrophobicContact CB-CD1 3.88Å; D566-L570 PolarHBondContact O-N 3.14Å; F567-L570 WeakPolarHBondContact O-CB 3.34Å; F567-L570 PolarHBondContact O-N 3.14Å; L570-S573 PolarHBondContact O-N 2.94Å; L570-S573 PolarHBondContact O-OG 3.17Å; L570-S573 VanDerWaalsContact O-OG 3.1Å
571	Y	96.4	Very high	93.7	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.008	13%	0.132	C	C	.	.	H	α-helix	trans	-70.7	-31.9	179.5	-78.5	-77.3	0	0	0	113.4	S161 L163 F567 A574 T600 T603 Y604 P620 A622 M623	S161-Y571 PolarHBondContact O-OH 3.37Å; S161-Y571 VanDerWaalsContact O-OH 3.09Å; L163-Y571 HydrophobicContact CD1-CD1 4.04Å; L163-Y571 HydrophobicContact CD1-CE1 3.92Å; L163-Y571 HydrophobicContact CD2-CD1 4.49Å; L163-Y571 HydrophobicContact CD2-CE1 4.08Å; L163-Y571 HydrophobicContact CG-CE1 4.2Å; F567-Y571 HydrophobicContact CB-CD2 4.31Å; F567-Y571 HydrophobicContact CB-CE2 4.31Å; F567-Y571 HydrophobicContact CD1-CE2 4.16Å; F567-Y571 WeakPolarHBondContact O-CD2 3.27Å; F567-Y571 PolarHBondContact O-N 3.14Å; Y571-A574 WeakPolarHBondContact O-CB 3.38Å; Y571-T600 HydrophobicContact CE1-CG2 3.76Å; Y571-T600 PolarHBondContact OH-O 3Å; Y571-T603 WeakPolarHBondContact OH-CB 3.36Å; Y571-Y604 AromaticContact CD1-CD2 3.93Å; Y571-Y604 HydrophobicContact CD1-CD2 3.93Å; Y571-Y604 HydrophobicContact CD1-CG 4.41Å; Y571-Y604 AromaticContact CD2-CD2 3.62Å; Y571-Y604 HydrophobicContact CD2-CD2 3.62Å; Y571-Y604 HydrophobicContact CD2-CE2 4.47Å; Y571-Y604 HydrophobicContact CD2-CG 4.49Å; Y571-Y604 HydrophobicContact CE1-CD2 4.39Å; Y571-Y604 HydrophobicContact CE2-CD2 4.15Å; Y571-Y604 AromaticContact CG-CD2 3.53Å; Y571-Y604 HydrophobicContact CG-CD2 3.53Å; Y571-Y604 HydrophobicContact CG-CE2 4.22Å; Y571-Y604 HydrophobicContact CG-CG 4.4Å; Y571-Y604 PolarHBondContact OH-N 3.28Å; Y571-P620 HydrophobicContact CD1-CB 4.43Å; Y571-P620 HydrophobicContact CD1-CG 4.17Å; Y571-A622 WeakPolarHBondContact O-CB 3.5Å; Y571-M623 HydrophobicContact CD1-SD 3.9Å; Y571-M623 HydrophobicContact CE1-SD 4.23Å
572	R	95.8	Very high	93	Very high	158 Å²	158	25 Å²	25	60%	0.596	13%	0.133	S	C	*	.	H	α-helix	trans	-69.5	-36.2	176.1	-77.1	-170.6	-58.6	-95	-1.6	112.6	Q123 A568 A569 A574	Q123-R572 PolarHBondContact NE2-O 3.35Å; Q123-R572 PolarHBondContact OE1-O 3.49Å; A568-R572 WeakPolarHBondContact O-CB 3.38Å; A568-R572 WeakPolarHBondContact O-CG 3.37Å; A568-R572 PolarHBondContact O-N 3.27Å; A569-R572 PolarHBondContact O-N 3.02Å; R572-A574 VanDerWaalsContact C-N 3.26Å; R572-A574 PolarHBondContact O-N 3.46Å
573	S	95.7	Very high	92.2	Very high	6 Å²	6	24.6 Å²	24.6	4%	0.042	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	6.4	-178.5	61.5	0	0	0	0	114.2	Y149 N150 A569 L570	Y149-S573 PolarHBondContact N-O 3.44Å; N150-S573 WeakPolarHBondContact CB-OG 3.4Å; N150-S573 PolarHBondContact N-OG 3.14Å; N150-S573 VanDerWaalsContact OD1-CB 3.26Å; N150-S573 WeakPolarHBondContact OD1-CB 3.14Å; A569-S573 WeakPolarHBondContact O-CB 3.35Å; A569-S573 PolarHBondContact O-N 2.93Å; A569-S573 VanDerWaalsContact O-N 3.09Å; A569-S573 PolarHBondContact O-OG 3.41Å; L570-S573 PolarHBondContact O-N 2.94Å; L570-S573 PolarHBondContact O-OG 3.17Å; L570-S573 VanDerWaalsContact O-OG 3.1Å
574	A	96.4	Very high	91.1	Very high	2 Å²	2	24 Å²	24	2%	0.017	13%	0.125	C	C	.	.	B	Isolated β-bridge	trans	-69.3	132.6	178.1	0	0	0	0	0	111.8	Q123 T147 L148 Y571 R572 M579 A622 M623	Q123-A574 PolarHBondContact NE2-O 3.33Å; T147-A574 WeakPolarHBondContact O-CA 3.47Å; L148-A574 HydrophobicContact CD2-CB 4.15Å; Y571-A574 WeakPolarHBondContact O-CB 3.38Å; R572-A574 VanDerWaalsContact C-N 3.26Å; R572-A574 PolarHBondContact O-N 3.46Å; A574-M579 HydrophobicContact CB-CE 3.47Å; A574-M579 VanDerWaalsContact CB-CE 3.47Å; A574-A622 HydrophobicContact CB-CB 4.24Å; A574-M623 HydrophobicContact CB-CG 3.97Å; A574-M623 HydrophobicContact CB-SD 4.21Å
575	D	94.9	Very high	89.8	Confident	8 Å²	8	24.9 Å²	24.9	4%	0.043	13%	0.129	C	C	.	.			trans	-103.8	96.8	166.2	-178.4	-15.8	0	0	0	108.7	R145 T147 Y149 F577 T578 M579	R145-D575 IonicContact NH1-OD2 3.19Å; R145-D575 PolarHBondContact NH1-OD2 3.16Å; T147-D575 PolarHBondContact O-N 3.09Å; Y149-D575 HydrophobicContact CE2-CB 4.35Å; D575-F577 VanDerWaalsContact C-N 3.32Å; D575-F577 PolarHBondContact O-N 3.49Å; D575-F577 PolarHBondContact OD1-N 3.37Å; D575-F577 VanDerWaalsContact OD1-N 3.09Å; D575-T578 PolarHBondContact O-N 3.47Å; D575-T578 PolarHBondContact OD1-N 3.4Å; D575-T578 VanDerWaalsContact OD1-N 3.14Å; D575-T578 PolarHBondContact OD2-OG1 2.95Å; D575-M579 VanDerWaalsContact O-CG 3.32Å; D575-M579 WeakPolarHBondContact O-CG 3.27Å; D575-M579 PolarHBondContact O-N 3.38Å
576	L	93.1	Very high	88.3	Confident	7 Å²	7	20.5 Å²	20.5	4%	0.037	10%	0.101	C	C	.	.	H	α-helix	trans	-59.7	-39.9	-178.2	175.6	63.1	0	0	0	112.6	T578 M579 I580 A622 L625 L626 F629	L576-T578 VanDerWaalsContact C-N 3.31Å; L576-T578 PolarHBondContact O-N 2.99Å; L576-M579 WeakPolarHBondContact O-CB 3.48Å; L576-M579 PolarHBondContact O-N 2.96Å; L576-M579 VanDerWaalsContact O-N 3.16Å; L576-I580 HydrophobicContact CD1-CD1 4.2Å; L576-I580 HydrophobicContact CD1-CG1 4.13Å; L576-I580 HydrophobicContact CG-CG1 4.45Å; L576-I580 WeakPolarHBondContact O-CG1 3.47Å; L576-I580 PolarHBondContact O-N 3.5Å; L576-A622 WeakPolarHBondContact CB-O 3.08Å; L576-L625 HydrophobicContact CD2-CB 3.7Å; L576-L626 HydrophobicContact CD1-CB 3.92Å; L576-L626 HydrophobicContact CD1-CD1 3.65Å; L576-L626 HydrophobicContact CD1-CG 4.41Å; L576-L626 HydrophobicContact CD2-CB 4.4Å; L576-F629 HydrophobicContact CD1-CD2 4.32Å; L576-F629 HydrophobicContact CD2-CD2 3.62Å; L576-F629 HydrophobicContact CD2-CE2 3.68Å; L576-F629 HydrophobicContact CG-CD2 3.76Å; L576-F629 HydrophobicContact CG-CE2 3.9Å
577	F	89.4	Confident	86.8	Confident	33 Å²	33	24 Å²	24	15%	0.145	11%	0.113	C	C	.	.	H	α-helix	trans	-64.5	-41.8	-177.6	-75.3	-107.3	0	0	0	110.4	L99 L126 C127 T128 D575 I580 F629	L99-F577 HydrophobicContact CD1-CZ 4.09Å; L126-F577 HydrophobicContact CD1-CE2 3.95Å; L126-F577 HydrophobicContact CD1-CZ 4.37Å; L126-F577 HydrophobicContact CD2-CD2 3.76Å; L126-F577 HydrophobicContact CD2-CE2 3.75Å; L126-F577 HydrophobicContact CG-CE2 4.32Å; C127-F577 WeakPolarHBondContact SG-CD1 3.13Å; T128-F577 HydrophobicContact CG2-CE1 3.98Å; T128-F577 HydrophobicContact CG2-CZ 4.47Å; D575-F577 VanDerWaalsContact C-N 3.32Å; D575-F577 PolarHBondContact O-N 3.49Å; D575-F577 PolarHBondContact OD1-N 3.37Å; D575-F577 VanDerWaalsContact OD1-N 3.09Å; F577-I580 PolarHBondContact O-N 2.77Å; F577-F629 HydrophobicContact CD1-CE2 4.49Å; F577-F629 HydrophobicContact CD1-CZ 4.32Å; F577-F629 HydrophobicContact CD2-CE2 4.31Å; F577-F629 HydrophobicContact CE1-CE2 4.37Å; F577-F629 AromaticContact CE1-CZ 3.84Å; F577-F629 HydrophobicContact CE1-CZ 3.84Å; F577-F629 HydrophobicContact CE2-CE2 4.16Å; F577-F629 HydrophobicContact CE2-CZ 4.16Å; F577-F629 HydrophobicContact CG-CE2 4.48Å; F577-F629 HydrophobicContact CZ-CE2 4.21Å; F577-F629 AromaticContact CZ-CZ 3.75Å; F577-F629 HydrophobicContact CZ-CZ 3.75Å
578	T	90.8	Very high	85.2	Confident	1 Å²	1	24.8 Å²	24.8	1%	0.006	12%	0.118	C	C	.	.	H	α-helix	trans	-66.8	-37.4	173.9	-59.9	0	0	0	0	112	R145 T147 D575 L576 I580 N581	R145-T578 HydrophobicContact CB-CG2 3.88Å; R145-T578 WeakPolarHBondContact CB-OG1 3.45Å; R145-T578 WeakPolarHBondContact CD-OG1 3.27Å; T147-T578 HydrophobicContact CG2-CG2 4.07Å; D575-T578 PolarHBondContact O-N 3.47Å; D575-T578 PolarHBondContact OD1-N 3.4Å; D575-T578 VanDerWaalsContact OD1-N 3.14Å; D575-T578 PolarHBondContact OD2-OG1 2.95Å; L576-T578 VanDerWaalsContact C-N 3.31Å; L576-T578 PolarHBondContact O-N 2.99Å; T578-I580 PolarHBondContact O-N 2.97Å; T578-N581 WeakPolarHBondContact O-CB 3.46Å; T578-N581 PolarHBondContact O-N 2.8Å
579	M	90.7	Very high	83.8	Confident	1 Å²	1	24 Å²	24	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-62.3	-39.6	175.7	-73.2	-174.3	-170.3	0	0	113.2	T147 L148 L163 P164 A574 D575 L576 N581 I582 L583 M623	T147-M579 HydrophobicContact CG2-CB 4.42Å; T147-M579 HydrophobicContact CG2-CG 3.8Å; T147-M579 WeakPolarHBondContact O-CE 3.36Å; L148-M579 HydrophobicContact CD2-CE 3.33Å; L148-M579 HydrophobicContact CG-CE 4.02Å; L163-M579 HydrophobicContact CD2-CE 4.16Å; L163-M579 HydrophobicContact CD2-SD 4.21Å; P164-M579 HydrophobicContact CG-CB 4.09Å; P164-M579 HydrophobicContact CG-CG 3.89Å; P164-M579 HydrophobicContact CG-SD 4.15Å; A574-M579 HydrophobicContact CB-CE 3.47Å; A574-M579 VanDerWaalsContact CB-CE 3.47Å; D575-M579 VanDerWaalsContact O-CG 3.32Å; D575-M579 WeakPolarHBondContact O-CG 3.27Å; D575-M579 PolarHBondContact O-N 3.38Å; L576-M579 WeakPolarHBondContact O-CB 3.48Å; L576-M579 PolarHBondContact O-N 2.96Å; L576-M579 VanDerWaalsContact O-N 3.16Å; M579-N581 VanDerWaalsContact C-N 3.25Å; M579-N581 PolarHBondContact O-N 2.79Å; M579-I582 PolarHBondContact O-N 3.07Å; M579-I582 VanDerWaalsContact O-N 3.11Å; M579-L583 HydrophobicContact CB-CD1 4.47Å; M579-L583 WeakPolarHBondContact O-CG 3.38Å; M579-L583 PolarHBondContact O-N 3.07Å; M579-M623 HydrophobicContact SD-CE 3.71Å
580	I	87.3	Confident	82.1	Confident	13 Å²	13	28.4 Å²	28.4	7%	0.067	13%	0.126	C	C	.	.	H	α-helix	trans	-61.7	-34.5	180	-69.3	-56.3	0	0	0	111.6	L576 F577 T578 I582 L583 S584 L626 F629 I630 I633	L576-I580 HydrophobicContact CD1-CD1 4.2Å; L576-I580 HydrophobicContact CD1-CG1 4.13Å; L576-I580 HydrophobicContact CG-CG1 4.45Å; L576-I580 WeakPolarHBondContact O-CG1 3.47Å; L576-I580 PolarHBondContact O-N 3.5Å; F577-I580 PolarHBondContact O-N 2.77Å; T578-I580 PolarHBondContact O-N 2.97Å; I580-I582 VanDerWaalsContact C-N 3.29Å; I580-I582 PolarHBondContact O-N 3.09Å; I580-L583 HydrophobicContact CD1-CD1 4.38Å; I580-L583 PolarHBondContact O-N 3.05Å; I580-S584 WeakPolarHBondContact O-CB 3.36Å; I580-S584 PolarHBondContact O-N 3.32Å; I580-S584 PolarHBondContact O-OG 2.92Å; I580-S584 VanDerWaalsContact O-OG 3.11Å; I580-L626 HydrophobicContact CD1-CD1 4.39Å; I580-F629 HydrophobicContact CD1-CB 3.54Å; I580-F629 HydrophobicContact CD1-CD2 4.19Å; I580-F629 HydrophobicContact CD1-CG 4.33Å; I580-F629 HydrophobicContact CG1-CB 3.76Å; I580-F629 HydrophobicContact CG1-CD2 3.61Å; I580-F629 HydrophobicContact CG1-CG 4.03Å; I580-I630 HydrophobicContact CD1-CD1 4.34Å; I580-I633 HydrophobicContact CD1-CD1 4.16Å; I580-I633 HydrophobicContact CG2-CD1 4.09Å
581	N	79.5	Confident	80.3	Confident	15 Å²	15	35.3 Å²	35.3	8%	0.08	16%	0.163	C	C	.	.	H	α-helix	trans	-56	-45.1	173.5	-65.5	-1.5	0	0	0	111.5	S168 T578 M579 S584 H661	S168-N581 PolarHBondContact OG-ND2 2.92Å; T578-N581 WeakPolarHBondContact O-CB 3.46Å; T578-N581 PolarHBondContact O-N 2.8Å; M579-N581 VanDerWaalsContact C-N 3.25Å; M579-N581 PolarHBondContact O-N 2.79Å; N581-S584 PolarHBondContact O-OG 3.27Å; N581-H661 PolarHBondContact ND2-CE1 3.44Å
582	I	82.4	Confident	79.6	Confident	3 Å²	3	40 Å²	40	2%	0.015	19%	0.188	C	C	.	.	H	α-helix	trans	-73.9	-44	179.5	-70	159.3	0	0	0	111.5	T147 P164 F500 M579 I580 S584 N585	T147-I582 HydrophobicContact CG2-CD1 3.4Å; P164-I582 HydrophobicContact CB-CG2 4.16Å; F500-I582 HydrophobicContact CE2-CG2 4.42Å; M579-I582 PolarHBondContact O-N 3.07Å; M579-I582 VanDerWaalsContact O-N 3.11Å; I580-I582 VanDerWaalsContact C-N 3.29Å; I580-I582 PolarHBondContact O-N 3.09Å; I582-S584 VanDerWaalsContact C-N 3.3Å; I582-S584 PolarHBondContact O-N 3.22Å; I582-N585 WeakPolarHBondContact O-CB 3.33Å; I582-N585 PolarHBondContact O-N 3.43Å
583	L	81.4	Confident	79.1	Confident	7 Å²	7	32.6 Å²	32.6	4%	0.037	16%	0.16	C	C	.	.	H	α-helix	trans	-68.2	-27.1	-178.3	-68.1	173.6	0	0	0	113.4	P164 M579 I580 N585 L593 L626 I630	P164-L583 HydrophobicContact CB-CD2 4.45Å; P164-L583 HydrophobicContact CG-CD1 4.35Å; P164-L583 HydrophobicContact CG-CD2 4.06Å; P164-L583 HydrophobicContact CG-CG 4.08Å; M579-L583 HydrophobicContact CB-CD1 4.47Å; M579-L583 WeakPolarHBondContact O-CG 3.38Å; M579-L583 PolarHBondContact O-N 3.07Å; I580-L583 HydrophobicContact CD1-CD1 4.38Å; I580-L583 PolarHBondContact O-N 3.05Å; L583-N585 PolarHBondContact O-N 2.97Å; L583-N585 VanDerWaalsContact O-N 3.11Å; L583-L593 HydrophobicContact CB-CD2 4.09Å; L583-L593 HydrophobicContact CD2-CD2 4.03Å; L583-L626 HydrophobicContact CD1-CD1 4.44Å; L583-I630 HydrophobicContact CD1-CD1 4.4Å
584	S	72.9	Confident	78.8	Confident	7 Å²	7	34 Å²	34	5%	0.049	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	2.9	176.5	69.4	0	0	0	0	113.4	I580 N581 I582 F639 W662	I580-S584 WeakPolarHBondContact O-CB 3.36Å; I580-S584 PolarHBondContact O-N 3.32Å; I580-S584 PolarHBondContact O-OG 2.92Å; I580-S584 VanDerWaalsContact O-OG 3.11Å; N581-S584 PolarHBondContact O-OG 3.27Å; I582-S584 VanDerWaalsContact C-N 3.3Å; I582-S584 PolarHBondContact O-N 3.22Å; S584-F639 WeakPolarHBondContact O-CE1 3.45Å; S584-F639 WeakPolarHBondContact O-CZ 3.46Å; S584-W662 PolarHBondContact OG-NE1 2.71Å
585	N	69.1	Low	78.4	Confident	19 Å²	19	36.6 Å²	36.6	10%	0.102	19%	0.186	C	C	.	.	S	Bend	trans	-66.3	132.4	177.6	-161	-69.9	0	0	0	112.1	F500 I582 L583 K587 D588 V589	F500-N585 WeakPolarHBondContact CD1-ND2 3.45Å; F500-N585 HydrophobicContact CE1-CB 4.44Å; F500-N585 VanDerWaalsContact CE1-ND2 3.27Å; F500-N585 WeakPolarHBondContact CE1-ND2 3.39Å; F500-N585 VanDerWaalsContact CG-ND2 3.32Å; F500-N585 WeakPolarHBondContact CG-ND2 3.46Å; I582-N585 WeakPolarHBondContact O-CB 3.33Å; I582-N585 PolarHBondContact O-N 3.43Å; L583-N585 PolarHBondContact O-N 2.97Å; L583-N585 VanDerWaalsContact O-N 3.11Å; N585-K587 PolarHBondContact O-N 3.42Å; N585-K587 PolarHBondContact OD1-N 3.33Å; N585-D588 PolarHBondContact O-N 3.21Å; N585-V589 WeakPolarHBondContact O-CG2 3.23Å; N585-V589 PolarHBondContact O-N 2.88Å
586	P	61.1	Low	78.2	Confident	12 Å²	12	39 Å²	39	8%	0.078	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-15.7	-179.7	-28.6	33.9	0	0	0	117.1	F639	P586-F639 HydrophobicContact CB-CE1 4.43Å; P586-F639 HydrophobicContact CG-CE1 4.01Å
587	K	63.9	Low	78.2	Confident	147 Å²	147	39 Å²	39	64%	0.639	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-38.9	172.7	-71.4	-176.5	-178.8	176.1	0	111.9	D498 N585	D498-K587 IonicContact OD1-NZ 2.81Å; N585-K587 PolarHBondContact O-N 3.42Å; N585-K587 PolarHBondContact OD1-N 3.33Å
588	D	62.3	Low	78.4	Confident	47 Å²	47	37.4 Å²	37.4	25%	0.251	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-31.4	-172.1	-73.6	-2.6	0	0	0	112.8	N585 R590 N592 L593 R596	N585-D588 PolarHBondContact O-N 3.21Å; D588-R590 VanDerWaalsContact C-N 3.29Å; D588-R590 PolarHBondContact O-N 2.76Å; D588-N592 PolarHBondContact O-N 2.98Å; D588-L593 HydrophobicContact CB-CD2 4.09Å; D588-R596 IonicContact OD2-NH1 3.13Å; D588-R596 PolarHBondContact OD2-NH1 3.15Å
589	V	65.2	Low	78.5	Confident	8 Å²	8	40.6 Å²	40.6	5%	0.048	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-33.1	-170.2	178.1	0	0	0	0	113.4	N585 D591 L593 I633 F634 F639	N585-V589 WeakPolarHBondContact O-CG2 3.23Å; N585-V589 PolarHBondContact O-N 2.88Å; V589-D591 PolarHBondContact O-N 3.43Å; V589-L593 HydrophobicContact CB-CD1 4.11Å; V589-L593 HydrophobicContact CG1-CD1 4.33Å; V589-L593 HydrophobicContact CG2-CD1 3.71Å; V589-I633 HydrophobicContact CG1-CG2 3.98Å; V589-I633 HydrophobicContact CG2-CG2 3.9Å; V589-F634 HydrophobicContact CG1-CD1 4.33Å; V589-F634 HydrophobicContact CG1-CE1 4.31Å; V589-F634 WeakPolarHBondContact O-CE1 3.4Å; V589-F639 HydrophobicContact CB-CD1 3.78Å; V589-F639 HydrophobicContact CB-CE1 4.12Å; V589-F639 HydrophobicContact CB-CG 4.38Å; V589-F639 HydrophobicContact CG1-CB 3.84Å; V589-F639 HydrophobicContact CG1-CD1 3.57Å; V589-F639 HydrophobicContact CG1-CD2 4.46Å; V589-F639 HydrophobicContact CG1-CE1 4.3Å; V589-F639 HydrophobicContact CG1-CG 3.69Å; V589-F639 HydrophobicContact CG2-CD1 3.75Å; V589-F639 HydrophobicContact CG2-CE1 3.59Å; V589-F639 HydrophobicContact CG2-CG 4.36Å; V589-F639 HydrophobicContact CG2-CZ 4.1Å
590	R	59.7	Low	78.7	Confident	101 Å²	101	40.8 Å²	40.8	38%	0.381	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-34.6	-166.7	-92.4	-174.7	-87.3	-143.8	-15.1	115.5	D430 K433 D588	D430-R590 IonicContact OD1-NH1 3.69Å; K433-R590 VanDerWaalsContact CE-NH1 3.3Å; D588-R590 VanDerWaalsContact C-N 3.29Å; D588-R590 PolarHBondContact O-N 2.76Å
591	D	59.2	Low	79.1	Confident	144 Å²	144	40.2 Å²	40.2	77%	0.77	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-137.8	-10.2	-170.9	-63.7	-55.8	0	0	0	115.3	V589	V589-D591 PolarHBondContact O-N 3.43Å
592	N	80.4	Confident	79.8	Confident	101 Å²	101	39.6 Å²	39.6	54%	0.54	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-127.6	-12.3	-165.4	-70.8	-40.1	0	0	0	116.3	D588 T594 S595 R596	D588-N592 PolarHBondContact O-N 2.98Å; N592-T594 PolarHBondContact O-N 3.21Å; N592-S595 PolarHBondContact O-N 2.82Å; N592-R596 VanDerWaalsContact O-CB 3.27Å; N592-R596 WeakPolarHBondContact O-CB 3.37Å; N592-R596 PolarHBondContact O-N 3.48Å
593	L	86	Confident	80.4	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-65.5	-40.8	-172.3	-77.4	-173.6	0	0	0	114.3	L583 D588 V589 S597 I630 I633 F634	L583-L593 HydrophobicContact CB-CD2 4.09Å; L583-L593 HydrophobicContact CD2-CD2 4.03Å; D588-L593 HydrophobicContact CB-CD2 4.09Å; V589-L593 HydrophobicContact CB-CD1 4.11Å; V589-L593 HydrophobicContact CG1-CD1 4.33Å; V589-L593 HydrophobicContact CG2-CD1 3.71Å; L593-S597 WeakPolarHBondContact O-CB 3.45Å; L593-S597 PolarHBondContact O-N 2.83Å; L593-S597 PolarHBondContact O-OG 3.07Å; L593-I630 HydrophobicContact CB-CD1 4.44Å; L593-I630 HydrophobicContact CB-CG2 4.33Å; L593-I630 HydrophobicContact CD1-CD1 4.27Å; L593-I630 HydrophobicContact CD2-CD1 4.41Å; L593-I633 HydrophobicContact CD1-CG2 4.12Å; L593-F634 HydrophobicContact CB-CE1 4.42Å; L593-F634 HydrophobicContact CB-CZ 3.86Å
594	T	88.2	Confident	81	Confident	36 Å²	36	41.5 Å²	41.5	22%	0.221	21%	0.206	C	C	.	.	H	α-helix	trans	-63.3	-47.5	176.7	-55.8	0	0	0	0	111	N592 S597 A598 F634 F728 L731 I732	N592-T594 PolarHBondContact O-N 3.21Å; T594-S597 PolarHBondContact O-N 2.76Å; T594-A598 WeakPolarHBondContact O-CB 3.31Å; T594-A598 PolarHBondContact O-N 2.54Å; T594-F634 VanDerWaalsContact OG1-CE2 3.28Å; T594-F634 WeakPolarHBondContact OG1-CE2 3.15Å; T594-F634 WeakPolarHBondContact OG1-CZ 3.33Å; T594-F728 HydrophobicContact CG2-CE2 4.47Å; T594-F728 HydrophobicContact CG2-CZ 4.5Å; T594-L731 HydrophobicContact CG2-CD2 3.43Å; T594-L731 VanDerWaalsContact CG2-CD2 3.43Å; T594-I732 HydrophobicContact CG2-CD1 3.84Å
595	S	89.6	Confident	82	Confident	56 Å²	56	41.8 Å²	41.8	39%	0.392	21%	0.206	S	C	.	.	H	α-helix	trans	-64.1	-45.7	179.2	177.8	0	0	0	0	111.7	N592 S597 A598 Q599	N592-S595 PolarHBondContact O-N 2.82Å; S595-S597 VanDerWaalsContact C-N 3.34Å; S595-S597 PolarHBondContact O-N 3.32Å; S595-A598 PolarHBondContact O-N 3.46Å; S595-Q599 WeakPolarHBondContact O-CB 3.47Å; S595-Q599 PolarHBondContact O-N 3.22Å
596	R	90.4	Very high	83.2	Confident	60 Å²	60	45.3 Å²	45.3	23%	0.226	22%	0.222	C	C	.	.	H	α-helix	trans	-59.9	-44.7	175.9	-172.9	176.9	-175.3	167.9	6.2	111.4	A162 D588 N592 Q599 T600	A162-R596 HydrophobicContact CB-CG 4.44Å; A162-R596 PolarHBondContact O-NE 3.18Å; D588-R596 IonicContact OD2-NH1 3.13Å; D588-R596 PolarHBondContact OD2-NH1 3.15Å; N592-R596 VanDerWaalsContact O-CB 3.27Å; N592-R596 WeakPolarHBondContact O-CB 3.37Å; N592-R596 PolarHBondContact O-N 3.48Å; R596-Q599 WeakPolarHBondContact O-CB 3.4Å; R596-Q599 PolarHBondContact O-N 2.83Å; R596-T600 PolarHBondContact O-N 2.87Å; R596-T600 PolarHBondContact O-OG1 2.85Å; R596-T600 VanDerWaalsContact O-OG1 3.07Å
597	S	91.8	Very high	84.8	Confident	5 Å²	5	49.9 Å²	49.9	4%	0.035	24%	0.24	C	C	.	.	H	α-helix	trans	-65.3	-41.4	178.5	-61.5	0	0	0	0	111.9	L593 T594 S595 T600 L601 I630	L593-S597 WeakPolarHBondContact O-CB 3.45Å; L593-S597 PolarHBondContact O-N 2.83Å; L593-S597 PolarHBondContact O-OG 3.07Å; T594-S597 PolarHBondContact O-N 2.76Å; S595-S597 VanDerWaalsContact C-N 3.34Å; S595-S597 PolarHBondContact O-N 3.32Å; S597-T600 PolarHBondContact O-N 2.82Å; S597-L601 WeakPolarHBondContact O-CG 3.3Å; S597-L601 PolarHBondContact O-N 3.3Å; S597-L601 VanDerWaalsContact O-N 3.12Å; S597-I630 WeakPolarHBondContact OG-CG1 3.36Å
598	A	93.5	Very high	86.2	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.4	-43	172.5	0	0	0	0	0	111.7	T594 S595 L601 A602 E735 I736 L739	T594-A598 WeakPolarHBondContact O-CB 3.31Å; T594-A598 PolarHBondContact O-N 2.54Å; S595-A598 PolarHBondContact O-N 3.46Å; A598-L601 PolarHBondContact O-N 2.91Å; A598-A602 WeakPolarHBondContact O-CB 3.37Å; A598-A602 PolarHBondContact O-N 2.84Å; A598-E735 HydrophobicContact CB-CB 3.71Å; A598-E735 HydrophobicContact CB-CG 3.51Å; A598-I736 HydrophobicContact CB-CG1 4.23Å; A598-L739 HydrophobicContact CB-CD1 3.99Å
599	Q	94.2	Very high	87.6	Confident	69 Å²	69	43.5 Å²	43.5	32%	0.322	22%	0.217	S	C	.	.	H	α-helix	trans	-62	-45.5	176.5	-175.8	62.9	46.2	0	0	112	A162 S595 R596 L601 A602 T603 L739	A162-Q599 HydrophobicContact CB-CB 4.1Å; A162-Q599 HydrophobicContact CB-CG 3.77Å; S595-Q599 WeakPolarHBondContact O-CB 3.47Å; S595-Q599 PolarHBondContact O-N 3.22Å; R596-Q599 WeakPolarHBondContact O-CB 3.4Å; R596-Q599 PolarHBondContact O-N 2.83Å; Q599-L601 PolarHBondContact O-N 2.87Å; Q599-A602 PolarHBondContact O-N 2.85Å; Q599-T603 PolarHBondContact NE2-OG1 3.37Å; Q599-T603 WeakPolarHBondContact O-CB 3.44Å; Q599-T603 PolarHBondContact O-N 2.86Å; Q599-T603 PolarHBondContact O-OG1 2.88Å; Q599-T603 VanDerWaalsContact O-OG1 3.13Å; Q599-L739 HydrophobicContact CB-CD1 4.33Å
600	T	94.5	Very high	88.6	Confident	5 Å²	5	48 Å²	48	3%	0.031	25%	0.247	C	C	.	.	H	α-helix	trans	-56.3	-50.3	175.5	-64.5	0	0	0	0	111.3	S161 A162 L163 Y571 R596 S597 T603 Y604 M623 L626	S161-T600 PolarHBondContact O-OG1 3.43Å; A162-T600 WeakPolarHBondContact CB-OG1 3.2Å; A162-T600 PolarHBondContact O-OG1 3Å; L163-T600 HydrophobicContact CD2-CG2 3.45Å; L163-T600 VanDerWaalsContact CD2-CG2 3.45Å; L163-T600 HydrophobicContact CG-CG2 4.28Å; Y571-T600 HydrophobicContact CE1-CG2 3.76Å; Y571-T600 PolarHBondContact OH-O 3Å; R596-T600 PolarHBondContact O-N 2.87Å; R596-T600 PolarHBondContact O-OG1 2.85Å; R596-T600 VanDerWaalsContact O-OG1 3.07Å; S597-T600 PolarHBondContact O-N 2.82Å; T600-T603 PolarHBondContact O-N 3.23Å; T600-Y604 PolarHBondContact O-N 3Å; T600-M623 HydrophobicContact CG2-CE 4.03Å; T600-M623 HydrophobicContact CG2-SD 4.2Å; T600-L626 HydrophobicContact CG2-CD2 4.5Å
601	L	94.8	Very high	90	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-70.5	-34.5	-178.7	-64.5	175.5	0	0	0	112.5	S597 A598 Q599 Y604 R605 L619 P620 L626 P627 I732 I736	S597-L601 WeakPolarHBondContact O-CG 3.3Å; S597-L601 PolarHBondContact O-N 3.3Å; S597-L601 VanDerWaalsContact O-N 3.12Å; A598-L601 PolarHBondContact O-N 2.91Å; Q599-L601 PolarHBondContact O-N 2.87Å; L601-Y604 PolarHBondContact O-N 2.84Å; L601-R605 WeakPolarHBondContact O-CB 3.34Å; L601-R605 PolarHBondContact O-N 3.23Å; L601-L619 HydrophobicContact CD1-CD2 3.69Å; L601-L619 HydrophobicContact CD2-CD2 3.67Å; L601-L619 HydrophobicContact CG-CD2 4.24Å; L601-P620 HydrophobicContact CD2-CG 4.47Å; L601-L626 HydrophobicContact CD2-CD2 4.47Å; L601-L626 HydrophobicContact CG-CD2 4.39Å; L601-P627 HydrophobicContact CD1-CG 4.11Å; L601-I732 HydrophobicContact CD1-CG2 3.76Å; L601-I736 HydrophobicContact CB-CD1 3.55Å; L601-I736 HydrophobicContact CB-CG1 4.16Å; L601-I736 HydrophobicContact CD1-CD1 4.01Å; L601-I736 HydrophobicContact CG-CD1 4.46Å
602	A	94.4	Very high	91.3	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.008	24%	0.241	C	C	.	.	H	α-helix	trans	-64.2	-45.6	173.4	0	0	0	0	0	111.4	A598 Q599 R605 Q606 I736 L739 L740	A598-A602 WeakPolarHBondContact O-CB 3.37Å; A598-A602 PolarHBondContact O-N 2.84Å; Q599-A602 PolarHBondContact O-N 2.85Å; A602-R605 PolarHBondContact O-N 2.78Å; A602-Q606 WeakPolarHBondContact O-CG 3.19Å; A602-Q606 PolarHBondContact O-N 2.87Å; A602-I736 HydrophobicContact CB-CG2 4.15Å; A602-L739 HydrophobicContact CB-CB 4.14Å; A602-L739 HydrophobicContact CB-CD1 4.14Å; A602-L740 HydrophobicContact CB-CD2 4.15Å; A602-L740 HydrophobicContact CB-CG 4.49Å
603	T	95.1	Very high	91.6	Very high	5 Å²	5	41.9 Å²	41.9	3%	0.031	24%	0.239	C	C	.	.	H	α-helix	trans	-61.7	-45.9	175.8	-63.6	0	0	0	0	111.1	Q160 F567 Y571 Q599 T600 R605 Q606 K607	Q160-T603 WeakPolarHBondContact O-CB 3.35Å; Q160-T603 VanDerWaalsContact O-CG2 3.25Å; Q160-T603 WeakPolarHBondContact O-CG2 3.45Å; Q160-T603 PolarHBondContact O-OG1 3.1Å; F567-T603 HydrophobicContact CD1-CG2 4.27Å; F567-T603 HydrophobicContact CE1-CG2 4.1Å; Y571-T603 WeakPolarHBondContact OH-CB 3.36Å; Q599-T603 PolarHBondContact NE2-OG1 3.37Å; Q599-T603 WeakPolarHBondContact O-CB 3.44Å; Q599-T603 PolarHBondContact O-N 2.86Å; Q599-T603 PolarHBondContact O-OG1 2.88Å; Q599-T603 VanDerWaalsContact O-OG1 3.13Å; T600-T603 PolarHBondContact O-N 3.23Å; T603-R605 VanDerWaalsContact C-N 3.29Å; T603-R605 PolarHBondContact O-N 3.14Å; T603-Q606 PolarHBondContact O-N 3.35Å; T603-K607 HydrophobicContact CG2-CG 3.91Å; T603-K607 WeakPolarHBondContact O-CB 3.4Å; T603-K607 WeakPolarHBondContact O-CG 3.27Å; T603-K607 PolarHBondContact O-N 3.44Å
604	Y	95.4	Very high	91.4	Very high	45 Å²	45	47.5 Å²	47.5	18%	0.176	27%	0.268	C	S	.	.	H	α-helix	trans	-55.8	-46.5	175.9	177.2	-106.5	0	0	0	111.5	Y571 T600 L601 K607 C608 S609 V618 P620	Y571-Y604 AromaticContact CD1-CD2 3.93Å; Y571-Y604 HydrophobicContact CD1-CD2 3.93Å; Y571-Y604 HydrophobicContact CD1-CG 4.41Å; Y571-Y604 AromaticContact CD2-CD2 3.62Å; Y571-Y604 HydrophobicContact CD2-CD2 3.62Å; Y571-Y604 HydrophobicContact CD2-CE2 4.47Å; Y571-Y604 HydrophobicContact CD2-CG 4.49Å; Y571-Y604 HydrophobicContact CE1-CD2 4.39Å; Y571-Y604 HydrophobicContact CE2-CD2 4.15Å; Y571-Y604 AromaticContact CG-CD2 3.53Å; Y571-Y604 HydrophobicContact CG-CD2 3.53Å; Y571-Y604 HydrophobicContact CG-CE2 4.22Å; Y571-Y604 HydrophobicContact CG-CG 4.4Å; Y571-Y604 PolarHBondContact OH-N 3.28Å; T600-Y604 PolarHBondContact O-N 3Å; L601-Y604 PolarHBondContact O-N 2.84Å; Y604-K607 PolarHBondContact O-N 2.95Å; Y604-C608 HydrophobicContact CD2-CB 3.62Å; Y604-C608 HydrophobicContact CE2-CB 3.45Å; Y604-C608 VanDerWaalsContact CE2-CB 3.45Å; Y604-C608 HydrophobicContact CG-CB 4.36Å; Y604-C608 WeakPolarHBondContact O-CA 3.26Å; Y604-C608 VanDerWaalsContact O-CB 3.24Å; Y604-C608 WeakPolarHBondContact O-CB 3.41Å; Y604-C608 PolarHBondContact O-N 2.95Å; Y604-S609 PolarHBondContact O-N 3.42Å; Y604-V618 HydrophobicContact CD1-CG1 4.5Å; Y604-V618 HydrophobicContact CE1-CG1 3.99Å; Y604-P620 HydrophobicContact CD1-CB 4.14Å; Y604-P620 HydrophobicContact CD1-CG 4.23Å; Y604-P620 HydrophobicContact CD2-CB 3.88Å; Y604-P620 HydrophobicContact CD2-CG 4.31Å; Y604-P620 HydrophobicContact CE1-CB 3.89Å; Y604-P620 HydrophobicContact CE1-CG 4.42Å; Y604-P620 HydrophobicContact CE2-CB 3.64Å; Y604-P620 HydrophobicContact CG-CB 4.12Å; Y604-P620 HydrophobicContact CG-CG 4.16Å
605	R	93.8	Very high	91.2	Very high	14 Å²	14	49 Å²	49	5%	0.053	29%	0.29	C	S	.	.	H	α-helix	trans	-60.5	-47.9	177.3	173.9	167.8	170	144.7	33.8	112.5	L601 A602 T603 S609 S612 S613 Q616 L740	L601-R605 WeakPolarHBondContact O-CB 3.34Å; L601-R605 PolarHBondContact O-N 3.23Å; A602-R605 PolarHBondContact O-N 2.78Å; T603-R605 VanDerWaalsContact C-N 3.29Å; T603-R605 PolarHBondContact O-N 3.14Å; R605-S609 CarbonylContact O-C 3.54Å; R605-S609 PolarHBondContact O-N 2.65Å; R605-S609 VanDerWaalsContact O-O 3.13Å; R605-S612 PolarHBondContact NH2-O 3.49Å; R605-S613 PolarHBondContact NH2-O 2.8Å; R605-Q616 PolarHBondContact NH1-O 2.81Å; R605-L740 VanDerWaalsContact CD-CD1 3.49Å; R605-L740 HydrophobicContact CG-CD1 4.23Å
606	Q	93.5	Very high	91.1	Very high	93 Å²	93	51.3 Å²	51.3	44%	0.435	30%	0.295	S	S	.	.	H	α-helix	trans	-64.4	-41.7	179.9	-72.4	178.4	-11.4	0	0	112.9	A602 T603 L740	A602-Q606 WeakPolarHBondContact O-CG 3.19Å; A602-Q606 PolarHBondContact O-N 2.87Å; T603-Q606 PolarHBondContact O-N 3.35Å; Q606-L740 HydrophobicContact CG-CD2 3.31Å
607	K	94	Very high	91	Very high	108 Å²	108	50.1 Å²	50.1	47%	0.47	29%	0.293	S	S	.	.	H	α-helix	trans	-94.4	-30.6	-169	-60.4	-63.9	-174.8	179.2	0	113.8	F567 T603 Y604	F567-K607 HydrophobicContact CB-CB 4.06Å; F567-K607 HydrophobicContact CD2-CB 3.96Å; F567-K607 HydrophobicContact CD2-CD 4.15Å; F567-K607 HydrophobicContact CD2-CG 3.87Å; F567-K607 HydrophobicContact CE2-CD 4.11Å; F567-K607 HydrophobicContact CE2-CG 4.08Å; F567-K607 HydrophobicContact CG-CB 4.02Å; F567-K607 HydrophobicContact CG-CG 4.16Å; T603-K607 HydrophobicContact CG2-CG 3.91Å; T603-K607 WeakPolarHBondContact O-CB 3.4Å; T603-K607 WeakPolarHBondContact O-CG 3.27Å; T603-K607 PolarHBondContact O-N 3.44Å; Y604-K607 PolarHBondContact O-N 2.95Å
608	C	93.6	Very high	90.9	Very high	38 Å²	38	50.8 Å²	50.8	26%	0.257	30%	0.297	S	S	.	.	H	α-helix	trans	-115.2	-20.6	-172.5	-54.2	0	0	0	0	113.4	Y604	Y604-C608 HydrophobicContact CD2-CB 3.62Å; Y604-C608 HydrophobicContact CE2-CB 3.45Å; Y604-C608 VanDerWaalsContact CE2-CB 3.45Å; Y604-C608 HydrophobicContact CG-CB 4.36Å; Y604-C608 WeakPolarHBondContact O-CA 3.26Å; Y604-C608 VanDerWaalsContact O-CB 3.24Å; Y604-C608 WeakPolarHBondContact O-CB 3.41Å; Y604-C608 PolarHBondContact O-N 2.95Å
609	S	91.8	Very high	90.9	Very high	22 Å²	22	52.4 Å²	52.4	15%	0.154	31%	0.305	C	S	.	.			trans	-141.3	56.1	-178.7	-164.3	0	0	0	0	113.8	Y604 R605 S611 S612	Y604-S609 PolarHBondContact O-N 3.42Å; R605-S609 CarbonylContact O-C 3.54Å; R605-S609 PolarHBondContact O-N 2.65Å; R605-S609 VanDerWaalsContact O-O 3.13Å; S609-S611 VanDerWaalsContact C-N 3.27Å; S609-S611 PolarHBondContact O-N 3.03Å; S609-S612 PolarHBondContact O-N 2.6Å; S609-S612 PolarHBondContact OG-OG 3.01Å
610	P	87.3	Confident	90.8	Very high	103 Å²	103	49.3 Å²	49.3	67%	0.669	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-21.7	-172.8	27.7	-35.9	0	0	0	114.3	S612	P610-S612 VanDerWaalsContact C-N 3.33Å; P610-S612 PolarHBondContact O-N 2.94Å
611	S	89.3	Confident	90.7	Very high	118 Å²	118	55.5 Å²	55.5	83%	0.825	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-5.7	-177.3	52.5	0	0	0	0	114.5	S609	S609-S611 VanDerWaalsContact C-N 3.27Å; S609-S611 PolarHBondContact O-N 3.03Å
612	S	86.6	Confident	90.6	Very high	29 Å²	29	57 Å²	57	20%	0.203	33%	0.332	C	S	.	.	S	Bend	trans	-76.9	138.6	-175.5	-68.3	0	0	0	0	113.1	R605 S609 P610 V618	R605-S612 PolarHBondContact NH2-O 3.49Å; S609-S612 PolarHBondContact O-N 2.6Å; S609-S612 PolarHBondContact OG-OG 3.01Å; P610-S612 VanDerWaalsContact C-N 3.33Å; P610-S612 PolarHBondContact O-N 2.94Å; S612-V618 VanDerWaalsContact CB-CG2 3.49Å
613	S	86.3	Confident	90.5	Very high	70 Å²	70	57.1 Å²	57.1	49%	0.49	33%	0.332	S	S	.	.			trans	-60.4	142.3	-177.4	75.9	0	0	0	0	113.2	R605 G615 Q616	R605-S613 PolarHBondContact NH2-O 2.8Å; S613-G615 PolarHBondContact O-N 3.42Å; S613-G615 VanDerWaalsContact O-N 3.16Å; S613-Q616 PolarHBondContact O-N 3.27Å
614	L	82.1	Confident	90.3	Very high	120 Å²	120	58.5 Å²	58.5	63%	0.628	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-28.9	179.4	-71.2	174.3	0	0	0	113.7	Q616 H733	L614-Q616 VanDerWaalsContact C-N 3.27Å; L614-Q616 PolarHBondContact O-N 2.9Å; L614-H733 PolarHBondContact O-NE2 3.49Å
615	G	83.4	Confident	90.2	Very high	67 Å²	67	56.6 Å²	56.6	69%	0.691	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-15.5	176.2	0	0	0	0	0	114.6	S613 H733	S613-G615 PolarHBondContact O-N 3.42Å; S613-G615 VanDerWaalsContact O-N 3.16Å; G615-H733 PolarHBondContact O-CE1 2.81Å
616	Q	87.1	Confident	90.2	Very high	105 Å²	105	56 Å²	56	49%	0.491	33%	0.329	S	S	.	.	S	Bend	trans	-95.6	136.1	179.9	-170.9	174.2	-16.2	0	0	111	R605 S613 L614 V618	R605-Q616 PolarHBondContact NH1-O 2.81Å; S613-Q616 PolarHBondContact O-N 3.27Å; L614-Q616 VanDerWaalsContact C-N 3.27Å; L614-Q616 PolarHBondContact O-N 2.9Å; Q616-V618 HydrophobicContact CG-CG2 4.29Å
617	L	88.4	Confident	90.1	Very high	34 Å²	34	51.6 Å²	51.6	18%	0.178	31%	0.308	C	S	.	.			trans	-86.4	117.7	165.1	178.9	62	0	0	0	108	L619 L729 H733 I736	L617-L619 HydrophobicContact CD1-CD2 4.02Å; L617-L619 HydrophobicContact CD2-CD2 4.18Å; L617-L619 HydrophobicContact CG-CD2 3.88Å; L617-L619 HydrophobicContact CG-CG 4.2Å; L617-L729 HydrophobicContact CD2-CD2 3.94Å; L617-H733 HydrophobicContact CD1-CB 4.29Å; L617-I736 HydrophobicContact CD1-CD1 3.49Å; L617-I736 VanDerWaalsContact CD1-CD1 3.49Å
618	V	90.9	Very high	90	Very high	19 Å²	19	46.7 Å²	46.7	12%	0.115	29%	0.287	C	S	.	.			trans	-106.4	123	-179.6	-173	0	0	0	0	108.1	Y604 S612 Q616	Y604-V618 HydrophobicContact CD1-CG1 4.5Å; Y604-V618 HydrophobicContact CE1-CG1 3.99Å; S612-V618 VanDerWaalsContact CB-CG2 3.49Å; Q616-V618 HydrophobicContact CG-CG2 4.29Å
619	L	92.4	Very high	89.9	Confident	35 Å²	35	46.2 Å²	46.2	18%	0.183	28%	0.281	C	S	.	.			trans	-117.4	139.5	-179.4	-54.8	177.5	0	0	0	109.2	P97 L601 L617 K624	P97-L619 HydrophobicContact CG-CD1 4.02Å; L601-L619 HydrophobicContact CD1-CD2 3.69Å; L601-L619 HydrophobicContact CD2-CD2 3.67Å; L601-L619 HydrophobicContact CG-CD2 4.24Å; L617-L619 HydrophobicContact CD1-CD2 4.02Å; L617-L619 HydrophobicContact CD2-CD2 4.18Å; L617-L619 HydrophobicContact CG-CD2 3.88Å; L617-L619 HydrophobicContact CG-CG 4.2Å; L619-K624 HydrophobicContact CB-CB 4.2Å; L619-K624 HydrophobicContact CD1-CB 4.4Å
620	P	93.1	Very high	89.8	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.019	27%	0.273	C	S	.	.			trans	-67.2	140.9	169.5	28	-31.4	0	0	0	109.5	Y571 L601 Y604 A622 M623 K624	Y571-P620 HydrophobicContact CD1-CB 4.43Å; Y571-P620 HydrophobicContact CD1-CG 4.17Å; L601-P620 HydrophobicContact CD2-CG 4.47Å; Y604-P620 HydrophobicContact CD1-CB 4.14Å; Y604-P620 HydrophobicContact CD1-CG 4.23Å; Y604-P620 HydrophobicContact CD2-CB 3.88Å; Y604-P620 HydrophobicContact CD2-CG 4.31Å; Y604-P620 HydrophobicContact CE1-CB 3.89Å; Y604-P620 HydrophobicContact CE1-CG 4.42Å; Y604-P620 HydrophobicContact CE2-CB 3.64Å; Y604-P620 HydrophobicContact CG-CB 4.12Å; Y604-P620 HydrophobicContact CG-CG 4.16Å; P620-A622 VanDerWaalsContact C-N 3.3Å; P620-A622 PolarHBondContact O-N 2.94Å; P620-M623 HydrophobicContact CG-CB 3.81Å; P620-M623 HydrophobicContact CG-CG 3.96Å; P620-M623 HydrophobicContact CG-SD 4.13Å; P620-M623 CarbonylContact O-C 3.54Å; P620-M623 PolarHBondContact O-N 3.37Å; P620-K624 PolarHBondContact O-N 3.25Å
621	E	92.1	Very high	89.9	Confident	136 Å²	136	40.3 Å²	40.3	64%	0.636	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-53.9	-46.8	-177.2	-175	58.2	-156.5	0	0	112.3	M623 K624	E621-M623 PolarHBondContact O-N 3.18Å; E621-M623 VanDerWaalsContact O-N 3.14Å; E621-K624 WeakPolarHBondContact O-CG 3.31Å; E621-K624 PolarHBondContact O-N 2.76Å; E621-K624 WeakPolarHBondContact OE1-CE 3.36Å; E621-K624 IonicContact OE1-NZ 2.76Å; E621-K624 PolarHBondContact OE1-NZ 3.26Å; E621-K624 IonicContact OE2-NZ 2.96Å
622	A	92.6	Very high	89.8	Confident	32 Å²	32	36.2 Å²	36.2	26%	0.264	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-64.3	-16.8	178.9	0	0	0	0	0	114.4	Y571 A574 L576 P620	Y571-A622 WeakPolarHBondContact O-CB 3.5Å; A574-A622 HydrophobicContact CB-CB 4.24Å; L576-A622 WeakPolarHBondContact CB-O 3.08Å; P620-A622 VanDerWaalsContact C-N 3.3Å; P620-A622 PolarHBondContact O-N 2.94Å
623	M	91.2	Very high	89.6	Confident	3 Å²	3	35 Å²	35	2%	0.015	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-129	21.4	-179.4	-36.2	174.9	68	0	0	113.7	L163 Y571 A574 M579 T600 P620 E621 L625 L626	L163-M623 HydrophobicContact CD2-CE 3.39Å; L163-M623 HydrophobicContact CD2-SD 3.52Å; L163-M623 VanDerWaalsContact CD2-SD 3.52Å; Y571-M623 HydrophobicContact CD1-SD 3.9Å; Y571-M623 HydrophobicContact CE1-SD 4.23Å; A574-M623 HydrophobicContact CB-CG 3.97Å; A574-M623 HydrophobicContact CB-SD 4.21Å; M579-M623 HydrophobicContact SD-CE 3.71Å; T600-M623 HydrophobicContact CG2-CE 4.03Å; T600-M623 HydrophobicContact CG2-SD 4.2Å; P620-M623 HydrophobicContact CG-CB 3.81Å; P620-M623 HydrophobicContact CG-CG 3.96Å; P620-M623 HydrophobicContact CG-SD 4.13Å; P620-M623 CarbonylContact O-C 3.54Å; P620-M623 PolarHBondContact O-N 3.37Å; E621-M623 PolarHBondContact O-N 3.18Å; E621-M623 VanDerWaalsContact O-N 3.14Å; M623-L625 PolarHBondContact O-N 2.69Å; M623-L625 VanDerWaalsContact O-N 3.14Å; M623-L626 HydrophobicContact CB-CB 4.18Å; M623-L626 HydrophobicContact CE-CD1 4.45Å; M623-L626 HydrophobicContact CE-CD2 3.98Å; M623-L626 WeakPolarHBondContact O-CB 3.38Å; M623-L626 PolarHBondContact O-N 3.22Å
624	K	92.1	Very high	89.3	Confident	35 Å²	35	33.6 Å²	33.6	15%	0.152	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-21.7	-178.4	68	-174.7	-175.5	-175	0	113.7	P97 V102 L619 P620 E621	P97-K624 HydrophobicContact CB-CB 4.06Å; P97-K624 HydrophobicContact CB-CD 4.18Å; P97-K624 HydrophobicContact CB-CG 3.88Å; P97-K624 HydrophobicContact CG-CB 3.88Å; P97-K624 HydrophobicContact CG-CD 4.49Å; P97-K624 HydrophobicContact CG-CG 4.24Å; P97-K624 WeakPolarHBondContact CG-O 3.49Å; V102-K624 HydrophobicContact CG2-CD 4.33Å; V102-K624 HydrophobicContact CG2-CG 4.5Å; L619-K624 HydrophobicContact CB-CB 4.2Å; L619-K624 HydrophobicContact CD1-CB 4.4Å; P620-K624 PolarHBondContact O-N 3.25Å; E621-K624 WeakPolarHBondContact O-CG 3.31Å; E621-K624 PolarHBondContact O-N 2.76Å; E621-K624 WeakPolarHBondContact OE1-CE 3.36Å; E621-K624 IonicContact OE1-NZ 2.76Å; E621-K624 PolarHBondContact OE1-NZ 3.26Å; E621-K624 IonicContact OE2-NZ 2.96Å
625	L	92.9	Very high	89.3	Confident	4 Å²	4	28.8 Å²	28.8	2%	0.021	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	1.6	173.9	-58.8	173.1	0	0	0	113.8	P97 L99 V102 L576 M623 L628 F629	P97-L625 HydrophobicContact CB-CD2 3.93Å; L99-L625 HydrophobicContact CB-CD1 4.43Å; L99-L625 HydrophobicContact CB-CD2 4.36Å; L99-L625 HydrophobicContact CD1-CD1 3.62Å; V102-L625 HydrophobicContact CB-CD1 3.85Å; V102-L625 HydrophobicContact CG1-CD1 3.84Å; V102-L625 HydrophobicContact CG2-CD1 3.88Å; V102-L625 HydrophobicContact CG2-CD2 4.28Å; V102-L625 HydrophobicContact CG2-CG 4.12Å; L576-L625 HydrophobicContact CD2-CB 3.7Å; M623-L625 PolarHBondContact O-N 2.69Å; M623-L625 VanDerWaalsContact O-N 3.14Å; L625-L628 HydrophobicContact CD2-CD2 4.14Å; L625-L628 WeakPolarHBondContact O-CB 3.32Å; L625-L628 PolarHBondContact O-N 2.82Å; L625-L628 VanDerWaalsContact O-N 3.1Å; L625-F629 HydrophobicContact CB-CD2 4.39Å; L625-F629 HydrophobicContact CB-CE2 4.15Å; L625-F629 HydrophobicContact CB-CZ 4.39Å; L625-F629 HydrophobicContact CD1-CZ 4.26Å; L625-F629 PolarHBondContact O-N 2.92Å
626	L	93.1	Very high	89	Confident	2 Å²	2	27.2 Å²	27.2	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-55.2	-49.1	-178.8	174.3	72	0	0	0	112	L576 I580 L583 T600 L601 M623 L628 F629 I630	L576-L626 HydrophobicContact CD1-CB 3.92Å; L576-L626 HydrophobicContact CD1-CD1 3.65Å; L576-L626 HydrophobicContact CD1-CG 4.41Å; L576-L626 HydrophobicContact CD2-CB 4.4Å; I580-L626 HydrophobicContact CD1-CD1 4.39Å; L583-L626 HydrophobicContact CD1-CD1 4.44Å; T600-L626 HydrophobicContact CG2-CD2 4.5Å; L601-L626 HydrophobicContact CD2-CD2 4.47Å; L601-L626 HydrophobicContact CG-CD2 4.39Å; M623-L626 HydrophobicContact CB-CB 4.18Å; M623-L626 HydrophobicContact CE-CD1 4.45Å; M623-L626 HydrophobicContact CE-CD2 3.98Å; M623-L626 WeakPolarHBondContact O-CB 3.38Å; M623-L626 PolarHBondContact O-N 3.22Å; L626-L628 VanDerWaalsContact C-N 3.25Å; L626-L628 PolarHBondContact O-N 3.25Å; L626-F629 PolarHBondContact O-N 3.47Å; L626-I630 HydrophobicContact CD1-CD1 4.27Å; L626-I630 HydrophobicContact CD1-CG1 3.89Å; L626-I630 HydrophobicContact CG-CG1 4.28Å; L626-I630 VanDerWaalsContact O-CG1 3.23Å; L626-I630 WeakPolarHBondContact O-CG1 3.29Å; L626-I630 PolarHBondContact O-N 3.28Å
627	P	92.8	Very high	88.4	Confident	1 Å²	1	24 Å²	24	1%	0.006	13%	0.128	C	C	.	.	H	α-helix	trans	-62	-34.1	179.2	-22.3	34.9	0	0	0	112.9	L601 N631 Y725 F728 L729	L601-P627 HydrophobicContact CD1-CG 4.11Å; P627-N631 WeakPolarHBondContact O-CB 3.42Å; P627-N631 PolarHBondContact O-N 3.4Å; P627-N631 VanDerWaalsContact O-N 3.08Å; P627-Y725 HydrophobicContact CB-CE2 4.31Å; P627-F728 HydrophobicContact CB-CD1 4.24Å; P627-F728 HydrophobicContact CB-CE1 4.3Å; P627-F728 WeakPolarHBondContact O-CD1 3.49Å; P627-F728 WeakPolarHBondContact O-CE1 3.22Å; P627-L729 HydrophobicContact CB-CD2 3.6Å; P627-L729 HydrophobicContact CG-CD2 3.84Å
628	L	91.9	Very high	87.4	Confident	4 Å²	4	22.7 Å²	22.7	2%	0.021	12%	0.121	C	C	.	.	H	α-helix	trans	-63.3	-54.7	176.7	175	60.5	0	0	0	110.6	L99 L625 L626 I630 N631 C632 E716 Y725	L99-L628 HydrophobicContact CB-CD2 3.95Å; L625-L628 HydrophobicContact CD2-CD2 4.14Å; L625-L628 WeakPolarHBondContact O-CB 3.32Å; L625-L628 PolarHBondContact O-N 2.82Å; L625-L628 VanDerWaalsContact O-N 3.1Å; L626-L628 VanDerWaalsContact C-N 3.25Å; L626-L628 PolarHBondContact O-N 3.25Å; L628-I630 VanDerWaalsContact C-N 3.31Å; L628-I630 PolarHBondContact O-N 2.86Å; L628-N631 WeakPolarHBondContact O-CB 3.22Å; L628-N631 PolarHBondContact O-N 3Å; L628-N631 VanDerWaalsContact O-N 3.1Å; L628-C632 PolarHBondContact O-N 3.05Å; L628-C632 PolarHBondContact O-SG 2.9Å; L628-E716 HydrophobicContact CD1-CG 3.74Å; L628-Y725 HydrophobicContact CB-CD2 4.09Å; L628-Y725 HydrophobicContact CB-CE1 4.42Å; L628-Y725 HydrophobicContact CB-CE2 3.67Å; L628-Y725 HydrophobicContact CD1-CD1 4.06Å; L628-Y725 HydrophobicContact CD1-CD2 4.03Å; L628-Y725 HydrophobicContact CD1-CE1 4.41Å; L628-Y725 HydrophobicContact CD1-CE2 4.4Å; L628-Y725 HydrophobicContact CD1-CG 3.88Å
629	F	90.7	Very high	86.5	Confident	28 Å²	28	23.3 Å²	23.3	12%	0.123	12%	0.122	C	C	.	.	H	α-helix	trans	-63.3	-36.5	-177.7	-67.9	-29.6	0	0	0	113.2	L99 L576 F577 I580 L625 L626 N631 C632 I633	L99-F629 HydrophobicContact CD1-CE1 3.96Å; L99-F629 HydrophobicContact CD1-CZ 3.82Å; L99-F629 HydrophobicContact CD2-CE1 4.33Å; L576-F629 HydrophobicContact CD1-CD2 4.32Å; L576-F629 HydrophobicContact CD2-CD2 3.62Å; L576-F629 HydrophobicContact CD2-CE2 3.68Å; L576-F629 HydrophobicContact CG-CD2 3.76Å; L576-F629 HydrophobicContact CG-CE2 3.9Å; F577-F629 HydrophobicContact CD1-CE2 4.49Å; F577-F629 HydrophobicContact CD1-CZ 4.32Å; F577-F629 HydrophobicContact CD2-CE2 4.31Å; F577-F629 HydrophobicContact CE1-CE2 4.37Å; F577-F629 AromaticContact CE1-CZ 3.84Å; F577-F629 HydrophobicContact CE1-CZ 3.84Å; F577-F629 HydrophobicContact CE2-CE2 4.16Å; F577-F629 HydrophobicContact CE2-CZ 4.16Å; F577-F629 HydrophobicContact CG-CE2 4.48Å; F577-F629 HydrophobicContact CZ-CE2 4.21Å; F577-F629 AromaticContact CZ-CZ 3.75Å; F577-F629 HydrophobicContact CZ-CZ 3.75Å; I580-F629 HydrophobicContact CD1-CB 3.54Å; I580-F629 HydrophobicContact CD1-CD2 4.19Å; I580-F629 HydrophobicContact CD1-CG 4.33Å; I580-F629 HydrophobicContact CG1-CB 3.76Å; I580-F629 HydrophobicContact CG1-CD2 3.61Å; I580-F629 HydrophobicContact CG1-CG 4.03Å; L625-F629 HydrophobicContact CB-CD2 4.39Å; L625-F629 HydrophobicContact CB-CE2 4.15Å; L625-F629 HydrophobicContact CB-CZ 4.39Å; L625-F629 HydrophobicContact CD1-CZ 4.26Å; L625-F629 PolarHBondContact O-N 2.92Å; L626-F629 PolarHBondContact O-N 3.47Å; F629-N631 VanDerWaalsContact C-N 3.35Å; F629-C632 WeakPolarHBondContact O-CB 3.35Å; F629-C632 PolarHBondContact O-N 2.91Å; F629-I633 WeakPolarHBondContact O-CG1 3.21Å; F629-I633 PolarHBondContact O-N 2.94Å
630	I	89	Confident	85.4	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-64.9	-40.8	174.7	-62.9	-70.5	0	0	0	110.8	I580 L583 L593 S597 L626 L628 C632 I633 F634 F728	I580-I630 HydrophobicContact CD1-CD1 4.34Å; L583-I630 HydrophobicContact CD1-CD1 4.4Å; L593-I630 HydrophobicContact CB-CD1 4.44Å; L593-I630 HydrophobicContact CB-CG2 4.33Å; L593-I630 HydrophobicContact CD1-CD1 4.27Å; L593-I630 HydrophobicContact CD2-CD1 4.41Å; S597-I630 WeakPolarHBondContact OG-CG1 3.36Å; L626-I630 HydrophobicContact CD1-CD1 4.27Å; L626-I630 HydrophobicContact CD1-CG1 3.89Å; L626-I630 HydrophobicContact CG-CG1 4.28Å; L626-I630 VanDerWaalsContact O-CG1 3.23Å; L626-I630 WeakPolarHBondContact O-CG1 3.29Å; L626-I630 PolarHBondContact O-N 3.28Å; L628-I630 VanDerWaalsContact C-N 3.31Å; L628-I630 PolarHBondContact O-N 2.86Å; I630-C632 VanDerWaalsContact C-N 3.32Å; I630-C632 PolarHBondContact O-N 3.46Å; I630-I633 HydrophobicContact CD1-CD1 4.14Å; I630-I633 PolarHBondContact O-N 2.91Å; I630-F634 HydrophobicContact CG2-CD2 4.01Å; I630-F634 HydrophobicContact CG2-CE2 3.46Å; I630-F634 VanDerWaalsContact CG2-CE2 3.46Å; I630-F634 HydrophobicContact CG2-CZ 4.15Å; I630-F634 WeakPolarHBondContact O-CD2 3.49Å; I630-F634 PolarHBondContact O-N 3.1Å; I630-F634 VanDerWaalsContact O-N 3.11Å; I630-F728 HydrophobicContact CB-CE1 4.18Å; I630-F728 HydrophobicContact CB-CZ 4.35Å; I630-F728 HydrophobicContact CG2-CE1 4.04Å; I630-F728 HydrophobicContact CG2-CZ 3.7Å
631	N	89.3	Confident	84	Confident	1 Å²	1	24.2 Å²	24.2	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-62.2	-41	173.5	-163.6	31	0	0	0	111.8	P627 L628 F629 F634 K635 P723 Y725 F728	P627-N631 WeakPolarHBondContact O-CB 3.42Å; P627-N631 PolarHBondContact O-N 3.4Å; P627-N631 VanDerWaalsContact O-N 3.08Å; L628-N631 WeakPolarHBondContact O-CB 3.22Å; L628-N631 PolarHBondContact O-N 3Å; L628-N631 VanDerWaalsContact O-N 3.1Å; F629-N631 VanDerWaalsContact C-N 3.35Å; N631-F634 PolarHBondContact O-N 3.49Å; N631-K635 PolarHBondContact ND2-NZ 3.13Å; N631-K635 WeakPolarHBondContact O-CG 3.47Å; N631-K635 PolarHBondContact O-N 3.39Å; N631-K635 VanDerWaalsContact O-N 3.1Å; N631-P723 PolarHBondContact ND2-O 3.04Å; N631-P723 VanDerWaalsContact ND2-O 3.12Å; N631-P723 PolarHBondContact OD1-O 3.36Å; N631-Y725 PolarHBondContact ND2-N 2.79Å; N631-F728 HydrophobicContact CB-CB 4.21Å; N631-F728 HydrophobicContact CB-CD1 3.77Å; N631-F728 HydrophobicContact CB-CE1 4.27Å; N631-F728 HydrophobicContact CB-CG 3.9Å
632	C	87.1	Confident	82.6	Confident	32 Å²	32	18.3 Å²	18.3	22%	0.216	11%	0.11	C	C	.	.	H	α-helix	trans	-63.4	-40.7	175.8	-61.8	0	0	0	0	112.2	L628 F629 I630 F634 K635 S636 V715	L628-C632 PolarHBondContact O-N 3.05Å; L628-C632 PolarHBondContact O-SG 2.9Å; F629-C632 WeakPolarHBondContact O-CB 3.35Å; F629-C632 PolarHBondContact O-N 2.91Å; I630-C632 VanDerWaalsContact C-N 3.32Å; I630-C632 PolarHBondContact O-N 3.46Å; C632-F634 VanDerWaalsContact C-N 3.32Å; C632-F634 PolarHBondContact O-N 3.36Å; C632-K635 PolarHBondContact O-N 2.88Å; C632-S636 PolarHBondContact O-N 3.18Å; C632-V715 VanDerWaalsContact SG-CG2 3.56Å
633	I	82.3	Confident	81.1	Confident	4 Å²	4	21 Å²	21	2%	0.021	13%	0.127	C	C	.	.	H	α-helix	trans	-58.4	-45.5	174.2	-72	161	0	0	0	110.3	I580 V589 L593 F629 I630 K635 S636 F639	I580-I633 HydrophobicContact CD1-CD1 4.16Å; I580-I633 HydrophobicContact CG2-CD1 4.09Å; V589-I633 HydrophobicContact CG1-CG2 3.98Å; V589-I633 HydrophobicContact CG2-CG2 3.9Å; L593-I633 HydrophobicContact CD1-CG2 4.12Å; F629-I633 WeakPolarHBondContact O-CG1 3.21Å; F629-I633 PolarHBondContact O-N 2.94Å; I630-I633 HydrophobicContact CD1-CD1 4.14Å; I630-I633 PolarHBondContact O-N 2.91Å; I633-K635 VanDerWaalsContact C-N 3.27Å; I633-K635 PolarHBondContact O-N 3.24Å; I633-S636 WeakPolarHBondContact O-CB 3.43Å; I633-S636 PolarHBondContact O-N 3.49Å; I633-F639 HydrophobicContact CG2-CD2 3.89Å; I633-F639 HydrophobicContact CG2-CE2 3.98Å; I633-F639 HydrophobicContact CG2-CG 4.47Å; I633-F639 VanDerWaalsContact O-CD2 3.3Å; I633-F639 WeakPolarHBondContact O-CD2 3.18Å
634	F	81.7	Confident	79.8	Confident	41 Å²	41	26.5 Å²	26.5	18%	0.18	15%	0.152	C	C	.	.	H	α-helix	trans	-64.7	-31.5	178.6	-69.5	-50.6	0	0	0	113.4	V589 L593 T594 I630 N631 C632 S640 H722 F728	V589-F634 HydrophobicContact CG1-CD1 4.33Å; V589-F634 HydrophobicContact CG1-CE1 4.31Å; V589-F634 WeakPolarHBondContact O-CE1 3.4Å; L593-F634 HydrophobicContact CB-CE1 4.42Å; L593-F634 HydrophobicContact CB-CZ 3.86Å; T594-F634 VanDerWaalsContact OG1-CE2 3.28Å; T594-F634 WeakPolarHBondContact OG1-CE2 3.15Å; T594-F634 WeakPolarHBondContact OG1-CZ 3.33Å; I630-F634 HydrophobicContact CG2-CD2 4.01Å; I630-F634 HydrophobicContact CG2-CE2 3.46Å; I630-F634 VanDerWaalsContact CG2-CE2 3.46Å; I630-F634 HydrophobicContact CG2-CZ 4.15Å; I630-F634 WeakPolarHBondContact O-CD2 3.49Å; I630-F634 PolarHBondContact O-N 3.1Å; I630-F634 VanDerWaalsContact O-N 3.11Å; N631-F634 PolarHBondContact O-N 3.49Å; C632-F634 VanDerWaalsContact C-N 3.32Å; C632-F634 PolarHBondContact O-N 3.36Å; F634-S640 WeakPolarHBondContact O-CB 3.16Å; F634-H722 PolarHBondContact O-CE1 2.84Å; F634-H722 PolarHBondContact O-NE2 2.93Å; F634-F728 HydrophobicContact CD2-CE2 4.13Å; F634-F728 HydrophobicContact CD2-CZ 4.31Å; F634-F728 AromaticContact CE2-CE2 4Å; F634-F728 HydrophobicContact CE2-CE2 4Å; F634-F728 AromaticContact CE2-CZ 3.99Å; F634-F728 HydrophobicContact CE2-CZ 3.99Å
635	K	81.2	Confident	78.5	Confident	19 Å²	19	25.8 Å²	25.8	8%	0.083	15%	0.15	C	C	.	.	H	α-helix	trans	-79.4	-20.6	176.5	-71.5	177.8	-175	176.6	0	113.7	N631 C632 I633 D637 V715 D717 H722 P723	N631-K635 PolarHBondContact ND2-NZ 3.13Å; N631-K635 WeakPolarHBondContact O-CG 3.47Å; N631-K635 PolarHBondContact O-N 3.39Å; N631-K635 VanDerWaalsContact O-N 3.1Å; C632-K635 PolarHBondContact O-N 2.88Å; I633-K635 VanDerWaalsContact C-N 3.27Å; I633-K635 PolarHBondContact O-N 3.24Å; K635-D637 PolarHBondContact O-N 3.03Å; K635-V715 WeakPolarHBondContact CD-O 3.12Å; K635-V715 PolarHBondContact NZ-O 3.18Å; K635-D717 PolarHBondContact NZ-O 2.82Å; K635-H722 HydrophobicContact CD-CB 4.44Å; K635-H722 HydrophobicContact CG-CB 3.71Å; K635-P723 WeakPolarHBondContact CE-O 3.29Å; K635-P723 PolarHBondContact NZ-O 3.32Å
636	S	77.9	Confident	77.2	Confident	33 Å²	33	28.5 Å²	28.5	23%	0.231	17%	0.167	C	C	.	.	S	Bend	trans	-62	129.2	-179.5	172.6	0	0	0	0	110.9	C632 I633 S638 F639 S640	C632-S636 PolarHBondContact O-N 3.18Å; I633-S636 WeakPolarHBondContact O-CB 3.43Å; I633-S636 PolarHBondContact O-N 3.49Å; S636-S638 PolarHBondContact O-N 2.98Å; S636-S638 VanDerWaalsContact O-N 3.08Å; S636-F639 PolarHBondContact O-N 2.76Å; S636-S640 PolarHBondContact O-N 2.67Å; S636-S640 PolarHBondContact O-OG 2.62Å
637	D	74.1	Confident	76	Confident	38 Å²	38	30.3 Å²	30.3	20%	0.203	18%	0.178	C	C	.	.	H	α-helix	trans	-54.5	-26.6	179.8	-81.7	-14.1	0	0	0	113.4	K635 F639 S640 G641 L645 L653	K635-D637 PolarHBondContact O-N 3.03Å; D637-F639 PolarHBondContact O-N 2.72Å; D637-S640 WeakPolarHBondContact CA-OG 3.43Å; D637-G641 PolarHBondContact O-N 3.32Å; D637-L645 HydrophobicContact CB-CD1 3.44Å; D637-L645 VanDerWaalsContact CB-CD1 3.44Å; D637-L645 HydrophobicContact CB-CD2 4.23Å; D637-L645 HydrophobicContact CB-CG 4.39Å; D637-L645 VanDerWaalsContact CG-CD1 3.49Å; D637-L653 HydrophobicContact CB-CD1 3.46Å; D637-L653 VanDerWaalsContact CB-CD1 3.46Å
638	S	67.5	Low	74.6	Confident	6 Å²	6	35.2 Å²	35.2	4%	0.042	20%	0.204	C	C	.	.	H	α-helix	trans	-55.2	-39.4	171.4	-58.4	0	0	0	0	112.6	S636 R650 L653	S636-S638 PolarHBondContact O-N 2.98Å; S636-S638 VanDerWaalsContact O-N 3.08Å; S638-R650 PolarHBondContact O-NE 2.8Å; S638-L653 WeakPolarHBondContact OG-CB 3.42Å; S638-L653 PolarHBondContact OG-O 2.68Å
639	F	71.2	Confident	73.3	Confident	32 Å²	32	37.7 Å²	37.7	14%	0.14	22%	0.218	C	C	.	.	H	α-helix	trans	-104.8	-48.6	-173.1	-55.2	-73.3	0	0	0	112.2	S584 P586 V589 I633 S636 D637 G641 R650	S584-F639 WeakPolarHBondContact O-CE1 3.45Å; S584-F639 WeakPolarHBondContact O-CZ 3.46Å; P586-F639 HydrophobicContact CB-CE1 4.43Å; P586-F639 HydrophobicContact CG-CE1 4.01Å; V589-F639 HydrophobicContact CB-CD1 3.78Å; V589-F639 HydrophobicContact CB-CE1 4.12Å; V589-F639 HydrophobicContact CB-CG 4.38Å; V589-F639 HydrophobicContact CG1-CB 3.84Å; V589-F639 HydrophobicContact CG1-CD1 3.57Å; V589-F639 HydrophobicContact CG1-CD2 4.46Å; V589-F639 HydrophobicContact CG1-CE1 4.3Å; V589-F639 HydrophobicContact CG1-CG 3.69Å; V589-F639 HydrophobicContact CG2-CD1 3.75Å; V589-F639 HydrophobicContact CG2-CE1 3.59Å; V589-F639 HydrophobicContact CG2-CG 4.36Å; V589-F639 HydrophobicContact CG2-CZ 4.1Å; I633-F639 HydrophobicContact CG2-CD2 3.89Å; I633-F639 HydrophobicContact CG2-CE2 3.98Å; I633-F639 HydrophobicContact CG2-CG 4.47Å; I633-F639 VanDerWaalsContact O-CD2 3.3Å; I633-F639 WeakPolarHBondContact O-CD2 3.18Å; S636-F639 PolarHBondContact O-N 2.76Å; D637-F639 PolarHBondContact O-N 2.72Å; F639-G641 VanDerWaalsContact C-N 3.29Å; F639-G641 PolarHBondContact O-N 3.27Å; F639-R650 PolarHBondContact O-NH2 3.38Å
640	S	70.3	Confident	72.1	Confident	41 Å²	41	36.9 Å²	36.9	29%	0.287	21%	0.214	S	C	.	.	H	α-helix	trans	-62.6	-35	-177.6	66.6	0	0	0	0	112.4	F634 S636 D637	F634-S640 WeakPolarHBondContact O-CB 3.16Å; S636-S640 PolarHBondContact O-N 2.67Å; S636-S640 PolarHBondContact O-OG 2.62Å; D637-S640 WeakPolarHBondContact CA-OG 3.43Å
641	G	64	Low	71	Confident	17 Å²	17	38.3 Å²	38.3	18%	0.175	23%	0.226	C	C	.	.			trans	65.2	48.9	-177.3	0	0	0	0	0	112.6	D637 F639	D637-G641 PolarHBondContact O-N 3.32Å; F639-G641 VanDerWaalsContact C-N 3.29Å; F639-G641 PolarHBondContact O-N 3.27Å
642	G	61.9	Low	69.7	Low	11 Å²	11	42.2 Å²	42.2	11%	0.113	24%	0.24	C	C	.	.			trans	-44.4	141.7	-178.5	0	0	0	0	0	114.4	E644 L645	G642-E644 PolarHBondContact O-N 3.4Å; G642-E644 VanDerWaalsContact O-N 3.07Å; G642-L645 PolarHBondContact O-N 3.39Å; G642-L645 VanDerWaalsContact O-N 3.08Å
643	S	61.2	Low	68.6	Low	88 Å²	88	42.5 Å²	42.5	62%	0.615	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-22.2	-172.6	65.9	0	0	0	0	114.4	R424	R424-S643 PolarHBondContact NH2-O 2.93Å
644	E	64	Low	67.8	Low	119 Å²	119	42.7 Å²	42.7	56%	0.556	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-11	-179.4	-61.9	-173	150.8	0	0	114	G642 K712	G642-E644 PolarHBondContact O-N 3.4Å; G642-E644 VanDerWaalsContact O-N 3.07Å; E644-K712 IonicContact OE2-NZ 3.58Å; E644-K712 PolarHBondContact OE2-NZ 3.01Å
645	L	65.4	Low	67	Low	21 Å²	21	43 Å²	43	11%	0.11	24%	0.244	C	C	.	.			trans	-79.9	142.5	-178.3	-67	155.1	0	0	0	111.3	D637 G642 D649 L653	D637-L645 HydrophobicContact CB-CD1 3.44Å; D637-L645 VanDerWaalsContact CB-CD1 3.44Å; D637-L645 HydrophobicContact CB-CD2 4.23Å; D637-L645 HydrophobicContact CB-CG 4.39Å; D637-L645 VanDerWaalsContact CG-CD1 3.49Å; G642-L645 PolarHBondContact O-N 3.39Å; G642-L645 VanDerWaalsContact O-N 3.08Å; L645-D649 HydrophobicContact CB-CB 4.46Å; L645-D649 HydrophobicContact CD2-CB 3.83Å; L645-L653 HydrophobicContact CD2-CD1 4.25Å
646	T	64.9	Low	66.1	Low	60 Å²	60	42.8 Å²	42.8	37%	0.368	24%	0.244	S	C	.	.			trans	-74.5	163.8	164.5	69.8	0	0	0	0	110.4	D648 D649 R650	T646-D648 PolarHBondContact O-N 2.88Å; T646-D648 PolarHBondContact OG1-N 3.32Å; T646-D649 WeakPolarHBondContact CB-OD2 3.41Å; T646-D649 WeakPolarHBondContact CG2-OD2 3.35Å; T646-D649 PolarHBondContact N-OD2 2.69Å; T646-D649 PolarHBondContact O-N 2.87Å; T646-D649 PolarHBondContact OG1-N 2.86Å; T646-D649 PolarHBondContact OG1-OD2 2.88Å; T646-R650 PolarHBondContact O-N 2.77Å
647	V	67.2	Low	65.4	Low	41 Å²	41	42 Å²	42	25%	0.248	24%	0.239	C	C	.	.	H	α-helix	trans	-60.3	-35.3	172.7	177.3	0	0	0	0	110.4	L427 A651	L427-V647 HydrophobicContact CD2-CG2 3.93Å; L427-V647 HydrophobicContact CG-CG2 4.32Å; V647-A651 WeakPolarHBondContact O-CB 3.26Å; V647-A651 PolarHBondContact O-N 2.91Å
648	D	63.3	Low	64.8	Low	104 Å²	104	45.8 Å²	45.8	56%	0.556	25%	0.25	S	S	*	.	H	α-helix	trans	-71.2	-44.8	-178.4	-63.8	-24.9	0	0	0	111.2	T646 R650 A651 W652	T646-D648 PolarHBondContact O-N 2.88Å; T646-D648 PolarHBondContact OG1-N 3.32Å; D648-R650 VanDerWaalsContact C-N 3.28Å; D648-R650 PolarHBondContact O-N 2.91Å; D648-A651 PolarHBondContact O-N 2.85Å; D648-W652 VanDerWaalsContact O-CB 3.3Å; D648-W652 WeakPolarHBondContact O-CB 3.42Å; D648-W652 PolarHBondContact O-N 2.93Å
649	D	64.4	Low	64.1	Low	56 Å²	56	45.5 Å²	45.5	30%	0.299	25%	0.249	S	C	.	.	H	α-helix	trans	-56.9	-44.4	175.1	-61.6	-42.4	0	0	0	111	L645 T646 W652 L653	L645-D649 HydrophobicContact CB-CB 4.46Å; L645-D649 HydrophobicContact CD2-CB 3.83Å; T646-D649 WeakPolarHBondContact CB-OD2 3.41Å; T646-D649 WeakPolarHBondContact CG2-OD2 3.35Å; T646-D649 PolarHBondContact N-OD2 2.69Å; T646-D649 PolarHBondContact O-N 2.87Å; T646-D649 PolarHBondContact OG1-N 2.86Å; T646-D649 PolarHBondContact OG1-OD2 2.88Å; D649-W652 PolarHBondContact O-N 3.43Å; D649-L653 WeakPolarHBondContact O-CB 3.08Å; D649-L653 VanDerWaalsContact O-CG 3.26Å; D649-L653 WeakPolarHBondContact O-CG 3.49Å; D649-L653 PolarHBondContact O-N 3.19Å
650	R	66.1	Low	63.2	Low	10 Å²	10	44.8 Å²	44.8	4%	0.038	25%	0.247	C	C	.	.	H	α-helix	trans	-70	-39.6	179.7	-169.9	176.2	-175.8	-165.5	-3.8	112.4	E432 R436 S638 F639 T646 D648 W652 V654	E432-R650 IonicContact OE1-CZ 2.75Å; E432-R650 IonicContact OE1-NE 2.63Å; E432-R650 IonicContact OE1-NH1 3.61Å; E432-R650 PolarHBondContact OE1-NH1 3.28Å; E432-R650 VanDerWaalsContact OE1-NH1 3.11Å; E432-R650 IonicContact OE2-CZ 3.88Å; E432-R650 VanDerWaalsContact OE2-CZ 3.3Å; E432-R650 IonicContact OE2-NH1 3.37Å; E432-R650 PolarHBondContact OE2-NH1 2.96Å; E432-R650 IonicContact OE2-NH2 3.3Å; R436-R650 VanDerWaalsContact NH2-NE 3.19Å; S638-R650 PolarHBondContact O-NE 2.8Å; F639-R650 PolarHBondContact O-NH2 3.38Å; T646-R650 PolarHBondContact O-N 2.77Å; D648-R650 VanDerWaalsContact C-N 3.28Å; D648-R650 PolarHBondContact O-N 2.91Å; R650-W652 VanDerWaalsContact C-N 3.33Å; R650-V654 WeakPolarHBondContact O-CB 3.09Å; R650-V654 WeakPolarHBondContact O-CG2 3.4Å; R650-V654 PolarHBondContact O-N 2.86Å
651	A	65.3	Low	62.3	Low	31 Å²	31	43.7 Å²	43.7	26%	0.256	24%	0.238	S	C	.	.	H	α-helix	trans	-62.7	-43.9	176	0	0	0	0	0	110.8	V647 D648 V654 I655	V647-A651 WeakPolarHBondContact O-CB 3.26Å; V647-A651 PolarHBondContact O-N 2.91Å; D648-A651 PolarHBondContact O-N 2.85Å; A651-V654 PolarHBondContact O-N 3.11Å; A651-I655 WeakPolarHBondContact O-CG1 3.41Å; A651-I655 PolarHBondContact O-N 3.09Å
652	W	62.6	Low	61.6	Low	82 Å²	82	47.3 Å²	47.3	31%	0.311	25%	0.246	S	C	.	.	H	α-helix	trans	-57.6	-54.8	174.2	173.3	75.8	0	0	0	111.7	F455 D648 D649 R650 V654 I655 V656	F455-W652 PolarHBondContact O-NE1 3.3Å; D648-W652 VanDerWaalsContact O-CB 3.3Å; D648-W652 WeakPolarHBondContact O-CB 3.42Å; D648-W652 PolarHBondContact O-N 2.93Å; D649-W652 PolarHBondContact O-N 3.43Å; R650-W652 VanDerWaalsContact C-N 3.33Å; W652-V654 PolarHBondContact O-N 3.28Å; W652-I655 PolarHBondContact O-N 2.96Å; W652-V656 HydrophobicContact CD2-CG2 4.27Å; W652-V656 HydrophobicContact CG-CG2 4.43Å; W652-V656 HydrophobicContact CZ2-CG2 4.1Å; W652-V656 WeakPolarHBondContact O-CG2 3.49Å; W652-V656 PolarHBondContact O-N 3.38Å
653	L	65.1	Low	60.5	Low	39 Å²	39	49.5 Å²	49.5	20%	0.204	26%	0.255	C	S	.	.	H	α-helix	trans	-54.9	-39.5	178.2	-78	173.5	0	0	0	112.6	D637 S638 L645 D649 S657	D637-L653 HydrophobicContact CB-CD1 3.46Å; D637-L653 VanDerWaalsContact CB-CD1 3.46Å; S638-L653 WeakPolarHBondContact OG-CB 3.42Å; S638-L653 PolarHBondContact OG-O 2.68Å; L645-L653 HydrophobicContact CD2-CD1 4.25Å; D649-L653 WeakPolarHBondContact O-CB 3.08Å; D649-L653 VanDerWaalsContact O-CG 3.26Å; D649-L653 WeakPolarHBondContact O-CG 3.49Å; D649-L653 PolarHBondContact O-N 3.19Å; L653-S657 VanDerWaalsContact O-CB 3.27Å; L653-S657 WeakPolarHBondContact O-CB 3.34Å; L653-S657 PolarHBondContact O-N 3.41Å; L653-S657 PolarHBondContact O-OG 2.8Å; L653-S657 VanDerWaalsContact O-OG 3.13Å
654	V	65.6	Low	59.3	Low	7 Å²	7	47.3 Å²	47.3	4%	0.042	24%	0.24	C	C	.	.	H	α-helix	trans	-68.5	-41.3	178	170.1	0	0	0	0	111.9	R436 R650 A651 W652 S657 R658	R436-V654 VanDerWaalsContact NH1-CG2 3.3Å; R650-V654 WeakPolarHBondContact O-CB 3.09Å; R650-V654 WeakPolarHBondContact O-CG2 3.4Å; R650-V654 PolarHBondContact O-N 2.86Å; A651-V654 PolarHBondContact O-N 3.11Å; W652-V654 PolarHBondContact O-N 3.28Å; V654-S657 WeakPolarHBondContact CA-OG 3.29Å; V654-S657 PolarHBondContact O-OG 3.17Å; V654-R658 VanDerWaalsContact O-CG 3.29Å; V654-R658 WeakPolarHBondContact O-CG 3.44Å; V654-R658 PolarHBondContact O-N 2.77Å
655	I	63.5	Low	58	Low	49 Å²	49	44.1 Å²	44.1	25%	0.251	23%	0.226	S	C	.	.	H	α-helix	trans	-65.2	-47.3	177.9	-69.6	165.7	0	0	0	110.1	A651 W652 S657 R658 G659	A651-I655 WeakPolarHBondContact O-CG1 3.41Å; A651-I655 PolarHBondContact O-N 3.09Å; W652-I655 PolarHBondContact O-N 2.96Å; I655-S657 PolarHBondContact O-N 2.99Å; I655-R658 PolarHBondContact O-N 3.26Å; I655-R658 VanDerWaalsContact O-N 3.08Å; I655-G659 PolarHBondContact O-N 3.41Å; I655-G659 VanDerWaalsContact O-N 3.1Å
656	V	62.3	Low	56.4	Low	13 Å²	13	46.7 Å²	46.7	8%	0.079	25%	0.246	C	C	.	.	H	α-helix	trans	-60.1	-46.5	178.9	171.8	0	0	0	0	110.7	W652 R658 G659 C660 L665	W652-V656 HydrophobicContact CD2-CG2 4.27Å; W652-V656 HydrophobicContact CG-CG2 4.43Å; W652-V656 HydrophobicContact CZ2-CG2 4.1Å; W652-V656 WeakPolarHBondContact O-CG2 3.49Å; W652-V656 PolarHBondContact O-N 3.38Å; V656-R658 PolarHBondContact O-N 3.13Å; V656-R658 VanDerWaalsContact O-N 3.13Å; V656-G659 PolarHBondContact O-N 2.85Å; V656-C660 WeakPolarHBondContact O-CB 3.42Å; V656-C660 PolarHBondContact O-N 3.42Å; V656-C660 VanDerWaalsContact O-N 3.16Å; V656-L665 HydrophobicContact CG1-CD1 3.91Å; V656-L665 HydrophobicContact CG1-CD2 3.24Å; V656-L665 HydrophobicContact CG1-CG 3.82Å
657	S	63.1	Low	55	Low	17 Å²	17	48.3 Å²	48.3	12%	0.119	25%	0.252	C	S	.	.	H	α-helix	trans	-63.3	-18.7	177	69.4	0	0	0	0	114.8	L653 V654 I655	L653-S657 VanDerWaalsContact O-CB 3.27Å; L653-S657 WeakPolarHBondContact O-CB 3.34Å; L653-S657 PolarHBondContact O-N 3.41Å; L653-S657 PolarHBondContact O-OG 2.8Å; L653-S657 VanDerWaalsContact O-OG 3.13Å; V654-S657 WeakPolarHBondContact CA-OG 3.29Å; V654-S657 PolarHBondContact O-OG 3.17Å; I655-S657 PolarHBondContact O-N 2.99Å
658	R	62.9	Low	53.7	Low	117 Å²	117	50.7 Å²	50.7	44%	0.442	26%	0.256	S	S	.	.	H	α-helix	trans	-91.7	-35.8	179.4	-78.2	175.7	170.9	-164.8	-4.5	113.5	G501 V654 I655 V656	G501-R658 WeakPolarHBondContact CA-O 3.46Å; V654-R658 VanDerWaalsContact O-CG 3.29Å; V654-R658 WeakPolarHBondContact O-CG 3.44Å; V654-R658 PolarHBondContact O-N 2.77Å; I655-R658 PolarHBondContact O-N 3.26Å; I655-R658 VanDerWaalsContact O-N 3.08Å; V656-R658 PolarHBondContact O-N 3.13Å; V656-R658 VanDerWaalsContact O-N 3.13Å
659	G	51.8	Low	52.7	Low	1 Å²	1	49.5 Å²	49.5	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-98.5	-20.5	-171	0	0	0	0	0	115	K520 C521 I655 V656	K520-G659 WeakPolarHBondContact CA-O 3.43Å; C521-G659 PolarHBondContact N-O 3.13Å; C521-G659 VanDerWaalsContact N-O 3.13Å; I655-G659 PolarHBondContact O-N 3.41Å; I655-G659 VanDerWaalsContact O-N 3.1Å; V656-G659 PolarHBondContact O-N 2.85Å
660	C	52.6	Low	51.4	Low	16 Å²	16	50.4 Å²	50.4	11%	0.108	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-98.5	142.9	-178.8	-69.2	0	0	0	0	111.3	P453 V656 S664 L665	P453-C660 WeakPolarHBondContact CB-SG 3.45Å; V656-C660 WeakPolarHBondContact O-CB 3.42Å; V656-C660 PolarHBondContact O-N 3.42Å; V656-C660 VanDerWaalsContact O-N 3.16Å; C660-S664 WeakPolarHBondContact CB-OG 3.22Å; C660-L665 HydrophobicContact CB-CB 4.4Å; C660-L665 HydrophobicContact CB-CD1 3.65Å; C660-L665 HydrophobicContact CB-CG 3.62Å
661	H	51.9	Low	50.4	Low	19 Å²	19	53.1 Å²	53.1	9%	0.088	26%	0.262	C	S	.	.			trans	-59.9	140.6	159.2	-156.2	-60.1	0	0	0	107.5	S168 C521 N581 N663 S664 L665	S168-H661 PolarHBondContact OG-NE2 2.95Å; C521-H661 HydrophobicContact CB-CB 3.75Å; N581-H661 PolarHBondContact ND2-CE1 3.44Å; H661-N663 HydrophobicContact CB-CB 4.41Å; H661-N663 VanDerWaalsContact CE1-CG 3.49Å; H661-N663 PolarHBondContact CE1-ND2 3.06Å; H661-N663 PolarHBondContact ND1-N 3.05Å; H661-N663 PolarHBondContact ND1-ND2 2.66Å; H661-N663 VanDerWaalsContact ND1-ND2 3.18Å; H661-N663 PolarHBondContact O-N 3.21Å; H661-S664 PolarHBondContact N-OG 2.88Å; H661-S664 VanDerWaalsContact N-OG 3.09Å; H661-S664 PolarHBondContact O-N 3.42Å; H661-S664 PolarHBondContact O-OG 3.21Å; H661-L665 PolarHBondContact O-N 3.37Å
662	W	47.8	Very low	49.3	Very low	92 Å²	92	51.7 Å²	51.7	35%	0.348	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-15.3	170.5	-75.6	76.5	0	0	0	113	S584 L665 S666	S584-W662 PolarHBondContact OG-NE1 2.71Å; W662-L665 CarbonylContact O-C 3.57Å; W662-S666 PolarHBondContact O-N 2.72Å
663	N	39.4	Very low	48.4	Very low	57 Å²	57	52.4 Å²	52.4	31%	0.305	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-32.2	173.8	-58	-17.2	0	0	0	112.7	C127 H661 L665 S666	C127-N663 WeakPolarHBondContact CB-ND2 3.44Å; C127-N663 WeakPolarHBondContact CB-OD1 3.02Å; C127-N663 PolarHBondContact SG-OD1 2.9Å; H661-N663 HydrophobicContact CB-CB 4.41Å; H661-N663 VanDerWaalsContact CE1-CG 3.49Å; H661-N663 PolarHBondContact CE1-ND2 3.06Å; H661-N663 PolarHBondContact ND1-N 3.05Å; H661-N663 PolarHBondContact ND1-ND2 2.66Å; H661-N663 VanDerWaalsContact ND1-ND2 3.18Å; H661-N663 PolarHBondContact O-N 3.21Å; N663-L665 VanDerWaalsContact C-N 3.29Å; N663-S666 VanDerWaalsContact O-CB 3.23Å; N663-S666 WeakPolarHBondContact O-CB 3.3Å; N663-S666 PolarHBondContact O-N 2.78Å; N663-S666 VanDerWaalsContact O-N 3.14Å; N663-S666 PolarHBondContact O-OG 3.44Å
664	S	37	Very low	47.4	Very low	42 Å²	42	56.4 Å²	56.4	29%	0.294	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-24.1	169.4	62.9	0	0	0	0	111.4	D519 C660 H661	D519-S664 PolarHBondContact O-OG 3.49Å; C660-S664 WeakPolarHBondContact CB-OG 3.22Å; H661-S664 PolarHBondContact N-OG 2.88Å; H661-S664 VanDerWaalsContact N-OG 3.09Å; H661-S664 PolarHBondContact O-N 3.42Å; H661-S664 PolarHBondContact O-OG 3.21Å
665	L	36.2	Very low	46.4	Very low	52 Å²	52	57.8 Å²	57.8	27%	0.272	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	8	162.1	-94	165.8	0	0	0	113.9	V656 C660 H661 W662 N663 L667	V656-L665 HydrophobicContact CG1-CD1 3.91Å; V656-L665 HydrophobicContact CG1-CD2 3.24Å; V656-L665 HydrophobicContact CG1-CG 3.82Å; C660-L665 HydrophobicContact CB-CB 4.4Å; C660-L665 HydrophobicContact CB-CD1 3.65Å; C660-L665 HydrophobicContact CB-CG 3.62Å; H661-L665 PolarHBondContact O-N 3.37Å; W662-L665 CarbonylContact O-C 3.57Å; N663-L665 VanDerWaalsContact C-N 3.29Å; L665-L667 PolarHBondContact O-N 2.99Å
666	S	31.8	Very low	45.8	Very low	76 Å²	76	57.2 Å²	57.2	53%	0.531	28%	0.283	S	S	.	.	S	Bend	trans	-57.9	95.5	155.6	62.3	0	0	0	0	104.3	W662 N663 R668	W662-S666 PolarHBondContact O-N 2.72Å; N663-S666 VanDerWaalsContact O-CB 3.23Å; N663-S666 WeakPolarHBondContact O-CB 3.3Å; N663-S666 PolarHBondContact O-N 2.78Å; N663-S666 VanDerWaalsContact O-N 3.14Å; N663-S666 PolarHBondContact O-OG 3.44Å; S666-R668 VanDerWaalsContact C-N 3.3Å; S666-R668 PolarHBondContact O-N 3.38Å
667	L	35.7	Very low	45.3	Very low	94 Å²	94	59.4 Å²	59.4	49%	0.492	31%	0.309	S	S	.	.			trans	-33.6	106.5	169.8	-79.4	155.8	0	0	0	103.4	L665 E669	L665-L667 PolarHBondContact O-N 2.99Å; L667-E669 WeakPolarHBondContact O-CA 3.46Å; L667-E669 WeakPolarHBondContact O-CG 3.43Å; L667-E669 PolarHBondContact O-N 3.26Å
668	R	39.3	Very low	44.8	Very low	90 Å²	90	59.6 Å²	59.6	34%	0.34	31%	0.309	S	S	.	.			trans	-42.9	105.6	178.8	-84.8	172.3	157.1	-141.3	-23.3	104.2	A470 D471 H474 S666 L670 W671	A470-R668 PolarHBondContact O-NH1 2.76Å; D471-R668 IonicContact OD1-NH1 3.84Å; D471-R668 PolarHBondContact OD1-NH1 2.74Å; H474-R668 PolarHBondContact ND1-NH2 3.19Å; S666-R668 VanDerWaalsContact C-N 3.3Å; S666-R668 PolarHBondContact O-N 3.38Å; R668-L670 HydrophobicContact CB-CB 4.21Å; R668-L670 HydrophobicContact CB-CD1 3.94Å; R668-L670 HydrophobicContact CB-CG 4.02Å; R668-L670 HydrophobicContact CG-CD1 4.33Å; R668-L670 PolarHBondContact O-N 2.85Å; R668-W671 PolarHBondContact O-N 3.09Å
669	E	41.7	Very low	44.1	Very low	79 Å²	79	58.6 Å²	58.6	37%	0.369	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	3.8	-172.2	-68.9	-173.5	139.2	0	0	108.9	L667 W671 I672 Q673 S680	L667-E669 WeakPolarHBondContact O-CA 3.46Å; L667-E669 WeakPolarHBondContact O-CG 3.43Å; L667-E669 PolarHBondContact O-N 3.26Å; E669-W671 PolarHBondContact O-N 3.46Å; E669-I672 HydrophobicContact CB-CB 4.3Å; E669-I672 HydrophobicContact CB-CD1 4.19Å; E669-I672 HydrophobicContact CG-CD1 3.89Å; E669-I672 CarbonylContact O-C 3.59Å; E669-I672 VanDerWaalsContact O-CA 3.32Å; E669-I672 WeakPolarHBondContact O-CA 3.46Å; E669-I672 WeakPolarHBondContact O-CB 3.43Å; E669-I672 PolarHBondContact O-N 3.18Å; E669-Q673 PolarHBondContact O-N 2.79Å; E669-S680 WeakPolarHBondContact OE1-CA 3.32Å
670	L	37.8	Very low	43.9	Very low	75 Å²	75	59.9 Å²	59.9	39%	0.393	32%	0.321	S	S	.	.	H	α-helix	trans	-35.3	-49.6	157.6	-65.1	177.9	0	0	0	111.7	R668 I672 Q673 D674	R668-L670 HydrophobicContact CB-CB 4.21Å; R668-L670 HydrophobicContact CB-CD1 3.94Å; R668-L670 HydrophobicContact CB-CG 4.02Å; R668-L670 HydrophobicContact CG-CD1 4.33Å; R668-L670 PolarHBondContact O-N 2.85Å; L670-I672 VanDerWaalsContact C-N 3.32Å; L670-I672 PolarHBondContact O-N 2.8Å; L670-Q673 PolarHBondContact O-N 2.82Å; L670-D674 WeakPolarHBondContact O-CA 3.12Å; L670-D674 WeakPolarHBondContact O-CB 3.28Å; L670-D674 PolarHBondContact O-N 2.76Å
671	W	45.4	Very low	43.6	Very low	68 Å²	68	63.4 Å²	63.4	26%	0.258	33%	0.334	S	S	.	.	H	α-helix	trans	-68.3	-31.9	178	80.5	-88.5	0	0	0	112.7	R668 E669 V675 F676 F681	R668-W671 PolarHBondContact O-N 3.09Å; E669-W671 PolarHBondContact O-N 3.46Å; W671-V675 HydrophobicContact CE3-CB 4.39Å; W671-V675 HydrophobicContact CE3-CG2 4.17Å; W671-V675 WeakPolarHBondContact O-CA 3.46Å; W671-V675 WeakPolarHBondContact O-CB 3.18Å; W671-V675 WeakPolarHBondContact O-CG2 3.49Å; W671-V675 PolarHBondContact O-N 3.27Å; W671-F676 HydrophobicContact CE3-CE2 4.31Å; W671-F676 HydrophobicContact CH2-CE2 4.17Å; W671-F676 HydrophobicContact CZ3-CD2 4.44Å; W671-F676 AromaticContact CZ3-CE2 3.58Å; W671-F676 HydrophobicContact CZ3-CE2 3.58Å; W671-F676 HydrophobicContact CZ3-CZ 4.36Å; W671-F681 HydrophobicContact CH2-CE1 4.28Å; W671-F681 HydrophobicContact CH2-CE2 4.22Å; W671-F681 AromaticContact CH2-CZ 3.56Å; W671-F681 HydrophobicContact CH2-CZ 3.56Å; W671-F681 HydrophobicContact CZ2-CE1 4.46Å; W671-F681 AromaticContact CZ2-CE2 3.61Å; W671-F681 HydrophobicContact CZ2-CE2 3.61Å; W671-F681 AromaticContact CZ2-CZ 3.38Å; W671-F681 HydrophobicContact CZ2-CZ 3.38Å
672	I	42.4	Very low	43.2	Very low	1 Å²	1	65.6 Å²	65.6	1%	0.005	36%	0.356	C	S	.	.	H	α-helix	trans	-71	-41.8	176.1	-60.2	176.8	0	0	0	110.5	E669 L670 F676 G677 V678 F681 I684	E669-I672 HydrophobicContact CB-CB 4.3Å; E669-I672 HydrophobicContact CB-CD1 4.19Å; E669-I672 HydrophobicContact CG-CD1 3.89Å; E669-I672 CarbonylContact O-C 3.59Å; E669-I672 VanDerWaalsContact O-CA 3.32Å; E669-I672 WeakPolarHBondContact O-CA 3.46Å; E669-I672 WeakPolarHBondContact O-CB 3.43Å; E669-I672 PolarHBondContact O-N 3.18Å; L670-I672 VanDerWaalsContact C-N 3.32Å; L670-I672 PolarHBondContact O-N 2.8Å; I672-F676 HydrophobicContact CG2-CD2 4.08Å; I672-F676 CarbonylContact O-C 3Å; I672-F676 VanDerWaalsContact O-CA 3.3Å; I672-F676 WeakPolarHBondContact O-CA 3.4Å; I672-F676 VanDerWaalsContact O-CB 3.27Å; I672-F676 WeakPolarHBondContact O-CB 3.19Å; I672-F676 PolarHBondContact O-N 2.88Å; I672-G677 PolarHBondContact O-N 3.01Å; I672-V678 HydrophobicContact CG2-CG2 3.53Å; I672-V678 WeakPolarHBondContact CG2-O 3.32Å; I672-F681 HydrophobicContact CD1-CD2 3.16Å; I672-F681 HydrophobicContact CD1-CE2 3.38Å; I672-F681 HydrophobicContact CD1-CG 3.89Å; I672-F681 HydrophobicContact CD1-CZ 4.25Å; I672-F681 HydrophobicContact CG1-CD2 4.31Å; I672-F681 HydrophobicContact CG1-CE2 4.15Å; I672-I684 HydrophobicContact CG2-CD1 3.87Å; I672-I684 HydrophobicContact CG2-CG1 4.28Å
673	Q	43.2	Very low	43.2	Very low	97 Å²	97	66.2 Å²	66.2	45%	0.453	36%	0.363	S	S	.	.	H	α-helix	trans	-68.5	-40.6	176.9	-153.8	177.7	27.7	0	0	110.3	E669 L670 G677 V678 N679	E669-Q673 PolarHBondContact O-N 2.79Å; L670-Q673 PolarHBondContact O-N 2.82Å; Q673-G677 WeakPolarHBondContact O-CA 3.45Å; Q673-G677 PolarHBondContact O-N 2.79Å; Q673-V678 WeakPolarHBondContact CA-O 3.47Å; Q673-V678 PolarHBondContact N-O 2.77Å; Q673-N679 PolarHBondContact NE2-OD1 3.19Å
674	D	45.1	Very low	43.7	Very low	123 Å²	123	64.8 Å²	64.8	66%	0.658	36%	0.355	S	S	*	.	H	α-helix	trans	-71.8	-35.4	177.9	-69.3	-22.1	0	0	0	112.3	L670	L670-D674 WeakPolarHBondContact O-CA 3.12Å; L670-D674 WeakPolarHBondContact O-CB 3.28Å; L670-D674 PolarHBondContact O-N 2.76Å
675	V	43.5	Very low	44.3	Very low	36 Å²	36	65.3 Å²	65.3	22%	0.218	36%	0.358	C	S	.	.	H	α-helix	trans	-90.9	-38.4	-177	176.2	0	0	0	0	112.6	W671 S692 F695	W671-V675 HydrophobicContact CE3-CB 4.39Å; W671-V675 HydrophobicContact CE3-CG2 4.17Å; W671-V675 WeakPolarHBondContact O-CA 3.46Å; W671-V675 WeakPolarHBondContact O-CB 3.18Å; W671-V675 WeakPolarHBondContact O-CG2 3.49Å; W671-V675 PolarHBondContact O-N 3.27Å; V675-S692 PolarHBondContact O-OG 3.31Å; V675-F695 HydrophobicContact CG1-CD2 3.71Å; V675-F695 HydrophobicContact CG1-CE2 4.43Å
676	F	50	Low	44.9	Very low	36 Å²	36	66.3 Å²	66.3	16%	0.158	37%	0.374	C	S	.	.	H	α-helix	trans	-119	-9.8	-172.2	-55.9	-69.5	0	0	0	113.9	W671 I672 V678 I684 V689	W671-F676 HydrophobicContact CE3-CE2 4.31Å; W671-F676 HydrophobicContact CH2-CE2 4.17Å; W671-F676 HydrophobicContact CZ3-CD2 4.44Å; W671-F676 AromaticContact CZ3-CE2 3.58Å; W671-F676 HydrophobicContact CZ3-CE2 3.58Å; W671-F676 HydrophobicContact CZ3-CZ 4.36Å; I672-F676 HydrophobicContact CG2-CD2 4.08Å; I672-F676 CarbonylContact O-C 3Å; I672-F676 VanDerWaalsContact O-CA 3.3Å; I672-F676 WeakPolarHBondContact O-CA 3.4Å; I672-F676 VanDerWaalsContact O-CB 3.27Å; I672-F676 WeakPolarHBondContact O-CB 3.19Å; I672-F676 PolarHBondContact O-N 2.88Å; F676-V678 HydrophobicContact CB-CG2 3.86Å; F676-V678 PolarHBondContact O-N 2.91Å; F676-I684 HydrophobicContact CB-CG1 4.38Å; F676-I684 HydrophobicContact CD1-CG2 4.48Å; F676-I684 HydrophobicContact CD2-CD1 3.58Å; F676-I684 HydrophobicContact CD2-CG1 4.21Å; F676-I684 HydrophobicContact CE2-CD1 3.8Å; F676-I684 HydrophobicContact CG-CD1 4.12Å; F676-I684 HydrophobicContact CG-CG1 4.28Å; F676-V689 HydrophobicContact CE1-CB 4.32Å; F676-V689 HydrophobicContact CE1-CG1 4.1Å; F676-V689 HydrophobicContact CE1-CG2 4.31Å; F676-V689 HydrophobicContact CZ-CG1 4.24Å
677	G	52.6	Low	45.7	Very low	60 Å²	60	69.4 Å²	69.4	62%	0.619	39%	0.385	S	S	*	.	S	Bend	trans	67.9	21.4	-178.6	0	0	0	0	0	113.5	I672 Q673	I672-G677 PolarHBondContact O-N 3.01Å; Q673-G677 WeakPolarHBondContact O-CA 3.45Å; Q673-G677 PolarHBondContact O-N 2.79Å
678	V	52.4	Low	46.4	Very low	20 Å²	20	71 Å²	71	12%	0.121	39%	0.388	C	S	.	.			trans	-123	152.1	-177.4	-59.4	0	0	0	0	111.2	I672 Q673 F676 S680 Q683 I684	I672-V678 HydrophobicContact CG2-CG2 3.53Å; I672-V678 WeakPolarHBondContact CG2-O 3.32Å; Q673-V678 WeakPolarHBondContact CA-O 3.47Å; Q673-V678 PolarHBondContact N-O 2.77Å; F676-V678 HydrophobicContact CB-CG2 3.86Å; F676-V678 PolarHBondContact O-N 2.91Å; V678-S680 VanDerWaalsContact C-N 3.33Å; V678-S680 WeakPolarHBondContact CG2-O 3.45Å; V678-Q683 HydrophobicContact CB-CB 3.63Å; V678-Q683 HydrophobicContact CG1-CB 3.88Å; V678-Q683 HydrophobicContact CG2-CB 4.03Å; V678-I684 HydrophobicContact CG2-CD1 4.42Å; V678-I684 HydrophobicContact CG2-CG1 3.52Å
679	N	49.2	Very low	46.8	Very low	97 Å²	97	67.9 Å²	67.9	52%	0.519	38%	0.379	S	S	.	.	S	Bend	trans	-93.5	9.2	-172.5	-59.9	-19.3	0	0	0	112.8	Q673	Q673-N679 PolarHBondContact NE2-OD1 3.19Å
680	S	46.4	Very low	47.1	Very low	27 Å²	27	69.6 Å²	69.6	19%	0.189	39%	0.385	C	S	.	.	S	Bend	trans	-169.4	159.3	170.1	69.2	0	0	0	0	111.5	E669 V678 A682 Q683	E669-S680 WeakPolarHBondContact OE1-CA 3.32Å; V678-S680 VanDerWaalsContact C-N 3.33Å; V678-S680 WeakPolarHBondContact CG2-O 3.45Å; S680-A682 PolarHBondContact O-N 2.76Å; S680-A682 PolarHBondContact OG-N 2.89Å; S680-Q683 PolarHBondContact O-N 2.91Å; S680-Q683 VanDerWaalsContact O-N 3.12Å
681	F	46.5	Very low	47.4	Very low	90 Å²	90	69.9 Å²	69.9	40%	0.395	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-52.6	-34.1	170.6	-98.9	-78.2	0	0	0	113.4	W671 I672 Q683 I684	W671-F681 HydrophobicContact CH2-CE1 4.28Å; W671-F681 HydrophobicContact CH2-CE2 4.22Å; W671-F681 AromaticContact CH2-CZ 3.56Å; W671-F681 HydrophobicContact CH2-CZ 3.56Å; W671-F681 HydrophobicContact CZ2-CE1 4.46Å; W671-F681 AromaticContact CZ2-CE2 3.61Å; W671-F681 HydrophobicContact CZ2-CE2 3.61Å; W671-F681 AromaticContact CZ2-CZ 3.38Å; W671-F681 HydrophobicContact CZ2-CZ 3.38Å; I672-F681 HydrophobicContact CD1-CD2 3.16Å; I672-F681 HydrophobicContact CD1-CE2 3.38Å; I672-F681 HydrophobicContact CD1-CG 3.89Å; I672-F681 HydrophobicContact CD1-CZ 4.25Å; I672-F681 HydrophobicContact CG1-CD2 4.31Å; I672-F681 HydrophobicContact CG1-CE2 4.15Å; F681-Q683 PolarHBondContact O-N 2.93Å; F681-I684 HydrophobicContact CD1-CD1 3.65Å; F681-I684 HydrophobicContact CE1-CD1 4.07Å; F681-I684 HydrophobicContact CG-CD1 4.18Å; F681-I684 WeakPolarHBondContact O-CB 3.18Å; F681-I684 PolarHBondContact O-N 2.77Å
682	A	43.1	Very low	47.5	Very low	65 Å²	65	67.9 Å²	67.9	54%	0.537	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-64.7	-22.4	-177.7	0	0	0	0	0	113.3	S680	S680-A682 PolarHBondContact O-N 2.76Å; S680-A682 PolarHBondContact OG-N 2.89Å
683	Q	47.9	Very low	47.6	Very low	106 Å²	106	71.3 Å²	71.3	50%	0.495	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-86.8	-9.3	177.7	-68	179.5	-2.8	0	0	113.1	V678 S680 F681 S685	V678-Q683 HydrophobicContact CB-CB 3.63Å; V678-Q683 HydrophobicContact CG1-CB 3.88Å; V678-Q683 HydrophobicContact CG2-CB 4.03Å; S680-Q683 PolarHBondContact O-N 2.91Å; S680-Q683 VanDerWaalsContact O-N 3.12Å; F681-Q683 PolarHBondContact O-N 2.93Å; Q683-S685 PolarHBondContact O-N 2.9Å
684	I	51.1	Low	47.8	Very low	27 Å²	27	70.8 Å²	70.8	14%	0.138	42%	0.422	C	S	.	.			trans	-79.8	101	178	-54.3	175.7	0	0	0	108.3	I672 F676 V678 F681 A686 V689	I672-I684 HydrophobicContact CG2-CD1 3.87Å; I672-I684 HydrophobicContact CG2-CG1 4.28Å; F676-I684 HydrophobicContact CB-CG1 4.38Å; F676-I684 HydrophobicContact CD1-CG2 4.48Å; F676-I684 HydrophobicContact CD2-CD1 3.58Å; F676-I684 HydrophobicContact CD2-CG1 4.21Å; F676-I684 HydrophobicContact CE2-CD1 3.8Å; F676-I684 HydrophobicContact CG-CD1 4.12Å; F676-I684 HydrophobicContact CG-CG1 4.28Å; V678-I684 HydrophobicContact CG2-CD1 4.42Å; V678-I684 HydrophobicContact CG2-CG1 3.52Å; F681-I684 HydrophobicContact CD1-CD1 3.65Å; F681-I684 HydrophobicContact CE1-CD1 4.07Å; F681-I684 HydrophobicContact CG-CD1 4.18Å; F681-I684 WeakPolarHBondContact O-CB 3.18Å; F681-I684 PolarHBondContact O-N 2.77Å; I684-A686 PolarHBondContact O-N 3.03Å; I684-V689 HydrophobicContact CG2-CG2 3.18Å
685	S	49.7	Very low	47.8	Very low	52 Å²	52	65.9 Å²	65.9	36%	0.364	40%	0.395	S	S	.	.			trans	-68	134.6	167.3	75.1	0	0	0	0	108.9	Q683 D687 K688	Q683-S685 PolarHBondContact O-N 2.9Å; S685-D687 PolarHBondContact O-N 2.74Å; S685-K688 WeakPolarHBondContact O-CB 3.37Å; S685-K688 PolarHBondContact O-N 2.98Å; S685-K688 WeakPolarHBondContact OG-CG 3.46Å; S685-K688 PolarHBondContact OG-N 3.42Å
686	A	48.6	Very low	47.8	Very low	74 Å²	74	66.3 Å²	66.3	61%	0.612	40%	0.397	S	S	*	.	H	α-helix	trans	-48.6	-35.9	178.7	0	0	0	0	0	112.9	I684 K688 V689	I684-A686 PolarHBondContact O-N 3.03Å; A686-K688 VanDerWaalsContact C-N 3.31Å; A686-K688 PolarHBondContact O-N 2.98Å; A686-V689 PolarHBondContact O-N 2.54Å
687	D	48.7	Very low	47.5	Very low	141 Å²	141	73.5 Å²	73.5	75%	0.754	43%	0.428	S	S	*	.	H	α-helix	trans	-66.6	-25.9	177.8	-63.2	-29.3	0	0	0	114.2	S685 S691	S685-D687 PolarHBondContact O-N 2.74Å; D687-S691 WeakPolarHBondContact O-CB 3.5Å; D687-S691 PolarHBondContact O-OG 2.86Å
688	K	48.9	Very low	47	Very low	128 Å²	128	78.4 Å²	78.4	56%	0.557	43%	0.428	S	S	*	.	H	α-helix	trans	-84.9	-24.1	-179.4	-80.6	-177.5	-179.8	-178.6	0	113.5	S685 A686 F690 S691 S692	S685-K688 WeakPolarHBondContact O-CB 3.37Å; S685-K688 PolarHBondContact O-N 2.98Å; S685-K688 WeakPolarHBondContact OG-CG 3.46Å; S685-K688 PolarHBondContact OG-N 3.42Å; A686-K688 VanDerWaalsContact C-N 3.31Å; A686-K688 PolarHBondContact O-N 2.98Å; K688-F690 PolarHBondContact O-N 2.91Å; K688-S691 WeakPolarHBondContact CA-OG 3.48Å; K688-S691 PolarHBondContact O-N 2.84Å; K688-S692 PolarHBondContact O-N 3.34Å; K688-S692 VanDerWaalsContact O-N 3.09Å
689	V	48.9	Very low	46.8	Very low	23 Å²	23	81.5 Å²	81.5	14%	0.139	44%	0.438	C	S	.	.	H	α-helix	trans	-58.3	-43	179	179.8	0	0	0	0	110.5	F676 I684 A686 L710	F676-V689 HydrophobicContact CE1-CB 4.32Å; F676-V689 HydrophobicContact CE1-CG1 4.1Å; F676-V689 HydrophobicContact CE1-CG2 4.31Å; F676-V689 HydrophobicContact CZ-CG1 4.24Å; I684-V689 HydrophobicContact CG2-CG2 3.18Å; A686-V689 PolarHBondContact O-N 2.54Å; V689-L710 HydrophobicContact CG1-CD1 4.18Å
690	F	47.5	Very low	46.3	Very low	115 Å²	115	83.7 Å²	83.7	50%	0.504	44%	0.443	S	S	.	.	H	α-helix	trans	-90.7	-15.5	-176.9	-61.5	-78.1	0	0	0	113.4	K688 V696 E707	K688-F690 PolarHBondContact O-N 2.91Å; F690-V696 VanDerWaalsContact O-CG2 3.24Å; F690-V696 WeakPolarHBondContact O-CG2 3.11Å; F690-E707 HydrophobicContact CE1-CG 4.24Å; F690-E707 HydrophobicContact CZ-CG 4.21Å
691	S	44.5	Very low	46.1	Very low	82 Å²	82	91.4 Å²	91.4	57%	0.573	48%	0.476	S	S	*	.	H	α-helix	trans	-98.5	-11.4	-178.4	83.6	0	0	0	0	114.6	D687 K688 A693	D687-S691 WeakPolarHBondContact O-CB 3.5Å; D687-S691 PolarHBondContact O-OG 2.86Å; K688-S691 WeakPolarHBondContact CA-OG 3.48Å; K688-S691 PolarHBondContact O-N 2.84Å; S691-A693 PolarHBondContact O-N 3.25Å; S691-A693 VanDerWaalsContact O-N 3.11Å
692	S	48.2	Very low	46	Very low	25 Å²	25	90.9 Å²	90.9	18%	0.175	48%	0.477	C	S	.	.			trans	-57.8	114.2	177.7	162.7	0	0	0	0	110.5	V675 K688 V694 F695 V696	V675-S692 PolarHBondContact O-OG 3.31Å; K688-S692 PolarHBondContact O-N 3.34Å; K688-S692 VanDerWaalsContact O-N 3.09Å; S692-V694 PolarHBondContact O-N 3.48Å; S692-V694 VanDerWaalsContact O-N 3.1Å; S692-V694 PolarHBondContact OG-N 2.98Å; S692-F695 PolarHBondContact O-N 2.87Å; S692-F695 VanDerWaalsContact O-N 3.09Å; S692-F695 PolarHBondContact OG-N 3.32Å; S692-V696 WeakPolarHBondContact O-CB 3.48Å; S692-V696 WeakPolarHBondContact O-CG2 3.46Å; S692-V696 PolarHBondContact O-N 3.46Å
693	A	44.2	Very low	46.1	Very low	74 Å²	74	91 Å²	91	61%	0.612	47%	0.473	S	S	*	.	H	α-helix	trans	-59.7	-22.4	179	0	0	0	0	0	112.9	S691 K697	S691-A693 PolarHBondContact O-N 3.25Å; S691-A693 VanDerWaalsContact O-N 3.11Å; A693-K697 WeakPolarHBondContact O-CB 3.24Å; A693-K697 WeakPolarHBondContact O-CG 3.42Å; A693-K697 PolarHBondContact O-N 3.36Å
694	V	47.2	Very low	45.9	Very low	86 Å²	86	92.2 Å²	92.2	52%	0.521	48%	0.483	S	S	.	.	H	α-helix	trans	-76.2	-46.4	175.1	-179.9	0	0	0	0	110.5	S692 K697 R698	S692-V694 PolarHBondContact O-N 3.48Å; S692-V694 VanDerWaalsContact O-N 3.1Å; S692-V694 PolarHBondContact OG-N 2.98Å; V694-K697 PolarHBondContact O-N 3.45Å; V694-R698 WeakPolarHBondContact O-CB 3.1Å; V694-R698 PolarHBondContact O-N 3.45Å
695	F	44.1	Very low	46	Very low	20 Å²	20	100.7 Å²	100.7	9%	0.088	51%	0.514	C	S	.	.	H	α-helix	trans	-63	-45.2	175.6	-163.6	-95.5	0	0	0	111.1	V675 S692 Y699 M706 L710	V675-F695 HydrophobicContact CG1-CD2 3.71Å; V675-F695 HydrophobicContact CG1-CE2 4.43Å; S692-F695 PolarHBondContact O-N 2.87Å; S692-F695 VanDerWaalsContact O-N 3.09Å; S692-F695 PolarHBondContact OG-N 3.32Å; F695-Y699 HydrophobicContact CD2-CD2 4.46Å; F695-Y699 WeakPolarHBondContact O-CB 3.03Å; F695-Y699 PolarHBondContact O-N 2.85Å; F695-M706 HydrophobicContact CE1-CE 4.46Å; F695-M706 HydrophobicContact CE2-CE 3.62Å; F695-M706 HydrophobicContact CZ-CE 3.45Å; F695-M706 VanDerWaalsContact CZ-CE 3.45Å; F695-M706 HydrophobicContact CZ-SD 4.23Å; F695-L710 HydrophobicContact CE1-CD1 4.34Å; F695-L710 HydrophobicContact CE2-CD1 4.35Å; F695-L710 HydrophobicContact CZ-CD1 3.62Å
696	V	43.6	Very low	46.2	Very low	45 Å²	45	99.6 Å²	99.6	27%	0.273	50%	0.503	S	S	.	.	H	α-helix	trans	-70.3	-34.7	178.7	177.9	0	0	0	0	112.1	F690 S692 K700	F690-V696 VanDerWaalsContact O-CG2 3.24Å; F690-V696 WeakPolarHBondContact O-CG2 3.11Å; S692-V696 WeakPolarHBondContact O-CB 3.48Å; S692-V696 WeakPolarHBondContact O-CG2 3.46Å; S692-V696 PolarHBondContact O-N 3.46Å; V696-K700 HydrophobicContact CG1-CD 3.83Å; V696-K700 HydrophobicContact CG1-CG 3.8Å; V696-K700 WeakPolarHBondContact O-CA 3.43Å; V696-K700 WeakPolarHBondContact O-CB 3.46Å; V696-K700 WeakPolarHBondContact O-CG 3.38Å; V696-K700 PolarHBondContact O-N 3.31Å; V696-K700 VanDerWaalsContact O-N 3.15Å
697	K	44.2	Very low	46.8	Very low	187 Å²	187	99.3 Å²	99.3	81%	0.813	49%	0.489	S	S	*	.	H	α-helix	trans	-72.9	-39.3	176.3	-94.3	-177	170.4	179.4	0	113.1	A693 V694	A693-K697 WeakPolarHBondContact O-CB 3.24Å; A693-K697 WeakPolarHBondContact O-CG 3.42Å; A693-K697 PolarHBondContact O-N 3.36Å; V694-K697 PolarHBondContact O-N 3.45Å
698	R	43.1	Very low	47.5	Very low	163 Å²	163	95.4 Å²	95.4	62%	0.615	47%	0.473	S	S	*	.	H	α-helix	trans	-84.2	-25.7	-173.7	-153.4	165.1	-174.2	145.7	-2	112.6	V694	V694-R698 WeakPolarHBondContact O-CB 3.1Å; V694-R698 PolarHBondContact O-N 3.45Å
699	Y	47.4	Very low	48.2	Very low	85 Å²	85	95 Å²	95	33%	0.333	47%	0.468	S	S	.	.	H	α-helix	trans	-130.9	18.8	-172.9	-57.9	-72.8	0	0	0	114.8	F695 H701 L702 S703 M706	F695-Y699 HydrophobicContact CD2-CD2 4.46Å; F695-Y699 WeakPolarHBondContact O-CB 3.03Å; F695-Y699 PolarHBondContact O-N 2.85Å; Y699-H701 PolarHBondContact O-N 2.82Å; Y699-L702 HydrophobicContact CD1-CD1 3.79Å; Y699-L702 WeakPolarHBondContact O-CA 3.44Å; Y699-L702 WeakPolarHBondContact O-CB 3.35Å; Y699-L702 PolarHBondContact O-N 3.01Å; Y699-S703 PolarHBondContact O-N 2.72Å; Y699-M706 WeakPolarHBondContact CB-SD 3.41Å; Y699-M706 HydrophobicContact CD1-CE 4.13Å; Y699-M706 HydrophobicContact CD1-SD 3.47Å; Y699-M706 WeakPolarHBondContact CD1-SD 3.13Å; Y699-M706 HydrophobicContact CD2-CE 4Å; Y699-M706 HydrophobicContact CD2-SD 4.08Å; Y699-M706 HydrophobicContact CE1-CE 4.47Å; Y699-M706 HydrophobicContact CE1-SD 4.28Å; Y699-M706 HydrophobicContact CE2-CE 4.35Å; Y699-M706 HydrophobicContact CG-CE 3.88Å; Y699-M706 HydrophobicContact CG-SD 3.35Å
700	K	38.2	Very low	48.9	Very low	143 Å²	143	95.2 Å²	95.2	62%	0.622	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-52.3	-33.5	-179.2	-134.6	170.2	178.2	-179.7	0	114.5	V696 L702	V696-K700 HydrophobicContact CG1-CD 3.83Å; V696-K700 HydrophobicContact CG1-CG 3.8Å; V696-K700 WeakPolarHBondContact O-CA 3.43Å; V696-K700 WeakPolarHBondContact O-CB 3.46Å; V696-K700 WeakPolarHBondContact O-CG 3.38Å; V696-K700 PolarHBondContact O-N 3.31Å; V696-K700 VanDerWaalsContact O-N 3.15Å; K700-L702 VanDerWaalsContact C-N 3.29Å
701	H	42.1	Very low	49.9	Very low	188 Å²	188	95 Å²	95	87%	0.87	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-83.8	-6.7	-178.3	-49.4	-60.8	0	0	0	113	Y699	Y699-H701 PolarHBondContact O-N 2.82Å
702	L	44.1	Very low	51	Low	79 Å²	79	93.5 Å²	93.5	41%	0.414	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-112.1	2.5	-173.7	-80.3	154	0	0	0	113.3	Y699 K700 N704 R705 M706	Y699-L702 HydrophobicContact CD1-CD1 3.79Å; Y699-L702 WeakPolarHBondContact O-CA 3.44Å; Y699-L702 WeakPolarHBondContact O-CB 3.35Å; Y699-L702 PolarHBondContact O-N 3.01Å; K700-L702 VanDerWaalsContact C-N 3.29Å; L702-N704 VanDerWaalsContact C-N 3.27Å; L702-N704 PolarHBondContact O-N 3.13Å; L702-R705 PolarHBondContact O-N 3.35Å; L702-M706 HydrophobicContact CB-CG 4.08Å; L702-M706 HydrophobicContact CB-SD 4.06Å; L702-M706 PolarHBondContact O-N 2.79Å
703	S	45.4	Very low	52.1	Low	67 Å²	67	96.2 Å²	96.2	47%	0.469	46%	0.459	S	S	.	.	H	α-helix	trans	-51.7	-41.4	-166.9	80.8	0	0	0	0	113.7	Y699 E707	Y699-S703 PolarHBondContact O-N 2.72Å; S703-E707 WeakPolarHBondContact O-CB 3.44Å; S703-E707 PolarHBondContact O-N 3.42Å
704	N	45.1	Very low	53.8	Low	132 Å²	132	97 Å²	97	71%	0.706	45%	0.453	S	S	*	.	H	α-helix	trans	-73.2	-31.8	-178.9	-67.2	-6.5	0	0	0	113.4	L702	L702-N704 VanDerWaalsContact C-N 3.27Å; L702-N704 PolarHBondContact O-N 3.13Å
705	R	52.6	Low	55.5	Low	205 Å²	205	95.6 Å²	95.6	77%	0.774	44%	0.444	S	S	*	.	H	α-helix	trans	-81.1	-38.2	177.7	-77.6	-171.6	174.4	-172.9	-1.3	111.8	L702 S708 W709	L702-R705 PolarHBondContact O-N 3.35Å; R705-S708 PolarHBondContact O-N 2.88Å; R705-W709 PolarHBondContact O-N 2.74Å
706	M	53.4	Low	57.6	Low	30 Å²	30	98.8 Å²	98.8	15%	0.148	46%	0.459	C	S	.	.	H	α-helix	trans	-71.4	-33.2	178.1	-78.4	-175	81	0	0	113	F695 Y699 L702 S708 W709 L710	F695-M706 HydrophobicContact CE1-CE 4.46Å; F695-M706 HydrophobicContact CE2-CE 3.62Å; F695-M706 HydrophobicContact CZ-CE 3.45Å; F695-M706 VanDerWaalsContact CZ-CE 3.45Å; F695-M706 HydrophobicContact CZ-SD 4.23Å; Y699-M706 WeakPolarHBondContact CB-SD 3.41Å; Y699-M706 HydrophobicContact CD1-CE 4.13Å; Y699-M706 HydrophobicContact CD1-SD 3.47Å; Y699-M706 WeakPolarHBondContact CD1-SD 3.13Å; Y699-M706 HydrophobicContact CD2-CE 4Å; Y699-M706 HydrophobicContact CD2-SD 4.08Å; Y699-M706 HydrophobicContact CE1-CE 4.47Å; Y699-M706 HydrophobicContact CE1-SD 4.28Å; Y699-M706 HydrophobicContact CE2-CE 4.35Å; Y699-M706 HydrophobicContact CG-CE 3.88Å; Y699-M706 HydrophobicContact CG-SD 3.35Å; L702-M706 HydrophobicContact CB-CG 4.08Å; L702-M706 HydrophobicContact CB-SD 4.06Å; L702-M706 PolarHBondContact O-N 2.79Å; M706-S708 VanDerWaalsContact C-N 3.32Å; M706-S708 PolarHBondContact O-N 3.05Å; M706-W709 PolarHBondContact O-N 3Å; M706-L710 VanDerWaalsContact O-CB 3.29Å; M706-L710 WeakPolarHBondContact O-CB 3.34Å; M706-L710 WeakPolarHBondContact O-CG 3.06Å; M706-L710 PolarHBondContact O-N 3.37Å
707	E	60.7	Low	59.6	Low	68 Å²	68	101.3 Å²	101.3	32%	0.318	47%	0.471	S	S	.	.	H	α-helix	trans	-61.4	-43.8	174.7	-170.7	-172.8	156.2	0	0	111.1	F690 S703 W709 L710 K711	F690-E707 HydrophobicContact CE1-CG 4.24Å; F690-E707 HydrophobicContact CZ-CG 4.21Å; S703-E707 WeakPolarHBondContact O-CB 3.44Å; S703-E707 PolarHBondContact O-N 3.42Å; E707-W709 VanDerWaalsContact C-N 3.32Å; E707-W709 PolarHBondContact O-N 3.4Å; E707-L710 PolarHBondContact O-N 2.69Å; E707-K711 HydrophobicContact CG-CD 4.38Å; E707-K711 WeakPolarHBondContact O-CB 3.36Å; E707-K711 VanDerWaalsContact O-CG 3.27Å; E707-K711 WeakPolarHBondContact O-CG 3.15Å; E707-K711 PolarHBondContact O-N 3.32Å; E707-K711 WeakPolarHBondContact OE1-CE 3.38Å; E707-K711 IonicContact OE1-NZ 3.66Å; E707-K711 PolarHBondContact OE1-NZ 3.41Å
708	S	64.8	Low	61.7	Low	59 Å²	59	100.1 Å²	100.1	41%	0.413	46%	0.462	S	S	.	.	H	α-helix	trans	-59.4	-43.2	174.6	-169.6	0	0	0	0	111.9	R705 M706	R705-S708 PolarHBondContact O-N 2.88Å; M706-S708 VanDerWaalsContact C-N 3.32Å; M706-S708 PolarHBondContact O-N 3.05Å
709	W	62.6	Low	63.2	Low	120 Å²	120	93.5 Å²	93.5	46%	0.455	44%	0.442	S	S	.	.	H	α-helix	trans	-68.6	-44.7	177.8	-176.7	81.3	0	0	0	112.7	R705 M706 E707 K711 K712 F713	R705-W709 PolarHBondContact O-N 2.74Å; M706-W709 PolarHBondContact O-N 3Å; E707-W709 VanDerWaalsContact C-N 3.32Å; E707-W709 PolarHBondContact O-N 3.4Å; W709-K711 VanDerWaalsContact C-N 3.32Å; W709-K711 PolarHBondContact O-N 3.11Å; W709-K712 VanDerWaalsContact O-CB 3.28Å; W709-K712 WeakPolarHBondContact O-CB 3.36Å; W709-K712 PolarHBondContact O-N 3.41Å; W709-K712 VanDerWaalsContact O-N 3.13Å; W709-F713 AromaticContact CD2-CE2 3.98Å; W709-F713 HydrophobicContact CD2-CE2 3.98Å; W709-F713 AromaticContact CE2-CE2 3.71Å; W709-F713 HydrophobicContact CE3-CE2 4.02Å; W709-F713 AromaticContact CH2-CE2 3.61Å; W709-F713 HydrophobicContact CH2-CE2 3.61Å; W709-F713 AromaticContact CH2-CZ 3.9Å; W709-F713 HydrophobicContact CH2-CZ 3.9Å; W709-F713 AromaticContact CZ2-CE2 3.54Å; W709-F713 HydrophobicContact CZ2-CE2 3.54Å; W709-F713 AromaticContact CZ2-CZ 3.71Å; W709-F713 HydrophobicContact CZ2-CZ 3.71Å; W709-F713 AromaticContact CZ3-CE2 3.85Å; W709-F713 HydrophobicContact CZ3-CE2 3.85Å
710	L	64.1	Low	64.5	Low	26 Å²	26	95.6 Å²	95.6	14%	0.136	46%	0.459	C	S	.	.	H	α-helix	trans	-62.9	-37.1	177.6	-79.2	175.1	0	0	0	112.2	V689 F695 M706 E707 K712 F713	V689-L710 HydrophobicContact CG1-CD1 4.18Å; F695-L710 HydrophobicContact CE1-CD1 4.34Å; F695-L710 HydrophobicContact CE2-CD1 4.35Å; F695-L710 HydrophobicContact CZ-CD1 3.62Å; M706-L710 VanDerWaalsContact O-CB 3.29Å; M706-L710 WeakPolarHBondContact O-CB 3.34Å; M706-L710 WeakPolarHBondContact O-CG 3.06Å; M706-L710 PolarHBondContact O-N 3.37Å; E707-L710 PolarHBondContact O-N 2.69Å; L710-K712 PolarHBondContact O-N 2.9Å; L710-K712 VanDerWaalsContact O-N 3.14Å; L710-F713 WeakPolarHBondContact O-CB 3.43Å; L710-F713 PolarHBondContact O-N 2.86Å
711	K	68.7	Low	66.4	Low	111 Å²	111	93.8 Å²	93.8	48%	0.483	46%	0.464	S	S	.	.	H	α-helix	trans	-58.2	-24.7	175.6	-80.8	174.9	-179.8	169.8	0	112.9	E707 W709 F713 L714	E707-K711 HydrophobicContact CG-CD 4.38Å; E707-K711 WeakPolarHBondContact O-CB 3.36Å; E707-K711 VanDerWaalsContact O-CG 3.27Å; E707-K711 WeakPolarHBondContact O-CG 3.15Å; E707-K711 PolarHBondContact O-N 3.32Å; E707-K711 WeakPolarHBondContact OE1-CE 3.38Å; E707-K711 IonicContact OE1-NZ 3.66Å; E707-K711 PolarHBondContact OE1-NZ 3.41Å; W709-K711 VanDerWaalsContact C-N 3.32Å; W709-K711 PolarHBondContact O-N 3.11Å; K711-F713 PolarHBondContact O-N 3.06Å; K711-L714 HydrophobicContact CG-CD1 4.46Å; K711-L714 PolarHBondContact O-N 2.81Å
712	K	68.1	Low	68.3	Low	50 Å²	50	87 Å²	87	22%	0.217	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-25.5	174.2	-59.5	-176.5	-176.6	174.7	0	113	E644 W709 L710	E644-K712 IonicContact OE2-NZ 3.58Å; E644-K712 PolarHBondContact OE2-NZ 3.01Å; W709-K712 VanDerWaalsContact O-CB 3.28Å; W709-K712 WeakPolarHBondContact O-CB 3.36Å; W709-K712 PolarHBondContact O-N 3.41Å; W709-K712 VanDerWaalsContact O-N 3.13Å; L710-K712 PolarHBondContact O-N 2.9Å; L710-K712 VanDerWaalsContact O-N 3.14Å
713	F	70.1	Confident	70.5	Confident	82 Å²	82	84.8 Å²	84.8	36%	0.36	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-10.6	177.4	-63.5	-87.2	0	0	0	113.2	W709 L710 K711 V715	W709-F713 AromaticContact CD2-CE2 3.98Å; W709-F713 HydrophobicContact CD2-CE2 3.98Å; W709-F713 AromaticContact CE2-CE2 3.71Å; W709-F713 HydrophobicContact CE3-CE2 4.02Å; W709-F713 AromaticContact CH2-CE2 3.61Å; W709-F713 HydrophobicContact CH2-CE2 3.61Å; W709-F713 AromaticContact CH2-CZ 3.9Å; W709-F713 HydrophobicContact CH2-CZ 3.9Å; W709-F713 AromaticContact CZ2-CE2 3.54Å; W709-F713 HydrophobicContact CZ2-CE2 3.54Å; W709-F713 AromaticContact CZ2-CZ 3.71Å; W709-F713 HydrophobicContact CZ2-CZ 3.71Å; W709-F713 AromaticContact CZ3-CE2 3.85Å; W709-F713 HydrophobicContact CZ3-CE2 3.85Å; L710-F713 WeakPolarHBondContact O-CB 3.43Å; L710-F713 PolarHBondContact O-N 2.86Å; K711-F713 PolarHBondContact O-N 3.06Å; F713-V715 PolarHBondContact O-N 3.32Å
714	L	80.5	Confident	72.7	Confident	92 Å²	92	82.7 Å²	82.7	48%	0.482	41%	0.409	S	S	.	.			trans	-81.2	67.5	171.5	-57.2	-178.6	0	0	0	109.5	K711 E716 D717	K711-L714 HydrophobicContact CG-CD1 4.46Å; K711-L714 PolarHBondContact O-N 2.81Å; L714-E716 PolarHBondContact O-N 3.08Å; L714-D717 HydrophobicContact CB-CB 4.34Å; L714-D717 WeakPolarHBondContact O-CB 3.32Å; L714-D717 PolarHBondContact O-N 2.89Å
715	V	83.1	Confident	74.9	Confident	56 Å²	56	76.6 Å²	76.6	34%	0.339	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-16	-166.4	-64.3	0	0	0	0	115.2	C632 K635 F713	C632-V715 VanDerWaalsContact SG-CG2 3.56Å; K635-V715 WeakPolarHBondContact CD-O 3.12Å; K635-V715 PolarHBondContact NZ-O 3.18Å; F713-V715 PolarHBondContact O-N 3.32Å
716	E	87.7	Confident	76.8	Confident	87 Å²	87	70 Å²	70	41%	0.407	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-27.3	173.2	-68.8	-168	-145.5	0	0	112.6	L628 L714 S724 Y725	L628-E716 HydrophobicContact CD1-CG 3.74Å; L714-E716 PolarHBondContact O-N 3.08Å; E716-S724 CarbonylContact O-C 3.5Å; E716-S724 WeakPolarHBondContact O-CA 3.41Å; E716-S724 WeakPolarHBondContact O-CB 3.26Å; E716-Y725 PolarHBondContact O-N 3.15Å
717	D	86.5	Confident	78.6	Confident	98 Å²	98	72.2 Å²	72.2	52%	0.524	37%	0.368	S	S	.	.	S	Bend	trans	-76.8	159.4	-179.5	-71.5	-23.6	0	0	0	111.9	K635 L714 A719	K635-D717 PolarHBondContact NZ-O 2.82Å; L714-D717 HydrophobicContact CB-CB 4.34Å; L714-D717 WeakPolarHBondContact O-CB 3.32Å; L714-D717 PolarHBondContact O-N 2.89Å; D717-A719 PolarHBondContact O-N 2.96Å
718	R	87	Confident	80.1	Confident	162 Å²	162	69.2 Å²	69.2	61%	0.611	35%	0.354	S	S	*	.			trans	-65.8	130.4	174.5	-170.9	172.5	177.5	149.1	-5.1	109.9	H722 E727	R718-H722 WeakPolarHBondContact CG-O 3.48Å; R718-E727 IonicContact CZ-OE1 3.99Å; R718-E727 IonicContact NH1-OE1 2.75Å; R718-E727 PolarHBondContact NH1-OE1 2.79Å; R718-E727 IonicContact NH1-OE2 2.9Å
719	A	75.4	Confident	81.4	Confident	24 Å²	24	66.6 Å²	66.6	20%	0.198	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-132.4	122.1	-179.9	0	0	0	0	0	109.9	D717 S721 H722	D717-A719 PolarHBondContact O-N 2.96Å; A719-S721 PolarHBondContact O-N 2.9Å; A719-H722 PolarHBondContact N-O 3.47Å; A719-H722 WeakPolarHBondContact O-CA 3.45Å; A719-H722 WeakPolarHBondContact O-CB 3.35Å; A719-H722 PolarHBondContact O-N 3.17Å
720	D	73.3	Confident	82.8	Confident	129 Å²	129	63.6 Å²	63.6	69%	0.69	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.9	-117.3	-177.1	-62.2	-31.7	0	0	0	113.1
721	S	78.5	Confident	84.2	Confident	105 Å²	105	66.3 Å²	66.3	73%	0.734	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-3.4	176.7	52.7	0	0	0	0	114.3	A719	A719-S721 PolarHBondContact O-N 2.9Å
722	H	82.8	Confident	85.3	Confident	44 Å²	44	61 Å²	61	20%	0.204	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-92.1	136.4	-176	-64.7	-75.1	0	0	0	112.2	F634 K635 R718 A719	F634-H722 PolarHBondContact O-CE1 2.84Å; F634-H722 PolarHBondContact O-NE2 2.93Å; K635-H722 HydrophobicContact CD-CB 4.44Å; K635-H722 HydrophobicContact CG-CB 3.71Å; R718-H722 WeakPolarHBondContact CG-O 3.48Å; A719-H722 PolarHBondContact N-O 3.47Å; A719-H722 WeakPolarHBondContact O-CA 3.45Å; A719-H722 WeakPolarHBondContact O-CB 3.35Å; A719-H722 PolarHBondContact O-N 3.17Å
723	P	89.1	Confident	86.5	Confident	34 Å²	34	59.6 Å²	59.6	22%	0.221	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-66.3	153.6	-178	27.3	-34	0	0	0	112.5	N631 K635 E727 F728	N631-P723 PolarHBondContact ND2-O 3.04Å; N631-P723 VanDerWaalsContact ND2-O 3.12Å; N631-P723 PolarHBondContact OD1-O 3.36Å; K635-P723 WeakPolarHBondContact CE-O 3.29Å; K635-P723 PolarHBondContact NZ-O 3.32Å; P723-E727 VanDerWaalsContact CA-OE2 3.29Å; P723-E727 WeakPolarHBondContact CA-OE2 3.37Å; P723-E727 HydrophobicContact CB-CB 3.56Å; P723-F728 HydrophobicContact CB-CB 4.45Å; P723-F728 HydrophobicContact CG-CB 4.09Å; P723-F728 HydrophobicContact CG-CD2 4.01Å
724	S	91.7	Very high	87.6	Confident	23 Å²	23	61.9 Å²	61.9	16%	0.161	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-61.3	165.6	162.8	73.9	0	0	0	0	110.8	E716 V726 E727 F728	E716-S724 CarbonylContact O-C 3.5Å; E716-S724 WeakPolarHBondContact O-CA 3.41Å; E716-S724 WeakPolarHBondContact O-CB 3.26Å; S724-V726 VanDerWaalsContact C-N 3.27Å; S724-V726 PolarHBondContact O-N 2.91Å; S724-E727 PolarHBondContact N-OE2 3.4Å; S724-E727 PolarHBondContact O-N 3.36Å; S724-E727 WeakPolarHBondContact OG-CG 3.3Å; S724-E727 PolarHBondContact OG-N 3.14Å; S724-F728 WeakPolarHBondContact O-CB 3.48Å; S724-F728 PolarHBondContact O-N 2.77Å
725	Y	92	Very high	88.1	Confident	3 Å²	3	60.6 Å²	60.6	1%	0.012	32%	0.319	C	S	.	.	H	α-helix	trans	-57.3	-41.5	176.3	175.3	-145.6	0	0	0	112.1	M96 P97 P627 L628 N631 E716 F728 L729	M96-Y725 HydrophobicContact CE-CD1 3.37Å; M96-Y725 HydrophobicContact CE-CE1 3.4Å; M96-Y725 VanDerWaalsContact CE-CE1 3.4Å; M96-Y725 HydrophobicContact CE-CG 4.12Å; P97-Y725 PolarHBondContact O-OH 3.19Å; P627-Y725 HydrophobicContact CB-CE2 4.31Å; L628-Y725 HydrophobicContact CB-CD2 4.09Å; L628-Y725 HydrophobicContact CB-CE1 4.42Å; L628-Y725 HydrophobicContact CB-CE2 3.67Å; L628-Y725 HydrophobicContact CD1-CD1 4.06Å; L628-Y725 HydrophobicContact CD1-CD2 4.03Å; L628-Y725 HydrophobicContact CD1-CE1 4.41Å; L628-Y725 HydrophobicContact CD1-CE2 4.4Å; L628-Y725 HydrophobicContact CD1-CG 3.88Å; N631-Y725 PolarHBondContact ND2-N 2.79Å; E716-Y725 PolarHBondContact O-N 3.15Å; Y725-F728 PolarHBondContact O-N 3.38Å; Y725-L729 HydrophobicContact CD2-CD1 4.17Å; Y725-L729 HydrophobicContact CD2-CG 3.95Å; Y725-L729 HydrophobicContact CE1-CD1 4.25Å; Y725-L729 HydrophobicContact CE2-CD1 3.68Å; Y725-L729 HydrophobicContact CE2-CD2 3.8Å; Y725-L729 HydrophobicContact CE2-CG 3.54Å; Y725-L729 WeakPolarHBondContact O-CG 3.47Å; Y725-L729 PolarHBondContact O-N 2.87Å
726	V	91.9	Very high	88.6	Confident	67 Å²	67	58.1 Å²	58.1	41%	0.406	30%	0.303	S	S	.	.	H	α-helix	trans	-62.6	-45	177	-176.1	0	0	0	0	111.6	M96 S724 F728 L729 C730	M96-V726 HydrophobicContact CE-CG2 3.74Å; M96-V726 HydrophobicContact SD-CG2 3.82Å; S724-V726 VanDerWaalsContact C-N 3.27Å; S724-V726 PolarHBondContact O-N 2.91Å; V726-F728 VanDerWaalsContact C-N 3.32Å; V726-F728 PolarHBondContact O-N 3.26Å; V726-L729 PolarHBondContact O-N 2.92Å; V726-C730 PolarHBondContact O-N 3.13Å; V726-C730 VanDerWaalsContact O-N 3.13Å; V726-C730 PolarHBondContact O-SG 3.23Å
727	E	92.4	Very high	88.8	Confident	76 Å²	76	59.6 Å²	59.6	36%	0.355	31%	0.305	S	S	.	.	H	α-helix	trans	-63	-40.7	177.3	-73.2	173.4	150.8	0	0	110.9	R718 P723 S724 C730 L731	R718-E727 IonicContact CZ-OE1 3.99Å; R718-E727 IonicContact NH1-OE1 2.75Å; R718-E727 PolarHBondContact NH1-OE1 2.79Å; R718-E727 IonicContact NH1-OE2 2.9Å; P723-E727 VanDerWaalsContact CA-OE2 3.29Å; P723-E727 WeakPolarHBondContact CA-OE2 3.37Å; P723-E727 HydrophobicContact CB-CB 3.56Å; S724-E727 PolarHBondContact N-OE2 3.4Å; S724-E727 PolarHBondContact O-N 3.36Å; S724-E727 WeakPolarHBondContact OG-CG 3.3Å; S724-E727 PolarHBondContact OG-N 3.14Å; E727-C730 WeakPolarHBondContact O-CB 3.31Å; E727-C730 PolarHBondContact O-N 3.19Å; E727-L731 PolarHBondContact O-N 2.66Å; E727-L731 VanDerWaalsContact O-N 3.09Å
728	F	92.2	Very high	89.1	Confident	5 Å²	5	59 Å²	59	2%	0.022	30%	0.302	C	S	.	.	H	α-helix	trans	-67.7	-39.1	177.7	-169	-106.1	0	0	0	112.7	T594 P627 I630 N631 F634 P723 S724 Y725 V726 C730 L731 I732	T594-F728 HydrophobicContact CG2-CE2 4.47Å; T594-F728 HydrophobicContact CG2-CZ 4.5Å; P627-F728 HydrophobicContact CB-CD1 4.24Å; P627-F728 HydrophobicContact CB-CE1 4.3Å; P627-F728 WeakPolarHBondContact O-CD1 3.49Å; P627-F728 WeakPolarHBondContact O-CE1 3.22Å; I630-F728 HydrophobicContact CB-CE1 4.18Å; I630-F728 HydrophobicContact CB-CZ 4.35Å; I630-F728 HydrophobicContact CG2-CE1 4.04Å; I630-F728 HydrophobicContact CG2-CZ 3.7Å; N631-F728 HydrophobicContact CB-CB 4.21Å; N631-F728 HydrophobicContact CB-CD1 3.77Å; N631-F728 HydrophobicContact CB-CE1 4.27Å; N631-F728 HydrophobicContact CB-CG 3.9Å; F634-F728 HydrophobicContact CD2-CE2 4.13Å; F634-F728 HydrophobicContact CD2-CZ 4.31Å; F634-F728 AromaticContact CE2-CE2 4Å; F634-F728 HydrophobicContact CE2-CE2 4Å; F634-F728 AromaticContact CE2-CZ 3.99Å; F634-F728 HydrophobicContact CE2-CZ 3.99Å; P723-F728 HydrophobicContact CB-CB 4.45Å; P723-F728 HydrophobicContact CG-CB 4.09Å; P723-F728 HydrophobicContact CG-CD2 4.01Å; S724-F728 WeakPolarHBondContact O-CB 3.48Å; S724-F728 PolarHBondContact O-N 2.77Å; Y725-F728 PolarHBondContact O-N 3.38Å; V726-F728 VanDerWaalsContact C-N 3.32Å; V726-F728 PolarHBondContact O-N 3.26Å; F728-C730 VanDerWaalsContact C-N 3.3Å; F728-C730 PolarHBondContact O-N 3.08Å; F728-L731 HydrophobicContact CE2-CD2 4.44Å; F728-L731 WeakPolarHBondContact O-CB 3.04Å; F728-L731 PolarHBondContact O-N 2.75Å; F728-L731 VanDerWaalsContact O-N 3.16Å; F728-I732 HydrophobicContact CD1-CG1 4.02Å; F728-I732 HydrophobicContact CE1-CD1 4Å; F728-I732 HydrophobicContact CE1-CG1 3.62Å; F728-I732 HydrophobicContact CZ-CD1 3.89Å; F728-I732 HydrophobicContact CZ-CG1 3.91Å; F728-I732 WeakPolarHBondContact O-CG1 3.36Å; F728-I732 PolarHBondContact O-N 2.95Å
729	L	92.6	Very high	89.3	Confident	5 Å²	5	54.1 Å²	54.1	3%	0.026	29%	0.288	C	S	.	.	H	α-helix	trans	-59.5	-41.3	172.4	-77.6	174.3	0	0	0	112.1	M96 L617 P627 Y725 V726 L731 I732 H733	M96-L729 HydrophobicContact CE-CD1 3.61Å; M96-L729 HydrophobicContact CG-CD1 4.26Å; M96-L729 HydrophobicContact SD-CD1 4.22Å; L617-L729 HydrophobicContact CD2-CD2 3.94Å; P627-L729 HydrophobicContact CB-CD2 3.6Å; P627-L729 HydrophobicContact CG-CD2 3.84Å; Y725-L729 HydrophobicContact CD2-CD1 4.17Å; Y725-L729 HydrophobicContact CD2-CG 3.95Å; Y725-L729 HydrophobicContact CE1-CD1 4.25Å; Y725-L729 HydrophobicContact CE2-CD1 3.68Å; Y725-L729 HydrophobicContact CE2-CD2 3.8Å; Y725-L729 HydrophobicContact CE2-CG 3.54Å; Y725-L729 WeakPolarHBondContact O-CG 3.47Å; Y725-L729 PolarHBondContact O-N 2.87Å; V726-L729 PolarHBondContact O-N 2.92Å; L729-L731 VanDerWaalsContact C-N 3.3Å; L729-L731 PolarHBondContact O-N 2.84Å; L729-I732 PolarHBondContact O-N 3.17Å; L729-H733 WeakPolarHBondContact O-CB 3.43Å; L729-H733 PolarHBondContact O-N 3.24Å
730	C	92.2	Very high	89.9	Confident	57 Å²	57	55 Å²	55	39%	0.385	29%	0.289	S	S	.	.	H	α-helix	trans	-62.5	-40	175.7	-66.2	0	0	0	0	111.6	L91 V726 E727 F728 K734	L91-C730 WeakPolarHBondContact CD1-SG 3.39Å; V726-C730 PolarHBondContact O-N 3.13Å; V726-C730 VanDerWaalsContact O-N 3.13Å; V726-C730 PolarHBondContact O-SG 3.23Å; E727-C730 WeakPolarHBondContact O-CB 3.31Å; E727-C730 PolarHBondContact O-N 3.19Å; F728-C730 VanDerWaalsContact C-N 3.3Å; F728-C730 PolarHBondContact O-N 3.08Å; C730-K734 WeakPolarHBondContact O-CB 3.36Å; C730-K734 PolarHBondContact O-N 3.02Å
731	L	92	Very high	90.5	Very high	82 Å²	82	55.3 Å²	55.3	43%	0.429	31%	0.309	S	S	.	.	H	α-helix	trans	-64.1	-49.4	176.4	-174.7	151	0	0	0	111.4	T594 E727 F728 L729 H733 K734 E735	T594-L731 HydrophobicContact CG2-CD2 3.43Å; T594-L731 VanDerWaalsContact CG2-CD2 3.43Å; E727-L731 PolarHBondContact O-N 2.66Å; E727-L731 VanDerWaalsContact O-N 3.09Å; F728-L731 HydrophobicContact CE2-CD2 4.44Å; F728-L731 WeakPolarHBondContact O-CB 3.04Å; F728-L731 PolarHBondContact O-N 2.75Å; F728-L731 VanDerWaalsContact O-N 3.16Å; L729-L731 VanDerWaalsContact C-N 3.3Å; L729-L731 PolarHBondContact O-N 2.84Å; L731-H733 VanDerWaalsContact C-N 3.33Å; L731-H733 PolarHBondContact O-N 2.87Å; L731-K734 WeakPolarHBondContact O-CB 3.34Å; L731-K734 PolarHBondContact O-N 3.09Å; L731-E735 PolarHBondContact O-N 3.21Å
732	I	92.3	Very high	91.1	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-59.8	-43.2	176.5	-71.1	-68.3	0	0	0	111.1	T594 L601 F728 L729 K734 E735 I736	T594-I732 HydrophobicContact CG2-CD1 3.84Å; L601-I732 HydrophobicContact CD1-CG2 3.76Å; F728-I732 HydrophobicContact CD1-CG1 4.02Å; F728-I732 HydrophobicContact CE1-CD1 4Å; F728-I732 HydrophobicContact CE1-CG1 3.62Å; F728-I732 HydrophobicContact CZ-CD1 3.89Å; F728-I732 HydrophobicContact CZ-CG1 3.91Å; F728-I732 WeakPolarHBondContact O-CG1 3.36Å; F728-I732 PolarHBondContact O-N 2.95Å; L729-I732 PolarHBondContact O-N 3.17Å; I732-K734 VanDerWaalsContact C-N 3.32Å; I732-K734 PolarHBondContact O-N 3.3Å; I732-E735 PolarHBondContact O-N 2.78Å; I732-I736 HydrophobicContact CG2-CD1 3.66Å; I732-I736 HydrophobicContact CG2-CG1 4.34Å; I732-I736 VanDerWaalsContact O-CG1 3.27Å; I732-I736 WeakPolarHBondContact O-CG1 3.23Å; I732-I736 PolarHBondContact O-N 2.82Å
733	H	92.8	Very high	91.5	Very high	21 Å²	21	53.3 Å²	53.3	10%	0.097	29%	0.293	C	S	.	.	H	α-helix	trans	-66.9	-32.9	178.3	-174.5	-150.2	0	0	0	112.9	L614 G615 L617 L729 L731 R737	L614-H733 PolarHBondContact O-NE2 3.49Å; G615-H733 PolarHBondContact O-CE1 2.81Å; L617-H733 HydrophobicContact CD1-CB 4.29Å; L729-H733 WeakPolarHBondContact O-CB 3.43Å; L729-H733 PolarHBondContact O-N 3.24Å; L731-H733 VanDerWaalsContact C-N 3.33Å; L731-H733 PolarHBondContact O-N 2.87Å; H733-R737 WeakPolarHBondContact O-CG 3.44Å; H733-R737 PolarHBondContact O-N 3.12Å; H733-R737 VanDerWaalsContact O-N 3.12Å; H733-R737 PolarHBondContact O-NE 3.05Å
734	K	92.9	Very high	91.7	Very high	129 Å²	129	54.4 Å²	54.4	56%	0.561	30%	0.296	S	S	*	.	H	α-helix	trans	-63.6	-46.8	170.6	-172.9	-174.5	177	-173.2	0	110.8	C730 L731 I732 R737 N738	C730-K734 WeakPolarHBondContact O-CB 3.36Å; C730-K734 PolarHBondContact O-N 3.02Å; L731-K734 WeakPolarHBondContact O-CB 3.34Å; L731-K734 PolarHBondContact O-N 3.09Å; I732-K734 VanDerWaalsContact C-N 3.32Å; I732-K734 PolarHBondContact O-N 3.3Å; K734-R737 PolarHBondContact O-N 3.4Å; K734-N738 VanDerWaalsContact O-CG 3.31Å; K734-N738 PolarHBondContact O-N 3.09Å; K734-N738 PolarHBondContact O-ND2 3.05Å
735	E	93	Very high	91.7	Very high	66 Å²	66	56.2 Å²	56.2	31%	0.308	30%	0.304	S	S	.	.	H	α-helix	trans	-65.3	-42.4	-178.9	-162.3	66.1	-178.4	0	0	112.3	A598 L731 I732 R737 N738 L739	A598-E735 HydrophobicContact CB-CB 3.71Å; A598-E735 HydrophobicContact CB-CG 3.51Å; L731-E735 PolarHBondContact O-N 3.21Å; I732-E735 PolarHBondContact O-N 2.78Å; E735-R737 VanDerWaalsContact C-N 3.3Å; E735-R737 PolarHBondContact O-N 3.33Å; E735-N738 WeakPolarHBondContact O-CB 3.39Å; E735-N738 PolarHBondContact O-N 2.78Å; E735-N738 VanDerWaalsContact O-N 3.1Å; E735-N738 PolarHBondContact OE2-ND2 3.15Å; E735-L739 WeakPolarHBondContact O-CG 3.35Å; E735-L739 PolarHBondContact O-N 3.36Å
736	I	92.9	Very high	91.6	Very high	3 Å²	3	59.6 Å²	59.6	2%	0.015	32%	0.323	C	S	.	.	H	α-helix	trans	-56.7	-46.2	172.4	-69.1	163	0	0	0	110.3	A598 L601 A602 L617 I732 N738 L739 L740	A598-I736 HydrophobicContact CB-CG1 4.23Å; L601-I736 HydrophobicContact CB-CD1 3.55Å; L601-I736 HydrophobicContact CB-CG1 4.16Å; L601-I736 HydrophobicContact CD1-CD1 4.01Å; L601-I736 HydrophobicContact CG-CD1 4.46Å; A602-I736 HydrophobicContact CB-CG2 4.15Å; L617-I736 HydrophobicContact CD1-CD1 3.49Å; L617-I736 VanDerWaalsContact CD1-CD1 3.49Å; I732-I736 HydrophobicContact CG2-CD1 3.66Å; I732-I736 HydrophobicContact CG2-CG1 4.34Å; I732-I736 VanDerWaalsContact O-CG1 3.27Å; I732-I736 WeakPolarHBondContact O-CG1 3.23Å; I732-I736 PolarHBondContact O-N 2.82Å; I736-N738 VanDerWaalsContact C-N 3.27Å; I736-N738 PolarHBondContact O-N 3.17Å; I736-L739 PolarHBondContact O-N 2.67Å; I736-L739 VanDerWaalsContact O-N 3.13Å; I736-L740 HydrophobicContact CG2-CD1 3.69Å; I736-L740 HydrophobicContact CG2-CG 4.19Å; I736-L740 WeakPolarHBondContact O-CG 3.26Å; I736-L740 PolarHBondContact O-N 3.24Å
737	R	91.6	Very high	91.6	Very high	119 Å²	119	59.1 Å²	59.1	45%	0.449	32%	0.317	S	S	.	.	H	α-helix	trans	-62	-35.9	178.3	-76.1	-177.7	-67.8	168.3	-2.2	112.5	H733 K734 E735 L739 L740 A741	H733-R737 WeakPolarHBondContact O-CG 3.44Å; H733-R737 PolarHBondContact O-N 3.12Å; H733-R737 VanDerWaalsContact O-N 3.12Å; H733-R737 PolarHBondContact O-NE 3.05Å; K734-R737 PolarHBondContact O-N 3.4Å; E735-R737 VanDerWaalsContact C-N 3.3Å; E735-R737 PolarHBondContact O-N 3.33Å; R737-L739 VanDerWaalsContact C-N 3.33Å; R737-L740 PolarHBondContact O-N 2.98Å; R737-A741 WeakPolarHBondContact O-CB 3.25Å; R737-A741 PolarHBondContact O-N 2.77Å
738	N	92.3	Very high	91.6	Very high	86 Å²	86	57.9 Å²	57.9	46%	0.46	32%	0.315	S	S	.	.	H	α-helix	trans	-66.3	-35	175.2	-63.1	-23.6	0	0	0	112.3	K734 E735 I736	K734-N738 VanDerWaalsContact O-CG 3.31Å; K734-N738 PolarHBondContact O-N 3.09Å; K734-N738 PolarHBondContact O-ND2 3.05Å; E735-N738 WeakPolarHBondContact O-CB 3.39Å; E735-N738 PolarHBondContact O-N 2.78Å; E735-N738 VanDerWaalsContact O-N 3.1Å; E735-N738 PolarHBondContact OE2-ND2 3.15Å; I736-N738 VanDerWaalsContact C-N 3.27Å; I736-N738 PolarHBondContact O-N 3.17Å
739	L	91.7	Very high	91.5	Very high	59 Å²	59	61.9 Å²	61.9	31%	0.309	34%	0.337	S	S	.	.	H	α-helix	trans	-76.7	-21.8	177.6	-67.4	171.2	0	0	0	113.6	A598 Q599 A602 E735 I736 R737	A598-L739 HydrophobicContact CB-CD1 3.99Å; Q599-L739 HydrophobicContact CB-CD1 4.33Å; A602-L739 HydrophobicContact CB-CB 4.14Å; A602-L739 HydrophobicContact CB-CD1 4.14Å; E735-L739 WeakPolarHBondContact O-CG 3.35Å; E735-L739 PolarHBondContact O-N 3.36Å; I736-L739 PolarHBondContact O-N 2.67Å; I736-L739 VanDerWaalsContact O-N 3.13Å; R737-L739 VanDerWaalsContact C-N 3.33Å
740	L	88.5	Confident	91.4	Very high	43 Å²	43	66.7 Å²	66.7	23%	0.225	36%	0.363	C	S	.	.	H	α-helix	trans	-94.9	-18.6	179.3	-62.8	178.3	0	0	0	113.6	A602 R605 Q606 I736 R737	A602-L740 HydrophobicContact CB-CD2 4.15Å; A602-L740 HydrophobicContact CB-CG 4.49Å; R605-L740 VanDerWaalsContact CD-CD1 3.49Å; R605-L740 HydrophobicContact CG-CD1 4.23Å; Q606-L740 HydrophobicContact CG-CD2 3.31Å; I736-L740 HydrophobicContact CG2-CD1 3.69Å; I736-L740 HydrophobicContact CG2-CG 4.19Å; I736-L740 WeakPolarHBondContact O-CG 3.26Å; I736-L740 PolarHBondContact O-N 3.24Å; R737-L740 PolarHBondContact O-N 2.98Å
741	A	85.4	Confident	91.4	Very high	135 Å²	135	67.5 Å²	67.5	100%	1.116	36%	0.361	S	S	*	.			trans	-75.2	0	172.1	0	0	0	0	0	109.8	R737	R737-A741 WeakPolarHBondContact O-CB 3.25Å; R737-A741 PolarHBondContact O-N 2.77Å

Retrieved 741 of 741 residues in 424.7 ms (Link to these results)

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